General Property |
Molceule ID (DB) | EGIN0000949 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 29 compound |
IUPAC Name | N-benzyl-6-nitroquinazolin-4-amine |
Formula | C15H12N4O2 |
Mass | 280.2814 |
Exact Mass | 280.0960256 |
Composition | C (64.28%), H (4.32%), N (19.99%), O (11.42%) |
Atom Count | 33 |
PI | 10.62 |
Smiles | c12c(ccc(c1)N(=O)=O)ncnc2NCc1ccccc1 |
InChI | 1S/C15H12N4O2/c20-19(21)12-6-7-14-13(8-12)15(18-10-17-14)16-9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,16,17,
18) |
InChIKey | MUFPYUMPKFPPPJ-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
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 | 7658435 |
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 |
5328027
|
Drug Bank Link | - |
ChemSpider Link | 4485194 |
ChEMBL Link | CHEMBL119000 |