General Property |
Molceule ID (DB) | EGIN0003781 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 57 compound |
IUPAC Name | ethyl 4-(4-{[6-(2,6-dichlorophenyl)-8-methyl-7-oxo-7H,8H-pyrido[2,3-d]pyrimidin-2-yl]amino}phenyl)butanoate |
Formula | C26H24Cl2N4O3 |
Mass | 511.4 |
Exact Mass | 510.1225461 |
Composition | C (61.06%), H (4.73%), Cl (13.87%), N (10.96%), O (9.39%) |
Atom Count | 59 |
PI | 7.39 |
Smiles | n1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)Nc1ccc(cc1)CCCC(=O)OCC)C |
InChI | 1S/C26H24Cl2N4O3/c1-3-35-22(33)9-4-6-16-10-12-18(13-11-16)30-26-29-15-17-14-19(25(34)32(2)24(17)31-2
6)23-20(27)7-5-8-21(23)28/h5,7-8,10-15H,3-4,6,9H2,1-2H3,(H,29,30,31) |
InChIKey | NXHGGDQABDGSFK-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 | 9703473 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | FGFr | c-Src | PDGFr | ALL |
Pub Chem Link |
5327903
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Drug Bank Link | - |
ChemSpider Link | 4485073 |
ChEMBL Link | CHEMBL419022 |