SMILES stringlengths 11 220 | Source stringclasses 16
values |
|---|---|
IC1=CC2CC1C13CC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
IC1=CC2OC1C13CC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
BrCC=C1C23C4C=CC(C4)C12C1CC3CC1Nc1ccccc1 | tartarus_reactivity |
CC1(Cl)C2CCC1C13C4C=CC(C4)C21C3c1ccccc1 | tartarus_reactivity |
BrC1=CC2CC1C13CC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
N=C1C23C4C=CC(C4)C12C1CC3CC1Nc1ccccc1 | tartarus_reactivity |
OC12C=CC(C1)C13CC21C1CC3CC1c1ccccc1-c1ccccc1C=CCBr | tartarus_reactivity |
IC1C23C4C=CC(C4)C12C1CC3CC1c1ccccc1-c1ccccc1 | tartarus_reactivity |
Ic1ccccc1C=CC=Cc1ccccc1C1CC2CC1C13OC21C1C=CC3C1 | tartarus_reactivity |
C1=CC2C(Oc3ccccc3)C1C13CC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
C(C=CC1CC2CC1C13NC21C1C=CC3C1)=CCc1ccccc1-c1ccccc1 | tartarus_reactivity |
Cc1ccccc1C1CC2CC1C13NC21C1C=CC3O1 | tartarus_reactivity |
C1=CC2CC1C13CC21C1CC3CC1Nc1ccccn1 | tartarus_reactivity |
C1=CC2C(Oc3ccccc3)C1C13SC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
Cc1ccccc1-c1ccccc1C=COc1ccccc1C1CC2CC1C13CC21C1C=CC3S1 | tartarus_reactivity |
C=CC1C2C=CC1C13CC21C1CC(c2ccccc2C)C3C1 | tartarus_reactivity |
CC=CCc1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
Cc1ccccc1C1CC2CC1C13CC21C1C=C(F)C3C1 | tartarus_reactivity |
Fc1ccccc1C1CC2CC1C13OC21C1C=CC3C1F | tartarus_reactivity |
C1=CC2CC1C13CC21C1CC3CC1C1C=C1c1ccccc1 | tartarus_reactivity |
C1=CC2C(c3ccccc3)C1C13CC21C1CC3CC1c1cccnc1 | tartarus_reactivity |
OC12CC(c3ccccc3)C(C1)C13SC21C1C=CC3C1 | tartarus_reactivity |
C=C(Cc1ccccc1C)C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
C1=CC2CC1C13CC21C1CC3CC1OCc1ccccc1 | tartarus_reactivity |
C1=CC2SC1C13OC21C1(c2ccccc2)CC3CC1c1ccccc1 | tartarus_reactivity |
Brc1ccccc1NC1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
CCC1C2C=CC1C13C4CC(CC4c4ccccc4)C21C3Br | tartarus_reactivity |
ICOc1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
C1=CC2(c3ccccc3)CC1C13NC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
C=CCc1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
C=CC1C23C4C=CC(C4)C12C1CC3CC1c1ccccc1C | tartarus_reactivity |
ClC12C=CC(C1)C13OC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
Cc1ccccc1C1CC2CC1C13OC21C1OC3C=C1F | tartarus_reactivity |
C1=CC2OC1C13SC21C1CC3CC1Cc1ccccc1 | tartarus_reactivity |
Cc1ccccc1C1CC2CC1(C)C13CC21C1C=CC3C1c1ccccc1 | tartarus_reactivity |
ClC1C2CC(CCc3ccccc3)C1C13CC21C1C=CC3C1 | tartarus_reactivity |
Brc1ccccc1CC1CC2CC1C13C4C=CC(C4)C21C3c1ccccc1 | tartarus_reactivity |
CC=CC=Cc1ccccc1C1CC2CC1C13CC21C1C=CC3C1c1ccccc1 | tartarus_reactivity |
C1=CC2CC1C13CC21C1CC3CC1c1ccccc1-c1ccccc1 | tartarus_reactivity |
CC=Cc1ccccc1C1CC2CC1(C)C13CC21C1C=CC3C1 | tartarus_reactivity |
Brc1ccccc1C=CC1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
BrC1C2C=CC1C13OC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
Cc1ccccc1C1CC2CC1C13CC21C1C=CC3C1c1ccccc1 | tartarus_reactivity |
Cc1ccccc1C=COc1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
BrC1C(c2ccccc2)C2CC1C13CC21C1C=CC3C1c1ccccc1 | tartarus_reactivity |
Cc1ccccc1C1CC2CC1C13CC21C1C=CC3C1F | tartarus_reactivity |
BrC12CC(CC1c1ccccc1)C13CC21C1C=CC3C1 | tartarus_reactivity |
C(=Cc1ccccc1C1CC2CC1C13CC21C1C=CC3S1)c1ccccc1 | tartarus_reactivity |
CC1CC2C(c3ccccc3)C1C13CC21C1C=CC3O1 | tartarus_reactivity |
C=CC1C2CC(c3ccccc3OC)C1C13CC21C1C=CC3C1 | tartarus_reactivity |
CC12CC(CC1c1ccccc1)C13NC21C1C=CC3O1 | tartarus_reactivity |
Oc1ccccc1C1CC2CC1C13NC21C1C=CC3C1 | tartarus_reactivity |
SCc1ncccc1C1CC2CC1(c1ccccc1)C13CC21C1C=CC3C1 | tartarus_reactivity |
FC1C2C=CC1C13OC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
O=CCCc1ccccc1C1C2C=CC1C13CC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
Fc1ccccc1C1CC2CC1C13CC21C1C=CC3C1Cl | tartarus_reactivity |
FCC1C2C=CC1C13OC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
CC1=CC2OC1C13SC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
CC1=CC2OC1C13SC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
Cc1ccccc1C12CC(CC1c1ccccc1CBr)C13CC21C1C=CC3C1 | tartarus_reactivity |
CC=CCC1C2C=CC1C13CC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
ICCCCC1C2C=CC1C13CC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
C1=CC2CC1C13NC21C1CC3CC1c1ccccc1-c1ccccc1 | tartarus_reactivity |
BrC12CC(c3ccccc3)C(C1)C13OC21C1C=CC3C1 | tartarus_reactivity |
ClCc1ccccc1CC1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
FCC=CC1C2C=CC1C13SC21C1CC(c2ccccc2-c2ccccc2)C3C1 | tartarus_reactivity |
CCCCN1C23C4C=CC(C4)C12C1CCC3C1 | tartarus_reactivity |
CC1CC2C(c3ccccc3)C1(Br)C13CC21C1C=CC3C1 | tartarus_reactivity |
BrC1=CC2OC1C13OC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
Cc1ccccc1C1CC2CC1(Br)C13CC21C1C=CC3C1 | tartarus_reactivity |
Cc1ccccc1CCOc1ccccc1C1CC2CC1C13CC21C1C=CC3S1 | tartarus_reactivity |
Clc1ccccc1C=CC1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
O=Cc1ccccc1C1CC2CC1C13OC21C1C=CC3C1 | tartarus_reactivity |
NC1CC2CC1C13NC21C1C=CC3C1Oc1ccccc1 | tartarus_reactivity |
BrC12C=CC(C1)C13OC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
C1=CC2C(c3ccccc3)C1C13CC21C1NC3CC1C1=CC=C(c2ccccc2)C1 | tartarus_reactivity |
C1=CC2CC1C13CC21C1CC3CC1c1ccccc1CCCc1ccccc1 | tartarus_reactivity |
CSc1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
COc1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
BrCC1C2C=CC1C13OC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
CC12CC(CC1c1ccccc1)C13CC21C1C=CC3C1 | tartarus_reactivity |
Sc1ccccc1C1CC2CC1C13CC21C1C=CC3C1c1ccccc1 | tartarus_reactivity |
C1=CC2C(c3ccccc3)C1C13SC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
C1=CC2C(c3ccccc3N3C=C3)C1C13CC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
COCc1ccccc1C1CC2CC1C13CC21C1C=CC3C1c1ccccc1 | tartarus_reactivity |
Fc1ccccc1C1CC2CC1C13CC21C1C=C(Br)C3C1 | tartarus_reactivity |
ClC=Cc1ccccc1C=Cc1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
C=C1C23C4C=CC(C4)C12C1CC3CC1c1ccccc1CBr | tartarus_reactivity |
BrC12CC(CC1Cc1ccccc1)C13CC21C1C=CC3C1 | tartarus_reactivity |
FC1=CC2CC1C13CC21C1CC(c2ccccc2Cl)C3C1 | tartarus_reactivity |
CC1CC2C(c3ccccc3)C1C13CC21C1C=CC3C1F | tartarus_reactivity |
OC12C=CC(C1)C13OC21C1CC3CC1c1ccccc1 | tartarus_reactivity |
Sc1ccccc1C1CC2CC1C13CC21C1C=CC3(c2ccccc2)C1 | tartarus_reactivity |
CC1CC2C(c3ccccc3)C1C13C4C=CC(C4)C21C3Br | tartarus_reactivity |
CC(O)=CC=Cc1ccccc1-c1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
Cc1ccccc1C1CC2CC1C13NC21C1C=CC3C1c1ccccc1 | tartarus_reactivity |
BrCC1=CC2CC1C13CC21C1CC3CC1c1ccccc1-c1ccccc1 | tartarus_reactivity |
BrC12C=CC(C1)C13OC21C1CC(c2ccccc2)C3C1 | tartarus_reactivity |
Cc1ccccc1C=Cc1ccccc1C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
C=C(CCC=Cc1ccccc1)C1CC2CC1C13CC21C1C=CC3C1 | tartarus_reactivity |
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