| General Property |
| Molceule ID (DB) | EGIN0002264 |
| Inhibitor Class | Benzo-thiazole |
| Molecule Name in Refrence Article | 33 compound |
| IUPAC Name | N-[3-(1,3-benzothiazol-2-yl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
| Formula | C19H13N5S |
| Mass | 343.405 |
| Exact Mass | 343.0891661 |
| Composition | C (66.45%), H (3.82%), N (20.39%), S (9.34%) |
| Atom Count | 38 |
| PI | 9.97 |
| Smiles | N(c1cc(ccc1)c1nc2c(s1)cccc2)c1ncnc2c1cc[nH]2 |
| InChI | 1S/C19H13N5S/c1-2-7-16-15(6-1)24-19(25-16)12-4-3-5-13(10-12)23-18-14-8-9-20-17(14)21-11-22-18/h1-11H
,(H2,20,21,22,23) |
| InChIKey | BMGGDZTXJBWQCN-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 | 19211246 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Aurora A | EphB4 | IGF1R | InsR | PDGFR beta | Src | VEGFR2 | VEGFR3 | TIE2 | Aurora B | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 23336086 |
| ChEMBL Link | CHEMBL490555 |
