In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 29 | No |
Popular Name: (2S)-1-allyl-3-(4-chlorobenzoyl)-2-(2,4-dimethoxyphenyl)-4-hydroxy-2H-pyrrol-5-one (2S)-1-allyl-3-(4-chlorobenzoyl)…
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) | 3.74 | 8.37 | -55.05 | 0 | 6 | -1 | 79 | 412.849 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.74 | 7.61 | -10.94 | 1 | 6 | 0 | 76 | 413.857 | 7 | ↓ |