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)

• 19419101
• 19419103

Parameters Provided:

name.synonym = 1-Piperidineacetonitrile, alpha-phenyl-; 2-Phenyl-2-piperidinoacetonitrile; AI3-02750; Acetonitrile, 2-phenyl-2-piperidino-; BRN 0168026; EINECS 227-291-9; LS-13306; NSC 15446; USAF A-2217; alpha-(1-Piperidyl)-alpha-tolunitrile; alpha-Phenyl-alpha-(1-pipe
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-Piperidineacetonitrile, alpha-phenyl-; 2-Phenyl-2-piperidinoacetonitrile; AI3-02750; Acetonitrile, 2-phenyl-2-piperidino-; BRN 0168026; EINECS 227-291-9; LS-13306; NSC 15446; USAF A-2217; alpha-(1-Piperidyl)-alpha-tolunitrile; alpha-Phenyl-alpha-(1-pipe' 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-Piperidineacetonitrile%2C+alpha-phenyl-%3B+2-Phenyl-2-piperidinoacetonitrile%3B+AI3-02750%3B+Acetonitrile%2C+2-phenyl-2-piperidino-%3B+BRN+0168026%3B+EINECS+227-291-9%3B+LS-13306%3B+NSC+15446%3B+USAF+A-2217%3B+alpha-%281-Piperidyl%29-alpha-tolunitrile%3B+alpha-Phenyl-alpha-%281-pipe&filter.purchasability=all

Embed Link to Results

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