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Popular Name: 1-[2-(4-aminophenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[2-(4-aminophenyl)ethyl]-3-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) 0.98 4.82 -12.37 2 4 0 50 219.288 3 ↓

Analogs

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Popular Name: 1-[(2R)-2-(4-ethoxyphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(4-ethoxyphenyl)-2-(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) 2.27 6.99 -42.36 2 5 1 49 292.403 7 ↓
Hi High (pH 8-9.5) 2.27 6.02 -11.87 1 5 0 45 291.395 7 ↓

Analogs

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Popular Name: 1-[(2S)-2-(4-ethoxyphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(4-ethoxyphenyl)-2-(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) 2.27 7.49 -45.9 2 5 1 49 292.403 7 ↓
Hi High (pH 8-9.5) 2.27 6.47 -12.33 1 5 0 45 291.395 7 ↓

Analogs

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Popular Name: 1-[(2R)-2-(ethylamino)-2-(o-tolyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(ethylamino)-2-(o-toly…

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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) 2.24 7.36 -47.49 2 4 1 40 262.377 5 ↓
Hi High (pH 8-9.5) 2.24 6.6 -10.82 1 4 0 36 261.369 5 ↓

Analogs

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Popular Name: 1-[(2S)-2-(ethylamino)-2-(o-tolyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(ethylamino)-2-(o-toly…

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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) 2.24 7.65 -43.16 2 4 1 40 262.377 5 ↓
Hi High (pH 8-9.5) 2.24 6.74 -10.27 1 4 0 36 261.369 5 ↓

Analogs

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Popular Name: 1-[(2R)-2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(2,4-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.67 8.03 -47.26 2 4 1 40 276.404 5 ↓
Hi High (pH 8-9.5) 2.67 7.26 -10.94 1 4 0 36 275.396 5 ↓

Analogs

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Popular Name: 1-[(2S)-2-(2,4-dimethylphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(2,4-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.67 8.32 -43.28 2 4 1 40 276.404 5 ↓
Hi High (pH 8-9.5) 2.67 7.41 -10.33 1 4 0 36 275.396 5 ↓

Analogs

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Popular Name: 1-[(2R)-2-(ethylamino)-2-(2,4,6-trimethylphenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(ethylamino)-2-(2,4,6-…

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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) 3.04 8.7 -32.06 2 4 1 40 290.431 5 ↓
Hi High (pH 8-9.5) 3.04 8.33 -9.68 1 4 0 36 289.423 5 ↓

Analogs

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Popular Name: 1-[(2S)-2-(ethylamino)-2-(2,4,6-trimethylphenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(ethylamino)-2-(2,4,6-…

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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) 3.04 8.86 -40.76 2 4 1 40 290.431 5 ↓
Hi High (pH 8-9.5) 3.04 7.81 -9.7 1 4 0 36 289.423 5 ↓

Analogs

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Popular Name: 1-[(2R)-2-(2,5-dimethylphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(2,5-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.67 8.04 -47.61 2 4 1 40 276.404 5 ↓
Hi High (pH 8-9.5) 2.67 7.26 -10.91 1 4 0 36 275.396 5 ↓

Analogs

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Popular Name: 1-[(2S)-2-(2,5-dimethylphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(2,5-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.67 8.33 -43.03 2 4 1 40 276.404 5 ↓
Hi High (pH 8-9.5) 2.67 7.41 -10.3 1 4 0 36 275.396 5 ↓

Analogs

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Popular Name: 1-[(2R)-2-(2-ethoxyphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(2-ethoxyphenyl)-2-(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) 2.23 7.19 -44.74 2 5 1 49 292.403 7 ↓
Hi High (pH 8-9.5) 2.23 6.36 -10.19 1 5 0 45 291.395 7 ↓

Analogs

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Popular Name: 1-[(2S)-2-(2-ethoxyphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(2-ethoxyphenyl)-2-(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) 2.23 7.49 -44.15 2 5 1 49 292.403 7 ↓
Hi High (pH 8-9.5) 2.23 6.58 -13.75 1 5 0 45 291.395 7 ↓

Analogs

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Popular Name: 1-[(2S)-2-(ethylamino)-2-(4-propylphenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(ethylamino)-2-(4-prop…

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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) 3.15 9.48 -44.02 2 4 1 40 290.431 7 ↓
Hi High (pH 8-9.5) 3.15 8.38 -11.05 1 4 0 36 289.423 7 ↓

Analogs

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Popular Name: 1-[(2R)-2-(ethylamino)-2-(4-propylphenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(ethylamino)-2-(4-prop…

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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) 3.15 8.96 -40.41 2 4 1 40 290.431 7 ↓
Hi High (pH 8-9.5) 3.15 8.1 -9.98 1 4 0 36 289.423 7 ↓

Analogs

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Popular Name: 1-[(2R)-2-(ethylamino)-2-(2-methoxy-5-methyl-phenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(ethylamino)-2-(2-meth…

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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 6.94 -45.03 2 5 1 49 292.403 6 ↓
Hi High (pH 8-9.5) 2.27 6.11 -10.5 1 5 0 45 291.395 6 ↓

Analogs

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Popular Name: 1-[(2S)-2-(ethylamino)-2-(2-methoxy-5-methyl-phenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(ethylamino)-2-(2-meth…

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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 7.24 -44.1 2 5 1 49 292.403 6 ↓
Hi High (pH 8-9.5) 2.27 6.32 -13.63 1 5 0 45 291.395 6 ↓

Analogs

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Popular Name: 1-[(2R)-2-(3,4-dimethylphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(3,4-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.67 7.97 -40.18 2 4 1 40 276.404 5 ↓
Hi High (pH 8-9.5) 2.67 7.03 -10.58 1 4 0 36 275.396 5 ↓

Analogs

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Popular Name: 1-[(2S)-2-(3,4-dimethylphenyl)-2-(ethylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(3,4-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.67 8.47 -43.84 2 4 1 40 276.404 5 ↓
Hi High (pH 8-9.5) 2.67 7.46 -11.21 1 4 0 36 275.396 5 ↓

Analogs

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Popular Name: 1-[(2S)-2-(ethylamino)-2-(4-ethylphenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(ethylamino)-2-(4-ethy…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.76 8.7 -43.99 2 4 1 40 276.404 6 ↓
Hi High (pH 8-9.5) 2.76 7.6 -11.22 1 4 0 36 275.396 6 ↓

Analogs

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Popular Name: 1-[(2R)-2-(ethylamino)-2-(4-ethylphenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(ethylamino)-2-(4-ethy…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.76 8.18 -40.34 2 4 1 40 276.404 6 ↓
Hi High (pH 8-9.5) 2.76 7.32 -10.11 1 4 0 36 275.396 6 ↓

Analogs

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Popular Name: 1-[(2R)-2-(ethylamino)-2-(4-isopropylphenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(ethylamino)-2-(4-isop…

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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) 3.35 8.7 -40.53 2 4 1 40 290.431 6 ↓
Hi High (pH 8-9.5) 3.35 7.75 -10.14 1 4 0 36 289.423 6 ↓

Analogs

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Popular Name: 1-[(2S)-2-(ethylamino)-2-(4-isopropylphenyl)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(ethylamino)-2-(4-isop…

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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) 3.35 9.19 -43.95 2 4 1 40 290.431 6 ↓
Hi High (pH 8-9.5) 3.35 8.19 -10.8 1 4 0 36 289.423 6 ↓

Analogs

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Popular Name: 1-methyl-3-[(2R)-2-phenyl-2-(propylamino)ethyl]imidazolidin-2-one 1-methyl-3-[(2R)-2-phenyl-2-(pro…

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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) 2.35 7.72 -33.46 2 4 1 40 262.377 6 ↓
Hi High (pH 8-9.5) 2.35 6.67 -10.36 1 4 0 36 261.369 6 ↓

Analogs

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Popular Name: 1-methyl-3-[(2S)-2-phenyl-2-(propylamino)ethyl]imidazolidin-2-one 1-methyl-3-[(2S)-2-phenyl-2-(pro…

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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) 2.35 8.02 -44.54 2 4 1 40 262.377 6 ↓
Hi High (pH 8-9.5) 2.35 7.03 -10.99 1 4 0 36 261.369 6 ↓

Analogs

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Popular Name: 1-methyl-3-[(2R)-2-(propylamino)-2-(p-tolyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2R)-2-(propylamino)…

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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) 2.79 8.2 -41.18 2 4 1 40 276.404 6 ↓
Hi High (pH 8-9.5) 2.79 7.26 -10.36 1 4 0 36 275.396 6 ↓

Analogs

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Popular Name: 1-methyl-3-[(2S)-2-(propylamino)-2-(p-tolyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2S)-2-(propylamino)…

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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) 2.79 8.7 -44.66 2 4 1 40 276.404 6 ↓
Hi High (pH 8-9.5) 2.79 7.69 -11.05 1 4 0 36 275.396 6 ↓

Analogs

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Popular Name: 1-[(2R)-2-(2-methoxyphenyl)-2-(propylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(2-methoxyphenyl)-2-(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) 2.35 6.97 -30.4 2 5 1 49 292.403 7 ↓
Hi High (pH 8-9.5) 2.35 6.19 -10.3 1 5 0 45 291.395 7 ↓

Analogs

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Popular Name: 1-[(2S)-2-(2-methoxyphenyl)-2-(propylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(2-methoxyphenyl)-2-(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) 2.35 7.32 -45 2 5 1 49 292.403 7 ↓
Hi High (pH 8-9.5) 2.35 6.41 -13.76 1 5 0 45 291.395 7 ↓

Analogs

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Popular Name: 1-[(2S)-2-(4-isobutylphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(4-isobutylphenyl)-2-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.77 9.11 -46.44 2 4 1 40 290.431 6 ↓
Hi High (pH 8-9.5) 2.77 7.91 -11.11 1 4 0 36 289.423 6 ↓

Analogs

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Popular Name: 1-[(2R)-2-(4-isobutylphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(4-isobutylphenyl)-2-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.77 8.61 -42.72 2 4 1 40 290.431 6 ↓
Hi High (pH 8-9.5) 2.77 7.62 -10.03 1 4 0 36 289.423 6 ↓

Analogs

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Popular Name: 1-methyl-3-[(2S)-2-(methylamino)-2-(o-tolyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2S)-2-(methylamino)…

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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) 1.87 6.83 -45.7 2 4 1 40 248.35 4 ↓
Hi High (pH 8-9.5) 1.87 5.93 -10.61 1 4 0 36 247.342 4 ↓

Analogs

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Popular Name: 1-methyl-3-[(2R)-2-(methylamino)-2-(o-tolyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2R)-2-(methylamino)…

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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) 1.87 6.54 -49.97 2 4 1 40 248.35 4 ↓
Hi High (pH 8-9.5) 1.87 5.78 -10.62 1 4 0 36 247.342 4 ↓

Analogs

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Popular Name: 1-[(2S)-2-(2,4-dimethylphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(2,4-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.29 7.49 -45.85 2 4 1 40 262.377 4 ↓
Hi High (pH 8-9.5) 2.29 6.59 -10.66 1 4 0 36 261.369 4 ↓

Analogs

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Popular Name: 1-[(2R)-2-(2,4-dimethylphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(2,4-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.29 7.21 -49.74 2 4 1 40 262.377 4 ↓
Hi High (pH 8-9.5) 2.29 6.45 -10.66 1 4 0 36 261.369 4 ↓

Analogs

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Popular Name: 1-methyl-3-[(2S)-2-(methylamino)-2-(2,4,6-trimethylphenyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2S)-2-(methylamino)…

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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 8.23 -36.55 2 4 0 40 276.404 4 ↓
Hi High (pH 8-9.5) 2.67 6.32 -10.08 1 4 0 36 275.396 4 ↓

Analogs

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Popular Name: 1-methyl-3-[(2R)-2-(methylamino)-2-(2,4,6-trimethylphenyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2R)-2-(methylamino)…

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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 7.91 -33.21 2 4 1 40 276.404 4 ↓
Hi High (pH 8-9.5) 2.67 7.4 -9.88 1 4 0 36 275.396 4 ↓

Analogs

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Popular Name: 1-[(2S)-2-(2,5-dimethylphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(2,5-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.29 7.57 -45.66 2 4 1 40 262.377 4 ↓
Hi High (pH 8-9.5) 2.29 6.68 -10.57 1 4 0 36 261.369 4 ↓

Analogs

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Popular Name: 1-[(2R)-2-(2,5-dimethylphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(2,5-dimethylphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.29 7.16 -49.97 2 4 1 40 262.377 4 ↓
Hi High (pH 8-9.5) 2.29 6.08 -10.87 1 4 0 36 261.369 4 ↓

Analogs

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Popular Name: 1-[(2S)-2-(2-ethoxyphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(2-ethoxyphenyl)-2-(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) 1.85 6.66 -46.91 2 5 1 49 278.376 6 ↓
Hi High (pH 8-9.5) 1.85 5.8 -13.84 1 5 0 45 277.368 6 ↓

Analogs

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Popular Name: 1-[(2R)-2-(2-ethoxyphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(2-ethoxyphenyl)-2-(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) 1.85 6.37 -47.51 2 5 1 49 278.376 6 ↓
Hi High (pH 8-9.5) 1.85 5.25 -10.47 1 5 0 45 277.368 6 ↓

Analogs

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Popular Name: 1-methyl-3-[(2S)-2-(methylamino)-2-(4-propoxyphenyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2S)-2-(methylamino)…

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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 7.45 -48.23 2 5 1 49 292.403 7 ↓
Hi High (pH 8-9.5) 2.40 6.24 -11.91 1 5 0 45 291.395 7 ↓

Analogs

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Popular Name: 1-methyl-3-[(2R)-2-(methylamino)-2-(4-propoxyphenyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2R)-2-(methylamino)…

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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 6.95 -44.31 2 5 1 49 292.403 7 ↓
Hi High (pH 8-9.5) 2.40 5.95 -11.64 1 5 0 45 291.395 7 ↓

Analogs

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Popular Name: 1-[(2S)-2-(4-isopropoxyphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(4-isopropoxyphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.26 7.27 -49.47 2 5 1 49 292.403 6 ↓
Hi High (pH 8-9.5) 2.26 6.1 -12.15 1 5 0 45 291.395 6 ↓

Analogs

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Popular Name: 1-[(2R)-2-(4-isopropoxyphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(4-isopropoxyphenyl)-2…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.26 6.8 -45.37 2 5 1 49 292.403 6 ↓
Hi High (pH 8-9.5) 2.26 5.83 -11.79 1 5 0 45 291.395 6 ↓

Analogs

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Popular Name: 1-methyl-3-[(2S)-2-(methylamino)-2-(4-propylphenyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2S)-2-(methylamino)…

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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) 2.77 8.65 -46.34 2 4 1 40 276.404 6 ↓
Hi High (pH 8-9.5) 2.77 7.45 -11.19 1 4 0 36 275.396 6 ↓

Analogs

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Popular Name: 1-methyl-3-[(2R)-2-(methylamino)-2-(4-propylphenyl)ethyl]imidazolidin-2-one 1-methyl-3-[(2R)-2-(methylamino)…

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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) 2.77 8.15 -42.58 2 4 1 40 276.404 6 ↓
Hi High (pH 8-9.5) 2.77 7.16 -10.18 1 4 0 36 275.396 6 ↓

Analogs

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Popular Name: 1-[(2S)-2-(2-methoxy-5-methyl-phenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2S)-2-(2-methoxy-5-methyl-ph…

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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) 1.90 6.41 -46.88 2 5 1 49 278.376 5 ↓
Hi High (pH 8-9.5) 1.90 5.54 -13.81 1 5 0 45 277.368 5 ↓

Analogs

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Popular Name: 1-[(2R)-2-(2-methoxy-5-methyl-phenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(2-methoxy-5-methyl-ph…

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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) 1.90 6.12 -47.81 2 5 1 49 278.376 5 ↓
Hi High (pH 8-9.5) 1.90 4.98 -10.69 1 5 0 45 277.368 5 ↓

Analogs

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Popular Name: 1-[(2R)-2-(3,4-dimethoxyphenyl)-2-(methylamino)ethyl]-3-methyl-imidazolidin-2-one 1-[(2R)-2-(3,4-dimethoxyphenyl)-…

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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 5.13 -48.46 2 6 1 59 294.375 6 ↓
Hi High (pH 8-9.5) 1.11 4.07 -13.67 1 6 0 54 293.367 6 ↓

Parameters Provided:

ring.id = 30852
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 = 30852 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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