UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (4R)-N-isobutyl-3-(2-thienylsulfonyl)thiazolidine-4-carboxamide (4R)-N-isobutyl-3-(2-thienylsulf…

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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) 1.79 3.61 -17.11 1 5 0 66 334.488 5 ↓

Analogs

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Popular Name: (4S)-N-isobutyl-3-(2-thienylsulfonyl)thiazolidine-4-carboxamide (4S)-N-isobutyl-3-(2-thienylsulf…

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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) 1.79 4.39 -19.19 1 5 0 66 334.488 5 ↓

Analogs

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Popular Name: (4R)-3-[[5-(acetamidomethyl)-2-thienyl]sulfonyl]-N,N-diethyl-thiazolidine-4-carboxamide (4R)-3-[[5-(acetamidomethyl)-2-t…

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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) 0.82 3.51 -15.19 1 7 0 87 405.567 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-3-[[5-(acetamidomethyl)-2-thienyl]sulfonyl]-N,N-diethyl-thiazolidine-4-carboxamide (4S)-3-[[5-(acetamidomethyl)-2-t…

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) 0.82 4.31 -21.95 1 7 0 87 405.567 7 ↓

Parameters Provided:

ring.id = 285153
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 = 285153 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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