0 B13R2.64 C1=CC(=CC=N1)CC2CCCN2 Z3251716672 [0,0,0,0,0,0|2,0,1]=3 1 B13R2.64 C1=CC(=CN=C1)NC2=NCCS2 Z234896765 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.64 C1=CC(=CN=C1)NC2=NN=CN2 Z2032287089 [0,0,0,0,0,0|3,0,1]=4 3 B13R2.64 C1=CC=C(C=C1)CC2=CNC=C2 Z1198723699 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.64 C1=CC=C(C=C1)CC2=CNC=N2 Z1262562584 [0,0,0,0,0,0|2,0,1]=3 5 B13R2.64 C1=CC=C(C=C1)CC2=CNN=C2 Z4958664297 [0,0,0,0,0,0|4,0,0]=4 6 B13R2.64 C1=CC=C(C=C1)CC2=NCCN2 Z1255415487 [0,0,0,0,0,0|0,0,0]=0 7 B13R2.64 C1=CC=C(C=C1)CC2=NN=CN2 Z1262564339 [0,0,0,0,0,0|1,0,1]=2 8 B13R2.64 C1=CC=C(C=C1)CC2=NN=NN2 Z1000626 [0,0,0,0,0,0|2,0,0]=2 9 B13R2.64 C1=CC=C(C=C1)CC2CCCN2 Z237735126 [0,0,0,0,0,0|1,0,1]=2 10 B13R2.64 C1=CC=C(C=C1)CC2CCNC2 Z979422194 [0,0,0,0,0,0|3,0,1]=4 11 B13R2.64 C1=CC=C(C=C1)CN2C=CC=N2 Z198954580 [0,0,0,0,0,0|2,0,2]=4 12 B13R2.64 C1=CC=C(C=C1)CN2C=NC=N2 Z57161818 [0,0,0,0,0,0|3,0,1]=4 13 B13R2.64 C1=CC=C(C=C1)CN2C=NN=N2 Z1201620216 [0,0,0,0,0,0|4,0,0]=4 14 B13R2.64 C1=CC=C(C=C1)CN2CCCC2 Z54750390 [0,0,0,0,0,0|3,0,0]=3 15 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 Z56755591 [0,0,0,0,0,0|2,0,0]=2 16 B13R2.64 C1=CC=C(C=C1)NC2=NN=CS2 Z56347187 [0,0,0,0,0,0|3,0,1]=4 17 B13R2.64 C1=CC=C(C=C1)NC2CCCC2 Z334877896 [0,0,0,0,0,0|3,0,1]=4 18 B13R2.64 C1=CN=C(C=C1)CC2=NN=NN2 Z1381246420 [0,0,0,0,0,0|3,0,0]=3 19 B13R2.64 C1=CN=C(C=C1)CN2CCCC2 Z232680510 [0,0,0,0,0,0|4,0,0]=4 20 B13R2.64 C1=CN=C(C=C1)N=C2CCCC2 Z56887750 [0,0,0,0,0,0|4,0,0]=4 21 B13R2.64 C1=CN=C(C=N1)CC2=NN=NN2 Z1000452 [0,0,0,0,0,0|4,0,0]=4 22 B14R2.19 CC1CN/C(=N/C2=CN=CC=C2)/S1 Z234896793 [0,1,0,0,0,0|3,0,0]=4 23 B14R2.19 NC1=CC(=NO1)CC2=CC=CC=C2 Z1255417836 [0,1,0,0,0,0|2,0,1]=4 24 B14R2.19 NC1=NC(=CS1)CC2=CC=CC=C2 Z406353710 [0,1,0,0,0,0|2,0,1]=4 25 B14R2.19 NC1=NC(=NS1)CC2=CC=CC=C2 Z234898255 [0,1,0,0,0,0|1,0,2]=4 26 B14R2.19 NC1=NNC(=C1)CC2=CC=CC=C2 Z1251353580 [0,1,0,0,0,0|2,0,1]=4 27 B14R2.19 NC1=NNC(=N1)NC2=CC=CC=C2 Z1216814163 [0,1,0,0,0,0|2,0,1]=4 28 B14R2.19 NC1CCC(C1)CC2=CC=CC=C2 Z1233210256 [0,1,0,0,0,0|2,0,1]=4 29 B14R2.19 NC1CCN(C1)CC2=CC=CC=C2 Z104493644 [0,1,0,0,0,0|3,0,0]=4 30 B14R2.19 N[C@H]1CCN(C1)CC2=CC=CC=C2 Z1460105607 [0,1,0,0,0,0|3,0,0]=4 31 B14R2.19 O=C1CCC(N1)CC2=CC=CC=C2 Z1270257271 [0,1,0,0,0,0|1,0,2]=4 32 B14R2.19 O=C1CSC(=N1)NC2=CC=CC=C2 Z56839764 [0,1,0,0,0,0|2,0,1]=4 33 B14R2.19 O=C1NC(=NO1)CC2=CC=NC=C2 Z992946060 [0,1,0,0,0,0|2,0,1]=4 34 B14R2.19 O=C1NN=C(N1)CC2=CC=CC=C2 Z1217215136 [0,1,0,0,0,0|1,0,1]=3 35 B14R2.19 O=C1NN=C(O1)CC2=CC=CC=C2 Z1206172055 [0,1,0,0,0,0|2,0,1]=4 36 B14R2.19 OC1CCN(C1)CC2=CC=CC=C2 Z370712446 [0,1,0,0,0,0|3,0,0]=4 37 B14R2.19 O[C@@H]1CCN(C1)CC2=CC=CC=C2 Z817098778 [0,1,0,0,0,0|3,0,0]=4 38 B14R2.19 SC1=NC(=NN1)CC2=CC=CC=C2 Z55982240 [0,1,0,0,0,0|1,0,2]=4 39 B14R2.19 SC1=NC(=NO1)CC2=CC=CC=C2 Z1065635888 [0,1,0,0,0,0|1,0,2]=4 40 B14R2.19 SC1=NN=C(O1)CC2=CC=CC=C2 Z55879421 [0,1,0,0,0,0|2,0,1]=4 41 B14R2.30 NC1=C(NN=C1)CC2=CC=CC=C2 Z4550459630 [0,1,0,0,0,0|2,0,1]=4 42 B14R2.30 NC1CCCC1CC2=CC=CC=C2 Z813018506 [0,1,0,0,0,0|2,0,1]=4 43 B14R2.30 O=C1CC=NN1CC2=CC=CC=C2 Z1278926316 [0,1,0,0,0,0|2,0,1]=4 44 B14R2.30 O=C1CCCC1CC2=CC=CC=C2 Z813018324 [0,1,0,0,0,0|2,0,1]=4 45 B14R2.30 O=C\1CCC/C1=C/C2=CC=CC=C2 Z56782493 [0,1,0,0,0,0|2,0,1]=4 46 B14R2.30 OC1CCCC1CC2=CC=CC=C2 Z854048260 [0,1,0,0,0,0|2,0,1]=4 47 B14R2.30 O[C@@H]1CCN[C@@H]1CC2=CC=CC=C2 Z4966451600 [0,1,0,0,0,0|1,0,1]=3 48 B14R2.50 BrC1=C(C=CC=C1)CC2=NN=NN2 Z335295190 [0,1,0,0,0,0|2,0,0]=3 49 B14R2.50 CC1=C(C=CC=C1)CC2=NN=NN2 Z335295276 [0,1,0,0,0,0|2,0,0]=3 50 B14R2.50 CC1=C(C=CC=C1)CC2CCCN2 Z285198452 [0,1,0,0,0,0|1,0,1]=3 51 B14R2.50 CC1=C(C=CC=N1)CC2=NN=NN2 Z2418410020 [0,1,0,0,0,0|3,0,0]=4 52 B14R2.50 ClC1=C(C=CC=C1)/N=C/2\NCCS2 Z48963560 [0,1,0,0,0,0|2,0,0]=3 53 B14R2.50 ClC1=C(C=CC=C1)CC2CCCN2 Z802665944 [0,1,0,0,0,0|1,0,1]=3 54 B14R2.50 FC1=C(C=CC=C1)CN2CCCC2 Z4924244858 [0,1,0,0,0,0|3,0,0]=4 55 B14R2.50 IC1=C(C=CC=C1)/N=C/2\CCCN2 Z55927720 [0,1,0,0,0,0|2,0,0]=3 56 B14R2.50 NC1=C(C=CC=C1)CN2CCCC2 Z285162766 [0,1,0,0,0,0|3,0,0]=4 57 B14R2.72 BrC1=CC=C(C=C1)CC2=NN=NN2 Z335295280 [0,1,0,0,0,0|2,0,0]=3 58 B14R2.72 BrC1=CC=C(C=C1)CC2CCCN2 Z281773886 [0,1,0,0,0,0|1,0,1]=3 59 B14R2.72 BrC1=CC=C(C=C1)CN2CCCC2 Z54750392 [0,1,0,0,0,0|3,0,0]=4 60 B14R2.72 CC1=CC=C(C=C1)/N=C\2/CCCN2 Z55927692 [0,1,0,0,0,0|2,0,0]=3 61 B14R2.72 CC1=CC=C(C=C1)CC2=NN=NN2 Z335295264 [0,1,0,0,0,0|2,0,0]=3 62 B14R2.72 CC1=CC=C(C=C1)CC2CCCN2 Z382710498 [0,1,0,0,0,0|1,0,1]=3 63 B14R2.72 FC1=CC=C(C=C1)/N=C\2/CCCN2 Z55927666 [0,1,0,0,0,0|2,0,0]=3 64 B14R2.72 FC1=CC=C(C=C1)CC2=NN=NN2 Z1000628 [0,1,0,0,0,0|2,0,0]=3 65 B14R2.72 FC1=CC=C(C=C1)CC2CCCN2 Z281773862 [0,1,0,0,0,0|1,0,1]=3 66 B14R2.72 NC1=CC=C(C=C1)CC2=NC=CS2 Z5346664207 [0,1,0,0,0,0|1,0,2]=4 67 B14R2.72 NC1=CC=C(C=C1)CC2=NN=NN2 Z972815694 [0,1,0,0,0,0|2,0,0]=3 68 B14R2.72 NC1=CC=C(C=C1)SC2=NC=NN2 Z330802946 [0,1,0,0,0,0|2,0,1]=4 69 B14R2.114 NC(C1=CC=CC=C1)C2=NC=CS2 Z803085908 [0,1,0,0,0,0|1,0,2]=4 70 B14R2.114 NC(C1=CC=CC=C1)C2=NN=NN2 Z752371236 [0,1,0,0,0,0|2,0,0]=3 71 B14R2.114 NC(C1=CC=CC=C1)C2CCCC2 Z451452470 [0,1,0,0,0,0|2,0,1]=4 72 B14R2.114 O=C(C1=CC=CC=C1)C2=NC=CN2 Z652692194 [0,1,0,0,0,0|0,0,3]=4 73 B14R2.114 O=C(C1=CC=CC=C1)C2=NN=CN2 Z1259213893 [0,1,0,0,0,0|1,0,2]=4 74 B14R2.114 O=C(C1=CC=CC=C1)C2CCCN2 Z3013892609 [0,1,0,0,0,0|1,0,2]=4 75 B14R2.114 OC(C1=CC=CC=C1)C2=NC=CN2 Z56758905 [0,1,0,0,0,0|0,0,2]=3 76 B14R2.114 OC(C1=CC=CC=C1)C2=NN=CN2 Z1259214161 [0,1,0,0,0,0|1,0,1]=3 77 B14R2.114 OC(C1=CC=CC=C1)C2CCCC2 Z513750534 [0,1,0,0,0,0|2,0,1]=4 78 B14R2.114 OC(C1=CC=CC=C1)C2CCCN2 Z1192039732 [0,1,0,0,0,0|1,0,1]=3 79 B14R2.114 OC(C1=CC=NC=C1)C2=NC=CN2 Z274340654 [0,1,0,0,0,0|1,0,2]=4 80 B14R2.114 OC(C1=CC=NC=C1)C2=NN=CN2 Z1686576598 [0,1,0,0,0,0|2,0,1]=4 81 B14R2.114 OC(C1=CN=CC=C1)C2=NC=CN2 Z1395143326 [0,1,0,0,0,0|1,0,2]=4 82 B14R2.114 OC(C1=NC=CC=C1)C2=NC=CN2 Z1763810026 [0,1,0,0,0,0|1,0,2]=4 83 B14R2.411 CC1(CCCN1)CC2=CC=CC=C2 Z1704732682 [0,1,0,0,0,0|1,0,1]=3 84 B14R2.411 NC1(CCCC1)CC2=CC=CC=C2 Z1655103589 [0,1,0,0,0,0|2,0,1]=4 85 B14R2.411 OC1(CCCC1)CC2=CC=CC=C2 Z449370862 [0,1,0,0,0,0|2,0,1]=4 86 B14R2.716 BrC1=CC(=CC=C1)CC2CCCN2 Z2327402589 [0,1,0,0,0,0|1,0,1]=3 87 B14R2.716 BrC1=CC(=CC=C1)CN2CCCC2 Z2380439453 [0,1,0,0,0,0|3,0,0]=4 88 B14R2.716 ClC1=CC(=CC=C1)/N=C/2\CCCN2 Z56976780 [0,1,0,0,0,0|2,0,0]=3 89 B14R2.716 FC1=CC(=CC=C1)/N=C/2\CCCN2 Z56971424 [0,1,0,0,0,0|2,0,0]=3 90 B14R2.716 FC1=CC(=CC=C1)CC2CCCN2 Z285198426 [0,1,0,0,0,0|1,0,1]=3 91 B14R2.716 NC1=CC(=CC=C1)CC2=NNN=N2 Z1262643706 [0,1,0,0,0,0|2,0,1]=4 92 B14R2.716 NC1=CC(=CC=C1)CN2CCCC2 Z285162764 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.8 C#CCNOCC1=CC=CC=C1 Z1251328742 [0,0,1,0,0,0|2,0,1]=4 94 B12R1.8 C=CCNCCC1=CC=CC=C1 Z90513756 [0,0,1,0,0,0|1,0,2]=4 95 B12R1.8 CCCNCCC1=CC=CC=C1 Z90518163 [0,0,1,0,0,0|1,0,1]=3 96 B12R1.8 CCCNCCC1=NC=CC=C1 Z53110779 [0,0,1,0,0,0|2,0,1]=4 97 B12R1.8 NCCCCCC1=CC=CC=C1 Z820118542 [0,0,1,0,0,0|1,0,1]=3 98 B12R1.8 NCCCOCC1=CC=CC=C1 Z104377938 [0,0,1,0,0,0|2,0,0]=3 99 B12R1.8 NCCOCCC1=CC=CC=C1 Z1270210787 [0,0,1,0,0,0|1,0,1]=3 100 B12R1.8 OCCCNCC1=CC=CC=C1 Z57079457 [0,0,1,0,0,0|3,0,0]=4 101 B12R1.8 OCCCOCC1=CC=CC=C1 Z1080358454 [0,0,1,0,0,0|3,0,0]=4 102 B12R1.8 OCCCSCC1=CC=CC=C1 Z104944808 [0,0,1,0,0,0|3,0,0]=4 103 B12R1.8 OCCNCCC1=CC=CC=C1 Z90504498 [0,0,1,0,0,0|1,0,1]=3 104 B12R1.32 CCCC(=O)CC1=CC=CC=C1 Z513733628 [0,0,1,0,0,0|2,0,0]=3 105 B12R1.32 CCCC(N)CC1=CC=CC=C1 Z513795750 [0,0,1,0,0,0|1,0,1]=3 106 B12R1.32 CCNC(=O)NC1=CC=CC=C1 Z44586347 [0,0,1,0,0,0|2,0,0]=3 107 B12R1.32 CCNC(=O)NC1=CN=CC=C1 Z44592359 [0,0,1,0,0,0|3,0,0]=4 108 B12R1.32 CCOC(=O)CC1=CN=CC=C1 Z982129808 [0,0,1,0,0,0|3,0,0]=4 109 B12R1.32 CNCC(N)CC1=CC=CC=C1 Z756920442 [0,0,1,0,0,0|2,0,1]=4 110 B12R1.32 COCC(=O)CC1=CC=CC=C1 Z447897954 [0,0,1,0,0,0|3,0,0]=4 111 B12R1.32 COCC(N)CC1=CC=CC=C1 Z825742276 [0,0,1,0,0,0|2,0,1]=4 112 B12R1.32 NC(CCO)CC1=CC=CC=C1 Z1992316427 [0,0,1,0,0,0|2,0,1]=4 113 B12R1.118 CCC(CC1=CC=CC=C1)NC Z513799420 [0,0,1,0,0,0|1,0,1]=3 114 B12R1.118 CCN(CC1=CC=CC=C1)N=O Z1198158367 [0,0,1,0,0,0|3,0,0]=4 115 B14R3.49 C1=CC2=C(C=C1)C3=C(N2)CCC3 Z57479476 [0,0,0,1,0,0|3,0,0]=4 116 B14R3.49 C1=CC2=C(C=C1)N3C=NN=C3S2 Z56791559 [0,0,0,1,0,0|2,0,1]=4 117 B14R3.49 C1=CC2=C(C=C1)N3CCCC3=N2 Z1198156372 [0,0,0,1,0,0|2,0,0]=3 118 B14R3.49 C1=CC2=C(C=C1)N3CCNC3=N2 Z56854350 [0,0,0,1,0,0|1,0,1]=3 119 B12R2.2 C1=CC(=CC=N1)C2=NC=CN2 Z728187792 [0,0,0,0,1,0|1,0,2]=4 120 B12R2.2 C1=CC(=CC=N1)C2=NCCN2 Z278202128 [0,0,0,0,1,0|1,0,0]=2 121 B12R2.2 C1=CC(=CC=N1)C2=NN=CN2 Z1203735208 [0,0,0,0,1,0|2,0,1]=4 122 B12R2.2 C1=CC(=CC=N1)C2CCCN2 Z238920298 [0,0,0,0,1,0|2,0,1]=4 123 B12R2.2 C1=CC(=CN=C1)C2=NC=CN2 Z728187794 [0,0,0,0,1,0|1,0,2]=4 124 B12R2.2 C1=CC(=CN=C1)C2=NCCN2 Z275361154 [0,0,0,0,1,0|1,0,0]=2 125 B12R2.2 C1=CC(=CN=C1)C2CCCN2 Z164706372 [0,0,0,0,1,0|2,0,1]=4 126 B12R2.2 C1=CC=C(C=C1)C2=CC=CN2 Z1198155817 [0,0,0,0,1,0|1,0,2]=4 127 B12R2.2 C1=CC=C(C=C1)C2=CC=NN2 Z1224534135 [0,0,0,0,1,0|2,0,1]=4 128 B12R2.2 C1=CC=C(C=C1)C2=CCNC2 Z1574940564 [0,0,0,0,1,0|3,0,0]=4 129 B12R2.2 C1=CC=C(C=C1)C2=CN=NN2 Z2798585249 [0,0,0,0,1,0|3,0,0]=4 130 B12R2.2 C1=CC=C(C=C1)C2=NC=CN2 Z104492164 [0,0,0,0,1,0|0,0,2]=3 131 B12R2.2 C1=CC=C(C=C1)C2=NC=CS2 Z1198153051 [0,0,0,0,1,0|1,0,2]=4 132 B12R2.2 C1=CC=C(C=C1)C2=NCCC2 Z235344923 [0,0,0,0,1,0|1,0,0]=2 133 B12R2.2 C1=CC=C(C=C1)C2=NCCN2 Z283858536 [0,0,0,0,1,0|0,0,0]=1 134 B12R2.2 C1=CC=C(C=C1)C2=NN=CO2 Z55670800 [0,0,0,0,1,0|2,0,1]=4 135 B12R2.2 C1=CC=C(C=C1)C2=NNC=N2 Z804949032 [0,0,0,0,1,0|1,0,2]=4 136 B12R2.2 C1=CC=C(C=C1)C2=NNN=N2 Z56887706 [0,0,0,0,1,0|2,0,1]=4 137 B12R2.2 C1=CC=C(C=C1)C2CCCN2 Z223138744 [0,0,0,0,1,0|1,0,1]=3 138 B12R2.2 C1=CN=C(C=C1)C2=NC=CN2 Z728187802 [0,0,0,0,1,0|1,0,2]=4 139 B12R2.2 C1=CN=C(C=C1)C2=NCCN2 Z1198221938 [0,0,0,0,1,0|1,0,0]=2 140 B12R2.2058 C1=CC=C(C=C1)CC2CCN2 Z1324054892 [0,0,0,0,1,0|0,0,1]=2 141 B12R2.2058 C1=CC=C(C=C1)CC2CNC2 Z234895271 [0,0,0,0,1,0|2,0,1]=4 142 B14R2.6 C1=CC(=CC=N1)CC2COCCN2 Z5184111611 [0,0,0,0,0,1|2,0,1]=4 143 B14R2.6 C1=CC=C(C=C1)C=C2CCNCC2 Z1262570167 [0,0,0,0,0,1|2,0,1]=4 144 B14R2.6 C1=CC=C(C=C1)CC2=NC=CC=C2 Z57160157 [0,0,0,0,0,1|1,0,2]=4 145 B14R2.6 C1=CC=C(C=C1)CC2CCCCN2 Z336080118 [0,0,0,0,0,1|1,0,1]=3 146 B14R2.6 C1=CC=C(C=C1)CC2CCCNC2 Z969110994 [0,0,0,0,0,1|1,0,1]=3 147 B14R2.6 C1=CC=C(C=C1)CC2CNCCO2 Z1198184698 [0,0,0,0,0,1|1,0,1]=3 148 B14R2.6 C1=CC=C(C=C1)CC2CNCCS2 Z1258863693 [0,0,0,0,0,1|1,0,1]=3 149 B14R2.6 C1=CC=C(C=C1)CC2COCCN2 Z1346385428 [0,0,0,0,0,1|1,0,1]=3 150 B14R2.6 C1=CC=C(C=C1)C[C@@H]2CNCCO2 Z1255397150 [0,0,0,0,0,1|1,0,1]=3 151 B14R2.6 C1=CC=C(C=C1)C[C@H]2CNCCO2 Z1255401018 [0,0,0,0,0,1|1,0,1]=3 152 B14R2.6 C1=CC=C(C=C1)NC2=NCCCS2 Z56816137 [0,0,0,0,0,1|2,0,0]=3 153 B14R2.6 C1=CC=C(C=C1)NC2CCCNC2 Z838921656 [0,0,0,0,0,1|2,0,1]=4 154 B14R2.6 C1=CC=C(C=C1)OC2CCCNC2 Z839583154 [0,0,0,0,0,1|2,0,1]=4 155 B14R2.6 C1=CC=C(C=C1)O[C@@H]2CCCNC2 Z2327513729 [0,0,0,0,0,1|2,0,1]=4 156 B14R2.6 C1=CN=C(C=C1)CC2COCCN2 Z4810311699 [0,0,0,0,0,1|2,0,1]=4 157 B14R2.101 C1=CC(=CN=C1)C/N=C\2/CCCN2 Z55927776 [0,0,0,0,0,1|2,0,0]=3 158 B14R2.101 C1=CC(=CN=C1)CNC2=NCCS2 Z367661262 [0,0,0,0,0,1|2,0,0]=3 159 B14R2.101 C1=CC=C(C=C1)/C=C/C2=NN=NN2 Z1431321796 [0,0,0,0,0,1|2,0,1]=4 160 B14R2.101 C1=CC=C(C=C1)CCC2=NN=NN2 Z335295262 [0,0,0,0,0,1|2,0,0]=3 161 B14R2.101 C1=CC=C(C=C1)CCC2CCCN2 Z281773822 [0,0,0,0,0,1|1,0,1]=3 162 B14R2.101 C1=CC=C(C=C1)CNC2=NC=CS2 Z86229412 [0,0,0,0,0,1|1,0,2]=4 163 B14R2.101 C1=CC=C(C=C1)CNC2=NC=NS2 Z1259046780 [0,0,0,0,0,1|2,0,1]=4 164 B14R2.101 C1=CC=C(C=C1)CNC2=NCCN2 Z1089994872 [0,0,0,0,0,1|0,0,0]=1 165 B14R2.101 C1=CC=C(C=C1)CNC2=NCCS2 Z56858227 [0,0,0,0,0,1|1,0,0]=2 166 B14R2.101 C1=CC=C(C=C1)CNC2CCCC2 Z90661352 [0,0,0,0,0,1|2,0,1]=4 167 B14R2.101 C1=CC=C(C=C1)COC2=NNC=C2 Z2235789778 [0,0,0,0,0,1|2,0,1]=4 168 B14R2.101 C1=CC=C(C=C1)CSC2=NCCN2 Z89241755 [0,0,0,0,0,1|0,0,0]=1 169 B14R2.101 C1=CC=C(C=C1)NCC2=CN=CN2 Z4655941942 [0,0,0,0,0,1|2,0,1]=4 170 B14R2.101 C1=CC=C(C=C1)NCC2=CSC=N2 Z137579644 [0,0,0,0,0,1|2,0,1]=4 171 B14R2.101 C1=CC=C(C=C1)OCC2CCCN2 Z285198378 [0,0,0,0,0,1|1,0,1]=3 172 B14R2.101 C1=CC=C(C=C1)OC[C@@H]2CCCN2 Z2235330295 [0,0,0,0,0,1|1,0,1]=3 173 B14R2.101 C1=CC=C(C=C1)SCC2=CNN=N2 Z1823910317 [0,0,0,0,0,1|3,0,0]=4 174 B14R2.101 C1=CN=C(C=C1)NNC2=NCCC2 Z56765826 [0,0,0,0,0,1|3,0,0]=4 175 B11R1.28 C#CCNCC1=CC=CC=C1 Z2082999436 [1,0,1,0,0,0|1,0,1]=4 176 B11R1.28 C=CCNCC1=CC=CC=C1 Z86135577 [1,0,1,0,0,0|1,0,1]=4 177 B11R1.28 CCCCCC1=CC=CC=C1 Z199507042 [1,0,1,0,0,0|1,0,1]=4 178 B11R1.28 CCCNCC1=CC=CC=C1 Z56946091 [1,0,1,0,0,0|1,0,0]=3 179 B11R1.28 CCCNCC1=CC=NC=C1 Z3247723488 [1,0,1,0,0,0|2,0,0]=4 180 B11R1.28 CCCNCC1=CN=CC=C1 Z3247723489 [1,0,1,0,0,0|2,0,0]=4 181 B11R1.28 CCCNCC1=NC=CC=C1 Z4401052052 [1,0,1,0,0,0|2,0,0]=4 182 B11R1.28 CCNCCC1=CC=CC=C1 Z444350074 [1,0,1,0,0,0|0,0,1]=3 183 B11R1.28 CCNCCC1=NC=CC=C1 Z138534138 [1,0,1,0,0,0|1,0,1]=4 184 B11R1.28 CCOCCC1=CC=CC=C1 Z1198150519 [1,0,1,0,0,0|1,0,1]=4 185 B11R1.28 ClCCNCC1=CC=CC=C1 Z57158447 [1,0,1,0,0,0|1,0,0]=3 186 B11R1.28 N#CCNCC1=CC=CC=C1 Z266079624 [1,0,1,0,0,0|0,0,2]=4 187 B11R1.28 NCCCCC1=CC=CC=C1 Z2574929438 [1,0,1,0,0,0|0,0,1]=3 188 B11R1.28 NCCCCC1=CC=NC=C1 Z3234944907 [1,0,1,0,0,0|1,0,1]=4 189 B11R1.28 NCCCNC1=CC=CC=C1 Z756919512 [1,0,1,0,0,0|1,0,1]=4 190 B11R1.28 NCCCOC1=CC=CC=C1 Z234895129 [1,0,1,0,0,0|1,0,1]=4 191 B11R1.28 NCCCSC1=CC=CC=C1 Z262222134 [1,0,1,0,0,0|1,0,1]=4 192 B11R1.28 NCCNCC1=NC=CC=C1 Z600492946 [1,0,1,0,0,0|1,0,1]=4 193 B11R1.28 NCCOCC1=CC=CC=C1 Z271005946 [1,0,1,0,0,0|1,0,0]=3 194 B11R1.28 OCCNCC1=CN=CC=C1 Z90504502 [1,0,1,0,0,0|2,0,0]=4 195 B11R1.28 OCCOCC1=CC=CC=C1 Z854223062 [1,0,1,0,0,0|2,0,0]=4 196 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [1,0,1,0,0,0|1,0,1]=4 197 B11R1.40 CCC(=O)CC1=CN=CC=C1 Z992407884 [1,0,1,0,0,0|2,0,0]=4 198 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [1,0,1,0,0,0|0,0,1]=3 199 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [1,0,1,0,0,0|1,0,1]=4 200 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [1,0,1,0,0,0|1,0,1]=4 201 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [1,0,1,0,0,0|1,0,1]=4 202 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [1,0,1,0,0,0|2,0,0]=4 203 B11R1.40 CNC(=O)NC1=CC=CC=C1 Z55293754 [1,0,1,0,0,0|2,0,0]=4 204 B11R1.40 CNC(=S)NC1=CC=CC=C1 Z45796176 [1,0,1,0,0,0|2,0,0]=4 205 B11R1.40 CS/C(=N/C1=CC=CC=C1)/N Z107728768 [1,0,1,0,0,0|2,0,0]=4 206 B11R1.40 N/C(=N\O)/CC1=NC=CC=C1 Z285132826 [1,0,1,0,0,0|2,0,0]=4 207 B11R1.40 N=C(NN)NC1=CC=CC=C1 Z2768171754 [1,0,1,0,0,0|2,0,0]=4 208 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [1,0,1,0,0,0|1,0,1]=4 209 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [1,0,1,0,0,0|2,0,0]=4 210 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [1,0,1,0,0,0|1,0,1]=4 211 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [1,0,1,0,0,0|2,0,0]=4 212 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [1,0,1,0,0,0|1,0,1]=4 213 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [1,0,1,0,0,0|1,0,1]=4 214 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [1,0,1,0,0,0|2,0,0]=4 215 B13R1.6 CCCNCCC1=CC(=CC=C1)F Z1267881689 [0,1,1,0,0,0|1,0,1]=4 216 B13R1.9 NC1=CC=C(C=C1)CCNCCO Z1251358284 [0,1,1,0,0,0|1,0,1]=4 217 B13R1.9 NCCCCCC1=CC=C(C=C1)Br Z3327815448 [0,1,1,0,0,0|1,0,1]=4 218 B13R1.9 NCCCCCC1=CC=C(C=C1)Cl Z4525234042 [0,1,1,0,0,0|1,0,1]=4 219 B13R1.9 NCCCCCC1=CC=C(C=C1)F Z1255496234 [0,1,1,0,0,0|1,0,1]=4 220 B13R1.24 CC(OCCCN)C1=CC=CC=C1 Z99601222 [0,1,1,0,0,0|2,0,0]=4 221 B13R1.28 CNCCCOCC1=CC=CC=C1 Z164328298 [0,1,1,0,0,0|2,0,0]=4 222 B13R1.28 COCCNCCC1=CC=CC=C1 Z90501852 [0,1,1,0,0,0|1,0,1]=4 223 B13R1.28 NCCCCOCC1=CC=CC=C1 Z285164088 [0,1,1,0,0,0|1,0,1]=4 224 B13R1.28 NCCCOCCC1=CC=CC=C1 Z330915366 [0,1,1,0,0,0|1,0,1]=4 225 B13R1.28 NCCOCCOC1=CC=CC=C1 Z594038162 [0,1,1,0,0,0|1,0,1]=4 226 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 Z285214492 [0,1,1,0,0,0|2,0,0]=4 227 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 Z1436181402 [0,1,1,0,0,0|2,0,0]=4 228 B13R1.42 NCCC(O)CCC1=CC=CC=C1 Z1255452410 [0,1,1,0,0,0|1,0,1]=4 229 B13R1.44 CCCNC(=O)NC1=CC=CC=C1 Z44586337 [0,1,1,0,0,0|2,0,0]=4 230 B13R1.44 CN(CCCN)CC1=CC=CC=C1 Z96092423 [0,1,1,0,0,0|2,0,0]=4 231 B13R1.44 NCCCC(=O)NC1=CC=CC=C1 Z1449746694 [0,1,1,0,0,0|2,0,0]=4 232 B13R1.44 NCCNC(=O)CC1=CC=CC=C1 Z285226374 [0,1,1,0,0,0|0,0,1]=3 233 B13R1.44 NCCNC(=S)NC1=CC=CC=C1 Z56814594 [0,1,1,0,0,0|1,0,1]=4 234 B13R1.44 O=C(NCCO)OC1=CC=CC=C1 Z31725824 [0,1,1,0,0,0|2,0,0]=4 235 B13R1.337 CC(C)CNCCC1=CC=CC=C1 Z90503847 [0,1,1,0,0,0|1,0,1]=4 236 B13R1.718 CC(CN)COCC1=CC=CC=C1 Z812516860 [0,1,1,0,0,0|2,0,0]=4 237 B13R1.19 CCNC(=O)CC1=CC=C(C=C1)F Z32024691 [0,1,1,0,0,0|1,0,0]=3 238 B13R1.19 CCNC(=O)CC1=CC=C(C=C1)N Z239124818 [0,1,1,0,0,0|1,0,0]=3 239 B13R1.19 CCNC(=O)NC1=CC=C(C=C1)C Z44589983 [0,1,1,0,0,0|2,0,0]=4 240 B13R1.19 CCNC(=O)NC1=CC=C(C=C1)F Z44586779 [0,1,1,0,0,0|2,0,0]=4 241 B13R1.19 CCOC(=O)CC1=CC=C(C=C1)F Z53835949 [0,1,1,0,0,0|2,0,0]=4 242 B13R1.20 CCNC(=O)CC1=CC(=CC=C1)F Z32025095 [0,1,1,0,0,0|1,0,0]=3 243 B13R1.20 CCNC(=O)NC1=CC(=CC=C1)Cl Z44590091 [0,1,1,0,0,0|2,0,0]=4 244 B13R1.20 CCNC(=O)NC1=CC(=CC=C1)N Z356292614 [0,1,1,0,0,0|2,0,0]=4 245 B13R1.20 CCNC(=O)OC1=CC(=CC=C1)O Z2467210012 [0,1,1,0,0,0|2,0,0]=4 246 B13R1.20 CCOC(=O)CC1=CC(=CC=C1)C Z979746960 [0,1,1,0,0,0|2,0,0]=4 247 B13R1.20 CCOC(=O)CC1=CC(=CC=C1)Cl Z982130886 [0,1,1,0,0,0|2,0,0]=4 248 B13R1.20 CONC(=O)CC1=CC(=CC=C1)F Z247486334 [0,1,1,0,0,0|2,0,0]=4 249 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 Z2755013956 [0,1,1,0,0,0|2,0,0]=4 250 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 Z1274177321 [0,1,1,0,0,0|2,0,0]=4 251 B13R1.79 CCNC(CC)CC1=CC=CC=C1 Z513799512 [0,1,1,0,0,0|1,0,1]=4 252 B13R1.135 CCN(N)C(=S)NC1=CC=CC=C1 Z56822471 [0,1,1,0,0,0|2,0,0]=4 253 B13R1.348 CC(C)CC(N)CC1=CC=CC=C1 Z3214214500 [0,1,1,0,0,0|1,0,1]=4 254 B13R1.348 CC(C)NC(=O)CC1=NC=CC=C1 Z1736981249 [0,1,1,0,0,0|2,0,0]=4 255 B13R1.348 CC(C)NC(=O)NC1=CC=CC=C1 Z44580881 [0,1,1,0,0,0|2,0,0]=4 256 B13R1.470 CCNC(=O)CC1=C(C=CC=C1)F Z32024739 [0,1,1,0,0,0|1,0,0]=3 257 B13R1.470 CCNC(=O)NC1=C(C=CC=C1)F Z44591387 [0,1,1,0,0,0|2,0,0]=4 258 B13R1.470 CCOC(=O)CC1=C(C=CC=C1)F Z53836539 [0,1,1,0,0,0|2,0,0]=4 259 B13R1.470 CONC(=O)CC1=C(C=CC=C1)C Z193293116 [0,1,1,0,0,0|2,0,0]=4 260 B13R1.470 CONC(=O)CC1=C(C=CC=C1)Cl Z247486336 [0,1,1,0,0,0|2,0,0]=4 261 B13R1.470 CONC(=O)CC1=C(C=CC=C1)F Z247486228 [0,1,1,0,0,0|2,0,0]=4 262 B13R1.145 CCC(CC1=CC=C(C=C1)C)NC Z513804920 [0,1,1,0,0,0|1,0,1]=4 263 B13R2.10 CC1=NNC(=N1)C2=CC=CC=C2 Z385478582 [0,1,0,0,1,0|1,0,1]=4 264 B13R2.10 FC1CNC(C1)C2=CC=CC=C2 Z2732815726 [0,1,0,0,1,0|1,0,1]=4 265 B13R2.10 O=C1N=C(NN1)C2=CC=CC=C2 Z1737940654 [0,1,0,0,1,0|1,0,1]=4 266 B13R2.10 O=C1NC(=NO1)C2=CC=CC=C2 Z685594006 [0,1,0,0,1,0|1,0,1]=4 267 B13R2.10 OC1CNC(C1)C2=CC=CC=C2 Z2298064173 [0,1,0,0,1,0|1,0,1]=4 268 B13R2.12 BrC1=CC=C(C=C1)C2=NC=CN2 Z728187810 [0,1,0,0,1,0|0,0,2]=4 269 B13R2.12 BrC1=CC=C(C=C1)C2=NOCC2 Z1813177730 [0,1,0,0,1,0|2,0,0]=4 270 B13R2.12 BrC1=CC=C(C=C1)C2CCCN2 Z281773782 [0,1,0,0,1,0|1,0,1]=4 271 B13R2.12 CC1=CC=C(C=C1)C2=NCCN2 Z283690302 [0,1,0,0,1,0|0,0,0]=2 272 B13R2.12 CC1=CC=C(C=C1)C2CCCN2 Z281773826 [0,1,0,0,1,0|1,0,1]=4 273 B13R2.12 ClC1=CC=C(C=C1)C2=NCCN2 Z235362997 [0,1,0,0,1,0|0,0,0]=2 274 B13R2.12 ClC1=CC=C(C=C1)C2=NN=NN2 Z56995161 [0,1,0,0,1,0|2,0,0]=4 275 B13R2.12 ClC1=CC=C(C=C1)C2CCCN2 Z1262246112 [0,1,0,0,1,0|1,0,1]=4 276 B13R2.12 ClC1=NC=C(C=C1)C2=NCCC2 Z1486027108 [0,1,0,0,1,0|2,0,0]=4 277 B13R2.12 FC1=CC=C(C=C1)C2CCCN2 Z221586518 [0,1,0,0,1,0|1,0,1]=4 278 B13R2.12 IC1=CC=C(C=C1)C2CCCN2 Z362776096 [0,1,0,0,1,0|1,0,1]=4 279 B13R2.12 NC1=CC=C(C=C1)C2=NC=CN2 Z992717176 [0,1,0,0,1,0|0,0,2]=4 280 B13R2.12 NC1=CC=C(C=C1)C2=NN=CN2 Z1266933857 [0,1,0,0,1,0|1,0,1]=4 281 B13R2.12 NC1=CC=C(C=C1)C2=NN=NN2 Z336080032 [0,1,0,0,1,0|2,0,0]=4 282 B13R2.12 OC1=CC=C(C=C1)C2=NC=CN2 Z234896375 [0,1,0,0,1,0|0,0,2]=4 283 B13R2.12 OC1=CC=C(C=C1)C2=NN=CN2 Z1201703037 [0,1,0,0,1,0|1,0,1]=4 284 B13R2.12 OC1=CC=C(C=C1)C2=NN=NN2 Z1000398 [0,1,0,0,1,0|2,0,0]=4 285 B13R2.12 OC1=CC=C(C=C1)C2CCCN2 Z803145548 [0,1,0,0,1,0|1,0,1]=4 286 B13R2.13 BrC1=CC(=CC=C1)C2=NC=CN2 Z728187806 [0,1,0,0,1,0|0,0,2]=4 287 B13R2.13 BrC1=CC(=CC=C1)C2=NN=NN2 Z1000965 [0,1,0,0,1,0|2,0,0]=4 288 B13R2.13 BrC1=CC(=CC=C1)C2CCCN2 Z295459704 [0,1,0,0,1,0|1,0,1]=4 289 B13R2.13 CC1=CC(=CC=C1)C2=NCCN2 Z285049242 [0,1,0,0,1,0|0,0,0]=2 290 B13R2.13 CC1=CC(=CC=C1)C2CCCN2 Z281773884 [0,1,0,0,1,0|1,0,1]=4 291 B13R2.13 ClC1=CC(=CC=C1)C2CCCN2 Z234895217 [0,1,0,0,1,0|1,0,1]=4 292 B13R2.13 ClC1=CC(=NC=C1)C2=NCCO2 Z1517008563 [0,1,0,0,1,0|2,0,0]=4 293 B13R2.13 ClC1=NC=CC(=C1)C2=NCCN2 Z808596768 [0,1,0,0,1,0|1,0,0]=3 294 B13R2.13 FC1=CC(=CC=C1)C2CCCN2 Z752370692 [0,1,0,0,1,0|1,0,1]=4 295 B13R2.13 IC1=CC(=CC=C1)C2=NN=NN2 Z1001158 [0,1,0,0,1,0|2,0,0]=4 296 B13R2.13 IC1=CC(=CC=C1)C2CCCN2 Z362776598 [0,1,0,0,1,0|1,0,1]=4 297 B13R2.13 NC1=CC(=CC=C1)C2=NC=CN2 Z1160899483 [0,1,0,0,1,0|0,0,2]=4 298 B13R2.13 NC1=CC(=CC=C1)C2=NN=CN2 Z1267881699 [0,1,0,0,1,0|1,0,1]=4 299 B13R2.13 NC1=CC(=CC=C1)C2=NN=NN2 Z56347234 [0,1,0,0,1,0|2,0,0]=4 300 B13R2.13 OC1=CC(=CC=C1)C2=NN=CN2 Z1201703035 [0,1,0,0,1,0|1,0,1]=4 301 B13R2.15 CN1C=NN=C1C2=CC=CC=C2 Z1255361478 [0,1,0,0,1,0|1,0,1]=4 302 B13R2.15 O[C@@H]1CCN[C@@H]1C2=CC=CC=C2 Z4203073787 [0,1,0,0,1,0|1,0,1]=4 303 B13R2.18 BrC1=C(C=CC=C1)C2=NC=CN2 Z851790692 [0,1,0,0,1,0|0,0,2]=4 304 B13R2.18 BrC1=C(C=CC=C1)C2=NN=NN2 Z56969325 [0,1,0,0,1,0|2,0,0]=4 305 B13R2.18 BrC1=C(C=CC=C1)C2CCCN2 Z1407007541 [0,1,0,0,1,0|1,0,1]=4 306 B13R2.18 ClC1=C(C=CC=C1)C2=NC=NN2 Z108564448 [0,1,0,0,1,0|1,0,1]=4 307 B13R2.18 ClC1=C(C=CC=C1)C2CCCN2 Z281773778 [0,1,0,0,1,0|1,0,1]=4 308 B13R2.18 FC1=C(C=CC=C1)C2=NN=NN2 Z335291106 [0,1,0,0,1,0|2,0,0]=4 309 B13R2.18 IC1=C(C=CC=C1)C2CCCN2 Z281773830 [0,1,0,0,1,0|1,0,1]=4 310 B13R2.18 NC1=C(C=CC=C1)C2=NC=CN2 Z815309798 [0,1,0,0,1,0|0,0,2]=4 311 B13R2.18 NC1=C(C=CC=C1)C2=NN=CN2 Z1575312107 [0,1,0,0,1,0|1,0,1]=4 312 B13R2.18 NC1=C(C=CC=C1)C2=NN=NN2 Z609890064 [0,1,0,0,1,0|2,0,0]=4 313 B13R2.18 OC1=C(C=CC=C1)C2=NN=CN2 Z1412755279 [0,1,0,0,1,0|1,0,1]=4 314 B13R2.18 OC1=C(C=CC=C1)C2=NN=NN2 Z1123826076 [0,1,0,0,1,0|2,0,0]=4 315 B13R2.31 N[C@H]1C[C@@H](C1)CC2=CC=CC=C2 Z5336692620 [0,1,0,0,1,0|1,0,1]=4 316 B13R2.31 O=C1CC(N1)CC2=CC=CC=C2 Z1198168168 [0,1,0,0,1,0|0,0,2]=4 317 B13R2.31 OC1CC(C1)CC2=CC=CC=C2 Z1551917814 [0,1,0,0,1,0|1,0,1]=4 318 B13R2.221 NC1(CCC1)CC2=CC=CC=C2 Z1428160831 [0,1,0,0,1,0|1,0,1]=4 319 B13R2.1069 OC1=CC=C(C=C1)CC2CCC2 Z1513872159 [0,1,0,0,1,0|1,0,1]=4 320 B13R2.8137 NC(C1=CC=CC=C1)C2CCC2 Z3244520377 [0,1,0,0,1,0|1,0,1]=4 321 B15R2.29 CC1=CC=C(C=C1)CC2CCCNC2 Z957334522 [0,1,0,0,0,1|1,0,1]=4 322 B15R2.29 ClC1=CC=C(C=C1)CC2CCCNC2 Z1188338007 [0,1,0,0,0,1|1,0,1]=4 323 B15R2.29 FC1=CC=C(C=C1)CC2CCCCN2 Z969111080 [0,1,0,0,0,1|1,0,1]=4 324 B15R2.29 OC1=CC=C(C=C1)CC2CCCCN2 Z1376900548 [0,1,0,0,0,1|1,0,1]=4 325 B15R2.31 BrC1=CC(=CC=C1)CC2CCCCN2 Z1082216860 [0,1,0,0,0,1|1,0,1]=4 326 B15R2.31 ClC1=CC(=CC=C1)CC2CCCCN2 Z1082216846 [0,1,0,0,0,1|1,0,1]=4 327 B15R2.38 BrC1=C(C=CC=C1)CC2CCCCN2 Z1082216852 [0,1,0,0,0,1|1,0,1]=4 328 B15R2.38 CC1=C(C=CC=C1)NC2=NCCCS2 Z56823080 [0,1,0,0,0,1|2,0,0]=4 329 B15R2.38 ClC1=C(C=CC=C1)NC2=NCCCS2 Z56877816 [0,1,0,0,0,1|2,0,0]=4 330 B15R2.38 FC1=C(C=CC=C1)CC2CCCCN2 Z2453175126 [0,1,0,0,0,1|1,0,1]=4 331 B15R2.38 O=C1CCNCC1CC2=CC=CC=C2 Z3247606789 [0,1,0,0,0,1|1,0,1]=4 332 B15R2.38 O=C1NCCCC1CC2=CC=CC=C2 Z1255379456 [0,1,0,0,0,1|1,0,1]=4 333 B15R2.38 O=C1NCCCN1CC2=CC=CC=C2 Z1255447124 [0,1,0,0,0,1|2,0,0]=4 334 B15R2.38 O=C1NCCNC1CC2=CC=CC=C2 Z2238934540 [0,1,0,0,0,1|0,0,2]=4 335 B15R2.38 O=C1NCCSC1CC2=CC=CC=C2 Z1258578706 [0,1,0,0,0,1|1,0,1]=4 336 B15R2.2226 O=C(C1=CC=CC=C1)C2=CNCCC2 Z235462066 [0,1,0,0,0,1|1,0,1]=4 337 B15R2.2226 OC(C1=CC=CC=C1)C2CCCCN2 Z979439592 [0,1,0,0,0,1|1,0,1]=4 338 B15R2.2226 OC(C1=CC=CC=C1)C2CCCNC2 Z3352159077 [0,1,0,0,0,1|1,0,1]=4 339 B15R2.55 CN1C=CN=C1SCC2=CC=CC=C2 Z18499767 [0,1,0,0,0,1|0,0,2]=4 340 B15R2.55 CN1CCN=C1NCC2=CC=CC=C2 Z3210132368 [0,1,0,0,0,1|0,0,0]=2 341 B15R2.55 CN\1CCS/C1=N\CC2=CC=CC=C2 Z48963488 [0,1,0,0,0,1|1,0,0]=3 342 B15R2.64 OC(CC1=CC=CC=C1)C2CCCN2 Z5209485269 [0,1,0,0,0,1|1,0,1]=4 343 B15R2.100 BrC1=CC=C(C=C1)CSC2=NN=CN2 Z18741430 [0,1,0,0,0,1|1,0,1]=4 344 B15R2.100 BrC1=CC=C(C=C1)SCC2CCCN2 Z839514338 [0,1,0,0,0,1|1,0,1]=4 345 B15R2.100 CC1=CC=C(C=C1)CSC2=NCCS2 Z19630672 [0,1,0,0,0,1|1,0,0]=3 346 B15R2.100 CC1=CC=C(C=C1)NCC2=NC=CN2 Z825759194 [0,1,0,0,0,1|0,0,2]=4 347 B15R2.100 ClC1=CC=C(C=C1)CNC2=NCCS2 Z367660566 [0,1,0,0,0,1|1,0,0]=3 348 B15R2.100 ClC1=CC=C(C=C1)CSC2=NCCN2 Z48834205 [0,1,0,0,0,1|0,0,0]=2 349 B15R2.100 ClC1=CC=C(C=C1)OCC2=NN=NN2 Z111570484 [0,1,0,0,0,1|2,0,0]=4 350 B15R2.100 FC1=CC=C(C=C1)CSC2=NCCN2 Z48834218 [0,1,0,0,0,1|0,0,0]=2 351 B15R2.100 FC1=CC=C(C=C1)CSC2=NCCS2 Z19631284 [0,1,0,0,0,1|1,0,0]=3 352 B15R2.100 FC1=CC=C(C=C1)CSC2=NN=CN2 Z18741443 [0,1,0,0,0,1|1,0,1]=4 353 B15R2.100 FC1=CC=C(C=C1)OCC2CCCN2 Z839513656 [0,1,0,0,0,1|1,0,1]=4 354 B15R2.100 IC1=CC=C(C=C1)CSC2=NN=CN2 Z1272920906 [0,1,0,0,0,1|1,0,1]=4 355 B15R2.100 NC1=CC=C(C=C1)CCC2=NN=NN2 Z1201626131 [0,1,0,0,0,1|2,0,0]=4 356 B15R2.100 NC1=CC=C(C=C1)OCC2=NN=NN2 Z808589120 [0,1,0,0,0,1|2,0,0]=4 357 B15R2.100 OC1=CC=C(C=C1)OCC2=NN=CN2 Z2582323444 [0,1,0,0,0,1|1,0,1]=4 358 B15R2.283 CC1=NN=C(N1)SCC2=CC=CC=C2 Z57725004 [0,1,0,0,0,1|1,0,1]=4 359 B15R2.283 CC1CN=C(S1)NCC2=CC=NC=C2 Z56828899 [0,1,0,0,0,1|2,0,0]=4 360 B15R2.283 CC1CSC(=N1)SCC2=NC=CC=C2 Z1532759642 [0,1,0,0,0,1|2,0,0]=4 361 B15R2.283 NC1=NN=C(N1)SCC2=CC=CC=C2 Z18356882 [0,1,0,0,0,1|1,0,1]=4 362 B15R2.283 O=C1NC(=NO1)OCC2=CC=CC=C2 Z1509188104 [0,1,0,0,0,1|1,0,1]=4 363 B15R2.562 BrC1=C(C=CC=C1)CSC2=NCCN2 Z228497876 [0,1,0,0,0,1|0,0,0]=2 364 B15R2.562 BrC1=C(C=CC=C1)CSC2=NN=CN2 Z18741580 [0,1,0,0,0,1|1,0,1]=4 365 B15R2.562 CC1=C(C=CC=C1)NCC2=NC=CN2 Z825759202 [0,1,0,0,0,1|0,0,2]=4 366 B15R2.562 FC1=C(C=CC=C1)CSC2=NCCN2 Z57470394 [0,1,0,0,0,1|0,0,0]=2 367 B15R2.562 FC1=C(C=CC=C1)CSC2=NN=CN2 Z18741414 [0,1,0,0,0,1|1,0,1]=4 368 B15R2.1117 BrC1=CC(=CC=C1)CSC2=NCCN2 Z216501478 [0,1,0,0,0,1|0,0,0]=2 369 B15R2.1117 CC1=CC(=CC=C1)CSC2=NCCS2 Z19631672 [0,1,0,0,0,1|1,0,0]=3 370 B15R2.1117 ClC1=CC(=CC=C1)CSC2=NCCS2 Z19631280 [0,1,0,0,0,1|1,0,0]=3 371 B15R2.1117 ClC1=CC(=CC=C1)CSC2=NN=CN2 Z18741439 [0,1,0,0,0,1|1,0,1]=4 372 B15R2.1117 FC1=CC(=CC=C1)CSC2=NCCS2 Z19630733 [0,1,0,0,0,1|1,0,0]=3 373 B15R2.1117 OC1=CC(=CC=C1)CSC2=NN=NN2 Z4604985954 [0,1,0,0,0,1|2,0,0]=4 374 B15R2.1259 CC(CC1=NN=NN1)C2=CC=CC=C2 Z1000147 [0,1,0,0,0,1|2,0,0]=4 375 B15R2.1259 CC(NC1=NCCS1)C2=CC=CC=C2 Z56839765 [0,1,0,0,0,1|1,0,0]=3 376 B15R2.1259 CN(CC1CCCN1)C2=CC=CC=C2 Z335286882 [0,1,0,0,0,1|1,0,1]=4 377 B15R2.1259 NC(CC1=NC=CN1)C2=CC=CC=C2 Z1525520820 [0,1,0,0,0,1|0,0,2]=4 378 B15R2.1259 NC(CC1=NN=CN1)C2=CC=CC=C2 Z1741785888 [0,1,0,0,0,1|1,0,1]=4 379 B15R2.1259 NC(CC1=NN=NN1)C2=CC=CC=C2 Z3688940910 [0,1,0,0,0,1|2,0,0]=4 380 B15R2.1259 O=C(CC1=NC=CN1)C2=CC=CC=C2 Z57048974 [0,1,0,0,0,1|0,0,2]=4 381 B15R2.1259 O=C(CC1CCCN1)C2=CC=CC=C2 Z1259303180 [0,1,0,0,0,1|1,0,1]=4 382 B15R2.1259 O=C(NC1=NCCS1)C2=CC=CC=C2 Z30009147 [0,1,0,0,0,1|1,0,1]=4 383 B15R2.1259 OC(CC1CCCN1)C2=CC=CC=C2 Z1269753912 [0,1,0,0,0,1|1,0,1]=4 384 B15R2.1259 O[C@H](C[C@@H]1CCCN1)C2=CC=CC=C2 Z1262593111 [0,1,0,0,0,1|1,0,1]=4 385 B15R2.8863 CC1(CCCN1)CCC2=CC=CC=C2 Z1295563464 [0,1,0,0,0,1|1,0,1]=4 386 B15R2.15 CCC1CSC(=N1)NC2=CC=CC=C2 Z56828394 [0,2,0,0,0,0|2,0,0]=4 387 B15R2.15 NCC1=NN=C(N1)CC2=CC=CC=C2 Z3486009738 [0,2,0,0,0,0|1,0,1]=4 388 B15R2.15 OCC1=CNC(=N1)CC2=CC=CC=C2 Z1094714388 [0,2,0,0,0,0|0,0,2]=4 389 B15R2.98 CC1=CC=C(C=C1)NC2=NCC(S2)C Z56872081 [0,2,0,0,0,0|2,0,0]=4 390 B15R2.98 CC1=NNC(=N1)CC2=CC=C(C=C2)Cl Z385478716 [0,2,0,0,0,0|1,0,1]=4 391 B15R2.98 CC1CN/C(=N/C2=CC=C(C=C2)F)/S1 Z48963848 [0,2,0,0,0,0|2,0,0]=4 392 B15R2.98 CC1CN=C(S1)NC2=CC=C(C=C2)Cl Z56838465 [0,2,0,0,0,0|2,0,0]=4 393 B15R2.305 CC1=C(C=CC=C1)NC2=NCC(S2)C Z56872063 [0,2,0,0,0,0|2,0,0]=4 394 B15R2.1115 CC1=CC=CC(=C1)NC2=NC(CS2)C Z56904687 [0,2,0,0,0,0|2,0,0]=4 395 B15R2.1115 CC1=CC=CC(=C1)NC2=NCC(S2)C Z56917895 [0,2,0,0,0,0|2,0,0]=4 396 B15R2.4083 CN1C(=NN=C1CC2=CC=CC=C2)S Z56985759 [0,2,0,0,0,0|1,0,1]=4 397 B15R2.335 CN1C=NN=C1CC2=CC(=CC=C2)Br Z1416188648 [0,2,0,0,0,0|1,0,1]=4 398 B15R2.395 CN1C=CN=C1C(O)C2=CC=CC=C2 Z57204768 [0,2,0,0,0,0|0,0,2]=4 399 B15R2.1510 CC1=CC=C(C=C1)CC2=NN=NN2C Z5611933166 [0,2,0,0,0,0|2,0,0]=4 400 B15R2.1510 CN1N=NN=C1CC2=CC=C(C=C2)Br Z1203907838 [0,2,0,0,0,0|2,0,0]=4 401 B15R2.123 COC1=C(C=CC=C1)/N=C/2\CCCN2 Z56971426 [0,2,0,0,0,0|2,0,0]=4 402 B15R2.123 COC1=C(C=CC=C1)/N=C/2\NCCS2 Z89266991 [0,2,0,0,0,0|2,0,0]=4 403 B15R2.123 COC1=C(C=CC=C1)CC2CCCN2 Z381029840 [0,2,0,0,0,0|1,0,1]=4 404 B15R2.123 CSC1=C(C=CC=C1)/N=C/2\CCCN2 Z55928028 [0,2,0,0,0,0|2,0,0]=4 405 B15R2.1109 CC1=C(C=CC=C1Cl)NC2=NCCS2 Z56904587 [0,2,0,0,0,0|2,0,0]=4 406 B15R2.1109 FC1=C(C(=CC=C1)CC2CCCN2)F Z3014243699 [0,2,0,0,0,0|1,0,1]=4 407 B15R2.1154 CC1=CC(=C(C=C1)NC2=NCCN2)Cl Z1269184834 [0,2,0,0,0,0|1,0,0]=3 408 B15R2.1154 FC1=CC(=C(C=C1)CC2=NN=NN2)F Z1001248 [0,2,0,0,0,0|2,0,0]=4 409 B15R2.1154 FC1=CC(=C(C=C1)CC2CCCN2)F Z3050586021 [0,2,0,0,0,0|1,0,1]=4 410 B15R2.7567 FC1=CC(=C(C=C1)F)CC2CCCN2 Z2327229296 [0,2,0,0,0,0|1,0,1]=4 411 B15R2.15371 ClC1=CC=CC(=C1/N=C/2\CCCN2)Cl Z55927672 [0,2,0,0,0,0|2,0,0]=4 412 B15R2.15371 ClC1=CC=CC(=C1NC2=NCCN2)Cl Z1695759754 [0,2,0,0,0,0|1,0,0]=3 413 B15R2.15371 FC1=C(C(=CC=C1)Cl)CC2CCCN2 Z449369140 [0,2,0,0,0,0|1,0,1]=4 414 B15R2.34 CCC1=CC=C(C=C1)/N=C\2/NCCS2 Z48963565 [0,2,0,0,0,0|2,0,0]=4 415 B15R2.34 COC1=CC=C(C=C1)/N=C\2/CCCN2 Z55927696 [0,2,0,0,0,0|2,0,0]=4 416 B15R2.34 COC1=CC=C(C=C1)CC2=NN=NN2 Z1000623 [0,2,0,0,0,0|2,0,0]=4 417 B15R2.34 COC1=CC=C(C=C1)CC2CCCN2 Z285198380 [0,2,0,0,0,0|1,0,1]=4 418 B15R2.34 COC1=CC=C(C=C1)NC2=NCCN2 Z57186564 [0,2,0,0,0,0|1,0,0]=3 419 B15R2.34 COC1=CC=C(C=C1)NC2=NCCS2 Z56837061 [0,2,0,0,0,0|2,0,0]=4 420 B15R2.91 NC(C1=CC=C(C=C1)F)C2=NC=CN2 Z1395143967 [0,2,0,0,0,0|0,0,2]=4 421 B15R2.91 OC(C1=CC=C(C=C1)F)C2=NC=CN2 Z274340640 [0,2,0,0,0,0|0,0,2]=4 422 B15R2.92 CC1=C(C=C(C=C1)/N=C\2/NCCS2)Cl Z48963555 [0,2,0,0,0,0|2,0,0]=4 423 B15R2.92 ClC1=C(C=C(C=C1)CC2=NN=NN2)Cl Z362839076 [0,2,0,0,0,0|2,0,0]=4 424 B15R2.92 ClC1=C(C=C(C=C1)NC2=NCCS2)Cl Z56881227 [0,2,0,0,0,0|2,0,0]=4 425 B15R2.19013 CC1(CCCN1)CC2=CC=C(C=C2)F Z1295563548 [0,2,0,0,0,0|1,0,1]=4 426 B15R2.19013 CC1=CC=C(C=C1)CC2(CCCN2)C Z2738331035 [0,2,0,0,0,0|1,0,1]=4 427 B15R2.131 CCC(C1=CC=CC=C1)C2CCCN2 Z1262246222 [0,2,0,0,0,0|1,0,1]=4 428 B15R2.131 CNC(C1=CC=CC=C1)C2=NC=CN2 Z1395145605 [0,2,0,0,0,0|0,0,2]=4 429 B15R2.131 N#CC(C1=CC=CC=C1)C2CCCN2 Z1318147507 [0,2,0,0,0,0|1,0,1]=4 430 B15R2.131 NCC(C1=CC=CC=C1)C2=NN=CN2 Z2238129711 [0,2,0,0,0,0|1,0,1]=4 431 B15R2.353 CC(C)(C1=CC=CC=C1)C2CCCN2 Z285198448 [0,2,0,0,0,0|1,0,1]=4 432 B15R2.4135 CCC1(CCCN1)CC2=CC=CC=C2 Z2509379140 [0,2,0,0,0,0|1,0,1]=4 433 B15R2.7139 CC1(CCCN1)CC2=CC(=CC=C2)Br Z2756849860 [0,2,0,0,0,0|1,0,1]=4 434 B15R2.7139 CC1(CCCN1)CC2=CC(=CC=C2)Cl Z2418410859 [0,2,0,0,0,0|1,0,1]=4 435 B15R2.7139 CC1=CC(=CC=C1)CC2(CCCN2)C Z2732437115 [0,2,0,0,0,0|1,0,1]=4 436 B15R2.2053 COC1=CC(=CC=C1)CC2CCCN2 Z285198410 [0,2,0,0,0,0|1,0,1]=4 437 B15R2.2053 N#CC1=CC(=CC=C1)/N=C/2\CCCN2 Z55928092 [0,2,0,0,0,0|2,0,0]=4 438 B13R2.1 CCCN1C=NC2=C1C=CC=C2 Z53833307 [0,0,1,1,0,0|2,0,0]=4 439 B13R2.1 NCCC1=CNC2=C1C=CC=C2 Z104478080 [0,0,1,1,0,0|2,0,0]=4 440 B13R2.1 NCCC1=CSC2=C1C=CC=C2 Z432090862 [0,0,1,1,0,0|2,0,0]=4 441 B13R2.1 NCCN1C=NC2=C1C=CC=C2 Z607822458 [0,0,1,1,0,0|1,0,1]=4 442 B13R2.1 NCCN1CCC2=C1C=CC=C2 Z594038402 [0,0,1,1,0,0|0,0,2]=4 443 B13R2.1 OCCN1CCC2=C1C=CC=C2 Z425793930 [0,0,1,1,0,0|1,0,1]=4 444 B13R2.3 C1=CC=C(C=C1)C2CCCNC2 Z2205958510 [0,0,1,1,0,0|1,0,1]=4 445 B13R2.3 C1=CC=C(C=C1)C2CNCCN2 Z1250954583 [0,0,1,1,0,0|0,0,2]=4 446 B13R2.3 C1=CC=C(C=C1)C2CNCCO2 Z283821656 [0,0,1,1,0,0|1,0,1]=4 447 B13R2.3 C1=CC=C(C=C1)C2COCCN2 Z1097086259 [0,0,1,1,0,0|1,0,1]=4 448 B13R2.3 C1=CC=C(C=C1)C2CSCCN2 Z1201621925 [0,0,1,1,0,0|1,0,1]=4 449 B13R2.50 NC[C@@H]1C[C@H]1CC2=CC=CC=C2 Z3013803470 [0,0,1,1,0,0|1,0,1]=4 450 B13R2.56 NCC1CCC1C2=CC=CC=C2 Z4003034803 [0,0,1,1,0,0|1,0,1]=4 451 B13R2.56 OC[C@@H]1NC[C@H]1C2=CC=CC=C2 Z3691037314 [0,0,1,1,0,0|1,0,1]=4 452 B13R2.67 C1=CC2=C(C=C1)CCNCCC2 Z1262566301 [0,0,1,1,0,0|1,0,1]=4 453 B13R2.67 C1=CC2=C(C=C1)NCCCCC2 Z1262691695 [0,0,1,1,0,0|1,0,1]=4 454 B13R2.1613 CCC1NCCC2=C1C=CC=C2 Z1267881708 [0,0,1,1,0,0|1,0,1]=4 455 B13R2.1613 NCC1=C2C=CC=CC2=CC=N1 Z220439492 [0,0,1,1,0,0|0,0,2]=4 456 B13R2.1613 NCC1CCCC2=C1C=CC=C2 Z234895145 [0,0,1,1,0,0|1,0,1]=4 457 B13R2.1613 NCC1COCC2=C1C=CC=C2 Z3476924979 [0,0,1,1,0,0|2,0,0]=4 458 B13R2.1613 NCC1OCCC2=C1C=CC=C2 Z1695797895 [0,0,1,1,0,0|1,0,1]=4 459 B13R2.1613 NCC1SCCC2=C1C=CC=C2 Z1262636262 [0,0,1,1,0,0|1,0,1]=4 460 B13R2.1613 OCC1NCCC2=C1C=CC=C2 Z1192380043 [0,0,1,1,0,0|1,0,1]=4 461 B13R2.5252 CC1CNCCC2=C1C=CC=C2 Z1262566288 [0,0,1,1,0,0|1,0,1]=4 462 B13R2.26 CCCC1=NC2=C(N1)C=CC=C2 Z55692902 [0,0,1,1,0,0|2,0,0]=4 463 B13R2.26 CCNC1=NC2=C(S1)C=CC=C2 Z55176255 [0,0,1,1,0,0|1,0,0]=3 464 B13R2.26 CCSC1=NC2=C(N1)C=CC=C2 Z53833332 [0,0,1,1,0,0|2,0,0]=4 465 B13R2.26 CCSC1=NC2=C(S1)C=CC=C2 Z19653777 [0,0,1,1,0,0|2,0,0]=4 466 B13R2.135 CCN1C(=NC2=C1C=CC=C2)N Z56921771 [0,0,1,1,0,0|1,0,1]=4 467 B13R2.135 CCN1C(=NC2=C1C=CC=C2)S Z56896246 [0,0,1,1,0,0|2,0,0]=4 468 B13R2.135 CCN1C(=O)NC2=C1C=CC=C2 Z57114989 [0,0,1,1,0,0|2,0,0]=4 469 B13R2.163 O=C1CCCC2=C(C1)C=CC=C2 Z1255446913 [0,0,1,1,0,0|2,0,0]=4 470 B13R2.197 C[C@@H]1C[C@@]1(N)CC2=CC=CC=C2 Z3487486148 [0,0,1,1,0,0|1,0,1]=4 471 B13R2.328 CC1=C2C=CC=CC2=NC(=N1)N Z57166964 [0,0,1,1,0,0|1,0,1]=4 472 B13R2.444 NC(CC1=CC=CC=C1)C2CC2 Z1695784318 [0,0,1,1,0,0|1,0,1]=4 473 B13R2.444 O=C(CC1=CC=CC=C1)C2CC2 Z513735694 [0,0,1,1,0,0|2,0,0]=4 474 B13R2.45 CNC1=NC2=C(N1C)C=CC=C2 Z1198162309 [0,0,1,1,0,0|1,0,1]=4 475 B13R2.45 CN\1C2=C(C=CC=C2)S/C1=N/N Z271004716 [0,0,1,1,0,0|2,0,0]=4 476 B13R2.45 CSC1=NC2=C(N1C)C=CC=C2 Z15478802 [0,0,1,1,0,0|2,0,0]=4 477 B13R2.57 CCC1CC2=C(C=CC=C2)CN1 Z979717460 [0,0,1,1,0,0|1,0,1]=4 478 B13R2.57 CNC1CCC2=C(C1)C=CC=C2 Z102767748 [0,0,1,1,0,0|1,0,1]=4 479 B13R3.1962 C1=CC2=C(C=C1)C3CCC2N3 Z2242191032 [0,0,0,1,1,0|1,0,1]=4 480 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CNCC3 Z1526503389 [0,0,0,1,0,1|2,0,0]=4 481 B15R3.3 C1=CC2=C(C=C1)N3CCCNC3=N2 Z1198155825 [0,0,0,1,0,1|1,0,1]=4 482 B15R3.3 C1=CC2=C(C=C1)N3CCNCC3=C2 Z2188172213 [0,0,0,1,0,1|0,0,2]=4 483 B15R3.1739 C1=CC2=C(C=C1)N3CCCC3CN2 Z382687448 [0,0,0,1,0,1|1,0,1]=4 484 B15R3.4266 C1=CC2=C(C=C1)N=C3CCCN3C2 Z2295423882 [0,1,0,1,0,0|2,0,0]=4 485 B15R3.4266 C1=CC2=C(C=C1)NC3=NCCN3C2 Z2092177512 [0,1,0,1,0,0|1,0,0]=3 486 B15R3.10591 NC1=CC2=C(C=C1)SC3=NCCN23 Z448248214 [0,1,0,1,0,0|1,0,0]=3 487 B11R1.16 CCCC(=O)C1=CC=CC=C1 Z104477742 [0,0,1,0,1,0|2,0,0]=4 488 B11R1.16 CCOC(=O)C1=CC=CC=C1 Z53835169 [0,0,1,0,1,0|2,0,0]=4 489 B11R1.16 O=C(NCO)C1=CC=CC=C1 Z56799838 [0,0,1,0,1,0|2,0,0]=4 490 B11R2.2 C1=CSC(=C1)C2=NCCC2 Z57040509 [0,0,0,0,2,0|2,0,0]=4 491 B11R2.2 C1=CSC(=C1)C2=NCCN2 Z235363021 [0,0,0,0,2,0|1,0,0]=3 492 B11R2.239 C1=CC=C(C=C1)C2CCN2 Z359510120 [0,0,0,0,2,0|0,0,1]=3 493 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [0,0,0,0,2,0|1,0,1]=4 494 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [0,0,0,0,2,0|1,0,1]=4 495 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [0,0,0,0,2,0|1,0,1]=4 496 B11R2.238 C1=CC=C(C=C1)NC2CC2 Z1203731288 [0,0,0,0,2,0|1,0,1]=4 497 B13R1.417 C/N=C(\NC)/NCC1=CC=CC=C1 Z1089994842 [0,0,1,0,0,1|0,0,0]=2 498 B15R2.2167 C1=CC=C(C=C1)CN2CCCNCC2 Z169852140 [0,0,0,0,0,2|2,0,0]=4 499 B15R2.2195 C1=CC=C(C=C1)C/N=C\2/NCCCS2 Z48963283 [0,0,0,0,0,2|1,0,0]=3 500 B15R2.2195 C1=CC=C(C=C1)CCC2CCCCN2 Z2106609139 [0,0,0,0,0,2|1,0,1]=4 501 B15R2.2195 C1=CC=C(C=C1)CCC2CNCCO2 Z1198184701 [0,0,0,0,0,2|1,0,1]=4 502 B15R2.2195 C1=CC=C(C=C1)CNC2CCCNC2 Z838921710 [0,0,0,0,0,2|1,0,1]=4 503 B15R2.2195 C1=CC=C(C=C1)COC2CCCNC2 Z3234813924 [0,0,0,0,0,2|1,0,1]=4 504 B15R2.2195 C1=CC=C(C=C1)OCC2CCCNC2 Z317037454 [0,0,0,0,0,2|1,0,1]=4 505 B15R2.2195 C1=CC=C(C=C1)OCC2CNCCO2 Z1198169844 [0,0,0,0,0,2|1,0,1]=4 506 B15R2.2196 C1=CC=C(C=C1)CCCC2=NN=NN2 Z335295228 [0,0,0,0,0,2|2,0,0]=4 507 B15R2.2196 C1=CC=C(C=C1)CCCC2CCCN2 Z361890872 [0,0,0,0,0,2|1,0,1]=4 508 B15R2.2196 C1=CC=C(C=C1)CCNC2=NCCS2 Z56896214 [0,0,0,0,0,2|1,0,0]=3 509 B15R2.2196 C1=CC=C(C=C1)CCSC2=NN=CN2 Z18740984 [0,0,0,0,0,2|1,0,1]=4