| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2011 | 16 | Yes |
Popular Name: (2S)-1-[(4R)-4-isopropylazepan-1-yl]-2-(methylamino)propan-1-one (2S)-1-[(4R)-4-isopropylazepan-1…
| 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) | 2.70 | 6.03 | -37.35 | 2 | 3 | 1 | 37 | 227.372 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.70 | 4.72 | -6.7 | 1 | 3 | 0 | 32 | 226.364 | 3 | ↓ |
