ZINC 12

User Information

Page Size:

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)

• 2041132
• 2041133

Parameters Provided:

name.synonym = 1-Amino-2-ethylhexan [Czech]; 1-Hexanamine, 2-ethyl-; 2-ETHYLHEXYLAMINE; 2-Ethyl hexylamine; 2-Ethylhexanamine; 2-Ethylhexylamine [UN2276] [Flammable liquid]; AI3-26287; BRN 1209249; CCRIS 4646; EINECS 203-233-8; Hexylamine, 2-ethyl-; LS-379; UN2276; beta
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 '1-Amino-2-ethylhexan [Czech]; 1-Hexanamine, 2-ethyl-; 2-ETHYLHEXYLAMINE; 2-Ethyl hexylamine; 2-Ethylhexanamine; 2-Ethylhexylamine [UN2276] [Flammable liquid]; AI3-26287; BRN 1209249; CCRIS 4646; EINECS 203-233-8; Hexylamine, 2-ethyl-; LS-379; UN2276; beta' 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=1-Amino-2-ethylhexan+%5BCzech%5D%3B+1-Hexanamine%2C+2-ethyl-%3B+2-ETHYLHEXYLAMINE%3B+2-Ethyl+hexylamine%3B+2-Ethylhexanamine%3B+2-Ethylhexylamine+%5BUN2276%5D+%5BFlammable+liquid%5D%3B+AI3-26287%3B+BRN+1209249%3B+CCRIS+4646%3B+EINECS+203-233-8%3B+Hexylamine%2C+2-ethyl-%3B+LS-379%3B+UN2276%3B+beta&filter.purchasability=all

Embed Link to Results

<div id="zinc-link"></div> <script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script> <script type="text/javascript"> window.zinc.embed('zinc-link', { "name.synonym": "1-Amino-2-ethylhexan [Czech]; 1-Hexanamine, 2-ethyl-; 2-ETHYLHEXYLAMINE; 2-Ethyl hexylamine; 2-Ethylhexanamine; 2-Ethylhexylamine [UN2276] [Flammable liquid]; AI3-26287; BRN 1209249; CCRIS 4646; EINECS 203-233-8; Hexylamine, 2-ethyl-; LS-379; UN2276; beta" }); </script>