UCSF
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Popular Name: 1-(2-methoxyethyl)-3-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea 1-(2-methoxyethyl)-3-[5-(1-napht…

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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) 3.62 6.66 -16.63 2 6 0 76 374.491 7 ↓

Analogs

47821160
47821160
28533
28533
1774712
1774712

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Popular Name: 2-ethylsulfanyl-5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazole 2-ethylsulfanyl-5-(1-naphthylmet…

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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) 5.10 9.72 -7.35 0 2 0 26 318.492 5 ↓

Parameters Provided:

ring.id = 280698
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 = 280698 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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