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

Analogs

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Popular Name: 2-[[(5R)-9-tert-butyl-1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl]sulfanyl]-N-(m-tolyl)acetamid 2-[[(5R)-9-tert-butyl-1,5-dicyan…

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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) 4.57 9.26 -18.96 1 6 0 106 450.608 5 ↓

Analogs

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Popular Name: 2-[[(11R)-3-tert-butyl-7,11-dicyano-10-oxo-9-azaspiro[5.5]undec-7-en-8-yl]sulfanyl]-N-(4-fluoropheny 2-[[(11R)-3-tert-butyl-7,11-dicy…

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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) 4.31 8.68 -13.92 1 6 0 106 454.571 5 ↓

Analogs

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Popular Name: (11R)-8-[[(5S)-1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl]sulfanylmethylsulfanyl]-10-oxo-9-aza (11R)-8-[[(5S)-1,5-dicyano-4-oxo…

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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) 4.16 8.1 -23.97 0 8 0 154 506.657 4 ↓

Analogs

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Popular Name: 2-(hexylsulfanyl)-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile 2-(hexylsulfanyl)-4-oxo-3-azaspi…

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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) 4.69 8.43 -15.33 0 4 0 77 331.485 6 ↓

Analogs

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Popular Name: (5R)-2-ethylsulfanyl-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile (5R)-2-ethylsulfanyl-4-oxo-3-aza…

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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 5.29 -15.42 0 4 0 77 275.377 2 ↓

Analogs

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Popular Name: 2-[[(5R)-1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl]sulfanyl]-N-(8-quinolyl)acetamide 2-[[(5R)-1,5-dicyano-4-oxo-3-aza…

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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) 3.00 6.72 -15.56 1 7 0 119 431.521 4 ↓

Analogs

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Popular Name: (5R)-2-allylsulfanyl-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile (5R)-2-allylsulfanyl-4-oxo-3-aza…

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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) 2.89 5.45 -8.82 0 4 0 77 287.388 3 ↓

Analogs

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Popular Name: (5S)-2-allylsulfanyl-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile (5S)-2-allylsulfanyl-4-oxo-3-aza…

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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) 2.89 6 -14 0 4 0 77 287.388 3 ↓

Analogs

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Popular Name: (5R)-2-ethylsulfanyl-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile (5R)-2-ethylsulfanyl-4-oxo-3-aza…

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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 4.88 -8.89 0 4 0 77 275.377 2 ↓

Analogs

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Popular Name: (5S)-2-ethylsulfanyl-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile (5S)-2-ethylsulfanyl-4-oxo-3-aza…

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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 5.44 -14.21 0 4 0 77 275.377 2 ↓

Analogs

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Popular Name: (5R)-4-oxo-2-propylsulfanyl-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile (5R)-4-oxo-2-propylsulfanyl-3-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) 3.12 5.68 -8.7 0 4 0 77 289.404 3 ↓

Analogs

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Popular Name: (5S)-4-oxo-2-propylsulfanyl-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile (5S)-4-oxo-2-propylsulfanyl-3-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) 3.12 6.23 -14.13 0 4 0 77 289.404 3 ↓

Analogs

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Popular Name: (11R)-8-[2-[[(5S)-1,5-dicyano-4-oxo-3-azaspiro[5.5]undec-1-en-2-yl]sulfanyl]ethylsulfanyl]-10-oxo-9- (11R)-8-[2-[[(5S)-1,5-dicyano-4-…

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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) 4.17 8.49 -25.32 0 8 0 154 520.684 5 ↓

Parameters Provided:

ring.id = 11025
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 = 11025 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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