UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 3-[(5-amino-2-chloro-phenyl)methyl]thiazolidine-2,4-dione 3-[(5-amino-2-chloro-phenyl)meth…

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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) 1.00 3.49 -7.09 2 4 0 63 256.714 2 ↓

Analogs

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Popular Name: 3-[(2-chloro-5-nitro-phenyl)methyl]thiazolidine-2,4-dione 3-[(2-chloro-5-nitro-phenyl)meth…

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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) 1.88 6.33 -9.35 0 6 0 83 286.696 3 ↓

Analogs

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Popular Name: 3-[(2,4-dioxothiazolidin-3-yl)methyl]-N-[(1S)-1,2,2-trimethylpropyl]benzamide 3-[(2,4-dioxothiazolidin-3-yl)me…

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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) 2.52 7.16 -14.4 1 5 0 66 334.441 5 ↓

Analogs

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Popular Name: 3-[(2,4-dioxothiazolidin-3-yl)methyl]-N-[(1R)-1,2,2-trimethylpropyl]benzamide 3-[(2,4-dioxothiazolidin-3-yl)me…

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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) 2.52 7.16 -14.37 1 5 0 66 334.441 5 ↓

Parameters Provided:

ring.id = 16271
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 = 16271 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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