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)

• 1648223

Parameters Provided:

name.synonym = (1-methylethyl)-Benzene;(1-Methylethyl)benzene;(1-methylethyl)benzene (cumene);(methylethyl)benzene;(propan-2-yl)benzene;1-Methylethyl-Benzene;1-Methylethylbenzene, 9CI;2-Fenilpropano;2-Fenyl-propaan;2-Phenyl-Propane;2-Phenylpropane;Benzene, (1-methylethy
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-methylethyl)-Benzene;(1-Methylethyl)benzene;(1-methylethyl)benzene (cumene);(methylethyl)benzene;(propan-2-yl)benzene;1-Methylethyl-Benzene;1-Methylethylbenzene, 9CI;2-Fenilpropano;2-Fenyl-propaan;2-Phenyl-Propane;2-Phenylpropane;Benzene, (1-methylethy' 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

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//zinc12.docking.org/results/combination?name.synonym=%281-methylethyl%29-Benzene%3B%281-Methylethyl%29benzene%3B%281-methylethyl%29benzene+%28cumene%29%3B%28methylethyl%29benzene%3B%28propan-2-yl%29benzene%3B1-Methylethyl-Benzene%3B1-Methylethylbenzene%2C+9CI%3B2-Fenilpropano%3B2-Fenyl-propaan%3B2-Phenyl-Propane%3B2-Phenylpropane%3BBenzene%2C+%281-methylethy&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-methylethyl)-Benzene;(1-Methylethyl)benzene;(1-methylethyl)benzene (cumene);(methylethyl)benzene;(propan-2-yl)benzene;1-Methylethyl-Benzene;1-Methylethylbenzene, 9CI;2-Fenilpropano;2-Fenyl-propaan;2-Phenyl-Propane;2-Phenylpropane;Benzene, (1-methylethy" }); </script>