| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2009 | 28 | Yes |
Popular Name: 3-amino-6-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]quinoline-4-carboxylic 3-amino-6-(trifluoromethyl)-2-[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) | 4.81 | 9.21 | -48.09 | 2 | 4 | -1 | 79 | 399.27 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.81 | 9.59 | -47.12 | 3 | 4 | 0 | 80 | 400.278 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4968702 | IBM Patent Data |
