| General Property |
| Molceule ID (DB) | EGIN0001173 |
| Inhibitor Class | Azaspiro-octane |
| Molecule Name in Refrence Article | 20 compound |
| IUPAC Name | (6S,7S)-N-hydroxy-5-methyl-6-[(4-phenylpiperazin-1-yl)carbonyl]-5-azaspiro[2.5]octane-7-carboxamide |
| Formula | C20H28N4O3 |
| Mass | 372.4613 |
| Exact Mass | 372.2161408 |
| Composition | C (64.49%), H (7.58%), N (15.04%), O (12.89%) |
| Atom Count | 55 |
| PI | 8.2 |
| Smiles | [C@H]1([C@H](N(CC2(C1)CC2)C)C(=O)N1CCN(CC1)c1ccccc1)C(=O)NO |
| InChI | 1S/C20H28N4O3/c1-22-14-20(7-8-20)13-16(18(25)21-27)17(22)19(26)24-11-9-23(10-12-24)15-5-3-2-4-6-15/h
2-6,16-17,27H,7-14H2,1H3,(H,21,25)/t16-,17-/m0/s1 |
| InChIKey | NJCBPLQYZDLBCA-IRXDYDNUSA-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 |
16108944
|
| Drug Bank Link | - |
| ChemSpider Link | 17266361 |
| ChEMBL Link | CHEMBL387202 |
