In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 30 | No |
Popular Name: (2R)-4-hydroxy-3-(2-methoxybenzoyl)-2-(4-pyridyl)-1-(3-pyridylmethyl)-2H-pyrrol-5-one (2R)-4-hydroxy-3-(2-methoxybenzo…
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) | 1.26 | 8.59 | -62.12 | 0 | 7 | -1 | 95 | 400.414 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 7.84 | -17.04 | 1 | 7 | 0 | 93 | 401.422 | 6 | ↓ |