General Property |
Molceule ID (DB) | EGIN0003762 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 36 compound |
IUPAC Name | 6-(2,6-dichlorophenyl)-8-methyl-2-{[2-(pyridin-2-yl)ethyl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one |
Formula | C21H17Cl2N5O |
Mass | 426.299 |
Exact Mass | 425.0810156 |
Composition | C (59.17%), H (4.02%), Cl (16.63%), N (16.43%), O (3.75%) |
Atom Count | 46 |
PI | 10.45 |
Smiles | n1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)NCCc1ncccc1)C |
InChI | 1S/C21H17Cl2N5O/c1-28-19-13(11-15(20(28)29)18-16(22)6-4-7-17(18)23)12-26-21(27-19)25-10-8-14-5-2-3-9
-24-14/h2-7,9,11-12H,8,10H2,1H3,(H,25,26,27) |
InChIKey | NRYIWRROVMCMDV-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 | c-Src | FGFr | PDGFr | ALL |
Pub Chem Link |
5327883
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Drug Bank Link | - |
ChemSpider Link | 4485053 |
ChEMBL Link | CHEMBL323699 |