| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | Yes |
Popular Name: 2-(azepan-1-yl)-N-[(4-chloro-3-fluoro-phenyl)methyl]ethanamine 2-(azepan-1-yl)-N-[(4-chloro-3-f…
| 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) | 3.71 | 9.55 | -132.51 | 3 | 2 | 2 | 21 | 286.822 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.71 | 7.72 | -49.55 | 2 | 2 | 1 | 20 | 285.814 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.71 | 8.19 | -38.91 | 2 | 2 | 1 | 16 | 285.814 | 5 | ↓ |
