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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

Draw Identity 99% 90% 80% 70%

Popular Name: 3-Fluoro-5-methoxybenzyl bromide 3-Fluoro-5-methoxybenzyl bromide

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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) 2.79 5.25 -3.86 0 1 0 9 219.053 2 ↓

Analogs

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Popular Name: 2-Cyano-5-fluorobenzyl bromide 2-Cyano-5-fluorobenzyl bromide

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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) 2.49 6.18 -5.27 0 1 0 24 214.037 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Fluoro-5-methoxybenzyl chloride 2-Fluoro-5-methoxybenzyl chloride

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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) 2.66 5.1 -4.24 0 1 0 9 174.602 2 ↓

Analogs

36750089
36750089

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Popular Name: 2-Fluoro-4-methoxybenzyl chloride 2-Fluoro-4-methoxybenzyl chloride

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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) 2.66 5.11 -4.24 0 1 0 9 174.602 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(Chloromethyl)-1-fluoro-2-methoxybenzene 4-(Chloromethyl)-1-fluoro-2-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) 2.66 5.14 -6.08 0 1 0 9 174.602 2 ↓

Analogs

45627000
45627000

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Popular Name: 4-Chloro-3-fluorophenylacetonitrile 4-Chloro-3-fluorophenylacetonitrile

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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) 2.67 6.23 -10.34 0 1 0 24 169.586 1 ↓

Analogs

43505126
43505126

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Popular Name: 4-Fluoro-3-methoxyphenylacetonitrile 4-Fluoro-3-methoxyphenylacetonit…

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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) 2.05 5.03 -11.94 0 2 0 33 165.167 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-Fluoro-6-methoxyphenyl)acetonitrile 2-(2-Fluoro-6-methoxyphenyl)acet…

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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) 2.03 5.06 -7.54 0 2 0 33 165.167 2 ↓

Analogs

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Popular Name: 5-Methoxy-2-fluorobenzylcyanide 5-Methoxy-2-fluorobenzylcyanide

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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) 2.05 4.99 -8.55 0 2 0 33 165.167 2 ↓

Analogs

39712972
39712972

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Popular Name: 4-Methoxy-2-fluorobenzyl cyanide 4-Methoxy-2-fluorobenzyl cyanide

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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) 2.05 5 -9.27 0 2 0 33 165.167 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-Fluoro-2-methoxyphenyl)acetonitrile 2-(4-Fluoro-2-methoxyphenyl)acet…

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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) 2.05 5.1 -8.86 0 2 0 33 165.167 2 ↓

Analogs

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Popular Name: 3,5-Dibromobenzylcyanide 3,5-Dibromobenzylcyanide

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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) 3.45 6.88 -8.15 0 1 0 24 274.943 1 ↓

Analogs

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Popular Name: 2-Methyl-3-nitrophenylacetic acid 2-Methyl-3-nitrophenylacetic acid

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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) 1.67 5.97 -46.14 0 5 -1 86 194.166 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Bromo-4-chlorophenylacetic acid 2-Bromo-4-chlorophenylacetic acid

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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) 2.78 5.94 -43.55 0 2 -1 40 248.483 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2-Fluoro-6-methoxyphenyl)acetic acid (2-Fluoro-6-methoxyphenyl)acetic…

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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) 1.49 4.32 -54.33 0 3 -1 49 183.158 3 ↓

Analogs

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Popular Name: 4-Hydroxy-2-(trifluoromethoxy)benzaldehyde 4-Hydroxy-2-(trifluoromethoxy)be…

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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) 2.15 2.48 -11.09 1 3 0 47 206.119 3 ↓

Analogs

34364935
34364935

Draw Identity 99% 90% 80% 70%

Popular Name: 3-Chloro-4-(trifluoromethoxy)benzaldehyde 3-Chloro-4-(trifluoromethoxy)ben…

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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) 3.30 4.58 -7.62 0 2 0 26 224.565 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-Bromo-2-nitrobenzaldehyde 4-Bromo-2-nitrobenzaldehyde

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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) 2.42 5.29 -4.8 0 4 0 63 230.017 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-3-fluorobenzaldehyde 4-bromo-3-fluorobenzaldehyde

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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) 2.63 4.88 -5.98 0 1 0 17 203.01 1 ↓

Analogs

34330887
34330887

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Popular Name: 3-Bromo-5-fluorobenzaldehyde 3-Bromo-5-fluorobenzaldehyde

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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) 2.63 4.9 -5.93 0 1 0 17 203.01 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Fluoro-5-hydroxybenzaldehyde 2-Fluoro-5-hydroxybenzaldehyde

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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) 1.34 1.43 -9.91 1 2 0 37 140.113 1 ↓

Analogs

37078983
37078983

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Popular Name: 2-Amino-5-trifluoromethylbenzonitrile 2-Amino-5-trifluoromethylbenzoni…

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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) 2.00 3.76 -5.92 2 2 0 50 186.136 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Chloro-3-methylbenzonitrile 2-Chloro-3-methylbenzonitrile

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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) 2.72 5.88 -6.41 0 1 0 24 151.596 0 ↓

Analogs

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Popular Name: 2-Nitro-5-(trifluoromethyl)benzonitrile 2-Nitro-5-(trifluoromethyl)benzo…

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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 6.3 -10.29 0 4 0 70 216.118 2 ↓

Analogs

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Popular Name: 4-Hydroxy-2,5-dimethylbenzonitrile 4-Hydroxy-2,5-dimethylbenzonitrile

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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) 2.43 3.29 -5.75 1 2 0 44 147.177 0 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-Bromo-3-fluorobenzonitrile 4-Bromo-3-fluorobenzonitrile

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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) 2.59 5.55 -4.91 0 1 0 24 200.01 0 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-Amino-4-fluorobenzonitrile 3-Amino-4-fluorobenzonitrile

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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) 1.27 2.86 -4.9 2 2 0 50 136.129 0 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(Trifluoromethoxy)isophthalonitrile 4-(Trifluoromethoxy)isophthaloni…

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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) 2.35 5.11 -8.3 0 3 0 57 212.13 2 ↓

Analogs

38416841
38416841

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Popular Name: 3,5-dichloro-4-methylbenzoic acid 3,5-dichloro-4-methylbenzoic acid

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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) 3.51 5.64 -43.42 0 2 -1 40 204.032 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Methyl 3-bromomethyl-4-cyanobenzoate Methyl 3-bromomethyl-4-cyanobenz…

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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) 2.50 6.77 -7.76 0 3 0 50 254.083 3 ↓

Analogs

44224859
44224859

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Popular Name: 4-(trifluoromethyl)benzoic acid 4-(trifluoromethyl)benzoic acid

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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) 2.74 5.12 -43.37 0 2 -1 40 189.112 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-Fluoro-2-iodobenzoic acid 3-Fluoro-2-iodobenzoic acid

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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) 2.66 5.06 -44.73 0 2 -1 40 265.001 1 ↓
Hi High (pH 8-9.5) 2.38 7.9 -24.73 4 11 0 151 633.668 7 ↓

Analogs

34449105
34449105
34567156
34567156
34617989
34617989

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Popular Name: Benzoyl chloride Benzoyl chloride

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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) 2.39 4.74 -4.4 0 1 0 17 140.569 1 ↓

Analogs

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Popular Name: 3-Bromo-5-fluorobenzoyl chloride 3-Bromo-5-fluorobenzoyl chloride

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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) 3.29 5.44 -2.43 0 1 0 17 237.455 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Bromo-4-fluorobenzoyl chloride 2-Bromo-4-fluorobenzoyl chloride

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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) 3.29 5.43 -4 0 1 0 17 237.455 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Bromo-6-fluorobenzoyl chloride 2-Bromo-6-fluorobenzoyl chloride

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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) 3.27 5.48 -6.64 0 1 0 17 237.455 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-Fluoro-3-nitrobenzoyl chloride 4-Fluoro-3-nitrobenzoyl chloride

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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) 2.44 5.44 -7.43 0 4 0 63 203.556 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Hexafluorobisphenol A Hexafluorobisphenol A

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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) 4.94 7.56 -3.8 0 2 0 18 336.231 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-Chloro-2,4-difluorobenzylamine 5-Chloro-2,4-difluorobenzylamine

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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) 1.98 3.15 -47.33 3 1 1 28 178.589 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-Chloro-4-(Trifluoromethyl)Benzylamine 3-Chloro-4-(Trifluoromethyl)Benz…

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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) 2.62 3.94 -54.07 3 1 1 28 210.606 2 ↓

Analogs

44249048
44249048
44249065
44249065

Draw Identity 99% 90% 80% 70%

Popular Name: {2-[3-(Trifluoromethoxy)phenyl]ethyl}amine {2-[3-(Trifluoromethoxy)phenyl]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) 1.87 3.11 -48.33 3 2 1 37 206.187 4 ↓
Hi High (pH 8-9.5) 1.84 5.82 -95.07 7 7 2 113 444.461 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-Chloro-4-(trifluoromethyl)benzylalcohol 2-Chloro-4-(trifluoromethyl)benz…

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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) 2.78 3.46 -3.36 1 1 0 20 210.582 2 ↓

Analogs

34976805
34976805
36180160
36180160
36180166
36180166

Draw Identity 99% 90% 80% 70%

Popular Name: 3'-Bromo-2'-fluoroacetophenone 3'-Bromo-2'-fluoroacetophenone

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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) 2.71 5.55 -11.42 0 1 0 17 217.037 1 ↓

Analogs

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Popular Name: 2,2,2-TRIFLUOROACETOPHENONE 2,2,2-TRIFLUOROACETOPHENONE

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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) 2.39 5.31 -4.04 0 1 0 17 174.121 2 ↓

Analogs

2579841
2579841

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Popular Name: 2'-Chloro-2,2,2-trifluoroacetophenone 2'-Chloro-2,2,2-trifluoroacetoph…

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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) 3.02 5.83 -4.99 0 1 0 17 208.566 2 ↓

Analogs

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Popular Name: 2,2,2,2'-Tetrafluoroacetophenone 2,2,2,2'-Tetrafluoroacetophenone

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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) 2.50 5.44 -5.58 0 1 0 17 192.111 2 ↓

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Popular Name: 3,4-Dichloro-2-fluoroaniline 3,4-Dichloro-2-fluoroaniline

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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) 2.80 3.41 -4.61 2 1 0 26 180.009 0 ↓

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Popular Name: 3-Iodo-4-methoxyaniline 3-Iodo-4-methoxyaniline

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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) 2.08 2.81 -4.33 2 2 0 35 249.051 1 ↓

Analogs

5161791
5161791
32256355
32256355
40166200
40166200

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Popular Name: 3-(Dibutylamino)phenol 3-(Dibutylamino)phenol

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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) 4.41 7.02 -3.81 1 2 0 23 221.344 7 ↓

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Popular Name: 2-Bromo-5-trifluoromethylphenol 2-Bromo-5-trifluoromethylphenol

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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) 3.35 3.31 -3.52 1 1 0 20 241.006 1 ↓

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