0 B15R2.1154 Brc1cc(Br)c(cc1)NC2=NCCS2 Amb25138369 [0,0,0,0,0,0|2,1,0]=3 1 B15R2.1154 Brc1cc(Br)c(cc1)NC=2CCCN2 Amb24498576 [0,0,0,0,0,0|2,1,0]=3 2 B15R2.1154 Brc1cc(I)ccc1NC=2CCCN2 Amb25138555 [0,0,0,0,0,0|2,1,0]=3 3 B15R2.1154 Cc1c[n]c(NC=2NCCN2)c(Cl)c1 Amb25253553 [0,0,0,0,0,0|1,0,0]=1 4 B15R2.1154 Cc1cc(C)c(CC=2NCCN2)cc1 Amb18564543 [0,0,0,0,0,0|2,0,0]=2 5 B15R2.1154 Cc1cc(C)c(cc1)NC2=NCCO2 Amb25229560 [0,0,0,0,0,0|2,0,0]=2 6 B15R2.1154 Cc1cc(C)c(cc1)Nc2[nH][n][n][n]2 Amb24559779 [0,0,0,0,0,0|3,0,0]=3 7 B15R2.1154 Cc1cc(Cl)c(Cc2[nH][n][n][n]2)cc1 Amb25079591 [0,0,0,0,0,0|3,0,0]=3 8 B15R2.1154 Cc1cc(Cl)c(\C=C\2/CNCC2)cc1 Amb25824479 [0,0,0,0,0,0|4,0,0]=4 9 B15R2.1154 Cc1cc(Cl)c(cc1)N=C2NCCN2 Amb22734872 [0,0,0,0,0,0|0,0,2]=2 10 B15R2.1154 Cc1cc(Cl)ccc1NC2=NCCS2 Amb25045152 [0,0,0,0,0,0|3,0,0]=3 11 B15R2.1154 Cc1cc(Cl)ccc1NC2NCCO2 Amb24361903 [0,0,0,0,0,0|3,0,1]=4 12 B15R2.1154 Cc1cc(Cl)ccc1NC=2NCCN2 Amb24089676 [0,0,0,0,0,0|2,0,0]=2 13 B15R2.1154 Cc1cc(F)c(cc1)NC=2CCCN2 Amb25101271 [0,0,0,0,0,0|1,1,0]=2 14 B15R2.1154 Cc1cc(N)c(cc1)Sc2[nH]cc[n]2 Amb24759707 [0,0,0,0,0,0|2,0,2]=4 15 B15R2.1154 Cc1cc(O)c(cc1)Nc2[n]cc[s]2 Amb24089644 [0,0,0,0,0,0|2,0,2]=4 16 B15R2.1154 Cc1ccc(CC2C=CCN2)c(Cl)c1 Amb25191137 [0,0,0,0,0,0|2,0,2]=4 17 B15R2.1154 Cc1ccc(CC2CCCN2)c(Br)c1 Amb24470977 [0,0,0,0,0,0|2,1,1]=4 18 B15R2.1154 Cc1ccc(CC2CCCN2)c(Cl)c1 Amb25703392 [0,0,0,0,0,0|2,0,1]=3 19 B15R2.1154 Cc1ccc(NC=2NCCN2)c(Br)c1 Amb24506719 [0,0,0,0,0,0|0,1,0]=1 20 B15R2.1154 Cc1ccc(NC=2NCCN2)c(C)c1 Amb24096399 [0,0,0,0,0,0|1,0,0]=1 21 B15R2.1154 Cc1ccc(NC=2NCCN2)c(Cl)c1 Amb24096485 [0,0,0,0,0,0|0,0,0]=0 22 B15R2.1154 Cc1ccc(c(c1)C)CC2CCCN2 Amb17234797 [0,0,0,0,0,0|3,0,1]=4 23 B15R2.1154 Cc1ccc(c(c1)C)Nc2nnns2 Amb1076405 [0,0,0,0,0,0|4,0,0]=4 24 B15R2.1154 Clc1cc(Br)ccc1CN2CCCN2 Amb24562638 [0,0,0,0,0,0|4,0,0]=4 25 B15R2.1154 Clc1cc(Br)ccc1Cc2[nH][n][n][n]2 Amb24649397 [0,0,0,0,0,0|4,0,0]=4 26 B15R2.1154 Clc1cc(Br)ccc1NC=2CCCN2 Amb24607782 [0,0,0,0,0,0|2,0,0]=2 27 B15R2.1154 Clc1cc(Cl)c(CC=2NCCN2)cc1 Amb18070428 [0,0,0,0,0,0|2,0,0]=2 28 B15R2.1154 Clc1cc(Cl)c(cc1)NC=2CCCN2 Amb24710824 [0,0,0,0,0,0|2,0,0]=2 29 B15R2.1154 Clc1cc(I)ccc1NC=2CCCN2 Amb25716334 [0,0,0,0,0,0|2,0,0]=2 30 B15R2.1154 Clc1ccc(NC=2NCCN2)c(Cl)c1 Amb25713217 [0,0,0,0,0,0|1,0,0]=1 31 B15R2.1154 Clc1ccc(c(c1)Cl)Nc2ncn[nH]2 Amb2408542 [0,0,0,0,0,0|2,0,1]=3 32 B15R2.1154 Fc1cc(Cl)c(CC=2NCCN2)cc1 Amb25170601 [0,0,0,0,0,0|2,0,0]=2 33 B15R2.1154 Fc1cc(Cl)c(cc1)NC=2CCCN2 Amb25853491 [0,0,0,0,0,0|2,0,0]=2 34 B15R2.1154 Fc1cc(Cl)ccc1NC=2CCCN2 Amb24650611 [0,0,0,0,0,0|2,1,0]=3 35 B15R2.1154 Fc1cc(Cl)ccc1NC=2NCCN2 Amb25366205 [0,0,0,0,0,0|1,1,0]=2 36 B15R2.1154 Fc1cc(F)c(CC=2NCCN2)cc1 Amb25170558 [0,0,0,0,0,0|2,1,0]=3 37 B15R2.1154 Fc1cc(I)c(cc1)NC2=NCCS2 Amb25664833 [0,0,0,0,0,0|2,1,0]=3 38 B15R2.1154 Fc1ccc(CC2CCCN2)c(Cl)c1 Amb24679954 [0,0,0,0,0,0|3,0,1]=4 39 B15R2.1154 Fc1ccc(NC=2NCCN2)c(Br)c1 Amb24506723 [0,0,0,0,0,0|1,1,0]=2 40 B15R2.1154 Fc1ccc(NC=2NCCN2)c(Cl)c1 Amb25733483 [0,0,0,0,0,0|1,0,0]=1 41 B15R2.1154 Fc1ccc(NC=2NCCN2)c(F)c1 Amb24521201 [0,0,0,0,0,0|1,1,0]=2 42 B15R2.1154 Fc1ccc(NC=2NCCN2)c(I)c1 Amb25297853 [0,0,0,0,0,0|1,1,0]=2 43 B15R2.1154 Nc1cc(Br)ccc1Nc2[nH]cc[n]2 Amb25855715 [0,0,0,0,0,0|2,0,2]=4 44 B15R2.1154 Nc1cc(Cl)ccc1NC=2NCCN2 Amb24336736 [0,0,0,0,0,0|2,0,0]=2 45 B15R2.1154 Nc1ccc(c(c1)Cl)Nc2nccs2 Amb17211158 [0,0,0,0,0,0|2,0,2]=4 46 B14R2.50 Brc1ccccc1CC=2NCCN2 Amb25296599 [1,0,0,0,0,0|1,1,0]=3 47 B14R2.50 Brc1ccccc1\N=C\2/CCCN2 Amb19200230 [1,0,0,0,0,0|1,1,1]=4 48 B14R2.50 Cc1[n]cccc1NC2=NCCS2 Amb24435190 [1,0,0,0,0,0|3,0,0]=4 49 B14R2.50 Cc1ccccc1CC=2NCCN2 Amb18065544 [1,0,0,0,0,0|2,0,0]=3 50 B14R2.50 Cc1ccccc1NC2=NCCO2 Amb24490227 [1,0,0,0,0,0|2,0,0]=3 51 B14R2.50 Cc1ccccc1NC2=NCCS2 Amb1103908 [1,0,0,0,0,0|2,0,0]=3 52 B14R2.50 Cc1ccccc1NC=2NCCN2 Amb24072045 [1,0,0,0,0,0|1,0,0]=2 53 B14R2.50 Clc1[n]cccc1\N=C/2\CCCN2 Amb24525470 [1,0,0,0,0,0|2,0,1]=4 54 B14R2.50 Clc1c[n]ccc1\N=C/2\CCCN2 Amb24720973 [1,0,0,0,0,0|2,0,1]=4 55 B14R2.50 Clc1ccc[n]c1NC=2NCCN2 Amb24399753 [1,0,0,0,0,0|1,0,0]=2 56 B14R2.50 Clc1ccccc1CC2CCCN2 Amb17659180 [1,0,0,0,0,0|2,0,1]=4 57 B14R2.50 Clc1ccccc1CC2CCCN2 Amb2235504 [1,0,0,0,0,0|2,0,1]=4 58 B14R2.50 Clc1ccccc1CC2CCCN2 Amb2237175 [1,0,0,0,0,0|2,0,1]=4 59 B14R2.50 Clc1ccccc1CC=2CCCC2 Amb24597891 [1,0,0,0,0,0|3,0,0]=4 60 B14R2.50 Clc1ccccc1CC=2NCCN2 Amb18066352 [1,0,0,0,0,0|1,0,0]=2 61 B14R2.50 Clc1ccccc1Cc2[nH]cc[n]2 Amb18335693 [1,0,0,0,0,0|1,0,2]=4 62 B14R2.50 Clc1ccccc1NC2=NCCS2 Amb2257757 [1,0,0,0,0,0|1,0,0]=2 63 B14R2.50 Clc1ccccc1NC=2NCCN2 Amb22473004 [1,0,0,0,0,0|0,0,0]=1 64 B14R2.50 Clc1ccccc1NC=2NCCN2 Amb24103886 [1,0,0,0,0,0|0,0,0]=1 65 B14R2.50 Clc1ccccc1Nc2[n][nH][n][n]2 Amb25290178 [1,0,0,0,0,0|2,0,1]=4 66 B14R2.50 Clc1ccccc1Nc2[n][n][n][s]2 Amb22486773 [1,0,0,0,0,0|3,0,0]=4 67 B14R2.50 Fc1ccccc1CC=2NCCN2 Amb18065750 [1,0,0,0,0,0|1,1,0]=3 68 B14R2.50 Ic1ccccc1NC=2NCCN2 Amb25685142 [1,0,0,0,0,0|0,1,0]=2 69 B14R2.50 Ic1ccccc1\N=C\2/CCCN2 Amb19200231 [1,0,0,0,0,0|1,1,1]=4 70 B14R2.50 Nc1ccccc1N=C2NCCN2 Amb10562456 [1,0,0,0,0,0|1,0,2]=4 71 B14R2.50 Nc1ccccc1NC2=NCCS2 Amb24652647 [1,0,0,0,0,0|2,0,0]=3 72 B14R2.50 Nc1ccccc1NC=2NCCN2 Amb25040556 [1,0,0,0,0,0|1,0,0]=2 73 B14R2.50 Nc1ccccc1\N=C/2\CCCN2 Amb25844093 [1,0,0,0,0,0|2,0,1]=4 74 B14R2.72 Brc1ccc(CC2=NCCO2)cc1 Amb24645309 [1,0,0,0,0,0|3,0,0]=4 75 B14R2.72 Brc1ccc(CC=2NCCN2)cc1 Amb18071163 [1,0,0,0,0,0|2,0,0]=3 76 B14R2.72 Brc1ccc(cc1)NC=2NCCN2 Amb25109011 [1,0,0,0,0,0|1,0,0]=2 77 B14R2.72 Cc1[n]cc(c[n]1)NC2=NCCS2 Amb24646300 [1,0,0,0,0,0|3,0,0]=4 78 B14R2.72 Cc1ccc(C=C2CCCC2)cc1 Amb17778164 [1,0,0,0,0,0|3,0,0]=4 79 B14R2.72 Cc1ccc(CC=2NCCN2)c[n]1 Amb24070755 [1,0,0,0,0,0|2,0,0]=3 80 B14R2.72 Cc1ccc(CC=2NCCN2)cc1 Amb18065546 [1,0,0,0,0,0|1,0,0]=2 81 B14R2.72 Cc1ccc(C[C@H]2CCCN2)cc1 Amb24355310 [1,0,0,0,0,0|2,0,1]=4 82 B14R2.72 Cc1ccc(Cc2[nH]cc[n]2)cc1 Amb24436471 [1,0,0,0,0,0|1,0,2]=4 83 B14R2.72 Cc1ccc(cc1)CC2CCCN2 Amb2234679 [1,0,0,0,0,0|2,0,1]=4 84 B14R2.72 Cc1ccc(cc1)N=C2NCCN2 Amb10573974 [1,0,0,0,0,0|0,0,2]=3 85 B14R2.72 Cc1ccc(cc1)NC=2CCCN2 Amb22036691 [1,0,0,0,0,0|1,0,0]=2 86 B14R2.72 Cc1ccc(cc1)Nc2[nH]c[n][n]2 Amb25242514 [1,0,0,0,0,0|1,0,1]=3 87 B14R2.72 Cc1ccc(cc1)Nc2nnns2 Amb1069890 [1,0,0,0,0,0|3,0,0]=4 88 B14R2.72 Cc1ccc(cc1)OC2=NCCS2 Amb25322609 [1,0,0,0,0,0|2,0,0]=3 89 B14R2.72 Cc1ccc(cc1)Oc2nnn[nH]2 Amb2444274 [1,0,0,0,0,0|3,0,0]=4 90 B14R2.72 Cc1ccc(cc1)Sc2nnn[nH]2 Amb1002536 [1,0,0,0,0,0|3,0,0]=4 91 B14R2.72 Cc1ccc(cc1)\N=C/2\NCCO2 Amb24639108 [1,0,0,0,0,0|1,0,1]=3 92 B14R2.72 Cc1ccc(cc1)\N=C\2/CCCN2 Amb19200233 [1,0,0,0,0,0|1,0,1]=3 93 B14R2.72 Clc1ccc(CC=2NCCN2)cc1 Amb18565621 [1,0,0,0,0,0|2,0,0]=3 94 B14R2.72 Clc1ccc(NC=2NCCN2)[n]c1 Amb25192033 [1,0,0,0,0,0|2,0,0]=3 95 B14R2.72 Clc1ccc(cc1)NC2=NCCS2 Amb2369264 [1,0,0,0,0,0|2,0,0]=3 96 B14R2.72 Clc1ccc(cc1)NC=2NCCN2 Amb21953094 [1,0,0,0,0,0|1,0,0]=2 97 B14R2.72 Clc1ccc(cc1)Nc2[nH][n][n][n]2 Amb24490187 [1,0,0,0,0,0|3,0,0]=4 98 B14R2.72 Clc1ccc(cc1)Nc2ncn[nH]2 Amb2408537 [1,0,0,0,0,0|2,0,1]=4 99 B14R2.72 Clc1ccc(cc1)\N=C/2\NCCO2 Amb25131174 [1,0,0,0,0,0|2,0,1]=4 100 B14R2.72 Fc1ccc(CC=2CCCN2)cc1 Amb22304726 [1,0,0,0,0,0|3,0,0]=4 101 B14R2.72 Fc1ccc(CC=2NCCN2)cc1 Amb18065751 [1,0,0,0,0,0|2,0,0]=3 102 B14R2.72 Ic1ccc(cc1)NC=2CCCN2 Amb24696076 [1,0,0,0,0,0|2,0,0]=3 103 B14R2.72 Nc1ccc(CC=2NCCN2)cc1 Amb24089893 [1,0,0,0,0,0|2,0,0]=3 104 B14R2.72 Nc1ccc(CC=2NCCN2)cc1 Amb24102833 [1,0,0,0,0,0|2,0,0]=3 105 B14R2.72 Nc1ccc(cc1)\N=C\2/CCCN2 Amb19202195 [1,0,0,0,0,0|2,0,1]=4 106 B14R2.72 Oc1ccc(cc1)NC=2CCCN2 Amb24552374 [1,0,0,0,0,0|2,0,0]=3 107 B14R2.72 Oc1ccc(cc1)NC=2NCCN2 Amb24424478 [1,0,0,0,0,0|1,0,0]=2 108 B14R2.72 Oc1ccc(cc1)Nc2[nH][n][n][n]2 Amb24418380 [1,0,0,0,0,0|3,0,0]=4 109 B16R2.316 Cc1cc(C)c(cc1)Nc2[nH]c(N)[n][n]2 Amb23005809 [0,1,0,0,0,0|2,0,1]=4 110 B16R2.316 Cc1cc(Cl)c(CC=2CCC(Cl)C2)cc1 Amb25359281 [0,1,0,0,0,0|3,0,0]=4 111 B16R2.316 Cc1cc(Cl)c(cc1)Nc2[n][nH]c(N)[n]2 Amb24119835 [0,1,0,0,0,0|1,0,2]=4 112 B16R2.316 Cc1cc(Cl)c(cc1)Nc2[n][n]c(Br)[s]2 Amb24377859 [0,1,0,0,0,0|2,0,1]=4 113 B16R2.316 Cc1cc(Cl)c(cc1)Nc2[n]c(Br)c[s]2 Amb24746952 [0,1,0,0,0,0|1,0,2]=4 114 B16R2.316 Cc1ccc(c(c1)C)NC2=NC(=O)CS2 Amb1103466 [0,1,0,0,0,0|2,0,1]=4 115 B16R2.316 Cc1ccc(c(c1)C)NC2=NC(CS2)C Amb1104033 [0,1,0,0,0,0|2,0,0]=3 116 B16R2.316 Clc1ccc(c(c1)Cl)NC2=NC(=O)CS2 Amb2471290 [0,1,0,0,0,0|2,0,1]=4 117 B16R2.316 Nc1[nH]c(Nc2ccc(Cl)cc2Cl)[n][n]1 Amb22477609 [0,1,0,0,0,0|2,0,1]=4 118 B16R2.319 Cc1ccc(C(=O)C2=CCCO2)c(Cl)c1 Amb25221209 [0,1,0,0,0,0|3,0,0]=4 119 B16R2.2060 COc1ccc(CC2CCCN2)c(Cl)c1 Amb18571423 [0,1,0,0,0,0|2,0,1]=4 120 B16R2.6175 CC=1NC(Cl)=C(NC=2NCCN2)C(=O)N1 Amb22054981 [0,1,0,0,0,0|2,0,0]=3 121 B16R2.6175 Cc1[n]c(O)c(NC=2NCCN2)c(O)[n]1 Amb22055160 [0,1,0,0,0,0|3,0,0]=4 122 B16R2.6175 Cc1cc(C)c(CC=2NCCN2)c(C)c1 Amb18566595 [0,1,0,0,0,0|2,0,0]=3 123 B16R2.6175 Cc1cc(Cl)c(NC=2NCCN2)c(C)c1 Amb24096483 [0,1,0,0,0,0|0,0,0]=1 124 B16R2.6175 Cc1cc(Cl)cc(C)c1NC=2NCCN2 Amb24072336 [0,1,0,0,0,0|2,0,0]=3 125 B16R2.6175 Cc1cc(Cl)cc(Cl)c1NC=2NCCN2 Amb24096392 [0,1,0,0,0,0|1,0,0]=2 126 B16R2.6175 Clc1cc(I)cc(Cl)c1N=C2NCCN2 Amb22350179 [0,1,0,0,0,0|1,0,2]=4 127 B16R2.6175 Clc1cc(I)cc(Cl)c1NC=2NCCN2 Amb22733389 [0,1,0,0,0,0|1,0,0]=2 128 B16R2.6175 Clc1cc(N)cc(c1N=C2NCCN2)Cl Amb17608482 [0,1,0,0,0,0|1,0,2]=4 129 B16R2.6175 Nc1cc(Cl)c(NC=2NCCN2)c(Cl)c1 Amb20622176 [0,1,0,0,0,0|1,0,0]=2 130 B16R2.6175 Oc1cc(Cl)c(NC2=NCC[NH2+]2)c(Cl)c1 Amb22057387 [0,1,0,0,0,0|1,0,1]=3 131 B16R2.6175 Oc1cc(Cl)c(c(c1)Cl)NC2=NCCN2 Amb17615224 [0,1,0,0,0,0|1,0,0]=2 132 B16R2.6175 Oc1cc(F)c(NC=2NCCN2)c(Br)c1 Amb22055502 [0,1,0,0,0,0|1,1,0]=3 133 B16R2.6917 COc1cc(Cl)ccc1NC=2CCCN2 Amb23561753 [0,1,0,0,0,0|3,0,0]=4 134 B16R2.6917 Cc1ccc(NC=2NCCN2)c(c1)OC Amb24072017 [0,1,0,0,0,0|1,0,0]=2 135 B16R2.12609 Cc1cc(C)c(cc1)\N=C/2\SCCN2C Amb19667635 [0,1,0,0,0,0|2,0,1]=4 136 B14R1.774 Cc1cc(C)c(\C=C\CCCN)cc1 Amb18564647 [0,0,1,0,0,0|3,0,0]=4 137 B14R1.6823 CCCC(=N)Nc1ccc(Br)cc1Cl Amb25729307 [0,0,1,0,0,0|2,0,0]=3 138 B14R1.6823 CCCC(=N)Nc1ccc(Br)cc1F Amb25729297 [0,0,1,0,0,0|2,1,0]=4 139 B14R1.6823 CCCC(=N)Nc1ccc(C)[n]c1C Amb25036773 [0,0,1,0,0,0|3,0,0]=4 140 B14R1.6823 CCCC(=N)Nc1ccc(C)cc1C Amb25181230 [0,0,1,0,0,0|2,0,0]=3 141 B14R1.6823 CCCC(=N)Nc1ccc(Cl)cc1Br Amb25216086 [0,0,1,0,0,0|2,1,0]=4 142 B14R1.6823 CCCC(=N)Nc1ccc(Cl)cc1Cl Amb25807673 [0,0,1,0,0,0|2,0,0]=3 143 B14R1.6823 CCCC(=N)Nc1ccc(Cl)cc1I Amb25742110 [0,0,1,0,0,0|2,1,0]=4 144 B14R1.6823 CCCC(=N)Nc1ccc(F)cc1Cl Amb25163930 [0,0,1,0,0,0|2,0,0]=3 145 B14R1.6823 CCCC(=N)Nc1ccc(F)cc1I Amb25776574 [0,0,1,0,0,0|2,1,0]=4 146 B14R1.6823 CCCC(=N)Nc1ccc(I)cc1Br Amb24692383 [0,0,1,0,0,0|2,1,0]=4 147 B14R1.6823 CCCC(=N)Nc1ccc(I)cc1Cl Amb25051539 [0,0,1,0,0,0|2,0,0]=3 148 B14R1.6823 CCCC(=O)Nc1ccc(F)cc1Cl Amb25821609 [0,0,1,0,0,0|3,0,0]=4 149 B14R1.6823 CCCC(=O)Nc1ccc(O)cc1Cl Amb24418223 [0,0,1,0,0,0|3,0,0]=4 150 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)C Amb2551364 [0,0,1,0,0,0|2,1,0]=4 151 B14R1.6823 CCNC(=N)Cc1ccc(Cl)cc1Cl Amb25083005 [0,0,1,0,0,0|2,0,0]=3 152 B14R1.6823 CCNC(=N)Nc1ccc(Br)cc1Br Amb25183123 [0,0,1,0,0,0|1,1,0]=3 153 B14R1.6823 CCNC(=N)Nc1ccc(Br)cc1Cl Amb25126315 [0,0,1,0,0,0|1,0,0]=2 154 B14R1.6823 CCNC(=N)Nc1ccc(Br)cc1F Amb24402713 [0,0,1,0,0,0|1,1,0]=3 155 B14R1.6823 CCNC(=N)Nc1ccc(F)cc1Br Amb25340789 [0,0,1,0,0,0|1,1,0]=3 156 B14R1.6823 CCNC(=N)Nc1ccc(F)cc1Cl Amb24335750 [0,0,1,0,0,0|1,0,0]=2 157 B14R1.6823 CCNC(=N)Nc1ccc(F)cc1F Amb19084598 [0,0,1,0,0,0|1,1,0]=3 158 B14R1.6823 CCNC(=N)Nc1ccc(F)cc1I Amb24554661 [0,0,1,0,0,0|1,1,0]=3 159 B14R1.6823 CCNC(=O)Cc1ccc(C)cc1C Amb23091959 [0,0,1,0,0,0|3,0,0]=4 160 B14R1.6823 CCNC(=O)Nc1ccc(Cl)cc1Br Amb25856776 [0,0,1,0,0,0|2,1,0]=4 161 B14R1.6823 CCNC(=O)Nc1ccc(Cl)cc1Cl Amb17846245 [0,0,1,0,0,0|2,0,0]=3 162 B14R1.6823 CCNC(=O)Nc1ccc(Cl)cc1F Amb25780648 [0,0,1,0,0,0|2,1,0]=4 163 B14R1.6823 CCNC(=O)Nc1ccc(Cl)cc1I Amb25096122 [0,0,1,0,0,0|2,1,0]=4 164 B14R1.6823 CCNC(=O)Nc1ccc(F)cc1I Amb25193455 [0,0,1,0,0,0|2,1,0]=4 165 B14R1.6823 CCNC(=O)Nc1ccc(N)cc1F Amb18956115 [0,0,1,0,0,0|2,1,0]=4 166 B14R1.6823 CCNC(=O)Nc1ccc(O)cc1Cl Amb25701348 [0,0,1,0,0,0|2,0,0]=3 167 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)F Amb183304 [0,0,1,0,0,0|2,1,0]=4 168 B14R1.6823 CCNC(=S)Nc1[n]cc(Br)cc1Cl Amb23244482 [0,0,1,0,0,0|3,0,0]=4 169 B14R1.6823 CCNC(=S)Nc1[n]cc(Cl)cc1Cl Amb23244480 [0,0,1,0,0,0|3,0,0]=4 170 B14R1.6823 CCNC(=S)Nc1ccc(Br)cc1Br Amb23552367 [0,0,1,0,0,0|2,1,0]=4 171 B14R1.6823 CCNC(=S)Nc1ccc(F)cc1Br Amb24386721 [0,0,1,0,0,0|2,1,0]=4 172 B14R1.6823 CCNC(=S)Nc1ccc(F)cc1Cl Amb25306154 [0,0,1,0,0,0|2,0,0]=3 173 B14R1.6823 CCNC(=S)Nc1ccc(cc1Cl)C Amb2258011 [0,0,1,0,0,0|1,0,0]=2 174 B14R1.6823 CCOC(=N)Cc1ccc(Cl)cc1Cl Amb20673161 [0,0,1,0,0,0|3,0,0]=4 175 B14R1.6823 CCOC(=O)Nc1ccc(Br)cc1Cl Amb25108044 [0,0,1,0,0,0|3,0,0]=4 176 B14R1.6823 CCOC(=O)Nc1ccc(cc1Br)C Amb1260559 [0,0,1,0,0,0|2,1,0]=4 177 B14R1.6823 Cc1c[n]c(NC(=O)NCC)c(N)c1 Amb24613584 [0,0,1,0,0,0|3,0,0]=4 178 B14R1.6823 Cc1c[n]c(NC(=S)NCC)c(Br)c1 Amb23244498 [0,0,1,0,0,0|2,1,0]=4 179 B14R1.6823 Cc1c[n]c(NC(=S)NCC)c(Cl)c1 Amb23244497 [0,0,1,0,0,0|2,0,0]=3 180 B14R1.6823 Cc1cc(Br)ccc1NC(=N)CCC Amb25728616 [0,0,1,0,0,0|3,0,0]=4 181 B14R1.6823 Cc1cc(Cl)c(cc1)NC(=N)NC#N Amb21967617 [0,0,1,0,0,0|1,0,1]=3 182 B14R1.6823 Cc1cc(Cl)c(cc1)NC(=O)CCN Amb19514676 [0,0,1,0,0,0|3,0,0]=4 183 B14R1.6823 Cc1cc(Cl)ccc1NC(=N)CCC Amb24507682 [0,0,1,0,0,0|3,0,0]=4 184 B14R1.6823 Cc1cc(Cl)ccc1NC(=N)NCC Amb24507834 [0,0,1,0,0,0|2,0,0]=3 185 B14R1.6823 Cc1cc(F)ccc1NC(=N)CCC Amb25730570 [0,0,1,0,0,0|3,0,0]=4 186 B14R1.6823 Cc1cc(F)ccc1NC(=N)NCC Amb19063452 [0,0,1,0,0,0|2,0,0]=3 187 B14R1.6823 Cc1ccc(CC(=O)NCC)c(N)c1 Amb22913585 [0,0,1,0,0,0|3,0,0]=4 188 B14R1.6823 Cc1ccc(NC(=N)CCC)c(Br)c1 Amb25164800 [0,0,1,0,0,0|1,1,0]=3 189 B14R1.6823 Cc1ccc(NC(=N)CCC)c(Cl)c1 Amb25323171 [0,0,1,0,0,0|1,0,0]=2 190 B14R1.6823 Cc1ccc(NC(=N)NC#N)c(C)c1 Amb21967616 [0,0,1,0,0,0|2,0,1]=4 191 B14R1.6823 Cc1ccc(NC(=N)NCC)c(C)c1 Amb19073550 [0,0,1,0,0,0|1,0,0]=2 192 B14R1.6823 Cc1ccc(NC(=N)NCC)c(Cl)c1 Amb24402002 [0,0,1,0,0,0|0,0,0]=1 193 B14R1.6823 Cc1ccc(NC(=N)NCC)c(F)c1 Amb19063453 [0,0,1,0,0,0|0,1,0]=2 194 B14R1.6823 Cc1ccc(NC(=O)CCBr)c(Cl)c1 Amb24747642 [0,0,1,0,0,0|3,0,0]=4 195 B14R1.6823 Cc1ccc(NC(=O)CNC)c(Cl)c1 Amb24770030 [0,0,1,0,0,0|3,0,0]=4 196 B14R1.6823 Cc1ccc(NC(=O)NCC)c(C)[n]1 Amb25753986 [0,0,1,0,0,0|3,0,0]=4 197 B14R1.6823 Cc1ccc(NC(=O)NCC)c(O)c1 Amb19042494 [0,0,1,0,0,0|2,0,0]=3 198 B14R1.6823 Cc1ccc(NC(=O)OCC)c(Cl)c1 Amb24721872 [0,0,1,0,0,0|2,0,0]=3 199 B14R1.6823 Cc1ccc(NC(=O)OCC)c(F)c1 Amb22475206 [0,0,1,0,0,0|2,1,0]=4 200 B14R1.6823 Cc1ccc(NC(=O)OCC)c(O)c1 Amb19080567 [0,0,1,0,0,0|3,0,0]=4 201 B14R1.6823 Cc1ccc(NC(=S)NCC)c(C)[n]1 Amb25795660 [0,0,1,0,0,0|3,0,0]=4 202 B14R1.6823 Cc1ccc(OC(=O)NCC)c(N)c1 Amb25360303 [0,0,1,0,0,0|3,0,0]=4 203 B14R1.6823 N=C(NC#N)Nc1ccc(Cl)cc1Cl Amb21967618 [0,0,1,0,0,0|2,0,1]=4 204 B14R1.6932 CN\C(\Nc1ccc(Br)cc1Br)=N\N Amb25666004 [0,0,1,0,0,0|2,1,0]=4 205 B14R1.6932 CN\C(\Nc1ccc(Br)cc1Cl)=N\N Amb24681990 [0,0,1,0,0,0|2,0,0]=3 206 B14R1.6932 CN\C(\Nc1ccc(Cl)cc1Cl)=N\C Amb24641600 [0,0,1,0,0,0|1,0,0]=2 207 B14R1.6932 CN\C(\Nc1ccc(Cl)cc1F)=N\N Amb24658226 [0,0,1,0,0,0|2,1,0]=4 208 B14R1.6932 CN\C(\Nc1ccc(F)cc1Cl)=N\N Amb25748364 [0,0,1,0,0,0|2,0,0]=3 209 B14R1.6932 CN\C(\Nc1ccc(F)cc1F)=N\N Amb24411904 [0,0,1,0,0,0|2,1,0]=4 210 B14R1.6932 CN\C(\Nc1ccc(F)cc1I)=N\N Amb25748408 [0,0,1,0,0,0|2,1,0]=4 211 B14R1.6932 CN\C(\Nc1ccc(I)cc1Br)=N\C Amb24617511 [0,0,1,0,0,0|1,1,0]=3 212 B14R1.6932 CN\C(\Nc1ccc(I)cc1Cl)=N\N Amb24732582 [0,0,1,0,0,0|2,0,0]=3 213 B14R1.6932 Cc1cc(Br)ccc1N\C(\NC)=N/C Amb24609844 [0,0,1,0,0,0|2,0,0]=3 214 B14R1.6932 Cc1cc(Cl)ccc1N\C(\NC)=N/N Amb24577525 [0,0,1,0,0,0|3,0,0]=4 215 B14R1.6932 Cc1cc(F)ccc1N\C(\NC)=N/N Amb24348394 [0,0,1,0,0,0|3,0,0]=4 216 B14R1.6932 Cc1ccc(N\C(\NC)=N/N)c(Br)c1 Amb24401998 [0,0,1,0,0,0|1,1,0]=3 217 B14R1.6932 Cc1ccc(N\C(\NC)=N/N)c(F)c1 Amb25748532 [0,0,1,0,0,0|1,1,0]=3 218 B14R2.739 Cc1cc(Br)c(cc1)-c2[nH][n][n][n]2 Amb21959360 [0,0,0,0,1,0|2,1,0]=4 219 B14R2.739 Cc1cc(Br)c(cc1)-c2[nH]cc[n]2 Amb24469237 [0,0,0,0,1,0|0,1,2]=4 220 B14R2.739 Cc1cc(Br)ccc1C=2CCCN2 Amb24680107 [0,0,0,0,1,0|3,0,0]=4 221 B14R2.739 Cc1cc(C)c(cc1)-c2[nH][n][n][n]2 Amb18065515 [0,0,0,0,1,0|3,0,0]=4 222 B14R2.739 Cc1cc(Cl)c(c[n]1)[C@H]2CCCN2 Amb25039581 [0,0,0,0,1,0|2,0,1]=4 223 B14R2.739 Cc1cc(Cl)ccc1C=2NCCN2 Amb25785092 [0,0,0,0,1,0|2,0,0]=3 224 B14R2.739 Cc1cc(F)c(cc1)-c2[nH][n][n][n]2 Amb18184267 [0,0,0,0,1,0|2,1,0]=4 225 B14R2.739 Cc1cc(F)c(cc1)-c2[nH]cc[n]2 Amb25791196 [0,0,0,0,1,0|0,1,2]=4 226 B14R2.739 Cc1cc(F)ccc1C=2NCCN2 Amb25853077 [0,0,0,0,1,0|2,0,0]=3 227 B14R2.739 Cc1cc(N)c(cc1)-c2[nH][n][n][n]2 Amb24696574 [0,0,0,0,1,0|3,0,0]=4 228 B14R2.739 Cc1cc(O)c(cc1)C2=NCCO2 Amb24633544 [0,0,0,0,1,0|2,0,0]=3 229 B14R2.739 Cc1cc(O)ccc1C2=NCCO2 Amb18127879 [0,0,0,0,1,0|3,0,0]=4 230 B14R2.739 Cc1ccc(C2CCCN2)c(Br)c1 Amb25677000 [0,0,0,0,1,0|1,1,1]=4 231 B14R2.739 Cc1ccc(C2CCCN2)c(Cl)c1 Amb25180391 [0,0,0,0,1,0|1,0,1]=3 232 B14R2.739 Cc1ccc(C2CCCN2)c(F)c1 Amb25160781 [0,0,0,0,1,0|1,1,1]=4 233 B14R2.739 Cc1ccc([C@@H]2CCCN2)c(Cl)[n]1 Amb24761393 [0,0,0,0,1,0|2,0,1]=4 234 B14R2.739 Cc1ccc([C@@H]2CCCN2)c(N)c1 Amb25258178 [0,0,0,0,1,0|2,0,1]=4 235 B14R2.739 Cc1ccc([C@H]2CCCN2)c(F)c1 Amb25113906 [0,0,0,0,1,0|1,1,1]=4 236 B14R2.739 Cc1ccc([C@H]2CCCN2)c(O)c1 Amb25702191 [0,0,0,0,1,0|2,0,1]=4 237 B14R2.739 Cc1ccc(c(c1)C)C2CCCN2 Amb2235415 [0,0,0,0,1,0|2,0,1]=4 238 B14R2.739 Clc1cc(Br)ccc1-c2[nH]cc[n]2 Amb25076563 [0,0,0,0,1,0|1,0,2]=4 239 B14R2.739 Clc1cc(Cl)c(cc1)-c2[nH]cc[n]2 Amb18335620 [0,0,0,0,1,0|1,0,2]=4 240 B14R2.739 Clc1cc(Cl)c(cc1)C2NCCO2 Amb25192249 [0,0,0,0,1,0|2,0,1]=4 241 B14R2.739 Clc1cc(Cl)c(cc1)C=2NCCN2 Amb24358312 [0,0,0,0,1,0|1,0,0]=2 242 B14R2.739 Clc1ccc(c(c1)Cl)C2CCCN2 Amb2235019 [0,0,0,0,1,0|2,0,1]=4 243 B14R2.739 Clc1ccc(c(c1)Cl)C2NCCS2 Amb1323997 [0,0,0,0,1,0|2,0,1]=4 244 B14R2.739 Fc1cc(Br)c(cc1)C=2NCCN2 Amb24416071 [0,0,0,0,1,0|1,1,0]=3 245 B14R2.739 Fc1cc(Cl)c(cc1)-c2[nH][n][n][n]2 Amb19038143 [0,0,0,0,1,0|3,0,0]=4 246 B14R2.739 Fc1cc(Cl)c(cc1)-c2[nH]cc[n]2 Amb18318148 [0,0,0,0,1,0|1,0,2]=4 247 B14R2.739 Fc1cc(Cl)c(cc1)C=2NCCN2 Amb24488855 [0,0,0,0,1,0|1,0,0]=2 248 B14R2.739 Fc1ccc(C2NCCS2)c(Cl)c1 Amb25708806 [0,0,0,0,1,0|2,0,1]=4 249 B14R2.739 Fc1ccc([C@@H]2CCCN2)c(Cl)c1 Amb25242928 [0,0,0,0,1,0|2,0,1]=4 250 B14R2.739 Nc1cc(Br)c(cc1)C=2NCCN2 Amb25031574 [0,0,0,0,1,0|1,1,0]=3 251 B14R2.739 Nc1cc(Br)ccc1C=2NCCN2 Amb25052435 [0,0,0,0,1,0|2,0,0]=3 252 B14R2.739 Nc1cc(Cl)c(cc1)-c2[nH][n][n][n]2 Amb18224920 [0,0,0,0,1,0|3,0,0]=4 253 B14R2.739 Nc1cc(Cl)c(cc1)-c2[nH][n]c[n]2 Amb18224903 [0,0,0,0,1,0|2,0,1]=4 254 B14R2.739 Nc1cc(Cl)c(cc1)-c2[nH]cc[n]2 Amb18945419 [0,0,0,0,1,0|1,0,2]=4 255 B14R2.739 Nc1cc(Cl)c(cc1)C=2NCCN2 Amb25375234 [0,0,0,0,1,0|1,0,0]=2 256 B14R2.739 Nc1ccc(C2CCCN2)c(Cl)c1 Amb18562893 [0,0,0,0,1,0|2,0,1]=4 257 B14R2.739 Oc1cc(Cl)c(cc1)-c2[nH]cc[n]2 Amb25297725 [0,0,0,0,1,0|1,0,2]=4 258 B14R2.739 Oc1cc(Cl)c(cc1)C2=NCCO2 Amb18130443 [0,0,0,0,1,0|2,0,0]=3 259 B14R2.739 Oc1cc(Cl)c(cc1)C=2NCCN2 Amb25115326 [0,0,0,0,1,0|1,0,0]=2 260 B14R2.739 Oc1cc(Cl)ccc1C2=NCCO2 Amb25752661 [0,0,0,0,1,0|3,0,0]=4 261 B14R2.739 Oc1cc(Cl)ccc1C=2NCCN2 Amb24458692 [0,0,0,0,1,0|2,0,0]=3 262 B14R2.739 Oc1cc(O)c(cc1)C2=NCCO2 Amb24534176 [0,0,0,0,1,0|3,0,0]=4 263 B14R2.739 Oc1cc(O)c(cc1)C2=NCCS2 Amb25767089 [0,0,0,0,1,0|3,0,0]=4 264 B14R2.739 Oc1ccc(C2CCCN2)c(Cl)c1 Amb25843730 [0,0,0,0,1,0|2,0,1]=4 265 B14R2.739 Oc1ccc([C@@H]2CCCN2)c(Cl)c1 Amb25799752 [0,0,0,0,1,0|2,0,1]=4 266 B14R2.4458 Cc1[n][n](C)cc1NC=2NCCN2 Amb25755609 [0,0,0,0,1,0|3,0,0]=4 267 B14R2.30090 Cc1cc(C)c(cc1)NC2CCC2 Amb18185935 [0,0,0,0,1,0|2,0,1]=4 268 B14R2.30090 Cc1cc(Cl)c(C=C2CNC2)cc1 Amb25765236 [0,0,0,0,1,0|3,0,0]=4 269 B14R2.30090 Cc1ccc(NC2CCC2)c(Br)c1 Amb24426944 [0,0,0,0,1,0|1,1,1]=4 270 B14R2.30090 Cc1ccc(NC2CCC2)c(Cl)c1 Amb18330655 [0,0,0,0,1,0|1,0,1]=3 271 B14R2.30090 Cc1ccc(NC2CCC2)c(F)c1 Amb18186407 [0,0,0,0,1,0|1,1,1]=4 272 B14R2.30090 Cc1ccc(NC2CCC2)c(N)c1 Amb18285851 [0,0,0,0,1,0|2,0,1]=4 273 B14R2.30090 Cc1ccc(NC2CSC2)c(Cl)c1 Amb25032977 [0,0,0,0,1,0|2,0,1]=4 274 B14R2.30090 Clc1cc(Cl)c(cc1)NC2CCC2 Amb25095549 [0,0,0,0,1,0|2,0,1]=4 275 B14R2.30090 Fc1ccc(NC2CCC2)c(Cl)c1 Amb19090078 [0,0,0,0,1,0|2,0,1]=4 276 B14R2.30090 Nc1ccc(NC2CCC2)c(Cl)c1 Amb18286083 [0,0,0,0,1,0|2,0,1]=4 277 B16R2.312 Cc1ccc(OC2CNCCC2)c(Cl)c1 Amb21957380 [0,0,0,0,0,1|2,0,1]=4 278 B16R2.312 Cc1ccc(c(c1)C)NC2=NCCCS2 Amb1059954 [0,0,0,0,0,1|2,0,0]=3 279 B16R2.312 Clc1cc(Br)ccc1N=C2NCCCO2 Amb22433080 [0,0,0,0,0,1|2,0,1]=4 280 B16R2.3000 Cc1ccc(c(c1)Br)NCC2CCCN2 Amb2236405 [0,0,0,0,0,1|1,1,1]=4 281 B16R2.3000 Cc1ccc(c(c1)Br)NCC2CCCN2 Amb2237196 [0,0,0,0,0,1|1,1,1]=4 282 B16R2.3000 Cc1ccc(c(c1)C)NCC2CCCN2 Amb2236180 [0,0,0,0,0,1|2,0,1]=4 283 B16R2.3000 Cc1ccc(c(c1)C)NCC2CCCN2 Amb2237195 [0,0,0,0,0,1|2,0,1]=4 284 B16R2.3000 Cc1ccc(c(c1)C)OCC2=NCCN2 Amb17075377 [0,0,0,0,0,1|2,0,0]=3 285 B16R2.3000 Clc1ccc(c(c1)C)OCC2=NCCN2 Amb17075401 [0,0,0,0,0,1|3,0,0]=4 286 B16R2.3000 Clc1ccc(c(c1)Cl)CNc2ncn[nH]2 Amb1926877 [0,0,0,0,0,1|2,0,1]=4 287 B16R2.3000 Clc1ccc(c(c1)Cl)NCC2CCCN2 Amb2236407 [0,0,0,0,0,1|2,0,1]=4 288 B16R2.3000 Clc1ccc(c(c1)Cl)NCC2CCCN2 Amb2237198 [0,0,0,0,0,1|2,0,1]=4 289 B16R2.3000 Clc1ccc(c(c1)Cl)OCC2=NCCN2 Amb17075408 [0,0,0,0,0,1|2,0,0]=3 290 B16R2.3000 Fc1cc(Cl)ccc1CSC=2NCCN2 Amb21978713 [0,0,0,0,0,1|2,1,0]=4 291 B16R2.3000 Fc1ccc(c(c1)Cl)OCC2=NCCN2 Amb17075404 [0,0,0,0,0,1|2,0,0]=3 292 B16R2.3000 Fc1ccc(c(c1)F)OCC2=NCCN2 Amb17075399 [0,0,0,0,0,1|2,1,0]=4 293 B13R1.9 Cc1ccc(\C=C\CCCN)cc1 Amb18065586 [1,0,1,0,0,0|2,0,0]=4 294 B13R1.9 Cc1ccc(cc1)NN=NCCC Amb24089188 [1,0,1,0,0,0|2,0,0]=4 295 B13R1.369 CCC\N=C\c1ccc(Cl)cc1Cl Amb25854979 [1,0,1,0,0,0|2,0,0]=4 296 B13R1.369 Cc1ccc(NCCCO)c(Cl)c1 Amb18307873 [1,0,1,0,0,0|1,0,1]=4 297 B13R1.369 NCCCNc1ccc(Br)cc1Cl Amb25772535 [1,0,1,0,0,0|1,0,1]=4 298 B13R1.369 NCCCNc1ccc(Cl)cc1Cl Amb25669383 [1,0,1,0,0,0|1,0,1]=4 299 B13R1.369 NCCCNc1ccc(I)cc1Cl Amb25720760 [1,0,1,0,0,0|1,0,1]=4 300 B13R1.369 NCCCNc1ccc(cc1C)C Amb17057743 [1,0,1,0,0,0|1,0,1]=4 301 B13R1.369 NCC\C=C\c1ccc(Br)cc1Cl Amb25153560 [1,0,1,0,0,0|2,0,0]=4 302 B13R1.369 NCC\C=C\c1ccc(Cl)cc1Cl Amb25189912 [1,0,1,0,0,0|2,0,0]=4 303 B13R1.369 NCC\C=C\c1ccc(cc1C)C Amb17233137 [1,0,1,0,0,0|2,0,0]=4 304 B13R1.555 CCO\N=C\Nc1ccccc1Cl Amb25351762 [1,0,1,0,0,0|2,0,0]=4 305 B13R1.19 CCCC(=N)Nc1ccc(Cl)cc1 Amb25370912 [1,0,1,0,0,0|2,0,0]=4 306 B13R1.19 CCCC(=N)Nc1ccc(I)cc1 Amb25372369 [1,0,1,0,0,0|2,0,0]=4 307 B13R1.19 CCNC(=N)Cc1ccc(Cl)cc1 Amb25120194 [1,0,1,0,0,0|2,0,0]=4 308 B13R1.19 CCNC(=N)Nc1ccc(Cl)cc1 Amb19066808 [1,0,1,0,0,0|1,0,0]=3 309 B13R1.19 CCNC(=N)Nc1ccc(F)cc1 Amb18185014 [1,0,1,0,0,0|1,0,0]=3 310 B13R1.19 CCNC(=N)Nc1ccc(I)cc1 Amb25140628 [1,0,1,0,0,0|1,0,0]=3 311 B13R1.19 CCNC(=O)Nc1ccc(cc1)C Amb1240612 [1,0,1,0,0,0|1,0,0]=3 312 B13R1.19 CCNC(=O)Nc1ccc(cc1)Cl Amb1233667 [1,0,1,0,0,0|2,0,0]=4 313 B13R1.19 CCNC(=S)Nc1ccc(cc1)C Amb2503024 [1,0,1,0,0,0|1,0,0]=3 314 B13R1.19 CCNC(=S)Nc1ccc(cc1)O Amb2459583 [1,0,1,0,0,0|2,0,0]=4 315 B13R1.19 CCOC(=O)Nc1ccc(cc1)C Amb2500803 [1,0,1,0,0,0|2,0,0]=4 316 B13R1.19 CCSC(=N)Nc1ccc(O)cc1 Amb24181835 [1,0,1,0,0,0|2,0,0]=4 317 B13R1.19 CCSC(=S)Nc1ccc(cc1)C Amb2459592 [1,0,1,0,0,0|2,0,0]=4 318 B13R1.19 CC\C=C(\C)/Nc1ccc(C)cc1 Amb25701882 [1,0,1,0,0,0|2,0,0]=4 319 B13R1.19 Cc1ccc(CC(=N)NCC)cc1 Amb25854695 [1,0,1,0,0,0|1,0,0]=3 320 B13R1.19 Cc1ccc(CC(=N)OCC)cc1 Amb20673135 [1,0,1,0,0,0|2,0,0]=4 321 B13R1.19 Cc1ccc(NC(=S)NCC)[n]c1 Amb23244496 [1,0,1,0,0,0|2,0,0]=4 322 B13R1.19 Cc1ccc(c[n]1)NC(=N)CCC Amb25701336 [1,0,1,0,0,0|2,0,0]=4 323 B13R1.19 Cc1ccc(c[n]1)NC(=N)NCC Amb24558063 [1,0,1,0,0,0|1,0,0]=3 324 B13R1.19 Cc1ccc(c[n]1)NC(=O)NCC Amb25853382 [1,0,1,0,0,0|2,0,0]=4 325 B13R1.19 Cc1ccc(c[n]1)NC(=S)NCC Amb25098510 [1,0,1,0,0,0|2,0,0]=4 326 B13R1.19 Cc1ccc(cc1)NC(=N)CCC Amb24689739 [1,0,1,0,0,0|1,0,0]=3 327 B13R1.19 Cc1ccc(cc1)NC(=N)NCC Amb18804672 [1,0,1,0,0,0|0,0,0]=2 328 B13R1.19 Cc1ccc(cc1)NC(=N)SCC Amb25683372 [1,0,1,0,0,0|1,0,0]=3 329 B13R1.19 Cc1ccc(cc1)NC(=O)NCO Amb25054096 [1,0,1,0,0,0|2,0,0]=4 330 B13R1.19 Cc1ccc(cc1)NC(=O)SCC Amb24383156 [1,0,1,0,0,0|2,0,0]=4 331 B13R1.19 Cc1ccc(cc1)NC(=S)CCC Amb24724786 [1,0,1,0,0,0|2,0,0]=4 332 B13R1.19 Cc1ccc(cc1)NC(=S)NOC Amb25752656 [1,0,1,0,0,0|2,0,0]=4 333 B13R1.19 Cc1ccc(cc1)NC(=S)OCC Amb24308972 [1,0,1,0,0,0|2,0,0]=4 334 B13R1.19 Cc1ccc(cc1)OC(=O)NCC Amb22359936 [1,0,1,0,0,0|2,0,0]=4 335 B13R1.19 Cc1ccc(cc1)SC(=O)NCC Amb24585739 [1,0,1,0,0,0|2,0,0]=4 336 B13R1.19 Cc1ccc(cc1)SC(=S)NCC Amb25804596 [1,0,1,0,0,0|2,0,0]=4 337 B13R1.470 CCCC(=N)Nc1ccccc1Br Amb25730577 [1,0,1,0,0,0|1,1,0]=4 338 B13R1.470 CCCC(=N)Nc1ccccc1Cl Amb25093168 [1,0,1,0,0,0|1,0,0]=3 339 B13R1.470 CCCC(=N)Nc1ccccc1I Amb24458938 [1,0,1,0,0,0|1,1,0]=4 340 B13R1.470 CCNC(=N)Cc1ccccc1Br Amb24747330 [1,0,1,0,0,0|1,1,0]=4 341 B13R1.470 CCNC(=N)Cc1ccccc1Cl Amb24430254 [1,0,1,0,0,0|1,0,0]=3 342 B13R1.470 CCNC(=N)Cc1ccccc1F Amb25686401 [1,0,1,0,0,0|1,1,0]=4 343 B13R1.470 CCNC(=N)Nc1ccccc1Cl Amb19066809 [1,0,1,0,0,0|0,0,0]=2 344 B13R1.470 CCNC(=N)Nc1ccccc1F Amb18185015 [1,0,1,0,0,0|0,1,0]=3 345 B13R1.470 CCNC(=O)Cc1ccccc1Cl Amb23014083 [1,0,1,0,0,0|2,0,0]=4 346 B13R1.470 CCNC(=O)Nc1[n]cccc1Cl Amb24371568 [1,0,1,0,0,0|2,0,0]=4 347 B13R1.470 CCNC(=O)Nc1ccc[n]c1Cl Amb24555422 [1,0,1,0,0,0|2,0,0]=4 348 B13R1.470 CCNC(=O)Nc1ccccc1C Amb2236972 [1,0,1,0,0,0|2,0,0]=4 349 B13R1.470 CCNC(=O)Nc1ccccc1F Amb2236700 [1,0,1,0,0,0|1,1,0]=4 350 B13R1.470 CCNC(=O)Oc1ccccc1Cl Amb22486818 [1,0,1,0,0,0|2,0,0]=4 351 B13R1.470 CCNC(=S)Nc1ccccc1I Amb17712785 [1,0,1,0,0,0|1,1,0]=4 352 B13R1.470 CCNC(=S)Nc1ccccc1N Amb2426399 [1,0,1,0,0,0|2,0,0]=4 353 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb19083262 [1,0,1,0,0,0|2,0,0]=4 354 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb20673156 [1,0,1,0,0,0|2,0,0]=4 355 B13R1.470 CCOC(=N)Nc1ccccc1O Amb24557161 [1,0,1,0,0,0|2,0,0]=4 356 B13R1.470 Cc1cc[n]cc1NC(=N)NCC Amb24684114 [1,0,1,0,0,0|2,0,0]=4 357 B13R1.470 Cc1ccccc1NC(=N)NCC Amb18804674 [1,0,1,0,0,0|1,0,0]=3 358 B13R1.470 Cc1ccccc1NC(=N)OCC Amb25375687 [1,0,1,0,0,0|2,0,0]=4 359 B13R1.470 Cc1ccccc1NC(=N)SCC Amb24600073 [1,0,1,0,0,0|2,0,0]=4 360 B13R1.470 N=C(Nc1ccccc1Cl)NC#N Amb21967607 [1,0,1,0,0,0|1,0,1]=4 361 B13R1.2679 CCC(=N)Nc1ccc(Cl)cc1F Amb25833805 [1,0,1,0,0,0|1,1,0]=4 362 B13R1.2679 CCC(=N)Nc1ccc(Cl)cc1I Amb25755169 [1,0,1,0,0,0|1,1,0]=4 363 B13R1.2679 CCC(=N)Nc1ccc(F)cc1Br Amb25833801 [1,0,1,0,0,0|1,1,0]=4 364 B13R1.2679 CCC(=N)Nc1ccc(F)cc1Cl Amb25323160 [1,0,1,0,0,0|1,0,0]=3 365 B13R1.2679 CCC(=N)Nc1ccc(F)cc1I Amb24627677 [1,0,1,0,0,0|1,1,0]=4 366 B13R1.2679 CCC(=O)Nc1ccc(Br)cc1Cl Amb25214498 [1,0,1,0,0,0|2,0,0]=4 367 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C Amb1254030 [1,0,1,0,0,0|2,0,0]=4 368 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F Amb197181 [1,0,1,0,0,0|2,0,0]=4 369 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)N Amb1120268 [1,0,1,0,0,0|2,0,0]=4 370 B13R1.2679 CNC(=N)Nc1ccc(Br)cc1Cl Amb24684775 [1,0,1,0,0,0|1,0,0]=3 371 B13R1.2679 CNC(=N)Nc1ccc(C)cc1C Amb18184211 [1,0,1,0,0,0|1,0,0]=3 372 B13R1.2679 CNC(=N)Nc1ccc(Cl)cc1F Amb24436052 [1,0,1,0,0,0|1,1,0]=4 373 B13R1.2679 CNC(=N)Nc1ccc(F)cc1Br Amb25219797 [1,0,1,0,0,0|1,1,0]=4 374 B13R1.2679 CNC(=N)Nc1ccc(F)cc1F Amb18326631 [1,0,1,0,0,0|1,1,0]=4 375 B13R1.2679 CNC(=N)Nc1ccc(F)cc1I Amb25728671 [1,0,1,0,0,0|1,1,0]=4 376 B13R1.2679 CNC(=O)Nc1ccc(I)cc1Cl Amb25038893 [1,0,1,0,0,0|2,0,0]=4 377 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)C Amb11316749 [1,0,1,0,0,0|1,1,0]=4 378 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)Br Amb11316921 [1,0,1,0,0,0|2,0,0]=4 379 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)F Amb2444107 [1,0,1,0,0,0|2,0,0]=4 380 B13R1.2679 CNC(=S)Nc1ccc(F)cc1Cl Amb25761342 [1,0,1,0,0,0|2,0,0]=4 381 B13R1.2679 CNC(=S)Nc1ccc(I)cc1Cl Amb25157640 [1,0,1,0,0,0|2,0,0]=4 382 B13R1.2679 CNC(=S)Nc1ccc(cc1C)C Amb1815198 [1,0,1,0,0,0|2,0,0]=4 383 B13R1.2679 CNC(=S)Nc1ccc(cc1Cl)Cl Amb1808329 [1,0,1,0,0,0|2,0,0]=4 384 B13R1.2679 Cc1c[n]c(NC(=S)NC)c(Cl)c1 Amb23244005 [1,0,1,0,0,0|2,0,0]=4 385 B13R1.2679 Cc1cc(Br)ccc1NC(=N)CC Amb25833800 [1,0,1,0,0,0|2,0,0]=4 386 B13R1.2679 Cc1cc(C)c(cc1)N\C(\N)=N\N Amb25261650 [1,0,1,0,0,0|2,0,0]=4 387 B13R1.2679 Cc1cc(Cl)ccc1NC(=N)CC Amb25855330 [1,0,1,0,0,0|2,0,0]=4 388 B13R1.2679 Cc1cc(Cl)ccc1NC(=N)NC Amb25689106 [1,0,1,0,0,0|2,0,0]=4 389 B13R1.2679 Cc1cc(F)ccc1NC(=N)CC Amb25667858 [1,0,1,0,0,0|2,0,0]=4 390 B13R1.2679 Cc1cc(F)ccc1NC(=N)NC Amb18185016 [1,0,1,0,0,0|2,0,0]=4 391 B13R1.2679 Cc1ccc(CC(=O)CC)c(Cl)c1 Amb25071233 [1,0,1,0,0,0|2,0,0]=4 392 B13R1.2679 Cc1ccc(CC(=O)NC)c(Cl)c1 Amb24403506 [1,0,1,0,0,0|2,0,0]=4 393 B13R1.2679 Cc1ccc(NC(=N)NC)c(Cl)c1 Amb18325457 [1,0,1,0,0,0|0,0,0]=2 394 B13R1.2679 Cc1ccc(NC(=N)NC)c(F)c1 Amb18185017 [1,0,1,0,0,0|0,1,0]=3 395 B13R1.2679 Cc1ccc(NC(=N)SC)c(C)c1 Amb22445566 [1,0,1,0,0,0|2,0,0]=4 396 B13R1.2679 Cc1ccc(NC(=N)SC)c(C)c1 Amb24724694 [1,0,1,0,0,0|2,0,0]=4 397 B13R1.2679 Cc1ccc(NC(=O)CC)c(Cl)[n]1 Amb24404388 [1,0,1,0,0,0|2,0,0]=4 398 B13R1.2679 Cc1ccc(NC(=O)CC)c(Cl)c1 Amb25674659 [1,0,1,0,0,0|1,0,0]=3 399 B13R1.2679 Cc1ccc(NC(=O)CC)c(F)c1 Amb25850568 [1,0,1,0,0,0|1,1,0]=4 400 B13R1.2679 Cc1ccc(NC(=O)NC)c(Cl)[n]1 Amb24722343 [1,0,1,0,0,0|2,0,0]=4 401 B13R1.2679 Cc1ccc(NC(=O)NC)c(Cl)c1 Amb25130982 [1,0,1,0,0,0|1,0,0]=3 402 B13R1.2679 Cc1ccc(NC(=O)NC)c(O)c1 Amb24474038 [1,0,1,0,0,0|2,0,0]=4 403 B13R1.2679 Cc1ccc(NC(=O)OC)c(Cl)c1 Amb24372555 [1,0,1,0,0,0|2,0,0]=4 404 B13R1.2679 Cc1ccc(NC(=S)NC)c(O)c1 Amb25102526 [1,0,1,0,0,0|2,0,0]=4 405 B13R1.2679 Cc1ccc(NC(N)=NO)c(C)c1 Amb18809202 [1,0,1,0,0,0|2,0,0]=4 406 B13R1.2679 Cc1ccc(NC(N)=NO)c(Cl)c1 Amb19090072 [1,0,1,0,0,0|1,0,0]=3 407 B13R1.2679 Cc1ccc(NC(N)=NO)c(F)c1 Amb19074274 [1,0,1,0,0,0|1,1,0]=4 408 B13R1.2679 Cc1ccc(NS(=O)CC)c(Cl)c1 Amb24589155 [1,0,1,0,0,0|2,0,0]=4 409 B13R1.2679 Cc1ccc(N\C(\N)=N\N)c(Cl)c1 Amb25741207 [1,0,1,0,0,0|1,0,0]=3 410 B13R1.2679 Cc1ccc(OC(=O)NC)c(Cl)c1 Amb25190430 [1,0,1,0,0,0|2,0,0]=4 411 B13R1.2679 ClCC(=O)Nc1ccc(cc1Cl)C Amb1995238 [1,0,1,0,0,0|2,0,0]=4 412 B13R1.2679 NCC(=O)Nc1ccc(cc1Cl)C Amb13951547 [1,0,1,0,0,0|2,0,0]=4 413 B13R1.2679 N\C(\Nc1ccc(Cl)cc1Cl)=N\N Amb25256534 [1,0,1,0,0,0|2,0,0]=4 414 B13R1.2679 N\C(\Nc1ccc(Cl)cc1Cl)=N\O Amb24661542 [1,0,1,0,0,0|2,0,0]=4 415 B13R1.2679 N\C(\Nc1ccc(F)cc1Cl)=N\O Amb25262331 [1,0,1,0,0,0|2,0,0]=4 416 B13R1.2679 OCC(=O)Nc1ccc(cc1Cl)C Amb1111374 [1,0,1,0,0,0|2,0,0]=4 417 B13R1.145 CN=C(Nc1ccc(Cl)cc1)SC Amb22453827 [1,0,1,0,0,0|2,0,0]=4 418 B13R1.145 CN\C(\Nc1ccc(Cl)cc1)=N\C Amb24573078 [1,0,1,0,0,0|1,0,0]=3 419 B13R1.145 CN\C(\Nc1ccc(Cl)cc1)=N\N Amb25714995 [1,0,1,0,0,0|2,0,0]=4 420 B13R1.145 CN\C(\Nc1ccc(I)cc1)=N\N Amb25155714 [1,0,1,0,0,0|2,0,0]=4 421 B13R1.145 Cc1ccc(C\C(\NC)=N/C)cc1 Amb24728214 [1,0,1,0,0,0|1,0,0]=3 422 B13R1.145 Cc1ccc(C\C(\NC)=N\N)cc1 Amb18790851 [1,0,1,0,0,0|2,0,0]=4 423 B13R1.145 Cc1ccc(c[n]1)N\C(\NC)=N/N Amb25155752 [1,0,1,0,0,0|2,0,0]=4 424 B13R1.145 Cc1ccc(cc1)N=C(NC)SC Amb22472382 [1,0,1,0,0,0|1,0,1]=4 425 B13R1.145 Cc1ccc(cc1)N\C(\NC)=N/C Amb24444281 [1,0,1,0,0,0|0,0,0]=2 426 B13R1.145 Cc1ccc(cc1)\N=C(\NC)/SC Amb24557408 [1,0,1,0,0,0|1,0,1]=4 427 B13R1.335 CN\C(\Cc1ccccc1Cl)=N/N Amb18318337 [1,0,1,0,0,0|2,0,0]=4 428 B13R1.335 CN\C(\Nc1ccccc1Br)=N\N Amb25140571 [1,0,1,0,0,0|1,1,0]=4 429 B13R1.335 CN\C(\Nc1ccccc1Cl)=N\C Amb24539940 [1,0,1,0,0,0|0,0,0]=2 430 B13R1.335 CN\C(\Nc1ccccc1Cl)=N\N Amb25225385 [1,0,1,0,0,0|1,0,0]=3 431 B13R1.335 CN\C(\Nc1ccccc1F)=N\C Amb24549812 [1,0,1,0,0,0|0,1,0]=3 432 B13R2.64 C(C1=CCCN1)c2ccccc2 Amb17938862 [2,0,0,0,0,0|2,0,0]=4 433 B13R2.64 C(C1=NCCN1)c2cccnc2 Amb17842975 [2,0,0,0,0,0|2,0,0]=4 434 B13R2.64 C(C=1NCCN1)c2cc[n]cc2 Amb25312067 [2,0,0,0,0,0|2,0,0]=4 435 B13R2.64 C(C=1NCCN1)c2ccc[n]c2 Amb22527135 [2,0,0,0,0,0|2,0,0]=4 436 B13R2.64 C(c1ccccc1)C=2CCCN2 Amb24053775 [2,0,0,0,0,0|2,0,0]=4 437 B13R2.64 C1CCC=C1Nc2ccccc2 Amb25805974 [2,0,0,0,0,0|2,0,0]=4 438 B13R2.64 C1CNC(=Nc2ccccc2)N1 Amb1803476 [2,0,0,0,0,0|0,0,2]=4 439 B13R2.64 C1CNC(Nc2c[n]c[n]c2)=N1 Amb24484220 [2,0,0,0,0,0|2,0,0]=4 440 B13R2.64 C1CNC(Nc2ccc[n]c2)=N1 Amb25059502 [2,0,0,0,0,0|1,0,0]=3 441 B13R2.64 C1COC(Nc2ccc[n]c2)=N1 Amb24442387 [2,0,0,0,0,0|2,0,0]=4 442 B13R2.64 C1CSC(Nc2cccc[n]2)=N1 Amb24664860 [2,0,0,0,0,0|2,0,0]=4 443 B13R2.64 c1ccc(cc1)CC2=NCCO2 Amb2429421 [2,0,0,0,0,0|2,0,0]=4 444 B13R2.64 c1ccc(cc1)NC2=NCCC2 Amb1286041 [2,0,0,0,0,0|1,0,0]=3 445 B13R2.64 c1ccc(cc1)Nc2ncn[nH]2 Amb2433367 [2,0,0,0,0,0|1,0,1]=4 446 B13R2.64 c1ccc(cn1)NC2=NCCS2 Amb15710014 [2,0,0,0,0,0|2,0,0]=4 447 B13R2.64 c1ccccc1Nc2[nH]cc[n]2 Amb22749785 [2,0,0,0,0,0|0,0,2]=4 448 B15R1.5927 C=CCNC(=S)Nc1ccc(cc1Cl)C Amb2242082 [0,1,1,0,0,0|1,0,1]=4 449 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)I Amb11350383 [0,1,1,0,0,0|2,0,0]=4 450 B15R1.5927 CCCNC(=S)Nc1ccc(cc1Cl)Cl Amb1845279 [0,1,1,0,0,0|2,0,0]=4 451 B15R1.5927 Cc1c[n]c(NC(=S)NCCC)c(Cl)c1 Amb23244556 [0,1,1,0,0,0|2,0,0]=4 452 B15R1.5927 Cc1cc(Cl)c(cc1)NC(=O)CCCCl Amb25366958 [0,1,1,0,0,0|2,0,0]=4 453 B15R1.5927 Cc1cc(Cl)c(cc1)NC(=S)NCCO Amb22451076 [0,1,1,0,0,0|1,0,0]=3 454 B15R1.5927 Cc1ccc(NC(=O)CCCN)c(C)c1 Amb25388591 [0,1,1,0,0,0|2,0,0]=4 455 B15R1.5927 Cc1ccc(NC(=O)CCCN)c(Cl)c1 Amb25388892 [0,1,1,0,0,0|1,0,0]=3 456 B15R1.5927 Cc1ccc(NC(=O)CCCN)c(F)c1 Amb25388850 [0,1,1,0,0,0|1,1,0]=4 457 B15R1.5927 NCCNC(=O)Nc1ccc(cc1Br)C Amb17276086 [0,1,1,0,0,0|0,1,1]=4 458 B15R1.5927 NCCNC(=O)Nc1ccc(cc1C)C Amb17239372 [0,1,1,0,0,0|1,0,1]=4 459 B15R1.5927 NCCNC(=O)Nc1ccc(cc1Cl)Cl Amb17259697 [0,1,1,0,0,0|1,0,1]=4 460 B15R1.5927 NCCNC(=S)Nc1ccc(Cl)cc1Cl Amb22460540 [0,1,1,0,0,0|1,0,1]=4 461 B15R1.5927 OCCNC(=O)Nc1ccc(cc1C)C Amb11385749 [0,1,1,0,0,0|2,0,0]=4 462 B15R1.5927 OCCNC(=S)Nc1ccc(cc1Cl)Cl Amb1845620 [0,1,1,0,0,0|2,0,0]=4 463 B15R1.8426 CC(NC(=O)Nc1ccc(cc1Cl)I)C Amb11350393 [0,1,1,0,0,0|2,0,0]=4 464 B15R1.8426 Cc1c[n]c(NC(=S)NC(C)C)c(Cl)c1 Amb23244617 [0,1,1,0,0,0|2,0,0]=4 465 B15R1.8426 Cc1ccc(NC(=O)CC(C)C)c(Cl)c1 Amb20688874 [0,1,1,0,0,0|2,0,0]=4 466 B15R1.9726 CNc1ccc(NC(=O)CCC)c(Cl)c1 Amb23551483 [0,1,1,0,0,0|2,0,0]=4 467 B15R1.14339 CN(CC)C(=O)Nc1ccc(I)cc1Cl Amb25171615 [0,1,1,0,0,0|2,0,0]=4 468 B15R1.14339 Cc1ccc(NC(=O)C(Br)CC)c(Cl)c1 Amb25845724 [0,1,1,0,0,0|2,0,0]=4 469 B15R1.14339 Cc1ccc(NC(=O)C(C)CC)c(Cl)c1 Amb21425719 [0,1,1,0,0,0|2,0,0]=4 470 B15R1.14339 Cc1ccc(NC(=O)N(C)CC)c(Br)c1 Amb25334384 [0,1,1,0,0,0|1,1,0]=4 471 B15R1.37637 CCNC(=O)Nc1c(Cl)cc(F)cc1Br Amb24341100 [0,1,1,0,0,0|2,0,0]=4 472 B15R1.37637 CCOC(=O)Nc1c(C)cc(cc1Cl)C Amb2557907 [0,1,1,0,0,0|2,0,0]=4 473 B15R1.37637 Cc1cc(Br)c(NC(=O)NCC)c(C)c1 Amb25030474 [0,1,1,0,0,0|1,1,0]=4 474 B15R1.30776 Cc1cc(C)c(NC(=NC)SC)c(C)c1 Amb22467878 [0,1,1,0,0,0|2,0,0]=4 475 B15R2.123 COc1ccccc1CC=2NCCN2 Amb18564750 [1,1,0,0,0,0|2,0,0]=4 476 B15R2.123 COc1ccccc1NC2=NCCS2 Amb1103973 [1,1,0,0,0,0|2,0,0]=4 477 B15R2.123 COc1ccccc1NC=2NCCN2 Amb25690998 [1,1,0,0,0,0|1,0,0]=3 478 B15R2.123 CSc1ccccc1NC=2NCCN2 Amb25277169 [1,1,0,0,0,0|1,0,0]=3 479 B15R2.305 CC1CN=C(S1)Nc2ccccc2C Amb1543312 [1,1,0,0,0,0|2,0,0]=4 480 B15R2.305 CC1CNC(Nc2ccccc2Br)=N1 Amb24409943 [1,1,0,0,0,0|0,1,0]=3 481 B15R2.305 CC1CNC(Nc2ccccc2I)=N1 Amb24535903 [1,1,0,0,0,0|0,1,0]=3 482 B15R2.305 Cc1ccccc1NC2=NCC(C)O2 Amb25081060 [1,1,0,0,0,0|2,0,0]=4 483 B15R2.305 Cc1ccccc1NC=2NCC(C)N2 Amb24658249 [1,1,0,0,0,0|1,0,0]=3 484 B15R2.305 Nc1[nH]c(Nc2ccccc2Cl)[n][n]1 Amb23005813 [1,1,0,0,0,0|1,0,1]=4 485 B15R2.358 CN(C=1NCCN1)c2ccccc2F Amb24448220 [1,1,0,0,0,0|0,1,0]=3 486 B15R2.358 CN(c1[nH]cc[n]1)c2ccccc2Cl Amb25827118 [1,1,0,0,0,0|0,0,2]=4 487 B15R2.358 Cc1ccccc1N(C)C=2NCCN2 Amb25823253 [1,1,0,0,0,0|1,0,0]=3 488 B15R2.358 OC(C=1NCCN1)c2ccccc2Cl Amb25835660 [1,1,0,0,0,0|1,0,0]=3 489 B15R2.359 ON/1CCN\C1=N/c2ccccc2Cl Amb25377873 [1,1,0,0,0,0|0,0,2]=4 490 B15R2.1109 Cc1c(Br)cccc1NC2=NCCS2 Amb24383840 [1,1,0,0,0,0|2,0,0]=4 491 B15R2.1109 Cc1c(Br)cccc1NC=2NCCN2 Amb25691358 [1,1,0,0,0,0|1,0,0]=3 492 B15R2.1109 Cc1c(Cl)cccc1NC2=NCCO2 Amb25276318 [1,1,0,0,0,0|2,0,0]=4 493 B15R2.1109 Cc1c(Cl)cccc1NC=2CCCN2 Amb25110789 [1,1,0,0,0,0|2,0,0]=4 494 B15R2.1109 Cc1c(F)cccc1NC=2CCCN2 Amb25088709 [1,1,0,0,0,0|2,0,0]=4 495 B15R2.1109 Cc1c(I)cccc1NC2=NCCS2 Amb24425979 [1,1,0,0,0,0|2,0,0]=4 496 B15R2.1109 Cc1c(N)cccc1NC=2CCCN2 Amb24670545 [1,1,0,0,0,0|2,0,0]=4 497 B15R2.1109 Cc1cccc(NC2=NCCS2)c1F Amb25337950 [1,1,0,0,0,0|1,1,0]=4 498 B15R2.1109 Cc1cccc(NC=2CCCN2)c1Cl Amb24753670 [1,1,0,0,0,0|1,0,0]=3 499 B15R2.1109 Cc1cccc(NC=2CCCN2)c1F Amb25069193 [1,1,0,0,0,0|1,1,0]=4 500 B15R2.1109 Cc1cccc(NC=2NCCN2)c1C Amb24089501 [1,1,0,0,0,0|1,0,0]=3 501 B15R2.1109 Cc1cccc(NC=2NCCN2)c1Cl Amb25668120 [1,1,0,0,0,0|0,0,0]=2 502 B15R2.1109 Clc1cccc(NC2=NCCS2)c1Br Amb24419230 [1,1,0,0,0,0|1,1,0]=4 503 B15R2.1109 Clc1cccc(NC=2CCCN2)c1Cl Amb25193326 [1,1,0,0,0,0|1,0,0]=3 504 B15R2.1109 Clc1cccc(c1C)NC2=NCCS2 Amb2262896 [1,1,0,0,0,0|2,0,0]=4 505 B15R2.1109 Fc1c(Cl)cccc1CC=2NCCN2 Amb24437250 [1,1,0,0,0,0|1,1,0]=4 506 B15R2.1109 Fc1c(Cl)cccc1NC=2NCCN2 Amb25768690 [1,1,0,0,0,0|0,1,0]=3 507 B15R2.1109 Fc1cccc(NC2=NCCS2)c1I Amb24423659 [1,1,0,0,0,0|1,1,0]=4 508 B15R2.1109 Fc1cccc(NC=2NCCN2)c1F Amb24631319 [1,1,0,0,0,0|0,1,0]=3 509 B15R2.1109 Fc1cccc(NC=2NCCN2)c1I Amb24535566 [1,1,0,0,0,0|0,1,0]=3 510 B15R2.7567 Brc1cc(NC2=NCCS2)c(Br)cc1 Amb25769266 [1,1,0,0,0,0|1,1,0]=4 511 B15R2.7567 Brc1cc(NC=2CCCN2)c(Br)cc1 Amb24693473 [1,1,0,0,0,0|1,1,0]=4 512 B15R2.7567 Brc1ccc(I)cc1NC2=NCCS2 Amb24390038 [1,1,0,0,0,0|1,1,0]=4 513 B15R2.7567 Brc1ccc(I)cc1NC=2CCCN2 Amb25114565 [1,1,0,0,0,0|1,1,0]=4 514 B15R2.7567 Cc1cc(CC=2NCCN2)c(C)cc1 Amb18564542 [1,1,0,0,0,0|2,0,0]=4 515 B15R2.7567 Cc1cc(NC=2CCCN2)c(Cl)cc1 Amb25323213 [1,1,0,0,0,0|1,0,0]=3 516 B15R2.7567 Cc1cc(NC=2NCCN2)c(F)cc1 Amb25038153 [1,1,0,0,0,0|0,1,0]=3 517 B15R2.7567 Cc1ccc(Br)cc1NC=2CCCN2 Amb24498503 [1,1,0,0,0,0|2,0,0]=4 518 B15R2.7567 Cc1ccc(Cl)cc1NC=2NCCN2 Amb24669132 [1,1,0,0,0,0|1,0,0]=3 519 B15R2.7567 Cc1ccc(F)cc1NC=2CCCN2 Amb25708188 [1,1,0,0,0,0|2,0,0]=4 520 B15R2.7567 Cc1ccc(F)cc1NC=2NCCN2 Amb24725470 [1,1,0,0,0,0|1,0,0]=3 521 B15R2.7567 Cc1ccc(c(c1)NC2=NCCS2)C Amb1059601 [1,1,0,0,0,0|2,0,0]=4 522 B15R2.7567 Clc1cc(NC2=NCCS2)c(Br)cc1 Amb24407032 [1,1,0,0,0,0|1,1,0]=4 523 B15R2.7567 Clc1cc(NC=2CCCN2)c(Cl)cc1 Amb24425975 [1,1,0,0,0,0|1,0,0]=3 524 B15R2.7567 Clc1cc(NC=2NCCN2)c(Br)cc1 Amb24348650 [1,1,0,0,0,0|0,1,0]=3 525 B15R2.7567 Clc1ccc(I)cc1NC=2CCCN2 Amb24717554 [1,1,0,0,0,0|1,0,0]=3 526 B15R2.7567 Fc1cc(NC2=NCCS2)c(Cl)cc1 Amb25775756 [1,1,0,0,0,0|1,0,0]=3 527 B15R2.7567 Fc1cc(NC=2CCCN2)c(F)cc1 Amb25108958 [1,1,0,0,0,0|1,1,0]=4 528 B15R2.7567 Fc1cc(NC=2NCCN2)c(Cl)cc1 Amb25282454 [1,1,0,0,0,0|0,0,0]=2 529 B15R2.7567 Fc1ccc(Br)cc1NC=2NCCN2 Amb25759249 [1,1,0,0,0,0|0,1,0]=3 530 B15R2.7567 Fc1ccc(Cl)cc1NC=2CCCN2 Amb24626505 [1,1,0,0,0,0|1,1,0]=4 531 B15R2.7567 Nc1cc(NC=2NCCN2)c(Cl)cc1 Amb24506898 [1,1,0,0,0,0|0,0,0]=2 532 B15R2.15371 Brc1cccc(Br)c1NC=2CCCN2 Amb25136674 [1,1,0,0,0,0|1,1,0]=4 533 B15R2.15371 Brc1cccc(Br)c1NC=2NCCN2 Amb24096416 [1,1,0,0,0,0|0,1,0]=3 534 B15R2.15371 Brc1cccc(Br)c1NC=2NCCN2 Amb24103794 [1,1,0,0,0,0|0,1,0]=3 535 B15R2.15371 Cc1cccc(Br)c1CC=2NCCN2 Amb25033408 [1,1,0,0,0,0|1,1,0]=4 536 B15R2.15371 Cc1cccc(C)c1CC=2NCCN2 Amb25281292 [1,1,0,0,0,0|2,0,0]=4 537 B15R2.15371 Cc1cccc(C)c1NC=2CCCN2 Amb25765497 [1,1,0,0,0,0|2,0,0]=4 538 B15R2.15371 Cc1cccc(C)c1NC=2NCCN2 Amb24103887 [1,1,0,0,0,0|1,0,0]=3 539 B15R2.15371 Cc1cccc(Cl)c1NC2=NCCO2 Amb24530501 [1,1,0,0,0,0|1,0,0]=3 540 B15R2.15371 Cc1cccc(Cl)c1NC=2NCCN2 Amb24089592 [1,1,0,0,0,0|0,0,0]=2 541 B15R2.15371 Cc1cccc(Cl)c1NC=2NCCN2 Amb24096492 [1,1,0,0,0,0|0,0,0]=2 542 B15R2.15371 Cc1cccc(Cl)c1NC=2NCCN2 Amb24103795 [1,1,0,0,0,0|0,0,0]=2 543 B15R2.15371 Cc1cccc(Cl)c1\C=C/2\CCCN2 Amb25804142 [1,1,0,0,0,0|2,0,0]=4 544 B15R2.15371 Cc1cccc(F)c1NC2=NCCS2 Amb25108043 [1,1,0,0,0,0|1,1,0]=4 545 B15R2.15371 Cc1cccc(F)c1NC=2CCCN2 Amb24621374 [1,1,0,0,0,0|1,1,0]=4 546 B15R2.15371 Cc1cccc(F)c1NC=2NCCN2 Amb24506720 [1,1,0,0,0,0|0,1,0]=3 547 B15R2.15371 Clc1cccc(Cl)c1CC=2NCCN2 Amb24064916 [1,1,0,0,0,0|1,0,0]=3 548 B15R2.15371 Clc1cccc(Cl)c1NC=2NCCN2 Amb19959948 [1,1,0,0,0,0|0,0,0]=2 549 B15R2.15371 Clc1cccc(Cl)c1SC=2NCCN2 Amb24718377 [1,1,0,0,0,0|1,0,0]=3 550 B15R2.15371 Clc1cccc(Cl)c1\N=C/2\CCCN2 Amb22077849 [1,1,0,0,0,0|1,0,1]=4 551 B15R2.15371 Clc1cccc(Cl)c1\N=C\2/CCCN2 Amb19754605 [1,1,0,0,0,0|1,0,1]=4 552 B15R2.15371 Clc1cccc(Cl)c1\N=C\2/NCCO2 Amb24382649 [1,1,0,0,0,0|1,0,1]=4 553 B15R2.15371 Clc1cccc(c1NC2=NCCC2)Cl Amb1286239 [1,1,0,0,0,0|1,0,0]=3 554 B15R2.15371 Fc1cccc(Br)c1NC=2CCCN2 Amb25358291 [1,1,0,0,0,0|1,1,0]=4 555 B15R2.15371 Fc1cccc(Br)c1NC=2NCCN2 Amb24325460 [1,1,0,0,0,0|0,1,0]=3 556 B15R2.15371 Fc1cccc(Cl)c1CC=2NCCN2 Amb18569509 [1,1,0,0,0,0|1,0,0]=3 557 B15R2.15371 Fc1cccc(F)c1NC=2CCCN2 Amb25210370 [1,1,0,0,0,0|1,1,0]=4 558 B15R2.15371 Fc1cccc(c1NC2=NCCN2)Br Amb17619983 [1,1,0,0,0,0|0,1,0]=3 559 B15R2.34 CCc1ccc(CC=2NCCN2)cc1 Amb18564541 [1,1,0,0,0,0|1,0,0]=3 560 B15R2.34 CCc1ccc(cc1)\N=C/2\NCCO2 Amb25229954 [1,1,0,0,0,0|1,0,1]=4 561 B15R2.34 COc1ccc(CC2=CCCN2)cc1 Amb25725057 [1,1,0,0,0,0|2,0,0]=4 562 B15R2.34 COc1ccc(CC=2NCCN2)cc1 Amb18564752 [1,1,0,0,0,0|1,0,0]=3 563 B15R2.34 COc1ccc(CC=2NCON2)cc1 Amb24367148 [1,1,0,0,0,0|2,0,0]=4 564 B15R2.34 COc1ccc(cc1)NC2=NCCC2 Amb2503097 [1,1,0,0,0,0|1,0,0]=3 565 B15R2.34 COc1ccc(cc1)NC2=NCCS2 Amb1103998 [1,1,0,0,0,0|1,0,0]=3 566 B15R2.34 COc1ccc(cc1)NC=2CCCN2 Amb24122664 [1,1,0,0,0,0|1,0,0]=3 567 B15R2.34 COc1ccc(cc1)Nc2ncn[nH]2 Amb2411799 [1,1,0,0,0,0|1,0,1]=4 568 B15R2.34 COc1ccc(cc1)SC=2NCCN2 Amb23591583 [1,1,0,0,0,0|1,0,0]=3 569 B15R2.34 COc1ccc(cc1)\N=C/2\NCCO2 Amb25772930 [1,1,0,0,0,0|1,0,1]=4 570 B15R2.34 COc1ccc(cc1)\N=C\2/CCCN2 Amb1152598 [1,1,0,0,0,0|1,0,1]=4 571 B15R2.34 CSc1ccc(cc1)\N=C/2\NCCO2 Amb24759155 [1,1,0,0,0,0|1,0,1]=4 572 B15R2.34 N#Cc1ccc(CC=2NCCN2)cc1 Amb25087903 [1,1,0,0,0,0|1,0,1]=4 573 B15R2.34 N#Cc1ccc(cc1)NC=2NCCN2 Amb24349501 [1,1,0,0,0,0|0,0,1]=3 574 B15R2.91 CC(C=1NCCN1)c2ccc(F)cc2 Amb24742582 [1,1,0,0,0,0|2,0,0]=4 575 B15R2.91 Cc1ccc(cc1)N(C)C=2NCCN2 Amb25823254 [1,1,0,0,0,0|0,0,0]=2 576 B15R2.91 Cc1ccc(cc1)N(C)c2[nH]cc[n]2 Amb25272814 [1,1,0,0,0,0|0,0,2]=4 577 B15R2.91 OC(C=1NCCN1)c2ccc(Cl)cc2 Amb22527114 [1,1,0,0,0,0|2,0,0]=4 578 B15R2.92 Brc1cc(ccc1I)NC2=NCCS2 Amb24507984 [1,1,0,0,0,0|2,0,0]=4 579 B15R2.92 Brc1cc(ccc1I)NC=2NCCN2 Amb24420103 [1,1,0,0,0,0|1,0,0]=3 580 B15R2.92 Brc1ccc(cc1I)NC2=NCCS2 Amb25349868 [1,1,0,0,0,0|2,0,0]=4 581 B15R2.92 Brc1ccc(cc1I)NC=2CCCN2 Amb25038382 [1,1,0,0,0,0|2,0,0]=4 582 B15R2.92 Brc1ccc(cc1I)NC=2NCCN2 Amb25724830 [1,1,0,0,0,0|1,0,0]=3 583 B15R2.92 Cc1cc(ccc1Br)NC=2NCCN2 Amb24631318 [1,1,0,0,0,0|1,0,0]=3 584 B15R2.92 Cc1cc(ccc1C)NC2=NCCO2 Amb25756158 [1,1,0,0,0,0|1,0,0]=3 585 B15R2.92 Cc1cc(ccc1C)NC=2NCCN2 Amb25193543 [1,1,0,0,0,0|0,0,0]=2 586 B15R2.92 Cc1cc(ccc1F)NC=2NCCN2 Amb25086835 [1,1,0,0,0,0|1,0,0]=3 587 B15R2.92 Cc1ccc(cc1Br)NC2=NCCS2 Amb24700979 [1,1,0,0,0,0|1,0,0]=3 588 B15R2.92 Cc1ccc(cc1Br)NC=2CCCN2 Amb25774139 [1,1,0,0,0,0|1,0,0]=3 589 B15R2.92 Cc1ccc(cc1Br)NC=2NCCN2 Amb24736684 [1,1,0,0,0,0|0,0,0]=2 590 B15R2.92 Cc1ccc(cc1Cl)\N=C\2/NCCS2 Amb1153082 [1,1,0,0,0,0|1,0,1]=4 591 B15R2.92 Cc1ccc(cc1F)NC=2CCCN2 Amb24433610 [1,1,0,0,0,0|1,0,0]=3 592 B15R2.92 Cc1ccc(cc1F)NC=2NCCN2 Amb25324919 [1,1,0,0,0,0|0,0,0]=2 593 B15R2.92 Cc1ccc(cc1I)NC2=NCCS2 Amb24357762 [1,1,0,0,0,0|1,0,0]=3 594 B15R2.92 Cc1ccc(cc1I)NC=2NCCN2 Amb24711691 [1,1,0,0,0,0|0,0,0]=2 595 B15R2.92 Clc1cc(CC=2NCCN2)ccc1Cl Amb18070429 [1,1,0,0,0,0|2,0,0]=4 596 B15R2.92 Clc1cc(ccc1Br)NC=2NCCN2 Amb25790240 [1,1,0,0,0,0|1,0,0]=3 597 B15R2.92 Clc1cc(ccc1Cl)NC=2CCCN2 Amb22051543 [1,1,0,0,0,0|2,0,0]=4 598 B15R2.92 Clc1cc(ccc1Cl)NC=2NCCN2 Amb25134432 [1,1,0,0,0,0|1,0,0]=3 599 B15R2.92 Clc1ccc(cc1Br)NC=2NCCN2 Amb25237057 [1,1,0,0,0,0|1,0,0]=3 600 B15R2.92 Clc1ccc(cc1Cl)NC2=NCCS2 Amb1104001 [1,1,0,0,0,0|2,0,0]=4 601 B15R2.92 Fc1cc(ccc1Br)NC=2CCCN2 Amb24498574 [1,1,0,0,0,0|2,0,0]=4 602 B15R2.92 Fc1cc(ccc1Br)NC=2NCCN2 Amb25729467 [1,1,0,0,0,0|1,0,0]=3 603 B15R2.92 Fc1cc(ccc1Cl)NC2=NCCS2 Amb24431553 [1,1,0,0,0,0|2,0,0]=4 604 B15R2.92 Fc1cc(ccc1Cl)NC=2CCCN2 Amb24365764 [1,1,0,0,0,0|2,0,0]=4 605 B15R2.92 Fc1cc(ccc1F)NC=2CCCN2 Amb24553127 [1,1,0,0,0,0|2,0,0]=4 606 B15R2.92 Fc1ccc(cc1Br)NC2=NCCS2 Amb25818993 [1,1,0,0,0,0|2,0,0]=4 607 B15R2.92 Fc1ccc(cc1Br)NC=2NCCN2 Amb24608224 [1,1,0,0,0,0|1,0,0]=3 608 B15R2.92 Nc1ccc(CC=2NCCN2)cc1Cl Amb25054619 [1,1,0,0,0,0|2,0,0]=4 609 B15R2.92 Oc1cc(CC=2NCCN2)ccc1O Amb24089728 [1,1,0,0,0,0|2,0,0]=4 610 B15R2.98 CC1CN=C(S1)Nc2ccc(cc2)C Amb1150386 [1,1,0,0,0,0|1,0,0]=3 611 B15R2.98 CC1CN=C(S1)Nc2ccc(cc2)Cl Amb1104017 [1,1,0,0,0,0|2,0,0]=4 612 B15R2.98 CC1CN=C(S1)Nc2ccc(cc2)O Amb1094318 [1,1,0,0,0,0|2,0,0]=4 613 B15R2.98 CC1CNC(Nc2ccc(Cl)cc2)=N1 Amb24591145 [1,1,0,0,0,0|1,0,0]=3 614 B15R2.98 CC1CSC(=N1)Nc2ccc(cc2)Br Amb2502454 [1,1,0,0,0,0|2,0,0]=4 615 B15R2.98 CC1CSC(=N1)Nc2ccc(cc2)Cl Amb1103950 [1,1,0,0,0,0|2,0,0]=4 616 B15R2.98 Cc1ccc(CC=2NC(=O)CN2)cc1 Amb24354813 [1,1,0,0,0,0|1,0,1]=4 617 B15R2.98 Cc1ccc(cc1)NC2=NCC(=O)S2 Amb25119222 [1,1,0,0,0,0|1,0,1]=4 618 B15R2.98 Cc1ccc(cc1)NC2=NCC(C)O2 Amb24398680 [1,1,0,0,0,0|1,0,0]=3 619 B15R2.98 Cc1ccc(cc1)Nc2[nH][n]c(S)[n]2 Amb24741095 [1,1,0,0,0,0|1,0,1]=4 620 B15R2.98 Cc1ccc(cc1)Nc2[nH]c(N)[n][n]2 Amb18650204 [1,1,0,0,0,0|1,0,1]=4 621 B15R2.98 Cc1ccc(cc1)\N=C\2/NCC(C)S2 Amb21996046 [1,1,0,0,0,0|1,0,1]=4 622 B15R2.98 O=C1CSC(=N1)Nc2ccc(cc2)C Amb1103457 [1,1,0,0,0,0|1,0,1]=4 623 B15R2.1510 CN1CCN=C1Nc2ccc(Br)cc2 Amb25219780 [1,1,0,0,0,0|1,0,0]=3 624 B15R2.1510 CN1CCN=C1Nc2ccc(Cl)cc2 Amb24681972 [1,1,0,0,0,0|1,0,0]=3 625 B15R2.1510 CN1CCN=C1Nc2ccc(I)cc2 Amb25121042 [1,1,0,0,0,0|1,0,0]=3 626 B15R2.1510 Cc1ccc(cc1)NC2=NCCN2C Amb25126340 [1,1,0,0,0,0|0,0,0]=2 627 B15R2.1152 Fc1ccc(c(Br)c1F)C=2NCCN2 Amb25170599 [0,1,0,0,1,0|1,1,0]=4 628 B15R2.1153 Cc1cc(Cl)c(cc1)-c2[nH][n]c(C)[n]2 Amb24337586 [0,1,0,0,1,0|1,0,1]=4 629 B15R2.1153 Cc1cc(Cl)c(cc1)-c2[nH]c(N)[n][n]2 Amb24613282 [0,1,0,0,1,0|1,0,1]=4 630 B15R2.2111 COc1cc(Cl)c(cc1)-c2[nH][n][n][n]2 Amb18569200 [0,1,0,0,1,0|2,0,0]=4 631 B15R2.2111 Oc1cc(CCl)ccc1C2=NCCO2 Amb25804051 [0,1,0,0,1,0|2,0,0]=4 632 B15R2.2233 Cc1ccc(c(c1)OC)C=2NCCN2 Amb25170602 [0,1,0,0,1,0|1,0,0]=3 633 B15R2.4201 Cc1cc(F)c(c(Cl)c1)-c2[nH]cc[n]2 Amb24732468 [0,1,0,0,1,0|0,0,2]=4 634 B15R2.15599 Fc1cc(c(Br)cc1F)C=2NCCN2 Amb24702146 [0,1,0,0,1,0|1,1,0]=4 635 B15R2.15650 Cc1ccc(NC2CCC2C)c(Cl)c1 Amb25819432 [0,1,0,0,1,0|1,0,1]=4 636 B15R2.15651 Cc1cc(Cl)c(C=C2CC(N)C2)cc1 Amb25191083 [0,1,0,0,1,0|2,0,0]=4 637 B15R2.15651 Cc1ccc(NC2CC(N)C2)c(Cl)c1 Amb25852010 [0,1,0,0,1,0|1,0,1]=4 638 B17R2.41853 O=C1CCSC(Nc2ccc(Cl)cc2Cl)=N1 Amb22441957 [0,1,0,0,0,1|2,0,0]=4 639 B17R2.3478 CC(NC=1NCCN1)c2ccc(Cl)cc2Cl Amb19417082 [0,1,0,0,0,1|1,0,0]=3 640 B17R2.5361 Cc1cc(O)ccc1NC(=O)C=2NCCN2 Amb24117294 [0,1,0,0,0,1|2,0,0]=4 641 B17R2.10450 COc1cc(C)ccc1OCC2=NCCN2 Amb17075389 [0,1,0,0,0,1|2,0,0]=4 642 B17R2.42397 Cc1cc(C)c(cc1OCC2=NCCN2)C Amb17075382 [0,1,0,0,0,1|2,0,0]=4 643 B17R2.83661 Cc1cc(C)c(c(c1)C)OCC2=NCCN2 Amb17075383 [0,1,0,0,0,1|2,0,0]=4 644 B17R2.83661 Cc1cc(C)c(c(c1)Cl)NCC2CCCN2 Amb17254555 [0,1,0,0,0,1|1,0,1]=4 645 B17R2.10574 CCC1CSC(=N1)Nc2ccc(cc2C)C Amb1104007 [0,2,0,0,0,0|2,0,0]=4 646 B17R2.157255 Cc1ccc(c(c1)C)NC2=NC(CS2)(C)C Amb1104034 [0,2,0,0,0,0|2,0,0]=4 647 B17R2.2801 COc1cc(OC)c(CC=2NCCN2)cc1 Amb18068184 [0,2,0,0,0,0|2,0,0]=4 648 B17R2.5412 Cc1[n]c(Cl)c(NC=2NCCN2)c([n]1)OC Amb22167490 [0,2,0,0,0,0|2,0,0]=4 649 B15R2.346 Cc1cc2[n]c(NCCN)[nH]c2cc1 Amb18339990 [0,0,1,1,0,0|1,0,1]=4 650 B15R2.346 Cc1ccc2[nH]c(NCCC)[n]c2c1 Amb18512422 [0,0,1,1,0,0|2,0,0]=4 651 B15R2.346 NCCSc1nc2c([nH]1)ccc(c2)C Amb17074181 [0,0,1,1,0,0|2,0,0]=4 652 B15R2.10368 Cc1cc(Cl)c2[nH]cc(CCN)c2c1 Amb18776387 [0,0,1,1,0,0|1,0,0]=3 653 B15R2.10368 Cc1cc(Cl)c2occ(CCN)c2c1 Amb25703338 [0,0,1,1,0,0|2,0,0]=4 654 B15R2.10368 Cc1cc2c(CCN)c[nH]c2c(C)c1 Amb18650016 [0,0,1,1,0,0|2,0,0]=4 655 B15R2.10368 NCCc1c[nH]c2c1cc(C)cc2Br Amb2234799 [0,0,1,1,0,0|1,1,0]=4 656 B15R2.10368 NCCc1c[nH]c2c1cc(C)cc2Br Amb2237278 [0,0,1,1,0,0|1,1,0]=4 657 B15R2.10368 NCCc1c[nH]c2c1cc(C)cc2N Amb17594925 [0,0,1,1,0,0|2,0,0]=4 658 B15R2.10368 NCCc1c[nH]c2c1cc(Cl)cc2Cl Amb11038134 [0,0,1,1,0,0|2,0,0]=4 659 B15R2.6580 CCN1C(=N)Sc2c1cc(C)cc2C Amb23598117 [0,0,1,1,0,0|2,0,0]=4 660 B15R2.10802 CCNc1[n]c2cc(Cl)cc(Cl)c2o1 Amb25316996 [0,0,1,1,0,0|2,0,0]=4 661 B15R2.10802 CCNc1nc2c(s1)c(C)cc(c2)C Amb17319799 [0,0,1,1,0,0|2,0,0]=4 662 B15R2.10802 CCNc1nc2c(s1)c(Cl)cc(c2)Cl Amb17319800 [0,0,1,1,0,0|2,0,0]=4 663 B15R2.10802 Cc1cc(Cl)c2[nH]c(CCN)[n]c2c1 Amb24467553 [0,0,1,1,0,0|2,0,0]=4 664 B15R2.10802 Cc1cc2[s]c(NCC)[n]c2c(Cl)c1 Amb18939997 [0,0,1,1,0,0|1,0,1]=4 665 B15R2.15656 Cc1ccc(NC(=N)C2CC2)c(C)c1 Amb25134259 [0,0,1,1,0,0|2,0,0]=4 666 B15R2.15656 N=C(Nc1ccc(Br)cc1Cl)C2CC2 Amb25671013 [0,0,1,1,0,0|2,0,0]=4 667 B15R2.15656 N=C(Nc1ccc(Cl)cc1Cl)C2CC2 Amb25729303 [0,0,1,1,0,0|2,0,0]=4 668 B15R3.562 Clc1cccc2c1[nH]c3CCCc32 Amb23402080 [1,0,0,1,0,0|2,0,0]=4 669 B15R3.562 Nc1cccc2c1SC3=NCCN23 Amb25752041 [1,0,0,1,0,0|2,0,0]=4 670 B15R3.10591 Cc1cc2c(cc1)[n]c3NCC[n]23 Amb24088978 [1,0,0,1,0,0|0,0,2]=4 671 B15R3.10591 Nc1ccc2SC3=NCCN3c2c1 Amb17776563 [1,0,0,1,0,0|2,0,0]=4 672 B17R3.34483 Cc1cc2c([nH]c3CNCCc32)c(C)c1 Amb18894693 [0,0,0,1,0,1|2,0,0]=4 673 B13R1.1511 CCNC(=N)c1ccc(F)cc1Cl Amb25686399 [0,0,1,0,1,0|1,0,0]=3 674 B13R1.1511 CCNC(=N)c1ccc(N)cc1O Amb25035457 [0,0,1,0,1,0|2,0,0]=4 675 B13R1.1511 CCNC(=O)c1ccc(Br)cc1Cl Amb25052607 [0,0,1,0,1,0|2,0,0]=4 676 B13R1.1511 CCNC(=O)c1ccc(O)cc1Cl Amb24454719 [0,0,1,0,1,0|2,0,0]=4 677 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)N Amb1120144 [0,0,1,0,1,0|2,0,0]=4 678 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)N Amb13949225 [0,0,1,0,1,0|2,0,0]=4 679 B13R1.1511 CCOC(=N)c1ccc(Cl)cc1Cl Amb25081253 [0,0,1,0,1,0|2,0,0]=4 680 B13R1.1511 CO\N=C(\N)/c1ccc(F)cc1Cl Amb25739525 [0,0,1,0,1,0|2,0,0]=4 681 B13R1.1511 Cc1c[n]c(C(=N)NCC)c(C)c1 Amb25784910 [0,0,1,0,1,0|2,0,0]=4 682 B13R1.1511 Cc1cc(F)ccc1C(=N)NCC Amb25788588 [0,0,1,0,1,0|2,0,0]=4 683 B13R1.1511 Cc1ccc(C(=N)OCC)c(C)c1 Amb18180668 [0,0,1,0,1,0|2,0,0]=4 684 B13R1.1511 Cc1ccc(C(N)CCC)c(Cl)c1 Amb22642872 [0,0,1,0,1,0|1,0,1]=4 685 B13R1.1511 Cc1ccc([C@H](N)CCC)c(Cl)c1 Amb24346933 [0,0,1,0,1,0|1,0,1]=4 686 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)CCC Amb24685808 [0,0,1,0,1,0|2,0,0]=4 687 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)NCC Amb19531816 [0,0,1,0,1,0|1,0,0]=3 688 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)NOC Amb25293326 [0,0,1,0,1,0|2,0,0]=4 689 B13R1.1511 Cc1ccc(c(Cl)c1)C(=O)OCC Amb22750097 [0,0,1,0,1,0|2,0,0]=4 690 B13R1.1511 Cc1ccc(c(I)c1)C(=O)NCC Amb23001185 [0,0,1,0,1,0|1,1,0]=4 691 B13R1.1511 Cc1ccc(c(N)c1)C(=O)NCC Amb24390754 [0,0,1,0,1,0|2,0,0]=4 692 B13R1.961 CN\C(=N\C)\c1ccc(F)cc1F Amb25806892 [0,0,1,0,1,0|1,1,0]=4 693 B13R1.961 CN\C(=N\N)\c1ccc(Cl)cc1Cl Amb25794532 [0,0,1,0,1,0|2,0,0]=4 694 B13R1.961 CN\C(=N\O)\c1ccc(Cl)cc1Cl Amb24575525 [0,0,1,0,1,0|2,0,0]=4 695 B13R1.961 Cc1cc(C)c(cc1)\C(\NC)=N/N Amb18178427 [0,0,1,0,1,0|2,0,0]=4 696 B13R1.961 Cc1ccc(c(F)c1)\C(\NC)=N/N Amb25053569 [0,0,1,0,1,0|1,1,0]=4 697 B13R2.18 Brc1ccccc1C2=NCCO2 Amb18063906 [1,0,0,0,1,0|1,1,0]=4 698 B13R2.18 Brc1ccccc1C=2CCCN2 Amb24381998 [1,0,0,0,1,0|1,1,0]=4 699 B13R2.18 Brc1ccccc1C=2NCCN2 Amb18069920 [1,0,0,0,1,0|0,1,0]=3 700 B13R2.18 Cc1cc[n]cc1C=2NCCN2 Amb24619723 [1,0,0,0,1,0|2,0,0]=4 701 B13R2.18 Cc1ccccc1C=2NCCN2 Amb18563497 [1,0,0,0,1,0|1,0,0]=3 702 B13R2.18 Clc1[n]cccc1C=2CCCN2 Amb23444816 [1,0,0,0,1,0|2,0,0]=4 703 B13R2.18 Clc1ccc[n]c1C=2NCCN2 Amb24369623 [1,0,0,0,1,0|1,0,0]=3 704 B13R2.18 Clc1ccccc1C2=CCCN2 Amb25765810 [1,0,0,0,1,0|1,0,0]=3 705 B13R2.18 Clc1ccccc1C2=NCCS2 Amb10573095 [1,0,0,0,1,0|1,0,0]=3 706 B13R2.18 Clc1ccccc1C2CCCN2 Amb19887240 [1,0,0,0,1,0|1,0,1]=4 707 B13R2.18 Clc1ccccc1C2CCCN2 Amb2236611 [1,0,0,0,1,0|1,0,1]=4 708 B13R2.18 Clc1ccccc1C2NCCO2 Amb17335655 [1,0,0,0,1,0|1,0,1]=4 709 B13R2.18 Clc1ccccc1C2NCCS2 Amb1294336 [1,0,0,0,1,0|1,0,1]=4 710 B13R2.18 Clc1ccccc1C=2CCCC2 Amb24658577 [1,0,0,0,1,0|2,0,0]=4 711 B13R2.18 Clc1ccccc1C=2CCCN2 Amb22285378 [1,0,0,0,1,0|1,0,0]=3 712 B13R2.18 Clc1ccccc1[C@@H]2CCCN2 Amb24062899 [1,0,0,0,1,0|1,0,1]=4 713 B13R2.18 Clc1ccccc1[C@H]2CCCN2 Amb24078711 [1,0,0,0,1,0|1,0,1]=4 714 B13R2.18 Clc1ccccc1c2ncc[nH]2 Amb17233505 [1,0,0,0,1,0|0,0,2]=4 715 B13R2.18 Clc1ccccc1c2nnn[nH]2 Amb2418064 [1,0,0,0,1,0|2,0,0]=4 716 B13R2.18 Fc1ccccc1C2=NCCN2 Amb17578183 [1,0,0,0,1,0|0,1,0]=3 717 B13R2.18 Nc1cc[n]cc1C=2NCCN2 Amb25130499 [1,0,0,0,1,0|2,0,0]=4 718 B13R2.18 Nc1ccccc1C2=NCCO2 Amb18063926 [1,0,0,0,1,0|2,0,0]=4 719 B13R2.18 Oc1ccc[n]c1C=2NCCN2 Amb25317740 [1,0,0,0,1,0|2,0,0]=4 720 B13R2.18 Oc1ccccc1C2=NCCO2 Amb18645804 [1,0,0,0,1,0|2,0,0]=4 721 B13R2.18 Sc1ccccc1C2=CCCN2 Amb22363566 [1,0,0,0,1,0|2,0,0]=4 722 B13R2.18 Sc1ccccc1C2=NCCN2 Amb2425856 [1,0,0,0,1,0|1,0,0]=3 723 B13R2.29 Cc1c[s]cc1NC=2NCCN2 Amb25779204 [1,0,0,0,1,0|2,0,0]=4 724 B13R2.29 Clc1[s]ccc1NC=2CCCN2 Amb24528621 [1,0,0,0,1,0|2,0,0]=4 725 B13R2.29 Clc1[s]ccc1NC=2NCCN2 Amb24589770 [1,0,0,0,1,0|1,0,0]=3 726 B13R2.5225 Clc1ccccc1CC2CCN2 Amb25350647 [1,0,0,0,1,0|1,0,1]=4 727 B13R2.5225 Clc1ccccc1NC2CCC2 Amb18809691 [1,0,0,0,1,0|1,0,1]=4 728 B13R2.12 Brc1ccc([n]c1)C=2NCCN2 Amb25069957 [1,0,0,0,1,0|2,0,0]=4 729 B13R2.12 Cc1c[n]c([n]c1)C=2NCCN2 Amb24673026 [1,0,0,0,1,0|2,0,0]=4 730 B13R2.12 Cc1ccc(cc1)C2=NCCO2 Amb10553845 [1,0,0,0,1,0|1,0,0]=3 731 B13R2.12 Cc1ccc(cc1)C2CCCN2 Amb2234807 [1,0,0,0,1,0|1,0,1]=4 732 B13R2.12 Cc1ccc(cc1)C2NCC=N2 Amb25299358 [1,0,0,0,1,0|0,0,2]=4 733 B13R2.12 Cc1ccc(cc1)C2NCCO2 Amb17334583 [1,0,0,0,1,0|1,0,1]=4 734 B13R2.12 Cc1ccc(cc1)C2NCCS2 Amb1294340 [1,0,0,0,1,0|1,0,1]=4 735 B13R2.12 Cc1ccc(cc1)C2NCCS2 Amb22356240 [1,0,0,0,1,0|1,0,1]=4 736 B13R2.12 Cc1ccc(cc1)C=2CCCN2 Amb24053769 [1,0,0,0,1,0|1,0,0]=3 737 B13R2.12 Cc1ccc(cc1)c2ncc[nH]2 Amb17232253 [1,0,0,0,1,0|0,0,2]=4 738 B13R2.12 Cc1ccc(cc1)c2nnn[nH]2 Amb1649917 [1,0,0,0,1,0|2,0,0]=4 739 B13R2.12 Cc1ccc(cn1)C2=NCCC2 Amb15692886 [1,0,0,0,1,0|2,0,0]=4 740 B13R2.12 Clc1ccc(cc1)C2=NCCO2 Amb10553673 [1,0,0,0,1,0|2,0,0]=4 741 B13R2.12 Fc1ccc(cc1)C2=NCCS2 Amb22356246 [1,0,0,0,1,0|2,0,0]=4 742 B13R2.12 Fc1ccc(cc1)C=2CCCN2 Amb23578424 [1,0,0,0,1,0|2,0,0]=4 743 B13R2.12 Fc1ccc(cc1)C=2NCCN2 Amb18563604 [1,0,0,0,1,0|1,0,0]=3 744 B13R2.12 Ic1ccc(cc1)C=2CCCN2 Amb24727205 [1,0,0,0,1,0|2,0,0]=4 745 B13R2.12 Nc1ccc(cc1)C2=NCCS2 Amb24626639 [1,0,0,0,1,0|2,0,0]=4 746 B13R2.12 Nc1ccc(cc1)C=2CCCN2 Amb24543977 [1,0,0,0,1,0|2,0,0]=4 747 B13R2.12 Nc1ccc(cn1)C2=NCCN2 Amb10070824 [1,0,0,0,1,0|2,0,0]=4 748 B13R2.12 Oc1ccc(cc1)C2=NCCN2 Amb10070817 [1,0,0,0,1,0|1,0,0]=3 749 B13R2.12 Oc1ccc(cc1)C2=NCCO2 Amb18645792 [1,0,0,0,1,0|2,0,0]=4 750 B13R2.12 Oc1ccc(cc1)C2=NCCS2 Amb18648260 [1,0,0,0,1,0|2,0,0]=4 751 B13R2.12 Sc1ccc(cc1)C=2NCCN2 Amb24102828 [1,0,0,0,1,0|1,0,0]=3 752 B13R2.142 C[n]1cc(c[n]1)NC=2NCCN2 Amb25674345 [1,0,0,0,1,0|2,0,0]=4 753 B13R2.1069 Cc1ccc(cc1)NC2CCC2 Amb18800583 [1,0,0,0,1,0|1,0,1]=4 754 B13R2.4666 Cc1oc(C)cc1C=2NCCN2 Amb25118672 [0,0,0,0,2,0|2,0,0]=4 755 B13R2.13518 Cc1ccc(C2CCN2)c(Cl)[n]1 Amb25063820 [0,0,0,0,2,0|1,0,1]=4 756 B13R2.13518 Cc1ccc(C2CCN2)c(F)c1 Amb24535422 [0,0,0,0,2,0|0,1,1]=4 757 B13R2.13518 Cc1ccc(C2CCN2)c(O)c1 Amb24436485 [0,0,0,0,2,0|1,0,1]=4 758 B13R2.13518 Cc1ccc([C@@H]2CCN2)c(F)c1 Amb24620420 [0,0,0,0,2,0|0,1,1]=4 759 B13R2.13518 Cc1ccc([C@@H]2CCN2)c(N)c1 Amb25348391 [0,0,0,0,2,0|1,0,1]=4 760 B13R2.13518 Cc1ccc([C@H]2CCN2)c(Br)c1 Amb25309330 [0,0,0,0,2,0|0,1,1]=4 761 B13R2.13518 Cc1ccc([C@H]2CCN2)c(Cl)c1 Amb25150809 [0,0,0,0,2,0|0,0,1]=3 762 B13R2.13518 Cc1ccc([C@H]2CCN2)c(O)c1 Amb25187495 [0,0,0,0,2,0|1,0,1]=4 763 B13R2.13518 Cc1ccc(c(Cl)c1)N2CCC2 Amb25209325 [0,0,0,0,2,0|2,0,0]=4 764 B13R2.13518 Clc1cc(Br)ccc1C2CCN2 Amb25332550 [0,0,0,0,2,0|1,0,1]=4 765 B13R2.13518 Clc1cc(Br)ccc1[C@@H]2CCN2 Amb25047236 [0,0,0,0,2,0|1,0,1]=4 766 B13R2.13518 Clc1cc(Cl)c(cc1)[C@@H]2CCN2 Amb24680029 [0,0,0,0,2,0|1,0,1]=4 767 B13R2.13518 Clc1cc(Cl)c(cc1)[C@H]2CCN2 Amb24468383 [0,0,0,0,2,0|1,0,1]=4 768 B13R2.13518 Clc1cc(I)ccc1[C@H]2CCN2 Amb25311963 [0,0,0,0,2,0|1,0,1]=4 769 B13R2.13518 Fc1ccc(C2CCN2)c(Cl)c1 Amb25355240 [0,0,0,0,2,0|1,0,1]=4 770 B13R2.13518 Nc1ccc(C2CCN2)c(Cl)c1 Amb25694385 [0,0,0,0,2,0|1,0,1]=4 771 B13R2.13518 Nc1ccc([C@@H]2CCN2)c(Cl)c1 Amb25809483 [0,0,0,0,2,0|1,0,1]=4 772 B13R2.13518 Oc1ccc(C2CCN2)c(Cl)c1 Amb25151060 [0,0,0,0,2,0|1,0,1]=4 773 B13R2.13518 Oc1ccc([C@H]2CCN2)c(Cl)c1 Amb25112006 [0,0,0,0,2,0|1,0,1]=4 774 B13R2.5400 Cc1cc(C)c(cc1)NC2CC2 Amb24497456 [0,0,0,0,2,0|1,0,1]=4 775 B13R2.5400 Cc1ccc(NC2CC2)c(Cl)c1 Amb25158219 [0,0,0,0,2,0|0,0,1]=3 776 B13R2.5400 Cc1ccc(NC2CC2)c(F)c1 Amb25246063 [0,0,0,0,2,0|0,1,1]=4 777 B13R2.5400 Cc1ccc(OC2CC2)c(Cl)c1 Amb24364755 [0,0,0,0,2,0|1,0,1]=4 778 B13R2.5400 Clc1cc(Br)ccc1NC2CC2 Amb25071860 [0,0,0,0,2,0|1,0,1]=4 779 B13R2.5400 Clc1cc(Cl)c(cc1)NC2CC2 Amb24524851 [0,0,0,0,2,0|1,0,1]=4 780 B13R2.5400 Clc1cc(I)ccc1NC2CC2 Amb24659079 [0,0,0,0,2,0|1,0,1]=4 781 B15R1.462 CNC(NCc1ccc(C)cc1C)=NC Amb20638306 [0,0,1,0,0,1|1,0,0]=3 782 B15R1.462 CNC(NCc1ccc(F)cc1F)=NC Amb19309267 [0,0,1,0,0,1|1,1,0]=4 783 B15R2.38 Cc1ccccc1NC2=NCCCS2 Amb1103914 [1,0,0,0,0,1|2,0,0]=4 784 B15R2.38 Cc1ccccc1NC=2CCCCN2 Amb24498647 [1,0,0,0,0,1|2,0,0]=4 785 B15R2.38 Cc1ccccc1NC=2NCCCN2 Amb24605632 [1,0,0,0,0,1|1,0,0]=3 786 B15R2.38 Clc1ccccc1CC=2CCCCN2 Amb25779939 [1,0,0,0,0,1|2,0,0]=4 787 B15R2.38 Clc1ccccc1NC2CNCCC2 Amb18955874 [1,0,0,0,0,1|1,0,1]=4 788 B15R2.38 Clc1ccccc1\C=C/2\CCCCN2 Amb25090802 [1,0,0,0,0,1|2,0,0]=4 789 B15R2.38 Clc1ccccc1\C=C\2/CNCCC2 Amb24459508 [1,0,0,0,0,1|2,0,0]=4 790 B15R2.38 Fc1ccccc1NC=2NCCCN2 Amb24536568 [1,0,0,0,0,1|0,1,0]=3 791 B15R2.562 Brc1ccccc1CCC=2NCCN2 Amb18584296 [1,0,0,0,0,1|1,1,0]=4 792 B15R2.562 Brc1ccccc1CNC2=NCCS2 Amb25204216 [1,0,0,0,0,1|1,1,0]=4 793 B15R2.562 Brc1ccccc1CNC=2NCCN2 Amb24355724 [1,0,0,0,0,1|0,1,0]=3 794 B15R2.562 Brc1ccccc1CSC2=NCCN2 Amb186215 [1,0,0,0,0,1|1,1,0]=4 795 B15R2.562 Brc1ccccc1OCC2=NCCN2 Amb17075358 [1,0,0,0,0,1|1,1,0]=4 796 B15R2.562 Cc1c[n]ccc1CNC=2NCCN2 Amb25759261 [1,0,0,0,0,1|2,0,0]=4 797 B15R2.562 Cc1cc[n]cc1CNC=2NCCN2 Amb24383573 [1,0,0,0,0,1|2,0,0]=4 798 B15R2.562 Cc1ccccc1CNC2=NCCS2 Amb18979483 [1,0,0,0,0,1|2,0,0]=4 799 B15R2.562 Cc1ccccc1CNC=2NCCN2 Amb25059087 [1,0,0,0,0,1|1,0,0]=3 800 B15R2.562 Cc1ccccc1CSC2=NCCN2 Amb1485630 [1,0,0,0,0,1|2,0,0]=4 801 B15R2.562 Cc1ccccc1CSC2=NCCN2 Amb17760664 [1,0,0,0,0,1|2,0,0]=4 802 B15R2.562 Cc1ccccc1NNC=2NCCN2 Amb24382035 [1,0,0,0,0,1|1,0,0]=3 803 B15R2.562 Cc1ccccc1OCC2=NCCN2 Amb17075350 [1,0,0,0,0,1|2,0,0]=4 804 B15R2.562 Cc1ccccc1SCC=2NCCN2 Amb25776541 [1,0,0,0,0,1|2,0,0]=4 805 B15R2.562 Cc1ccccc1\C=C\C=2NCCN2 Amb22352578 [1,0,0,0,0,1|2,0,0]=4 806 B15R2.562 Cc1ccccc1\C=C\C=2NCCN2 Amb24441669 [1,0,0,0,0,1|2,0,0]=4 807 B15R2.562 Clc1ccc[n]c1NNC=2NCCN2 Amb24373936 [1,0,0,0,0,1|1,0,0]=3 808 B15R2.562 Clc1ccccc1CCC=2CCCN2 Amb25788977 [1,0,0,0,0,1|2,0,0]=4 809 B15R2.562 Clc1ccccc1CNc2nnn[nH]2 Amb10242670 [1,0,0,0,0,1|2,0,0]=4 810 B15R2.562 Clc1ccccc1NCC2CCCN2 Amb17240796 [1,0,0,0,0,1|1,0,1]=4 811 B15R2.562 Clc1ccccc1NCC2CCCN2 Amb2236195 [1,0,0,0,0,1|1,0,1]=4 812 B15R2.562 Clc1ccccc1NCC=2NCCN2 Amb24639087 [1,0,0,0,0,1|0,0,0]=2 813 B15R2.562 Clc1ccccc1NCc2[nH]cc[n]2 Amb18979216 [1,0,0,0,0,1|0,0,2]=4 814 B15R2.562 Clc1ccccc1NNC=2NCCN2 Amb25835689 [1,0,0,0,0,1|0,0,0]=2 815 B15R2.562 Clc1ccccc1OCC2=NCCN2 Amb17075355 [1,0,0,0,0,1|1,0,0]=3 816 B15R2.562 Clc1ccccc1\C=C\C=2NCCN2 Amb25698358 [1,0,0,0,0,1|1,0,0]=3 817 B15R2.562 Fc1ccccc1CCC=2NCCN2 Amb18565096 [1,0,0,0,0,1|1,1,0]=4 818 B15R2.562 Fc1ccccc1CNC2=NCCO2 Amb25780151 [1,0,0,0,0,1|1,1,0]=4 819 B15R2.562 Fc1ccccc1CNC=2NCCN2 Amb25843878 [1,0,0,0,0,1|0,1,0]=3 820 B15R2.562 Fc1ccccc1NCC=2NCCN2 Amb25040540 [1,0,0,0,0,1|0,1,0]=3 821 B15R2.562 Fc1ccccc1OCC2=NCCN2 Amb17075353 [1,0,0,0,0,1|1,1,0]=4 822 B15R2.562 Oc1ccccc1CNC2=NCCS2 Amb24742810 [1,0,0,0,0,1|2,0,0]=4 823 B15R2.562 Oc1ccccc1CNC=2NCCN2 Amb24506658 [1,0,0,0,0,1|1,0,0]=3 824 B15R2.29 Brc1ccc(CC=2NCCCN2)cc1 Amb25825973 [1,0,0,0,0,1|2,0,0]=4 825 B15R2.29 Cc1ccc(\C=C/2\NCCCO2)cc1 Amb25054547 [1,0,0,0,0,1|2,0,0]=4 826 B15R2.29 Cc1ccc(\C=C\2/CNCCC2)cc1 Amb25664745 [1,0,0,0,0,1|2,0,0]=4 827 B15R2.29 Cc1ccc(cc1)N=C2NCCCN2 Amb10573973 [1,0,0,0,0,1|0,0,2]=4 828 B15R2.29 Cc1ccc(cc1)NC2=NCCCS2 Amb1051433 [1,0,0,0,0,1|1,0,0]=3 829 B15R2.29 Cc1ccc(cc1)NC2=NCCOC2 Amb1396040 [1,0,0,0,0,1|1,0,0]=3 830 B15R2.29 Cc1ccc(cc1)NC2=NCCOC2 Amb2503403 [1,0,0,0,0,1|1,0,0]=3 831 B15R2.29 Cc1ccc(cc1)NC2CNCCC2 Amb18955884 [1,0,0,0,0,1|1,0,1]=4 832 B15R2.29 Cc1ccc(cc1)NC=2CSCCN2 Amb22536177 [1,0,0,0,0,1|1,0,0]=3 833 B15R2.29 Fc1ccc(CC=2NCCCN2)cc1 Amb25691534 [1,0,0,0,0,1|2,0,0]=4 834 B15R2.29 Ic1ccc(cc1)NC=2CCCCN2 Amb24415592 [1,0,0,0,0,1|2,0,0]=4 835 B15R2.29 Ic1ccc(cc1)NC=2NCCCN2 Amb24712378 [1,0,0,0,0,1|1,0,0]=3 836 B15R2.29 Nc1ccc(CC=2NCCCN2)cc1 Amb24720037 [1,0,0,0,0,1|2,0,0]=4 837 B15R2.29 Oc1ccc(CC=2NCCCN2)cc1 Amb25711660 [1,0,0,0,0,1|2,0,0]=4 838 B15R2.100 Brc1ccc(CCC=2NCCN2)cc1 Amb18073273 [1,0,0,0,0,1|2,0,0]=4 839 B15R2.100 Brc1ccc(CNC=2CCCN2)cc1 Amb25362857 [1,0,0,0,0,1|2,0,0]=4 840 B15R2.100 Brc1ccc(CNC=2NCCN2)cc1 Amb25053629 [1,0,0,0,0,1|1,0,0]=3 841 B15R2.100 Brc1ccc(cc1)OCC2=NCCN2 Amb17075360 [1,0,0,0,0,1|2,0,0]=4 842 B15R2.100 Cc1ccc(CCC=2NCCN2)cc1 Amb18564538 [1,0,0,0,0,1|1,0,0]=3 843 B15R2.100 Cc1ccc(CNC2=NCCO2)cc1 Amb24378176 [1,0,0,0,0,1|1,0,0]=3 844 B15R2.100 Cc1ccc(CNC2=NCCS2)c[n]1 Amb19001284 [1,0,0,0,0,1|2,0,0]=4 845 B15R2.100 Cc1ccc(CNC2NCCS2)cc1 Amb25682635 [1,0,0,0,0,1|1,0,1]=4 846 B15R2.100 Cc1ccc(CNC=2CCCN2)c[n]1 Amb24498686 [1,0,0,0,0,1|2,0,0]=4 847 B15R2.100 Cc1ccc(CNC=2NCCN2)cc1 Amb25321765 [1,0,0,0,0,1|0,0,0]=2 848 B15R2.100 Cc1ccc(CNc2[nH][n][n][n]2)cc1 Amb24722063 [1,0,0,0,0,1|2,0,0]=4 849 B15R2.100 Cc1ccc(CSC2=NCCN2)cc1 Amb17774704 [1,0,0,0,0,1|1,0,0]=3 850 B15R2.100 Cc1ccc(cc1)CNc2[nH]cnn2 Amb2011468 [1,0,0,0,0,1|1,0,1]=4 851 B15R2.100 Cc1ccc(cc1)CSC2=NCCN2 Amb1283640 [1,0,0,0,0,1|1,0,0]=3 852 B15R2.100 Cc1ccc(cc1)NCC2CCCN2 Amb2236099 [1,0,0,0,0,1|1,0,1]=4 853 B15R2.100 Cc1ccc(cc1)NCC2CCCN2 Amb2237188 [1,0,0,0,0,1|1,0,1]=4 854 B15R2.100 Cc1ccc(cc1)NCC=2CCCC2 Amb25219714 [1,0,0,0,0,1|2,0,0]=4 855 B15R2.100 Cc1ccc(cc1)NCC=2NCCN2 Amb25105042 [1,0,0,0,0,1|0,0,0]=2 856 B15R2.100 Cc1ccc(cc1)NC[C@@H]2CCCN2 Amb24726342 [1,0,0,0,0,1|1,0,1]=4 857 B15R2.100 Cc1ccc(cc1)NC[C@H]2CCCN2 Amb24424483 [1,0,0,0,0,1|1,0,1]=4 858 B15R2.100 Cc1ccc(cc1)NCc2[nH][n][n][n]2 Amb25237321 [1,0,0,0,0,1|2,0,0]=4 859 B15R2.100 Cc1ccc(cc1)NCc2[nH]c[n][n]2 Amb18977009 [1,0,0,0,0,1|1,0,1]=4 860 B15R2.100 Cc1ccc(cc1)NCc2[nH]cc[n]2 Amb18979227 [1,0,0,0,0,1|0,0,2]=4 861 B15R2.100 Cc1ccc(cc1)OCC2=NCCN2 Amb17075352 [1,0,0,0,0,1|1,0,0]=3 862 B15R2.100 Cc1ccc(cc1)SCC=2NCON2 Amb25840983 [1,0,0,0,0,1|2,0,0]=4 863 B15R2.100 Cc1ccc(cc1)\C=C\C=2NCCN2 Amb24637977 [1,0,0,0,0,1|1,0,0]=3 864 B15R2.100 Clc1ccc(CCC=2NCCN2)cc1 Amb18568614 [1,0,0,0,0,1|2,0,0]=4 865 B15R2.100 Clc1ccc(CNC=2CCCN2)cc1 Amb24498648 [1,0,0,0,0,1|2,0,0]=4 866 B15R2.100 Clc1ccc(CSC2=NCCN2)cc1 Amb17768361 [1,0,0,0,0,1|2,0,0]=4 867 B15R2.100 Clc1ccc(cc1)CSC2=NCCN2 Amb1283639 [1,0,0,0,0,1|2,0,0]=4 868 B15R2.100 Clc1ccc(cc1)NCC=2NCCN2 Amb22486804 [1,0,0,0,0,1|1,0,0]=3 869 B15R2.100 Clc1ccc(cc1)NNC=2NCCN2 Amb24741835 [1,0,0,0,0,1|1,0,0]=3 870 B15R2.100 Clc1ccc(cc1)OCC2=NCCN2 Amb17075357 [1,0,0,0,0,1|2,0,0]=4 871 B15R2.100 Clc1ccc(cc1)\C=C\C=2NCCN2 Amb24562269 [1,0,0,0,0,1|2,0,0]=4 872 B15R2.100 Fc1ccc(CCC=2NCCN2)cc1 Amb18565097 [1,0,0,0,0,1|2,0,0]=4 873 B15R2.100 Fc1ccc(CNC=2CCCN2)cc1 Amb25360725 [1,0,0,0,0,1|2,0,0]=4 874 B15R2.100 Fc1ccc(CNC=2NCCN2)cc1 Amb25212904 [1,0,0,0,0,1|1,0,0]=3 875 B15R2.100 Fc1ccc(cc1)OCC2=NCCN2 Amb17075354 [1,0,0,0,0,1|2,0,0]=4 876 B15R2.100 Fc1ccc(cc1)SCC=2NCCN2 Amb24714969 [1,0,0,0,0,1|2,0,0]=4 877 B15R2.100 Nc1ccc(CCC=2NCCN2)cc1 Amb24711338 [1,0,0,0,0,1|2,0,0]=4 878 B15R2.100 Nc1ccc(CNC=2NCCN2)c[n]1 Amb24353531 [1,0,0,0,0,1|2,0,0]=4 879 B15R2.100 Nc1ccc(cc1)\C=C\C=2NCCN2 Amb24424454 [1,0,0,0,0,1|2,0,0]=4 880 B15R2.100 Oc1ccc(CNC=2NCCN2)cc1 Amb24386368 [1,0,0,0,0,1|1,0,0]=3 881 B15R2.100 Oc1ccc(CSC=2NCCN2)cc1 Amb24603870 [1,0,0,0,0,1|2,0,0]=4 882 B15R2.100 Oc1ccc(cc1)OCC=2NCCN2 Amb25756976 [1,0,0,0,0,1|2,0,0]=4 883 B15R2.100 Oc1ccc(cc1)\C=C\C=2NCCN2 Amb24689563 [1,0,0,0,0,1|2,0,0]=4 884 B15R2.6880 Cc1cc(cc(Br)c1)NC2=NCCS2 Amb25351023 [0,0,0,0,1,1|1,1,0]=4 885 B15R2.6880 Cc1cc(cc(C)c1)NC2=NCCO2 Amb24470817 [0,0,0,0,1,1|2,0,0]=4 886 B15R2.6880 Cc1cc(cc(C)c1)NC=2NCCN2 Amb24506721 [0,0,0,0,1,1|1,0,0]=3 887 B15R2.6880 Cc1cc(cc(F)c1)NC=2NCCN2 Amb25359272 [0,0,0,0,1,1|0,1,0]=3 888 B15R2.6880 Clc1cc(cc(Br)c1)NC=2NCCN2 Amb24425649 [0,0,0,0,1,1|1,0,0]=3 889 B15R2.6880 Clc1cc(cc(Cl)c1)NC=2CCCN2 Amb24498619 [0,0,0,0,1,1|2,0,0]=4 890 B15R2.6880 Clc1cc(cc(Cl)c1)NC=2NCCN2 Amb25038151 [0,0,0,0,1,1|1,0,0]=3 891 B15R2.6880 Fc1cc(Cl)cc(c1)NC=2CCCN2 Amb25241020 [0,0,0,0,1,1|2,0,0]=4 892 B15R2.6880 Fc1cc(cc(Cl)c1)NC2=NCCS2 Amb25671621 [0,0,0,0,1,1|2,0,0]=4 893 B17R2.5360 Cc1ccc(CNC=2NCCCN2)c(C)c1 Amb24222457 [0,0,0,0,0,2|1,0,0]=3 894 B17R2.5360 Clc1cc(Cl)c(cc1)NN=C2CCCCN2 Amb22473376 [0,0,0,0,0,2|2,0,0]=4 895 B17R2.5360 Clc1ccc(CSC=2NCCCN2)c(Cl)c1 Amb22473960 [0,0,0,0,0,2|2,0,0]=4 896 B17R2.5360 Clc1ccc(c(c1)Cl)CSC2=NCCCN2 Amb175968 [0,0,0,0,0,2|2,0,0]=4 897 B17R2.3487 Cc1cc(C)c(cc1)OCCC=2NCCN2 Amb18570564 [0,0,0,0,0,2|2,0,0]=4 898 B17R2.3487 Clc1cc(Cl)c(cc1)OCCC=2NCCN2 Amb18073575 [0,0,0,0,0,2|2,0,0]=4 899 B17R2.3487 Fc1cc(Cl)c(cc1)OCCC=2NCCN2 Amb18578045 [0,0,0,0,0,2|2,0,0]=4