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

Analogs

1733340
1733340
1733341
1733341
1733342
1733342

Draw Identity 99% 90% 80% 70%

Popular Name: 9-azabicyclo[6.2.0]decan-10-one 9-azabicyclo[6.2.0]decan-10-one

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Vendors

And 2 More

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 8400 0.65 Functional ≤ 10μM

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 -2.61 -5.95 1 2 0 29 153.225 0 ↓

Analogs

1733341
1733341
1733342
1733342
1733339
1733339

Draw Identity 99% 90% 80% 70%

Popular Name: 9-azabicyclo[6.2.0]decan-10-one 9-azabicyclo[6.2.0]decan-10-one

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Vendors

And 4 More

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 8400 0.65 Functional ≤ 10μM

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 -2.45 -6.21 1 2 0 29 153.225 0 ↓

Analogs

1733342
1733342
1733339
1733339

Draw Identity 99% 90% 80% 70%

Popular Name: 9-azabicyclo[6.2.0]decan-10-one 9-azabicyclo[6.2.0]decan-10-one

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Vendors

And 2 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 8400 0.65 Functional ≤ 10μM

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 -2.24 -6.74 1 2 0 29 153.225 0 ↓

Analogs

1733339
1733339

Draw Identity 99% 90% 80% 70%

Popular Name: 9-azabicyclo[6.2.0]decan-10-one 9-azabicyclo[6.2.0]decan-10-one

Find On: PubMed — Wikipedia — Google

Vendors

And 2 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 8400 0.65 Functional ≤ 10μM

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 -3.04 -5.84 1 2 0 29 153.225 0 ↓

Analogs

1721895
1721895
31716305
31716305
33849011
33849011

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,8R)-9-azabicyclo[6.2.0]dec-4-en-10-one (1R,8R)-9-azabicyclo[6.2.0]dec-4…

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Vendors

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 7300 0.65 Functional ≤ 10μM

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) 1.58 -2.8 -6.1 1 2 0 29 151.209 0 ↓

Analogs

31716305
31716305
33849011
33849011
1721892
1721892

Draw Identity 99% 90% 80% 70%

Popular Name: (1S,8S)-9-azabicyclo[6.2.0]dec-4-en-10-one (1S,8S)-9-azabicyclo[6.2.0]dec-4…

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Vendors

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 7300 0.65 Functional ≤ 10μM

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) 1.58 1.98 -6.35 1 2 0 29 151.209 0 ↓

Analogs

33849011
33849011
1721892
1721892
1721895
1721895

Draw Identity 99% 90% 80% 70%

Popular Name: (+/-)-9-azabicyclo[6.2.0]dec-4-en-10-one (+/-)-9-azabicyclo[6.2.0]dec-4-e…

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Vendors

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 7300 0.65 Functional ≤ 10μM

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) 1.58 1.15 -6.29 1 2 0 29 151.209 0 ↓

Analogs

1721892
1721892
1721895
1721895
31716305
31716305

Draw Identity 99% 90% 80% 70%

Popular Name: (1R,4E,8S)-9-azabicyclo[6.2.0]dec-4-en-10-one (1R,4E,8S)-9-azabicyclo[6.2.0]de…

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 7300 0.65 Functional ≤ 10μM

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) 1.58 0.91 -6.15 1 2 0 29 151.209 0 ↓

Analogs

39375381
39375381

Draw Identity 99% 90% 80% 70%

Popular Name: 7-Azabicyclo[4.2.0]oct-3-en-8-one 7-Azabicyclo[4.2.0]oct-3-en-8-one

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Vendors

And 6 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 9100 0.78 Functional ≤ 10μM

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) 0.56 0.24 -5.37 1 2 0 29 123.155 0 ↓

Analogs

39375381
39375381

Draw Identity 99% 90% 80% 70%

Popular Name: 7-Azabicyclo[4.2.0]oct-3-en-8-one 7-Azabicyclo[4.2.0]oct-3-en-8-one

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Vendors

And 8 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 9100 0.78 Functional ≤ 10μM

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) 0.56 1.04 -6.77 1 2 0 29 123.155 0 ↓

Analogs

39375381
39375381

Draw Identity 99% 90% 80% 70%

Popular Name: 7-Azabicyclo[4.2.0]oct-3-en-8-one 7-Azabicyclo[4.2.0]oct-3-en-8-one

Find On: PubMed — Wikipedia — Google

Vendors

And 7 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 9100 0.78 Functional ≤ 10μM

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) 0.56 0.81 -6.91 1 2 0 29 123.155 0 ↓

Analogs

39375381
39375381

Draw Identity 99% 90% 80% 70%

Popular Name: 7-Azabicyclo[4.2.0]oct-3-en-8-one 7-Azabicyclo[4.2.0]oct-3-en-8-one

Find On: PubMed — Wikipedia — Google

Vendors

And 6 More

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50426-8-O Plasmodium Falciparum (isolate K1 / Thailand) (cluster #8 Of 9), Other Other 9100 0.78 Functional ≤ 10μM

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) 0.56 0.5 -5.75 1 2 0 29 123.155 0 ↓

Parameters Provided:

target.name = Z50426-8-O
target.type = F10
page.format = summary
page.num = 1
filter.purchasability = purchasable

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 activity AS ac ON ci.sub_id_fk=ac.sub_id_fk INNER JOIN target AS t ON ac.target_fk=t.target_id  WHERE c.free = 1 AND t.code LIKE 'Z50426-8-O' AND t.atype_fk = 5 AND c.purchasable IN (1,2,4,5)    LIMIT 50

Permalink

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