In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 35 | No |
Popular Name: (2S)-3-(4-allyloxybenzoyl)-1-butyl-4-hydroxy-2-(3,4,5-trimethoxyphenyl)-2H-pyrrol-5-one (2S)-3-(4-allyloxybenzoyl)-1-but…
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) | 4.15 | 9.55 | -58.67 | 0 | 8 | -1 | 97 | 480.537 | 12 | ↓ |
Lo Low (pH 4.5-6) | 4.15 | 8.8 | -16.59 | 1 | 8 | 0 | 95 | 481.545 | 12 | ↓ |