0 B12R1.891 CC(C)(C)NCC1=CC=CN=C1 5402675 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.891 CC(C)(C)NCC1=CC=NC=C1 4090542 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.891 CC(C)(C)NCC1=CC=NC=C1 9071212 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.891 CC(C)(C)NCC1=NC=CC=C1 4091190 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.891 CC(C)(C)NCC1=NC=CC=C1 9071969 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.891 FC(F)(F)CNC1=CC=CC=C1 4040454 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.91 CC(C)NCC1=CC=CN=C1 4088009 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.91 CC(C)NCC1=CC=CN=C1 5402672 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.91 N=C(N)CCC1=CC=CC=C1 4041259 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.91 O=C(O)CCC1=CC=NC=C1 4004170 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.91 O=C(O)CCC1=NC=CC=C1 4004241 [1,0,0,0,0,0|2,0,1]=4 11 B13R1.157 CC(C)(C)NCC1=CC=CC=C1F 4088913 [0,1,0,0,0,0|2,0,0]=3 12 B13R1.157 CC(C)(C)NCC1=CC=CC=C1F 9071198 [0,1,0,0,0,0|2,0,0]=3 13 B13R1.254 CC(C)(CO)NCC1=CC=CC=C1 9070764 [0,1,0,0,0,0|1,0,0]=2 14 B13R1.254 CC(C)(CO)NCC1=CC=CN=C1 4090969 [0,1,0,0,0,0|2,0,0]=3 15 B13R1.254 CC(C)(CO)NCC1=CC=CN=C1 9032118 [0,1,0,0,0,0|2,0,0]=3 16 B13R1.254 CC(C)(CO)NCC1=CC=NC=C1 4090652 [0,1,0,0,0,0|2,0,0]=3 17 B13R1.254 CC(C)(CO)NCC1=CC=NC=C1 9027527 [0,1,0,0,0,0|2,0,0]=3 18 B13R1.254 CC(C)(CO)NCC1=NC=CC=C1 4089806 [0,1,0,0,0,0|2,0,0]=3 19 B13R1.254 CC(C)(CO)NCC1=NC=CC=C1 9037788 [0,1,0,0,0,0|2,0,0]=3 20 B13R1.352 CC(C)(C)CC(N)C1=CC=CN=C1 4026609 [0,1,0,0,0,0|2,0,0]=3 21 B13R1.512 CC(C)(C)NCC1=CC=C(Br)C=C1 4022322 [0,1,0,0,0,0|2,0,0]=3 22 B13R1.512 CC(C)(C)NCC1=CC=C(Br)C=C1 4089046 [0,1,0,0,0,0|2,0,0]=3 23 B13R1.838 CC(C)(C)NCC1=CC=CC(Cl)=C1 4090489 [0,1,0,0,0,0|2,0,0]=3 24 B13R1.838 CC(C)(C)NCC1=CC=CC(Cl)=C1 9072027 [0,1,0,0,0,0|2,0,0]=3 25 B13R1.838 CC(C)(N)CNC1=CC(Cl)=CC=C1 4023228 [0,1,0,0,0,0|2,0,0]=3 26 B13R2.222 CC1(C)CC2=CC=CC=C2CN1 9071824 [0,0,0,1,0,0|2,0,0]=3 27 B11R1.510 CC(C)(C)NCC1=CC=CO1 4089556 [0,0,0,0,1,0|3,0,0]=4 28 B11R1.510 CC(C)(C)NCC1=CC=CO1 9071656 [0,0,0,0,1,0|3,0,0]=4 29 B11R1.510 CC(C)(C)NCC1=CSC=C1 4088260 [0,0,0,0,1,0|3,0,0]=4 30 B11R1.510 CC(C)(C)NCC1=CSC=C1 9070637 [0,0,0,0,1,0|3,0,0]=4 31 B13R1.3523 FC(F)(F)CNCC1=CC=CC=C1 4040689 [0,0,0,0,0,1|3,0,0]=4 32 B10R1.17 BrCCCC1=CC=CN=C1 4027035 [2,0,0,0,0,0|2,0,0]=4 33 B10R1.17 CCNCC1=NC=CC=C1 9070750 [2,0,0,0,0,0|2,0,0]=4 34 B10R1.17 CNCCC1=CC=NC=C1 4004718 [2,0,0,0,0,0|2,0,0]=4 35 B10R1.17 CNCCC1=CC=NC=C1 4087817 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.17 ICCOC1=CC=CC=C1 5101649 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.17 NCCCC1=CC=CN=C1 4003523 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.17 NCCCC1=CC=NC=C1 4003521 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.17 NCCCC1=NC=CC=C1 4004571 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.17 NCCSC1=CC=CC=C1 4087772 [2,0,0,0,0,0|2,0,0]=4 41 B10R1.17 OCCNC1=CC=CC=N1 5107563 [2,0,0,0,0,0|2,0,0]=4 42 B12R1.21 CC(C)COC1=CC=C(N)C=C1 4017585 [1,1,0,0,0,0|1,0,0]=3 43 B12R1.21 CC(C)NCC1=CC=C(Br)C=C1 4022320 [1,1,0,0,0,0|1,0,0]=3 44 B12R1.21 CC(C)NCC1=CC=C(Cl)C=C1 4022326 [1,1,0,0,0,0|1,0,0]=3 45 B12R1.21 CC(C)NCC1=CC=C(Cl)C=C1 4089158 [1,1,0,0,0,0|1,0,0]=3 46 B12R1.21 CC(C)NCC1=CC=C(F)C=C1 4089696 [1,1,0,0,0,0|1,0,0]=3 47 B12R1.21 CC(C)NCC1=CC=C(F)C=C1 5402692 [1,1,0,0,0,0|1,0,0]=3 48 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 4017387 [1,1,0,0,0,0|1,0,0]=3 49 B12R1.21 CC1=CC=C(OCC(C)N)C=C1 4027657 [1,1,0,0,0,0|2,0,0]=4 50 B12R1.27 CCC(C)NCC1=CC=CN=C1 4090038 [1,1,0,0,0,0|2,0,0]=4 51 B12R1.27 CCC(C)NCC1=CC=CN=C1 9071485 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.27 CCC(C)NCC1=CC=NC=C1 4089267 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.27 CCC(C)NCC1=CC=NC=C1 9071023 [1,1,0,0,0,0|2,0,0]=4 54 B12R1.27 CCC(C)NCC1=NC=CC=C1 4088188 [1,1,0,0,0,0|2,0,0]=4 55 B12R1.27 CCC(C)NCC1=NC=CC=C1 9070682 [1,1,0,0,0,0|2,0,0]=4 56 B12R1.107 CC(C)CC(=O)C1=CC=CN=C1 4026598 [1,1,0,0,0,0|1,0,1]=4 57 B12R1.107 CC(C)CC(N)C1=CC=CN=C1 4026599 [1,1,0,0,0,0|1,0,0]=3 58 B12R1.125 CC(C)COC1=C(N)C=CC=C1 4017584 [1,1,0,0,0,0|1,0,0]=3 59 B12R1.125 CC(C)COC1=CC=CC=C1O 7365290 [1,1,0,0,0,0|1,0,0]=3 60 B12R1.125 CC(C)NCC1=C(Br)C=CC=C1 4024824 [1,1,0,0,0,0|1,0,0]=3 61 B12R1.125 CC(C)NCC1=C(Cl)C=CC=C1 4024825 [1,1,0,0,0,0|1,0,0]=3 62 B12R1.125 CC(C)NCC1=C(Cl)C=CC=C1 4091077 [1,1,0,0,0,0|1,0,0]=3 63 B12R1.125 CC1=C(CNC(C)C)C=CC=C1 4017385 [1,1,0,0,0,0|1,0,0]=3 64 B12R1.125 CC1=C(CNC(C)C)C=CC=C1 4090531 [1,1,0,0,0,0|1,0,0]=3 65 B12R1.125 CC1=C(OCC(C)N)C=CC=C1 4026980 [1,1,0,0,0,0|2,0,0]=4 66 B12R1.125 CC1=CC=CN=C1CNC(C)C 4010342 [1,1,0,0,0,0|2,0,0]=4 67 B12R1.226 CC1=CC=CC(CNC(C)C)=C1 4017386 [1,1,0,0,0,0|1,0,0]=3 68 B12R1.226 CC1=CC=CC(CNC(C)C)=C1 4088712 [1,1,0,0,0,0|1,0,0]=3 69 B12R1.196 CC(C)(CO)NCC1=CC=CO1 4088184 [0,1,0,0,1,0|2,0,0]=4 70 B12R1.196 CC(C)(CO)NCC1=CC=CO1 9070867 [0,1,0,0,1,0|2,0,0]=4 71 B12R1.196 CC(C)(CO)NCC1=CSC=C1 4089028 [0,1,0,0,1,0|2,0,0]=4 72 B12R1.196 CC(C)(CO)NCC1=CSC=C1 9071299 [0,1,0,0,1,0|2,0,0]=4 73 B14R1.93 COC1=CC=CC=C1CNC(C)(C)C 4022335 [0,2,0,0,0,0|2,0,0]=4 74 B14R1.298 CC(C)(CO)NCC1=CC=CC=C1F 4090535 [0,2,0,0,0,0|1,0,0]=3 75 B14R1.298 CC(C)(CO)NCC1=CC=CC=C1F 9071152 [0,2,0,0,0,0|1,0,0]=3 76 B14R1.298 CC1=CC=CC=C1CNC(C)(C)CO 4089808 [0,2,0,0,0,0|1,0,0]=3 77 B14R1.298 CC1=CC=CC=C1CNC(C)(C)CO 9070834 [0,2,0,0,0,0|1,0,0]=3 78 B14R1.211 CC(C)(O)C#CC1=CC=C(C=O)C=C1 4003333 [0,2,0,0,0,0|0,0,2]=4 79 B14R1.211 CCC1=CC=C(CNC(C)(C)C)C=C1 4090014 [0,2,0,0,0,0|2,0,0]=4 80 B14R1.211 CCC1=CC=C(CNC(C)(C)C)C=C1 9070733 [0,2,0,0,0,0|2,0,0]=4 81 B14R1.2162 COC1=CC=CC(CNC(C)(C)C)=C1 4088300 [0,2,0,0,0,0|2,0,0]=4 82 B14R1.2162 COC1=CC=CC(CNC(C)(C)C)=C1 9071971 [0,2,0,0,0,0|2,0,0]=4 83 B12R2.22 NC1CC(C2=CC=NC=C2)C1 4108210 [1,0,0,1,0,0|2,0,0]=4 84 B12R2.22 NC1CC(C2=CN=CC=C2)C1 4108204 [1,0,0,1,0,0|2,0,0]=4 85 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 4002962 [1,0,0,1,0,0|0,0,2]=4 86 B12R2.24 NC1CCC2=C(C=CC=C2)C1 4028420 [1,0,0,1,0,0|1,0,0]=3 87 B12R2.24 NC1COC2=CC=CC=C2C1 4018509 [1,0,0,1,0,0|2,0,0]=4 88 B12R2.2057 C1=CC(CNC2CC2)=CC=N1 4027137 [1,0,0,1,0,0|2,0,0]=4 89 B12R2.2057 C1=CC(CNC2CC2)=CC=N1 4089122 [1,0,0,1,0,0|2,0,0]=4 90 B12R2.2057 C1=CC=C(CNC2CC2)N=C1 4027378 [1,0,0,1,0,0|2,0,0]=4 91 B12R2.2057 C1=CN=CC(CNC2CC2)=C1 4027359 [1,0,0,1,0,0|2,0,0]=4 92 B12R2.94 NC1(CC2=CC=CC=C2)CC1 4033380 [0,0,0,1,1,0|1,0,0]=3 93 B14R2.3492 NCC1(COC2=CC=CC=C2)CC1 4026743 [0,1,0,1,0,0|2,0,0]=4 94 B14R2.29496 CC1(C)CC(N)C2=CC=CC=C2O1 4011214 [0,1,0,1,0,0|0,0,0]=2 95 B14R2.29496 CC1NC(C)(C)CC2=C1C=CC=C2 4000293 [0,1,0,1,0,0|2,0,0]=4 96 B10R1.18 CC(N)CC1=CN=CC=C1 4002035 [1,0,0,0,1,0|2,0,0]=4 97 B10R1.18 CC(O)CC1=NC=CC=C1 4041318 [1,0,0,0,1,0|1,0,0]=3 98 B12R1.252 CC(C)CNCC1=CC=CC=C1 4014220 [1,0,0,0,0,1|0,0,0]=2 99 B12R1.252 CC(C)CNCC1=CC=CC=C1 4087867 [1,0,0,0,0,1|0,0,0]=2 100 B12R1.252 CC(C)CNCC1=CC=CN=C1 4090219 [1,0,0,0,0,1|1,0,0]=3 101 B12R1.252 CC(C)CNCC1=CC=CN=C1 5402676 [1,0,0,0,0,1|1,0,0]=3 102 B12R1.252 CC(C)CNCC1=CC=NC=C1 4091094 [1,0,0,0,0,1|1,0,0]=3 103 B12R1.252 CC(C)CNCC1=CC=NC=C1 9070906 [1,0,0,0,0,1|1,0,0]=3 104 B12R1.252 CC(C)CNCC1=NC=CC=C1 4090205 [1,0,0,0,0,1|1,0,0]=3 105 B12R1.252 CC(C)CNCC1=NC=CC=C1 9071496 [1,0,0,0,0,1|1,0,0]=3 106 B12R1.252 CC(C)NCCC1=CC=CC=C1 4024832 [1,0,0,0,0,1|0,0,0]=2 107 B12R1.252 CC(C)NCCC1=CC=CC=C1 4088731 [1,0,0,0,0,1|0,0,0]=2 108 B14R1.3331 CC(C)(C)NCC#CC1=CC=CC=C1 4088734 [0,0,0,0,0,2|1,0,1]=4 109 B14R1.3331 CC(C)(C)NCC#CC1=CC=CC=C1 9071183 [0,0,0,0,0,2|1,0,1]=4