UCSF
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Analogs

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Popular Name: N-methyl-N-[1-[(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)methyl]-4-piperidyl]ethanesulfonamide N-methyl-N-[1-[(2-oxo-5-phenyl-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) 1.51 5.32 -48.18 1 8 1 90 381.478 6 ↓
Mid Mid (pH 6-8) 1.51 2.84 -14.29 0 8 0 89 380.47 6 ↓

Analogs

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Popular Name: N-ethyl-N-[1-[(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)methyl]-4-piperidyl]methanesulfonamide N-ethyl-N-[1-[(2-oxo-5-phenyl-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) 1.51 5.39 -51.04 1 8 1 90 381.478 6 ↓
Mid Mid (pH 6-8) 1.51 2.87 -15.44 0 8 0 89 380.47 6 ↓

Analogs

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Popular Name: N-ethyl-N-[1-[[5-(4-fluorophenyl)-2-oxo-1,3,4-oxadiazol-3-yl]methyl]-4-piperidyl]methanesulfonamide N-ethyl-N-[1-[[5-(4-fluorophenyl…

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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) 1.67 5.18 -51.97 1 8 1 90 399.468 6 ↓
Mid Mid (pH 6-8) 1.67 2.72 -13.99 0 8 0 89 398.46 6 ↓

Parameters Provided:

ring.id = 188813
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 = 188813 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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