General Property |
Molceule ID (DB) | EGIN0002702 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 8g compound |
IUPAC Name | 4-N-[(4-bromophenyl)methyl]pyrido[4,3-d]pyrimidine-4,7-diamine |
Formula | C14H12BrN5 |
Mass | 330.183 |
Exact Mass | 329.0276081 |
Composition | C (50.93%), H (3.66%), Br (24.2%), N (21.21%) |
Atom Count | 32 |
PI | 11.62 |
Smiles | c12c(ncnc1cc(nc2)N)NCc1ccc(Br)cc1 |
InChI | 1S/C14H12BrN5/c15-10-3-1-9(2-4-10)6-18-14-11-7-17-13(16)5-12(11)19-8-20-14/h1-5,7-8H,6H2,(H2,16,17)(
H,18,19,20) |
InChIKey | HZIJNNGFACBXKU-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0002702.png) | Structure Backbone | ![](./frame/f_EGIN0002702.png) |
|
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 | 7562908 |
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 |
5328083
|
Drug Bank Link | - |
ChemSpider Link | 4485250 |
ChEMBL Link | CHEMBL125949 |