In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 27 | No |
Popular Name: (2S)-1-allyl-2-(4-ethylphenyl)-4-hydroxy-3-(4-methylbenzoyl)-2H-pyrrol-5-one (2S)-1-allyl-2-(4-ethylphenyl)-4…
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) | 4.39 | 11.15 | -59.73 | 0 | 4 | -1 | 60 | 360.433 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.39 | 10.38 | -11.66 | 1 | 4 | 0 | 58 | 361.441 | 6 | ↓ |