| General Property |
| Molceule ID (DB) | EGIN0001288 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 1 compound |
| IUPAC Name | 4-amino-6-{[4-(benzyloxy)-3-chlorophenyl]amino}pyrimidine-5-carbaldehyde |
| Formula | C18H15ClN4O2 |
| Mass | 354.79 |
| Exact Mass | 354.0883535 |
| Composition | C (60.94%), H (4.26%), Cl (9.99%), N (15.79%), O (9.02%) |
| Atom Count | 40 |
| PI | 10.05 |
| Smiles | c1c(cccc1)COc1ccc(cc1Cl)Nc1c(c(ncn1)N)C=O |
| InChI | 1S/C18H15ClN4O2/c19-15-8-13(23-18-14(9-24)17(20)21-11-22-18)6-7-16(15)25-10-12-4-2-1-3-5-12/h1-9,11H
,10H2,(H3,20,21,22,23) |
| InChIKey | ZHAHSGZKQQBJOB-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 | VEGF-R2 | ALL |
| Pub Chem Link |
24777233
|
| Drug Bank Link | - |
| ChemSpider Link | 23331343 |
| ChEMBL Link | CHEMBL461311 |
