UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

12030051
12030051
19220883
19220883
19220890
19220890

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Popular Name: 3-(benzofuran-2-ylmethyl)-N-[(1S)-1-(2-furyl)ethyl]-9-methoxy-7-oxo-1,2,4,5-tetrahydropyrido[1,2-d][ 3-(benzofuran-2-ylmethyl)-N-[(1S…

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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) 3.27 0.47 -61.24 2 8 1 91 462.526 6 ↓

Analogs

19220883
19220883
19220890
19220890
12030049
12030049

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(benzofuran-2-ylmethyl)-N-[(1R)-1-(2-furyl)ethyl]-9-methoxy-7-oxo-1,2,4,5-tetrahydropyrido[1,2-d][ 3-(benzofuran-2-ylmethyl)-N-[(1R…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 3.27 0.47 -64.02 2 8 1 91 462.526 6 ↓

Parameters Provided:

ring.id = 80019
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 = 80019 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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