| General Property |
| Molceule ID (DB) | EGIN0004300 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 18 compound |
| IUPAC Name | 7-[(4-{[(4-fluorophenyl)methyl]amino}-7-methoxyquinazolin-6-yl)oxy]-N-hydroxyheptanamide |
| Formula | C23H27FN4O4 |
| Mass | 442.4833 |
| Exact Mass | 442.2016336 |
| Composition | C (62.43%), H (6.15%), F (4.29%), N (12.66%), O (14.46%) |
| Atom Count | 59 |
| PI | 7.14 |
| Smiles | c1(c(cc2c(c1)c(ncn2)NCc1ccc(cc1)F)OC)OCCCCCCC(=O)NO |
| InChI | 1S/C23H27FN4O4/c1-31-20-13-19-18(12-21(20)32-11-5-3-2-4-6-22(29)28-30)23(27-15-26-19)25-14-16-7-9-17
(24)10-8-16/h7-10,12-13,15,30H,2-6,11,14H2,1H3,(H,28,29)(H,25,26,27) |
| InChIKey | CNAYRPIRUOIQNH-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 | 24648923 |
| ChEMBL Link | CHEMBL596964 |
