UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

14229542
14229542
25155598
25155598

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Popular Name: 6-(2,5-dimethyl-3-thienyl)-1-isopropyl-N-[(1R)-2-methoxy-1-methyl-ethyl]pyrazolo[5,4-b]pyridine-4-ca 6-(2,5-dimethyl-3-thienyl)-1-iso…

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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) 2.89 8.9 -10.08 1 6 0 69 386.521 6 ↓

Analogs

25155598
25155598
14229539
14229539

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Popular Name: 6-(2,5-dimethyl-3-thienyl)-1-isopropyl-N-[(1S)-2-methoxy-1-methyl-ethyl]pyrazolo[5,4-b]pyridine-4-ca 6-(2,5-dimethyl-3-thienyl)-1-iso…

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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) 2.89 8.9 -10.09 1 6 0 69 386.521 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-(2,5-dimethyl-3-thienyl)-N,1-diisopropyl-pyrazolo[5,4-b]pyridine-4-carboxamide 6-(2,5-dimethyl-3-thienyl)-N,1-d…

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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) 3.25 9.69 -10.95 1 5 0 60 356.495 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-(2,5-dimethyl-3-thienyl)-1-isopropyl-N-(2-methoxyethyl)pyrazolo[5,4-b]pyridine-4-carboxamide 6-(2,5-dimethyl-3-thienyl)-1-iso…

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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) 2.56 7.96 -11.2 1 6 0 69 372.494 6 ↓

Parameters Provided:

ring.id = 154889
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 = 154889 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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