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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

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Popular Name: 3,5-dihydroxy-7-[(3-nitrophenyl)methoxy]-2-phenyl-chromen-4-one 3,5-dihydroxy-7-[(3-nitrophenyl)…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 2000 0.27 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 2000 0.27 Functional ≤ 10μM

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) 4.72 8.86 -16.06 2 8 0 126 405.362 5 ↓

Analogs

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Popular Name: 7-[(2-chlorophenyl)methoxy]-3,5-dihydroxy-2-phenyl-chromen-4-one 7-[(2-chlorophenyl)methoxy]-3,5-…

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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) 5.41 8.73 -9.37 2 5 0 80 394.81 4 ↓

Analogs

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Popular Name: 7-[(2-bromophenyl)methoxy]-3,5-dihydroxy-2-phenyl-chromen-4-one 7-[(2-bromophenyl)methoxy]-3,5-d…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 10000 0.25 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 10000 0.25 Functional ≤ 10μM

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) 5.54 8.83 -9.33 2 5 0 80 439.261 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(3,5-dihydroxy-4-oxo-2-phenyl-chromen-7-yl)oxymethyl]benzonitrile 3-[(3,5-dihydroxy-4-oxo-2-phenyl…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 3000 0.27 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 3000 0.27 Functional ≤ 10μM

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) 4.51 8.53 -14.21 2 6 0 104 385.375 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dihydroxy-2-phenyl-7-(p-tolylmethoxy)chromen-4-one 3,5-dihydroxy-2-phenyl-7-(p-toly…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 6000 0.26 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 6000 0.26 Functional ≤ 10μM

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) 5.23 8.82 -9.83 2 5 0 80 374.392 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dihydroxy-7-(m-tolylmethoxy)-2-phenyl-chromen-4-one 3,5-dihydroxy-7-(m-tolylmethoxy)…

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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) 5.21 8.81 -9.89 2 5 0 80 374.392 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dihydroxy-7-[(2-nitrophenyl)methoxy]-2-phenyl-chromen-4-one 3,5-dihydroxy-7-[(2-nitrophenyl)…

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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) 4.69 8.82 -13.42 2 8 0 126 405.362 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[(3,5-dihydroxy-4-oxo-2-phenyl-chromen-7-yl)oxymethyl]benzonitrile 4-[(3,5-dihydroxy-4-oxo-2-phenyl…

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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) 4.54 8.54 -13.78 2 6 0 104 385.375 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-[(4-chlorophenyl)methoxy]-3,5-dihydroxy-2-phenyl-chromen-4-one 7-[(4-chlorophenyl)methoxy]-3,5-…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 8000 0.25 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 8000 0.25 Functional ≤ 10μM

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) 5.46 8.67 -10.42 2 5 0 80 394.81 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-[(4-bromophenyl)methoxy]-3,5-dihydroxy-2-phenyl-chromen-4-one 7-[(4-bromophenyl)methoxy]-3,5-d…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 6000 0.26 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 6000 0.26 Functional ≤ 10μM

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) 5.59 8.77 -10.38 2 5 0 80 439.261 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dihydroxy-7-[(4-nitrophenyl)methoxy]-2-phenyl-chromen-4-one 3,5-dihydroxy-7-[(4-nitrophenyl)…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 10000 0.23 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 10000 0.23 Functional ≤ 10μM

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) 4.74 8.86 -15.26 2 8 0 126 405.362 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dihydroxy-7-(o-tolylmethoxy)-2-phenyl-chromen-4-one 3,5-dihydroxy-7-(o-tolylmethoxy)…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 7000 0.26 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 7000 0.26 Functional ≤ 10μM

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) 5.18 8.83 -10.04 2 5 0 80 374.392 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dihydroxy-7-[(2-methoxyphenyl)methoxy]-2-phenyl-chromen-4-one 3,5-dihydroxy-7-[(2-methoxypheny…

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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) 4.79 7.6 -10.3 2 6 0 89 390.391 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3,5-dihydroxy-4-oxo-2-phenyl-chromen-7-yl)oxymethyl]benzonitrile 2-[(3,5-dihydroxy-4-oxo-2-phenyl…

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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) 4.49 8.56 -12.31 2 6 0 104 385.375 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-[(3-chlorophenyl)methoxy]-3,5-dihydroxy-2-phenyl-chromen-4-one 7-[(3-chlorophenyl)methoxy]-3,5-…

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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) 5.44 8.66 -10.55 2 5 0 80 394.81 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-[(4-chlorophenyl)methoxy]-3,5-dihydroxy-2-(4-methoxyphenyl)chromen-4-one 7-[(4-chlorophenyl)methoxy]-3,5-…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 6000 0.24 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 6000 0.24 Functional ≤ 10μM

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) 5.52 7.97 -11.13 2 6 0 89 424.836 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[7-[(4-chlorophenyl)methoxy]-3,5-dihydroxy-4-oxo-chromen-2-yl]benzonitrile 4-[7-[(4-chlorophenyl)methoxy]-3…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 900 0.28 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 900 0.28 Functional ≤ 10μM

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) 5.21 9.07 -12.07 2 6 0 104 419.82 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-[(4-chlorophenyl)methoxy]-3,5-dihydroxy-2-[4-(trifluoromethyl)phenyl]chromen-4-one 7-[(4-chlorophenyl)methoxy]-3,5-…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 3000 0.24 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 3000 0.24 Functional ≤ 10μM

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) 6.36 9.67 -9.91 2 5 0 80 462.807 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dihydroxy-7-[(4-methoxyphenyl)methoxy]-2-phenyl-chromen-4-one 3,5-dihydroxy-7-[(4-methoxypheny…

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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) 4.84 7.45 -11.48 2 6 0 89 390.391 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-[(3-bromophenyl)methoxy]-3,5-dihydroxy-2-phenyl-chromen-4-one 7-[(3-bromophenyl)methoxy]-3,5-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) 5.57 8.76 -10.56 2 5 0 80 439.261 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-dihydroxy-7-[(3-methoxyphenyl)methoxy]-2-phenyl-chromen-4-one 3,5-dihydroxy-7-[(3-methoxypheny…

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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) 4.82 7.45 -11.61 2 6 0 89 390.391 5 ↓

Parameters Provided:

ring.id = 366105
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 = 366105 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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