| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 13 | Yes |
Popular Name: 4-(4-chlorophenyl)-1H-pyrazol-5-amine 4-(4-chlorophenyl)-1H-pyrazol-5-…
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CAS Numbers: 40545-65-1 , 57999-09-4 , [40545-65-1]
4-(4-Chloro-phenyl)-2H-pyrazol-3-ylamine
4-(4-chlorophenyl)-1H-pyrazol-3-amine
4-(4-Chlorophenyl)-1H-pyrazol-3-ylamine
4-(4-Chlorophenyl)-1H-pyrazol-5-ylamine
| 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) | 2.33 | 4.1 | -5.46 | 3 | 3 | 0 | 55 | 193.637 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.33 | 4.26 | -35.54 | 4 | 3 | 1 | 56 | 194.645 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 99% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| melting_point | LMS | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.