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    The document contains a table with 55 rows listing various molecular properties including pKa, TPSA, MolLogP, molecular weight, number of rotatable bonds, hydrogen donors, hydrogen acceptors, and ring count for different molecules. The properties listed are consistent across the 55 rows and include values for pKa, TPSA, MolLogP, molecular weight, and counts for various structural features.

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    The document contains a table with 55 rows listing various molecular properties including pKa, TPSA, MolLogP, molecular weight, number of rotatable bonds, hydrogen donors, hydrogen acceptors, and ring count for different molecules. The properties listed are consistent across the 55 rows and include values for pKa, TPSA, MolLogP, molecular weight, and counts for various structural features.

    Copyright:

    © All Rights Reserved
    Download as TXT, PDF, TXT or read online from Scribd
    Flag for inappropriate content
    6 views1 page

    Features

    Uploaded by

    prajwalra31
    The document contains a table with 55 rows listing various molecular properties including pKa, TPSA, MolLogP, molecular weight, number of rotatable bonds, hydrogen donors, hydrogen acceptors, and ring count for different molecules. The properties listed are consistent across the 55 rows and include values for pKa, TPSA, MolLogP, molecular weight, and counts for various structural features.

    Copyright:

    © All Rights Reserved
    Download as TXT, PDF, TXT or read online from Scribd
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    of 1

    ,Hammett-

    Taft_pKa,TPSA,MolLogP,MolWt,NumRotatableBonds,NumHDonors,NumHAcceptors,RingCount
    0,9.04,21.700000000000003,13.456999999999978,642.1100000000002,33,0,3,1
    1,8.93,21.700000000000003,13.314499999999978,642.1100000000002,32,0,3,1
    2,8.37,21.700000000000003,13.066899999999979,628.0830000000003,32,0,3,1
    3,9.04,21.700000000000003,13.456999999999978,642.1100000000002,33,0,3,1
    4,9.04,21.700000000000003,13.456999999999978,642.1100000000002,33,0,3,1
    5,8.58,21.700000000000003,13.597899999999974,654.121,31,0,3,2
    6,8.58,21.700000000000003,13.597899999999974,654.121,31,0,3,2
    7,8.98,21.700000000000003,13.987999999999973,668.1479999999999,31,0,3,2
    8,8.98,21.700000000000003,13.987999999999975,668.1480000000003,31,0,3,2
    9,9.17,21.700000000000003,13.847099999999974,656.1370000000002,33,0,3,1
    10,7.91,21.700000000000003,12.81929999999998,626.0670000000003,30,0,3,2
    11,8.14,21.700000000000003,13.20939999999998,640.0940000000003,30,0,3,2
    12,8.58,21.700000000000003,13.599499999999976,654.1210000000002,30,0,3,2
    13,7.71,29.54,12.86699999999998,614.056,33,0,3,0
    14,8.79,29.54,13.257099999999978,628.0830000000002,34,0,3,0
    15,9.17,29.54,13.647199999999975,642.1100000000001,35,0,3,0
    16,9.46,29.54,14.037299999999972,656.1370000000001,36,0,3,0
    17,9.61,29.54,14.42739999999997,670.164,37,0,3,0
    18,9.46,21.700000000000003,14.237199999999971,670.164,34,0,3,1
    19,9.39,21.700000000000003,13.845499999999973,668.1479999999999,32,0,3,2
    20,9.39,21.700000000000003,13.845499999999973,668.1479999999999,32,0,3,2
    21,8.76,21.700000000000003,13.601099999999976,654.1210000000001,30,0,3,2
    22,7.64,34.59,14.032299999999971,705.1689999999998,34,0,4,2
    23,8.67,55.84,11.877599999999987,658.0650000000002,34,0,5,0
    24,9.49,21.700000000000003,14.235599999999973,682.1750000000002,32,0,3,2
    25,9.49,21.700000000000003,14.235599999999973,682.1750000000002,32,0,3,2
    26,9.23,21.700000000000003,12.717699999999981,628.0830000000001,32,0,3,1
    27,8.85,21.700000000000003,13.06529999999998,628.0830000000001,31,0,3,1
    28,9.17,21.700000000000003,13.597899999999974,654.1210000000001,29,0,3,2
    29,9.17,29.54,14.42739999999997,670.164,37,0,3,0
    30,9.17,29.54,15.204399999999964,698.2179999999997,37,0,3,0
    31,9.31,32.34,13.220199999999979,641.1260000000002,35,1,2,0
    32,9.39,21.700000000000003,13.704599999999974,656.1370000000001,33,0,3,1
    33,9.62,21.700000000000003,14.484799999999971,684.191,35,0,3,1
    34,8.9,41.57,13.049999999999978,643.0980000000001,34,1,3,0
    35,8.48,41.57,13.049999999999981,643.0980000000003,34,1,3,0
    36,10.3,38.33,14.085199999999974,656.1370000000001,37,1,3,0
    37,10.05,38.33,14.083599999999974,656.1370000000001,36,1,3,0
    38,8.88,6.48,13.503199999999977,627.1430000000001,35,0,2,0
    39,9.12,32.34,13.077699999999979,641.1260000000001,35,1,2,0
    40,10.05,38.33,13.304999999999978,628.0830000000002,35,1,3,0
    41,9.58,21.700000000000003,12.824399999999981,630.0989999999999,36,0,3,0
    42,8.2,21.700000000000003,12.81929999999998,626.0670000000001,28,0,3,2
    43,9.12,41.57,13.440099999999978,657.1250000000002,35,1,3,0
    44,8.48,41.57,13.297599999999978,657.125,35,1,3,0
    45,8.38,40.160000000000004,12.806799999999983,700.1460000000004,33,0,5,2
    46,9.17,29.54,14.037299999999972,656.1370000000001,36,0,3,0
    47,9.73,52.32,13.04429999999998,614.0560000000002,34,1,3,0
    48,9.12,41.57,13.440099999999976,657.125,35,1,3,0
    49,8.5,30.930000000000003,12.834299999999981,670.1199999999999,32,0,4,2
    50,8.98,21.700000000000003,13.987999999999973,668.1479999999999,31,0,3,2
    51,9.79,3.24,13.571399999999974,570.0470000000001,32,0,1,0
    52,8.63,21.700000000000003,12.186699999999984,602.0450000000001,34,0,3,0
    53,9.14,21.700000000000003,13.843899999999973,680.1589999999998,31,0,3,3
    54,9.36,21.700000000000003,12.57679999999998,616.0720000000001,35,0,3,0
    55,9.33,21.700000000000003,13.065299999999977,628.0830000000001,32,0,3,1

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