| General Property |
| Molceule ID (DB) | EGIN0000575 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 3b compound |
| IUPAC Name | 4-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide |
| Formula | C19H16ClN5O4S2 |
| Mass | 477.944 |
| Exact Mass | 477.0332231 |
| Composition | C (47.75%), H (3.37%), Cl (7.42%), N (14.65%), O (13.39%), S (13.42%) |
| Atom Count | 47 |
| PI | 3.8 |
| Smiles | c12c(cc(c(c1)OC)OC)nc(nc2Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)Cl |
| InChI | 1S/C19H16ClN5O4S2/c1-28-15-9-13-14(10-16(15)29-2)23-18(20)24-17(13)22-11-3-5-12(6-4-11)31(26,27)25-1
9-21-7-8-30-19/h3-10H,1-2H3,(H,21,25)(H,22,23,24) |
| InChIKey | HACJZPRDPDFNEL-UHFFFAOYSA-N |
| 2D Structure |  | Structure Backbone |  |
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| 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 | 18678492 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 20513894 |
| ChEMBL Link | CHEMBL525527 |
