In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2009 | 30 | No |
Popular Name: (3R)-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(methyl-(2-phenoxyethyl)amino)pyrrolidine-2,5-dione (3R)-1-[2-(3,4-dimethoxyphenyl)e…
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) | 2.27 | 10.33 | -55.71 | 1 | 7 | 1 | 70 | 413.494 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 7.6 | -12.1 | 0 | 7 | 0 | 68 | 412.486 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 8.03 | -12.14 | 0 | 7 | 0 | 68 | 412.486 | 10 | ↓ |