| General Property |
| Molceule ID (DB) | EGIN0002329 |
| Inhibitor Class | Triazene |
| Molecule Name in Refrence Article | 10 (ZRL5) |
| IUPAC Name | (N'E)-N'-({4-[(3-chlorophenyl)amino]quinazolin-6-yl}imino)-N-methyl-1-4-nitrophenoxyformohydrazide |
| Formula | C22H16ClN7O4 |
| Mass | 477.86 |
| Exact Mass | 477.0952297 |
| Composition | C (55.3%), H (3.37%), Cl (7.42%), N (20.52%), O (13.39%) |
| Atom Count | 50 |
| PI | 9.03 |
| Smiles | c1(ccc2c(c1)c(ncn2)Nc1cc(ccc1)Cl)/N=N/N(C(=O)Oc1ccc(cc1)[N+](=O)[O-])C |
| InChI | 1S/C22H16ClN7O4/c1-29(22(31)34-18-8-6-17(7-9-18)30(32)33)28-27-16-5-10-20-19(12-16)21(25-13-24-20)26
-15-4-2-3-14(23)11-15/h2-13H,1H3,(H,24,25,26)/b28-27+ |
| InChIKey | VELJECLRZJJJQW-BYYHNAKLSA-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 |
23265636
|
| Drug Bank Link | - |
| ChemSpider Link | 24633273 |
| ChEMBL Link | CHEMBL570709 |
