| General Property |
| Molceule ID (DB) | EGIN0003294 |
| Inhibitor Class | Amino-thiazole |
| Molecule Name in Refrence Article | BMS-387032 |
| IUPAC Name | N-(5-{[(5-tert-butyl-1,3-oxazol-2-yl)methyl]sulfanyl}-1,3-thiazol-2-yl)piperidine-4-carboxamide |
| Formula | C17H24N4O2S2 |
| Mass | 380.528 |
| Exact Mass | 380.1340674 |
| Composition | C (53.66%), H (6.36%), N (14.72%), O (8.41%), S (16.85%) |
| Atom Count | 49 |
| PI | 10.41 |
| Smiles | C1(CCNCC1)C(=O)Nc1ncc(s1)SCc1oc(cn1)C(C)(C)C |
| InChI | 1S/C17H24N4O2S2/c1-17(2,3)12-8-19-13(23-12)10-24-14-9-20-16(25-14)21-15(22)11-4-6-18-7-5-11/h8-9,11,
18H,4-7,10H2,1-3H3,(H,20,21,22) |
| InChIKey | OUSFTKFNBAZUKL-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 | 15027863 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | IGF1R | Chk1 | EMT | FAK | IKK | Lck | PKC beta | PKC gamma | ZAP70 | CDK1/cycB | CDK2/cycE | CDK4/cycD | ALL |
| Pub Chem Link |
3025986
|
| Drug Bank Link | - |
| ChemSpider Link | 2291614 |
| ChEMBL Link | CHEMBL296468 |
