UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

11838501
11838501

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Popular Name: N-[[(3S)-8-(4-fluorobenzoyl)-4-oxa-8-azaspiro[4.5]decan-3-yl]methyl]-4-isopropoxy-benzamide N-[[(3S)-8-(4-fluorobenzoyl)-4-o…

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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) 3.52 -1.1 -13.63 1 6 0 68 454.542 6 ↓

Analogs

11838500
11838500

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Popular Name: N-[[(3R)-8-(4-fluorobenzoyl)-4-oxa-8-azaspiro[4.5]decan-3-yl]methyl]-4-isopropoxy-benzamide N-[[(3R)-8-(4-fluorobenzoyl)-4-o…

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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) 3.52 -1.1 -15.72 1 6 0 68 454.542 6 ↓

Analogs

12036996
12036996

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Popular Name: methyl methyl

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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) 2.84 -0.39 -19.76 1 7 0 85 454.498 6 ↓

Analogs

12036992
12036992

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Popular Name: methyl methyl

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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) 2.84 -0.3 -22.46 1 7 0 85 454.498 6 ↓

Parameters Provided:

ring.id = 57666
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 = 57666 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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