UCSF
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Analogs

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Popular Name: N-[4-[[3-[(2R)-2H-indol-2-yl]phenyl]sulfamoyl]phenyl]propanamide N-[4-[[3-[(2R)-2H-indol-2-yl]phe…

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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) 4.17 7.29 -41.1 3 6 1 89 420.514 6 ↓
Mid Mid (pH 6-8) 4.17 7.3 -54.3 2 6 0 91 419.506 6 ↓

Analogs

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Popular Name: N-[3-[(2S)-5-chloro-2H-indol-2-yl]phenyl]benzenesulfonamide N-[3-[(2S)-5-chloro-2H-indol-2-y…

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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) 4.76 7.96 -42.4 2 4 1 60 383.88 4 ↓
Mid Mid (pH 6-8) 4.76 8.08 -51.28 1 4 0 62 382.872 4 ↓

Analogs

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Popular Name: N-[3-[(2S)-5-fluoro-2H-indol-2-yl]phenyl]-4-methyl-benzenesulfonamide N-[3-[(2S)-5-fluoro-2H-indol-2-y…

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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) 4.70 8.2 -42.59 2 4 1 60 381.452 4 ↓
Mid Mid (pH 6-8) 4.70 8.32 -52.02 1 4 0 62 380.444 4 ↓

Parameters Provided:

ring.id = 350629
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 = 350629 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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