Kotli, M.; Piir, G.; Maran, U. Multi-task prediction of pesticide toxicity to pollinators with censored data and interpretable attributions on graph neural networks. Journal of Chemical Information and Modeling

702 compounds | Property honeybee_contact: Acute contact toxicity, Apis mellifera (modelled target, log molar LD50) i

ID	Name	honeybee_contact	Details
10.htm	Acequinocyl i	-0.09968064110925011	View
100.htm	Buprofezin i	-0.1496193415331535	View
1004.htm	Fenoxaprop-P i	-0.5073430475999386	View
101.htm	Butachlor i	-0.455803819876607	View
1010.htm	Benalaxyl-M i	-0.4803088308599395	View
1011.htm	Pethoxamid i	-0.13611784289647613	View
1018.htm	Bistrifluron i	-0.6430873206711717	View
1021.htm	Cinmethylin i	-0.09373678456233929	View
1025.htm	Hydroprene i	0.6267752704055264	View
1026.htm	Imibenconazole i	-0.2995399839593545	View
1027.htm	S-metolachlor i	-0.11662434514197093	View
1028.htm	Profoxydim i	-0.336229516779083	View
1029.htm	Pyrithiobac-sodium i	-1.101293301590337	View
104.htm	Butralin i	-0.4380199320463232	View
1046.htm	Dodemorph acetate i	-0.5070416386985954	View
106.htm	Cadusafos i	-2.35964227912149	View
1061.htm	Bromoxynil-heptanoate i	-0.2696174801389658	View
1062.htm	Glyphosate-trimesium i	0.39520714132126455	View
1063.htm	Ioxynil octanoate i	-0.38017504899673	View
1068.htm	Haloxyfop-P-methyl i	-0.5594517535656185	View
108.htm	Calcium carbonate i	0.757070493276674	View
1085.htm	Iminoctadine triacetate i	-0.49727528635799534	View
1087.htm	Butroxydim i	-0.26274763769818466	View
1093.htm	Quizalofop i	-0.5206669064729443	View
1096.htm	Sodium 5-nitroguaiacolate i	-0.2097294280162052	View
1097.htm	Sodium o-nitrophenolate i	-0.12733160938002155	View
1098.htm	Sodium p-nitrophenolate i	-0.08200863059336413	View
11.htm	Acetamiprid i	-1.417546616951992	View
1101.htm	Dialifos i	-4.044528231929728	View
1111.htm	Monocrotophos i	-3.2063068195795967	View
1113.htm	Dikegulac i	-0.4999584742734803	View
1114.htm	Dikegulac-sodium i	-0.4999584742734803	View
1117.htm	Halosulfuron-methyl i	-0.6229493168242638	View
1118.htm	Tembotrione i	-0.6280720349583051	View
1119.htm	Spirotetramat i	-0.5393521520395353	View
112.htm	Camphechlor i	-3.447696257315065	View
1120.htm	Fluroxypyr-meptyl i	-0.5391639529515666	View
1124.htm	MCPA-thioethyl i	-0.36479480717410984	View
1131.htm	Kinoprene i	-0.8506987358760448	View
1132.htm	Flubendiamide i	-0.5186586805830776	View
1133.htm	Pyroxsulam i	-0.624560532712514	View
1135.htm	Orthosulfamuron i	-0.6066929993140617	View
1136.htm	Chromafenozide i	-0.5614114832565925	View
1137.htm	Amisulbrom i	-0.6563090664561143	View
1138.htm	Chlorantraniliprole i	-2.069140630529497	View
1139.htm	Pyridalyl i	-0.6785092742385559	View
114.htm	Captan i	-0.16512556908822865	View
1140.htm	Ipconazole i	-0.49088510945359554	View
1143.htm	Cyflumetofen i	-0.6179967950190554	View
1144.htm	Spinetoram i	-4.45129380235189	View
1145.htm	Chlorimuron-ethyl i	-1.504835000627311	View
1146.htm	Ethametsulfuron-methyl i	-1.9289541910718684	View
1148.htm	Pyrazosulfuron-ethyl i	-0.5979911948988507	View
1149.htm	Sulfometuron-methyl i	-0.5419035956845621	View
115.htm	Carbaryl i	-3.132922612520788	View
1150.htm	Trifloxysulfuron i	-1.2286672189323613	View
1152.htm	Imazapic i	0.5880942252431823	View
1153.htm	Cloransulam-methyl i	-1.2219043357526032	View
1154.htm	Diclosulam i	-1.1999196515905677	View
1156.htm	Pyriftalid i	-0.483216312403526	View
116.htm	Carbendazim i	-0.5613876373001334	View
1160.htm	Lactofen i	-0.445847355668899	View
1161.htm	Flumiclorac-pentyl i	-0.3105307546744039	View
1162.htm	Pentoxazone i	-0.5328356644184273	View
1163.htm	Butafenacil i	-1.3585724867939084	View
1168.htm	Benzobicyclon i	-0.33022093626404964	View
117.htm	Carbetamide i	-0.3426989621395915	View
1174.htm	Fentrazamide i	-0.34197499523592656	View
1175.htm	Anilofos i	-1.7715999357338323	View
1176.htm	Piperophos i	-1.1698079768420317	View
1179.htm	Diflufenzopyr i	-0.6330507934481236	View
118.htm	Carbofuran i	-3.7578387024932836	View
1180.htm	Indanofan i	-0.5100756113539492	View
1184.htm	Isoprocarb i	-1.949682690795204	View
1185.htm	XMC i	-2.496119908630807	View
1193.htm	Aminocarb i	-3.2008098124380866	View
1195.htm	Dinotefuran i	-3.9126840474082814	View
1199.htm	Mexacarbate i	-3.631409731394807	View
12.htm	Acetochlor i	-0.09621458534640515	View
120.htm	Carbophenothion i	-2.3680742690325625	View
1201.htm	Piperalin i	-0.9337543513786412	View
1202.htm	Prodiamine i	-0.5226658888301148	View
1207.htm	Iprobenfos i	-0.8550788586493079	View
1209.htm	Thifluzamide i	-0.7176871423188254	View
121.htm	Carbosulfan i	-3.286668500198556	View
1210.htm	Penthiopyrad i	0.16843734658696408	View
1211.htm	Metominostrobin i	-0.42842638644058817	View
1212.htm	Phthalide i	0.49457867241671905	View
1215.htm	Diclomezine i	-0.392749698374226	View
1216.htm	Diflumetorim i	-1.0312412617797062	View
1217.htm	Flumorph i	-0.31265018662464755	View
122.htm	Carboxin i	-0.08906547973566428	View
1229.htm	Chlordimeform i	-0.1846204618686863	View
123.htm	Carfentrazone-ethyl i	-0.6914853397960561	View
1232.htm	Imiprothrin i	-2.869510400405736	View
1236.htm	Pyrasulfotole i	-0.6680502805617384	View
1241.htm	Thiencarbazone-methyl i	-0.27450422265588315	View
1244.htm	Saflufenacil i	-0.6846030223283709	View
1250.htm	Bixafen i	-0.5201261868879614	View
1281.htm	Fluchloralin i	-0.5525161255899232	View
1282.htm	Transfluthrin i	-2.2541249353992074	View
1288.htm	Diclobutrazol i	-3.791100899236972	View
1299.htm	Monosodium methylarsonate i	-0.7498972786493305	View
13.htm	Acibenzolar-S-methyl i	-0.3101408017961939	View
132.htm	Chlorbromuron i	-1.2483718001323876	View
1323.htm	Kasugamycin hydrochloride hydrate i	-0.947151780132966	View
1327.htm	Pelargonic acid i	0.11151131502700516	View
1330.htm	1-naphthylacetic acid i	-0.16662743073986333	View
1331.htm	2-naphthyloxyacetic acid i	0.0174574176970566	View
134.htm	Chlordane i	-2.827907499026671	View
1340.htm	2-phenylphenol i	-0.2044455814330675	View
135.htm	Chlorethoxyfos i	-3.9096897200170204	View
1354.htm	8-hydroxyquinoline i	-0.14019367857863124	View
1355.htm	Noviflumuron i	-0.7177453749069219	View
1362.htm	Fluopyram i	-0.5861708123875782	View
1367.htm	Pyroxasulfone i	-0.5765947107338312	View
138.htm	Chlorfenvinphos i	-1.92558876827042	View
1380.htm	Propisochlor i	-0.4176543408059521	View
14.htm	Acifluorfen-sodium i	-0.549738731264899	View
141.htm	Chloridazon i	-0.028530586511328743	View
1416.htm	Clodinafop i	-0.8662656682435477	View
1417.htm	N-(2-chlorothiazol-5-ylmethyl)-N’-nitroguanidine i	-1.7699451055816438	View
143.htm	Chlormequat chloride i	-0.22520618322981625	View
1444.htm	Thiacloprid-amide i	-0.41440505275888345	View
1449.htm	Isopyrazam i	-0.22560646493617914	View
1474.htm	Prallethrin i	-4.026234602073965	View
1478.htm	Ferric phosphate i	0.022413561996148853	View
148.htm	Chloropicrin i	-0.21582255515437218	View
1499.htm	Fluthiacet-methyl i	-0.5896927445846418	View
15.htm	Aclonifen i	-0.4075438579770624	View
150.htm	Chlorothalonil i	-0.4203969635489245	View
151.htm	Chlorotoluron i	0.0013688158195829599	View
152.htm	Chloroxuron i	-1.2361907457265808	View
153.htm	Chlorpropham i	-0.32168096201518576	View
1531.htm	Heptamaloxyloglucan i	-1.0036328370044083	View
154.htm	Chlorpyrifos i	-3.6983180735427403	View
1541.htm	Diquat i	-0.45773054824599835	View
1542.htm	Imazamethabenz i	-0.4085282682762359	View
1548.htm	Fosetyl i	-0.012795058145412529	View
155.htm	Chlorpyrifos-methyl i	-3.3286963503914277	View
1550.htm	Flupoxam i	-1.0479365161380791	View
1552.htm	Bensulfuron i	-0.5800806438630073	View
1553.htm	Flupyrsulfuron i	-1.2447816485650363	View
1554.htm	Iodosulfuron i	-0.5061892310744531	View
1555.htm	Metsulfuron i	-1.1513698502474603	View
1556.htm	Tribenuron i	-1.6047480987490061	View
1557.htm	Triflusulfuron i	-0.663974039928248	View
1559.htm	Propoxycarbazone i	-0.27905064819902614	View
156.htm	Chlorsulfuron i	-0.538686816604501	View
1560.htm	Fenchlorazole-ethyl i	-0.11991541025799103	View
157.htm	Chlorthal-dimethyl i	-0.5130843604651442	View
1575.htm	Methylarsonic acid i	-0.2975996076547002	View
1577.htm	Furilazole i	-0.42327864964203477	View
158.htm	Chlorthiamid i	-0.415124583520605	View
1581.htm	Pyriminobac-methyl i	-0.23325000954110026	View
159.htm	Chlozolinate i	-0.5065591467257824	View
16.htm	Acrinathrin i	-3.7919494981080613	View
162.htm	Cinidon-ethyl i	-0.27542653674163897	View
1622.htm	Primisulfuron methyl i	-0.6592123961433822	View
1624.htm	Potassium bicarbonate i	0.7876241919074212	View
1625.htm	Sucrose octanoate i	-0.732594775555279	View
164.htm	Clethodim i	-0.8157860305568564	View
1648.htm	Ametoctradin i	-0.39828730535740114	View
1649.htm	Methiozolin i	-0.5054891384167239	View
165.htm	Clodinafop propargyl i	-0.527152817088064	View
1652.htm	Bicyclopyrone i	0.31322627402445175	View
1655.htm	Penflufen i	-0.4671787779430316	View
1659.htm	Valifenalate i	-0.5701458225591007	View
1662.htm	Cyantraniliprole i	-3.6920331437861544	View
1663.htm	Indaziflam i	-0.4490307604004151	View
1665.htm	Sedaxane i	-0.4944468092813847	View
1668.htm	Aminocyclopyrachlor i	-0.31293860901313536	View
1669.htm	Sulfoxaflor i	-2.8481972438354357	View
167.htm	Clofentezine i	-0.5430830658366497	View
1671.htm	Gibberellins i	-0.4888185428338049	View
1672.htm	Isofenphos-methyl i	-2.704895604261881	View
168.htm	Clomazone i	-0.401477557004818	View
1685.htm	Cyenopyrafen i	-0.5590323710924758	View
169.htm	Clopyralid i	-0.28472385568958664	View
17.htm	Alachlor i	-1.1931245983544616	View
170.htm	Cloquintocet-mexyl i	-0.49643144518420007	View
171.htm	Clothianidin i	-3.7396981774099873	View
1719.htm	Prohexadione i	-0.3012470886362114	View
1729.htm	1-naphthylacetamide i	-0.24087360002058092	View
18.htm	Alanycarb i	-2.670176249022063	View
185.htm	Cyanazine i	-0.35717225772303357	View
186.htm	Cyazofamid i	-0.4937228689611966	View
187.htm	Cyclanilide i	-0.42327864964203477	View
1879.htm	Oxolinic acid i	-1.0971531498459597	View
1889.htm	Thymol i	0.1671718704606465	View
189.htm	Cycloxydim i	-0.47458045234237944	View
19.htm	Aldicarb i	-2.798749270285457	View
191.htm	Cyflufenamid i	-0.5968389138251573	View
192.htm	Cyfluthrin i	-5.619229026450969	View
193.htm	Cyhalofop-butyl i	-0.5279004451947662	View
195.htm	Cyhexatin i	-1.019752201140953	View
196.htm	Cymoxanil i	-0.27441188342587425	View
197.htm	Cypermethrin i	-4.237204859765335	View
198.htm	Cyproconazole i	-0.43716371044650393	View
199.htm	Cyprodinil i	-0.447509460839576	View
20.htm	Aldoxycarb i	-0.6194272748814922	View
200.htm	Cyromazine i	0.10757145305477007	View
2002.htm	Fluxapyroxad i	-0.5672734553170502	View
2010.htm	Fenpyrazamine i	-0.49173978568949706	View
2015.htm	Alpha-terpineol i	-0.9008620148111808	View
202.htm	Daminozide i	0.1305335899191334	View
203.htm	Dazomet i	-0.4834731816212223	View
204.htm	DDT i	-2.8059159995587653	View
205.htm	Deltamethrin i	-5.510571817680582	View
206.htm	Demeton-S-methyl i	-1.9178083718920969	View
207.htm	Desmedipham i	-0.4535935099205207	View
208.htm	Desmetryn i	-0.2927822763666139	View
210.htm	Diafenthiuron i	-2.3708460382359764	View
212.htm	Diazinon i	-3.3381192251135867	View
213.htm	Dicamba i	-0.3805750232338422	View
214.htm	Dichlobenil i	-1.1864426206173622	View
216.htm	Dichlofluanid i	-1.3039381530264402	View
2172.htm	Benthiavalicarb-isopropyl i	-0.5530087057273627	View
218.htm	Dichlorprop i	-1.1518867422002754	View
2183.htm	Disodium methanearsonate i	-0.8141381749040187	View
219.htm	Dichlorprop-P i	-0.05497672919221898	View
2195.htm	Kasugamycin i	-0.947151780132966	View
22.htm	Allethrin i	-1.9097290330025278	View
220.htm	Dichlorvos i	-2.6674732560377055	View
221.htm	Diclofop-methyl i	-0.5146274324113403	View
222.htm	Dicloran i	-0.05218074306831812	View
223.htm	Dicofol i	-1.2792225301030051	View
224.htm	Dicrotophos i	-3.788207664919245	View
227.htm	Dienochlor i	-1.120025233114033	View
228.htm	Diethofencarb i	-0.39119984010877445	View
23.htm	Alloxydim i	-1.2703585277523708	View
230.htm	Difenoconazole i	-0.5900835532566222	View
234.htm	Diflubenzuron i	-0.6090418313644064	View
235.htm	Diflufenican i	-0.5834368336219379	View
236.htm	Dimefox i	-1.873626486094774	View
237.htm	Dimefuron i	0.19430888234152516	View
2374.htm	Geraniol i	0.1671718704606465	View
2379.htm	Maltodextrin i	0.07556563645676934	View
239.htm	Dimethachlor i	-0.07479816187323227	View
2395.htm	Glyphosate-isopropylamine i	-0.20685285000669779	View
2396.htm	Glyphosate-monopotassium i	-0.20685285000669779	View
2398.htm	Triclopyr-butotyl i	-0.532104361451173	View
24.htm	Alpha-cypermethrin i	-4.08041875590504	View
240.htm	Dimethenamid i	-0.4379022931973949	View
241.htm	Dimethenamid-P i	-0.11000015113311228	View
242.htm	Dimethipin i	-0.3014640731432998	View
244.htm	Dimethoate i	-3.336799831348111	View
2444.htm	Piproctanyl i	-0.36208645292039515	View
2445.htm	Piproctanyl bromide i	-0.36208645292039515	View
245.htm	Dimethomorph i	-0.5544891600038189	View
2454.htm	Climbazole i	-2.4403107283825056	View
2455.htm	Hexylthiofos i	-0.3638751089410316	View
246.htm	Dimoxystrobin i	-0.4831734860925139	View
2460.htm	Pyriofenone i	-0.5386239964632282	View
247.htm	Diniconazole i	-1.1890409079090098	View
2482.htm	N-demethyl-spinetoram-J i	-4.024407472797641	View
2484.htm	N-demethyl-spinetoram-L i	-4.243964425634412	View
250.htm	Dinocap i	-1.0648666889224407	View
2517.htm	Phosphoric acid i	-0.5796464293318135	View
2531.htm	Pyrethrins (cinerin I) i	-4.345750624171134	View
2532.htm	Pyrethrins (jasmolin I) i	-4.363481802197638	View
2533.htm	Pyrethrins (pyrethrin II) i	-4.422892747959248	View
2534.htm	Pyrethrins (cinerin II) i	-3.0028987613243454	View
2535.htm	Pyrethrins (jasmolin II) i	-4.422892747959248	View
255.htm	Diphenamid i	1.0392781555731236	View
2567.htm	Diofenolan i	-0.46516589791146595	View
257.htm	Disulfoton i	-2.4247115318613925	View
258.htm	Dithianon i	-0.4658288153574365	View
2587.htm	Dipropetryn i	-0.36964251840525925	View
259.htm	Dithiopyr i	-0.8615231394122118	View
260.htm	Diuron i	-0.3410033847776425	View
2601.htm	Verbutin i	-0.46667878530879187	View
2608.htm	Flutianil i	-0.6152659988991497	View
2618.htm	Oxathiapiprolin i	-0.7137928479390603	View
262.htm	Dodemorph i	-0.5070416386985954	View
2620.htm	Flupyradifurone i	-0.14237382122314451	View
2621.htm	Benzovindiflupyr i	-0.5833234881567619	View
2623.htm	Momfluorothrin i	-3.2626883443016963	View
2628.htm	Mandestrobin i	-0.4626974081017171	View
263.htm	Dodine i	-0.13564799134280564	View
2630.htm	Halauxifen i	-0.5162542961119814	View
2631.htm	Halauxifen-methyl i	-0.5321554693977395	View
2634.htm	Brofluthrinate i	-2.7237377896995154	View
2636.htm	Afidopyropen i	-0.4427462218289052	View
264.htm	Endosulfan i	-1.710341688260044	View
266.htm	Endrin i	-2.9087413704356053	View
2666.htm	Napropamide-M i	-0.35685990302565723	View
2668.htm	Triflumezopyrim i	-2.9946667671616596	View
267.htm	Epoxiconazole i	-0.5005794923633375	View
269.htm	Esfenvalerate i	-3.7544684709873613	View
270.htm	Ethaboxam i	-0.7757603191593835	View
271.htm	Ethalfluralin i	-0.5040084564010464	View
274.htm	Ethephon i	-0.1412615906220901	View
275.htm	Ethiofencarb i	-2.135091329351824	View
276.htm	Ethion i	-1.517687635861916	View
278.htm	Ethofumesate i	-0.7294887691795613	View
2780.htm	Fluenetil i	-0.38589213471240347	View
2781.htm	Isofetamid i	-0.5241103934951361	View
279.htm	Ethoprophos i	-1.1555501338371095	View
28.htm	Amidosulfuron i	-0.5493466360057607	View
281.htm	Ethoxysulfuron i	-0.27905064819902614	View
283.htm	Etofenprox i	-3.962107528479191	View
284.htm	Etoxazole i	-0.2255935481547996	View
2857.htm	Zarilamid i	-3.056104097422453	View
286.htm	Etrimfos i	-3.439585300777564	View
287.htm	Famoxadone i	-1.1538026734511289	View
2873.htm	Sodium hydrogen carbonate i	0.9692658654925763	View
289.htm	Fenamidone i	-1.0588128659223732	View
2895.htm	Fluensulfone i	-0.23466577528279828	View
29.htm	Aminopyralid i	-1.5108789149611945	View
290.htm	Fenamiphos i	-3.0018263952525825	View
2907.htm	Diniconazole-M i	-1.1890409079090098	View
2908.htm	Furalaxyl-M i	-1.7515562247937042	View
2909.htm	5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid i	-0.24814498728777779	View
291.htm	Fenarimol i	-0.5039131939996202	View
292.htm	Fenazaquin i	-2.37086926479515	View
2920.htm	Triafamone i	-0.5946687312953245	View
293.htm	Fenbuconazole i	-1.7643527770516445	View
2933.htm	Formetanate hydrochloride i	-2.297128932411204	View
2935.htm	Thiophanate i	-0.5469372972916577	View
295.htm	Fenchlorazole i	-0.09269725716790282	View
296.htm	Fenclorim i	-1.0394537789617364	View
298.htm	Fenhexamid i	-0.13895069988323305	View
299.htm	Fenitrothion i	-3.2193552692900123	View
30.htm	Amitraz i	-0.7327474853099947	View
301.htm	Fenothiocarb i	-0.0685754384203689	View
302.htm	Fenoxaprop-ethyl i	-0.06150274174356591	View
303.htm	Fenoxaprop-P-ethyl i	-0.9775226128141723	View
3030.htm	Carfentrazone i	-0.27191127385989566	View
3031.htm	Chlorimuron i	-1.4779196222932358	View
304.htm	Fenoxycarb i	-0.14089606170382435	View
306.htm	Fenpropathrin i	-3.814553891777727	View
3067.htm	Bromoxynil-butanoate i	-0.2299608201079928	View
307.htm	Fenpropidin i	-0.7214163071254593	View
3073.htm	Fenpicoxamid i	-0.4544607185545853	View
308.htm	Fenpropimorph i	-0.4317014174634197	View
3086.htm	Pydiflumetofen i	-0.6133554779791122	View
309.htm	Fenpyroximate i	-1.3971366459135597	View
3091.htm	Broflanilide i	-4.8123584416293905	View
3097.htm	Florpyrauxifen-benzyl i	-0.6285115370662023	View
3098.htm	Mefentrifluconazole i	-0.5828130671704281	View
31.htm	Amitrole i	0.09658441423091368	View
310.htm	Fenthion i	-2.9317516686782454	View
3107.htm	Guadipyr i	-0.7562510947311804	View
3116.htm	Dichlorprop-P-etexyl i	-0.2540241265777192	View
314.htm	Fenvalerate i	-3.237838674984025	View
3140.htm	P,P'-DDT i	-1.593827087231565	View
3141.htm	O,P'-DDT i	-2.8059159995587653	View
3143.htm	Mefenpyr diethyl i	0.294771828805999	View
315.htm	Ferbam i	-0.974804668354214	View
3156.htm	Ferric pyrophosphate i	-0.2403994657386411	View
316.htm	Fipronil i	-4.865766253785313	View
3174.htm	Epsilon-momfluorothrin i	-3.2626883443016963	View
3180.htm	Isoflucypram i	-0.5782608996533166	View
3187.htm	Kaolin calcined i	-0.22577434814392977	View
319.htm	Flazasulfuron i	-0.5968718786042466	View
3198.htm	Metyltetraprole i	-0.5794405971397971	View
3204.htm	Fluopimomide i	-0.7852448167592543	View
3206.htm	Clopyralid-methyl i	-0.31148383450919437	View
3209.htm	Clopyralid-tripromine i	-0.2390353062326205	View
321.htm	Flonicamid i	-0.34853850125799346	View
3210.htm	Chlormequat i	-0.22520618322981625	View
322.htm	Florasulam i	-0.5456039684814168	View
323.htm	Fluazifop-butyl i	-0.7608052903954657	View
3237.htm	Dinocap 6 i	-1.0492577235446119	View
3238.htm	ACC i	0.10906750097437425	View
324.htm	Fluazifop-P-butyl i	-0.2591158441850662	View
3249.htm	Fluindapyr i	-0.04298218595132189	View
325.htm	Fluazinam i	-0.3627368696516848	View
3262.htm	Benzpyrimoxan i	-0.5121238267229445	View
328.htm	Flucycloxuron i	-0.6662651925380559	View
3282.htm	Trifludimoxazin i	-0.603436691950435	View
3285.htm	Bixlozone i	-0.416690423375564	View
329.htm	Flucythrinate i	-3.7396230507610118	View
3290.htm	Flupyrimin i	-0.4865863151432628	View
330.htm	Fludioxonil i	-0.3840665380759458	View
331.htm	Flufenacet i	-0.506143105855138	View
3311.htm	Glyphosate-sesquisodium i	-0.20685285000669779	View
3312.htm	Glyphosate-diammonium i	-0.20685285000669779	View
3313.htm	Glyphosate-dimethylammonium i	-0.20685285000669779	View
3314.htm	Glyphosate-monoammonium i	-0.20685285000669779	View
3317.htm	Flumiclorac i	-0.24001407325258048	View
3318.htm	Fluthiacet i	-0.5760647882253771	View
3319.htm	Thiencarbazone i	-0.2604172540725083	View
332.htm	Flufenoxuron i	-0.6791370581737235	View
3320.htm	Pyrazosulfuron i	-0.5708347064242137	View
3321.htm	Sulfometuron i	-0.5266622930104643	View
333.htm	Diflovidazin i	-1.0757366956809902	View
3338.htm	Picloram-etexyl i	-0.5244091053023572	View
3339.htm	Picloram-isoctyl i	-0.5244091053023572	View
334.htm	Flumetsulam i	-0.5000168013349142	View
3340.htm	Picloram-methyl i	-0.39870369511307885	View
3344.htm	Picloram-tripromine i	-0.230704313612569	View
335.htm	Flumioxazin i	-0.22943865122494858	View
336.htm	Fluometuron i	-0.3446280256941044	View
337.htm	Fluopicolide i	-0.574621506951349	View
339.htm	Fluoroglycofen i	-0.6134400986587901	View
340.htm	Fluoxastrobin i	-0.3450795263148667	View
341.htm	Flupyrsulfuron-methyl-sodium i	-1.2564964543240227	View
342.htm	Fluquinconazole i	-0.5659776155608442	View
346.htm	Flurochloridone i	-0.4800500826504367	View
3463.htm	Beflubutamid-M i	-0.23140025062200054	View
347.htm	Fluroxypyr i	-0.14265013144201058	View
348.htm	Flurprimidol i	-0.4730049642672709	View
3481.htm	Pyrimidifen i	-2.7241268579397273	View
3485.htm	Sodium tetrathiocarbonate i	-0.7490867065501933	View
3486.htm	Pefurazoate i	-0.5081390149082311	View
349.htm	Flurtamone i	-0.5040492767487136	View
350.htm	Flusilazole i	-0.2600424629804417	View
351.htm	Flusulfamide i	-0.35071648999527216	View
352.htm	Flutolanil i	-0.18636294039473103	View
3524.htm	Glyphosate-sodium i	-0.20685285000669779	View
353.htm	Flutriafol i	-0.7607089026757241	View
354.htm	Folpet i	-0.16512556908822865	View
356.htm	Fonofos i	-1.8454926738277837	View
357.htm	Foramsulfuron i	-0.6357852355336517	View
358.htm	Forchlorfenuron i	-0.4695113945040653	View
360.htm	Formetanate i	-2.305562099948067	View
361.htm	Formothion i	-3.213393781652465	View
362.htm	Fosamine i	0.13963204311818428	View
363.htm	Fosetyl-aluminium i	-0.012795058145412529	View
364.htm	Fosthiazate i	-3.015349930223829	View
365.htm	Fuberidazole i	0.05519666056665519	View
369.htm	Gamma-cyhalothrin i	-4.935194783852778	View
370.htm	Lindane i	-3.092751148247371	View
371.htm	Gibberellic acid i	-1.112859605752242	View
372.htm	Glufosinate-ammonium i	0.3098553036064141	View
373.htm	Glyphosate i	-0.20685285000669779	View
374.htm	Guazatine i	-0.49727528635799534	View
375.htm	Halfenprox i	-4.225825991461893	View
376.htm	Halofenozide i	-0.4936671312280174	View
377.htm	Haloxyfop-P i	-0.5448242987597279	View
378.htm	Heptachlor i	-2.8451570113609295	View
38.htm	Ancymidol i	-0.3805187580704302	View
382.htm	Hexaconazole i	-0.4728587962254014	View
384.htm	Hexazinone i	-0.36578739509366065	View
385.htm	Hexythiazox i	-0.21972856864825183	View
386.htm	Hydramethylnon i	-1.195244489514421	View
388.htm	Hymexazol i	0.026641200113602326	View
390.htm	Imazalil i	-0.8608138953070048	View
392.htm	Imazamox i	-0.6932112857799593	View
393.htm	Imazapyr i	-0.39121748323940203	View
394.htm	Imazaquin i	-0.46864266839151125	View
395.htm	Imazethapyr i	-0.4316531973465765	View
396.htm	Imazosulfuron i	-0.6017558787388017	View
397.htm	Imidacloprid i	-3.481725660230397	View
398.htm	Sumithrin i	-3.6657551562838027	View
399.htm	Indoxacarb i	-3.8050758708635963	View
4.htm	2,4-D i	-0.3323980585497542	View
401.htm	Iodosulfuron-methyl-sodium i	-0.5168965848538889	View
402.htm	Ioxynil i	-0.5657061778128057	View
403.htm	Iprodione i	-0.5011414552877826	View
404.htm	Iprovalicarb i	-0.1646502159342967	View
406.htm	Isofenphos i	-2.721445701595876	View
409.htm	Isoproturon i	0.02654885597506534	View
411.htm	Isoxaben i	-0.48883263438240043	View
412.htm	Isoxaflutole i	-0.5406172403282097	View
413.htm	Isoxathion i	-3.559205725982383	View
414.htm	Kresoxim-methyl i	-0.46862790626156536	View
415.htm	Lambda-cyhalothrin i	-4.054381191571987	View
417.htm	Lenacil i	0.021653087169310664	View
419.htm	Linuron i	-0.3880772170976282	View
42.htm	Asulam sodium i	-0.3427581424192911	View
420.htm	Lufenuron i	-0.4006156892070235	View
421.htm	Malathion i	-3.288933560915721	View
422.htm	Maleic hydrazide i	-0.033664963203176974	View
424.htm	Mancozeb i	-0.3794043578774717	View
425.htm	Mandipropamid i	-0.28968926565721403	View
426.htm	Maneb i	-0.31035338904499465	View
427.htm	MCPA i	0.018770512579999246	View
428.htm	MCPB i	-0.3335681749239878	View
43.htm	Atrazine i	-0.3044474408661749	View
430.htm	Mecoprop i	-0.30867110671541836	View
431.htm	Mecoprop-P i	-0.38959301433934446	View
435.htm	Mepanipyrim i	-0.32257072423127603	View
436.htm	Mephosfolan i	-4.859395656995042	View
437.htm	Mepiquat chloride i	0.008419542825660174	View
438.htm	Mepronil i	0.6017474118161177	View
439.htm	Meptyldinocap i	-0.6033384570198363	View
441.htm	Mesosulfuron-methyl i	-0.6833712864879428	View
442.htm	Mesotrione i	-0.5135105833853545	View
443.htm	Metaflumizone i	-2.4729602332117593	View
444.htm	Metalaxyl i	-0.11085895673186738	View
445.htm	Metalaxyl-M i	-0.41188895239584855	View
446.htm	Metaldehyde i	-0.15125863214473528	View
448.htm	Metamitron i	-0.2836177863656437	View
450.htm	Metazachlor i	-0.41767094132511023	View
451.htm	Metconazole i	-0.4737058868877721	View
452.htm	Methabenzthiazuron i	-2.4195427247002796	View
453.htm	Methamidophos i	-2.1373084226134553	View
456.htm	Methidathion i	-3.350337492869775	View
457.htm	Methiocarb i	-2.9608842141706946	View
458.htm	Methomyl i	-2.978123429263076	View
459.htm	Methoprene i	0.5587920499552169	View
460.htm	Methoxychlor i	-1.146272601181712	View
461.htm	Methoxyfenozide i	-0.5317853697059669	View
463.htm	Metiram i	-0.4072634020530511	View
464.htm	Metobromuron i	-0.09343919668345288	View
465.htm	Metolachlor i	-0.37626165564772707	View
466.htm	Metosulam i	-0.6076265624612568	View
467.htm	Metoxuron i	-1.1294683390674962	View
468.htm	Metrafenone i	-0.5889324523231858	View
469.htm	Metribuzin i	-0.3014423795704337	View
470.htm	Metsulfuron-methyl i	-0.8648194867340808	View
471.htm	Mevinphos i	-3.3512369246025915	View
476.htm	Monuron i	-0.23174753890858665	View
478.htm	Myclobutanil i	-0.9037940235916256	View
479.htm	Nabam i	-1.2275680187285445	View
48.htm	Azamethiphos i	-1.497758718287268	View
480.htm	Naled i	-5.271504723504128	View
481.htm	Napropamide i	-0.3982525881838823	View
482.htm	Naptalam i	-0.3904950876503772	View
483.htm	Neburon i	-0.4133668314092986	View
484.htm	Nicosulfuron i	-0.7127825743472024	View
486.htm	Norflurazon i	-0.09632073953650552	View
487.htm	Novaluron i	-0.5981623818218436	View
488.htm	Nuarimol i	-1.1464725771337567	View
49.htm	Azimsulfuron i	-1.2130393712509595	View
494.htm	Oryzalin i	-0.9055181096632262	View
495.htm	Oxadiargyl i	-0.21361071528471218	View
496.htm	Oxadiazon i	-0.5146407109486933	View
497.htm	Oxadixyl i	-0.4152405239139742	View
498.htm	Oxamyl i	-2.6421276129907794	View
499.htm	Oxasulfuron i	-0.28811502528810307	View
5.htm	2,4-DB i	-0.3783979009481377	View
50.htm	Azinphos-ethyl i	-2.3745241735964866	View
500.htm	Oxycarboxin i	-0.14749697134880485	View
501.htm	Oxydemeton-methyl i	-3.1208934243155424	View
502.htm	Oxyfluorfen i	-0.5448242987597279	View
504.htm	Paclobutrazol i	-0.8351037191185415	View
507.htm	Parathion-methyl i	-1.113309007767932	View
509.htm	Penconazole i	-1.9527278831388293	View
51.htm	Azinphos-methyl i	-2.861392154484513	View
510.htm	Pencycuron i	-0.48807103570630994	View
511.htm	Pendimethalin i	-0.41856642837431945	View
512.htm	Penoxsulam i	-0.6714320456364768	View
513.htm	Pentachlorophenol i	-0.742512382237241	View
515.htm	Permethrin i	-4.189291415375807	View
516.htm	Phenmedipham i	-0.4535935099205207	View
518.htm	Phenthoate i	-2.990410472089903	View
519.htm	Phorate i	-2.8809028706204836	View
520.htm	Phosalone i	-1.9039404695822455	View
521.htm	Phosmet i	-3.142204535859577	View
522.htm	Phosphamidon i	-3.217530390337891	View
525.htm	Picloram i	-0.4556744232975103	View
526.htm	Picolinafen i	-0.26032187024631226	View
527.htm	Picoxystrobin i	-0.24451214537802712	View
528.htm	Pinoxaden i	-0.5661427555146685	View
529.htm	Piperonyl butoxide i	-0.02047121242164764	View
530.htm	Pirimicarb i	-1.0922986874866507	View
532.htm	Pirimiphos-methyl i	-3.0237553005194147	View
534.htm	Pretilachlor i	-0.4873208713226719	View
535.htm	Primisulfuron i	-0.6476274364773391	View
536.htm	Prochloraz i	-0.40679924671416245	View
537.htm	Procymidone i	-0.4362262752705825	View
538.htm	Profenofos i	-3.5767655547149713	View
539.htm	Prohexadione-calcium i	-0.3012470886362114	View
54.htm	Azoxystrobin i	-0.2858384967689099	View
541.htm	Prometon i	-0.75788083837009	View
542.htm	Prometryn i	-0.35114794866057253	View
544.htm	Propamocarb hydrochloride i	-0.2255935481547996	View
545.htm	Propanil i	-0.320146286111054	View
546.htm	Propaquizafop i	-0.32397360535088227	View
547.htm	Propargite i	-0.8305578649509648	View
548.htm	Propazine i	-1.1254609330859737	View
550.htm	Propham i	-1.016275795575671	View
551.htm	Propiconazole i	-0.511990251080793	View
552.htm	Propineb i	-0.3351568995347431	View
553.htm	Propoxur i	-3.2388522599730662	View
554.htm	Propoxycarbazone-sodium i	-0.27905064819902614	View
555.htm	Proquinazid i	-0.25583552257548925	View
556.htm	Propyzamide i	-0.2556803516548801	View
557.htm	Prosulfocarb i	-0.45905306259001644	View
558.htm	Prosulfuron i	-0.6055959152407835	View
559.htm	Prothioconazole i	-0.5173806648031773	View
562.htm	Pymetrozine i	-0.3141833391373773	View
563.htm	Pyraclofos i	-2.555757835515087	View
564.htm	Pyraclostrobin i	-0.5678142075027517	View
565.htm	Pyraflufen-ethyl i	-0.602135986212937	View
566.htm	Pyrazophos i	-3.1500929820526897	View
568.htm	Pyrethrins (pyrethrin I) i	-4.363481802197638	View
569.htm	Pyridaben i	-4.1509226574080005	View
571.htm	Pyridate i	-0.5511204923577153	View
572.htm	Pyrifenox i	-0.6067804623192472	View
573.htm	Pyrimethanil i	-0.26986304055441107	View
574.htm	Pyriproxyfen i	-0.6110771111289633	View
575.htm	Pyroquilon i	0.7901634049303445	View
576.htm	Quinalphos i	-2.808609900934236	View
577.htm	Quinclorac i	-0.11708809541601768	View
578.htm	Quinmerac i	-0.32954024765666384	View
579.htm	Quinoclamine i	-0.429343086292031	View
58.htm	Beflubutamid i	-0.2281307660571532	View
580.htm	Quinoxyfen i	-0.47720810493131144	View
581.htm	Quintozene i	-0.47029285975042734	View
583.htm	Quizalofop-P-ethyl i	-0.551035024150877	View
584.htm	Quizalofop-P-tefuryl i	-0.6103300590163426	View
585.htm	Resmethrin i	-3.695120169937245	View
586.htm	Rimsulfuron i	-0.6173463799861104	View
589.htm	Sethoxydim i	-1.4745804523423796	View
59.htm	Benalaxyl i	-0.4803088308599395	View
590.htm	Siduron i	-0.24748226067705428	View
591.htm	Silthiofam i	-0.39146441183910324	View
592.htm	Simazine i	-0.2909978758174056	View
593.htm	Sintofen i	-0.526610626653219	View
597.htm	Spirodiclofen i	-0.28680439469068586	View
598.htm	Spiromesifen i	-0.23074260949742287	View
599.htm	Spiroxamine i	-1.7953668331589165	View
6.htm	2-aminobutane i	0.20725821416525136	View
600.htm	Sulcotrione i	-0.19818955651682155	View
601.htm	Sulfentrazone i	-1.1768058436992104	View
603.htm	Sulfosulfuron i	-1.2575441867252692	View
608.htm	Tau-fluvalinate i	-1.6027199791139237	View
61.htm	Bendiocarb i	-2.6889989365514846	View
610.htm	Tebuconazole i	-0.15478902873874995	View
611.htm	Tebufenozide i	-0.1416507333234938	View
612.htm	Tebufenpyrad i	-1.664810306752769	View
614.htm	Tebuthiuron i	-0.8496241248456594	View
616.htm	Teflubenzuron i	-0.5741007492864469	View
617.htm	Tefluthrin i	-3.15988931440588	View
618.htm	Temephos i	-2.4593049195601435	View
62.htm	Benfluralin i	-0.5040084564010464	View
620.htm	Terbacil i	-0.023135133193483325	View
621.htm	Terbufos i	-1.8141663569352406	View
623.htm	Terbuthylazine i	-0.8244309374219925	View
624.htm	Terbutryn i	-3.1426631606021975	View
626.htm	Tetraconazole i	-0.7582388283625938	View
629.htm	Thiabendazole i	-0.7567703085297309	View
63.htm	Benfuracarb i	-3.3013613045220747	View
630.htm	Thiacloprid i	-0.7977287088213365	View
631.htm	Thiamethoxam i	-4.069498513859764	View
635.htm	Thifensulfuron-methyl i	-0.5732314298042585	View
636.htm	Thiobencarb i	-0.3831867994748993	View
637.htm	Thiodicarb i	-2.0354297381845483	View
638.htm	Thiofanox i	-3.537992691350954	View
639.htm	Thiometon i	-2.623700271208834	View
640.htm	Thiophanate-methyl i	-0.5162708827293401	View
642.htm	Thiram i	-0.35862003433464534	View
644.htm	Tolclofos-methyl i	0.5375570774093256	View
645.htm	Tolylfluanid i	-0.23169839090058864	View
646.htm	Tralkoxydim i	-0.4803088308599395	View
647.htm	Tralomethrin i	-3.6961748626261577	View
649.htm	Triadimenol i	-0.1424207542195595	View
650.htm	Tri-allate i	-0.46019097574857853	View
651.htm	Triasulfuron i	-0.5862608986236786	View
652.htm	Triazamate i	-1.034375895044873	View
653.htm	Triazophos i	-0.6963330079847667	View
654.htm	Triazoxide i	-0.08206693428511301	View
655.htm	Tribenuron-methyl i	-0.5848068010134204	View
656.htm	Tribufos i	-0.8129133566428556	View
657.htm	Trichlorfon i	-1.9419819292602734	View
659.htm	Triclopyr i	-0.4021409672924676	View
66.htm	Benomyl i	-1.4348562097403752	View
660.htm	Tricyclazole i	-0.2605245358422259	View
664.htm	Trifloxystrobin i	-0.2891651526498891	View
665.htm	Triflumizole i	-1.218312261446063	View
666.htm	Triflumuron i	-0.24132230288877302	View
667.htm	Trifluralin i	-0.5040084564010464	View
668.htm	Triflusulfuron-methyl i	-0.675136504467994	View
669.htm	Triforine i	-0.6241170119291274	View
672.htm	Trinexapac-ethyl i	-0.07212117145190827	View
673.htm	Triticonazole i	-0.4737058868877721	View
674.htm	Tritosulfuron i	-0.3387054443032551	View
675.htm	Uniconazole i	-1.1361337147825228	View
678.htm	Vamidothion i	-2.681887028545739	View
68.htm	Bensulfuron-methyl i	-0.5935850954538958	View
682.htm	Zeta-cypermethrin i	-5.2979027001189465	View
683.htm	Zineb i	-1.4590950403259193	View
684.htm	Ziram i	-0.057590038670664125	View
685.htm	Zoxamide i	-0.5058280338548362	View
686.htm	Topramezone i	-0.5394023246923064	View
687.htm	Fluacrypyrim i	-1.6076908722146115	View
69.htm	Bensulide i	-1.1918816485922994	View
7.htm	(4-chlorophenoxy)acetic acid i	-0.2541370308854681	View
70.htm	Bensultap i	-1.1999710767269414	View
71.htm	Bentazone i	-0.05726661269175381	View
72.htm	Benthiavalicarb i	-0.506843136339351	View
731.htm	3,5,6-trichloro-2-pyridinol i	-0.7145243856735867	View
74.htm	Beta-cyfluthrin i	-4.540047780403344	View
746.htm	Bromoxynil-octanoate i	-0.5865422977302251	View
75.htm	Beta-cypermethrin i	-4.45280466010469	View
76.htm	Bifenazate i	-1.5180337055127004	View
764.htm	Diclofop i	-0.4983794839511456	View
77.htm	Bifenox i	-0.2214794423288966	View
78.htm	Bifenthrin i	-4.3986776824460705	View
79.htm	Binapacryl i	-0.7841463734383349	View
792.htm	4-hydroxyquinazoline i	-0.1464381352857746	View
80.htm	Bioallethrin i	-1.9097290330025278	View
81.htm	Bioresmethrin i	-4.215707118437997	View
819.htm	Acifluorfen i	-0.549738731264899	View
83.htm	Bispyribac-sodium i	-0.3141095986699443	View
84.htm	Bitertanol i	-0.1962176497519285	View
854.htm	6-chloronicotinic acid i	-0.18616496172741515	View
86.htm	Boscalid i	-0.21892918508808726	View
883.htm	Mesosulfuron i	-1.5584777960541167	View
9.htm	Acephate i	-1.9878519756169333	View
93.htm	Bromophos i	-2.910333290266367	View
938.htm	Alpha-(1-chlorocyclopropyl)-alpha-o(2-chlorophenyl)methyl-1H-1,2,4-triazole-1-ethanol i	-0.4728587962254014	View
94.htm	Bromophos-ethyl i	-2.938542467274887	View
96.htm	Bromoxynil i	-0.2614690601395999	View
97.htm	Bromuconazole i	0.13672473640344546	View
972.htm	Thifensulfuron i	-0.5590683340345368	View
99.htm	Bupirimate i	-0.7667696548678414	View

10967/277 - QDB Compounds

QsarDB Repository

Kotli, M.; Piir, G.; Maran, U. Multi-task prediction of pesticide toxicity to pollinators with censored data and interpretable attributions on graph neural networks. Journal of Chemical Information and Modeling

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