UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 4-amino-N-methyl-N-[(3R)-tetrahydrothiophen-3-yl]-1,2,5-oxadiazole-3-carboxamide 4-amino-N-methyl-N-[(3R)-tetrahy…

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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) 0.32 2.66 -5.96 2 6 0 85 228.277 2 ↓

Analogs

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Popular Name: 4-amino-N-methyl-N-[(3S)-tetrahydrothiophen-3-yl]-1,2,5-oxadiazole-3-carboxamide 4-amino-N-methyl-N-[(3S)-tetrahy…

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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) 0.32 2.69 -5.82 2 6 0 85 228.277 2 ↓

Analogs

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Popular Name: 4-amino-N-(2-methoxyethyl)-N-[(3R)-tetrahydrothiophen-3-yl]-1,2,5-oxadiazole-3-carboxamide 4-amino-N-(2-methoxyethyl)-N-[(3…

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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) 0.31 2.66 -9.14 2 7 0 94 272.33 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-amino-N-(2-methoxyethyl)-N-[(3S)-tetrahydrothiophen-3-yl]-1,2,5-oxadiazole-3-carboxamide 4-amino-N-(2-methoxyethyl)-N-[(3…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 0.31 3.21 -7.12 2 7 0 94 272.33 5 ↓

Parameters Provided:

ring.id = 122763
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 = 122763 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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