| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 36 | No |
Popular Name: (3S)-3-(4-benzhydrylpiperazin-1-yl)-1-(4-fluorobenzoyl)azepan-2-one (3S)-3-(4-benzhydrylpiperazin-1-…
| 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) | 4.38 | 15.51 | -47.09 | 1 | 5 | 1 | 45 | 486.611 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.38 | 15.16 | -7.81 | 0 | 5 | 0 | 44 | 485.603 | 5 | ↓ |
