UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

4790590
4790590
9597541
9597541
9673477
9673477
20237113
20237113
3907212
3907212

Draw Identity 99% 90% 80% 70%

Popular Name: 6-(2,4-dioxo-9-thia-3,5-diazabicyclo[4.3.0]nona-7,10-dien-3-yl)-N-(4-ethoxyphenyl)-hexanamide 6-(2,4-dioxo-9-thia-3,5-diazabic…

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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) 3.24 -2.17 -19.88 2 7 0 93 401.488 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-(2,4-dioxo-9-thia-3,5-diazabicyclo[4.3.0]nona-7,10-dien-3-yl)-N-(4-fluorophenyl)-hexanamide 6-(2,4-dioxo-9-thia-3,5-diazabic…

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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) 2.98 -1.44 -19.24 2 6 0 83 375.425 7 ↓

Parameters Provided:

ring.id = 246952
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 = 246952 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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