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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: 7-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-3-phenyl-2-(trifluoromethyl)chromen-4-one 7-[(6-chloro-4H-1,3-benzodioxin-…

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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) 6.70 12.22 -9.55 0 5 0 58 488.845 5 ↓

Analogs

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Popular Name: 7-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-3-(4-methoxyphenyl)chromen-4-one 7-[(6-chloro-4H-1,3-benzodioxin-…

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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) 5.62 10.65 -13.38 0 6 0 67 450.874 5 ↓

Analogs

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Popular Name: 7-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-3-(4-methoxyphenyl)-2-methyl-chromen-4-one 7-[(6-chloro-4H-1,3-benzodioxin-…

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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) 5.84 11.25 -12.54 0 6 0 67 464.901 5 ↓

Analogs

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Popular Name: 7-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-3-(3,4-dimethoxyphenyl)chromen-4-one 7-[(6-chloro-4H-1,3-benzodioxin-…

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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 10.56 -15.22 0 7 0 76 480.9 6 ↓

Analogs

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Popular Name: 7-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-3-(3,4-dimethoxyphenyl)-2-methyl-chromen-4-one 7-[(6-chloro-4H-1,3-benzodioxin-…

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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) 5.43 11.16 -15.48 0 7 0 76 494.927 6 ↓

Analogs

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Popular Name: 3-(4-bromophenyl)-7-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one 3-(4-bromophenyl)-7-[(6-chloro-4…

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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) 6.37 11.99 -11.58 0 5 0 58 499.744 4 ↓

Analogs

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Popular Name: 3-(4-bromophenyl)-7-[(6-chloro-4H-1,3-benzodioxin-8-yl)methoxy]-2-methyl-chromen-4-one 3-(4-bromophenyl)-7-[(6-chloro-4…

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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) 6.59 12.59 -11.18 0 5 0 58 513.771 4 ↓

Analogs

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Popular Name: 7-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-3-(2-methoxyphenyl)chromen-4-one 7-[(6-bromo-4H-1,3-benzodioxin-8…

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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) 5.70 10.8 -13.52 0 6 0 67 495.325 5 ↓

Analogs

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Popular Name: 7-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-3-(2-methoxyphenyl)-2-methyl-chromen-4-one 7-[(6-bromo-4H-1,3-benzodioxin-8…

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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) 5.92 11.45 -14.3 0 6 0 67 509.352 5 ↓

Analogs

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Popular Name: 7-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-3-phenyl-chromen-4-one 7-[(6-bromo-4H-1,3-benzodioxin-8…

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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) 5.69 11.48 -12.17 0 5 0 58 465.299 4 ↓

Analogs

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Popular Name: 7-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-2-methyl-3-phenyl-chromen-4-one 7-[(6-bromo-4H-1,3-benzodioxin-8…

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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) 5.92 12.07 -12.01 0 5 0 58 479.326 4 ↓

Analogs

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Popular Name: 7-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-3-(4-chlorophenyl)chromen-4-one 7-[(6-bromo-4H-1,3-benzodioxin-8…

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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) 6.37 11.98 -11.57 0 5 0 58 499.744 4 ↓

Analogs

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Popular Name: 7-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-3-(4-chlorophenyl)-2-methyl-chromen-4-one 7-[(6-bromo-4H-1,3-benzodioxin-8…

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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) 6.59 12.58 -11.2 0 5 0 58 513.771 4 ↓

Analogs

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Popular Name: 7-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-3-(4-methoxyphenyl)chromen-4-one 7-[(6-bromo-4H-1,3-benzodioxin-8…

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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) 5.75 10.75 -13.35 0 6 0 67 495.325 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-[(6-bromo-4H-1,3-benzodioxin-8-yl)methoxy]-3-(4-methoxyphenyl)-2-methyl-chromen-4-one 7-[(6-bromo-4H-1,3-benzodioxin-8…

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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) 5.97 11.35 -12.51 0 6 0 67 509.352 5 ↓

Parameters Provided:

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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 = 537195 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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