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Analogs

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Popular Name: (1R,5S)-8-[(1S)-1-cyclopentylethyl]-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-8-[(1S)-1-cyclopentyleth…

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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) 3.38 8.64 -99.39 3 2 2 21 252.446 4 ↓
Hi High (pH 8-9.5) 3.38 7.46 -28.31 2 2 1 16 251.438 4 ↓
Mid Mid (pH 6-8) 3.38 6.65 -35.86 2 2 1 20 251.438 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,5S)-8-[(1S)-1-cyclopentylethyl]-N-methyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-8-[(1S)-1-cyclopentyleth…

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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) 3.01 8.58 -97.73 3 2 2 21 238.419 3 ↓
Mid Mid (pH 6-8) 3.01 8.6 -26.55 2 2 1 16 237.411 3 ↓
Mid Mid (pH 6-8) 3.01 6.62 -33.62 2 2 1 20 237.411 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,5S)-8-[(1R)-1-cyclopentylethyl]-N-methyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-8-[(1R)-1-cyclopentyleth…

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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) 3.01 8.33 -97.6 3 2 2 21 238.419 3 ↓
Mid Mid (pH 6-8) 3.01 8.41 -26.55 2 2 1 16 237.411 3 ↓
Mid Mid (pH 6-8) 3.01 6.23 -33.78 2 2 1 20 237.411 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,5S)-8-[(1S)-1-cyclopentylethyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-8-[(1S)-1-cyclopentyleth…

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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) 3.89 9.39 -101.37 3 2 2 21 266.473 5 ↓
Mid Mid (pH 6-8) 3.89 7.41 -36.65 2 2 1 20 265.465 5 ↓