UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

9749920
9749920

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Popular Name: N-(3,5-dimethylphenyl)-2-[4-oxo-3-(2-thienylmethyl)benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl-acetamide N-(3,5-dimethylphenyl)-2-[4-oxo-…

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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) 5.52 12.63 -18.49 1 6 0 77 475.595 6 ↓

Analogs

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Popular Name: N-(3-methylsulfanylphenyl)-2-[4-oxo-3-(2-thienylmethyl)benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl-aceta N-(3-methylsulfanylphenyl)-2-[4-…

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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 12.3 -18.48 1 6 0 77 493.635 7 ↓

Analogs

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Popular Name: N-(2-methoxy-5-methyl-phenyl)-2-[4-oxo-3-(2-thienylmethyl)benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl-ac N-(2-methoxy-5-methyl-phenyl)-2-…

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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) 5.13 11.38 -18.01 1 7 0 86 491.594 7 ↓

Parameters Provided:

ring.id = 506797
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 = 506797 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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