General Information of the Compound
| Compound ID |
CP0036857
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[(2-amino-6-methylpyridin-3-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C13H17N3O2S
|
||||||||||||||||||
| Molecular Weight |
279.365
|
||||||||||||||||||
| Canonical SMILES |
Cc1c(CCO)sc(=O)n1Cc1ccc(C)nc1N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C13H17N3O2S/c1-8-3-4-10(12(14)15-8)7-16-9(2)11(5-6-17)19-13(16)18/h3-4,17H,5-7H2,1-2H3,(H2,14,15)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RWODGYBNOPNGQQ-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