In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 5th, 2008 | 30 | No |
Popular Name: (5S)-4-(4-ethoxybenzoyl)-5-(4-fluorophenyl)-3-hydroxy-1-(3-methoxypropyl)-5H-pyrrol-2-one (5S)-4-(4-ethoxybenzoyl)-5-(4-fl…
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) | 3.23 | 8.61 | -56.73 | 0 | 6 | -1 | 79 | 412.437 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.65 | 8.61 | -22.12 | 0 | 6 | 0 | 73 | 413.445 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.68 | 7.63 | -28.12 | 1 | 6 | 0 | 76 | 413.445 | 8 | ↓ |