UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

14246593
14246593
12741397
12741397
12741399
12741399
8402027
8402027

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Popular Name: (3R)-N-methyl-N-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-1-oxo-3-phenyl-isochroman-6-carboxamide (3R)-N-methyl-N-[2-(4-methylpipe…

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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) 1.53 9.46 -18.36 0 7 0 70 421.497 4 ↓

Analogs

14246592
14246592
12741397
12741397

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Popular Name: (3S)-N-methyl-N-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-1-oxo-3-phenyl-isochroman-6-carboxamide (3S)-N-methyl-N-[2-(4-methylpipe…

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) 1.53 9.47 -19.52 0 7 0 70 421.497 4 ↓

Parameters Provided:

ring.id = 239398
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 = 239398 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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