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)

• 1586746

Parameters Provided:

name.synonym = Butyl ester of propanoic acid;Butyl propanoate;Butyl propionate;Butyl propionate [UN1914] [Flammable liquid];FEMA 2211;N-Butyl N-propionate;N-Butyl propanoate;N-Butyl propionate;Propanoic acid, butyl ester;Propionic acid, butyl ester
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 'Butyl ester of propanoic acid;Butyl propanoate;Butyl propionate;Butyl propionate [UN1914] [Flammable liquid];FEMA 2211;N-Butyl N-propionate;N-Butyl propanoate;N-Butyl propionate;Propanoic acid, butyl ester;Propionic acid, butyl ester' 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=Butyl+ester+of+propanoic+acid%3BButyl+propanoate%3BButyl+propionate%3BButyl+propionate+%5BUN1914%5D+%5BFlammable+liquid%5D%3BFEMA+2211%3BN-Butyl+N-propionate%3BN-Butyl+propanoate%3BN-Butyl+propionate%3BPropanoic+acid%2C+butyl+ester%3BPropionic+acid%2C+butyl+ester&filter.purchasability=all

Embed Link to Results

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