General Property |
Molceule ID (DB) | EGIN0001012 |
Inhibitor Class | Pyrrolo-pyrimidine |
Molecule Name in Refrence Article | 46 compound |
IUPAC Name | N-cyclohexyl-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
Formula | C14H20N4 |
Mass | 244.3354 |
Exact Mass | 244.1687967 |
Composition | C (68.82%), H (8.25%), N (22.93%) |
Atom Count | 38 |
PI | 10.93 |
Smiles | n1cnc2c(c1NC1CCCCC1)c(c([nH]2)C)C |
InChI | 1S/C14H20N4/c1-9-10(2)17-13-12(9)14(16-8-15-13)18-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3,(H2,15,16,17,18
) |
InChIKey | MNMIACDKHXNMKX-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 8691423 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
10538285
|
Drug Bank Link | - |
ChemSpider Link | 8713676 |
ChEMBL Link | CHEMBL419635 |