UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

1390594
1390594
1390595
1390595

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Popular Name: 2-[(5R)-5-benzyl-2,4-dioxo-thiazolidin-3-yl]acetic 2-[(5R)-5-benzyl-2,4-dioxo-thiaz…

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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) 0.04 6.95 -47.31 0 5 -1 78 264.282 4 ↓

Analogs

1390594
1390594
1390595
1390595

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Popular Name: 2-[(5S)-5-benzyl-2,4-dioxo-thiazolidin-3-yl]acetic 2-[(5S)-5-benzyl-2,4-dioxo-thiaz…

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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) 0.04 6.95 -47.68 0 5 -1 78 264.282 4 ↓

Analogs

36636016
36636016
6506143
6506143
6506154
6506154

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Popular Name: (5R)-3-(3-aminopropyl)-5-[(4-fluorophenyl)methyl]thiazolidine-2,4-dione (5R)-3-(3-aminopropyl)-5-[(4-flu…

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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) 0.95 4.85 -47.87 3 4 1 65 283.348 5 ↓

Analogs

36636015
36636015
6506143
6506143

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Popular Name: (5S)-3-(3-aminopropyl)-5-[(4-fluorophenyl)methyl]thiazolidine-2,4-dione (5S)-3-(3-aminopropyl)-5-[(4-flu…

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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) 0.95 4.85 -48.53 3 4 1 65 283.348 5 ↓

Analogs

36636018
36636018

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Popular Name: (5R)-3-(3-aminopropyl)-5-[(4-chlorophenyl)methyl]thiazolidine-2,4-dione (5R)-3-(3-aminopropyl)-5-[(4-chl…

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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) 1.46 5.31 -47.11 3 4 1 65 299.803 5 ↓

Analogs

36636017
36636017

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Popular Name: (5S)-3-(3-aminopropyl)-5-[(4-chlorophenyl)methyl]thiazolidine-2,4-dione (5S)-3-(3-aminopropyl)-5-[(4-chl…

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) 1.46 5.31 -47.69 3 4 1 65 299.803 5 ↓

Parameters Provided:

ring.id = 101525
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 = 101525 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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