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Popular Name: 2-[(2S)-2-(4-isopropylphenyl)-2,3-dihydrothiazol-4-yl]-N-[2-(5-methoxy-2H-indol-3-yl)ethyl]acetamide 2-[(2S)-2-(4-isopropylphenyl)-2,…

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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) 5.15 9.88 -37.86 3 5 1 64 436.601 7 ↓

Analogs

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Popular Name: (4E)-4-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-5-[2-[hydroxy(phosphonooxy)phosphoryl]oxyethyl]- (4E)-4-[3-[(4-amino-2-methyl-pyr…

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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) -2.49 5.31 -295.17 3 14 0 231 523.377 12 ↓
Lo Low (pH 4.5-6) -2.49 5.74 -404.81 4 14 0 232 524.385 12 ↓

Parameters Provided:

ring.id = 355296
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 = 355296 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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