UCSF
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Analogs

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Popular Name: N-(4-methoxy-3-methyl-phenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine N-(4-methoxy-3-methyl-phenyl)-5,…

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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 5.64 -28.99 2 3 1 35 237.348 3 ↓
Mid Mid (pH 6-8) 2.80 5.7 -6.92 1 3 0 34 236.34 2 ↓

Analogs

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Popular Name: N-(4-fluoro-2-methoxy-phenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine N-(4-fluoro-2-methoxy-phenyl)-5,…

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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) 2.51 4.97 -29.29 2 3 1 35 241.311 3 ↓
Mid Mid (pH 6-8) 2.51 5.12 -7.93 1 3 0 34 240.303 2 ↓

Parameters Provided:

ring.id = 171601
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 = 171601 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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