In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 32 | No |
Popular Name: 4-[(2S)-2-(2,4-dimethoxyphenyl)-3-(4-fluorobenzoyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]butanoic 4-[(2S)-2-(2,4-dimethoxyphenyl)-…
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) | 2.37 | 7.15 | -115.57 | 0 | 8 | -2 | 119 | 441.411 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 6.27 | -74.95 | 1 | 8 | -1 | 116 | 442.419 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 7.04 | -62.32 | 0 | 8 | -1 | 113 | 442.419 | 9 | ↓ |