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)

• 1718580

Parameters Provided:

name.synonym = 2-Propenoic acid, hexyl ester; AI3-15732; Acrylic acid, hexyl ester; Ageflex n-HA; BRN 1757327; CCRIS 7038; EINECS 219-698-5; HSDB 5463; Hexyl 2-propenoate; Hexyl acrylate; LS-14711; NSC 11786; hexyl prop-2-enoate; n-Hexyl acrylate; n-Hexylacrylate
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 '2-Propenoic acid, hexyl ester; AI3-15732; Acrylic acid, hexyl ester; Ageflex n-HA; BRN 1757327; CCRIS 7038; EINECS 219-698-5; HSDB 5463; Hexyl 2-propenoate; Hexyl acrylate; LS-14711; NSC 11786; hexyl prop-2-enoate; n-Hexyl acrylate; n-Hexylacrylate' 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=2-Propenoic+acid%2C+hexyl+ester%3B+AI3-15732%3B+Acrylic+acid%2C+hexyl+ester%3B+Ageflex+n-HA%3B+BRN+1757327%3B+CCRIS+7038%3B+EINECS+219-698-5%3B+HSDB+5463%3B+Hexyl+2-propenoate%3B+Hexyl+acrylate%3B+LS-14711%3B+NSC+11786%3B+hexyl+prop-2-enoate%3B+n-Hexyl+acrylate%3B+n-Hexylacrylate&filter.purchasability=all

Embed Link to Results

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