| General Property |
| Molceule ID (DB) | EGIN0002324 |
| Inhibitor Class | Triazene |
| Molecule Name in Refrence Article | 4 (ZRL1) |
| IUPAC Name | (6E)-4-N-(3-chlorophenyl)-6-N-({[2-(dimethylamino)ethyl][(ethenyloxy)carbonyl]amino}imino)quinazoline-4,6-diamine |
| Formula | C21H22ClN7O2 |
| Mass | 439.898 |
| Exact Mass | 439.1523507 |
| Composition | C (57.34%), H (5.04%), Cl (8.06%), N (22.29%), O (7.27%) |
| Atom Count | 53 |
| PI | 11.69 |
| Smiles | c1(ccc2c(c1)c(ncn2)Nc1cc(ccc1)Cl)/N=N/N(C(=O)OC=C)CCN(C)C |
| InChI | 1S/C21H22ClN7O2/c1-4-31-21(30)29(11-10-28(2)3)27-26-17-8-9-19-18(13-17)20(24-14-23-19)25-16-7-5-6-15
(22)12-16/h4-9,12-14H,1,10-11H2,2-3H3,(H,23,24,25)/b27-26+ |
| InChIKey | FCGLNNGWOXPGOR-CYYJNZCTSA-N |
| 2D Structure |  | Structure Backbone |  |
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| 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 | 24634034 |
| ChEMBL Link | CHEMBL572030 |
