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 |