In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 30 | No |
Popular Name: (2R)-3-(4-bromobenzoyl)-2-(4-tert-butylphenyl)-4-hydroxy-1-(3-hydroxypropyl)-2H-pyrrol-5-one (2R)-3-(4-bromobenzoyl)-2-(4-ter…
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) | 4.53 | 8.45 | -59.29 | 1 | 5 | -1 | 81 | 471.371 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.53 | 7.68 | -14.18 | 2 | 5 | 0 | 78 | 472.379 | 7 | ↓ |