In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2007 | 31 | No |
Popular Name: 5-(4-fluorophenyl)-3-hydroxy-4-(4-methoxybenzoyl)-1-(4-pyridylmethyl)-5H-pyrrol-2-one 5-(4-fluorophenyl)-3-hydroxy-4-(…
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) | 2.71 | 9.09 | -56.85 | 0 | 6 | -1 | 83 | 417.416 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 0.59 | -23.61 | 0 | 6 | 0 | 76 | 418.424 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.71 | 0.8 | -54.28 | 2 | 6 | 1 | 80 | 419.432 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.12 | 0.71 | -65.52 | 1 | 6 | 1 | 77 | 419.432 | 6 | ↓ |