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You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: Nc1ccc(NC(=O)c2ccc(N)cc2)cc1 Toxic: <boolean>No</boolean> Example 2: Smiles: O=C(Nc1ccc(C(=O)O)c(O)c1)c1ccccc1 Toxic: <boolean>No</boolean> Example 3: Smiles: NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccco2)cc1Cl Toxic: <boolean>No</boolean> Example 4: Smiles: O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1ccc([N+](=O)[O-])cc1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): COC(=O)C(C)N(C(=O)c1ccco1)c1c(C)cccc1C Toxic:
<boolean>No</boolean>
COC(=O)C(C)N(C(=O)c1ccco1)c1c(C)cccc1C
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCCc1ccc(N)cc1 Toxic:
<boolean>No</boolean>
CCCc1ccc(N)cc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: C[N+]1(C)[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21 Toxic: <boolean>No</boolean> Example 2: Smiles: CCCC[N+]1(C)[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21 Toxic: <boolean>No</boolean> Example 3: Smiles: CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)C(O)c1ccccc1)C2 Toxic: <boolean>Yes</boolean> Example 4: Smiles: CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 Toxic: <boolean>Yes</boolean> Target Molecule (Smiles): CN1[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21 Toxic:
<boolean>No</boolean>
CN1[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC1CCC(C(C)(C)S)C(=O)C1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)[C@H]1CC[C@@H](C)CC1=O Toxic: <boolean>No</boolean> Example 3: Smiles: CC(C)(C)C1CCCCC1=O Toxic: <boolean>No</boolean> Example 4: Smiles: CCC(C)C1CCCCC1=O Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCCC1CCC(=O)CC1 Toxic:
<boolean>No</boolean>
CCCC1CCC(=O)CC1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCNC(=S)NCCCC Toxic:
<boolean>No</boolean>
CCCCNC(=S)NCCCC
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=C([O-])Cc1cccc2ccccc12 Toxic: <boolean>No</boolean> Example 2: Smiles: CCCCc1ccc2cccc(S(=O)(=O)[O-])c2c1 Toxic: <boolean>No</boolean> Example 3: Smiles: O=S(=O)([O-])c1cccc2ccccc12 Toxic: <boolean>No</boolean> Example 4: Smiles: Nc1ccc2cc(S(=O)(=O)O)ccc2c1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCN(CC)C(=O)C(C)Oc1cccc2ccccc12 Toxic:
<boolean>No</boolean>
CCN(CC)C(=O)C(C)Oc1cccc2ccccc12
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: C=CCc1ccc2c(c1)OCO2 Toxic: <boolean>No</boolean> Example 2: Smiles: C=CCc1cc(OC)c2c(c1)OCO2 Toxic: <boolean>No</boolean> Example 3: Smiles: CNC(=O)Oc1cccc2c1OC(C)(C)O2 Toxic: <boolean>No</boolean> Example 4: Smiles: CC(=O)CCc1ccc2c(c1)OCO2 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC=Cc1ccc2c(c1)OCO2 Toxic:
<boolean>No</boolean>
CC=Cc1ccc2c(c1)OCO2
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=C(O)CNC(=O)c1ccc([N+](=O)[O-])cc1 Toxic:
<boolean>No</boolean>
O=C(O)CNC(=O)c1ccc([N+](=O)[O-])cc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): COCCOCCOC Toxic:
<boolean>No</boolean>
COCCOCCOC
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CCN(Cc1ccc(Cl)nc1)/C(=C/[N+](=O)[O-])NC Toxic: <boolean>No</boolean> Example 2: Smiles: Cc1ncc(CO)c(CO)c1O Toxic: <boolean>No</boolean> Example 3: Smiles: CC(=O)c1cccnc1 Toxic: <boolean>No</boolean> Example 4: Smiles: NCc1cccnc1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=C(O)c1ccccn1 Toxic:
<boolean>No</boolean>
O=C(O)c1ccccn1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CCN(Cc1ccc(Cl)nc1)/C(=C/[N+](=O)[O-])NC Toxic: <boolean>No</boolean> Example 2: Smiles: Cc1ncc(CO)c(CO)c1O Toxic: <boolean>No</boolean> Example 3: Smiles: CC(=O)c1cccnc1 Toxic: <boolean>No</boolean> Example 4: Smiles: NCc1cccnc1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): NC(=O)c1cccnc1 Toxic:
<boolean>No</boolean>
NC(=O)c1cccnc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCCCC#N Toxic:
<boolean>No</boolean>
CCCCCCC#N
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCC(CC)C(=O)Cl Toxic:
<boolean>No</boolean>
CCCCC(CC)C(=O)Cl
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(C)C(=O)OCCc1ccccc1 Toxic:
<boolean>No</boolean>
CC(C)C(=O)OCCc1ccccc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: COc1ccc(CCN(C)CCCC(C#N)(c2cc(OC)c(OC)c(OC)c2)C(C)C)cc1OC Toxic: <boolean>No</boolean> Example 2: Smiles: CNCCC(Oc1ccccc1OC)c1ccccc1 Toxic: <boolean>No</boolean> Example 3: Smiles: CCN(CCCCOC(=O)c1ccc(OC)c(OC)c1)C(C)Cc1ccc(OC)cc1 Toxic: <boolean>No</boolean> Example 4: Smiles: CCN(CCCc1ccccc1)CCCc1ccccc1.O=C(O)CC(O)(CC(=O)O)C(=O)O Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(COc1ccccc1)NC(C)C(O)c1ccc(O)cc1 Toxic:
<boolean>No</boolean>
CC(COc1ccccc1)NC(C)C(O)c1ccc(O)cc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CC[C@@H](CO)NCCN[C@@H](CC)CO Toxic:
<boolean>No</boolean>
CC[C@@H](CO)NCCN[C@@H](CC)CO
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(C)NCC(O)c1ccc([N+](=O)[O-])cc1 Toxic:
<boolean>No</boolean>
CC(C)NCC(O)c1ccc([N+](=O)[O-])cc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=C(Cl)c1c(Cl)cccc1Cl Toxic:
<boolean>No</boolean>
O=C(Cl)c1c(Cl)cccc1Cl
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(C)CCCCCCc1ccc(OCCOCCO)cc1 Toxic:
<boolean>No</boolean>
CC(C)CCCCCCc1ccc(OCCOCCO)cc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=C([O-])Cc1cccc2ccccc12 Toxic: <boolean>No</boolean> Example 2: Smiles: CCCCc1ccc2cccc(S(=O)(=O)[O-])c2c1 Toxic: <boolean>No</boolean> Example 3: Smiles: O=S(=O)([O-])c1cccc2ccccc12 Toxic: <boolean>No</boolean> Example 4: Smiles: Nc1ccc2cc(S(=O)(=O)O)ccc2c1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): Oc1ccc2ccccc2c1 Toxic:
<boolean>No</boolean>
Oc1ccc2ccccc2c1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: C[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@@H]2O Toxic: <boolean>Yes</boolean> Example 2: Smiles: C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C Toxic: <boolean>Yes</boolean> Example 3: Smiles: C#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C Toxic: <boolean>Yes</boolean> Example 4: Smiles: CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C Toxic: <boolean>Yes</boolean> Target Molecule (Smiles): C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O Toxic:
<boolean>Yes</boolean>
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: Oc1nc(O)nc(O)n1 Toxic: <boolean>No</boolean> Example 2: Smiles: COCN(COC)c1nc(N(COC)COC)nc(N(COC)COC)n1 Toxic: <boolean>No</boolean> Example 3: Smiles: C=CCOc1nc(OCC=C)nc(OCC=C)n1 Toxic: <boolean>No</boolean> Example 4: Smiles: CSc1nc(NC(C)C)nc(NC(C)C)n1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): Nc1nc(N)nc(N)n1 Toxic:
<boolean>No</boolean>
Nc1nc(N)nc(N)n1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CC1=CCC(=C(C)C)CC1 Toxic:
<boolean>No</boolean>
CC1=CCC(=C(C)C)CC1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): OCCNCCO Toxic:
<boolean>No</boolean>
OCCNCCO
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: COc1c2occc2c(OC)c2c(=O)cc(C)oc12 Toxic: <boolean>No</boolean> Example 2: Smiles: CCn1cc(C(=O)O)c(=O)c2cc3c(cc21)OCO3 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCCc1c2oc(C(=O)O)cc(=O)c2cc2c(=O)cc(C(=O)O)n(CC)c12 Toxic:
<boolean>No</boolean>
CCCc1c2oc(C(=O)O)cc(=O)c2cc2c(=O)cc(C(=O)O)n(CC)c12
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCOC(=O)NCCCN(C)C Toxic:
<boolean>No</boolean>
CCCOC(=O)NCCCN(C)C
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=C1NC(=O)c2ccccc21 Toxic: <boolean>No</boolean> Example 2: Smiles: O=C1c2ccccc2C(=O)N1CO Toxic: <boolean>No</boolean> Example 3: Smiles: CCCCN1C(=O)c2ccccc2C1=O Toxic: <boolean>No</boolean> Example 4: Smiles: COP(=S)(OC)SCN1C(=O)c2ccccc2C1=O Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=C1NC(=O)c2cc([N+](=O)[O-])ccc21 Toxic:
<boolean>No</boolean>
O=C1NC(=O)c2cc([N+](=O)[O-])ccc21
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CCCN1C=CN(C)C1 Toxic: <boolean>No</boolean> Example 2: Smiles: CCN1C=CN(C)C1C Toxic: <boolean>No</boolean> Example 3: Smiles: CCCN1C=CN(C)C1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCCCN1C=CN(C)C1 Toxic:
<boolean>No</boolean>
CCCCN1C=CN(C)C1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): O=S(=O)([O-])[S-] Toxic:
<boolean>No</boolean>
O=S(=O)([O-])[S-]
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): C=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@@]12C=C[C@H](O)[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O Toxic:
<boolean>No</boolean>
C=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@@]12C=C[C@H](O)[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): N#CNC(=N)N Toxic:
<boolean>No</boolean>
N#CNC(=N)N
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): COC(=O)c1ccccc1C(=O)O Toxic:
<boolean>No</boolean>
COC(=O)c1ccccc1C(=O)O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCSCCCC Toxic:
<boolean>No</boolean>
CCCCSCCCC
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(C=O)Cc1ccc(C(C)C)cc1 Toxic:
<boolean>No</boolean>
CC(C=O)Cc1ccc(C(C)C)cc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): C=CCCCCCCCCC(=O)O Toxic:
<boolean>No</boolean>
C=CCCCCCCCCC(=O)O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O Toxic:
<boolean>No</boolean>
CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): C=COC(=O)C(C)(CC)CCC(C)C Toxic:
<boolean>No</boolean>
C=COC(=O)C(C)(CC)CCC(C)C
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC1(C)C(C=C(Cl)Cl)C1C(=O)OCc1cccc(Oc2ccccc2)c1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)=CC1C(C(=O)OCc2cccc(Oc3ccccc3)c2)C1(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CC(C)=C[C@@H]1[C@@H](C(=O)OCc2coc(Cc3ccccc3)c2)C1(C)C Toxic: <boolean>No</boolean> Example 4: Smiles: CS(=O)(=O)NC(=O)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-] Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC1(C)C(C=C(Cl)Cl)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1 Toxic:
<boolean>No</boolean>
CC1(C)C(C=C(Cl)Cl)C1C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCCOC(=O)Cc1ccc(OCC(=O)N(CC)CC)c(OC)c1 Toxic:
<boolean>No</boolean>
CCCOC(=O)Cc1ccc(OCC(=O)N(CC)CC)c(OC)c1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCN(CC)C(C)=O Toxic:
<boolean>No</boolean>
CCN(CC)C(C)=O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CN(C)[C@@H]1C(O)=C(C(N)=O)C(=O)[C@@]2(O)C(O)=C3C(=O)c4c(O)cccc4[C@@](C)(O)[C@H]3[C@H](O)[C@@H]12 Toxic: <boolean>No</boolean> Example 2: Smiles: CN(C)c1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(O)=C(C(N)=O)C(=O)[C@@]3(O)C(O)=C1C2=O Toxic: <boolean>No</boolean> Target Molecule (Smiles): C=C1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@H]12 Toxic:
<boolean>No</boolean>
C=C1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@H]12
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=C1CCCCO1 Toxic: <boolean>No</boolean> Example 2: Smiles: O=C1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O Toxic: <boolean>No</boolean> Example 3: Smiles: O=C1CCCCCO1 Toxic: <boolean>No</boolean> Example 4: Smiles: CCCCCC1CCC(=O)O1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCCCCC1CCCC(=O)O1 Toxic:
<boolean>No</boolean>
CCCCCC1CCCC(=O)O1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): C/C=C(C)/C=C/C=C(C)C Toxic:
<boolean>No</boolean>
C/C=C(C)/C=C/C=C(C)C
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCN(CC)c1ccccc1 Toxic:
<boolean>No</boolean>
CCN(CC)c1ccccc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(=O)OCC=Cc1ccccc1 Toxic:
<boolean>No</boolean>
CC(=O)OCC=Cc1ccccc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(=O)OCCc1ccccc1 Toxic:
<boolean>No</boolean>
CC(=O)OCCc1ccccc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: Cc1c(Cn2ccnc2)c2ccccc2n1CCC(=O)O Toxic: <boolean>No</boolean> Target Molecule (Smiles): Cc1nccn1CC1CCc2c(c3ccccc3n2C)C1=O Toxic:
<boolean>No</boolean>
Cc1nccn1CC1CCc2c(c3ccccc3n2C)C1=O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): OCCOCCOCCOCCOCCO Toxic:
<boolean>No</boolean>
OCCOCCOCCOCCOCCO
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=C(c1ccccc1)C1(O)CCCCC1 Toxic: <boolean>No</boolean> Example 2: Smiles: O=C(C=Cc1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O Toxic: <boolean>No</boolean> Example 3: Smiles: CC1(C(=O)Nc2ccc(O)c(Cl)c2Cl)CCCCC1 Toxic: <boolean>No</boolean> Example 4: Smiles: OC1CCCCC1c1ccccc1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC1CC(OC(=O)c2ccccc2O)CC(C)(C)C1 Toxic:
<boolean>No</boolean>
CC1CC(OC(=O)c2ccccc2O)CC(C)(C)C1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=CN1CCOCC1 Toxic: <boolean>No</boolean> Example 2: Smiles: O=NN1CCOCC1 Toxic: <boolean>No</boolean> Example 3: Smiles: N=C(N)NC(=N)N1CCOCC1 Toxic: <boolean>No</boolean> Example 4: Smiles: O=S(=O)(O)CCCN1CCOCC1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCCCCCCCCCCCCN1CC(C)OC(C)C1 Toxic:
<boolean>No</boolean>
CCCCCCCCCCCCCN1CC(C)OC(C)C1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CC(O)CC(C)(C)O Toxic:
<boolean>No</boolean>
CC(O)CC(C)(C)O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC1=CC(O)CC(C)(C)C1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC1=C(CC=O)C(C)(C)CCC1 Toxic: <boolean>No</boolean> Example 3: Smiles: CC(=O)/C=C/C1=C(C)CCCC1(C)C Toxic: <boolean>No</boolean> Example 4: Smiles: CCC(=O)/C=C/C1C(C)=CCCC1(C)C Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(=O)C=CC1=C(C)CCCC1(C)C Toxic:
<boolean>No</boolean>
CC(=O)C=CC1=C(C)CCCC1(C)C
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): COc1ccc(Br)c(C)c1 Toxic:
<boolean>No</boolean>
COc1ccc(Br)c(C)c1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCC(=O)OCCC(C)C Toxic:
<boolean>No</boolean>
CCCC(=O)OCCC(C)C
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): O=C(O)CNCC(=O)O Toxic:
<boolean>No</boolean>
O=C(O)CNCC(=O)O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CC(C)[C@]12CC(=O)[C@H](C)[C@H]1C2 Toxic:
<boolean>No</boolean>
CC(C)[C@]12CC(=O)[C@H](C)[C@H]1C2
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCOC(=O)N(C)C(=O)CSP(=S)(OCC)OCC Toxic:
<boolean>No</boolean>
CCOC(=O)N(C)C(=O)CSP(=S)(OCC)OCC
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCCCCCC(=O)OCC(C)OC(=O)CCCCCCCC Toxic:
<boolean>No</boolean>
CCCCCCCCC(=O)OCC(C)OC(=O)CCCCCCCC
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O Toxic: <boolean>No</boolean> Example 2: Smiles: OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@@H]9[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O Toxic: <boolean>No</boolean> Target Molecule (Smiles): OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O Toxic:
<boolean>No</boolean>
OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CCCCCC1CCC(=O)O1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC1CCC(=O)O1 Toxic: <boolean>No</boolean> Example 3: Smiles: CC(=O)C1CCOC1=O Toxic: <boolean>No</boolean> Example 4: Smiles: CCCCC1CCC(=O)O1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=C1CCCO1 Toxic:
<boolean>No</boolean>
O=C1CCCO1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCC(CC)COS(=O)(=O)[O-] Toxic:
<boolean>No</boolean>
CCCCC(CC)COS(=O)(=O)[O-]
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: Cc1cc(NS(=O)(=O)c2ccc(N)cc2)no1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(=O)Nc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1 Toxic: <boolean>No</boolean> Example 3: Smiles: Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 Toxic: <boolean>No</boolean> Example 4: Smiles: O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C Toxic:
<boolean>No</boolean>
Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ba+2] Toxic:
<boolean>No</boolean>
CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ba+2]
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): NN Toxic:
<boolean>No</boolean>
NN
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC1=CC(O)CC(C)(C)C1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC1=C(CC=O)C(C)(C)CCC1 Toxic: <boolean>No</boolean> Example 3: Smiles: CC(=O)/C=C/C1=C(C)CCCC1(C)C Toxic: <boolean>No</boolean> Example 4: Smiles: CCC(=O)/C=C/C1C(C)=CCCC1(C)C Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1 Toxic:
<boolean>No</boolean>
CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CO[Si](CCCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CCC[Si](OC)(OC)OC)c1=O)(OC)OC Toxic: <boolean>No</boolean> Example 2: Smiles: O=c1n(Cl)c(=O)n(Cl)c(=O)n1Cl Toxic: <boolean>No</boolean> Example 3: Smiles: C=CCn1c(=O)n(CC=C)c(=O)n(CC=C)c1=O Toxic: <boolean>No</boolean> Example 4: Smiles: O=c1[n-]c(=O)n(Cl)c(=O)n1Cl Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=c1n(CCO)c(=O)n(CCO)c(=O)n1CCO Toxic:
<boolean>No</boolean>
O=c1n(CCO)c(=O)n(CCO)c(=O)n1CCO
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCOC(=O)c1ccccc1O Toxic:
<boolean>No</boolean>
CCOC(=O)c1ccccc1O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): BrCCOc1ccccc1 Toxic:
<boolean>No</boolean>
BrCCOc1ccccc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): O=C([O-])[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO Toxic:
<boolean>No</boolean>
O=C([O-])[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC=CC(=O)N(CC)c1ccccc1C Toxic:
<boolean>No</boolean>
CC=CC(=O)N(CC)c1ccccc1C
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC(C)SCc1ccco1 Toxic: <boolean>No</boolean> Example 2: Smiles: O=Cc1ccco1 Toxic: <boolean>Yes</boolean> Example 3: Smiles: O=C(O)c1ccco1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1occc1S Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(=O)OCc1ccco1 Toxic:
<boolean>No</boolean>
CC(=O)OCc1ccco1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: C#C[C@]1(O)CC[C@H]2[C@@H]3CCc4cc(OC)ccc4[C@H]3CC[C@@]21C Toxic: <boolean>No</boolean> Example 2: Smiles: C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1C[C@@H](O)[C@@H]2O Toxic: <boolean>No</boolean> Example 3: Smiles: C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O Toxic: <boolean>Yes</boolean> Example 4: Smiles: C#C[C@]1(O)CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@@]21C Toxic: <boolean>No</boolean> Target Molecule (Smiles): C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=O Toxic:
<boolean>Yes</boolean>
C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=O
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC(C)(C)c1nnc(NS(=O)(=O)c2ccccc2)s1 Toxic: <boolean>No</boolean> Example 2: Smiles: Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1 Toxic: <boolean>No</boolean> Example 3: Smiles: COc1ccc(S(=O)(=O)Nc2nnc(CC(C)C)s2)cc1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1cccc(C)c1NC(=O)CN1CCCC1=O Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(C)N(C(=O)COc1nnc(C(F)(F)F)s1)c1ccc(F)cc1 Toxic:
<boolean>No</boolean>
CC(C)N(C(=O)COc1nnc(C(F)(F)F)s1)c1ccc(F)cc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC(C)[C@H]1CC[C@H](C)C[C@@H]1O Toxic: <boolean>No</boolean> Example 2: Smiles: C=COCC1CCC(CO)CC1 Toxic: <boolean>No</boolean> Example 3: Smiles: O=C=NCC1CCCC(CN=C=O)C1 Toxic: <boolean>No</boolean> Example 4: Smiles: OCCCC1CCCCC1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(=O)CC(C)(C)C1CCCCC1 Toxic:
<boolean>No</boolean>
CC(=O)CC(C)(C)C1CCCCC1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): ClC(Cl)(Cl)c1ccccc1 Toxic:
<boolean>No</boolean>
ClC(Cl)(Cl)c1ccccc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: C[N+]1(C)[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21 Toxic: <boolean>No</boolean> Example 2: Smiles: CCCC[N+]1(C)[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21 Toxic: <boolean>No</boolean> Example 3: Smiles: CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)C(O)c1ccccc1)C2 Toxic: <boolean>Yes</boolean> Example 4: Smiles: CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 Toxic: <boolean>Yes</boolean> Target Molecule (Smiles): CN1[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21 Toxic:
<boolean>No</boolean>
CN1[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): Cc1ccccc1[N+](=O)[O-] Toxic:
<boolean>No</boolean>
Cc1ccccc1[N+](=O)[O-]
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): ClC(Br)Br Toxic:
<boolean>No</boolean>
ClC(Br)Br
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CC(O)CO Toxic:
<boolean>No</boolean>
CC(O)CO
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC(C)(C)c1ccc(C=O)cc1 Toxic:
<boolean>No</boolean>
CC(C)(C)c1ccc(C=O)cc1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CCn1cc[n+](C)c1C.O=S(=O)([O-])C(F)(F)F Toxic: <boolean>No</boolean> Example 2: Smiles: CCCCn1cc[n+](C)c1.F[B-](F)(F)F Toxic: <boolean>No</boolean> Example 3: Smiles: CCCn1cc[n+](C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: C[n+]1ccn(CCO)c1.F[B-](F)(F)F Toxic: <boolean>No</boolean> Target Molecule (Smiles): COP(=O)([O-])OC.Cn1cc[n+](C)c1 Toxic:
<boolean>No</boolean>
COP(=O)([O-])OC.Cn1cc[n+](C)c1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): Cc1cc(Cl)ccc1N Toxic:
<boolean>No</boolean>
Cc1cc(Cl)ccc1N
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=CN1CCOCC1 Toxic: <boolean>No</boolean> Example 2: Smiles: O=NN1CCOCC1 Toxic: <boolean>No</boolean> Example 3: Smiles: N=C(N)NC(=N)N1CCOCC1 Toxic: <boolean>No</boolean> Example 4: Smiles: CN1CCOCC1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=S(=O)(O)CCCN1CCOCC1 Toxic:
<boolean>No</boolean>
O=S(=O)(O)CCCN1CCOCC1
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4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC(=O)S[C@H](C(=O)N[C@H]1Cc2ccccc2[C@H]2CCC[C@@H](C(=O)O)N2C1=O)C(C)C Toxic: <boolean>No</boolean> Example 2: Smiles: Cc1cc(O)cc2c1O[C@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)CC2 Toxic: <boolean>No</boolean> Example 3: Smiles: CC(=O)Oc1c(C)c(C)c2c(c1C)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CC1(C)Oc2ccc(C#N)cc2[C@@H](N2CCCC2=O)[C@@H]1O Toxic:
<boolean>No</boolean>
CC1(C)Oc2ccc(C#N)cc2[C@@H](N2CCCC2=O)[C@@H]1O
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): C=CC(=O)OC(C)(C)C Toxic:
<boolean>No</boolean>
C=CC(=O)OC(C)(C)C
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCCCCCCCCCCCCBr Toxic:
<boolean>No</boolean>
CCCCCCCCCCCCCCCBr
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCCCC#N Toxic:
<boolean>No</boolean>
CCCCC#N
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CC(CN)CC(C)(C)CCN Toxic:
<boolean>No</boolean>
CC(CN)CC(C)(C)CCN
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCOCCC(=O)OCC Toxic:
<boolean>No</boolean>
CCOCCC(=O)OCC
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: COP(=S)(OC)SCn1nnc2ccccc2c1=O Toxic: <boolean>No</boolean> Example 2: Smiles: O=c1nn[nH]c2ccccc12 Toxic: <boolean>No</boolean> Example 3: Smiles: CC[C@H](NC(C)C)[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12 Toxic: <boolean>No</boolean> Example 4: Smiles: NS(=O)(=O)Cc1noc2ccccc12 Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=c1[nH]ncc2ccccc12 Toxic:
<boolean>No</boolean>
O=c1[nH]ncc2ccccc12
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): SCCSCCS Toxic:
<boolean>No</boolean>
SCCSCCS
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CC(=O)O[AlH3](O)OC(C)=O Toxic:
<boolean>No</boolean>
CC(=O)O[AlH3](O)OC(C)=O
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): C[N+](C)(C)C Toxic:
<boolean>No</boolean>
C[N+](C)(C)C
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: O=S(=O)(Cl)c1ccccc1 Toxic: <boolean>No</boolean> Example 2: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 3: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 4: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1 Toxic:
<boolean>No</boolean>
CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CSCCC=O Toxic:
<boolean>No</boolean>
CSCCC=O
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CCN(Cc1ccc(Cl)nc1)/C(=C/[N+](=O)[O-])NC Toxic: <boolean>No</boolean> Example 2: Smiles: Cc1ncc(CO)c(CO)c1O Toxic: <boolean>No</boolean> Example 3: Smiles: CC(=O)c1cccnc1 Toxic: <boolean>No</boolean> Example 4: Smiles: NCc1cccnc1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=C(O)c1ccccn1 Toxic:
<boolean>No</boolean>
O=C(O)c1ccccn1
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): OCCSCSCCO Toxic:
<boolean>No</boolean>
OCCSCSCCO
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CCN(Cc1ccc(Cl)nc1)/C(=C/[N+](=O)[O-])NC Toxic: <boolean>No</boolean> Example 2: Smiles: Cc1ncc(CO)c(CO)c1O Toxic: <boolean>No</boolean> Example 3: Smiles: CC(=O)c1cccnc1 Toxic: <boolean>No</boolean> Example 4: Smiles: NCc1cccnc1 Toxic: <boolean>No</boolean> Target Molecule (Smiles): CCc1cnc(C(=O)O)c(C(=O)O)c1 Toxic:
<boolean>No</boolean>
CCc1cnc(C(=O)O)c(C(=O)O)c1
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Example 1: Smiles: CC(C)N(c1ccccc1)C(C)C Toxic: <boolean>No</boolean> Example 2: Smiles: CCc1cccc(C)c1 Toxic: <boolean>No</boolean> Example 3: Smiles: Cc1ccccc1CCO Toxic: <boolean>No</boolean> Example 4: Smiles: O=[N+]([O-])c1cc([As](=O)(O)O)ccc1O Toxic: <boolean>No</boolean> Target Molecule (Smiles): O=S(=O)(Cl)c1ccccc1 Toxic:
<boolean>No</boolean>
O=S(=O)(Cl)c1ccccc1
scaffold
4
smiles
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Task Description: Given the Smiles string and molecular properties above, predict whether this molecule exhibits androgen receptor antagonist activity (Yes) or not (No). Consider all molecular properties provided to assess the compound's potential and its interaction with the androgen receptor. You are also provided with an image for the target molecule which you need to take in account for analysis like a chemist does and provide the final conclusion considering the image as well. Examples: Target Molecule (Smiles): CCN(CC)CCOC(=O)C(Cc1cccc2ccccc12)CC1CCCO1 Toxic:
<boolean>No</boolean>
CCN(CC)CCOC(=O)C(Cc1cccc2ccccc12)CC1CCCO1
scaffold
4
smiles
End of preview. Expand in Data Studio

BACE-V-SMILES Dataset

Dataset Description

This dataset contains molecular data with visual representations for BACE (Beta-secretase 1) related compounds.

Features

  • Question: Question related to the molecule
  • Answer: Corresponding answer
  • TargetMolecule: SMILES representation of the target molecule
  • SampleMethod: Method used for sampling
  • SampleNum: Sample number
  • SampleRep: Sample repetition
  • image: Generated molecular structure image from SMILES

Dataset Statistics

  • Total samples: 1560
  • Image format: PIL Image (RGB)
  • Image size: 300x300 pixels

Usage

from datasets import load_dataset

dataset = load_dataset("molvision/TOX21-V-SMILES-4")

Data Fields

  • Question (string): Question text
  • Answer (string): Answer text
  • TargetMolecule (string): SMILES representation
  • SampleMethod (string): Sampling method
  • SampleNum (int): Sample number
  • SampleRep (string): Sample repetition
  • image (PIL.Image): Molecular structure visualization

Citation

Please cite this dataset if you use it in your research.

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