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

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-[(4-methoxyphenyl)methyl]-methyl-oxo-BLAHcarboxamide N-(1,3-benzodioxol-5-ylmethyl)-[…

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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) 2.18 6.94 -26.29 1 10 0 99 501.543 6 ↓
Lo Low (pH 4.5-6) 2.18 9.22 -69.67 2 10 1 101 502.551 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-ethyl-[(4-methoxyphenyl)methyl]-oxo-BLAHcarboxamide N-(1,3-benzodioxol-5-ylmethyl)-e…

Find On: PubMed — Wikipedia — Google

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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) 2.56 7.69 -25.91 1 10 0 99 515.57 7 ↓
Lo Low (pH 4.5-6) 2.56 9.97 -69.51 2 10 1 101 516.578 7 ↓

Parameters Provided:

ring.id = 392442
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 = 392442 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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