0 B11R1.40 CCC(=O)CC1=CC=CC=C1 BB57-4116 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 BB01-5922 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.40 NNC(=O)CC1=CC=CC=C1 BB01-5971 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.17 CCCNC1=CC=CC=C1 BB57-4946 [1,0,0,0,0,0|2,0,0]=3 4 B10R1.17 CCNCC1=CC=NC=C1 BB01-5979 [1,0,0,0,0,0|3,0,0]=4 5 B10R1.17 CNCCC1=CC=NC=C1 BB01-0962 [1,0,0,0,0,0|1,0,0]=2 6 B10R1.17 CNCCC1=NC=CC=C1 BB01-6110 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.17 NCCOC1=CC=CC=C1 BB58-0604 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.17 NCCSC1=CC=CC=C1 BB53-1253 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.17 O=C=NCC1=CC=CC=C1 BB01-4445 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.17 O=CNCC1=CC=CC=C1 BB20-1135 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.17 OCCNC1=CC=CC=C1 BB01-3862 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.17 S=C=NCC1=CC=CC=C1 BB01-6211 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.18 N=C(N)NC1=CC=CC=C1 BB01-2596 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.18 NC(=S)CC1=CC=CC=C1 BB57-5511 [1,0,0,0,0,0|1,0,1]=3 15 B10R1.18 NC(=S)NC1=CC=CC=C1 BB01-7403 [1,0,0,0,0,0|2,0,1]=4 16 B12R1.32 CN(CCN)CC1=CC=CC=C1 BB01-5165 [0,1,0,0,0,0|2,0,0]=3 17 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 BB57-6956 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.34 NNC(=O)C(O)C1=CC=CC=C1 BB55-0723 [0,1,0,0,0,0|2,0,1]=4 19 B12R1.43 CC(OC1=CC=CC=C1)C(=O)Cl BB55-5200 [0,1,0,0,0,0|3,0,0]=4 20 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O BB01-4649 [0,1,0,0,0,0|3,0,0]=4 21 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 BB55-5151 [0,1,0,0,0,0|3,0,0]=4 22 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 BB57-0278 [0,1,0,0,0,0|2,0,1]=4 23 B12R1.49 CCC(C)OC1=CC=C(N)C=C1 BB57-1183 [0,1,0,0,0,0|2,0,0]=3 24 B12R1.49 CNC(=O)CC1=CC=C(Br)C=C1 BB57-4101 [0,1,0,0,0,0|1,0,1]=3 25 B12R1.49 NNC(=O)CC1=CC=C(Br)C=C1 BB55-0707 [0,1,0,0,0,0|2,0,1]=4 26 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 BB01-5050 [0,1,0,0,0,0|2,0,1]=4 27 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 BB01-5047 [0,1,0,0,0,0|2,0,1]=4 28 B12R1.49 NNC(=O)CC1=CC=C(O)C=C1 BB55-2082 [0,1,0,0,0,0|2,0,1]=4 29 B12R1.50 CC1=CC(CC(=O)NN)=CC=C1 BB01-6389 [0,1,0,0,0,0|2,0,1]=4 30 B12R1.50 COC(=O)CC1=CC=CC(C)=C1 BB01-6393 [0,1,0,0,0,0|2,0,1]=4 31 B12R1.50 COC(=O)CC1=CC=CC(O)=C1 BB58-5012 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.50 NNC(=O)CC1=CC=CC(F)=C1 BB01-5054 [0,1,0,0,0,0|2,0,1]=4 33 B12R1.50 NNC(=O)CC1=CC=CC(O)=C1 BB58-5013 [0,1,0,0,0,0|2,0,1]=4 34 B12R1.118 CCC(CN)CC1=CC=CC=C1 BB58-0581 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.371 CC1=C(CC(=O)NN)C=CC=C1 BB17-0310 [0,1,0,0,0,0|2,0,1]=4 36 B12R1.371 NNC(=O)CC1=C(Cl)C=CC=C1 BB01-5065 [0,1,0,0,0,0|2,0,1]=4 37 B12R1.371 NNC(=O)CC1=CC=CC=C1F BB01-5053 [0,1,0,0,0,0|2,0,1]=4 38 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 BB01-8134 [0,0,0,1,0,0|2,0,1]=4 39 B12R2.18 CN1C(N)=NC2=C1C=CC=C2 BB01-3970 [0,0,0,1,0,0|2,0,1]=4 40 B12R2.18 CN1C(N)=NC2=C1C=CC=C2 BB05-0210 [0,0,0,1,0,0|2,0,1]=4 41 B12R2.18 CN1C2=CC=CC=C2N=C1S BB57-1880 [0,0,0,1,0,0|2,0,1]=4 42 B12R2.24 CC1CCC2=CC=CC=C2N1 BB57-6640 [0,0,0,1,0,0|2,0,0]=3 43 B10R1.15 NNC(=S)C1=CC=CC=C1 BB17-0201 [0,0,0,0,1,0|2,0,1]=4 44 B10R1.15 OC(CBr)C1=CC=CC=C1 BB58-3926 [0,0,0,0,1,0|3,0,0]=4 45 B12R1.27 NCC(O)COC1=CC=CC=C1 BB57-0160 [0,0,0,0,0,1|3,0,0]=4 46 B12R1.27 NNC(=O)CCC1=CC=CC=C1 BB01-5059 [0,0,0,0,0,1|2,0,1]=4 47 B12R1.27 NNC(=O)CSC1=CC=CC=C1 BB57-6020 [0,0,0,0,0,1|2,0,1]=4 48 B12R1.27 NNC(=O)OCC1=CC=CC=C1 BB20-2293 [0,0,0,0,0,1|2,0,1]=4 49 B9R1.8 CNCC1=CC=CN=C1 BB01-7899 [2,0,0,0,0,0|1,0,0]=3 50 B9R1.8 NCCC1=CC=CN=C1 BB01-0960 [2,0,0,0,0,0|1,0,0]=3 51 B9R1.8 NCCC1=CC=NC=C1 BB01-0961 [2,0,0,0,0,0|1,0,0]=3 52 B9R1.8 NCCC1=NC=CC=C1 BB01-0959 [2,0,0,0,0,0|1,0,0]=3 53 B9R1.8 NNCC1=CC=CC=C1 BB58-2846 [2,0,0,0,0,0|1,0,0]=3 54 B9R1.8 O=CCC1=CC=CC=C1 BB01-5910 [2,0,0,0,0,0|1,0,1]=4 55 B11R1.1 CCCCC1=CC=C(N)C=C1 BB01-5924 [1,1,0,0,0,0|1,0,0]=3 56 B11R1.1 CCCOC1=CC=C(N)C=C1 BB57-6688 [1,1,0,0,0,0|2,0,0]=4 57 B11R1.17 CCCCC1=CC=CC=C1N BB01-7939 [1,1,0,0,0,0|1,0,0]=3 58 B11R1.17 CCCNC1=CC=CC=C1C BB01-3212 [1,1,0,0,0,0|2,0,0]=4 59 B11R1.17 CCCNC1=CC=CC=C1F BB01-3208 [1,1,0,0,0,0|2,0,0]=4 60 B11R1.17 CCCOC1=C(N)C=CC=C1 BB01-4972 [1,1,0,0,0,0|2,0,0]=4 61 B11R1.24 CCCNC1=CC(C)=CC=C1 BB01-8198 [1,1,0,0,0,0|2,0,0]=4 62 B11R1.24 CCCNC1=CC(Cl)=CC=C1 BB01-5259 [1,1,0,0,0,0|2,0,0]=4 63 B11R1.24 CCCNC1=CC(F)=CC=C1 BB01-3220 [1,1,0,0,0,0|2,0,0]=4 64 B11R1.28 CNCCOC1=CC=CC=C1 BB57-6363 [1,1,0,0,0,0|0,0,0]=2 65 B11R1.28 NCCCSC1=CC=CC=C1 BB57-5461 [1,1,0,0,0,0|2,0,0]=4 66 B11R1.28 NCCNCC1=CC=CC=C1 BB58-0025 [1,1,0,0,0,0|2,0,0]=4 67 B11R1.28 O=C=NCCC1=CC=CC=C1 BB57-0293 [1,1,0,0,0,0|0,0,2]=4 68 B11R1.91 C=C(C)COC1=CC=CC=C1 BB58-4833 [1,1,0,0,0,0|2,0,0]=4 69 B11R1.91 CC(C)NCC1=CC=CC=C1 BB57-0208 [1,1,0,0,0,0|2,0,0]=4 70 B11R1.91 CC(N)CCC1=CC=CC=C1 BB01-6051 [1,1,0,0,0,0|1,0,0]=3 71 B11R1.20 CC(C)NC1=CC=C(O)C=C1 BB20-0130 [1,1,0,0,0,0|1,0,0]=3 72 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 BB55-3666 [1,1,0,0,0,0|1,0,0]=3 73 B11R1.20 CC(C)OC1=CC=C(N)C=C1 BB55-3484 [1,1,0,0,0,0|1,0,0]=3 74 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 BB01-6272 [1,1,0,0,0,0|1,0,1]=4 75 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 BB01-6345 [1,1,0,0,0,0|0,0,1]=3 76 B11R1.86 NC(=O)CC1=CC=CC=C1O BB57-7069 [1,1,0,0,0,0|1,0,1]=4 77 B11R1.157 CC(C)OC1=CC=CC(N)=C1 BB55-3499 [1,1,0,0,0,0|1,0,0]=3 78 B11R1.157 CN(C)CC1=CC(Br)=CC=C1 BB55-8394 [1,1,0,0,0,0|1,0,0]=3 79 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 BB55-6363 [0,1,0,0,1,0|2,0,0]=4 80 B11R1.22 CCC(N)C1=CC=C(C)C=C1 BB55-1057 [0,1,0,0,1,0|2,0,0]=4 81 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 BB57-1172 [0,1,0,0,1,0|1,0,1]=4 82 B11R1.22 COC(C)C1=CC=C(Br)C=C1 BB55-3662 [0,1,0,0,1,0|1,0,0]=3 83 B11R1.23 CNC(=O)C1=CC(Br)=CC=C1 BB55-4688 [0,1,0,0,1,0|1,0,1]=4 84 B11R1.222 CNC(=O)C1=C(Br)C=CC=C1 BB57-2486 [0,1,0,0,1,0|1,0,1]=4 85 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 BB57-5866 [0,1,0,0,1,0|1,0,1]=4 86 B13R1.42 CCCC(C)NCC1=CC=CC=C1 BB55-6525 [0,1,0,0,0,1|1,0,0]=3 87 B13R1.351 CC(C)C(C)NCC1=CC=CC=C1 BB55-6528 [0,1,0,0,0,1|1,0,0]=3 88 B13R1.417 BrCC(CBr)OCC1=CC=CC=C1 BB58-1326 [0,1,0,0,0,1|2,0,0]=4 89 B13R1.528 CNC(=O)COC1=C(Br)C=CC=C1 BB55-2949 [0,1,0,0,0,1|1,0,1]=4 90 B13R1.44 CN(CCCN)CC1=CC=CC=C1 BB01-5130 [0,2,0,0,0,0|2,0,0]=4 91 B13R1.79 CCN(CCN)CC1=CC=CC=C1 BB01-5830 [0,2,0,0,0,0|2,0,0]=4 92 B13R1.133 CC(C)N(C)CC1=CC=C(Br)C=C1 BB01-1287 [0,2,0,0,0,0|2,0,0]=4 93 B13R1.148 CC(C)N(C)CC1=CC(Br)=CC=C1 BB01-1276 [0,2,0,0,0,0|2,0,0]=4 94 B11R1.25 CNC(C)CCC1=CC=CO1 BB01-4354 [0,0,1,1,0,0|1,0,1]=4 95 B11R2.1 CN1N=NC2=CC=CC=C21 BB58-1288 [1,0,0,1,0,0|2,0,0]=4 96 B11R2.1 NC1CCC2=C1C=CC=C2 BB01-6422 [1,0,0,1,0,0|2,0,0]=4 97 B11R2.20 C1=CC=C2OCCCC2=C1 BB57-6849 [1,0,0,1,0,0|2,0,0]=4 98 B11R2.10 NC1CC2=CC=CC=C2C1 BB53-1264 [1,0,0,1,0,0|0,0,0]=2 99 B11R2.10 O=C1CC2=C(C=CC=C2)C1 BB01-8363 [1,0,0,1,0,0|1,0,1]=4 100 B11R2.40 NC1(C2=CC=CC=C2)CC1 BB58-3672 [0,0,0,1,1,0|2,0,0]=4 101 B13R2.45 CN1C(CO)=CC2=CC=CC=C21 BB58-1337 [0,1,0,1,0,0|0,0,2]=4 102 B13R2.45 CN1C2=CC=CC=C2N=C1CN BB01-4652 [0,1,0,1,0,0|1,0,1]=4 103 B13R2.369 OC1CC2=CC=CC=C2CC1O BB58-4389 [0,1,0,1,0,0|2,0,0]=4 104 B13R2.3683 CC1CCC2=C(C=CC(F)=C2)N1 BB01-5978 [0,1,0,1,0,0|2,0,0]=4 105 B9R1.6 CC(N)C1=CC=CC=N1 BB01-4954 [1,0,0,0,1,0|1,0,0]=3 106 B9R1.6 CC(N)C1=CC=NC=C1 BB01-4967 [1,0,0,0,1,0|1,0,0]=3 107 B9R1.6 CC(N)C1=CN=CC=C1 BB01-4888 [1,0,0,0,1,0|1,0,0]=3 108 B9R1.6 N=C(N)C1=CC=CC=C1 BB01-6195 [1,0,0,0,1,0|1,0,1]=4 109 B9R1.6 NC(=O)C1=CC=CC=C1 BB01-2129 [1,0,0,0,1,0|1,0,1]=4 110 B9R1.6 NN(C)C1=CC=CC=C1 BB01-7902 [1,0,0,0,1,0|1,0,0]=3 111 B9R1.13 CC(N)CN1C=CC=N1 BB05-2151 [1,0,0,0,1,0|2,0,0]=4