In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2007 | 31 | No |
Popular Name: 5-(3,4-dimethoxyphenyl)-3-hydroxy-4-(4-methoxybenzoyl)-1-(2-methoxyethyl)-5H-pyrrol-2-one 5-(3,4-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) | 2.07 | 6.06 | -59.41 | 0 | 8 | -1 | 97 | 426.445 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.48 | 5.63 | -26.85 | 0 | 8 | 0 | 91 | 427.453 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 4.65 | -32.06 | 1 | 8 | 0 | 95 | 427.453 | 8 | ↓ |