| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 25 | Yes |
Popular Name: 2-phenoxy-6-[3-(trifluoromethyl)phenyl]nicotinonitrile 2-phenoxy-6-[3-(trifluoromethyl)…
Find On: PubMed — Wikipedia — Google
CAS Number: 303152-80-9
| 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) | 5.26 | 4.26 | -13.17 | 0 | 3 | 0 | 45 | 340.304 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 5.26 | 4.79 | -38.78 | 1 | 3 | 1 | 47 | 341.312 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 174 - 177 | KeyOrganics |
