General Property |
Molceule ID (DB) | EGIN0000670 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 8a compound |
IUPAC Name | 4-N-benzylpyrido[4,3-d]pyrimidine-4,7-diamine |
Formula | C14H13N5 |
Mass | 251.2865 |
Exact Mass | 251.1170954 |
Composition | C (66.92%), H (5.21%), N (27.87%) |
Atom Count | 32 |
PI | 11.62 |
Smiles | c12c(cc(nc1)N)ncnc2NCc1ccccc1 |
InChI | 1S/C14H13N5/c15-13-6-12-11(8-16-13)14(19-9-18-12)17-7-10-4-2-1-3-5-10/h1-6,8-9H,7H2,(H2,15,16)(H,17,
18,19) |
InChIKey | JBRBEQRTMVYDCU-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 | 7562908 | 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 |
5328077
|
Drug Bank Link | - |
ChemSpider Link | 4485244 |
ChEMBL Link | CHEMBL300083 |