| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 14 | No |
Popular Name: 4-Ethyl-5-pyridin-3-yl-4H-[1,2,4]triazole-3-thiol 4-Ethyl-5-pyridin-3-yl-4H-[1,2,4…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 26131-68-0 , [26131-68-0]
4-ethyl-5-(pyridin-3-yl)-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) | 1.59 | 5.78 | -46.67 | 0 | 4 | -1 | 44 | 205.266 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.87 | 5.69 | -12 | 1 | 4 | 0 | 47 | 206.274 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 88° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
