General Information of the Compound
| Compound ID |
CP0467783
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-cyano-2-(1-{2- [(cyclopropylmethyl)(methyl)- amino]ethyl}-1H-imidazol-4- yl)pyridine-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H20N6O
|
||||||||||||||||||
| Molecular Weight |
324.388
|
||||||||||||||||||
| Canonical SMILES |
CN(CCn1cnc(c1)-c1cc(ccn1)C(=O)NC#N)CC1CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H20N6O/c1-22(9-13-2-3-13)6-7-23-10-16(21-12-23)15-8-14(4-5-19-15)17(24)20-11-18/h4-5,8,10,12-13H,2-3,6-7,9H2,1H3,(H,20,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
YLAZXWUGKKWCID-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
Protein ID: PT03776, Lysine-specific demethylase 2B
Protein ID: PT02979, Lysine-specific demethylase 4C
Protein ID: PT02613, Lysine-specific demethylase 5A
Protein ID: PT03382, Lysine-specific demethylase 5B