| General Property |
| Molceule ID (DB) | EGIN0000176 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | 15 compound |
| IUPAC Name | N-[2-(aminocarbamothioyl)-4-chlorophenyl]-4-methylbenzamide |
| Formula | C15H14ClN3OS |
| Mass | 319.809 |
| Exact Mass | 319.0546105 |
| Composition | C (56.33%), H (4.41%), Cl (11.09%), N (13.14%), O (5%), S (10.03%) |
| Atom Count | 35 |
| PI | 6.79 |
| Smiles | N(C(=S)c1c(NC(=O)c2ccc(cc2)C)ccc(c1)Cl)N |
| InChI | 1S/C15H14ClN3OS/c1-9-2-4-10(5-3-9)14(20)18-13-7-6-11(16)8-12(13)15(21)19-17/h2-8H,17H2,1H3,(H,18,20)
(H,19,21) |
| InChIKey | DWOJNXKZDCBGJF-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 | 20599299 |
| 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 | 26351424 |
| ChEMBL Link | CHEMBL1242172 |
