| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2004 | 17 | Yes |
Popular Name: 1-Benzyl-3,5-dimethyl-1H-pyrazole-4-carboxylic acid 1-Benzyl-3,5-dimethyl-1H-pyrazol…
Find On: PubMed — Wikipedia — Google
CAS Number: 108444-25-3
| 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) | 1.93 | 7.65 | -49.74 | 0 | 4 | -1 | 58 | 229.259 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 137 - 139 | Enamine Building Blocks |
| MP | 137...139 | Enamine Building Blocks |
| MP | 152-154° | Matrix Scientific |
| mp | 85 - 87 | MolMall (formerly Molecular Diversity Preservation International) |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
