0 B13R1.718 NNC(=O)CCNC1=CC=CC=C1 4023493 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.718 O=C(CBr)NCCC1=CC=CC=C1 4023661 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.8 CCCNCCC1=CC=CC=C1 6382736 [1,0,0,0,0,0|2,0,1]=4 3 B12R1.8 CCNCCCC1=CC=CC=C1 4024844 [1,0,0,0,0,0|2,0,0]=3 4 B12R1.8 CCNCCOC1=CC=CC=C1 4088022 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.8 CCNCCOC1=CC=CC=C1 9070430 [1,0,0,0,0,0|3,0,0]=4 6 B12R1.8 CNCCCOC1=CC=CC=C1 9071185 [1,0,0,0,0,0|2,0,1]=4 7 B12R1.8 CNCCCSC1=CC=CC=C1 4089624 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.8 CNCCCSC1=CC=CC=C1 9070836 [1,0,0,0,0,0|2,0,1]=4 9 B12R1.8 COCCNCC1=CC=CN=C1 4089315 [1,0,0,0,0,0|2,0,1]=4 10 B12R1.8 COCCNCC1=CC=CN=C1 9071847 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.8 COCCNCC1=CC=NC=C1 4090664 [1,0,0,0,0,0|2,0,1]=4 12 B12R1.8 COCCNCC1=CC=NC=C1 9071014 [1,0,0,0,0,0|2,0,1]=4 13 B12R1.8 COCCNCC1=NC=CC=C1 4090709 [1,0,0,0,0,0|2,0,1]=4 14 B12R1.8 COCCNCC1=NC=CC=C1 9070784 [1,0,0,0,0,0|2,0,1]=4 15 B12R1.252 CC(C)CNCC1=CC=CC=C1 4014220 [1,0,0,0,0,0|2,0,1]=4 16 B12R1.252 CC(C)CNCC1=CC=CC=C1 4087867 [1,0,0,0,0,0|2,0,1]=4 17 B12R1.252 CC(C)NCCC1=CC=CC=C1 4024832 [1,0,0,0,0,0|2,0,1]=4 18 B12R1.252 CC(C)NCCC1=CC=CC=C1 4088731 [1,0,0,0,0,0|2,0,1]=4 19 B12R1.252 N=C(N)CCCC1=CC=CC=C1 4059893 [1,0,0,0,0,0|2,0,0]=3 20 B14R1.13 O=C(CCl)NCCC1=CC=C(Cl)C=C1 9071189 [0,1,0,0,0,0|3,0,0]=4 21 B14R2.19 O=C1CC(CC2=CC=CC=C2)CN1 4026758 [0,0,0,1,0,0|1,0,0]=2 22 B14R2.68 O=C1CCN(C2=CC=CC=C2)CC1 4000343 [0,0,0,1,0,0|2,0,0]=3 23 B14R2.95 COC(=O)C1=NNC2=CC=CC=C21 4027020 [0,0,0,1,0,0|2,0,1]=4 24 B14R2.95 O=C(CBr)N1CCC2=C1C=CC=C2 4023676 [0,0,0,1,0,0|3,0,0]=4 25 B12R1.27 NNC(=O)CCC1=CC=CC=C1 3017808 [0,0,0,0,1,0|2,0,0]=3 26 B12R1.27 NNC(=O)CCC1=CC=CC=C1 4045083 [0,0,0,0,1,0|2,0,0]=3 27 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 4023673 [0,0,0,0,1,0|3,0,0]=4 28 B11R1.28 C=CCNCC1=CC=CC=C1 4090793 [2,0,0,0,0,0|1,0,1]=4 29 B11R1.28 C=CCNCC1=CC=CC=C1 9070780 [2,0,0,0,0,0|1,0,1]=4 30 B11R1.28 CNCCOC1=CC=CC=C1 4013938 [2,0,0,0,0,0|2,0,0]=4 31 B13R1.9 COCCNCC1=CC=C(Br)C=C1 4090438 [1,1,0,0,0,0|1,0,1]=4 32 B13R1.9 COCCNCC1=CC=C(Br)C=C1 9071820 [1,1,0,0,0,0|1,0,1]=4 33 B13R1.9 COCCNCC1=CC=C(C)C=C1 4090699 [1,1,0,0,0,0|1,0,1]=4 34 B13R1.9 COCCNCC1=CC=C(C)C=C1 9071276 [1,1,0,0,0,0|1,0,1]=4 35 B13R1.9 COCCNCC1=CC=C(F)C=C1 4004363 [1,1,0,0,0,0|1,0,1]=4 36 B13R1.28 COCCCNCC1=CC=CC=C1 4004359 [1,1,0,0,0,0|0,0,1]=3 37 B13R1.28 COCCCNCC1=CC=CC=C1 4089774 [1,1,0,0,0,0|0,0,1]=3 38 B13R1.337 CC(C)NCCCC1=CC=CC=C1 4024826 [1,1,0,0,0,0|2,0,0]=4 39 B13R1.337 CC(C)NCCCC1=CC=CC=C1 4089458 [1,1,0,0,0,0|2,0,0]=4 40 B13R1.555 COCCNCC1=C(Cl)C=CC=C1 4004519 [1,1,0,0,0,0|1,0,1]=4 41 B13R1.555 COCCNCC1=C(Cl)C=CC=C1 4090037 [1,1,0,0,0,0|1,0,1]=4 42 B13R1.555 COCCNCC1=CC=CC=C1C 4090123 [1,1,0,0,0,0|1,0,1]=4 43 B13R1.555 COCCNCC1=CC=CC=C1C 9070646 [1,1,0,0,0,0|1,0,1]=4 44 B13R1.45 CN(C)CCC(N)C1=CC=CC=C1 4013730 [1,1,0,0,0,0|2,0,0]=4 45 B13R1.158 CC1=C(CSCC(=O)O)C=CC=C1 6187574 [1,1,0,0,0,0|1,0,0]=3 46 B13R1.348 CN(CC(=O)O)CC1=CC=CC=C1 4110663 [1,1,0,0,0,0|1,0,0]=3 47 B13R1.348 CN(CC(=O)O)CC1=CC=NC=C1 4003361 [1,1,0,0,0,0|2,0,0]=4 48 B13R1.348 CN(CC(=O)O)CC1=CC=NC=C1 4088460 [1,1,0,0,0,0|2,0,0]=4 49 B13R1.348 CN(CC(=O)O)CC1=CN=CC=C1 4003359 [1,1,0,0,0,0|2,0,0]=4 50 B13R1.348 CN(CC(=O)O)CC1=CN=CC=C1 4090519 [1,1,0,0,0,0|2,0,0]=4 51 B13R1.348 CN(CC(=O)O)CC1=NC=CC=C1 4003360 [1,1,0,0,0,0|2,0,0]=4 52 B13R1.348 CN(CC(=O)O)CC1=NC=CC=C1 4088525 [1,1,0,0,0,0|2,0,0]=4 53 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 4027608 [1,1,0,0,0,0|1,0,1]=4 54 B13R1.351 CC(NCC1=CC=CC=C1)C(=O)O 6933119 [1,1,0,0,0,0|1,0,0]=3 55 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 4013598 [1,1,0,0,0,0|0,0,1]=3 56 B13R1.513 CC(=O)CCSC1=CC=C(F)C=C1 4011074 [1,1,0,0,0,0|1,0,0]=3 57 B13R1.513 O=C(O)CCCC1=CC=C(Cl)C=C1 4002816 [1,1,0,0,0,0|0,0,0]=2 58 B13R1.11 COC(=O)CC(N)C1=CC=CC=C1 4045080 [0,1,0,0,1,0|0,0,0]=2 59 B13R1.14 CNC(=O)CCC1=CC=C(N)C=C1 4032190 [0,1,0,0,1,0|1,0,0]=3 60 B13R1.14 CNC(=O)COC1=CC=C(Br)C=C1 7332322 [0,1,0,0,1,0|2,0,0]=4 61 B13R1.14 COC(=O)COC1=CC=C(N)C=C1 7315349 [0,1,0,0,1,0|1,0,0]=3 62 B13R1.14 NNC(=O)CCC1=CC=C(O)C=C1 3005245 [0,1,0,0,1,0|2,0,0]=4 63 B13R1.15 CCC(=O)NCC1=CC(Br)=CC=C1 9070652 [0,1,0,0,1,0|2,0,0]=4 64 B13R1.15 CNC(=O)CCC1=CC(N)=CC=C1 4034313 [0,1,0,0,1,0|1,0,0]=3 65 B13R1.15 CNC(=O)CCC1=CC(N)=CC=C1 4089715 [0,1,0,0,1,0|1,0,0]=3 66 B13R1.528 CNC(=O)CCC1=C(N)C=CC=C1 4032084 [0,1,0,0,1,0|1,0,0]=3 67 B13R1.528 CNC(=O)COC1=CC=CC=C1Br 9071965 [0,1,0,0,1,0|2,0,0]=4 68 B13R1.528 NNC(=O)CCC1=C(O)C=CC=C1 5190979 [0,1,0,0,1,0|2,0,0]=4 69 B15R1.959 COC(=O)CCNC(C)C1=CC=CC=C1 4002822 [0,1,0,0,0,1|0,0,0]=2 70 B15R1.959 COC(=O)CCNC(C)C1=CC=CC=C1 4089301 [0,1,0,0,0,1|0,0,0]=2 71 B13R2.3 C1=CC=C(C2CCCNC2)C=C1 4003675 [1,0,0,1,0,0|1,0,1]=4 72 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 3002445 [1,0,0,1,0,0|2,0,0]=4 73 B13R2.64 C1=CC=C(CC2CCNC2)C=C1 4042868 [1,0,0,1,0,0|1,0,1]=4 74 B13R2.1613 CNC1CCCC2=CC=CC=C21 4011061 [1,0,0,1,0,0|1,0,1]=4 75 B13R2.10 O=C1CCN(C2=CC=CC=C2)C1 4015909 [1,0,0,1,0,0|1,0,0]=3 76 B13R2.163 O=C1COCC2=C(C=CC=C2)N1 4046465 [1,0,0,1,0,0|2,0,0]=4 77 B13R2.33 O=C1COC2=CC=CC=C2CN1 4027041 [0,0,0,1,1,0|2,0,0]=4 78 B15R2.29 O=C1CCN(CC2=CC=CC=N2)CC1 4001982 [0,0,0,1,0,1|2,0,0]=4 79 B15R2.3 O=C1CCN(C2=CC=C(Cl)C=C2)CC1 4000323 [0,1,0,1,0,0|2,0,0]=4 80 B15R2.3 O=C1CCN(C2=CC=C(F)C=C2)CC1 4000326 [0,1,0,1,0,0|2,0,0]=4 81 B15R2.297 O=C1CC(C(=O)C2=CC=CC=C2)CO1 9071210 [0,1,0,1,0,0|0,0,1]=3 82 B15R2.31 O=C1CNC[C@H](CC2=CC=CC=C2)N1 4069109 [0,1,0,1,0,0|2,0,0]=4 83 B15R2.308 CC1=C(N2CCC(=O)CC2)C=CC=C1 4000330 [0,1,0,1,0,0|2,0,0]=4 84 B15R2.308 O=C1CCN(C2=C(Cl)C=CC=C2)CC1 4000333 [0,1,0,1,0,0|2,0,0]=4 85 B15R2.308 O=C1CCN(C2=CC=CC=C2F)CC1 4000324 [0,1,0,1,0,0|2,0,0]=4 86 B15R2.28 CC1=CC=CC(N2CCC(=O)CC2)=C1 4000328 [0,1,0,1,0,0|2,0,0]=4 87 B15R2.28 O=C1CCN(C2=CC(Cl)=CC=C2)CC1 4000322 [0,1,0,1,0,0|2,0,0]=4 88 B15R2.28 O=C1CCN(C2=CC(F)=CC=C2)CC1 4000325 [0,1,0,1,0,0|2,0,0]=4 89 B11R1.91 N=C(N)CCC1=CC=CC=C1 4041259 [1,0,0,0,1,0|2,0,0]=4 90 B11R1.91 O=C(O)CCC1=CC=NC=C1 4004170 [1,0,0,0,1,0|1,0,0]=3 91 B11R1.91 O=C(O)CCC1=NC=CC=C1 4004241 [1,0,0,0,1,0|1,0,0]=3 92 B11R1.91 O=C(O)CCC1=NC=CN=C1 4003578 [1,0,0,0,1,0|2,0,0]=4 93 B11R1.91 O=C(O)CNC1=CC=CN=C1 4110417 [1,0,0,0,1,0|2,0,0]=4 94 B11R1.91 O=C(O)CSC1=NC=CC=C1 4400385 [1,0,0,0,1,0|2,0,0]=4 95 B11R1.172 O=C(O)CCCC1=CNN=C1 4002951 [1,0,0,0,1,0|2,0,0]=4 96 B11R1.172 O=C(O)CCCN1C=CC=N1 4042881 [1,0,0,0,1,0|2,0,0]=4 97 B11R1.172 O=C(O)CCCN1C=CN=C1 4022290 [1,0,0,0,1,0|2,0,0]=4 98 B11R1.40 NNC(=O)CC1=CC=CC=C1 3002732 [0,0,0,0,2,0|2,0,0]=4