| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2006 | 17 | No |
Popular Name: 4-Ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazole-3-thiol 4-Ethyl-5-[(4-methylphenoxy)meth…
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CAS Numbers: 335215-56-0 , [335215-56-0]
4-Ethyl-5-((p-tolyloxy)methyl)-4H-1,2,4-triazole-3-thiol
4-ethyl-5-(4-methylphenoxymethyl)-4H-1,2,4-triazole-3-thiol
4-Ethyl-5-p-tolyloxymethyl-4H-[1,2,4]triazole-3-thiol
| 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) | 2.75 | 7.56 | -10.67 | 0 | 4 | 0 | 40 | 249.339 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.