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)

You've reached a desolate place

If you believe there should have been a result, please tell us what you think is missing. (Vendor ID, Compound ID, URL to where we can find the molecule on line). Thanks!

Parameters Provided:

name.synonym = ( -)-2-Cyano-1-(4-pyridyl)-3-(1,2,2-trimethylpropyl)guanidine monohydrate; C13H19N5; Guanidine, N''-cyano-N-4-pyridinyl-N'-(1,2,2-trimethylpropyl)-, monohydrate, ( -)-; Guanidine, N''-cyano-N-4-pyridinyl-N'-(1,2,2-trimethylpropylmonohydrate), ( -)-; Guani
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-Cyano-1-(4-pyridyl)-3-(1,2,2-trimethylpropyl)guanidine monohydrate; C13H19N5; Guanidine, N\'\'-cyano-N-4-pyridinyl-N\'-(1,2,2-trimethylpropyl)-, monohydrate, ( -)-; Guanidine, N\'\'-cyano-N-4-pyridinyl-N\'-(1,2,2-trimethylpropylmonohydrate), ( -)-; Guani' 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=%28+-%29-2-Cyano-1-%284-pyridyl%29-3-%281%2C2%2C2-trimethylpropyl%29guanidine+monohydrate%3B+C13H19N5%3B+Guanidine%2C+N%27%27-cyano-N-4-pyridinyl-N%27-%281%2C2%2C2-trimethylpropyl%29-%2C+monohydrate%2C+%28+-%29-%3B+Guanidine%2C+N%27%27-cyano-N-4-pyridinyl-N%27-%281%2C2%2C2-trimethylpropylmonohydrate%29%2C+%28+-%29-%3B+Guani&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-Cyano-1-(4-pyridyl)-3-(1,2,2-trimethylpropyl)guanidine monohydrate; C13H19N5; Guanidine, N\'\'-cyano-N-4-pyridinyl-N\'-(1,2,2-trimethylpropyl)-, monohydrate, ( -)-; Guanidine, N\'\'-cyano-N-4-pyridinyl-N\'-(1,2,2-trimethylpropylmonohydrate), ( -)-; Guani" }); </script>