| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 17 | Yes |
Popular Name: (1-cyclopropylethyl)(1-{[1,2,4]triazolo[4,3-a]pyridin-3-yl}ethyl)amine dihydrochloride (1-cyclopropylethyl)(1-{[1,2,4]t…
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CAS Numbers: 1156208-28-4 , 1258650-23-5
| 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) | 2.19 | 7.9 | -41.19 | 2 | 4 | 1 | 47 | 231.323 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 6.87 | -12.68 | 1 | 4 | 0 | 42 | 230.315 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
![[1,2,4]triazolo[4,3-a]pyridine](http://zinc12.docking.org/img/rings/2142.gif)
![Cyclopropylmethyl([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)amine](http://zinc12.docking.org/img/rings/125558.gif)