0 B11R2.10 BrC1=CN2C(C=CC=C2)=N1 BCP03005 [0,0,0,0,0,0|3,0,0]=3 1 B11R2.10 CC=1NC2=C(N1)C=CN=C2 BCP15050 [0,0,0,0,0,0|3,0,0]=3 2 B11R2.10 ClC1=NC2=CC=CN=C2S1 BCP19454 [0,0,0,0,0,0|3,1,0]=4 3 B11R2.10 NC1=NC2=CC=CC=C2O1 BCP08019 [0,0,0,0,0,0|2,0,0]=2 4 B11R2.10 NC1CC2=CC=CC=C2C1 BCP06421 [0,0,0,0,0,0|2,0,2]=4 5 B11R2.10 O=C1NC=2C=CC=CC2N1 BCP18291 [0,0,0,0,0,0|3,0,0]=3 6 B11R2.10 O=C1OC2=CC=CN=C2N1 BCP10943 [0,0,0,0,0,0|3,0,0]=3 7 B10R2.7 C12=C(CNC1)C=CC=C2 BCP01139 [1,0,0,0,0,0|2,0,1]=4 8 B10R2.7 C12=C(CNC1)C=CC=C2 BCP15681 [1,0,0,0,0,0|2,0,1]=4 9 B10R2.7 C12=C(NC=C1)C=CC=C2 BCP29310 [1,0,0,0,0,0|1,0,0]=2 10 B10R2.7 C12=CN=CN1C=CC=C2 BCP11480 [1,0,0,0,0,0|3,0,0]=4 11 B10R2.7 C=12C=CC=CC1OBO2 BCP15959 [1,0,0,0,0,0|2,0,0]=3 12 B10R2.7 C=12C=CC=CC1OCO2 BCP11873 [1,0,0,0,0,0|1,0,1]=3 13 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O BCP15996 [0,1,0,0,0,0|2,0,0]=3 14 B12R2.32 CCC1=CC=2C=CC=CC2N1 BCP15588 [0,1,0,0,0,0|1,0,0]=2 15 B12R2.32 ClCC1=NC2=CC=CC=C2S1 BCP05859 [0,1,0,0,0,0|1,1,0]=3 16 B12R2.32 NCC1=NC2=C(N1)C=CC=C2 BCP05262 [0,1,0,0,0,0|2,0,0]=3 17 B12R2.202 FC1=CC=CC=2CC(NC21)=O BCP05932 [0,1,0,0,0,0|2,0,1]=4 18 B12R2.202 O=C1NC2=C(C1)C(Br)=CC=C2 BCP05909 [0,1,0,0,0,0|2,0,1]=4 19 B12R2.606 CC1=NN2C=C(Br)C=CC2=N1 BCP19243 [0,1,0,0,0,0|3,0,0]=4 20 B12R2.606 CN1N=C2C=CC(Br)=CC2=C1 BCP00200 [0,1,0,0,0,0|2,0,0]=3 21 B12R2.606 CN1N=C2C=CC(I)=CC2=C1 BCP00029 [0,1,0,0,0,0|2,0,0]=3 22 B12R2.606 NC1=NC2=CC=C(Br)C=C2S1 BCP11471 [0,1,0,0,0,0|2,1,0]=4 23 B12R2.606 NC1=NC=2C=C(F)C=CC2S1 BCP10150 [0,1,0,0,0,0|2,1,0]=4 24 B12R2.606 O=C1NC2=NC=C(Br)C=C2O1 BCP10942 [0,1,0,0,0,0|3,0,0]=4 25 B12R2.606 O=C1OC2=CC=C(Cl)C=C2N1 BCP07916 [0,1,0,0,0,0|2,0,0]=3 26 B12R2.606 SC1=NC2=C(C=CC(Cl)=C2)O1 BCP15804 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.18 C1=NC=CC=C1CC(O)=O BCP20278 [0,0,1,0,0,0|2,0,1]=4 28 B10R1.18 CC(=O)Cc1ccncc1 BCP13413 [0,0,1,0,0,0|1,0,2]=4 29 B10R1.18 CC(NC1=CC=CC=C1)=O BCP02363 [0,0,1,0,0,0|1,0,1]=3 30 B10R1.18 NC(CC1=CC=CC=C1)=O BCP10408 [0,0,1,0,0,0|1,0,2]=4 31 B10R1.18 O=C(Cl)OC1=CC=CC=C1 BCP14449 [0,0,1,0,0,0|2,0,0]=3 32 B10R1.18 OC(=O)Cc1ccncc1 BCP05255 [0,0,1,0,0,0|2,0,1]=4 33 B10R1.18 S=C(Cl)OC1=CC=CC=C1 BCP10334 [0,0,1,0,0,0|2,0,0]=3 34 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 BCP08383 [0,0,0,0,0,1|3,0,0]=4 35 B12R2.24 CC1COC2=C(C=CC=C2)N1 BCP14442 [0,0,0,0,0,1|1,0,1]=3 36 B12R2.24 ClC1=CC2=CC=CN=C2C=C1 BCP20124 [0,0,0,0,0,1|3,0,0]=4 37 B12R2.24 FC1=CC=C2C=NC=CC2=C1 BCP02781 [0,0,0,0,0,1|3,0,0]=4 38 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 BCP13447 [0,0,0,0,0,1|2,0,0]=3 39 B12R2.24 NC1=NC2=NC=CC=C2C=C1 BCP04700 [0,0,0,0,0,1|3,0,0]=4 40 B12R2.24 OC1=CC2=CC=CC=C2N=C1 BCP20129 [0,0,0,0,0,1|2,0,0]=3 41 B9R1.8 ONCC1=CC=CC=C1 BCP07876 [1,0,1,0,0,0|1,0,1]=4 42 B9R1.15 CNC1=CC=CC=C1N BCP19652 [1,0,1,0,0,0|2,0,0]=4 43 B9R1.15 IC1=C(C=O)C=CC=C1 BCP07495 [1,0,1,0,0,0|2,0,0]=4 44 B9R1.15 NC1=C(C=O)C=CC=C1 BCP07330 [1,0,1,0,0,0|2,0,0]=4 45 B9R1.15 NC1=NC=CC=C1OC BCP12904 [1,0,1,0,0,0|2,0,0]=4 46 B11R1.17 BrC1=CC=CC=C1\C=C\C=O BCP04224 [0,1,1,0,0,0|1,0,1]=4 47 B11R1.17 OC1=C(OCCO)C=CC=C1 BCP18969 [0,1,1,0,0,0|1,0,1]=4 48 B11R1.222 CCC(C1=CC=CC=C1Cl)=O BCP07782 [0,1,1,0,0,0|1,0,1]=4 49 B11R1.222 O=C(NC)C1=CC=CC=C1S BCP11862 [0,1,1,0,0,0|1,1,0]=4 50 B11R1.20 CC(NC1=CC=C(O)C=C1)=O BCP23431 [0,1,1,0,0,0|1,0,1]=4 51 B11R1.36 C1=C(C(C(O)=O)C)C=CC=C1 BCP16764 [0,1,1,0,0,0|1,0,1]=4 52 B11R1.36 C=C(C(O)=O)C1=CC=CC=C1 BCP01226 [0,1,1,0,0,0|1,0,0]=3 53 B11R1.36 C[C](c1ccccc1)C(=O)O BCP14307 [0,1,1,0,0,0|1,0,1]=4 54 B11R2.1 BrC1=C2C=CC=CN2N=C1 BCP07335 [1,1,0,0,0,0|2,0,0]=4 55 B11R2.1 BrC1=CN=C2N1C=CC=C2 BCP22690 [1,1,0,0,0,0|2,0,0]=4 56 B11R2.1 BrC1=N[NH]C2=CC=CC=C12 BCP17108 [1,1,0,0,0,0|2,0,0]=4 57 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C BCP00912 [1,1,0,0,0,0|1,0,0]=3 58 B11R2.1 IC1=CNC2=CN=CC=C12 BCP08933 [1,1,0,0,0,0|2,0,0]=4 59 B11R2.1 O=C1C2=C(CC1)C=CC=C2 BCP19847 [1,1,0,0,0,0|1,0,1]=4 60 B11R2.1 O=C1COc2c1cccc2 BCP07835 [1,1,0,0,0,0|0,0,1]=3 61 B11R2.36 BrC1=CC2=C(C=C1)C=NN2 BCP00386 [1,1,0,0,0,0|2,0,0]=4 62 B11R2.36 BrC1=CC=C2C=CSC2=C1 BCP04573 [1,1,0,0,0,0|0,1,0]=3 63 B11R2.36 BrC1=CC=C2NC=CC2=N1 BCP15426 [1,1,0,0,0,0|2,0,0]=4 64 B11R2.36 BrC1=CC=C2NN=CC2=C1 BCP00022 [1,1,0,0,0,0|2,0,0]=4 65 B11R2.36 Brc1ccc2c(c1)CCO2 BCP08601 [1,1,0,0,0,0|0,0,2]=4 66 B11R2.36 Brc1ccc2c(c1)cco2 BCP01211 [1,1,0,0,0,0|0,0,0]=2 67 B11R2.36 C1=CNC2=NC=C(C=C21)Br BCP00110 [1,1,0,0,0,0|2,0,0]=4 68 B11R2.36 CC1=CC2=C(C=C1)C=CN2 BCP00914 [1,1,0,0,0,0|1,0,0]=3 69 B11R2.36 ClC1=CC2=C(C=C1)C=CN2 BCP00061 [1,1,0,0,0,0|1,0,0]=3 70 B11R2.36 ClC1=CC2=C(C=C1)NN=C2 BCP00023 [1,1,0,0,0,0|2,0,0]=4 71 B11R2.36 ClC1=CC2=C(NC=C2)N=C1 BCP00242 [1,1,0,0,0,0|2,0,0]=4 72 B11R2.36 ClC1=CC=C2C(NN=C2)=C1 BCP00929 [1,1,0,0,0,0|2,0,0]=4 73 B11R2.36 ClC=1N=CC2=C(C1)C=CN2 BCP15425 [1,1,0,0,0,0|2,0,0]=4 74 B11R2.36 Clc1ncc2c(c1)[nH]cc2 BCP07759 [1,1,0,0,0,0|2,0,0]=4 75 B11R2.36 FC1=CC2=C(C=C1)NN=C2 BCP00024 [1,1,0,0,0,0|2,0,0]=4 76 B11R2.36 FC1=CC2=C(NC=C2)C=C1 BCP09868 [1,1,0,0,0,0|1,0,0]=3 77 B11R2.36 FC1=CC=C2C(NC=C2)=N1 BCP09441 [1,1,0,0,0,0|2,0,0]=4 78 B11R2.36 IC1=CC2=C(C=C1)C=NN2 BCP00928 [1,1,0,0,0,0|2,0,0]=4 79 B11R2.36 NC1=CC2=C(C=C1)NC=N2 BCP11467 [1,1,0,0,0,0|2,0,0]=4 80 B11R2.36 NC1=CC2=C(NN=C2)C=C1 BCP00021 [1,1,0,0,0,0|2,0,0]=4 81 B11R2.36 NC1=CC2=CC=NN2C=C1 BCP09810 [1,1,0,0,0,0|2,0,0]=4 82 B11R2.36 NC1=CC=C2OCCC2=C1 BCP19517 [1,1,0,0,0,0|0,0,2]=4 83 B11R2.36 Nc1ccc2c(c1)[nH]nc2 BCP00039 [1,1,0,0,0,0|2,0,0]=4 84 B11R2.36 Nc1ccc2n(c1)ccn2 BCP09820 [1,1,0,0,0,0|2,0,0]=4 85 B11R2.36 OC1=CC2=C(C=C1)OCO2 BCP14043 [1,1,0,0,0,0|1,0,1]=4 86 B11R2.36 OC1=CC2=NC=CN2C=C1 BCP13666 [1,1,0,0,0,0|2,0,0]=4 87 B11R2.36 OC1=CC=C2NN=CC2=C1 BCP11175 [1,1,0,0,0,0|2,0,0]=4 88 B11R2.36 OC1=CN=C2NC=CC2=C1 BCP05680 [1,1,0,0,0,0|2,0,0]=4 89 B11R2.106 BrC1=C2C=CSC2=CC=C1 BCP06885 [1,1,0,0,0,0|0,1,0]=3 90 B11R2.106 BrC1=C2OC=CC2=CC=C1 BCP10086 [1,1,0,0,0,0|0,0,0]=2 91 B11R2.106 BrC1=CC=CC2=C1C=CN2 BCP00057 [1,1,0,0,0,0|1,0,0]=3 92 B11R2.106 BrC1=CC=CC2=C1C=NN2 BCP00013 [1,1,0,0,0,0|2,0,0]=4 93 B11R2.106 BrC1=CC=CC2=C1NN=C2 BCP00108 [1,1,0,0,0,0|2,0,0]=4 94 B11R2.106 BrC1=CC=NC2=C1C=CN2 BCP00239 [1,1,0,0,0,0|2,0,0]=4 95 B11R2.106 BrC1=CN=CC2=C1[NH]C=C2 BCP09437 [1,1,0,0,0,0|2,0,0]=4 96 B11R2.106 Brc1cccc2c1OCC2 BCP07134 [1,1,0,0,0,0|0,0,2]=4 97 B11R2.106 Brc1cccc2c1[nH]cc2 BCP00953 [1,1,0,0,0,0|1,0,0]=3 98 B11R2.106 CC1=CC=NC2=C1C=CN2 BCP04307 [1,1,0,0,0,0|2,0,0]=4 99 B11R2.106 Clc1nccc2c1[nH]cc2 BCP10136 [1,1,0,0,0,0|2,0,0]=4 100 B11R2.106 FC1=C2NN=CC2=CC=C1 BCP02784 [1,1,0,0,0,0|2,0,0]=4 101 B11R2.106 IC1=C2C(NC=C2)=NC=C1 BCP09440 [1,1,0,0,0,0|2,0,0]=4 102 B11R2.106 NC1=C2C(NC=C2)=NC=C1 BCP22734 [1,1,0,0,0,0|2,0,0]=4 103 B11R2.106 NC1=C2OCCC2=CC=C1 BCP14902 [1,1,0,0,0,0|0,0,2]=4 104 B11R2.106 NC1=CC=CC2=NC=CN21 BCP09816 [1,1,0,0,0,0|2,0,0]=4 105 B11R2.106 [O-][N+]1=C2NC=CC2=CC=C1 BCP09382 [1,1,0,0,0,0|2,0,0]=4 106 B13R2.57 COC1=CC=2C=NC=CC2C=C1 BCP16502 [0,1,0,0,0,1|2,0,0]=4 107 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 BCP04093 [0,1,0,0,0,1|1,0,0]=3 108 B13R2.57 NCC1=CN=C2C(C=CC=C2)=C1 BCP11483 [0,1,0,0,0,1|1,0,0]=3 109 B13R2.57 NCc1ccc2c(c1)cccn2 BCP13333 [0,1,0,0,0,1|2,0,0]=4 110 B13R2.57 O=Cc1cnc2c(c1)cccc2 BCP15507 [0,1,0,0,0,1|1,0,1]=4 111 B13R2.155 BrC1=CC2=C(C=CC(Br)=C2)C=C1 BCP09880 [0,1,0,0,0,1|2,0,0]=4 112 B13R2.155 BrC1=CC2=NC(N)=NC=C2C=C1 BCP13678 [0,1,0,0,0,1|2,0,0]=4 113 B13R2.155 ClC1=NC=C2C=CC(Br)=CC2=N1 BCP10060 [0,1,0,0,0,1|2,0,0]=4 114 B13R2.155 Nc1cc2cc(Br)ccc2cn1 BCP29210 [0,1,0,0,0,1|2,0,0]=4 115 B13R2.155 O=C1NC2=C(C=CC(O)=C2)C=C1 BCP12809 [0,1,0,0,0,1|2,0,0]=4 116 B13R2.162 CC1=CC=CC2=CC=C(C)N=C21 BCP23522 [0,1,0,0,0,1|1,0,0]=3 117 B13R2.162 ClC1=CC=NC=2C=CC(=CC21)C BCP10342 [0,1,0,0,0,1|2,0,0]=4 118 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=N1 BCP07122 [0,1,0,0,0,1|2,0,0]=4 119 B13R2.328 BrC1=CC(C)=NC2=C1C=CC=C2 BCP22686 [0,1,0,0,0,1|1,0,0]=3 120 B13R2.328 ClC1=C2C=CC=CC2=NC(Cl)=C1 BCP20135 [0,1,0,0,0,1|2,0,0]=4 121 B13R2.328 NC1=CC(Br)=C2C=CC=CC2=C1 BCP19169 [0,1,0,0,0,1|2,0,0]=4 122 B13R2.328 O=C1C=C(N)NC2=C1C=CC=C2 BCP07687 [0,1,0,0,0,1|2,0,0]=4 123 B13R2.328 OC=1C=2C=CC=CC2SC(C1)=O BCP07314 [0,1,0,0,0,1|1,1,0]=4 124 B13R2.369 NC1=CC=2C=CC=CC2OC1=O BCP20024 [0,1,0,0,0,1|1,0,0]=3 125 B13R2.369 O=C1NC2=NC=CC=C2OC1C BCP19244 [0,1,0,0,0,1|1,0,1]=4 126 B13R2.3683 BrC1=CC2=CC=C(Br)C=C2C=C1 BCP11203 [0,1,0,0,0,1|2,0,0]=4 127 B13R2.3683 ClC1=CC2=NC=C(Cl)N=C2C=C1 BCP07594 [0,1,0,0,0,1|2,0,0]=4 128 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 BCP14076 [0,1,0,0,0,1|2,0,0]=4 129 B13R2.3683 NC1=NC2=C(C=C(Br)C=C2)C=N1 BCP11479 [0,1,0,0,0,1|2,0,0]=4 130 B13R2.3683 Nc1ccc2c(c1)ccc(c2)Br BCP10070 [0,1,0,0,0,1|2,0,0]=4 131 B13R2.3028 CC1=C(C)NC2=C1C=C(Cl)C=C2 BCP05447 [0,2,0,0,0,0|1,0,0]=3 132 B13R2.3028 O=C1C=2C=C(Cl)C=CC2NC1=O BCP06904 [0,2,0,0,0,0|2,0,0]=4 133 B13R2.3028 O=C1N(C)CC2=C1C=C(Br)C=C2 BCP17655 [0,2,0,0,0,0|2,0,0]=4 134 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O BCP04280 [0,2,0,0,0,0|2,0,0]=4 135 B13R2.3028 O=C1NC2=C(C=C(C)C=C2)C1=O BCP05738 [0,2,0,0,0,0|2,0,0]=4 136 B13R2.4825 O=C1Nc2c(C1=O)cccc2Br BCP09352 [0,2,0,0,0,0|2,0,0]=4 137 B13R2.4856 O=C1C2=C(C=CC=C2C)NC1=O BCP09720 [0,2,0,0,0,0|2,0,0]=4 138 B13R2.5190 NC1=CC2=NN(C)C(C)=C2C=C1 BCP12745 [0,2,0,0,0,0|2,0,0]=4 139 B13R2.435 CC(C1=NC=2C=CC=CC2S1)=O BCP18676 [0,2,0,0,0,0|1,1,0]=4 140 B13R2.435 FC(F)C1=NC2=C(C=CC=C2)N1 BCP00468 [0,2,0,0,0,0|2,0,0]=4 141 B13R2.435 OC(C1=CC=2C=CC=CC2N1)=O BCP00082 [0,2,0,0,0,0|1,0,1]=4 142 B13R2.3050 OC1=C(F)C2=C(NC(C)=C2)C=C1 BCP05449 [0,2,0,0,0,0|1,0,0]=3 143 B11R2.20 C12=CC=NC=C1C=CC=C2 BCP23537 [0,0,1,1,0,0|2,0,0]=4 144 B9R1.6 N[C](C)C1=CC=CC=C1 BCP13697 [0,0,1,0,1,0|1,0,1]=4 145 B9R1.6 O=C(O)C1=CN=CC=C1 BCP16301 [0,0,1,0,1,0|2,0,0]=4 146 B9R1.6 O[C](C)C1=NC=CC=C1 BCP18401 [0,0,1,0,1,0|1,0,1]=4