In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2008 | 22 | Yes |
Popular Name: 5,7-Bis(trifluoromethyl)-4-hydroxyquinoline-3-carboxylic acid 5,7-Bis(trifluoromethyl)-4-hydro…
Find On: PubMed — Wikipedia — Google
CAS Number: 240408-95-1
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) | 3.20 | 5.84 | -41.7 | 1 | 4 | -1 | 73 | 324.156 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.20 | 6.66 | -115.64 | 0 | 4 | -2 | 76 | 323.148 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.