General Property |
Molceule ID (DB) | EGIN0001942 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 2b compound |
IUPAC Name | 6,7-dimethoxy-4-(4-phenylbut-1-yn-1-yl)quinazoline |
Formula | C20H18N2O2 |
Mass | 318.3691 |
Exact Mass | 318.1368278 |
Composition | C (75.45%), H (5.7%), N (8.8%), O (10.05%) |
Atom Count | 42 |
PI | No isoelectric point. |
Smiles | c1(c(cc2c(c1)c(ncn2)C#CCCc1ccccc1)OC)OC |
InChI | 1S/C20H18N2O2/c1-23-19-12-16-17(21-14-22-18(16)13-20(19)24-2)11-7-6-10-15-8-4-3-5-9-15/h3-5,8-9,12-1
4H,6,10H2,1-2H3 |
InChIKey | UJTHKWFURJCQDD-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0001942.png) | Structure Backbone | ![](./frame/f_EGIN0001942.png) |
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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 | 17869510 |
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 |
44442165
|
Drug Bank Link | - |
ChemSpider Link | 23306753 |
ChEMBL Link | CHEMBL250318 |