General Information of the Compound
| Compound ID |
CP0439905
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(3-methylphenyl)methyl]-4-(6-methylpyridin-2-yl)-5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1,3-thiazol-2-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H20N6S
|
||||||||||||||||||
| Molecular Weight |
412.522
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(CNc2nc(c(s2)-c2ccc3ncnn3c2)-c2cccc(C)n2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H20N6S/c1-15-5-3-7-17(11-15)12-24-23-28-21(19-8-4-6-16(2)27-19)22(30-23)18-9-10-20-25-14-26-29(20)13-18/h3-11,13-14H,12H2,1-2H3,(H,24,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DSKSACIENVKOMV-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