| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 18 | Yes |
Popular Name: (3S)-3-[[(1R)-1-(1-methyl-4-piperidyl)ethyl]amino]azepan-2-one (3S)-3-[[(1R)-1-(1-methyl-4-pipe…
| 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) | 1.23 | 5.32 | -99.16 | 4 | 4 | 2 | 50 | 255.406 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 5.17 | -40.83 | 3 | 4 | 1 | 46 | 254.398 | 3 | ↓ |
