| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 34 | Yes |
Popular Name: (4-benzyl-1,4-diazepan-1-yl)-[6-[(3R)-3-phenylpiperazin-1-yl]-3-pyridyl]methanone (4-benzyl-1,4-diazepan-1-yl)-[6-…
| 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) | 2.90 | 14.26 | -98.05 | 3 | 6 | 2 | 57 | 457.622 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.90 | 12.98 | -44.52 | 2 | 6 | 1 | 53 | 456.614 | 5 | ↓ |
