General Property |
Molceule ID (DB) | EGIN0002783 |
Inhibitor Class | Dithiobis-indole |
Molecule Name in Refrence Article | 10z compound |
IUPAC Name | (1S,3R)-1-[(furan-2-yl)carbonyl]-3-methyl-2,3-dihydro-1H-indene-2-thione |
Formula | C15H12O2S |
Mass | 256.32 |
Exact Mass | 256.0558003 |
Composition | C (70.29%), H (4.72%), O (12.48%), S (12.51%) |
Atom Count | 30 |
PI | 1.57 |
Smiles | c1cccc2c1[C@H](C(=S)[C@@H]2C)C(=O)c1occc1 |
InChI | 1S/C15H12O2S/c1-9-10-5-2-3-6-11(10)13(15(9)18)14(16)12-7-4-8-17-12/h2-9,13H,1H3/t9-,13+/m1/s1 |
InChIKey | YHUGBUVOGAQVTA-RNCFNFMXSA-N |
2D Structure | | Structure Backbone | |
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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 | 7837241 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | SRC | |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | - |
ChEMBL Link | - |