| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2008 | 20 | Yes |
Popular Name: 5-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-4-propyl-2H-1,2,4-triazol-3-one 5-[2-(azepan-1-yl)-2-oxo-ethyl]s…
| 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) | 1.66 | 6.88 | -10.51 | 1 | 6 | 0 | 71 | 298.412 | 5 | ↓ |
