| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 20 | Yes |
Popular Name: (3S)-3-[(3,4-dimethoxyphenyl)methylamino]azepan-2-one (3S)-3-[(3,4-dimethoxyphenyl)met…
| 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) | 1.14 | 4.21 | -48.95 | 3 | 5 | 1 | 64 | 279.36 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.14 | 3.86 | -11.22 | 2 | 5 | 0 | 60 | 278.352 | 5 | ↓ |
