UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 3,5-difluoro-N-[2-(3-methoxypropyl)isoindolin-4-yl]benzamide 3,5-difluoro-N-[2-(3-methoxyprop…

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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) 2.68 8.67 -50.11 2 4 1 43 347.385 6 ↓
Hi High (pH 8-9.5) 2.68 6.09 -8.2 1 4 0 42 346.377 6 ↓

Analogs

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Popular Name: 2,5-difluoro-N-[2-(3-methoxypropyl)isoindolin-4-yl]benzamide 2,5-difluoro-N-[2-(3-methoxyprop…

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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) 2.68 8.68 -51.27 2 4 1 43 347.385 6 ↓
Hi High (pH 8-9.5) 2.68 6.1 -10.78 1 4 0 42 346.377 6 ↓

Analogs

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Popular Name: 2-chloro-N-[2-(3-methoxypropyl)isoindolin-4-yl]benzamide 2-chloro-N-[2-(3-methoxypropyl)i…

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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) 3.06 9.05 -51.95 2 4 1 43 345.85 6 ↓
Hi High (pH 8-9.5) 3.06 6.47 -11.19 1 4 0 42 344.842 6 ↓

Analogs

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Popular Name: N-[2-(3-methoxypropyl)isoindolin-4-yl]-2-methyl-benzamide N-[2-(3-methoxypropyl)isoindolin…

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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) 2.83 9.29 -48.56 2 4 1 43 325.432 6 ↓
Hi High (pH 8-9.5) 2.83 6.72 -9.57 1 4 0 42 324.424 6 ↓

Parameters Provided:

ring.id = 384703
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 = 384703 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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