| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2010 | 18 | Yes |
Popular Name: (5S)-5-ethyl-1-[(1R,2R)-2-phenylcyclopropyl]-1,4-diazepane (5S)-5-ethyl-1-[(1R,2R)-2-phenyl…
| 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) | 2.83 | 7.4 | -31.3 | 2 | 2 | 1 | 20 | 245.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | 8.02 | -29.83 | 2 | 2 | 1 | 16 | 245.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | 6.3 | -1.14 | 1 | 2 | 0 | 15 | 244.382 | 3 | ↓ |
