UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: [3-(2-ethoxyethoxy)phenyl]-(9-oxa-3-azaspiro[5.5]undecan-3-yl)methanone [3-(2-ethoxyethoxy)phenyl]-(9-ox…

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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) 2.06 6.97 -10.37 0 5 0 48 347.455 6 ↓

Analogs

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Popular Name: 3-(6-chloropyridazin-3-yl)-9-oxa-3-azaspiro[5.5]undecane 3-(6-chloropyridazin-3-yl)-9-oxa…

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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) 2.51 5.71 -8.32 0 4 0 38 267.76 1 ↓

Analogs

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Popular Name: (2R)-2-propyl-3-oxa-9-azaspiro[5.5]undecane (2R)-2-propyl-3-oxa-9-azaspiro[5…

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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) 2.03 4.96 -41.51 2 2 1 26 198.33 2 ↓

Analogs

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Popular Name: (2S)-2-propyl-3-oxa-9-azaspiro[5.5]undecane (2S)-2-propyl-3-oxa-9-azaspiro[5…

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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) 2.03 4.96 -40.96 2 2 1 26 198.33 2 ↓

Analogs

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Popular Name: 2,2-dimethyl-3-oxa-9-azaspiro[5.5]undecane 2,2-dimethyl-3-oxa-9-azaspiro[5.…

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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) 1.42 3.92 -41.51 2 2 1 26 184.303 0 ↓

Analogs

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Popular Name: (2S)-2-isopropyl-3-oxa-9-azaspiro[5.5]undecane (2S)-2-isopropyl-3-oxa-9-azaspir…

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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) 1.72 4.71 -41.99 2 2 1 26 198.33 1 ↓

Analogs

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Popular Name: (2R)-2-isopropyl-3-oxa-9-azaspiro[5.5]undecane (2R)-2-isopropyl-3-oxa-9-azaspir…

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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) 1.72 4.78 -41.35 2 2 1 26 198.33 1 ↓

Analogs

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Popular Name: (2R)-2-methyl-3-oxa-9-azaspiro[5.5]undecane (2R)-2-methyl-3-oxa-9-azaspiro[5…

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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) 0.97 3.36 -41.25 2 2 1 26 170.276 0 ↓

Analogs

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Popular Name: (2S)-2-methyl-3-oxa-9-azaspiro[5.5]undecane (2S)-2-methyl-3-oxa-9-azaspiro[5…

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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) 0.97 3.36 -41.48 2 2 1 26 170.276 0 ↓

Analogs

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Popular Name: (2R)-2-ethyl-2-methyl-3-oxa-9-azaspiro[5.5]undecane (2R)-2-ethyl-2-methyl-3-oxa-9-az…

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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) 1.92 4.6 -41.19 2 2 1 26 198.33 1 ↓

Analogs

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Popular Name: (2S)-2-ethyl-2-methyl-3-oxa-9-azaspiro[5.5]undecane (2S)-2-ethyl-2-methyl-3-oxa-9-az…

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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) 1.92 4.64 -41.19 2 2 1 26 198.33 1 ↓

Analogs

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Popular Name: (2R)-2-ethyl-3-oxa-9-azaspiro[5.5]undecane (2R)-2-ethyl-3-oxa-9-azaspiro[5.…

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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) 1.47 4.18 -41.05 2 2 1 26 184.303 1 ↓

Analogs

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Popular Name: (2S)-2-ethyl-3-oxa-9-azaspiro[5.5]undecane (2S)-2-ethyl-3-oxa-9-azaspiro[5.…

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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) 1.47 4.18 -41.02 2 2 1 26 184.303 1 ↓

Parameters Provided:

ring.id = 26264
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 = 26264 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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