In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 27th, 2007 | 32 | No |
Popular Name: 4-benzofuran-2-ylcarbonyl-3-hydroxy-5-(4-isopropylphenyl)-1-thiazol-2-yl-5H-pyrrol-2-one 4-benzofuran-2-ylcarbonyl-3-hydr…
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) | 5.21 | 11.62 | -57.3 | 0 | 6 | -1 | 86 | 443.504 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.65 | 10.7 | -33.3 | 1 | 6 | 0 | 84 | 444.512 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.62 | 11.7 | -19.72 | 0 | 6 | 0 | 80 | 444.512 | 5 | ↓ |