UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: N,3,5-trimethyl-N-[(5-methyl-2-furyl)methyl]benzofuran-2-carboxamide N,3,5-trimethyl-N-[(5-methyl-2-f…

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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) 3.62 9.56 -11.36 0 4 0 47 297.354 3 ↓

Analogs

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Popular Name: N,3-dimethyl-N-[(5-methyl-2-furyl)methyl]benzofuran-2-carboxamide N,3-dimethyl-N-[(5-methyl-2-fury…

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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) 3.19 8.86 -9.11 0 4 0 47 283.327 3 ↓

Analogs

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Popular Name: N-(2-furylmethyl)-3-(methoxymethyl)-N-methyl-benzofuran-2-carboxamide N-(2-furylmethyl)-3-(methoxymeth…

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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) 2.48 7.1 -10.81 0 5 0 56 299.326 5 ↓

Analogs

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Popular Name: 5-ethyl-N-(2-furylmethyl)-3-methyl-benzofuran-2-carboxamide 5-ethyl-N-(2-furylmethyl)-3-meth…

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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) 3.62 7.26 -7.59 1 4 0 55 283.327 4 ↓

Analogs

28231962
28231962

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Popular Name: 5-fluoro-N,3-dimethyl-N-[(5-methyl-2-furyl)methyl]benzofuran-2-carboxamide 5-fluoro-N,3-dimethyl-N-[(5-meth…

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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) 2.36 8.93 -8.27 0 4 0 47 301.317 3 ↓

Analogs

8062445
8062445
8062446
8062446

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Popular Name: N-(2-furylmethyl)-5-methoxy-N,3-dimethyl-benzofuran-2-carboxamide N-(2-furylmethyl)-5-methoxy-N,3-…

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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) 3.00 7.33 -11.93 0 5 0 56 299.326 4 ↓

Analogs

8062445
8062445
8062446
8062446

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Popular Name: 5-methoxy-3-methyl-N-[(1R)-1-(5-methyl-2-furyl)ethyl]benzofuran-2-carboxamide 5-methoxy-3-methyl-N-[(1R)-1-(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) 3.54 6.74 -8.3 1 5 0 65 313.353 4 ↓

Analogs

8062445
8062445
8062446
8062446

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Popular Name: 5-methoxy-3-methyl-N-[(1S)-1-(5-methyl-2-furyl)ethyl]benzofuran-2-carboxamide 5-methoxy-3-methyl-N-[(1S)-1-(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) 3.54 6.75 -8.28 1 5 0 65 313.353 4 ↓

Analogs

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Popular Name: 5-amino-N-[(1R)-1-(5-methyl-2-furyl)ethyl]benzofuran-2-carboxamide 5-amino-N-[(1R)-1-(5-methyl-2-fu…

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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) 2.18 4.63 -8.46 3 5 0 81 284.315 3 ↓

Analogs

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Popular Name: 5-amino-N-[(1S)-1-(5-methyl-2-furyl)ethyl]benzofuran-2-carboxamide 5-amino-N-[(1S)-1-(5-methyl-2-fu…

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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) 2.18 4.64 -8.49 3 5 0 81 284.315 3 ↓

Parameters Provided:

ring.id = 64713
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 = 64713 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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