UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

1760278
1760278

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Popular Name: (5S)-5-ethyl-5-methyl-2-phenyl-4,6-dihydro-1H-pyrimidine (5S)-5-ethyl-5-methyl-2-phenyl-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) 2.30 -0.97 -25.5 2 2 1 26 203.309 2 ↓

Analogs

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Popular Name: 2-(3-methoxyphenyl)-1,4,5,6-tetrahydropyrimidine 2-(3-methoxyphenyl)-1,4,5,6-tetr…

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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) 1.11 4.12 -26.56 2 3 1 35 191.254 2 ↓

Analogs

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Popular Name: 2-(2,3-dimethoxyphenyl)-1,4,5,6-tetrahydropyrimidine 2-(2,3-dimethoxyphenyl)-1,4,5,6-…

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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) 0.90 4.05 -26.45 2 4 1 44 221.28 3 ↓

Analogs

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Popular Name: 2-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]acetic 2-[4-(1,4,5,6-tetrahydropyrimidi…

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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) 0.38 5.68 -58.99 2 5 0 75 234.255 4 ↓

Parameters Provided:

ring.id = 101656
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 = 101656 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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