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)

• 900729

Parameters Provided:

name.synonym = AI3-09059; BROMOBENZENE; Benzene, bromo-; Bromobenzene [UN2514] [Flammable liquid]; CCRIS 5887; EINECS 203-623-8; HSDB 47; LS-472; Monobromobenzene; NCI-C55492; NSC 6529; Phenyl bromide; UN2514
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 'AI3-09059; BROMOBENZENE; Benzene, bromo-; Bromobenzene [UN2514] [Flammable liquid]; CCRIS 5887; EINECS 203-623-8; HSDB 47; LS-472; Monobromobenzene; NCI-C55492; NSC 6529; Phenyl bromide; UN2514' 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=AI3-09059%3B+BROMOBENZENE%3B+Benzene%2C+bromo-%3B+Bromobenzene+%5BUN2514%5D+%5BFlammable+liquid%5D%3B+CCRIS+5887%3B+EINECS+203-623-8%3B+HSDB+47%3B+LS-472%3B+Monobromobenzene%3B+NCI-C55492%3B+NSC+6529%3B+Phenyl+bromide%3B+UN2514&filter.purchasability=all

Embed Link to Results

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