0 B12R1.891 FC(F)(F)SCC1=CC=CC=C1 SC-46284 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.91 CC(=N)NCC1=CC=CC=C1 SC-62048 [1,0,0,0,0,0|2,0,1]=4 2 B11R1.91 CC(=S)CSC1=CC=CC=C1 SC-42706 [1,0,0,0,0,0|1,1,1]=4 3 B11R1.91 CC(Br)C#CC1=CC=CC=C1 SC-69437 [1,0,0,0,0,0|1,0,2]=4 4 B11R1.91 CC(N)CCC1=CC=CC=C1 SC-62200 [1,0,0,0,0,0|1,0,0]=2 5 B11R1.91 CN(C)\N=C\C1=CC=CC=C1 SC-33533 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.91 N=C(N)CCC1=CC=CC=C1 SC-39335 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.91 O=C(O)CCC1=CC=CC=C1 SC-04862 [1,0,0,0,0,0|1,0,1]=3 8 B11R1.91 O=C(O)CCC1=CC=NC=C1 SC-50418 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 SC-68717 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.91 OB(O)CCC1=CC=CC=C1 SC-86482 [1,0,0,0,0,0|2,0,0]=3 11 B13R1.254 CC(C)(CO)OCC1=CC=CC=C1 SC-48398 [0,1,0,0,0,0|1,0,0]=2 12 B13R1.352 CC(C)(C)CC(=O)C1=NC=CC=C1 SC-40016 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.352 CC(C)(C)NC(=O)C1=CC=CC=C1 SC-78512 [0,1,0,0,0,0|2,0,1]=4 14 B13R1.352 CC(C)(C)\N=S(/Cl)C1=CC=CC=C1 SC-52005 [0,1,0,0,0,0|3,0,0]=4 15 B13R1.512 CC(C)(C)CNC1=CC=C(O)C=C1 SC-40873 [0,1,0,0,0,0|2,0,0]=3 16 B13R1.512 CC(C)(C)COC1=CC=C(O)C=C1 SC-80466 [0,1,0,0,0,0|2,0,0]=3 17 B13R2.222 CC1(C)CCC2=C(C=CC=C2)O1 SC-61255 [0,0,0,1,0,0|0,0,0]=1 18 B13R2.222 CC1(C)CNC2=NC=CC=C2O1 SC-34953 [0,0,0,1,0,0|2,0,0]=3 19 B11R1.509 CC(C)(C)OC1=CC=CN=C1 SC-66376 [0,0,0,0,1,0|3,0,0]=4 20 B11R1.509 CC(C)(C)OC1=CC=NC=C1 SC-66374 [0,0,0,0,1,0|3,0,0]=4 21 B11R1.509 CC(C)(C)OC1=NC=CC=C1 SC-66375 [0,0,0,0,1,0|3,0,0]=4 22 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SC-19169 [0,0,0,0,1,0|2,0,0]=3 23 B11R1.509 O=S(=O)(O)CC1=CC=CC=C1 SC-22051 [0,0,0,0,1,0|3,0,0]=4 24 B10R1.17 BrCCOC1=CC=CC=C1 SC-05561 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.17 BrCCSC1=CC=CC=C1 SC-51881 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.17 CCCCC1=NC=CC=C1 SC-52456 [2,0,0,0,0,0|1,0,0]=3 27 B10R1.17 CNCCC1=CC=NC=C1 SC-25785 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.17 ClCCCC1=CC=NC=C1 SC-54620 [2,0,0,0,0,0|2,0,0]=4 29 B10R1.17 ClCCCC1=CN=CC=C1 SC-54619 [2,0,0,0,0,0|2,0,0]=4 30 B10R1.17 NCCCC1=CC=CC=N1 SC-49860 [2,0,0,0,0,0|2,0,0]=4 31 B10R1.17 NCCCC1=CC=CN=C1 SC-49861 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.17 NCCSC1=CC=CC=C1 SC-40816 [2,0,0,0,0,0|2,0,0]=4 33 B10R1.17 OCC#CC1=CC=CC=C1 SC-46226 [2,0,0,0,0,0|0,0,2]=4 34 B10R1.17 OCCCC1=NC=CC=C1 SC-27298 [2,0,0,0,0,0|1,0,0]=3 35 B10R1.17 OCCCC1=NC=CC=N1 SC-87505 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.17 SCCOC1=CC=CC=C1 SC-66414 [2,0,0,0,0,0|1,1,0]=4 37 B12R1.21 CC(=O)CCC1=CC=C(Br)C=C1 SC-34731 [1,1,0,0,0,0|0,0,2]=4 38 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 SC-18497 [1,1,0,0,0,0|0,0,2]=4 39 B12R1.21 CC(C)CNC1=CC=C(O)C=C1 SC-41141 [1,1,0,0,0,0|1,0,0]=3 40 B12R1.21 CC(C)NCC1=CC=C(N)C=C1 SC-27374 [1,1,0,0,0,0|1,0,0]=3 41 B12R1.21 CC(C)OCC1=CC=C(Br)C=C1 SC-34569 [1,1,0,0,0,0|1,0,0]=3 42 B12R1.21 CN(C)CCC1=CC=C(Br)C=C1 SC-34602 [1,1,0,0,0,0|1,0,0]=3 43 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 SC-13784 [1,1,0,0,0,0|1,0,0]=3 44 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 SC-25794 [1,1,0,0,0,0|1,0,1]=4 45 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 SC-45126 [1,1,0,0,0,0|1,0,0]=3 46 B12R1.27 N=C(CCC1=CC=CC=C1)NO SC-56238 [1,1,0,0,0,0|1,0,1]=4 47 B12R1.27 NC(CO)CCC1=CC=CC=C1 SC-41147 [1,1,0,0,0,0|1,0,0]=3 48 B12R1.27 N[C@@H](CO)CCC1=CC=CC=C1 SC-13097 [1,1,0,0,0,0|1,0,0]=3 49 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 SC-14428 [1,1,0,0,0,0|0,0,2]=4 50 B12R1.43 CC(C)C(=O)CC1=CC=CC=C1 SC-87217 [1,1,0,0,0,0|0,0,1]=3 51 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-10967 [1,1,0,0,0,0|1,0,1]=4 52 B12R1.107 CC(C)CN(N)C1=CC=CC=C1 SC-38535 [1,1,0,0,0,0|1,0,0]=3 53 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SC-27547 [1,1,0,0,0,0|1,0,1]=4 54 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SC-46779 [1,1,0,0,0,0|1,0,1]=4 55 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SC-46780 [1,1,0,0,0,0|1,0,1]=4 56 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SC-80858 [1,1,0,0,0,0|1,0,1]=4 57 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl SC-49196 [1,1,0,0,0,0|1,0,1]=4 58 B12R1.125 O=C(O)CCC1=CC=CC=C1F SC-76672 [1,1,0,0,0,0|1,0,1]=4 59 B12R1.226 CC1=CC(NCC(C)C)=NC=C1 SC-64966 [1,1,0,0,0,0|2,0,0]=4 60 B12R1.226 NC1=CC(CCC(=O)O)=CC=C1 SC-73734 [1,1,0,0,0,0|1,0,1]=4 61 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 SC-13620 [1,1,0,0,0,0|1,0,1]=4 62 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 SC-28105 [1,1,0,0,0,0|1,0,1]=4 63 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 SC-54326 [1,1,0,0,0,0|1,0,1]=4 64 B12R1.194 CC(N)(CN)CC1=CC=CC=C1 SC-30246 [0,1,0,0,1,0|1,0,0]=3 65 B12R1.564 CC(C)(Br)C(=O)C1=CC=CC=C1 SC-45972 [0,1,0,0,1,0|1,0,1]=4 66 B14R1.4463 CC1=CC(O)=CC=C1NCC(C)(C)C SC-59549 [0,2,0,0,0,0|2,0,0]=4 67 B14R1.683 CC(C)(C)CC(=O)C1=CC=C(Br)C=C1 SC-39760 [0,2,0,0,0,0|1,0,1]=4 68 B14R1.3335 CC(C)(C)CC(C)(C)C1=CC=CC=C1 SC-51707 [0,2,0,0,0,0|1,0,0]=3 69 B14R1.5966 CC(C)(C)CC(=O)C1=CC=CC(Br)=C1 SC-39904 [0,2,0,0,0,0|1,0,1]=4 70 B14R1.211 COC1=CC=C(NCC(C)(C)C)C=C1 SC-40839 [0,2,0,0,0,0|2,0,0]=4 71 B14R1.684 CC1=CC(NCC(C)(C)C)=CC=C1O SC-40704 [0,2,0,0,0,0|2,0,0]=4 72 B14R1.2162 CC(C)(C)COC1=CC(C=O)=CC=C1 SC-32110 [0,2,0,0,0,0|2,0,0]=4 73 B14R1.2162 CC(C)(C)COC1=CC(CO)=CC=C1 SC-30879 [0,2,0,0,0,0|2,0,0]=4 74 B12R2.22 N[C@H]1C[C@@H](C2=CC=CC=C2)C1 SC-87898 [1,0,0,1,0,0|1,0,0]=3 75 B12R2.22 N[C@H]1C[C@@H](C2=NC=CC=C2)C1 SC-51413 [1,0,0,1,0,0|2,0,0]=4 76 B12R2.24 NC1CCC2=C(C=CC=C2)C1 SC-53503 [1,0,0,1,0,0|1,0,0]=3 77 B12R2.24 NC1CCC2=C(C=CC=C2)N1 SC-43583 [1,0,0,1,0,0|2,0,0]=4 78 B12R2.24 N[C@@H]1COC2=CC=CC=C2C1 SC-51778 [1,0,0,1,0,0|2,0,0]=4 79 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SC-26690 [1,0,0,1,0,0|0,0,0]=2 80 B12R2.92 ClC1(Cl)CC1C2=CC=CC=C2 SC-27126 [1,0,0,1,0,0|2,0,0]=4 81 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 SC-30760 [1,0,0,1,0,0|1,0,0]=3 82 B12R2.2057 C1=CC=C(OCC2CC2)N=C1 SC-51349 [1,0,0,1,0,0|2,0,0]=4 83 B12R2.2057 C1=CC=C(OC[C@@H]2CO2)C=C1 SC-52606 [1,0,0,1,0,0|1,0,0]=3 84 B12R2.2057 C1=CC=C(OC[C@H]2CO2)C=C1 SC-52609 [1,0,0,1,0,0|1,0,0]=3 85 B14R2.8039 CC1(C)CCC2=C(C=CC=C2Br)O1 SC-21438 [0,1,0,1,0,0|0,0,0]=2 86 B14R2.29496 CC1(C)CC(=O)C2=C(C=CC=C2)O1 SC-48034 [0,1,0,1,0,0|0,0,1]=3 87 B14R2.29496 CC1(C)N=C(Cl)C2=CC=CC=C2O1 SC-33981 [0,1,0,1,0,0|1,0,1]=4 88 B10R1.18 CC(C)OC1=CC=NC=C1 SC-48093 [1,0,0,0,1,0|2,0,0]=4 89 B10R1.18 CC(C)OC1=CN=CC=C1 SC-66373 [1,0,0,0,1,0|2,0,0]=4 90 B10R1.28 CC(C)(C)C1=NC=CC=C1 SC-48814 [0,0,0,0,2,0|2,0,0]=4 91 B10R1.28 CC(C)(N)C1=CC=NC=C1 SC-14565 [0,0,0,0,2,0|2,0,0]=4 92 B10R1.28 CC(C)(O)C1=NC=CC=N1 SC-87508 [0,0,0,0,2,0|2,0,0]=4 93 B12R1.252 CC(=O)CSCC1=CC=CC=C1 SC-65406 [1,0,0,0,0,1|0,0,2]=4 94 B12R1.252 CC(C)CNCC1=CC=CC=C1 SC-51577 [1,0,0,0,0,1|0,0,0]=2 95 B12R1.252 C[C@H](N)COCC1=CC=CC=C1 SC-09293 [1,0,0,0,0,1|1,0,0]=3