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

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-bromo-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)benzamide 3-bromo-N-(7-keto-5,5-dimethyl-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) 4.14 -1.31 -11.73 1 4 0 59 379.279 2 ↓

    Analogs

    4889859
    4889859
    204289
    204289

    Draw Identity 99% 90% 80% 70%


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    Popular Name:

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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) 3.39 -0.51 -14.26 1 6 0 77 360.435 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-(diethylsulfamoyl)-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)benzamide 4-(diethylsulfamoyl)-N-(7-keto-5…

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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) 3.42 -4.16 -18.05 1 7 0 96 435.571 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-(dimethylsulfamoyl)-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)benzamide 4-(dimethylsulfamoyl)-N-(7-keto-…

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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) 2.67 -4.52 -18.32 1 7 0 96 407.517 4 ↓

    Analogs

    4889859
    4889859

    Draw Identity 99% 90% 80% 70%


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    Popular Name:

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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 -0.18 -16.2 1 6 0 77 360.435 4 ↓

    Analogs

    567763
    567763

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-(dimethylamino)-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)benzamide 4-(dimethylamino)-N-(7-keto-5,5-…

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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) 3.46 -0.56 -14.09 1 5 0 62 343.452 3 ↓

    Analogs

    567763
    567763

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-(diethylamino)-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)benzamide 4-(diethylamino)-N-(7-keto-5,5-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) 4.21 -0.03 -13.58 1 5 0 62 371.506 5 ↓

    Analogs

    12036521
    12036521
    14888053
    14888053
    14888056
    14888056

    Draw Identity 99% 90% 80% 70%

    Popular Name: (5S)-2-benzamido-N-isopropyl-N-methyl-7-oxo-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide (5S)-2-benzamido-N-isopropyl-N-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) 2.59 -0.93 -14.19 1 6 0 79 371.462 4 ↓

    Analogs

    14888053
    14888053
    14888056
    14888056
    12036519
    12036519

    Draw Identity 99% 90% 80% 70%

    Popular Name: (5R)-2-benzamido-N-isopropyl-N-methyl-7-oxo-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide (5R)-2-benzamido-N-isopropyl-N-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) 2.59 -0.78 -13.25 1 6 0 79 371.462 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-fluoro-4-nitro-benzamide N-(5,5-dimethyl-7-oxo-4,6-dihydr…

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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 8.16 -17.25 1 7 0 105 363.37 3 ↓

    Analogs

    44449151
    44449151
    204289
    204289

    Draw Identity 99% 90% 80% 70%

    Popular Name: Benzamide, 3-ethoxy-N-(4,5,6,7-tetrahydro-5,5-dimethyl-7-oxo-2-benzothiazolyl)- (9CI) Benzamide, 3-ethoxy-N-(4,5,6,7-t…

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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) 3.76 -0.51 -15.52 1 5 0 68 344.436 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-[methyl(propyl)amino]benzamide N-(5,5-dimethyl-7-oxo-4,6-dihydr…

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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) 4.33 9.49 -13.11 1 5 0 62 371.506 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2-methyl-5-nitro-benzamide N-(5,5-dimethyl-7-oxo-4,6-dihydr…

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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) 3.69 8.74 -13.09 1 7 0 105 359.407 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-5-ethylsulfonyl-N-(7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl)benzamide 2-chloro-5-ethylsulfonyl-N-(7-ox…

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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) 2.32 5.38 -19.89 1 6 0 93 398.893 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-2,4-difluoro-benzamide N-(5,5-dimethyl-7-oxo-4,6-dihydr…

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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) 3.61 7.52 -15.21 1 4 0 59 336.363 2 ↓
    Hi High (pH 8-9.5) 3.68 6.43 -46.18 0 4 -1 65 335.355 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-fluoro-benzamide 2-chloro-N-(5,5-dimethyl-7-oxo-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) 4.12 7.95 -13.66 1 4 0 59 352.818 2 ↓
    Hi High (pH 8-9.5) 4.19 7.27 -44.12 0 4 -1 65 351.81 2 ↓

    Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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    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 = 1196 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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