1 D3U 2-pcpa derivative 1.000 2 FA9 [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-[(3r,3as,7ar)-10,11-dimethyl-1,4,6-trioxo-3-phenyl-2,3,5,6,7,7a-hexahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate 0.984 3 FAJ Fad-trans-2-phenylcyclopropylamine adduct 0.984 4 A1IG2 Bomedemstat FAD adduct 0.969 5 D51 [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-[(1r,3s,3as,7as)-1-amino-1,10,11-trimethyl-4,6-dioxo-3-phenyl-2,3,5,6,7,7a-hexahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate 0.969 6 XRK Methyl 3-{(1r,3s,3as,13r)-8-[(2s,3s,4r)-5-{[(S)-{[(S)-{[(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-2,3,4-trihydroxypentyl]-1-hydroxy-10,11-dimethyl-4,6-dioxo-2,3,4,5,6,8-hexahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-3-yl}benzoate (non-preferred name) 0.925 7 ZSI [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2r,3s,4s)-2,3,4-trihydroxy-5-[(1r,3s,3as,13r)-1-hydroxy-10,11-dimethyl-3-[3-(methylcarbamoyl)phenyl]-4,6-dioxo-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]pentyl dihydrogen diphosphate (non-preferred name) 0.925 8 2PF [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-2,3,4-trihydroxy-5-[(1r,3r,3as)-1-hydroxy-10,11-dimethyl-4,6-dioxo-3-(pentafluorophenyl)-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]pentyl dihydrogen diphosphate 0.912 9 YAF [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2r,3s,4s)-5-[(1r,3s,3as,13r)-3-[3-(dimethylcarbamoyl)phenyl]-1-hydroxy-10,11-dimethyl-4,6-dioxo-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate (non-preferred name) 0.912 10 XB3 [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2r,3s,4s)-5-[(1r,3s,3as,13r)-3-([1,1'-biphenyl]-4-yl)-1-hydroxy-10,11-dimethyl-4,6-dioxo-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate (non-preferred name) 0.899 11 FCG (n5,c4a)-(alpha-hydroxy-propano)-3,4,4a,5-tetrahydro-flavin-adenine dinucleotide 0.889 12 UJG [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-{7,8-dimethyl-2,4-dioxo-5-[(2r)-tetrahydrothiophen-2-yl]-1,3,4,5-tetrahydrobenzo[G]pteridin-10(2h)-yl}-2,3,4-trihydroxypentyl dihydrogen diphosphate (non-preferred name) 0.875 13 12F [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-[(1r,3r,3as)-3-[2-(benzyloxy)-3-fluorophenyl]-1-hydroxy-10,11-dimethyl-4,6-dioxo-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate 0.861 14 XHT [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2s,3r,4s)-2,3,4-trihydroxy-5-[(1r,3r,3as,13r)-1-hydroxy-10,11-dimethyl-3-{3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl}-4,6-dioxo-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]pentyl dihydrogen diphosphate (non-preferred name) 0.861 15 XZQ [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2r,3s,4s)-2,3,4-trihydroxy-5-[(1r,3r,3as,13r)-1-hydroxy-10,11-dimethyl-4,6-dioxo-3-[3-(phenylcarbamoyl)phenyl]-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]pentyl dihydrogen diphosphate 0.861 16 Y66 [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2s,3r,4r)-2,3,4-trihydroxy-5-[(1r,3s,3as,13r)-1-hydroxy-10,11-dimethyl-3-{4-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl}-4,6-dioxo-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]pentyl dihydrogen diphosphate 0.861 17 YAO [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2r,3s,4s)-5-[(1r,3s,3as,13r)-3-(3-benzamidophenyl)-1-hydroxy-10,11-dimethyl-4,6-dioxo-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate (non-preferred name) 0.861 18 FA8 [[(2r,3s,4s)-5-[(4as)-7,8-dimethyl-2,4-dioxo-4a,5-dihydrobenzo[G]pteridin-10-yl]-2,3,4-trihydroxy-pentoxy]-hydroxy-phosphoryl] [(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl hydrogen phosphate 0.855 19 FAD Flavin-adenine dinucleotide 0.855 20 FAE Flavin-n7 protonated-adenine dinucleotide 0.855 21 FAO [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-[(4as,10ar)-7,8-dimethyl-2,4-dioxo-1,3,4,4a,5,10a-hexahydrobenzo[G]pteridin-10(2h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate 0.855 22 FAS Arabino-flavin-adenine dinucleotide 0.855 23 FDA Dihydroflavine-adenine dinucleotide 0.855 24 6FA 6-hydroxy-flavin-adenine dinucleotide 0.841 25 FAY [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-(8-formyl-7-methyl-2,4-dioxo-3,4-dihydrobenzo[G]pteridin-10(2h)-yl)-2,3,4-trihydroxypentyl dihydrogen diphosphate 0.841 26 FED [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-2,3,4-trihydroxy-5-[(4ar)-4a-hydroxy-7,8-dimethyl-2,4-dioxo-3,4,4a,5-tetrahydrobenzo[G]pteridin-10(2h)-yl]pentyl dihydrogen diphosphate (non-preferred name) 0.841 27 A1AT4 (2~{S},5~{R})-5-[10-[(2~{S},3~{S},4~{R})-5-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-2,3,4-tris(oxidanyl)pentyl]-7,8-dimethyl-2,4-bis(oxidanylidene)benzo[G]pteridin-5-yl]pyrrolidine-2-carboxylic acid 0.836 28 HUF [[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2r,3s,4s)-5-[5-methanoyl-7,8-dimethyl-2,4-bis(oxidanylidene)-1h-benzo[G]pteridin-10-yl]-2,3,4-tris(oxidanyl)pentyl] hydrogen phosphate 0.828 29 Y9K [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2r,3s,4s)-2,3,4-trihydroxy-5-[(1r,3s,3as,13r)-1-hydroxy-10,11-dimethyl-4,6-dioxo-3-([1~1~,2~1~:2~3~,3~1~-terphenyl]-1~4~-yl)-2,3,5,6-tetrahydro-1h-benzo[G]pyrrolo[2,1-E]pteridin-8(4h)-yl]pentyl dihydrogen diphosphate (non-preferred name) 0.827 30 62F [[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{S})-5-[5-[(2~{R},3~{R},4~{S},5~{R},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-7,8-dimethyl-2,4-bis(oxidanyl)benzo[G]pteridin-10-yl]-2,3,4-tris(oxidanyl)pentyl] hydrogen phosphate 0.826 31 UJJ [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-[5-(1,3-dithiolan-2-yl)-7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[G]pteridin-10(2h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate 0.818 32 P5F N-propargylglycine-modified flavin adenine dinucleotide 0.815 33 FSH (2r,3s,4s)-5-[(4r)-6',7'-dimethyl-2,3',5-trioxo-1'H-spiro[imidazolidine-4,2'-quinoxalin]-4'(3'H)-yl]-2,3,4-trihydroxypentyl-adenosine diphosphate 0.812 34 SFD (S)-10-((2s,3s,4r)-5-((S)-((S)-(((2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryloxy)(hydroxy)phosphoryloxy)-2,3,4-trihydroxypentyl)-7,8-dimethyl-2,4-dioxo-2,3,4,4a-tetrahydrobenzo[G]pteridine-5(10h)-sulfonic acid 0.803 35 RFL 8-demethyl-8-dimethylamino-flavin-adenine-dinucleotide 0.800 36 FAB Flavin-adenine dinucleotide-n5-isobutyl ketone 0.791 37 FNK [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-[7,8-dimethyl-5-(3-methylbutanoyl)-2,4-dioxo-1,3,4,5-tetrahydrobenzo[G]pteridin-10(2h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate 0.779 38 UBG [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[G]pteridin-10(2h)-yl)-2,3,4-trihydroxypentyl dihydrogen diphosphate (non-preferred name) 0.776 39 FAA N5-(4-hydroxybenzyl)flavin-adenine dinucleotide 0.757 40 KXM [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3r,4r)-5-[(4ar)-7,8-dimethyl-2,4-dioxo-5-(2-phenylethyl)-3,4,4a,5-tetrahydrobenzo[G]pteridin-10(2h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate (non-preferred name) 0.757 41 4R2 [[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{S})-5-[5-[(~{E})-4-carbamimidamidobut-2-enoyl]-7,8-dimethyl-2,4-bis(oxidanylidene)-1~{H}-benzo[G]pteridin-10-yl]-2,3,4-tris(oxidanyl)pentyl] hydrogen phosphate 0.746 42 A1BC6 {[(3e)-4-{10-[(2s,3s,4r)-5-{[(R)-{[(R)-{[(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]oxy}-2,3,4-trihydroxypentyl]-7,8-dimethyl-2,4-dioxo-2,3,4,10-tetrahydrobenzo[G]pteridin-5(1h)-yl}but-3-en-2-ylidene]amino}acetic acid (non-preferred name) 0.746 43 F2N [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-5-[7,8-dimethyl-2,4-dioxo-5-(3-phenylpropanoyl)-1,3,4,5-tetrahydrobenzo[G]pteridin-10(2h)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate 0.736 44 D73 [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-2,3,4-trihydroxy-5-[(4as)-4a-[(1s,3e)-3-imino-1-phenylbutyl]-7,8-dimethyl-2,4-dioxo-3,4,4a,5-tetrahydrobenzo[G]pteridin-10(2h)-yl]pentyl dihydrogen diphosphate 0.726 45 D70 [(2r,3s,4r,5r)-5-(6-amino-9h-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2r,3s,4s)-2,3,4-trihydroxy-5-[(4as,10as)-4a-[(1s,3e)-3-imino-1-phenylpentyl]-7,8-dimethyl-2,4-dioxo-1,3,4,4a,5,10a-hexahydrobenzo[G]pteridin-10(2h)-yl]pentyl dihydrogen diphosphate 0.716 46 I7I [[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{S})-5-[5-[(1~{R})-1-(3-methoxy-4-oxidanyl-phenyl)propyl]-7,8-dimethyl-2,4-bis(oxidanylidene)-1~{H}-benzo[G]pteridin-10-yl]-2,3,4-tris(oxidanyl)pentyl] hydrogen phosphate 0.716