| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2008 | 10 | Yes |
Popular Name: methyl 3-amino-1H-pyrazole-4-carboxylate methyl 3-amino-1H-pyrazole-4-car…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 29097-00-5 , [29097-00-5]
1H-Pyrazole-4-carboxylic acid, 3-amino-, methyl ester (9CI)
1H-pyrazole-4-carboxylic acid, 5-amino-, methyl ester
5-Amino-1H-pyrazole-4-carboxylic acid methyl ester
Methyl 3-aminopyrazole-4-carboxylate
methyl 5-amino-1H-pyrazole-4-carboxylate
methyl-3-amino-2H-pyrazole-4-carboxylate
| 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) | -0.31 | 0.63 | -9.16 | 3 | 5 | 0 | 81 | 141.13 | 2 | ↓ |
| Ref Reference (pH 7) | -0.31 | 0.63 | -6.94 | 3 | 5 | 0 | 81 | 141.13 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | US4271071 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.