In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 28 | No |
Popular Name: (2R)-1-allyl-3-benzoyl-2-(4-tert-butylphenyl)-4-hydroxy-2H-pyrrol-5-one (2R)-1-allyl-3-benzoyl-2-(4-tert…
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) | 4.73 | 10.97 | -59.84 | 0 | 4 | -1 | 60 | 374.46 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.73 | 10.2 | -12.16 | 1 | 4 | 0 | 58 | 375.468 | 6 | ↓ |