UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

11995733
11995733

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Popular Name: (1R)-N-[2-[(2R)-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-2,3,4,9-tetrahydro-1H-carbazole (1R)-N-[2-[(2R)-2-methyl-3,5-dih…

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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) 3.89 -2.16 -52.6 3 5 1 59 404.534 4 ↓

Analogs

11995732
11995732

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Popular Name: (1R)-N-[2-[(2S)-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-2,3,4,9-tetrahydro-1H-carbazole (1R)-N-[2-[(2S)-2-methyl-3,5-dih…

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) 3.89 -1.81 -51.26 3 5 1 59 404.534 4 ↓

Parameters Provided:

ring.id = 67484
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 = 67484 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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