In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2005 | 26 | No |
Popular Name: 4-benzoyl-3-hydroxy-1-(2-hydroxyethyl)-5-(3-methoxyphenyl)-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) | 1.78 | 4.53 | -64.68 | 1 | 6 | -1 | 90 | 352.366 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.22 | -2.47 | -25.8 | 2 | 6 | 0 | 87 | 353.374 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.20 | -2.19 | -17.86 | 1 | 6 | 0 | 83 | 353.374 | 6 | ↓ |