In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 26 | No |
Popular Name: 4-benzoyl-3-hydroxy-5-(4-iodophenyl)-1-(2-methoxyethyl)-5H-pyrrol-2-one 4-benzoyl-3-hydroxy-5-(4-iodophe…
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 | 9.12 | -39.76 | 0 | 5 | -1 | 70 | 462.263 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.86 | -1.14 | -17.61 | 0 | 5 | 0 | 63 | 463.271 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 7.6 | -24.61 | 1 | 5 | 0 | 67 | 463.271 | 5 | ↓ |