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

Analogs

37840891
37840891
37840890
37840890
37840526
37840526
37840525
37840525
37840410
37840410

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(3S)-1-methylsulfonyl-3-piperidyl]-1H-pyrazole-4-sulfonamide N-[(3S)-1-methylsulfonyl-3-piper…

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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) -0.89 -3.15 -20.08 2 8 0 112 308.385 4 ↓

Analogs

37840891
37840891
37840890
37840890
37840526
37840526
37840525
37840525
37840410
37840410

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Popular Name: N-[(3R)-1-methylsulfonyl-3-piperidyl]-1H-pyrazole-4-sulfonamide N-[(3R)-1-methylsulfonyl-3-piper…

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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) -0.89 -3.21 -19.73 2 8 0 112 308.385 4 ↓

Analogs

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Popular Name: 1-methyl-N-[(3R)-1-methylsulfonyl-3-piperidyl]pyrazole-4-sulfonamide 1-methyl-N-[(3R)-1-methylsulfony…

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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) -0.82 -1.96 -18.57 1 8 0 101 322.412 4 ↓

Analogs

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Popular Name: 1-methyl-N-[(3S)-1-methylsulfonyl-3-piperidyl]pyrazole-4-sulfonamide 1-methyl-N-[(3S)-1-methylsulfony…

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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) -0.82 -1.79 -21.12 1 8 0 101 322.412 4 ↓

Analogs

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Popular Name: 5-methyl-N-[(3R)-3-piperidyl]-1H-pyrazole-4-sulfonamide 5-methyl-N-[(3R)-3-piperidyl]-1H…

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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) -0.64 -1.27 -49.98 4 6 1 91 245.328 3 ↓

Analogs

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Popular Name: 5-methyl-N-[(3S)-3-piperidyl]-1H-pyrazole-4-sulfonamide 5-methyl-N-[(3S)-3-piperidyl]-1H…

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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) -0.64 -1.31 -52.43 4 6 1 91 245.328 3 ↓

Analogs

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Popular Name: N,5-dimethyl-N-[(3R)-3-piperidyl]-1H-pyrazole-4-sulfonamide N,5-dimethyl-N-[(3R)-3-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) -0.39 0.09 -58.14 3 6 1 83 259.355 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N,5-dimethyl-N-[(3S)-3-piperidyl]-1H-pyrazole-4-sulfonamide N,5-dimethyl-N-[(3S)-3-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) -0.39 0.12 -51.11 3 6 1 83 259.355 3 ↓

Analogs

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Popular Name: N-ethyl-5-methyl-N-[(3R)-3-piperidyl]-1H-pyrazole-4-sulfonamide N-ethyl-5-methyl-N-[(3R)-3-piper…

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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) -0.02 0.87 -52.86 3 6 1 83 273.382 4 ↓

Analogs

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Popular Name: N-ethyl-5-methyl-N-[(3S)-3-piperidyl]-1H-pyrazole-4-sulfonamide N-ethyl-5-methyl-N-[(3S)-3-piper…

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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) -0.02 0.85 -49.69 3 6 1 83 273.382 4 ↓

Analogs

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Popular Name: 5-methyl-N-[(3R)-3-piperidyl]-N-propyl-1H-pyrazole-4-sulfonamide 5-methyl-N-[(3R)-3-piperidyl]-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) 0.49 1.62 -53.16 3 6 1 83 287.409 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-methyl-N-[(3S)-3-piperidyl]-N-propyl-1H-pyrazole-4-sulfonamide 5-methyl-N-[(3S)-3-piperidyl]-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) 0.49 1.6 -49.99 3 6 1 83 287.409 5 ↓

Analogs

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Popular Name: 2-[(5-methyl-1H-pyrazol-4-yl)sulfonyl-[(3R)-3-piperidyl]amino]acetamide 2-[(5-methyl-1H-pyrazol-4-yl)sul…

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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 -3.08 -68.14 5 8 1 126 302.38 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(5-methyl-1H-pyrazol-4-yl)sulfonyl-[(3S)-3-piperidyl]amino]acetamide 2-[(5-methyl-1H-pyrazol-4-yl)sul…

Find On: PubMed — Wikipedia — Google

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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 -3.1 -53.16 5 8 1 126 302.38 5 ↓

Parameters Provided:

ring.id = 398927
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 = 398927 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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