General Property |
Molceule ID (DB) | EGIN0001563 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 3 compound |
IUPAC Name | N-[3,5-bis(trifluoromethyl)phenyl]-6-methylquinazolin-4-amine |
Formula | C17H11F6N3 |
Mass | 371.2798 |
Exact Mass | 371.0857166 |
Composition | C (54.99%), H (2.99%), F (30.7%), N (11.32%) |
Atom Count | 37 |
PI | 9.81 |
Smiles | c12c(ccc(c1)C)ncnc2Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F |
InChI | 1S/C17H11F6N3/c1-9-2-3-14-13(4-9)15(25-8-24-14)26-12-6-10(16(18,19)20)5-11(7-12)17(21,22)23/h2-8H,1H
3,(H,24,25,26) |
InChIKey | XXKYNRWOJCCKEG-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0001563.png) | Structure Backbone | ![](./frame/f_EGIN0001563.png) |
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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 |
21002443
|
Drug Bank Link | - |
ChemSpider Link | 20538046 |
ChEMBL Link | - |