UCSF
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Analogs

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Popular Name: 2-[(4S)-2,5-dioxo-4-(p-tolyl)-4,7-dihydro-3H-furo[3,4-d]pyrimidin-1-yl]-N-(p-tolylmethyl)acetamide 2-[(4S)-2,5-dioxo-4-(p-tolyl)-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) 2.79 9.44 -19.39 2 7 0 88 405.454 5 ↓

Analogs

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Popular Name: 2-[(4R)-2,5-dioxo-4-(p-tolyl)-4,7-dihydro-3H-furo[3,4-d]pyrimidin-1-yl]-N-(p-tolylmethyl)acetamide 2-[(4R)-2,5-dioxo-4-(p-tolyl)-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) 2.79 9.45 -19.51 2 7 0 88 405.454 5 ↓

Analogs

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Popular Name: 2-[(4S)-4-(3-chlorophenyl)-2,5-dioxo-4,7-dihydro-3H-furo[3,4-d]pyrimidin-1-yl]-N-[(4-methoxyphenyl)m 2-[(4S)-4-(3-chlorophenyl)-2,5-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) 2.60 7.89 -21.25 2 8 0 97 441.871 6 ↓

Analogs

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Popular Name: 2-[(4R)-4-(3-chlorophenyl)-2,5-dioxo-4,7-dihydro-3H-furo[3,4-d]pyrimidin-1-yl]-N-[(4-methoxyphenyl)m 2-[(4R)-4-(3-chlorophenyl)-2,5-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) 2.60 7.9 -20.32 2 8 0 97 441.871 6 ↓

Analogs

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Popular Name: N-benzyl-2-[(4R)-4-(m-tolyl)-2,5-dioxo-4,7-dihydro-3H-furo[3,4-d]pyrimidin-1-yl]acetamide N-benzyl-2-[(4R)-4-(m-tolyl)-2,5…

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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) 2.32 8.8 -19.36 2 7 0 88 391.427 5 ↓

Analogs

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Popular Name: N-benzyl-2-[(4S)-4-(m-tolyl)-2,5-dioxo-4,7-dihydro-3H-furo[3,4-d]pyrimidin-1-yl]acetamide N-benzyl-2-[(4S)-4-(m-tolyl)-2,5…

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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) 2.32 8.82 -19.48 2 7 0 88 391.427 5 ↓

Parameters Provided:

ring.id = 563027
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 = 563027 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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