| General Property |
| Molceule ID (DB) | EGIN0002242 |
| Inhibitor Class | Benzo-thiazole |
| Molecule Name in Refrence Article | 11 compound |
| IUPAC Name | N-[4-(1,3-benzothiazol-2-yl)-3-methoxyphenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
| Formula | C20H15N5OS |
| Mass | 373.431 |
| Exact Mass | 373.0997308 |
| Composition | C (64.33%), H (4.05%), N (18.75%), O (4.28%), S (8.59%) |
| Atom Count | 42 |
| PI | 9.96 |
| Smiles | c1c(ccc(c1OC)c1nc2c(s1)cccc2)Nc1ncnc2c1cc[nH]2 |
| InChI | 1S/C20H15N5OS/c1-26-16-10-12(24-19-14-8-9-21-18(14)22-11-23-19)6-7-13(16)20-25-15-4-2-3-5-17(15)27-2
0/h2-11H,1H3,(H2,21,22,23,24) |
| InChIKey | CXJQAZDGOBZGLJ-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 | Aurora B | InsR | Src | VEGFR2 | VEGFR3 | IGF1R | TIE2 | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 23335821 |
| ChEMBL Link | CHEMBL462162 |
