General Property |
Molceule ID (DB) | EGIN0000958 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 38 compound |
IUPAC Name | 4-(benzylamino)-6-methoxyquinazolin-7-ol |
Formula | C16H15N3O2 |
Mass | 281.3092 |
Exact Mass | 281.1164267 |
Composition | C (68.31%), H (5.37%), N (14.94%), O (11.37%) |
Atom Count | 36 |
PI | 6.97 |
Smiles | c12c(cc(c(c1)OC)O)ncnc2NCc1ccccc1 |
InChI | 1S/C16H15N3O2/c1-21-15-7-12-13(8-14(15)20)18-10-19-16(12)17-9-11-5-3-2-4-6-11/h2-8,10,20H,9H2,1H3,(H
,17,18,19) |
InChIKey | YKDOURWNBDLSNO-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 | 7658435 |
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 | 21201140 |
ChEMBL Link | CHEMBL333851 |