UCSF
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Analogs

38634162
38634162

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Popular Name: 4-(benzenesulfonyl)-N-(1,3-benzodioxol-5-yl)-1-oxa-4,8-diazaspiro[4.5]decane-8-carboxamide 4-(benzenesulfonyl)-N-(1,3-benzo…

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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) 2.81 4.54 -15.82 1 9 0 97 445.497 3 ↓

Analogs

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Popular Name: N-(1,3-benzodioxol-5-yl)-4-(4-fluorophenyl)sulfonyl-1-oxa-4,8-diazaspiro[4.5]decane-8-carboxamide N-(1,3-benzodioxol-5-yl)-4-(4-fl…

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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 4.6 -15.47 1 9 0 97 463.487 3 ↓

Analogs

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Popular Name: N-(1,3-benzodioxol-5-yl)-4-(4-chlorophenyl)sulfonyl-1-oxa-4,8-diazaspiro[4.5]decane-8-carboxamide N-(1,3-benzodioxol-5-yl)-4-(4-ch…

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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) 3.49 5.06 -15.15 1 9 0 97 479.942 3 ↓

Parameters Provided:

ring.id = 590599
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 = 590599 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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