UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 4-[[2-chloro-4-[(Z)-(2,4-dioxothiazolidin-5-ylidene)methyl]phenoxy]methyl]benzoic 4-[[2-chloro-4-[(Z)-(2,4-dioxoth…

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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) 3.65 6.47 -60.11 1 6 -1 99 388.808 5 ↓

Analogs

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Popular Name: (5Z)-5-[[4-[(4-iodophenyl)methoxy]-3-methoxy-phenyl]methylene]thiazolidine-2,4-dione (5Z)-5-[[4-[(4-iodophenyl)methox…

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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) 3.81 7.39 -11.69 1 5 0 68 467.284 5 ↓

Analogs

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Popular Name: 5-{3-allyl-4-[(2,4-dichlorobenzyl)oxy]-5-ethoxybenzylidene}-3-(2-propynyl)-1,3-thiazolidine-2,4-dione 5-{3-allyl-4-[(2,4-dichlorobenzy…

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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) 5.56 3.24 -9.4 0 5 0 57 502.419 9 ↓

Analogs

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Popular Name: 5-{3-chloro-4-[(2,4-dichlorobenzyl)oxy]-5-methoxybenzylidene}-3-(2-propynyl)-1,3-thiazolidine-2,4-dione 5-{3-chloro-4-[(2,4-dichlorobenz…

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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) 5.04 2.13 -11.24 0 5 0 57 482.772 6 ↓

Analogs

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Popular Name: 4-[(4-{[2,4-dioxo-3-(2-propynyl)-1,3-thiazolidin-5-ylidene]methyl}-2-ethoxy-6-iodophenoxy)methyl]benzoic acid 4-[(4-{[2,4-dioxo-3-(2-propynyl)…

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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) 4.45 1.31 -57.89 0 7 -1 97 562.361 8 ↓

Analogs

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Popular Name: 3-[(4-{[2,4-dioxo-3-(2-propynyl)-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)methyl]benzoic acid 3-[(4-{[2,4-dioxo-3-(2-propynyl)…

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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) 2.84 1.95 -62.98 0 7 -1 97 422.438 7 ↓

Analogs

2813140
2813140
4754634
4754634
8821673
8821673
8821674
8821674
8821675
8821675

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Popular Name: (5Z)-5-[4-(2,4-dichlorobenzyl)oxy-3-ethoxy-benzylidene]-3-propyl-thiazolidine-2,4-quinone (5Z)-5-[4-(2,4-dichlorobenzyl)ox…

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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) 5.33 12.07 -8.35 0 5 0 58 466.386 8 ↓

Analogs

9258972
9258972
15012939
15012939

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Popular Name: 3-[[2-chloro-4-[(E)-(2,4-diketo-3-propargyl-thiazolidin-5-ylidene)methyl]-6-ethoxy-phenoxy]methyl]be 3-[[2-chloro-4-[(E)-(2,4-diketo-…

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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) 4.02 1.95 -61.44 0 7 -1 97 470.91 8 ↓

Analogs

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Popular Name: 4-[[4-[(3-ethyl-2,4-dioxo-thiazolidin-5-ylidene)methyl]-2-methoxy-phenoxy]methyl]benzoic 4-[[4-[(3-ethyl-2,4-dioxo-thiazo…

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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) 3.08 1.08 -58 0 7 -1 97 412.443 7 ↓

Analogs

15012758
15012758

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Popular Name: 3-prop-2-ynyl-5-[[4-(p-tolylmethoxy)phenyl]methylene]thiazolidine-2,4-dione 3-prop-2-ynyl-5-[[4-(p-tolylmeth…

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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) 3.81 2.36 -10.83 0 4 0 48 363.438 5 ↓

Parameters Provided:

ring.id = 147106
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 = 147106 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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