In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2006 | 28 | No |
Popular Name: 4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1-(2-methoxyethyl)-5H-pyrrol-2-one 4-benzoyl-3-hydroxy-5-(4-isoprop…
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) | 3.87 | 9.97 | -43.78 | 0 | 5 | -1 | 70 | 378.448 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.32 | 0.22 | -24.94 | 1 | 5 | 0 | 66 | 379.456 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 0.5 | -17.38 | 0 | 5 | 0 | 63 | 379.456 | 7 | ↓ |