| General Property |
| Molceule ID (DB) | EGIN0001171 |
| Inhibitor Class | Azaspiro-octane |
| Molecule Name in Refrence Article | 18 compound |
| IUPAC Name | (6S,7S)-N-hydroxy-6-{[(3R)-3-phenylpyrrolidin-1-yl]carbonyl}-5-azaspiro[2.5]octane-7-carboxamide |
| Formula | C19H25N3O3 |
| Mass | 343.4201 |
| Exact Mass | 343.1895917 |
| Composition | C (66.45%), H (7.34%), N (12.24%), O (13.98%) |
| Atom Count | 50 |
| PI | 8.36 |
| Smiles | [C@H]1([C@H](NCC2(C1)CC2)C(=O)N1C[C@H](CC1)c1ccccc1)C(=O)NO |
| InChI | 1S/C19H25N3O3/c23-17(21-25)15-10-19(7-8-19)12-20-16(15)18(24)22-9-6-14(11-22)13-4-2-1-3-5-13/h1-5,14
-16,20,25H,6-12H2,(H,21,23)/t14-,15-,16-/m0/s1 |
| InChIKey | XKPUKZQRNSFQLM-JYJNAYRXSA-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 | 17256836 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | ADAM-10 | MMP-1 | MMP-2 | MMP-3 | MMP-9 | ALL |
| Pub Chem Link |
16108943
|
| Drug Bank Link | - |
| ChemSpider Link | 17266360 |
| ChEMBL Link | CHEMBL221698 |
