| General Property |
| Molceule ID (DB) | EGIN0001747 |
| Inhibitor Class | Purine |
| Molecule Name in Refrence Article | 10 compound |
| IUPAC Name | 3-({2-[(2-aminoethyl)amino]-9-ethyl-8,9-dihydro-7H-purin-6-yl}amino)benzonitrile |
| Formula | C16H20N8 |
| Mass | 324.3836 |
| Exact Mass | 324.1810927 |
| Composition | C (59.24%), H (6.21%), N (34.54%) |
| Atom Count | 44 |
| PI | 12.91 |
| Smiles | c1(nc(nc2c1NCN2CC)NCCN)Nc1cc(ccc1)C#N |
| InChI | 1S/C16H20N8/c1-2-24-10-20-13-14(21-12-5-3-4-11(8-12)9-18)22-16(19-7-6-17)23-15(13)24/h3-5,8,20H,2,6-
7,10,17H2,1H3,(H2,19,21,22,23) |
| InChIKey | PRPOSFHQOGDUML-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 | 9990463 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | PKC alpha | PKA | CDK1 | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | CHEMBL175158 |
