General Property |
Molceule ID (DB) | EGIN0004049 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 10b compound |
IUPAC Name | N-(3-chlorophenyl)-6,7-diethoxyquinazolin-4-amine |
Formula | C18H18ClN3O2 |
Mass | 343.807 |
Exact Mass | 343.1087545 |
Composition | C (62.88%), H (5.28%), Cl (10.31%), N (12.22%), O (9.31%) |
Atom Count | 42 |
PI | 10.26 |
Smiles | c12c(ncnc1cc(c(c2)OCC)OCC)Nc1cc(Cl)ccc1 |
InChI | 1S/C18H18ClN3O2/c1-3-23-16-9-14-15(10-17(16)24-4-2)20-11-21-18(14)22-13-7-5-6-12(19)8-13/h5-11H,3-4H
2,1-2H3,(H,20,21,22) |
InChIKey | VXCUTOVXETTYDM-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 | 16279804 |
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 |
11660897
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Drug Bank Link | - |
ChemSpider Link | 9835632 |
ChEMBL Link | CHEMBL64950 |