| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2009 | 9 | Yes |
Popular Name: 4-Amino-1H-pyrazole-3-carboxylic acid 4-Amino-1H-pyrazole-3-carboxylic…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 116008-52-7 , 1431962-52-5 , N/A , [116008-52-7]
1H-Pyrazole-3-carboxylic acid, 4-amino- (9CI)
1H-Pyrazole-3-carboxylicacid,4-amino-
1H-pyrazole-5-carboxylic acid, 4-amino-
4-Amino-1H-pyrazole-3-carboxylic acid hydrochloride
| 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) | -0.46 | -0.46 | -43.23 | 3 | 5 | -1 | 95 | 126.095 | 1 | ↓ |
| Ref Reference (pH 7) | -0.46 | -0.44 | -51.6 | 3 | 5 | -1 | 95 | 126.095 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0023707A1; EP0064775A1; EP0742717A1; US4317823; US5654307; US6084095 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.