0 B13R1.42 CCOC(=O)C#CC1=CN=CC=C1 AC6430 [0,0,0,0,0,0|1,0,2]=3 1 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 AC2306 [0,0,0,0,0,0|1,0,2]=3 2 B12R1.27 CCC(=O)NCC1=CC=CC=C1 Y13566 [1,0,0,0,0,0|1,0,1]=3 3 B12R1.27 COC(=O)C#CC1=NC=CC=C1 W12522 [1,0,0,0,0,0|1,0,2]=4 4 B12R1.27 COC(=O)CCC1=NC=CC=C1 AC5808 [1,0,0,0,0,0|1,0,2]=4 5 B12R1.27 COC(=O)NCC1=CC=CC=C1 C75727 [1,0,0,0,0,0|1,0,1]=3 6 B12R1.27 COC(=O)\C=C\C1=CN=CC=C1 N10425 [1,0,0,0,0,0|1,0,0]=2 7 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 A11325 [1,0,0,0,0,0|1,0,2]=4 8 B14R1.29 CCOC(=O)CC(=O)C1=NC=CN=C1 29911 [0,1,0,0,0,0|2,0,1]=4 9 B14R1.29 CCOC(=O)CN(C)C1=NC=CC=C1 AC3365 [0,1,0,0,0,0|2,0,1]=4 10 B14R1.29 CCOC(=O)C[C@H](N)C1=CN=CC=C1 46245 [0,1,0,0,0,0|1,0,2]=4 11 B14R1.29 CCOC(=O)C[C@H](N)C1=CN=CC=C1 46247 [0,1,0,0,0,0|1,0,2]=4 12 B14R1.32 CCNC(=O)\C=C\C1=CC=CC(Br)=C1 A12667 [0,1,0,0,0,0|1,0,0]=2 13 B14R1.32 CCOC(=O)CCC1=CC(C)=CC=C1 C11585 [0,1,0,0,0,0|0,0,2]=3 14 B14R1.32 CCOC(=O)CCC1=CC=CC(Br)=C1 AB7159 [0,1,0,0,0,0|0,0,2]=3 15 B14R1.32 CCOC(=O)CCC1=CC=CC(Cl)=C1 D84518 [0,1,0,0,0,0|0,0,2]=3 16 B14R1.32 CCOC(=O)CNC1=CC=CC(Br)=C1 F52118 [0,1,0,0,0,0|1,0,1]=3 17 B14R1.32 CCOC(=O)COC1=CC=CC(F)=C1 AC6808 [0,1,0,0,0,0|1,0,1]=3 18 B14R1.32 CCOC(=O)\C=C\C1=CC(N)=CC=C1 50749 [0,1,0,0,0,0|0,0,0]=1 19 B14R1.32 CCOC(=O)\C=C\C1=CC(O)=CC=C1 W15436 [0,1,0,0,0,0|0,0,0]=1 20 B14R1.32 CCOC(=O)\C=C\C1=CC=CC(Cl)=C1 A10035 [0,1,0,0,0,0|0,0,0]=1 21 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 Y12270 [0,1,0,0,0,0|0,0,2]=3 22 B14R1.60 CCOC(=O)[C@@H](O)CC1=CC=CC=C1 D97639 [0,1,0,0,0,0|0,0,2]=3 23 B14R1.156 CCCCC(=O)OCC1=CC=CC=C1 D81803 [0,1,0,0,0,0|2,0,1]=4 24 B14R1.156 O=C(CCCO)OCC1=CC=CC=C1 W16162 [0,1,0,0,0,0|2,0,1]=4 25 B14R1.502 CCOC(=O)C#CC1=CC=C(F)C=C1 84995 [0,1,0,0,0,0|0,0,2]=3 26 B14R1.502 CCOC(=O)CCC1=CC=C(Cl)C=C1 C10962 [0,1,0,0,0,0|0,0,2]=3 27 B14R1.502 CCOC(=O)CCC1=CC=C(N)C=C1 F20005 [0,1,0,0,0,0|0,0,2]=3 28 B14R1.502 CCOC(=O)COC1=CC=C(F)C=C1 W18870 [0,1,0,0,0,0|1,0,1]=3 29 B14R1.502 CCOC(=O)COC1=CC=C(O)C=C1 C11637 [0,1,0,0,0,0|1,0,1]=3 30 B14R1.502 CCOC(=O)\C=C\C1=CN=C(N)C=C1 Y11005 [0,1,0,0,0,0|1,0,0]=2 31 B14R1.598 CCOC(=O)CCC1=C(F)C=CC=N1 D79920 [0,1,0,0,0,0|1,0,2]=4 32 B14R1.598 CCOC(=O)CCC1=C(O)C=CC=C1 W18949 [0,1,0,0,0,0|0,0,2]=3 33 B14R1.598 CCOC(=O)COC1=C(O)C=CC=C1 F17454 [0,1,0,0,0,0|1,0,1]=3 34 B14R1.598 CCOC(=O)\C=C\C1=C(Cl)C=CC=C1 AB7167 [0,1,0,0,0,0|0,0,0]=1 35 B14R1.756 COC(=O)C(=O)\C=C\C1=CC=CC=C1 S11384 [0,1,0,0,0,0|2,0,0]=3 36 B14R1.818 CC(=O)CC(=O)\C=C\C1=CC=CC=C1 30085 [0,1,0,0,0,0|1,0,1]=3 37 B14R1.818 CC(C)NC(=O)CCC1=CC=CC=C1 W16282 [0,1,0,0,0,0|1,0,2]=4 38 B14R2.112 BrCCC1=CC2=CC=CC=C2C=C1 W17006 [0,0,0,1,0,0|3,0,0]=4 39 B14R2.112 NCCC1=NC2=CC=CC=C2C=C1 83238 [0,0,0,1,0,0|3,0,0]=4 40 B14R2.203 COC1=C(Br)C=CC2=CC=CC=C21 F21158 [0,0,0,1,0,0|3,0,0]=4 41 B14R2.203 COC1=C(C)C=CC2=CC=CC=C21 C72616 [0,0,0,1,0,0|3,0,0]=4 42 B14R2.598 CN1N=C(Br)C=C1C2=CC=CC=C2 C73394 [0,0,0,1,0,0|3,0,0]=4 43 B14R2.2899 O=C(OCC1=CC=CC=C1)N2CC2 58577 [0,0,0,1,0,0|2,0,1]=4 44 B12R1.32 CCOC(=O)CC1=NC=NC=C1 87620 [0,0,0,0,1,0|2,0,1]=4 45 B12R1.32 CCOC(=O)C[N+]1=CC=CC=C1 C73314 [0,0,0,0,1,0|1,0,1]=3 46 B12R1.32 CCOC(=O)NC1=CC=NC=C1 F21286 [0,0,0,0,1,0|2,0,0]=3 47 B12R1.32 COCC(=O)OC1=CC=CC=C1 AC8183 [0,0,0,0,1,0|3,0,0]=4 48 B12R1.32 O=C(CCBr)NC1=CC=CC=C1 W16421 [0,0,0,0,1,0|3,0,0]=4 49 B12R1.51 CCOC(=O)\C=C\C1=CNC=N1 F19956 [0,0,0,0,1,0|2,0,0]=3 50 B14R1.520 CCOC(=O)CNCC1=NC=CC=C1 T72721 [0,0,0,0,0,1|1,0,2]=4 51 B11R1.91 CC(=O)C#CC1=CC=CC=C1 F21355 [2,0,0,0,0,0|0,0,2]=4 52 B11R1.91 O=C(O)\C=C\C1=NC=CC=N1 P18972 [2,0,0,0,0,0|2,0,0]=4 53 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 W18616 [2,0,0,0,0,0|2,0,0]=4 54 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 D70623 [2,0,0,0,0,0|1,0,1]=4 55 B13R1.11 CNC(=O)CC(=O)C1=CC=CC=C1 32568 [1,1,0,0,0,0|1,0,1]=4 56 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 Y11662 [1,1,0,0,0,0|0,0,2]=4 57 B13R1.14 COC(=O)C#CC1=CC=C(F)C=C1 F15255 [1,1,0,0,0,0|0,0,2]=4 58 B13R1.14 COC(=O)CCC1=CC=C(C)C=C1 D87477 [1,1,0,0,0,0|0,0,2]=4 59 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 C74823 [1,1,0,0,0,0|0,0,2]=4 60 B13R1.14 COC(=O)CNC1=CC=C(O)C=C1 C14201 [1,1,0,0,0,0|1,0,1]=4 61 B13R1.14 COC(=O)COC1=CC=C(Cl)C=C1 C75289 [1,1,0,0,0,0|1,0,1]=4 62 B13R1.14 COC(=O)\C=C\C1=CN=C(Cl)C=C1 AB17911 [1,1,0,0,0,0|1,0,0]=3 63 B13R1.15 COC(=O)CCC1=CC(O)=CC=C1 Y10606 [1,1,0,0,0,0|0,0,2]=4 64 B13R1.15 COC(=O)CCC1=CC=CC(F)=C1 AB9718 [1,1,0,0,0,0|0,0,2]=4 65 B13R1.15 COC(=O)\C=C\C1=CC(C)=CC=C1 W11679 [1,1,0,0,0,0|0,0,0]=2 66 B13R1.15 COC(=O)\C=C\C1=CC(F)=CN=C1 W16643 [1,1,0,0,0,0|1,0,0]=3 67 B13R1.15 COC(=O)\C=C\C1=CC(O)=CC=C1 A11407 [1,1,0,0,0,0|0,0,0]=2 68 B13R1.135 C=C(CC1=CC=CC=C1)C(=O)OC 75430 [1,1,0,0,0,0|0,0,1]=3 69 B13R1.135 COC(=O)[C@@H](Br)CC1=CC=CC=C1 D97565 [1,1,0,0,0,0|0,0,2]=4 70 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 N12401 [1,1,0,0,0,0|0,0,2]=4 71 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 Y14681 [1,1,0,0,0,0|1,0,1]=4 72 B13R1.528 COC(=O)\C=C\C1=C(C)C=CC=C1 W11677 [1,1,0,0,0,0|0,0,0]=2 73 B13R1.528 COC(=O)\C=C\C1=C(F)C=CC=C1 W11676 [1,1,0,0,0,0|0,0,0]=2 74 B13R1.528 COC(=O)\C=C\C1=C(N)C=CC=C1 S10571 [1,1,0,0,0,0|0,0,0]=2 75 B13R1.19 CCNC(=O)NC1=CC=C(Br)C=C1 C12551 [0,1,0,0,1,0|2,0,0]=4 76 B13R1.19 CCOC(=O)CC1=CN=C(N)C=C1 C10026 [0,1,0,0,1,0|1,0,1]=4 77 B13R1.19 CCOC(=O)CC1=CN=C(O)C=C1 D80218 [0,1,0,0,1,0|1,0,1]=4 78 B13R1.19 CCOC(=O)CC1=NC=C(C)C=C1 12065 [0,1,0,0,1,0|1,0,1]=4 79 B13R1.19 CCOC(=O)CC1=NC=C(Cl)C=C1 89137 [0,1,0,0,1,0|1,0,1]=4 80 B13R1.19 CCOC(=O)CC1=NC=C(F)C=C1 52927 [0,1,0,0,1,0|1,0,1]=4 81 B13R1.19 CCOC(=O)CC1=NC=C(I)C=C1 P13442 [0,1,0,0,1,0|1,0,1]=4 82 B13R1.19 CCOC(=O)CC1=NC=C(N)C=C1 P12845 [0,1,0,0,1,0|1,0,1]=4 83 B13R1.19 CCOC(=O)CC1=NC=C(O)C=C1 37596 [0,1,0,0,1,0|1,0,1]=4 84 B13R1.19 CCOC(=O)NC1=CC=C(N)C=C1 D96066 [0,1,0,0,1,0|1,0,0]=3 85 B13R1.20 CCOC(=O)CC1=CC(Br)=CN=C1 69675 [0,1,0,0,1,0|1,0,1]=4 86 B13R1.20 CCOC(=O)CC1=CC(F)=CN=C1 39150 [0,1,0,0,1,0|1,0,1]=4 87 B13R1.20 CCOC(=O)CC1=CC=CC(Br)=N1 C77298 [0,1,0,0,1,0|1,0,1]=4 88 B13R1.20 CCOC(=O)CC1=NC(N)=CC=C1 24693 [0,1,0,0,1,0|1,0,1]=4 89 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 F31216 [0,1,0,0,1,0|1,0,1]=4 90 B13R1.47 CCOC(=O)C(=O)C1=CN=CC=C1 25920 [0,1,0,0,1,0|1,0,0]=3 91 B13R1.47 CCOC(=O)[C@H](Br)C1=NC=CC=C1 93370 [0,1,0,0,1,0|1,0,1]=4 92 B13R1.47 CCOC(=O)[C@H](C)C1=CC=CC=C1 F13478 [0,1,0,0,1,0|0,0,1]=3 93 B13R1.47 CCOC(=O)[C@H](N)C1=CC=NC=C1 32467 [0,1,0,0,1,0|1,0,1]=4 94 B13R1.47 CCOC(=O)[C@H](N)C1=CN=CC=C1 F14058 [0,1,0,0,1,0|1,0,1]=4 95 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CC=C1 32465 [0,1,0,0,1,0|1,0,1]=4 96 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CC=C1 61481 [0,1,0,0,1,0|1,0,1]=4 97 B13R1.348 C[C@H](Cl)OC(=O)OC1=CC=CC=C1 A12584 [0,1,0,0,1,0|1,0,0]=3 98 B13R1.470 CCOC(=O)CC1=C(Br)C=CC=N1 CK2612 [0,1,0,0,1,0|1,0,1]=4 99 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=C1 98391 [0,1,0,0,1,0|1,0,1]=4 100 B13R1.470 CCOC(=O)CC1=C(I)C=CC=N1 D93367 [0,1,0,0,1,0|1,0,1]=4 101 B13R1.470 CCOC(=O)CC1=C(N)C=CC=C1 AB11211 [0,1,0,0,1,0|0,0,1]=3 102 B13R1.470 CCOC(=O)CC1=C(N)C=CC=C1 AB21211 [0,1,0,0,1,0|0,0,1]=3 103 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl 37575 [0,1,0,0,1,0|1,0,1]=4 104 B13R1.470 CCOC(=O)CC1=NC=CC=C1N F18231 [0,1,0,0,1,0|1,0,1]=4 105 B13R1.33 CCOC(=O)CC(=O)C1=CC=CN1 C73261 [0,1,0,0,1,0|1,0,1]=4 106 B13R1.33 CCOC(=O)CC(=O)C1=CSC=C1 C13681 [0,1,0,0,1,0|1,0,1]=4 107 B13R1.41 CCOC(=O)\C=C\C1=CC(Br)=CS1 W15343 [0,1,0,0,1,0|1,0,0]=3 108 B13R1.41 CCOC(=O)\C=C\C1=CN(C)N=C1 W11609 [0,1,0,0,1,0|2,0,0]=4 109 B13R1.41 CCOC(=O)\C=C\C1=NOC(C)=C1 W18224 [0,1,0,0,1,0|2,0,0]=4 110 B15R1.89 CCOC(=O)CCC(=O)C1=CC=CC=C1 20538 [0,1,0,0,0,1|0,0,1]=3 111 B15R1.89 CCOC(=O)\C=N/[C@@H](C)C1=CC=CC=C1 C13156 [0,1,0,0,0,1|0,0,1]=3 112 B15R1.633 CCOC(=O)CCCC1=CC(O)=CC=C1 61952 [0,1,0,0,0,1|0,0,2]=4 113 B15R1.633 CCOC(=O)\C=C\OC1=CC(C)=CC=C1 W18061 [0,1,0,0,0,1|0,0,0]=2 114 B15R1.809 CCOC(=O)CC(=O)CC1=CC=CC=C1 82566 [0,1,0,0,0,1|0,0,1]=3 115 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(I)C=C1 35761 [0,2,0,0,0,0|0,0,1]=3 116 B15R1.23 CCOC(=O)CC(=O)C1=CN=C(C)C=C1 AB11356 [0,2,0,0,0,0|1,0,1]=4 117 B15R1.23 CCOC(=O)C[C@H](N)C1=CC=C(Cl)C=C1 Y11615 [0,2,0,0,0,0|0,0,2]=4 118 B15R1.23 CCOC(=O)C[C@H](N)C1=CC=C(I)C=C1 D85980 [0,2,0,0,0,0|0,0,2]=4 119 B15R1.23 CCOC(=O)C[S@](=O)C1=CC=C(Cl)C=C1 D85843 [0,2,0,0,0,0|1,0,1]=4 120 B15R1.24 CCOC(=O)CC(=O)C1=CC(Br)=CN=C1 W18914 [0,2,0,0,0,0|1,0,1]=4 121 B15R1.578 CCOC(=O)[C@@H](C)C(=O)C1=CC=CC=C1 F30065 [0,2,0,0,0,0|0,0,1]=3 122 B15R1.578 CCOC(=O)[C@H](O)[C@H](N)C1=CC=CC=C1 P18020 [0,2,0,0,0,0|0,0,2]=4 123 B15R1.49 CCOC(=O)C(=O)NC1=CC=CC(Cl)=C1 W18548 [0,2,0,0,0,0|1,0,0]=3 124 B15R1.3858 CCOC(=O)\C=C\C1=C(N)C=CC(Br)=C1 79496 [0,2,0,0,0,0|0,0,0]=2 125 B15R1.3858 CCOC(=O)\C=C\C1=CC(Br)=CN=C1N CL0042 [0,2,0,0,0,0|1,0,0]=3 126 B15R1.10389 CCOC(=O)\C=C\C1=CC(C#N)=CC=C1 W11608 [0,2,0,0,0,0|0,0,0]=2 127 B15R1.10389 CCOC(=O)\C=C\C1=CC(OC)=CC=C1 W11607 [0,2,0,0,0,0|0,0,0]=2 128 B15R1.10390 CCOC(=O)\C=C\C1=CC(F)=C(Br)C=C1 W11618 [0,2,0,0,0,0|0,0,0]=2 129 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(Br)C=C1 C11559 [0,2,0,0,0,0|1,0,0]=3 130 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(F)C=C1 W18454 [0,2,0,0,0,0|1,0,0]=3 131 B15R1.48 CCOC(=O)C(=O)NC1=NC=C(Cl)C=C1 12232 [0,2,0,0,0,0|2,0,0]=4 132 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(F)C=C1 Y10795 [0,2,0,0,0,0|0,0,2]=4 133 B15R1.5919 O=C(O)CNC(=O)\C=C\C1=CC=CC=C1 C11443 [0,2,0,0,0,0|1,0,1]=4 134 B15R1.791 CCOC(=O)COC1=C(Cl)C=C(Br)C=C1 W10429 [0,2,0,0,0,0|1,0,1]=4 135 B15R1.791 CCOC(=O)\C=C\C1=C(F)C=C(O)C=C1 W10678 [0,2,0,0,0,0|0,0,0]=2 136 B15R1.793 CCOC(=O)CCC1=CC=C(C#N)C=C1 20794 [0,2,0,0,0,0|0,0,2]=4 137 B15R1.793 CCOC(=O)CCC1=CC=C(CO)C=C1 S10348 [0,2,0,0,0,0|0,0,2]=4 138 B15R1.1001 COC(=O)C(=O)\C=C\C1=CC=C(Br)C=C1 C75844 [0,2,0,0,0,0|2,0,0]=4 139 B15R1.768 CCOC(=O)COC1=C(C#N)C=CC=C1 AC7704 [0,2,0,0,0,0|1,0,1]=4 140 B15R1.768 CCOC(=O)\C=C\C1=C(C#N)C=CC=C1 W11632 [0,2,0,0,0,0|0,0,0]=2 141 B15R1.36731 CCOC(=O)CCC1=C(Br)C=CC=C1Cl 66294 [0,2,0,0,0,0|0,0,2]=4 142 B15R1.36731 CCOC(=O)\C=C\C1=C(Br)C=CC=C1O E70227 [0,2,0,0,0,0|0,0,0]=2 143 B15R1.3465 CC(C)(C)OC(=O)\C=C\C1=NC=CC=C1 W12163 [0,2,0,0,0,0|1,0,0]=3 144 B13R1.464 CCOC(=O)C1=C(CBr)C=CC=C1 F11922 [0,0,1,1,0,0|1,0,1]=4 145 B13R1.361 C=CCC1=CC=C(C(=O)OCC)S1 D86205 [0,0,1,1,0,0|1,0,1]=4 146 B13R1.460 C=CC1=CC=CC(C(=O)OCC)=C1 F14502 [0,0,1,1,0,0|0,0,0]=2 147 B13R1.460 CCOC(=O)C1=CC(C=O)=NC=C1 60946 [0,0,1,1,0,0|2,0,0]=4 148 B13R1.460 CCOC(=O)C1=NC=CC(C=O)=C1 D94597 [0,0,1,1,0,0|2,0,0]=4 149 B13R1.446 CCOC(=O)C1=C(F)C=CC(I)=C1 C13331 [0,0,1,1,0,0|2,0,0]=4 150 B13R1.446 CCOC(=O)C1=C(I)C=CC(Br)=C1 88899 [0,0,1,1,0,0|2,0,0]=4 151 B13R1.446 CCOC(=O)C1=C(I)C=CC(C)=C1 88035 [0,0,1,1,0,0|1,0,1]=4 152 B13R1.446 CCOC(=O)C1=C(N)C=CC(F)=C1 C13859 [0,0,1,1,0,0|2,0,0]=4 153 B13R1.446 CCOC(=O)C1=C(O)C=CC(Cl)=C1 D84516 [0,0,1,1,0,0|2,0,0]=4 154 B13R1.446 CCOC(=O)C1=C(O)C=CC(I)=C1 I11795 [0,0,1,1,0,0|2,0,0]=4 155 B13R2.1613 CCC1=C2N=CC=CC2=CC=C1 AB10152 [1,0,0,1,0,0|2,0,0]=4 156 B13R2.10 ClC1=CC(C2=CC=CC=C2)=NO1 C74725 [1,0,0,1,0,0|2,0,0]=4 157 B13R2.10 O=C1CC[C@@H](C2=CC=CC=C2)N1 P18707 [1,0,0,1,0,0|1,0,1]=4 158 B13R2.10 O=C1CC[C@H](C2=CC=CC=C2)C1 53458 [1,0,0,1,0,0|0,0,2]=4 159 B13R2.10 O=C1CC[C@H](C2=CC=CC=C2)C1 94449 [1,0,0,1,0,0|0,0,2]=4 160 B13R2.57 COC1=CC2=NC=CC=C2C=C1 31891 [1,0,0,1,0,0|2,0,0]=4 161 B13R2.57 COC1=NC2=CC=CC=C2C=C1 W11244 [1,0,0,1,0,0|1,0,0]=3 162 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 S11826 [1,0,0,1,0,0|2,0,0]=4 163 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 78918 [1,0,0,1,0,0|2,0,0]=4 164 B13R2.57 OCC1=NC2=CC=CC=C2C=C1 BL002914 [1,0,0,1,0,0|2,0,0]=4 165 B13R2.163 O=C1NCCC2=C(C=CC=C2)N1 F21129 [0,0,0,1,1,0|2,0,0]=4 166 B15R2.73 CCOC(=O)C1=C2C=CC=CN2C=N1 61982 [0,0,0,1,0,1|1,0,0]=3 167 B15R2.73 CCOC(=O)C1=C2C=NC=CN2C=N1 F14109 [0,0,0,1,0,1|2,0,0]=4 168 B15R2.73 CCOC(=O)C1=C2C=NC=CN2N=C1 84714 [0,0,0,1,0,1|2,0,0]=4 169 B15R2.73 CCOC(=O)C1=CN=C2C=NC=CN12 W14881 [0,0,0,1,0,1|2,0,0]=4 170 B15R2.73 CCOC(=O)C1=CNC2=C1C=CN=C2 C76111 [0,0,0,1,0,1|1,0,0]=3 171 B15R2.73 CCOC(=O)C1=NN=C2C=CC=CN21 W12754 [0,0,0,1,0,1|2,0,0]=4 172 B15R2.73 CCOC(=O)C1=NNC2=C1C=CN=C2 P10919 [0,0,0,1,0,1|2,0,0]=4 173 B15R2.73 CCOC(=O)C1=NNC2=CC=CN=C21 37459 [0,0,0,1,0,1|2,0,0]=4 174 B15R2.73 CCOC(=O)C1=NOC2=C1C=CC=C2 61596 [0,0,0,1,0,1|1,0,0]=3 175 B15R2.1342 CCOC(=O)[C@@H]1C[C@@H]1C2=CC=CC=C2 P20717 [0,0,0,1,0,1|0,0,2]=4 176 B15R2.395 O=C1CCCN1C(=O)C2=CC=CC=C2 75171 [0,1,0,1,0,0|2,0,0]=4 177 B15R2.1290 CCOC1=CC2=C(O)C=CN=C2C=C1 N16917 [0,1,0,1,0,0|2,0,0]=4 178 B15R2.10252 CCOC1=CC2=CC=C(N)C=C2C=C1 F17462 [0,1,0,1,0,0|1,0,0]=3 179 B15R2.10252 CCOC1=CC=C2C=C(Br)C=CC2=N1 D84758 [0,1,0,1,0,0|1,0,0]=3 180 B15R2.10252 CCOC1=CC=C2C=C(Br)C=NC2=C1 K10021 [0,1,0,1,0,0|2,0,0]=4 181 B15R2.1356 CCOC(=O)C1=CC2=C(N=CC=C2)N1 SC3721 [0,1,0,1,0,0|1,0,0]=3 182 B15R2.1356 CCOC(=O)C1=CN2C=CN=CC2=N1 24829 [0,1,0,1,0,0|2,0,0]=4 183 B15R2.1356 CCOC(=O)C1=NN2C=CC=CC2=C1 F53432 [0,1,0,1,0,0|1,0,0]=3 184 B15R2.1356 CCOC(=O)C1=NN2C=CC=CC2=N1 C10018 [0,1,0,1,0,0|2,0,0]=4 185 B15R2.1356 CCOC(=O)C1=NN2C=CC=NC2=C1 80123 [0,1,0,1,0,0|2,0,0]=4 186 B15R2.352 CCCCC1=CC2=CC=CC=C2C=C1 73799 [0,1,0,1,0,0|2,0,0]=4 187 B15R2.1282 CCOC1=CC=C2C=CC(Br)=CC2=N1 D82702 [0,1,0,1,0,0|1,0,0]=3 188 B15R2.1601 CCC(=O)C1=CC2=CC=CC=C2C=C1 Y11687 [0,1,0,1,0,0|2,0,0]=4 189 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 N10725 [0,1,0,1,0,0|2,0,0]=4 190 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 N10727 [0,1,0,1,0,0|2,0,0]=4 191 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 Y11453 [0,1,0,1,0,0|2,0,0]=4 192 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 Y12038 [0,1,0,1,0,0|2,0,0]=4 193 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 Y12599 [0,1,0,1,0,0|2,0,0]=4 194 B15R2.1668 FC(F)OC1=CC2=CC=CC=C2C=C1 S10100 [0,1,0,1,0,0|2,0,0]=4 195 B15R2.2115 COC1=C(C=O)C=CC2=CC=CC=C21 70990 [0,1,0,1,0,0|2,0,0]=4 196 B15R3.2009 O=C1N[C@@H]2C3=C(C=CC=C3)C[C@@H]2O1 AC8176 [0,0,0,2,0,0|1,0,1]=4 197 B11R1.40 CNC(=O)OC1=CC=CC=C1 C10489 [1,0,0,0,1,0|2,0,0]=4 198 B11R1.40 COC(=O)CC1=CN=CC=C1 31754 [1,0,0,0,1,0|1,0,1]=4 199 B11R1.40 NCC(=O)CC1=CC=CC=C1 A10565 [1,0,0,0,1,0|1,0,1]=4 200 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22065 [1,0,0,0,1,0|2,0,0]=4 201 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22066 [1,0,0,0,1,0|2,0,0]=4 202 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Y10931 [1,0,0,0,1,0|1,0,1]=4 203 B11R1.40 O=C(CO)NC1=CC=CC=C1 C77599 [1,0,0,0,1,0|2,0,0]=4 204 B11R1.16 CCCC(=O)C1=CN=CC=C1 N12405 [0,0,0,0,2,0|2,0,0]=4 205 B11R1.16 CCCC(=O)C1=NC=CC=C1 55420 [0,0,0,0,2,0|2,0,0]=4 206 B11R1.16 CONC(=O)C1=CC=CC=C1 W17974 [0,0,0,0,2,0|2,0,0]=4 207 B11R1.16 O=C(CCO)C1=CC=CC=C1 A11168 [0,0,0,0,2,0|2,0,0]=4 208 B15R1.778 CCOC(=O)\C=C\OCC1=CC=CC=C1 W16261 [0,0,0,0,0,2|0,0,0]=2