| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2008 | 18 | Yes |
Popular Name: (3S)-3-[2-(aminomethyl)-4-bromo-phenoxy]azepan-2-one (3S)-3-[2-(aminomethyl)-4-bromo-…
| 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) | 1.92 | 2.96 | -57.2 | 4 | 4 | 1 | 66 | 314.203 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 2.57 | -7.58 | 3 | 4 | 0 | 64 | 313.195 | 3 | ↓ |
