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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4aS,4bR,10aS,10bR,12aS)-10a,12a-dimethyl-1,3,4,4a,4b,5,6,10b,11,12-decahydrochrysene-2,8-dione (4aS,4bR,10aS,10bR,12aS)-10a,12a…

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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) 3.31 9.62 -13.65 0 2 0 34 298.426 0 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4aS,4bR,10aS,10bR,12aR)-10a,12a-dimethyl-1,3,4,4a,4b,5,6,10b,11,12-decahydrochrysene-2,8-dione (4aS,4bR,10aS,10bR,12aR)-10a,12a…

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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) 3.31 9.71 -14.42 0 2 0 34 298.426 0 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4aS,4bR,10aS,10bS,12aS)-10a,12a-dimethyl-1,3,4,4a,4b,5,6,10b,11,12-decahydrochrysene-2,8-dione (4aS,4bR,10aS,10bS,12aS)-10a,12a…

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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) 3.31 9.32 -14.6 0 2 0 34 298.426 0 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4aS,4bR,10aS,10bS,12aR)-10a,12a-dimethyl-1,3,4,4a,4b,5,6,10b,11,12-decahydrochrysene-2,8-dione (4aS,4bR,10aS,10bS,12aR)-10a,12a…

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) 3.31 9.78 -14.66 0 2 0 34 298.426 0 ↓

Parameters Provided:

ring.id = 510548
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 = 510548 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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