UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 5-(3-cyclohexylpropanoylamino)pyridine-3-carboxylic 5-(3-cyclohexylpropanoylamino)py…

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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) 2.61 6.94 -57.1 1 5 -1 82 275.328 5 ↓

Analogs

42167013
42167013
42167015
42167015
37028637
37028637
37028638
37028638
37028655
37028655

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Popular Name: 3-cyclohexyl-N-[2-(dimethylamino)-3-pyridyl]propanamide 3-cyclohexyl-N-[2-(dimethylamino…

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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) 3.28 8.11 -8.59 1 4 0 45 275.396 5 ↓
Mid Mid (pH 6-8) 3.28 8.56 -31.24 2 4 1 46 276.404 5 ↓

Parameters Provided:

ring.id = 315472
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 = 315472 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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