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Analogs

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Popular Name: N-[(2S)-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]cyclopropanamine N-[(2S)-2-(4-bromo-3,5-dimethyl-…

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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) 2.08 6.33 -42.16 2 3 1 34 273.198 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]cyclopropanamine N-[(2R)-2-(4-bromo-3,5-dimethyl-…

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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) 2.08 6.32 -41.9 2 3 1 34 273.198 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2R)-2-(4-bromo-3,5-dimethyl-…

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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) 2.83 7.89 -38.67 2 3 1 34 301.252 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(4-bromo-3,5-dimethyl-…

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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) 2.83 7.96 -38.5 2 3 1 34 301.252 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)butyl]cyclopropanamine N-[(2S)-2-(4-bromo-3,5-dimethyl-…

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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 7.31 -38.82 2 3 1 34 287.225 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)butyl]cyclopropanamine N-[(2R)-2-(4-bromo-3,5-dimethyl-…

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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 7.2 -42.95 2 3 1 34 287.225 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)propyl]cyclopropanamine N-[(2S)-2-(4-chloro-3,5-dimethyl…

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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) 1.95 6.25 -42.15 2 3 1 34 228.747 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)propyl]cyclopropanamine N-[(2R)-2-(4-chloro-3,5-dimethyl…

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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) 1.95 6.24 -41.91 2 3 1 34 228.747 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2R)-2-(4-chloro-3,5-dimethyl…

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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) 2.70 7.82 -38.67 2 3 1 34 256.801 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(4-chloro-3,5-dimethyl…

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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) 2.70 7.88 -38.48 2 3 1 34 256.801 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butyl]cyclopropanamine N-[(2S)-2-(4-chloro-3,5-dimethyl…

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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) 2.45 7.23 -38.79 2 3 1 34 242.774 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)butyl]cyclopropanamine N-[(2R)-2-(4-chloro-3,5-dimethyl…

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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) 2.45 7.13 -42.86 2 3 1 34 242.774 5 ↓

Analogs

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Popular Name: N-[(2S)-2-pyrazol-1-ylpropyl]cyclopropanamine N-[(2S)-2-pyrazol-1-ylpropyl]cyc…

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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) 0.90 4.5 -40.07 2 3 1 34 166.248 4 ↓

Analogs

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Popular Name: N-[(2R)-2-pyrazol-1-ylpropyl]cyclopropanamine N-[(2R)-2-pyrazol-1-ylpropyl]cyc…

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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) 0.90 4.51 -40.27 2 3 1 34 166.248 4 ↓

Analogs

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Popular Name: N-[(2S)-3-methyl-2-pyrazol-1-yl-butyl]cyclopropanamine N-[(2S)-3-methyl-2-pyrazol-1-yl-…

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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) 1.65 5.98 -39.59 2 3 1 34 194.302 5 ↓

Analogs

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Popular Name: N-[(2R)-3-methyl-2-pyrazol-1-yl-butyl]cyclopropanamine N-[(2R)-3-methyl-2-pyrazol-1-yl-…

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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) 1.65 6 -39.58 2 3 1 34 194.302 5 ↓

Analogs

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Popular Name: N-[(2S)-2-pyrazol-1-ylbutyl]cyclopropanamine N-[(2S)-2-pyrazol-1-ylbutyl]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) 1.40 5.41 -34.03 2 3 1 34 180.275 5 ↓

Analogs

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Popular Name: N-[(2R)-2-pyrazol-1-ylbutyl]cyclopropanamine N-[(2R)-2-pyrazol-1-ylbutyl]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) 1.40 5.23 -41.11 2 3 1 34 180.275 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]cyclopropanamine N-[(2S)-2-(3,5-dimethylpyrazol-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) 1.34 5.76 -40.31 2 3 1 34 194.302 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]cyclopropanamine N-[(2R)-2-(3,5-dimethylpyrazol-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) 1.34 5.75 -40.01 2 3 1 34 194.302 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2R)-2-(3,5-dimethylpyrazol-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) 2.09 7.32 -36.66 2 3 1 34 222.356 5 ↓
Lo Low (pH 4.5-6) 2.09 7.45 -93.1 3 3 2 36 223.364 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(3,5-dimethylpyrazol-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) 2.09 7.39 -36.54 2 3 1 34 222.356 5 ↓
Lo Low (pH 4.5-6) 2.09 7.51 -92.95 3 3 2 36 223.364 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)butyl]cyclopropanamine N-[(2S)-2-(3,5-dimethylpyrazol-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) 1.85 6.74 -36.78 2 3 1 34 208.329 5 ↓
Lo Low (pH 4.5-6) 1.85 6.86 -93.07 3 3 2 36 209.337 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)butyl]cyclopropanamine N-[(2R)-2-(3,5-dimethylpyrazol-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) 1.85 6.64 -40.96 2 3 1 34 208.329 5 ↓
Lo Low (pH 4.5-6) 1.85 6.76 -92.2 3 3 2 36 209.337 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-methylpyrazol-1-yl)propyl]cyclopropanamine N-[(2S)-2-(4-methylpyrazol-1-yl)…

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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) 1.28 5.18 -39.96 2 3 1 34 180.275 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-methylpyrazol-1-yl)propyl]cyclopropanamine N-[(2R)-2-(4-methylpyrazol-1-yl)…

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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) 1.28 5.18 -40.11 2 3 1 34 180.275 4 ↓

Analogs

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Popular Name: N-[(2R)-3-methyl-2-(4-methylpyrazol-1-yl)butyl]cyclopropanamine N-[(2R)-3-methyl-2-(4-methylpyra…

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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) 2.02 6.63 -39.34 2 3 1 34 208.329 5 ↓

Analogs

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Popular Name: N-[(2S)-3-methyl-2-(4-methylpyrazol-1-yl)butyl]cyclopropanamine N-[(2S)-3-methyl-2-(4-methylpyra…

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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) 2.02 6.7 -39.38 2 3 1 34 208.329 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-methylpyrazol-1-yl)butyl]cyclopropanamine N-[(2S)-2-(4-methylpyrazol-1-yl)…

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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 6.09 -33.93 2 3 1 34 194.302 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-methylpyrazol-1-yl)butyl]cyclopropanamine N-[(2R)-2-(4-methylpyrazol-1-yl)…

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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 5.91 -40.88 2 3 1 34 194.302 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-chloropyrazol-1-yl)propyl]cyclopropanamine N-[(2S)-2-(4-chloropyrazol-1-yl)…

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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) 1.51 5.02 -41.65 2 3 1 34 200.693 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-chloropyrazol-1-yl)propyl]cyclopropanamine N-[(2R)-2-(4-chloropyrazol-1-yl)…

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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) 1.51 5.02 -41.84 2 3 1 34 200.693 4 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-chloropyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(4-chloropyrazol-1-yl)…

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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) 2.25 6.51 -40.9 2 3 1 34 228.747 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-chloropyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2R)-2-(4-chloropyrazol-1-yl)…

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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) 2.25 6.52 -40.92 2 3 1 34 228.747 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-chloropyrazol-1-yl)butyl]cyclopropanamine N-[(2S)-2-(4-chloropyrazol-1-yl)…

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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) 2.01 5.93 -36.34 2 3 1 34 214.72 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-chloropyrazol-1-yl)butyl]cyclopropanamine N-[(2R)-2-(4-chloropyrazol-1-yl)…

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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) 2.01 5.74 -42.78 2 3 1 34 214.72 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-bromopyrazol-1-yl)propyl]cyclopropanamine N-[(2S)-2-(4-bromopyrazol-1-yl)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) 1.64 5.12 -41.66 2 3 1 34 245.144 4 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-bromopyrazol-1-yl)propyl]cyclopropanamine N-[(2R)-2-(4-bromopyrazol-1-yl)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) 1.64 5.12 -41.84 2 3 1 34 245.144 4 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-bromopyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2S)-2-(4-bromopyrazol-1-yl)-…

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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) 2.38 6.62 -40.84 2 3 1 34 273.198 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-bromopyrazol-1-yl)-3-methyl-butyl]cyclopropanamine N-[(2R)-2-(4-bromopyrazol-1-yl)-…

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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) 2.38 6.62 -40.91 2 3 1 34 273.198 5 ↓

Analogs

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Popular Name: N-[(2S)-2-(4-bromopyrazol-1-yl)butyl]cyclopropanamine N-[(2S)-2-(4-bromopyrazol-1-yl)b…

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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 6.02 -36.31 2 3 1 34 259.171 5 ↓

Analogs

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Popular Name: N-[(2R)-2-(4-bromopyrazol-1-yl)butyl]cyclopropanamine N-[(2R)-2-(4-bromopyrazol-1-yl)b…

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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 5.84 -42.7 2 3 1 34 259.171 5 ↓

Analogs

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Popular Name: N-[2-(4-chloro-3-nitro-pyrazol-1-yl)ethyl]cyclopropanamine N-[2-(4-chloro-3-nitro-pyrazol-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) 1.23 6.13 -54.99 2 6 1 80 231.663 5 ↓

Analogs

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Popular Name: N-[2-(4-methyl-3-nitro-pyrazol-1-yl)ethyl]cyclopropanamine N-[2-(4-methyl-3-nitro-pyrazol-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) 1.00 6.24 -53.25 2 6 1 80 211.245 5 ↓

Analogs

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Popular Name: N-cyclopropyl-N-(2-pyrazol-1-ylethyl)propane-1,3-diamine N-cyclopropyl-N-(2-pyrazol-1-yle…

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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) -0.14 2.33 -47.41 3 4 1 49 209.317 7 ↓
Mid Mid (pH 6-8) -0.14 4.62 -103.9 4 4 2 50 210.325 7 ↓

Analogs

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Popular Name: N-cyclopropyl-N-(2-pyrazol-1-ylethyl)ethane-1,2-diamine N-cyclopropyl-N-(2-pyrazol-1-yle…

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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) -0.41 1.78 -43.12 3 4 1 49 195.29 6 ↓
Lo Low (pH 4.5-6) -0.41 3.86 -113.7 4 4 2 50 196.298 6 ↓

Analogs

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Popular Name: 3-[cyclopropyl(2-pyrazol-1-ylethyl)amino]propanoic 3-[cyclopropyl(2-pyrazol-1-yleth…

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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) 0.30 7.16 -49.73 1 5 0 62 223.276 7 ↓

Analogs

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Popular Name: 2-[cyclopropyl(2-pyrazol-1-ylethyl)amino]ethanol 2-[cyclopropyl(2-pyrazol-1-yleth…

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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) 0.15 3.27 -33.78 2 4 1 42 196.274 6 ↓

Analogs

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Popular Name: ethyl 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) 1.02 7.56 -40.01 1 5 1 49 238.311 8 ↓
Mid Mid (pH 6-8) 1.02 5.65 -10.45 0 5 0 47 237.303 8 ↓

Parameters Provided:

ring.id = 259873
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 = 259873 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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