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Analogs

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Popular Name: (1R)-2,2-dichloro-N-[2-(2-methoxyphenoxy)ethyl]-1-methyl-cyclopropane-1-carboxamide (1R)-2,2-dichloro-N-[2-(2-methox…

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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 6.32 -11.96 1 4 0 48 318.2 6 ↓

Analogs

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Popular Name: (1S)-2,2-dichloro-N-[2-(2-methoxyphenoxy)ethyl]-1-methyl-cyclopropane-1-carboxamide (1S)-2,2-dichloro-N-[2-(2-methox…

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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 6.31 -11.52 1 4 0 48 318.2 6 ↓

Analogs

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Popular Name: (1S)-2,2-dichloro-1-methyl-N-[2-(4-methylphenoxy)ethyl]cyclopropanecarboxamide (1S)-2,2-dichloro-1-methyl-N-[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) 3.37 7.08 -8.5 1 3 0 38 302.201 5 ↓

Analogs

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Popular Name: (1R)-2,2-dichloro-1-methyl-N-[2-(4-methylphenoxy)ethyl]cyclopropanecarboxamide (1R)-2,2-dichloro-1-methyl-N-[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) 3.37 7.08 -8.78 1 3 0 38 302.201 5 ↓

Analogs

44808256
44808256
44808257
44808257
44827719
44827719
44827720
44827720
44860367
44860367

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Popular Name: N-[2-(3-methylphenoxy)ethyl]cyclopropanecarboxamide N-[2-(3-methylphenoxy)ethyl]cycl…

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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 5.38 -8.46 1 3 0 38 219.284 5 ↓

Analogs

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Popular Name: N-[2-(3-fluorophenoxy)ethyl]-N-methyl-cyclopropanecarboxamide N-[2-(3-fluorophenoxy)ethyl]-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) 2.36 7.31 -13.07 0 3 0 30 237.274 5 ↓

Analogs

44808256
44808256
44808257
44808257
44860367
44860367
44860369
44860369

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Popular Name: N1-[2-(3,5-dimethylphenoxy)ethyl]cyclopropane-1,1-dicarboxamide N1-[2-(3,5-dimethylphenoxy)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) 1.11 2.52 -10.12 3 5 0 81 276.336 6 ↓

Analogs

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Popular Name: (1S)-N-[2-(3-acetamidophenoxy)ethyl]-2,2-dichloro-1-methyl-cyclopropanecarboxamide (1S)-N-[2-(3-acetamidophenoxy)et…

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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 5.31 -16.65 2 5 0 67 345.226 6 ↓

Analogs

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Popular Name: (1R)-N-[2-(3-acetamidophenoxy)ethyl]-2,2-dichloro-1-methyl-cyclopropanecarboxamide (1R)-N-[2-(3-acetamidophenoxy)et…

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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 5.31 -17.21 2 5 0 67 345.226 6 ↓

Analogs

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Popular Name: (1S)-2,2-dichloro-1-methyl-N-[(1R)-1-methyl-2-(3-methylphenoxy)ethyl]cyclopropanecarboxamide (1S)-2,2-dichloro-1-methyl-N-[(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) 3.68 7.97 -7.44 1 3 0 38 316.228 5 ↓

Analogs

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Popular Name: (1S)-2,2-dichloro-1-methyl-N-[(1S)-1-methyl-2-(3-methylphenoxy)ethyl]cyclopropanecarboxamide (1S)-2,2-dichloro-1-methyl-N-[(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) 3.68 7.97 -7.62 1 3 0 38 316.228 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2,2-dichloro-1-methyl-N-[(1R)-1-methyl-2-(3-methylphenoxy)ethyl]cyclopropanecarboxamide (1R)-2,2-dichloro-1-methyl-N-[(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) 3.68 7.97 -7.63 1 3 0 38 316.228 5 ↓

Analogs

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Popular Name: (1R)-2,2-dichloro-1-methyl-N-[(1S)-1-methyl-2-(3-methylphenoxy)ethyl]cyclopropanecarboxamide (1R)-2,2-dichloro-1-methyl-N-[(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) 3.68 7.97 -7.45 1 3 0 38 316.228 5 ↓

Analogs

37802423
37802423
37802424
37802424

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Popular Name: (1S,2R)-N-[2-(2,3-dichlorophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1S,2R)-N-[2-(2,3-dichlorophenox…

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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 6.45 -9.92 1 3 0 38 288.174 5 ↓

Analogs

37802423
37802423
37802424
37802424

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Popular Name: (1S,2S)-N-[2-(2,3-dichlorophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1S,2S)-N-[2-(2,3-dichlorophenox…

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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 6.41 -10.61 1 3 0 38 288.174 5 ↓

Analogs

37802423
37802423
37802424
37802424

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Popular Name: (1R,2R)-N-[2-(2,3-dichlorophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1R,2R)-N-[2-(2,3-dichlorophenox…

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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 6.41 -10.63 1 3 0 38 288.174 5 ↓

Analogs

37802423
37802423
37802424
37802424

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-N-[2-(2,3-dichlorophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1R,2S)-N-[2-(2,3-dichlorophenox…

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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 6.45 -9.94 1 3 0 38 288.174 5 ↓

Analogs

40975830
40975830
40975832
40975832

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Popular Name: (1R,2S)-N-[(1R)-2-(2,6-dimethylphenoxy)-1-methyl-ethyl]-2-methyl-cyclopropanecarboxamide (1R,2S)-N-[(1R)-2-(2,6-dimethylp…

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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) 3.71 7.75 -6.4 1 3 0 38 261.365 5 ↓

Analogs

40975830
40975830
40975832
40975832

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Popular Name: (1R,2S)-N-[(1S)-2-(2,6-dimethylphenoxy)-1-methyl-ethyl]-2-methyl-cyclopropanecarboxamide (1R,2S)-N-[(1S)-2-(2,6-dimethylp…

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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) 3.71 7.75 -6.39 1 3 0 38 261.365 5 ↓

Analogs

40975830
40975830
40975832
40975832

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Popular Name: (1S,2S)-N-[(1R)-2-(2,6-dimethylphenoxy)-1-methyl-ethyl]-2-methyl-cyclopropanecarboxamide (1S,2S)-N-[(1R)-2-(2,6-dimethylp…

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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) 3.71 7.7 -7 1 3 0 38 261.365 5 ↓

Analogs

40975830
40975830
40975832
40975832

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-N-[(1S)-2-(2,6-dimethylphenoxy)-1-methyl-ethyl]-2-methyl-cyclopropanecarboxamide (1S,2S)-N-[(1S)-2-(2,6-dimethylp…

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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) 3.71 7.7 -7 1 3 0 38 261.365 5 ↓

Analogs

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Popular Name: (1R,2S)-N-[2-(3-bromophenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1R,2S)-N-[2-(3-bromophenoxy)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) 2.27 6.79 -16.95 1 6 0 84 329.15 6 ↓

Analogs

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Popular Name: (1S,2S)-N-[2-(3-bromophenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1S,2S)-N-[2-(3-bromophenoxy)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) 2.27 5.73 -10.74 1 6 0 84 329.15 6 ↓

Analogs

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Popular Name: (1R,2R)-N-[2-(3-bromophenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1R,2R)-N-[2-(3-bromophenoxy)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) 2.27 5.73 -10.41 1 6 0 84 329.15 6 ↓

Analogs

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Popular Name: (1S,2R)-N-[2-(3-bromophenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1S,2R)-N-[2-(3-bromophenoxy)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) 2.27 6.79 -16.93 1 6 0 84 329.15 6 ↓

Analogs

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Popular Name: (1R,2S)-N-[2-(2,3-dichlorophenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1R,2S)-N-[2-(2,3-dichlorophenox…

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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) 2.74 7.19 -19.19 1 6 0 84 319.144 6 ↓

Analogs

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Popular Name: (1S,2S)-N-[2-(2,3-dichlorophenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1S,2S)-N-[2-(2,3-dichlorophenox…

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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) 2.74 6.13 -14.02 1 6 0 84 319.144 6 ↓

Analogs

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Popular Name: (1R,2R)-N-[2-(2,3-dichlorophenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1R,2R)-N-[2-(2,3-dichlorophenox…

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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) 2.74 6.13 -12.56 1 6 0 84 319.144 6 ↓

Analogs

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Popular Name: (1S,2R)-N-[2-(2,3-dichlorophenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1S,2R)-N-[2-(2,3-dichlorophenox…

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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) 2.74 7.19 -19.53 1 6 0 84 319.144 6 ↓

Analogs

37799301
37799301
37799302
37799302

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Popular Name: (1S,2R)-N-[2-(3-bromophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1S,2R)-N-[2-(3-bromophenoxy)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) 3.37 6.05 -8.14 1 3 0 38 298.18 5 ↓

Analogs

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Popular Name: (1S,2S)-N-[2-(3-bromophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1S,2S)-N-[2-(3-bromophenoxy)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) 3.37 6 -8.85 1 3 0 38 298.18 5 ↓

Analogs

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Popular Name: (1R,2R)-N-[2-(3-bromophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1R,2R)-N-[2-(3-bromophenoxy)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) 3.37 6 -8.82 1 3 0 38 298.18 5 ↓

Analogs

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Popular Name: (1R,2S)-N-[2-(3-bromophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1R,2S)-N-[2-(3-bromophenoxy)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) 3.37 6.05 -8.15 1 3 0 38 298.18 5 ↓

Analogs

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Popular Name: (1R,2S)-N-[(1R)-1-methyl-2-(4-methylphenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1R,2S)-N-[(1R)-1-methyl-2-(4-me…

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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 7.72 -15.62 1 6 0 84 278.308 6 ↓

Analogs

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Popular Name: (1R,2S)-N-[(1S)-1-methyl-2-(4-methylphenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1R,2S)-N-[(1S)-1-methyl-2-(4-me…

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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 7.72 -15.72 1 6 0 84 278.308 6 ↓

Analogs

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Popular Name: (1S,2S)-N-[(1R)-1-methyl-2-(4-methylphenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1S,2S)-N-[(1R)-1-methyl-2-(4-me…

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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 6.67 -9.82 1 6 0 84 278.308 6 ↓

Analogs

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Popular Name: (1S,2S)-N-[(1S)-1-methyl-2-(4-methylphenoxy)ethyl]-2-nitro-cyclopropanecarboxamide (1S,2S)-N-[(1S)-1-methyl-2-(4-me…

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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 6.67 -9.26 1 6 0 84 278.308 6 ↓

Analogs

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Popular Name: (1S)-2,2-dichloro-1-methyl-N-[(1R)-1-methyl-2-(4-methylphenoxy)ethyl]cyclopropanecarboxamide (1S)-2,2-dichloro-1-methyl-N-[(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) 3.70 7.97 -7.32 1 3 0 38 316.228 5 ↓

Analogs

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Popular Name: (1S)-2,2-dichloro-1-methyl-N-[(1S)-1-methyl-2-(4-methylphenoxy)ethyl]cyclopropanecarboxamide (1S)-2,2-dichloro-1-methyl-N-[(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) 3.70 7.97 -7.55 1 3 0 38 316.228 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2,2-dichloro-1-methyl-N-[(1R)-1-methyl-2-(4-methylphenoxy)ethyl]cyclopropanecarboxamide (1R)-2,2-dichloro-1-methyl-N-[(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) 3.70 7.97 -7.54 1 3 0 38 316.228 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-2,2-dichloro-1-methyl-N-[(1S)-1-methyl-2-(4-methylphenoxy)ethyl]cyclopropanecarboxamide (1R)-2,2-dichloro-1-methyl-N-[(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) 3.70 7.97 -7.31 1 3 0 38 316.228 5 ↓

Analogs

37799277
37799277
37799278
37799278
37799293
37799293
37799294
37799294

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Popular Name: (1S,2R)-N-[2-(4-bromophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1S,2R)-N-[2-(4-bromophenoxy)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) 3.39 6.05 -7.48 1 3 0 38 298.18 5 ↓

Analogs

37799277
37799277
37799278
37799278
37799293
37799293
37799294
37799294

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-N-[2-(4-bromophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1S,2S)-N-[2-(4-bromophenoxy)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) 3.39 6 -8.16 1 3 0 38 298.18 5 ↓

Analogs

37799277
37799277
37799278
37799278
37799293
37799293
37799294
37799294

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-N-[2-(4-bromophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1R,2R)-N-[2-(4-bromophenoxy)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) 3.39 6 -8.19 1 3 0 38 298.18 5 ↓

Analogs

37799266
37799266
37799277
37799277
37799278
37799278
37799293
37799293

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-N-[2-(4-bromophenoxy)ethyl]-2-methyl-cyclopropanecarboxamide (1R,2S)-N-[2-(4-bromophenoxy)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) 3.39 6.05 -7.52 1 3 0 38 298.18 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-2-[methyl(2-phenoxyethyl)carbamoyl]cyclopropanecarboxylic (1S,2R)-2-[methyl(2-phenoxyethyl…

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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 7.79 -57.55 0 5 -1 70 262.285 6 ↓
Lo Low (pH 4.5-6) 1.69 5.86 -18.02 1 5 0 67 263.293 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2S)-2-[methyl(2-phenoxyethyl)carbamoyl]cyclopropanecarboxylic (1S,2S)-2-[methyl(2-phenoxyethyl…

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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 7.87 -56.66 0 5 -1 70 262.285 6 ↓
Lo Low (pH 4.5-6) 1.69 5.88 -13.67 1 5 0 67 263.293 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2R)-2-[methyl(2-phenoxyethyl)carbamoyl]cyclopropanecarboxylic (1R,2R)-2-[methyl(2-phenoxyethyl…

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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 7.87 -54.85 0 5 -1 70 262.285 6 ↓
Lo Low (pH 4.5-6) 1.69 5.87 -12.75 1 5 0 67 263.293 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,2S)-2-[methyl(2-phenoxyethyl)carbamoyl]cyclopropanecarboxylic (1R,2S)-2-[methyl(2-phenoxyethyl…

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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 7.78 -59.26 0 5 -1 70 262.285 6 ↓
Lo Low (pH 4.5-6) 1.69 5.92 -17.35 1 5 0 67 263.293 6 ↓

Analogs

9246136
9246136
9246137
9246137

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,2R)-2-[2-(4-chlorophenoxy)ethyl-methyl-carbamoyl]cyclopropanecarboxylic (1S,2R)-2-[2-(4-chlorophenoxy)et…

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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) 2.37 8.31 -55.36 0 5 -1 70 296.73 6 ↓
Lo Low (pH 4.5-6) 2.37 6.38 -17.07 1 5 0 67 297.738 6 ↓

Parameters Provided:

ring.id = 79147
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 = 79147 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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