In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 28 | No |
Popular Name: (5S)-4-benzoyl-5-(2,5-dimethoxyphenyl)-3-hydroxy-1-(2-hydroxyethyl)-5H-pyrrol-2-one (5S)-4-benzoyl-5-(2,5-dimethoxyp…
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) | 1.79 | 3.96 | -69.45 | 1 | 7 | -1 | 99 | 382.392 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 2.91 | -32.71 | 2 | 7 | 0 | 96 | 383.4 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 3.95 | -21.91 | 1 | 7 | 0 | 93 | 383.4 | 7 | ↓ |