| General Property |
| Molceule ID (DB) | EGIN0002699 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 8d compound |
| IUPAC Name | 4-N-[(4-nitrophenyl)methyl]pyrido[4,3-d]pyrimidine-4,7-diamine |
| Formula | C14H12N6O2 |
| Mass | 296.2841 |
| Exact Mass | 296.1021737 |
| Composition | C (56.75%), H (4.08%), N (28.36%), O (10.8%) |
| Atom Count | 34 |
| PI | 11.62 |
| Smiles | [N+](=O)(c1ccc(CNc2c3c(cc(nc3)N)ncn2)cc1)[O-] |
| InChI | 1S/C14H12N6O2/c15-13-5-12-11(7-16-13)14(19-8-18-12)17-6-9-1-3-10(4-2-9)20(21)22/h1-5,7-8H,6H2,(H2,15
,16)(H,17,18,19) |
| InChIKey | WHFXKHSZKZPINP-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 |
5328080
|
| Drug Bank Link | - |
| ChemSpider Link | 4485247 |
| ChEMBL Link | CHEMBL126097 |
