| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 19th, 2006 | 28 | Yes |
Popular Name: 2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methylindolin-1-yl)-ethanone 2-[(4-allyl-5-cyclohexyl-1,2,4-t…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.39 | 13.81 | -10.71 | 0 | 5 | 0 | 51 | 396.56 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.39 | 13.93 | -31.83 | 1 | 5 | 1 | 52 | 397.568 | 6 | ↓ |
