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)

• 1587812
• 1851039

Parameters Provided:

name.synonym = 1-(Hydroxymethyl)propylamine; 1-Butanol, 2-amino-; 1-Hydroxy-2-butylamine; 2-Amino-1-butanol; 2-Amino-1-hydroxybutane; 2-Amino-n-butyl alcohol; 2-Aminobutan-1-ol; 2-Aminobutanol; 2-Aminobutyl alcohol; AI3-03357; BRN 1098274; Butanol-2-amine; EINECS 202-48
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-(Hydroxymethyl)propylamine; 1-Butanol, 2-amino-; 1-Hydroxy-2-butylamine; 2-Amino-1-butanol; 2-Amino-1-hydroxybutane; 2-Amino-n-butyl alcohol; 2-Aminobutan-1-ol; 2-Aminobutanol; 2-Aminobutyl alcohol; AI3-03357; BRN 1098274; Butanol-2-amine; EINECS 202-48' 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-%28Hydroxymethyl%29propylamine%3B+1-Butanol%2C+2-amino-%3B+1-Hydroxy-2-butylamine%3B+2-Amino-1-butanol%3B+2-Amino-1-hydroxybutane%3B+2-Amino-n-butyl+alcohol%3B+2-Aminobutan-1-ol%3B+2-Aminobutanol%3B+2-Aminobutyl+alcohol%3B+AI3-03357%3B+BRN+1098274%3B+Butanol-2-amine%3B+EINECS+202-48&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-(Hydroxymethyl)propylamine; 1-Butanol, 2-amino-; 1-Hydroxy-2-butylamine; 2-Amino-1-butanol; 2-Amino-1-hydroxybutane; 2-Amino-n-butyl alcohol; 2-Aminobutan-1-ol; 2-Aminobutanol; 2-Aminobutyl alcohol; AI3-03357; BRN 1098274; Butanol-2-amine; EINECS 202-48" }); </script>