| General Property |
| Molceule ID (DB) | EGIN0004285 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 3 compound |
| IUPAC Name | 5-({4-[(3-chloro-4-fluorophenyl)amino]-7-methoxyquinazolin-6-yl}oxy)-N-hydroxypentanamide |
| Formula | C20H20ClFN4O4 |
| Mass | 434.849 |
| Exact Mass | 434.1157111 |
| Composition | C (55.24%), H (4.64%), Cl (8.15%), F (4.37%), N (12.88%), O (14.72%) |
| Atom Count | 50 |
| PI | 6.75 |
| Smiles | c1(c(cc2c(c1)c(ncn2)Nc1cc(c(cc1)F)Cl)OC)OCCCCC(=O)NO |
| InChI | 1S/C20H20ClFN4O4/c1-29-17-10-16-13(9-18(17)30-7-3-2-4-19(27)26-28)20(24-11-23-16)25-12-5-6-15(22)14(
21)8-12/h5-6,8-11,28H,2-4,7H2,1H3,(H,26,27)(H,23,24,25) |
| InChIKey | UCSIYDCODBRGKW-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 | 20143778 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | HDAC | |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 24647148 |
| ChEMBL Link | CHEMBL596736 |
