General Property |
Molceule ID (DB) | EGIN0003767 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 41 compound |
IUPAC Name | 6-(2,6-dichlorophenyl)-2-[(6-methoxypyridin-3-yl)amino]-8-methyl-7H,8H-pyrido[2,3-d]pyrimidin-7-one |
Formula | C20H15Cl2N5O2 |
Mass | 428.271 |
Exact Mass | 427.0602802 |
Composition | C (56.09%), H (3.53%), Cl (16.56%), N (16.35%), O (7.47%) |
Atom Count | 44 |
PI | 7.55 |
Smiles | n1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)Nc1cnc(cc1)OC)C |
InChI | 1S/C20H15Cl2N5O2/c1-27-18-11(8-13(19(27)28)17-14(21)4-3-5-15(17)22)9-24-20(26-18)25-12-6-7-16(29-2)2
3-10-12/h3-10H,1-2H3,(H,24,25,26) |
InChIKey | NBPINIBREWXSRV-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 | FGFr | c-Src | ALL |
Pub Chem Link |
5327888
|
Drug Bank Link | - |
ChemSpider Link | 4485058 |
ChEMBL Link | CHEMBL111365 |