| General Property |
| Molceule ID (DB) | EGIN0002518 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 8a compound |
| IUPAC Name | 5-[4-({3-chloro-4-[(3-fluorophenyl)methoxy]phenyl}amino)quinazolin-6-yl]-N-hydroxyfuran-2-carboxamide |
| Formula | C26H18ClFN4O4 |
| Mass | 504.897 |
| Exact Mass | 504.100061 |
| Composition | C (61.85%), H (3.59%), Cl (7.02%), F (3.76%), N (11.1%), O (12.68%) |
| Atom Count | 54 |
| PI | 6.27 |
| Smiles | c1(ccc2c(c1)c(ncn2)Nc1cc(c(cc1)OCc1cc(ccc1)F)Cl)c1ccc(o1)C(=O)NO |
| InChI | 1S/C26H18ClFN4O4/c27-20-12-18(5-7-23(20)35-13-15-2-1-3-17(28)10-15)31-25-19-11-16(4-6-21(19)29-14-30
-25)22-8-9-24(36-22)26(33)32-34/h1-12,14,34H,13H2,(H,32,33)(H,29,30,31) |
| InChIKey | ZMYUKKKHJVNBAM-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 | 21080629 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | PDGFR beta | InsR | Abl1 | PlK1 | CDK2 | PKA | ALL |
| Pub Chem Link |
49855952
|
| Drug Bank Link | - |
| ChemSpider Link | 26376972 |
| ChEMBL Link | CHEMBL1630117 |
