UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

1213498
1213498

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Popular Name: N-(3-acetylphenyl)-2-(2-benzylideneaminoamino-4-oxo-thiazol-5-yl)-acetamide N-(3-acetylphenyl)-2-(2-benzylid…

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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) 2.09 8.28 -21.07 2 7 0 100 394.456 6 ↓
Hi High (pH 8-9.5) 2.62 7.21 -57.76 1 7 -1 102 393.448 7 ↓

Analogs

21131559
21131559
1205676
1205676

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Popular Name: N-(2-chlorophenyl)-2-[2-[(4-methoxyphenyl)methyleneaminoimino]-4-oxo-thiazolidin-5-yl]-acetamide N-(2-chlorophenyl)-2-[2-[(4-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) 2.90 -1.14 -11.64 2 7 0 92 416.89 6 ↓

Analogs

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Popular Name: 2-[(2E,5R)-2-[(E)-(3-bromo-4-hydroxy-phenyl)methylenehydrazono]-4-oxo-thiazolidin-5-yl]-N-(4-fluorop 2-[(2E,5R)-2-[(E)-(3-bromo-4-hyd…

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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) 2.89 5.7 -13.75 3 7 0 103 465.304 5 ↓
Hi High (pH 8-9.5) 2.89 6.47 -45.57 2 7 -1 106 464.296 5 ↓

Analogs

10489249
10489249

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Popular Name: N-(2,3-dichlorophenyl)-2-[(2Z,5S)-4-hydroxy-2-[(E)-(4-hydroxy-3-methoxy-phenyl)methylenehydrazono]-5 N-(2,3-dichlorophenyl)-2-[(2Z,5S…

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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) 2.81 6.05 -13.22 3 8 0 112 467.334 6 ↓

Analogs

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Popular Name: N-(2-fluorophenyl)-2-[(2Z,5S)-4-hydroxy-2-[(E)-(4-hydroxy-3-methoxy-phenyl)methylenehydrazono]-5H-th N-(2-fluorophenyl)-2-[(2Z,5S)-4-…

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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) 1.67 5.05 -13.8 3 8 0 112 416.434 6 ↓

Parameters Provided:

ring.id = 1937
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 = 1937 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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