UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

43412059
43412059
44510574
44510574
44510575
44510575
44659673
44659673

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Popular Name: 3-[1-(cyclobutylmethyl)-4,6-dimethyl-2-oxo-pyrimidin-5-yl]propanoic 3-[1-(cyclobutylmethyl)-4,6-dime…

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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) 1.30 6.96 -48.02 0 5 -1 75 263.317 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[1-(cyclobutylmethyl)-4,6-dimethyl-2-oxo-pyrimidin-5-yl]acetic 2-[1-(cyclobutylmethyl)-4,6-dime…

Find On: PubMed — Wikipedia — Google

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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) 0.78 6.24 -49.93 0 5 -1 75 249.29 4 ↓
Lo Low (pH 4.5-6) 0.78 7.34 -36.55 1 5 0 76 250.298 4 ↓

Parameters Provided:

ring.id = 543947
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 = 543947 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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