0 B14R2.8239 NC1CC2=CC=C(Cl)C=C2NC1=O 14885 [0,0,0,0,0,0|1,1,2]=4 1 B14R2.8239 O=C1C=CC2=CC(O)=C(O)C=C2O1 10610 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.8239 OC1=NC2=CC=C(Cl)C=C2N=C1O 15426 [0,0,0,0,0,0|1,1,2]=4 3 B13R2.155 BrC1=CC=C2C=CC(Br)=CC2=C1 36175 [1,0,0,0,0,0|2,1,0]=4 4 B13R2.155 CC1=NC2=CC(Cl)=CC=C2C=C1 5850 [1,0,0,0,0,0|1,1,1]=4 5 B13R2.155 CC1=NC2=CC(F)=CC=C2C=C1 5896 [1,0,0,0,0,0|1,0,1]=3 6 B13R2.155 ClC1=NC2=CC(Br)=CC=C2C=C1 27904 [1,0,0,0,0,0|1,1,1]=4 7 B13R2.155 FC1=CC=C2C=NC(Cl)=NC2=C1 14313 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.155 NC1=CC=C2CCC(=O)NC2=C1 19778 [1,0,0,0,0,0|1,0,2]=4 9 B13R2.155 NC1=NC2=CC(Br)=CC=C2C=C1 34537 [1,0,0,0,0,0|1,1,1]=4 10 B13R2.155 NC1=NC2=CC(F)=CC=C2C=N1 14314 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.155 O=C1C=CC2=CC=C(O)C=C2N1 5866 [1,0,0,0,0,0|1,0,0]=2 12 B13R2.155 O=C1C=CC2=CC=C(O)C=C2O1 10607 [1,0,0,0,0,0|2,0,0]=3 13 B13R2.155 O=C1C=NC2=CC=C(Cl)C=C2N1 18465 [1,0,0,0,0,0|1,1,0]=3 14 B13R2.155 O=C1CCC2=CC=C(Cl)C=C2N1 25678 [1,0,0,0,0,0|0,1,2]=4 15 B13R2.155 O=C1CCC2=CC=C(F)C=C2C1 18147 [1,0,0,0,0,0|1,0,2]=4 16 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 14908 [1,0,0,0,0,0|1,0,2]=4 17 B13R2.155 O=C1COC2=C(C=C(Br)C=C2)N1 16746 [1,0,0,0,0,0|1,1,1]=4 18 B13R2.155 O=C1COC2=C(C=C(Cl)C=C2)N1 27691 [1,0,0,0,0,0|1,1,1]=4 19 B13R2.155 O=C1COC2=C(C=C(O)C=C2)N1 27892 [1,0,0,0,0,0|2,0,1]=4 20 B13R2.155 O=C1COC2=CC=C(F)C=C2C1 18379 [1,0,0,0,0,0|2,0,1]=4 21 B13R2.155 OC1=CC2=CC(Br)=CC=C2C=C1 32314 [1,0,0,0,0,0|1,1,1]=4 22 B13R2.155 OC1=NC2=NC(F)=CC=C2C=C1 10122 [1,0,0,0,0,0|1,0,2]=4 23 B13R2.369 CC1=C(O)C=C2C=CC=NC2=C1 34451 [1,0,0,0,0,0|3,0,0]=4 24 B13R2.369 CC1=CC2=CC=CC=C2N=C1Cl 12431 [1,0,0,0,0,0|2,0,1]=4 25 B13R2.369 CC1=NC2=CC=CC=C2N=C1O 15424 [1,0,0,0,0,0|2,0,1]=4 26 B13R2.369 ClC1=NC2=CC=CC=C2C=C1Br 35526 [1,0,0,0,0,0|2,0,1]=4 27 B13R2.369 NC1=CC2=CC=CC=C2C=C1N 15532 [1,0,0,0,0,0|3,0,0]=4 28 B13R2.369 NC1CC2=CC=CC=C2NC1=O 17875 [1,0,0,0,0,0|1,0,2]=4 29 B13R2.369 OC1=NC2=CC=CC=C2N=C1O 25656 [1,0,0,0,0,0|1,0,2]=4 30 B13R2.3683 BrC1=CC2=CC=C(I)C=C2N=C1 35122 [1,0,0,0,0,0|1,1,1]=4 31 B13R2.3683 CC1=CC=C2C=C(O)C=CC2=C1 33548 [1,0,0,0,0,0|2,0,0]=3 32 B13R2.3683 CC1=NC2=CC=C(F)C=C2C=C1 7579 [1,0,0,0,0,0|3,0,0]=4 33 B13R2.3683 ClC1=CC2=CC=C(Br)C=C2N=C1 21575 [1,0,0,0,0,0|1,1,1]=4 34 B13R2.3683 ClC1=CC=C2C=C(Br)C=NC2=C1 21567 [1,0,0,0,0,0|1,1,1]=4 35 B13R2.3683 FC1=CC=C2C=C(Br)C=CC2=C1 12551 [1,0,0,0,0,0|2,0,0]=3 36 B13R2.3683 NC1=CC2=CC=C(Cl)C=C2N=C1 21568 [1,0,0,0,0,0|1,1,1]=4 37 B13R2.3683 NC1=CC2=CC=C(F)C=C2C=C1 27846 [1,0,0,0,0,0|2,0,0]=3 38 B13R2.3683 O=C1C=CC2=CC(F)=CC=C2N1 26337 [1,0,0,0,0,0|2,0,1]=4 39 B13R2.3683 O=C1C=CC2=CC(O)=CC=C2O1 11099 [1,0,0,0,0,0|3,0,0]=4 40 B13R2.3683 OC1=CC2=CC=C(Br)C=C2C=C1 2170 [1,0,0,0,0,0|1,1,0]=3 41 B13R2.3683 OC1=CC2=CC=C(Cl)C=C2C=C1 27928 [1,0,0,0,0,0|1,1,0]=3 42 B13R2.3683 OC1=CC2=CC=C(F)C=C2C=C1 27847 [1,0,0,0,0,0|1,0,0]=2 43 B15R2.1754 N#CC1=CC2=CC=C(O)C=C2OC1=O 11028 [0,1,0,0,0,0|3,0,0]=4 44 B15R2.21336 COC1=CC=C2NC(=O)C(=O)NC2=C1 34277 [0,1,0,0,0,0|2,0,1]=4 45 B15R2.62227 O=C1NC2=CC(F)=C(F)C=C2NC1=O 31678 [0,1,0,0,0,0|1,0,1]=3 46 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(F)C=C1 19256 [0,0,1,0,0,0|1,0,2]=4 47 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 13606 [0,0,0,0,1,0|2,0,1]=4 48 B13R2.3028 CC1CC2=CC=C(F)C=C2C1=O 9661 [0,0,0,0,1,0|1,0,2]=4 49 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1=O 1666 [0,0,0,0,1,0|1,1,1]=4 50 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O 13607 [0,0,0,0,1,0|1,1,1]=4 51 B13R2.3028 O=C1NC2=CC=C(F)C=C2C1=O 1685 [0,0,0,0,1,0|1,0,1]=3 52 B13R2.3028 O=C1NC2=CC=C(I)C=C2C1=O 15509 [0,0,0,0,1,0|1,1,1]=4 53 B13R2.5190 O=C1NC2=CC(Br)=CC=C2C1=O 29201 [0,0,0,0,1,0|0,1,1]=3 54 B13R2.5190 O=C1NC2=CC(Cl)=CC=C2C1=O 13996 [0,0,0,0,1,0|0,1,1]=3 55 B13R2.5190 O=C1NC2=CC(F)=CC=C2C1=O 20320 [0,0,0,0,1,0|0,0,1]=2 56 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 8253 [1,0,1,0,0,0|2,0,0]=4 57 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 3758 [1,0,1,0,0,0|1,1,0]=4 58 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 3630 [1,0,1,0,0,0|1,1,0]=4 59 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 3491 [1,0,1,0,0,0|1,0,0]=3 60 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 24323 [1,0,1,0,0,0|2,0,0]=4 61 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 8247 [1,0,1,0,0,0|2,0,0]=4 62 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O 8190 [1,0,1,0,0,0|2,0,0]=4 63 B12R1.50 C=CC(=O)NC1=CC(N)=CC=C1 25681 [1,0,1,0,0,0|1,0,0]=3 64 B12R1.50 O=C(CCl)NC1=CC(F)=CC=C1 8398 [1,0,1,0,0,0|1,0,1]=4 65 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 3489 [1,0,1,0,0,0|2,0,0]=4 66 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 4346 [1,0,1,0,0,0|2,0,0]=4 67 B12R1.127 CC(=O)NC1=C(I)C=CC(F)=C1 31770 [1,0,1,0,0,0|1,0,1]=4 68 B12R1.127 O=C(O)CC1=C(Br)C=CC(F)=C1 16327 [1,0,1,0,0,0|2,0,0]=4 69 B12R1.127 O=C(O)CC1=C(Cl)C=CC(F)=C1 2711 [1,0,1,0,0,0|2,0,0]=4 70 B12R1.127 O=C(O)CC1=C(F)C=CC(F)=C1 4151 [1,0,1,0,0,0|2,0,0]=4 71 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 4174 [1,0,1,0,0,0|1,0,1]=4 72 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 2703 [1,0,1,0,0,0|1,0,1]=4 73 B12R1.233 O=C(O)CC1=C(Cl)C=C(F)C=C1 2710 [1,0,1,0,0,0|1,0,1]=4 74 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 4093 [1,0,1,0,0,0|1,0,1]=4 75 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 9426 [2,0,0,0,0,0|1,1,0]=4 76 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 5814 [2,0,0,0,0,0|1,0,1]=4 77 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 12788 [2,0,0,0,0,0|0,1,1]=4 78 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 21827 [2,0,0,0,0,0|1,0,1]=4 79 B12R2.24 CC1=CC2=CC=CC=C2N=C1 2344 [2,0,0,0,0,0|1,0,1]=4 80 B12R2.24 CC1=CC=C2C=CC=NC2=C1 5811 [2,0,0,0,0,0|1,0,1]=4 81 B12R2.24 CC1=NC2=CC=CC=C2C=C1 5809 [2,0,0,0,0,0|1,0,1]=4 82 B12R2.24 ClC1=CC2=CC=CC=C2C=C1 9464 [2,0,0,0,0,0|1,1,0]=4 83 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 14555 [2,0,0,0,0,0|1,0,1]=4 84 B12R2.24 ClC1=CC=C2C=CC=NC2=C1 19899 [2,0,0,0,0,0|0,1,1]=4 85 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 7580 [2,0,0,0,0,0|1,0,1]=4 86 B12R2.24 FC1=CC2=CC=CC=C2C=C1 19886 [2,0,0,0,0,0|1,0,0]=3 87 B12R2.24 FC1=CC=C2C=NC=CC2=C1 27896 [2,0,0,0,0,0|2,0,0]=4 88 B12R2.24 FC1=CC=C2N=CC=CC2=C1 36233 [2,0,0,0,0,0|2,0,0]=4 89 B12R2.24 IC1=NC2=CC=CC=C2C=C1 24681 [2,0,0,0,0,0|1,0,1]=4 90 B12R2.24 NC1=CC2=CC=CC=C2C=C1 23236 [2,0,0,0,0,0|2,0,0]=4 91 B12R2.24 NC1=CC2=CC=CC=C2N=C1 12769 [2,0,0,0,0,0|1,0,1]=4 92 B12R2.24 NC1=CC=C2C=CC=NC2=C1 12786 [2,0,0,0,0,0|1,0,1]=4 93 B12R2.24 NC1=NC2=CC=CC=C2C=C1 5818 [2,0,0,0,0,0|1,0,1]=4 94 B12R2.24 O=C1C=CC2=CC=CC=C2O1 21620 [2,0,0,0,0,0|1,0,0]=3 95 B12R2.24 O=C1C=CC2=CC=NC=C2N1 25763 [2,0,0,0,0,0|1,0,0]=3 96 B12R2.24 O=C1C=CC2=CN=CC=C2N1 27583 [2,0,0,0,0,0|1,0,0]=3 97 B12R2.24 O=C1COC2=C(C=CC=C2)N1 18791 [2,0,0,0,0,0|1,0,1]=4 98 B12R2.24 OC1=CC2=CC=CC=C2N=C1 12770 [2,0,0,0,0,0|0,0,1]=3 99 B12R2.24 OC1=CC=C2C=CC=NC2=C1 5841 [2,0,0,0,0,0|1,0,1]=4 100 B12R2.24 OC1=CC=C2C=CN=CC2=C1 6264 [2,0,0,0,0,0|2,0,0]=4 101 B12R2.24 OC1=CC=C2C=NC=CC2=C1 6260 [2,0,0,0,0,0|2,0,0]=4 102 B12R2.24 OC1=CC=C2N=CC=CC2=C1 5840 [2,0,0,0,0,0|2,0,0]=4 103 B12R2.24 OC1=NC2=CC=CC=C2N=C1 15472 [2,0,0,0,0,0|1,0,1]=4 104 B12R2.24 SC1=CC2=CC=CC=C2C=C1 6833 [2,0,0,0,0,0|1,1,0]=4 105 B14R2.4513 O=C1C=CC2=CC=C(O)C(O)=C2O1 13303 [1,1,0,0,0,0|2,0,0]=4 106 B14R2.29365 CC1=CC(=O)OC2=CC(N)=CC=C12 11097 [1,1,0,0,0,0|2,0,0]=4 107 B14R2.29365 CC1=CC(=O)OC2=CC(S)=CC=C12 34169 [1,1,0,0,0,0|2,0,0]=4 108 B14R2.29365 O=C1NC(=O)C2=CC=C(F)C=C2N1 14315 [1,1,0,0,0,0|1,0,0]=3 109 B14R2.29365 O=C1NC2=CC(Br)=CC=C2C(=O)O1 12757 [1,1,0,0,0,0|1,1,0]=4 110 B14R2.29365 O=C1NC2=CC(Cl)=CC=C2C(=O)O1 12751 [1,1,0,0,0,0|1,1,0]=4 111 B14R2.1128 N#CC1=CC2=CC=CC=C2OC1=O 8675 [1,1,0,0,0,0|2,0,0]=4 112 B14R2.2332 C=CC1=CC=C2C=C(O)C=CC2=C1 26531 [1,1,0,0,0,0|2,0,0]=4 113 B14R2.2332 COC1=CC2=CC=C(Br)C=C2N=C1 21576 [1,1,0,0,0,0|0,1,1]=4 114 B14R2.2332 COC1=CC=C2C=C(Br)C=CC2=C1 29076 [1,1,0,0,0,0|1,1,0]=4 115 B14R2.2332 COC1=CC=C2C=C(O)C=CC2=C1 2282 [1,1,0,0,0,0|2,0,0]=4 116 B14R2.2332 O=CC1=CC2=CC=C(O)C=C2C=C1 35927 [1,1,0,0,0,0|2,0,0]=4 117 B14R2.29369 OC1=C(Br)C2=CC=C(Br)C=C2C=C1 22920 [1,1,0,0,0,0|1,1,0]=4 118 B14R2.645 CC1=C(F)C=C2C(=O)C(=O)NC2=C1 29122 [0,1,0,0,1,0|1,0,1]=4 119 B14R2.645 O=C1NC2=CC(F)=C(F)C=C2C1=O 29177 [0,1,0,0,1,0|1,0,1]=4 120 B14R2.645 O=C1NC2=CC(F)=C(F)C=C2C1=O 31699 [0,1,0,0,1,0|1,0,1]=4 121 B14R2.9184 CC1=C2NC(=O)C(=O)C2=CC(F)=C1 29123 [0,1,0,0,1,0|1,0,1]=4 122 B14R2.1815 O=C1NC2=CC(CF)=CC=C2C1=O 29176 [0,1,0,0,1,0|0,0,1]=3 123 B14R2.8737 CC1=C2NC(=O)C(=O)C2=CC=C1F 29125 [0,1,0,0,1,0|0,0,1]=3 124 B14R2.8737 CC1=CC=C2C(=O)C(=O)NC2=C1F 17138 [0,1,0,0,1,0|1,0,1]=4 125 B14R2.8737 CC1=CC=C2C(=O)C(=O)NC2=C1F 29127 [0,1,0,0,1,0|1,0,1]=4 126 B14R2.27750 O=C1NC2=CC(F)=CC(Cl)=C2C1=O 31700 [0,1,0,0,1,0|0,0,1]=3 127 B16R2.192946 OCC1=CC2=CC(F)=C(F)C=C2N=C1Cl 25939 [0,2,0,0,0,0|1,0,1]=4 128 B16R2.23521 O=C(O)C1=CC2=CC(Br)=CC=C2C=C1O 25443 [0,2,0,0,0,0|1,1,0]=4 129 B16R2.23521 O=C(O)C1=CC2=CC(O)=CC=C2C=C1O 9419 [0,2,0,0,0,0|2,0,0]=4 130 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)O2 32494 [0,0,1,1,0,0|2,0,0]=4 131 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)O1 28020 [0,0,1,1,0,0|1,1,0]=4 132 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)O1 32493 [0,0,1,1,0,0|1,1,0]=4 133 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)O1 32495 [0,0,1,1,0,0|1,0,0]=3 134 B14R2.4529 O=C(O)C1=CC2=C(C=C(O)C=C2)O1 35763 [0,0,1,1,0,0|2,0,0]=4 135 B14R2.4529 O=C(O)C1=CC2=CC=C(F)C=C2N1 1684 [0,0,1,1,0,0|2,0,0]=4 136 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 2531 [0,0,1,1,0,0|2,0,0]=4 137 B14R2.8620 CC1=C2NC(=O)C(=O)C2=C(F)C=C1 29121 [0,0,1,1,0,0|0,0,2]=4 138 B14R2.8620 O=C1NC2=C(Br)C=CC(F)=C2C1=O 20357 [0,0,1,1,0,0|1,0,1]=4 139 B14R2.8620 O=C1NC2=C(F)C=CC(F)=C2C1=O 15260 [0,0,1,1,0,0|1,0,1]=4 140 B12R1.1703 O=CC(=O)C1=C(F)C=C(F)C=C1 12166 [0,0,1,0,1,0|1,0,1]=4 141 B12R2.132 CC1=CNC2=CC=C(F)C=C12 1686 [1,0,0,0,1,0|2,0,0]=4 142 B12R2.132 CC1=CSC2=C1C=C(F)C=C2 7416 [1,0,0,0,1,0|2,0,0]=4 143 B12R2.132 O=C1CCC2=CC=C(F)C=C12 8856 [1,0,0,0,1,0|0,0,2]=4 144 B12R2.132 O=C1OCC2=CC=C(F)C=C12 22583 [1,0,0,0,1,0|1,0,1]=4 145 B12R2.606 CC1=CC2=CC=C(Cl)C=C2N1 19921 [1,0,0,0,1,0|1,1,0]=4 146 B12R2.606 CC1=CC2=CC=C(F)C=C2N1 19920 [1,0,0,0,1,0|1,0,0]=3 147 B12R2.606 CC1=CC2=CC=C(O)C=C2N1 19945 [1,0,0,0,1,0|2,0,0]=4 148 B12R2.606 CC1=NC2=C(C=C(F)C=C2)N1 6528 [1,0,0,0,1,0|2,0,0]=4 149 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 1687 [1,0,0,0,1,0|2,0,0]=4 150 B12R2.606 O=C1CC2=CC=C(Br)C=C2N1 7320 [1,0,0,0,1,0|0,1,1]=4 151 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 1674 [1,0,0,0,1,0|0,1,1]=4 152 B12R2.606 O=C1CC2=CC=C(F)C=C2C1 18032 [1,0,0,0,1,0|1,0,1]=4 153 B12R2.606 O=C1CC2=CC=C(F)C=C2N1 1688 [1,0,0,0,1,0|0,0,1]=3 154 B12R2.606 O=C1NC2=C(C=C(F)C=C2)S1 21837 [1,0,0,0,1,0|2,0,0]=4 155 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)O1 21892 [1,0,0,0,1,0|1,1,0]=4 156 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)S1 21841 [1,0,0,0,1,0|1,1,0]=4 157 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)O1 8642 [1,0,0,0,1,0|1,1,0]=4 158 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)S1 13573 [1,0,0,0,1,0|1,1,0]=4 159 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 7334 [1,0,0,0,1,0|2,0,0]=4 160 B12R2.18 O=C1NC2=CC=CC=C2C1=O 13609 [1,0,0,0,1,0|0,0,1]=3 161 B12R2.18 O=C1NC2=NC=CC=C2C1=O 26690 [1,0,0,0,1,0|1,0,1]=4 162 B12R2.612 BrC1=CC=C2C(Br)=CNC2=C1 8325 [1,0,0,0,1,0|1,1,0]=4 163 B12R2.612 CC1=NNC2=CC(F)=CC=C21 20302 [1,0,0,0,1,0|2,0,0]=4 164 B12R2.612 FC1=CC=C2C(=C1)NN=C2Br 33034 [1,0,0,0,1,0|2,0,0]=4 165 B12R2.612 FC1=CC=C2C(=C1)NN=C2I 33035 [1,0,0,0,1,0|2,0,0]=4