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

Analogs

41545301
41545301

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Popular Name: (2R)-2-methyl-2-(4-oxopiperidine-1-carbonyl)-4H-1,4-benzoxazin-3-one (2R)-2-methyl-2-(4-oxopiperidine…

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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) 0.34 3.57 -13.99 1 6 0 76 288.303 1 ↓

Analogs

41545298
41545298

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Popular Name: (2S)-2-methyl-2-(4-oxopiperidine-1-carbonyl)-4H-1,4-benzoxazin-3-one (2S)-2-methyl-2-(4-oxopiperidine…

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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) 0.34 5.21 -15.41 1 6 0 76 288.303 1 ↓

Analogs

41546999
41546999

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Popular Name: (2S)-2,6-dimethyl-2-(4-oxopiperidine-1-carbonyl)-4H-1,4-benzoxazin-3-one (2S)-2,6-dimethyl-2-(4-oxopiperi…

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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) 0.77 5.88 -15.06 1 6 0 76 302.33 1 ↓

Analogs

41546996
41546996

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Popular Name: (2R)-2,6-dimethyl-2-(4-oxopiperidine-1-carbonyl)-4H-1,4-benzoxazin-3-one (2R)-2,6-dimethyl-2-(4-oxopiperi…

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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) 0.77 4.23 -13.69 1 6 0 76 302.33 1 ↓

Analogs

41548484
41548484

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Popular Name: (2R)-6-chloro-2-methyl-2-(4-oxopiperidine-1-carbonyl)-4H-1,4-benzoxazin-3-one (2R)-6-chloro-2-methyl-2-(4-oxop…

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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) 1.00 4.1 -13.49 1 6 0 76 322.748 1 ↓

Analogs

41548482
41548482

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Popular Name: (2S)-6-chloro-2-methyl-2-(4-oxopiperidine-1-carbonyl)-4H-1,4-benzoxazin-3-one (2S)-6-chloro-2-methyl-2-(4-oxop…

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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) 1.00 5.74 -14.94 1 6 0 76 322.748 1 ↓

Parameters Provided:

ring.id = 546830
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 = 546830 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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