| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 21 | Yes |
Popular Name: methyl 1-phenyl-3-(4-pyridinyl)-1H-pyrazole-4-carboxylate methyl 1-phenyl-3-(4-pyridinyl)-…
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CAS Number: 400074-76-2
| 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) | 1.81 | 7.98 | -10.56 | 0 | 5 | 0 | 57 | 279.299 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 8.43 | -34.69 | 1 | 5 | 1 | 58 | 280.307 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 137 - 139 | KeyOrganics |
