0 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 27901 [0,0,0,0,0,0|2,0,1]=3 1 B13R1.348 CC(C)=CC(=O)NC1=CC=CC=C1 C91653 [0,0,0,0,0,0|2,0,1]=3 2 B13R1.348 CN(C)C[C@@H](N)CC1=CC=CC=C1 53132 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.348 C[C@H](Cl)OC(=O)OC1=CC=CC=C1 A12584 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.32 CCOC(=O)CC1=NC=NC=C1 87620 [1,0,0,0,0,0|2,0,0]=3 5 B12R1.32 CCOC(=O)C[N+]1=CC=CC=C1 C73314 [1,0,0,0,0,0|1,0,0]=2 6 B12R1.32 CCOC(=O)NC1=CC=NC=C1 F21286 [1,0,0,0,0,0|2,0,0]=3 7 B12R1.32 COCC(=O)OC1=CC=CC=C1 AC8183 [1,0,0,0,0,0|3,0,0]=4 8 B12R1.32 O=C(CCBr)NC1=CC=CC=C1 W16421 [1,0,0,0,0,0|3,0,0]=4 9 B14R1.433 CC(C)(C)OC(=O)NC1=CN=NC=C1 24424 [0,1,0,0,0,0|3,0,0]=4 10 B14R2.598 O=C1C[C@H](C2=CC=CC=C2)C(=O)O1 86146 [0,0,0,1,0,0|1,0,1]=3 11 B14R2.642 CC(C)N1C(Cl)=NC2=C1C=CC=C2 D82881 [0,0,0,1,0,0|3,0,0]=4 12 B14R2.642 CC(C)[C@@H]1C(=O)NC2=C1C=CC=C2 W18023 [0,0,0,1,0,0|2,0,0]=3 13 B12R1.43 CN(C)C(=O)NC1=CC=CC=C1 F10253 [0,0,0,0,1,0|2,0,0]=3 14 B12R1.43 C[C@H](N)C(=O)CC1=CC=CC=C1 D80885 [0,0,0,0,1,0|1,0,0]=2 15 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 20111 [0,0,0,0,1,0|2,0,1]=4 16 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 20113 [0,0,0,0,1,0|2,0,1]=4 17 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 Y11320 [0,0,0,0,1,0|2,0,1]=4 18 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 Y11540 [0,0,0,0,1,0|2,0,1]=4 19 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 Y11782 [0,0,0,0,1,0|2,0,1]=4 20 B14R1.818 CC(C)NC(=O)CCC1=CC=CC=C1 W16282 [0,0,0,0,0,1|1,0,0]=2 21 B11R1.40 CNC(=O)CC1=CN=CC=C1 C71252 [2,0,0,0,0,0|2,0,0]=4 22 B11R1.40 CNC(=O)OC1=CC=CC=C1 C10489 [2,0,0,0,0,0|2,0,0]=4 23 B11R1.40 COC(=O)CC1=CN=CC=C1 31754 [2,0,0,0,0,0|1,0,0]=3 24 B11R1.40 COC(=O)CC1=NC=NC=C1 P11690 [2,0,0,0,0,0|2,0,0]=4 25 B11R1.40 NCC(=O)CC1=CC=CC=C1 A10565 [2,0,0,0,0,0|1,0,0]=3 26 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22065 [2,0,0,0,0,0|2,0,0]=4 27 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22066 [2,0,0,0,0,0|2,0,0]=4 28 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Y10931 [2,0,0,0,0,0|1,0,0]=3 29 B11R1.40 O=C(CO)NC1=CC=CC=C1 C77599 [2,0,0,0,0,0|2,0,0]=4 30 B13R1.19 CCNC(=O)NC1=CC=C(Br)C=C1 C12551 [1,1,0,0,0,0|2,0,0]=4 31 B13R1.19 CCOC(=O)CC1=CN=C(Br)C=N1 P20825 [1,1,0,0,0,0|2,0,0]=4 32 B13R1.19 CCOC(=O)CC1=CN=C(Cl)N=C1 P12370 [1,1,0,0,0,0|2,0,0]=4 33 B13R1.19 CCOC(=O)CC1=CN=C(N)C=C1 C10026 [1,1,0,0,0,0|1,0,0]=3 34 B13R1.19 CCOC(=O)CC1=CN=C(O)C=C1 D80218 [1,1,0,0,0,0|1,0,0]=3 35 B13R1.19 CCOC(=O)CC1=NC=C(C)C=C1 12065 [1,1,0,0,0,0|1,0,0]=3 36 B13R1.19 CCOC(=O)CC1=NC=C(Cl)C=C1 89137 [1,1,0,0,0,0|1,0,0]=3 37 B13R1.19 CCOC(=O)CC1=NC=C(F)C=C1 52927 [1,1,0,0,0,0|1,0,0]=3 38 B13R1.19 CCOC(=O)CC1=NC=C(I)C=C1 P13442 [1,1,0,0,0,0|1,0,0]=3 39 B13R1.19 CCOC(=O)CC1=NC=C(N)C=C1 P12845 [1,1,0,0,0,0|1,0,0]=3 40 B13R1.19 CCOC(=O)CC1=NC=C(N)C=N1 AC2279 [1,1,0,0,0,0|2,0,0]=4 41 B13R1.19 CCOC(=O)CC1=NC=C(O)C=C1 37596 [1,1,0,0,0,0|1,0,0]=3 42 B13R1.19 CCOC(=O)CC1=NN=C(Cl)C=C1 P10834 [1,1,0,0,0,0|2,0,0]=4 43 B13R1.19 CCOC(=O)CC1=NNC(=O)C=C1 D86639 [1,1,0,0,0,0|2,0,0]=4 44 B13R1.19 CCOC(=O)NC1=CC=C(N)C=C1 D96066 [1,1,0,0,0,0|1,0,0]=3 45 B13R1.20 CCOC(=O)CC1=CC(Br)=CN=C1 69675 [1,1,0,0,0,0|1,0,0]=3 46 B13R1.20 CCOC(=O)CC1=CC(F)=CN=C1 39150 [1,1,0,0,0,0|1,0,0]=3 47 B13R1.20 CCOC(=O)CC1=CC=CC(Br)=N1 C77298 [1,1,0,0,0,0|1,0,0]=3 48 B13R1.20 CCOC(=O)CC1=CN=CC(Cl)=N1 AT19767 [1,1,0,0,0,0|2,0,0]=4 49 B13R1.20 CCOC(=O)CC1=NC(N)=CC=C1 24693 [1,1,0,0,0,0|1,0,0]=3 50 B13R1.20 CCOC(=O)CC1=NC(N)=NC=C1 82815 [1,1,0,0,0,0|2,0,0]=4 51 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 F31216 [1,1,0,0,0,0|1,0,0]=3 52 B13R1.44 CCCOC(=O)CC1=CC=CC=C1 A12538 [1,1,0,0,0,0|0,0,0]=2 53 B13R1.47 CCOC(=O)C(=O)C1=CN=CC=C1 25920 [1,1,0,0,0,0|1,0,1]=4 54 B13R1.47 CCOC(=O)[C@H](Br)C1=NC=CC=C1 93370 [1,1,0,0,0,0|1,0,0]=3 55 B13R1.47 CCOC(=O)[C@H](C)C1=CC=CC=C1 F13478 [1,1,0,0,0,0|0,0,0]=2 56 B13R1.47 CCOC(=O)[C@H](N)C1=CC=NC=C1 32467 [1,1,0,0,0,0|1,0,0]=3 57 B13R1.47 CCOC(=O)[C@H](N)C1=CN=CC=C1 F14058 [1,1,0,0,0,0|1,0,0]=3 58 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CC=C1 32465 [1,1,0,0,0,0|1,0,0]=3 59 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CC=C1 61481 [1,1,0,0,0,0|1,0,0]=3 60 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CN=C1 66424 [1,1,0,0,0,0|2,0,0]=4 61 B13R1.470 CCOC(=O)CC1=C(Br)C=CC=N1 CK2612 [1,1,0,0,0,0|1,0,0]=3 62 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=C1 98391 [1,1,0,0,0,0|1,0,0]=3 63 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=N1 D82269 [1,1,0,0,0,0|2,0,0]=4 64 B13R1.470 CCOC(=O)CC1=C(I)C=CC=N1 D93367 [1,1,0,0,0,0|1,0,0]=3 65 B13R1.470 CCOC(=O)CC1=C(N)C=CC=C1 AB11211 [1,1,0,0,0,0|0,0,0]=2 66 B13R1.470 CCOC(=O)CC1=C(N)C=CC=C1 AB21211 [1,1,0,0,0,0|0,0,0]=2 67 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl 37575 [1,1,0,0,0,0|1,0,0]=3 68 B13R1.470 CCOC(=O)CC1=NC=CC=C1N F18231 [1,1,0,0,0,0|1,0,0]=3 69 B13R1.470 CCOC(=O)CC1=NC=CN=C1Cl AC7235 [1,1,0,0,0,0|2,0,0]=4 70 B13R1.718 C[C@@H](CN)CNCC1=CC=CC=C1 T70173 [1,1,0,0,0,0|2,0,0]=4 71 B13R1.133 CC(C)C(=O)CC1=CC=C(F)C=C1 N12781 [0,1,0,0,1,0|0,0,0]=2 72 B13R1.133 CC(C)C(=O)NC1=CC=C(Br)C=C1 A12789 [0,1,0,0,1,0|1,0,0]=3 73 B13R1.133 CC(C)[C@@H](O)CC1=CC=C(Cl)C=C1 A12512 [0,1,0,0,1,0|0,0,2]=4 74 B13R1.133 CN(C)C(=O)CC1=CC=C(N)C=C1 L10071 [0,1,0,0,1,0|1,0,0]=3 75 B13R1.148 CN(C)C(=O)OC1=CC(N)=CC=C1 C73781 [0,1,0,0,1,0|2,0,0]=4 76 B13R1.152 CN(C)C(=O)[C@H](N)C1=CC=CC=C1 C12625 [0,1,0,0,1,0|1,0,0]=3 77 B13R1.152 CN(C)C(=O)[C@H](O)C1=CC=CC=C1 C73823 [0,1,0,0,1,0|1,0,0]=3 78 B13R1.201 CC(C)CC(=O)C1=C(Cl)C=CC=C1 F10466 [0,1,0,0,1,0|1,0,0]=3 79 B15R1.111 CC(=O)OCC(=O)CC1=CC=C(Cl)C=C1 C13053 [0,1,0,0,0,1|1,0,1]=4 80 B15R1.111 CC(C)COC(=O)NC1=CC=C(I)C=C1 W13120 [0,1,0,0,0,1|1,0,0]=3 81 B15R1.741 C#C[C@H](C)NC(=O)OCC1=CC=CC=C1 D86372 [0,1,0,0,0,1|1,0,1]=4 82 B15R1.741 C#C[C@H](C)NC(=O)OCC1=CC=CC=C1 D86374 [0,1,0,0,0,1|1,0,1]=4 83 B15R1.741 C[C@@H](C#N)NC(=O)OCC1=CC=CC=C1 I11774 [0,1,0,0,0,1|1,0,1]=4 84 B15R1.741 C[C@@H](CN)NC(=O)OCC1=CC=CC=C1 I11642 [0,1,0,0,0,1|1,0,0]=3 85 B15R1.741 C[C@@H](CO)NC(=O)OCC1=CC=CC=C1 AB10098 [0,1,0,0,0,1|1,0,0]=3 86 B15R1.3465 CC(C)(C)OC(=O)\C=C\C1=NC=CC=C1 W12163 [0,1,0,0,0,1|1,0,1]=4 87 B15R1.3678 C[C@@H](O)[C@H](N)C(=O)OCC1=CC=CC=C1 T72913 [0,1,0,0,0,1|2,0,0]=4 88 B15R1.5336 CN(C)\C=C(/C=O)OCC1=CC=CC=C1 W17071 [0,1,0,0,0,1|2,0,0]=4 89 B15R1.5802 CC(C)(C)NC(=O)CC1=CC=CN=C1Cl P16741 [0,2,0,0,0,0|2,0,0]=4 90 B15R1.5802 CC(C)(C)OC(=O)CC1=C(O)C=CC=C1 92647 [0,2,0,0,0,0|0,0,0]=2 91 B15R1.5802 CC(C)(C)OC(=O)NC1=C(Br)C=CC=N1 W10497 [0,2,0,0,0,0|2,0,0]=4 92 B15R1.5802 CC(C)(C)OC(=O)NC1=C(Br)C=CN=C1 21072 [0,2,0,0,0,0|2,0,0]=4 93 B15R1.5802 CC(C)(C)OC(=O)NC1=C(I)C=CN=C1 F14805 [0,2,0,0,0,0|2,0,0]=4 94 B15R1.5802 CC(C)(C)OC(=O)NC1=C(S)C=NC=C1 C74885 [0,2,0,0,0,0|2,0,0]=4 95 B15R1.5802 CC(C)(C)OC(=O)NC1=NC=CC=C1O C10332 [0,2,0,0,0,0|2,0,0]=4 96 B15R1.5802 CC1=C(NC(=O)OC(C)(C)C)C=CC=C1 FD7306 [0,2,0,0,0,0|1,0,0]=3 97 B15R1.5802 CC1=C(NC(=O)OC(C)(C)C)C=CC=N1 O12089 [0,2,0,0,0,0|2,0,0]=4 98 B15R1.5802 CC1=C(NC(=O)OC(C)(C)C)C=NC=C1 AB8788 [0,2,0,0,0,0|2,0,0]=4 99 B15R1.3977 CC(C)(C)OC(=O)[C@H](Br)C1=CC=CC=C1 D85979 [0,2,0,0,0,0|0,0,0]=2 100 B15R1.3977 CC(C)(C)OC(=O)[C@H](N)C1=CC=CC=C1 C75526 [0,2,0,0,0,0|0,0,0]=2 101 B15R1.913 CC(C)(C)OC(=O)CC1=CC=C(F)C=C1 20802 [0,2,0,0,0,0|0,0,0]=2 102 B15R1.913 CC(C)(C)OC(=O)CC1=CC=C(N)C=C1 C11000 [0,2,0,0,0,0|0,0,0]=2 103 B15R1.913 CC(C)(C)OC(=O)CC1=NC=C(Br)C=N1 C71383 [0,2,0,0,0,0|2,0,0]=4 104 B15R1.913 CC(C)(C)OC(=O)NC1=CNC(=O)C=C1 37922 [0,2,0,0,0,0|2,0,0]=4 105 B15R1.913 CC(C)(C)OC(=O)SC1=CC=C(N)C=C1 A50862 [0,2,0,0,0,0|1,0,0]=3 106 B15R1.913 CC1=NC=C(NC(=O)OC(C)(C)C)C=C1 79584 [0,2,0,0,0,0|2,0,0]=4 107 B15R1.8303 CC(C)(C)OC(=O)CC1=CC=CC(Br)=C1 O12103 [0,2,0,0,0,0|0,0,0]=2 108 B15R1.8303 CC(C)(C)OC(=O)CC1=CN=CC(Cl)=N1 79483 [0,2,0,0,0,0|2,0,0]=4 109 B15R1.8303 CC(C)(C)OC(=O)CC1=NC=CC(Br)=C1 C72115 [0,2,0,0,0,0|1,0,0]=3 110 B15R1.8303 CC(C)(C)OC(=O)NC1=CC(=O)NC=C1 38528 [0,2,0,0,0,0|2,0,0]=4 111 B15R1.8303 CC(C)(C)OC(=O)NC1=CC(I)=CN=C1 26209 [0,2,0,0,0,0|2,0,0]=4 112 B15R1.8303 CC(C)(C)OC(=O)NC1=CC(N)=NC=C1 Y10742 [0,2,0,0,0,0|2,0,0]=4 113 B15R1.8303 CC(C)(C)OC(=O)NC1=CN=CC(O)=C1 W15850 [0,2,0,0,0,0|2,0,0]=4 114 B15R1.8303 CC(C)(C)OC(=O)NC1=NC=CC(O)=C1 21217 [0,2,0,0,0,0|2,0,0]=4 115 B15R1.8303 CC1=CC(NC(=O)OC(C)(C)C)=CN=C1 W12415 [0,2,0,0,0,0|2,0,0]=4 116 B15R1.8303 CC1=CC(NC(=O)OC(C)(C)C)=NC=C1 AB2749 [0,2,0,0,0,0|2,0,0]=4 117 B13R2.15 O=C1NCCN1C2=CC=CC=C2 78651 [1,0,0,1,0,0|2,0,0]=4 118 B13R2.15 O=C1NCC[C@@H]1C2=CC=CC=C2 P19899 [1,0,0,1,0,0|1,0,0]=3 119 B13R2.163 O=C1CCOC2=C(C=CC=C2)C1 P11804 [1,0,0,1,0,0|2,0,0]=4 120 B13R2.163 O=C1NCCC2=C(C=CC=C2)N1 F21129 [1,0,0,1,0,0|2,0,0]=4 121 B13R2.359 CC1(C)C(=O)NC2=C1C=CC=N2 68462 [0,0,0,1,1,0|2,0,0]=4 122 B13R2.369 C[C@@H]1NC2=C(C=CC=C2)NC1=O 38076 [0,0,0,1,1,0|2,0,0]=4 123 B13R2.369 N[C@H]1CC2=C(C=CC=C2)NC1=O FD7388 [0,0,0,1,1,0|2,0,0]=4 124 B13R2.369 O=C1NC2=C(C=CC=C2)C[C@@H]1O W17609 [0,0,0,1,1,0|2,0,0]=4 125 B13R2.3080 CC1(C)[C@@H](N)[C@@H]1C2=CC=CC=C2 C13591 [0,0,0,1,1,0|1,0,1]=4 126 B13R2.690 O=C(CC1CC1)C2=CC=CC=C2 72374 [0,0,0,1,1,0|1,0,0]=3 127 B13R2.690 O=C(NC1CC1)C2=CC=NC=C2 W13162 [0,0,0,1,1,0|2,0,0]=4 128 B13R2.12159 CC1(C)NC(=O)C2=C1C=CC=C2 37674 [0,0,0,1,1,0|1,0,0]=3 129 B13R2.12159 CC1=CC(C)(C)C2=C1C=CC=C2 D93282 [0,0,0,1,1,0|2,0,0]=4 130 B15R2.325 N[C@H]1CC(=O)N(CC2=CC=CC=C2)C1 Y11670 [0,0,0,1,0,1|2,0,0]=4 131 B15R2.325 O=C1C[C@H](O)CN1CC2=CC=CC=C2 55381 [0,0,0,1,0,1|2,0,0]=4 132 B15R2.24494 O=C(CC1CC1)OCC2=CC=CC=C2 W11717 [0,0,0,1,0,1|1,0,0]=3 133 B15R2.61354 CC1(C)CC(=O)NC2=C(Br)C=CC=C21 D72050 [0,1,0,1,0,0|2,0,0]=4 134 B15R2.994 CC(C)(C)N1C(=O)CC2=C1N=CC=C2 P18394 [0,1,0,1,0,0|2,0,0]=4 135 B15R2.7491 CC1(C)OC(=O)NC2=C1C=CC(Br)=C2 C71967 [0,1,0,1,0,0|1,0,0]=3 136 B15R3.656 O=C1NC2=C(C=CC=C2)N1C3CC3 F20216 [0,0,0,2,0,0|2,0,0]=4 137 B11R1.16 CCCC(=O)C1=CN=CC=C1 N12405 [1,0,0,0,1,0|2,0,0]=4 138 B11R1.16 CCCC(=O)C1=NC=CC=C1 55420 [1,0,0,0,1,0|2,0,0]=4 139 B11R1.16 CONC(=O)C1=CC=CC=C1 W17974 [1,0,0,0,1,0|2,0,0]=4 140 B11R1.16 O=C(CCO)C1=CC=CC=C1 A11168 [1,0,0,0,1,0|2,0,0]=4 141 B11R1.30 CCOC(=O)CC1=CSC=N1 31608 [1,0,0,0,1,0|2,0,0]=4 142 B11R1.30 CCOC(=O)CC1=NNC=C1 F12966 [1,0,0,0,1,0|2,0,0]=4 143 B11R1.30 CCOC(=O)CN1C=CC=N1 W10260 [1,0,0,0,1,0|2,0,0]=4 144 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Y11691 [1,0,0,0,1,0|1,0,1]=4 145 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 74050 [0,0,0,0,2,0|1,0,1]=4 146 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 F16904 [0,0,0,0,2,0|1,0,1]=4 147 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 Y11074 [0,0,0,0,2,0|1,0,1]=4 148 B11R1.36 C[C@H](F)C(=O)C1=CC=CC=C1 C10603 [0,0,0,0,2,0|1,0,0]=3 149 B13R1.42 CCOC(=O)C#CC1=CN=CC=C1 AC6430 [1,0,0,0,0,1|1,0,1]=4 150 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 AC2306 [1,0,0,0,0,1|1,0,0]=3