| General Property |
| Molceule ID (DB) | EGIN0002325 |
| Inhibitor Class | Triazene |
| Molecule Name in Refrence Article | 5 (ZRL2) |
| IUPAC Name | (6E)-4-N-(3-chlorophenyl)-6-N-({[(ethenyloxy)carbonyl](methyl)amino}imino)quinazoline-4,6-diamine |
| Formula | C18H15ClN6O2 |
| Mass | 382.804 |
| Exact Mass | 382.0945015 |
| Composition | C (56.48%), H (3.95%), Cl (9.26%), N (21.95%), O (8.36%) |
| Atom Count | 42 |
| PI | 9.03 |
| Smiles | c1(ccc2c(c1)c(ncn2)Nc1cc(ccc1)Cl)/N=N/N(C(=O)OC=C)C |
| InChI | 1S/C18H15ClN6O2/c1-3-27-18(26)25(2)24-23-14-7-8-16-15(10-14)17(21-11-20-16)22-13-6-4-5-12(19)9-13/h3
-11H,1H2,2H3,(H,20,21,22)/b24-23+ |
| InChIKey | USRZMUAJPCYUBP-WCWDXBQESA-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 | 19665377 |
| 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 | 24635179 |
| ChEMBL Link | CHEMBL572031 |
