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Popular Name: N-[2-[4-(cyclohexanecarbonylamino)phenyl]-1H-benzimidazol-5-yl]cyclohexanecarboxamide N-[2-[4-(cyclohexanecarbonylamin…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z101913-1-O Modoc Virus (cluster #1 Of 1), Other Other 50 0.31 Functional ≤ 10μM
Z102079-1-O Simian Virus 40 (cluster #1 Of 1), Other Other 1000 0.25 Functional ≤ 10μM
Z50515-1-O Human Herpesvirus 2 (cluster #1 Of 2), Other Other 170 0.29 Functional ≤ 10μM
Z50600-1-O Vaccinia Virus (cluster #1 Of 2), Other Other 200 0.28 Functional ≤ 10μM
Z50645-1-O Murine Hepatitis Virus (cluster #1 Of 1), Other Other 20 0.33 Functional ≤ 10μM
Z50651-1-O Vesicular Stomatitis Virus (cluster #1 Of 2), Other Other 1000 0.25 Functional ≤ 10μM
Z50665-1-O Enterovirus (cluster #1 Of 1), Other Other 160 0.29 Functional ≤ 10μM
Z50795-1-O San Angelo Virus (cluster #1 Of 1), Other Other 200 0.28 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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.46 11.57 -17.57 3 6 0 87 444.579 5 ↓
Lo Low (pH 4.5-6) 6.46 12 -36.98 4 6 1 88 445.587 5 ↓

Parameters Provided:

target.name = Z101913-1-O
target.type = F10
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 activity AS ac ON ci.sub_id_fk=ac.sub_id_fk INNER JOIN target AS t ON ac.target_fk=t.target_id  WHERE c.free = 1 AND t.code LIKE 'Z101913-1-O' AND t.atype_fk = 5 AND c.purchasable IN (1,2,4,5)    LIMIT 50

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//zinc12.docking.org/results/combination?target.name=Z101913-1-O&target.type=F10&filter.purchasability=purchasable

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