General Property |
Molceule ID (DB) | EGIN0004063 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 17b compound |
IUPAC Name | N-(4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine |
Formula | C16H14FN3O2 |
Mass | 299.2997 |
Exact Mass | 299.1070049 |
Composition | C (64.21%), H (4.71%), F (6.35%), N (14.04%), O (10.69%) |
Atom Count | 36 |
PI | 10.53 |
Smiles | c1(c(cc2c(c1)c(ncn2)Nc1ccc(cc1)F)OC)OC |
InChI | 1S/C16H14FN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-10(17)4-6-11/h3-9H,1-2H3,(H,18,
19,20) |
InChIKey | GOOMUHBHUSAARV-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 | 16279804 |
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 |
1475063
|
Drug Bank Link | DB00317 |
ChemSpider Link | 1216885 |
ChEMBL Link | CHEMBL224013 |