In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 10th, 2007 | 34 | No |
Popular Name: 5-(3,4-dichlorophenyl)-3-hydroxy-4-(4-isopropoxybenzoyl)-1-(3-pyridylmethyl)-5H-pyrrol-2-one 5-(3,4-dichlorophenyl)-3-hydroxy…
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) | 4.62 | 11.97 | -37.47 | 0 | 6 | -1 | 83 | 496.37 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.07 | 9.71 | -26.02 | 1 | 6 | 0 | 80 | 497.378 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.04 | 10.71 | -21.55 | 0 | 6 | 0 | 77 | 497.378 | 7 | ↓ |