General Property |
Molceule ID (DB) | EGIN0001971 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 20 compound |
IUPAC Name | 4-(5-bromo-1H-indol-3-yl)-6,7-dimethoxyquinazoline |
Formula | C18H14BrN3O2 |
Mass | 384.227 |
Exact Mass | 383.0269394 |
Composition | C (56.27%), H (3.67%), Br (20.8%), N (10.94%), O (8.33%) |
Atom Count | 38 |
PI | 8.44 |
Smiles | c1(c(cc2c(c1)ncnc2c1c[nH]c2c1cc(cc2)Br)OC)OC |
InChI | 1S/C18H14BrN3O2/c1-23-16-6-12-15(7-17(16)24-2)21-9-22-18(12)13-8-20-14-4-3-10(19)5-11(13)14/h3-9,20H
,1-2H3 |
InChIKey | MWBJNWJINFGNLQ-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
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 | 17981366 |
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 |
11696664
|
Drug Bank Link | - |
ChemSpider Link | 9871389 |
ChEMBL Link | CHEMBL473320 |