SMILES
stringlengths 5
260
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c1ccc(cc1)[C@@H](C(=O)OC[C@@H]2CCCO2)O
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c1ccc(cc1)[C@H](C(=O)OC[C@@H]2CCCO2)O
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COCCC(=O)OCCOc1ccccc1
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CCOCCC(=O)OCCCCCO
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C[C@@H](COC)OC(=O)C1(CCCCC1)O
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CCOCCOC(=O)[C@@H](c1ccccc1)O
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CC(C)OC(=O)c1ccc(c(c1)OC)O
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CCOc1ccccc1C(=O)OCCOC
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CCOCCOC(=O)/C=C/c1ccco1
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CCCCCCn1cnc2c1ncnc2N
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CCN(CC)C(=O)c1ccccc1C(=O)OC
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CCCOC(=O)C1(CC1)C(=O)OCCC
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CC(=O)Oc1c(cccc1OC)C(=O)OC
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c1ccc(cc1)OCCC(=O)N2CCOCC2
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c1ccc2c(c1)c(ccn2)C(=O)N3CCOCC3
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c1[nH]c2c(n1)ncnc2NCCCCCCO
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C1CCC=C(CC1)C(=O)N2CCOCC2
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c1cc(cc(c1)NCc2ccco2)C(=O)N
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CCCCS(=O)(=O)N1CCCCC1
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C/C=C/COC(=O)CNC(=O)OC(C)(C)C
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CC(C)(CO)NC(=O)CC1CCCCC1
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CCN(CC)S(=O)(=O)c1cccnc1
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COc1ccc(cc1)CCn2cncn2
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CC(C)(CO)NC(=O)/C=C/c1ccc(cc1)OC
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c1ccc2cc(ccc2c1)C[NH2+]CCO
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CCNc1c2cnn(c2nc(n1)Cl)C
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C[NH+](CCC(=O)[O-])Cc1cccc(c1)OC
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CCN(CC)C(=O)c1ccccc1C(=O)[O-]
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CCCCN(C)c1c2cnn(c2ncn1)C
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c1c(nc(nc1Cl)N)NC2(CCC2)CO
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c1c(nc(nc1Cl)N)NCC2(CCC2)O
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c1c(nc(nc1Cl)N)NCC2(CCCC2)O
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c1c(nc(nc1Cl)N)NCC2(CCC2)CO
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CCCCC[NH+]1CCN(CC1)c2ncccn2
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CCOC(CSc1ncccn1)OCC
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CCN(CC)C(=O)N[C@@H](CC(C)C)C(=O)NC
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c1ccc(cc1)C[C@@H](C(=O)[O-])[NH2+]CC(F)(F)F
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Cc1ccc(cc1)N2CC[NH+](CC2)CCCO
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Cc1cccc(c1)N2CC[NH+](CC2)CCCO
|
CCCCNc1c(c(nc(n1)N)Cl)N
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CC[NH+](CCO)C[C@@H](c1ccccc1)O
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CCNC(=O)C(=NC(=O)C)Cc1ccccc1
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c1ccc2c(c1)cc(o2)C(=O)NCCO
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CC(=O)c1cccc(c1)OCC(=O)OC
|
c1cc(c(cc1Br)O)C(=O)N
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Cc1ccccc1N2CC[NH+](CC2)CCCO
|
CCCONC(=O)c1ccc(cc1)OC
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CC[NH+](CC)Cc1nnnn1Cc2ccccc2
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c1ccc(c(c1)CNC(=O)C(=O)[O-])Cl
|
c1cc(c(cc1Cl)Cl)CNC(=O)C(=O)[O-]
|
CCN(CC)C(=S)SCC(=O)N(C)C
|
CN(C)C(=O)c1ccc(cc1)C(=O)N(C)C
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CC(C)N(C(C)C)C(=O)CCCC(=O)[O-]
|
CCCCOCCOC(=O)C1(CCCC1)O
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CCOC(=O)CCC(=O)N(C(C)C)C(C)C
|
CC(C)N(C(C)C)C(=O)CCC(=O)OC
|
c1ccc(cc1)C2(CCN(CC2)C(=O)C3CC3)O
|
CCCCCn1cnc2c1ncnc2N
|
CCC(=O)Oc1cccc(c1)OC(=O)C
|
CC(C)C(=O)OCCCOC(=O)C(C)C
|
CCCCNC(=O)CCC(=O)OCC
|
CCCN(CCC)C(=O)CCC(=O)OCC
|
CCCCOC(=O)CCC(=O)N(CC)CC
|
COCCOC(=O)c1ccccc1C(=O)OC
|
CC(C)(C(=O)OCCCc1ccccc1)O
|
CC[NH+](CC)CC(=O)N(C)c1ccccc1
|
Cc1ccc(cc1)NC(=O)NCC(=O)[O-]
|
CC(=O)NCC1CCC(CC1)CNC(=O)C
|
c1ccc2cc(ccc2c1)C[NH+](CCO)CCO
|
C(C(F)(F)F)NC(=O)NCC(F)(F)F
|
C1CSCCC1NC(=O)NCCF
|
CCOCCOC(=O)c1ccc(cc1)C#N
|
CC(=O)N(CCO)Cc1ccc(cc1)OC
|
Cc1ccc(cc1)S(=O)(=O)NC(C)(C)C[NH3+]
|
CCCCN1C[C@@H](Cc2c1cccc2)C(=O)N
|
c1ccc(cc1)S(=O)(=O)N2CCC=CC2
|
Cc1nc(c2cnn(c2n1)C)NCCC[NH+](C)C
|
C[C@H](c1ccccc1)[NH+](CCO)CCO
|
CN(CC(=O)[O-])C(=O)c1cc2ccccc2[nH]1
|
CN(CC(=O)OC)C(=O)c1cc2ccccc2[nH]1
|
COc1ccc(cc1)C(=O)NC2CCC2
|
C[NH+](C)CCSc1c2c(nc[nH]2)ncn1
|
CCOCCC(=O)NCc1ccccc1
|
CN(CCO)C(=O)/C=C/c1ccccc1
|
CC(=O)c1ccccc1NC(=O)CCC(=O)OC
|
c1ccc(cc1)C(=O)NCc2cnccn2
|
CCOC(=O)CNc1ccc(c(c1)F)F
|
CCN(CC)C(=S)S[C@@H](C)C(=O)OC
|
CC(=O)OCCOc1ccc(cc1)OC
|
CCCC[C@H](C(=O)[O-])NC(=O)C(F)(F)F
|
Cc1ccccc1NC(=O)NCC(=O)[O-]
|
CC[NH+](CC)CCOC(=O)c1ccccc1O
|
c1c(cnc(n1)NCCCO)Br
|
CCCCC[C@@H](C(=O)[O-])NC(=O)CCl
|
COCCNC(=O)CC1(CCCC1)CC(=O)[O-]
|
COCCCNc1ccc(cc1)S(=O)(=O)C
|
CC(=O)N[C@@H](CCO)c1ccc(cc1)OC
|
CC(C)(C)CC(=O)OCCC[NH+](C)C
|
CNC(=O)Oc1cccc(c1)NC(=O)C=C
|
CNC(=O)Oc1cccc(c1)NC(=O)C2CC2
|