| General Property |
| Molceule ID (DB) | EGIN0001134 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 39 compound |
| IUPAC Name | N-[2-(2-fluorophenyl)ethyl]-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-9-amine |
| Formula | C17H18FN5 |
| Mass | 311.3567 |
| Exact Mass | 311.1546238 |
| Composition | C (65.58%), H (5.83%), F (6.1%), N (22.49%) |
| Atom Count | 41 |
| PI | No isoelectric point. |
| Smiles | c12c(nc3n(c1NCCc1c(cccc1)F)ncn3)CCCC2 |
| InChI | 1S/C17H18FN5/c18-14-7-3-1-5-12(14)9-10-19-16-13-6-2-4-8-15(13)22-17-20-11-21-23(16)17/h1,3,5,7,11,19
H,2,4,6,8-10H2 |
| InChIKey | OVMYZFQHYXIFAN-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 | 18500794 |
| 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 |
6484054
|
| Drug Bank Link | - |
| ChemSpider Link | 4984496 |
| ChEMBL Link | CHEMBL487936 |
