| General Property |
| Molceule ID (DB) | EGIN0004288 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 6 compound |
| IUPAC Name | 6-({4-[(3-ethynylphenyl)amino]-7-methoxyquinazolin-6-yl}oxy)-N-hydroxyhexanamide |
| Formula | C23H24N4O4 |
| Mass | 420.4611 |
| Exact Mass | 420.1797553 |
| Composition | C (65.7%), H (5.75%), N (13.33%), O (15.22%) |
| Atom Count | 55 |
| PI | 6.74 |
| Smiles | c1(c(cc2c(c1)c(ncn2)Nc1cc(ccc1)C#C)OC)OCCCCCC(=O)NO |
| InChI | 1S/C23H24N4O4/c1-3-16-8-7-9-17(12-16)26-23-18-13-21(20(30-2)14-19(18)24-15-25-23)31-11-6-4-5-10-22(2
8)27-29/h1,7-9,12-15,29H,4-6,10-11H2,2H3,(H,27,28)(H,24,25,26) |
| InChIKey | XFDYLGGJRSOHKI-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 | 24650794 |
| ChEMBL Link | CHEMBL598164 |
