| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 14 | Yes |
Popular Name: 4-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid 4-chloro-1-methyl-3-(trifluorome…
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CAS Number: 128694-71-3
4-Chloro-2-methyl-5-trifluoromethyl-2 H -pyrazole-
4-Chloro-2-methyl-5-trifluoromethyl-2 H -pyrazole-3-carboxylic acid
4-Chloro-2-methyl-5-trifluoromethyl-2H-pyrazole-3-carboxylic acid
| 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) | 1.94 | 3.37 | -36.25 | 0 | 4 | -1 | 58 | 227.549 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.