path: root/cv/data/csv/LOAEL_electronic_cpsa.csv

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InChI%3D1S%2FCCl3F%2Fc2-1%283%2C4%295,0.796730577945709,293.371795654297,293.371795654297,0.203269436955452,74.8477935791016,0.796730577945709,-0.332220315933228,0.405199259519577,31.2099933624268,-218.524017333984,-0.0778252482414246,2.46300005912781,0.0847591906785965,0.203269436955452,153.540023803711,8.85700035095215,20.6753559112549,59.8667755126953,1.0
InChI%3D1S%2FC10H11F3N2O%2Fc1-15%282%299%2816%2914-8-5-3-4-7%286-8%2910%2811%2C12%2913%2Fh3-6H%2C1-2H3%2C%28H%2C14%2C16%29,0.903902053833008,513.521606445312,322.298645019531,0.432689070701599,245.817779541016,0.567310929298401,-0.835287809371948,0.227770626544952,15.528265953064,-76.4808807373047,-0.0561800748109818,18.9342765808105,0.0273328926414251,0.0960979238152504,836.473815917969,29.607723236084,4.8909330368042,47.4450874328613,0.283025085926056
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InChI%3D1S%2FC4H10NO3PS%2Fc1-4%286%295-9%287%2C8-2%2910-3%2Fh1-3H3%2C%28H%2C5%2C6%2C7%29,0.67803019285202,267.919860839844,152.897399902344,0.613059520721436,242.2470703125,0.386940509080887,-0.436105966567993,0.309021323919296,14.4819898605347,89.3496704101562,-0.0836481973528862,22.6060695648193,0.0366498604416847,0.321969836950302,445.352355957031,23.7439308166504,12.9544486999512,47.5351104736328,0.317948848009109
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InChI%3D1S%2FC12H11NO2%2Fc1-13-12%2814%2915-11-8-4-6-9-5-2-3-7-10%289%2911%2Fh2-8H%2C1H3%2C%28H%2C13%2C14%29,0.840642154216766,397.837921142578,188.23176574707,0.602261245250702,285.023010253906,0.397738754749298,-0.488426804542542,0.264996498823166,19.7376098632812,96.791259765625,-0.0468717068433762,15.2612771987915,0.041706096380949,0.159357875585556,581.161193847656,31.1587238311768,5.55444431304932,41.9198684692383,0.230691328644753
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InChI%3D1S%2FC12H8Cl2O3S%2Fc13-9-1-5-11%286-2-9%2917-18%2815%2C16%2912-7-3-10%2814%294-8-12%2Fh1-8H,0.925126731395721,483.468536376953,310.664306640625,0.405537635087967,211.93278503418,0.594462335109711,-0.684412360191345,0.198216676712036,18.8882255554199,-98.7315139770508,-0.0755934342741966,17.9776554107666,0.036142997443676,0.0748732835054398,601.672912597656,36.1203422546387,3.58456587791443,58.3931350708008,0.262347221374512
InChI%3D1S%2F3C6H5.Sn.H%2Fc3%2A1-2-4-6-5-3-1%3B%3B%2Fh3%2A1-5H%3B%3B,,,,,,,,,,,,47.8105545043945,,,,55.3830337524414,,,
InChI%3D1S%2FC18H26O2%2Fc1-13%282%2918-10-9-17%284%2C20-18%2916%2811-18%2919-12-15-8-6-5-7-14%2815%293%2Fh5-8%2C13%2C16H%2C9-12H2%2C1-4H3,0.982546031475067,594.77783203125,141.958129882812,0.765491604804993,463.385375976562,0.234508380293846,-0.301959037780762,0.287156075239182,17.0328903198242,321.42724609375,-0.0179542526602745,32.2553825378418,0.0281375609338284,0.0174539890140295,779.455932617188,50.6206169128418,0.63787454366684,27.9013805389404,0.0722443535923958
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InChI%3D1S%2FC14H14Cl2N2O%2Fc1-2-7-19-14%289-18-6-5-17-10-18%2912-4-3-11%2815%298-13%2812%2916%2Fh2-6%2C8%2C10%2C14H%2C1%2C7%2C9H2,0.96470957994461,610.295104980469,241.704193115234,0.61793178319931,390.916320800781,0.38206821680069,-0.567108988761902,0.247503951191902,22.760404586792,149.212142944336,-0.0461816005408764,25.0737266540527,0.0359779745340347,0.0352904051542282,939.007080078125,44.0042724609375,0.422917902469635,51.9758338928223,0.0831072181463242
InChI%3D1S%2FC2H3Cl%2Fc1-2-3%2Fh2H%2C1H2,1.0,221.852035522461,103.556579589844,0.533217787742615,118.295463562012,0.466782182455063,-0.103130906820297,0.631549954414368,6.73031711578369,14.7388801574707,-0.0584742985665798,3.69962096214294,0.0303369630128145,0.0,49.0160140991211,7.70037889480591,49.3531455993652,19.7029590606689,0.369666755199432
InChI%3D1S%2FC10H7NO2%2Fc12-11%2813%2910-7-3-5-8-4-1-2-6-9%288%2910%2Fh1-7H,1.0,393.236083984375,196.689804077148,0.49981752038002,196.546279907227,0.500182509422302,-0.321116864681244,0.197343394160271,12.2998514175415,-0.143515154719353,-0.0435255095362663,8.90844917297363,0.0312785431742668,0.0,252.457336425781,24.9715518951416,8.40769290924072,29.4156513214111,0.208939373493195
InChI%3D1S%2FC9H8N4OS%2Fc14-9%2812-8-6-10-13-15-8%2911-7-4-2-1-3-5-7%2Fh1-6H%2C%28H2%2C11%2C12%2C14%29,0.856924831867218,462.081848144531,243.506774902344,0.548419833183289,295.725860595703,0.451580166816711,-0.591141402721405,0.256106972694397,24.2516670227051,52.2191047668457,-0.053338386118412,15.4188632965088,0.0449744053184986,0.143075168132782,705.882934570312,29.94313621521,5.7109169960022,53.0134658813477,0.168443113565445
InChI%3D1S%2FC6Cl6%2Fc7-1-2%288%294%2810%296%2812%295%2811%293%281%299,1.0,384.243408203125,342.542510986328,0.108527325093746,41.7009124755859,0.891472697257996,-0.671814262866974,0.16666667163372,5.23763799667358,-300.841583251953,-0.111969038844109,2.51999998092651,0.013631041161716,0.0,289.566040039062,23.6399993896484,9.4163999557495,48.2610054016113,0.16666667163372
InChI%3D1S%2FC15H12F4N4O7S%2Fc1-28-11%2824%297-4-2-3-5-8%287%2931%2826%2C27%2923-15%2825%2922-14-20-9%2829-12%2816%2917%296-10%2821-14%2930-13%2818%2919%2Fh2-6%2C12-13H%2C1H3%2C%28H2%2C20%2C21%2C22%2C23%2C25%29,0.76817911863327,594.946960449219,380.437103271484,0.508790075778961,394.052734375,0.491209924221039,-1.70475780963898,0.0964939370751381,34.6277923583984,13.6156377792358,-0.0932304337620735,35.7324829101562,0.0447104535996914,0.231820896267891,2687.888671875,49.543514251709,2.15446162223816,106.83381652832,0.101156875491142
InChI%3D1S%2FC23H19ClF3NO3%2Fc1-22%282%2917%2812-19%2824%2923%2825%2C26%2927%2920%2822%2921%2829%2931-18%2813-28%2914-7-6-10-16%2811-14%2930-15-8-4-3-5-9-15%2Fh3-12%2C17-18%2C20H%2C1-2H3,0.898025870323181,908.056884765625,625.250915527344,0.381656020879745,385.919128417969,0.618344008922577,-1.44942772388458,0.13219778239727,21.0825004577637,-239.331787109375,-0.0662812739610672,30.2499332427979,0.0208496078848839,0.101974122226238,2370.23071289062,60.5060653686523,1.89371597766876,88.1041412353516,0.184516087174416
InChI%3D1S%2FC6H4Cl2%2Fc7-5-1-2-6%288%294-3-5%2Fh1-4H,1.0,349.296936035156,198.861999511719,0.430679231882095,150.434936523438,0.569320738315582,-0.228830844163895,0.324440598487854,10.0197248458862,-48.4270629882812,-0.0585607998073101,5.21282815933228,0.0286854058504105,0.0,140.395217895508,17.5871715545654,23.0162525177002,30.47483253479,0.180951297283173
InChI%3D1S%2FC9H7Cl3O3%2Fc1-4%289%2813%2914%2915-8-3-6%2811%295%2810%292-7%288%2912%2Fh2-4H%2C1H3%2C%28H%2C13%2C14%29,0.779567837715149,330.932586669922,294.946258544922,0.305204093456268,129.561508178711,0.694795906543732,-0.935127437114716,0.245290100574493,8.11983585357666,-165.384750366211,-0.11612094193697,11.786449432373,0.0191276501864195,0.220432192087173,571.346008300781,29.4535503387451,2.13060283660889,57.4140777587891,0.214238375425339
InChI%3D1S%2FC19H17ClN2O4%2Fc1-3-24-19%2823%2912%282%2925-14-5-7-15%288-6-14%2926-18-11-21-17-10-13%2820%294-9-16%2817%2922-18%2Fh4-12H%2C3H2%2C1-2H3,0.901066362857819,839.766784667969,362.471771240234,0.61106926202774,569.498229980469,0.38893073797226,-0.801632881164551,0.161188200116158,30.7021808624268,207.026458740234,-0.0440603718161583,28.3505191802979,0.0329433158040047,0.0989336669445038,1920.90197753906,52.3634796142578,1.18433797359467,71.7651290893555,0.141150578856468
InChI%3D1S%2FC6H13N%2Fc7-6-4-2-1-3-5-6%2Fh6H%2C1-5%2C7H2,0.937207460403442,281.77783203125,26.2379932403564,0.912731111049652,274.418823242188,0.0872689038515091,-0.0488527603447437,0.58500200510025,12.0631713867188,248.180847167969,-0.0216973312199116,13.5516910552979,0.0401227250695229,0.0627925470471382,168.306411743164,20.3283081054688,11.0442581176758,18.5866222381592,0.211803749203682
InChI%3D1S%2FC7H10N2O4S%2Fc1-5-4-6%288%292-3-7%285%299-13-14%2810%2C11%2912%2Fh2-4%2C9H%2C8H2%2C1H3%2C%28H%2C10%2C11%2C12%29,0.863152742385864,360.686492919922,198.073745727539,0.525993049144745,219.797241210938,0.474006921052933,-0.660217344760895,0.217134490609169,19.0714721679688,21.7234992980957,-0.0777140781283379,18.0040702819824,0.0456396192312241,0.136847257614136,582.028747558594,27.2959308624268,4.43822622299194,51.5459289550781,0.2974873483181
InChI%3D1S%2FC10H10O4%2Fc1-13-9%2811%297-3-5-8%286-4-7%2910%2812%2914-2%2Fh3-6H%2C1-2H3,0.744955122470856,320.637054443359,147.198059082031,0.658006012439728,283.213165283203,0.341994017362595,-0.459157854318619,0.234716936945915,18.4404277801514,136.015106201172,-0.0680842325091362,16.6800708770752,0.0428437404334545,0.255044847726822,577.865966796875,27.4759292602539,3.0013279914856,47.7446441650391,0.218195930123329
InChI%3D1S%2FC15H10ClF3N2O6S%2Fc1-28%2825%2C26%2920-14%2822%2910-7-9%283-4-12%2810%2921%2823%2924%2927-13-5-2-8%286-11%2813%2916%2915%2817%2C18%2919%2Fh2-7H%2C1H3%2C%28H%2C20%2C22%29,0.789590358734131,530.670104980469,443.836303710938,0.339610666036606,228.246490478516,0.660389304161072,-1.48606765270233,0.152720645070076,20.7228946685791,-215.589828491211,-0.102770045399666,25.929069519043,0.0308338422328234,0.210409641265869,1512.38146972656,46.8309288024902,3.95787262916565,89.7928695678711,0.185181498527527
InChI%3D1S%2FC25H28O3%2Fc1-4-27-22-15-13-21%2814-16-22%2925%282%2C3%2919-26-18-20-9-8-12-24%2817-20%2928-23-10-6-5-7-11-23%2Fh5-17H%2C4%2C18-19H2%2C1-3H3,0.98262906074524,742.659484863281,203.927719116211,0.730178773403168,551.860534667969,0.269821256399155,-0.493290096521378,0.20518159866333,26.3477382659912,347.932800292969,-0.0186668019741774,36.357795715332,0.0348612703382969,0.0173709467053413,1381.74011230469,65.0762023925781,1.01674103736877,40.4558868408203,0.0453237965703011
InChI%3D1S%2FC6H4Cl2N2O2%2Fc7-4-1-3%2810%2811%2912%292-5%288%296%284%299%2Fh1-2H%2C9H2,0.952718257904053,351.922515869141,262.373992919922,0.28970593214035,107.01383972168,0.71029406785965,-0.582059502601624,0.365066587924957,10.3590173721313,-155.360137939453,-0.0908656269311905,5.80882787704468,0.0280437432229519,0.0472817197442055,302.699523925781,21.3911724090576,6.37599468231201,43.9236717224121,0.15909019112587
InChI%3D1S%2FC16H18N4O7S%2Fc1-25-12-8-13%2826-2%2918-15%2817-12%2919-16%2822%2920-28%2823%2C24%299-10-6-4-5-7-11%2810%2914%2821%2927-3%2Fh4-8H%2C9H2%2C1-3H3%2C%28H2%2C17%2C18%2C19%2C20%2C22%29,0.774414718151093,686.812744140625,256.397247314453,0.710899651050568,630.482482910156,0.289100348949432,-0.849115788936615,0.113970197737217,45.1377258300781,374.085235595703,-0.0605643913149834,37.4797248840332,0.0508949756622314,0.225585252046585,2604.85180664062,53.0762748718262,1.2820680141449,98.851058959961,0.0998442396521568
InChI%3D1S%2FCClN%2Fc2-1-3,0.386041909456253,84.5800552368164,147.078109741211,0.328703254461288,72.0174102783203,0.671296715736389,-0.178441554307938,0.887264966964722,19.1433963775635,-75.0606994628906,-0.0788456276059151,1.08000004291534,0.0873746573925018,0.613958120346069,58.239143371582,5.03999996185303,55.452335357666,36.4181175231934,1.0
InChI%3D1S%2FC15H12F2N3Si%2Fc16-12-1-5-14%286-2-12%2921%2811-20-10-18-9-19-20%2915-7-3-13%2817%294-8-15%2Fh1-10H%2C11H2,,,,,,,,,,,,30.7776908874512,,,,44.8623085021973,,,
InChI%3D1S%2FC8H8%2Fc1-2-8-6-4-3-5-7-8%2Fh2-7H%2C1H2,1.0,358.068542480469,148.594879150391,0.58500999212265,209.473678588867,0.414990037679672,-0.198680281639099,0.20497927069664,12.3647565841675,60.8787956237793,-0.0293761715292931,8.74565601348877,0.0345318131148815,0.0,171.428604125977,19.4143447875977,9.71460723876953,22.8834400177002,0.130218967795372
InChI%3D1S%2FC16H22ClNO3%2Fc1-4-12-8-7-9-13%285-2%2916%2812%2918%2814%2819%2910-17%2911-15%2820%2921-6-3%2Fh7-9H%2C4-6%2C10-11H2%2C1-3H3,0.926448166370392,563.105712890625,172.065628051758,0.716909468173981,435.745727539062,0.283090502023697,-0.475385576486588,0.187507718801498,18.1746425628662,263.680114746094,-0.0408325530588627,30.2825546264648,0.0299017820507288,0.0735518634319305,1020.67980957031,48.5154457092285,1.94376254081726,42.9931335449219,0.164692342281342
InChI%3D1S%2FC12H15N3O2S%2Fc1-3-6-18-8-4-5-9-10%287-8%2914-11%2813-9%2915-12%2816%2917-2%2Fh4-5%2C7H%2C3%2C6H2%2C1-2H3%2C%28H2%2C13%2C14%2C15%2C16%29,0.866998732089996,643.457336425781,325.735656738281,0.56110155582428,416.430725097656,0.438898414373398,-0.747915983200073,0.191090866923332,26.4130744934082,90.695083618164,-0.0427446067333221,25.4205188751221,0.0355891548097134,0.133001238107681,1264.70739746094,40.2594795227051,2.90605521202087,58.1366844177246,0.164804816246033
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