0 B13R2.369 CC1=NC2=CC=CC=C2N=C1Cl BB57-5138 [0,0,0,0,0,0|3,0,1]=4 1 B13R2.369 CC1=NC2=CC=CC=C2NC1=O BB01-2991 [0,0,0,0,0,0|2,0,0]=2 2 B13R2.369 CC1NC2=CC=CC=C2NC1=O BB58-4464 [0,0,0,0,0,0|2,0,1]=3 3 B13R2.369 FC1=CC2=CN=CC=C2C=C1Br BB31-1311 [0,0,0,0,0,0|4,0,0]=4 4 B13R2.369 OC1=NC2=CC=CC=C2N=C1O BB01-5089 [0,0,0,0,0,0|1,0,2]=3 5 B13R2.369 SC1=NC2=CC=CC=C2N=C1S BB57-4838 [0,0,0,0,0,0|1,2,1]=4 6 B12R2.24 BrC1=CN=C2C=CC=CC2=C1 BB01-7804 [1,0,0,0,0,0|1,0,1]=3 7 B12R2.24 ClC1=CC2=CN=CC=C2C=C1 BB32-1617 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 BB57-6789 [1,0,0,0,0,0|1,0,1]=3 9 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 BB01-7793 [1,0,0,0,0,0|1,0,0]=2 10 B12R2.24 O=C1CCC2=CC=CC=C2N1 BB20-4909 [1,0,0,0,0,0|0,0,2]=3 11 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 BB01-4856 [1,0,0,0,0,0|1,0,1]=3 12 B12R2.24 O=C1COC2=CC=CC=C2N1 BB01-3566 [1,0,0,0,0,0|1,0,1]=3 13 B12R2.24 OC1=CC2=C(C=CC=N2)C=C1 BB57-3407 [1,0,0,0,0,0|2,0,0]=3 14 B12R2.24 OC1=CC=C2C=CC=CC2=N1 BB17-2144 [1,0,0,0,0,0|0,0,2]=3 15 B14R2.639 CC1(C)NC2=CC=CC=C2NC1=O BB20-4972 [0,1,0,0,0,0|2,0,1]=4 16 B14R2.1128 CCC1OC2=CC=CC=C2NC1=O BB01-2975 [0,1,0,0,0,0|2,0,1]=4 17 B14R2.1128 NNC1=C(O)N=C2C=CC=CC2=N1 BB01-5673 [0,1,0,0,0,0|2,0,1]=4 18 B14R2.1128 O=CC1=C(Cl)N=C2C=CC=CC2=C1 BB01-5681 [0,1,0,0,0,0|1,0,2]=4 19 B14R2.1128 O=CC1=CC2=CC=CC=C2N=C1O BB17-2379 [0,1,0,0,0,0|2,0,0]=3 20 B14R2.8188 CN1C(=O)NC2=CC=CC=C2C1=O BB58-3711 [0,1,0,0,0,0|2,0,0]=3 21 B14R2.8188 NN1C(=O)NC2=CC=CC=C2C1=O BB57-4608 [0,1,0,0,0,0|2,0,0]=3 22 B14R2.8188 O=C1OC2=CC=CC=C2C(O)=C1Br BB57-5016 [0,1,0,0,0,0|2,0,0]=3 23 B14R2.8239 O=C1C=CC2=CC(O)=C(O)C=C2O1 BB57-4660 [0,1,0,0,0,0|2,0,1]=4 24 B12R1.43 CC(Br)C(=O)NC1=CC=CC=C1 BB01-5555 [0,0,1,0,0,0|1,0,2]=4 25 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 BB55-1795 [0,0,1,0,0,0|1,0,2]=4 26 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O BB57-6615 [0,0,1,0,0,0|2,0,0]=3 27 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 BB55-5151 [0,0,1,0,0,0|1,0,2]=4 28 B12R1.43 O=C(O)\C(Cl)=C\C1=CC=CC=C1 BB57-2332 [0,0,1,0,0,0|2,0,0]=3 29 B12R1.371 CC1=CC=CC=C1NC(=O)CCl BB01-5233 [0,0,1,0,0,0|1,0,2]=4 30 B12R1.371 NNC(=O)NC1=CC=CC=C1O BB05-2822 [0,0,1,0,0,0|3,0,0]=4 31 B12R1.371 O=C(CBr)NC1=C(Cl)C=CC=C1 BB55-5020 [0,0,1,0,0,0|2,0,1]=4 32 B12R1.371 O=C(CBr)NC1=CC=CC=C1F BB17-0242 [0,0,1,0,0,0|2,0,1]=4 33 B12R1.371 O=C(CCl)NC1=CC=CC=C1Br BB55-1845 [0,0,1,0,0,0|2,0,1]=4 34 B12R1.371 O=C(CCl)NC1=CC=CC=C1Cl BB01-5112 [0,0,1,0,0,0|2,0,1]=4 35 B12R1.371 O=C(CCl)NC1=CC=CC=C1F BB01-5225 [0,0,1,0,0,0|2,0,1]=4 36 B12R1.371 O=C(CCl)NC1=CC=CC=C1I BB57-2911 [0,0,1,0,0,0|2,0,1]=4 37 B12R1.371 O=C(CCl)NC1=CC=CC=C1O BB57-5971 [0,0,1,0,0,0|2,0,1]=4 38 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 BB01-8134 [0,0,0,0,1,0|2,0,0]=3 39 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O BB01-6155 [0,0,0,0,1,0|0,0,1]=2 40 B14R2.741 O=C1NC2=CC=CC=C2CCC1Br BB58-2174 [0,0,0,0,0,1|1,0,2]=4 41 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 BB01-5922 [1,0,1,0,0,0|1,0,0]=3 42 B11R1.40 NCC(=O)NC1=CC=CC=C1 BB58-5120 [1,0,1,0,0,0|1,0,1]=4 43 B11R1.40 O=C(CCl)NC1=CC=CC=C1 BB12-3619 [1,0,1,0,0,0|1,0,1]=4 44 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 BB01-3764 [1,0,1,0,0,0|2,0,0]=4 45 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 BB55-7473 [1,0,1,0,0,0|2,0,0]=4 46 B11R1.86 CC(=O)NC1=CC=CC=C1O BB17-0735 [1,0,1,0,0,0|1,0,1]=4 47 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 BB01-6130 [1,0,1,0,0,0|1,0,1]=4 48 B11R1.86 O=C(O)CC1=CC=CC=C1Cl BB01-6128 [1,0,1,0,0,0|1,0,1]=4 49 B11R1.86 O=C(O)CC1=CC=CC=C1F BB01-6129 [1,0,1,0,0,0|1,0,1]=4 50 B13R1.133 CC1=CC=C(NC(=O)C(=O)O)C=C1 BB55-4710 [0,1,1,0,0,0|1,0,0]=3 51 B13R1.133 O=C(O)C(=O)CC1=CC=C(O)C=C1 BB57-6641 [0,1,1,0,0,0|2,0,0]=4 52 B13R1.133 O=C(O)C(=O)NC1=CC=C(F)C=C1 BB55-4705 [0,1,1,0,0,0|1,0,0]=3 53 B13R1.148 O=C(O)C(=O)NC1=CC(Cl)=CC=C1 BB55-4717 [0,1,1,0,0,0|1,0,0]=3 54 B13R1.148 O=C(O)C(=O)NC1=CC(F)=CC=C1 BB55-4702 [0,1,1,0,0,0|1,0,0]=3 55 B13R1.152 CN(C(=O)C(=O)O)C1=CC=CC=C1 BB55-4703 [0,1,1,0,0,0|1,0,0]=3 56 B13R1.202 CC1=C(NC(=O)C(=O)O)C=CC=C1 BB55-4721 [0,1,1,0,0,0|1,0,0]=3 57 B13R1.202 O=C(O)C(=O)NC1=C(Cl)C=CC=C1 BB55-4715 [0,1,1,0,0,0|1,0,0]=3 58 B13R1.202 O=C(O)C(=O)NC1=C(F)C=CC=C1 BB55-4696 [0,1,1,0,0,0|1,0,0]=3 59 B13R2.32 CC1=C(C)C2=CC=CC=C2C=C1 BB17-0559 [1,1,0,0,0,0|2,0,0]=4 60 B13R2.32 CC1=[N+](C)C2=CC=CC=C2C=C1 BB58-0123 [1,1,0,0,0,0|1,0,1]=4 61 B13R2.32 CN1C(=O)C=CC2=CC=CC=C21 BB58-5185 [1,1,0,0,0,0|0,0,0]=2 62 B13R2.32 CN1C(=S)C=CC2=CC=CC=C21 BB01-2473 [1,1,0,0,0,0|0,1,0]=3 63 B13R2.57 NNC1=CC2=CC=CC=C2C=C1 BB55-7351 [1,1,0,0,0,0|2,0,0]=4 64 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 BB57-7194 [1,1,0,0,0,0|0,0,2]=4 65 B13R2.57 O=CC1=CC=C2N=CC=CC2=C1 BB57-0554 [1,1,0,0,0,0|2,0,0]=4 66 B13R2.57 O=CC1=NC2=C(C=CC=C2)C=C1 BB01-5977 [1,1,0,0,0,0|0,0,1]=3 67 B13R2.155 NC1=CC=C2C=CC(O)=CC2=C1 BB57-0154 [1,1,0,0,0,0|1,0,0]=3 68 B13R2.155 O=C1C=CC2=C(C=C(Cl)C=C2)N1 BB32-0891 [1,1,0,0,0,0|0,0,0]=2 69 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)O1 BB01-6013 [1,1,0,0,0,0|1,0,0]=3 70 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 BB01-7901 [1,1,0,0,0,0|0,0,2]=4 71 B13R2.162 O=C1C=CC2=C(N1)C(O)=CC=C2 BB57-3401 [1,1,0,0,0,0|0,0,0]=2 72 B13R2.162 OC1=CC=CC2=C1N=C(Cl)C=C2 BB57-3392 [1,1,0,0,0,0|1,0,1]=4 73 B13R2.328 CC1=CC(Cl)=NC2=CC=CC=C12 BB58-4563 [1,1,0,0,0,0|1,0,1]=4 74 B13R2.328 CC1=NC2=C(C=CC=C2)C(N)=C1 BB01-8370 [1,1,0,0,0,0|1,0,1]=4 75 B13R2.328 CC1=NC2=CC=CC=C2C(O)=C1 BB01-2812 [1,1,0,0,0,0|1,0,1]=4 76 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)N1 BB01-0958 [1,1,0,0,0,0|0,0,0]=2 77 B13R2.328 O=C1C=C(O)C2=CC=CC=C2O1 BB01-7795 [1,1,0,0,0,0|1,0,0]=3 78 B13R2.328 O=C1NC(=O)C2=CC=CC=C2N1 BB01-7785 [1,1,0,0,0,0|1,0,0]=3 79 B13R2.328 O=C1NC(=O)C2=CC=CN=C2N1 BB20-3140 [1,1,0,0,0,0|2,0,0]=4 80 B13R2.3683 CC1=CC2=CC=C(C)N=C2C=C1 BB17-2145 [1,1,0,0,0,0|1,0,1]=4 81 B13R2.3683 CC1=CC=C2C=C(C)C=CC2=C1 BB17-0560 [1,1,0,0,0,0|2,0,0]=4 82 B13R2.3683 CC1=CC=C2NC(=O)CCC2=C1 BB57-5861 [1,1,0,0,0,0|0,0,2]=4 83 B13R2.3683 O=C1CCC2=CC(F)=CC=C2N1 BB57-5857 [1,1,0,0,0,0|0,0,2]=4 84 B13R2.3683 OC1=CC=C2C=C(O)C=CC2=C1 BB57-6846 [1,1,0,0,0,0|1,0,0]=3 85 B13R2.5179 CC1=CC=C2C(C)=CC=CC2=C1 BB55-7384 [1,1,0,0,0,0|2,0,0]=4 86 B13R2.45 CN1C(CO)=CC2=CC=CC=C21 BB58-1337 [0,1,0,0,1,0|2,0,0]=4 87 B13R2.45 O=CC1=C(Cl)C2=CC=CC=C2S1 BB57-6214 [0,1,0,0,1,0|2,0,0]=4 88 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)N1 BB01-4547 [0,1,0,0,1,0|1,0,1]=4 89 B13R2.135 CCN1C(=O)NC2=CC=CC=C21 BB55-8894 [0,1,0,0,1,0|2,0,0]=4 90 B13R2.135 N\N=C1/C(=O)NC2=CC=CC=C21 BB58-4977 [0,1,0,0,1,0|1,0,0]=3 91 B13R2.135 O=C1NC2=C(C=CC=C2)\C1=N/O BB01-8003 [0,1,0,0,1,0|0,0,0]=2 92 B13R2.135 O=CC1=C(Cl)NC2=CC=CC=C21 BB17-2375 [0,1,0,0,1,0|1,0,1]=4 93 B13R2.359 O=C1NC2=C(C=CC=C2)C1(Cl)Cl BB52-6589 [0,1,0,0,1,0|1,0,1]=4 94 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O BB01-4591 [0,1,0,0,1,0|0,0,1]=3 95 B13R2.3028 NC1C(=O)NC2=CC=C(F)C=C21 BB58-3759 [0,1,0,0,1,0|1,0,1]=4 96 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O BB17-2253 [0,1,0,0,1,0|0,0,1]=3 97 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O BB01-6339 [0,1,0,0,1,0|0,0,1]=3 98 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O BB01-6331 [0,1,0,0,1,0|0,0,1]=3 99 B13R2.4825 CC1=CC=CC2=C1NC(=O)C2=O BB01-4590 [0,1,0,0,1,0|0,0,1]=3 100 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O BB01-4214 [0,1,0,0,1,0|0,0,1]=3 101 B13R2.4825 O=C1NC2=C(F)C=CC=C2C1=O BB55-8108 [0,1,0,0,1,0|0,0,1]=3 102 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O BB01-4994 [0,1,0,0,1,0|0,0,1]=3 103 B15R2.274 O=CC1=C(O)C2=CC=CC=C2OC1=O BB53-1770 [0,2,0,0,0,0|1,0,1]=4 104 B15R2.984 CC(=O)C1=CC2=CC=CC=C2OC1=O BB17-2381 [0,2,0,0,0,0|1,0,1]=4 105 B15R2.1754 CC1=CC2=NC(O)=C(C=O)C=C2C=C1 BB01-5683 [0,2,0,0,0,0|2,0,0]=4 106 B15R2.21243 CN1C(=O)C(NN)=NC2=CC=CC=C21 BB57-6483 [0,2,0,0,0,0|2,0,0]=4 107 B15R2.9032 CN1C(=O)C(Cl)=C(O)C2=C1C=CC=C2 BB58-1209 [0,2,0,0,0,0|1,0,0]=3 108 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)N1 BB01-4568 [0,0,1,1,0,0|2,0,0]=4 109 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 BB57-1578 [0,0,1,1,0,0|1,0,0]=3 110 B11R2.1 CC1=CNC2=CC=CC=C12 BB01-6044 [1,0,0,0,1,0|1,0,0]=3 111 B11R2.1 CC1=NNC2=CC=CC=C21 BB57-2499 [1,0,0,0,1,0|2,0,0]=4 112 B11R2.1 IC1=CNC2=NC=CC=C12 BB20-1522 [1,0,0,0,1,0|2,0,0]=4 113 B11R2.1 NC1=NNC2=C1C=CC=C2 BB58-1538 [1,0,0,0,1,0|2,0,0]=4 114 B11R2.1 O=C1NNC2=C1C=CC=C2 BB20-2294 [1,0,0,0,1,0|1,0,1]=4 115 B11R2.1 O=C1NSC2=CC=CC=C12 BB01-6797 [1,0,0,0,1,0|2,0,0]=4 116 B11R2.1 O=C1OCC2=C1C=CC=C2 BB01-6204 [1,0,0,0,1,0|1,0,1]=4 117 B11R2.10 ClC1=NC2=CC=CC=C2N1 BB01-8305 [1,0,0,0,1,0|2,0,0]=4 118 B11R2.10 NC1=NC2=C(C=CC=C2)N1 BB20-0076 [1,0,0,0,1,0|2,0,0]=4 119 B11R2.10 O=C1CC2=C(C=CC=C2)C1 BB01-8363 [1,0,0,0,1,0|1,0,1]=4