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Analogs

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Popular Name: 5-chloro-4-[(4-propylphenoxy)methyl]thiadiazole 5-chloro-4-[(4-propylphenoxy)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) 4.53 6.79 -5.25 0 3 0 35 268.769 5 ↓

Analogs

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Popular Name: 4-[(4-propylphenoxy)methyl]thiadiazol-5-amine 4-[(4-propylphenoxy)methyl]thiad…

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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) 3.33 4.18 -9.23 2 4 0 61 249.339 5 ↓

Analogs

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Popular Name: N-methyl-4-[(4-propylphenoxy)methyl]thiadiazol-5-amine N-methyl-4-[(4-propylphenoxy)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) 3.71 5.21 -9.21 1 4 0 47 263.366 6 ↓

Analogs

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Popular Name: N-ethyl-4-[(4-propylphenoxy)methyl]thiadiazol-5-amine N-ethyl-4-[(4-propylphenoxy)meth…

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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) 4.08 6.04 -8.42 1 4 0 47 277.393 7 ↓

Analogs

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Popular Name: N-propyl-4-[(4-propylphenoxy)methyl]thiadiazol-5-amine N-propyl-4-[(4-propylphenoxy)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) 4.58 6.8 -8.06 1 4 0 47 291.42 8 ↓

Analogs

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Popular Name: [4-[(4-propylphenoxy)methyl]thiadiazol-5-yl]hydrazine [4-[(4-propylphenoxy)methyl]thia…

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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) 3.09 3.97 -9.38 3 5 0 73 264.354 6 ↓
Lo Low (pH 4.5-6) 3.09 3.8 -57.41 4 5 1 75 265.362 6 ↓

Analogs

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Popular Name: 5-chloro-4-[(2,3-difluorophenoxy)methyl]thiadiazole 5-chloro-4-[(2,3-difluorophenoxy…

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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) 3.45 4.7 -10.25 0 3 0 35 262.668 3 ↓

Analogs

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Popular Name: 2-[(5-chlorothiadiazol-4-yl)methoxy]-N,N,5-trimethyl-benzenesulfonamide 2-[(5-chlorothiadiazol-4-yl)meth…

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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) 2.91 3.77 -11.23 0 6 0 72 347.849 5 ↓

Analogs

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Popular Name: 4-[(5-chlorothiadiazol-4-yl)methoxy]-3-nitro-benzenesulfonamide 4-[(5-chlorothiadiazol-4-yl)meth…

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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) 1.80 1 -18.69 2 9 0 141 350.765 5 ↓

Analogs

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Popular Name: 4-[(2,3-difluorophenoxy)methyl]thiadiazol-5-amine 4-[(2,3-difluorophenoxy)methyl]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) 2.26 2.1 -14.53 2 4 0 61 243.238 3 ↓

Analogs

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Popular Name: 4-[(2,3-difluorophenoxy)methyl]-N-methyl-thiadiazol-5-amine 4-[(2,3-difluorophenoxy)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) 2.63 3.13 -14.47 1 4 0 47 257.265 4 ↓

Analogs

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Popular Name: 4-[(2,3-difluorophenoxy)methyl]-N-ethyl-thiadiazol-5-amine 4-[(2,3-difluorophenoxy)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) 3.01 3.96 -13.62 1 4 0 47 271.292 5 ↓

Analogs

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Popular Name: 4-[(2,3-difluorophenoxy)methyl]-N-propyl-thiadiazol-5-amine 4-[(2,3-difluorophenoxy)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) 3.51 4.72 -13.3 1 4 0 47 285.319 6 ↓

Analogs

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Popular Name: [4-[(2,3-difluorophenoxy)methyl]thiadiazol-5-yl]hydrazine [4-[(2,3-difluorophenoxy)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) 2.02 1.89 -14.56 3 5 0 73 258.253 4 ↓
Lo Low (pH 4.5-6) 2.02 1.72 -63.39 4 5 1 75 259.261 4 ↓

Analogs

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Popular Name: 4-[(2,5-dimethyl-4-nitro-phenoxy)methyl]thiadiazol-5-amine 4-[(2,5-dimethyl-4-nitro-phenoxy…

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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) 2.74 4.04 -12.68 2 7 0 107 280.309 4 ↓

Analogs

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Popular Name: 4-[(2,5-dimethyl-4-nitro-phenoxy)methyl]-N-methyl-thiadiazol-5-amine 4-[(2,5-dimethyl-4-nitro-phenoxy…

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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) 3.11 5.07 -12.38 1 7 0 93 294.336 5 ↓

Analogs

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Popular Name: 4-[(2,5-dimethyl-4-nitro-phenoxy)methyl]-N-ethyl-thiadiazol-5-amine 4-[(2,5-dimethyl-4-nitro-phenoxy…

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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) 3.49 5.9 -11.49 1 7 0 93 308.363 6 ↓

Analogs

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Popular Name: [4-[(2,5-dimethyl-4-nitro-phenoxy)methyl]thiadiazol-5-yl]hydrazine [4-[(2,5-dimethyl-4-nitro-phenox…

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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) 2.50 3.83 -12.83 3 8 0 119 295.324 5 ↓
Lo Low (pH 4.5-6) 2.50 3.66 -66.2 4 8 1 121 296.332 5 ↓

Analogs

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Popular Name: 5-chloro-4-[(3,5-difluorophenoxy)methyl]thiadiazole 5-chloro-4-[(3,5-difluorophenoxy…

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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) 3.48 4.71 -4.83 0 3 0 35 262.668 3 ↓

Analogs

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Popular Name: 4-[(3,5-difluorophenoxy)methyl]thiadiazol-5-amine 4-[(3,5-difluorophenoxy)methyl]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 2.11 -8.98 2 4 0 61 243.238 3 ↓

Analogs

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Popular Name: 4-[(3,5-difluorophenoxy)methyl]-N-methyl-thiadiazol-5-amine 4-[(3,5-difluorophenoxy)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) 2.66 3.13 -8.79 1 4 0 47 257.265 4 ↓

Analogs

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Popular Name: 4-[(3,5-difluorophenoxy)methyl]-N-ethyl-thiadiazol-5-amine 4-[(3,5-difluorophenoxy)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 3.97 -7.86 1 4 0 47 271.292 5 ↓

Analogs

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Popular Name: 4-[(3,5-difluorophenoxy)methyl]-N-propyl-thiadiazol-5-amine 4-[(3,5-difluorophenoxy)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) 3.54 4.72 -7.65 1 4 0 47 285.319 6 ↓

Analogs

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Popular Name: [4-[(3,5-difluorophenoxy)methyl]thiadiazol-5-yl]hydrazine [4-[(3,5-difluorophenoxy)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) 2.04 1.9 -9.52 3 5 0 73 258.253 4 ↓
Lo Low (pH 4.5-6) 2.04 1.73 -59.67 4 5 1 75 259.261 4 ↓

Analogs

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Popular Name: 4-[(5-bromo-2-chloro-phenoxy)methyl]thiadiazol-5-amine 4-[(5-bromo-2-chloro-phenoxy)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) 3.44 3.14 -9.33 2 4 0 61 320.599 3 ↓

Analogs

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Popular Name: [4-[(5-bromo-2-chloro-phenoxy)methyl]thiadiazol-5-yl]hydrazine [4-[(5-bromo-2-chloro-phenoxy)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) 3.20 2.94 -9.47 3 5 0 73 335.614 4 ↓
Lo Low (pH 4.5-6) 3.20 2.76 -57.76 4 5 1 75 336.622 4 ↓

Analogs

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Popular Name: 1-[5-chloro-2-[(5-chlorothiadiazol-4-yl)methoxy]phenyl]ethanone 1-[5-chloro-2-[(5-chlorothiadiaz…

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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) 3.73 6.85 -10.76 0 4 0 52 303.17 4 ↓

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) 2.98 5.13 -10.67 0 6 0 71 314.75 6 ↓

Analogs

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Popular Name: 5-chloro-4-[(2-chloro-5-nitro-phenoxy)methyl]thiadiazole 5-chloro-4-[(2-chloro-5-nitro-ph…

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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) 3.79 5.84 -7.35 0 6 0 81 306.13 4 ↓

Analogs

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Popular Name: 4-[(2-chloro-5-nitro-phenoxy)methyl]-N-ethyl-thiadiazol-5-amine 4-[(2-chloro-5-nitro-phenoxy)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) 3.34 5.1 -10.32 1 7 0 93 314.754 6 ↓

Analogs

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Popular Name: 4-[(2-chloro-5-nitro-phenoxy)methyl]-N-methyl-thiadiazol-5-amine 4-[(2-chloro-5-nitro-phenoxy)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) 2.97 4.27 -11.18 1 7 0 93 300.727 5 ↓

Analogs

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Popular Name: 4-[(2-chloro-5-nitro-phenoxy)methyl]thiadiazol-5-amine 4-[(2-chloro-5-nitro-phenoxy)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) 2.59 3.23 -11.36 2 7 0 107 286.7 4 ↓

Analogs

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Popular Name: 4-[(2-chloro-5-nitro-phenoxy)methyl]-N-propyl-thiadiazol-5-amine 4-[(2-chloro-5-nitro-phenoxy)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) 3.85 5.85 -10.02 1 7 0 93 328.781 7 ↓

Analogs

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Popular Name: [4-[(2-chloro-5-nitro-phenoxy)methyl]thiadiazol-5-yl]hydrazine [4-[(2-chloro-5-nitro-phenoxy)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) 2.35 3.03 -11.81 3 8 0 119 301.715 5 ↓
Lo Low (pH 4.5-6) 2.35 2.86 -61.42 4 8 1 121 302.723 5 ↓

Analogs

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Popular Name: 5-chloro-4-[[3-(methoxymethyl)phenoxy]methyl]thiadiazole 5-chloro-4-[[3-(methoxymethyl)ph…

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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) 3.15 4.29 -7.07 0 4 0 44 270.741 5 ↓

Analogs

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Popular Name: 4-[[3-(methoxymethyl)phenoxy]methyl]-N-propyl-thiadiazol-5-amine 4-[[3-(methoxymethyl)phenoxy]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) 3.21 4.31 -9.76 1 5 0 56 293.392 8 ↓

Analogs

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Popular Name: 4-[[3-(methoxymethyl)phenoxy]methyl]thiadiazol-5-amine 4-[[3-(methoxymethyl)phenoxy]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) 1.96 1.69 -10.87 2 5 0 70 251.311 5 ↓

Analogs

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Popular Name: 4-[[3-(methoxymethyl)phenoxy]methyl]-N-methyl-thiadiazol-5-amine 4-[[3-(methoxymethyl)phenoxy]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) 2.33 2.72 -10.83 1 5 0 56 265.338 6 ↓

Analogs

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Popular Name: N-ethyl-4-[[3-(methoxymethyl)phenoxy]methyl]thiadiazol-5-amine N-ethyl-4-[[3-(methoxymethyl)phe…

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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) 2.71 3.56 -10.04 1 5 0 56 279.365 7 ↓

Analogs

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Popular Name: 4-[(5-bromo-2-chloro-phenoxy)methyl]-5-chloro-thiadiazole 4-[(5-bromo-2-chloro-phenoxy)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) 4.64 5.75 -5.34 0 3 0 35 340.029 3 ↓

Analogs

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Popular Name: 4-[(5-chlorothiadiazol-4-yl)methoxy]benzoic 4-[(5-chlorothiadiazol-4-yl)meth…

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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) 3.13 5.13 -49.01 0 5 -1 75 269.689 4 ↓

Analogs

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Popular Name: 3-[(5-chlorothiadiazol-4-yl)methoxy]benzoic 3-[(5-chlorothiadiazol-4-yl)meth…

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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) 3.11 5.13 -52.91 0 5 -1 75 269.689 4 ↓

Analogs

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Popular Name: 2-[(5-chlorothiadiazol-4-yl)methoxy]benzoic 2-[(5-chlorothiadiazol-4-yl)meth…

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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) 3.17 5.88 -57.43 0 5 -1 75 269.689 4 ↓

Analogs

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Popular Name: 2-[4-[(5-chlorothiadiazol-4-yl)methoxy]phenyl]acetic 2-[4-[(5-chlorothiadiazol-4-yl)m…

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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) 2.65 5.91 -46.25 0 5 -1 75 283.716 5 ↓

Analogs

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Popular Name: 4-[(5-chlorothiadiazol-4-yl)methoxy]-3-methoxy-benzoic 4-[(5-chlorothiadiazol-4-yl)meth…

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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) 2.72 5.03 -49.55 0 6 -1 84 299.715 5 ↓

Analogs

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Popular Name: 5-chloro-4-[(3-chloro-4-nitro-phenoxy)methyl]thiadiazole 5-chloro-4-[(3-chloro-4-nitro-ph…

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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) 3.79 5.66 -8.77 0 6 0 81 306.13 4 ↓

Analogs

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Popular Name: 2-[(5-chlorothiadiazol-4-yl)methoxy]-3-methyl-benzoic 2-[(5-chlorothiadiazol-4-yl)meth…

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Activity (Go SEA)

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) 3.57 6.31 -46.33 0 5 -1 75 283.716 4 ↓

Parameters Provided:

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Structural Results Found: (before additional filtering)

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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 = 44206 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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