In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 25 | No |
Popular Name: (2S)-3-benzoyl-4-hydroxy-1-(3-hydroxypropyl)-2-(4-pyridyl)-2H-pyrrol-5-one (2S)-3-benzoyl-4-hydroxy-1-(3-hy…
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) | 0.73 | 3.68 | -62.35 | 1 | 6 | -1 | 94 | 337.355 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.73 | 2.93 | -17.59 | 2 | 6 | 0 | 91 | 338.363 | 6 | ↓ |