| General Property |
| Molceule ID (DB) | EGIN0003975 |
| Inhibitor Class | Quinazoline |
| Molecule Name in Refrence Article | KN1022 |
| IUPAC Name | 4-(6,7-dimethoxyquinazolin-4-yl)-N-(4-nitrophenyl)piperazine-1-carboxamide |
| Formula | C21H22N6O5 |
| Mass | 438.4366 |
| Exact Mass | 438.1651678 |
| Composition | C (57.53%), H (5.06%), N (19.17%), O (18.25%) |
| Atom Count | 54 |
| PI | 8.96 |
| Smiles | c12c(N3CCN(C(=O)Nc4ccc([N+](=O)[O-])cc4)CC3)ncnc1cc(c(c2)OC)OC |
| InChI | 1S/C21H22N6O5/c1-31-18-11-16-17(12-19(18)32-2)22-13-23-20(16)25-7-9-26(10-8-25)21(28)24-14-3-5-15(6-
4-14)27(29)30/h3-6,11-13H,7-10H2,1-2H3,(H,24,28) |
| InChIKey | ZIFCMJKHIXABHJ-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 | 12086491 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | FGFR | CSF1R | ERK2 | Jnk1 | Mek1 | Mkk3 | Mkk6 | p38 | PKA | PKC | Src | beta PDGFR | Flt3 | c-Kit | alpah-PDGFR | ALL |
| Pub Chem Link |
9911005
|
| Drug Bank Link | - |
| ChemSpider Link | 8086656 |
| ChEMBL Link | CHEMBL99743 |
