0 B21R3.756161 COC1=CC2=C(C=C1)N=C(NC2=O)C3=NC=CN=C3 Z840288622 [0,0,0,0,0,0|4,0,0]=4 1 B21R3.756161 COC1=CC2=C(C=C1)N=C(NC2=O)C3=NC=NC=C3 Z1983052000 [0,0,0,0,0,0|4,0,0]=4 2 B20R3.263189 CC1=CC2=C(C=C1)N=C(NC2=O)C3=CC=CC=C3 Z274352874 [1,0,0,0,0,0|2,0,0]=3 3 B20R3.263189 O=C1C=C(NC2=C1C=C(C=C2)Br)C3=CC=CC=C3 Z445213152 [1,0,0,0,0,0|2,0,0]=3 4 B20R3.263189 O=C1NC(=NC2=C1C=C(C=C2)F)C3=CC=CC=C3 Z666685624 [1,0,0,0,0,0|3,0,0]=4 5 B22R3.1186113 COC1=CC2=C(C=C1)N=C(NC2=O)C3=NC=C(C=C3)Br Z1356053211 [0,1,0,0,0,0|3,0,0]=4 6 B22R3.1186113 COC1=CC2=C(C=C1)N=C(NC2=O)C3=NC=C(C=C3)Cl Z1389071661 [0,1,0,0,0,0|3,0,0]=4 7 B22R3.17389156 COC1=CC2=C(C=C1)N=C(NC2=O)C3=CC(=CN=C3)Br Z1381294354 [0,1,0,0,0,0|3,0,0]=4 8 B22R3.17389161 COC1=CC2=C(C=C1)OC(CC2=O)C3=C(C=CC=C3)Cl Z56868148 [0,1,0,0,0,0|0,0,2]=3 9 B20R2.3432 COC1=CC(=CC=C1)C(=O)NC(=N)C2=CC=CC=C2 Z1171292267 [0,0,1,0,0,0|2,0,0]=3 10 B19R2.3487 COC1=CC(=C(C=C1)OCC2=NC=CC=C2)C=O Z335710196 [1,0,1,0,0,0|1,0,1]=4 11 B19R2.4553 CC1=CC(=C(C=C1)O)C(=O)NCC2=CC=CC=C2 Z27748810 [1,0,1,0,0,0|1,0,1]=4 12 B19R2.4553 O=C(/C=C/C1=CC=CC=C1)C2=C(C=CC(=C2)Br)F Z1431506852 [1,0,1,0,0,0|2,0,0]=4 13 B19R2.4553 O=C(/C=C/C1=CC=CC=C1)C2=C(C=CC(=C2)O)O Z1404734836 [1,0,1,0,0,0|0,0,0]=2 14 B19R3.55010 OC1=CC2=C(C=C1)C=C(C=C2)C3=CN=CC=C3 Z5020304793 [2,0,0,0,0,0|2,0,0]=4 15 B19R3.9171 CC1=C2C=CC=CC2=NC(=C1)C3=CC=CC=C3 Z48951265 [2,0,0,0,0,0|2,0,0]=4 16 B19R3.9171 NC1=C2C=CC=CC2=NC(=C1)C3=CC=CC=C3 Z56792391 [2,0,0,0,0,0|2,0,0]=4 17 B19R3.9171 O=C1C=C(NC2=C1C=CC=C2)C3=CC=CC=C3 Z445211730 [2,0,0,0,0,0|1,0,0]=3 18 B19R3.9171 O=C1CC(OC2=C1C=CC=C2)C3=CC=CC=C3 Z57085783 [2,0,0,0,0,0|0,0,2]=4 19 B19R3.9171 O=C1NC(=NC2=C1C=CC=C2)C3=CC=CC=C3 Z57042021 [2,0,0,0,0,0|2,0,0]=4 20 B19R3.9171 O=C1OC(=NC2=C1C=CC=C2)C3=CC=CC=C3 Z57177801 [2,0,0,0,0,0|2,0,0]=4 21 B21R2.64131 COC1=CC(=C(C=C1)O)C(=O)/C=C/C2=CC=C(C=C2)F Z85925141 [0,1,1,0,0,0|0,0,0]=2 22 B21R2.64131 COC1=CC(=C(C=C1)O)C(=O)NCC2=CC=C(C=C2)F Z26779343 [0,1,1,0,0,0|1,0,1]=4 23 B21R2.467897 COC1=CC(=C(C=C1)O)C(=O)OCC2=C(C=CC=C2)Cl Z24427294 [0,1,1,0,0,0|1,0,1]=4 24 B21R3.788229 COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3 Z57070681 [1,1,0,0,0,0|2,0,0]=4 25 B21R3.6885549 CC1=CC2=C(C=C1)N=C(OC2=O)C3=C(C=CC=C3)Br Z916919198 [1,1,0,0,0,0|2,0,0]=4 26 B21R3.6885549 O=C1N=C(OC2=C1C=C(C=C2)Cl)C3=C(C=CC=C3)Cl Z55992802 [1,1,0,0,0,0|2,0,0]=4 27 B23R3.1580966 COC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=CC=C3 Z56887640 [0,2,0,0,0,0|1,0,0]=3 28 B21R3.67565 COC1=CC(=CC=C1)C2=NC3=C(C=CC=C3)C(=C2)C Z48951253 [0,0,1,1,0,0|2,0,0]=4 29 B21R3.70020 COC1=CC2=C(C=C1)O/C(=C/C3=CN=CC=C3)/C2=O Z1250234337 [0,0,1,1,0,0|1,0,0]=3 30 B21R2.3546 COC1=CC(=CC=C1)C(=O)OCC(=O)C2=CC=CC=C2 Z18353072 [0,0,1,0,0,1|0,0,2]=4 31 B21R2.459344 COC1=CC(=CC=C1)NC(=O)CC(=O)C2=CC=CC=C2 Z55119711 [0,0,1,0,0,1|0,0,2]=4 32 B21R3.4480 COC1=CC2=C(C=C1)C(=CC(=N2)Cl)C3=CC=CC=C3 Z56924467 [0,0,0,0,1,1|1,0,0]=3 33 B21R3.4480 COC1=CC2=C(C=C1)C(=CC(=N2)S)C3=CC=CC=C3 Z56764356 [0,0,0,0,1,1|0,1,0]=3 34 B21R3.4480 COC1=CC2=C(C=C1)C(=CC(=N2)S)C3=CN=CC=C3 Z147641730 [0,0,0,0,1,1|1,1,0]=4 35 B21R3.4480 COC1=CC2=C(C=C1)C(=CC(=O)N2)C3=CC=CC=C3 Z56757902 [0,0,0,0,1,1|0,0,0]=2 36 B18R2.57 COC1=CC=C(C=C1)CC(=O)C2=CC=CC=C2 Z385417028 [2,0,1,0,0,0|1,0,0]=4 37 B18R2.6463 CC1=CC(=CC=C1)C(=O)/C=C/C2=CN=CC=C2 Z46584797 [2,0,1,0,0,0|1,0,0]=4 38 B18R2.6463 O=C(/C=C/C1=CC=CC=C1)C2=CC=CC(=C2)Br Z46028817 [2,0,1,0,0,0|1,0,0]=4 39 B18R2.6463 O=C(/C=C/C1=CN=CC=C1)C2=CC=CC(=C2)O Z46628000 [2,0,1,0,0,0|1,0,0]=4 40 B18R3.2123 C1=CC=C(C=C1)C2=CC3=C(C=CC=C3)C=C2 Z1723549920 [3,0,0,0,0,0|1,0,0]=4 41 B20R2.6237 COC1=CC=C(C=C1)/C=C(\C(=O)O)/C2=CC=CC=C2 Z56823404 [1,1,1,0,0,0|1,0,0]=4 42 B20R2.2939 COC1=C(C=CC(=C1)C(=O)/C=C/C2=CN=CC=C2)O Z46634123 [1,1,1,0,0,0|1,0,0]=4 43 B20R2.19346 COC1=CC(=CC=C1)C(=O)/C=C/C2=CC=C(C=C2)Br Z46054710 [1,1,1,0,0,0|0,0,0]=3 44 B20R2.11411 CCOC1=CC(=CC=C1)/C=C/C(=O)C2=CC=CC=C2 Z274449558 [1,1,1,0,0,0|0,0,1]=4 45 B20R2.301789 COC1=CC(=CC=C1)/C=C/C(=O)C2=CC=C(C=C2)Cl Z46033312 [1,1,1,0,0,0|0,0,1]=4 46 B20R2.302433 COC1=CC(=CC=C1)/C=C/C(=O)C2=C(C=CC=C2)Cl Z46034071 [1,1,1,0,0,0|0,0,1]=4 47 B20R2.23157 O=C(/C=C/C1=CC=CC=C1)C2=C(C(=CC(=C2)Cl)Cl)O Z235264155 [1,1,1,0,0,0|1,0,0]=4 48 B20R2.44895 COC1=CC(=C(C=C1)OC)C(=O)/C=C/C2=CC=CS2 Z46070580 [0,1,1,0,1,0|1,0,0]=4 49 B22R2.87006 COC1=CC(=C(C=C1)OC)NC(=O)/C=C/C2=CN=CC=C2 Z275037848 [0,1,1,0,0,1|1,0,0]=4 50 B22R2.87397 COC1=CC(=C(C=C1)OC)C(=O)/C=C/C2=CC=C(C=C2)C Z46070652 [0,2,1,0,0,0|0,0,0]=3 51 B22R2.87397 COC1=CC(=C(C=C1)OC)C(=O)/C=C/C2=CC=C(C=C2)F Z46070602 [0,2,1,0,0,0|0,0,0]=3 52 B22R2.669245 COC1=C(C=C(C(=C1)Cl)C(=O)/C=C/C2=CC=CC=C2)OC Z114938670 [0,2,1,0,0,0|1,0,0]=4 53 B22R2.672558 COC1=CC(=C(C=C1)O)C(=O)/C=C/C2=C(C=CC=C2)OC Z85924866 [0,2,1,0,0,0|0,0,0]=3 54 B22R3.3547817 COC1=CC(=CC=C1)C2=CC3=C(C=C2)C=C(C=C3)OC Z4745593863 [1,2,0,0,0,0|1,0,0]=4 55 B22R3.238558 CC1=C(OC2=C(C1=O)C=C(C=C2)Br)C3=CC(=CC=C3)Cl Z56937250 [1,2,0,0,0,0|1,0,0]=4 56 B22R3.2846088 O=C1C=C(OC2=CC(=C(C(=C12)O)O)O)C3=CC=CC=C3 Z1824568302 [1,2,0,0,0,0|0,0,0]=3 57 B22R3.635700 CC1=CC2=C(C=C1)N=C(C=C2C(=O)N)C3=CC=CC=C3 Z33545329 [1,2,0,0,0,0|1,0,0]=4 58 B22R3.635700 CC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=CC=C3 Z56921158 [1,2,0,0,0,0|1,0,0]=4 59 B22R3.6096807 COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=CC(=C3)C Z57179118 [1,2,0,0,0,0|0,0,0]=3 60 B22R3.126807 COC1=CC2=C(C=C1)C(=CC(=N2)NN)C3=CC=CC=C3 Z234969375 [0,1,0,0,1,1|1,0,0]=4 61 B22R3.126807 COC1=CC2=C(C=C1)C(=CC(=N2)SC)C3=CC=CC=C3 Z15371109 [0,1,0,0,1,1|0,1,0]=4 62 B22R3.18107779 COC1=CC2=C(C=C1)C(=O)N=C(O2)C3=C(C=CC=C3)Cl Z55992814 [0,1,0,0,1,1|1,0,0]=4 63 B24R3.1437904 COC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=C(C=C3)Br Z56887650 [0,3,0,0,0,0|1,0,0]=4 64 B24R3.11872260 CC(=O)NC1=CC2=C(C=C1)OC(=CC2=O)C3=C(C=CC=C3)F Z3222165703 [0,3,0,0,0,0|1,0,0]=4 65 B22R3.113022 COC1=CC2=C(C=C1)CC/C(=C/C3=CC=CC=C3)/C2=O Z56764252 [0,1,1,1,0,0|1,0,0]=4 66 B22R3.113022 COC1=CC2=C(C=C1)OC/C(=C/C3=CC=CC=C3)/C2=O Z286055796 [0,1,1,1,0,0|0,0,0]=3 67 B22R3.113022 COC1=CC2=C(C=C1)OC/C(=C/C3=CN=CC=C3)/C2=O Z286055780 [0,1,1,1,0,0|1,0,0]=4 68 B18R2.1463 COC1=CC(=CC=C1)C(=O)NC2=CC=CC=C2 Z27782718 [1,0,1,0,1,0|1,0,0]=4 69 B18R2.1681 COC1=CC(=C(C=C1)O)/C=N/C2=CC=CC=C2 Z56756242 [1,0,1,0,1,0|1,0,0]=4 70 B18R2.6536 CC1=CC(=C(C=C1)O)C(=O)NC2=CC=CC=C2 Z68085277 [1,0,1,0,1,0|1,0,0]=4 71 B18R2.1658 COC1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2 Z821061370 [0,0,1,0,2,0|0,0,0]=3 72 B18R3.111 O=C1C2=C(C=CC=C2)ON1C3=CC=CC=C3 Z2049888557 [2,0,0,0,1,0|1,0,0]=4 73 B20R2.3464 COC1=CC(=CC=C1)NC(=O)/C=C/C2=CC=NC=C2 Z365157288 [1,0,1,0,0,1|1,0,0]=4 74 B20R2.3743 COC1=CC(=C(C=C1)C(=O)/C=C/C2=CC=CC=C2)O Z57101034 [0,0,1,0,1,1|0,0,0]=3