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)

• 2164694
• 2164695

Parameters Provided:

name.synonym = 2-Methyl-3-(p-isopropylphenyl)propionaldehyde; 2-methyl-3-(p-isopropylphenyl) propionaldehyde; 3-(4-Isopropylphenyl)-2-methylpropanal; 3-(p-Isopropylphenyl)-2-methylpropionaldehyde; 3-p-Cumenyl-2-methylpropionaldehyde; 4-Isopropyl-alpha-methylhydrocinnami
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 '2-Methyl-3-(p-isopropylphenyl)propionaldehyde; 2-methyl-3-(p-isopropylphenyl) propionaldehyde; 3-(4-Isopropylphenyl)-2-methylpropanal; 3-(p-Isopropylphenyl)-2-methylpropionaldehyde; 3-p-Cumenyl-2-methylpropionaldehyde; 4-Isopropyl-alpha-methylhydrocinnami' 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=2-Methyl-3-%28p-isopropylphenyl%29propionaldehyde%3B+2-methyl-3-%28p-isopropylphenyl%29+propionaldehyde%3B+3-%284-Isopropylphenyl%29-2-methylpropanal%3B+3-%28p-Isopropylphenyl%29-2-methylpropionaldehyde%3B+3-p-Cumenyl-2-methylpropionaldehyde%3B+4-Isopropyl-alpha-methylhydrocinnami&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": "2-Methyl-3-(p-isopropylphenyl)propionaldehyde; 2-methyl-3-(p-isopropylphenyl) propionaldehyde; 3-(4-Isopropylphenyl)-2-methylpropanal; 3-(p-Isopropylphenyl)-2-methylpropionaldehyde; 3-p-Cumenyl-2-methylpropionaldehyde; 4-Isopropyl-alpha-methylhydrocinnami" }); </script>