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

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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) 3.78 -1.65 -9.51 2 4 0 50 262.353 3 ↓

    Analogs

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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 6.12 -11.83 2 5 0 60 306.406 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-bromo-4-fluoro-phenyl)-3-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]urea 1-(2-bromo-4-fluoro-phenyl)-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) 4.81 7.34 -6.35 2 3 0 41 383.183 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-bromo-4-fluoro-phenyl)-3-[(1S,3S)-3-(trifluoromethyl)cyclohexyl]urea 1-(2-bromo-4-fluoro-phenyl)-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) 4.81 7.73 -6.22 2 3 0 41 383.183 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-bromo-4-fluoro-phenyl)-3-[(1R,3R)-3-(trifluoromethyl)cyclohexyl]urea 1-(2-bromo-4-fluoro-phenyl)-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) 4.81 7.76 -6.39 2 3 0 41 383.183 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-bromo-4-fluoro-phenyl)-3-[(1S,3R)-3-(trifluoromethyl)cyclohexyl]urea 1-(2-bromo-4-fluoro-phenyl)-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) 4.81 7.31 -6.21 2 3 0 41 383.183 3 ↓

    Analogs

    43670435
    43670435

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-(cyclohexylcarbamoylamino)-N-methyl-benzamide 4-(cyclohexylcarbamoylamino)-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) 2.54 3.77 -17.23 3 5 0 70 275.352 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(3-amino-2,6-dimethyl-phenyl)-3-cyclohexyl-urea 1-(3-amino-2,6-dimethyl-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) 2.65 4.53 -12.42 4 4 0 67 261.369 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-cyclohexyl-1-[3-(N-hydroxy-C-methyl-carbonimidoyl)phenyl]urea 3-cyclohexyl-1-[3-(N-hydroxy-C-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) 3.29 3.86 -19.86 3 5 0 74 275.352 3 ↓

    Analogs

    37010023
    37010023

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(phenylcarbamoylamino)cyclohexane-1-carboxylic 1-(phenylcarbamoylamino)cyclohex…

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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) 0.69 6.15 -63.82 2 5 -1 81 261.301 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: methyl methyl

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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 6.62 -13.34 2 5 0 67 310.781 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-(3-aminophenyl)-1-[(1S,2R)-2-methylcyclohexyl]urea 3-(3-aminophenyl)-1-[(1S,2R)-2-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) 2.64 4.66 -12.27 4 4 0 67 247.342 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-(3-aminophenyl)-1-[(1S,2S)-2-methylcyclohexyl]urea 3-(3-aminophenyl)-1-[(1S,2S)-2-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) 2.64 4.24 -12.99 4 4 0 67 247.342 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-(3-aminophenyl)-1-[(1R,2R)-2-methylcyclohexyl]urea 3-(3-aminophenyl)-1-[(1R,2R)-2-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) 2.64 4.24 -13 4 4 0 67 247.342 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-(3-aminophenyl)-1-[(1R,2S)-2-methylcyclohexyl]urea 3-(3-aminophenyl)-1-[(1R,2S)-2-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) 2.64 4.66 -12.26 4 4 0 67 247.342 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(3-amino-3-thioxo-propyl)-3-cyclohexyl-1-phenyl-urea 1-(3-amino-3-thioxo-propyl)-3-cy…

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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 7.2 -14.23 3 4 0 58 305.447 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-cyano-3-fluoro-phenyl)-3-cyclohexyl-urea 1-(2-cyano-3-fluoro-phenyl)-3-cy…

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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) 3.17 6.08 -8.09 2 4 0 65 261.3 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-carbamothioyl-3-fluoro-phenyl)-3-cyclohexyl-urea 1-(2-carbamothioyl-3-fluoro-phen…

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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) 3.22 4.92 -14.92 4 4 0 67 295.383 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-cyclohexyl-N'-(2-fluoro-5-nitrophenyl)urea N-cyclohexyl-N'-(2-fluoro-5-nitr…

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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 -0.91 -11.87 2 6 0 87 281.287 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) 4.08 8.71 -18.81 2 5 0 61 345.487 7 ↓

    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) 3.07 7.2 -19.36 2 5 0 61 317.433 5 ↓

    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) 2.53 3.67 -17.17 3 6 0 79 319.405 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-aminocyclohexyl)-3-(2-methoxyphenyl)urea 1-(4-aminocyclohexyl)-3-(2-metho…

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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) 1.25 2.24 -50.18 5 5 1 78 264.349 3 ↓

    Analogs

    46705169
    46705169
    48388213
    48388213
    473324
    473324
    18174946
    18174946
    19075105
    19075105

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-aminocyclohexyl)-3-(2,4-difluorophenyl)urea 1-(4-aminocyclohexyl)-3-(2,4-dif…

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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) 1.50 2.98 -49.05 5 4 1 69 270.303 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-aminocyclohexyl)-3-(p-tolyl)urea 1-(4-aminocyclohexyl)-3-(p-tolyl…

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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) 1.69 3.5 -50.62 5 4 1 69 248.35 2 ↓

    Analogs

    31089943
    31089943

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-aminocyclohexyl)-3-phenyl-urea 1-(4-aminocyclohexyl)-3-phenyl-urea

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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) 1.24 2.83 -50.68 5 4 1 69 234.323 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-aminocyclohexyl)-3-(2-fluorophenyl)urea 1-(4-aminocyclohexyl)-3-(2-fluor…

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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) 1.36 2.91 -49.44 5 4 1 69 252.313 2 ↓

    Analogs

    31089951
    31089951

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-aminocyclohexyl)-3-(4-fluorophenyl)urea 1-(4-aminocyclohexyl)-3-(4-fluor…

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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) 1.40 2.89 -51.4 5 4 1 69 252.313 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-aminocyclohexyl)-3-(4-methoxyphenyl)urea 1-(4-aminocyclohexyl)-3-(4-metho…

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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) 1.30 2.11 -51.74 5 5 1 78 264.349 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-aminocyclohexyl)-3-(m-tolyl)urea 1-(4-aminocyclohexyl)-3-(m-tolyl…

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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) 1.66 3.47 -50.72 5 4 1 69 248.35 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-methoxyphenyl)-3-[4-(methylamino)cyclohexyl]urea 1-(2-methoxyphenyl)-3-[4-(methyl…

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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) 2.16 3.92 -45.12 4 5 1 67 278.376 4 ↓

    Analogs

    46705169
    46705169
    48388213
    48388213
    473324
    473324
    18174946
    18174946
    19075105
    19075105

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2,4-difluorophenyl)-3-[4-(methylamino)cyclohexyl]urea 1-(2,4-difluorophenyl)-3-[4-(met…

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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 4.69 -43.93 4 4 1 58 284.33 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(methylamino)cyclohexyl]-3-(p-tolyl)urea 1-[4-(methylamino)cyclohexyl]-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) 2.60 5.19 -45.51 4 4 1 58 262.377 3 ↓

    Analogs

    31089943
    31089943

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(methylamino)cyclohexyl]-3-phenyl-urea 1-[4-(methylamino)cyclohexyl]-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) 2.15 4.52 -45.46 4 4 1 58 248.35 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-fluorophenyl)-3-[4-(methylamino)cyclohexyl]urea 1-(2-fluorophenyl)-3-[4-(methyla…

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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) 2.26 4.61 -44.3 4 4 1 58 266.34 3 ↓

    Analogs

    31089951
    31089951

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-fluorophenyl)-3-[4-(methylamino)cyclohexyl]urea 1-(4-fluorophenyl)-3-[4-(methyla…

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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) 2.31 4.58 -46.21 4 4 1 58 266.34 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-methoxyphenyl)-3-[4-(methylamino)cyclohexyl]urea 1-(4-methoxyphenyl)-3-[4-(methyl…

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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) 2.21 3.8 -46.61 4 5 1 67 278.376 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(methylamino)cyclohexyl]-3-(m-tolyl)urea 1-[4-(methylamino)cyclohexyl]-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) 2.57 5.16 -45.61 4 4 1 58 262.377 3 ↓

    Analogs

    46705167
    46705167
    396188
    396188
    401528
    401528

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(ethylamino)cyclohexyl]-3-(2-methoxyphenyl)urea 1-[4-(ethylamino)cyclohexyl]-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) 2.53 5.18 -46.4 4 5 1 67 292.403 5 ↓

    Analogs

    46705169
    46705169
    4109996
    4109996
    8768253
    8768253
    8768256
    8768256

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2,4-difluorophenyl)-3-[4-(ethylamino)cyclohexyl]urea 1-(2,4-difluorophenyl)-3-[4-(eth…

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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 5.96 -45.67 4 4 1 58 298.357 4 ↓

    Analogs

    46705165
    46705165
    396205
    396205
    396224
    396224

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(ethylamino)cyclohexyl]-3-(p-tolyl)urea 1-[4-(ethylamino)cyclohexyl]-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) 2.97 6.46 -47.55 4 4 1 58 276.404 4 ↓

    Analogs

    31089943
    31089943
    6701110
    6701110

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(ethylamino)cyclohexyl]-3-phenyl-urea 1-[4-(ethylamino)cyclohexyl]-3-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) 2.52 5.78 -47.57 4 4 1 58 262.377 4 ↓

    Analogs

    46705159
    46705159
    6183056
    6183056
    6264247
    6264247

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(ethylamino)cyclohexyl]-3-(2-fluorophenyl)urea 1-[4-(ethylamino)cyclohexyl]-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) 2.64 5.87 -45.16 4 4 1 58 280.367 4 ↓

    Analogs

    46705163
    46705163
    31089951
    31089951
    6264245
    6264245
    399812
    399812

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(ethylamino)cyclohexyl]-3-(4-fluorophenyl)urea 1-[4-(ethylamino)cyclohexyl]-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) 2.69 5.85 -48.95 4 4 1 58 280.367 4 ↓

    Analogs

    47544906
    47544906
    396226
    396226
    395455
    395455

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(ethylamino)cyclohexyl]-3-(4-methoxyphenyl)urea 1-[4-(ethylamino)cyclohexyl]-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) 2.58 5.08 -48.83 4 5 1 67 292.403 5 ↓

    Analogs

    32686457
    32686457
    396229
    396229
    395293
    395293

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(ethylamino)cyclohexyl]-3-(m-tolyl)urea 1-[4-(ethylamino)cyclohexyl]-3-(…

    Find On: PubMed — Wikipedia — Google

    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) 2.95 6.46 -47.63 4 4 1 58 276.404 4 ↓

    Analogs

    46705165
    46705165
    396205
    396205
    5953961
    5953961
    5954102
    5954102

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(propylamino)cyclohexyl]-3-(p-tolyl)urea 1-[4-(propylamino)cyclohexyl]-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) 3.48 7.23 -48.55 4 4 1 58 290.431 5 ↓

    Analogs

    395442
    395442
    6264246
    6264246

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-phenyl-3-[4-(propylamino)cyclohexyl]urea 1-phenyl-3-[4-(propylamino)cyclo…

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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) 3.03 6.56 -48.52 4 4 1 58 276.404 5 ↓

    Analogs

    46705159
    46705159
    6264247
    6264247
    6183056
    6183056

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-fluorophenyl)-3-[4-(propylamino)cyclohexyl]urea 1-(2-fluorophenyl)-3-[4-(propyla…

    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) 3.14 6.66 -46.01 4 4 1 58 294.394 5 ↓

    Analogs

    46705163
    46705163
    6264245
    6264245
    399812
    399812
    31089951
    31089951

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-fluorophenyl)-3-[4-(propylamino)cyclohexyl]urea 1-(4-fluorophenyl)-3-[4-(propyla…

    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) 3.19 6.6 -49.92 4 4 1 58 294.394 5 ↓

    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 = 4033 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

    Permalink

    //zinc12.docking.org/results/combination?ring.id=4033&filter.purchasability=annotated

    Embed Link to Results

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