General Property |
Molceule ID (DB) | EGIN0001567 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 36 compound |
IUPAC Name | N-[(3,4-dimethoxyphenyl)methyl]-6-methylquinazolin-4-amine |
Formula | C18H19N3O2 |
Mass | 309.3624 |
Exact Mass | 309.1477269 |
Composition | C (69.88%), H (6.19%), N (13.58%), O (10.34%) |
Atom Count | 42 |
PI | 11.99 |
Smiles | c12c(ccc(c1)C)ncnc2NCc1ccc(c(c1)OC)OC |
InChI | 1S/C18H19N3O2/c1-12-4-6-15-14(8-12)18(21-11-20-15)19-10-13-5-7-16(22-2)17(9-13)23-3/h4-9,11H,10H2,1-
3H3,(H,19,20,21) |
InChIKey | SMFBIPPLTAJQBN-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 | 18702009 |
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 |
21002433
|
Drug Bank Link | - |
ChemSpider Link | 20538033 |
ChEMBL Link | - |