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Analogs

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Popular Name: cyclopropyl-(3-methylbenzofuran-2-yl)methanone cyclopropyl-(3-methylbenzofuran-…

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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) 3.27 7.72 -6.44 0 2 0 30 200.237 2 ↓

Analogs

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Popular Name: (5-bromobenzofuran-2-yl)-cyclopropyl-methanone (5-bromobenzofuran-2-yl)-cyclopr…

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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) 3.68 7.66 -4.77 0 2 0 30 265.106 2 ↓

Analogs

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Popular Name: (5-chlorobenzofuran-2-yl)-cyclopropyl-methanone (5-chlorobenzofuran-2-yl)-cyclop…

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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) 3.55 7.56 -4.88 0 2 0 30 220.655 2 ↓

Analogs

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Popular Name: (5-bromo-3-methyl-benzofuran-2-yl)-cyclopropyl-methanone (5-bromo-3-methyl-benzofuran-2-y…

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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 8.34 -4.71 0 2 0 30 279.133 2 ↓

Analogs

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Popular Name: cyclopropyl-(5,7-dichlorobenzofuran-2-yl)methanone cyclopropyl-(5,7-dichlorobenzofu…

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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) 4.16 8.06 -3.98 0 2 0 30 255.1 2 ↓

Analogs

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Popular Name: cyclopropyl-(3,5-dimethylbenzofuran-2-yl)methanone cyclopropyl-(3,5-dimethylbenzofu…

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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) 3.70 8.41 -6.13 0 2 0 30 214.264 2 ↓

Analogs

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Popular Name: cyclopropyl-(6-methoxybenzofuran-2-yl)methanone cyclopropyl-(6-methoxybenzofuran…

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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) 2.93 6.35 -6.96 0 3 0 39 216.236 3 ↓

Analogs

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Popular Name: (7-bromobenzofuran-2-yl)-cyclopropyl-methanone (7-bromobenzofuran-2-yl)-cyclopr…

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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) 3.66 7.65 -6.38 0 2 0 30 265.106 2 ↓

Analogs

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Popular Name: (5-chloro-3-methyl-benzofuran-2-yl)-cyclopropyl-methanone (5-chloro-3-methyl-benzofuran-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) 3.92 8.23 -4.82 0 2 0 30 234.682 2 ↓

Analogs

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Popular Name: cyclopropyl-(6-fluoro-3-methyl-benzofuran-2-yl)methanone cyclopropyl-(6-fluoro-3-methyl-b…

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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) 3.41 7.78 -5.12 0 2 0 30 218.227 2 ↓

Analogs

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Popular Name: cyclopropyl-(5-methylbenzofuran-2-yl)methanone cyclopropyl-(5-methylbenzofuran-…

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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) 3.32 7.73 -6.02 0 2 0 30 200.237 2 ↓

Analogs

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Popular Name: cyclopropyl-(3,6-dimethylbenzofuran-2-yl)methanone cyclopropyl-(3,6-dimethylbenzofu…

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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) 3.70 8.39 -6.23 0 2 0 30 214.264 2 ↓

Analogs

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Popular Name: cyclopropyl-(6-methoxy-3-methyl-benzofuran-2-yl)methanone cyclopropyl-(6-methoxy-3-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) 3.30 7.03 -7.13 0 3 0 39 230.263 3 ↓

Analogs

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Popular Name: cyclopropyl-(5-methoxy-3-methyl-benzofuran-2-yl)methanone cyclopropyl-(5-methoxy-3-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) 3.30 7.01 -6.87 0 3 0 39 230.263 3 ↓

Parameters Provided:

ring.id = 251961
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 = 251961 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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