In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 8th, 2006 | 28 | No |
Popular Name: 4-(4-fluorobenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(3-methoxypropyl)-5H-pyrrol-2-one 4-(4-fluorobenzoyl)-5-(2-fluorop…
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) | 2.91 | 9.13 | -50.3 | 0 | 5 | -1 | 70 | 386.374 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 1.15 | -25.62 | 1 | 5 | 0 | 66 | 387.382 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 1.35 | -15.89 | 0 | 5 | 0 | 63 | 387.382 | 7 | ↓ |