| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 17 | Yes |
Popular Name: (2S)-2-(1,4-diazepan-1-yl)-1-(1-piperidyl)propan-1-one (2S)-2-(1,4-diazepan-1-yl)-1-(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) | 0.50 | 4.42 | -33.82 | 2 | 4 | 1 | 37 | 240.371 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.50 | 5.71 | -112.08 | 3 | 4 | 2 | 41 | 241.379 | 2 | ↓ |
