General Property |
Molceule ID (DB) | EGIN0000258 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 15 compound |
IUPAC Name | N-(3-bromophenyl)-2-methylquinazolin-4-amine |
Formula | C15H12BrN3 |
Mass | 314.18 |
Exact Mass | 313.02146 |
Composition | C (57.34%), H (3.85%), Br (25.43%), N (13.37%) |
Atom Count | 31 |
PI | 10.43 |
Smiles | c12c(cccc1)nc(nc2Nc1cccc(c1)Br)C |
InChI | 1S/C15H12BrN3/c1-10-17-14-8-3-2-7-13(14)15(18-10)19-12-6-4-5-11(16)9-12/h2-9H,1H3,(H,17,18,19) |
InChIKey | USHLEHWRIXTPMO-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 | 9154973 |
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 | 23133991 |
ChEMBL Link | CHEMBL37099 |