Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| November 9th, 2010 |
22 |
No
|
Popular Name:
5-nitro-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)imidazo[2,1-b]thiazol-6-amine
5-nitro-N-(5,6,7,8-tetrahydro-[1…
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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)
|
0.81 |
9.59 |
-16.45 |
1 |
9 |
0 |
106 |
319.35 |
4 |
↓
|
Rings
-
4H-1,2,4-triazole
-
Glyoxaline
-
Thiazole
-
2,3,4,5-tetrahydropyridine
-
Imidazo[2,1-b]thiazole
![Imidazo[2,1-b]thiazole](//zinc12.docking.org/img/rings/1467.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)
-
Imidazo[2,1-b]thiazol-6-yl(5,6,7…
![Imidazo[2,1-b]thiazol-6-yl(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)amine](//zinc12.docking.org/img/rings/226403.gif)
No pre-computed analogs available. Try a structural similarity search.
![Imidazo[2,1-b]thiazole](http://zinc12.docking.org/img/rings/1467.gif)
![5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine](http://zinc12.docking.org/img/rings/19566.gif)
![Imidazo[2,1-b]thiazol-6-yl(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)amine](http://zinc12.docking.org/img/rings/226403.gif)