General Property |
Molceule ID (DB) | EGIN0003779 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 54 compound |
IUPAC Name | 6-(2,6-dichlorophenyl)-2-[(3,5-dimethoxyphenyl)amino]-8-methyl-7H,8H-pyrido[2,3-d]pyrimidin-7-one |
Formula | C22H18Cl2N4O3 |
Mass | 457.309 |
Exact Mass | 456.0755959 |
Composition | C (57.78%), H (3.97%), Cl (15.51%), N (12.25%), O (10.5%) |
Atom Count | 49 |
PI | 6.96 |
Smiles | n1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)Nc1cc(cc(c1)OC)OC)C |
InChI | 1S/C22H18Cl2N4O3/c1-28-20-12(7-16(21(28)29)19-17(23)5-4-6-18(19)24)11-25-22(27-20)26-13-8-14(30-2)10
-15(9-13)31-3/h4-11H,1-3H3,(H,25,26,27) |
InChIKey | RYCIKEDAOOTILW-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 | PDGFr | c-Src | FGFr | ALL |
Pub Chem Link |
5327900
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Drug Bank Link | - |
ChemSpider Link | 4485070 |
ChEMBL Link | CHEMBL324926 |