| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 31 | Yes |
Popular Name: (3S)-3-(4-benzylpiperazine-1-carbonyl)-1-(2-naphthyl)pyrrolidin-2-one (3S)-3-(4-benzylpiperazine-1-car…
| 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) | 3.69 | 11.04 | -13.16 | 0 | 5 | 0 | 44 | 413.521 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.69 | 13.25 | -46.32 | 1 | 5 | 1 | 45 | 414.529 | 4 | ↓ |
