| General Property |
| Molceule ID (DB) | EGIN0003407 |
| Inhibitor Class | Pyrazine-Pyridine |
| Molecule Name in Refrence Article | 39 compound |
| IUPAC Name | 4-[(5-{6-[(3-chlorophenyl)amino]pyrazin-2-yl}pyridin-3-yl)amino]butan-1-ol |
| Formula | C19H20ClN5O |
| Mass | 369.848 |
| Exact Mass | 369.135638 |
| Composition | C (61.7%), H (5.45%), Cl (9.59%), N (18.94%), O (4.33%) |
| Atom Count | 46 |
| PI | 9.67 |
| Smiles | n1c(Nc2cc(Cl)ccc2)cncc1c1cc(NCCCCO)cnc1 |
| InChI | 1S/C19H20ClN5O/c20-15-4-3-5-16(9-15)24-19-13-22-12-18(25-19)14-8-17(11-21-10-14)23-6-1-2-7-26/h3-5,8
-13,23,26H,1-2,6-7H2,(H,24,25) |
| InChIKey | IDNNHUIRPPFJBA-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 | 16033269 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | calmodulin kinase-2 | Casein kinase 1 | Casein kinase 2 | CDK1 | CDK4 | Insulin R kinase | MAPK | PKA | PKC beta2 | PKC gamma | FGFR-2 | PDGFR | GSK-3 | VEGFR2 | ALL |
| Pub Chem Link |
5330388
|
| Drug Bank Link | - |
| ChemSpider Link | 4487539 |
| ChEMBL Link | CHEMBL188386 |
