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

Analogs

26787050
26787050
4167588
4167588

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Popular Name: 4-chloro-N-(4-oxocyclohexa-2,5-dien-1-ylidene)-N'-(p-tolylsulfonyl)benzamidine 4-chloro-N-(4-oxocyclohexa-2,5-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) 4.15 8.94 -13.32 0 5 0 76 398.871 4 ↓

Analogs

16779794
16779794

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Popular Name: (NE)-N'-(benzenesulfonyl)-N-(2-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)benzamidine (NE)-N'-(benzenesulfonyl)-N-(2-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) 3.40 -1.93 -14.73 0 5 0 76 364.426 4 ↓

Analogs

16779794
16779794

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Popular Name: (NE)-N'-(benzenesulfonyl)-N-(2,3-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)benzamidine (NE)-N'-(benzenesulfonyl)-N-(2,3…

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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) 3.77 9.14 -15.33 0 5 0 76 378.453 4 ↓
Mid Mid (pH 6-8) 3.77 9.2 -38.57 1 5 1 78 379.461 4 ↓

Analogs

16809837
16809837

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Popular Name: (NE)-N'-(4-bromophenyl)sulfonyl-N-(2,3-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)benzamidine (NE)-N'-(4-bromophenyl)sulfonyl-…

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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) 4.58 9.76 -12.84 0 5 0 76 457.349 4 ↓
Mid Mid (pH 6-8) 4.58 9.82 -38.41 1 5 1 78 458.357 4 ↓

Analogs

16779882
16779882
34561136
34561136

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Popular Name: 4-methyl-N-[(4-oxo-1-cyclohexa-2,5-dienylidene)amino-phenyl-methylene]-benzenesulfonamide 4-methyl-N-[(4-oxo-1-cyclohexa-2…

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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) 3.47 8.2 -15.21 0 5 0 76 364.426 4 ↓
Lo Low (pH 4.5-6) 3.47 9.16 -40.6 1 5 1 78 365.434 4 ↓

Analogs

6145963
6145963
16779794
16779794

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Popular Name: N-[(2,6-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino-phenyl-methylene]benzenesulfonamide N-[(2,6-dimethyl-4-oxo-1-cyclohe…

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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) 3.77 8.34 -14.15 0 5 0 76 378.453 4 ↓
Mid Mid (pH 6-8) 3.77 8.45 -31.17 1 5 1 78 379.461 4 ↓

Parameters Provided:

ring.id = 14335
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 = 14335 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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