ZINC 12

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Format: Overview Compact Basic Summary Targets List Properties Purchasing Info Catalog Info SDF CAS SMILES MOL2 Flexibase ZINC Names Names+Smiles 800lb Gorilla MOL2 (e.g. PyMol) SDF (e.g. Chimera) SMILES (e.g. Marvin) Gorilla (e.g. Instant JChem) Representations: Default All Single Usual Metals Reference Mid High Low Purchasability: Purchasable In Stock or On Demand In Stock Only Make On Demand Boutique Not For Sale Annotated Model Systems Collabocules Everything Boutique (at any price)

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Parameters Provided:

name.synonym = (6)annulene; :benzene; AI3-00808; Benzeen [Dutch]; Benzen [Polish]; Benzene; Benzene (including benzene from gasoline); Benzene [UN1114] [Flammable liquid]; Benzene, pure; Benzin; Benzin (Obs.); Benzine (Obs.); Benzol; Benzol 90; Benzol diluent; Benzole
filter.purchasability = all
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN synonym AS syn ON (ci.cat_id_fk=syn.cat_fk AND ci.supplier_code=syn.supplier_code) INNER JOIN field AS f ON syn.field_fk=f.field_id  WHERE c.free = 1 AND syn.synonym IS NOT NULL AND syn.synonym LIKE '(6)annulene; :benzene; AI3-00808; Benzeen [Dutch]; Benzen [Polish]; Benzene; Benzene (including benzene from gasoline); Benzene [UN1114] [Flammable liquid]; Benzene, pure; Benzin; Benzin (Obs.); Benzine (Obs.); Benzol; Benzol 90; Benzol diluent; Benzole' AND f.ftype IN (3,7,11,12,14) AND ci.sub_id_fk IN (SELECT ci.sub_id_fk AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id  WHERE c.free = 1   )    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?name.synonym=%286%29annulene%3B+%3Abenzene%3B+AI3-00808%3B+Benzeen+%5BDutch%5D%3B+Benzen+%5BPolish%5D%3B+Benzene%3B+Benzene+%28including+benzene+from+gasoline%29%3B+Benzene+%5BUN1114%5D+%5BFlammable+liquid%5D%3B+Benzene%2C+pure%3B+Benzin%3B+Benzin+%28Obs.%29%3B+Benzine+%28Obs.%29%3B+Benzol%3B+Benzol+90%3B+Benzol+diluent%3B+Benzole&filter.purchasability=all

Embed Link to Results

<div id="zinc-link"></div> <script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script> <script type="text/javascript"> window.zinc.embed('zinc-link', { "name.synonym": "(6)annulene; :benzene; AI3-00808; Benzeen [Dutch]; Benzen [Polish]; Benzene; Benzene (including benzene from gasoline); Benzene [UN1114] [Flammable liquid]; Benzene, pure; Benzin; Benzin (Obs.); Benzine (Obs.); Benzol; Benzol 90; Benzol diluent; Benzole" }); </script>