In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2006 | 28 | No |
Popular Name: 4-benzoyl-5-(4-ethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-5H-pyrrol-2-one 4-benzoyl-5-(4-ethoxyphenyl)-3-h…
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) | 2.80 | 8.64 | -60.01 | 0 | 6 | -1 | 79 | 380.42 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.24 | -0.6 | -25.89 | 1 | 6 | 0 | 76 | 381.428 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.21 | -0.29 | -20.57 | 0 | 6 | 0 | 72 | 381.428 | 8 | ↓ |