UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-tert-butyl-4-(4-methyl-7-oxo-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxamide N-tert-butyl-4-(4-methyl-7-oxo-p…

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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) 2.34 6.89 -28.36 1 7 0 72 331.42 2 ↓

Analogs

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Popular Name: N-ethyl-4-(4-methyl-7-oxo-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxamide N-ethyl-4-(4-methyl-7-oxo-pyrazo…

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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) 1.53 5.71 -29.5 1 7 0 72 303.366 2 ↓

Analogs

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Popular Name: 4-(4-methyl-7-oxo-pyrazolo[1,5-a]pyrimidin-5-yl)-N-propyl-piperidine-1-carboxamide 4-(4-methyl-7-oxo-pyrazolo[1,5-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) 2.03 6.46 -29.41 1 7 0 72 317.393 3 ↓

Analogs

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Popular Name: 4-(4-methyl-7-oxo-pyrazolo[1,5-a]pyrimidin-5-yl)-N-[(1R)-1-methylpropyl]piperidine-1-carboxamide 4-(4-methyl-7-oxo-pyrazolo[1,5-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) 2.36 7.49 -29.24 1 7 0 72 331.42 3 ↓

Analogs

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Popular Name: 4-(4-methyl-7-oxo-pyrazolo[1,5-a]pyrimidin-5-yl)-N-[(1S)-1-methylpropyl]piperidine-1-carboxamide 4-(4-methyl-7-oxo-pyrazolo[1,5-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) 2.36 7.46 -27.7 1 7 0 72 331.42 3 ↓

Analogs

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Popular Name: N-isopentyl-4-(4-methyl-7-oxo-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxamide N-isopentyl-4-(4-methyl-7-oxo-py…

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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) 2.80 7.75 -29.14 1 7 0 72 345.447 4 ↓

Analogs

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Popular Name: N-isobutyl-4-(4-methyl-7-oxo-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxamide N-isobutyl-4-(4-methyl-7-oxo-pyr…

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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) 2.27 7.23 -29.08 1 7 0 72 331.42 3 ↓

Analogs

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Popular Name: 4-methyl-5-(1-propylsulfonyl-4-piperidyl)pyrazolo[1,5-a]pyrimidin-7-one 4-methyl-5-(1-propylsulfonyl-4-p…

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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) 1.20 5.27 -31.95 0 7 0 77 338.433 4 ↓

Analogs

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Popular Name: 5-(1-butylsulfonyl-4-piperidyl)-4-methyl-pyrazolo[1,5-a]pyrimidin-7-one 5-(1-butylsulfonyl-4-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) 1.76 6.05 -32.12 0 7 0 77 352.46 5 ↓

Parameters Provided:

ring.id = 381538
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 = 381538 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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