General Information of the Compound
| Compound ID |
CP0565121
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[5-(2-methoxyquinolin-3-yl)-1H-imidazol-2-yl]methyl]-1-methylazetidine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C19H21N5O2
|
||||||||||||||||||
| Molecular Weight |
351.41
|
||||||||||||||||||
| Canonical SMILES |
COc1nc2ccccc2cc1-c1cnc(CNC(=O)C2CN(C)C2)[nH]1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H21N5O2/c1-24-10-13(11-24)18(25)21-9-17-20-8-16(22-17)14-7-12-5-3-4-6-15(12)23-19(14)26-2/h3-8,13H,9-11H2,1-2H3,(H,20,22)(H,21,25)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PLPJAVVYFQLJMH-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 | |||||||||||||||||||
| 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
Protein ID: PT00991, Histone deacetylase 1
Protein ID: PT00835, Histone deacetylase 2
Protein ID: PT00995, Histone deacetylase 3