General Property |
Molceule ID (DB) | EGIN0000854 |
Inhibitor Class | Anilino-quinoline |
Molecule Name in Refrence Article | 17 compound |
IUPAC Name | 4-{[3-(dimethylamino)phenyl]amino}-6,7-dimethoxyquinoline-3-carbonitrile |
Formula | C20H20N4O2 |
Mass | 348.3984 |
Exact Mass | 348.1586259 |
Composition | C (68.95%), H (5.79%), N (16.08%), O (9.18%) |
Atom Count | 46 |
PI | 11.45 |
Smiles | c12c(cc(c(c1)OC)OC)ncc(c2Nc1cccc(c1)N(C)C)C#N |
InChI | 1S/C20H20N4O2/c1-24(2)15-7-5-6-14(8-15)23-20-13(11-21)12-22-17-10-19(26-4)18(25-3)9-16(17)20/h5-10,1
2H,1-4H3,(H,22,23) |
InChIKey | OLPCFXOXZCAXNQ-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 | 10966743 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
5328849
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Drug Bank Link | - |
ChemSpider Link | 4486011 |
ChEMBL Link | CHEMBL110035 |