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)

• 5315716

Parameters Provided:

name.synonym = AI3-62694; B 4576; BRN 2179006; Benzenamine, N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)-; CGA 10832; Caswell No. 271BB; EINECS 247-656-6; EPA Pesticide Chemical Code 106601; ER5461; GA-10832; HSDB 3923; LS-154347; N-(Cyclopropylmethyl)
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 'AI3-62694; B 4576; BRN 2179006; Benzenamine, N-(cyclopropylmethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)-; CGA 10832; Caswell No. 271BB; EINECS 247-656-6; EPA Pesticide Chemical Code 106601; ER5461; GA-10832; HSDB 3923; LS-154347; N-(Cyclopropylmethyl)' 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=AI3-62694%3B+B+4576%3B+BRN+2179006%3B+Benzenamine%2C+N-%28cyclopropylmethyl%29-2%2C6-dinitro-N-propyl-4-%28trifluoromethyl%29-%3B+CGA+10832%3B+Caswell+No.+271BB%3B+EINECS+247-656-6%3B+EPA+Pesticide+Chemical+Code+106601%3B+ER5461%3B+GA-10832%3B+HSDB+3923%3B+LS-154347%3B+N-%28Cyclopropylmethyl%29&filter.purchasability=all

Embed Link to Results

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