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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: (2R)-1,1,1-trifluoro-2,4-dimethyl-pentan-2-ol (2R)-1,1,1-trifluoro-2,4-dimethy…

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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) 2.69 2.96 -2.21 1 1 0 20 170.174 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2S)-1,1,1-trifluoro-2,4-dimethyl-pentan-2-ol (2S)-1,1,1-trifluoro-2,4-dimethy…

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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) 2.69 3.08 -1.89 1 1 0 20 170.174 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(2-hydroxy-1-methyl-2-phenylethyl)-N,3-dimethylbutanamide N-(2-hydroxy-1-methyl-2-phenylet…

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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) 2.46 6.13 -8.67 1 3 0 41 249.354 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(2-hydroxy-1-methyl-2-phenylethyl)-N,3-dimethylbutanamide N-(2-hydroxy-1-methyl-2-phenylet…

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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) 2.46 5.96 -7.79 1 3 0 41 249.354 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (3S,5S)-3-Isopropyl-5-((2S,4S)-4-isopropyl-5-oxotetrahydrofuran-2-yl)pyrrolidin-2-one (3S,5S)-3-Isopropyl-5-((2S,4S)-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) 3.51 5.7 -15.14 1 4 0 55 253.342 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (3S,5S)-3-Isopropyl-5-((2S,4S)-4-isopropyl-5-oxotetrahydrofuran-2-yl)pyrrolidin-2-one (3S,5S)-3-Isopropyl-5-((2S,4S)-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) 3.51 5.86 -15.32 1 4 0 55 253.342 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (3S,5S)-3-Isopropyl-5-((2S,4S)-4-isopropyl-5-oxotetrahydrofuran-2-yl)pyrrolidin-2-one (3S,5S)-3-Isopropyl-5-((2S,4S)-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) 3.51 5.76 -15.62 1 4 0 55 253.342 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (3S,5S)-tert-Butyl 3-isopropyl-5-((2S,4S)-4-isopropyl-5-oxotetrahydrofuran-2-yl)-2-oxopyrrolidine-1-carboxylate (3S,5S)-tert-Butyl 3-isopropyl-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) 4.79 10.37 -9.81 0 6 0 73 353.459 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (3S,5S)-tert-Butyl3-isopropyl-5-((2S,4S)-4-isopropyl-5-oxotetrahydrofuran-2-yl)-2-oxopyrrolidine-1-carboxylate (3S,5S)-tert-Butyl3-isopropyl-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) 4.79 10.47 -9.57 0 6 0 73 353.459 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (3S,5S)-tert-Butyl3-isopropyl-5-((2S,4S)-4-isopropyl-5-oxotetrahydrofuran-2-yl)-2-oxopyrrolidine-1-carboxylate (3S,5S)-tert-Butyl3-isopropyl-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) 4.79 10.42 -9.78 0 6 0 73 353.459 5 ↓

    Analogs

    15848234
    15848234
    15848236
    15848236
    4166201
    4166201
    4166226
    4166226

    Draw Identity 99% 90% 80% 70%

    Popular Name: Cyproterone Cyproterone

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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) 3.74 8.47 -12.57 1 3 0 54 374.908 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (4-chlorophenyl)-[4-[(1S)-1-methylpropyl]phenyl]methanone (4-chlorophenyl)-[4-[(1S)-1-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) 5.93 10.82 -5.38 0 1 0 17 272.775 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (4-chlorophenyl)-[4-[(1R)-1-methylpropyl]phenyl]methanone (4-chlorophenyl)-[4-[(1R)-1-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) 5.93 10.82 -5.4 0 1 0 17 272.775 4 ↓

    Analogs

    40630296
    40630296
    1584005
    1584005
    4240474
    4240474

    Draw Identity 99% 90% 80% 70%

    Popular Name: benzyl benzyl

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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) 2.94 8.09 -6.45 0 3 0 30 233.311 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 6-methyl-N-(3-pyridyl)pyridine-2-carboxamide 6-methyl-N-(3-pyridyl)pyridine-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) 0.64 3.66 -9.28 1 4 0 55 213.24 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N,2,5-trimethylfuran-3-carboxamide N,2,5-trimethylfuran-3-carboxamide

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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) 0.52 2.37 -9.61 1 3 0 42 153.181 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    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) 1.34 4.12 -6.16 0 3 0 30 157.213 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[5-(trifluoromethyl)-2-pyridyl]acetamide N-[5-(trifluoromethyl)-2-pyridyl…

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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) 1.16 4.03 -12.66 1 3 0 42 204.151 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: Methyl 1H-pyrazolo[4,3-b]pyridine-5-carboxylate Methyl 1H-pyrazolo[4,3-b]pyridin…

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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) 0.63 1.98 -8.35 1 5 0 68 177.163 2 ↓
    Mid Mid (pH 6-8) 0.63 2 -11.17 1 5 0 68 177.163 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (Z)-3-Ethoxy-6-(3,4,5-trimethoxystyryl)benzene-1,2-diol (Z)-3-Ethoxy-6-(3,4,5-trimethoxy…

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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) 3.60 4.16 -11.02 2 6 0 77 346.379 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: Methanone, [2-(dimethylamino)-7-hydroxy-6-methoxy-3-benzofuranyl](3,4,5-trimethoxyphenyl)- Methanone, [2-(dimethylamino)-7-…

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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) 3.05 4.75 -13.71 1 8 0 91 401.415 7 ↓
    Hi High (pH 8-9.5) 3.05 5.67 -56.6 0 8 -1 93 400.407 7 ↓

    Analogs

    8582176
    8582176
    8582177
    8582177
    8602468
    8602468
    8602469
    8602469
    3954086
    3954086

    Draw Identity 99% 90% 80% 70%

    Popular Name: Lithocholic acid methyl ester Lithocholic acid methyl ester

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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 1.39 -6.75 1 3 0 46 390.608 5 ↓

    Analogs

    3814431
    3814431
    3849834
    3849834

    Draw Identity 99% 90% 80% 70%

    Popular Name: Dihydrocholesterol Dihydrocholesterol

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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) 7.80 12.64 -1.37 1 1 0 20 388.68 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2R)-1-(2-methoxyethoxy)butan-2-ol (2R)-1-(2-methoxyethoxy)butan-2-ol

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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) 0.33 0.03 -6.1 1 3 0 39 148.202 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2S)-1-(2-methoxyethoxy)butan-2-ol (2S)-1-(2-methoxyethoxy)butan-2-ol

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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) 0.33 0.03 -6.06 1 3 0 39 148.202 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: benzoic acid, 4-(hexyloxy)-, 4-[(1-methylethoxy)carbonyl]phenyl ester benzoic acid, 4-(hexyloxy)-, 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) 7.22 4.69 -8.91 0 5 0 61 384.472 12 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: tert-butyl tert-butyl

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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) 1.72 1.47 -12.73 1 6 0 76 228.248 3 ↓

    Analogs

    245149
    245149

    Draw Identity 99% 90% 80% 70%


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    Popular Name:

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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) 3.87 6.8 -7.38 0 3 0 37 281.421 3 ↓

    Analogs

    13938444
    13938444

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-tert-Butyl-N-cyclopropyl-benzenesulfonamide 4-tert-Butyl-N-cyclopropyl-benze…

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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) 3.08 4.66 -7.98 1 3 0 46 253.367 4 ↓

    Analogs

    38881631
    38881631

    Draw Identity 99% 90% 80% 70%

    Popular Name: Thiophene, 2-(1-butynyl)- (9CI) Thiophene, 2-(1-butynyl)- (9CI)

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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) 2.92 6.51 -4.61 0 0 0 0 136.219 0 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(2,2-dimethylpropyl)-2-methyl-propanamide N-(2,2-dimethylpropyl)-2-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) 2.24 4.2 -6.42 1 2 0 29 157.257 3 ↓

    Analogs

    44117219
    44117219

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-Bromo-2-isopropylthiazole 5-Bromo-2-isopropylthiazole

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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) 2.57 4.43 -2.83 0 1 0 13 206.108 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-ethynyl-1,5-dimethyl-pyrazole 4-ethynyl-1,5-dimethyl-pyrazole

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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) 0.30 3.98 -7.38 0 2 0 18 120.155 0 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2-phenyl-4,5-dihydrooxazol-4-yl)methanol (2-phenyl-4,5-dihydrooxazol-4-yl…

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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) 1.03 -1.31 -8.13 1 3 0 42 177.203 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-Chlorophenyl)-1-phenylethanol 1-(4-Chlorophenyl)-1-phenylethanol

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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) 3.36 6.82 -4.32 1 1 0 20 232.71 2 ↓

    Analogs

    3188459
    3188459
    4255585
    4255585
    4422835
    4422835
    4552051
    4552051
    5210670
    5210670

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-Methoxyphenyl)-1-phenylethanol 1-(4-Methoxyphenyl)-1-phenylethanol

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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 0.08 -5.48 1 2 0 29 228.291 3 ↓

    Analogs

    3188459
    3188459
    4255585
    4255585
    4422835
    4422835
    4552051
    4552051
    5210670
    5210670

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-Methoxyphenyl)-1-phenylethanol 1-(4-Methoxyphenyl)-1-phenylethanol

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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 0.09 -5.68 1 2 0 29 228.291 3 ↓

    Analogs

    53146734
    53146734
    53146736
    53146736

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(3-Chlorophenyl)-2-butanol 2-(3-Chlorophenyl)-2-butanol

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    Vendors

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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) 3.24 4.39 -3.24 1 1 0 20 184.666 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (E,2R)-2,4-diphenylbut-3-en-2-ol (E,2R)-2,4-diphenylbut-3-en-2-ol

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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 0.44 -4.02 1 1 0 20 224.303 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S)-1-phenyl-1-(3-thienyl)ethanol (1S)-1-phenyl-1-(3-thienyl)ethanol

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    Vendors

    Activity (Go SEA)

    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) 2.27 5.26 -4.38 1 1 0 20 204.294 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1R)-1-phenyl-1-(3-thienyl)ethanol (1R)-1-phenyl-1-(3-thienyl)ethanol

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    Vendors

    Activity (Go SEA)

    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) 2.27 5.25 -4.34 1 1 0 20 204.294 2 ↓

    Analogs

    5048940
    5048940

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-naphthyl)-1-phenyl-ethanol 1-(2-naphthyl)-1-phenyl-ethanol

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    Vendors

    Activity (Go SEA)

    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 0.2 -5.8 1 1 0 20 248.325 2 ↓

    Analogs

    5048940
    5048940
    34218768
    34218768
    34218769
    34218769

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-naphthyl)-1-phenyl-ethanol 1-(2-naphthyl)-1-phenyl-ethanol

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    Vendors

    Activity (Go SEA)

    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 0.2 -5.82 1 1 0 20 248.325 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (9S)-9-phenyl-5,6,7,8-tetrahydrobenzo[7]annulen-9-ol (9S)-9-phenyl-5,6,7,8-tetrahydro…

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    Vendors

    Activity (Go SEA)

    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) 3.59 7.82 -3.67 1 1 0 20 238.33 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (9R)-9-phenyl-5,6,7,8-tetrahydrobenzo[7]annulen-9-ol (9R)-9-phenyl-5,6,7,8-tetrahydro…

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    Vendors

    Activity (Go SEA)

    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) 3.59 7.82 -3.68 1 1 0 20 238.33 1 ↓

    Analogs

    36171570
    36171570
    36171572
    36171572
    36171574
    36171574
    36171575
    36171575
    36173026
    36173026

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1R)-1-cyclohexyl-1-phenyl-ethanol (1R)-1-cyclohexyl-1-phenyl-ethanol

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    Vendors

    Activity (Go SEA)

    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) 4.00 6.38 -2.04 1 1 0 20 204.313 2 ↓

    Analogs

    1710992
    1710992
    36164956
    36164956
    36164959
    36164959
    36171570
    36171570

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S)-1-cyclohexyl-1-phenyl-ethanol (1S)-1-cyclohexyl-1-phenyl-ethanol

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    Vendors

    Activity (Go SEA)

    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) 4.00 6.38 -2.05 1 1 0 20 204.313 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(4-Chlorophenyl)-2-butanol 2-(4-Chlorophenyl)-2-butanol

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    Vendors

    And 5 More

    Activity (Go SEA)

    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 4.4 -2.56 1 1 0 20 184.666 2 ↓

    Analogs

    19414764
    19414764
    21818268
    21818268
    21818270
    21818270
    34530801
    34530801

    Draw Identity 99% 90% 80% 70%

    Popular Name: tert-butyl tert-butyl

    Find On: PubMed — Wikipedia — Google

    Vendors

    Activity (Go SEA)

    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) 3.79 -0.21 -7.04 1 5 0 58 270.373 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(2-Naphthyl)-2-butanol 2-(2-Naphthyl)-2-butanol

    Find On: PubMed — Wikipedia — Google

    Vendors

    Activity (Go SEA)

    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) 3.77 6.23 -5.7 1 1 0 20 200.281 2 ↓

    Parameters Provided:

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    Structural Results Found: (before additional filtering)

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