0 B12R2.252 NC(=O)C1=CC2=C(C=CO2)N1 SC-50041 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.252 O=C(O)C1=CC2=C(N1)SC=C2 SC-50044 [0,0,0,0,0,0|0,0,0]=0 2 B12R2.252 O=C(O)C1=CC2=C(N=CS2)N1 SC-50040 [0,0,0,0,0,0|2,0,0]=2 3 B13R2.2334 O=C(O)C1=C(Cl)C2=C(C=CO2)S1 SC-39040 [0,1,0,0,0,0|2,1,0]=4 4 B11R1.35 NC(CC1=CSC=C1)C(=O)O SC-62610 [0,0,1,0,0,0|0,0,2]=3 5 B11R1.90 CC1=C(\C=C\C(=O)O)NC=N1 SC-40847 [0,0,1,0,0,0|3,0,0]=4 6 B11R1.90 CN1C=CC=C1\C=C\C(=O)O SC-41353 [0,0,1,0,0,0|3,0,0]=4 7 B11R1.90 O=C(O)\C=C\C1=C(Cl)C=CS1 SC-39131 [0,0,1,0,0,0|2,0,0]=3 8 B13R2.430 O=C(Cl)C1=CC2=C(C=C1)NC=C2 SC-61042 [0,0,0,0,0,1|3,0,0]=4 9 B13R2.430 O=C(O)C1=CC2=C(C=C1)OC=C2 SC-07269 [0,0,0,0,0,1|1,1,0]=3 10 B13R2.430 O=C(O)C1=CC2=C(C=N1)NC=N2 SC-52588 [0,0,0,0,0,1|2,0,1]=4 11 B13R2.430 O=C(O)C1=CC=C2SN=NC2=C1 SC-19700 [0,0,0,0,0,1|3,0,0]=4 12 B13R2.430 O=C(O)C1=CN2C=CC=C2C=C1 SC-50294 [0,0,0,0,0,1|3,0,0]=4 13 B13R2.435 N=C(N)C1=CC2=C(C=CC=C2)N1 SC-51729 [0,0,0,0,0,1|3,0,0]=4 14 B13R2.435 NC(=O)C1=CC2=CC=CC=C2N1 SC-50743 [0,0,0,0,0,1|2,0,0]=3 15 B13R2.435 O=C(Cl)C1=CC2=C(C=CC=C2)N1 SC-62785 [0,0,0,0,0,1|2,0,0]=3 16 B13R2.435 O=C(Cl)C1=CC2=CC=CC=C2S1 SC-50625 [0,0,0,0,0,1|3,0,0]=4 17 B13R2.435 O=C(O)C1=CC2=CC=CC=C2N1 SC-01199 [0,0,0,0,0,1|1,0,0]=2 18 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 SC-27377 [0,0,0,0,0,1|2,0,1]=4 19 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)N1 SC-46307 [0,0,0,0,0,1|1,0,2]=4 20 B13R2.543 O=C(O)CC1=CN2C=CSC2=N1 SC-49537 [0,0,0,0,0,1|1,0,1]=3 21 B10R1.66 O=C(O)\C=C\C1=CC=CO1 SC-05180 [1,0,1,0,0,0|1,1,0]=4 22 B10R1.66 O=C(O)\C=C\C1=CC=CS1 SC-47960 [1,0,1,0,0,0|1,0,0]=3 23 B10R1.66 O=C(O)\C=C\C1=NC=CS1 SC-39350 [1,0,1,0,0,0|2,0,0]=4 24 B10R1.31 O=CC1=CNC(C(=O)O)=C1 SC-45725 [1,0,1,0,0,0|0,1,0]=3 25 B10R2.2 CC1=CC2=C(N1)SC=C2 SC-50043 [2,0,0,0,0,0|0,0,1]=3 26 B10R2.2 O=C1CC2=C(C=CS2)N1 SC-27722 [2,0,0,0,0,0|2,0,0]=4 27 B12R1.298 N#C\C(=C/C1=CC=CS1)C(=O)O SC-62502 [0,1,1,0,0,0|1,0,1]=4 28 B12R1.861 CC1=CC(\C=C\C(=O)O)=C(C)S1 SC-38898 [0,1,1,0,0,0|1,0,0]=3 29 B14R2.601 CC1=NC2=CC=C(C(=O)O)C=C2S1 SC-30635 [0,1,0,0,0,1|2,0,0]=4 30 B14R2.601 NC1=NC2=C(C=CC(C(=O)O)=C2)S1 SC-21389 [0,1,0,0,0,1|2,0,0]=4 31 B14R2.601 NC1=NC2=CC=C(C(=O)O)C=C2S1 SC-31851 [0,1,0,0,0,1|2,0,0]=4 32 B14R2.601 O=C(O)C1=CN=C2NC(Br)=CC2=C1 SC-69969 [0,1,0,0,0,1|1,0,1]=4 33 B14R2.624 O=C(O)C1=CC2=C(C=CN2)C=C1Cl SC-22157 [0,1,0,0,0,1|2,0,0]=4 34 B14R2.624 O=C(O)C1=CC2=C(C=CN2)C=C1F SC-21675 [0,1,0,0,0,1|2,0,0]=4 35 B14R2.966 COC(=O)C1=CC2=C(C=N1)SC=C2 SC-25379 [0,1,0,0,0,1|0,0,1]=3 36 B14R2.966 COC(=O)C1=NC=C2C=CSC2=C1 SC-51245 [0,1,0,0,0,1|1,0,0]=3 37 B14R2.5998 O=C(O)C1=C(F)C2=C(C=C1)NC=C2 SC-61876 [0,1,0,0,0,1|2,0,0]=4 38 B14R2.8824 O=C(O)C1=CC2=C(C=CN2)C(Cl)=C1 SC-68868 [0,1,0,0,0,1|2,0,0]=4 39 B14R2.8824 O=C(O)C1=CC2=C(C=CN2)C(F)=C1 SC-61880 [0,1,0,0,0,1|2,0,0]=4 40 B14R2.8824 O=C(O)C1=CC2=C(NC=C2)C(F)=C1 SC-32520 [0,1,0,0,0,1|2,0,0]=4 41 B14R2.450 CN1C(C(=O)Cl)=CC2=C1C=CC=C2 SC-61043 [0,1,0,0,0,1|2,0,0]=4 42 B14R2.450 O=C(O)C1=C(Br)C2=C(C=CC=C2)N1 SC-59877 [0,1,0,0,0,1|1,0,0]=3 43 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=NC=C2)S1 SC-39042 [0,1,0,0,0,1|2,0,0]=4 44 B14R2.450 O=C(O)C1=C(Cl)C2=NC=CC=C2S1 SC-38889 [0,1,0,0,0,1|2,0,0]=4 45 B14R2.972 NNC(=O)C1=CC2=CC=CC=C2N1 SC-39758 [0,1,0,0,0,1|2,0,0]=4 46 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=C1 SC-20916 [0,1,0,0,0,1|1,0,0]=3 47 B14R2.4529 CC1=CC=C2NC(C(=O)O)=CC2=C1 SC-65659 [0,1,0,0,0,1|1,0,0]=3 48 B14R2.4529 NC1=CC2=C(C=C1)C=C(C(=O)O)N2 SC-44970 [0,1,0,0,0,1|1,0,0]=3 49 B14R2.4529 O=C(Cl)C1=CC2=C(C=C(Br)C=C2)N1 SC-61040 [0,1,0,0,0,1|2,0,0]=4 50 B14R2.4529 O=C(Cl)C1=CC2=C(C=C(Cl)C=C2)N1 SC-61035 [0,1,0,0,0,1|2,0,0]=4 51 B14R2.4529 O=C(Cl)C1=CC2=C(C=C(F)C=C2)N1 SC-61028 [0,1,0,0,0,1|2,0,0]=4 52 B14R2.4529 O=C(Cl)C1=CC2=C(C=CC(Br)=C2)N1 SC-61041 [0,1,0,0,0,1|2,0,0]=4 53 B14R2.4529 O=C(Cl)C1=CC2=C(C=CC(Cl)=C2)N1 SC-62786 [0,1,0,0,0,1|2,0,0]=4 54 B14R2.4529 O=C(Cl)C1=CC2=CC(F)=CC=C2N1 SC-61029 [0,1,0,0,0,1|2,0,0]=4 55 B14R2.4529 O=C(O)C1=CC2=C(C=NC(Cl)=C2)N1 SC-24201 [0,1,0,0,0,1|1,0,0]=3 56 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2S1 SC-87191 [0,1,0,0,0,1|2,0,0]=4 57 B14R2.4529 O=C(O)C1=NC2=CC(Br)=CC=C2N1 SC-53633 [0,1,0,0,0,1|2,0,0]=4 58 B14R2.4529 O=C(O)C1=NC2=CC=C(F)C=C2N1 SC-72734 [0,1,0,0,0,1|2,0,0]=4 59 B14R2.7969 CC1=C2C=C(C(=O)O)NC2=CC=C1 SC-46080 [0,1,0,0,0,1|1,0,0]=3 60 B14R2.7969 NC1=CC=CC2=C1NC(C(=O)O)=C2 SC-70266 [0,1,0,0,0,1|1,0,0]=3 61 B14R2.7969 O=C(Cl)C1=CC2=C(C=CC=C2Cl)N1 SC-61033 [0,1,0,0,0,1|2,0,0]=4 62 B14R2.7969 O=C(Cl)C1=CC2=C(N1)C(Cl)=CC=C2 SC-61034 [0,1,0,0,0,1|2,0,0]=4 63 B14R2.7969 O=C(O)C1=CC2=C(C=NC=C2Br)S1 SC-30987 [0,1,0,0,0,1|2,0,0]=4 64 B14R2.7969 O=C(O)C1=CC2=C(C=NC=C2Cl)S1 SC-31106 [0,1,0,0,0,1|2,0,0]=4 65 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CN=C2S1 SC-29807 [0,1,0,0,0,1|2,0,0]=4 66 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 SC-72341 [0,1,0,0,0,1|1,0,0]=3 67 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2S1 SC-28330 [0,1,0,0,0,1|2,0,0]=4 68 B14R2.7969 O=C(O)C1=CC2=C(S1)C(F)=CC=C2 SC-51743 [0,1,0,0,0,1|2,0,0]=4 69 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2N1 SC-52059 [0,1,0,0,0,1|1,0,0]=3 70 B10R1.23 NC(C(=O)O)C1=COC=C1 SC-12433 [0,0,1,0,1,0|0,1,1]=4 71 B10R1.23 NC(C(=O)O)C1=CSC=C1 SC-65975 [0,0,1,0,1,0|0,0,1]=3 72 B10R1.23 O=C(O)C(=O)C1=CC=CS1 SC-45909 [0,0,1,0,1,0|1,0,0]=3 73 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SC-21936 [0,0,1,0,0,1|2,0,0]=4 74 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SC-22789 [0,0,1,0,0,1|2,0,0]=4 75 B12R1.43 O=C(O)\C(F)=C\C1=CC=CC=C1 SC-21162 [0,0,1,0,0,1|2,0,0]=4 76 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 SC-46433 [0,0,1,0,0,1|2,0,0]=4 77 B12R1.125 O=C(O)\C=C\C1=C(Cl)N=CC=C1 SC-41254 [0,0,1,0,0,1|2,0,0]=4 78 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F SC-45975 [0,0,1,0,0,1|2,0,0]=4 79 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1I SC-41296 [0,0,1,0,0,1|2,0,0]=4 80 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 SC-27466 [0,0,1,0,0,1|2,0,0]=4 81 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=N1 SC-39656 [0,0,1,0,0,1|2,0,0]=4 82 B12R1.226 O=C(O)\C=C\C1=CC(Br)=NC=C1 SC-36688 [0,0,1,0,0,1|2,0,0]=4 83 B12R1.226 O=C(O)\C=C\C1=CC=CC(I)=C1 SC-41212 [0,0,1,0,0,1|2,0,0]=4 84 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 SC-80962 [0,0,1,0,0,1|2,0,0]=4 85 B12R1.226 O=C(O)\C=C\C1=NC(Br)=CC=C1 SC-39560 [0,0,1,0,0,1|2,0,0]=4 86 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 SC-50273 [1,0,0,0,0,1|1,0,0]=3 87 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 SC-04439 [1,0,0,0,0,1|2,0,0]=4 88 B12R2.32 O=CC1=CC2=CC=CN=C2N1 SC-68009 [1,0,0,0,0,1|1,0,0]=3 89 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)C=N1 SC-20930 [0,0,0,0,0,2|1,0,1]=4 90 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)C=N1 SC-73742 [0,0,0,0,0,2|1,0,1]=4 91 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)NC1 SC-69256 [0,0,0,0,0,2|1,0,0]=3 92 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)OC1 SC-52044 [0,0,0,0,0,2|2,0,0]=4 93 B14R2.781 O=C(O)C1=CC2=CC=NC=C2N=C1 SC-49856 [0,0,0,0,0,2|1,0,1]=4 94 B14R2.781 O=C(O)C1=CC2=NC=CN=C2C=C1 SC-27045 [0,0,0,0,0,2|2,0,0]=4 95 B14R2.781 O=C(O)C1=NC2=CC=CC=C2C=C1 SC-07355 [0,0,0,0,0,2|1,0,1]=4 96 B14R2.768 O=C(O)CC1=CC2=C(C=CC=C2)N1 SC-28729 [0,0,0,0,0,2|1,0,0]=3