General Property |
Molceule ID (DB) | EGIN0003940 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 3 compound |
IUPAC Name | N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(2-methoxyethoxy)quinazolin-4-amine |
Formula | C18H17ClFN3O3 |
Mass | 377.797 |
Exact Mass | 377.0942473 |
Composition | C (57.22%), H (4.54%), Cl (9.38%), F (5.03%), N (11.12%), O (12.7%) |
Atom Count | 43 |
PI | 9.08 |
Smiles | c12c(Nc3c(cc(cc3)Cl)F)ncnc1cc(c(c2)OC)OCCOC |
InChI | 1S/C18H17ClFN3O3/c1-24-5-6-26-17-9-15-12(8-16(17)25-2)18(22-10-21-15)23-14-4-3-11(19)7-13(14)20/h3-4
,7-10H,5-6H2,1-2H3,(H,21,22,23) |
InChIKey | SWIHGAFGYUTAOY-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 | 11881999 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | FGFR | Flt1 | KDR | ALL |
Pub Chem Link |
5329011
|
Drug Bank Link | - |
ChemSpider Link | 4486173 |
ChEMBL Link | CHEMBL286160 |