| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2008 | 20 | Yes |
Popular Name: 4-{3-[(4-fluorophenoxy)methyl]-1H-1,2,4-triazol-5-yl}pyridine 4-{3-[(4-fluorophenoxy)methyl]-1…
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CAS Number: 477852-74-7
| 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) | 2.14 | 6 | -9.88 | 1 | 5 | 0 | 64 | 270.267 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 5.86 | -39.99 | 0 | 5 | -1 | 62 | 269.259 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 185 - 187 | KeyOrganics |
