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    • Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-(4-phenylpiperazino)ethan-1-one 2-chloro-1-(4-phenylpiperazino)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) 1.86 5.25 -9.93 0 3 0 24 238.718 2 ↓

    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) 1.08 7.48 -16.08 0 5 0 50 262.309 4 ↓

    Analogs

    37833788
    37833788

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-Acetyl-piperazin-1-yl)-2-chloro-ethanone 1-(4-Acetyl-piperazin-1-yl)-2-ch…

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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) -0.48 3.19 -16.91 0 4 0 41 204.657 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) -1.26 4.29 -18.7 0 6 0 67 228.248 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(2-methoxyphenyl)piperidino]ethanone 2-chloro-1-[4-(2-methoxyphenyl)p…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 2.27 0.73 -10.13 0 3 0 29 267.756 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(4-pyridylmethyl)piperazin-1-yl]ethanone 2-chloro-1-[4-(4-pyridylmethyl)p…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 0.27 3.75 -12.1 0 4 0 36 253.733 3 ↓
    Mid Mid (pH 6-8) 0.27 5.98 -55.9 1 4 1 38 254.741 3 ↓

    Analogs

    37832720
    37832720

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(chloroacetyl)-4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazine 1-(chloroacetyl)-4-(2-oxo-2-pyrr…

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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) -0.09 3.61 -16.13 0 5 0 44 273.764 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1'-(2-chloroacetyl)spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one 1'-(2-chloroacetyl)spiro[1,3-dih…

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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) 1.21 3.74 -14.64 2 5 0 61 293.754 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-Chloroacetyl-piperazine-1-carboxylic acid tert-butyl ester 4-Chloroacetyl-piperazine-1-carb…

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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) 1.20 0.25 -12.64 0 5 0 49 262.737 3 ↓

    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) 0.41 6.15 -17.07 0 7 0 76 286.328 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: MFCD08899270 MFCD08899270

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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 7.75 -10.22 0 2 0 20 237.73 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: MFCD08899270 MFCD08899270

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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 7.74 -10.19 0 2 0 20 237.73 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Chloro-1-[4-(4-methoxy-phenyl)-piperazin-1-yl]-ethanone 2-Chloro-1-[4-(4-methoxy-phenyl)…

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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 -1.79 -11.2 0 4 0 32 268.744 3 ↓

    Analogs

    3384233
    3384233

    Draw Identity 99% 90% 80% 70%

    Popular Name: methyl 3-[4-(4-methoxyphenyl)piperazino]-3-oxopropanoate methyl 3-[4-(4-methoxyphenyl)pip…

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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 -0.07 -17.04 0 6 0 59 292.335 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(chloroacetyl)-4-(3-chlorophenyl)piperazine 1-(chloroacetyl)-4-(3-chlorophen…

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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) 2.51 -1.93 -10.73 0 3 0 23 273.163 2 ↓

    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) 1.73 7.99 -17.22 0 5 0 50 296.754 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-Benzhydryl-piperazin-1-yl)-2-chloro-ethanone 1-(4-Benzhydryl-piperazin-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) 3.34 9.62 -9.48 0 3 0 24 328.843 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-piperazinepropanoic acid, 4-(diphenylmethyl)-b-oxo-, methyl ester 1-piperazinepropanoic acid, 4-(d…

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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) 2.56 10.7 -15.4 0 5 0 50 352.434 6 ↓
    Lo Low (pH 4.5-6) 2.56 12.44 -52.75 1 5 1 51 353.442 6 ↓

    Analogs

    5128374
    5128374

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(2-ethoxyphenyl)piperazin-1-yl]-ethanone 2-chloro-1-[4-(2-ethoxyphenyl)pi…

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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 -1.47 -10.26 0 4 0 32 282.771 4 ↓

    Analogs

    6342903
    6342903
    41673157
    41673157

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-[4-(Chloroacetyl)piperazin-1-yl]pyrimidine 2-[4-(Chloroacetyl)piperazin-1-y…

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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) 0.57 4.89 -12.95 0 5 0 49 240.694 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) 1.76 6.89 -16.77 0 4 0 41 280.755 3 ↓

    Analogs

    34615146
    34615146

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Chloro-1-[4-(furan-2-carbonyl)-piperazin-1-yl]-ethanone 2-Chloro-1-[4-(furan-2-carbonyl)…

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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) 0.45 0.02 -15.47 0 5 0 53 256.689 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(o-tolyl)piperazin-1-yl]-ethanone 2-chloro-1-[4-(o-tolyl)piperazin…

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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) 2.26 6.66 -9.1 0 3 0 24 252.745 2 ↓

    Analogs

    3266423
    3266423

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Chloro-1-(2-methyl-piperidin-1-yl)-ethanone 2-Chloro-1-(2-methyl-piperidin-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) 1.51 4.94 -7.51 0 2 0 20 175.659 1 ↓

    Analogs

    4487622
    4487622

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Chloro-1-(2-methyl-piperidin-1-yl)-ethanone 2-Chloro-1-(2-methyl-piperidin-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) 1.51 4.94 -7.52 0 2 0 20 175.659 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(3,4-dichlorophenyl)piperazin-1-yl]ethanone 2-chloro-1-[4-(3,4-dichloropheny…

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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 7.37 -12.06 0 3 0 24 307.608 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: methyl 3-[4-(3,4-dichlorophenyl)piperazino]-3-oxopropanoate methyl 3-[4-(3,4-dichlorophenyl)…

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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) 2.36 8.45 -18.15 0 5 0 50 331.199 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 4-[4-(chloroacetyl)piperazin-1-yl]phenol hydrochloride 4-[4-(chloroacetyl)piperazin-1-y…

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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) 1.38 -3.78 -11.62 1 4 0 43 254.717 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]-2-chloro-ethanone 1-[4-(1,3-benzodioxol-5-yl)piper…

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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) 1.75 3.98 -12.74 0 5 0 42 282.727 2 ↓

    Analogs

    5936671
    5936671

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Chloro-1-[4-(2-fluoro-phenyl)-piperazin-1-yl]-ethanone 2-Chloro-1-[4-(2-fluoro-phenyl)-…

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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) 1.97 -0.85 -10.35 0 3 0 23 256.708 2 ↓

    Analogs

    34940064
    34940064
    34940065
    34940065

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(chloroacetyl)-4-(2-chlorophenyl)piperazine 1-(chloroacetyl)-4-(2-chlorophen…

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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 -1.41 -9.41 0 3 0 23 273.163 2 ↓

    Analogs

    37831469
    37831469
    37831470
    37831470

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-(4-cyclopentylpiperazin-1-yl)ethanone 2-chloro-1-(4-cyclopentylpiperaz…

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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) 1.56 4.39 -8.3 0 3 0 24 230.739 2 ↓
    Mid Mid (pH 6-8) 1.56 6.61 -47.13 1 3 1 25 231.747 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(chloroacetyl)-4-(1-phenylethyl)piperazine hydrochloride 1-(chloroacetyl)-4-(1-phenylethy…

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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) 2.12 6.47 -9.64 0 3 0 24 266.772 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(chloroacetyl)-4-(1-phenylethyl)piperazine hydrochloride 1-(chloroacetyl)-4-(1-phenylethy…

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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) 2.12 6.35 -8.36 0 3 0 24 266.772 3 ↓

    Analogs

    332841
    332841
    1672539
    1672539

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(prop-2-yn-1-yl)piperazin-1-yl]ethan-1-one hydrochloride 2-chloro-1-[4-(prop-2-yn-1-yl)pi…

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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) 0.32 3.11 -10.47 0 3 0 24 200.669 2 ↓
    Lo Low (pH 4.5-6) 0.32 5.36 -47.97 1 3 1 25 201.677 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(Chloroacetyl)-4-(4-chlorophenyl)piperazine 1-(Chloroacetyl)-4-(4-chlorophen…

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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) 2.54 -1.94 -10.25 0 3 0 23 273.163 2 ↓

    Analogs

    7277864
    7277864

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(2,4-dimethylphenyl)piperazin-1-yl]-ethanone 2-chloro-1-[4-(2,4-dimethylpheny…

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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) 2.68 -0.32 -9.1 0 3 0 23 266.772 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-Benzyl-piperidin-1-yl)-2-chloro-ethanone 1-(4-Benzyl-piperidin-1-yl)-2-ch…

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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) 2.85 0.68 -9.01 0 2 0 20 251.757 3 ↓

    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) 2.06 9.6 -16.08 0 4 0 47 275.348 5 ↓

    Analogs

    4219104
    4219104
    32229202
    32229202
    32229204
    32229204
    37829659
    37829659
    37829660
    37829660

    Draw Identity 99% 90% 80% 70%

    Popular Name: ethyl 1-(chloroacetyl)piperidine-2-carboxylate ethyl 1-(chloroacetyl)piperidine…

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    And 7 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) 1.40 6.84 -15.16 0 4 0 47 233.695 4 ↓

    Analogs

    37829659
    37829659
    37829660
    37829660
    41697649
    41697649
    41697653
    41697653
    41697655
    41697655

    Draw Identity 99% 90% 80% 70%

    Popular Name: ethyl 1-(chloroacetyl)piperidine-2-carboxylate ethyl 1-(chloroacetyl)piperidine…

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    And 7 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) 1.40 6.84 -15.16 0 4 0 47 233.695 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(2,3-dichlorophenyl)piperazin-1-yl]ethanone 2-chloro-1-[4-(2,3-dichloropheny…

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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) 3.12 8.05 -11.08 0 3 0 24 307.608 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(4-Benzyl-piperazin-1-yl)-2-chloro-ethanone 1-(4-Benzyl-piperazin-1-yl)-2-ch…

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    And 26 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) 1.56 5.4 -8.66 0 3 0 24 252.745 3 ↓

    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) 0.78 6.6 -15.91 0 5 0 50 276.336 5 ↓
    Mid Mid (pH 6-8) 0.78 8.81 -55.96 1 5 1 51 277.344 5 ↓

    Analogs

    37833788
    37833788
    42462917
    42462917

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(chloroacetyl)-4-methylpiperazine 1-(chloroacetyl)-4-methylpiperazine

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    And 51 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) 0.16 1.85 -8.87 0 3 0 24 176.647 1 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: methyl methyl

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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) 0.83 7.87 -20.37 0 6 0 74 287.319 4 ↓

    Analogs

    37831892
    37831892

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-Chloro-1-(4-methoxy-piperidin-1-yl)-ethanone 2-Chloro-1-(4-methoxy-piperidin-…

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    And 2 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) -0.09 3.34 -10.08 0 3 0 30 191.658 2 ↓

    Analogs

    37832914
    37832914
    37832915
    37832915
    37832929
    37832929

    Draw Identity 99% 90% 80% 70%

    Popular Name: 2-chloro-1-[4-(pyrazin-2-yl)piperazin-1-yl]ethan-1-one 2-chloro-1-[4-(pyrazin-2-yl)pipe…

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    And 4 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) 0.28 4.03 -13.41 0 5 0 49 240.694 2 ↓

    Analogs

    5393518
    5393518

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(chloroacetyl)-4-(2-methoxyphenyl)piperazine 1-(chloroacetyl)-4-(2-methoxyphe…

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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) 1.87 -1.49 -10.48 0 4 0 32 268.744 3 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: methyl methyl

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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) 1.08 7.28 -16.59 0 6 0 59 292.335 5 ↓

    Parameters Provided:

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catalog.name = mccbb-v
filter.purchasability = purchasable

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