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

    Analogs

    2016018
    2016018
    59463104
    59463104
    59463106
    59463106

    Draw Identity 99% 90% 80% 70%

    Popular Name: grel grel

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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) 1.13 8.86 -52.51 0 5 -1 67 271.296 5 ↓
    Mid Mid (pH 6-8) 1.13 9.34 -71.35 1 5 0 68 272.304 5 ↓

    Analogs

    3830577
    3830577

    Draw Identity 99% 90% 80% 70%

    Popular Name: 6-chloro-5-cyclohexyl-1-indanecarboxylic acid 6-chloro-5-cyclohexyl-1-indaneca…

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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 1 -50.26 0 2 -1 40 277.771 2 ↓

    Analogs

    2020006
    2020006

    Draw Identity 99% 90% 80% 70%

    Popular Name: orex orex

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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) 1.28 -3.66 -42.86 4 2 1 47 192.282 2 ↓

    Analogs

    1846144
    1846144

    Draw Identity 99% 90% 80% 70%

    Popular Name: ac ac

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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) 2.76 -0.41 -50.33 1 4 -1 77 281.287 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-ethyl)

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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) 4.68 14.3 -15.47 0 5 0 61 394.858 6 ↓

    Analogs

    25799243
    25799243
    25799249
    25799249

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-ethyl)

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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 11.46 -14.28 2 6 0 85 408.498 8 ↓

    Analogs

    25799243
    25799243
    25799249
    25799249

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-ethyl)

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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 11.5 -14.04 2 6 0 85 408.498 8 ↓

    Analogs

    5778821
    5778821
    4925881
    4925881
    4925885
    4925885
    5219613
    5219613

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[[5-(3,4-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-indan-5-yl-propan-1-one 2-[[5-(3,4-dimethylphenyl)-1,3,4…

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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) 5.28 -0.26 -8.88 0 4 0 55 378.497 5 ↓

    Analogs

    4925881
    4925881
    4925885
    4925885
    5778820
    5778820

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[[5-(3,4-dimethylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-indan-5-yl-propan-1-one 2-[[5-(3,4-dimethylphenyl)-1,3,4…

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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) 5.28 -0.27 -8.83 0 4 0 55 378.497 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-2-oxo-ethyl) (2-indan-5-yl-2-oxo-ethyl)

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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) 3.82 3.61 -16.33 0 6 0 89 351.358 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-2-oxo-ethyl) (2-indan-5-yl-2-oxo-ethyl)

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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) 3.65 3.39 -11.35 0 6 0 89 339.347 6 ↓

    Analogs

    5779353
    5779353

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-ethyl)

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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) 4.01 3.72 -10.93 0 6 0 89 353.374 6 ↓

    Analogs

    5779351
    5779351

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) (2-indan-5-yl-1-methyl-2-oxo-ethyl)

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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) 4.01 3.73 -11.01 0 6 0 89 353.374 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-2-oxo-ethyl) (2-indan-5-yl-2-oxo-ethyl)

    Find On: PubMed — Wikipedia — Google

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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 3.88 -13.8 0 6 0 71 396.439 9 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S)-1-(3-chloro-4-indan-5-yloxy-phenyl)ethanamine (1S)-1-(3-chloro-4-indan-5-yloxy…

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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) 2.58 8.61 -49.24 3 2 1 37 288.798 3 ↓
    Hi High (pH 8-9.5) 2.58 8.29 -5.06 2 2 0 35 287.79 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1R)-1-(3-chloro-4-indan-5-yloxy-phenyl)ethanamine (1R)-1-(3-chloro-4-indan-5-yloxy…

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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) 2.58 8.61 -49.22 3 2 1 37 288.798 3 ↓
    Hi High (pH 8-9.5) 2.58 8.31 -4.44 2 2 0 35 287.79 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-indan-5-ylpyridine-3-carboxylic 5-indan-5-ylpyridine-3-carboxylic

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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) 2.63 8.6 -46.92 0 3 -1 53 238.266 2 ↓
    Lo Low (pH 4.5-6) 2.63 9.05 -44.23 1 3 0 54 239.274 2 ↓

    Analogs

    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) 2.80 1.89 -14.08 1 4 0 55 295.338 4 ↓

    Analogs

    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) 2.57 -0.01 -14.9 1 4 0 49 300.402 3 ↓

    Analogs

    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) 2.57 0.01 -14.63 1 4 0 49 300.402 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[[(1S)-4-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]indan-1-yl]amino]ethanol 2-[[(1S)-4-[5-(3,4-diethoxypheny…

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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) 3.45 6.45 -48.51 3 7 1 94 410.494 9 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[[(1R)-4-[5-(3,4-diethoxyphenyl)-1,2,4-oxadiazol-3-yl]indan-1-yl]amino]ethanol 2-[[(1R)-4-[5-(3,4-diethoxypheny…

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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) 3.45 6.47 -47.03 3 7 1 94 410.494 9 ↓

    Analogs

    32120380
    32120380
    32121785
    32121785
    32139965
    32139965
    32144338
    32144338
    34574616
    34574616

    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) 3.68 1.52 -12.11 0 3 0 29 287.403 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%


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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) 3.45 6.26 -14.28 2 5 0 60 296.326 2 ↓

    Analogs

    403133
    403133

    Draw Identity 99% 90% 80% 70%

    Popular Name: isopropyl isopropyl

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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 2.89 -9.12 2 4 0 59 235.283 3 ↓

    Analogs

    403133
    403133

    Draw Identity 99% 90% 80% 70%

    Popular Name: isopropyl isopropyl

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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 2.39 -10.21 2 4 0 59 235.283 3 ↓

    Analogs

    403133
    403133

    Draw Identity 99% 90% 80% 70%

    Popular Name: isopropyl isopropyl

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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 2.46 -10.94 2 4 0 59 235.283 3 ↓

    Analogs

    403133
    403133

    Draw Identity 99% 90% 80% 70%

    Popular Name: isopropyl isopropyl

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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 2.73 -9.37 2 4 0 59 235.283 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: [2-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl] [2-(1-indan-5-yl-2,5-dimethyl-py…

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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) 2.66 12.19 -12.92 1 7 0 91 420.465 8 ↓

    Analogs

    7148885
    7148885

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-cyclopropyl-3-[2-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-5-methyl-imidazolidine-2,4-d 5-cyclopropyl-3-[2-(1-indan-5-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) 2.89 11.86 -16.54 1 6 0 71 405.498 5 ↓

    Analogs

    7148879
    7148879

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-cyclopropyl-3-[2-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-5-methyl-imidazolidine-2,4-d 5-cyclopropyl-3-[2-(1-indan-5-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) 2.89 12.67 -16.47 1 6 0 71 405.498 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-ethanone 2-[(4-allyl-5-methyl-1,2,4-triaz…

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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) 3.52 15.68 -12.95 0 5 0 53 406.555 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-et 2-[(5-cyclopropyl-4-methyl-1,2,4…

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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) 3.24 15.72 -12.7 0 5 0 53 406.555 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-2-(6,8,9-triazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-ylsulf 1-(1-indan-5-yl-2,5-dimethyl-pyr…

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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) 4.09 15.67 -15.18 0 5 0 52 402.523 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[2-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-2,4-diazaspiro[4.4]nonane-1,3-dione 2-[2-(1-indan-5-yl-2,5-dimethyl-…

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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) 3.05 11.85 -13.47 1 6 0 71 405.498 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[[5-(2-furyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-ethanone 2-[[5-(2-furyl)-1,3,4-oxadiazol-…

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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) 4.08 9.18 -11.95 0 6 0 74 419.506 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-ethanone 2-(4,6-diaminopyrimidin-2-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) 3.33 10.16 -12.41 4 6 0 100 393.516 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(1-indan-5-yl-2,5-dimethyl-pyrrol-3-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone 1-(1-indan-5-yl-2,5-dimethyl-pyr…

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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) 2.78 14.44 -13 0 5 0 53 366.49 5 ↓

    Analogs

    36234482
    36234482
    36234485
    36234485

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-2-oxo-ethyl) (2-indan-5-yl-2-oxo-ethyl)

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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) 3.90 3.24 -14.3 1 5 0 72 415.436 8 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-indan-5-yl-2-oxo-ethyl) (2-indan-5-yl-2-oxo-ethyl)

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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) 4.24 2.78 -8.06 0 3 0 43 377.209 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-indane-5-carboxamide N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 2.82 1.93 -13.25 0 4 0 38 359.473 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-indan-5-yloxy-N-methyl-acetamide N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 3.26 2.25 -15.09 0 5 0 47 389.499 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-indan-5-yl-N-methyl-acetamide N-[(3,5-dimethyl-1-phenyl-pyrazo…

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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) 3.38 2.31 -15.51 0 4 0 38 373.5 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N1-indan-5-yl-4-methyl-benzene-1,3-diamine N1-indan-5-yl-4-methyl-benzene-1…

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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 7.36 -4.24 3 2 0 38 238.334 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(4-methyl-3-sulfamoyl-phenyl)indane-5-carboxamide N-(4-methyl-3-sulfamoyl-phenyl)i…

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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 -5.31 -20.52 3 5 0 89 330.409 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-indan-5-yl-ethane-1,2-dione 1-(3,4-dihydro-1H-isoquinolin-2-…

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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) 2.62 10.47 -8.44 0 3 0 37 305.377 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-indan-5-yl-ethane-1,2-dione 1-(3,4-dihydro-2H-quinolin-1-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) 3.44 10.77 -9.98 0 3 0 37 305.377 2 ↓

    Analogs

    34199394
    34199394
    34199396
    34199396
    34199398
    34199398

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-bromo-N-[(1R,2S)-2-hydroxyindan-1-yl]pyridine-3-sulfonamide 5-bromo-N-[(1R,2S)-2-hydroxyinda…

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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) 1.82 1.3 -10.03 2 5 0 79 369.24 3 ↓

    Analogs

    34199394
    34199394
    34199396
    34199396
    34199398
    34199398

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-bromo-N-[(1R,2R)-2-hydroxyindan-1-yl]pyridine-3-sulfonamide 5-bromo-N-[(1R,2R)-2-hydroxyinda…

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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) 1.82 0.99 -9.67 2 5 0 79 369.24 3 ↓

    Analogs

    34199394
    34199394
    34199396
    34199396
    34199398
    34199398

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-bromo-N-[(1S,2S)-2-hydroxyindan-1-yl]pyridine-3-sulfonamide 5-bromo-N-[(1S,2S)-2-hydroxyinda…

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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) 1.82 1.13 -10.19 2 5 0 79 369.24 3 ↓

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