UCSF
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Popular Name: N-[(3-fluorophenyl)methyl]-2,4-dioxo-N-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-pyrido[2,3-d]pyrimidin N-[(3-fluorophenyl)methyl]-2,4-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) 1.05 3.39 -41.22 1 8 -1 111 397.386 5 ↓
Lo Low (pH 4.5-6) 0.59 5.33 -10.31 2 8 0 108 398.394 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(3-fluorophenyl)methyl]-2,4-dioxo-N-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-pyrido[2,3-d]pyrimidin N-[(3-fluorophenyl)methyl]-2,4-d…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 1.05 3.22 -38.36 1 8 -1 111 397.386 5 ↓
Lo Low (pH 4.5-6) 0.59 5.16 -11.2 2 8 0 108 398.394 5 ↓

Parameters Provided:

ring.id = 15053
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 = 15053 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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