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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(5-bromo-2-thienyl)-cyclobutyl-methanamine (R)-(5-bromo-2-thienyl)-cyclobut…

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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 5.1 -43.95 3 1 1 28 247.181 2 ↓
Hi High (pH 8-9.5) 1.30 4.78 -2.04 2 1 0 26 246.173 2 ↓

Analogs

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Popular Name: (S)-(5-bromo-2-thienyl)-cyclobutyl-methanamine (S)-(5-bromo-2-thienyl)-cyclobut…

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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 5.1 -43.96 3 1 1 28 247.181 2 ↓
Hi High (pH 8-9.5) 1.30 4.79 -1.37 2 1 0 26 246.173 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(5-bromo-2-thienyl)-1-cyclobutyl-N-methyl-methanamine (1R)-1-(5-bromo-2-thienyl)-1-cyc…

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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) 3.56 6.44 -39.94 2 1 1 17 261.208 3 ↓
Hi High (pH 8-9.5) 3.56 5.68 -1.27 1 1 0 12 260.2 3 ↓

Analogs

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Popular Name: (1S)-1-(5-bromo-2-thienyl)-1-cyclobutyl-N-methyl-methanamine (1S)-1-(5-bromo-2-thienyl)-1-cyc…

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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) 3.56 6.4 -39.35 2 1 1 17 261.208 3 ↓
Hi High (pH 8-9.5) 3.56 5.56 -2.05 1 1 0 12 260.2 3 ↓

Analogs

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Popular Name: N-[(R)-(5-bromo-2-thienyl)-cyclobutyl-methyl]ethanamine N-[(R)-(5-bromo-2-thienyl)-cyclo…

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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) 3.93 7.24 -37.91 2 1 1 17 275.235 4 ↓
Hi High (pH 8-9.5) 3.93 6.57 -1.12 1 1 0 12 274.227 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-(5-bromo-2-thienyl)-cyclobutyl-methyl]ethanamine N-[(S)-(5-bromo-2-thienyl)-cyclo…

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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) 3.93 7.25 -37.88 2 1 1 17 275.235 4 ↓
Hi High (pH 8-9.5) 3.93 6.51 -1.9 1 1 0 12 274.227 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(R)-(5-bromo-2-thienyl)-cyclobutyl-methyl]propan-1-amine N-[(R)-(5-bromo-2-thienyl)-cyclo…

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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) 4.43 7.99 -38.56 2 1 1 17 289.262 5 ↓
Hi High (pH 8-9.5) 4.43 6.79 -1.12 1 1 0 12 288.254 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(S)-(5-bromo-2-thienyl)-cyclobutyl-methyl]propan-1-amine N-[(S)-(5-bromo-2-thienyl)-cyclo…

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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) 4.43 8.01 -38.54 2 1 1 17 289.262 5 ↓
Hi High (pH 8-9.5) 4.43 6.82 -1.44 1 1 0 12 288.254 5 ↓

Analogs

35498467
35498467
35498094
35498094
35498096
35498096
35498098
35498098
35498100
35498100

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(5-chloro-2-thienyl)-1-cyclobutyl-N-methyl-methanamine (1R)-1-(5-chloro-2-thienyl)-1-cy…

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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) 3.42 6.33 -39.76 2 1 1 17 216.757 3 ↓
Hi High (pH 8-9.5) 3.42 5.58 -1.28 1 1 0 12 215.749 3 ↓

Analogs

35498094
35498094
35498096
35498096
35498098
35498098
35498100
35498100
35498465
35498465

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(5-chloro-2-thienyl)-1-cyclobutyl-N-methyl-methanamine (1S)-1-(5-chloro-2-thienyl)-1-cy…

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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) 3.42 6.3 -39.22 2 1 1 17 216.757 3 ↓
Hi High (pH 8-9.5) 3.42 5.45 -2.02 1 1 0 12 215.749 3 ↓

Analogs

19726216
19726216

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-cyclobutyl-2-(2-thienyl)ethanamine (2R)-2-cyclobutyl-2-(2-thienyl)e…

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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 5.13 -46.84 3 1 1 28 182.312 3 ↓

Analogs

19726215
19726215

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-cyclobutyl-2-(2-thienyl)ethanamine (2S)-2-cyclobutyl-2-(2-thienyl)e…

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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 4.91 -43.25 3 1 1 28 182.312 3 ↓

Analogs

19726502
19726502

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-cyclobutyl-2-(2-thienyl)acetic (2R)-2-cyclobutyl-2-(2-thienyl)a…

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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 6.68 -50.13 0 2 -1 40 195.263 3 ↓

Analogs

19726501
19726501

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-cyclobutyl-2-(2-thienyl)acetic (2S)-2-cyclobutyl-2-(2-thienyl)a…

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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 6.64 -47.78 0 2 -1 40 195.263 3 ↓

Analogs

44980259
44980259
44980262
44980262
44980265
44980265
44983520
44983520
44983522
44983522

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-cyclobutyl(2-thienyl)methanol (R)-cyclobutyl(2-thienyl)methanol

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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) 2.07 3.83 -2.59 1 1 0 20 168.261 2 ↓

Analogs

44980259
44980259
44980262
44980262
44980265
44980265
44983520
44983520
44983522
44983522

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-cyclobutyl(2-thienyl)methanol (S)-cyclobutyl(2-thienyl)methanol

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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) 2.07 4.14 -2.4 1 1 0 20 168.261 2 ↓

Analogs

36157676
36157676
36157679
36157679
37365129
37365129
40257893
40257893
40257894
40257894

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(5-chloro-2-thienyl)-cyclobutyl-methanol (R)-(5-chloro-2-thienyl)-cyclobu…

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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) 2.87 4.46 -2.22 1 1 0 20 202.706 2 ↓

Analogs

36157676
36157676
36157679
36157679
37365129
37365129
40257893
40257893
40257894
40257894

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(5-chloro-2-thienyl)-cyclobutyl-methanol (S)-(5-chloro-2-thienyl)-cyclobu…

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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) 2.87 4.45 -2.24 1 1 0 20 202.706 2 ↓

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

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