| General Property |
| Molceule ID (DB) | EGIN0002677 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 7i compound |
| IUPAC Name | 4-N-[3-(trifluoromethyl)phenyl]pyrido[4,3-d]pyrimidine-4,7-diamine |
| Formula | C14H10F3N5 |
| Mass | 305.2579 |
| Exact Mass | 305.08883 |
| Composition | C (55.08%), H (3.3%), F (18.67%), N (22.94%) |
| Atom Count | 32 |
| PI | 10.12 |
| Smiles | c1(c2c(cc(nc2)N)ncn1)Nc1cc(C(F)(F)F)ccc1 |
| InChI | 1S/C14H10F3N5/c15-14(16,17)8-2-1-3-9(4-8)22-13-10-6-19-12(18)5-11(10)20-7-21-13/h1-7H,(H2,18,19)(H,2
0,21,22) |
| InChIKey | UCCQIOAGMXPOET-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 |
5328058
|
| Drug Bank Link | - |
| ChemSpider Link | 4485225 |
| ChEMBL Link | CHEMBL125810 |
