UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

38735743
38735743

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Popular Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-[4-(2,3-dihydroimidazo[2,1-b]thiazol-6-yl)phenyl]propanamide (2S)-2-(1,3-benzodioxol-5-yloxy)…

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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) 3.56 9.18 -25.5 1 7 0 75 409.467 5 ↓
Lo Low (pH 4.5-6) 3.56 9.62 -40.24 2 7 1 76 410.475 5 ↓

Analogs

38735740
38735740

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Popular Name: (2R)-2-(1,3-benzodioxol-5-yloxy)-N-[4-(2,3-dihydroimidazo[2,1-b]thiazol-6-yl)phenyl]propanamide (2R)-2-(1,3-benzodioxol-5-yloxy)…

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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) 3.56 9.15 -25.28 1 7 0 75 409.467 5 ↓
Lo Low (pH 4.5-6) 3.56 9.59 -40.03 2 7 1 76 410.475 5 ↓

Analogs

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Popular Name: 2-(1,3-benzodioxol-5-yloxy)-N-[4-(2,3-dihydroimidazo[2,1-b]thiazol-6-yl)phenyl]acetamide 2-(1,3-benzodioxol-5-yloxy)-N-[4…

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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) 3.20 8.59 -29.23 1 7 0 75 395.44 5 ↓
Lo Low (pH 4.5-6) 3.20 9.03 -43.28 2 7 1 76 396.448 5 ↓

Parameters Provided:

ring.id = 599768
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 = 599768 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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