UCSF
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Popular Name: 2-[4-[2-(trifluoromethyl)phenoxy]-1-piperidyl]thiazole-4-carboxamide 2-[4-[2-(trifluoromethyl)phenoxy…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
ACOD-1-E Acyl-CoA Desaturase (cluster #1 Of 1), Eukaryotic Eukaryotes 6523 0.29 Binding ≤ 10μM
ACOD1-1-E Acyl-CoA Desaturase 1 (cluster #1 Of 1), Eukaryotic Eukaryotes 676 0.35 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
ACOD1_RAT P07308 Acyl-CoA Desaturase 1, Rat 676 0.35 Binding ≤ 1μM
ACOD_HUMAN O00767 Acyl-CoA Desaturase, Human 6523 0.29 Binding ≤ 10μM
ACOD1_RAT P07308 Acyl-CoA Desaturase 1, Rat 676 0.35 Binding ≤ 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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.34 5.87 -12.79 2 5 0 68 371.384 5 ↓

Parameters Provided:

ring.id = 578185
filter.purchasability = annotated
page.format = targets
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 hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 578185 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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