In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 32 | No |
Popular Name: (2S)-1-butyl-4-hydroxy-3-(4-methylbenzoyl)-2-(3,4,5-trimethoxyphenyl)-2H-pyrrol-5-one (2S)-1-butyl-4-hydroxy-3-(4-meth…
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) | 3.90 | 9.4 | -60.17 | 0 | 7 | -1 | 88 | 438.5 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.90 | 8.65 | -16.52 | 1 | 7 | 0 | 85 | 439.508 | 9 | ↓ |