UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 4-[2-[(3S,5R)-3,5-dimethyl-2,6-dioxo-cyclohexyl]-2-imino-ethyl]piperidine-2,6-dione 4-[2-[(3S,5R)-3,5-dimethyl-2,6-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) 0.57 3.53 -37.58 2 6 -1 110 291.327 3 ↓
Mid Mid (pH 6-8) -0.01 3.3 -49.18 3 6 1 106 293.343 3 ↓
Mid Mid (pH 6-8) 0.57 1.6 -14.03 3 6 0 107 292.335 3 ↓

Analogs

5092219
5092219
5092222
5092222

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Popular Name: 4-[2-(2-hydroxy-6-oxo-1-cyclohexenyl)-2-imino-ethyl]piperidine-2,6-dione 4-[2-(2-hydroxy-6-oxo-1-cyclohex…

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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) -0.14 1.87 -36.7 2 6 -1 110 263.273 3 ↓
Mid Mid (pH 6-8) -0.81 1.81 -16.84 3 6 0 106 264.281 2 ↓

Parameters Provided:

ring.id = 42197
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 = 42197 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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