In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 16th, 2006 | 28 | No |
Popular Name: 4-benzoyl-3-hydroxy-5-(3-methoxyphenyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one 4-benzoyl-3-hydroxy-5-(3-methoxy…
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) | 2.67 | 7.18 | -61.66 | 0 | 6 | -1 | 79 | 380.42 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.11 | -0.44 | -26.7 | 1 | 6 | 0 | 76 | 381.428 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.08 | -0.16 | -20.01 | 0 | 6 | 0 | 72 | 381.428 | 8 | ↓ |