| General Property |
| Molceule ID (DB) | EGIN0000060 |
| Inhibitor Class | Benzoxazepine |
| Molecule Name in Refrence Article | 2m compound |
| IUPAC Name | N-(3-bromophenyl)-13-methoxy-2-oxa-9-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-7-amine |
| Formula | C20H17BrN2O2 |
| Mass | 397.265 |
| Exact Mass | 396.0473404 |
| Composition | C (60.47%), H (4.31%), Br (20.11%), N (7.05%), O (8.05%) |
| Atom Count | 42 |
| PI | 7.97 |
| Smiles | c12c(cccc1Nc1cc(ccc1)Br)Oc1c(CN2)cc(cc1)OC |
| InChI | 1S/C20H17BrN2O2/c1-24-16-8-9-18-13(10-16)12-22-20-17(6-3-7-19(20)25-18)23-15-5-2-4-14(21)11-15/h2-11
,22-23H,12H2,1H3 |
| InChIKey | OLAMWRSZEXAQDE-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 | 16412636 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | No activity data against other kinases present in database |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | CHEMBL383444 |
