UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

45618810
45618810

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Popular Name: 3-[(2R)-2-hydroxy-3-(4-phenoxyphenoxy)propyl]-1,2,3-benzotriazin-4-one 3-[(2R)-2-hydroxy-3-(4-phenoxyph…

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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) 3.70 6.5 -15.24 1 7 0 86 389.411 7 ↓

Analogs

45618807
45618807

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Popular Name: 3-[(2S)-2-hydroxy-3-(4-phenoxyphenoxy)propyl]-1,2,3-benzotriazin-4-one 3-[(2S)-2-hydroxy-3-(4-phenoxyph…

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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) 3.70 7.11 -13.93 1 7 0 86 389.411 7 ↓

Parameters Provided:

ring.id = 16572
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 = 16572 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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