General Property |
Molceule ID (DB) | EGIN0000929 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 9 compound |
IUPAC Name | N-[(4-methoxyphenyl)methyl]quinazolin-4-amine |
Formula | C16H15N3O |
Mass | 265.3098 |
Exact Mass | 265.1215121 |
Composition | C (72.43%), H (5.7%), N (15.84%), O (6.03%) |
Atom Count | 35 |
PI | 11.7 |
Smiles | c12c(cccc1)ncnc2NCc1ccc(cc1)OC |
InChI | 1S/C16H15N3O/c1-20-13-8-6-12(7-9-13)10-17-16-14-4-2-3-5-15(14)18-11-19-16/h2-9,11H,10H2,1H3,(H,17,18
,19) |
InChIKey | MCZPCSYKZMFAHI-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 |
5328015
|
Drug Bank Link | - |
ChemSpider Link | 4485182 |
ChEMBL Link | CHEMBL116919 |