General Information of the Compound
| Compound ID |
CP0963126
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-{4-Methyl-5-[3-((E)-2-pyridin-2-yl-vinyl)-1H-indazol-6-yl]-thiazol-2-yl}-3-trifluoromethyl-benzamide
Show/Hide
|
||||||||||||||||||
| Formula |
C26H18F3N5OS
|
||||||||||||||||||
| Molecular Weight |
505.525
|
||||||||||||||||||
| Canonical SMILES |
Cc1nc(NC(=O)c2cccc(C(F)(F)F)c2)sc1-c1ccc2c(/C=C/c3ccccn3)n[nH]c2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H18F3N5OS/c1-15-23(36-25(31-15)32-24(35)17-5-4-6-18(13-17)26(27,28)29)16-8-10-20-21(33-34-22(20)14-16)11-9-19-7-2-3-12-30-19/h2-14H,1H3,(H,33,34)(H,31,32,35)/b11-9+
Show/Hide
|
||||||||||||||||||
| InChIKey |
FDDPVEVXTJKGHJ-PKNBQFBNSA-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 | |||||||||||||||||||
| 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