0 B13R2.162 BrC1=CC=CC2=CC=C(I)C=C12 MC445702 [1,0,0,0,0,0|2,1,0]=4 1 B13R2.162 OC1=CC=C2C=CN=C(Cl)C2=C1 MC111226 [1,0,0,0,0,0|2,1,0]=4 2 B13R2.162 OC1=CC=CC2=C1C=C(Br)C=N2 CS15353 [1,0,0,0,0,0|2,0,1]=4 3 B13R2.162 OC1=CC=CC2=CC=C(Br)C=C12 MC432537 [1,0,0,0,0,0|3,0,0]=4 4 B13R2.162 OC1=CC=CC2=CC=C(F)C=C12 MC431686 [1,0,0,0,0,0|3,0,0]=4 5 B13R2.369 BrC1=CC2=CC=CC=C2C=C1Br CS11242 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.369 CC1=C(O)C=C2C=CC=NC2=C1 MC443422 [1,0,0,0,0,0|3,0,0]=4 7 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Cl CS15838 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.369 NC1=CC2=CC=CC=C2C=C1I MC431733 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.369 O=C1NC2=C(N=CC=C2)NC1=O MC107831 [1,0,0,0,0,0|2,0,1]=4 10 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=C1 MC443731 [1,0,0,0,0,0|3,0,0]=4 11 B13R2.5179 CC1=NC2=CC=CC(N)=C2C=C1 MC41751 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.5179 FC1=C2C=NC(Cl)=CC2=CC=C1 MC10452 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.5179 FC1=C2C=NC(Cl)=NC2=CC=C1 MC431898 [1,0,0,0,0,0|2,0,1]=4 14 B13R2.5179 FC1=C2N=CC(Br)=CC2=CC=C1 MC429330 [1,0,0,0,0,0|3,0,0]=4 15 B13R2.5179 FC1=C2N=CC(I)=CC2=CC=C1 MC115831 [1,0,0,0,0,0|3,0,0]=4 16 B13R2.5179 NC1=CC=CC2=CC(F)=CC=C12 MC432422 [1,0,0,0,0,0|3,0,0]=4 17 B13R2.5179 NC1=NC2=CC=CC(Br)=C2C=C1 MC441079 [1,0,0,0,0,0|1,1,1]=4 18 B13R2.5179 O=C1C=CC2=C(Cl)C=CC=C2N1 MC103322 [1,0,0,0,0,0|0,1,0]=2 19 B13R2.5179 O=C1C=CC2=C(Cl)C=CN=C2N1 MC107489 [1,0,0,0,0,0|1,1,0]=3 20 B13R2.5179 O=C1CCC2=C(F)C=CN=C2N1 MC432093 [1,0,0,0,0,0|1,0,2]=4 21 B13R2.5179 O=C1COC2=C(C=CC=C2O)N1 MC441078 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.5179 OC1=CC=C2C(O)=CC=CC2=C1 CS15075 [1,0,0,0,0,0|2,0,1]=4 23 B13R2.5179 OC1=CC=CC2=CC(Br)=CC=C12 CS16736 [1,0,0,0,0,0|3,0,0]=4 24 B13R2.5179 OC1=CC=CC2=CC(F)=CC=C12 MC431749 [1,0,0,0,0,0|3,0,0]=4 25 B13R1.148 NC(=S)C(=O)NC1=CC(Cl)=CC=C1 MC430685 [0,0,1,0,0,0|1,2,0]=4 26 B13R2.4825 O=C1NC2=C(Br)C=CC=C2C1=O CS13925 [0,0,0,0,1,0|1,1,1]=4 27 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O CS20590 [0,0,0,0,1,0|1,1,1]=4 28 B13R2.4825 O=C1NC2=C(F)C=CC=C2C1=O CS10646 [0,0,0,0,1,0|1,0,1]=3 29 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O CS13924 [0,0,0,0,1,0|0,1,1]=3 30 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O CS22789 [0,0,0,0,1,0|0,1,1]=3 31 B13R2.4856 O=C1NC2=CC=CC(F)=C2C1=O CS22839 [0,0,0,0,1,0|0,0,1]=2 32 B12R1.50 C=CC(=O)NC1=CC(N)=CC=C1 MC107629 [1,0,1,0,0,0|1,0,0]=3 33 B12R1.224 CC1=C(CC(=O)O)C=CC=C1F CS12682 [1,0,1,0,0,0|1,0,1]=4 34 B12R1.224 O=C(O)CC1=C(Cl)C(F)=CC=C1 CS13305 [1,0,1,0,0,0|2,0,0]=4 35 B12R1.224 O=C(O)CC1=C(F)C(F)=CC=C1 CS10729 [1,0,1,0,0,0|2,0,0]=4 36 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 CS10976 [1,0,1,0,0,0|2,0,0]=4 37 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 MC40216 [1,0,1,0,0,0|2,0,0]=4 38 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 CS10967 [1,0,1,0,0,0|1,1,0]=4 39 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1F MC40154 [1,0,1,0,0,0|1,0,1]=4 40 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1F MC40162 [1,0,1,0,0,0|1,0,1]=4 41 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 CS19153 [2,0,0,0,0,0|2,0,0]=4 42 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 CS21394 [2,0,0,0,0,0|1,0,1]=4 43 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 CS21392 [2,0,0,0,0,0|1,0,1]=4 44 B12R2.24 CC1=CC2=CC=CC=C2N=C1 CS11336 [2,0,0,0,0,0|1,0,1]=4 45 B12R2.24 CC1=NC2=CC=CC=C2C=C1 CS11335 [2,0,0,0,0,0|1,0,1]=4 46 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 CS22245 [2,0,0,0,0,0|1,0,1]=4 47 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 CS21419 [2,0,0,0,0,0|1,0,1]=4 48 B12R2.24 NC1=CC2=CC=CC=C2C=C1 MC41753 [2,0,0,0,0,0|2,0,0]=4 49 B12R2.24 NC1=CC2=CC=CC=C2N=C1 CS11010 [2,0,0,0,0,0|1,0,1]=4 50 B12R2.24 NC1=NC2=CC=CC=C2C=C1 CS11009 [2,0,0,0,0,0|1,0,1]=4 51 B12R2.24 O=C1C=CC2=CN=CC=C2N1 MC442445 [2,0,0,0,0,0|1,0,0]=3 52 B12R2.24 O=C1C=CC2=NC=CN=C2N1 CS12516 [2,0,0,0,0,0|2,0,0]=4 53 B12R2.24 O=C1C=NC2=C(N=CC=C2)N1 CS17925 [2,0,0,0,0,0|2,0,0]=4 54 B12R2.24 O=C1CCC2=CC=CC=C2N1 CS11038 [2,0,0,0,0,0|0,0,2]=4 55 B12R2.24 O=C1COC2=C(C=CC=C2)N1 CS21568 [2,0,0,0,0,0|1,0,1]=4 56 B12R2.24 OC1=CC2=CC=CC=C2C=C1 CS21708 [2,0,0,0,0,0|1,0,0]=3 57 B12R2.24 OC1=CC2=CC=CC=C2N=C1 CS19154 [2,0,0,0,0,0|0,0,1]=3 58 B12R2.24 OC1=CC=C2C=CC=NC2=C1 CS10982 [2,0,0,0,0,0|2,0,0]=4 59 B12R2.24 OC1=CC=C2C=CN=CC2=C1 MC441084 [2,0,0,0,0,0|2,0,0]=4 60 B12R2.24 OC1=CC=C2C=NC=CC2=C1 CS18471 [2,0,0,0,0,0|2,0,0]=4 61 B12R2.24 OC1=NC2=CC=CC=C2N=C1 CS21605 [2,0,0,0,0,0|1,0,1]=4 62 B12R2.1081 BrC1=C2C=CC=NC2=CC=C1 CS21397 [2,0,0,0,0,0|0,1,1]=4 63 B12R2.1081 BrC1=CC=CC2=CC=CC=C12 CS19505 [2,0,0,0,0,0|1,1,0]=4 64 B12R2.1081 CC1=C2C=CC=NC2=CC=C1 MC33383 [2,0,0,0,0,0|1,0,1]=4 65 B12R2.1081 ClC1=C2C=CC=NC2=CC=C1 CS21421 [2,0,0,0,0,0|0,1,1]=4 66 B12R2.1081 FC1=CC=CC2=C1CC=CO2 MC41786 [2,0,0,0,0,0|1,0,1]=4 67 B12R2.1081 FC1=CC=CC2=CC=CC=C12 MC20582 [2,0,0,0,0,0|1,0,0]=3 68 B12R2.1081 Ic1cccc2ccccc12 MC434036 [2,0,0,0,0,0|1,1,0]=4 69 B12R2.1081 NC1=CC=CC2=C1C=CC=N2 CS11015 [2,0,0,0,0,0|1,0,1]=4 70 B12R2.1081 NC1=CC=CC2=CC=CC=C12 CS20774 [2,0,0,0,0,0|2,0,0]=4 71 B12R2.1081 NC1=CC=CC2=CC=CC=C12 MC41752 [2,0,0,0,0,0|2,0,0]=4 72 B12R2.1081 OC1=CC=CC2=C1C=CC=N2 CS10980 [2,0,0,0,0,0|1,0,1]=4 73 B12R2.1081 OC1=CC=CC2=CC=CC=C12 CS18546 [2,0,0,0,0,0|2,0,0]=4 74 B14R2.142 COC1=CC=C2C=CC=C(F)C2=C1 MC114055 [1,1,0,0,0,0|1,0,0]=3 75 B14R2.4513 OC1=CC2=C(F)C(F)=CC=C2C=C1 MC114837 [1,1,0,0,0,0|1,0,0]=3 76 B14R2.8235 OC1=CC2=C(F)C=C(Br)C=C2C=C1 MC100565 [1,1,0,0,0,0|1,0,0]=3 77 B14R2.1128 O=CC1=CC2=CC=CC=C2C=C1O MC425440 [1,1,0,0,0,0|1,0,0]=3 78 B14R2.8239 OC1=CC=C2C=C(Br)C(O)=CC2=C1 MC103324 [1,1,0,0,0,0|2,0,0]=4 79 B14R2.29365 O=C1C=CC2=C(O)C=C(O)C=C2O1 CS10182 [1,1,0,0,0,0|2,0,0]=4 80 B14R2.8737 Cc1ccc2c(c1F)NC(=O)C2=O MC433922 [0,1,0,0,1,0|1,0,1]=4 81 B14R2.4506 O=C1NC2=CC=C(F)C(Cl)=C2C1=O MC107808 [0,1,0,0,1,0|0,1,1]=4 82 B14R2.11690 COC1=C2C(=O)C(=O)NC2=CC=C1 CS15542 [0,1,0,0,1,0|1,0,1]=4 83 B14R2.27750 O=C1NC2=CC(Cl)=CC(Cl)=C2C1=O CS13871 [0,1,0,0,1,0|0,1,1]=4 84 B14R2.27750 O=C1NC2=CC(F)=CC(F)=C2C1=O CS13577 [0,1,0,0,1,0|0,0,1]=3 85 B14R2.4529 O=C(O)C1=CC2=CC=C(F)C=C2N1 MC20055 [0,0,1,1,0,0|2,0,0]=4 86 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 CS14286 [0,0,1,1,0,0|2,0,0]=4 87 B14R2.1078 O=CC1=CC=CC2=C(F)C=CC=C12 MC431949 [0,0,1,1,0,0|2,0,0]=4 88 B12R1.24 NC1=C(C(=O)C=O)C=CC=C1F MC434029 [0,0,1,0,1,0|1,0,1]=4 89 B12R2.202 CC1=CC2=C(Br)C=CC=C2N1 CS14478 [1,0,0,0,1,0|1,1,0]=4 90 B12R2.202 FC1=CC=CC2=C1N=C(Cl)N2 CS20700 [1,0,0,0,1,0|2,0,0]=4 91 B12R2.202 O=C1CC2=C(F)C=CC=C2N1 CS22838 [1,0,0,0,1,0|0,0,2]=4 92 B12R2.203 CC1=CNC2=CC=CC(Br)=C12 CS12569 [1,0,0,0,1,0|1,1,0]=4 93 B12R2.203 CC1=NNC2=CC=CC(F)=C21 MC441186 [1,0,0,0,1,0|2,0,0]=4 94 B12R2.203 FC1=C2C(=CC=C1)NN=C2Br CS16108 [1,0,0,0,1,0|2,0,0]=4 95 B12R2.203 FC1=C2C(=CC=C1)NN=C2I CS19104 [1,0,0,0,1,0|2,0,0]=4 96 B12R2.203 FC1=C2C(Br)=CNC2=NC=C1 CS15418 [1,0,0,0,1,0|2,0,0]=4 97 B12R2.203 NC1=NNC2=CC=CC(F)=C21 MC33230 [1,0,0,0,1,0|2,0,0]=4 98 B12R2.203 OC1=NNC2=CC=CC(Br)=C21 MC105625 [1,0,0,0,1,0|1,1,0]=4 99 B12R2.18 O=C1NC2=CC=CC=C2C1=O CS11506 [1,0,0,0,1,0|0,0,1]=3 100 B12R2.196 O=C1CCC2=C(F)C=CC=C12 MC442503 [1,0,0,0,1,0|0,0,2]=4 101 B12R2.196 O=C1COC2=C1C=CC=C2F MC113785 [1,0,0,0,1,0|1,0,1]=4 102 B12R2.196 O=C1CSC2=C1C=CC=C2F MC107892 [1,0,0,0,1,0|1,0,1]=4 103 B14R1.5978 O=C(O)CC(=O)CC1=CC(F)=CC=C1 MC105949 [0,0,1,0,0,1|2,0,0]=4