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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: 1-[2-(4-phenyl-1-piperidyl)ethyl]spiro[3H-quinazoline-2,1'-cyclobutane]-4-one 1-[2-(4-phenyl-1-piperidyl)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) 4.26 11.53 -57.3 2 4 1 37 376.524 4 ↓
Hi High (pH 8-9.5) 4.26 9.3 -9.97 1 4 0 36 375.516 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-(4-methyl-1-piperidyl)ethyl]spiro[3H-quinazoline-2,1'-cyclobutane]-4-one 1-[2-(4-methyl-1-piperidyl)ethyl…

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) 2.94 8.7 -51.25 2 4 1 37 314.453 3 ↓
Hi High (pH 8-9.5) 2.94 6.46 -8.78 1 4 0 36 313.445 3 ↓

Parameters Provided:

ring.id = 197465
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 = 197465 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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