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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-[2-(2-tert-butylphenoxy)ethyl]-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-6-carboxamide N-[2-(2-tert-butylphenoxy)ethyl]…

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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) 2.70 2.48 -41.51 2 8 -1 120 381.412 6 ↓
Lo Low (pH 4.5-6) 2.24 4.42 -12.75 3 8 0 117 382.42 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(3,5-dimethylphenoxy)ethyl]-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-6-carboxamide N-[2-(3,5-dimethylphenoxy)ethyl]…

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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) 1.87 1.12 -42.37 2 8 -1 120 353.358 5 ↓
Lo Low (pH 4.5-6) 1.41 3.07 -13.28 3 8 0 117 354.366 5 ↓

Parameters Provided:

ring.id = 290207
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 = 290207 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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