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

    Analogs

    1676284
    1676284

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-Phenyl-1,3,5-triazine-2,4-diamine N-Phenyl-1,3,5-triazine-2,4-diamine

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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) 1.42 7.85 -6.72 3 5 0 77 187.206 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: Broxyquinoline Broxyquinoline

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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) 3.48 3.28 -5.93 1 2 0 33 302.953 0 ↓
    Mid Mid (pH 6-8) 3.48 4.05 -40.83 0 2 -1 36 301.945 0 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-(3-Chlorophenyl)-2-furoyl chloride 5-(3-Chlorophenyl)-2-furoyl chlo…

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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) 4.22 2.04 -9.45 0 2 0 30 241.073 2 ↓

    Analogs

    341006
    341006

    Draw Identity 99% 90% 80% 70%

    Popular Name: F0014-0931 F0014-0931

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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 5.31 -13.78 1 3 0 46 256.692 1 ↓
    Hi High (pH 8-9.5) 3.97 3.38 -54.26 0 3 -1 49 255.684 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Bromoethyl phenyl ether 2-Bromoethyl phenyl ether

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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) 2.73 0.31 -4.49 0 1 0 9 201.063 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-(1H-Benzoimidazol-2-yl)-4-chloro-phenylamine 3-(1H-Benzoimidazol-2-yl)-4-chlo…

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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) 3.23 -2.28 -10.59 3 3 0 54 243.697 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-5-(5,6-dimethyl-1,3-benzoxazol-2-yl)aniline 2-chloro-5-(5,6-dimethyl-1,3-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) 4.54 -2.09 -7.29 2 3 0 52 272.735 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-(4-Fluoro-phenyl)-2H-benzotriazol-5-ylamine 2-(4-Fluoro-phenyl)-2H-benzotria…

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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) 1.85 4.41 -9.33 2 4 0 57 228.23 1 ↓

    Analogs

    345222
    345222
    17073980
    17073980

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(4-Aminophenyl)-3-methylbenzamide N-(4-Aminophenyl)-3-methylbenzamide

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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) 2.33 -1.29 -10.17 3 3 0 55 226.279 2 ↓

    Analogs

    6687830
    6687830

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5-Benzooxazol-2-yl-2-chloro-phenylamine 5-Benzooxazol-2-yl-2-chloro-phen…

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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 -2.63 -7.64 2 3 0 52 244.681 1 ↓

    Analogs

    5167659
    5167659

    Draw Identity 99% 90% 80% 70%

    Popular Name: Acetone oxime Acetone oxime

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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) 0.68 -0.09 -4.81 1 2 0 33 73.095 0 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: [4-(5-amino-1,3-benzoxazol-2-yl)phenyl]-diethyl-amine [4-(5-amino-1,3-benzoxazol-2-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) 3.55 -2.12 -9.8 2 4 0 55 281.359 4 ↓

    Analogs

    34978149
    34978149

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-(3-Aminophenyl)butanamide N-(3-Aminophenyl)butanamide

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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) 1.61 2.85 -8.72 3 3 0 55 178.235 3 ↓

    Analogs

    34335296
    34335296
    34448156
    34448156
    34561951
    34561951
    34958468
    34958468
    39050131
    39050131

    Draw Identity 99% 90% 80% 70%

    Popular Name: Ethyl 2-pyridylacetate Ethyl 2-pyridylacetate

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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) 1.18 5.2 -9.63 0 3 0 39 165.192 4 ↓
    Lo Low (pH 4.5-6) 1.18 5.48 -30.78 1 3 1 40 166.2 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(2-Pyridylazo)-2-naphthol 1-(2-Pyridylazo)-2-naphthol

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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) 4.12 5.49 -10.81 1 4 0 58 249.273 2 ↓
    Ref Reference (pH 7) 4.12 5.93 -14.2 1 4 0 58 249.273 2 ↓
    Lo Low (pH 4.5-6) 2.94 8.17 -31.75 2 4 1 56 250.281 2 ↓

    Analogs

    5161759
    5161759
    5162156
    5162156
    5162919
    5162919
    5935126
    5935126
    6118850
    6118850

    Draw Identity 99% 90% 80% 70%

    Popular Name: Proflavine hemisulfate Proflavine hemisulfate

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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 3.23 -23.24 5 3 1 66 210.26 0 ↓
    Hi High (pH 8-9.5) 1.27 2.85 -13.27 4 3 0 65 209.252 0 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Methyl-N-(tri(pyrrolidin-1-yl)phosphoranylidene)propan-2-amine 2-Methyl-N-(tri(pyrrolidin-1-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) 2.14 -1.03 -5.2 0 4 0 22 312.442 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: Alpha-oxo-2-furanacetamide Alpha-oxo-2-furanacetamide

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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) -0.55 0.19 -8.41 2 4 0 73 139.11 2 ↓

    Analogs

    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) 2.82 5.56 -21.02 0 8 0 76 413.426 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: Noscapine Noscapine

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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) 2.82 5.92 -13.73 0 8 0 76 413.426 4 ↓

    Analogs

    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) 1.27 16.5 -27.99 1 4 1 34 313.384 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: New methylene Blue N, pure New methylene Blue N, pure

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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) 2.06 -2.43 -19.62 2 3 1 36 312.462 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1,8-Naphthalenesultam 1,8-Naphthalenesultam

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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 -4.84 -12.36 1 3 0 46 205.238 0 ↓
    Hi High (pH 8-9.5) 2.05 -4.28 -44.59 0 3 -1 48 204.23 0 ↓

    Analogs

    38804439
    38804439

    Draw Identity 99% 90% 80% 70%

    Popular Name: Guanine Guanine

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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) -0.93 1.36 -17.89 4 6 0 100 151.129 0 ↓

    Analogs

    12401964
    12401964

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2,3-Di(4-pyridyl)-2,3-butanediol 2,3-Di(4-pyridyl)-2,3-butanediol

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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) 0.53 1.12 -7.17 2 4 0 66 244.294 3 ↓
    Lo Low (pH 4.5-6) 0.53 1.4 -38.43 3 4 1 67 245.302 3 ↓
    Lo Low (pH 4.5-6) 0.53 1.67 -96.9 4 4 2 69 246.31 3 ↓

    Analogs

    57591
    57591

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2,3-Di(4-pyridyl)-2,3-butanediol 2,3-Di(4-pyridyl)-2,3-butanediol

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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) 0.53 1.59 -8.9 2 4 0 66 244.294 3 ↓
    Lo Low (pH 4.5-6) 0.53 1.69 -42.68 3 4 1 67 245.302 3 ↓
    Lo Low (pH 4.5-6) 0.53 2.13 -82.67 4 4 2 69 246.31 3 ↓

    Analogs

    12401964
    12401964

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2,3-Di(4-pyridyl)-2,3-butanediol 2,3-Di(4-pyridyl)-2,3-butanediol

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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) 0.53 1.35 -7.94 2 4 0 66 244.294 3 ↓
    Lo Low (pH 4.5-6) 0.53 1.91 -96.52 4 4 2 69 246.31 3 ↓
    Lo Low (pH 4.5-6) 0.53 1.63 -37.86 3 4 1 67 245.302 3 ↓

    Analogs

    39051665
    39051665
    39051667
    39051667
    39367466
    39367466
    8580873
    8580873

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1,2-Di(pyridin-4-yl)ethene 1,2-Di(pyridin-4-yl)ethene

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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) 1.92 5.78 -7.17 0 2 0 26 182.226 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (S)-1,1-Diphenylpropane-1,2-diol (S)-1,1-Diphenylpropane-1,2-diol

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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) 2.04 -1.98 -4.68 2 2 0 40 228.291 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 5,5-Dimethylbarbituric acid 5,5-Dimethylbarbituric 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) 0.07 -1.66 -5.8 2 5 0 75 156.141 0 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3,4-DIHYDRO-2H-PYRIDO[1,2-A]PYRIMIDIN-2-ONE 3,4-DIHYDRO-2H-PYRIDO[1,2-A]PYRI…

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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) 0.49 2.98 -23.05 0 3 0 34 148.165 0 ↓

    Analogs

    39048689
    39048689

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-[(E)-phenyldiazenyl]benzene-1,3-diamine 4-[(E)-phenyldiazenyl]benzene-1,…

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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 2.74 -8.75 4 4 0 77 212.256 2 ↓

    Analogs

    32191269
    32191269

    Draw Identity 99% 90% 80% 70%

    Popular Name: Methyl 3,4-dimethoxybenzoate Methyl 3,4-dimethoxybenzoate

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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) 1.76 4.37 -8.44 0 4 0 45 196.202 4 ↓

    Analogs

    32164866
    32164866
    39124766
    39124766

    Draw Identity 99% 90% 80% 70%

    Popular Name: N,N-Diethylbenzamide N,N-Diethylbenzamide

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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) 1.66 6.22 -9.02 0 2 0 20 177.247 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: Methyl 2-chlorobenzoate Methyl 2-chlorobenzoate

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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) 2.40 2.16 -7.29 0 2 0 26 170.595 2 ↓

    Analogs

    39249058
    39249058

    Draw Identity 99% 90% 80% 70%

    Popular Name: Methyl phenylacetate Methyl phenylacetate

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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 5.93 -6.42 0 2 0 26 150.177 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: Methyl cinnamate Methyl cinnamate

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    And 36 More

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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) 2.53 2.66 -5.66 0 2 0 26 162.188 3 ↓

    Analogs

    32164869
    32164869
    41698122
    41698122

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-Benzoylpiperidine 1-Benzoylpiperidine

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    And 25 More

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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) 1.81 6.45 -8.3 0 2 0 20 189.258 1 ↓

    Analogs

    1555237
    1555237

    Draw Identity 99% 90% 80% 70%

    Popular Name: N,N-Dimethylbenzamide N,N-Dimethylbenzamide

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    And 19 More

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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) 0.90 4.33 -9.28 0 2 0 20 149.193 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4'-Chloroacetanilide 4'-Chloroacetanilide

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    And 37 More

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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) 1.83 3.91 -8.37 1 2 0 29 169.611 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1,3-Diphenylurea 1,3-Diphenylurea

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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) 3.14 5.69 -9.89 2 3 0 41 212.252 2 ↓
    Ref Reference (pH 7) 2.77 3.39 -5.14 2 3 0 45 212.252 3 ↓
    Lo Low (pH 4.5-6) 2.77 4.42 -28.21 3 3 1 46 213.26 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-tert-Butylbenzamide N-tert-Butylbenzamide

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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) 2.32 4.92 -7.65 1 2 0 29 177.247 2 ↓

    Analogs

    6095777
    6095777

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-ethylbenzamide N-ethylbenzamide

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    And 12 More

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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) 1.51 3.61 -8.4 1 2 0 29 149.193 2 ↓

    Analogs

    41695851
    41695851

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-Methylbenzamide N-Methylbenzamide

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    And 33 More

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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) 1.13 2.77 -8.92 1 2 0 29 135.166 1 ↓
    Mid Mid (pH 6-8) 1.20 -1.13 -6.71 1 2 0 33 135.166 1 ↓
    Mid Mid (pH 6-8) 1.20 -0.14 -6.26 1 2 0 33 135.166 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1,1-Dimethyl-3-phenylurea 1,1-Dimethyl-3-phenylurea

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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) 1.30 4.2 -9.63 1 3 0 32 164.208 1 ↓

    Analogs

    32164850
    32164850
    32164851
    32164851
    39125863
    39125863
    39126461
    39126461

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-sec-BUTYLBENZAMIDE N-sec-BUTYLBENZAMIDE

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    And 10 More

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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) 2.34 5.36 -9.83 1 2 0 29 177.247 3 ↓

    Analogs

    32164850
    32164850
    32164851
    32164851
    39125863
    39125863
    39126461
    39126461

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-sec-BUTYLBENZAMIDE N-sec-BUTYLBENZAMIDE

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    And 11 More

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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) 2.34 5.36 -9.83 1 2 0 29 177.247 3 ↓

    Analogs

    32188802
    32188802
    39126039
    39126039

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-phenethylacetamide N-phenethylacetamide

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    And 41 More

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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) 1.26 4.28 -9.23 1 2 0 29 163.22 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Chloro-N,N-diethylacetamide 2-Chloro-N,N-diethylacetamide

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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) 1.02 4.21 -8.51 0 2 0 20 149.621 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Chloroacetamide 2-Chloroacetamide

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    And 33 More

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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) -0.35 -1.19 -9.27 2 2 0 43 93.513 1 ↓

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