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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

12032383
12032383

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Popular Name: N'-[4-[(5E)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]-2-methyl-benzohyd N'-[4-[(5E)-5-[(4-ethylphenyl)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) 3.65 12.01 -15.62 2 6 0 80 467.616 8 ↓

Analogs

12032384
12032384

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Popular Name: N'-[4-[(5E)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]-3-nitro-benzohydr N'-[4-[(5E)-5-[(4-ethylphenyl)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) 3.18 12.03 -20.86 2 9 0 126 498.586 9 ↓

Analogs

13773923
13773923
8764028
8764028
8951766
8951766

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Popular Name: N'-[4-[(5E)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]benzohydrazide N'-[4-[(5E)-5-[(4-ethylphenyl)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) 3.25 -3.73 -16.19 2 6 0 80 453.589 8 ↓

Analogs

8951773
8951773

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Popular Name: N'-[4-[(5E)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]-4-nitro-benzohydr N'-[4-[(5E)-5-[(4-ethylphenyl)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) 3.21 -3.21 -17.64 2 9 0 126 498.586 9 ↓

Analogs

35638307
35638307

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Popular Name: N'-[4-[(5Z)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]-2-methyl-benzohyd N'-[4-[(5Z)-5-[(4-ethylphenyl)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) 3.65 -3.25 -15.5 2 6 0 80 467.616 8 ↓

Analogs

35638309
35638309

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Popular Name: N'-[4-[(5Z)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]-3-nitro-benzohydr N'-[4-[(5Z)-5-[(4-ethylphenyl)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) 3.18 -2.96 -21.18 2 9 0 126 498.586 9 ↓

Analogs

13800397
13800397
2251522
2251522
8766309
8766309

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Popular Name: N'-[4-[(5E)-4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]butanoyl]benzohydrazide N'-[4-[(5E)-4-oxo-5-(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) 2.78 -3.89 -16.39 2 6 0 80 439.562 7 ↓

Analogs

8766310
8766310

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Popular Name: 4-hydroxy-N'-[4-[(5E)-4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]butanoyl]benzohydrazide 4-hydroxy-N'-[4-[(5E)-4-oxo-5-(p…

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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) 2.30 -5.82 -17.33 3 7 0 100 455.561 7 ↓

Analogs

8766311
8766311

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Popular Name: 2-methoxy-N'-[4-[(5E)-4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]butanoyl]benzohydrazide 2-methoxy-N'-[4-[(5E)-4-oxo-5-(p…

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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) 3.34 -3.16 -19.23 2 7 0 89 469.588 8 ↓

Analogs

8766312
8766312

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Popular Name: 4-bromo-N'-[4-[(5E)-4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]butanoyl]benzohydrazide 4-bromo-N'-[4-[(5E)-4-oxo-5-(p-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) 3.59 -4.64 -15.19 2 6 0 80 518.458 7 ↓

Analogs

8766313
8766313

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Popular Name: 4-fluoro-N'-[4-[(5E)-4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]butanoyl]benzohydrazide 4-fluoro-N'-[4-[(5E)-4-oxo-5-(p-…

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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) 2.95 -3.15 -15.55 2 6 0 80 457.552 7 ↓

Analogs

8766314
8766314

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Popular Name: 4-nitro-N'-[4-[(5E)-4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]butanoyl]benzohydrazide 4-nitro-N'-[4-[(5E)-4-oxo-5-(p-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) 2.74 -3.36 -17.88 2 9 0 126 484.559 8 ↓

Analogs

8911491
8911491

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Popular Name: N'-[4-[(5Z)-5-[(2-chlorophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]-3-nitro-benzohyd N'-[4-[(5Z)-5-[(2-chlorophenyl)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) 2.90 10.67 -20.48 2 9 0 126 504.977 8 ↓

Analogs

3913878
3913878

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Popular Name: N'-[4-[(5E)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]-3-hydroxy-benzohy N'-[4-[(5E)-5-[(4-ethylphenyl)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) 2.74 8.47 -17.84 3 7 0 100 469.588 8 ↓

Analogs

3913877
3913877

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Popular Name: N'-[4-[(5E)-5-[(4-ethylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoyl]-2-hydroxy-benzohy N'-[4-[(5E)-5-[(4-ethylphenyl)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) 3.74 9.87 -17.91 3 7 0 100 469.588 8 ↓

Parameters Provided:

ring.id = 20927
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 = 20927 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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