UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

11813241
11813241

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

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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) 3.42 -1.32 -12.61 1 5 0 59 372.509 5 ↓

Analogs

11813239
11813239

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

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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) 3.42 -1.26 -14.83 1 5 0 59 372.509 5 ↓

Analogs

11840257
11840257

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Popular Name: 2,3,6-trifluoro-N-[[(2S)-8-(3-methylbutanoyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]benzamide 2,3,6-trifluoro-N-[[(2S)-8-(3-me…

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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) 3.32 0.21 -16.38 1 5 0 59 412.452 5 ↓

Analogs

11840255
11840255

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Popular Name: 2,3,6-trifluoro-N-[[(2R)-8-(3-methylbutanoyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]benzamide 2,3,6-trifluoro-N-[[(2R)-8-(3-me…

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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) 3.32 0.29 -15.23 1 5 0 59 412.452 5 ↓

Analogs

12040772
12040772

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Popular Name: 2-fluoro-N-[[(2S)-8-(2-methylsulfanylacetyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]benzamide 2-fluoro-N-[[(2S)-8-(2-methylsul…

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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) 1.96 -1.91 -18.92 1 5 0 59 380.485 5 ↓

Analogs

12040767
12040767

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Popular Name: 2-fluoro-N-[[(2R)-8-(2-methylsulfanylacetyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]benzamide 2-fluoro-N-[[(2R)-8-(2-methylsul…

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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) 1.96 -1.82 -21.72 1 5 0 59 380.485 5 ↓

Analogs

12041022
12041022

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Popular Name: 3,4-dimethoxy-N-[[(2S)-8-(3-methylbutanoyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]benzamide 3,4-dimethoxy-N-[[(2S)-8-(3-meth…

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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) 2.62 -1.28 -15.74 1 7 0 77 418.534 7 ↓

Analogs

12041019
12041019

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Popular Name: 3,4-dimethoxy-N-[[(2R)-8-(3-methylbutanoyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]benzamide 3,4-dimethoxy-N-[[(2R)-8-(3-meth…

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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) 2.62 -1.19 -18.03 1 7 0 77 418.534 7 ↓

Parameters Provided:

ring.id = 46371
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 = 46371 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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