| General Property |
| Molceule ID (DB) | EGIN0000202 |
| Inhibitor Class | Diphenyl-amine |
| Molecule Name in Refrence Article | 18 compound |
| IUPAC Name | 4-amino-5-(2-{[4-(4-amino-5-sulfanyl-4H-1,2,4-triazol-3-yl)phenyl]amino}phenyl)-4H-1,2,4-triazole-3-thiol |
| Formula | C16H15N9S2 |
| Mass | 397.481 |
| Exact Mass | 397.0891829 |
| Composition | C (48.35%), H (3.8%), N (31.71%), S (16.13%) |
| Atom Count | 42 |
| PI | 4.65 |
| Smiles | c1c(c(ccc1)c1nnc(n1N)S)Nc1ccc(cc1)c1nnc(n1N)S |
| InChI | 1S/C16H15N9S2/c17-24-13(20-22-15(24)26)9-5-7-10(8-6-9)19-12-4-2-1-3-11(12)14-21-23-16(27)25(14)18/h1
-8,19H,17-18H2,(H,22,26)(H,23,27) |
| InChIKey | WPIOWAHTYKKARX-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 | 20580136 |
| 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 | 26352385 |
| ChEMBL Link | CHEMBL1242902 |
