| General Property |
| Molceule ID (DB) | EGIN0004293 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 11 compound |
| IUPAC Name | 7-({4-[(3-chloro-4-fluorophenyl)amino]quinazolin-6-yl}oxy)-N-hydroxyheptanamide |
| Formula | C21H22ClFN4O3 |
| Mass | 432.876 |
| Exact Mass | 432.1364465 |
| Composition | C (58.27%), H (5.12%), Cl (8.19%), F (4.39%), N (12.94%), O (11.09%) |
| Atom Count | 52 |
| PI | 6.49 |
| Smiles | c1(ccc2c(c1)c(ncn2)Nc1cc(c(cc1)F)Cl)OCCCCCCC(=O)NO |
| InChI | 1S/C21H22ClFN4O3/c22-17-11-14(6-8-18(17)23)26-21-16-12-15(7-9-19(16)24-13-25-21)30-10-4-2-1-3-5-20(2
8)27-29/h6-9,11-13,29H,1-5,10H2,(H,27,28)(H,24,25,26) |
| InChIKey | DGORACVWOLFYBN-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 |
-
|
| Drug Bank Link | - |
| ChemSpider Link | 24653428 |
| ChEMBL Link | CHEMBL604094 |
