In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2005 | 31 | No |
Popular Name: 5-(3,4-dimethoxyphenyl)-4-(2,5-dimethylbenzoyl)-3-hydroxy-1-(2-methoxyethyl)-5H-pyrrol-2-one 5-(3,4-dimethoxyphenyl)-4-(2,5-d…
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) | 2.83 | 8.25 | -49.91 | 0 | 7 | -1 | 88 | 424.473 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.28 | 1.08 | -21.02 | 1 | 7 | 0 | 85 | 425.481 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.25 | 0.71 | -16.82 | 0 | 7 | 0 | 82 | 425.481 | 8 | ↓ |