In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 30 | No |
Popular Name: (2S)-1-butyl-3-(4-chlorobenzoyl)-2-(2,3-dimethoxyphenyl)-4-hydroxy-2H-pyrrol-5-one (2S)-1-butyl-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) | 4.31 | 9.61 | -57.2 | 0 | 6 | -1 | 79 | 428.892 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.31 | 8.85 | -12.29 | 1 | 6 | 0 | 76 | 429.9 | 8 | ↓ |