UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

39703687
39703687

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Popular Name: N-[(1-isopropyl-4-piperidyl)methyl]-N'-(oxoBLAHyl)oxamide N-[(1-isopropyl-4-piperidyl)meth…

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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) 0.91 7.75 -44.22 3 7 1 83 399.515 5 ↓

Analogs

39703687
39703687

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Popular Name: N-[[1-(2-methoxyethyl)-4-piperidyl]methyl]-N'-(oxoBLAHyl)oxamide N-[[1-(2-methoxyethyl)-4-piperid…

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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) 0.22 6.4 -45.76 3 8 1 92 415.514 7 ↓

Analogs

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Popular Name: N-[[1-(tert-butylcarbamoyl)-4-piperidyl]methyl]-N'-(oxoBLAHyl)oxamide N-[[1-(tert-butylcarbamoyl)-4-pi…

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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) 1.62 6.51 -18.55 3 9 0 111 455.559 5 ↓

Analogs

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Popular Name: N-[(1-methylsulfonyl-4-piperidyl)methyl]-N'-(oxoBLAHyl)oxamide N-[(1-methylsulfonyl-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) -0.39 3.18 -20.69 2 9 0 116 434.518 5 ↓

Analogs

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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) 0.08 5.41 -17.56 2 9 0 108 414.462 5 ↓

Analogs

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Popular Name: N-(oxoBLAHyl)-N'-[[1-(2,2,2-trifluoroacetyl)-4-piperidyl]methyl]oxamide N-(oxoBLAHyl)-N'-[[1-(2,2,2-trif…

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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) 0.48 5.85 -16.7 2 8 0 99 452.433 5 ↓

Parameters Provided:

ring.id = 571797
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 = 571797 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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