General Property |
Molceule ID (DB) | EGIN0003687 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 9c compound |
IUPAC Name | 6-N,6-N-dimethyl-4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-diamine |
Formula | C16H17N5 |
Mass | 279.3397 |
Exact Mass | 279.1483956 |
Composition | C (68.79%), H (6.13%), N (25.07%) |
Atom Count | 38 |
PI | 10.28 |
Smiles | c12c(ncnc2cnc(c1)N(C)C)Nc1cc(ccc1)C |
InChI | 1S/C16H17N5/c1-11-5-4-6-12(7-11)20-16-13-8-15(21(2)3)17-9-14(13)18-10-19-16/h4-10H,1-3H3,(H,18,19,20
) |
InChIKey | SSOSNGLIBSWZMG-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0003687.png) | Structure Backbone | ![](./frame/f_EGIN0003687.png) |
|
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 | 9513602 |
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 |
-
|
Drug Bank Link | - |
ChemSpider Link | 4485542 |
ChEMBL Link | CHEMBL163188 |