In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2006 | 29 | No |
Popular Name: 5-(3-chlorophenyl)-4-(4-ethoxybenzoyl)-3-hydroxy-1-(2-methoxyethyl)-5H-pyrrol-2-one 5-(3-chlorophenyl)-4-(4-ethoxybe…
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) | 3.45 | 8.58 | -41.66 | 0 | 6 | -1 | 79 | 414.865 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 8.35 | -20.1 | 0 | 6 | 0 | 73 | 415.873 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.90 | 7.35 | -28.14 | 1 | 6 | 0 | 76 | 415.873 | 7 | ↓ |