UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

10065931
10065931
5121436
5121436

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Popular Name: N-(2-diethylaminoethyl)-N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-4-phenyl-benzamide N-(2-diethylaminoethyl)-N-([1,3]…

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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) 6.07 13.92 -49.58 1 6 1 56 474.606 8 ↓
Hi High (pH 8-9.5) 6.07 11.89 -10.05 0 6 0 55 473.598 8 ↓

Analogs

5122445
5122445

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Popular Name: N-[3-(dimethylamino)propyl]-N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-4-phenyl-benzamide N-[3-(dimethylamino)propyl]-N-([…

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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) 5.59 13.45 -53.55 1 6 1 56 460.579 7 ↓

Parameters Provided:

ring.id = 103784
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 = 103784 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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