0 B14R2.20 CC1=CC=C(C=C1)C2=CSC(=N2)N Z48847560 [0,0,0,0,0,0|1,1,2]=4 1 B14R2.20 CC1=CC=C(C=C1)C2=NC(=NN2)N Z57170086 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.20 CC1=CC=C(C=C1)C2=NOC(=C2)N Z57990855 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.20 CC1=CC=C(C=C1)C2CNC(=O)C2 Z1251360848 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.20 CC1=CSC(=N1)C2=CC=C(C=C2)Cl Z48867288 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.20 CC1=NC(=CO1)C2=CC=C(C=C2)N Z235352191 [0,0,0,0,0,0|2,0,2]=4 6 B14R2.20 CC1=NC(=CS1)C2=CC=C(C=C2)Cl Z56821365 [0,0,0,0,0,0|1,1,2]=4 7 B14R2.20 CC1=NC(=NO1)C2=CC=C(C=C2)N Z427942110 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.20 CC1=NC(=NO1)C2=CC=C(C=C2)O Z90124429 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.20 NC1=CC(=NN1)C2=CC=C(C=C2)Cl Z317042226 [0,0,0,0,0,0|3,0,1]=4 10 B14R2.20 NC1=CC(=NO1)C2=CC=C(C=C2)Br Z335439006 [0,0,0,0,0,0|2,1,1]=4 11 B14R2.20 NC1=CC(=NO1)C2=CC=C(C=C2)Cl Z56979376 [0,0,0,0,0,0|2,0,1]=3 12 B14R2.20 NC1=CC(=NO1)C2=CC=C(C=C2)F Z56979378 [0,0,0,0,0,0|2,1,1]=4 13 B14R2.20 NC1=CC(=NO1)C2=CC=C(C=C2)I Z362776376 [0,0,0,0,0,0|2,1,1]=4 14 B14R2.20 NC1=CC=C(C=C1)C2=CSC(=N2)N Z56799453 [0,0,0,0,0,0|1,1,2]=4 15 B14R2.20 NC1=CC=C(C=C1)C2=NNC(=N2)N Z802902270 [0,0,0,0,0,0|3,0,1]=4 16 B14R2.20 NC1=CC=C(C=C1)C2CCC(=O)N2 Z1258979785 [0,0,0,0,0,0|3,0,1]=4 17 B14R2.20 NC1=CC=C(C=C1)C2CNC(=O)C2 Z1255362676 [0,0,0,0,0,0|4,0,0]=4 18 B14R2.20 NC1=NC(=CO1)C2=CC=C(C=C2)Cl Z939904292 [0,0,0,0,0,0|0,0,2]=2 19 B14R2.20 NC1=NC(=CS1)C2=CC=C(C=C2)Br Z48847591 [0,0,0,0,0,0|0,2,2]=4 20 B14R2.20 NC1=NC(=CS1)C2=CC=C(C=C2)Cl Z48847650 [0,0,0,0,0,0|0,1,2]=3 21 B14R2.20 NC1=NC(=CS1)C2=CC=C(C=C2)F Z221527512 [0,0,0,0,0,0|0,2,2]=4 22 B14R2.20 NC1=NC(=CS1)C2=CC=C(C=C2)I Z53054019 [0,0,0,0,0,0|0,2,2]=4 23 B14R2.20 NC1=NC(=CS1)C2=CC=C(C=C2)O Z227972914 [0,0,0,0,0,0|1,1,2]=4 24 B14R2.20 NC1=NC(=NN1)C2=CC=C(C=C2)Cl Z1101435420 [0,0,0,0,0,0|2,0,1]=3 25 B14R2.20 NC1=NC(=NN1)C2=CC=C(C=C2)F Z336481654 [0,0,0,0,0,0|2,1,1]=4 26 B14R2.20 NC1=NC(=NN1)C2=CC=C(C=C2)O Z234896373 [0,0,0,0,0,0|3,0,1]=4 27 B14R2.20 NC1=NC(=NO1)C2=CC=C(C=C2)Cl Z991477690 [0,0,0,0,0,0|1,0,1]=2 28 B14R2.20 NC1=NC(=NO1)C2=CC=C(C=C2)F Z991477746 [0,0,0,0,0,0|1,1,1]=3 29 B14R2.20 NC1=NC(=NS1)C2=CC=C(C=C2)Br Z431702424 [0,0,0,0,0,0|1,2,1]=4 30 B14R2.20 NC1=NC(=NS1)C2=CC=C(C=C2)Cl Z431702514 [0,0,0,0,0,0|1,1,1]=3 31 B14R2.20 NC1=NC(=NS1)C2=CC=C(C=C2)F Z431702564 [0,0,0,0,0,0|1,2,1]=4 32 B14R2.20 NC1=NC(=NS1)C2=CC=C(C=C2)O Z3951659558 [0,0,0,0,0,0|2,1,1]=4 33 B14R2.20 NC1=NC=C(S1)C2=CC=C(C=C2)Cl Z732776068 [0,0,0,0,0,0|2,0,2]=4 34 B14R2.20 NC1=NCC(O1)C2=CC=C(C=C2)Cl Z1198155407 [0,0,0,0,0,0|2,0,0]=2 35 B14R2.20 NC1=NN(C=C1)C2=CC=C(C=C2)Br Z2211231279 [0,0,0,0,0,0|2,1,1]=4 36 B14R2.20 NC1=NN(C=C1)C2=CC=C(C=C2)Cl Z2467211492 [0,0,0,0,0,0|2,0,1]=3 37 B14R2.20 NC1=NN(C=C1)C2=CC=C(C=C2)F Z995041332 [0,0,0,0,0,0|2,1,1]=4 38 B14R2.20 NC1=NN(C=N1)C2=CC=C(C=C2)F Z2235790608 [0,0,0,0,0,0|2,1,1]=4 39 B14R2.20 NC1=NN(C=N1)C2=CC=C(C=C2)O Z1650031679 [0,0,0,0,0,0|3,0,1]=4 40 B14R2.20 NC1=NN(N=C1)C2=CC=C(C=C2)Br Z5533063617 [0,0,0,0,0,0|3,1,0]=4 41 B14R2.20 NC1=NN=C(O1)C2=CC=C(C=C2)Cl Z56886272 [0,0,0,0,0,0|3,0,1]=4 42 B14R2.20 NC1=NN=C(S1)C2=CC=C(C=C2)Cl Z57148446 [0,0,0,0,0,0|3,0,1]=4 43 B14R2.20 NC1=NOC(=N1)C2=CC=C(C=C2)Br Z1147463157 [0,0,0,0,0,0|2,1,1]=4 44 B14R2.20 NC1=NOC(=N1)C2=CC=C(C=C2)Cl Z1147463178 [0,0,0,0,0,0|2,0,1]=3 45 B14R2.20 NC1CCC(C1)C2=CC=C(C=C2)Cl Z2256130470 [0,0,0,0,0,0|2,0,1]=3 46 B14R2.20 NC1CCN(C1)C2=CC=C(C=C2)Cl Z594274280 [0,0,0,0,0,0|3,0,1]=4 47 B14R2.20 O=C1C=C(CN1)C2=CC=C(C=C2)Cl Z1509188622 [0,0,0,0,0,0|3,0,1]=4 48 B14R2.20 O=C1CC(CN1)C2=CC=C(C=C2)Br Z1269215863 [0,0,0,0,0,0|3,1,0]=4 49 B14R2.20 O=C1CC(CN1)C2=CC=C(C=C2)F Z1198162881 [0,0,0,0,0,0|3,1,0]=4 50 B14R2.20 O=C1CCC(N1)C2=CC=C(C=C2)Br Z1269201959 [0,0,0,0,0,0|2,1,1]=4 51 B14R2.20 O=C1CCC(N1)C2=CC=C(C=C2)F Z1255385257 [0,0,0,0,0,0|2,1,1]=4 52 B14R2.20 O=C1NC(=CO1)C2=CC=C(C=C2)Cl Z1509163669 [0,0,0,0,0,0|1,0,3]=4 53 B14R2.20 O=C1NC(CO1)C2=CC=C(C=C2)Br Z1266873491 [0,0,0,0,0,0|1,1,1]=3 54 B14R2.20 SC1=NC(=CS1)C2=CC=C(C=C2)Cl Z1222283420 [0,0,0,0,0,0|1,1,2]=4 55 B13R2.10 CC1=NC(=NO1)C2=CC=CC=C2 Z57791725 [1,0,0,0,0,0|2,0,1]=4 56 B13R2.10 NC1=CC(=NO1)C2=CC=CC=C2 Z164676856 [1,0,0,0,0,0|2,0,1]=4 57 B13R2.10 NC1=NC(=CO1)C2=CC=CC=C2 Z939904558 [1,0,0,0,0,0|0,0,2]=3 58 B13R2.10 NC1=NC(=CS1)C2=CC=CC=C2 Z48847603 [1,0,0,0,0,0|0,1,2]=4 59 B13R2.10 NC1=NC(=NN1)C2=CC=CC=C2 Z1891772907 [1,0,0,0,0,0|2,0,1]=4 60 B13R2.10 NC1=NC(=NO1)C2=CC=CC=C2 Z57454949 [1,0,0,0,0,0|1,0,1]=3 61 B13R2.10 NC1=NC(=NS1)C2=CC=CC=C2 Z431702624 [1,0,0,0,0,0|1,1,1]=4 62 B13R2.10 NC1=NC(CO1)C2=CC=CC=C2 Z1262629910 [1,0,0,0,0,0|0,0,0]=1 63 B13R2.10 NC1=NCC(N1)C2=CC=CC=C2 Z4461628926 [1,0,0,0,0,0|1,0,1]=3 64 B13R2.10 NC1=NN(C=C1)C2=CC=CC=C2 Z271098778 [1,0,0,0,0,0|2,0,1]=4 65 B13R2.10 NC1=NN(CC1)C2=CC=CC=C2 Z57473788 [1,0,0,0,0,0|2,0,0]=3 66 B13R2.10 NC1=NOC(=N1)C2=CC=CC=C2 Z56791884 [1,0,0,0,0,0|2,0,1]=4 67 B13R2.10 NC1=NSC(=N1)C2=CC=CC=C2 Z1198151495 [1,0,0,0,0,0|2,0,1]=4 68 B13R2.10 NC1CCC(C1)C2=CC=CC=C2 Z1947438117 [1,0,0,0,0,0|2,0,1]=4 69 B13R2.10 O=C1C=C(CO1)C2=CC=CC=C2 Z1862024981 [1,0,0,0,0,0|2,0,1]=4 70 B13R2.10 O=C1CC(CN1)C2=CC=CC=C2 Z954601980 [1,0,0,0,0,0|3,0,0]=4 71 B13R2.10 O=C1CC(CO1)C2=CC=CC=C2 Z1551943626 [1,0,0,0,0,0|2,0,0]=3 72 B13R2.10 O=C1NC(CO1)C2=CC=CC=C2 Z57199626 [1,0,0,0,0,0|1,0,1]=3 73 B13R2.10 O=C1NCC(N1)C2=CC=CC=C2 Z1255433877 [1,0,0,0,0,0|2,0,1]=4 74 B13R2.10 SC1=NC(=CO1)C2=CC=CC=C2 Z1198224385 [1,0,0,0,0,0|1,0,2]=4 75 B13R2.12 BrC1=CC=C(C=C1)C2=NOC=N2 Z1210306668 [1,0,0,0,0,0|1,1,1]=4 76 B13R2.12 ClC1=CC=C(C=C1)C2=CNC=N2 Z2239077877 [1,0,0,0,0,0|1,0,2]=4 77 B13R2.12 ClC1=CC=C(C=C1)C2=NNC=N2 Z1216815679 [1,0,0,0,0,0|2,0,1]=4 78 B13R2.12 ClC1=CC=C(C=C1)C2=NOC=N2 Z1201619154 [1,0,0,0,0,0|1,0,1]=3 79 B13R2.12 ClC1=CC=C(C=C1)C2CCCN2 Z1262246112 [1,0,0,0,0,0|1,0,2]=4 80 B13R2.12 ClC1=CC=C(C=C1)C2CCNC2 Z1266933891 [1,0,0,0,0,0|2,0,1]=4 81 B13R2.12 NC1=CC=C(C=C1)C2=NOC=N2 Z1263820479 [1,0,0,0,0,0|2,0,1]=4 82 B13R2.12 NC1=CC=C(C=C1)C2CCOC2 Z1486013480 [1,0,0,0,0,0|2,0,1]=4 83 B13R2.12 OC1=CC=C(C=C1)C2CCOC2 Z1486018525 [1,0,0,0,0,0|2,0,1]=4 84 B15R2.275 C=CC1=NC(=NO1)C2=CC=C(C=C2)Cl Z1162906959 [0,1,0,0,0,0|2,0,1]=4 85 B15R2.275 CCC1=NC(=NO1)C2=CC=C(C=C2)Cl Z57792053 [0,1,0,0,0,0|2,0,1]=4 86 B15R2.275 ClCC1=NC(=NO1)C2=CC=C(C=C2)Cl Z57743273 [0,1,0,0,0,0|2,0,1]=4 87 B15R2.275 NCC1=NC(=CN1)C2=CC=C(C=C2)Cl Z1268152388 [0,1,0,0,0,0|1,0,2]=4 88 B15R2.275 NCC1=NC(=CS1)C2=CC=C(C=C2)Cl Z319971342 [0,1,0,0,0,0|0,1,2]=4 89 B15R2.275 NCC1=NC(=NO1)C2=CC=C(C=C2)Cl Z1473033220 [0,1,0,0,0,0|1,0,1]=3 90 B15R2.275 NCC1=NOC(=N1)C2=CC=C(C=C2)Cl Z2041506879 [0,1,0,0,0,0|2,0,1]=4 91 B15R2.299 CC1=C(C=CC(=C1)C2=NOC(=N2)N)F Z991477786 [0,1,0,0,0,0|1,1,1]=4 92 B15R2.299 NC1=NC(=CO1)C2=CC(=C(C=C2)Cl)Cl Z939904592 [0,1,0,0,0,0|0,0,2]=3 93 B15R2.299 NC1=NC(=CO1)C2=CC(=C(C=C2)F)F Z2740145339 [0,1,0,0,0,0|0,1,2]=4 94 B15R2.299 NC1=NC(=CS1)C2=CC(=C(C=C2)Cl)Cl Z48847656 [0,1,0,0,0,0|0,1,2]=4 95 B15R2.307 CC1=CN(N=C1N)C2=CC=C(C=C2)Cl Z1993522734 [0,1,0,0,0,0|2,0,1]=4 96 B15R2.309 CC1=C(N=C(S1)N)C2=CC=C(C=C2)Cl Z48847688 [0,1,0,0,0,0|0,1,2]=4 97 B15R2.309 CC1=CC(=NN1C2=CC=C(C=C2)Cl)N Z995041190 [0,1,0,0,0,0|2,0,1]=4 98 B15R2.1153 NC1=CC(=NO1)C2=C(C=C(C=C2)Cl)Cl Z335439034 [0,1,0,0,0,0|2,0,1]=4 99 B15R2.1153 NC1=NC(=CS1)C2=C(C=C(C=C2)Cl)Cl Z56933452 [0,1,0,0,0,0|0,1,2]=4 100 B15R2.1153 NC1=NOC(=N1)C2=C(C=C(C=C2)Cl)Cl Z1147463086 [0,1,0,0,0,0|2,0,1]=4 101 B15R2.1153 O=C1NC(CO1)C2=C(C=C(C=C2)Br)F Z1266873365 [0,1,0,0,0,0|1,1,1]=4 102 B15R2.18922 CC1(CNC(=O)C1)C2=CC=C(C=C2)Cl Z1270255645 [0,1,0,0,0,0|3,0,0]=4 103 B15R2.18922 CC1(COC(=O)N1)C2=CC=C(C=C2)Br Z1266873349 [0,1,0,0,0,0|1,1,1]=4 104 B13R1.14 COC(=O)CCC1=CC=C(C=C1)N Z802847350 [0,0,1,0,0,0|3,0,0]=4 105 B13R1.14 COC(=O)CCC1=CC=C(C=C1)O Z796576156 [0,0,1,0,0,0|3,0,0]=4 106 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Br Z1269234118 [0,0,1,0,0,0|2,1,0]=4 107 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)F Z352782250 [0,0,1,0,0,0|2,1,0]=4 108 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)N Z1262514048 [0,0,1,0,0,0|3,0,0]=4 109 B13R1.132 CC1=CC=C(C=C1)C(C)CC(=O)O Z352782406 [0,0,1,0,0,0|3,0,0]=4 110 B13R1.132 NC(=O)C[C@@H](N)C1=CC=C(C=C1)Cl Z1346385388 [0,0,1,0,0,0|2,0,1]=4 111 B13R1.132 NC(=O)C[C@H](N)C1=CC=C(C=C1)Cl Z756926884 [0,0,1,0,0,0|2,0,1]=4 112 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl Z56899122 [0,0,1,0,0,0|3,0,0]=4 113 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)Cl Z982132070 [0,0,1,0,0,0|3,0,0]=4 114 B13R1.513 N=C(N)SCCC1=CC=C(C=C1)Cl Z2237698506 [0,0,1,0,0,0|0,1,0]=2 115 B13R1.513 NC(=O)CCSC1=CC=C(C=C1)Cl Z33545287 [0,0,1,0,0,0|3,0,0]=4 116 B13R1.513 NC(=O)CSCC1=CC=C(C=C1)Cl Z18433099 [0,0,1,0,0,0|3,0,0]=4 117 B13R1.513 O=C(O)CCCC1=CC=C(C=C1)Cl Z336286026 [0,0,1,0,0,0|3,0,0]=4 118 B13R2.147 CC1=CC=C(C=C1)C2CC(=O)N2 Z1238837490 [0,0,0,0,1,0|2,0,1]=4 119 B13R2.147 NC1CC(C1)C2=CC=C(C=C2)Br Z1696091784 [0,0,0,0,1,0|1,1,1]=4 120 B13R2.147 NC1CC(C1)C2=CC=C(C=C2)F Z1266854912 [0,0,0,0,1,0|1,1,1]=4 121 B13R2.147 N[C@H]1C[C@@H](C1)C2=CC=C(C=C2)Cl Z1947189743 [0,0,0,0,1,0|1,0,1]=3 122 B13R2.147 O=C1CC(C1)C2=CC=C(C=C2)Br Z385459408 [0,0,0,0,1,0|2,1,0]=4 123 B13R2.147 O=C1CC(C1)C2=CC=C(C=C2)F Z444338412 [0,0,0,0,1,0|2,1,0]=4 124 B13R2.147 O=C1CC(N1)C2=CC=C(C=C2)Br Z1238837631 [0,0,0,0,1,0|1,1,1]=4 125 B13R2.147 O=C1CC(N1)C2=CC=C(C=C2)Cl Z1198168152 [0,0,0,0,1,0|1,0,1]=3 126 B15R2.3 O=C1CCC(=NN1)C2=CC=C(C=C2)Cl Z49527483 [0,0,0,0,0,1|2,0,1]=4 127 B15R2.28 NC1=NC(=CC=N1)C2=CC=C(C=C2)Cl Z363993198 [0,0,0,0,0,1|1,0,2]=4 128 B15R2.28 NC1=NC(=CN=N1)C2=CC=C(C=C2)Cl Z381019784 [0,0,0,0,0,1|1,0,2]=4 129 B15R2.28 NC1=NC(=NC=C1)C2=CC=C(C=C2)Cl Z960787230 [0,0,0,0,0,1|1,0,2]=4 130 B15R2.28 NC1CCCC(C1)C2=CC=C(C=C2)Cl Z1233210545 [0,0,0,0,0,1|2,0,1]=4 131 B15R2.98 NC1=NC(=NO1)CC2=CC=C(C=C2)F Z991477738 [0,0,0,0,0,1|1,1,1]=4 132 B15R2.98 NC1=NN(C=N1)CC2=CC=C(C=C2)Cl Z600615128 [0,0,0,0,0,1|2,0,1]=4 133 B15R2.98 O=C1N[C@@H](CO1)CC2=CC=C(C=C2)O Z220564166 [0,0,0,0,0,1|2,0,1]=4 134 B12R1.12 CCC(CN)C1=CC=C(C=C1)Cl Z1198306661 [1,0,1,0,0,0|1,0,1]=4 135 B12R1.12 CNC(CO)C1=CC=C(C=C1)Cl Z2235386839 [1,0,1,0,0,0|0,0,2]=4 136 B12R1.12 NCC(CO)C1=CC=C(C=C1)Cl Z2130644164 [1,0,1,0,0,0|0,0,1]=3 137 B12R1.12 NCC(CO)C1=CC=C(C=C1)F Z1269131038 [1,0,1,0,0,0|0,1,1]=4 138 B12R1.12 OCC(CO)C1=CC=C(C=C1)Cl Z1198166557 [1,0,1,0,0,0|1,0,1]=4 139 B12R1.1 NCCCCC1=CC=C(C=C1)Cl Z3234944947 [1,0,1,0,0,0|1,0,1]=4 140 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Cl Z48820386 [1,0,1,0,0,0|2,0,0]=4 141 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl Z178961272 [1,0,1,0,0,0|2,0,0]=4 142 B12R1.27 COC(=O)CCC1=CC=CC=C1 Z18264384 [1,0,1,0,0,0|2,0,0]=4 143 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 Z33546734 [1,0,1,0,0,0|1,0,1]=4 144 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 Z56899204 [1,0,1,0,0,0|2,0,0]=4 145 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 Z1089996260 [1,0,1,0,0,0|1,0,1]=4 146 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 Z198194342 [1,0,1,0,0,0|0,0,2]=4 147 B12R1.107 CC(NC(=S)N)C1=CC=CC=C1 Z56913099 [1,0,1,0,0,0|0,1,1]=4 148 B12R1.252 N=C(N)COCC1=CC=CC=C1 Z2574925846 [1,0,1,0,0,0|2,0,0]=4 149 B12R1.252 N=C(N)CSCC1=CC=CC=C1 Z1795818268 [1,0,1,0,0,0|2,0,0]=4 150 B12R1.252 N=C(N)NCCC1=NC=CC=C1 Z1089995406 [1,0,1,0,0,0|2,0,0]=4 151 B12R1.252 NC(=O)NCCC1=CC=CC=C1 Z198194788 [1,0,1,0,0,0|2,0,0]=4 152 B12R1.252 NC(=S)NCCC1=CC=CC=C1 Z56933803 [1,0,1,0,0,0|2,0,0]=4 153 B14R1.10 COC(=O)CC(N)C1=CC=C(C=C1)Cl Z367450950 [0,1,1,0,0,0|2,0,0]=4 154 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(C=C1)Cl Z2768215215 [0,1,1,0,0,0|2,0,0]=4 155 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(C=C1)Cl Z1331055684 [0,1,1,0,0,0|2,0,0]=4 156 B14R1.502 COCC(=O)NCC1=CC=C(C=C1)Cl Z31452434 [0,1,1,0,0,0|1,0,1]=4 157 B14R1.4 COC1=CC=C(C=C1)CCNC(=N)N Z1089995164 [0,1,1,0,0,0|2,0,0]=4 158 B14R1.13 C/N=C(\N)/NCCC1=CC=C(C=C1)Cl Z991127516 [0,1,1,0,0,0|1,0,0]=3 159 B14R2.8 CNC1=NC(=NO1)C2=CC=CC=C2 Z992944726 [1,1,0,0,0,0|1,0,1]=4 160 B14R2.22 NC1=NC(=NO1)C2=CC(=CC=C2)F Z991477758 [1,1,0,0,0,0|1,0,1]=4 161 B14R2.22 NC1=NN(CC1)C2=CC(=CC=C2)Cl Z1262622749 [1,1,0,0,0,0|2,0,0]=4 162 B14R2.256 NC1=NC(=CO1)C2=C(C=CC=C2)Cl Z939904420 [1,1,0,0,0,0|0,0,2]=4 163 B14R2.256 NC1=NC(=NO1)C2=C(C=CC=C2)Cl Z991477790 [1,1,0,0,0,0|1,0,1]=4 164 B14R2.256 O=C1NC(CO1)C2=C(C=CC=C2)I Z2182109334 [1,1,0,0,0,0|1,0,1]=4 165 B16R2.63 CNCC1=NC(=NO1)C2=CC=C(C=C2)Cl Z104757314 [0,2,0,0,0,0|1,0,1]=4 166 B16R2.63 NCCC1=NC(=NO1)C2=CC=C(C=C2)Cl Z1266854928 [0,2,0,0,0,0|1,0,1]=4 167 B14R2.4402 O=C(O)[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl Z2306910175 [0,0,1,1,0,0|2,0,0]=4 168 B12R1.49 CCC(N)CC1=CC=C(C=C1)Cl Z2044769785 [0,0,1,0,1,0|1,0,1]=4 169 B12R1.49 COC(=O)CC1=CC=C(C=C1)Br Z18830099 [0,0,1,0,1,0|1,1,0]=4 170 B12R1.49 COC(=O)CC1=CC=C(C=C1)Cl Z18425668 [0,0,1,0,1,0|1,0,0]=3 171 B12R1.49 COC(=O)CC1=CC=C(C=C1)N Z285139238 [0,0,1,0,1,0|2,0,0]=4 172 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [0,0,1,0,1,0|1,0,1]=4 173 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br Z1259342200 [0,0,1,0,1,0|1,1,0]=4 174 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl Z982129848 [0,0,1,0,1,0|1,0,0]=3 175 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F Z792377290 [0,0,1,0,1,0|1,1,0]=4 176 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I Z1269218602 [0,0,1,0,1,0|1,1,0]=4 177 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N Z2935001159 [0,0,1,0,1,0|2,0,0]=4 178 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O Z792377274 [0,0,1,0,1,0|2,0,0]=4 179 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [0,0,1,0,1,0|1,0,1]=4 180 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl Z317024646 [0,0,1,0,1,0|2,0,0]=4 181 B12R2.22 N[C@H]1C[C@@H](C1)C2=CC=CC=C2 Z2301685436 [1,0,0,0,1,0|1,0,1]=4 182 B12R2.22 O=C1CC(C1)C2=CC=CC=C2 Z336080338 [1,0,0,0,1,0|2,0,0]=4 183 B12R2.22 O=C1CC(N1)C2=CC=CC=C2 Z367677412 [1,0,0,0,1,0|1,0,1]=4 184 B12R2.23 NC1CCC1C2=CC=CC=C2 Z1203589614 [1,0,0,0,1,0|1,0,1]=4 185 B12R2.23 N[C@@H]1CC[C@@H]1C2=CC=CC=C2 Z2489138864 [1,0,0,0,1,0|1,0,1]=4 186 B12R2.2302 ClC1=CC=C(C=C1)C2CCN2 Z1267773691 [1,0,0,0,1,0|0,0,2]=4 187 B12R2.2302 ClC1=CC=C(C=C1)C2CNC2 Z3244745362 [1,0,0,0,1,0|1,0,1]=4 188 B12R2.79 CC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2380468351 [0,0,0,0,2,0|1,0,1]=4 189 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)Cl Z3074487523 [0,0,0,0,2,0|1,0,1]=4 190 B12R2.79 NC1CC1C2=CC=C(C=C2)F Z1266823169 [0,0,0,0,2,0|0,1,1]=4 191 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Br Z2298098036 [0,0,0,0,2,0|0,1,1]=4 192 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl Z2298098012 [0,0,0,0,2,0|0,0,1]=3 193 B14R1.677 N=C(N)SCCOC1=CC=C(C=C1)Cl Z48820131 [0,0,1,0,0,1|0,1,0]=3 194 B14R1.677 N=C(N)SCCSC1=CC=C(C=C1)Cl Z48820360 [0,0,1,0,0,1|0,1,0]=3 195 B14R1.677 NC(=NCCSC1=CC=C(C=C1)Cl)N Z1127411793 [0,0,1,0,0,1|1,0,1]=4 196 B14R2.19 NC1=NCC(N1)CC2=CC=CC=C2 Z1331044122 [1,0,0,0,0,1|1,0,1]=4 197 B14R2.19 O=C1N[C@H](CO1)CC2=CC=CC=C2 Z1222283104 [1,0,0,0,0,1|1,0,1]=4 198 B14R2.21 O=C1COCC(N1)C2=CC=CC=C2 Z1255426729 [1,0,0,0,0,1|1,0,1]=4 199 B16R2.137 O=C1OCC(O1)SCC2=CC=C(C=C2)Cl Z2062194719 [0,0,0,0,0,2|2,0,0]=4