molecule,#stars,#amine,#amidine,#acid,#amide,#rotor,#rtvFG,CNS,mol_MW,dipole,SASA,FOSA,FISA,PISA,WPSA,volume,donorHB,accptHB,dip^2/V,ACxDN^.5/SA,glob,QPpolrz,QPlogPC16,QPlogPoct,QPlogPw,QPlogPo/w,QPlogS,CIQPlogS,QPlogHERG,QPPCaco,QPlogBB,QPPMDCK,QPlogKp,IP(eV),EA(eV),#metab,QPlogKhsa,HumanOralAbsorption,PercentHumanOralAbsorption,SAfluorine,SAamideO,PSA,#NandO,RuleOfFive,#ringatoms,#in34,#in56,#noncon,#nonHatm,RuleOfThree,Jm
"1b",1,0,0,0,0,7,1,-2,450.499,4.745,789.622,336.471,281.492,171.659,0,1400.299,4,11,0.0160797,0.0278614,0.7665836,47.031,15.539,27.971,19.851,1.363,-5.46,-4.907,-6.128,21.208,-3.052,7.682,-5.431,8.326,1.168,4,-0.087,2,45.708,0,0,166.021,11,1,22,0,22,5,33,1,0
"1c",1,0,0,0,0,7,1,-2,436.472,6.169,778.686,280.039,296.253,202.395,0,1359.258,5,11,0.0279939,0.0315875,0.7620856,45.682,15.719,29.205,21.599,0.894,-5.224,-4.587,-6.347,15.365,-3.259,5.423,-5.594,8.329,1.247,5,-0.23,2,40.46,0,0,175.288,11,1,22,0,22,5,32,1,0
"1d",1,0,0,0,0,10,1,-2,480.525,9.441,801.89,319.164,328.54,154.186,0,1464.057,5,12.07.,0.0608845,0.0354139,0.7775993,47.489,16.507,31.299,22.559,0.64,-4.667,-4.802,-5.866,7.592,-3.662,2.531,-6.071,8.497,1.168,5,-0.342,2,33.49,0,0,187.54,12,1,22,0,22,5,35,1,0
"1e",1,0,0,0,0,7,1,-2,437.46,7.879,772.828,280.2,307.188,185.44,0,1346.525,5,12,0.0461052,0.0347203,0.7630599,45.01,15.547,29.787,22.529,0.368,-4.902,-4.267,-6.25,12.101,-3.376,4.189,-5.856,8.553,1.33,6,-0.398,2,35.52,0,0,185.679,12,1,22,0,22,5,32,1,0
"1f",2,0,0,1,0,7,0,-2,422.446,6.241,725.646,181.094,344.617,199.935,0,1269.334,6,11,0.0306867,0.0371316,0.7813114,42.059,15.308,29.733,23.248,0.432,-4.371,-4.265,-4.217,1.354,-3.622,0.499,-6.494,8.295,1.263,5,-0.596,1,5.91,0,0,187.754,11,2,22,0,22,5,31,1,0
"1g",3,0,0,0,1,7,0,-2,421.461,5.668,731.798,180.158,351.38,200.261,0,1281.82,7,11.05.,0.0250597,0.0415772,0.7798154,42.562,15.711,31.587,27.952,-1.021,-3.068,-3.372,-4.675,2.372,-3.711,1.476,-6.618,8.211,1.211,6,-0.846,1,1.765,0,36.264,191.45,11,2,22,0,22,5,31,1,0
"1h",0,0,0,0,0,8,1,-2,436.472,5.58,765.666,295.005,275.678,194.984,0,1353.915,5,11,0.0230011,0.0321246,0.7730123,44.755,15.41,28.718,21.157,1.017,-4.868,-4.592,-6.135,24.079,-2.994,8.812,-5.145,8.297,1.257,5,-0.264,2,44.67,0,0,170.031,11,1,21,0,21,4,32,0,0
"2a",1,0,0,0,0,8,1,-2,464.526,4.469,813.94,367.866,285.124,160.95,0,1450.705,4,11,0.0137674,0.027029,0.7614216,48.303,16.003,28.341,19.641,1.617,-5.675,-5.168,-6.16,19.591,-3.197,7.051,-5.439,8.559,1.104,4,-0.02,2,46.58,0,0,166.034,11,1,22,0,22,5,34,1,0
"2b",1,0,0,0,0,9,1,-2,474.521,3.421,830.126,339.337,285.199,205.589,0,1475.386,04.05.,11,0.0079309,0.0281096,0.7550198,49.075,16.715,29.27,20.496,1.728,-5.726,-5.322,-6.476,19.559,-3.314,7.039,-5.187,8.61,1.127,5,-0.036,2,47.216,0,0,166.001,11,1,22,0,22,5,35,2,0
"2c",3,0,0,0,0,9,1,-2,526.597,8.691,879.217,303.786,270.798,304.632,0,1622.374,4,11,0.0465589,0.0250223,0.759457,55.904,18.534,31.626,20.457,2.915,-6.548,-6.709,-6.877,26.787,-3.109,9.888,-4.573,8.318,1.003,5,0.349,1,43.656,0,0,160.638,11,2,28,0,28,5,39,1,0
"2d",1,0,0,0,0,7,1,-2,454.506,8.928,774.977,274.919,309.229,158.929,31.899,1365.237,4,11,0.0583787,0.028388,0.7679774,45.506,15.526,28.29,19.929,1.072,-5.374,-4.981,-6.044,11.574,-3.276,5.97,-5.987,8.597,1.164,4,-0.166,2,39.299,0,0,175.274,11,1,22,0,22,5,32,1,0
"2e",2,0,0,0,0,11,1,-2,494.552,6.25,854.242,353.439,341.081,159.723,0,1531.422,5,12.07.,0.0255086,0.0332436,0.7521663,49.596,17.454,31.475,22.587,0.903,-5.28,-5.058,-6.304,5.773,-4.119,1.882,-6.187,8.584,1.116,5,-0.283,2,32.901,0,0,189.181,12,1,22,0,22,5,36,1,0
"3a",1,0,0,0,1,8,1,-2,450.499,9.84,812.976,310.628,291.152,211.197,0,1420.998,5,11,0.068141,0.0302552,0.7518816,47.594,16.411,30.344,23.252,0.658,-4.787,-4.201,-5.18,11.089,-3.352,6.116,-5.373,7.934,1.116,7,-0.472,2,36.541,0,23.869,175.688,11,1,22,0,22,5,33,2,0
"3b",1,0,0,0,0,7,1,-2,436.472,2.312,774.224,277.51,297.022,199.692,0,1355.74,5,11,0.0039434,0.0317695,0.7651548,45.515,15.653,28.831,21.575,0.871,-5.157,-4.587,-6.284,15.109,-3.241,5.325,-5.618,8.247,1.208,6,-0.232,2,40.192,0,0,174.464,11,1,22,0,22,5,32,1,0
"3c",0,0,0,0,0,5,0,-2,317.352,3.365,575.859,28.747,204.255,342.857,0,989.904,5,6,0.0114354,0.0232981,0.83415,33.526,12.354,22.071,16.957,1.353,-3.495,-4.235,-5.851,114.538,-1.695,47.554,-3.596,8.282,1.053,4,-0.239,3,71.719,0,0,111.427,7,0,20,0,20,0,24,0,0.026
"3d",0,0,0,0,0,5,0,-2,295.303,3.335,555.387,38.56,252.323,264.505,0,928.178,5,07.05.,0.0119811,0.0301961,0.8285591,30.307,11.509,21.841,18.179,0.101,-3.011,-3.188,-5.568,40.098,-2.188,15.293,-4.758,8.673,1.145,2,-0.52,2,56.232,0,0,135.754,8,0,16,0,16,0,22,0,0.005
"3e",0,0,0,0,0,5,0,-2,363.301,7.565,583.435,39.639,229.095,213.34,101.361,1014.465,5,07.05.,0.0564082,0.0287444,0.836882,33.272,11.206,23.84,17.776,1.088,-3.839,-4.371,-5.189,66.588,-1.67,95.025,-4.51,8.741,1.286,3,-0.333,3,65.948,101.361,0,135.097,8,0,16,0,16,0,26,0,0.002
"4a",1,0,0,0,0,8,1,-2,464.526,1.584,821.854,375.35,279.787,166.716,0,1467.465,4,11,0.001709,0.0267688,0.7598871,49.029,16.176,28.409,19.663,1.759,-5.799,-5.168,-6.212,22.013,-3.149,7.998,-5.321,8.266,1.129,4,0.018,2,48.315,0,0,165.483,11,1,22,0,22,5,34,2,0
"4b",1,0,0,0,0,9,1,-2,478.553,1.581,855.371,408.886,279.759,166.726,0,1528.6,4,11,0.0016349,0.0257198,0.7502505,50.834,16.834,28.972,19.523,2.111,-6.166,-5.432,-6.368,22.026,-3.292,8.003,-5.224,8.266,1.129,4,0.107,2,50.383,0,0,165.474,11,1,22,0,22,5,35,2,0
"4c",0,0,0,0,0,6,0,-2,392.463,1.643,693.913,292.733,234.569,166.61,0,1238.856,4,9,0.0021788,0.0259399,0.80391,41.164,13.49,24.566,17.518,1.517,-4.664,-4.529,-5.499,59.086,-2.218,23.252,-4.68,8.259,1.142,3,-0.062,3,67.535,0,0,130.989,9,0,22,0,22,5,29,0,0
"4d",0,0,0,0,0,7,0,-2,371.401,5.842,675.041,31.064,253.697,390.28,0,1161.072,5,8,0.0293956,0.0264999,0.7914212,39.545,14.699,25.637,19.383,1.351,-4.322,-4.72,-6.768,38.913,-2.559,14.805,-4.148,8.346,1.244,4,-0.223,3,63.316,0,0,138.473,8,0,22,0,22,0,28,0,0.001
"4e",0,0,0,0,0,9,0,-2,414.469,9.231,770.859,100.68,257.3,412.879,0,1329.703,6,08.05.,0.0640883,0.0270097,0.7586239,45.225,16.887,29.701,21.308,1.932,-5.199,-5.247,-7.407,35.968,-2.96,13.598,-3.943,8.328,1.251,5,-0.115,2,53.147,0,0,148.927,9,1,22,0,22,0,31,0,0
"4f",1,1,0,0,0,10,0,-2,444.495,3.84,817.302,203.704,253.078,360.52,0,1417.911,6,9.75,0.0103977,0.0292212,0.7468187,47.613,17.431,30.296,22.045,1.438,-4.264,-4.343,-8.074,9.837,-2.666,3.705,-6.016,8.529,1.026,6,-0.14,2,40.175,0,0,157.116,10,1,22,0,22,0,33,1,0
"4g",1,1,0,0,0,11,0,-2,474.521,6.791,854.971,283.908,256.468,314.594,0,1494.792,6,10.05.,0.0308547,0.0300825,0.739493,49.609,17.941,31.568,22.365,1.535,-4.508,-4.644,-7.974,9.135,-2.828,3.42,-6.144,8.56,1.064,7,-0.123,2,27.211,0,0,162.203,11,2,22,0,22,0,35,2,0
"4h",0,1,0,0,0,8,0,-2,373.416,3.977,692.668,72.587,206.947,413.134,0,1191.235,5,7,0.0132806,0.0225974,0.7845817,40.328,14.841,24.899,18.057,1.685,-3.407,-4.025,-7.714,26.936,-1.761,11.005,-5.173,8.492,0.988,4,-0.08,2,62.412,0,0,120.244,8,0,22,0,22,0,28,0,0.001
"4i",0,1,0,0,0,9,0,-2,403.443,4.831,729.744,165.285,206.944,357.515,0,1266.893,5,7.75,0.0184211,0.0237474,0.7759269,42.182,15.217,25.879,18.286,1.799,-3.669,-4.34,-7.589,26.937,-1.872,11.006,-5.273,8.478,0.973,5,-0.054,2,63.081,0,0,128.526,9,0,22,0,22,0,30,0,0
"4j",0,1,0,0,0,11,0,-2,463.495,5.287,803.573,321.941,206.952,274.68,0,1422.405,5,9.25,0.0196525,0.0257396,0.7611823,46.331,16.213,27.926,18.937,2.075,-4.156,-4.961,-7.432,26.933,-2.082,11.004,-5.372,8.476,0.971,7,-0.002,2,51.734,0,0,139.612,11,1,22,0,22,0,34,1,0