| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2010 | 18 | Yes |
Popular Name: 2-(1,4-diazepan-1-yl)-1-(2,4-dichlorophenyl)ethanone 2-(1,4-diazepan-1-yl)-1-(2,4-dic…
| 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) | 2.34 | 5.52 | -43.42 | 2 | 3 | 1 | 37 | 288.198 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.34 | 7.53 | -125.17 | 3 | 3 | 2 | 38 | 289.206 | 3 | ↓ |
