| General Property |
| Molceule ID (DB) | EGIN0002603 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 35 compound |
| IUPAC Name | 3-[6-(2,6-dichlorophenyl)-2-{[4-(diethylamino)butyl]amino}pyrido[2,3-d]pyrimidin-7-yl]-1-phenylurea |
| Formula | C28H31Cl2N7O |
| Mass | 552.498 |
| Exact Mass | 551.1967141 |
| Composition | C (60.87%), H (5.66%), Cl (12.83%), N (17.75%), O (2.9%) |
| Atom Count | 69 |
| PI | 10.47 |
| Smiles | c1(c(c2c(Cl)cccc2Cl)cc2c(n1)nc(nc2)NCCCCN(CC)CC)NC(=O)Nc1ccccc1 |
| InChI | 1S/C28H31Cl2N7O/c1-3-37(4-2)16-9-8-15-31-27-32-18-19-17-21(24-22(29)13-10-14-23(24)30)26(34-25(19)35
-27)36-28(38)33-20-11-6-5-7-12-20/h5-7,10-14,17-18H,3-4,8-9,15-16H2,1-2H3,(H3,31,32,33,34,35,36,38) |
| InChIKey | LYJIVFCOOJRVBF-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 | 11384237 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | CDK4 | IR | PKC | FGFr | PDGFr | MEK/ERK | c-Src | ALL |
| Pub Chem Link |
5328137
|
| Drug Bank Link | - |
| ChemSpider Link | 4485304 |
| ChEMBL Link | CHEMBL56983 |
