| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2005 | 22 | Yes |
Popular Name: 6-(4-chlorophenyl)-2-phenoxynicotinonitrile 6-(4-chlorophenyl)-2-phenoxynico…
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CAS Number: 252059-10-2
| 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) | 5.07 | 2.82 | -10.67 | 0 | 3 | 0 | 45 | 306.752 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 5.07 | 2.81 | -36.66 | 1 | 3 | 1 | 47 | 307.76 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 179 - 180 | KeyOrganics |
