| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 16 | Yes |
Popular Name: 5-hydroxy-1-(4-methylphenyl)-1H-pyrazole-3-carboxylic acid 5-hydroxy-1-(4-methylphenyl)-1H-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1211627-27-8 , [64123-68-8]
| 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) | 1.82 | 3.67 | -53.32 | 1 | 5 | -1 | 78 | 217.204 | 2 | ↓ |
| Ref Reference (pH 7) | 1.37 | 5.61 | -40.69 | 1 | 5 | -1 | 78 | 217.204 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.83 | 3.39 | -117.88 | 0 | 5 | -2 | 81 | 216.196 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 259 - 261 | Enamine Building Blocks |
| MP | 259...261 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
