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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: 3-methyl-3,8-diazaspiro[4.5]decane-7,9-dione 3-methyl-3,8-diazaspiro[4.5]deca…

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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) -0.62 1.98 -46.25 2 4 1 51 183.231 0 ↓
Hi High (pH 8-9.5) -0.62 -0.65 -9.36 1 4 0 49 182.223 0 ↓

Analogs

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Popular Name: 3-cyclopropyl-3,8-diazaspiro[4.5]decane-7,9-dione 3-cyclopropyl-3,8-diazaspiro[4.5…

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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) -0.26 3.47 -48.32 2 4 1 51 209.269 1 ↓
Hi High (pH 8-9.5) -0.26 0.99 -8.44 1 4 0 49 208.261 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-isopropyl-3,8-diazaspiro[4.5]decane-7,9-dione 3-isopropyl-3,8-diazaspiro[4.5]d…

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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) 0.05 3.21 -48.38 2 4 1 51 211.285 1 ↓
Hi High (pH 8-9.5) 0.05 0.8 -8.2 1 4 0 49 210.277 1 ↓

Parameters Provided:

ring.id = 316873
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 = 316873 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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