| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2009 | 16 | Yes |
Popular Name: (2S)-1-(azepan-1-yl)-2-(3-hydroxypropylamino)propan-1-one (2S)-1-(azepan-1-yl)-2-(3-hydrox…
| 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) | 0.83 | 2.67 | -40.93 | 3 | 4 | 1 | 57 | 229.344 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | 1.44 | -9.57 | 2 | 4 | 0 | 53 | 228.336 | 5 | ↓ |
