| General Property |
| Molceule ID (DB) | EGIN0004587 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 1c |
| IUPAC Name | 4-N-(3-chloro-4-fluorophenyl)quinazoline-4,6-diamine |
| Formula | C14H10ClFN4 |
| Mass | 288.707 |
| Exact Mass | 288.0578023 |
| Composition | C (58.24%), H (3.49%), Cl (12.28%), F (6.58%), N (19.41%) |
| Atom Count | 30 |
| PI | 10.57 |
| Smiles | c1c(ccc2c1c(ncn2)Nc1cc(c(cc1)F)Cl)N |
| InChI | 1S/C14H10ClFN4/c15-11-6-9(2-3-12(11)16)20-14-10-5-8(17)1-4-13(10)18-7-19-14/h1-7H,17H2,(H,18,19,20) |
| InChIKey | HJAGRTPTIMMQPY-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 | 22309911 |
| 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 |
10880751
|
| Drug Bank Link | - |
| ChemSpider Link | 9056020 |
| ChEMBL Link | CHEMBL242541 |
