General Property |
Molceule ID (DB) | EGIN0000576 |
Inhibitor Class | Anilino-quinoline |
Molecule Name in Refrence Article | 5 compound |
IUPAC Name | 6-ethoxy-4-{4-[(furan-2-yl)carbonyl]piperazin-1-yl}-2-methylquinoline |
Formula | C21H23N3O3 |
Mass | 365.4256 |
Exact Mass | 365.1739416 |
Composition | C (69.02%), H (6.34%), N (11.5%), O (13.13%) |
Atom Count | 50 |
PI | No isoelectric point. |
Smiles | c12c(ccc(c1)OCC)nc(cc2N1CCN(CC1)C(=O)c1ccco1)C |
InChI | 1S/C21H23N3O3/c1-3-26-16-6-7-18-17(14-16)19(13-15(2)22-18)23-8-10-24(11-9-23)21(25)20-5-4-12-27-20/h
4-7,12-14H,3,8-11H2,1-2H3 |
InChIKey | SKIMAWJZDXFYKF-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 | 18678492 |
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 | 24709316 |
ChEMBL Link | CHEMBL497322 |