General Property |
Molceule ID (DB) | EGIN0003485 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 24 compound |
IUPAC Name | N-benzyl-6-[(1E)-dimethyltriaz-1-en-1-yl]quinazolin-4-amine |
Formula | C17H18N6 |
Mass | 306.365 |
Exact Mass | 306.1592946 |
Composition | C (66.65%), H (5.92%), N (27.43%) |
Atom Count | 41 |
PI | 10.83 |
Smiles | c12c(ncnc1ccc(/N=N/N(C)C)c2)NCc1ccccc1 |
InChI | 1S/C17H18N6/c1-23(2)22-21-14-8-9-16-15(10-14)17(20-12-19-16)18-11-13-6-4-3-5-7-13/h3-10,12H,11H2,1-2
H3,(H,18,19,20)/b22-21+ |
InChIKey | OIRWZNNJKRUVCD-QURGRASLSA-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 | 13678409 |
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 |
11822927
|
Drug Bank Link | - |
ChemSpider Link | 9997578 |
ChEMBL Link | CHEMBL137027 |