In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 18 | Yes |
Popular Name: (4S)-4-amino-1-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-2-one (4S)-4-amino-1-[(3,4-dimethoxyph…
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) | -0.30 | 2.72 | -58.94 | 3 | 5 | 1 | 66 | 251.306 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.30 | 2.43 | -12.97 | 2 | 5 | 0 | 65 | 250.298 | 4 | ↓ |