In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 37 | No |
Popular Name: (2S)-3-(4-allyloxy-3-methyl-benzoyl)-1-butyl-2-(4-hexoxyphenyl)-4-hydroxy-2H-pyrrol-5-one (2S)-3-(4-allyloxy-3-methyl-benz…
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) | 7.40 | 14.96 | -59.22 | 0 | 6 | -1 | 79 | 504.647 | 15 | ↓ |
Lo Low (pH 4.5-6) | 7.40 | 14.2 | -13.54 | 1 | 6 | 0 | 76 | 505.655 | 15 | ↓ |