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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]adamantane-1-carboxamide N-[2-(4-methylsulfonylpiperazin-…

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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) 1.30 3.61 -16.16 1 7 0 87 383.514 4 ↓

Analogs

25520717
25520717
25520722
25520722

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Popular Name: N-[(1R)-1-(4-acetylpiperazine-1-carbonyl)-2-methyl-propyl]adamantane-1-carboxamide N-[(1R)-1-(4-acetylpiperazine-1-…

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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) 2.40 7.79 -11.34 1 6 0 70 389.54 4 ↓

Analogs

25520717
25520717
25520722
25520722

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(4-acetylpiperazine-1-carbonyl)-2-methyl-propyl]adamantane-1-carboxamide N-[(1S)-1-(4-acetylpiperazine-1-…

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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) 2.40 7.66 -11.22 1 6 0 70 389.54 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl]adamantane-1-carboxamide N-[2-(4-acetylpiperazin-1-yl)-2-…

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) 1.29 6.03 -12.74 1 6 0 70 347.459 3 ↓

Parameters Provided:

ring.id = 28440
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 = 28440 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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