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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

38568540
38568540

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Popular Name: N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2,4-difluoro-benzamide N-[[(3R)-1,4-dioxaspiro[4.5]deca…

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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 6.12 -10.92 1 4 0 48 311.328 3 ↓

Analogs

38568539
38568539

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Popular Name: N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2,4-difluoro-benzamide N-[[(3S)-1,4-dioxaspiro[4.5]deca…

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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 6.13 -10.47 1 4 0 48 311.328 3 ↓

Analogs

38568546
38568546

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Popular Name: N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-4-propyl-benzamide N-[[(3R)-1,4-dioxaspiro[4.5]deca…

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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) 4.22 8.2 -8.25 1 4 0 48 317.429 5 ↓

Analogs

38568545
38568545

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Popular Name: N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-4-propyl-benzamide N-[[(3S)-1,4-dioxaspiro[4.5]deca…

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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) 4.22 8.2 -7.91 1 4 0 48 317.429 5 ↓

Analogs

38568548
38568548
38790661
38790661
38790662
38790662

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Popular Name: N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2,4,6-trimethyl-benzamide N-[[(3R)-1,4-dioxaspiro[4.5]deca…

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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) 4.11 7.56 -8.03 1 4 0 48 317.429 3 ↓

Analogs

38790661
38790661
38790662
38790662
38936604
38936604
38936605
38936605
38568547
38568547

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2,4,6-trimethyl-benzamide N-[[(3S)-1,4-dioxaspiro[4.5]deca…

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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) 4.11 7.57 -7.86 1 4 0 48 317.429 3 ↓

Analogs

38568554
38568554

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Popular Name: 4-(dimethylamino)-N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]benzamide 4-(dimethylamino)-N-[[(3R)-1,4-d…

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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 6.39 -9.6 1 5 0 51 318.417 4 ↓

Analogs

38568553
38568553

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Popular Name: 4-(dimethylamino)-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]benzamide 4-(dimethylamino)-N-[[(3S)-1,4-d…

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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 6.4 -9.3 1 5 0 51 318.417 4 ↓

Analogs

38568556
38568556

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Popular Name: 3-(dimethylamino)-N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]benzamide 3-(dimethylamino)-N-[[(3R)-1,4-d…

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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) 2.99 6.37 -9.66 1 5 0 51 318.417 4 ↓

Analogs

38568555
38568555

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Popular Name: 3-(dimethylamino)-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]benzamide 3-(dimethylamino)-N-[[(3S)-1,4-d…

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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) 2.99 6.38 -9.31 1 5 0 51 318.417 4 ↓

Analogs

38568564
38568564

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Popular Name: N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-methylsulfanyl-benzamide N-[[(3R)-1,4-dioxaspiro[4.5]deca…

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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) 3.30 6.97 -10.1 1 4 0 48 321.442 4 ↓

Analogs

38568563
38568563

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Popular Name: N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-methylsulfanyl-benzamide N-[[(3S)-1,4-dioxaspiro[4.5]deca…

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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) 3.30 6.98 -9.76 1 4 0 48 321.442 4 ↓

Analogs

38568574
38568574

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Popular Name: 2-chloro-N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-4-fluoro-benzamide 2-chloro-N-[[(3R)-1,4-dioxaspiro…

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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) 3.68 6.55 -8.96 1 4 0 48 327.783 3 ↓

Analogs

38568573
38568573

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Popular Name: 2-chloro-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-4-fluoro-benzamide 2-chloro-N-[[(3S)-1,4-dioxaspiro…

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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) 3.68 6.56 -8.47 1 4 0 48 327.783 3 ↓

Analogs

38568580
38568580

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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) 3.08 6.66 -10.06 1 6 0 74 333.384 5 ↓

Analogs

38568579
38568579

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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) 3.08 6.65 -9.71 1 6 0 74 333.384 5 ↓

Analogs

38568592
38568592

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Popular Name: N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-ethylsulfanyl-benzamide N-[[(3R)-1,4-dioxaspiro[4.5]deca…

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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) 3.67 7.84 -10.09 1 4 0 48 335.469 5 ↓

Analogs

38568591
38568591

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Popular Name: N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-ethylsulfanyl-benzamide N-[[(3S)-1,4-dioxaspiro[4.5]deca…

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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) 3.67 7.85 -9.67 1 4 0 48 335.469 5 ↓

Analogs

38568640
38568640

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Popular Name: N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2,3,4-trimethoxy-benzamide N-[[(3R)-1,4-dioxaspiro[4.5]deca…

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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) 3.29 6.26 -13.36 1 7 0 75 365.426 6 ↓

Analogs

38568639
38568639

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Popular Name: N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2,3,4-trimethoxy-benzamide N-[[(3S)-1,4-dioxaspiro[4.5]deca…

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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) 3.29 6.27 -13.05 1 7 0 75 365.426 6 ↓

Analogs

38568648
38568648

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Popular Name: 4-(dimethylsulfamoyl)-N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]benzamide 4-(dimethylsulfamoyl)-N-[[(3R)-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) 2.23 3.92 -13.95 1 7 0 85 382.482 5 ↓

Analogs

38568647
38568647

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Popular Name: 4-(dimethylsulfamoyl)-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]benzamide 4-(dimethylsulfamoyl)-N-[[(3S)-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) 2.23 3.93 -13.34 1 7 0 85 382.482 5 ↓

Analogs

38568651
38568651

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Popular Name: 2-bromo-N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-5-methoxy-benzamide 2-bromo-N-[[(3R)-1,4-dioxaspiro[…

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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 5.89 -8.82 1 5 0 57 384.27 4 ↓

Analogs

38568649
38568649

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Popular Name: 2-bromo-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-5-methoxy-benzamide 2-bromo-N-[[(3S)-1,4-dioxaspiro[…

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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 5.9 -8.53 1 5 0 57 384.27 4 ↓

Analogs

38568701
38568701

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Popular Name: N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-iodo-benzamide N-[[(3R)-1,4-dioxaspiro[4.5]deca…

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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) 3.95 7.04 -8.57 1 4 0 48 401.244 3 ↓

Analogs

38568699
38568699

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Popular Name: N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-2-iodo-benzamide N-[[(3S)-1,4-dioxaspiro[4.5]deca…

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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) 3.95 7.05 -8.14 1 4 0 48 401.244 3 ↓

Analogs

38568711
38568711

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Popular Name: 4-(diethylsulfamoyl)-N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]benzamide 4-(diethylsulfamoyl)-N-[[(3R)-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) 2.98 5.7 -13.49 1 7 0 85 410.536 7 ↓

Analogs

38568709
38568709

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Popular Name: 4-(diethylsulfamoyl)-N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]benzamide 4-(diethylsulfamoyl)-N-[[(3S)-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) 2.98 5.7 -12.83 1 7 0 85 410.536 7 ↓

Analogs

38568715
38568715
38790681
38790681
38790682
38790682

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-3,5-bis(trifluoromethyl)benzamide N-[[(3R)-1,4-dioxaspiro[4.5]deca…

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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) 4.63 8.01 -7.39 1 4 0 48 411.342 5 ↓

Analogs

38790681
38790681
38790682
38790682
38568713
38568713

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]methyl]-3,5-bis(trifluoromethyl)benzamide N-[[(3S)-1,4-dioxaspiro[4.5]deca…

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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) 4.63 8.01 -7.09 1 4 0 48 411.342 5 ↓

Parameters Provided:

ring.id = 590721
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

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 = 590721 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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