In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2006 | 24 | Yes |
Popular Name: 4-(2-hydroxyphenyl)-2-phenyl-1-(2-thienyl)butane-1,4-dione 4-(2-hydroxyphenyl)-2-phenyl-1-(…
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) | 4.79 | 10.3 | -10.04 | 1 | 3 | 0 | 54 | 336.412 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.79 | 11.42 | -60.36 | 0 | 3 | -1 | 57 | 335.404 | 6 | ↓ |