General Property |
Molceule ID (DB) | EGIN0003579 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 6a compound |
IUPAC Name | 3-tert-butyl-1-[6-(2,6-dichlorophenyl)-2-{[3-(diethylamino)propyl]amino}pyrido[2,3-d]pyrimidin-7-yl]urea |
Formula | C25H33Cl2N7O |
Mass | 518.482 |
Exact Mass | 517.2123641 |
Composition | C (57.91%), H (6.42%), Cl (13.68%), N (18.91%), O (3.09%) |
Atom Count | 68 |
PI | 10.7 |
Smiles | c1(c(c2c(Cl)cccc2Cl)cc2c(n1)nc(nc2)NCCCN(CC)CC)NC(=O)NC(C)(C)C |
InChI | 1S/C25H33Cl2N7O/c1-6-34(7-2)13-9-12-28-23-29-15-16-14-17(20-18(26)10-8-11-19(20)27)22(30-21(16)31-23
)32-24(35)33-25(3,4)5/h8,10-11,14-15H,6-7,9,12-13H2,1-5H3,(H3,28,29,30,31,32,33,35) |
InChIKey | ULIJLYCJYRQKBG-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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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 | 9240345 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | InsRT | PDGFr | c-Src | FGFr | ALL |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 4485282 |
ChEMBL Link | CHEMBL299026 |