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

Analogs

19899434
19899434

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6R)-9-(4-methoxyphenyl)-3,6-diphenyl-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione (3S,6R)-9-(4-methoxyphenyl)-3,6-…

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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) 6.49 15.71 -29.22 1 4 0 55 475.588 4 ↓

Analogs

19899434
19899434

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6S)-9-(4-methoxyphenyl)-3,6-diphenyl-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione (3S,6S)-9-(4-methoxyphenyl)-3,6-…

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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) 6.49 15.72 -29.25 1 4 0 55 475.588 4 ↓

Analogs

19899434
19899434

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6R)-9-(4-methoxyphenyl)-3,6-diphenyl-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione (3R,6R)-9-(4-methoxyphenyl)-3,6-…

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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) 6.49 15.71 -29.34 1 4 0 55 475.588 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6S)-9-(4-chlorophenyl)-3,6-diphenyl-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione (3R,6S)-9-(4-chlorophenyl)-3,6-d…

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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) 7.12 16.92 -26.17 1 3 0 46 480.007 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,6S)-9-(4-chlorophenyl)-3,6-diphenyl-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione (3S,6S)-9-(4-chlorophenyl)-3,6-d…

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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) 7.12 16.92 -26.23 1 3 0 46 480.007 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,6R)-9-(4-chlorophenyl)-3,6-diphenyl-2,3,4,5,6,7,9,10-octahydroacridine-1,8-dione (3R,6R)-9-(4-chlorophenyl)-3,6-d…

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) 7.12 16.91 -26.23 1 3 0 46 480.007 3 ↓

Parameters Provided:

ring.id = 112701
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 = 112701 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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