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Analogs

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Popular Name: 2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridine-3-carboxylic 2-[(5-tert-butyl-1,3,4-oxadiazol…

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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) 1.52 3.04 -52.33 0 6 -1 92 292.34 5 ↓

Analogs

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Popular Name: 2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridine-4-carboxylic 2-[(5-tert-butyl-1,3,4-oxadiazol…

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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) 1.86 3.16 -47.93 0 6 -1 92 292.34 5 ↓

Analogs

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Popular Name: 2-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridin-3-amine 2-[(5-tert-butyl-1,3,4-oxadiazol…

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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) 1.43 0.55 -9.05 2 5 0 78 264.354 4 ↓

Analogs

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Popular Name: 2-[(5-methyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridin-3-amine 2-[(5-methyl-1,3,4-oxadiazol-2-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) -0.29 -1.34 -10.04 2 5 0 78 222.273 3 ↓

Analogs

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Popular Name: 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridin-3-amine 2-[(5-ethyl-1,3,4-oxadiazol-2-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) 0.28 -0.59 -9.47 2 5 0 78 236.3 4 ↓

Analogs

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Popular Name: 6-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridin-3-amine 6-[(5-tert-butyl-1,3,4-oxadiazol…

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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 0.48 -9.29 2 5 0 78 264.354 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[(5-methyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridin-3-amine 6-[(5-methyl-1,3,4-oxadiazol-2-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) -0.08 -1.41 -10.25 2 5 0 78 222.273 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridin-3-amine 6-[(5-ethyl-1,3,4-oxadiazol-2-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) 0.50 -0.66 -9.64 2 5 0 78 236.3 4 ↓

Analogs

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Popular Name: 4,6-dimethyl-2-[(5-methyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridine-3-carboxylic 4,6-dimethyl-2-[(5-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) 0.61 2.53 -58.52 0 6 -1 92 278.313 4 ↓

Analogs

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Popular Name: 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]-4,6-dimethyl-pyridine-3-carboxylic 2-[(5-ethyl-1,3,4-oxadiazol-2-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) 1.18 3.29 -57.85 0 6 -1 92 292.34 5 ↓

Analogs

48398257
48398257

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Popular Name: 6-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridine-3-carboxylic 6-[(5-ethyl-1,3,4-oxadiazol-2-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) 0.42 2.01 -46.41 0 6 -1 92 264.286 5 ↓

Analogs

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Popular Name: 6-[(5-methyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridine-3-carboxylic 6-[(5-methyl-1,3,4-oxadiazol-2-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) -0.15 1.25 -47.05 0 6 -1 92 250.259 4 ↓

Analogs

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Popular Name: 6-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridine-3-carboxylic 6-[(5-tert-butyl-1,3,4-oxadiazol…

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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 3.15 -46.03 0 6 -1 92 292.34 5 ↓

Analogs

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Popular Name: 2-methyl-5-[(1R)-1-[(3-nitro-2-pyridyl)sulfanyl]ethyl]-1,3,4-oxadiazole 2-methyl-5-[(1R)-1-[(3-nitro-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) 0.54 2.27 -15.35 0 7 0 98 266.282 4 ↓

Analogs

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Popular Name: 2-methyl-5-[(1S)-1-[(3-nitro-2-pyridyl)sulfanyl]ethyl]-1,3,4-oxadiazole 2-methyl-5-[(1S)-1-[(3-nitro-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) 0.54 2.28 -15.37 0 7 0 98 266.282 4 ↓

Analogs

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Popular Name: 2-tert-butyl-5-[(3-nitro-2-pyridyl)sulfanylmethyl]-1,3,4-oxadiazole 2-tert-butyl-5-[(3-nitro-2-pyrid…

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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) 1.91 3.16 -13.93 0 7 0 98 294.336 5 ↓

Parameters Provided:

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