In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 6th, 2006 | 29 | No |
Popular Name: 4-(4-ethoxybenzoyl)-5-(2-fluorophenyl)-3-hydroxy-1-(2-methoxyethyl)-5H-pyrrol-2-one 4-(4-ethoxybenzoyl)-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 | 8.28 | -44.88 | 0 | 6 | -1 | 79 | 398.41 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.36 | -0.23 | -28.89 | 1 | 6 | 0 | 76 | 399.418 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.33 | -0.1 | -19.02 | 0 | 6 | 0 | 72 | 399.418 | 8 | ↓ |