| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 14 | No |
Popular Name: 4-ethyl-5-(piperidin-4-yl)-4H-1,2,4-triazole-3-thiol hydrochloride 4-ethyl-5-(piperidin-4-yl)-4H-1,…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1158560-78-1 , 1158708-56-5
| 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) | -0.27 | 5.64 | -63.11 | 3 | 4 | 1 | 50 | 213.33 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.46 | 5.47 | -77.68 | 2 | 4 | 0 | 47 | 212.322 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 317 - 319 | Enamine Building Blocks |
| MP | 317...319 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
