In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 27 | No |
Popular Name: 4-benzoyl-3-hydroxy-1-(2-hydroxyethyl)-5-(4-hydroxy-3-methoxy-phenyl)-5H-pyrrol-2-one 4-benzoyl-3-hydroxy-1-(2-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) | 1.09 | 3.23 | -68.63 | 2 | 7 | -1 | 110 | 368.365 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.53 | -4.66 | -31.44 | 3 | 7 | 0 | 107 | 369.373 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.50 | -4.43 | -24.63 | 2 | 7 | 0 | 104 | 369.373 | 6 | ↓ |