| General Property |
| Molceule ID (DB) | EGIN0001294 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 8d compound |
| IUPAC Name | 4-amino-6-{[4-(benzyloxy)-3-chlorophenyl]amino}-N-[2-(morpholin-4-yl)ethyl]pyrimidine-5-carboxamide |
| Formula | C24H27ClN6O3 |
| Mass | 482.963 |
| Exact Mass | 482.1833165 |
| Composition | C (59.69%), H (5.63%), Cl (7.34%), N (17.4%), O (9.94%) |
| Atom Count | 61 |
| PI | 9.64 |
| Smiles | c1(ncnc(c1C(=O)NCCN1CCOCC1)N)Nc1ccc(c(c1)Cl)OCc1ccccc1 |
| InChI | 1S/C24H27ClN6O3/c25-19-14-18(6-7-20(19)34-15-17-4-2-1-3-5-17)30-23-21(22(26)28-16-29-23)24(32)27-8-9
-31-10-12-33-13-11-31/h1-7,14,16H,8-13,15H2,(H,27,32)(H3,26,28,29,30) |
| InChIKey | OUKDWNYVCNEMPJ-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 | 18678484 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Aurora A | CDK1 | VEGFR2 | ALL |
| Pub Chem Link |
25271515
|
| Drug Bank Link | - |
| ChemSpider Link | 23331432 |
| ChEMBL Link | CHEMBL518646 |
