UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

36755254
36755254
44197017
44197017
49950011
49950011
49950012
49950012
7406860
7406860

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Popular Name: 2-cyclohexyl-5-[(2R)-2-methylpiperidine-1-carbonyl]isoindoline-1,3-dione 2-cyclohexyl-5-[(2R)-2-methylpip…

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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) 3.61 9.67 -11.56 0 5 0 59 354.45 2 ↓

Analogs

49950011
49950011
49950012
49950012
36755252
36755252
7406860
7406860
7406861
7406861

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Popular Name: 2-cyclohexyl-5-[(2S)-2-methylpiperidine-1-carbonyl]isoindoline-1,3-dione 2-cyclohexyl-5-[(2S)-2-methylpip…

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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) 3.61 9.68 -10.63 0 5 0 59 354.45 2 ↓

Analogs

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Popular Name: 2-cyclohexyl-5-[(2R)-2-ethylpiperidine-1-carbonyl]isoindoline-1,3-dione 2-cyclohexyl-5-[(2R)-2-ethylpipe…

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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) 4.15 10.3 -11.36 0 5 0 59 368.477 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-cyclohexyl-5-[(2S)-2-ethylpiperidine-1-carbonyl]isoindoline-1,3-dione 2-cyclohexyl-5-[(2S)-2-ethylpipe…

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) 4.15 10.28 -11.48 0 5 0 59 368.477 3 ↓

Parameters Provided:

ring.id = 111012
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 = 111012 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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