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Popular Name: 2-(chloromethyl)-5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazole 2-(chloromethyl)-5-[(1S)-tetrali…

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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) 1.92 3.91 -8.15 0 3 0 39 248.713 2 ↓

Analogs

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Popular Name: 2-(chloromethyl)-5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazole 2-(chloromethyl)-5-[(1R)-tetrali…

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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) 1.92 3.91 -8.5 0 3 0 39 248.713 2 ↓

Analogs

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Popular Name: 2-[(1S)-1-chloroethyl]-5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazole 2-[(1S)-1-chloroethyl]-5-[(1R)-t…

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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) 2.28 4.62 -7.99 0 3 0 39 262.74 2 ↓

Analogs

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Popular Name: 2-[(1R)-1-chloroethyl]-5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazole 2-[(1R)-1-chloroethyl]-5-[(1R)-t…

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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) 2.28 4.62 -8.22 0 3 0 39 262.74 2 ↓

Analogs

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Popular Name: 2-[(1S)-1-chloroethyl]-5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazole 2-[(1S)-1-chloroethyl]-5-[(1S)-t…

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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) 2.28 4.62 -8.22 0 3 0 39 262.74 2 ↓

Analogs

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Popular Name: 2-[(1R)-1-chloroethyl]-5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazole 2-[(1R)-1-chloroethyl]-5-[(1S)-t…

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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) 2.28 4.62 -7.96 0 3 0 39 262.74 2 ↓

Analogs

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Popular Name: 2-(2-chloroethyl)-5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazole 2-(2-chloroethyl)-5-[(1S)-tetral…

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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 4.7 -7.4 0 3 0 39 262.74 3 ↓

Analogs

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Popular Name: 2-(2-chloroethyl)-5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazole 2-(2-chloroethyl)-5-[(1R)-tetral…

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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 4.7 -7.33 0 3 0 39 262.74 3 ↓

Analogs

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Popular Name: 2-(3-chloropropyl)-5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazole 2-(3-chloropropyl)-5-[(1S)-tetra…

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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 5.47 -9.45 0 3 0 39 276.767 4 ↓

Analogs

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Popular Name: 2-(3-chloropropyl)-5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazole 2-(3-chloropropyl)-5-[(1R)-tetra…

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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 5.47 -9.67 0 3 0 39 276.767 4 ↓

Analogs

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Popular Name: 5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-amine 5-[(1S)-tetralin-1-yl]-1,3,4-oxa…

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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) 1.39 0.71 -8.87 2 4 0 65 215.256 1 ↓

Analogs

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Popular Name: 5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-amine 5-[(1R)-tetralin-1-yl]-1,3,4-oxa…

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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) 1.39 0.7 -8.84 2 4 0 65 215.256 1 ↓

Analogs

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Popular Name: 5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazole-2-thiol 5-[(1S)-tetralin-1-yl]-1,3,4-oxa…

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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) 2.30 3.11 -43.59 0 3 -1 39 231.3 1 ↓
Mid Mid (pH 6-8) 1.58 3.85 -8.07 1 3 0 42 232.308 1 ↓

Analogs

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Popular Name: 5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazole-2-thiol 5-[(1R)-tetralin-1-yl]-1,3,4-oxa…

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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) 2.30 3.1 -43.61 0 3 -1 39 231.3 1 ↓
Mid Mid (pH 6-8) 1.58 3.85 -8.1 1 3 0 42 232.308 1 ↓

Analogs

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Popular Name: 2-[[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetic 2-[[5-[(1S)-tetralin-1-yl]-1,3,4…

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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) 1.75 4.51 -43.54 0 5 -1 79 289.336 4 ↓

Analogs

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Popular Name: 2-[[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetic 2-[[5-[(1R)-tetralin-1-yl]-1,3,4…

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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) 1.75 4.5 -43.56 0 5 -1 79 289.336 4 ↓

Analogs

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Popular Name: 3-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]propanoic 3-[5-[(1S)-tetralin-1-yl]-1,3,4-…

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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) 1.04 4.78 -45.36 0 5 -1 79 271.296 4 ↓

Analogs

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Popular Name: 3-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]propanoic 3-[5-[(1R)-tetralin-1-yl]-1,3,4-…

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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) 1.04 4.78 -45.78 0 5 -1 79 271.296 4 ↓

Analogs

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Popular Name: 4-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]butanoic 4-[5-[(1S)-tetralin-1-yl]-1,3,4-…

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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) 1.31 5.56 -50.03 0 5 -1 79 285.323 5 ↓
Lo Low (pH 4.5-6) 1.31 3.58 -14.2 1 5 0 76 286.331 5 ↓

Analogs

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Popular Name: 4-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]butanoic 4-[5-[(1R)-tetralin-1-yl]-1,3,4-…

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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) 1.31 5.56 -51.7 0 5 -1 79 285.323 5 ↓
Lo Low (pH 4.5-6) 1.31 3.58 -14.63 1 5 0 76 286.331 5 ↓

Analogs

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Popular Name: 2-[[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methoxy]acetic 2-[[5-[(1S)-tetralin-1-yl]-1,3,4…

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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) 0.54 3.98 -51.68 0 6 -1 88 287.295 5 ↓

Analogs

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Popular Name: 2-[[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methoxy]acetic 2-[[5-[(1R)-tetralin-1-yl]-1,3,4…

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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) 0.54 3.98 -53.91 0 6 -1 88 287.295 5 ↓

Analogs

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Popular Name: [5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methanamine [5-[(1S)-tetralin-1-yl]-1,3,4-ox…

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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) 0.52 0.7 -50.73 3 4 1 67 230.291 2 ↓
Hi High (pH 8-9.5) 0.52 0.3 -8.88 2 4 0 65 229.283 2 ↓

Analogs

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Popular Name: [5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methanamine [5-[(1R)-tetralin-1-yl]-1,3,4-ox…

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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) 0.52 0.69 -50.63 3 4 1 67 230.291 2 ↓
Hi High (pH 8-9.5) 0.52 0.3 -8.93 2 4 0 65 229.283 2 ↓

Analogs

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Popular Name: 3-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine 3-[5-[(1S)-tetralin-1-yl]-1,3,4-…

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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) 0.60 2.23 -51.16 3 4 1 67 258.345 4 ↓

Analogs

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Popular Name: 3-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine 3-[5-[(1R)-tetralin-1-yl]-1,3,4-…

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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) 0.60 2.23 -50.82 3 4 1 67 258.345 4 ↓

Analogs

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Popular Name: 2-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine 2-[5-[(1S)-tetralin-1-yl]-1,3,4-…

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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) 0.32 1.45 -52.59 3 4 1 67 244.318 3 ↓

Analogs

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Popular Name: 2-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine 2-[5-[(1R)-tetralin-1-yl]-1,3,4-…

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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) 0.32 1.45 -52.35 3 4 1 67 244.318 3 ↓

Analogs

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Popular Name: (1S)-1-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine (1S)-1-[5-[(1R)-tetralin-1-yl]-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) -0.79 1.39 -46.37 3 4 1 67 244.318 2 ↓
Hi High (pH 8-9.5) -0.79 1.04 -8.09 2 4 0 65 243.31 2 ↓

Analogs

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Popular Name: (1R)-1-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine (1R)-1-[5-[(1R)-tetralin-1-yl]-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) -0.79 1.38 -46.11 3 4 1 67 244.318 2 ↓
Hi High (pH 8-9.5) -0.79 1.03 -6.82 2 4 0 65 243.31 2 ↓

Analogs

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Popular Name: (1S)-1-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine (1S)-1-[5-[(1S)-tetralin-1-yl]-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) -0.79 1.39 -46.08 3 4 1 67 244.318 2 ↓
Hi High (pH 8-9.5) -0.79 1.04 -8.32 2 4 0 65 243.31 2 ↓

Analogs

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Popular Name: (1R)-1-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine (1R)-1-[5-[(1S)-tetralin-1-yl]-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) -0.79 1.38 -46.38 3 4 1 67 244.318 2 ↓
Hi High (pH 8-9.5) -0.79 1.03 -6.89 2 4 0 65 243.31 2 ↓

Analogs

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Popular Name: N-methyl-1-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methanamine N-methyl-1-[5-[(1R)-tetralin-1-y…

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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 2.57 -44.6 2 4 1 56 244.318 3 ↓
Hi High (pH 8-9.5) 0.90 1.13 -8.17 1 4 0 51 243.31 3 ↓

Analogs

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Popular Name: N-methyl-1-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methanamine N-methyl-1-[5-[(1S)-tetralin-1-y…

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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 2.57 -44.74 2 4 1 56 244.318 3 ↓
Hi High (pH 8-9.5) 0.90 1.13 -8.12 1 4 0 51 243.31 3 ↓

Analogs

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Popular Name: N-[[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]ethanamine N-[[5-[(1R)-tetralin-1-yl]-1,3,4…

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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) 1.27 3.43 -43.64 2 4 1 56 258.345 4 ↓
Hi High (pH 8-9.5) 1.27 2.07 -8.03 1 4 0 51 257.337 4 ↓

Analogs

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Popular Name: N-[[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]ethanamine N-[[5-[(1S)-tetralin-1-yl]-1,3,4…

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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) 1.27 3.43 -43.79 2 4 1 56 258.345 4 ↓
Hi High (pH 8-9.5) 1.27 2.07 -7.94 1 4 0 51 257.337 4 ↓

Analogs

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Popular Name: N-[[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine N-[[5-[(1R)-tetralin-1-yl]-1,3,4…

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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 4.18 -44.41 2 4 1 56 272.372 5 ↓
Hi High (pH 8-9.5) 1.78 2.83 -7.84 1 4 0 51 271.364 5 ↓

Analogs

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Popular Name: N-[[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine N-[[5-[(1S)-tetralin-1-yl]-1,3,4…

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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 4.18 -44.58 2 4 1 56 272.372 5 ↓
Hi High (pH 8-9.5) 1.78 2.83 -7.83 1 4 0 51 271.364 5 ↓

Analogs

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Popular Name: N-[[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine N-[[5-[(1R)-tetralin-1-yl]-1,3,4…

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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 3.96 -41.4 2 4 1 56 272.372 4 ↓
Hi High (pH 8-9.5) 1.57 2.76 -7.81 1 4 0 51 271.364 4 ↓

Analogs

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Popular Name: N-[[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine N-[[5-[(1S)-tetralin-1-yl]-1,3,4…

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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 3.96 -41.53 2 4 1 56 272.372 4 ↓
Hi High (pH 8-9.5) 1.57 2.76 -7.75 1 4 0 51 271.364 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine 2-methyl-N-[[5-[(1R)-tetralin-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) 2.08 4.39 -39.25 2 4 1 56 286.399 4 ↓
Hi High (pH 8-9.5) 2.08 3.14 -7.56 1 4 0 51 285.391 4 ↓

Analogs

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Popular Name: 2-methyl-N-[[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine 2-methyl-N-[[5-[(1S)-tetralin-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) 2.08 4.39 -39.38 2 4 1 56 286.399 4 ↓
Hi High (pH 8-9.5) 2.08 3.14 -7.55 1 4 0 51 285.391 4 ↓

Analogs

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Popular Name: N-methyl-3-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine N-methyl-3-[5-[(1R)-tetralin-1-y…

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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 4.11 -45.95 2 4 1 56 272.372 5 ↓

Analogs

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Popular Name: N-methyl-3-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine N-methyl-3-[5-[(1S)-tetralin-1-y…

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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 4.11 -46.31 2 4 1 56 272.372 5 ↓

Analogs

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Popular Name: N-ethyl-3-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine N-ethyl-3-[5-[(1R)-tetralin-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) 1.60 4.96 -45.41 2 4 1 56 286.399 6 ↓

Analogs

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Popular Name: N-ethyl-3-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine N-ethyl-3-[5-[(1S)-tetralin-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) 1.60 4.96 -45.78 2 4 1 56 286.399 6 ↓

Analogs

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Popular Name: (1S)-N-methyl-1-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine (1S)-N-methyl-1-[5-[(1R)-tetrali…

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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) 1.46 3.07 -40.87 2 4 1 56 258.345 3 ↓
Hi High (pH 8-9.5) 1.46 1.75 -7.43 1 4 0 51 257.337 3 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-[5-[(1R)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine (1R)-N-methyl-1-[5-[(1R)-tetrali…

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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) 1.46 3.05 -40.69 2 4 1 56 258.345 3 ↓
Hi High (pH 8-9.5) 1.46 1.79 -8.23 1 4 0 51 257.337 3 ↓

Analogs

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Popular Name: (1S)-N-methyl-1-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine (1S)-N-methyl-1-[5-[(1S)-tetrali…

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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) 1.46 3.07 -40.67 2 4 1 56 258.345 3 ↓
Hi High (pH 8-9.5) 1.46 1.75 -7.36 1 4 0 51 257.337 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-N-methyl-1-[5-[(1S)-tetralin-1-yl]-1,3,4-oxadiazol-2-yl]ethanamine (1R)-N-methyl-1-[5-[(1S)-tetrali…

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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) 1.46 3.05 -40.9 2 4 1 56 258.345 3 ↓
Hi High (pH 8-9.5) 1.46 1.79 -7.98 1 4 0 51 257.337 3 ↓

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 = 136685 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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