In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 12th, 2008 | 35 | No |
Popular Name: 3-[(2S)-2-(4-acetamidophenyl)-4-hydroxy-3-(4-methylbenzoyl)-5-oxo-2H-pyrrol-1-yl]benzoic 3-[(2S)-2-(4-acetamidophenyl)-4-…
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) | 3.63 | 10.76 | -147.9 | 1 | 8 | -2 | 130 | 468.465 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 9.71 | -72.52 | 1 | 8 | -1 | 124 | 469.473 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.08 | 8.68 | -89.51 | 2 | 8 | -1 | 127 | 469.473 | 5 | ↓ |