0 B18R2.16852 NC1=NC(=O)C=CN1[C@@H]2O[C@H](CO)[C@H](O)[C@H]2F Amb22899806 [0,0,0,0,0,0|4,0,0]=4 1 B18R2.16852 NC1=NC(=O)N(C=N1)C2OC(CO)C(O)C2O Amb19654023 [0,0,0,0,0,0|0,0,0]=0 2 B18R2.16852 NC1=NC(=O)N(C=N1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O Amb20240535 [0,0,0,0,0,0|0,0,0]=0 3 B18R2.16852 NC1=NC(=O)N(C=N1)[C@@H]2O[C@H](CO)[C@H](O)C2O Amb19130595 [0,0,0,0,0,0|0,0,0]=0 4 B18R2.16852 NC=1C=CN(C2OC(CO)C(O)C2F)C(=O)N1 Amb20247305 [0,0,0,0,0,0|2,0,0]=2 5 B18R2.16852 NC=1C=CN(C2OC(CO)C(O)C2O)C(=O)N1 Amb19737280 [0,0,0,0,0,0|1,0,0]=1 6 B18R2.16852 NC=1C=CN(C2OC(CO)C(O)C2O)C(=O)N1 Amb20659788 [0,0,0,0,0,0|1,0,0]=1 7 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)C(O)C2O)C(=O)N1 Amb21956130 [0,0,0,0,0,0|1,0,0]=1 8 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)C(O)C2O)C(=O)N1 Amb22800495 [0,0,0,0,0,0|1,0,0]=1 9 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)C(O)C2O)C(=S)N1 Amb22799708 [0,0,0,0,0,0|1,1,0]=2 10 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)C(O)[C@H]2O)C(=O)N1 Amb19131368 [0,0,0,0,0,0|1,0,0]=1 11 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](F)[C@H]2O)C(=O)N1 Amb22745738 [0,0,0,0,0,0|2,0,0]=2 12 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F)C(=O)N1 Amb22747195 [0,0,0,0,0,0|2,0,0]=2 13 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)C(=O)N1 Amb19516151 [0,0,0,0,0,0|1,0,0]=1 14 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)C(=O)N1 Amb20240612 [0,0,0,0,0,0|1,0,0]=1 15 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2Cl)C(=O)N1 Amb22168433 [0,0,0,0,0,0|2,0,0]=2 16 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2F)C(=O)N1 Amb19515760 [0,0,0,0,0,0|2,0,0]=2 17 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2F)C(=O)N1 Amb22899415 [0,0,0,0,0,0|2,0,0]=2 18 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2N)C(=O)N1 Amb22745390 [0,0,0,0,0,0|2,0,0]=2 19 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N1 Amb20240536 [0,0,0,0,0,0|1,0,0]=1 20 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N1 Amb22801147 [0,0,0,0,0,0|1,0,0]=1 21 B18R2.16852 NC=1C=CN([C@@H]2O[C@H](CO)[C@H](O)C2O)C(=O)N1 Amb19131372 [0,0,0,0,0,0|1,0,0]=1 22 B18R2.16852 NC=1C=CN([C@@H]2S[C@H](CO)[C@@H](O)[C@@H]2O)C(=O)N1 Amb24076379 [0,0,0,0,0,0|1,1,0]=2 23 B18R2.16852 NC=1C=NN(C2OC(CO)C(O)C2O)C(=O)N1 Amb19115431 [0,0,0,0,0,0|2,0,0]=2 24 B18R2.16852 NC=1C=NN([C@@H]2O[C@H](CO)C(O)C2O)C(=O)N1 Amb22800465 [0,0,0,0,0,0|2,0,0]=2 25 B18R2.16852 NC=1N=CN([C@@H]2O[C](CO)[C](O)[C]2O)C(=O)N1 Amb22801287 [0,0,0,0,0,0|0,0,3]=3 26 B18R2.16852 NC=1NC=C([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N1 Amb22168869 [0,0,0,0,0,0|1,0,1]=2 27 B18R2.16852 N[13C]=1[13CH]=[13CH]N([C@@H]2O[C@H](CO)C(O)[C@H]2O)C(=O)N1 Amb19131369 [0,0,0,0,0,0|1,0,0]=1 28 B18R2.16852 N[C@@H]1[C@H](O[C@@H](CO)[C@@H]1O)N2C=CC(=O)NC2=O Amb22745392 [0,0,0,0,0,0|3,0,1]=4 29 B18R2.16852 OC1C(F)C(OC1CO)N2C=CC(=O)NC2=O Amb20247304 [0,0,0,0,0,0|3,0,1]=4 30 B18R2.16852 OC1C(OC(CO)C1O)N2C=CC(=O)NC2=S Amb22470686 [0,0,0,0,0,0|2,1,1]=4 31 B18R2.16852 OC1[C@@H](O[C@H](CO)C1O)N2C=CC(=O)NC2=S Amb22800109 [0,0,0,0,0,0|2,1,1]=4 32 B18R2.16852 OC1[C@@H](O[C@H](CO)[C@@H]1O)N2C=CC(=O)NC2=S Amb19134067 [0,0,0,0,0,0|2,1,1]=4 33 B18R2.16852 OC=1C=CN(C2OC(CO)C(O)C2O)C(=S)N1 Amb19814039 [0,0,0,0,0,0|2,1,0]=3 34 B18R2.16852 OC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)C1 Amb22475167 [0,0,0,0,0,0|3,0,0]=3 35 B18R2.16852 OCC1OC(C(C1O)Br)n2ccc(=O)[nH]c2=O Amb16203734 [0,0,0,0,0,0|3,0,1]=4 36 B18R2.16852 OCC1OC(C(C1O)O)n2cnc(nc2=O)N Amb16226865 [0,0,0,0,0,0|0,0,0]=0 37 B18R2.16852 OCC1OC(C(C1O)O)n2ncc(nc2=O)N Amb1269348 [0,0,0,0,0,0|2,0,0]=2 38 B18R2.16852 OCC1OC(C(O)C1O)N2C=CC(=O)NC2=O Amb19748304 [0,0,0,0,0,0|2,0,1]=3 39 B18R2.16852 OCC1OC(C(O)C1O)N2C=CC(=S)NC2=O Amb21855911 [0,0,0,0,0,0|2,0,1]=3 40 B18R2.16852 OCC1OC(C(O)C1O)N2N=CC(=O)NC2=O Amb20665330 [0,0,0,0,0,0|3,0,1]=4 41 B18R2.16852 OCC1OC([C@@H](O)[C@H]1O)N2N=CC(=O)NC2=O Amb23479090 [0,0,0,0,0,0|3,0,1]=4 42 B18R2.16852 OC[C@@H]1O[C@@H](C(O)C1O)N2C=CC(=O)CC2=O Amb22800236 [0,0,0,0,0,0|3,0,0]=3 43 B18R2.16852 OC[C@@H]1O[C@@H](C(O)C1O)N2C=CC(=S)NC2=O Amb22799762 [0,0,0,0,0,0|2,0,1]=3 44 B18R2.16852 OC[C@@H]1O[C@@H](C(O)C1O)N2CCC(=O)NC2=O Amb22801040 [0,0,0,0,0,0|2,0,2]=4 45 B18R2.16852 OC[C@@H]1O[C@@H](C(O)[C@@H]1O)N2C=CC(=S)NC2=S Amb19132031 [0,0,0,0,0,0|2,1,1]=4 46 B18R2.16852 OC[C@@H]1O[C@@H]([C@@H](O)C1O)N2C=CC(=O)NC2=O Amb19130570 [0,0,0,0,0,0|2,0,1]=3 47 B18R2.16852 OC[C@@H]1O[C@@H]([C@@H](O)C1O)[15N]2C=CC(=O)[15NH][13C]2=O Amb19130571 [0,0,0,0,0,0|2,0,1]=3 48 B18R2.16852 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C2=CNC(=O)NC2=O Amb22748711 [0,0,0,0,0,0|2,0,2]=4 49 B18R2.16852 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2C=CC(=O)NC2=O Amb22752781 [0,0,0,0,0,0|2,0,1]=3 50 B18R2.16852 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2N=CC(=O)NC2=O Amb22746177 [0,0,0,0,0,0|3,0,1]=4 51 B18R2.16852 OC[C@@H]1O[C@@H]([C@H]([C@H]1O)O)n2ccc(=O)[nH]c2=O Amb16202942 [0,0,0,0,0,0|2,0,1]=3 52 B18R2.16852 OC[C@@H]1O[C@H]([C@@H](O)[C@H]1O)N2C=CC(=O)NC2=O Amb22746465 [0,0,0,0,0,0|2,0,1]=3 53 B18R2.16852 OC[C@H]1OC([C@@H](O)[C@@H]1O)n2ccc(=O)[nH]c2=O Amb17943009 [0,0,0,0,0,0|2,0,1]=3 54 B18R2.16852 OC[C@H]1O[C@@H]([C@H]([C@H]1O)O)n2ccc(nc2=O)N Amb10072313 [0,0,0,0,0,0|1,0,0]=1 55 B18R2.16852 OC[C@H]1O[C@H]([C@@H](O)[C@@H]1O)N2C=CC(=O)NC2=O Amb20240610 [0,0,0,0,0,0|2,0,1]=3 56 B18R2.16852 OC[C@H]1O[C@H]([C@@H]([C@@H]1O)Br)n2ccc(=O)[nH]c2=O Amb16234209 [0,0,0,0,0,0|3,0,1]=4 57 B18R2.16852 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)C2=CNC(=O)NC2=O Amb22504492 [0,0,0,0,0,0|2,0,2]=4 58 B18R2.16852 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=CC(=O)NC2=O Amb20242382 [0,0,0,0,0,0|2,0,1]=3 59 B18R2.16852 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2CCC(=O)NC2=O Amb24076368 [0,0,0,0,0,0|2,0,2]=4 60 B18R2.16852 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2N=CC(=O)NC2=O Amb22352507 [0,0,0,0,0,0|3,0,1]=4 61 B18R2.16852 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)[n]2c[n]c(=O)[nH]c2=O Amb24066389 [0,0,0,0,0,0|1,0,1]=2 62 B18R2.16852 OC[C@H]1O[C@H]([C@H]([C@@H]1O)F)n2ccc(nc2=O)N Amb10603741 [0,0,0,0,0,0|2,0,0]=2 63 B18R2.16852 O[C@@H]1[C@@H](F)[C@H](O[C@H]1CO)N2C=CC(=O)NC2=O Amb22746199 [0,0,0,0,0,0|3,0,1]=4 64 B18R2.16852 O[C@@H]1[C@H](F)[C@@H](CO)O[C@H]1[n]2ccc(=O)[nH]c2=O Amb24087357 [0,0,0,0,0,0|3,0,1]=4 65 B18R2.16852 O[C@@H]1[C@H](F)[C@H](O[C@H]1CO)N2C=CC(=O)NC2=O Amb22745014 [0,0,0,0,0,0|3,0,1]=4 66 B18R2.16852 O[C@H]1[C@@H](Cl)[C@@H](O[C@@H]1CO)N2C=CC(=O)NC2=O Amb22168432 [0,0,0,0,0,0|3,0,1]=4 67 B18R2.16852 O[C@H]1[C@@H](F)[C@@H](O[C@@H]1CO)N2C=CC(=O)NC2=O Amb20240756 [0,0,0,0,0,0|3,0,1]=4 68 B18R2.16852 [15NH2]C1=[15N]C(=O)[15N](C=[15N]1)[C@@H]2O[C@H](CO)[C@H](O)C2O Amb19130596 [0,0,0,0,0,0|0,0,0]=0 69 B17R2.10947 NC1=NC(=O)N(C=N1)[C@@H]2C[C@H](O)[C@H](CO)O2 Amb19130602 [1,0,0,0,0,0|0,0,0]=1 70 B17R2.10947 NC1=NC(=O)N(C=N1)[C@H]2C[C@H](O)[C@@H](CO)O2 Amb20240580 [1,0,0,0,0,0|0,0,0]=1 71 B17R2.10947 NC=1C=CN(C2CC(O)C(CO)O2)C(=O)N1 Amb18363428 [1,0,0,0,0,0|1,0,0]=2 72 B17R2.10947 NC=1C=CN(C2CC(O)C(CO)O2)C(=O)N1 Amb20665332 [1,0,0,0,0,0|1,0,0]=2 73 B17R2.10947 NC=1C=CN([C@@H]2CC(O)[C@H](CO)O2)C(=O)N1 Amb22800681 [1,0,0,0,0,0|1,0,0]=2 74 B17R2.10947 NC=1C=CN([C@@H]2CC(O)[C@H](CO)O2)C(=O)N1 Amb22801762 [1,0,0,0,0,0|1,0,0]=2 75 B17R2.10947 NC=1C=CN([C@@H]2C[C@@H](O)[C@H](CO)O2)C(=O)N1 Amb24273748 [1,0,0,0,0,0|1,0,0]=2 76 B17R2.10947 NC=1C=CN([C@@H]2C[C@H](O)[C@@H](CO)O2)C(=O)N1 Amb22752774 [1,0,0,0,0,0|1,0,0]=2 77 B17R2.10947 NC=1C=CN([C@@H]2C[C@H](O)[C@H](CO)O2)C(=O)N1 Amb19131511 [1,0,0,0,0,0|1,0,0]=2 78 B17R2.10947 NC=1C=CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)N1 Amb20240537 [1,0,0,0,0,0|1,0,0]=2 79 B17R2.10947 NC=1C=CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)N1 Amb22348235 [1,0,0,0,0,0|1,0,0]=2 80 B17R2.10947 NC=1C=C[15N]([C@@H]2C[C@H](O)[C@H](CO)O2)[13C](=O)[15N]1 Amb19131512 [1,0,0,0,0,0|1,0,0]=2 81 B17R2.10947 OC=1C=CN(C2CC(O)C(CO)O2)C(=O)N1 Amb19803066 [1,0,0,0,0,0|2,0,0]=3 82 B17R2.10947 OCC1OC(CC1O)n2ccc(nc2=O)[NH3+] Amb10553761 [1,0,0,0,0,0|1,0,1]=3 83 B17R2.10947 OC[C@@H]1O[C@@H](C[C@H]1O)n2ccc(=O)[nH]c2=O Amb17938049 [1,0,0,0,0,0|2,0,1]=4 84 B17R2.10947 OC[C@H]1O[C@H](C[C@@H]1N)n2ccc(nc2=O)N Amb16232202 [1,0,0,0,0,0|2,0,0]=3 85 B17R2.10947 O[C@@H]1C[C@@H](O[C@@H]1CO)N2C=CC(=O)NC2=O Amb19131571 [1,0,0,0,0,0|2,0,1]=4 86 B17R2.10947 O[C@@H]1C[C@@H](O[C@@H]1CO)[15N]2C=CC(=O)[15NH][13C]2=O Amb19131572 [1,0,0,0,0,0|2,0,1]=4 87 B17R2.10947 O[C@@H]1C[C@@H](O[C@H]1CO)N2C=CC(=O)NC2=O Amb22752775 [1,0,0,0,0,0|2,0,1]=4 88 B17R2.10947 O[C@H]1C[C@@H](O[C@@H]1CO)N2C=CC(=O)NC2=O Amb20240532 [1,0,0,0,0,0|2,0,1]=4 89 B17R2.11225 OC[C@@H]1O[C@@H](C(O)[C@@H]1O)N2C=CC=NC2=O Amb19134283 [1,0,0,0,0,0|1,0,0]=2 90 B17R2.11225 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=CC=NC2=O Amb22337524 [1,0,0,0,0,0|1,0,0]=2 91 B17R2.42524 C[C@@H]1O[C@@H](C(O)[C@@H]1O)N2C=CC(=O)NC2=O Amb19131573 [1,0,0,0,0,0|2,0,1]=4 92 B17R2.42524 C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2C=CC(=O)NC2=O Amb22746979 [1,0,0,0,0,0|2,0,1]=4 93 B17R2.61232 NC1=NC(=O)C=CN1C2OC(CC2O)CO Amb22734335 [1,0,0,0,0,0|3,0,0]=4 94 B17R2.61232 OC1CC(CO)OC1N2C=CC(=O)NC2=O Amb22734334 [1,0,0,0,0,0|2,0,1]=4 95 B19R2.24751 CN1C(=N)C=CN(C2OC(CO)C(O)C2O)C1=O Amb19133101 [0,1,0,0,0,0|1,0,2]=4 96 B19R2.24751 CN1C(=N)C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1=O Amb22349799 [0,1,0,0,0,0|1,0,2]=4 97 B19R2.24751 CN1C(=O)N(C=CC1=N)[C@@H]2O[C@H](CO)C(O)C2O Amb22800181 [0,1,0,0,0,0|1,0,2]=4 98 B19R2.24751 CN1C(=O)N(C=CC1=O)[C@@H]2O[C@H](CO)C(O)C2O Amb22800173 [0,1,0,0,0,0|2,0,1]=4 99 B19R2.24751 C[n]1c(=O)[n](ccc1=O)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O Amb22233162 [0,1,0,0,0,0|2,0,1]=4 100 B19R2.285965 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2C(I)=CC(=O)NC2=O Amb22746524 [0,1,0,0,0,0|2,0,1]=4 101 B19R2.1626356 COC1C(CO)OC(C1O)N2C=CC(=O)NC2=O Amb22349595 [0,1,0,0,0,0|2,0,1]=4 102 B19R2.1626356 COC1[C@@H](CO)O[C@H](C1O)N2C=CC(=O)NC2=O Amb22801156 [0,1,0,0,0,0|2,0,1]=4 103 B19R2.1626356 COC1[C@@H](CO)O[C@H](C1O)N2C=CC(N)=NC2=O Amb22800136 [0,1,0,0,0,0|1,0,0]=2 104 B19R2.1626547 COC1C(OC(CO)C1O)N2C=CC(=O)NC2=O Amb19133307 [0,1,0,0,0,0|2,0,1]=4 105 B19R2.1626547 COC1C(OC(CO)C1O)N2C=CC(N)=NC2=O Amb19133099 [0,1,0,0,0,0|1,0,0]=2 106 B19R2.1626547 CO[C@@H]1[C@H](O)[C@H](O[C@H]1n2ccc(=O)[nH]c2=O)CO Amb15693008 [0,1,0,0,0,0|2,0,1]=4 107 B19R2.1626547 CO[C@@H]1[C@H](O[C@@H](CO)[C@@H]1O)N2C=CC(N)=NC2=O Amb22745169 [0,1,0,0,0,0|1,0,0]=2 108 B19R2.1626547 CO[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C=CC(=O)NC2=O Amb22736064 [0,1,0,0,0,0|2,0,1]=4 109 B19R2.1626547 CO[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C=CC(N)=NC2=O Amb20242958 [0,1,0,0,0,0|1,0,0]=2 110 B19R2.1626584 CC1(O)C(OC(CO)C1O)N2C=CC(N)=NC2=O Amb19133100 [0,1,0,0,0,0|1,0,0]=2 111 B19R2.1626584 C[C@@]1(F)[C@H](O[C@@H](CO)[C@@H]1O)N2C=CC(N)=NC2=O Amb22746044 [0,1,0,0,0,0|2,0,0]=3 112 B19R2.1626584 C[C@@]1(O)[C@H](O[C@@H](CO)[C@@H]1O)N2C=CC(=O)NC2=O Amb22746771 [0,1,0,0,0,0|2,0,1]=4 113 B19R2.1626584 C[C@@]1(O)[C@H](O[C@@H](CO)[C@@H]1O)N2C=CC(N)=NC2=O Amb22745455 [0,1,0,0,0,0|1,0,0]=2 114 B19R2.1626584 C[C@]1(O)[C@@H](O[C@H](CO)[C@H]1O)N2C=CC(N)=NC2=O Amb22169565 [0,1,0,0,0,0|1,0,0]=2 115 B19R2.1626584 NC=1C=CN(C2OC(CO)C(O)C2(F)F)C(=O)N1 Amb20240908 [0,1,0,0,0,0|2,0,0]=3 116 B19R2.1626584 NC=1C=CN(C2OC(CO)C(O)C2(F)F)C(=O)N1 Amb22265017 [0,1,0,0,0,0|2,0,0]=3 117 B19R2.1626584 NC=1C=CN([C@@H]2O[C@@H](CO)[C@@H](O)C2(F)F)C(=O)N1 Amb19132108 [0,1,0,0,0,0|2,0,0]=3 118 B19R2.1626584 NC=1C=CN([C@@H]2O[C@H](CO)C(O)C2(F)F)C(=O)N1 Amb19132110 [0,1,0,0,0,0|2,0,0]=3 119 B19R2.1626584 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)C(=O)N1 Amb19929377 [0,1,0,0,0,0|2,0,0]=3 120 B19R2.1626584 NC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)C(=O)N1 Amb20240741 [0,1,0,0,0,0|2,0,0]=3 121 B19R2.1626584 NC=1C=CN([C@@H]2O[C@H](CO)[C@H](O)C2(F)F)C(=O)N1 Amb19132445 [0,1,0,0,0,0|2,0,0]=3 122 B19R2.1626584 NC=1C=C[15N]([C@@H]2O[C@@H](CO)[C@@H](O)C2(F)F)[13C](=O)[15N]1 Amb19132109 [0,1,0,0,0,0|2,0,0]=3 123 B19R2.1626584 NC=1C=C[15N]([C@@H]2O[C@H](CO)[C@H](O)C2(F)F)[13C](=O)[15N]1 Amb19132446 [0,1,0,0,0,0|2,0,0]=3 124 B19R2.1646569 CNC=1C=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N1 Amb22746396 [0,1,0,0,0,0|1,0,0]=2 125 B19R2.1646569 NNC=1C=CN(C2OC(CO)C(O)C2O)C(=O)N1 Amb21935644 [0,1,0,0,0,0|1,0,0]=2 126 B19R2.3613666 CC1=CN(C2OC(CO)C(O)C2O)C(=O)NC1=O Amb20246757 [0,1,0,0,0,0|2,0,1]=4 127 B19R2.3613666 CC1=CN([C@@H]2O[C@H](CO)C(O)C2O)C(=O)NC1=O Amb22799830 [0,1,0,0,0,0|2,0,1]=4 128 B19R2.3613666 CC1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N=C1N Amb19930491 [0,1,0,0,0,0|1,0,0]=2 129 B19R2.3613666 CC1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)NC1=O Amb20240534 [0,1,0,0,0,0|2,0,1]=4 130 B19R2.3613666 CC1=CN([C@@H]2O[C@H](CO)[C@H](O)C2O)C(=O)NC1=O Amb19133305 [0,1,0,0,0,0|2,0,1]=4 131 B19R2.3613666 N=C1NC(=O)N(C=C1F)[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O Amb22800755 [0,1,0,0,0,0|1,0,2]=4 132 B19R2.3613666 NC1=CN(C2OC(CO)C(O)C2O)C(=O)NC1=O Amb20029978 [0,1,0,0,0,0|2,0,1]=4 133 B19R2.3613666 NC1=CN([C@@H]2O[C@H](CO)[C@H](O)C2O)C(=O)NC1=O Amb19130501 [0,1,0,0,0,0|2,0,1]=4 134 B19R2.3613666 NC1=NC(=O)N(C=C1Br)C2OC(CO)C(O)C2O Amb19802399 [0,1,0,0,0,0|1,0,0]=2 135 B19R2.3613666 NC1=NC(=O)N(C=C1Br)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O Amb22746197 [0,1,0,0,0,0|1,0,0]=2 136 B19R2.3613666 NC1=NC(=O)N(C=C1Cl)C2OC(CO)C(O)C2O Amb22350112 [0,1,0,0,0,0|1,0,0]=2 137 B19R2.3613666 NC1=NC(=O)N(C=C1Cl)[C@@H]2O[C@H](CO)C(O)[C@@H]2O Amb19131201 [0,1,0,0,0,0|1,0,0]=2 138 B19R2.3613666 NC1=NC(=O)N(C=C1F)C2OC(CO)C(O)C2O Amb20621268 [0,1,0,0,0,0|1,0,0]=2 139 B19R2.3613666 NC1=NC(=O)N(C=C1F)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O Amb19883992 [0,1,0,0,0,0|1,0,0]=2 140 B19R2.3613666 NC1=NC(=O)N(C=C1F)[C@@H]2O[C@H](CO)[C@H](O)C2O Amb19132345 [0,1,0,0,0,0|1,0,0]=2 141 B19R2.3613666 NC1=NC(=O)N(C=C1I)[C@@H]2O[C@H](CO)C(O)[C@@H]2O Amb19132791 [0,1,0,0,0,0|1,0,0]=2 142 B19R2.3613666 NC1=NC(=O)N(C=C1I)[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F Amb20240738 [0,1,0,0,0,0|2,0,0]=3 143 B19R2.3613666 NC1=NC(=O)N(C=C1I)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O Amb20242410 [0,1,0,0,0,0|1,0,0]=2 144 B19R2.3613666 Nc1c[n]([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O Amb24089241 [0,1,0,0,0,0|2,0,1]=4 145 B19R2.3613666 OC1=CN([C@@H]2O[C@H](CO)C(O)C2O)C(=O)NC1=O Amb22801765 [0,1,0,0,0,0|2,0,1]=4 146 B19R2.3613666 OC1=NC(=O)N(C=C1F)C2OC(CO)C(O)C2O Amb19803174 [0,1,0,0,0,0|2,0,0]=3 147 B19R2.3613666 OCC1OC(C(O)C1O)N2C=C(Br)C(=O)NC2=O Amb19769744 [0,1,0,0,0,0|2,0,1]=4 148 B19R2.3613666 OCC1OC(C(O)C1O)N2C=C(Cl)C(=O)NC2=O Amb20247302 [0,1,0,0,0,0|2,0,1]=4 149 B19R2.3613666 OCC1OC(C(O)C1O)N2C=C(F)C(=O)NC2=O Amb20246817 [0,1,0,0,0,0|2,0,1]=4 150 B19R2.3613666 OCC1OC(C(O)C1O)N2C=C(I)C(=O)NC2=O Amb20661490 [0,1,0,0,0,0|2,0,1]=4 151 B19R2.3613666 OCC1OC(C(O)C1O)N2C=C(O)C(O)=NC2=O Amb19803064 [0,1,0,0,0,0|2,0,0]=3 152 B19R2.3613666 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2C=C(Br)C(=O)NC2=O Amb22745337 [0,1,0,0,0,0|2,0,1]=4 153 B19R2.3613666 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2C=C(Cl)C(=O)NC2=O Amb22746246 [0,1,0,0,0,0|2,0,1]=4 154 B19R2.3613666 OC[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2C=C(F)C(=O)NC2=O Amb24273742 [0,1,0,0,0,0|2,0,1]=4 155 B19R2.3613666 OC[C@@H]1O[C@@H]([C@H](O)C1O)N2C=C(Cl)C(=O)NC2=O Amb19131261 [0,1,0,0,0,0|2,0,1]=4 156 B19R2.3613666 OC[C@@H]1O[C@@H]([C@H](O)C1O)N2C=C(F)C(=O)NC2=O Amb19132366 [0,1,0,0,0,0|2,0,1]=4 157 B19R2.3613666 OC[C@@H]1O[C@@H]([C@H](O)C1O)[15N]2C=C(F)C(=O)[15NH][13C]2=O Amb19132367 [0,1,0,0,0,0|2,0,1]=4 158 B19R2.3613666 OC[C@H]1O[C@H]([C@@H](O)[C@@H]1O)N2C=C(F)C(=O)NC2=O Amb22504388 [0,1,0,0,0,0|2,0,1]=4 159 B19R2.3613666 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=C(Br)C(=O)NC2=O Amb20671276 [0,1,0,0,0,0|2,0,1]=4 160 B19R2.3613666 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=C(Cl)C(=O)NC2=O Amb20240874 [0,1,0,0,0,0|2,0,1]=4 161 B19R2.3613666 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=C(F)C(=O)NC2=O Amb19883814 [0,1,0,0,0,0|2,0,1]=4 162 B19R2.3613666 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=C(I)C(=O)NC2=O Amb22336746 [0,1,0,0,0,0|2,0,1]=4 163 B19R2.3613666 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cc(I)c(=O)[nH]c2=O Amb17678767 [0,1,0,0,0,0|2,0,1]=4 164 B16R2.2335 NC=1C=CN(C2CCC(CO)O2)C(=O)N1 Amb22352189 [2,0,0,0,0,0|1,0,0]=3 165 B16R2.2335 NC=1C=CN([C@@H]2CC[C@H](CO)O2)C(=O)N1 Amb22745292 [2,0,0,0,0,0|1,0,0]=3 166 B16R2.2335 NC=1C=CN([C@@H]2CO[C@H](CO)O2)C(=O)N1 Amb22750665 [2,0,0,0,0,0|2,0,0]=4 167 B16R2.2335 NC=1C=CN([C@@H]2CS[C@H](CO)O2)C(=O)N1 Amb19372824 [2,0,0,0,0,0|2,0,0]=4 168 B16R2.2335 NC=1C=CN([C@@H]2CS[C@H](CO)O2)C(=O)N1 Amb22168064 [2,0,0,0,0,0|2,0,0]=4 169 B16R2.2335 NC=1C=CN([C@H]2CC[C@@H](CO)O2)C(=O)N1 Amb22045224 [2,0,0,0,0,0|1,0,0]=3 170 B16R2.2335 NC=1C=CN([C@H]2CS[C@@H](CO)O2)C(=O)N1 Amb21855909 [2,0,0,0,0,0|2,0,0]=4 171 B16R2.2335 Nc1ccn(c(=O)n1)C2CC[C@H](O2)CO Amb2444071 [2,0,0,0,0,0|1,0,0]=3 172 B18R2.165926 CC1=CN([C@@H]2CC(O)[C@H](CO)O2)C(=O)N=C1N Amb22801642 [1,1,0,0,0,0|1,0,0]=3 173 B18R2.165926 CC1=CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)N=C1N Amb20243187 [1,1,0,0,0,0|1,0,0]=3 174 B18R2.165926 NC1=NC(=O)N(C=C1Br)[C@@H]2C[C@@H](O)[C@H](CO)O2 Amb22745174 [1,1,0,0,0,0|1,0,0]=3 175 B18R2.165926 NC1=NC(=O)N(C=C1Cl)C2CC(O)C(CO)O2 Amb22731210 [1,1,0,0,0,0|1,0,0]=3 176 B18R2.165926 NC1=NC(=O)N(C=C1F)C2C[C@H](O)[C@@H](CO)O2 Amb22364414 [1,1,0,0,0,0|1,0,0]=3 177 B18R2.165926 NC1=NC(=O)N(C=C1F)[C@@H]2C[C@@H](O)[C@H](CO)O2 Amb22745263 [1,1,0,0,0,0|1,0,0]=3 178 B18R2.165926 NC1=NC(=O)N(C=C1F)[C@H]2C[C@H](O)[C@@H](CO)O2 Amb20243213 [1,1,0,0,0,0|1,0,0]=3 179 B18R2.165926 NC1=NC(=O)N(C=C1I)C2CC(O)C(CO)O2 Amb19654025 [1,1,0,0,0,0|1,0,0]=3 180 B18R2.165926 NC1=NC(=O)N(C=C1I)[C@H]2C[C@H](O)[C@@H](CO)O2 Amb20240576 [1,1,0,0,0,0|1,0,0]=3 181 B18R2.165926 OC1=NC(=O)N(C=C1I)C2CC(O)C(CO)O2 Amb19802364 [1,1,0,0,0,0|2,0,0]=4 182 B18R2.165926 OCC1OC(CC1O)n2cc(I)c(nc2=O)N Amb2099553 [1,1,0,0,0,0|1,0,0]=3 183 B18R2.166711 NC=1NC(=O)N([C@@H]2C[C@H](O)[C@H](CO)O2)C(=O)N1 Amb19130603 [1,1,0,0,0,0|0,0,1]=3 184 B18R2.66696 CC1OC(C(O)C1O)N2C=C(F)C(O)=NC2=O Amb22572001 [1,1,0,0,0,0|2,0,0]=4 185 B18R2.66696 C[C@@H]1O[C@@H](C(O)[C@@H]1O)N2C=C(F)C(N)=NC2=O Amb19131528 [1,1,0,0,0,0|1,0,0]=3 186 B18R2.66696 C[C@@H]1O[C@@H](C(O)[C@@H]1O)[15N]2C=C(F)C(N)=[15N][13C]2=O Amb19131529 [1,1,0,0,0,0|1,0,0]=3 187 B18R2.66696 C[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)N2C=C(F)C(N)=NC2=O Amb22744729 [1,1,0,0,0,0|1,0,0]=3 188 B18R2.66696 C[C@@H]1O[C@@H]([C@H](O)C1O)N2C=C(Cl)C(N)=NC2=O Amb19131205 [1,1,0,0,0,0|1,0,0]=3 189 B18R2.66696 C[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=C(F)C(N)=NC2=O Amb20241130 [1,1,0,0,0,0|1,0,0]=3 190 B18R2.66696 C[C@H]1O[C@H]([C@H](O)[C@@H]1O)[n]2cc(Cl)c(N)[n]c2=O Amb24087679 [1,1,0,0,0,0|1,0,0]=3 191 B20R2.2344042 C#CC1(O)C(CO)OC(C1O)N2C=CC(N)=NC2=O Amb24182971 [0,2,0,0,0,0|1,0,0]=3 192 B20R2.2344042 C#CC1(O)C(CO)OC(C1O)N2C=CC(O)=NC2=O Amb24182863 [0,2,0,0,0,0|2,0,0]=4 193 B20R2.2344042 C#C[C@@]1(O)[C@@H](CO)O[C@H]([C@@H]1O)N2C=CC(N)=NC2=O Amb23440156 [0,2,0,0,0,0|1,0,0]=3 194 B20R2.131223 CCO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1N2C=CC(N)=NC2=O Amb22748540 [0,2,0,0,0,0|1,0,0]=3 195 B20R2.131223 CCO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1N2C=CC(N)=NC2=O Amb22754476 [0,2,0,0,0,0|1,0,0]=3 196 B20R2.131223 [N-]=[N+]=NC1C(OC(CO)C1O)N2C=CC(N)=NC2=O Amb22731906 [0,2,0,0,0,0|2,0,0]=4 197 B20R2.5521486 CC1=CN([C@@H]2O[C@H](CO)C(O)C2OC)C(=O)N=C1N Amb22799557 [0,2,0,0,0,0|1,0,0]=3 198 B20R2.5521486 CO[C@@H]1[C@H](O[C@@H](CO)[C@@H]1O)N2C=C(I)C(N)=NC2=O Amb22748545 [0,2,0,0,0,0|1,0,0]=3 199 B18R3.199977 N=C1C=CN2C3OC(CO)C(O)C3OC2=N1 Amb20246843 [1,0,0,1,0,0|1,0,1]=4 200 B18R3.199977 N=C1C=CN2[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3OC2=N1 Amb20243171 [1,0,0,1,0,0|1,0,1]=4 201 B18R3.199977 N=C1C=CN2[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3OC2=N1 Amb20243200 [1,0,0,1,0,0|1,0,1]=4 202 B18R3.199977 O[C@@H]1[C@H]2OC3=NC(=O)C=CN3[C@H]2O[C@H]1CO Amb22744887 [1,0,0,1,0,0|2,0,0]=4 203 B18R3.199977 O[C@H]1[C@@H]2OC3=NC(=O)C=CN3[C@@H]2O[C@@H]1CO Amb20243215 [1,0,0,1,0,0|2,0,0]=4