In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 34 | No |
Popular Name: (2S)-3-(3-allyloxybenzoyl)-2-(3-butoxyphenyl)-1-butyl-4-hydroxy-2H-pyrrol-5-one (2S)-3-(3-allyloxybenzoyl)-2-(3-…
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) | 5.96 | 12.2 | -60.78 | 0 | 6 | -1 | 79 | 462.566 | 13 | ↓ |
Lo Low (pH 4.5-6) | 5.96 | 11.44 | -14.37 | 1 | 6 | 0 | 76 | 463.574 | 13 | ↓ |