General Property |
Molceule ID (DB) | EGIN0003479 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 18 compound |
IUPAC Name | N-methyl-N-phenyl-6-[(2E)-3-(pyridin-2-ylmethyl)triaz-2-en-1-yl]quinazolin-4-amine |
Formula | C21H19N7 |
Mass | 369.4225 |
Exact Mass | 369.1701936 |
Composition | C (68.28%), H (5.18%), N (26.54%) |
Atom Count | 47 |
PI | 11.59 |
Smiles | c1(c2c(ncn1)ccc(c2)N/N=N/Cc1ncccc1)N(c1ccccc1)C |
InChI | 1S/C21H19N7/c1-28(18-8-3-2-4-9-18)21-19-13-16(10-11-20(19)23-15-24-21)26-27-25-14-17-7-5-6-12-22-17/
h2-13,15H,14H2,1H3,(H,25,26) |
InChIKey | JQGXTUPDMJBRGY-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 | 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 |
10926736
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Drug Bank Link | - |
ChemSpider Link | 9101981 |
ChEMBL Link | CHEMBL137635 |