| General Property |
| Molceule ID (DB) | EGIN0001561 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 1 compound |
| IUPAC Name | N-[3,5-bis(trifluoromethyl)phenyl]quinazolin-4-amine |
| Formula | C16H9F6N3 |
| Mass | 357.2532 |
| Exact Mass | 357.0700665 |
| Composition | C (53.79%), H (2.54%), F (31.91%), N (11.76%) |
| Atom Count | 34 |
| PI | 9.6 |
| Smiles | c12c(cccc1)ncnc2Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F |
| InChI | 1S/C16H9F6N3/c17-15(18,19)9-5-10(16(20,21)22)7-11(6-9)25-14-12-3-1-2-4-13(12)23-8-24-14/h1-8H,(H,23,
24,25) |
| InChIKey | PLDKLHMHFREGNY-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 | 18702009 |
| 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 |
11451154
|
| Drug Bank Link | - |
| ChemSpider Link | 9626006 |
| ChEMBL Link | - |
