General Information of the Compound
| Compound ID |
CP0459782
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[2-(5-cyano-3-hydroxypyridin-2-yl)-5-phenyl-1,3-thiazol-4-yl]-N-(2-pyridin-2-ylethyl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H19N5O2S
|
||||||||||||||||||
| Molecular Weight |
441.516
|
||||||||||||||||||
| Canonical SMILES |
Oc1cc(cnc1-c1nc(CC(=O)NCCc2ccccn2)c(s1)-c1ccccc1)C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H19N5O2S/c25-14-16-12-20(30)22(28-15-16)24-29-19(23(32-24)17-6-2-1-3-7-17)13-21(31)27-11-9-18-8-4-5-10-26-18/h1-8,10,12,15,30H,9,11,13H2,(H,27,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
AZNDVNFEFCMGHP-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