In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 34 | No |
Popular Name: (2S)-1-butyl-4-hydroxy-3-[4-(p-tolylmethoxy)benzoyl]-2-(3-pyridyl)-2H-pyrrol-5-one (2S)-1-butyl-4-hydroxy-3-[4-(p-t…
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) | 4.68 | 11.66 | -62.37 | 0 | 6 | -1 | 83 | 455.534 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.68 | 10.91 | -16.55 | 1 | 6 | 0 | 80 | 456.542 | 9 | ↓ |