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

    155265
    155265
    507383
    507383
    507384
    507384
    26441573
    26441573
    26441575
    26441575

    Draw Identity 99% 90% 80% 70%

    Popular Name: bicyclo[2.2.1]heptan-2-one, 3-bromo-1,7,7-trimethyl- bicyclo[2.2.1]heptan-2-one, 3-br…

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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) 2.61 6.11 -4.93 0 1 0 17 231.133 0 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-7,7-dimethyl-1-[[4-(2-methylbenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-8-yl]sulfonylmethyl]nor (1S,4R)-7,7-dimethyl-1-[[4-(2-me…

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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 10.87 -18.99 0 6 0 75 490.691 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1R,4S)-7,7-dimethyl-1-[[4-(2-methylbenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-8-yl]sulfonylmethyl]nor (1R,4S)-7,7-dimethyl-1-[[4-(2-me…

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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 10.87 -18.94 0 6 0 75 490.691 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-7,7-dimethyl-1-[[4-(3-methylbenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-8-yl]sulfonylmethyl]nor (1S,4R)-7,7-dimethyl-1-[[4-(3-me…

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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) 2.87 10.88 -18.34 0 6 0 75 490.691 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1R,4S)-7,7-dimethyl-1-[[4-(3-methylbenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-8-yl]sulfonylmethyl]nor (1R,4S)-7,7-dimethyl-1-[[4-(3-me…

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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) 2.87 10.85 -19.78 0 6 0 75 490.691 4 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1R,4S)-1-[[4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]sulfonylmethyl]-7,7-d (1R,4S)-1-[[4-[3-[(4-fluoropheny…

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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 10.92 -19.91 0 7 0 83 492.642 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-1-[[4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]sulfonylmethyl]-7,7-d (1S,4R)-1-[[4-[3-[(4-fluoropheny…

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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 10.92 -19.68 0 7 0 83 492.642 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-1-[[(2R)-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]sulfon (1S,4R)-1-[[(2R)-4-[3-[(4-fluoro…

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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) 3.69 11.69 -16.72 0 7 0 83 506.669 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-1-[[(2S)-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazin-1-yl]sulfon (1S,4R)-1-[[(2S)-4-[3-[(4-fluoro…

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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) 3.69 11.54 -16.6 0 7 0 83 506.669 6 ↓

    Analogs

    19864896
    19864896

    Draw Identity 99% 90% 80% 70%

    Popular Name: LS-97148 LS-97148

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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) 1.05 5.92 -38.83 1 3 1 25 223.34 2 ↓
    Hi High (pH 8-9.5) 1.05 3.45 -4.65 0 3 0 24 222.332 2 ↓
    Mid Mid (pH 6-8) 1.05 5.56 -39.66 1 3 1 25 223.34 2 ↓

    Analogs

    19864893
    19864893

    Draw Identity 99% 90% 80% 70%

    Popular Name: LS-97148 LS-97148

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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) 1.05 5.91 -35.29 1 3 1 25 223.34 2 ↓
    Hi High (pH 8-9.5) 1.05 3.45 -5.96 0 3 0 24 222.332 2 ↓
    Mid Mid (pH 6-8) 1.05 5.7 -33.05 1 3 1 25 223.34 2 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(((4-(diphenylmethyl)piperazinyl)sulfonyl)methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one 1-(((4-(diphenylmethyl)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) 4.09 12.52 -14.79 0 5 0 58 466.647 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-(((4-(diphenylmethyl)piperazinyl)sulfonyl)methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one 1-(((4-(diphenylmethyl)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) 4.09 12.27 -14.73 0 5 0 58 466.647 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-1-[[7-(5-chloro-2-pyridyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]sulfonylmethyl]-7, (1S,4R)-1-[[7-(5-chloro-2-pyridy…

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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 -1.95 -18.77 0 7 0 86 505.036 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-1-[[9-methoxy-7-(6-methoxy-2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]sulfonylmethyl]-7 (1S,4R)-1-[[9-methoxy-7-(6-metho…

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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) 3.10 -2.63 -19.8 0 8 0 95 500.617 6 ↓

    Analogs

    12030423
    12030423

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-7,7-dimethyl-1-[[(3R)-3-(4-phenyl-2H-pyrazol-3-yl)-1-piperidyl]sulfonylmethyl]norbornan-2-on (1S,4R)-7,7-dimethyl-1-[[(3R)-3-…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 3.36 -3.17 -17.74 1 6 0 83 441.597 5 ↓

    Analogs

    12030419
    12030419

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-7,7-dimethyl-1-[[(3S)-3-(4-phenyl-2H-pyrazol-3-yl)-1-piperidyl]sulfonylmethyl]norbornan-2-on (1S,4R)-7,7-dimethyl-1-[[(3S)-3-…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 3.36 -3.16 -17.32 1 6 0 83 441.597 5 ↓

    Analogs

    12402059
    12402059
    39881041
    39881041
    39881042
    39881042
    39881057
    39881057
    39881058
    39881058

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-N-(2-bromo-4-fluoro-phenyl)-4,7,7-trimethyl-3-oxo-norbornane-1-carboxamide (1S,4R)-N-(2-bromo-4-fluoro-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) 3.56 8.09 -6.75 1 3 0 46 368.246 2 ↓

    Analogs

    39881041
    39881041
    39881042
    39881042
    39881057
    39881057
    39881058
    39881058
    39881075
    39881075

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1R,4S)-N-(2-bromo-4-fluoro-phenyl)-4,7,7-trimethyl-3-oxo-norbornane-1-carboxamide (1R,4S)-N-(2-bromo-4-fluoro-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) 3.56 8.09 -7.07 1 3 0 46 368.246 2 ↓

    Analogs

    20529150
    20529150
    36645727
    36645727

    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) 2.52 -3.89 -14.32 0 6 0 73 393.505 5 ↓

    Analogs

    36636379
    36636379
    5330957
    5330957

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1R,4S)-1-[[4-(3-chlorophenyl)piperazin-1-yl]sulfonylmethyl]-7,7-dimethyl-norbornan-2-one (1R,4S)-1-[[4-(3-chlorophenyl)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) 3.26 9.51 -16.16 0 5 0 58 410.967 4 ↓

    Analogs

    36636378
    36636378
    5330957
    5330957

    Draw Identity 99% 90% 80% 70%

    Popular Name: (1S,4R)-1-[[4-(3-chlorophenyl)piperazin-1-yl]sulfonylmethyl]-7,7-dimethyl-norbornan-2-one (1S,4R)-1-[[4-(3-chlorophenyl)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) 3.26 9.51 -15.8 0 5 0 58 410.967 4 ↓

    Analogs

    36638905
    36638905

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-isobutyl-methanesulfonamide 1-[(1S,4R)-7,7-dimethyl-2-oxo-no…

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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) 1.90 5.43 -14.4 1 4 0 63 287.425 5 ↓

    Analogs

    36638904
    36638904

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-isobutyl-methanesulfonamide 1-[(1R,4S)-7,7-dimethyl-2-oxo-no…

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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) 1.90 5.42 -14.2 1 4 0 63 287.425 5 ↓

    Analogs

    16739998
    16739998

    Draw Identity 99% 90% 80% 70%

    Popular Name: 7,7-dimethyl-1-[({4-[5-(trifluoromethyl)-2-pyridinyl]piperazino}sulfonyl)methyl]bicyclo[2.2.1]heptan-2-one 7,7-dimethyl-1-[({4-[5-(trifluor…

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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) 2.61 8.42 -16.24 0 6 0 71 445.507 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: ethyl ethyl

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 2.96 9.5 -21.61 2 7 0 105 446.569 9 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-methanesulfonamide 1-[(1R,4S)-7,7-dimethyl-2-oxo-no…

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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 8.64 -15.03 0 4 0 54 353.459 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-[(2-fluorophenyl)methyl]-N-methyl-methanesulfonamide 1-[(1S,4R)-7,7-dimethyl-2-oxo-no…

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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 8.63 -13.8 0 4 0 54 353.459 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[(2-chlorophenyl)methyl]-1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-methyl-methanesulfonamide N-[(2-chlorophenyl)methyl]-1-[(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) 3.05 9.42 -15.09 0 4 0 54 369.914 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[(2-chlorophenyl)methyl]-1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-methyl-methanesulfonamide N-[(2-chlorophenyl)methyl]-1-[(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) 3.05 9.42 -16.81 0 4 0 54 369.914 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-cyclopropyl-2-[[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonyl-methyl-amino]acetamide N-cyclopropyl-2-[[(1R,4S)-7,7-di…

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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) 0.99 5.35 -15.42 1 6 0 84 342.461 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-cyclopropyl-2-[[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonyl-methyl-amino]acetamide N-cyclopropyl-2-[[(1S,4R)-7,7-di…

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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) 0.99 5.34 -15.09 1 6 0 84 342.461 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[(4-dimethylaminophenyl)methyl]-1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]methanesulfonamide N-[(4-dimethylaminophenyl)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) 2.28 7.38 -16.6 1 5 0 66 364.511 6 ↓
    Lo Low (pH 4.5-6) 2.28 8.16 -60.78 2 5 0 68 365.519 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[(4-dimethylaminophenyl)methyl]-1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methanesulfonamide N-[(4-dimethylaminophenyl)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) 2.28 7.39 -16.93 1 5 0 66 364.511 6 ↓
    Lo Low (pH 4.5-6) 2.28 8.17 -60.88 2 5 0 68 365.519 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]methanesulfonamide N-[2-(1,3-benzodioxol-5-yl)ethyl…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 2.47 6.43 -20.3 1 6 0 82 379.478 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methanesulfonamide N-[2-(1,3-benzodioxol-5-yl)ethyl…

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    Physical Representations

    Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
    Ref Reference (pH 7) 2.47 6.44 -19.75 1 6 0 82 379.478 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2S)-2-[[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonylamino]-2-phenyl-acetamide (2S)-2-[[(1R,4S)-7,7-dimethyl-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) 1.09 3.81 -16.09 3 6 0 106 364.467 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2S)-2-[[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonylamino]-2-phenyl-acetamide (2S)-2-[[(1S,4R)-7,7-dimethyl-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) 1.09 3.82 -18.38 3 6 0 106 364.467 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-[(6-methoxy-3-pyridyl)methyl]methanesulfonamide 1-[(1R,4S)-7,7-dimethyl-2-oxo-no…

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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 3.68 -17.44 1 6 0 85 352.456 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-[(6-methoxy-3-pyridyl)methyl]methanesulfonamide 1-[(1S,4R)-7,7-dimethyl-2-oxo-no…

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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 3.69 -18.33 1 6 0 85 352.456 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonylamino]-N-(6-methyl-2-pyridyl)propanamide 3-[[(1S,4R)-7,7-dimethyl-2-oxo-n…

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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) 1.00 6.27 -24.08 2 7 0 105 393.509 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 3-[[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonylamino]-N-(6-methyl-2-pyridyl)propanamide 3-[[(1R,4S)-7,7-dimethyl-2-oxo-n…

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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) 1.00 6.27 -25.85 2 7 0 105 393.509 7 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2S)-N-cyclopentyl-2-[[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonylamino]propanamide (2S)-N-cyclopentyl-2-[[(1S,4R)-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) 1.61 5.31 -19.63 2 6 0 92 370.515 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: (2R)-N-cyclopentyl-2-[[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonylamino]propanamide (2R)-N-cyclopentyl-2-[[(1S,4R)-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) 1.61 5.23 -23.27 2 6 0 92 370.515 6 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-[(3-methylisoxazol-5-yl)methyl]methanesulfonamide 1-[(1S,4R)-7,7-dimethyl-2-oxo-no…

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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) 1.12 4.73 -22.19 1 6 0 89 326.418 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-[(3-methylisoxazol-5-yl)methyl]methanesulfonamide 1-[(1R,4S)-7,7-dimethyl-2-oxo-no…

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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) 1.12 4.73 -21.96 1 6 0 89 326.418 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-(2-naphthylmethyl)methanesulfonamide 1-[(1R,4S)-7,7-dimethyl-2-oxo-no…

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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 9.23 -16.97 1 4 0 63 371.502 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: 1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]-N-(2-naphthylmethyl)methanesulfonamide 1-[(1S,4R)-7,7-dimethyl-2-oxo-no…

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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 9.25 -17.43 1 4 0 63 371.502 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[[(1R)-cyclohex-3-en-1-yl]methyl]-1-[(1R,4S)-7,7-dimethyl-2-oxo-norbornan-1-yl]methanesulfonamide N-[[(1R)-cyclohex-3-en-1-yl]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) 2.58 7.24 -14.59 1 4 0 63 325.474 5 ↓

    Analogs

    Draw Identity 99% 90% 80% 70%

    Popular Name: N-[[(1R)-cyclohex-3-en-1-yl]methyl]-1-[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methanesulfonamide N-[[(1R)-cyclohex-3-en-1-yl]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) 2.58 7.24 -14.95 1 4 0 63 325.474 5 ↓

    Parameters Provided:

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