General Property |
Molceule ID (DB) | EGIN0002714 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 8s compound |
IUPAC Name | 4-N-{[4-(dimethylamino)phenyl]methyl}pyrido[4,3-d]pyrimidine-4,7-diamine |
Formula | C16H18N6 |
Mass | 294.3543 |
Exact Mass | 294.1592946 |
Composition | C (65.29%), H (6.16%), N (28.55%) |
Atom Count | 40 |
PI | 11.63 |
Smiles | c12c(ncnc1cc(nc2)N)NCc1ccc(N(C)C)cc1 |
InChI | 1S/C16H18N6/c1-22(2)12-5-3-11(4-6-12)8-19-16-13-9-18-15(17)7-14(13)20-10-21-16/h3-7,9-10H,8H2,1-2H3,
(H2,17,18)(H,19,20,21) |
InChIKey | GDHQNZFWQPKIKO-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 | 7562908 |
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 |
5328095
|
Drug Bank Link | - |
ChemSpider Link | 4485262 |
ChEMBL Link | CHEMBL121984 |