In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 9th, 2006 | 27 | No |
Popular Name: 1-butyl-4-(4-chlorobenzoyl)-5-(2-fluorophenyl)-3-hydroxy-5H-pyrrol-2-one 1-butyl-4-(4-chlorobenzoyl)-5-(2…
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) | 4.61 | 11.21 | -38.41 | 0 | 4 | -1 | 60 | 386.83 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.05 | 0.25 | -24.69 | 1 | 4 | 0 | 57 | 387.838 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.03 | 0.41 | -14.96 | 0 | 4 | 0 | 54 | 387.838 | 6 | ↓ |