ZINC 12

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
UR2R-1-E	Urotensin II Receptor (cluster #1 Of 1), Eukaryotic	Eukaryotes	41	0.33	Binding ≤ 10μM
UTS2-1-E	Urotensin-2 (cluster #1 Of 1), Eukaryotic	Eukaryotes	4	0.38	Binding ≤ 10μM
UR2R-1-E	Urotensin II Receptor (cluster #1 Of 1), Eukaryotic	Eukaryotes	320	0.29	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.78	8.67	-83.18	5	6	2	80	420.557	6	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.96	5.02	-20.94	3	6	0	81	418.541	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.96	8.19	-89.57	5	6	2	84	420.557	5	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

annotation.name = UTS2_MACMU
anotation.type = B10
page.format = summary
page.num = 1
filter.purchasability = purchasable

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 note AS n ON ci.sub_id_fk=n.sub_id_fk INNER JOIN annotation AS a ON n.anno_id_fk=a.anno_id  WHERE c.free = 1 AND a.short_desc LIKE 'UTS2\\_MACMU' AND c.purchasable IN (1,2,4,5)    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?annotation.name=UTS2_MACMU&filter.purchasability=purchasable

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', {
        "annotation.name": "UTS2_MACMU"        

    });
</script>