UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-(3-benzyl-4-oxo-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-prop-2-ynyl-acetamide 2-(3-benzyl-4-oxo-6-phenyl-thien…

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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) 4.51 12.01 -14.16 1 5 0 64 445.569 7 ↓

Analogs

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Popular Name: 6-(4-methoxyphenyl)-3-[(2-methyl-3-nitro-phenyl)methyl]thieno[3,2-d]pyrimidin-4-one 6-(4-methoxyphenyl)-3-[(2-methyl…

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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) 4.69 11.9 -15.43 0 7 0 90 407.451 5 ↓

Analogs

5325806
5325806
5325814
5325814
5325815
5325815

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Popular Name: 4-[[6-(4-methoxyphenyl)-4-oxo-thieno[3,2-d]pyrimidin-3-yl]methyl]benzamide 4-[[6-(4-methoxyphenyl)-4-oxo-th…

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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) 3.20 8 -25.19 2 6 0 87 391.452 5 ↓

Analogs

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Popular Name: 3-[(4-oxo-6-phenyl-thieno[3,2-d]pyrimidin-3-yl)methyl]benzonitrile 3-[(4-oxo-6-phenyl-thieno[3,2-d]…

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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) 4.06 12.29 -15.54 0 4 0 59 343.411 3 ↓

Parameters Provided:

ring.id = 45482
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 = 45482 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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