Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| December 30th, 2008 |
25 |
Yes
|
Popular Name:
(3-isopentyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl)-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,5-
(3-isopentyl-1,4,6,7-tetrahydrop…
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Physical Representations
|
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)
|
1.75 |
8.9 |
-12.89 |
1 |
7 |
0 |
80 |
342.447 |
4 |
↓
|
Rings
-
4H-1,2,4-triazole
-
1H-pyrazole
-
1,2,3,6-tetrahydropyridine
-
2,3,4,5-tetrahydropyridine
-
4,5,6,7-tetrahydro-1H-pyrazolo[4…
![4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine](//zinc12.docking.org/img/rings/22531.gif)
-
5,6,7,8-tetrahydro-[1,2,4]triazo…
![5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine](//zinc12.docking.org/img/rings/19566.gif)
-
1,4,6,7-tetrahydropyrazolo[4,3-c…
![1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone](//zinc12.docking.org/img/rings/140885.gif)
No pre-computed analogs available. Try a structural similarity search.
![4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine](http://zinc12.docking.org/img/rings/22531.gif)
![5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine](http://zinc12.docking.org/img/rings/19566.gif)
![1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanone](http://zinc12.docking.org/img/rings/140885.gif)