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

12401863
12401863

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Popular Name: 2,4-dichloro-5-(dimethylsulfamoyl)-N-[(1S)-1-[4-(1-piperidyl)phenyl]ethyl]benzamide 2,4-dichloro-5-(dimethylsulfamoy…

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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) 4.62 -5.92 -10.13 1 6 0 70 484.449 6 ↓

Analogs

12401862
12401862

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Popular Name: 2,4-dichloro-5-(dimethylsulfamoyl)-N-[(1R)-1-[4-(1-piperidyl)phenyl]ethyl]benzamide 2,4-dichloro-5-(dimethylsulfamoy…

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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) 4.62 -5.98 -10.18 1 6 0 70 484.449 6 ↓

Analogs

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Popular Name: 3-methoxy-N-methyl-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 3-methoxy-N-methyl-N-[[4-(1-pipe…

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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) 3.35 8.95 -13.03 0 4 0 33 338.451 5 ↓

Analogs

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Popular Name: 4-methyl-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 4-methyl-N-[[4-(1-piperidyl)phen…

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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) 3.99 8.58 -7.87 1 3 0 32 308.425 4 ↓

Analogs

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Popular Name: 4-nitro-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 4-nitro-N-[[4-(1-piperidyl)pheny…

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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) 3.50 8.58 -9.51 1 6 0 78 339.395 5 ↓

Analogs

44900352
44900352

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Popular Name: 4-fluoro-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 4-fluoro-N-[[4-(1-piperidyl)phen…

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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) 3.70 7.98 -7.24 1 3 0 32 312.388 4 ↓

Analogs

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Popular Name: 3-methanesulfonamido-2-methyl-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 3-methanesulfonamido-2-methyl-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) 3.13 5.4 -13.25 2 6 0 79 401.532 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-3-nitro-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 2-methyl-3-nitro-N-[[4-(1-piperi…

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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 9.08 -12.08 1 6 0 78 353.422 5 ↓

Analogs

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Popular Name: 2-methyl-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 2-methyl-N-[[4-(1-piperidyl)phen…

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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) 3.94 8.58 -7.05 1 3 0 32 308.425 4 ↓

Analogs

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Popular Name: 3,4,5-trimethoxy-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 3,4,5-trimethoxy-N-[[4-(1-piperi…

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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 7.05 -10.54 1 6 0 60 384.476 7 ↓

Analogs

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Popular Name: 3,5-dimethoxy-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 3,5-dimethoxy-N-[[4-(1-piperidyl…

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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) 3.58 6.52 -9.44 1 5 0 51 354.45 6 ↓

Analogs

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Popular Name: 2-chloro-5-nitro-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 2-chloro-5-nitro-N-[[4-(1-piperi…

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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 9.09 -8.09 1 6 0 78 373.84 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-3-nitro-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 4-chloro-3-nitro-N-[[4-(1-piperi…

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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 8.95 -13.19 1 6 0 78 373.84 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 2-methoxy-N-[[4-(1-piperidyl)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) 4.10 8.47 -11.04 1 4 0 42 324.424 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-methyl-4-nitro-N-[[4-(1-piperidyl)phenyl]methyl]benzamide 3-methyl-4-nitro-N-[[4-(1-piperi…

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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) 3.88 9.2 -9.2 1 6 0 78 353.422 5 ↓

Analogs

15937558
15937558

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Popular Name: N-[(1S)-3-amino-1-[4-(4-bromo-1-piperidyl)-3-nitro-phenyl]-3-oxo-propyl]-3,5-dimethyl-benzamide N-[(1S)-3-amino-1-[4-(4-bromo-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) 2.75 10.76 -22.96 3 8 0 121 503.397 7 ↓

Analogs

15937557
15937557

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Popular Name: N-[(1R)-3-amino-1-[4-(4-bromo-1-piperidyl)-3-nitro-phenyl]-3-oxo-propyl]-3,5-dimethyl-benzamide N-[(1R)-3-amino-1-[4-(4-bromo-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) 2.75 10.89 -22.2 3 8 0 121 503.397 7 ↓

Parameters Provided:

ring.id = 100486
filter.purchasability = annotated
page.format = targets
page.num = 1

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 = 100486 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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