| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2009 | 29 | Yes |
Popular Name: (3S)-3-(4-benzylpiperazine-1-carbonyl)-1-(4-chloro-3-methyl-phenyl)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) | 3.56 | 9.85 | -11.1 | 0 | 5 | 0 | 44 | 411.933 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.56 | 12.07 | -46.17 | 1 | 5 | 1 | 45 | 412.941 | 4 | ↓ |
