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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: (1S,2R)-2-(5-methyl-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1S,2R)-2-(5-methyl-1,3-benzothi…

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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) 3.53 9.32 -56.03 0 3 -1 53 274.365 2 ↓

Analogs

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Popular Name: (1S,2S)-2-(5-methyl-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1S,2S)-2-(5-methyl-1,3-benzothi…

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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) 3.53 8.99 -55.28 0 3 -1 53 274.365 2 ↓

Analogs

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Popular Name: (1R,2R)-2-(5-methyl-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1R,2R)-2-(5-methyl-1,3-benzothi…

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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) 3.53 9.06 -58.4 0 3 -1 53 274.365 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-(5-methyl-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1R,2S)-2-(5-methyl-1,3-benzothi…

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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) 3.53 8.73 -48.65 0 3 -1 53 274.365 2 ↓

Analogs

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Popular Name: (1S,2R)-2-(5-fluoro-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1S,2R)-2-(5-fluoro-1,3-benzothi…

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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) 3.24 8.73 -53.72 0 3 -1 53 278.328 2 ↓

Analogs

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Popular Name: (1S,2S)-2-(5-fluoro-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1S,2S)-2-(5-fluoro-1,3-benzothi…

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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) 3.24 8.4 -51.95 0 3 -1 53 278.328 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-(5-fluoro-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1R,2R)-2-(5-fluoro-1,3-benzothi…

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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) 3.24 8.48 -54.89 0 3 -1 53 278.328 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-(5-fluoro-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1R,2S)-2-(5-fluoro-1,3-benzothi…

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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) 3.24 8.14 -43.53 0 3 -1 53 278.328 2 ↓

Analogs

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Popular Name: (1S,2R)-2-(5-bromo-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1S,2R)-2-(5-bromo-1,3-benzothia…

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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) 3.89 9.26 -52.71 0 3 -1 53 339.234 2 ↓

Analogs

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Popular Name: (1S,2S)-2-(5-bromo-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1S,2S)-2-(5-bromo-1,3-benzothia…

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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) 3.89 8.93 -51.47 0 3 -1 53 339.234 2 ↓

Analogs

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Popular Name: (1R,2R)-2-(5-bromo-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1R,2R)-2-(5-bromo-1,3-benzothia…

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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) 3.89 9.01 -54.41 0 3 -1 53 339.234 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-(5-bromo-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1R,2S)-2-(5-bromo-1,3-benzothia…

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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) 3.89 8.67 -43.59 0 3 -1 53 339.234 2 ↓

Analogs

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Popular Name: (1S,2R)-2-(7-chloro-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1S,2R)-2-(7-chloro-1,3-benzothi…

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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) 3.73 9.17 -52.55 0 3 -1 53 294.783 2 ↓

Analogs

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Popular Name: (1S,2S)-2-(7-chloro-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1S,2S)-2-(7-chloro-1,3-benzothi…

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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) 3.73 8.72 -50.31 0 3 -1 53 294.783 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-(7-chloro-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1R,2R)-2-(7-chloro-1,3-benzothi…

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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) 3.73 8.91 -53.57 0 3 -1 53 294.783 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-(7-chloro-1,3-benzothiazol-2-yl)cyclohexanecarboxylic (1R,2S)-2-(7-chloro-1,3-benzothi…

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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) 3.73 8.93 -54.4 0 3 -1 53 294.783 2 ↓

Parameters Provided:

ring.id = 35199
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 = 35199 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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