0 B14R2.8239 CC1=CC2=CC(Cl)=CC=C2N=C1N OR307519 [0,0,0,0,0,0|2,1,1]=4 1 B14R2.8239 CC1=CC2=CC(F)=CC=C2N=C1Cl PC404556 [0,0,0,0,0,0|2,0,1]=3 2 B14R2.8239 CC1=CC2=CC(F)=CC=C2N=C1N PC404500 [0,0,0,0,0,0|2,0,1]=3 3 B14R2.8239 CC1=CC2=CC=C(F)C=C2N=C1Cl PC404501 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.8239 CC1=CC2=CC=C(F)C=C2N=C1N PC7195 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.8239 CC1=CC=C2N=C(Cl)C(C)=CC2=C1 OR307901 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.8239 O=C1C=CC2=C(C=C(O)C(Cl)=C2)O1 OR351240 [0,0,0,0,0,0|4,0,0]=4 7 B14R2.8239 OC1=C(O)N=C2C=C(F)C=CC2=N1 PC446058 [0,0,0,0,0,0|1,0,2]=3 8 B13R2.155 CC1=NC2=C(C=CC(F)=C2)C=C1 PC0635 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.155 FC1=CC2=CC(Br)=CC=C2C=N1 PC57049 [1,0,0,0,0,0|3,0,0]=4 10 B13R2.155 FC1=CC=C2C=CC(Cl)=NC2=C1 PC404622 [1,0,0,0,0,0|3,0,0]=4 11 B13R2.155 NC1=CC2=CC(F)=CC=C2N=C1 PC49030 [1,0,0,0,0,0|1,0,1]=3 12 B13R2.155 OC1=CC2=C(C=C1)C=CC(O)=N2 OR321481 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.155 OC1=CC2=CC(Br)=CC=C2N=C1 OR307869 [1,0,0,0,0,0|0,1,1]=3 14 B13R2.155 OC1=CC=C2C=CC(Cl)=CC2=N1 OR2149 [1,0,0,0,0,0|2,1,0]=4 15 B13R2.155 OC1=NC2=NC(F)=CC=C2C=C1 PC19691 [1,0,0,0,0,0|3,0,0]=4 16 B13R2.369 BrC1=CC2=C(C=CC=C2)C=C1Br OR302155 [1,0,0,0,0,0|3,0,0]=4 17 B13R2.369 CC1=CC2=CC=CC=C2N=C1N OR309451 [1,0,0,0,0,0|2,0,1]=4 18 B13R2.369 CC1=NC2=C(C=CC=C2)N=C1O OR300638 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.369 CC1=NC2=CC=CC=C2C=C1N OR309366 [1,0,0,0,0,0|2,0,1]=4 20 B13R2.369 CC1SC2=C(C=CC=C2)NC1=O OR110446 [1,0,0,0,0,0|2,0,1]=4 21 B13R2.369 NC1=CC2=CC=CC=C2OC1=O OR6156 [1,0,0,0,0,0|2,0,0]=3 22 B13R2.369 O=C1NC2=C(C=NC=C2)NC1=O OR54537 [1,0,0,0,0,0|2,0,1]=4 23 B13R2.369 O=C1OC2=CC=CC=C2C=C1Cl OR345156 [1,0,0,0,0,0|2,0,0]=3 24 B13R2.369 OC1=NC2=CC=CC=C2N=C1O OR30493 [1,0,0,0,0,0|1,0,2]=4 25 B13R2.3683 CC1=CC2=CC=C(F)C=C2C=C1 PC32109 [1,0,0,0,0,0|2,0,0]=3 26 B13R2.3683 CC1=CC=C2C=C(N)C=CC2=N1 OR21398 [1,0,0,0,0,0|2,0,1]=4 27 B13R2.3683 CC1=NC2=C(C=C1)C=C(F)C=C2 PC3827 [1,0,0,0,0,0|1,0,1]=3 28 B13R2.3683 FC1=CC2=CC=C(Br)C=C2C=C1 PC7265 [1,0,0,0,0,0|2,0,0]=3 29 B13R2.3683 FC1=CC=C2N=C(Cl)C=CC2=C1 PC404621 [1,0,0,0,0,0|1,0,1]=3 30 B13R2.3683 FC1=CC=C2N=C(Cl)C=NC2=C1 PC201263 [1,0,0,0,0,0|2,0,1]=4 31 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CC2 OR451145 [1,0,0,0,0,0|1,0,2]=4 32 B13R2.3683 NC1=CC2=C(C=C1)OC(=O)C=C2 OR318015 [1,0,0,0,0,0|2,0,0]=3 33 B13R2.3683 NC1=CC2=CC=C(F)C=C2N=C1 PC49035 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.3683 NC1=NC2=C(C=C1)C=C(Br)C=C2 OR307864 [1,0,0,0,0,0|1,1,1]=4 35 B13R2.3683 NC1=NC2=CC=C(Cl)C=C2C=C1 OR471112 [1,0,0,0,0,0|1,1,1]=4 36 B13R2.3683 O=C1C=CC2=C(C=CC(Cl)=C2)O1 OR471287 [1,0,0,0,0,0|1,1,0]=3 37 B13R2.3683 O=C1C=NC2=CC(F)=CC=C2N1 PC201262 [1,0,0,0,0,0|1,0,0]=2 38 B13R2.3683 O=C1CCC2=CC(Cl)=CC=C2N1 OR303220 [1,0,0,0,0,0|0,1,2]=4 39 B13R2.3683 O=C1COC2=C(C=CC(F)=C2)N1 PC200146 [1,0,0,0,0,0|1,0,1]=3 40 B13R2.3683 O=C1CSC2=CC(F)=CC=C2N1 PC200535 [1,0,0,0,0,0|1,0,1]=3 41 B13R2.3683 O=C1NC2=C(C=C(Br)C=C2)CO1 OR400397 [1,0,0,0,0,0|1,1,1]=4 42 B13R2.3683 OC1=NC2=C(C=C1)C=C(I)C=C2 OR471271 [1,0,0,0,0,0|0,1,2]=4 43 B15R2.1754 O=CC1=CC2=CC=C(Cl)C=C2N=C1O OR309255 [0,1,0,0,0,0|2,1,0]=4 44 B15R2.1754 O=CC1=CC2=CC=C(F)C=C2N=C1Cl PC404559 [0,1,0,0,0,0|3,0,0]=4 45 B15R2.1824 CC1=CC=C2N=C(Cl)C(CO)=CC2=C1 OR309263 [0,1,0,0,0,0|2,0,1]=4 46 B15R2.1824 FC1=CC=C2N=C(Cl)C(CCl)=CC2=C1 PC404554 [0,1,0,0,0,0|2,0,1]=4 47 B15R2.1824 N#CC1=CC2=CC(F)=CC=C2N=C1Cl PC404557 [0,1,0,0,0,0|2,0,1]=4 48 B15R2.1824 O=CC1=CC2=CC(F)=CC=C2N=C1Cl PC404558 [0,1,0,0,0,0|1,0,2]=4 49 B15R2.1824 OCC1=CC2=CC(Cl)=CC=C2N=C1Cl OR309256 [0,1,0,0,0,0|1,1,1]=4 50 B15R2.62227 O=C1NC2=C(C=C(F)C(F)=C2)NC1=O PC210109 [0,1,0,0,0,0|1,0,1]=3 51 B15R2.62227 OC1=CC2=CC(Br)=C(O)C=C2C=C1Br OR471332 [0,1,0,0,0,0|2,1,0]=4 52 B13R1.133 CC(NC1=CC=C(F)C=C1)C(=O)O PC201163 [0,0,1,0,0,0|2,0,1]=4 53 B13R1.148 O=C(O)C(O)CC1=CC=CC(F)=C1 PC510274 [0,0,1,0,0,0|1,0,2]=4 54 B13R1.148 O=C(O)[C@@H](O)CC1=CC=CC(F)=C1 PC510276 [0,0,1,0,0,0|1,0,2]=4 55 B13R1.2679 O=C(CCl)NC1=C(F)C=C(F)C=C1 PC1686 [0,0,1,0,0,0|2,0,1]=4 56 B13R2.3028 CC1=C(C)C2=C(C=CC(Br)=C2)N1 OR315504 [0,0,0,0,1,0|2,1,0]=4 57 B13R2.3028 CC1=C(C)C2=CC(F)=CC=C2N1 PC520512 [0,0,0,0,1,0|2,0,0]=3 58 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O PC0325 [0,0,0,0,1,0|0,0,1]=2 59 B13R2.5190 O=C1C2=CC=C(F)C=C2OC1Br PC500587 [0,0,0,0,1,0|2,0,1]=4 60 B13R2.5190 O=C1NC2=CC(F)=CC=C2C1=O PC408008 [0,0,0,0,1,0|1,0,1]=3 61 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 PC3732 [1,0,1,0,0,0|2,0,0]=4 62 B12R1.43 O=C(O)\C(F)=C\C1=CC=CC=C1 PC3729 [1,0,1,0,0,0|2,0,0]=4 63 B12R1.43 O=C(O)\C(F)=C\C1=CC=CC=C1 PC8812 [1,0,1,0,0,0|2,0,0]=4 64 B12R1.49 NNC(=O)NC1=CC=C(F)C=C1 PC2141 [1,0,1,0,0,0|2,0,0]=4 65 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 PC1688F [1,0,1,0,0,0|1,0,1]=4 66 B12R1.49 O=C(CS)NC1=CC=C(F)C=C1 PC31158 [1,0,1,0,0,0|0,1,1]=4 67 B12R1.226 CC(=O)\C=C\C1=CC=CC(Br)=C1 OR300762 [1,0,1,0,0,0|1,1,0]=4 68 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 OR350254 [1,0,1,0,0,0|2,0,0]=4 69 B12R1.226 NC(=O)NNC1=CC(F)=CC=C1 PC9716 [1,0,1,0,0,0|2,0,0]=4 70 B12R1.226 O=C(O)C=CC1=CC(F)=CC=C1 PC3731 [1,0,1,0,0,0|1,0,0]=3 71 B12R1.226 O=[N+]([O-])\C=C\C1=CC(F)=CC=C1 PC201286 [1,0,1,0,0,0|2,0,0]=4 72 B12R1.127 CC1=C(CC(=O)O)C=C(F)C=C1 PC0371 [1,0,1,0,0,0|1,0,1]=4 73 B12R1.127 O=C(O)CC1=C(Br)C=CC(F)=C1 PC7747 [1,0,1,0,0,0|1,0,1]=4 74 B12R1.127 O=C(O)CC1=C(Cl)C=CC(F)=C1 PC2515 [1,0,1,0,0,0|1,0,1]=4 75 B12R1.127 O=C(O)CC1=C(F)C=CC(F)=C1 PC2874C [1,0,1,0,0,0|1,0,1]=4 76 B12R1.233 CC(=O)NC1=C(Br)C=C(F)C=C1 PC1394M [1,0,1,0,0,0|1,0,1]=4 77 B12R1.233 CC(=O)NC1=C(C)C=C(F)C=C1 PC0358 [1,0,1,0,0,0|0,0,2]=4 78 B12R1.233 CC(=O)NC1=C(Cl)C=C(F)C=C1 PC1814 [1,0,1,0,0,0|1,0,1]=4 79 B12R1.233 CC(=O)NC1=C(F)C=C(F)C=C1 PC2569 [1,0,1,0,0,0|1,0,1]=4 80 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 PC302112 [1,0,1,0,0,0|1,0,1]=4 81 B12R1.233 NC(=O)NC1=C(F)C=C(F)C=C1 PC1316 [1,0,1,0,0,0|2,0,0]=4 82 B12R1.233 NC(=O)NC1=CC=C(F)C=C1Br PC501485 [1,0,1,0,0,0|2,0,0]=4 83 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 PC2440 [1,0,1,0,0,0|2,0,0]=4 84 B12R1.233 O=C(O)CC1=C(Cl)C=C(F)C=C1 PC4091 [1,0,1,0,0,0|2,0,0]=4 85 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 PC2874B [1,0,1,0,0,0|2,0,0]=4 86 B12R2.24 FC1=CC2=C(C=C1)C=NC=C2 PC201019 [2,0,0,0,0,0|2,0,0]=4 87 B12R2.24 FC1=CC2=C(C=C1)N=CC=N2 PC4570 [2,0,0,0,0,0|1,0,1]=4 88 B12R2.24 FC1=CC2=CC=CC=C2C=C1 PC2378 [2,0,0,0,0,0|1,0,0]=3 89 B12R2.24 FC1=CC=C2N=CC=CC2=C1 PC6908 [2,0,0,0,0,0|0,0,1]=3 90 B12R2.24 O=C1COC2=C(C=CC=C2)N1 OR322066 [2,0,0,0,0,0|1,0,1]=4 91 B14R1.134 NNC(=O)C(=O)NC1=CC=C(F)C=C1 PC9356 [0,1,1,0,0,0|1,0,1]=4 92 B14R2.134 COC1=CC2=CC(Br)=CC=C2C=C1 OR470815 [1,1,0,0,0,0|1,1,0]=4 93 B14R2.134 COC1=CC=C2C=CC(C)=CC2=C1 OR470814 [1,1,0,0,0,0|2,0,0]=4 94 B14R2.134 COC1=CC=C2N=CC(F)=CC2=C1 PC200015 [1,1,0,0,0,0|2,0,0]=4 95 B14R2.4513 FC1=CC=C2N=CC(Br)=C(Cl)C2=C1 PC404594 [1,1,0,0,0,0|1,0,1]=4 96 B14R2.4513 FC1=CC=C2N=CC(Cl)=C(Br)C2=C1 PC404602 [1,1,0,0,0,0|1,0,1]=4 97 B14R2.4513 FC1=CC=C2N=CC(Cl)=C(Cl)C2=C1 PC404595 [1,1,0,0,0,0|1,0,1]=4 98 B14R2.4513 NC1=C(Br)C=NC2=C1C=C(F)C=C2 PC404608 [1,1,0,0,0,0|1,0,1]=4 99 B14R2.4513 O=C1C(Br)=COC2=CC=C(F)C=C12 PC9712 [1,1,0,0,0,0|2,0,0]=4 100 B14R2.4513 O=C1C(I)=COC2=CC=C(F)C=C12 PC200507 [1,1,0,0,0,0|2,0,0]=4 101 B14R2.1128 CCC1=NC2=C(C=CC=C2)NC1=O OR25840 [1,1,0,0,0,0|2,0,0]=4 102 B14R2.1128 N#CC1=C(O)C=C2C=CC=CC2=C1 OR471069 [1,1,0,0,0,0|2,0,0]=4 103 B14R2.1128 N#CC1=CC2=CC=CC=C2OC1=O OR345027 [1,1,0,0,0,0|2,0,0]=4 104 B14R2.1128 OCC1=CC2=CC=CC=C2N=C1Cl OR309269 [1,1,0,0,0,0|1,0,1]=4 105 B14R2.2332 COC1=CC=C2OC(=O)C=CC2=C1 OR9101 [1,1,0,0,0,0|2,0,0]=4 106 B14R2.2332 N#CC1=CC2=CC=C(F)C=C2C=C1 PC6244 [1,1,0,0,0,0|2,0,0]=4 107 B14R2.2332 O=CC1=NC2=CC=C(F)C=C2C=C1 PC56081 [1,1,0,0,0,0|0,0,1]=3 108 B14R2.8235 CC1=CC(Br)=C2C=C(F)C=CC2=N1 PC404614 [1,1,0,0,0,0|1,0,1]=4 109 B14R2.8235 CC1=CC(Cl)=NC2=CC=C(F)C=C12 PC404620 [1,1,0,0,0,0|1,0,1]=4 110 B14R2.8235 CC1=CC=C2NC(=O)NC(=O)C2=C1 OR323060 [1,1,0,0,0,0|2,0,0]=4 111 B14R2.8235 CC1=CC=C2NC(=O)OC(=O)C2=C1 OR400012 [1,1,0,0,0,0|2,0,0]=4 112 B14R2.8235 CC1=NC2=C(C=C(F)C=C2)C(O)=C1 PC3756T [1,1,0,0,0,0|1,0,1]=4 113 B14R2.8235 CC1=NC2=C(O)C=C(F)C=C2C=C1 PC510158 [1,1,0,0,0,0|1,0,1]=4 114 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(Cl)=C1 PC200558 [1,1,0,0,0,0|1,0,1]=4 115 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(N)=C1 PC7197 [1,1,0,0,0,0|1,0,1]=4 116 B14R2.8235 FC1=CC2=C(Cl)C=C(Cl)N=C2C=C1 PC449020 [1,1,0,0,0,0|1,0,1]=4 117 B14R2.8235 O=C1CC(=O)C2=C(C=CC(F)=C2)O1 PC6507 [1,1,0,0,0,0|1,0,1]=4 118 B14R2.8235 O=C1NC2=CC=C(F)C=C2C(=O)O1 PC8701 [1,1,0,0,0,0|1,0,0]=3 119 B14R2.8235 O=C1NC2=CC=C(I)C=C2C(=O)O1 OR400030 [1,1,0,0,0,0|1,1,0]=4 120 B14R2.645 O=C1NC2=C(C=C(Cl)C(F)=C2)C1=O PC510278 [0,1,0,0,1,0|0,1,1]=4 121 B14R2.645 O=C1NC2=CC(Cl)=C(F)C=C2C1=O PC250000 [0,1,0,0,1,0|0,0,1]=3 122 B14R2.9184 CC1=CC2=C(NC(=O)C2=O)C(Br)=C1 OR471591 [0,1,0,0,1,0|1,0,1]=4 123 B14R2.9184 CC1=CC2=C(NC(=O)C2=O)C(C)=C1 OR322609 [0,1,0,0,1,0|1,0,1]=4 124 B14R2.19008 NCC1C(=O)NC2=C1C=C(F)C=C2 PC430531 [0,1,0,0,1,0|1,0,1]=4 125 B14R2.19008 O=CC1=C(Cl)NC2=C1C=C(F)C=C2 PC300936 [0,1,0,0,1,0|1,0,1]=4 126 B14R2.27750 O=C1NC2=C(C1=O)C(F)=CC(F)=C2 PC900686 [0,1,0,0,1,0|1,0,1]=4 127 B16R2.128840 CN1CC(=O)NC2=C(C=C(F)C=C2)C1=O PC7801 [0,1,0,0,0,1|2,0,0]=4 128 B16R2.8614 CC1=C(C#N)C(=O)OC2=C1C=C(F)C=C2 PC6516 [0,2,0,0,0,0|2,0,0]=4 129 B16R2.8614 O=CC1=C(Cl)C2=CC(F)=CC=C2OC1=O PC4260 [0,2,0,0,0,0|1,0,1]=4 130 B16R2.23521 CC1=NC2=CC=C(F)C=C2C=C1C(=O)O PC1927 [0,2,0,0,0,0|1,0,1]=4 131 B16R2.23521 O=C(O)C1=CC2=C(C=CC(Br)=C2)OC1=O OR21141 [0,2,0,0,0,0|1,1,0]=4 132 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2N1 PC3758E [0,0,1,1,0,0|2,0,0]=4 133 B14R2.4529 O=C(O)C1=NC2=CC(F)=CC=C2N1 PC200073 [0,0,1,1,0,0|2,0,0]=4 134 B14R2.7969 NC(=O)C1=CC2=C(S1)C(Br)=CC=C2 OR111179 [0,0,1,1,0,0|0,2,0]=4 135 B14R2.7969 O=C(Cl)C1=CC2=C(S1)C(F)=CC=C2 PC56818 [0,0,1,1,0,0|1,1,0]=4 136 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2S1 PC7541 [0,0,1,1,0,0|1,1,0]=4 137 B14R2.2159 O=CC1=CC2=C(S1)C(F)=CC=C2Br PC502484 [0,0,1,1,0,0|1,1,0]=4 138 B12R1.1703 O=CC(=O)C1=CC=C(F)C=C1F PC2005 [0,0,1,0,1,0|1,0,1]=4 139 B12R1.354 O=CC(=O)C1=C(F)C=CC(F)=C1 PC10525 [0,0,1,0,1,0|1,0,1]=4 140 B12R2.132 BrC1=CC2=C(C=C1)NC=C2I OR305539 [1,0,0,0,1,0|1,1,0]=4 141 B12R2.132 CC1=CNC2=C1C=C(F)C=C2 PC3027 [1,0,0,0,1,0|1,0,0]=3 142 B12R2.132 CC1=CSC2=C1C=C(F)C=C2 PC9452 [1,0,0,0,1,0|2,0,0]=4 143 B12R2.132 FC1=CC=C2NN=C(Br)C2=C1 PC5508 [1,0,0,0,1,0|2,0,0]=4 144 B12R2.132 FC1=CC=C2NN=C(I)C2=C1 PC8399 [1,0,0,0,1,0|2,0,0]=4 145 B12R2.132 NC1=NNC2=C1C=C(F)C=C2 PC51032 [1,0,0,0,1,0|2,0,0]=4 146 B12R2.132 OC1=CNC2=C1C=C(Br)C=C2 OR305206 [1,0,0,0,1,0|0,1,0]=3 147 B12R2.606 CC1=CC2=C(C=CC(F)=C2)N1 PC7645 [1,0,0,0,1,0|1,0,0]=3 148 B12R2.606 CC1=CC2=CC=C(F)C=C2N1 PC7443 [1,0,0,0,1,0|2,0,0]=4 149 B12R2.606 CC1=NC2=C(C=CC(F)=C2)N1 PC9456 [1,0,0,0,1,0|2,0,0]=4 150 B12R2.606 ClC1=CC2=C(C=C1)NC(I)=C2 OR471570 [1,0,0,0,1,0|1,1,0]=4 151 B12R2.606 FC1=CC=C2NC(=S)NC2=C1 PC201265 [1,0,0,0,1,0|1,1,0]=4 152 B12R2.606 FC1=CC=C2NC(Cl)=NC2=C1 PC201022 [1,0,0,0,1,0|2,0,0]=4 153 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 PC1735 [1,0,0,0,1,0|0,0,2]=4 154 B12R2.606 O=C1NC2=CC=C(F)C=C2O1 PC200526 [1,0,0,0,1,0|1,0,1]=4 155 B12R2.612 O=C1CCC2=CC(F)=CC=C12 PC3757 [1,0,0,0,1,0|0,0,2]=4 156 B12R2.612 O=C1COC2=CC(F)=CC=C12 PC6230 [1,0,0,0,1,0|1,0,1]=4 157 B12R2.612 O=C1NNC2=C1C=CC(F)=C2 PC201329 [1,0,0,0,1,0|2,0,0]=4 158 B12R2.612 O=C1NOC2=CC(F)=CC=C12 PC201390 [1,0,0,0,1,0|2,0,0]=4 159 B12R2.612 O=C1NSC2=CC(F)=CC=C12 PC53136 [1,0,0,0,1,0|2,0,0]=4 160 B12R2.612 O=C1OCC2=CC(F)=CC=C12 PC500768 [1,0,0,0,1,0|1,0,1]=4