smiles
stringlengths 1
71
| activity
float64 -5.56
1.86
|
|---|---|
Clc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
| 0.380314
|
CCCCC[N+](=O)[O-]
| 0.254588
|
Clc1ccccc1Cl
| 0.629199
|
CC(=O)O
| -0.73839
|
C1=CC=CCC=C1
| 0.724135
|
Clc1cc(-c2c(Cl)cc(Cl)c(Cl)c2Cl)c(Cl)c(Cl)c1Cl
| -0.204696
|
COCC(OC)(OC)OC
| -0.49207
|
CNC(C)=O
| -1.587681
|
C1CCCC1
| 1.286053
|
Cc1c[nH]cn1
| -1.656958
|
CC(F)F
| 0.949929
|
CCCCC(=O)CCCC
| 0.300773
|
CC1=CCCCC1
| 1.150064
|
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