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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: (2Z)-6-hydroxy-4-methyl-2-[(4-phenylphenyl)methylene]-7-[[(2S)-2-(3-pyridyl)-1-piperidyl]methyl]benz (2Z)-6-hydroxy-4-methyl-2-[(4-ph…

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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) 6.36 15.21 -41.3 2 5 1 68 503.622 5 ↓
Hi High (pH 8-9.5) 6.36 13.21 -9.86 1 5 0 67 502.614 5 ↓
Mid Mid (pH 6-8) 6.36 15.98 -34.23 1 5 0 71 502.614 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2Z)-6-hydroxy-2-[(4-phenylphenyl)methylene]-7-[[(2S)-2-(3-pyridyl)-1-piperidyl]methyl]benzofuran-3- (2Z)-6-hydroxy-2-[(4-phenylpheny…

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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) 5.98 14.56 -41.75 2 5 1 68 489.595 5 ↓
Hi High (pH 8-9.5) 5.98 13.33 -47.58 0 5 -1 69 487.579 5 ↓
Mid Mid (pH 6-8) 5.98 12.56 -9.91 1 5 0 67 488.587 5 ↓

Parameters Provided:

ring.id = 549854
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 = 549854 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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