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

Analogs

14249969
14249969
14249971
14249971
14249973
14249973
18245629
18245629
18245630
18245630

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R)-2-oxotetrahydrofuran-3-yl] [(3R)-2-oxotetrahydrofuran-3-yl]

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.38 8.23 -12.71 1 6 0 82 319.357 6 ↓

Analogs

14249971
14249971
14249973
14249973
18245629
18245629
18245630
18245630
32910108
32910108

Draw Identity 99% 90% 80% 70%

Popular Name: [(3R)-2-oxotetrahydrofuran-3-yl] [(3R)-2-oxotetrahydrofuran-3-yl]

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.38 8.16 -15.03 1 6 0 82 319.357 6 ↓

Analogs

14249973
14249973
18245629
18245629
18245630
18245630
32910108
32910108
32910109
32910109

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S)-2-oxotetrahydrofuran-3-yl] [(3S)-2-oxotetrahydrofuran-3-yl]

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.38 7.89 -14.81 1 6 0 82 319.357 6 ↓

Analogs

18245629
18245629
18245630
18245630
32910108
32910108
32910109
32910109
14249967
14249967

Draw Identity 99% 90% 80% 70%

Popular Name: [(3S)-2-oxotetrahydrofuran-3-yl] [(3S)-2-oxotetrahydrofuran-3-yl]

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.38 7.88 -12.85 1 6 0 82 319.357 6 ↓

Parameters Provided:

ring.id = 240827
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 = 240827 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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//zinc12.docking.org/results/combination?ring.id=240827&filter.purchasability=annotated

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