General Property |
Molceule ID (DB) | EGIN0003482 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 21 compound |
IUPAC Name | N-methyl-6-[(2E)-3-methyltriaz-2-en-1-yl]-N-phenylquinazolin-4-amine |
Formula | C16H16N6 |
Mass | 292.3384 |
Exact Mass | 292.1436445 |
Composition | C (65.74%), H (5.52%), N (28.75%) |
Atom Count | 38 |
PI | 11.69 |
Smiles | c1(c2c(ncn1)ccc(c2)N/N=N/C)N(c1ccccc1)C |
InChI | 1S/C16H16N6/c1-17-21-20-12-8-9-15-14(10-12)16(19-11-18-15)22(2)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,17,20
) |
InChIKey | JROZUEGHQKCIHO-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 | 13678409 |
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 |
11055442
|
Drug Bank Link | - |
ChemSpider Link | 9230603 |
ChEMBL Link | CHEMBL135592 |