| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2009 | 39 | Yes |
Popular Name: N-[4-(4-benzhydrylpiperazin-1-yl)butyl]-7-cyano-4-oxo-1H-quinoline-3-carboxamide N-[4-(4-benzhydrylpiperazin-1-yl…
| 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) | 4.50 | 13.84 | -69.98 | 2 | 7 | 0 | 97 | 519.649 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.50 | 11.58 | -47.03 | 1 | 7 | -1 | 95 | 518.641 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 14.24 | -49.62 | 3 | 7 | 1 | 93 | 520.657 | 9 | ↓ |
