General Property |
Molceule ID (DB) | EGIN0000171 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 10 compound |
IUPAC Name | N-[6-chloro-2-(4-methylphenyl)quinazolin-4-yl]benzamide |
Formula | C22H16ClN3O |
Mass | 373.835 |
Exact Mass | 373.0981899 |
Composition | C (70.68%), H (4.31%), Cl (9.48%), N (11.24%), O (4.28%) |
Atom Count | 43 |
PI | 5.48 |
Smiles | n1c(c2c(nc1c1ccc(cc1)C)ccc(c2)Cl)NC(=O)c1ccccc1 |
InChI | 1S/C22H16ClN3O/c1-14-7-9-15(10-8-14)20-24-19-12-11-17(23)13-18(19)21(25-20)26-22(27)16-5-3-2-4-6-16/
h2-13H,1H3,(H,24,25,26,27) |
InChIKey | JVEZTNDLQKDBNC-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 | 20599299 |
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 | 26352139 |
ChEMBL Link | CHEMBL1242085 |