| General Property |
| Molceule ID (DB) | EGIN0003685 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 9a compound |
| IUPAC Name | 4-N-(3-methylphenyl)pyrido[3,4-d]pyrimidine-4,6-diamine |
| Formula | C14H13N5 |
| Mass | 251.2865 |
| Exact Mass | 251.1170954 |
| Composition | C (66.92%), H (5.21%), N (27.87%) |
| Atom Count | 32 |
| PI | 10.3 |
| Smiles | c1(c2c(ncn1)cnc(c2)N)Nc1cc(ccc1)C |
| InChI | 1S/C14H13N5/c1-9-3-2-4-10(5-9)19-14-11-6-13(15)16-7-12(11)17-8-18-14/h2-8H,1H3,(H2,15,16)(H,17,18,19
) |
| InChIKey | VNRZOOJIGRYVTF-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 | 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 | 4485540 |
| ChEMBL Link | CHEMBL165495 |
