UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (5-ethyl-4-methyl-2H-pyrazol-3-yl)-[3-(3-fluorophenyl)-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridin-5-yl (5-ethyl-4-methyl-2H-pyrazol-3-y…

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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) 2.97 7.08 -11.78 2 6 0 78 353.401 3 ↓
Ref Reference (pH 7) 2.97 7.4 -13.62 2 6 0 78 353.401 3 ↓
Mid Mid (pH 6-8) 2.97 7.44 -12.35 2 6 0 78 353.401 3 ↓

Analogs

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Popular Name: (2-ethyl-5-isobutyl-pyrazol-3-yl)-(3-phenyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)methanone (2-ethyl-5-isobutyl-pyrazol-3-yl…

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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) 3.64 9.52 -12.67 1 6 0 67 377.492 5 ↓

Parameters Provided:

ring.id = 52521
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 = 52521 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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