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Analogs

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Popular Name: 3-(2-aminoethyl)-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-(2-aminoethyl)-N-[(1S)-1-(2H-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) -0.53 0.76 -72.73 4 7 0 110 260.301 5 ↓
Lo Low (pH 4.5-6) -0.53 0.76 -50.52 5 7 1 111 261.309 5 ↓

Analogs

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Popular Name: 3-(2-aminoethyl)-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-(2-aminoethyl)-N-[(1R)-1-(2H-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) -0.53 0.77 -72.09 4 7 0 110 260.301 5 ↓
Lo Low (pH 4.5-6) -0.53 0.77 -50.51 5 7 1 111 261.309 5 ↓

Analogs

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Popular Name: 3-(2-aminoethyl)-N-(1H-tetrazol-5-ylmethyl)benzamide 3-(2-aminoethyl)-N-(1H-tetrazol-…

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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) -1.09 0.07 -72.02 4 7 0 110 246.274 5 ↓
Lo Low (pH 4.5-6) -1.09 0.21 -53.84 5 7 1 111 247.282 5 ↓

Analogs

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Popular Name: 3-amino-4-nitro-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-amino-4-nitro-N-[(1S)-1-(2H-te…

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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) -0.12 0.75 -35.46 3 10 -1 154 276.236 4 ↓
Lo Low (pH 4.5-6) -0.12 0.74 -10.04 4 10 0 155 277.244 4 ↓

Analogs

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Popular Name: 3-amino-4-nitro-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-amino-4-nitro-N-[(1R)-1-(2H-te…

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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) -0.12 0.75 -35.53 3 10 -1 154 276.236 4 ↓
Lo Low (pH 4.5-6) -0.12 0.75 -10.02 4 10 0 155 277.244 4 ↓

Analogs

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Popular Name: 3-(methylamino)-4-nitro-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-(methylamino)-4-nitro-N-[(1S)-…

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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) 0.25 1.69 -35.49 2 10 -1 140 290.263 5 ↓
Lo Low (pH 4.5-6) 0.25 1.69 -10.1 3 10 0 141 291.271 5 ↓

Analogs

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Popular Name: 3-(methylamino)-4-nitro-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-(methylamino)-4-nitro-N-[(1R)-…

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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) 0.25 1.7 -35.48 2 10 -1 140 290.263 5 ↓
Lo Low (pH 4.5-6) 0.25 1.69 -10.09 3 10 0 141 291.271 5 ↓

Analogs

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Popular Name: 3-amino-4-nitro-N-(1H-tetrazol-5-ylmethyl)benzamide 3-amino-4-nitro-N-(1H-tetrazol-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) -0.68 0.04 -35.01 3 10 -1 154 262.209 4 ↓
Lo Low (pH 4.5-6) -0.68 0.19 -14.27 4 10 0 155 263.217 4 ↓

Analogs

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Popular Name: 3-(methylamino)-4-nitro-N-(1H-tetrazol-5-ylmethyl)benzamide 3-(methylamino)-4-nitro-N-(1H-te…

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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) -0.31 1 -35.11 2 10 -1 140 276.236 5 ↓
Lo Low (pH 4.5-6) -0.31 1.13 -14.27 3 10 0 141 277.244 5 ↓

Analogs

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Popular Name: 3-(ethylamino)-4-nitro-N-(1H-tetrazol-5-ylmethyl)benzamide 3-(ethylamino)-4-nitro-N-(1H-tet…

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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) 0.07 1.8 -34.65 2 10 -1 140 290.263 6 ↓
Lo Low (pH 4.5-6) 0.07 1.94 -14.08 3 10 0 141 291.271 6 ↓

Analogs

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Popular Name: 3-hydrazino-4-nitro-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-hydrazino-4-nitro-N-[(1S)-1-(2…

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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) -0.36 0.46 -36.14 4 11 -1 166 291.251 5 ↓
Lo Low (pH 4.5-6) -0.36 0.45 -10.4 5 11 0 167 292.259 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-hydrazino-4-nitro-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-hydrazino-4-nitro-N-[(1R)-1-(2…

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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) -0.36 0.46 -35.9 4 11 -1 166 291.251 5 ↓
Lo Low (pH 4.5-6) -0.36 0.45 -10.42 5 11 0 167 292.259 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-hydrazino-4-nitro-N-(1H-tetrazol-5-ylmethyl)benzamide 3-hydrazino-4-nitro-N-(1H-tetraz…

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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) -0.92 -0.23 -35.6 4 11 -1 166 277.224 5 ↓
Lo Low (pH 4.5-6) -0.92 -0.09 -14.68 5 11 0 167 278.232 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-fluoro-4-nitro-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-fluoro-4-nitro-N-[(1S)-1-(2H-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) 0.56 2.69 -34.99 1 9 -1 128 279.211 4 ↓
Lo Low (pH 4.5-6) 0.56 2.69 -12.36 2 9 0 129 280.219 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-fluoro-4-nitro-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3-fluoro-4-nitro-N-[(1R)-1-(2H-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) 0.56 2.7 -34.97 1 9 -1 128 279.211 4 ↓
Lo Low (pH 4.5-6) 0.56 2.7 -12.36 2 9 0 129 280.219 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-fluoro-4-nitro-N-(1H-tetrazol-5-ylmethyl)benzamide 3-fluoro-4-nitro-N-(1H-tetrazol-…

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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) 0.00 2 -35.62 1 9 -1 128 265.184 4 ↓
Lo Low (pH 4.5-6) 0.00 2.14 -15.45 2 9 0 129 266.192 4 ↓

Analogs

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Popular Name: 5-fluoro-2-methyl-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 5-fluoro-2-methyl-N-[(1S)-1-(2H-…

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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) 1.05 2.7 -37.18 1 6 -1 82 248.241 3 ↓
Lo Low (pH 4.5-6) 1.05 2.7 -7.13 2 6 0 84 249.249 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-fluoro-2-methyl-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 5-fluoro-2-methyl-N-[(1R)-1-(2H-…

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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) 1.05 2.7 -37.08 1 6 -1 82 248.241 3 ↓
Lo Low (pH 4.5-6) 1.05 2.7 -7.15 2 6 0 84 249.249 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-fluoro-2-methyl-N-(1H-tetrazol-5-ylmethyl)benzamide 5-fluoro-2-methyl-N-(1H-tetrazol…

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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) 0.49 2 -36.66 1 6 -1 82 234.214 3 ↓
Lo Low (pH 4.5-6) 0.49 2.14 -10.36 2 6 0 84 235.222 3 ↓

Analogs

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Popular Name: 2-(isopropylamino)-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 2-(isopropylamino)-N-[(1S)-1-(2H…

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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 2.61 -37.75 2 7 -1 94 273.32 5 ↓
Lo Low (pH 4.5-6) 1.66 2.68 -7.43 3 7 0 96 274.328 5 ↓

Analogs

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Popular Name: 2-(isopropylamino)-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 2-(isopropylamino)-N-[(1R)-1-(2H…

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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 2.61 -37.7 2 7 -1 94 273.32 5 ↓
Lo Low (pH 4.5-6) 1.66 2.69 -7.52 3 7 0 96 274.328 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(isopropylamino)-N-(1H-tetrazol-5-ylmethyl)benzamide 2-(isopropylamino)-N-(1H-tetrazo…

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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) 1.10 1.98 -37.27 2 7 -1 94 259.293 5 ↓
Lo Low (pH 4.5-6) 1.10 2.13 -10.15 3 7 0 96 260.301 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-amino-4-fluoro-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 2-amino-4-fluoro-N-[(1S)-1-(2H-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) 0.08 0.23 -34.44 3 7 -1 108 249.229 3 ↓
Lo Low (pH 4.5-6) 0.08 0.23 -6.99 4 7 0 110 250.237 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-amino-4-fluoro-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 2-amino-4-fluoro-N-[(1R)-1-(2H-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) 0.08 0.23 -34.54 3 7 -1 108 249.229 3 ↓
Lo Low (pH 4.5-6) 0.08 0.23 -7.07 4 7 0 110 250.237 3 ↓

Analogs

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Popular Name: 2-amino-4-fluoro-N-(1H-tetrazol-5-ylmethyl)benzamide 2-amino-4-fluoro-N-(1H-tetrazol-…

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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) -0.48 -0.46 -34.02 3 7 -1 108 235.202 3 ↓
Lo Low (pH 4.5-6) -0.48 -0.32 -10.6 4 7 0 110 236.21 3 ↓

Analogs

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Popular Name: 4-(ethylamino)-3,5-difluoro-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 4-(ethylamino)-3,5-difluoro-N-[(…

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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) 0.92 1.65 -35.22 2 7 -1 94 295.273 5 ↓
Lo Low (pH 4.5-6) 0.92 1.65 -7.47 3 7 0 96 296.281 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(ethylamino)-3,5-difluoro-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 4-(ethylamino)-3,5-difluoro-N-[(…

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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) 0.92 1.65 -35.24 2 7 -1 94 295.273 5 ↓
Lo Low (pH 4.5-6) 0.92 1.65 -7.48 3 7 0 96 296.281 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-amino-3,5-difluoro-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 4-amino-3,5-difluoro-N-[(1S)-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) 0.17 0.03 -35.51 3 7 -1 108 267.219 3 ↓
Lo Low (pH 4.5-6) 0.17 0.03 -7.8 4 7 0 110 268.227 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-amino-3,5-difluoro-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 4-amino-3,5-difluoro-N-[(1R)-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) 0.17 0.04 -35.53 3 7 -1 108 267.219 3 ↓
Lo Low (pH 4.5-6) 0.17 0.03 -7.82 4 7 0 110 268.227 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-difluoro-4-(methylamino)-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3,5-difluoro-4-(methylamino)-N-[…

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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) 0.55 0.84 -35.55 2 7 -1 94 281.246 4 ↓
Lo Low (pH 4.5-6) 0.55 0.84 -7.75 3 7 0 96 282.254 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-difluoro-4-(methylamino)-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3,5-difluoro-4-(methylamino)-N-[…

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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) 0.55 0.85 -35.59 2 7 -1 94 281.246 4 ↓
Lo Low (pH 4.5-6) 0.55 0.84 -7.76 3 7 0 96 282.254 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(ethylamino)-3,5-difluoro-N-(1H-tetrazol-5-ylmethyl)benzamide 4-(ethylamino)-3,5-difluoro-N-(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) 0.36 0.93 -34.75 2 7 -1 94 281.246 5 ↓
Lo Low (pH 4.5-6) 0.36 1.08 -11.02 3 7 0 96 282.254 5 ↓

Analogs

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Popular Name: 3,5-difluoro-4-(propylamino)-N-(1H-tetrazol-5-ylmethyl)benzamide 3,5-difluoro-4-(propylamino)-N-(…

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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) 0.87 1.7 -34.63 2 7 -1 94 295.273 6 ↓
Lo Low (pH 4.5-6) 0.87 1.84 -10.84 3 7 0 96 296.281 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-amino-3,5-difluoro-N-(1H-tetrazol-5-ylmethyl)benzamide 4-amino-3,5-difluoro-N-(1H-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) -0.39 -0.68 -35.04 3 7 -1 108 253.192 3 ↓
Lo Low (pH 4.5-6) -0.39 -0.53 -11.3 4 7 0 110 254.2 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-difluoro-4-(methylamino)-N-(1H-tetrazol-5-ylmethyl)benzamide 3,5-difluoro-4-(methylamino)-N-(…

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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) -0.01 0.13 -35.07 2 7 -1 94 267.219 4 ↓
Lo Low (pH 4.5-6) -0.01 0.28 -11.34 3 7 0 96 268.227 4 ↓

Analogs

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Popular Name: 3,5-difluoro-4-hydrazino-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3,5-difluoro-4-hydrazino-N-[(1S)…

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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) -0.07 -0.17 -36.34 4 8 -1 120 282.234 4 ↓
Lo Low (pH 4.5-6) -0.07 -0.15 -8.49 5 8 0 122 283.242 4 ↓

Analogs

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Popular Name: 3,5-difluoro-4-hydrazino-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3,5-difluoro-4-hydrazino-N-[(1R)…

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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) -0.07 -0.17 -36.26 4 8 -1 120 282.234 4 ↓
Lo Low (pH 4.5-6) -0.07 -0.15 -8.52 5 8 0 122 283.242 4 ↓

Analogs

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Popular Name: 3,5-difluoro-4-hydrazino-N-(1H-tetrazol-5-ylmethyl)benzamide 3,5-difluoro-4-hydrazino-N-(1H-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) -0.63 -0.89 -35.8 4 8 -1 120 268.207 4 ↓
Lo Low (pH 4.5-6) -0.63 -0.74 -12.3 5 8 0 122 269.215 4 ↓

Analogs

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Popular Name: 3,4,5-trifluoro-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3,4,5-trifluoro-N-[(1S)-1-(2H-te…

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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) 0.85 2.15 -32.9 1 6 -1 82 270.194 3 ↓
Lo Low (pH 4.5-6) 0.85 2.15 -7.89 2 6 0 84 271.202 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4,5-trifluoro-N-[(1R)-1-(2H-tetrazol-5-yl)ethyl]benzamide 3,4,5-trifluoro-N-[(1R)-1-(2H-te…

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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) 0.85 2.15 -32.88 1 6 -1 82 270.194 3 ↓
Lo Low (pH 4.5-6) 0.85 2.15 -7.83 2 6 0 84 271.202 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4,5-trifluoro-N-(1H-tetrazol-5-ylmethyl)benzamide 3,4,5-trifluoro-N-(1H-tetrazol-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) 0.30 1.44 -32.45 1 6 -1 82 256.167 3 ↓
Lo Low (pH 4.5-6) 0.30 1.59 -12.28 2 6 0 84 257.175 3 ↓

Analogs

44887080
44887080
44887082
44887082
44888534
44888534
44888536
44888536

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Popular Name: 3-(2-methylallyloxy)-N-[(1S)-1-(1H-tetrazol-5-yl)ethyl]benzamide 3-(2-methylallyloxy)-N-[(1S)-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) 1.73 3.57 -39.44 1 7 -1 91 286.315 6 ↓
Lo Low (pH 4.5-6) 1.73 3.84 -11.93 2 7 0 93 287.323 6 ↓

Analogs

44887080
44887080
44887082
44887082
44888534
44888534
44888536
44888536

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(2-methylallyloxy)-N-[(1R)-1-(1H-tetrazol-5-yl)ethyl]benzamide 3-(2-methylallyloxy)-N-[(1R)-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) 1.73 3.57 -39.45 1 7 -1 91 286.315 6 ↓
Lo Low (pH 4.5-6) 1.73 3.84 -11.94 2 7 0 93 287.323 6 ↓

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) 1.31 4.16 -38.21 1 11 -1 154 347.311 7 ↓
Lo Low (pH 4.5-6) 1.31 4.14 -9.94 2 11 0 156 348.319 7 ↓

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) 1.31 4.16 -38.18 1 11 -1 154 347.311 7 ↓
Lo Low (pH 4.5-6) 1.31 4.16 -9.94 2 11 0 156 348.319 7 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

SQL Query Was

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