UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

41529792
41529792

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Popular Name: 4-(dibenzylamino)cinnoline-3-carbonitrile 4-(dibenzylamino)cinnoline-3-car…

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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) 4.75 12.58 -9.27 0 4 0 53 350.425 5 ↓

Analogs

41530372
41530372

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Popular Name: 4-(dibenzylamino)-6-methyl-cinnoline-3-carbonitrile 4-(dibenzylamino)-6-methyl-cinno…

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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) 5.18 13.23 -8.94 0 4 0 53 364.452 5 ↓

Parameters Provided:

ring.id = 544308
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 = 544308 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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