UCSF
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Analogs

50766132
50766132
25048833
25048833
25048826
25048826
9836868
9836868

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Popular Name: N-[2-(2H-indol-3-yl)ethyl]-N-methyl-2-[p-tolylsulfonyl-[2-(2-thienyl)ethyl]amino]acetamide N-[2-(2H-indol-3-yl)ethyl]-N-met…

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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) 4.71 12.38 -17.56 1 6 0 73 495.67 10 ↓

Analogs

27433538
27433538

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Popular Name: (2S)-3-(2H-indol-3-yl)-2-[[2-[p-tolylsulfonyl-[2-(2-thienyl)ethyl]amino]acetyl]amino]propanamide (2S)-3-(2H-indol-3-yl)-2-[[2-[p-…

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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) 4.24 7.55 -20.28 4 8 0 125 524.668 11 ↓

Parameters Provided:

ring.id = 604188
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 = 604188 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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