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Analogs

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Popular Name: N-[(2S)-3-methyl-2-morpholino-butyl]cyclopropanamine N-[(2S)-3-methyl-2-morpholino-bu…

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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) 1.45 3.49 -35.26 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.45 5.19 -112.87 3 3 2 30 214.353 5 ↓

Analogs

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Popular Name: N-[(2R)-3-methyl-2-morpholino-butyl]cyclopropanamine N-[(2R)-3-methyl-2-morpholino-bu…

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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) 1.45 3.37 -35.46 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.45 5.86 -106.64 3 3 2 30 214.353 5 ↓

Analogs

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Popular Name: N-[(2S)-2-morpholinopropyl]cyclopropanamine N-[(2S)-2-morpholinopropyl]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) 0.67 2.45 -35.1 2 3 1 29 185.291 4 ↓
Lo Low (pH 4.5-6) 0.67 4.3 -111.28 3 3 2 30 186.299 4 ↓

Analogs

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Popular Name: N-[(2R)-2-morpholinopropyl]cyclopropanamine N-[(2R)-2-morpholinopropyl]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) 0.67 2.36 -35.26 2 3 1 29 185.291 4 ↓
Lo Low (pH 4.5-6) 0.67 4.3 -111.39 3 3 2 30 186.299 4 ↓

Analogs

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Popular Name: N-[(2S)-2-morpholinobutyl]cyclopropanamine N-[(2S)-2-morpholinobutyl]cyclop…

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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) 1.21 3.07 -35.2 2 3 1 29 199.318 5 ↓
Lo Low (pH 4.5-6) 1.21 4.82 -112.4 3 3 2 30 200.326 5 ↓

Analogs

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Popular Name: N-[(2R)-2-morpholinobutyl]cyclopropanamine N-[(2R)-2-morpholinobutyl]cyclop…

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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) 1.21 3.08 -35.37 2 3 1 29 199.318 5 ↓
Lo Low (pH 4.5-6) 1.21 5.39 -106.25 3 3 2 30 200.326 5 ↓

Analogs

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Popular Name: N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(2S,6R)-2,6-dimethylm…

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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) 2.17 5.26 -35.53 2 3 1 29 241.399 5 ↓
Lo Low (pH 4.5-6) 2.17 7.29 -106.73 3 3 2 30 242.407 5 ↓

Analogs

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Popular Name: N-[(2R)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(2S,6S)-2,6-dimethylm…

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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) 2.17 5.47 -35.44 2 3 1 29 241.399 5 ↓
Lo Low (pH 4.5-6) 2.17 7.24 -106.57 3 3 2 30 242.407 5 ↓

Analogs

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Popular Name: N-[(2R)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(2R,6R)-2,6-dimethylm…

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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) 2.17 5.55 -35.77 2 3 1 29 241.399 5 ↓
Lo Low (pH 4.5-6) 2.17 7.26 -106.83 3 3 2 30 242.407 5 ↓

Analogs

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Popular Name: N-[(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2S,6R)-2,6-dimethylm…

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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 4 -35.73 2 3 1 29 213.345 4 ↓
Lo Low (pH 4.5-6) 1.40 5.83 -114.5 3 3 2 30 214.353 4 ↓

Analogs

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Popular Name: N-[(2S)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2S,6S)-2,6-dimethylm…

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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 4.23 -35.98 2 3 1 29 213.345 4 ↓
Lo Low (pH 4.5-6) 1.40 5.79 -112.77 3 3 2 30 214.353 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2R,6R)-2,6-dimethylm…

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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 4.3 -36.25 2 3 1 29 213.345 4 ↓
Lo Low (pH 4.5-6) 1.40 5.79 -112.86 3 3 2 30 214.353 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(2S,6R)-2,6-dimethylm…

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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) 1.93 4.56 -35.96 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.93 6.31 -115.25 3 3 2 30 228.38 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-2-[(2S,6R)-2,6-dimethylm…

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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) 1.93 4.35 -36.14 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.93 6.89 -107.87 3 3 2 30 228.38 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(2R,6R)-2,6-dimethylm…

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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) 1.93 4.83 -36.36 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.93 6.27 -113.72 3 3 2 30 228.38 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-2-[(2R,6R)-2,6-dimethylm…

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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) 1.93 4.84 -36.3 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.93 6.85 -107.93 3 3 2 30 228.38 5 ↓

Analogs

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Popular Name: N-[(2R)-3-methyl-2-[(2R)-2-methylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-3-methyl-2-[(2R)-2-methy…

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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) 1.81 4.18 -35.73 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.81 6.64 -107.44 3 3 2 30 228.38 5 ↓

Analogs

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Popular Name: N-[(2R)-3-methyl-2-[(2S)-2-methylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-3-methyl-2-[(2S)-2-methy…

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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) 1.81 4 -35.91 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.81 6.64 -107.22 3 3 2 30 228.38 5 ↓

Analogs

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Popular Name: N-[(2S)-2-[(2R)-2-methylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2R)-2-methylmorpholi…

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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) 1.03 3.27 -35.4 2 3 1 29 199.318 4 ↓
Lo Low (pH 4.5-6) 1.03 5.1 -113 3 3 2 30 200.326 4 ↓

Analogs

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Popular Name: N-[(2S)-2-[(2S)-2-methylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2S)-2-methylmorpholi…

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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) 1.03 3.2 -35.33 2 3 1 29 199.318 4 ↓
Lo Low (pH 4.5-6) 1.03 5.09 -113.03 3 3 2 30 200.326 4 ↓

Analogs

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Popular Name: N-[(2S)-2-[(2R)-2-methylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(2R)-2-methylmorpholi…

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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) 1.57 3.81 -35.61 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.57 5.56 -113.89 3 3 2 30 214.353 5 ↓

Analogs

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Popular Name: N-[(2R)-2-[(2R)-2-methylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-2-[(2R)-2-methylmorpholi…

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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) 1.57 3.82 -35.51 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.57 6.15 -107.44 3 3 2 30 214.353 5 ↓

Analogs

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Popular Name: N-[(2R)-3-methyl-2-[(3R)-3-methylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-3-methyl-2-[(3R)-3-methy…

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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) 1.78 3.85 -35.7 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.78 6.1 -103.83 3 3 2 30 228.38 5 ↓

Analogs

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Popular Name: N-[(2R)-3-methyl-2-[(3S)-3-methylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-3-methyl-2-[(3S)-3-methy…

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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) 1.78 4.7 -33.49 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.78 6.37 -103.15 3 3 2 30 228.38 5 ↓

Analogs

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Popular Name: N-[(2S)-2-[(3R)-3-methylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(3R)-3-methylmorpholi…

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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) 1.00 3.04 -33.01 2 3 1 29 199.318 4 ↓
Lo Low (pH 4.5-6) 1.00 4.77 -108 3 3 2 30 200.326 4 ↓

Analogs

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Popular Name: N-[(2S)-2-[(3S)-3-methylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(3S)-3-methylmorpholi…

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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) 1.00 3.03 -35.25 2 3 1 29 199.318 4 ↓
Lo Low (pH 4.5-6) 1.00 4.85 -109.35 3 3 2 30 200.326 4 ↓

Analogs

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Popular Name: N-[(2S)-2-[(3S)-3-methylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(3S)-3-methylmorpholi…

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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) 1.53 3.62 -35.46 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.53 5.24 -110.05 3 3 2 30 214.353 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-[(3S)-3-methylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-2-[(3S)-3-methylmorpholi…

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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) 1.53 4.01 -33.58 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.53 5.87 -102.67 3 3 2 30 214.353 5 ↓

Analogs

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Popular Name: N-[(2R)-2-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(2R,5R)-2,5-dimethylm…

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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) 2.14 3.82 -35.21 2 3 1 29 241.399 5 ↓
Lo Low (pH 4.5-6) 2.14 6.53 -110.75 3 3 2 30 242.407 5 ↓

Analogs

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Popular Name: N-[(2R)-2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(2S,5R)-2,5-dimethylm…

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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) 2.14 4.59 -35.99 2 3 1 29 241.399 5 ↓
Lo Low (pH 4.5-6) 2.14 6.92 -104.07 3 3 2 30 242.407 5 ↓

Analogs

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Popular Name: N-[(2S)-2-[(2R,5R)-2,5-dimethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2R,5R)-2,5-dimethylm…

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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 3.69 -35 2 3 1 29 213.345 4 ↓
Lo Low (pH 4.5-6) 1.36 5.37 -112.5 3 3 2 30 214.353 4 ↓

Analogs

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Popular Name: N-[(2S)-2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2S,5R)-2,5-dimethylm…

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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 3.72 -35.05 2 3 1 29 213.345 4 ↓
Lo Low (pH 4.5-6) 1.36 5.51 -109.2 3 3 2 30 214.353 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(2S,5S)-2,5-dimethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(2S,5S)-2,5-dimethylm…

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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 3.55 -35.6 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.90 6.34 -110.64 3 3 2 30 228.38 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-[(2S,5S)-2,5-dimethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2R)-2-[(2S,5S)-2,5-dimethylm…

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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 4.23 -35.09 2 3 1 29 227.372 5 ↓
Lo Low (pH 4.5-6) 1.90 6.57 -103.99 3 3 2 30 228.38 5 ↓

Analogs

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Popular Name: N-[(2R)-2-[(2R)-2-ethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(2R)-2-ethylmorpholin…

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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 5.53 -35.19 2 3 1 29 241.399 6 ↓
Lo Low (pH 4.5-6) 2.31 7.37 -107.62 3 3 2 30 242.407 6 ↓

Analogs

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Popular Name: N-[(2R)-2-[(2S)-2-ethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(2S)-2-ethylmorpholin…

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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 5.49 -35.16 2 3 1 29 241.399 6 ↓
Lo Low (pH 4.5-6) 2.31 7.35 -107.81 3 3 2 30 242.407 6 ↓

Analogs

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Popular Name: N-[(2S)-2-[(2R)-2-ethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2R)-2-ethylmorpholin…

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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) 1.53 4.1 -35.47 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.53 5.92 -114.38 3 3 2 30 214.353 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(2S)-2-ethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(2S)-2-ethylmorpholin…

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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) 1.53 4.04 -35.26 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.53 5.91 -114.09 3 3 2 30 214.353 5 ↓

Analogs

43893282
43893282
43893284
43893284

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Popular Name: N-[(2S)-2-[(2R)-2-ethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(2R)-2-ethylmorpholin…

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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) 2.07 4.65 -35.6 2 3 1 29 227.372 6 ↓
Lo Low (pH 4.5-6) 2.07 6.39 -115.29 3 3 2 30 228.38 6 ↓

Analogs

43893282
43893282
43893284
43893284

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(2S)-2-ethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(2S)-2-ethylmorpholin…

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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) 2.07 4.64 -35.45 2 3 1 29 227.372 6 ↓
Lo Low (pH 4.5-6) 2.07 6.4 -114.87 3 3 2 30 228.38 6 ↓

Analogs

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Popular Name: N-[(2R)-2-[(3R)-3-ethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(3R)-3-ethylmorpholin…

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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 4.57 -36.08 2 3 1 29 241.399 6 ↓
Lo Low (pH 4.5-6) 2.31 6.58 -103.96 3 3 2 30 242.407 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-[(3S)-3-ethylmorpholin-4-yl]-3-methyl-butyl]cyclopropanamine N-[(2R)-2-[(3S)-3-ethylmorpholin…

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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 5.28 -33.89 2 3 1 29 241.399 6 ↓
Lo Low (pH 4.5-6) 2.31 6.98 -103.53 3 3 2 30 242.407 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(3R)-3-ethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(3R)-3-ethylmorpholin…

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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) 1.53 3.64 -33.15 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.53 5.58 -101.7 3 3 2 30 214.353 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(3S)-3-ethylmorpholin-4-yl]propyl]cyclopropanamine N-[(2S)-2-[(3S)-3-ethylmorpholin…

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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) 1.53 3.63 -35.7 2 3 1 29 213.345 5 ↓
Lo Low (pH 4.5-6) 1.53 5.44 -110.89 3 3 2 30 214.353 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(3R)-3-ethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(3R)-3-ethylmorpholin…

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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) 2.07 4.81 -33.79 2 3 1 29 227.372 6 ↓
Lo Low (pH 4.5-6) 2.07 6.42 -102.4 3 3 2 30 228.38 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-[(3S)-3-ethylmorpholin-4-yl]butyl]cyclopropanamine N-[(2S)-2-[(3S)-3-ethylmorpholin…

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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) 2.07 4.21 -35.89 2 3 1 29 227.372 6 ↓
Lo Low (pH 4.5-6) 2.07 5.92 -111.61 3 3 2 30 228.38 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-(2,2-dimethylmorpholin-4-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(2,2-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) 2.26 5.16 -36.43 2 3 1 29 241.399 5 ↓
Lo Low (pH 4.5-6) 2.26 6.55 -114.07 3 3 2 30 242.407 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(2,2-dimethylmorpholin-4-yl)-3-methyl-butyl]cyclopropanamine N-[(2R)-2-(2,2-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) 2.26 5.07 -36.74 2 3 1 29 241.399 5 ↓
Lo Low (pH 4.5-6) 2.26 7.22 -107.81 3 3 2 30 242.407 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-(2,2-dimethylmorpholin-4-yl)propyl]cyclopropanamine N-[(2S)-2-(2,2-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) 1.48 4.02 -36.34 2 3 1 29 213.345 4 ↓
Lo Low (pH 4.5-6) 1.48 5.65 -112.67 3 3 2 30 214.353 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-(2,2-dimethylmorpholin-4-yl)propyl]cyclopropanamine N-[(2R)-2-(2,2-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) 1.48 4.03 -36.48 2 3 1 29 213.345 4 ↓
Lo Low (pH 4.5-6) 1.48 5.66 -112.76 3 3 2 30 214.353 4 ↓

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 = 225066 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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