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Popular Name: (5-methyl-2-furyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone (5-methyl-2-furyl)-(1H-pyrrolo[2…

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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) 2.12 6.24 -11.42 1 4 0 59 226.235 2 ↓

Analogs

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Popular Name: (5-nitro-2-furyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone (5-nitro-2-furyl)-(1H-pyrrolo[2,…

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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) 1.98 6.1 -9.58 1 7 0 105 257.205 3 ↓

Analogs

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Popular Name: (3-methyl-2-furyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone (3-methyl-2-furyl)-(1H-pyrrolo[2…

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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) 2.28 6.1 -11.9 1 4 0 59 226.235 2 ↓

Analogs

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Popular Name: 2-furyl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone 2-furyl(1H-pyrrolo[2,3-b]pyridin…

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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) 1.90 5.41 -12.21 1 4 0 59 212.208 2 ↓

Analogs

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Popular Name: (5-bromo-2-furyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone (5-bromo-2-furyl)-(1H-pyrrolo[2,…

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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) 2.83 6.14 -8.64 1 4 0 59 291.104 2 ↓

Parameters Provided:

ring.id = 16330
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 = 16330 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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