| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2008 | 14 | Yes |
Popular Name: 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethanamine 2-(3-pyridin-4-yl-1H-1,2,4-triaz…
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CAS Number: 933716-01-9
2-(3-(Pyridin-4-yl)-1H-1,2,4-triazol-5-yl)ethanamine
2-(5-(Pyridin-4-yl)-4H-1,2,4-triazol-3-yl)ethanamine
{2-[3-(4-pyridinyl)-1H-1,2,4-triazol-5-yl]ethyl}amine dihydrochloride
| 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) | -0.69 | 1.38 | -50.12 | 4 | 5 | 1 | 82 | 190.23 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.69 | 1.24 | -56.38 | 3 | 5 | 0 | 80 | 189.222 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
