UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 6-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-5-methyl-pyridin-3-amine 6-[(4,5-dicyclopropyl-1,2,4-tria…

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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) 2.02 7.53 -16.91 2 5 0 70 287.392 4 ↓

Analogs

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Popular Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carboxylic 2-[(4,5-dicyclopropyl-1,2,4-tria…

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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) 1.52 8.77 -55.62 0 6 -1 84 301.351 5 ↓

Analogs

14855544
14855544
22420124
22420124

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Popular Name: 6-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-2-methoxy-pyridin-3-amine 6-[(4,5-dicyclopropyl-1,2,4-tria…

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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) 1.83 5.84 -15.15 2 6 0 79 303.391 5 ↓

Analogs

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Popular Name: 2-bromo-6-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]pyridine 2-bromo-6-[(4,5-dicyclopropyl-1,…

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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) 3.15 9.57 -16.72 0 4 0 44 337.246 4 ↓

Parameters Provided:

ring.id = 23093
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 = 23093 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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