General Information of the Compound
| Compound ID |
CP0427572
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[[[4-(6-methylpyridin-2-yl)-5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1,3-thiazol-2-yl]amino]methyl]benzonitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H17N7S
|
||||||||||||||||||
| Molecular Weight |
423.505
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(n1)-c1nc(NCc2cccc(c2)C#N)sc1-c1ccc2ncnn2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H17N7S/c1-15-4-2-7-19(28-15)21-22(18-8-9-20-26-14-27-30(20)13-18)31-23(29-21)25-12-17-6-3-5-16(10-17)11-24/h2-10,13-14H,12H2,1H3,(H,25,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CBDNDJPIMQLOAF-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound