| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2010 | 26 | Yes |
Popular Name: (4-benzyl-1,4-diazepan-1-yl)-[3-(trifluoromethyl)phenyl]methanone (4-benzyl-1,4-diazepan-1-yl)-[3-…
| 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) | 3.34 | 12.05 | -44.49 | 1 | 3 | 1 | 25 | 363.403 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 10.23 | -11 | 0 | 3 | 0 | 24 | 362.395 | 4 | ↓ |
