0 B13R2.369 CC1=NC2=CC=CC=C2N=C1C BB01-7443 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.369 CC1OC2=CC=CC=C2NC1=O BB57-5543 [0,0,0,0,0,0|2,0,2]=4 2 B13R2.369 N=C1NC2=C(C=CC=C2)NC1=O BB54-3988 [0,0,0,0,0,0|3,0,0]=3 3 B13R2.369 NC1=CC2=CC=CC=C2C=C1O BB55-7577 [0,0,0,0,0,0|2,0,0]=2 4 B13R2.369 NC1CC2=CC=CC=C2NC1=O BB55-4907 [0,0,0,0,0,0|2,0,2]=4 5 B13R2.369 O=C1NC2=CC=CC=C2OC1=O BB12-1662 [0,0,0,0,0,0|1,0,1]=2 6 B12R2.24 BrC1=CC2=C(C=C1)N=CC=C2 BB54-0061 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.24 BrC1=NC2=NC=CC=C2C=C1 BB32-2954 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.24 FC1=CC2=CC=CC=C2C=C1 BB53-1916 [1,0,0,0,0,0|2,0,0]=3 9 B12R2.24 NC1=CC=C2C=CC=NC2=C1 BB58-0390 [1,0,0,0,0,0|3,0,0]=4 10 B12R2.24 NC1=CC=C2N=CC=CC2=C1 BB12-2220 [1,0,0,0,0,0|3,0,0]=4 11 B12R2.24 O=C1C=CC2=C(C=NC=C2)N1 BB32-2378 [1,0,0,0,0,0|2,0,0]=3 12 B12R2.24 O=C1C=CC2=CN=CC=C2N1 BB57-7205 [1,0,0,0,0,0|2,0,0]=3 13 B12R2.24 O=C1C=NC2=CC=CC=C2N1 BB57-5371 [1,0,0,0,0,0|2,0,0]=3 14 B12R2.24 O=C1CSC2=CC=CC=C2N1 BB20-4697 [1,0,0,0,0,0|2,0,1]=4 15 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 BB57-3400 [1,0,0,0,0,0|1,0,0]=2 16 B12R2.24 S=C1COC2=CC=CC=C2N1 BB10-0259 [1,0,0,0,0,0|1,1,1]=4 17 B14R2.1128 CC1=NC2=CC=CC=C2N=C1C=O BB57-1068 [0,1,0,0,0,0|3,0,0]=4 18 B14R2.1128 N#CC1=CC2=C(C=CC=C2)N=C1N BB54-1839 [0,1,0,0,0,0|3,0,0]=4 19 B14R2.8188 CC1=C(Br)C(=O)NC2=CC=CC=C21 BB12-1910 [0,1,0,0,0,0|2,0,0]=3 20 B14R2.8188 CC1=CC2=CC=CC=C2C(N)=C1C BB58-4732 [0,1,0,0,0,0|3,0,0]=4 21 B14R2.8188 CN1C(=O)C(=O)NC2=CC=CC=C21 BB57-6420 [0,1,0,0,0,0|2,0,1]=4 22 B14R2.8239 CC1=CC=C2NC(=O)C(=O)NC2=C1 BB57-5886 [0,1,0,0,0,0|2,0,1]=4 23 B14R2.8239 O=C1NC2=C(C=C(O)C=C2)OC1=O BB54-5616 [0,1,0,0,0,0|1,0,1]=3 24 B14R2.28472 NC1=C2NC(=O)C(=O)NC2=CC=C1 BB54-3281 [0,1,0,0,0,0|2,0,1]=4 25 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 BB55-4698 [0,0,1,0,0,0|1,0,1]=3 26 B12R2.18 CC1CC2=CC=CC=C2C1=O BB12-2283 [0,0,0,0,1,0|1,0,2]=4 27 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 BB17-2230 [1,0,1,0,0,0|1,0,0]=3 28 B11R1.91 O=C(O)C#CC1=CC=CC=C1 BB55-0680 [1,0,1,0,0,0|0,0,2]=4 29 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB12-2585 [1,0,1,0,0,0|1,0,1]=4 30 B11R1.91 O=C(O)CSC1=CC=CC=C1 BB54-0245 [1,0,1,0,0,0|1,0,1]=4 31 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 BB57-7143 [1,0,1,0,0,0|2,0,0]=4 32 B11R1.41 COC1=C(\C=N\O)C=CC=C1 BB20-3227 [1,0,1,0,0,0|1,0,1]=4 33 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1O BB12-3041 [0,1,1,0,0,0|1,0,1]=4 34 B13R1.470 CC1=C(NC(=O)\C=N\O)C=CC=C1 BB12-1558 [0,1,1,0,0,0|1,0,1]=4 35 B13R1.470 O=C(\C=N\O)NC1=C(Cl)C=CC=C1 BB12-1535 [0,1,1,0,0,0|2,0,0]=4 36 B13R1.470 O=C(\C=N\O)NC1=C(F)C=CC=C1 BB12-1448 [0,1,1,0,0,0|2,0,0]=4 37 B13R1.2872 C\C(C=O)=C/C1=C(O)C=CC(Br)=C1 BB17-1487 [0,1,1,0,0,0|1,0,0]=3 38 B13R1.2872 C\C(C=O)=C\C1=C(O)C=CC(Cl)=C1 BB17-1588 [0,1,1,0,0,0|1,0,0]=3 39 B13R2.32 NC1=C2C=CC=CC2=CC=C1O BB54-1922 [1,1,0,0,0,0|1,0,0]=3 40 B13R2.32 O=C1C(Br)=CSC2=CC=CC=C12 BB20-0457 [1,1,0,0,0,0|1,1,0]=4 41 B13R2.32 O=C1C=CC2=C(C=CC=C2)N1O BB58-1194 [1,1,0,0,0,0|1,0,0]=3 42 B13R2.32 OC1=C(Cl)C2=CC=CC=C2C=C1 BB12-5003 [1,1,0,0,0,0|1,0,0]=3 43 B13R2.57 ClCC1=CC2=CC=CC=C2N=C1 BB58-0503 [1,1,0,0,0,0|2,0,0]=4 44 B13R2.57 N#CC1=CC=C2C=CC=CC2=N1 BB54-1225 [1,1,0,0,0,0|2,0,0]=4 45 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 BB32-1896 [1,1,0,0,0,0|2,0,0]=4 46 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 BB55-6172 [1,1,0,0,0,0|2,0,0]=4 47 B13R2.57 NCC1=NC2=C(C=CC=C2)C=C1 BB54-4524 [1,1,0,0,0,0|2,0,0]=4 48 B13R2.57 O=CC1=CC2=C(C=C1)N=CC=C2 BB05-3503 [1,1,0,0,0,0|2,0,0]=4 49 B13R2.57 O=CC1=CC=C2C=CC=NC2=C1 BB54-4676 [1,1,0,0,0,0|2,0,0]=4 50 B13R2.57 O=CC1=NC2=C(C=CC=C2)N=C1 BB05-0129 [1,1,0,0,0,0|2,0,0]=4 51 B13R2.57 O=CC1=NC2=C(C=CC=C2)N=C1 BB55-0044 [1,1,0,0,0,0|2,0,0]=4 52 B13R2.57 OCC1=CC2=CC=CC=C2N=C1 BB57-1133 [1,1,0,0,0,0|1,0,0]=3 53 B13R2.57 OCC1=CC=C2N=CC=CC2=C1 BB55-6176 [1,1,0,0,0,0|2,0,0]=4 54 B13R2.155 ClC1=CC=C2C=CC(Cl)=NC2=C1 BB32-3464 [1,1,0,0,0,0|2,0,0]=4 55 B13R2.155 NC1=CC2=C(C=C1)N=CC(=O)N2 BB54-2810 [1,1,0,0,0,0|2,0,0]=4 56 B13R2.155 NC1=CC2=C(C=C1)N=CC(Br)=C2 BB54-0856 [1,1,0,0,0,0|2,0,0]=4 57 B13R2.155 O=C1C=CC2=CC=C(O)C=C2N1 BB57-4832 [1,1,0,0,0,0|1,0,0]=3 58 B13R2.155 O=C1C=NC2=C(C=C(Br)C=C2)N1 BB54-2824 [1,1,0,0,0,0|2,0,0]=4 59 B13R2.155 OC1=CC=C2N=CC(Cl)=CC2=C1 BB31-5174 [1,1,0,0,0,0|2,0,0]=4 60 B13R2.162 CC1=C2N=C(N)C=CC2=CC=C1 BB58-5092 [1,1,0,0,0,0|2,0,0]=4 61 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 BB56-0660 [1,1,0,0,0,0|2,0,0]=4 62 B13R2.162 NC1=NC2=C(C=CC=C2O)C=C1 BB57-3388 [1,1,0,0,0,0|2,0,0]=4 63 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=C1 BB01-2818 [1,1,0,0,0,0|2,0,0]=4 64 B13R2.328 NC1=CC(=O)C2=C(C=CC=C2)O1 BB54-5088 [1,1,0,0,0,0|1,0,0]=3 65 B13R2.328 OC1=CC2=C(N=CC=C2)C(O)=C1 BB58-1203 [1,1,0,0,0,0|2,0,0]=4 66 B13R2.3683 CC1=NC2=CC=C(N)C=C2C=C1 BB12-4988 [1,1,0,0,0,0|2,0,0]=4 67 B13R2.3683 NC1=CC=C2C=C(N)C=CC2=C1 BB57-6530 [1,1,0,0,0,0|2,0,0]=4 68 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=N1 BB17-0572 [1,1,0,0,0,0|2,0,0]=4 69 B13R2.5179 NC1=C2N=CC(I)=CC2=CC=C1 BB32-2886 [1,1,0,0,0,0|2,0,0]=4 70 B13R2.45 CC1=C(C=O)SC2=C1C=CC=C2 BB05-3029 [0,1,0,0,1,0|1,1,0]=4 71 B13R2.45 N#CC1=C(N)C2=C(C=CC=C2)O1 BB54-3115 [0,1,0,0,1,0|2,0,0]=4 72 B13R2.45 O=CC1=C(Cl)C2=CC=CC=C2N1 BB01-2135 [0,1,0,0,1,0|2,0,0]=4 73 B13R2.3028 CN1C(=O)OC2=CC=C(N)C=C21 BB57-6507 [0,1,0,0,1,0|2,0,0]=4 74 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1O BB58-3099 [0,1,0,0,1,0|1,0,1]=4 75 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 BB12-1449 [0,1,0,0,1,0|1,0,1]=4 76 B13R2.3085 NN1C(=O)C2=CC=CC=C2C1=O BB57-1966 [0,1,0,0,1,0|2,0,0]=4 77 B13R2.4825 O=C1NC2=C(Br)C=CC=C2C1=O BB01-7339 [0,1,0,0,1,0|1,0,1]=4 78 B13R2.4856 CC1=C2C(=O)C(=O)NC2=CC=C1 BB55-7561 [0,1,0,0,1,0|1,0,1]=4 79 B13R2.5190 CC1=CC=C2C(=O)C(=O)NC2=C1 BB55-7560 [0,1,0,0,1,0|1,0,1]=4 80 B13R2.5190 CN1C(=O)OC2=CC(N)=CC=C21 BB57-7094 [0,1,0,0,1,0|2,0,0]=4 81 B13R2.5190 O=C1NC2=C(C=CC(Br)=C2)C1=O BB55-2378 [0,1,0,0,1,0|1,0,1]=4 82 B15R2.274 CC1=C(C#N)C(=O)NC2=CC=CC=C21 BB12-2134 [0,2,0,0,0,0|2,0,0]=4 83 B15R2.274 N#CC1=C(N)C2=CC=CC=C2NC1=O BB54-1008 [0,2,0,0,0,0|2,0,0]=4 84 B15R2.274 NC1=C(C=O)C(=O)C2=CC=CC=C2O1 BB57-0555 [0,2,0,0,0,0|1,0,1]=4 85 B15R2.888 CCOC1=NC2=CC=CC=C2NC1=O BB01-2513 [0,2,0,0,0,0|2,0,0]=4 86 B15R2.984 O=C(O)C1=CC2=CC=CC=C2C=C1Br BB31-4092 [0,2,0,0,0,0|2,0,0]=4 87 B15R2.984 O=C(O)C1=NC2=CC=CC=C2NC1=O BB01-3739 [0,2,0,0,0,0|2,0,0]=4 88 B15R2.21243 C(=O)C1=CC2=CC=CC=C2N(C)C1=O BB53-1880 [0,2,0,0,0,0|1,0,1]=4 89 B15R2.21243 CN1C(=O)C(C#N)=CC2=CC=CC=C21 BB53-1922 [0,2,0,0,0,0|2,0,0]=4 90 B15R2.21243 CN1C(=O)C(CCl)=CC2=CC=CC=C21 BB53-1921 [0,2,0,0,0,0|2,0,0]=4 91 B15R2.21243 CN1C(=O)C(CO)=CC2=CC=CC=C21 BB53-1881 [0,2,0,0,0,0|1,0,0]=3 92 B15R2.6237 CCN1C(=O)C(O)=NC2=CC=CC=C21 BB01-2549 [0,2,0,0,0,0|2,0,0]=4 93 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 BB12-3811 [0,0,1,1,0,0|2,0,0]=4 94 B13R2.435 CC(=O)C1=CC2=CC=CC=C2O1 BB01-7402 [0,0,1,1,0,0|1,0,0]=3 95 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 BB50-0386 [0,0,1,1,0,0|0,1,0]=3 96 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)S1 BB31-7905 [0,0,1,1,0,0|1,1,0]=4 97 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 BB05-1015 [0,0,1,1,0,0|2,0,0]=4 98 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 BB12-2951 [0,0,1,1,0,0|2,0,0]=4 99 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 BB54-4264 [0,0,1,1,0,0|2,0,0]=4 100 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 BB12-1678 [0,0,1,1,0,0|1,0,1]=4 101 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 BB57-2002 [0,0,1,1,0,0|1,0,1]=4 102 B11R2.1 O=C1NCC2=CC=CC=C12 BB57-1240 [1,0,0,0,1,0|1,0,1]=4 103 B11R2.10 CC1=NC2=CC=CC=C2O1 BB12-1505 [1,0,0,0,1,0|2,0,0]=4 104 B11R2.10 NC1=NC2=CC=CC=C2O1 BB05-4615 [1,0,0,0,1,0|2,0,0]=4 105 B11R2.10 O=C1NC2=CC=CC=C2N1 BB12-1666 [1,0,0,0,1,0|2,0,0]=4 106 B11R2.10 O=C1NC2=CC=CC=C2O1 BB01-7355 [1,0,0,0,1,0|1,0,0]=3 107 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 BB12-2929 [0,0,1,0,0,1|0,0,2]=4 108 B13R2.33 O=C1COC2=CC=CC=C2CN1 BB57-5539 [1,0,0,0,0,1|1,0,1]=4