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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: 2-(2-methyltetrazol-5-yl)sulfanyl-1,3-benzothiazole-6-carboxylic 2-(2-methyltetrazol-5-yl)sulfany…

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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) 2.38 4.79 -50 0 7 -1 97 292.325 3 ↓

Analogs

60216759
60216759
60217174
60217174

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Popular Name: 2-(2-butyltetrazol-5-yl)sulfanyl-6-nitro-1,3-benzothiazole 2-(2-butyltetrazol-5-yl)sulfanyl…

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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) 3.86 7.35 -9.26 0 8 0 102 336.402 6 ↓

Analogs

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Popular Name: 2-(2-butyltetrazol-5-yl)sulfanyl-1,3-benzothiazole 2-(2-butyltetrazol-5-yl)sulfanyl…

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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) 3.93 6.64 -10.83 0 5 0 57 291.405 5 ↓

Analogs

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Popular Name: 2-(2-ethyltetrazol-5-yl)sulfanyl-1,3-benzothiazole 2-(2-ethyltetrazol-5-yl)sulfanyl…

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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) 2.87 5.11 -11.47 0 5 0 57 263.351 3 ↓

Analogs

60215796
60215796

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Popular Name: 2-(2-tert-butyltetrazol-5-yl)sulfanyl-6-methylsulfonyl-1,3-benzothiazole 2-(2-tert-butyltetrazol-5-yl)sul…

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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) 2.52 3.85 -17.36 0 7 0 91 369.497 4 ↓

Analogs

60220320
60220320

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Popular Name: 2-(2-isopropyltetrazol-5-yl)sulfanyl-1,3-benzothiazole-6-carboxylic 2-(2-isopropyltetrazol-5-yl)sulf…

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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) 3.12 6.31 -49.43 0 7 -1 97 320.379 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-ethyltetrazol-5-yl)sulfanyl-1,3-benzothiazole-6-carboxylic 2-(2-ethyltetrazol-5-yl)sulfanyl…

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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) 2.75 5.65 -49.57 0 7 -1 97 306.352 4 ↓

Analogs

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Popular Name: 2-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]tetrazol-2-yl]acetic 2-[5-[(6-nitro-1,3-benzothiazol-…

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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 5.87 -45.24 0 10 -1 142 337.322 5 ↓

Analogs

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Popular Name: 6-methylsulfonyl-2-(2-propyltetrazol-5-yl)sulfanyl-1,3-benzothiazole 6-methylsulfonyl-2-(2-propyltetr…

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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) 2.21 3.39 -16.81 0 7 0 91 355.47 5 ↓

Analogs

60219772
60219772

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Popular Name: 2-(2-tert-butyltetrazol-5-yl)sulfanyl-1,3-benzothiazole-6-carboxylic 2-(2-tert-butyltetrazol-5-yl)sul…

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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) 3.56 6.86 -49.74 0 7 -1 97 334.406 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-butyltetrazol-5-yl)sulfanyl-6-methylsulfonyl-1,3-benzothiazole 2-(2-butyltetrazol-5-yl)sulfanyl…

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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) 2.77 4.17 -16.86 0 7 0 91 369.497 6 ↓

Analogs

60215780
60215780

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Popular Name: 2-(2-tert-butyltetrazol-5-yl)sulfanyl-4-chloro-1,3-benzothiazole 2-(2-tert-butyltetrazol-5-yl)sul…

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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) 4.31 6.84 -12.47 0 5 0 57 325.85 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-ethyltetrazol-5-yl)sulfanyl-6-methylsulfonyl-1,3-benzothiazole 2-(2-ethyltetrazol-5-yl)sulfanyl…

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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) 1.71 2.64 -17.48 0 7 0 91 341.443 4 ↓

Analogs

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Popular Name: 2-[2-(carboxymethyl)tetrazol-5-yl]sulfanyl-1,3-benzothiazole-6-carboxylic 2-[2-(carboxymethyl)tetrazol-5-y…

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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) 1.62 5.7 -93.43 0 9 -2 137 335.326 5 ↓

Parameters Provided:

ring.id = 198257
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 = 198257 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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