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

    14559561
    14559561

    Draw Identity 99% 90% 80% 70%

    Popular Name: acetamide, 2-[2-(1-methylpropyl)phenoxy]-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- acetamide, 2-[2-(1-methylpropyl)…

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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) 3.48 10.61 -25.63 1 5 0 59 380.488 7 ↓

    Analogs

    14559558
    14559558

    Draw Identity 99% 90% 80% 70%

    Popular Name: acetamide, 2-[2-(1-methylpropyl)phenoxy]-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- acetamide, 2-[2-(1-methylpropyl)…

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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) 3.48 10.61 -25.65 1 5 0 59 380.488 7 ↓

    Analogs

    33779281
    33779281
    735360
    735360
    741959
    741959
    741960
    741960

    Draw Identity 99% 90% 80% 70%

    Popular Name: acetamide, 2-(4-chlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- acetamide, 2-(4-chlorophenoxy)-N…

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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 8.51 -16.37 1 5 0 59 358.825 5 ↓

    Analogs

    742117
    742117

    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) 2.59 8.66 -16.61 1 5 0 59 338.407 5 ↓

    Analogs

    14559693
    14559693

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2,4-dichlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2,4-dichlorophen…

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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 9.64 -27.23 1 5 0 59 407.297 5 ↓

    Analogs

    14559690
    14559690

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2,4-dichlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2,4-dichlorophen…

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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 9.62 -27.3 1 5 0 59 407.297 5 ↓

    Analogs

    14559804
    14559804

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-methylphenoxy)…

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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) 2.96 9.37 -25.95 1 5 0 59 352.434 5 ↓

    Analogs

    14559801
    14559801

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-methylphenoxy)…

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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) 2.96 9.28 -26.11 1 5 0 59 352.434 5 ↓

    Analogs

    14559813
    14559813

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(3-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(3-methylphenoxy)…

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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) 2.93 9.28 -26.26 1 5 0 59 352.434 5 ↓

    Analogs

    14559810
    14559810

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(3-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(3-methylphenoxy)…

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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) 2.93 9.27 -26.35 1 5 0 59 352.434 5 ↓

    Analogs

    14559819
    14559819
    14560026
    14560026
    14560029
    14560029

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-methylphenoxy)…

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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) 2.91 9.32 -25.61 1 5 0 59 352.434 5 ↓

    Analogs

    14560026
    14560026
    14560029
    14560029
    14559815
    14559815

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-methylphenoxy)…

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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) 2.91 9.31 -25.72 1 5 0 59 352.434 5 ↓

    Analogs

    14559826
    14559826

    Draw Identity 99% 90% 80% 70%

    Popular Name: butanamide, 2-(2-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- butanamide, 2-(2-methylphenoxy)-…

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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) 3.41 9.93 -25.47 1 5 0 59 366.461 6 ↓

    Analogs

    14559823
    14559823

    Draw Identity 99% 90% 80% 70%

    Popular Name: butanamide, 2-(2-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- butanamide, 2-(2-methylphenoxy)-…

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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) 3.41 9.94 -25.49 1 5 0 59 366.461 6 ↓

    Analogs

    14559836
    14559836
    14559842
    14559842
    14559845
    14559845

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-phenoxy-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-phenoxy-N-[3-(1-p…

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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) 2.51 8.69 -25.97 1 5 0 59 338.407 5 ↓

    Analogs

    14559842
    14559842
    14559845
    14559845
    14559833
    14559833

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-phenoxy-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-phenoxy-N-[3-(1-p…

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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) 2.51 8.54 -26.18 1 5 0 59 338.407 5 ↓

    Analogs

    14559845
    14559845
    14559833
    14559833
    14559836
    14559836

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-methoxyphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-methoxyphenoxy…

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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) 2.56 7.98 -26.42 1 6 0 68 368.433 6 ↓

    Analogs

    14559833
    14559833
    14559836
    14559836
    14559842
    14559842

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-methoxyphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-methoxyphenoxy…

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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) 2.56 7.89 -26.58 1 6 0 68 368.433 6 ↓

    Analogs

    14559852
    14559852

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-methoxyphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-methoxyphenoxy…

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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) 2.12 8.35 -30.23 1 6 0 68 368.433 6 ↓

    Analogs

    14559849
    14559849

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-methoxyphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-methoxyphenoxy…

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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) 2.12 8.35 -30.11 1 6 0 68 368.433 6 ↓

    Analogs

    14559858
    14559858
    742120
    742120

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-chlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-chlorophenoxy)…

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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) 3.18 9.2 -25.03 1 5 0 59 372.852 5 ↓

    Analogs

    742120
    742120
    14559855
    14559855

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-chlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-chlorophenoxy)…

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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) 3.18 9.13 -25.14 1 5 0 59 372.852 5 ↓

    Analogs

    14559865
    14559865

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2S)-2-(2,5-dimethylphenoxy)-N-[3-(pyrrolidine-1-carbonyl)phenyl]propanamide (2S)-2-(2,5-dimethylphenoxy)-N-[…

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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 9.99 -25.58 1 5 0 59 366.461 5 ↓

    Analogs

    14559861
    14559861

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2R)-2-(2,5-dimethylphenoxy)-N-[3-(pyrrolidine-1-carbonyl)phenyl]propanamide (2R)-2-(2,5-dimethylphenoxy)-N-[…

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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 9.95 -25.73 1 5 0 59 366.461 5 ↓

    Analogs

    14559882
    14559882

    Draw Identity 99% 90% 80% 70%

    Popular Name: butanamide, 2-(4-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- butanamide, 2-(4-methylphenoxy)-…

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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 9.85 -25.83 1 5 0 59 366.461 6 ↓

    Analogs

    14559879
    14559879

    Draw Identity 99% 90% 80% 70%

    Popular Name: butanamide, 2-(4-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- butanamide, 2-(4-methylphenoxy)-…

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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 9.8 -25.68 1 5 0 59 366.461 6 ↓

    Analogs

    14559894
    14559894

    Draw Identity 99% 90% 80% 70%

    Popular Name: butanamide, 2-(3-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- butanamide, 2-(3-methylphenoxy)-…

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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) 3.43 9.9 -26.18 1 5 0 59 366.461 6 ↓

    Analogs

    14559891
    14559891

    Draw Identity 99% 90% 80% 70%

    Popular Name: butanamide, 2-(3-methylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- butanamide, 2-(3-methylphenoxy)-…

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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) 3.43 9.9 -26.1 1 5 0 59 366.461 6 ↓

    Analogs

    14559903
    14559903

    Draw Identity 99% 90% 80% 70%

    Popular Name: butanamide, 2-phenoxy-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- butanamide, 2-phenoxy-N-[3-(1-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) 3.01 9.2 -25.9 1 5 0 59 352.434 6 ↓

    Analogs

    14559899
    14559899

    Draw Identity 99% 90% 80% 70%

    Popular Name: butanamide, 2-phenoxy-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- butanamide, 2-phenoxy-N-[3-(1-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) 3.01 9.12 -25.83 1 5 0 59 352.434 6 ↓

    Analogs

    14559915
    14559915

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-chlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-chlorophenoxy)…

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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) 3.14 9.22 -28.07 1 5 0 59 372.852 5 ↓

    Analogs

    14559912
    14559912

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-chlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-chlorophenoxy)…

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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) 3.14 9.11 -28.54 1 5 0 59 372.852 5 ↓

    Analogs

    14559946
    14559946

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-nitrophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-nitrophenoxy)-…

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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) 2.42 9.76 -39 1 8 0 104 383.404 6 ↓

    Analogs

    14559943
    14559943

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-nitrophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-nitrophenoxy)-…

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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) 2.42 9.75 -38.53 1 8 0 104 383.404 6 ↓

    Analogs

    14559972
    14559972

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-nitrophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-nitrophenoxy)-…

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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) 2.47 9.36 -27.96 1 8 0 104 383.404 6 ↓

    Analogs

    14559968
    14559968

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-nitrophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-nitrophenoxy)-…

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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) 2.47 9.29 -28.17 1 8 0 104 383.404 6 ↓

    Analogs

    14559993
    14559993

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-ethylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-ethylphenoxy)-…

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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 10.04 -25.69 1 5 0 59 366.461 6 ↓

    Analogs

    14559990
    14559990

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-ethylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-ethylphenoxy)-…

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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 10.04 -25.73 1 5 0 59 366.461 6 ↓

    Analogs

    14560000
    14560000
    14560113
    14560113
    14560116
    14560116

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-[4-(1-methylethyl)phenoxy]-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-[4-(1-methylethyl…

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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) 4.02 10.56 -25.68 1 5 0 59 380.488 6 ↓

    Analogs

    14560113
    14560113
    14560116
    14560116
    14559997
    14559997

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-[4-(1-methylethyl)phenoxy]-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-[4-(1-methylethyl…

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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) 4.02 10.59 -25.68 1 5 0 59 380.488 6 ↓

    Analogs

    14560029
    14560029
    14559815
    14559815
    14559819
    14559819

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2,6-dimethylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2,6-dimethylphen…

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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) 3.31 9.93 -23.94 1 5 0 59 366.461 5 ↓

    Analogs

    14559815
    14559815
    14559819
    14559819
    14560026
    14560026

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2,6-dimethylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2,6-dimethylphen…

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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) 3.31 10 -24.24 1 5 0 59 366.461 5 ↓

    Analogs

    14560045
    14560045

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-bromo-2,6-dimethylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-bromo-2,6-dime…

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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) 4.07 10.54 -22.76 1 5 0 59 445.357 5 ↓

    Analogs

    14560042
    14560042

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(4-bromo-2,6-dimethylphenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(4-bromo-2,6-dime…

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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) 4.07 10.59 -22.79 1 5 0 59 445.357 5 ↓

    Analogs

    14560051
    14560051

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-bromo-4-chlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-bromo-4-chloro…

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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 9.75 -26.91 1 5 0 59 451.748 5 ↓

    Analogs

    14560048
    14560048

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-(2-bromo-4-chlorophenoxy)-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-(2-bromo-4-chloro…

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    Activity (Go SEA)

    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 9.73 -27.02 1 5 0 59 451.748 5 ↓

    Analogs

    14560116
    14560116
    14559997
    14559997
    14560000
    14560000

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-[4-(1,1-dimethylethyl)phenoxy]-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-[4-(1,1-dimethyle…

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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 11.01 -25.51 1 5 0 59 394.515 6 ↓

    Analogs

    14559997
    14559997
    14560000
    14560000
    14560113
    14560113

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-[4-(1,1-dimethylethyl)phenoxy]-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-[4-(1,1-dimethyle…

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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 10.94 -25.64 1 5 0 59 394.515 6 ↓

    Analogs

    14560174
    14560174
    14560178
    14560178
    14560182
    14560182

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-[2-(1-methylpropyl)phenoxy]-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-[2-(1-methylpropy…

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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 11.27 -25.63 1 5 0 59 394.515 7 ↓

    Analogs

    14560178
    14560178
    14560182
    14560182
    14560171
    14560171

    Draw Identity 99% 90% 80% 70%

    Popular Name: propanamide, 2-[2-(1-methylpropyl)phenoxy]-N-[3-(1-pyrrolidinylcarbonyl)phenyl]- propanamide, 2-[2-(1-methylpropy…

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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 11.26 -25.7 1 5 0 59 394.515 7 ↓

    Parameters Provided:

    ring.id = 247136
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 = 247136 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

    Permalink

    //zinc12.docking.org/results/combination?ring.id=247136&filter.purchasability=annotated

    Embed Link to Results

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