General Property |
Molceule ID (DB) | EGIN0001571 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 44 compound |
IUPAC Name | benzyl 4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carboxylate |
Formula | C22H24N4O4 |
Mass | 408.4504 |
Exact Mass | 408.1797553 |
Composition | C (64.69%), H (5.92%), N (13.72%), O (15.67%) |
Atom Count | 54 |
PI | No isoelectric point. |
Smiles | c12c(cc(c(c1)OC)OC)ncnc2N1CCN(CC1)C(=O)OCc1ccccc1 |
InChI | 1S/C22H24N4O4/c1-28-19-12-17-18(13-20(19)29-2)23-15-24-21(17)25-8-10-26(11-9-25)22(27)30-14-16-6-4-3
-5-7-16/h3-7,12-13,15H,8-11,14H2,1-2H3 |
InChIKey | GMKGTICWDBTEPZ-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 | 18702009 |
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 | - |
ChEMBL Link | - |