UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

14246542
14246542
14246543
14246543
14246544
14246544

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Popular Name: N-[(2R,4aS,8aR)-decalin-2-yl]-2-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]acetamide N-[(2R,4aS,8aR)-decalin-2-yl]-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) 2.79 5.78 -18.44 2 7 0 96 433.574 6 ↓

Analogs

14246543
14246543
14246544
14246544
14246541
14246541

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,4aS,8aR)-decalin-2-yl]-2-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]acetamide N-[(2S,4aS,8aR)-decalin-2-yl]-2-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.79 5.78 -18.55 2 7 0 96 433.574 6 ↓

Analogs

14246544
14246544
14246541
14246541
14246542
14246542

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R,4aR,8aR)-decalin-2-yl]-2-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]acetamide N-[(2R,4aR,8aR)-decalin-2-yl]-2-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.79 6.13 -18.59 2 7 0 96 433.574 6 ↓

Analogs

14246541
14246541
14246542
14246542

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S,4aR,8aR)-decalin-2-yl]-2-[[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]acetamide N-[(2S,4aR,8aR)-decalin-2-yl]-2-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 2.79 6.54 -17.81 2 7 0 96 433.574 6 ↓

Parameters Provided:

ring.id = 239344
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 = 239344 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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