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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name.synonym = ( -)-4-(2-Bis(isopropylamino)ethoxy)-N-butyl-alpha-(p-toluoylamino)hydrocinnamamide; BRN 2792161; CR 709; Hydrocinnamamide, 4-(2-bis(isopropylamino)ethoxy)-N-butyl-alpha-(p-toluoylamino)-, ( -)-; LS-77082; O-(2-Diisopropylaminoethyl)-N-toluoyl-DL-tyrosyl-
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 '( -)-4-(2-Bis(isopropylamino)ethoxy)-N-butyl-alpha-(p-toluoylamino)hydrocinnamamide; BRN 2792161; CR 709; Hydrocinnamamide, 4-(2-bis(isopropylamino)ethoxy)-N-butyl-alpha-(p-toluoylamino)-, ( -)-; LS-77082; O-(2-Diisopropylaminoethyl)-N-toluoyl-DL-tyrosyl-' 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=%28+-%29-4-%282-Bis%28isopropylamino%29ethoxy%29-N-butyl-alpha-%28p-toluoylamino%29hydrocinnamamide%3B+BRN+2792161%3B+CR+709%3B+Hydrocinnamamide%2C+4-%282-bis%28isopropylamino%29ethoxy%29-N-butyl-alpha-%28p-toluoylamino%29-%2C+%28+-%29-%3B+LS-77082%3B+O-%282-Diisopropylaminoethyl%29-N-toluoyl-DL-tyrosyl-&filter.purchasability=all

Embed Link to Results

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