| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 17 | Yes |
Popular Name: (3S)-3-[(3,5-dimethylisoxazol-4-yl)methylamino]azepan-2-one (3S)-3-[(3,5-dimethylisoxazol-4-…
| 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) | 0.35 | 3.3 | -49.81 | 3 | 5 | 1 | 72 | 238.311 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.35 | 2.95 | -10.9 | 2 | 5 | 0 | 67 | 237.303 | 3 | ↓ |
