General Property |
Molceule ID (DB) | EGIN0003775 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 49 compound |
IUPAC Name | 6-(2,6-dichlorophenyl)-2-[(4-methoxyphenyl)amino]-8-methyl-7H,8H-pyrido[2,3-d]pyrimidin-7-one |
Formula | C21H16Cl2N4O2 |
Mass | 427.283 |
Exact Mass | 426.0650312 |
Composition | C (59.03%), H (3.77%), Cl (16.59%), N (13.11%), O (7.49%) |
Atom Count | 45 |
PI | 7.63 |
Smiles | n1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)Nc1ccc(cc1)OC)C |
InChI | 1S/C21H16Cl2N4O2/c1-27-19-12(10-15(20(27)28)18-16(22)4-3-5-17(18)23)11-24-21(26-19)25-13-6-8-14(29-2
)9-7-13/h3-11H,1-2H3,(H,24,25,26) |
InChIKey | ZDVPZVBAWYNOOH-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
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 |
5327896
|
Drug Bank Link | - |
ChemSpider Link | 4485066 |
ChEMBL Link | CHEMBL104153 |