In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2007 | 31 | No |
Popular Name: 5-(2,4-dimethoxyphenyl)-3-hydroxy-1-(3-hydroxypropyl)-4-(4-methoxybenzoyl)-5H-pyrrol-2-one 5-(2,4-dimethoxyphenyl)-3-hydrox…
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) | 2.11 | 3.98 | -62.03 | 1 | 8 | -1 | 108 | 426.445 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 2.96 | -28.71 | 2 | 8 | 0 | 106 | 427.453 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 3.95 | -20.55 | 1 | 8 | 0 | 102 | 427.453 | 9 | ↓ |