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Analogs

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Popular Name: 2-[(R)-chloro(phenyl)methyl]-5-(methoxymethyl)-1,3,4-oxadiazole 2-[(R)-chloro(phenyl)methyl]-5-(…

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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 1.41 -9.26 0 4 0 48 238.674 4 ↓

Analogs

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Popular Name: 2-[(S)-chloro(phenyl)methyl]-5-(methoxymethyl)-1,3,4-oxadiazole 2-[(S)-chloro(phenyl)methyl]-5-(…

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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 1.42 -9.26 0 4 0 48 238.674 4 ↓

Analogs

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Popular Name: 2-[(1S)-1-chloroethyl]-5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazole 2-[(1S)-1-chloroethyl]-5-[(3-chl…

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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) 2.55 3.68 -8.13 0 3 0 39 257.12 3 ↓

Analogs

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Popular Name: 2-[(1R)-1-chloroethyl]-5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazole 2-[(1R)-1-chloroethyl]-5-[(3-chl…

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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) 2.55 3.68 -7.84 0 3 0 39 257.12 3 ↓

Analogs

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Popular Name: 2-(2-chloroethyl)-5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazole 2-(2-chloroethyl)-5-[(3-chloroph…

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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 3.76 -8.29 0 3 0 39 257.12 4 ↓

Analogs

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Popular Name: 2-[(3-chlorophenyl)methyl]-5-(3-chloropropyl)-1,3,4-oxadiazole 2-[(3-chlorophenyl)methyl]-5-(3-…

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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) 2.66 4.53 -10.3 0 3 0 39 271.147 5 ↓

Analogs

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Popular Name: 5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-amine 5-[(3-chlorophenyl)methyl]-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) 1.66 -0.23 -9.52 2 4 0 65 209.636 2 ↓

Analogs

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Popular Name: 5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazole-2-thiol 5-[(3-chlorophenyl)methyl]-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) 2.57 2.16 -39.79 0 3 -1 39 225.68 2 ↓
Mid Mid (pH 6-8) 1.85 2.87 -10.33 1 3 0 42 226.688 2 ↓

Analogs

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Popular Name: 2-[[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetic 2-[[5-[(3-chlorophenyl)methyl]-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) 2.02 3.56 -42.57 0 5 -1 79 283.716 5 ↓

Analogs

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Popular Name: 3-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]propanoic 3-[5-[(3-chlorophenyl)methyl]-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) 1.30 3.84 -44.32 0 5 -1 79 265.676 5 ↓

Analogs

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Popular Name: 4-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]butanoic 4-[5-[(3-chlorophenyl)methyl]-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) 1.58 4.62 -49.37 0 5 -1 79 279.703 6 ↓
Lo Low (pH 4.5-6) 1.58 2.64 -14.92 1 5 0 76 280.711 6 ↓

Analogs

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Popular Name: 5-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]pentanoic 5-[5-[(3-chlorophenyl)methyl]-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 5.4 -48.22 0 5 -1 79 293.73 7 ↓
Lo Low (pH 4.5-6) 2.08 3.42 -12.84 1 5 0 76 294.738 7 ↓

Analogs

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Popular Name: 2-[[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]methoxy]acetic 2-[[5-[(3-chlorophenyl)methyl]-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) 0.81 3.04 -50.85 0 6 -1 88 281.675 6 ↓

Analogs

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Popular Name: (1S)-1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]ethanamine (1S)-1-[5-[(3-chlorophenyl)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) -0.52 0.44 -45.79 3 4 1 67 238.698 3 ↓
Hi High (pH 8-9.5) -0.52 0.09 -6.53 2 4 0 65 237.69 3 ↓

Analogs

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Popular Name: (1R)-1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]ethanamine (1R)-1-[5-[(3-chlorophenyl)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) -0.52 0.43 -46.85 3 4 1 67 238.698 3 ↓
Hi High (pH 8-9.5) -0.52 0.1 -7.73 2 4 0 65 237.69 3 ↓

Analogs

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Popular Name: 1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-methanamine 1-[5-[(3-chlorophenyl)methyl]-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) 1.17 1.63 -44.96 2 4 1 56 238.698 4 ↓
Hi High (pH 8-9.5) 1.17 0.19 -7.82 1 4 0 51 237.69 4 ↓

Analogs

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Popular Name: N-[[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]methyl]ethanamine N-[[5-[(3-chlorophenyl)methyl]-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) 1.54 2.49 -43.95 2 4 1 56 252.725 5 ↓
Hi High (pH 8-9.5) 1.54 1.12 -7.64 1 4 0 51 251.717 5 ↓

Analogs

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Popular Name: N-[[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine N-[[5-[(3-chlorophenyl)methyl]-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) 2.05 3.24 -44.79 2 4 1 56 266.752 6 ↓
Hi High (pH 8-9.5) 2.05 1.89 -7.47 1 4 0 51 265.744 6 ↓

Analogs

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Popular Name: N-[[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine N-[[5-[(3-chlorophenyl)methyl]-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) 1.84 3.02 -41.83 2 4 1 56 266.752 5 ↓
Hi High (pH 8-9.5) 1.84 1.82 -7.4 1 4 0 51 265.744 5 ↓

Analogs

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Popular Name: N-[[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]methyl]-2-methyl-propan-2-amine N-[[5-[(3-chlorophenyl)methyl]-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) 2.35 3.45 -39.69 2 4 1 56 280.779 5 ↓
Hi High (pH 8-9.5) 2.35 2.2 -7.22 1 4 0 51 279.771 5 ↓

Analogs

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Popular Name: 3-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-propan-1-amine 3-[5-[(3-chlorophenyl)methyl]-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) 1.84 3.16 -46.28 2 4 1 56 266.752 6 ↓

Analogs

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Popular Name: 3-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-ethyl-propan-1-amine 3-[5-[(3-chlorophenyl)methyl]-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) 1.87 4.01 -45.69 2 4 1 56 280.779 7 ↓

Analogs

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Popular Name: 3-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-propyl-propan-1-amine 3-[5-[(3-chlorophenyl)methyl]-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) 2.37 4.77 -46.76 2 4 1 56 294.806 8 ↓

Analogs

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Popular Name: 3-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-isopropyl-propan-1-amine 3-[5-[(3-chlorophenyl)methyl]-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) 2.52 4.55 -44.55 2 4 1 56 294.806 7 ↓

Analogs

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

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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) 3.03 4.97 -43.33 2 4 1 56 308.833 7 ↓

Analogs

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Popular Name: (1S)-1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-ethanamine (1S)-1-[5-[(3-chlorophenyl)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) 1.73 2.13 -40.47 2 4 1 56 252.725 4 ↓
Hi High (pH 8-9.5) 1.73 0.81 -7.17 1 4 0 51 251.717 4 ↓

Analogs

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Popular Name: (1R)-1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-ethanamine (1R)-1-[5-[(3-chlorophenyl)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) 1.73 2.11 -41.38 2 4 1 56 252.725 4 ↓
Hi High (pH 8-9.5) 1.73 0.85 -7.63 1 4 0 51 251.717 4 ↓

Analogs

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Popular Name: (1S)-1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-ethyl-ethanamine (1S)-1-[5-[(3-chlorophenyl)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) 2.10 2.97 -39.26 2 4 1 56 266.752 5 ↓
Hi High (pH 8-9.5) 2.10 1.78 -7.6 1 4 0 51 265.744 5 ↓

Analogs

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Popular Name: (1R)-1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-ethyl-ethanamine (1R)-1-[5-[(3-chlorophenyl)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) 2.10 2.96 -40.13 2 4 1 56 266.752 5 ↓
Hi High (pH 8-9.5) 2.10 1.74 -7 1 4 0 51 265.744 5 ↓

Analogs

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Popular Name: N-[(1S)-1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]ethyl]propan-1-amine N-[(1S)-1-[5-[(3-chlorophenyl)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) 2.61 3.73 -39.86 2 4 1 56 280.779 6 ↓
Hi High (pH 8-9.5) 2.61 2.53 -7.48 1 4 0 51 279.771 6 ↓

Analogs

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Popular Name: N-[(1R)-1-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]ethyl]propan-1-amine N-[(1R)-1-[5-[(3-chlorophenyl)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) 2.61 3.72 -40.69 2 4 1 56 280.779 6 ↓
Hi High (pH 8-9.5) 2.61 2.5 -6.88 1 4 0 51 279.771 6 ↓

Analogs

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Popular Name: 2-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-ethanamine 2-[5-[(3-chlorophenyl)methyl]-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) 1.57 2.38 -47.39 2 4 1 56 252.725 5 ↓

Analogs

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Popular Name: 2-[5-[(3-chlorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-ethyl-ethanamine 2-[5-[(3-chlorophenyl)methyl]-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) 1.60 3.23 -46.34 2 4 1 56 266.752 6 ↓

Analogs

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

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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) 2.10 3.99 -47.37 2 4 1 56 280.779 7 ↓

Analogs

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

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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 3.77 -45.14 2 4 1 56 280.779 6 ↓

Analogs

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

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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 4.19 -43.85 2 4 1 56 294.806 6 ↓

Analogs

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Popular Name: N-(3-isopropoxypropyl)-3-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3,4-oxadiazol-2-yl]propanamide N-(3-isopropoxypropyl)-3-[5-[[3-…

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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 -1.18 -14.08 1 6 0 77 399.413 11 ↓

Analogs

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Popular Name: methyl methyl

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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) 1.49 2.55 -18.36 0 7 0 86 385.342 9 ↓

Analogs

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Popular Name: 2-Amino-5-(3,5-difluorobenzyl)oxadiazole 2-Amino-5-(3,5-difluorobenzyl)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) 1.26 -0.6 -9.38 2 4 0 65 211.171 2 ↓

Analogs

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Popular Name: 2-[(R)-chloro(phenyl)methyl]-5-(2-propoxyethyl)-1,3,4-oxadiazole 2-[(R)-chloro(phenyl)methyl]-5-(…

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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) 2.19 3.96 -7.34 0 4 0 48 280.755 7 ↓

Analogs

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Popular Name: 2-[(S)-chloro(phenyl)methyl]-5-(2-propoxyethyl)-1,3,4-oxadiazole 2-[(S)-chloro(phenyl)methyl]-5-(…

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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) 2.19 3.97 -7.36 0 4 0 48 280.755 7 ↓

Analogs

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Popular Name: (R)-phenyl-[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methanamine (R)-phenyl-[5-(2-propoxyethyl)-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 0.8 -46.25 3 5 1 76 262.333 7 ↓
Mid Mid (pH 6-8) 1.00 0.45 -6.96 2 5 0 74 261.325 7 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-phenyl-[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methanamine (S)-phenyl-[5-(2-propoxyethyl)-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 0.8 -46.5 3 5 1 76 262.333 7 ↓
Mid Mid (pH 6-8) 1.00 0.45 -6.54 2 5 0 74 261.325 7 ↓

Analogs

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Popular Name: (1R)-N-methyl-1-phenyl-1-[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methanamine (1R)-N-methyl-1-phenyl-1-[5-(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) 1.37 2.6 -40.74 2 5 1 65 276.36 8 ↓
Hi High (pH 8-9.5) 1.37 1.28 -7.52 1 5 0 60 275.352 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-N-methyl-1-phenyl-1-[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methanamine (1S)-N-methyl-1-phenyl-1-[5-(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) 1.37 2.47 -40.56 2 5 1 65 276.36 8 ↓
Hi High (pH 8-9.5) 1.37 1.3 -6.64 1 5 0 60 275.352 8 ↓

Analogs

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

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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 3.45 -38.83 2 5 1 65 290.387 9 ↓
Hi High (pH 8-9.5) 1.75 2.21 -7.26 1 5 0 60 289.379 9 ↓

Analogs

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

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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 3.32 -38.56 2 5 1 65 290.387 9 ↓
Hi High (pH 8-9.5) 1.75 2.24 -6.38 1 5 0 60 289.379 9 ↓

Analogs

44865628
44865628

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Popular Name: 2-butylsulfanyl-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole 2-butylsulfanyl-5-[(4-methoxyphe…

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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) 3.62 3.98 -8.35 0 4 0 48 278.377 7 ↓

Analogs

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Popular Name: 2-[(1S)-1-bromopropyl]-5-[(2-methoxyphenyl)methyl]-1,3,4-oxadiazole 2-[(1S)-1-bromopropyl]-5-[(2-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) 2.54 3.36 -7.96 0 4 0 48 311.179 5 ↓

Analogs

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Popular Name: 2-[(1R)-1-bromopropyl]-5-[(2-methoxyphenyl)methyl]-1,3,4-oxadiazole 2-[(1R)-1-bromopropyl]-5-[(2-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) 2.54 3.35 -7.83 0 4 0 48 311.179 5 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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