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• Acetamiprid

IUPAC Name: N-[(6-chloropyridin-3-yl)methyl]-N'-cyano-N-methylethanimidamide | CAS Registry Number: 135410-20-7
Synonyms: Acetamipride, (E)-acetamiprid, (Z)-acetamiprid, Acetamiprid [ISO], HSDB 7274, NI 25, CHEBI:39163, CHEBI:39164, CHEBI:39165, NCGC00163881-01, NCGC00163881-02, LS-183006, (E)-N-(6-Chloro-3-pyridyl)methyl-N'-cyano-N-methylacetamidine, C464485, N-((6-Chloro-3-pyridinyl)methyl)-N'-cyano-N-methylethanimidamide, (1E)-N-[(6-chloropyridin-3-yl)methyl]-N'-cyano-N-methylethanimidamide, Ethanimidamide, N-((6-chloro-3-pyridinyl)methyl)-N'-cyano-N-methyl-, (E)-, N-[(6-chloropyridin-3-yl)methyl]-N'-cyano-N-methylethanimidamide, (1Z)-N-[(6-chloropyridin-3-yl)methyl]-N'-cyano-N-methylethanimidamide, (E)-N-((6-chloro-3-pyridinyl)methyl)-N'-cyano-N-methylethanimidamide

Molecular Formula:	C₁₀H₁₁ClN₄	Molecular Weight:	222.674140 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: WCXDHFDTOYPNIE-UHFFFAOYSA-N

• Acetochlor

IUPAC Name: 2-chloro-N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)acetamide | CAS Registry Number: 34256-82-1
Synonyms: acetochlor, Azetochlor, Harness, Nevirex, Acenit, Erunit, Acetochlore, Caswell No. 003B, Spectrum_001979, Acetochlore [ISO-French], SpecPlus_000626, Spectrum2_001915, Spectrum3_000873, Spectrum4_000713, Spectrum5_002071, Acetochlor [ANSI:BSI:ISO], PS2040_SUPELCO, CCRIS 7709, BSPBio_002545, KBioGR_001265

Molecular Formula:	C₁₄H₂₀ClNO₂	Molecular Weight:	269.767100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: VTNQPKFIQCLBDU-UHFFFAOYSA-N

• Ametryn

IUPAC Name: 4-N-ethyl-6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine | CAS Registry Number: 834-12-8
Synonyms: Ametrex, Gesapax, Evik, Cemerin, Ametrine, AMETRYNE, Crisatrine, Doruplant, Gardopax, Amephyt, Geshpax, Gestene, Topazol, Trinatox D, Primatol Z 80, Caswell No. 431, Evik 80W, Maybridge3_005565, Ametryn [ANSI:BSI:ISO], PS383_SUPELCO

Molecular Formula:	C₉H₁₇N₅S	Molecular Weight:	227.329780 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: RQVYBGPQFYCBGX-UHFFFAOYSA-N

• Atrazine

IUPAC Name: 6-chloro-4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine | CAS Registry Number: 1912-24-9
Synonyms: atrazine, Oleogesaprim, Chromozin, Atazinax, Atrasine, Fenatrol, Gesaprim, Gesoprim, Hungazin, Primatol, Strazine, Aktikon, Argezin, Atranex, Atrazin, Fenamin, Pitezin, Primaze, Radazin, Zeazine

Molecular Formula:	C₈H₁₄ClN₅	Molecular Weight:	215.683260 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: MXWJVTOOROXGIU-UHFFFAOYSA-N

• Avermectin B1

Synonyms: Abamectinum, Abamectin, Vertimec, Agrimek, Affirm, Avomec, Zephyr, Avid, avermectin B1, Agri-Mek, Abamectin [ANSI], Abamectin [USAN], Avermectin B(sub 1), AVID EC, Abamectin [ANSI:ISO], HSDB 6941, MK 936, ABAMECTIN (4:1 MIXTURE), EPA Pesticide Chemical Code 122804, MK 0936

Molecular Formula:	C₉₅H₁₄₂O₂₈	Molecular Weight:	1732.127180 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	28

InChIKey: IBSREHMXUMOFBB-MVGRHBATSA-N

• Azoxystrobin

IUPAC Name: methyl (E)-2-[2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxyphenyl]-3-methoxyprop-2-enoate | CAS Registry Number: 131860-33-8
Synonyms: Heritage, Amistar, Quadris, Bankit, Azoxystrobine x, Icia 5504, Icia-5504, HSDB 7017, ICI-A 5504, CID3034285, EINECS Annex I Index 607-256-00-X, NCGC00163818-01, NCGC00163818-02, LS-28710, Methyl (E)-2-(2-(6-(2-cyanopheoxy)pyrimidin-4-yloxy)phenyl)-3-methoxypropenoate, Benzeneacetic acid, 2-((6-(2-cyanophenoxy)-4-pyrimidinyl)oxy)-alpha-(methoxymethylene)-, methyl ester, (E)-, methyl (2E)-2-(2-{[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy}phenyl)-3-methoxyacrylate, METHYL (2Z)-2-(2-{[6-(2-CYANOPHENOXY)PYRIMIDIN-4-YL]OXY}PHENYL)-3-METHOXYACRYLATE, 215934-32-0, AZO

Molecular Formula:	C₂₂H₁₇N₃O₅	Molecular Weight:	403.387480 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	8

InChIKey: WFDXOXNFNRHQEC-GHRIWEEISA-N

• Benfuracarb

IUPAC Name: ethyl 3-[[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxycarbonyl-methylamino]sulfanyl-propan-2-ylamino]propanoate | CAS Registry Number: 82560-54-1
Synonyms: Aminofuracarb, Oncol, Furacon, Oncol 5G, Caswell No. 349C, Benfuracarb [BSI:ISO], 45759_RIEDEL, CHEBI:3014, MolPort-003-933-538, OK 174, EPA Pesticide Chemical Code 123201, CID54886, OC-11588, NCGC00166199-01, LS-16047, C11073, beta-Alanine, N-(((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)thio)-N-(1-methylethyl)-, ethyl ester, 8-Oxa-3-thia-2,4-diazadecanoic acid, 2-methyl-4-(1-methylethyl)-7-oxo-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester, 88650-68-4, ethyl 3-[{[{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]carbonyl}(methyl)amino]sulfanyl}(1-methylethyl)amino]propanoate

Molecular Formula:	C₂₀H₃₀N₂O₅S	Molecular Weight:	410.527600 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: FYZBOYWSHKHDMT-UHFFFAOYSA-N

• Bispyribac-Sodium

IUPAC Name: sodium;2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate | CAS Registry Number: 125401-92-5
Synonyms: Bispyribac-sodium, Bispyribac sodium, Bispyribac-sodium [ISO:BSI], EPA Chemical Code 078906, KIH-2023, V 10029, Nanogen Index code is BPY (3-031), Sodium 2,6-bis((4,6-dimethoxypyrimidin-2-yl)oxy)benzoate, sodium 2,6-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]benzoate, Sodium 2,6-bis(4,6-dimethoxy-2-pyrimidinyl)xoy)benzoate, Benzoic acid, 2,6-bis((4,6-dimethoxy-2-pyrimidinyl)oxy)-, sodium salt, Designee, Nominee, Regiment, Short-keep, Nominee 400SC, Bispyribac sodium salt, SureCN116404, DSSTox_CID_14383, DSSTox_RID_79151

Molecular Formula:	C₁₉H₁₇N₄NaO₈	Molecular Weight:	452.350049 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	12

InChIKey: FUHMZYWBSHTEDZ-UHFFFAOYSA-M

• Carmazine

IUPAC Name: zinc; manganese(2+); N-[2-(sulfidocarbothioylamino)ethyl]carbamodithioate | CAS Registry Number: 8018-01-7
Synonyms: Dithane, Manzeb, MANCOZEB, 1,2-Ethanedicarbamic acid, tetrathio-, ethylenebisdithiocarbamate manganese-zinc, NCGC00168344-01, LS-63091, C15225, C013099, manganese(2+) ethane-1,2-diylbis(dithiocarbamate) zinc ethane-1,2-diylbis(dithiocarbamate), 12656-69-8, 172672-41-2

Molecular Formula:	C₈H₁₂MnN₄S₈Zn	Molecular Weight:	541.074729 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	4

InChIKey: CHNQZRKUZPNOOH-UHFFFAOYSA-J

• Clethodim (CAS: 99129-21-2)

• Clocythrin (CAS: 91465-08-6)

• Clomazone

IUPAC Name: 2-[(2-chlorophenyl)methyl]-4,4-dimethyl-1,2-oxazolidin-3-one | CAS Registry Number: 81777-89-1
Synonyms: Dimethazone, Magister, Command, Gamit, Clomazone [ISO], 46120_RIEDEL, HSDB 6614, FMC 57020, EPA Pesticide Chemical Code 125401, FMC57020, NCGC00163923-01, NCGC00163923-02, LS-86761, 2-(2-Chlorobenzyl)-4,4-dimethylisoxazolidin-3-one, 2-(2-Chlorobenzyl)-4,4-dimethyl-3-isoxazolidinone, C11095, 2-(2-Chlorobenzyl)-4,4-dimethyl-1,2-oxazolidin-3-one, 2-((2-Chlorophenyl)methyl)-4,4-dimethyl-3-isoxazolidinone, 3-ISOXAZOLIDINONE, 2-((2-CHLOROPHENYL)METHYL)-4,4-DIMETHYL-, 89493-06-1

Molecular Formula:	C₁₂H₁₄ClNO₂	Molecular Weight:	239.698060 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: KIEDNEWSYUYDSN-UHFFFAOYSA-N

• Copper Oxy Chloride

IUPAC Name: dicopper chloride trihydroxide | CAS Registry Number: 1332-65-6
Synonyms: Aviocaffaro, Coppercide, Copperthom, Cuprocaffaro, Cuprovinol, Devicopper, Rhodiacuivre, Viricuivre, Chemocin, Colloidox, Coppesan, Coprantol, Criscobre, Cupramer, Cuprargos, Cuprasol, Cupravit, Cupricol, Cupritox, Cuprokylt

Molecular Formula:	ClCu₂H₃O₃	Molecular Weight:	213.567020 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: SKQUUKNCBWILCD-UHFFFAOYSA-J

• Cyhalofop-butyl

IUPAC Name: butyl (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoate | CAS Registry Number: 122008-85-9
Synonyms: Clincher, Cyhalofop-butyl [ISO], HSDB 7272, XDE 537, NCGC00168299-01, LS-195719, (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoic acid, Propanoic acid, 2-(4-(4-cyano-2-fluorophenoxy)phenoxy)-, butyl ester, (2R)-

Molecular Formula:	C₂₀H₂₀FNO₄	Molecular Weight:	357.375503 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: TYIYMOAHACZAMQ-CQSZACIVSA-N

• Cymoxanil

IUPAC Name: 2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide | CAS Registry Number: 57966-95-7
Synonyms: Curzate, CYMOXANIL, Dpx 3217, Cymoxanil [ANSI:BSI:ISO], DPX 3217M, PS1067_SUPELCO, HSDB 6914, 34326_RIEDEL, DPX-T3217, EINECS 261-043-0, AIDS121268, AIDS-121268, 1-(2-Cyano-2-methoxyiminoacetyl)-3-ethylurea, INT-3217-49, CID5364079, LS-8718, NCGC00164268-01, NCGC00164268-02, NCGC00164268-03, 2-Cyano-N-(ethylcarbamoyl)-2-(methoxyimino)acetamide

Molecular Formula:	C₇H₁₀N₄O₃	Molecular Weight:	198.179300 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: XERJKGMBORTKEO-VZUCSPMQSA-N

• CYPROCONAZOLE (CAS: 4361-06-5)

• Deltamethrin

IUPAC Name: [(S)-cyano-[3-(phenoxy)phenyl]methyl] (1R,3R)-3-(2,2-dibromoethenyl)-2,2-dimethylcyclopropane-1-carboxylate | CAS Registry Number: 52918-63-5
Synonyms: deltamethrin, Decamethrin, Decamethrine, Deltamethrine, Esbecythrin, Crackdown, Deltacide, Deltagran, Stricker, Suspend, Butoss, Cislin, Zodiac, Zorcis, Butox, Decis, DeltaGard, New Musigie, Butoflin, K-Othrine

Molecular Formula:	C₂₂H₁₉Br₂NO₃	Molecular Weight:	505.199160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: OWZREIFADZCYQD-NSHGMRRFSA-N

• Diazinon

IUPAC Name: diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane | CAS Registry Number: 333-41-5
Synonyms: diazinon, Dimpylate, Diazinone, Neocidol, Oleodiazinon, Spectracide, Ciazinon, Dassitox, Diazajet, Diazitol, Dimpylat, Ektoband, Nedcidol, Antigal, Basudin, Bazuden, Dacutox, Diazide, Flytrol, Galesan

Molecular Formula:	C₁₂H₂₁N₂O₃PS	Molecular Weight:	304.345501 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: FHIVAFMUCKRCQO-UHFFFAOYSA-N

• Difenoconazole

IUPAC Name: 1-[[2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole | CAS Registry Number: 119446-68-3
Synonyms: Dividend, Dragon, Plover, Score, Difenoconazol, Dividend (fungicide), Score EC 250, Difenoconazole [ISO], 36531_RIEDEL, CGA 169374, CID86173, NCGC00163894-01, NCGC00163894-02, LS-155877, C115058, 1-((2-(2-Chloro-4-(4-chlorophenoxy)phenyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole, 1H-1,2,4-Triazole, 1-((2-(2-chloro-4-(4-chlorophenoxy)phenyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-, 1-((2-[2-Chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole, 1-({2-[2-chloro-4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl}methyl)-1H-1,2,4-triazole

Molecular Formula:	C₁₉H₁₇Cl₂N₃O₃	Molecular Weight:	406.262580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: BQYJATMQXGBDHF-UHFFFAOYSA-N

• Diflubenzuron

IUPAC Name: N-[(4-chlorophenyl)carbamoyl]-2,6-difluorobenzamide | CAS Registry Number: 35367-38-5
Synonyms: Difluron, DIFLUBENZURON, Dimilin, Duphacid, Larvakil, Micromite, Astonex, Dioflubenzuron, Dimilin G1, Dimilin G4, Dimilin ODC-45, Dimilin WP-25, Caswell No. 346A, Thompson Hayward 6040, Thompson-hayward TH6040, Philips-duphar PH 60-40, PS1028_SUPELCO, CBDivE_015152, Diflubenzuron [ANSI:BSI:ISO], HSDB 6611

Molecular Formula:	C₁₄H₉ClF₂N₂O₂	Molecular Weight:	310.683266 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: QQQYTWIFVNKMRW-UHFFFAOYSA-N

• Diflufenican

IUPAC Name: N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide | CAS Registry Number: 83164-33-4
Synonyms: Diflufenicanil, Diflufenican [BSI:ISO], MLS000327776, 45751_RIEDEL, 45751_FLUKA, MolPort-002-887-935, CID91735, BRN 4212494, ZINC04110301, MS-3566, NCGC00166198-01, MB 38544, SMR000180823, LS-130595, M&B 38544, 2',4'-Difluoro-2-(alpha,alpha,alpha-trifluoro-m-tolyloxy)nicotinanilide, N-(2,4-Difluorophenyl)-2-(3-(trifluoromethyl)phenoxy)-3-pyridinecarboxamide, 3-Pyridinecarboxamide, N-(2,4-difluorophenyl)-2-(3-(trifluoromethyl)phenoxy)-, N-(2,4-difluorophenyl)-2-[3-(trifluoromethyl)phenoxy]nicotinamide

Molecular Formula:	C₁₉H₁₁F₅N₂O₂	Molecular Weight:	394.294856 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: WYEHFWKAOXOVJD-UHFFFAOYSA-N

• Dimethomorph

IUPAC Name: (E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one | CAS Registry Number: 110488-70-5
Synonyms: 46027_RIEDEL, CME 151, CID5889665, NCGC00163797-01, NCGC00163797-02, EE4042002, 4-(3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)acryloyl)morpholine, 4-(3-(4-Chloorfenyl)-3-(3,4-dimethoxyfenyl)acryloyl)morpholine [Dutch], 4-(3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)acryloyl)morpholine [French], 4-(3-(4-Chlorphenyl)-3-(3,4-dimethoxyphenyl)acryloyl)morpholin [Danish], 4-(3-(4-Chlorphenyl)-3-(3,4-dimethoxyphenyl)acryloyl)morpholin [German], 4-(3-(4-Clorofenil)-3-(3,4-dimetossifenil)acriloil)morfolina [Italian], 4-(3-(4-Clorofenil)-3-(3,4-dimetoxifenil)acriloil)morfolina [Portuguese], 4-(3-(4-Clorofenil)-3-(3,4-dimetoxifenil)acriloil)morfolina [Spanish], 4-[(2E)-3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]morpholine

Molecular Formula:	C₂₁H₂₂ClNO₄	Molecular Weight:	387.856680 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: QNBTYORWCCMPQP-NBVRZTHBSA-N

• Diuron

IUPAC Name: 3-(3,4-dichlorophenyl)-1,1-dimethylurea | CAS Registry Number: 330-54-1
Synonyms: diuron, Dichlorfenidim, Herbatox, Vonduron, Dailon, Karmex, Marmer, Duran, Dynex, Durashield, Cekiuron, Crisuron, Herburon, Anduron, Ansaron, Dirurol, Lucenit, Seduron, Unidron, Bioron

Molecular Formula:	C₉H₁₀Cl₂N₂O	Molecular Weight:	233.094500 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: XMTQQYYKAHVGBJ-UHFFFAOYSA-N

• Emamectin Benzoate

Synonyms: Proclaim, Denim, Emamectin benzoate, Proclaim 5SG, Denim (pesticide), Emamectin benzoate (salt), Shot Wan Liquid Formulation, Emamectin benzoate [ISO], Methylamino abamectin benzoate, Sch 58854, MK 244, MK 0244, NCGC00168343-01, LS-22278, Avermectin b1, 4''-deoxy-4''-(methylamino)-, (4''R)-, benzoate (salt), 155569-91-8, 179607-18-2

Molecular Formula:	C₅₆H₈₁NO₁₅	Molecular Weight:	1008.240040 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	15

InChIKey: GCKZANITAMOIAR-XWVCPFKXSA-N

• Epoxiconazole

IUPAC Name: 1-[[(2S,3R)-3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl]-1,2,4-triazole | CAS Registry Number: 133855-98-8
Synonyms: Epoxiconazol, 36848_RIEDEL, CID107901, LS-192865, C11229, (2RS,35R)-1-(3-(2-Chlorophenyl)-2,3-epoxy-2-(4-fluorophenyl)propyl)-1H-1,2,4-triazole, 1-((3-(2-Chlorophenyl)-2-(4-fluorophenyl)oxiranyl)methyl)-1H-1,2,4-triazole cis-(+-)-, 1H-1,2,4-Triazole, 1-(((2R,3S)-3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiranyl)methyl)-, rel-, 1H-1,2,4-Triazole, 1-((3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiranyl)methyl)-, cis-(+-)-

Molecular Formula:	C₁₇H₁₃ClFN₃O	Molecular Weight:	329.756023 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: ZMYFCFLJBGAQRS-IAGOWNOFSA-N

• Ethyltrianol

IUPAC Name: 1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pentan-3-ol | CAS Registry Number: 107534-96-3
Synonyms: Tebuconazole, Folicur, Terbuconazole, Terbutrazole, Etiltrianol, Fenetrazole, Elite, Raxil, Preventol A 8, LYNX, Tebuconazole (+-), Tebuconazole [ISO], Tebuconazole (unspecified), BAY-HWG 1608, C16H22ClN3O, Tebuconazole Resp. HWG 1608, HWG 1608, HSDB 7448, AIDS108285, AIDS-108285

Molecular Formula:	C₁₆H₂₂ClN₃O	Molecular Weight:	307.818380 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: PXMNMQRDXWABCY-UHFFFAOYSA-N

• Fipronil

IUPAC Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazole-3-carbonitrile | CAS Registry Number: 120068-37-3
Synonyms: fipronil, Regent, Fipronil (JAN), Fipronil [ISO], UPCMLD-DP011, C12H4Cl2F6N4OS, CBiol_001754, BSPBio_001315, BSPBio_002266, KBioGR_000035, KBioSS_000035, HSDB 7051, SPECTRUM1505354, 46451_RIEDEL, CHEBI:5063, UPCMLD-DP011:001, UPCMLD-DP011:002, BCBcMAP01_000152, KBio2_000035, KBio2_002603

Molecular Formula:	C₁₂H₄Cl₂F₆N₄OS	Molecular Weight:	437.147779 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	11

InChIKey: ZOCSXAVNDGMNBV-UHFFFAOYSA-N

• Fluorogestone Acetate

IUPAC Name: [(8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate | CAS Registry Number: 2529-45-5
Synonyms: Cronolone, FLUROGESTONE ACETATE, Flurogestone acetate (USAN), CID10476437, C15432, D04235, 9alpha-Fluoro-11-hydroxy,17alpha-acetoxyprogesterone, 9-Fluoro-11beta,17-dihydroxypregn-4-ene-3,20-dione 17-acetate

Molecular Formula:	C₂₃H₃₁FO₅	Molecular Weight:	406.487643 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: JKQQZJHNUVDHKP-FQJIPJFPSA-N

• Flutriafol

IUPAC Name: 1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol | CAS Registry Number: 76674-21-0
Synonyms: Impact sopra, Impact (pesticide), Flutriafol [BSI:ISO], Oprea1_336494, Oprea1_365445, 34344_RIEDEL, PP 450, CID91727, NCGC00164269-01, LS-155987, LS-155988, ST5412128, R 152450, (RS)-2,4'-Difluoro-alpha-(1H-1,2,4-triazol-1-ylmethyl)benzhydryl alcohol, 1H-1,2,4-Triazole-1-ethanol, alpha-(2-fluorophenyl)-alpha-(4-fluorophenyl)-, alpha-(2-Fluorophenyl)-alpha-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol, (+-)-alpha-(2-Fluorophenyl)-alpha-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol, 1H-1,2,4-Triazole-1-ethanol, alpha-(2-fluorophenyl)-alpha-(4-fluorophenyl)-, (+-)-, 87676-93-5

Molecular Formula:	C₁₆H₁₃F₂N₃O	Molecular Weight:	301.290726 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: JWUCHKBSVLQQCO-UHFFFAOYSA-N

• Gestonoronacetat

IUPAC Name: [(8R,9S,10R,13S,14S,17R)-17-acetyl-13-methyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate | CAS Registry Number: 31981-44-9
Synonyms: EINECS 250-882-8, CID134963, 19-Nor-17alpha-hydroxyprogesterone acetate, 17alpha-Hydroxy-19norprogesterone-17alpha acetate, 17alpha-Hydroxy-19-norprogesterone-17alpha acetate, 17-Hydroxy-19-norpregn-4-ene-3,20-dione 17-acetate

Molecular Formula:	C₂₂H₃₀O₄	Molecular Weight:	358.471200 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: MTSLFKWJINJVBO-ZCPXKWAGSA-N

• Gibberellic Acid

Synonyms: Gibberellin, GIBBERELLIC ACID, Gibberellins, Gibberellin A3, Gibrescol, Gibreskol, Activol, Berelex, Brellin, Cekugib, Gibefol, Regulex, Grocel, Ryzup, Gibberellin X, Activol GA, Gib-Tabs, Pro-Gibb, Pgr-iv, Pro-Gibb Plus

Molecular Formula:	C₁₉H₂₂O₆	Molecular Weight:	346.374380 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: IXORZMNAPKEEDV-OBDJNFEBSA-N

• Glyphosate

IUPAC Name: 2-(phosphonomethylamino)acetic acid | CAS Registry Number: 1071-83-6
Synonyms: glyphosate, Glyphosphate, Pondmaster, Roundup, gliphosate, Silglif, Roundup Max, N-(Phosphonomethyl)glycine, 2gga, 2ggd, Anti-BOB, Caswell No. 661A, Isopropylamine glyphosate, Glyphosate, free acid, N-Phosphonomethylglycine, Spectrum_001867, SpecPlus_000478, Spectrum2_001847, Spectrum3_000839, Spectrum4_000679

Molecular Formula:	C₃H₈NO₅P	Molecular Weight:	169.073081 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: XDDAORKBJWWYJS-UHFFFAOYSA-N

• Hexaconazole

IUPAC Name: 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol | CAS Registry Number: 79983-71-4
Synonyms: Anvil, Chlortriafol, Contaf, Hexaconazol, Sitara, Anvil Liquid, Anvil (fungicide), Contaf 5EC, Anvil L, Hexaconazole [BSI:ISO], 34348_RIEDEL, PP 523, FD 4053, NCGC00164270-01, NCGC00164270-02, LS-155975, TL8005398, R 154523, C409722, (RS)-2-(2,4-Dichlorophenyl)-1-(1H-1,2,4-triazol-1-yl)hexan-2-ol

Molecular Formula:	C₁₄H₁₇Cl₂N₃O	Molecular Weight:	314.210280 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: STMIIPIFODONDC-UHFFFAOYSA-N

• Imidacloprid

IUPAC Name: N-[1-[(6-chloropyridin-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide | CAS Registry Number: 138261-41-3
Synonyms: Confidor, Provado, Admire, Gaucho, Merit, Advantage, Confidor SL, Premise 75, Merit (insecticide), (E)-imidacloprid, (Z)-imidacloprid, IMAZETHAPYR, Confidor 200 SL, Imidacloprid solution, Imidacloprid (old RN), Imidacloprid [ISO], Advantage Flea Adulticide, PS2086_SUPELCO, Bayer Brand of Imidacloprid, CP 1

Molecular Formula:	C₉H₁₀ClN₅O₂	Molecular Weight:	255.661000 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: YWTYJOPNNQFBPC-UHFFFAOYSA-N

• Isobutyramide

IUPAC Name: 2-methylpropanamide | CAS Registry Number: 563-83-7
Synonyms: Isobutylamide, 2-Methylpropanamide, 2-Methylpropionamide, Isopropylformamide, Isobutyrimidic acid, Propanamide, 2-methyl-, C4H9NO, 144436_ALDRICH, NSC 8423, EINECS 209-265-9, NSC8423, BRN 1737615, ZINC01484944, NCI60_041854, LS-119321, 4-02-00-00852 (Beilstein Handbook Reference), T5304550, 563-83-7 NIL |caspi| 3312140566 NIL NIL, InChI=1/C4H9NO/c1-3(2)4(5)6/h3H,1-2H3,(H2,5,6, IBO

Molecular Formula:	C₄H₉NO	Molecular Weight:	87.120360 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: WFKAJVHLWXSISD-UHFFFAOYSA-N

• Lufenuron

IUPAC Name: N-[[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl]-2,6-difluorobenzamide | CAS Registry Number: 103055-07-8
Synonyms: Fluphenacur, Lufenuron [BAN:INN], Lufenurone [INN-French], Lufenuronum [INN-Latin], BSPBio_002424, SPECTRUM1505355, CHEBI:39384, AIDS095054, AIDS-095054, CID71777, NCGC00095978-01, NCGC00095978-02, NCGC00095978-03, 1-(2,5-Dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl)-3-(2,6-difluorobenzoyl)urea, N-{[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]carbamoyl}-2,6-difluorobenzamide, N-({[2,5-dichloro-4-(1,1,2,3,3,3-hexafluoropropoxy)phenyl]amino}carbonyl)-2,6-difluorobenzamide

Molecular Formula:	C₁₇H₈Cl₂F₈N₂O₃	Molecular Weight:	511.150246 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	11

InChIKey: PWPJGUXAGUPAHP-UHFFFAOYSA-N

• Metolachlor

IUPAC Name: 2-chloro-N-(2-ethyl-6-methylphenyl)-N-(1-methoxypropan-2-yl)acetamide | CAS Registry Number: 51218-45-2
Synonyms: metolachlor, Metelilachlor, Yibingjiacaoan, Humextra, Pennant, Codal, Dual, Dual Magnum, Dual Triple, Ontrack 8E, Dual II, Metolachlor technical, Dual 8E, Caswell No. 188DD, Dual 720EC, Dual 960 EC, Spectrum_001833, SpecPlus_000434, Metolachlore [ISO-French], Spectrum2_001885

Molecular Formula:	C₁₅H₂₂ClNO₂	Molecular Weight:	283.793680 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: WVQBLGZPHOPPFO-UHFFFAOYSA-N

• Mezlocillin Sodium (Sterile)

IUPAC Name: sodium (2S,5R,6R)-3,3-dimethyl-6-[[(2R)-2-[(3-methylsulfonyl-2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate | CAS Registry Number: 59798-30-0
Synonyms: MEZLOCILLIN SODIUM, Mezlocillin sodium (USP), CHEBI:52067, CID441241, D05022, sodium (2S,5R,6R)-3,3-dimethyl-6-{[(2R)-2-({[3-(methylsulfonyl)-2-oxoimidazolidin-1-yl]carbonyl}amino)-2-phenylacetyl]amino}-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium 6beta-{(2R)-2-[3-(methanesulfonyl)-2-oxoimidazolidine-1-carboxamido]-2-phenylacetamido}-2,2-dimethylpenam-3alpha-carboxylate, sodium 6beta-{(2R)-2-[3-(methanesulfonyl)-2-oxoimidazolidine-1-carboxamido]-2-phenylacetamido}penicillanate

Molecular Formula:	C₂₁H₂₄N₅NaO₈S₂	Molecular Weight:	561.563730 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	8

InChIKey: GTGQRSIMEUWHPA-ZBJAFUORSA-M

• Myclobutanil (CAS: 88671-89-0)

• N-Methylcaprolactam

IUPAC Name: 1-methylazepan-2-one | CAS Registry Number: 2556-73-2
Synonyms: 1-Methylcaprolactam, N-Methyl-e-caprolactam, N-Methyl-.epsilon.-caprolactam, WLN: T7NVTJ A1, epsilon-Caprolactam, N-methyl-, 2H-Azepin-2-one, hexahydro-1-methyl-, 224766_ALDRICH, EINECS 219-874-1, Hexahydro-N-methyl-2H-azepin-2-one, NSC 68794, .epsilon.-Caprolactam, N-methyl-, NSC68794, BRN 0108968, Hexahydro-1-methyl-2H-azepin-2-one, ZINC04283847, 2H-AZEPIN-2-ONE, HEXAHYDRO-N-METHYL-, AI3-09488, LS-22993, 2H-Azepin-2-one, hexahydro-1-methyl- (8CI), 5-21-06-00449 (Beilstein Handbook Reference)

Molecular Formula:	C₇H₁₃NO	Molecular Weight:	127.184220 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: ZWXPDGCFMMFNRW-UHFFFAOYSA-N

• N4-Acetylcytidine

IUPAC Name: N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide | CAS Registry Number: 3768-18-1
Synonyms: N-Acetylcytidine, Cytidine, N-acetyl-, A7766_SIGMA, EINECS 223-195-6, BTB 14110, ZINC04321512, 4-Acetyl-1-(beta-D-ribofuranosyl)cytosine, TL8002770

Molecular Formula:	C₁₁H₁₅N₃O₆	Molecular Weight:	285.253300 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: NIDVTARKFBZMOT-PEBGCTIMSA-N

• Nicosulfuron

IUPAC Name: 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylpyridine-3-carboxamide | CAS Registry Number: 111991-09-4
Synonyms: Motivell, Milagro, Accent, Nicosulphuron, Accent (herbicide), Accent (pesticide), DPX-V9636, SL 950, 34210_RIEDEL, DPX-V 9360, HU 195, AIDS082313, EPA Pesticide Chemical Code 129008, AIDS-082313, LS-130611, C10949, 2-((((4,6-Dimethoxy-(2-pyrimidinyl)amino)carbonyl)amino)sulfonyl)-N,N-dimethyl-3-pyridinecarboxamide, 3-Pyridinecarboxamide, 2-(((((4,6-dimethoxy-2-pyrimidinyl)amino)carbonyl)amino)sulfonyl)-N,N-dimethyl-, 1-(4,6-Dimethoxy-2-pyrimidinyl)-3-[3-(dimethylcarbamoyl)-2-pyridylsulfonyl]urea, 2-[(4,6-Dimethoxypyrimidin-2-ylcarbamoyl)sulfamoyl]-N,N-dimethylnicotinamide

Molecular Formula:	C₁₅H₁₈N₆O₆S	Molecular Weight:	410.405020 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: RTCOGUMHFFWOJV-UHFFFAOYSA-N

• Nomegestrol 17-acetate

IUPAC Name: [(8S,9S,10R,13S,14S,17R)-17-acetyl-6,13-dimethyl-3-oxo-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate | CAS Registry Number: 58652-20-3
Synonyms: Nomegestrol acetate, Uniplant, Lutenyl, NOMAC, Prestwick3_001033, BSPBio_001245, MLS002154113, BPBio1_001370, EINECS 261-379-8, TX 066, CID91668, TX-066, ZINC03938628, ORG-10486-0, NCGC00179247-01, LS-97336, SMR001233420, AB00514012, BRD-K27351809-001-02-0, 17-alpha-Acetoxy-6-methyl-19-nor-4,6-pregnadiene-3,20-dione

Molecular Formula:	C₂₃H₃₀O₄	Molecular Weight:	370.481900 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: IIVBFTNIGYRNQY-YQLZSBIMSA-N

• O-(4-Bromo-2-Chlorophenyl)-O-Ethyl S-Propyl Phosphorothioate

IUPAC Name: 4-bromo-2-chloro-1-[ethoxy(propylsulfanyl)phosphoryl]oxybenzene | CAS Registry Number: 41198-08-7
Synonyms: Curacron, PROFENOFOS, Polycron, Selecron, (+)-Profenofos, (-)-Profenofos, Caswell No. 266AA, Profenofos [ANSI:BSI:ISO], PS1024_SUPELCO, HSDB 6992, 45632_RIEDEL, CHEBI:38845, EINECS 255-255-2, CGA 15324, EPA Pesticide Chemical Code 111401, BRN 2150258, AI3-29236, NCGC00164297-01, NCGC00164297-02, LS-108416

Molecular Formula:	C₁₁H₁₅BrClO₃PS	Molecular Weight:	373.630761 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: QYMMJNLHFKGANY-UHFFFAOYSA-N

• Oxadiazon

IUPAC Name: 5-tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one | CAS Registry Number: 19666-30-9
Synonyms: OXADIAZON, Ronstar, Oxadiazone, Oxydiazon, Caswell No. 624A, Oxadiazon [ANSI:BSI:ISO], PS1050_SUPELCO, 33382_RIEDEL, 442729_SUPELCO, HSDB6936, EINECS 243-215-7, HSDB 6936, EPA Pesticide Chemical Code 109001, CID29732, BRN 0558070, RP 17623, G 315, NCGC00163727-01, NCGC00163727-02, NCGC00163727-03

Molecular Formula:	C₁₅H₁₈Cl₂N₂O₃	Molecular Weight:	345.221020 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: CHNUNORXWHYHNE-UHFFFAOYSA-N

• Penconazole

IUPAC Name: 1-[2-(2,4-dichlorophenyl)pentyl]-1,2,4-triazole | CAS Registry Number: 66246-88-6
Synonyms: Topaze, Onmex, Penconazol, Topaze C, Topas C, Topas MZ, Penconazole [BSI:ISO], 36189_RIEDEL, EINECS 266-275-6, CGA 71818, BRN 0541488, NCGC00166157-01, LS-155946, 1-(2-(2,4-Dichlorophenyl)pentyl)-1H-1,2,4-triazole, 5-26-01-00149 (Beilstein Handbook Reference), C087058, 1H-1,2,4-Triazole, 1-(2-(2,4-dichlorophenyl)pentyl)-, 1-(2,4-dichloro-beta-propylphenethyl)-1H-1,2,4-triazole, 1H-1,2,4-Triazole, 1-[2-(2,4-dichlorophenyl)pentyl]-, 87501-25-5

Molecular Formula:	C₁₃H₁₅Cl₂N₃	Molecular Weight:	284.184300 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: WKBPZYKAUNRMKP-UHFFFAOYSA-N

• Picloram

IUPAC Name: 4-amino-3,5,6-trichloropyridine-2-carboxylic acid | CAS Registry Number: 1918-02-1
Synonyms: PICLORAM, Borolin, Tordon, Amdon, Grazon, Amdon grazon, Access, K-Pin, Tordon 10K, Tordon 22K, Tordon 101 mixture, Grazon PC, ATCP, Tordon 2K, Tordon(R), Grazon P+D, Caswell No. 039, Grazon 10K, Tordon 2 K, Piclorame [ISO-French]

Molecular Formula:	C₆H₃Cl₃N₂O₂	Molecular Weight:	241.459220 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: NQQVFXUMIDALNH-UHFFFAOYSA-N

• Propamocarb

IUPAC Name: propyl N-[3-(dimethylamino)propyl]carbamate | CAS Registry Number: 24579-73-5
Synonyms: Propamocarbe, Prevex, PROPAMOCARB, Previcur, Propamocarbe [ISO-French], Nor-AM 39744, Propamocarb [ANSI:BSI:ISO], propamocarb monohydrochloride, 45638_RIEDEL, EPA Pesticide Chemical Code 119302, BRN 2080745, Propyl (3-(dimehylamino)propyl)carbamate, SN 39744, Propyl (3-(dimethylamino)propyl)carbamate, Propyl 3-(dimethylamino)propylcarbamate, NCGC00163874-01, NCGC00163874-02, NCGC00163874-03, LS-49437, C033205

Molecular Formula:	C₉H₂₀N₂O₂	Molecular Weight:	188.267300 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: WZZLDXDUQPOXNW-UHFFFAOYSA-N

• Propanil

IUPAC Name: N-(3,4-dichlorophenyl)propanamide | CAS Registry Number: 709-98-8
Synonyms: propanil, Propanide, Grascide, Propanex, Propanid, Supernox, Surcopur, Dipram, Rogue, Cekupropanil, Propanilo, Riselect, Stampede, Erbanil, Rosanil, Herbax, Montrose propanil, Chem Rice, Synpran N, Erban

Molecular Formula:	C₉H₉Cl₂NO	Molecular Weight:	218.079860 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: LFULEKSKNZEWOE-UHFFFAOYSA-N

• Propiconazole

IUPAC Name: 1-[[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole | CAS Registry Number: 60207-90-1
Synonyms: PROPICONAZOLE, Tilt, Banner, Desmel, Orbit, Radar, Propyconazol, Caswell No. 323EE, Propiconazole solution, Propiconazole [BSI:ISO], PS1075_SUPELCO, Oprea1_008846, Oprea1_352194, HSDB 6731, MLS000525333, C15H17Cl2N3O2, 45642_RIEDEL, 45899_RIEDEL, CGD 92710F, EINECS 262-104-4

Molecular Formula:	C₁₅H₁₇Cl₂N₃O₂	Molecular Weight:	342.220380 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: STJLVHWMYQXCPB-UHFFFAOYSA-N