UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-[2-(8-methoxy-2-quinolyl)imidazol-1-yl]-N,N-dimethyl-ethanamine 2-[2-(8-methoxy-2-quinolyl)imida…

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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) 2.25 8.3 -52.5 1 5 1 44 297.382 5 ↓
Hi High (pH 8-9.5) 2.25 6.61 -10.17 0 5 0 43 296.374 5 ↓

Analogs

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Popular Name: 6-ethoxy-2-[1-(2-methoxyethyl)imidazol-2-yl]quinoline 6-ethoxy-2-[1-(2-methoxyethyl)im…

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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) 2.60 7.7 -8.81 0 5 0 49 297.358 6 ↓
Lo Low (pH 4.5-6) 2.60 8.12 -32.4 1 5 1 50 298.366 6 ↓

Analogs

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Popular Name: 8-chloro-2-(1H-imidazol-2-yl)quinoline 8-chloro-2-(1H-imidazol-2-yl)qui…

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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) 2.77 5.92 -9.84 1 3 0 42 229.67 1 ↓
Lo Low (pH 4.5-6) 2.77 6.41 -33.79 2 3 1 43 230.678 1 ↓

Parameters Provided:

ring.id = 526959
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 = 526959 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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