General Information of the Compound
| Compound ID |
CP0476353
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[[3-(6-methylpyridin-2-yl)-4-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyrazole-1-carbothioyl]amino]benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H20N8OS
|
||||||||||||||||||
| Molecular Weight |
468.546
|
||||||||||||||||||
| Canonical SMILES |
Cc1nc2ccc(cn2n1)-c1cn(nc1-c1cccc(C)n1)C(=S)Nc1cccc(c1)C(N)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H20N8OS/c1-14-5-3-8-20(26-14)22-19(17-9-10-21-27-15(2)29-31(21)12-17)13-32(30-22)24(34)28-18-7-4-6-16(11-18)23(25)33/h3-13H,1-2H3,(H2,25,33)(H,28,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CESLKFXFGDURME-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