0 B14R2.29369 O=C1CCC2=C(C(=CC=C2N1)Br)Cl Z1618112563 [0,0,0,0,0,0|2,1,0]=3 1 B14R2.29369 O=C1CCC2=C(N1)C=CC(=C2Br)F Z4020199385 [0,0,0,0,0,0|2,2,0]=4 2 B14R2.29369 OC1=CC2=C(N=C1)C(=C(C=C2)Cl)Cl Z1267861259 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.32 ClC1=C(C2=C(C=C1)CCNC2)Br Z3277626367 [1,0,0,0,0,0|1,1,1]=4 4 B13R2.32 ClC1=C(C2=C(C=C1)CCNC2)Cl Z1224524509 [1,0,0,0,0,0|1,0,1]=3 5 B13R2.32 ClC1=C(C2=C(C=C1)CNCC2)Cl Z1262327499 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.32 ClC1=C(C2=C(C=CC=N2)C=C1)Cl Z1198342782 [1,0,0,0,0,0|3,0,0]=4 7 B13R2.32 ClC1=C(C2=C(C=CN=C2)C=C1)Cl Z1201624980 [1,0,0,0,0,0|1,0,2]=4 8 B13R2.32 ClC1=C2CNCCC2=CC=C1Br Z2696430462 [1,0,0,0,0,0|1,1,1]=4 9 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CC2 Z285150736 [1,0,0,0,0,0|3,0,0]=4 10 B13R2.3683 O=C1C=NC2=C(N1)C=CC(=C2)Cl Z1198166471 [1,0,0,0,0,0|3,0,0]=4 11 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)Br Z299596072 [1,0,0,0,0,0|2,1,0]=4 12 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)Cl Z586255942 [1,0,0,0,0,0|2,0,0]=3 13 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)F Z330795836 [1,0,0,0,0,0|2,1,0]=4 14 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)I Z1269172761 [1,0,0,0,0,0|2,1,0]=4 15 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)O Z234893935 [1,0,0,0,0,0|3,0,0]=4 16 B13R2.3683 O=C1COC2=C(N1)C=CC(=C2)Cl Z1198161300 [1,0,0,0,0,0|3,0,0]=4 17 B13R2.3683 O=C1CSC2=C(N1)C=CC(=C2)Cl Z56974851 [1,0,0,0,0,0|3,0,0]=4 18 B13R2.3683 O=C1NC2=C(C=C(C=C2)Br)CO1 Z1269239432 [1,0,0,0,0,0|2,1,0]=4 19 B13R2.3683 O=C1NCC2=C(N1)C=CC(=C2)Br Z1269196478 [1,0,0,0,0,0|1,1,0]=3 20 B13R2.3683 O=C1NCC2=C(O1)C=CC(=C2)Br Z1269142316 [1,0,0,0,0,0|2,1,0]=4 21 B13R2.5179 NC1=C2COC(=O)NC2=CC=C1 Z2732485068 [1,0,0,0,0,0|3,0,0]=4 22 B13R2.5179 O=C1C=NC2=C(C=CC=C2N1)Cl Z3300694292 [1,0,0,0,0,0|3,0,0]=4 23 B13R2.5179 O=C1CCC2=C(C=CC=C2N1)Cl Z1251362378 [1,0,0,0,0,0|2,0,0]=3 24 B13R2.5179 O=C1COC2=C(C=CC=C2N1)Cl Z274568256 [1,0,0,0,0,0|3,0,0]=4 25 B13R2.5179 O=C1NCC2=C(C=CC=C2O1)O Z1509303010 [1,0,0,0,0,0|3,0,0]=4 26 B13R1.150 CC1=C(C(=CC=C1)CNC(=O)N)Br Z1817045294 [0,0,1,0,0,0|2,1,0]=4 27 B13R1.150 NC(=O)COC1=C(C(=CC=C1)Cl)Cl Z18533326 [0,0,1,0,0,0|3,0,0]=4 28 B13R1.150 O=C(O)CCC1=C(C(=CC=C1)Cl)Cl Z317038008 [0,0,1,0,0,0|3,0,0]=4 29 B13R1.2879 CCC(=O)NC1=CC(=C(C=C1)Cl)N Z57727810 [0,0,1,0,0,0|3,0,0]=4 30 B13R1.2879 CNC(=O)NC1=CC(=C(C=C1)Br)N Z1524590207 [0,0,1,0,0,0|2,1,0]=4 31 B13R1.2879 CNC(=O)NC1=CC(=C(C=C1)C)Cl Z56324726 [0,0,1,0,0,0|2,0,0]=3 32 B13R1.2879 NNC(=S)NC1=CC(=C(C=C1)Cl)Cl Z56836960 [0,0,1,0,0,0|2,0,0]=3 33 B13R1.2879 O=C(CCl)NC1=CC(=C(C=C1)Cl)Cl Z56821872 [0,0,1,0,0,0|3,0,0]=4 34 B13R1.3528 CC1=C(C=CC(=C1Cl)Cl)CC(=O)O Z2311004283 [0,0,1,0,0,0|3,0,0]=4 35 B13R2.3050 CC1=C(C2=C(C=C1)NC(=O)N2)Br Z1551949017 [0,0,0,0,1,0|2,1,0]=4 36 B13R2.3050 NC1=NC2=C(N1)C(=C(C=C2)F)Cl Z5384005983 [0,0,0,0,1,0|0,1,2]=4 37 B13R2.3050 NC1=NC2=C(S1)C=CC(=C2Cl)Cl Z57603637 [0,0,0,0,1,0|1,0,2]=4 38 B13R2.3050 O=C1CC2=C(N1)C=CC(=C2F)O Z1198223512 [0,0,0,0,1,0|2,1,0]=4 39 B13R2.5180 NC1CCC2=C(C(=CC=C12)Cl)Cl Z1695797798 [0,0,0,0,1,0|1,0,2]=4 40 B13R2.5180 O=C1CCC2=C1C=CC(=C2Br)Cl Z1269182225 [0,0,0,0,1,0|2,1,0]=4 41 B13R2.5180 O=C1CCC2=C1C=CC(=C2Cl)Cl Z814904732 [0,0,0,0,1,0|2,0,0]=3 42 B13R2.5180 O=C1COC2=C1C=CC(=C2Cl)Cl Z425810644 [0,0,0,0,1,0|3,0,0]=4 43 B13R2.5180 O=C1NCC2=C1C=CC(=C2Cl)Cl Z1269236182 [0,0,0,0,1,0|1,0,0]=2 44 B12R1.226 CC1=CC(=CC=C1)CNC(=S)N Z847147370 [1,0,1,0,0,0|2,0,0]=4 45 B12R1.226 CC1=CC(=CC=C1)CSC(=N)N Z57992123 [1,0,1,0,0,0|2,0,0]=4 46 B12R1.226 N=C(N)SCC1=CC(=CC=C1)F Z48820172 [1,0,1,0,0,0|1,1,0]=4 47 B12R1.226 NC(=O)NCC1=CC(=CC=C1)F Z362629554 [1,0,1,0,0,0|1,1,0]=4 48 B12R1.49 CNC(=O)NC1=CC=C(C=C1)Cl Z55293750 [1,0,1,0,0,0|1,0,0]=3 49 B12R1.49 CNC(=O)NC1=CC=C(C=C1)F Z55293762 [1,0,1,0,0,0|1,1,0]=4 50 B12R1.49 CNC(=O)NC1=CC=C(C=C1)N Z246671880 [1,0,1,0,0,0|2,0,0]=4 51 B12R1.49 NNC(=S)NC1=CC=C(C=C1)Cl Z56828393 [1,0,1,0,0,0|2,0,0]=4 52 B12R1.125 N=C(N)NCC1=C(C=CC=C1)F Z3034959360 [1,0,1,0,0,0|0,1,0]=3 53 B12R1.125 N=C(N)SCC1=C(C=CC=C1)Cl Z48820396 [1,0,1,0,0,0|1,0,0]=3 54 B12R1.125 NC(=O)NCC1=C(C=CC=C1)Cl Z198194806 [1,0,1,0,0,0|1,0,0]=3 55 B12R1.125 NC(=O)NCC1=C(C=CC=C1)F Z198194842 [1,0,1,0,0,0|1,1,0]=4 56 B12R1.233 CC1=CC(=C(C=C1)NC(=O)N)C Z56754685 [1,0,1,0,0,0|2,0,0]=4 57 B12R1.233 N=C(N)NC1=C(C=C(C=C1)F)F Z2235390716 [1,0,1,0,0,0|1,1,0]=4 58 B12R1.544 CC1=C(C=CC(=C1Cl)Cl)CCN Z4970349053 [1,0,1,0,0,0|1,0,1]=4 59 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)Cl Z28153679 [1,0,1,0,0,0|2,0,0]=4 60 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)Cl Z28128347 [1,0,1,0,0,0|1,0,0]=3 61 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)N Z239122040 [1,0,1,0,0,0|2,0,0]=4 62 B12R1.19 CC(=O)NC1=CC(=C(C=C1)N)Cl Z425366400 [1,0,1,0,0,0|2,0,0]=4 63 B12R1.19 CC(=O)NC1=NC=C(C(=C1)Cl)Cl Z1297118487 [1,0,1,0,0,0|2,0,0]=4 64 B12R1.19 CC(C)NC1=CC(=C(C=C1)Cl)Cl Z267194630 [1,0,1,0,0,0|1,0,1]=4 65 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl Z33546666 [1,0,1,0,0,0|2,0,0]=4 66 B12R1.19 NC(=O)NC1=CC(=C(C=C1)Cl)N Z239124000 [1,0,1,0,0,0|2,0,0]=4 67 B12R1.19 NC(=O)NC1=CC(=C(C=C1)F)Cl Z198194754 [1,0,1,0,0,0|1,1,0]=4 68 B12R1.19 NC(=S)NC1=CC(=C(C=C1)F)Cl Z56923300 [1,0,1,0,0,0|1,1,0]=4 69 B12R1.50 CNC(=O)NC1=CC(=CC=C1)I Z177091564 [1,0,1,0,0,0|1,1,0]=4 70 B12R1.50 CNC(=O)NC1=CC(=CC=C1)N Z254059098 [1,0,1,0,0,0|2,0,0]=4 71 B12R1.50 CNC(=S)NC1=CC(=CC=C1)C Z45796896 [1,0,1,0,0,0|2,0,0]=4 72 B12R1.50 COC(=O)NC1=CC(=CC=C1)Cl Z56754690 [1,0,1,0,0,0|2,0,0]=4 73 B12R1.50 NNC(=S)NC1=CC(=CC=C1)Cl Z56862329 [1,0,1,0,0,0|2,0,0]=4 74 B12R1.385 CCCNC1=CC(=C(C=C1)Cl)Cl Z3006084945 [1,0,1,0,0,0|1,0,1]=4 75 B12R1.224 CC(=O)NC1=C(C(=CC=C1)Cl)C Z28292377 [1,0,1,0,0,0|2,0,0]=4 76 B12R1.224 CC1=C(C(=CC=C1)NC(=O)N)C Z107732968 [1,0,1,0,0,0|2,0,0]=4 77 B12R1.224 CC1=C(C=CC=C1I)NC(=O)N Z1638019250 [1,0,1,0,0,0|1,1,0]=4 78 B12R1.224 NC(=O)NC1=C(C(=CC=C1)Cl)Br Z1837227078 [1,0,1,0,0,0|2,0,0]=4 79 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 Z1716481593 [2,0,0,0,0,0|1,0,1]=4 80 B12R2.24 ClC1=CC2=C(C=C1)NCCC2 Z259727454 [2,0,0,0,0,0|1,0,1]=4 81 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 Z1201622353 [2,0,0,0,0,0|2,0,0]=4 82 B12R2.24 O=C1CCC2=C(N1)C=CC=C2 Z85917566 [2,0,0,0,0,0|2,0,0]=4 83 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 Z1198157416 [2,0,0,0,0,0|2,0,0]=4 84 B12R2.24 O=C1NCC2=C(N1)C=NC=C2 Z4560521307 [2,0,0,0,0,0|2,0,0]=4 85 B12R2.24 O=C1NCC2=C(O1)C=CC=C2 Z1198723657 [2,0,0,0,0,0|2,0,0]=4 86 B12R2.24 S=C1NC2=C(C=CC=C2)CS1 Z367678726 [2,0,0,0,0,0|2,0,0]=4 87 B14R1.686 CC(Cl)C(=O)NC1=CC(=C(C=C1)Cl)Cl Z248486902 [0,1,1,0,0,0|2,0,0]=4 88 B14R1.686 CC1=C(C=C(C=C1)NC(=O)N(C)C)Cl Z56324724 [0,1,1,0,0,0|2,0,0]=4 89 B14R1.686 CC1=C(C=C(C=C1)NC(=S)N(C)C)Cl Z45810709 [0,1,1,0,0,0|2,0,0]=4 90 B14R1.686 CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl Z55293721 [0,1,1,0,0,0|1,0,0]=3 91 B14R1.967 CNCC(=O)NC1=CC(=C(C=C1)Cl)Cl Z56960150 [0,1,1,0,0,0|1,0,0]=3 92 B14R1.967 CONC(=O)CC1=CC(=C(C=C1)Cl)Cl Z193289708 [0,1,1,0,0,0|2,0,0]=4 93 B14R1.3276 CNC(=O)NC1=CC(=C(C=C1)SC)Cl Z1328049689 [0,1,1,0,0,0|2,0,0]=4 94 B14R2.8235 O=C1NC(=O)C2=C(N1)C=CC(=C2)Cl Z1201617625 [1,1,0,0,0,0|1,0,1]=4 95 B14R2.8239 CN1CC2=C(C=CC(=C2)Br)NC1=O Z57473912 [1,1,0,0,0,0|1,1,0]=4 96 B14R2.8239 CN1CC2=C(C=CC(=C2)N)NC1=O Z1532736797 [1,1,0,0,0,0|2,0,0]=4 97 B14R2.4506 O=C1NC2=C(C1=O)C(=C(C=C2)Cl)Cl Z1269197510 [0,1,0,0,1,0|1,0,1]=4 98 B14R2.8737 NC1C(=O)NC2=C(C(=CC=C12)Cl)Cl Z1266854943 [0,1,0,0,1,0|2,0,0]=4 99 B14R2.8737 O=C1NC2=C(C(=CC=C2C1O)Cl)Cl Z805554544 [0,1,0,0,1,0|2,0,0]=4 100 B14R2.8737 O=C1NC2=C(C1=O)C=CC(=C2Cl)Cl Z247609732 [0,1,0,0,1,0|2,0,0]=4 101 B12R1.367 CCC(=O)C1=CC(=C(C=C1)Cl)Cl Z56858267 [0,0,1,0,1,0|2,0,0]=4 102 B12R1.367 CNC(=O)C1=CC(=C(C=C1)Cl)Cl Z32016404 [0,0,1,0,1,0|1,0,0]=3 103 B12R1.367 CNC(=O)C1=CC(=C(C=C1)Cl)N Z239124726 [0,0,1,0,1,0|2,0,0]=4 104 B12R1.367 CNC(C)C1=CC(=C(C=C1)Cl)Cl Z159528194 [0,0,1,0,1,0|1,0,1]=4 105 B12R1.367 COC(=O)C1=CC(=C(C=C1)Cl)Cl Z19801006 [0,0,1,0,1,0|2,0,0]=4 106 B12R1.893 CC1=C(C=CC(=C1Cl)Cl)C(=O)O Z1269122266 [0,0,1,0,1,0|2,0,0]=4 107 B12R2.82 ClC1=C(C2=C(C=C1)CNC2)Cl Z4926579019 [1,0,0,0,1,0|0,0,1]=3 108 B12R2.82 ClC1=C2N=CNC2=CC=C1I Z2311291810 [1,0,0,0,1,0|0,1,1]=4 109 B12R2.82 FC1=C2NC=CC2=CC=C1Cl Z1255416961 [1,0,0,0,1,0|1,1,0]=4 110 B12R2.606 CC1=CC2=C(C=C1)NC(=N)C2 Z4603464626 [1,0,0,0,1,0|1,0,0]=3 111 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 Z2768165443 [1,0,0,0,1,0|2,0,0]=4 112 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 Z56793257 [1,0,0,0,1,0|2,0,0]=4 113 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Cl Z995046354 [1,0,0,0,1,0|0,0,2]=4 114 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [1,0,0,0,1,0|2,0,0]=4 115 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Br Z299596076 [1,0,0,0,1,0|1,1,0]=4 116 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [1,0,0,0,1,0|1,0,0]=3 117 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)F Z1255450667 [1,0,0,0,1,0|1,1,0]=4 118 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [1,0,0,0,1,0|2,0,0]=4 119 B12R2.606 O=C1NC2=C(N1)C=C(C=C2)F Z1198165756 [1,0,0,0,1,0|1,1,0]=4 120 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Cl Z99599674 [1,0,0,0,1,0|2,0,0]=4 121 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Cl Z57183224 [1,0,0,0,1,0|2,0,0]=4 122 B12R2.606 SC1=NC2=C(N1)C=C(C=C2)Cl Z56921384 [1,0,0,0,1,0|1,0,1]=4 123 B12R2.612 CC1=CC2=C(C=C1)C(=O)NC2 Z1198184833 [1,0,0,0,1,0|2,0,0]=4 124 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 Z1198272534 [1,0,0,0,1,0|2,0,0]=4 125 B12R2.612 O=C1CCC2=C1C=CC(=C2)Cl Z318770634 [1,0,0,0,1,0|2,0,0]=4 126 B12R2.612 O=C1NCC2=C1C=CC(=C2)Br Z1269136562 [1,0,0,0,1,0|1,1,0]=4 127 B12R2.612 O=C1NCC2=C1C=CC(=C2)Cl Z1198176501 [1,0,0,0,1,0|1,0,0]=3 128 B12R2.612 O=C1NCC2=C1C=CC(=C2)F Z1255503451 [1,0,0,0,1,0|1,1,0]=4 129 B12R2.612 O=C1NCC2=C1C=CC(=C2)O Z1198272536 [1,0,0,0,1,0|2,0,0]=4 130 B12R2.612 O=C1NCC2=C1C=CC(=N2)Cl Z1255426797 [1,0,0,0,1,0|2,0,0]=4 131 B12R2.612 O=C1NSC2=C1C=CC(=C2)Cl Z1198155415 [1,0,0,0,1,0|2,0,0]=4 132 B12R2.612 O=C1OCC2=C1C=CC(=C2)Cl Z1198234542 [1,0,0,0,1,0|2,0,0]=4 133 B12R2.196 NC1=C2C=CC=C(C2=NN1)Cl Z1474025932 [1,0,0,0,1,0|1,0,1]=4 134 B12R2.196 NC1=C2CNC(=O)C2=CC=C1 Z1198176565 [1,0,0,0,1,0|2,0,0]=4 135 B12R2.196 O=C1CCC2=C(C=CC=C12)Cl Z234895081 [1,0,0,0,1,0|2,0,0]=4 136 B12R2.196 O=C1NCC2=C(C=CC=C12)Br Z1258930120 [1,0,0,0,1,0|1,1,0]=4 137 B12R2.196 O=C1NCC2=C(C=CC=C12)Cl Z1198221042 [1,0,0,0,1,0|1,0,0]=3 138 B12R2.196 O=C1NCC2=C(C=CC=C12)F Z1255380598 [1,0,0,0,1,0|1,1,0]=4 139 B12R2.196 O=C1NCC2=C(C=CC=C12)O Z1741980680 [1,0,0,0,1,0|2,0,0]=4 140 B12R2.196 O=C1NCC2=C(C=CN=C12)Cl Z1813149947 [1,0,0,0,1,0|2,0,0]=4 141 B12R2.196 O=C1NCC2=C(N=CC=C12)Cl Z1813090473 [1,0,0,0,1,0|2,0,0]=4 142 B12R2.202 CC1=C2NC(=O)NC2=CC=C1 Z1198176895 [1,0,0,0,1,0|2,0,0]=4 143 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)Cl Z1198221008 [1,0,0,0,1,0|2,0,0]=4 144 B12R2.202 NC1=C2NC(=O)NC2=CC=C1 Z1741972722 [1,0,0,0,1,0|2,0,0]=4 145 B12R2.202 O=C1CC2=C(C=CC=C2N1)Br Z1269158294 [1,0,0,0,1,0|1,1,0]=4 146 B12R2.202 O=C1CC2=C(C=CC=C2N1)O Z1198161564 [1,0,0,0,1,0|2,0,0]=4 147 B12R2.202 O=C1NC2=CC=CC(=C2N1)Br Z1269197007 [1,0,0,0,1,0|1,1,0]=4 148 B12R2.202 O=C1NC2=CC=CC(=C2N1)F Z1575308465 [1,0,0,0,1,0|1,1,0]=4 149 B12R2.202 O=C1NC2=CC=CC(=C2N1)O Z1504677969 [1,0,0,0,1,0|2,0,0]=4 150 B12R2.202 OC1=NC2=C(N1)C=CC=C2Cl Z1245791555 [1,0,0,0,1,0|1,0,1]=4 151 B14R1.154 N=C(N)N/N=C/C1=C(C(=CC=C1)Cl)Cl Z56851458 [0,0,1,0,0,1|0,0,1]=3 152 B14R2.7974 O=C1CCCC2=C(N1)C=CC(=C2)Cl Z1263715714 [1,0,0,0,0,1|2,0,0]=4 153 B14R2.7974 O=C1CCSC2=C(N1)C=CC(=C2)Cl Z1509153639 [1,0,0,0,0,1|2,0,0]=4