UCSF
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42458892
42458892
42458894
42458894
43897591
43897591
43897593
43897593
23070211
23070211

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Popular Name: (8R,9S)-8-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-6,7,8,9-tetrahydro-5H-benzo[7]annulen-9-amine (8R,9S)-8-[(2S,6S)-2,6-dimethylm…

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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) 0.80 5.21 -41.8 3 3 1 40 275.416 1 ↓
Lo Low (pH 4.5-6) 0.80 6.98 -123.51 4 3 2 41 276.424 1 ↓

Parameters Provided:

ring.id = 122713
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 = 122713 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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