General Property |
Molceule ID (DB) | EGIN0000760 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 57 compound |
IUPAC Name | N-(3-bromophenyl)-6,7-dipropoxyquinazolin-4-amine |
Formula | C20H22BrN3O2 |
Mass | 416.312 |
Exact Mass | 415.0895396 |
Composition | C (57.7%), H (5.33%), Br (19.19%), N (10.09%), O (7.69%) |
Atom Count | 48 |
PI | 10.31 |
Smiles | c12c(cc(c(c1)OCCC)OCCC)ncnc2Nc1cccc(c1)Br |
InChI | 1S/C20H22BrN3O2/c1-3-8-25-18-11-16-17(12-19(18)26-9-4-2)22-13-23-20(16)24-15-7-5-6-14(21)10-15/h5-7,
10-13H,3-4,8-9H2,1-2H3,(H,22,23,24) |
InChIKey | ZBOJKFDQWQBBHE-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000760.png) | Structure Backbone | ![](./frame/f_EGIN0000760.png) |
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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 | 8568816 |
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 |
5328221
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Drug Bank Link | - |
ChemSpider Link | 4485386 |
ChEMBL Link | CHEMBL418967 |