UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: tris(dimethylBLAHyl)methanol tris(dimethylBLAHyl)methanol

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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) 7.25 16.05 -11.59 1 4 0 59 545.771 3 ↓
Lo Low (pH 4.5-6) 7.25 16.26 -20.99 2 4 1 60 546.779 3 ↓

Analogs

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Popular Name: [bis(dimethylBLAHyl)-methoxy-methyl]-dimethyl-BLAH [bis(dimethylBLAHyl)-methoxy-met…

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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) 7.87 17.9 -9.22 0 4 0 48 559.798 4 ↓
Lo Low (pH 4.5-6) 7.87 18.07 -20.81 1 4 1 49 560.806 4 ↓

Parameters Provided:

ring.id = 197546
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 = 197546 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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