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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

5825413
5825413

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Popular Name: [(2Z)-2-[(E)-3-(2-methoxyphenyl)prop-2-enylidene]-3-oxo-benzofuran-6-yl] [(2Z)-2-[(E)-3-(2-methoxyphenyl)…

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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 12.29 -11.3 0 5 0 66 378.424 6 ↓

Analogs

41431146
41431146
41431362
41431362
41436591
41436591
41437612
41437612
41506088
41506088

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Popular Name: (2E)-6-hydroxy-7-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2E)-6-hydroxy-7-methyl-2-[(E)-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) 4.33 7.59 -10.02 1 3 0 50 278.307 2 ↓
Hi High (pH 8-9.5) 4.33 8.34 -43.18 0 3 -1 53 277.299 2 ↓

Analogs

41431231
41431231
41431453
41431453
41436697
41436697
41437770
41437770
41506273
41506273

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Popular Name: (2Z)-6-hydroxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-6-hydroxy-4-methyl-2-[(E)-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) 3.86 7.54 -9.27 1 3 0 50 278.307 2 ↓
Hi High (pH 8-9.5) 3.86 8.32 -44.66 0 3 -1 53 277.299 2 ↓

Analogs

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Popular Name: [(2Z)-7-methyl-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-6-yl] [(2Z)-7-methyl-3-oxo-2-[(E)-3-ph…

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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) 3.90 11.6 -12.12 0 4 0 57 320.344 4 ↓

Analogs

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Popular Name: [(2Z)-4-methyl-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-6-yl] [(2Z)-4-methyl-3-oxo-2-[(E)-3-ph…

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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) 3.90 11.6 -12.02 0 4 0 57 320.344 4 ↓

Analogs

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Popular Name: 2-[(2Z)-4-methyl-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-6-yl]oxyacetonitrile 2-[(2Z)-4-methyl-3-oxo-2-[(E)-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) 4.18 10.37 -13.57 0 4 0 63 317.344 4 ↓

Analogs

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Popular Name: 2-[(2Z)-7-methyl-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-6-yl]oxyacetamide 2-[(2Z)-7-methyl-3-oxo-2-[(E)-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) 3.13 7.86 -17.55 2 5 0 83 335.359 5 ↓

Analogs

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Popular Name: 2-[(2Z)-4-methyl-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-6-yl]oxyacetamide 2-[(2Z)-4-methyl-3-oxo-2-[(E)-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) 3.13 7.79 -16.31 2 5 0 83 335.359 5 ↓

Analogs

41499015
41499015

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Popular Name: methyl 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) 4.62 11.95 -13 0 5 0 66 364.397 6 ↓

Analogs

41499011
41499011

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Popular Name: methyl 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) 4.62 11.95 -12.98 0 5 0 66 364.397 6 ↓

Analogs

41499423
41499423

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Popular Name: methyl 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) 4.62 11.89 -13.2 0 5 0 66 364.397 6 ↓

Analogs

41499419
41499419

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Popular Name: methyl 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) 4.62 11.9 -13.21 0 5 0 66 364.397 6 ↓

Analogs

41500079
41500079

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Popular Name: ethyl ethyl

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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) 5.00 12.88 -12.66 0 5 0 66 378.424 7 ↓

Analogs

41500075
41500075

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Popular Name: ethyl ethyl

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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) 5.00 12.88 -12.63 0 5 0 66 378.424 7 ↓

Analogs

41500492
41500492

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Popular Name: ethyl ethyl

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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) 5.00 12.82 -12.9 0 5 0 66 378.424 7 ↓

Analogs

41500488
41500488

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Popular Name: ethyl ethyl

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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) 5.00 12.82 -12.88 0 5 0 66 378.424 7 ↓

Analogs

41432292
41432292

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Popular Name: isopropyl isopropyl

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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) 5.00 13.01 -13.57 0 5 0 66 378.424 7 ↓

Analogs

41432388
41432388

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Popular Name: isopropyl isopropyl

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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) 5.00 12.93 -12.55 0 5 0 66 378.424 7 ↓

Analogs

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Popular Name: (2Z)-7-methyl-6-(3-methylbut-2-enoxy)-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-methyl-6-(3-methylbut-2-e…

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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) 6.08 12.73 -8.53 0 3 0 39 346.426 5 ↓

Analogs

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Popular Name: (2Z)-4-methyl-6-(3-methylbut-2-enoxy)-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-4-methyl-6-(3-methylbut-2-e…

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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) 6.08 12.62 -8.11 0 3 0 39 346.426 5 ↓

Analogs

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Popular Name: allyl allyl

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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) 4.91 12.87 -13.53 0 5 0 66 376.408 8 ↓

Analogs

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Popular Name: allyl allyl

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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) 4.91 12.79 -12.43 0 5 0 66 376.408 8 ↓

Analogs

41431146
41431146
41431362
41431362
41436591
41436591
41437612
41437612
41248313
41248313

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Popular Name: (2Z)-6-acetonyloxy-7-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-6-acetonyloxy-7-methyl-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) 3.95 11.69 -15.45 0 4 0 57 334.371 5 ↓

Analogs

41431231
41431231
41431453
41431453
41436697
41436697
41437770
41437770
41248386
41248386

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Popular Name: (2Z)-6-acetonyloxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-6-acetonyloxy-4-methyl-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) 3.95 11.61 -14.29 0 4 0 57 334.371 5 ↓

Analogs

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Popular Name: (2Z)-7-(dimethylaminomethyl)-6-hydroxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-(dimethylaminomethyl)-6-h…

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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 9.52 -43.8 2 4 1 55 336.411 4 ↓
Hi High (pH 8-9.5) 4.06 7.8 -44.34 0 4 -1 57 334.395 4 ↓
Mid Mid (pH 6-8) 4.06 10.27 -32.08 1 4 0 58 335.403 4 ↓

Analogs

41514612
41514612
41584456
41584456

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Popular Name: (2Z)-7-(diethylaminomethyl)-6-hydroxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-(diethylaminomethyl)-6-hy…

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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 11.15 -40.22 2 4 1 55 364.465 6 ↓
Mid Mid (pH 6-8) 4.82 11.73 -28.09 1 4 0 58 363.457 6 ↓

Analogs

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Popular Name: (2Z)-7-[(diisobutylamino)methyl]-6-hydroxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-[(diisobutylamino)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) 6.31 13.84 -39.94 2 4 1 55 420.573 8 ↓
Mid Mid (pH 6-8) 6.31 14.52 -26.41 1 4 0 58 419.565 8 ↓

Analogs

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Popular Name: (2Z)-7-[(diisobutylamino)methyl]-6-hydroxy-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-[(diisobutylamino)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) 5.93 13.22 -40.56 2 4 1 55 406.546 8 ↓
Mid Mid (pH 6-8) 5.93 13.75 -27.07 1 4 0 58 405.538 8 ↓

Analogs

41584184
41584184
41513413
41513413

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Popular Name: (2Z)-7-[[butyl(methyl)amino]methyl]-6-hydroxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3- (2Z)-7-[[butyl(methyl)amino]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) 5.50 12.03 -43.24 2 4 1 55 378.492 7 ↓
Mid Mid (pH 6-8) 5.50 12.6 -28.82 1 4 0 58 377.484 7 ↓

Analogs

41584221
41584221
2360466
2360466

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Popular Name: (2Z)-7-[[butyl(methyl)amino]methyl]-6-hydroxy-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-[[butyl(methyl)amino]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) 5.12 11.4 -43.65 2 4 1 55 364.465 7 ↓
Mid Mid (pH 6-8) 5.12 11.96 -29.26 1 4 0 58 363.457 7 ↓

Analogs

41584046
41584046
41513413
41513413

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Popular Name: (2Z)-7-[(dibutylamino)methyl]-6-hydroxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-[(dibutylamino)methyl]-6-…

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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) 6.94 14.08 -42.6 2 4 1 55 420.573 10 ↓
Mid Mid (pH 6-8) 6.94 14.75 -28.84 1 4 0 58 419.565 10 ↓

Analogs

41584079
41584079

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Popular Name: (2Z)-7-[(dibutylamino)methyl]-6-hydroxy-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-[(dibutylamino)methyl]-6-…

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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) 6.56 13.55 -42.76 2 4 1 55 406.546 10 ↓
Mid Mid (pH 6-8) 6.56 14.1 -29.21 1 4 0 58 405.538 10 ↓

Analogs

41513157
41513157

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Popular Name: (2Z)-7-[[bis(2-methoxyethyl)amino]methyl]-6-hydroxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofu (2Z)-7-[[bis(2-methoxyethyl)amin…

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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) 4.03 8.45 -10.94 1 6 0 72 423.509 10 ↓
Hi High (pH 8-9.5) 4.03 7.72 -50.01 0 6 -1 75 422.501 10 ↓
Mid Mid (pH 6-8) 4.03 9.94 -35.01 1 6 0 76 423.509 10 ↓

Analogs

41510667
41510667
41514612
41514612

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Popular Name: (2Z)-7-[(dipropylamino)methyl]-6-hydroxy-4-methyl-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-[(dipropylamino)methyl]-6…

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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) 5.82 12.56 -41 2 4 1 55 392.519 8 ↓
Mid Mid (pH 6-8) 5.82 13.22 -27.83 1 4 0 58 391.511 8 ↓

Analogs

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Popular Name: (2Z)-7-[(dipropylamino)methyl]-6-hydroxy-2-[(E)-3-phenylprop-2-enylidene]benzofuran-3-one (2Z)-7-[(dipropylamino)methyl]-6…

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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 11.92 -41.43 2 4 1 55 378.492 8 ↓
Mid Mid (pH 6-8) 5.44 12.56 -29.03 1 4 0 58 377.484 8 ↓

Parameters Provided:

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filter.purchasability = annotated
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Structural Results Found: (before additional filtering)

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