In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 23 | Yes |
Popular Name: 1-[[4-(4-ethylpiperazine-1-carbonyl)phenyl]methyl]pyrrolidin-2-one 1-[[4-(4-ethylpiperazine-1-carbo…
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) | 0.70 | 8.78 | -54.6 | 1 | 5 | 1 | 45 | 316.425 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.70 | 6.53 | -16.45 | 0 | 5 | 0 | 44 | 315.417 | 4 | ↓ |