| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 22 | No |
Popular Name: 1-(4-hydroxyphenyl)-3-[3-(trifluoromethyl)phenyl]propane-1,3-dione 1-(4-hydroxyphenyl)-3-[3-(triflu…
| 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) | 4.46 | 5.44 | -11.73 | 1 | 3 | 0 | 60 | 307.247 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.46 | 6.21 | -39.84 | 0 | 3 | 0 | 63 | 306.239 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.27 | 8.27 | -22.27 | 1 | 3 | 0 | 54 | 308.255 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
