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

    39882170
    39882170
    39882203
    39882203
    8555008
    8555008

    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) 0.76 0.22 -20.2 1 7 0 77 334.372 5 ↓

    Analogs

    36729172
    36729172
    36729173
    36729173
    36729174
    36729174

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-en-1-one (E)-1-[(2R,6S)-2,6-dimethylmorph…

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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) 2.61 7.17 -12.23 0 5 0 48 319.401 5 ↓

    Analogs

    36729172
    36729172
    36729173
    36729173
    36729174
    36729174

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-en-1-one (E)-1-[(2S,6S)-2,6-dimethylmorph…

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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) 2.61 7.36 -12.35 0 5 0 48 319.401 5 ↓

    Analogs

    36729172
    36729172
    36729173
    36729173
    36729174
    36729174

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-en-1-one (E)-1-[(2R,6R)-2,6-dimethylmorph…

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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) 2.61 7.37 -12.31 0 5 0 48 319.401 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[2-chloro-4-[(Z)-2-cyano-3-morpholino-3-oxo-prop-1-enyl]phenoxy]acetic 2-[2-chloro-4-[(Z)-2-cyano-3-mor…

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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) 1.49 6.16 -52.75 0 7 -1 103 349.75 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-3-(3-allyl-5-ethoxy-4-hydroxy-phenyl)-2-(morpholine-4-carbonyl)prop-2-enenitrile (Z)-3-(3-allyl-5-ethoxy-4-hydrox…

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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) 2.28 5.81 -12.81 1 6 0 83 342.395 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)prop-2-en-1-one (E)-1-[(2R,5R)-2,5-dimethylmorph…

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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) 2.49 7.08 -11.72 0 3 0 30 263.312 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)prop-2-en-1-one (E)-1-[(2S,5R)-2,5-dimethylmorph…

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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) 2.49 6.92 -10.85 0 3 0 30 263.312 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)prop-2-en-1-one (E)-1-[(2R,5S)-2,5-dimethylmorph…

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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) 2.49 6.94 -10.72 0 3 0 30 263.312 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2S,5S)-2,5-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)prop-2-en-1-one (E)-1-[(2S,5S)-2,5-dimethylmorph…

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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) 2.49 7.07 -11.76 0 3 0 30 263.312 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-3-phenyl-prop-2-en-1-one (E)-1-[(2R,5R)-2,5-dimethylmorph…

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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) 2.55 7.04 -8.53 0 3 0 30 245.322 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-3-phenyl-prop-2-en-1-one (E)-1-[(2S,5R)-2,5-dimethylmorph…

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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) 2.55 6.88 -7.74 0 3 0 30 245.322 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-3-phenyl-prop-2-en-1-one (E)-1-[(2R,5S)-2,5-dimethylmorph…

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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) 2.55 6.9 -7.62 0 3 0 30 245.322 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2S,5S)-2,5-dimethylmorpholin-4-yl]-3-phenyl-prop-2-en-1-one (E)-1-[(2S,5S)-2,5-dimethylmorph…

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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) 2.55 7.03 -8.57 0 3 0 30 245.322 2 ↓

    Analogs

    37860622
    37860622
    37860983
    37860983

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-(2-methoxy-5-methyl-phenyl)-1-morpholino-prop-2-en-1-one (E)-3-(2-methoxy-5-methyl-phenyl…

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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) 2.11 5.55 -11.61 0 4 0 39 261.321 3 ↓

    Analogs

    4551076
    4551076
    13124827
    13124827

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-(3,4-dimethoxyphenyl)-1-(2,6-dimethylmorpholin-4-yl)-prop-2-en-1-one 3-(3,4-dimethoxyphenyl)-1-(2,6-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) 2.23 6.39 -12.46 0 5 0 48 305.374 4 ↓

    Analogs

    13124827
    13124827
    4551075
    4551075

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-(3,4-dimethoxyphenyl)-1-(2,6-dimethylmorpholin-4-yl)-prop-2-en-1-one 3-(3,4-dimethoxyphenyl)-1-(2,6-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) 2.23 6.4 -12.48 0 5 0 48 305.374 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-[2-chloro-5-(trifluoromethyl)phenyl]-1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]prop-2-en-1-one (E)-3-[2-chloro-5-(trifluorometh…

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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) 3.91 8.44 -8.6 0 3 0 30 347.764 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-[2-chloro-5-(trifluoromethyl)phenyl]-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]prop-2-en-1-one (E)-3-[2-chloro-5-(trifluorometh…

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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) 3.91 8.6 -8.75 0 3 0 30 347.764 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-[2-chloro-5-(trifluoromethyl)phenyl]-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]prop-2-en-1-one (E)-3-[2-chloro-5-(trifluorometh…

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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) 3.91 8.61 -8.75 0 3 0 30 347.764 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-(3-chloro-4-methyl-phenyl)-1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]prop-2-en-1-one (E)-3-(3-chloro-4-methyl-phenyl)…

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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) 3.64 8.13 -7.77 0 3 0 30 293.794 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-(3-chloro-4-methyl-phenyl)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]prop-2-en-1-one (E)-3-(3-chloro-4-methyl-phenyl)…

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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) 3.64 8.28 -7.85 0 3 0 30 293.794 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-(3-chloro-4-methyl-phenyl)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]prop-2-en-1-one (E)-3-(3-chloro-4-methyl-phenyl)…

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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) 3.64 8.28 -7.8 0 3 0 30 293.794 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2S)-4-[(E)-3-(2-methoxyphenyl)but-2-enoyl]morpholine-2-carboxamide (2S)-4-[(E)-3-(2-methoxyphenyl)b…

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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) 0.47 3.55 -14.19 2 6 0 82 304.346 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2R)-4-[(E)-3-(2-methoxyphenyl)but-2-enoyl]morpholine-2-carboxamide (2R)-4-[(E)-3-(2-methoxyphenyl)b…

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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) 0.47 3.56 -14.23 2 6 0 82 304.346 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)but-2-en-1-one (Z)-1-[(2S,6R)-2,6-dimethylmorph…

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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 7.76 -8.89 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)but-2-en-1-one (Z)-1-[(2S,6S)-2,6-dimethylmorph…

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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 7.9 -8.92 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)but-2-en-1-one (Z)-1-[(2R,6R)-2,6-dimethylmorph…

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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 7.93 -8.89 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)but-2-en-1-one (E)-1-[(2R,5R)-2,5-dimethylmorph…

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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) 2.55 7.88 -8.86 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)but-2-en-1-one (Z)-1-[(2R,5R)-2,5-dimethylmorph…

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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) 2.55 7.79 -8.67 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)but-2-en-1-one (E)-1-[(2S,5R)-2,5-dimethylmorph…

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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) 2.55 7.73 -7.75 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-3-(2-fluorophenyl)but-2-en-1-one (Z)-1-[(2S,5R)-2,5-dimethylmorph…

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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) 2.55 7.64 -7.93 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-3-(4-fluorophenyl)but-2-en-1-one (Z)-1-[(2R,5R)-2,5-dimethylmorph…

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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) 2.60 7.78 -8.75 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-3-(4-fluorophenyl)but-2-en-1-one (Z)-1-[(2S,5R)-2,5-dimethylmorph…

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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) 2.60 7.61 -8 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-3-(4-fluorophenyl)but-2-en-1-one (Z)-1-[(2R,5S)-2,5-dimethylmorph…

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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) 2.60 7.64 -7.87 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-[(2S,5S)-2,5-dimethylmorpholin-4-yl]-3-(4-fluorophenyl)but-2-en-1-one (Z)-1-[(2S,5S)-2,5-dimethylmorph…

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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) 2.60 7.76 -8.81 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-(3,3-dimethylmorpholin-4-yl)-3-(4-fluorophenyl)but-2-en-1-one (Z)-1-(3,3-dimethylmorpholin-4-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) 2.71 7.54 -7.86 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-1-(3,3-dimethylmorpholin-4-yl)-3-(2-fluorophenyl)but-2-en-1-one (Z)-1-(3,3-dimethylmorpholin-4-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) 2.67 7.56 -7.65 0 3 0 30 277.339 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-(2,6-difluorophenyl)-1-(3,3-dimethylmorpholin-4-yl)prop-2-en-1-one (E)-3-(2,6-difluorophenyl)-1-(3,…

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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) 2.72 6.98 -9.19 0 3 0 30 281.302 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[(E)-3-(3,3-dimethylmorpholin-4-yl)-3-oxo-prop-1-enyl]benzonitrile 3-[(E)-3-(3,3-dimethylmorpholin-…

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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) 2.40 7.21 -12.22 0 4 0 53 270.332 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-(3,3-dimethylmorpholin-4-yl)-3-(2,4-dimethylphenyl)prop-2-en-1-one (E)-1-(3,3-dimethylmorpholin-4-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) 3.32 8.01 -7.81 0 3 0 30 273.376 2 ↓

    Analogs

    25139824
    25139824
    25139826
    25139826

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[(E)-3-(3,3-dimethylmorpholin-4-yl)-3-oxo-prop-1-enyl]benzonitrile 2-[(E)-3-(3,3-dimethylmorpholin-…

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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) 2.20 7.04 -15.23 0 4 0 53 270.332 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-(3-chloro-4-methyl-phenyl)-1-(3,3-dimethylmorpholin-4-yl)prop-2-en-1-one (E)-3-(3-chloro-4-methyl-phenyl)…

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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) 3.73 7.91 -7.1 0 3 0 30 293.794 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-(2-chlorophenyl)-1-(3,3-dimethylmorpholin-4-yl)prop-2-en-1-one (E)-3-(2-chlorophenyl)-1-(3,3-di…

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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) 3.12 7.25 -9.94 0 3 0 30 279.767 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-(3,3-dimethylmorpholin-4-yl)-3-(2-methoxyphenyl)prop-2-en-1-one (E)-1-(3,3-dimethylmorpholin-4-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) 2.50 6.19 -10.79 0 4 0 39 275.348 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-1-(3,3-dimethylmorpholin-4-yl)-3-(4-methoxyphenyl)prop-2-en-1-one (E)-1-(3,3-dimethylmorpholin-4-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) 2.73 6.13 -8.77 0 4 0 39 275.348 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E)-3-(4-fluoro-2-nitro-phenyl)-1-morpholino-prop-2-en-1-one (E)-3-(4-fluoro-2-nitro-phenyl)-…

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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) 1.73 6.18 -17.4 0 6 0 75 280.255 3 ↓

    Analogs

    41824865
    41824865
    41824867
    41824867
    41824869
    41824869

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[(Z)-3-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-3-oxo-prop-1-enyl]benzonitrile 3-[(Z)-3-[(2R,5R)-2,5-dimethylmo…

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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 7.39 -9.71 0 4 0 53 270.332 2 ↓

    Analogs

    41824867
    41824867
    41824869
    41824869
    41824864
    41824864

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[(E)-3-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-3-oxo-prop-1-enyl]benzonitrile 3-[(E)-3-[(2R,5R)-2,5-dimethylmo…

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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 7.43 -12.98 0 4 0 53 270.332 2 ↓

    Analogs

    41824869
    41824869
    41824864
    41824864
    41824865
    41824865

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[(Z)-3-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-3-oxo-prop-1-enyl]benzonitrile 3-[(Z)-3-[(2S,5R)-2,5-dimethylmo…

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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 7.22 -9.31 0 4 0 53 270.332 2 ↓

    Parameters Provided:

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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 = 102263 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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    //zinc12.docking.org/results/combination?ring.id=102263&filter.purchasability=annotated

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