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

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[2-[(3-ethoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]cyclopentane-1-carbo 1-[2-[(3-ethoxycarbonyl-4,5,6,7-…

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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) 3.21 9.82 -59.73 1 6 -1 96 378.47 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[2-[[(6S)-3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-oxo-ethyl]cyclop 1-[2-[[(6S)-3-ethoxycarbonyl-6-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) 3.69 10.44 -59.33 1 6 -1 96 392.497 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[2-[[(6R)-3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-oxo-ethyl]cyclop 1-[2-[[(6R)-3-ethoxycarbonyl-6-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) 3.69 10.44 -61.09 1 6 -1 96 392.497 7 ↓

    Analogs

    483987
    483987

    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) 2.88 5.16 -10.9 3 4 0 72 306.431 4 ↓

    Analogs

    14230458
    14230458
    2084113
    2084113
    2084114
    2084114

    Draw Identity 99% 90% 80% 70%

    Popular Name: (6R)-2-[(2-cyclopentylacetyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide (6R)-2-[(2-cyclopentylacetyl)ami…

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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) 3.35 5.77 -10.63 3 4 0 72 320.458 4 ↓

    Analogs

    14230455
    14230455
    2084113
    2084113

    Draw Identity 99% 90% 80% 70%

    Popular Name: (6S)-2-[(2-cyclopentylacetyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide (6S)-2-[(2-cyclopentylacetyl)ami…

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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) 3.35 5.77 -10.7 3 4 0 72 320.458 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[(2-cyclopentylacetyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic 2-[(2-cyclopentylacetyl)amino]-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) 3.63 9.12 -50.51 1 4 -1 69 306.407 4 ↓

    Parameters Provided:

    ring.id = 118059
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 = 118059 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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