0 B13R1.42 C(C)OC(COC1=CC=CN=C1)=O AK-37073 [0,0,0,0,0,0|2,0,1]=3 1 B13R1.42 CCOC(=O)C=CC1=CC=NC=C1 AK-49599 [0,0,0,0,0,0|1,0,0]=1 2 B13R1.42 NCCC(OCC1=CC=CC=C1)=O AK-81294 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.27 C1=C(CCC(OC)=O)C=CC=C1 AK-41212 [1,0,0,0,0,0|0,0,2]=3 4 B12R1.27 O=C(CCC1=CC=CC=C1)CBr AK-40603 [1,0,0,0,0,0|1,0,2]=4 5 B12R1.27 O=C(OC)COC1=CC=CC=C1 AK139324 [1,0,0,0,0,0|1,0,1]=3 6 B12R1.27 O=C(OC)\C=C\C1=CC=CC=C1 AK-93451 [1,0,0,0,0,0|0,0,0]=1 7 B12R1.27 O=C(OCC1=CC=CC=C1)CBr AK-77490 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.27 O=C(OCC1=CC=CC=C1)CN AK-41495 [1,0,0,0,0,0|2,0,1]=4 9 B12R1.27 O=C(OCC1=CC=CC=C1)CN AK-45583 [1,0,0,0,0,0|2,0,1]=4 10 B12R1.27 O=C(OCC1=CC=CC=C1)CO AK117482 [1,0,0,0,0,0|2,0,1]=4 11 B14R1.29 CCOC(=O)CC(N)C1=CC=CC=C1 AK-43947 [0,1,0,0,0,0|0,0,2]=3 12 B14R1.29 O=C(OCC)CC(C1=CC=CC=C1)=O AK-72988 [0,1,0,0,0,0|0,0,1]=2 13 B14R1.29 O=C(OCC)CC(C1=CC=NC=C1)=O AK-23981 [0,1,0,0,0,0|1,0,1]=3 14 B14R1.29 O=C(OCC)CC(C1=NC=CC=C1)=O AK-39258 [0,1,0,0,0,0|1,0,1]=3 15 B14R1.29 O=C(OCC)CC(N)C1=CC=CN=C1 AK-82823 [0,1,0,0,0,0|1,0,2]=4 16 B14R1.29 O=C(OCC)CC(O)C1=CC=CC=C1 AK-82824 [0,1,0,0,0,0|0,0,2]=3 17 B14R1.29 O=C(OCC)C[C@H](N)C1=CC=CC=C1 AK-60005 [0,1,0,0,0,0|0,0,2]=3 18 B14R1.32 O=C(OCC)CNC1=CC=CC(Br)=C1 AK312747 [0,1,0,0,0,0|1,0,1]=3 19 B14R1.60 N[C@@H](CC1=CC=CC=C1)C(OCC)=O AK-46035 [0,1,0,0,0,0|0,0,2]=3 20 B14R1.60 O=C(OCC)C(N)CC1=CC=CC=C1 AK544810 [0,1,0,0,0,0|0,0,2]=3 21 B14R1.156 BrCCNC(=O)OCC1=CC=CC=C1 AK-41250 [0,1,0,0,0,0|2,0,1]=4 22 B14R1.156 O=C(OCC1=CC=CC=C1)CCCBr AK116323 [0,1,0,0,0,0|2,0,1]=4 23 B14R1.156 O=C(OCC1=CC=CC=C1)CCCN AK-87747 [0,1,0,0,0,0|2,0,1]=4 24 B14R1.156 O=C(OCC1=CC=CC=C1)NCCN AK-43139 [0,1,0,0,0,0|2,0,1]=4 25 B14R1.156 O=C(OCC1=CC=CC=C1)NCCO AK-90111 [0,1,0,0,0,0|2,0,1]=4 26 B14R1.156 O=C(OCC=C)\C=C\C1=CC=CC=C1 AK114249 [0,1,0,0,0,0|0,0,1]=2 27 B14R1.502 BrC1=CC=C(C=C1)CCC(=O)OCC AK-35074 [0,1,0,0,0,0|0,0,2]=3 28 B14R1.502 CCOC(=O)/C=C/C1=CC=C(O)C=C1 AK104398 [0,1,0,0,0,0|0,0,0]=1 29 B14R1.502 CCOC(=O)CCC1=CC=C(F)C=C1 AK-72737 [0,1,0,0,0,0|0,0,2]=3 30 B14R1.502 O=C(OCC)C#CC1=CC=C(Cl)C=C1 AK156093 [0,1,0,0,0,0|0,0,2]=3 31 B14R1.502 O=C(OCC)\C=C\C1=CC=C(Br)C=C1 AK112240 [0,1,0,0,0,0|0,0,0]=1 32 B14R1.598 CCOC(=O)CCC1=C(Br)C=CC=C1 AK-47819 [0,1,0,0,0,0|0,0,2]=3 33 B14R1.598 O=C(OCC)COC1=CC=CC=C1O AK-97218 [0,1,0,0,0,0|1,0,1]=3 34 B14R1.756 O=C(OC)C(\C=C\C1=CC=CC=C1)=O AK685036 [0,1,0,0,0,0|2,0,0]=3 35 B14R2.21 O=C1NC(C2=CC=CC=C2)CCC1 AK-51101 [0,0,0,1,0,0|2,0,1]=4 36 B14R2.112 C1=CC(=NC2=C1C=CC=C2)CCO AK-28366 [0,0,0,1,0,0|3,0,0]=4 37 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 AK115895 [0,0,0,1,0,0|3,0,0]=4 38 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 AK-79279 [0,0,0,1,0,0|3,0,0]=4 39 B14R2.203 COC1=C2C=CC=CC2=CC=C1Br AK-67717 [0,0,0,1,0,0|3,0,0]=4 40 B14R2.598 O=C1C(C2=CC=CC=C2)=CC(O1)=O AK113240 [0,0,0,1,0,0|1,0,1]=3 41 B14R2.598 O=C1O[C@H](C2=CC=CC=C2)[C@H](C)N1 AK-60022 [0,0,0,1,0,0|2,0,1]=4 42 B12R1.32 C(C)OC(CC1=NC=CC=N1)=O AK-24266 [0,0,0,0,1,0|2,0,1]=4 43 B12R1.32 CCCC(CC1=CC=CC=C1)=O AK113874 [0,0,0,0,1,0|1,0,1]=3 44 B12R1.32 O=C(OCC)CC1=CC=CC=C1 AK116248 [0,0,0,0,1,0|0,0,1]=2 45 B12R1.32 O=C(OCC)CC1=CC=CN=C1 AK-81622 [0,0,0,0,1,0|1,0,1]=3 46 B12R1.32 O=C(OCC)C[N+]1=CC=CC=C1 AK-60276 [0,0,0,0,1,0|1,0,1]=3 47 B14R1.520 C(C)OC(CCNC1=NC=CC=C1)=O AK-31676 [0,0,0,0,0,1|1,0,2]=4 48 B14R1.520 O=C(OCC)CNCC1=CC=CC=C1 AK-26991 [0,0,0,0,0,1|0,0,2]=3 49 B14R1.520 O=C(OCC)NCCC1=CC=CC=C1 AK-47113 [0,0,0,0,0,1|0,0,2]=3 50 B11R1.91 CC(\C=C\C1=CC=CC=C1)=O AK107621 [2,0,0,0,0,0|0,0,0]=2 51 B11R1.91 O=C(N)\C=C\C1=CC=CC=C1 AK112937 [2,0,0,0,0,0|1,0,0]=3 52 B11R1.91 O=C(O)C#CC1=CC=CC=C1 AK-86834 [2,0,0,0,0,0|0,0,2]=4 53 B11R1.91 O=C(O)CCC1=CC=CC=C1 AK-94756 [2,0,0,0,0,0|0,0,2]=4 54 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 AK114507 [2,0,0,0,0,0|0,0,0]=2 55 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 AK-32864 [2,0,0,0,0,0|1,0,0]=3 56 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 AK-35529 [2,0,0,0,0,0|1,0,0]=3 57 B11R1.91 OC(=O)COC1=CC=CC=C1 AK-76874 [2,0,0,0,0,0|1,0,1]=4 58 B11R1.91 [O-]C(=O)C=CC1=CC=CC=C1 AK104134 [2,0,0,0,0,0|0,0,1]=3 59 B11R1.91 [O-][N+](=O)/C=C/C1=CC=CC=C1 AK111240 [2,0,0,0,0,0|1,0,1]=4 60 B13R1.11 O=C(OC)CC(C1=NC=CC=C1)=O AK-50095 [1,1,0,0,0,0|1,0,1]=4 61 B13R1.11 O=C(OC)C[C@H](N)C1=CC=CC=C1 AK104659 [1,1,0,0,0,0|0,0,2]=4 62 B13R1.11 O=C(OC)C[C@H](N)C1=CC=CC=C1 AK104667 [1,1,0,0,0,0|0,0,2]=4 63 B13R1.14 BrC1=CC=C(C=C1)CCC(=O)OC AK-39981 [1,1,0,0,0,0|0,0,2]=4 64 B13R1.14 COC(=O)/C=C/C1=CC=C(O)C=C1 AK109487 [1,1,0,0,0,0|0,0,0]=2 65 B13R1.14 O=C(OC)CCC1=CC=C(I)C=C1 AK209542 [1,1,0,0,0,0|0,0,2]=4 66 B13R1.14 O=C(OC)CCC1=CC=C(N)C=C1 AK-64364 [1,1,0,0,0,0|0,0,2]=4 67 B13R1.14 O=C(OC)CCC1=CC=C(N)C=C1 AK175380 [1,1,0,0,0,0|0,0,2]=4 68 B13R1.14 O=C(OC)CCC1=CC=C(O)C=C1 AK-35645 [1,1,0,0,0,0|0,0,2]=4 69 B13R1.14 O=C(OC)CNC1=CC=C(O)C=C1 AK-88073 [1,1,0,0,0,0|1,0,1]=4 70 B13R1.14 O=C(OC)\C=C\C1=CC=C(Br)C=C1 AK117162 [1,1,0,0,0,0|0,0,0]=2 71 B13R1.14 O=C(OC)\C=C\C1=CC=C(O)C=C1 AK-49067 [1,1,0,0,0,0|0,0,0]=2 72 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 AK-79037 [1,1,0,0,0,0|0,0,2]=4 73 B13R1.15 O=C(OC)CCC1=CC=CC(Br)=C1 AK-83017 [1,1,0,0,0,0|0,0,2]=4 74 B13R1.135 N[C@@H](CC1=CC=CC=C1)C(OC)=O AK-44164 [1,1,0,0,0,0|0,0,2]=4 75 B13R1.135 O=C(OC)C(N)CC1=CC=CC=C1 AK-88496 [1,1,0,0,0,0|0,0,2]=4 76 B13R1.135 O=C(OC)[C@@H](O)CC1=CC=CC=C1 AK-43989 [1,1,0,0,0,0|0,0,2]=4 77 B13R1.135 O=C(OC)[C@H](N)CC1=CC=CC=C1 AK-44133 [1,1,0,0,0,0|0,0,2]=4 78 B13R1.135 O=C(OC)[C@H](O)CC1=CC=CC=C1 AK-42956 [1,1,0,0,0,0|0,0,2]=4 79 B13R1.351 C1=CC=CC=C1COC(C(C)N)=O AK-41707 [1,1,0,0,0,0|1,0,1]=4 80 B13R1.351 C[C@@H](N)C(OCC1=CC=CC=C1)=O AK-49776 [1,1,0,0,0,0|1,0,1]=4 81 B13R1.351 C[C@H](N)C(OCC1=CC=CC=C1)=O AK-49907 [1,1,0,0,0,0|1,0,1]=4 82 B13R1.528 COC(=O)CCC1=CC=CC=C1Br AK-48437 [1,1,0,0,0,0|0,0,2]=4 83 B13R1.19 C1=C(CC(OCC)=O)C=CC(=C1)O AK-62643 [0,1,0,0,1,0|0,0,1]=3 84 B13R1.19 C1=CC(=CC=C1CC(OCC)=O)Br AK-73014 [0,1,0,0,1,0|0,0,1]=3 85 B13R1.19 C1=CC(=CC=C1CC(OCC)=O)Cl AK-45269 [0,1,0,0,1,0|0,0,1]=3 86 B13R1.19 C1=CC(=CC=C1CC(OCC)=O)F AK-35766 [0,1,0,0,1,0|0,0,1]=3 87 B13R1.19 O=C(OCC)CC1=CC=C(N)C=C1 AK-77257 [0,1,0,0,1,0|0,0,1]=3 88 B13R1.19 O=C(OCC)CC1=CC=C(N)N=C1 AK165027 [0,1,0,0,1,0|1,0,1]=4 89 B13R1.20 BrC1=CC=CC(=C1)CC(=O)OCC AK-47271 [0,1,0,0,1,0|0,0,1]=3 90 B13R1.20 CCOC(=O)CC1=NC(Br)=CC=C1 AK110628 [0,1,0,0,1,0|1,0,1]=4 91 B13R1.20 CCOC(=O)CC1=NC(C)=CC=C1 AK-90308 [0,1,0,0,1,0|1,0,1]=4 92 B13R1.20 O=C(OCC)CC1=CC=CC(O)=C1 AK146400 [0,1,0,0,1,0|0,0,1]=3 93 B13R1.20 O=C(OCC)CC1=NC(Cl)=CC=C1 AK-74296 [0,1,0,0,1,0|1,0,1]=4 94 B13R1.20 O=C(OCC)CC1=NC(N)=CC=C1 AK-72798 [0,1,0,0,1,0|1,0,1]=4 95 B13R1.47 O=C(OCC)C(C1=CC=CN=C1)=O AK-40228 [0,1,0,0,1,0|1,0,0]=3 96 B13R1.47 O=C(OCC)[C@H](N)C1=CC=CC=C1 AK-63329 [0,1,0,0,1,0|0,0,1]=3 97 B13R1.348 CC(C)CC(CC1=CC=CC=C1)=O AK115092 [0,1,0,0,1,0|1,0,1]=4 98 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=C1 AK-89593 [0,1,0,0,1,0|1,0,1]=4 99 B13R1.470 CCOC(=O)CC1=C(Cl)C=CC=C1 AK-40513 [0,1,0,0,1,0|0,0,1]=3 100 B13R1.470 CCOC(=O)CC1=NC=CC=C1Br AK-82088 [0,1,0,0,1,0|1,0,1]=4 101 B13R1.470 O=C(OCC)CC1=CC=CC=C1I AK146854 [0,1,0,0,1,0|0,0,1]=3 102 B13R1.33 CCOC(=O)CC(=O)C1=CSC=C1 AK-81672 [0,1,0,0,1,0|1,0,1]=4 103 B13R1.33 O=C(OCC)CC(C1=CC=CS1)=O AK-25395 [0,1,0,0,1,0|1,0,1]=4 104 B13R1.33 O=C(OCC)CC(C1=COC=C1)=O AK-86212 [0,1,0,0,1,0|1,0,1]=4 105 B15R1.11 O=C(OCC)CCCC1=CC=C(Br)C=C1 AK109535 [0,1,0,0,0,1|0,0,2]=4 106 B15R1.89 O=C(OCC)\C=C\C(C1=CC=CC=C1)=O AK-98826 [0,1,0,0,0,1|0,0,0]=2 107 B15R1.809 O=C(OCC)CC(CC1=CC=CC=C1)=O AK-32542 [0,1,0,0,0,1|0,0,1]=3 108 B15R1.826 O=C(OCC)C(CCC1=CC=CC=C1)=O AK116966 [0,1,0,0,0,1|0,0,1]=3 109 B15R1.826 O=C(OCC)[C@@H](N)CCC1=CC=CC=C1 AK-47422 [0,1,0,0,0,1|0,0,2]=4 110 B15R1.826 O=C(OCC)[C@H](N)CCC1=CC=CC=C1 AK-61280 [0,1,0,0,0,1|0,0,2]=4 111 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Br)C=C1 AK-73052 [0,2,0,0,0,0|0,0,1]=3 112 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C)C=C1 AK-81571 [0,2,0,0,0,0|0,0,1]=3 113 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Cl)C=C1 AK-29089 [0,2,0,0,0,0|0,0,1]=3 114 B15R1.23 O=C(OCC)CC(C1=CC=C(F)C=C1)=O AK-33969 [0,2,0,0,0,0|0,0,1]=3 115 B15R1.23 O=C(OCC)CC(C1=CC=C(I)C=C1)=O AK-86466 [0,2,0,0,0,0|0,0,1]=3 116 B15R1.24 CCOC(=O)CC(=O)C1=CC(C)=CC=C1 AK-81597 [0,2,0,0,0,0|0,0,1]=3 117 B15R1.24 O=C(OCC)CC(C1=CC=CC(F)=C1)=O AK-34723 [0,2,0,0,0,0|0,0,1]=3 118 B15R1.578 O=C(OCC)C(C)C(C1=CC=CC=C1)=O AK-55970 [0,2,0,0,0,0|0,0,1]=3 119 B15R1.3722 CCOC(=O)CC(=O)C1=C(Cl)C=CC=C1 AK-44302 [0,2,0,0,0,0|0,0,1]=3 120 B15R1.3722 O=C(OCC)CC(C1=CC=CC=C1C)=O AK-81663 [0,2,0,0,0,0|0,0,1]=3 121 B15R1.10390 O=C(OCC)\C=C\C1=CC=C(O)C(O)=C1 AK-88790 [0,2,0,0,0,0|0,0,0]=2 122 B15R1.48 N[C@@H](CC1=CC=C(C=C1)O)C(OCC)=O AK-49774 [0,2,0,0,0,0|0,0,2]=4 123 B15R1.48 O=C(OCC)C(NC1=NC=C(Cl)C=C1)=O AK167186 [0,2,0,0,0,0|2,0,0]=4 124 B15R1.48 O=C(OCC)[C@@H](N)CC1=CC=C(F)C=C1 AK186524 [0,2,0,0,0,0|0,0,2]=4 125 B15R1.48 O=C(OCC)[C@H](N)CC1=CC=C(F)C=C1 AK668446 [0,2,0,0,0,0|0,0,2]=4 126 B15R1.48 [C@@H](N)(CC1=CC=C(O)C=C1)C(=O)OCC AK-49585 [0,2,0,0,0,0|0,0,2]=4 127 B15R1.793 O=C(OCC)CCC1=CC=C(CO)C=C1 AK198688 [0,2,0,0,0,0|0,0,2]=4 128 B15R1.793 O=C(OCC)\C=C\C1=CC=C(OC)C=C1 AK-86469 [0,2,0,0,0,0|0,0,0]=2 129 B15R1.1001 COC(=O)C(=O)/C=C/C1=CC=C(Br)C=C1 AK-57121 [0,2,0,0,0,0|2,0,0]=4 130 B15R1.768 O=C(OCC)COC1=CC=CC=C1OC AK-57462 [0,2,0,0,0,0|1,0,1]=4 131 B13R1.464 C1=CC=CC(=C1NC)C(=O)OCC AK-64767 [0,0,1,1,0,0|1,0,1]=4 132 B13R1.464 O=C(OCC)C1=CC=CC=C1C#N AK-82519 [0,0,1,1,0,0|1,0,1]=4 133 B13R1.464 O=C(OCC)C1=CC=CC=C1C=O AK139973 [0,0,1,1,0,0|1,0,0]=3 134 B13R1.460 CCOC(=O)C1=CC(C=O)=NC=C1 AK100395 [0,0,1,1,0,0|2,0,0]=4 135 B13R1.460 O=C(OCC)C1=CC=CC(NN)=C1 AK158144 [0,0,1,1,0,0|2,0,0]=4 136 B13R1.446 CCOC(=O)C1=C(Br)C=CC(F)=C1 AK104622 [0,0,1,1,0,0|2,0,0]=4 137 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(Br)=C1 AK-29515 [0,0,1,1,0,0|2,0,0]=4 138 B13R1.446 CCOC(=O)C1=C(N)C=CC(I)=C1 AK-41595 [0,0,1,1,0,0|2,0,0]=4 139 B13R1.446 O=C(OCC)C1=CC(Br)=CC=C1F AK138049 [0,0,1,1,0,0|2,0,0]=4 140 B13R1.446 O=C(OCC)C1=CC(Br)=CC=C1N AK130408 [0,0,1,1,0,0|2,0,0]=4 141 B13R1.446 O=C(OCC)C1=CC(C)=CC=C1I AK183937 [0,0,1,1,0,0|1,0,1]=4 142 B13R1.446 O=C(OCC)C1=CC(C)=CC=C1N AK-92385 [0,0,1,1,0,0|1,0,1]=4 143 B13R1.446 O=C(OCC)C1=CC(Cl)=CC=C1I AK192770 [0,0,1,1,0,0|2,0,0]=4 144 B13R1.446 O=C(OCC)C1=CC(F)=CC=C1F AK194564 [0,0,1,1,0,0|2,0,0]=4 145 B13R1.446 O=C(OCC)C1=CC(F)=CC=C1N AK377469 [0,0,1,1,0,0|2,0,0]=4 146 B13R1.446 O=C(OCC)C1=CC(I)=CC=C1O AK-93266 [0,0,1,1,0,0|2,0,0]=4 147 B13R2.3 C1(C2=CC=CC=C2)=CCCCC1 AK339077 [1,0,0,1,0,0|1,0,1]=4 148 B13R2.1613 CCC1=C2C=CC=CC2=CC=C1 AK-47731 [1,0,0,1,0,0|1,0,0]=3 149 B13R2.1613 CNC1=CC=CC2=C1C=CC=C2 AK-86049 [1,0,0,1,0,0|2,0,0]=4 150 B13R2.1613 COC1=C2C=CC=CC2=CC=C1 AK105904 [1,0,0,1,0,0|2,0,0]=4 151 B13R2.1613 OCC1=C2C=CC=CC2=CC=C1 AK-84417 [1,0,0,1,0,0|2,0,0]=4 152 B13R2.10 ClC1=CC(C2=CC=CC=C2)=NO1 AK142366 [1,0,0,1,0,0|2,0,0]=4 153 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 AK-98958 [1,0,0,1,0,0|2,0,0]=4 154 B13R2.10 O=C1OC[C@@H](C2=CC=CC=C2)N1 AK-68242 [1,0,0,1,0,0|1,0,1]=4 155 B13R2.10 [C@H]1(NC(OC1)=O)C2=CC=CC=C2 AK-47582 [1,0,0,1,0,0|1,0,1]=4 156 B13R2.57 BrCC1=CC=C2C=CC=CC2=C1 AK-48607 [1,0,0,1,0,0|2,0,0]=4 157 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 AK-35655 [1,0,0,1,0,0|2,0,0]=4 158 B13R2.57 C1=C2C(=CC=C1)C=C(C=C2)CO AK-48971 [1,0,0,1,0,0|2,0,0]=4 159 B13R2.57 COC1=CC2=C(C=C1)C=CN=C2 AK-35027 [1,0,0,1,0,0|2,0,0]=4 160 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 AK-39658 [1,0,0,1,0,0|2,0,0]=4 161 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 AK110812 [1,0,0,1,0,0|1,0,0]=3 162 B13R2.57 COC1=CC2=C(C=NC=C2)C=C1 AK-35505 [1,0,0,1,0,0|2,0,0]=4 163 B13R2.57 COC1=CC2=CC=CC=C2N=C1 AK-39637 [1,0,0,1,0,0|2,0,0]=4 164 B13R2.57 COC1=CC=C2C=CC=NC2=C1 AK-35323 [1,0,0,1,0,0|2,0,0]=4 165 B13R2.57 COC1=NC2=CC=CC=C2C=C1 AK-94453 [1,0,0,1,0,0|1,0,0]=3 166 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 AK-77406 [1,0,0,1,0,0|2,0,0]=4 167 B13R2.57 NCC1=CC2=C(C=CC=C2)C=C1 AK-33985 [1,0,0,1,0,0|2,0,0]=4 168 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 AK-49046 [1,0,0,1,0,0|2,0,0]=4 169 B13R2.15272 O=C(C1C2=CC=CC=C2C1)OC AK163865 [1,0,0,1,0,0|0,0,2]=4 170 B13R2.135 CC=1N(CC)C2=C(C1)C=CC=C2 AK-87148 [0,0,0,1,1,0|2,0,0]=4 171 B13R2.135 O=C1N(CC)C2=CC=CC=C2N1 AK-92954 [0,0,0,1,1,0|2,0,0]=4 172 B13R2.163 C1=CC=CC2=C1NC(=O)CCC2 AK-25978 [0,0,0,1,1,0|2,0,0]=4 173 B13R2.163 O=C1NCCC2=CC=CC=C2N1 AK551054 [0,0,0,1,1,0|2,0,0]=4 174 B13R2.449 C1=C(C=C2C(=C1)C=C[NH]2)OCC AK-39304 [0,0,0,1,1,0|2,0,0]=4 175 B13R2.449 CCOC1=CC2=C(NC=C2)C=C1 AK-21810 [0,0,0,1,1,0|2,0,0]=4 176 B15R2.73 C1=CC=CC2=C1C(=N[NH]2)C(=O)OCC AK-22230 [0,0,0,1,0,1|1,0,0]=3 177 B15R2.73 O1C2=C(C(=N1)C(=O)OCC)C=CC=C2 AK-31279 [0,0,0,1,0,1|1,0,0]=3 178 B15R2.73 O=C(C1=C2N=CC=CN2N=C1)OCC AK-28184 [0,0,0,1,0,1|2,0,0]=4 179 B15R2.73 O=C(C1=CN=C2C=CC=CN21)OCC AK-92952 [0,0,0,1,0,1|1,0,0]=3 180 B15R2.73 O=C(C1=CN=C2C=NC=CN21)OCC AK474100 [0,0,0,1,0,1|2,0,0]=4 181 B15R2.73 O=C(C1=CN=C2N=CC=CN21)OCC AK126659 [0,0,0,1,0,1|2,0,0]=4 182 B15R2.73 O=C(C1=CNC2=C1C=CC=C2)OCC AK-81959 [0,0,0,1,0,1|0,0,0]=2 183 B15R2.73 O=C(C1=CNC2=C1C=CN=C2)OCC AK-64535 [0,0,0,1,0,1|1,0,0]=3 184 B15R2.73 O=C(C1=NC=C2C=CC=CN21)OCC AK-68625 [0,0,0,1,0,1|1,0,0]=3 185 B15R2.1356 C1=C(C(OCC)=O)[NH]C2=C1C=CC=C2 AK-46087 [0,1,0,1,0,0|0,0,0]=2 186 B15R2.1356 C1=C(N=C2[N]1C=CC=C2)C(OCC)=O AK-17601 [0,1,0,1,0,0|1,0,0]=3 187 B15R2.1356 CCOC(=O)C1=NC2=CC=CC=C2N1 AK105153 [0,1,0,1,0,0|1,0,0]=3 188 B15R2.1356 CCOC(C1=C[N]2C=CC=NC2=N1)=O AK-24814 [0,1,0,1,0,0|2,0,0]=4 189 B15R2.1356 N1=C2[N](C=C1C(=O)OCC)C=CN=C2 AK-24574 [0,1,0,1,0,0|2,0,0]=4 190 B15R2.1356 O=C(C1=CC2=CC=CC=C2O1)OCC AK-34660 [0,1,0,1,0,0|0,0,0]=2 191 B15R2.1356 O=C(C1=CC2=NC=CC=C2N1)OCC AK-68316 [0,1,0,1,0,0|1,0,0]=3 192 B15R2.1356 O=C(C=1NC2=C(C1)C=CN=C2)OCC AK-39458 [0,1,0,1,0,0|1,0,0]=3 193 B15R2.1356 O=C(C=1NC2=C(C1)C=NC=C2)OCC AK-50820 [0,1,0,1,0,0|1,0,0]=3 194 B15R2.1356 [NH]1C2=NC=CC=C2C=C1C(=O)OCC AK-30594 [0,1,0,1,0,0|1,0,0]=3 195 B15R2.1282 C(C)OC1=CC=C2C(=C1)C=C(C=C2)O AK-28273 [0,1,0,1,0,0|1,0,0]=3 196 B15R2.1601 CC[C@@H](C1=CC=C2C=CC=CC2=C1)N AK172717 [0,1,0,1,0,0|2,0,0]=4 197 B15R2.1601 CC[C@H](C1=CC=C2C=CC=CC2=C1)N AK172719 [0,1,0,1,0,0|2,0,0]=4 198 B15R2.1668 FC(F)OC1=CC=C2C=CC=CC2=C1 AK-62201 [0,1,0,1,0,0|2,0,0]=4 199 B11R1.40 O=C(NC1=CC=CC=C1)CCl AK-95957 [1,0,0,0,1,0|2,0,0]=4 200 B11R1.40 O=C(OC)CC1=CC=CC=C1 AK163377 [1,0,0,0,1,0|0,0,1]=3 201 B11R1.40 O=C(OC)OC1=CC=CC=C1 AK600729 [1,0,0,0,1,0|1,0,0]=3 202 B11R1.40 O=C(OC1=CC=CC=C1)CBr AK105971 [1,0,0,0,1,0|2,0,0]=4 203 B11R1.16 C1=C(C(OCC)=O)N=CC=C1 AK-48935 [0,0,0,0,2,0|1,0,0]=3 204 B11R1.16 CCCC(C1=CC=CC=C1)=O AK164430 [0,0,0,0,2,0|1,0,0]=3 205 B11R1.16 CCCC(C1=CC=CN=C1)=O AK123326 [0,0,0,0,2,0|2,0,0]=4 206 B11R1.16 CCOC(=O)C1=NC=CC=N1 AK-85955 [0,0,0,0,2,0|2,0,0]=4 207 B11R1.16 O=C(C1=NC=CN=C1)OCC AK-40036 [0,0,0,0,2,0|2,0,0]=4 208 B11R1.16 O=C(OCC)C1=CC=NC=C1 AK-50699 [0,0,0,0,2,0|1,0,0]=3 209 B11R1.16 O=C(OCC)C1=CN=CC=C1 AK-88428 [0,0,0,0,2,0|1,0,0]=3 210 B11R1.16 O=C(OCCl)C1=CC=CC=C1 AK-86220 [0,0,0,0,2,0|1,0,0]=3