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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: 6-(1,3-benzothiazol-2-ylsulfanyl)-5-methyl-pyridin-3-amine 6-(1,3-benzothiazol-2-ylsulfanyl…

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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) 3.92 5.63 -11.49 2 3 0 52 273.386 2 ↓

Analogs

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Popular Name: 2-[(6-chloro-3-nitro-2-pyridyl)sulfanyl]-1,3-benzothiazole 2-[(6-chloro-3-nitro-2-pyridyl)s…

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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) 4.82 7.93 -11.83 0 5 0 72 323.786 3 ↓

Analogs

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Popular Name: 6-(1,3-benzothiazol-2-ylsulfanyl)-2-propoxy-pyridin-3-amine 6-(1,3-benzothiazol-2-ylsulfanyl…

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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) 4.60 5.29 -10.91 2 4 0 61 317.439 5 ↓

Analogs

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Popular Name: 6-(1,3-benzothiazol-2-ylsulfanyl)-2-isopropoxy-pyridin-3-amine 6-(1,3-benzothiazol-2-ylsulfanyl…

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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) 4.46 5.57 -10.2 2 4 0 61 317.439 4 ↓

Analogs

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Popular Name: 6-(1,3-benzothiazol-2-ylsulfanyl)-2-ethoxy-pyridin-3-amine 6-(1,3-benzothiazol-2-ylsulfanyl…

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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) 4.10 4.67 -10.96 2 4 0 61 303.412 4 ↓

Analogs

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Popular Name: 6-(1,3-benzothiazol-2-ylsulfanyl)-2-methoxy-pyridin-3-amine 6-(1,3-benzothiazol-2-ylsulfanyl…

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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) 3.72 3.82 -10.79 2 4 0 61 289.385 3 ↓

Analogs

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Popular Name: 2-[(3-fluoro-2-pyridyl)sulfanyl]-1,3-benzothiazol-6-amine 2-[(3-fluoro-2-pyridyl)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) 3.06 5.12 -11.24 2 3 0 52 277.349 2 ↓

Analogs

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Popular Name: 2-[(6-bromo-2-pyridyl)sulfanyl]-1,3-benzothiazole 2-[(6-bromo-2-pyridyl)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) 5.04 7.46 -11.49 0 2 0 26 323.24 2 ↓

Analogs

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Popular Name: 5-amino-2-(1,3-benzothiazol-2-ylsulfanyl)pyridine-3-carboxamide 5-amino-2-(1,3-benzothiazol-2-yl…

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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) 2.29 1.63 -18.86 4 5 0 95 302.384 3 ↓

Analogs

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Popular Name: 2-[(5-chloro-2-pyridyl)sulfanyl]-1,3-benzothiazol-6-amine 2-[(5-chloro-2-pyridyl)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) 3.79 5.56 -9.51 2 3 0 52 293.804 2 ↓

Analogs

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Popular Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]pyridine-3-carbonitrile 2-[(6-amino-1,3-benzothiazol-2-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) 2.65 5.37 -12.84 2 4 0 76 284.369 2 ↓

Analogs

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Popular Name: 6-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]pyridine-3-carbonitrile 6-[(6-amino-1,3-benzothiazol-2-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) 2.70 5.46 -11.58 2 4 0 76 284.369 2 ↓

Analogs

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Popular Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]pyridine-4-carbonitrile 2-[(6-amino-1,3-benzothiazol-2-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) 2.65 5.46 -10.87 2 4 0 76 284.369 2 ↓

Analogs

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Popular Name: 2-[[3-(trifluoromethyl)-2-pyridyl]sulfanyl]-1,3-benzothiazol-6-amine 2-[[3-(trifluoromethyl)-2-pyridy…

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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) 3.79 5.94 -11.23 2 3 0 52 327.356 3 ↓

Analogs

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Popular Name: 2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]-1,3-benzothiazol-6-amine 2-[[5-(trifluoromethyl)-2-pyridy…

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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) 3.84 6.02 -9.8 2 3 0 52 327.356 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]pyridine-3-carboxamide 2-[(6-amino-1,3-benzothiazol-2-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) 1.71 1.86 -17.92 4 5 0 95 302.384 3 ↓

Analogs

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Popular Name: 2-[(3-chloro-2-pyridyl)sulfanyl]-1,3-benzothiazol-6-amine 2-[(3-chloro-2-pyridyl)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) 3.57 5.51 -10.67 2 3 0 52 293.804 2 ↓

Analogs

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Popular Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile 2-[(6-amino-1,3-benzothiazol-2-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) 3.47 6.47 -12.32 2 4 0 76 312.423 2 ↓

Analogs

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Popular Name: 2-[(6-methyl-2-pyridyl)sulfanyl]-1,3-benzothiazol-6-amine 2-[(6-methyl-2-pyridyl)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) 3.00 5.66 -11.31 2 3 0 52 273.386 2 ↓

Analogs

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Popular Name: 2-[(5-fluoro-2-pyridyl)sulfanyl]-1,3-benzothiazol-6-amine 2-[(5-fluoro-2-pyridyl)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) 3.28 5.13 -9.94 2 3 0 52 277.349 2 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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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 = 23081 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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