| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 29 | Yes |
Popular Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-[2-(1,4-diazepan-1-yl)-3-pyridyl]methanone [4-[(4-chlorophenyl)methyl]piper…
| 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) | 1.59 | 8.97 | -43.64 | 2 | 6 | 1 | 56 | 414.961 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 11.17 | -104.7 | 3 | 6 | 2 | 57 | 415.969 | 4 | ↓ |
