In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2007 | 33 | No |
Popular Name: 4-(4-chlorobenzoyl)-3-hydroxy-1-(3-methoxypropyl)-5-(3,4,5-trimethoxyphenyl)-5H-pyrrol-2-one 4-(4-chlorobenzoyl)-3-hydroxy-1-…
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) | 2.94 | 7.9 | -57.06 | 0 | 8 | -1 | 97 | 474.917 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 6.48 | -31.67 | 1 | 8 | 0 | 95 | 475.925 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 7.47 | -26.97 | 0 | 8 | 0 | 91 | 475.925 | 10 | ↓ |