General Property |
Molceule ID (DB) | EGIN0000679 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 12 compound |
IUPAC Name | (4E)-4-[(3-bromophenyl)imino]-N,3-dimethyl-3H,4H-pyrido[4,3-d]pyrimidin-7-amine |
Formula | C15H14BrN5 |
Mass | 344.209 |
Exact Mass | 343.0432581 |
Composition | C (52.34%), H (4.1%), Br (23.21%), N (20.35%) |
Atom Count | 35 |
PI | No isoelectric point. |
Smiles | c12c(cc(nc1)NC)ncn(/c/2=N/c1cccc(c1)Br)C |
InChI | 1S/C15H14BrN5/c1-17-14-7-13-12(8-18-14)15(21(2)9-19-13)20-11-5-3-4-10(16)6-11/h3-9H,1-2H3,(H,17,18)/
b20-15+ |
InChIKey | KGPJHDOZKFVFLW-HMMYKYKNSA-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 | 8627606 |
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 |
5328255
|
Drug Bank Link | - |
ChemSpider Link | 4485420 21201090 |
ChEMBL Link | CHEMBL52882 |