UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 5-phenyl-3H-1,3-benzoxazol-2-one 5-phenyl-3H-1,3-benzoxazol-2-one

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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) 2.95 5.41 -8.61 1 3 0 46 211.22 1 ↓
Mid Mid (pH 6-8) 3.41 2.77 -48.66 0 3 -1 49 210.212 1 ↓

Analogs

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Popular Name: 5-(m-tolyl)-3H-1,3-benzoxazol-2-one 5-(m-tolyl)-3H-1,3-benzoxazol-2-one

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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) 3.37 6.07 -8.47 1 3 0 46 225.247 1 ↓
Mid Mid (pH 6-8) 3.83 3.44 -48.41 0 3 -1 49 224.239 1 ↓

Parameters Provided:

ring.id = 123779
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 = 123779 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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