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)

• 3784127
• 3784397

Parameters Provided:

name.synonym = (3-(3-(2-(7-chloro-2-quinolinyl)ethenyl)phenyl)((3-dimethylamino-3-oxopropyl)thio)methyl)thiopropanoic acid; C26H27ClN2O3S2; L 660,711; L 660711; L-660711; LS-172278; MK 0571; MK 0679; MK 571; MK-0571; MK-0679; MK-679; Propanoic acid, 3-(((3-((1E)-2-(7-ch
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 '(3-(3-(2-(7-chloro-2-quinolinyl)ethenyl)phenyl)((3-dimethylamino-3-oxopropyl)thio)methyl)thiopropanoic acid; C26H27ClN2O3S2; L 660,711; L 660711; L-660711; LS-172278; MK 0571; MK 0679; MK 571; MK-0571; MK-0679; MK-679; Propanoic acid, 3-(((3-((1E)-2-(7-ch' 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

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//zinc12.docking.org/results/combination?name.synonym=%283-%283-%282-%287-chloro-2-quinolinyl%29ethenyl%29phenyl%29%28%283-dimethylamino-3-oxopropyl%29thio%29methyl%29thiopropanoic+acid%3B+C26H27ClN2O3S2%3B+L+660%2C711%3B+L+660711%3B+L-660711%3B+LS-172278%3B+MK+0571%3B+MK+0679%3B+MK+571%3B+MK-0571%3B+MK-0679%3B+MK-679%3B+Propanoic+acid%2C+3-%28%28%283-%28%281E%29-2-%287-ch&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": "(3-(3-(2-(7-chloro-2-quinolinyl)ethenyl)phenyl)((3-dimethylamino-3-oxopropyl)thio)methyl)thiopropanoic acid; C26H27ClN2O3S2; L 660,711; L 660711; L-660711; LS-172278; MK 0571; MK 0679; MK 571; MK-0571; MK-0679; MK-679; Propanoic acid, 3-(((3-((1E)-2-(7-ch" }); </script>