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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: (2E)-4,6,6-tributyl-2-[(E)-1-hydroxy-3-phenyl-prop-2-enylidene]-5-methoxy-cyclohex-4-ene-1,3-dione (2E)-4,6,6-tributyl-2-[(E)-1-hyd…

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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) 6.34 15.94 -53.79 0 4 -1 66 437.6 13 ↓
Lo Low (pH 4.5-6) 5.76 15.21 -8.87 0 4 0 60 438.608 13 ↓

Analogs

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Popular Name: (2E)-2-[(E)-1-hydroxy-3-phenyl-prop-2-enylidene]-4,6,6-triisobutyl-5-methoxy-cyclohex-4-ene-1,3-dion (2E)-2-[(E)-1-hydroxy-3-phenyl-p…

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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) 5.47 14.75 -50.24 0 4 -1 66 437.6 10 ↓
Lo Low (pH 4.5-6) 4.89 14.18 -8.9 0 4 0 60 438.608 10 ↓

Analogs

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Popular Name: (2E)-2-[(E)-1-hydroxy-3-phenyl-prop-2-enylidene]-4,6,6-triisopentyl-5-methoxy-cyclohex-4-ene-1,3-dio (2E)-2-[(E)-1-hydroxy-3-phenyl-p…

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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) 6.28 17.5 -54.4 0 4 -1 66 479.681 13 ↓
Lo Low (pH 4.5-6) 5.70 16.64 -8.68 0 4 0 60 480.689 13 ↓

Analogs

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Popular Name: (2E)-2-[(E)-1-hydroxy-3-phenyl-prop-2-enylidene]-5-methoxy-4,6,6-tris(3-methylbut-2-enyl)cyclohex-4- (2E)-2-[(E)-1-hydroxy-3-phenyl-p…

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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) 6.35 17.43 -53.89 0 4 -1 66 473.633 10 ↓
Lo Low (pH 4.5-6) 5.77 15.98 -9.43 0 4 0 60 474.641 10 ↓

Analogs

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Popular Name: (2E)-5-ethoxy-2-[(E)-1-hydroxy-3-phenyl-prop-2-enylidene]-4,6,6-tripropyl-cyclohex-4-ene-1,3-dione (2E)-5-ethoxy-2-[(E)-1-hydroxy-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) 6.49 14.54 -52.7 0 4 -1 66 409.546 11 ↓
Lo Low (pH 4.5-6) 5.90 13.76 -8.69 0 4 0 60 410.554 11 ↓

Analogs

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Popular Name: (2E)-2-[(E)-1-hydroxy-3-phenyl-prop-2-enylidene]-5-propoxy-4,6,6-tripropyl-cyclohex-4-ene-1,3-dione (2E)-2-[(E)-1-hydroxy-3-phenyl-p…

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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) 6.99 15.35 -52.24 0 4 -1 66 423.573 12 ↓
Lo Low (pH 4.5-6) 6.41 14.56 -8.36 0 4 0 60 424.581 12 ↓

Parameters Provided:

ring.id = 469265
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 = 469265 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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