UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-cyclopropyl-2-(dimethylamino)-N-methyl-thieno[2,3-d]thiazole-5-carboxamide N-cyclopropyl-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) 2.40 6.27 -11.73 0 4 0 36 281.406 3 ↓
Lo Low (pH 4.5-6) 2.40 6.67 -31.15 1 4 1 38 282.414 3 ↓

Analogs

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Popular Name: N-(cyanomethyl)-N-cyclopropyl-2-(dimethylamino)thieno[2,3-d]thiazole-5-carboxamide N-(cyanomethyl)-N-cyclopropyl-2-…

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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) 2.19 7 -15.31 0 5 0 60 306.416 4 ↓
Lo Low (pH 4.5-6) 2.19 7.36 -36.01 1 5 1 61 307.424 4 ↓

Parameters Provided:

ring.id = 341839
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 = 341839 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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