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|2,0,0]=2 2 B11R2.10 ClC1=NC2=CC=CN=C2S1 BCP19454 [0,0,0,0,0,0|2,1,0]=3 3 B11R2.10 NC1=NC2=CC=CC=C2O1 BCP08019 [0,0,0,0,0,0|1,0,0]=1 4 B11R2.10 NC1CC2=CC=CC=C2C1 BCP06421 [0,0,0,0,0,0|3,0,1]=4 5 B11R2.10 O=C1NC=2C=CC=CC2N1 BCP18291 [0,0,0,0,0,0|2,0,1]=3 6 B11R2.10 O=C1OC2=CC=CN=C2N1 BCP10943 [0,0,0,0,0,0|2,0,1]=3 7 B10R2.7 C12=C(CNC1)C=CC=C2 BCP01139 [1,0,0,0,0,0|3,0,0]=4 8 B10R2.7 C12=C(CNC1)C=CC=C2 BCP15681 [1,0,0,0,0,0|3,0,0]=4 9 B10R2.7 C12=C(NC=C1)C=CC=C2 BCP29310 [1,0,0,0,0,0|1,0,1]=3 10 B10R2.7 C=12C=CC=CC1OBO2 BCP15959 [1,0,0,0,0,0|2,0,0]=3 11 B10R2.7 C=12C=CC=CC1OCO2 BCP11873 [1,0,0,0,0,0|1,0,1]=3 12 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O BCP15996 [0,1,0,0,0,0|2,0,1]=4 13 B12R2.32 CCC1=CC=2C=CC=CC2N1 BCP15588 [0,1,0,0,0,0|1,0,1]=3 14 B12R2.32 ClCC1=NC2=CC=CC=C2S1 BCP05859 [0,1,0,0,0,0|0,1,0]=2 15 B12R2.32 NCC1=NC2=C(N1)C=CC=C2 BCP05262 [0,1,0,0,0,0|1,0,0]=2 16 B12R2.202 FC1=CC=CC=2CC(NC21)=O BCP05932 [0,1,0,0,0,0|2,0,1]=4 17 B12R2.202 NC1=NN2C=CC=C(Br)C2=N1 BCP12971 [0,1,0,0,0,0|3,0,0]=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|2,0,0]=3 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(=CN=C2S1)Br BCP11263 [0,1,0,0,0,0|2,1,0]=4 23 B12R2.606 NC1=NC2=CC=C(Br)C=C2S1 BCP11471 [0,1,0,0,0,0|1,1,0]=3 24 B12R2.606 NC1=NC=2C=C(F)C=CC2S1 BCP10150 [0,1,0,0,0,0|1,1,0]=3 25 B12R2.606 NC1=NN2C=CC(Br)=CC2=N1 BCP07699 [0,1,0,0,0,0|3,0,0]=4 26 B12R2.606 O=C1NC2=NC=C(Br)C=C2O1 BCP10942 [0,1,0,0,0,0|2,0,1]=4 27 B12R2.606 O=C1OC2=CC=C(Cl)C=C2N1 BCP07916 [0,1,0,0,0,0|1,0,1]=3 28 B12R2.606 SC1=NC2=C(C=CC(Cl)=C2)O1 BCP15804 [0,1,0,0,0,0|1,0,0]=2 29 B10R1.18 C1=NC=CC=C1CC(O)=O BCP20278 [0,0,1,0,0,0|3,0,0]=4 30 B10R1.18 CC(=O)Cc1ccncc1 BCP13413 [0,0,1,0,0,0|2,0,1]=4 31 B10R1.18 CC(NC1=CC=CC=C1)=O BCP02363 [0,0,1,0,0,0|0,0,2]=3 32 B10R1.18 NC(CC1=CC=CC=C1)=O BCP10408 [0,0,1,0,0,0|2,0,1]=4 33 B10R1.18 O=C(Cl)OC1=CC=CC=C1 BCP14449 [0,0,1,0,0,0|2,0,0]=3 34 B10R1.18 OC(=O)Cc1ccncc1 BCP05255 [0,0,1,0,0,0|3,0,0]=4 35 B10R1.18 S=C(Cl)OC1=CC=CC=C1 BCP10334 [0,0,1,0,0,0|2,0,0]=3 36 B12R2.24 CC1COC2=C(C=CC=C2)N1 BCP14442 [0,0,0,0,0,1|0,0,2]=3 37 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 BCP13447 [0,0,0,0,0,1|3,0,0]=4 38 B12R2.24 NC1=NC2=NC=CC=C2C=C1 BCP04700 [0,0,0,0,0,1|3,0,0]=4 39 B12R2.24 OC1=CC2=CC=CC=C2N=C1 BCP20129 [0,0,0,0,0,1|2,0,0]=3 40 B9R1.8 ONCC1=CC=CC=C1 BCP07876 [1,0,1,0,0,0|2,0,0]=4 41 B9R1.15 CNC1=CC=CC=C1N BCP19652 [1,0,1,0,0,0|1,0,1]=4 42 B9R1.15 IC1=C(C=O)C=CC=C1 BCP07495 [1,0,1,0,0,0|2,0,0]=4 43 B9R1.15 NC1=C(C=O)C=CC=C1 BCP07330 [1,0,1,0,0,0|1,0,1]=4 44 B9R1.15 NC1=NC=CC=C1OC BCP12904 [1,0,1,0,0,0|1,0,1]=4 45 B11R1.17 OC1=C(OCCO)C=CC=C1 BCP18969 [0,1,1,0,0,0|1,0,1]=4 46 B11R1.20 CC(NC1=CC=C(O)C=C1)=O BCP23431 [0,1,1,0,0,0|0,0,2]=4 47 B11R1.36 C1=C(C(C(O)=O)C)C=CC=C1 BCP16764 [0,1,1,0,0,0|2,0,0]=4 48 B11R1.36 C=C(C(O)=O)C1=CC=CC=C1 BCP01226 [0,1,1,0,0,0|2,0,0]=4 49 B11R1.36 C[C](c1ccccc1)C(=O)O BCP14307 [0,1,1,0,0,0|2,0,0]=4 50 B11R2.1 BrC1=C2C=CC=CN2N=C1 BCP07335 [1,1,0,0,0,0|2,0,0]=4 51 B11R2.1 BrC1=CN=C2N1C=CC=C2 BCP22690 [1,1,0,0,0,0|2,0,0]=4 52 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C BCP00912 [1,1,0,0,0,0|1,0,1]=4 53 B11R2.1 CN1C2=C(N=N1)C=CC=C2 BCP20547 [1,1,0,0,0,0|2,0,0]=4 54 B11R2.1 O=C1COc2c1cccc2 BCP07835 [1,1,0,0,0,0|1,0,1]=4 55 B11R2.36 BrC1=CC=C2C=CSC2=C1 BCP04573 [1,1,0,0,0,0|1,1,0]=4 56 B11R2.36 Brc1ccc2c(c1)CCO2 BCP08601 [1,1,0,0,0,0|1,0,1]=4 57 B11R2.36 Brc1ccc2c(c1)cco2 BCP01211 [1,1,0,0,0,0|1,0,0]=3 58 B11R2.36 CC1=CC2=C(C=C1)C=CN2 BCP00914 [1,1,0,0,0,0|1,0,1]=4 59 B11R2.36 ClC1=CC2=C(C=C1)C=CN2 BCP00061 [1,1,0,0,0,0|1,0,1]=4 60 B11R2.36 FC1=CC2=C(NC=C2)C=C1 BCP09868 [1,1,0,0,0,0|1,0,1]=4 61 B11R2.36 NC1=CC2=C(C=C1)NC=N2 BCP11467 [1,1,0,0,0,0|1,0,0]=3 62 B11R2.36 NC1=CC2=CC=NN2C=C1 BCP09810 [1,1,0,0,0,0|2,0,0]=4 63 B11R2.36 NC1=CC=C2OCCC2=C1 BCP19517 [1,1,0,0,0,0|1,0,1]=4 64 B11R2.36 Nc1ccc2n(c1)ccn2 BCP09820 [1,1,0,0,0,0|2,0,0]=4 65 B11R2.36 OC1=CC2=C(C=C1)OCO2 BCP14043 [1,1,0,0,0,0|1,0,1]=4 66 B11R2.36 OC1=CC2=NC=CN2C=C1 BCP13666 [1,1,0,0,0,0|2,0,0]=4 67 B11R2.106 BrC1=C2C=CSC2=CC=C1 BCP06885 [1,1,0,0,0,0|1,1,0]=4 68 B11R2.106 BrC1=C2OC=CC2=CC=C1 BCP10086 [1,1,0,0,0,0|1,0,0]=3 69 B11R2.106 BrC1=CC=CC2=C1C=CN2 BCP00057 [1,1,0,0,0,0|1,0,1]=4 70 B11R2.106 Brc1cccc2c1OCC2 BCP07134 [1,1,0,0,0,0|1,0,1]=4 71 B11R2.106 Brc1cccc2c1[nH]cc2 BCP00953 [1,1,0,0,0,0|1,0,1]=4 72 B11R2.106 C1=CN2C(=NC=N2)C(=C1)Br BCP19808 [1,1,0,0,0,0|2,0,0]=4 73 B11R2.106 ClC1=CC=NC2=C1CC=N2 BCP00243 [1,1,0,0,0,0|2,0,0]=4 74 B11R2.106 NC1=C2OCCC2=CC=C1 BCP14902 [1,1,0,0,0,0|1,0,1]=4 75 B11R2.106 NC1=CC=CC2=NC=CN21 BCP09816 [1,1,0,0,0,0|2,0,0]=4 76 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 BCP04093 [0,1,0,0,0,1|1,0,0]=3 77 B13R2.57 NCC1=CN=C2C(C=CC=C2)=C1 BCP11483 [0,1,0,0,0,1|1,0,0]=3 78 B13R2.57 O=Cc1cnc2c(c1)cccc2 BCP15507 [0,1,0,0,0,1|1,0,1]=4 79 B13R2.155 BrC1=CC2=NC(N)=NC=C2C=C1 BCP13678 [0,1,0,0,0,1|2,0,0]=4 80 B13R2.155 ClC1=NC=C2C=CC(Br)=CC2=N1 BCP10060 [0,1,0,0,0,1|2,0,0]=4 81 B13R2.155 Nc1cc2cc(Br)ccc2cn1 BCP29210 [0,1,0,0,0,1|2,0,0]=4 82 B13R2.162 CC1=CC=CC2=CC=C(C)N=C21 BCP23522 [0,1,0,0,0,1|1,0,0]=3 83 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=N1 BCP07122 [0,1,0,0,0,1|2,0,0]=4 84 B13R2.328 BrC1=CC(C)=NC2=C1C=CC=C2 BCP22686 [0,1,0,0,0,1|1,0,0]=3 85 B13R2.328 ClC1=C2C=CC=CC2=NC(Cl)=C1 BCP20135 [0,1,0,0,0,1|2,0,0]=4 86 B13R2.369 NC1=CC=2C=CC=CC2OC1=O BCP20024 [0,1,0,0,0,1|2,0,0]=4 87 B13R2.3683 ClC1=CC2=NC=C(Cl)N=C2C=C1 BCP07594 [0,1,0,0,0,1|2,0,0]=4 88 B13R2.3683 NC1=NC2=C(C=C(Br)C=C2)C=N1 BCP11479 [0,1,0,0,0,1|2,0,0]=4 89 B13R2.3028 CC1=C(C)NC2=C1C=C(Cl)C=C2 BCP05447 [0,2,0,0,0,0|1,0,1]=4 90 B13R2.5190 NC1=CC2=NN(C)C(C)=C2C=C1 BCP12745 [0,2,0,0,0,0|2,0,0]=4 91 B13R2.43 NC1=CC=C2N=C(SC2=C1)C#N BCP19002 [0,2,0,0,0,0|0,1,1]=4 92 B13R2.435 CC(C1=NC=2C=CC=CC2S1)=O BCP18676 [0,2,0,0,0,0|0,1,0]=3 93 B13R2.435 FC(F)C1=NC2=C(C=CC=C2)N1 BCP00468 [0,2,0,0,0,0|1,0,0]=3 94 B13R2.3050 OC1=C(F)C2=C(NC(C)=C2)C=C1 BCP05449 [0,2,0,0,0,0|1,0,1]=4 95 B13R2.2121 BrC=1SC2=CC(=CC=C2N1)OC BCP19004 [0,2,0,0,0,0|1,1,0]=4 96 B13R2.13083 NC1=NC2=C(S1)C=C(C)C(Cl)=C2 BCP09670 [0,2,0,0,0,0|1,1,0]=4 97 B9R1.6 N[C](C)C1=CC=CC=C1 BCP13697 [0,0,1,0,1,0|0,0,2]=4 98 B9R1.6 O=C(O)C1=CN=CC=C1 BCP16301 [0,0,1,0,1,0|2,0,0]=4 99 B9R1.6 O[C](C)C1=NC=CC=C1 BCP18401 [0,0,1,0,1,0|1,0,1]=4