| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 29 | Yes |
Popular Name: (4S)-4-(4-benzylpiperazine-1-carbonyl)-1-[(4-chlorophenyl)methyl]pyrrolidin-2-one (4S)-4-(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) | 2.88 | 9.88 | -12.84 | 0 | 5 | 0 | 44 | 411.933 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 12.09 | -55.6 | 1 | 5 | 1 | 45 | 412.941 | 5 | ↓ |
