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5-amino-1-(2,6-dichloro-4-(trifluoromet…
5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-(trifluoromethyl)-1h-pyrazole-3-carbonitrile
  • InChIKey: JWKXVHLIRTVXLD-UHFFFAOYSA-N
  • Compound CID: 22673275
  • Molecular Formula: C12H4Cl2F6N4
5-chloro-n-ethyl-4-hydroxy-n-(4-hydroxy…
5-chloro-n-ethyl-4-hydroxy-n-(4-hydroxyphenyl)-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
  • InChIKey: HBMNTNTZJMZXKP-UHFFFAOYSA-N
  • Compound CID: 154699630
  • Molecular Formula: C19H17ClN2O4
6-oxo-2-hydroxy-7-(4'-chlorophenyl)-3,8…
6-oxo-2-hydroxy-7-(4'-chlorophenyl)-3,8,8,8-tetrachloroocta-2z,4z-dienoate
  • InChIKey: HXBWHTRCTIAYBX-ZGCJARKRSA-M
  • Compound CID: 54675843
  • Molecular Formula: C14H8Cl5O4-
6-oxo-2-hydroxy-7-(4'-chlorophenyl)-3,8…
6-oxo-2-hydroxy-7-(4'-chlorophenyl)-3,8,8-trichloroocta-2z,4z,7-trienoate
  • InChIKey: UTGDEXKGRFRGPM-ZGCJARKRSA-M
  • Compound CID: 54675822
  • Molecular Formula: C14H7Cl4O4-
8-chloro-11-(4-methylpiperazin-1-yl)-5h…
8-chloro-11-(4-methylpiperazin-1-yl)-5h-dibenzo[b,e][1,4]diazepin-7-ol
  • InChIKey: OGZLSMWTACJBSH-UHFFFAOYSA-N
  • Compound CID: 19418676
  • Molecular Formula: C18H19ClN4O
8-chloro-11-(4-methylpiperazin-1-yl)-5h…
8-chloro-11-(4-methylpiperazin-1-yl)-5h-dibenzo[b,e][1,4]diazepin-9-ol
  • InChIKey: YUFIEOIPFQOEAY-UHFFFAOYSA-N
  • Compound CID: 101784622
  • Molecular Formula: C18H19ClN4O
n-hydroxy-3-(4-((2-(6-hydroxy-2-methyl-…
n-hydroxy-3-(4-((2-(6-hydroxy-2-methyl-1h-indol-3-yl)ethylamino)methyl)phenyl)acrylamide
  • InChIKey: YGFAIWRXVGWGFM-RMKNXTFCSA-N
  • Compound CID: 118753342
  • Molecular Formula: C21H23N3O3
n-methyl-2-[(1,7,7-trimethyl-2-phenyl-2…
n-methyl-2-[(1,7,7-trimethyl-2-phenyl-2-bicyclo[2.2.1]heptanyl)oxy]ethanamine
  • InChIKey: KTVWFUOXICTLAW-UHFFFAOYSA-N
  • Compound CID: 9865894
  • Molecular Formula: C19H29NO
(23R)-1alpha,23,25-trihydroxyvitamin D3…
(23R)-1alpha,23,25-trihydroxyvitamin D3/(23R)-1alpha,23,25-trihydroxycholecalciferol
  • InChIKey: NHRGJVVEKNHIIE-PTNHXQMASA-N
  • Compound CID: 5283795
  • Molecular Formula: C27H44O4
(2s)-1-(3-chlorophenyl)-2-[(1-hydroxy-2…
(2s)-1-(3-chlorophenyl)-2-[(1-hydroxy-2-methylpropan-2-yl)amino]propan-1-one
  • InChIKey: AKOAEVOSDHIVFX-VIFPVBQESA-N
  • Compound CID: 9813763
  • Molecular Formula: C13H18ClNO2
(2s,3s,4s,5r)-6-[(4-ethoxyphenyl)carbam…
(2s,3s,4s,5r)-6-[(4-ethoxyphenyl)carbamoylamino]-3,4,5-trihydroxyoxane-2-carboxylic acid
  • InChIKey: NXRTYUWUBFLGLO-GCFWVWJCSA-N
  • Compound CID: 154699830
  • Molecular Formula: C15H20N2O8
(4r)-5-(methoxycarbonyl)-2,6-dimethyl-4…
(4r)-5-(methoxycarbonyl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid
  • InChIKey: JPXPPUOCSLMCHK-CQSZACIVSA-N
  • Compound CID: 748472
  • Molecular Formula: C16H16N2O6
(6-((2-amino-6-chloro-9h-purin-9-yl)met…
(6-((2-amino-6-chloro-9h-purin-9-yl)methyl)-4-methoxy-5-methylpyridin-3-yl)methanol
  • InChIKey: KPMYVWBVTQHIQI-UHFFFAOYSA-N
  • Compound CID: 118753270
  • Molecular Formula: C14H15ClN6O2
(r)-2-(6-carbamoyl-7-methoxyquinolin-4-…
(r)-2-(6-carbamoyl-7-methoxyquinolin-4-ylamino)-3-(6-carbamoyl-7-methoxyquinolin-4-ylthio)propanoic acid
  • InChIKey: KCWOKPSYUUGOBQ-IBGZPJMESA-N
  • Compound CID: 118753341
  • Molecular Formula: C25H23N5O6S
1-(2-[2-chloro-4-(5-fluoro-2-methyl-ben…
1-(2-[2-chloro-4-(5-fluoro-2-methyl-benzoylamino)benzoylamino]-benzyl)-1h-pyrrole-2-carboxylic acid
  • InChIKey: RRGQTZFOQQMAOA-UHFFFAOYSA-N
  • Compound CID: 44433375
  • Molecular Formula: C27H21ClFN3O4
1-(4-methoxy-2-methylphenyl)-6-(trifluo…
1-(4-methoxy-2-methylphenyl)-6-(trifluoromethoxy)-2,3-dihydropyrrolo[3,2-c]quinolin-4-amine
  • InChIKey: XDTHJXLHKIVHAW-UHFFFAOYSA-N
  • Compound CID: 154700079
  • Molecular Formula: C20H18F3N3O2
17î±,21-dihydroxy-pregnan-1,4,6-trien-3…
17î±,21-dihydroxy-pregnan-1,4,6-trien-3,11,30-trione (m-xvii)
  • InChIKey: GEGKXSCVRMKKIM-ZPOLXVRWSA-N
  • Compound CID: 22793136
  • Molecular Formula: C21H24O5
2,3,3,4,4,5,5,6,6,7,7,8,8,8-tetradecafl…
2,3,3,4,4,5,5,6,6,7,7,8,8,8-tetradecafluorooctanoic acid
  • InChIKey: CLSJUWFCSPJRFC-UHFFFAOYSA-N
  • Compound CID: 85651307
  • Molecular Formula: C8H2F14O2
2-[1-(4-chlorobenzoyl)-5-methoxy-2-meth…
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-n-(1-hydroxy-2-phenylethyl)acetamide
  • InChIKey: AIUSZASLWVMSGU-UHFFFAOYSA-N
  • Compound CID: 154699481
  • Molecular Formula: C27H25ClN2O4
2-[1-(4-chlorobenzoyl)-5-methoxy-2-meth…
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-n-(2-hydroxy-2-phenylethyl)acetamide
  • InChIKey: AOIQKSHKQIJFMK-UHFFFAOYSA-N
  • Compound CID: 10480135
  • Molecular Formula: C27H25ClN2O4
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Funding support from the European Union’s Horizon 2020 research and innovation program under Grant Agreement No. 101036756 for project “ZeroPM: Zero pollution of persistent, mobile substances”

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