UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

33921156
33921156
39862623
39862623
39862693
39862693
39863530
39863530
39863532
39863532

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Popular Name: 5-{[5-(2-chlorophenyl)-2-furyl]methylene}-3-(4-ethylphenyl)-2-[(4-ethylphenyl)imino]-1,3-thiazolidin-4-one 5-{[5-(2-chlorophenyl)-2-furyl]m…

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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) 9.62 2.9 -14.1 0 4 0 47 513.062 6 ↓

Analogs

40147421
40147421

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Popular Name: 3-(3,4-dimethylphenyl)-2-[(3,4-dimethylphenyl)imino]-5-{[5-(4-fluorophenyl)-2-furyl]methylene}-1,3-thiazolidin-4-one 3-(3,4-dimethylphenyl)-2-[(3,4-d…

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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) 9.19 4.05 -14.31 0 4 0 47 496.607 4 ↓

Analogs

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Popular Name: 3-(3,5-dimethylphenyl)-2-[(3,5-dimethylphenyl)imino]-5-{[5-(4-fluorophenyl)-2-furyl]methylene}-1,3-thiazolidin-4-one 3-(3,5-dimethylphenyl)-2-[(3,5-d…

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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) 9.40 4.11 -14.3 0 4 0 47 496.607 4 ↓

Analogs

39862627
39862627
39863534
39863534
39864972
39864972
40147421
40147421
40147438
40147438

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Popular Name: 5-{[5-(4-bromophenyl)-2-furyl]methylene}-3-(4-methylphenyl)-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one 5-{[5-(4-bromophenyl)-2-furyl]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) 8.87 1.97 -13.08 0 4 0 47 529.459 4 ↓

Analogs

33905956
33905956
39863530
39863530
39863532
39863532
39863600
39863600
39864023
39864023

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Popular Name: 5-{[5-(2-chlorophenyl)-2-furyl]methylene}-3-(3-methylphenyl)-2-[(3-methylphenyl)imino]-1,3-thiazolidin-4-one 5-{[5-(2-chlorophenyl)-2-furyl]m…

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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) 8.85 2.59 -15.14 1 0 0 47 485.008 4 ↓

Analogs

39862627
39862627
39863534
39863534
39864972
39864972

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Popular Name: 5-{[5-(4-bromophenyl)-2-furyl]methylene}-3-(3-methylphenyl)-2-[(3-methylphenyl)imino]-1,3-thiazolidin-4-one 5-{[5-(4-bromophenyl)-2-furyl]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) 9.03 1.97 -13.45 2 0 0 47 529.459 4 ↓

Analogs

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Popular Name: 4-[5-[(Z)-[(2E)-3-(o-tolyl)-2-(o-tolylimino)-4-oxo-thiazolidin-5-ylidene]methyl]-2-furyl]benzoic 4-[5-[(Z)-[(2E)-3-(o-tolyl)-2-(o…

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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) 8.08 15.85 -58.55 0 6 -1 88 493.564 5 ↓
Lo Low (pH 4.5-6) 8.08 16.31 -58.89 1 6 0 89 494.572 5 ↓

Parameters Provided:

ring.id = 230549
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 = 230549 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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