UCSF
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Analogs

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Popular Name: (2S,4S)-4-amino-N-ethyl-1-[3-(1-oxoisoindolin-2-yl)propanoyl]pyrrolidine-2-carboxamide (2S,4S)-4-amino-N-ethyl-1-[3-(1-…

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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) -0.95 3.29 -70.7 4 7 1 97 345.423 5 ↓
Hi High (pH 8-9.5) -0.95 3.01 -20.38 3 7 0 96 344.415 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4R)-4-amino-N-ethyl-1-[3-(1-oxoisoindolin-2-yl)propanoyl]pyrrolidine-2-carboxamide (2S,4R)-4-amino-N-ethyl-1-[3-(1-…

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) -0.95 3.28 -70.51 4 7 1 97 345.423 5 ↓

Parameters Provided:

ring.id = 578484
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 = 578484 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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