0 B11R1.40 COC(=O)NC1=CC=CC=C1 CS-0066443 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.40 NC(CO)CC1=CC=NC=C1 CS-0434311 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.17 FCCNC1=CC=CC=C1 CS-W023117 [1,0,0,0,0,0|3,0,0]=4 3 B10R1.17 OCCCC1=NC=CC=C1 CS-0079867 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.18 NC(=S)CC1=CC=CC=C1 CS-0206469 [1,0,0,0,0,0|1,0,1]=3 5 B12R1.32 COC[C@H](N)CC1=CC=CC=C1 CS-0431739 [0,1,0,0,0,0|2,0,0]=3 6 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O CS-0275884 [0,1,0,0,0,0|3,0,0]=4 7 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O CS-0644493 [0,1,0,0,0,0|2,0,0]=3 8 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O CS-0170843 [0,1,0,0,0,0|3,0,0]=4 9 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 CS-0719299 [0,1,0,0,0,0|3,0,0]=4 10 B12R1.49 CNC(=O)CC1=CC=C(O)C=C1 CS-0061780 [0,1,0,0,0,0|1,0,1]=3 11 B12R1.49 N[C@@H](CO)CC1=CC=C(F)C=C1 CS-0316133 [0,1,0,0,0,0|3,0,0]=4 12 B12R1.50 CC1=CC(CC(O)CN)=CC=C1 CS-0352702 [0,1,0,0,0,0|3,0,0]=4 13 B12R1.50 CCC(O)CC1=CC(Cl)=CC=C1 CS-0715713 [0,1,0,0,0,0|2,0,0]=3 14 B12R1.50 N[C@H](CO)CC1=CC(Cl)=CC=C1 CS-0462134 [0,1,0,0,0,0|3,0,0]=4 15 B12R2.18 CC1=C2C=CC=CC2=NN1C CS-0696414 [0,0,0,1,0,0|3,0,0]=4 16 B12R2.18 CC1CC2=C(C=CC=C2)C1N CS-0260386 [0,0,0,1,0,0|2,0,0]=3 17 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@H]1O CS-0147141 [0,0,0,1,0,0|3,0,0]=4 18 B12R2.23 NC1CCC1C2=CC=CC=C2 CS-0461489 [0,0,0,1,0,0|2,0,0]=3 19 B12R2.24 BrC1CCC2=C(C=CC=C2)C1 CS-0473434 [0,0,0,1,0,0|2,0,0]=3 20 B12R2.24 CC1COC2=C(C=CC=C2)N1 CS-0037800 [0,0,0,1,0,0|3,0,0]=4 21 B12R2.24 NC1CCC2=C(C=CC=N2)C1 CS-0653269 [0,0,0,1,0,0|3,0,0]=4 22 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 CS-0120025 [0,0,0,1,0,0|1,0,1]=3 23 B12R2.24 O=C1CC2=CN=CC=C2CN1 CS-0451759 [0,0,0,1,0,0|2,0,1]=4 24 B12R2.32 C#CC1CC2=CC=CC=C2C1 CS-B0618 [0,0,0,1,0,0|1,0,1]=3 25 B12R2.32 NCC1CC2=C(C=CC=C2)N1 CS-0887707 [0,0,0,1,0,0|3,0,0]=4 26 B12R2.2058 C1=CC=C(NC2CNC2)C=C1 CS-0900900 [0,0,0,1,0,0|3,0,0]=4 27 B10R1.15 CCC(O)C1=CC=CC=C1 CS-W013334 [0,0,0,0,1,0|2,0,0]=3 28 B10R1.15 CC[C@H](N)C1=NC=CC=C1 CS-0120684 [0,0,0,0,1,0|3,0,0]=4 29 B10R1.15 C\C(=N/O)C1=CC=CC=C1 CS-0160349 [0,0,0,0,1,0|1,0,2]=4 30 B9R1.8 CNCC1=CC=NN=C1 CS-0184080 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.8 NNCC1=CC=CN=C1 CS-W021776 [2,0,0,0,0,0|2,0,0]=4 32 B11R1.1 CNCCC1=CC=C(O)C=C1 CS-0209581 [1,1,0,0,0,0|0,0,0]=2 33 B11R1.1 COCOC1=CC=C(Cl)C=C1 CS-0193630 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.1 FC1=CC=C(CCCI)C=C1 CS-0161806 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.16 C#CCC(O)C1=CC=CC=C1 CS-0436845 [1,1,0,0,0,0|1,0,1]=4 36 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 CS-0454208 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.16 ClCCC(Br)C1=CC=CC=C1 CS-0156511 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.17 CC1=CC=CC=C1CCCO CS-0307979 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.17 OC1=CC=CC=C1CCCBr CS-0511646 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.28 COCCNC1=CC=CC=C1 CS-0242309 [1,1,0,0,0,0|1,0,0]=3 41 B11R1.28 ICCOCC1=CC=CC=C1 CS-0146879 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.28 OCCOCC1=CC=CC=C1 CS-0896052 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.36 CC(C)[C@H](N)C1=NC=CC=C1 CS-0120118 [1,1,0,0,0,0|1,0,0]=3 44 B11R1.36 CN(N)C(=S)C1=CC=CC=C1 CS-0897241 [1,1,0,0,0,0|1,0,1]=4 45 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 CS-0745167 [1,1,0,0,0,0|1,0,0]=3 46 B11R1.36 NC(=O)[C@H](O)C1=CC=CC=C1 CS-0323911 [1,1,0,0,0,0|1,0,1]=4 47 B11R1.86 CC(C)OC1=CC=CN=C1N CS-0284703 [1,1,0,0,0,0|2,0,0]=4 48 B11R1.157 CC(N)CC1=CC(O)=CC=C1 CS-0875034 [1,1,0,0,0,0|0,0,0]=2 49 B11R1.157 CN(C)CC1=NC=CC(N)=C1 CS-0224461 [1,1,0,0,0,0|2,0,0]=4 50 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 CS-0182200 [1,1,0,0,0,0|1,0,0]=3 51 B11R1.7 C#CC(C)(C)C1=CC=CC=C1 CS-B0616 [0,1,0,0,1,0|1,0,1]=4 52 B11R1.7 CC(N)(CN)C1=CC=CC=C1 CS-0240093 [0,1,0,0,1,0|2,0,0]=4 53 B11R1.7 CC(N)(CO)C1=CC=CC=C1 CS-0089923 [0,1,0,0,1,0|2,0,0]=4 54 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 CS-0151244 [0,1,0,0,1,0|0,0,0]=2 55 B11R1.22 CC(CO)C1=CC=C(F)C=C1 CS-0225766 [0,1,0,0,1,0|2,0,0]=4 56 B11R1.22 CC[C@@H](N)C1=CC=C(Cl)C=C1 CS-0372161 [0,1,0,0,1,0|2,0,0]=4 57 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 CS-0329629 [0,1,0,0,1,0|2,0,0]=4 58 B11R1.22 CN[C@H](C)C1=CC=C(Br)C=C1 CS-0597537 [0,1,0,0,1,0|0,0,0]=2 59 B11R1.222 COC(C)C1=CC=CC=C1N CS-0616718 [0,1,0,0,1,0|1,0,0]=3 60 B13R1.91 CCC(C)OC1=CC=CC=C1C=O CS-0313245 [0,2,0,0,0,0|2,0,0]=4 61 B11R2.20 C1=CC2=C(CCCC2)N=C1 CS-0173570 [1,0,0,1,0,0|2,0,0]=4 62 B11R2.10 CC1=CC2=CC=CC=C2C1 CS-W021717 [1,0,0,1,0,0|0,0,2]=4 63 B11R2.10 CC1CC2=CC=CC=C2O1 CS-W013370 [1,0,0,1,0,0|1,0,0]=3 64 B11R2.40 OC1(C2=CC=CC=C2)CC1 CS-0056020 [0,0,0,1,1,0|2,0,0]=4 65 B13R2.10 N[C@H]1CCN(C2=CC=CC=C2)C1 CS-0200442 [0,0,0,1,0,1|2,0,0]=4 66 B13R2.57 CCN1CCC2=C(C=CC=C2)C1 CS-1178819 [0,0,0,1,0,1|2,0,0]=4 67 B13R2.2383 C1=CC(OC[C@@H]2CCN2)=CN=C1 CS-0032983 [0,0,0,1,0,1|1,0,0]=3 68 B13R2.2383 C1=CC=C(CNC2COC2)C=C1 CS-0308889 [0,0,0,1,0,1|2,0,0]=4 69 B13R2.15 NC1CNCC1C2=CC=CC=C2 CS-0460277 [0,1,0,1,0,0|1,0,0]=3 70 B13R2.31 OC1CC(OC2=CC=CC=C2)C1 CS-0930648 [0,1,0,1,0,0|2,0,0]=4 71 B13R2.64 C1=CC=C(C[C@H]2CCCN2)C=C1 CS-0168797 [0,1,0,1,0,0|0,0,0]=2 72 B13R2.369 CC1NC2=C(C=CC=C2)NC1C CS-0122519 [0,1,0,1,0,0|2,0,0]=4 73 B13R2.3028 CC1CC2=C(C=C(F)C=C2)C1N CS-0644467 [0,1,0,1,0,0|2,0,0]=4 74 B13R2.3683 CC1=CC2=C(C=C1)NC(C)CC2 CS-0610511 [0,1,0,1,0,0|2,0,0]=4 75 B13R2.3683 NC1CCC2=CC(F)=CC=C2C1 CS-0340363 [0,1,0,1,0,0|2,0,0]=4 76 B13R2.155 NC1CCC2=CC=C(Br)C=C2C1 CS-0157266 [0,1,0,1,0,0|2,0,0]=4 77 B13R2.155 OC1=CC2=C(C=C1)CCC(O)C2 CS-0644228 [0,1,0,1,0,0|2,0,0]=4 78 B13R2.5190 CC1=NC2=C(C=CC(O)=C2)N1C CS-0240235 [0,1,0,1,0,0|1,0,1]=4 79 B13R2.5190 CN1C(=O)CC2=C1C=CC(Cl)=C2 CS-0654820 [0,1,0,1,0,0|1,0,1]=4 80 B13R2.162 NC1=CC=CC2=C1CC(O)CC2 CS-B0024 [0,1,0,1,0,0|2,0,0]=4 81 B9R1.6 CC(C)C1=NC=CC=N1 CS-0887722 [1,0,0,0,1,0|2,0,0]=4 82 B9R1.6 C[C@@H](Cl)C1=CC=CC=C1 CS-0851644 [1,0,0,0,1,0|1,0,0]=3 83 B9R1.6 C[C@@H](O)C1=CC=CN=C1 CS-0093784 [1,0,0,0,1,0|2,0,0]=4 84 B9R1.6 C[C@H](Cl)C1=CC=CC=C1 CS-0852321 [1,0,0,0,1,0|1,0,0]=3 85 B9R1.13 C[C@@H](N)CC1=CN=CN1 CS-W015657 [1,0,0,0,1,0|2,0,0]=4