General Property |
Molceule ID (DB) | EGIN0003768 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 42 compound |
IUPAC Name | 6-(2,6-dichlorophenyl)-8-methyl-2-[(pyridin-4-yl)amino]-7H,8H-pyrido[2,3-d]pyrimidin-7-one |
Formula | C19H13Cl2N5O |
Mass | 398.245 |
Exact Mass | 397.0497155 |
Composition | C (57.3%), H (3.29%), Cl (17.8%), N (17.59%), O (4.02%) |
Atom Count | 40 |
PI | 9.91 |
Smiles | n1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)Nc1ccncc1)C |
InChI | 1S/C19H13Cl2N5O/c1-26-17-11(10-23-19(25-17)24-12-5-7-22-8-6-12)9-13(18(26)27)16-14(20)3-2-4-15(16)21
/h2-10H,1H3,(H,22,23,24,25) |
InChIKey | YOKSFKATMBKCHB-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 | PDGFr | FGFr | ALL |
Pub Chem Link |
5327889
|
Drug Bank Link | - |
ChemSpider Link | 4485059 |
ChEMBL Link | CHEMBL104779 |