In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 23 | No |
Popular Name: (3R)-1-(4-dimethylaminophenyl)-3-(4-methylpiperazin-1-yl)pyrrolidine-2,5-dione (3R)-1-(4-dimethylaminophenyl)-3…
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) | 0.36 | 5.79 | -42.3 | 1 | 6 | 1 | 48 | 317.413 | 3 | ↓ |
Ref Reference (pH 7) | 0.36 | 5.84 | -42.67 | 1 | 6 | 1 | 48 | 317.413 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 3.48 | -11.53 | 0 | 6 | 0 | 47 | 316.405 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 3.41 | -11.23 | 0 | 6 | 0 | 47 | 316.405 | 3 | ↓ |