| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2011 | 24 | Yes |
Popular Name: 1-(azepan-1-yl)-3-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one 1-(azepan-1-yl)-3-[(4-methyl-5-p…
| 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) | 3.53 | 11.43 | -18.72 | 0 | 5 | 0 | 51 | 344.484 | 5 | ↓ |
