UCSF
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8781281
8781281
16667063
16667063
17140350
17140350
17142480
17142480
38611729
38611729

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Popular Name: 4,7-dimethyl-2-(1-piperidylmethyl)tetralin-1-one 4,7-dimethyl-2-(1-piperidylmethy…

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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) 5.16 10.76 -11.26 2 6 0 80 411.461 5 ↓
Ref Reference (pH 7) 6.89 9.95 -17.65 2 6 0 83 411.461 5 ↓
Hi High (pH 8-9.5) 6.89 10.95 -67.9 1 6 -1 86 410.453 5 ↓

Parameters Provided:

ring.id = 2935
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 = 2935 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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