General Property |
Molceule ID (DB) | EGIN0000877 |
Inhibitor Class | Anilino-quinoline |
Molecule Name in Refrence Article | 40 compound |
IUPAC Name | N-{4-[(3-cyano-6,7-dimethoxyquinolin-4-yl)amino]phenyl}acetamide |
Formula | C20H18N4O3 |
Mass | 362.3819 |
Exact Mass | 362.1378905 |
Composition | C (66.29%), H (5.01%), N (15.46%), O (13.25%) |
Atom Count | 45 |
PI | 10.03 |
Smiles | c12c(cc(c(c1)OC)OC)ncc(c2Nc1ccc(cc1)NC(=O)C)C#N |
InChI | 1S/C20H18N4O3/c1-12(25)23-14-4-6-15(7-5-14)24-20-13(10-21)11-22-17-9-19(27-3)18(26-2)8-16(17)20/h4-9
,11H,1-3H3,(H,22,24)(H,23,25) |
InChIKey | WIUNOYZFECMGSN-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 |
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Drug Bank Link | - |
ChemSpider Link | - |
ChEMBL Link | CHEMBL324399 |