0 B13R1.348 CC(=O)CC(=O)OC1=CC=CC=C1 F12019 [0,0,0,0,0,0|2,0,1]=3 1 B13R1.348 CN(C)C[C@@H](N)CC1=CC=CC=C1 53133 [0,0,0,0,0,0|2,0,1]=3 2 B13R1.348 CN(C)C[C@@H](N)CC1=CC=CC=C1 AT22332 [0,0,0,0,0,0|2,0,1]=3 3 B13R1.348 CN(C)C[C@@H](N)CC1=CC=CC=C1 C78125 [0,0,0,0,0,0|2,0,1]=3 4 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 C14931 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.32 CCOC(=O)CC1=CC=NC=C1 31557 [1,0,0,0,0,0|2,0,0]=3 6 B12R1.32 CCOC(=O)CC1=CN=CN=C1 F53477 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.32 CCOC(=O)NC1=CN=CC=C1 F14111 [1,0,0,0,0,0|3,0,0]=4 8 B12R1.32 CCOC(=O)OC1=NC=CC=C1 F18008 [1,0,0,0,0,0|3,0,0]=4 9 B12R1.32 NCCC(=O)NC1=CC=CC=C1 F21144 [1,0,0,0,0,0|2,0,0]=3 10 B12R1.252 CN(C)\C=N\CC1=CC=CC=C1 F53333 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.252 C[C@H](Br)COCC1=CC=CC=C1 C92726 [1,0,0,0,0,0|2,0,0]=3 12 B12R1.252 C[C@H](Br)COCC1=CC=CC=C1 C92727 [1,0,0,0,0,0|2,0,0]=3 13 B12R1.252 C[C@H](O)CCCC1=CN=CC=C1 F53169 [1,0,0,0,0,0|2,0,1]=4 14 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 AC4615 [1,0,0,0,0,0|2,0,0]=3 15 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 AT23036 [1,0,0,0,0,0|2,0,0]=3 16 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 D71911 [1,0,0,0,0,0|2,0,0]=3 17 B14R1.425 CC(C)[C@H](N)C(=O)NC1=CC=CC=C1 F14830 [0,1,0,0,0,0|1,0,0]=2 18 B14R1.698 CC(C)NC(=O)OC1=CN=C(Br)C=C1 CS3057 [0,1,0,0,0,0|3,0,0]=4 19 B14R1.698 CC(C)N[C@@H](C)CC1=CC=C(I)C=C1 A10376 [0,1,0,0,0,0|2,0,1]=4 20 B14R1.743 CN(CC1=CC=CC=C1)C[C@H](O)CO 56521 [0,1,0,0,0,0|3,0,0]=4 21 B14R1.743 CN(CC1=CC=CC=C1)C[C@H](O)CO 56527 [0,1,0,0,0,0|3,0,0]=4 22 B14R2.19 Br[C@H]1CCN(CC2=CC=CC=C2)C1 W17561 [0,0,0,1,0,0|3,0,0]=4 23 B14R2.19 CN1CN[C@@H](CC2=CC=CC=C2)C1 98527 [0,0,0,1,0,0|2,0,1]=4 24 B14R2.19 C[C@H]1CN(CC2=CC=CC=C2)CN1 98532 [0,0,0,1,0,0|3,0,0]=4 25 B14R2.19 Cl[C@H]1CCN(CC2=CC=CC=C2)C1 AC1291 [0,0,0,1,0,0|3,0,0]=4 26 B14R2.4893 CC1(N)CN(CC2=CC=CC=C2)C1 P12493 [0,0,0,1,0,0|3,0,0]=4 27 B14R2.8189 CN1CC2=C(C=CC=C2)C(C)(C)C1 22982 [0,0,0,1,0,0|2,0,0]=3 28 B12R1.43 C[C@H](N)C(=O)NC1=CC=CC=C1 F15365 [0,0,0,0,1,0|2,0,0]=3 29 B12R1.43 C[C@H](N)C(=O)OC1=CC=CC=C1 F52322 [0,0,0,0,1,0|2,0,0]=3 30 B12R1.43 C[C@H](O)C(=O)NC1=CC=CC=C1 F15116 [0,0,0,0,1,0|2,0,0]=3 31 B12R1.107 CC(=O)CC(=O)C1=CN=CC=C1 F50499 [0,0,0,0,1,0|2,0,1]=4 32 B12R1.107 CC(C)CC(=O)C1=CN=CC=C1 F30170 [0,0,0,0,1,0|1,0,0]=2 33 B12R1.107 CC(C)CC(=O)C1=NC=CC=C1 F30232 [0,0,0,0,1,0|1,0,0]=2 34 B12R1.107 CC(C)C[C@H](N)C1=CC=NC=C1 AC7589 [0,0,0,0,1,0|2,0,1]=4 35 B12R1.107 CC(C)C[C@H](O)C1=CN=CC=C1 F50992 [0,0,0,0,1,0|1,0,2]=4 36 B12R1.107 CC(C)N[C@@H](C)C1=CC=CC=C1 A11925 [0,0,0,0,1,0|2,0,1]=4 37 B12R1.107 CN(C)C[C@H](O)C1=CC=CC=C1 C78399 [0,0,0,0,1,0|1,0,2]=4 38 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [2,0,0,0,0,0|1,0,1]=4 39 B11R1.28 NCC\C=C\C1=CC=CC=C1 F15194 [2,0,0,0,0,0|1,0,1]=4 40 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [2,0,0,0,0,0|1,0,1]=4 41 B11R1.40 N#CC(=O)CC1=CC=CC=C1 AC5929 [2,0,0,0,0,0|1,0,1]=4 42 B13R1.19 CCCC(=O)CC1=CC=C(Br)C=C1 N14161 [1,1,0,0,0,0|0,0,0]=2 43 B13R1.19 CCCC(=O)CC1=CC=C(C)C=C1 N14169 [1,1,0,0,0,0|0,0,0]=2 44 B13R1.19 CCCC(=O)CC1=CC=C(Cl)C=C1 N14153 [1,1,0,0,0,0|0,0,0]=2 45 B13R1.19 CCCC(=O)CC1=CC=C(F)C=C1 N14143 [1,1,0,0,0,0|0,0,0]=2 46 B13R1.19 CCC[C@H](N)CC1=CC=C(C)C=C1 N14551 [1,1,0,0,0,0|1,0,1]=4 47 B13R1.19 CCC[C@H](N)CC1=CC=C(Cl)C=C1 N14548 [1,1,0,0,0,0|1,0,1]=4 48 B13R1.19 CCC[C@H](N)CC1=CC=C(F)C=C1 N14544 [1,1,0,0,0,0|1,0,1]=4 49 B13R1.19 CCOC(=O)C[N+]1=CC=C(N)C=C1 D85768 [1,1,0,0,0,0|2,0,0]=4 50 B13R1.19 N#CCC(=O)CC1=CC=C(Cl)C=C1 93621 [1,1,0,0,0,0|1,0,1]=4 51 B13R1.19 NCCC(=O)NC1=CC=C(F)C=C1 F21222 [1,1,0,0,0,0|2,0,0]=4 52 B13R1.20 CCCC(=O)CC1=CC(C)=CC=C1 N14167 [1,1,0,0,0,0|0,0,0]=2 53 B13R1.20 CCCC(=O)CC1=CC=CC(Br)=C1 N14159 [1,1,0,0,0,0|0,0,0]=2 54 B13R1.20 CCCC(=O)CC1=CC=CC(Cl)=C1 N14151 [1,1,0,0,0,0|0,0,0]=2 55 B13R1.20 CCCC(=O)CC1=CC=CC(F)=C1 N14138 [1,1,0,0,0,0|0,0,0]=2 56 B13R1.20 CCC[C@H](N)CC1=CC(C)=CC=C1 N14537 [1,1,0,0,0,0|1,0,1]=4 57 B13R1.20 CCC[C@H](N)CC1=CC=CC(Br)=C1 N14533 [1,1,0,0,0,0|1,0,1]=4 58 B13R1.20 CCC[C@H](N)CC1=CC=CC(Cl)=C1 N14528 [1,1,0,0,0,0|1,0,1]=4 59 B13R1.20 CCC[C@H](N)CC1=CC=CC(F)=C1 N14525 [1,1,0,0,0,0|1,0,1]=4 60 B13R1.20 CCOC(=O)CC1=CC(Br)=NC=C1 C14462 [1,1,0,0,0,0|2,0,0]=4 61 B13R1.20 N#CCC(=O)CC1=CC=CC(Br)=C1 93640 [1,1,0,0,0,0|1,0,1]=4 62 B13R1.20 N#CCC(=O)CC1=CC=CC(Cl)=C1 93638 [1,1,0,0,0,0|1,0,1]=4 63 B13R1.20 N#CCC(=O)CC1=CC=CC(F)=C1 93636 [1,1,0,0,0,0|1,0,1]=4 64 B13R1.20 O=C(CCCl)NC1=CC=CC(Br)=C1 S11923 [1,1,0,0,0,0|2,0,0]=4 65 B13R1.44 NCCNC(=O)NC1=CC=CC=C1 F21136 [1,1,0,0,0,0|2,0,0]=4 66 B13R1.44 O=C(CC1=CC=CC=C1)NCCO W12293 [1,1,0,0,0,0|1,0,0]=3 67 B13R1.47 CCOC(=O)N(C)C1=CC=CC=C1 C13886 [1,1,0,0,0,0|2,0,0]=4 68 B13R1.47 CCOC(=O)[C@H](O)C1=CN=CC=C1 W16894 [1,1,0,0,0,0|2,0,0]=4 69 B13R1.470 CCCC(=O)CC1=C(Br)C=CC=C1 N14157 [1,1,0,0,0,0|0,0,0]=2 70 B13R1.470 CCCC(=O)CC1=C(C)C=CC=C1 N14164 [1,1,0,0,0,0|0,0,0]=2 71 B13R1.470 CCCC(=O)CC1=C(Cl)C=CC=C1 N14148 [1,1,0,0,0,0|0,0,0]=2 72 B13R1.470 CCCC(=O)CC1=C(F)C=CC=C1 N14135 [1,1,0,0,0,0|0,0,0]=2 73 B13R1.470 CCC[C@H](N)CC1=C(Br)C=CC=C1 N14511 [1,1,0,0,0,0|1,0,1]=4 74 B13R1.470 CCC[C@H](N)CC1=C(C)C=CC=C1 N14513 [1,1,0,0,0,0|1,0,1]=4 75 B13R1.470 CCC[C@H](N)CC1=C(Cl)C=CC=C1 N14501 [1,1,0,0,0,0|1,0,1]=4 76 B13R1.470 CCC[C@H](N)CC1=C(F)C=CC=C1 N14506 [1,1,0,0,0,0|1,0,1]=4 77 B13R1.470 CCOC(=O)CC1=C(Cl)C=NC=C1 AT23302 [1,1,0,0,0,0|2,0,0]=4 78 B13R1.470 CCOC(=O)CC1=NC=CC=C1O P12794 [1,1,0,0,0,0|2,0,0]=4 79 B13R1.351 C[C@H](O)[C@H](C)OCC1=CC=CC=C1 P19299 [1,1,0,0,0,0|2,0,0]=4 80 B13R1.513 CC(C)CNCC1=CC=C(Br)C=C1 11874 [1,1,0,0,0,0|1,0,0]=3 81 B13R1.718 C[C@@H](CO)COCC1=CC=CC=C1 50122 [1,1,0,0,0,0|1,0,0]=3 82 B13R1.718 NC[C@H](F)COCC1=CC=CC=C1 92939 [1,1,0,0,0,0|2,0,0]=4 83 B13R1.718 NC[C@H](O)COCC1=CC=CC=C1 77446 [1,1,0,0,0,0|2,0,0]=4 84 B13R1.718 NC[C@H](O)COCC1=CC=CC=C1 AT18638 [1,1,0,0,0,0|2,0,0]=4 85 B13R1.718 NC[C@H](O)COCC1=CC=CC=C1 AT18639 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.718 N[C@@H](CO)CSCC1=CC=CC=C1 AT13352 [1,1,0,0,0,0|2,0,0]=4 87 B13R1.718 O[C@H](CBr)COCC1=CC=CC=C1 T70304 [1,1,0,0,0,0|2,0,0]=4 88 B13R1.718 O[C@H](CCl)CNCC1=CC=CC=C1 C12977 [1,1,0,0,0,0|2,0,0]=4 89 B13R1.718 O[C@H](CCl)COCC1=CC=CC=C1 D72522 [1,1,0,0,0,0|2,0,0]=4 90 B13R1.133 CC(C)C(=O)CC1=CC=C(Br)C=C1 N12783 [0,1,0,0,1,0|0,0,0]=2 91 B13R1.133 CC(C)C(=O)CC1=CC=C(Cl)C=C1 N12699 [0,1,0,0,1,0|0,0,0]=2 92 B13R1.133 CC(C)[C@@H](N)CC1=CC=C(Cl)C=C1 N12824 [0,1,0,0,1,0|1,0,1]=4 93 B13R1.133 CC(C)[C@@H](N)CC1=CC=C(F)C=C1 N12963 [0,1,0,0,1,0|1,0,1]=4 94 B13R1.133 CC1=CC=C(CC(=O)C(C)C)C=C1 N12878 [0,1,0,0,1,0|0,0,0]=2 95 B13R1.133 CC1=CC=C(C[C@H](N)C(C)C)C=C1 N14553 [0,1,0,0,1,0|1,0,1]=4 96 B13R1.148 CC(C)C(=O)CC1=CC=CC(Br)=C1 N14160 [0,1,0,0,1,0|0,0,0]=2 97 B13R1.148 CC(C)C(=O)CC1=CC=CC(F)=C1 N14140 [0,1,0,0,1,0|0,0,0]=2 98 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(Br)=C1 N14534 [0,1,0,0,1,0|1,0,1]=4 99 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(Cl)=C1 N14530 [0,1,0,0,1,0|1,0,1]=4 100 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(F)=C1 N14523 [0,1,0,0,1,0|1,0,1]=4 101 B13R1.148 CC1=CC=CC(CC(=O)C(C)C)=C1 N14168 [0,1,0,0,1,0|0,0,0]=2 102 B13R1.202 CC(C)C(=O)CC1=C(Br)C=CC=C1 N12903 [0,1,0,0,1,0|0,0,0]=2 103 B13R1.202 CC(C)[C@@H](N)CC1=C(Br)C=CC=C1 N14509 [0,1,0,0,1,0|1,0,1]=4 104 B13R1.202 CC(C)[C@@H](N)CC1=C(Cl)C=CC=C1 N14498 [0,1,0,0,1,0|1,0,1]=4 105 B13R1.202 CC(C)[C@@H](N)CC1=C(F)C=CC=C1 N14504 [0,1,0,0,1,0|1,0,1]=4 106 B13R1.202 CC1=C(C[C@H](N)C(C)C)C=CC=C1 N14515 [0,1,0,0,1,0|1,0,1]=4 107 B13R1.132 CC(C)C[C@H](N)C1=CC=C(Cl)C=C1 N12881 [0,1,0,0,1,0|1,0,1]=4 108 B13R1.132 CC(C)C[C@H](N)C1=CC=C(Cl)C=C1 N14470 [0,1,0,0,1,0|1,0,1]=4 109 B13R1.132 CC1=CC=C([C@@H](N)CC(C)C)C=C1 N14476 [0,1,0,0,1,0|1,0,1]=4 110 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Br)=C1 N14471 [0,1,0,0,1,0|1,0,1]=4 111 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Cl)=C1 N14468 [0,1,0,0,1,0|1,0,1]=4 112 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Cl)=C1 N14469 [0,1,0,0,1,0|1,0,1]=4 113 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(F)=C1 N14465 [0,1,0,0,1,0|1,0,1]=4 114 B13R1.147 CC1=CC=CC([C@@H](N)CC(C)C)=C1 N14475 [0,1,0,0,1,0|1,0,1]=4 115 B13R1.201 CC(=O)CC(=O)C1=C(C)C=CC=C1 78540 [0,1,0,0,1,0|1,0,1]=4 116 B13R1.201 CC(C)C[C@H](N)C1=C(Cl)C=CC=C1 N14466 [0,1,0,0,1,0|1,0,1]=4 117 B13R1.201 CC(C)C[C@H](N)C1=C(Cl)C=CC=C1 N14467 [0,1,0,0,1,0|1,0,1]=4 118 B13R1.201 CC(C)C[C@H](N)C1=C(F)C=CC=C1 N14464 [0,1,0,0,1,0|1,0,1]=4 119 B13R1.201 CC(C)OC(=O)C1=C(N)C=CC=C1 24666 [0,1,0,0,1,0|1,0,0]=3 120 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14472 [0,1,0,0,1,0|1,0,1]=4 121 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14473 [0,1,0,0,1,0|1,0,1]=4 122 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14474 [0,1,0,0,1,0|1,0,1]=4 123 B13R1.1116 CC(C)(C)OC(=O)CC1=CC=CN1 AC4542 [0,1,0,0,1,0|2,0,0]=4 124 B15R1.496 CC(C)C[C@H](N)C(=O)NC1=CC=CC=C1 F15370 [0,1,0,0,0,1|1,0,0]=3 125 B15R1.741 C[C@@H](C#N)NC(=O)OCC1=CC=CC=C1 C90334 [0,1,0,0,0,1|1,0,1]=4 126 B15R1.741 C[C@@H](C=O)NC(=O)OCC1=CC=CC=C1 F13079 [0,1,0,0,0,1|1,0,1]=4 127 B15R1.741 C[C@@H](CN)NC(=O)OCC1=CC=CC=C1 I11641 [0,1,0,0,0,1|1,0,0]=3 128 B15R1.741 C[C@@H](CN)NC(=O)OCC1=CC=CC=C1 W13061 [0,1,0,0,0,1|1,0,0]=3 129 B15R1.741 C[C@@H](CN)NC(=O)OCC1=CC=CC=C1 W19059 [0,1,0,0,0,1|1,0,0]=3 130 B15R1.741 O=C(CCl)CC(=O)OCC1=CC=CC=C1 80272 [0,1,0,0,0,1|1,0,1]=4 131 B15R1.3465 CC(C)(C)OC(=O)CNC1=NC=CC=C1 24420 [0,1,0,0,0,1|2,0,0]=4 132 B15R1.8426 CC(C)NC(=O)NC1=C(Cl)C=C(O)C=C1 97048 [0,2,0,0,0,0|2,0,0]=4 133 B15R1.910 CC(C)[C@H](N)C(=O)NC1=CC=C(F)C=C1 F21192 [0,2,0,0,0,0|1,0,0]=3 134 B15R1.8303 CC(C)(C)OC(=O)CC1=CC(Br)=NC=C1 97743 [0,2,0,0,0,0|2,0,0]=4 135 B15R1.8303 CC(C)(C)OC(=O)CC1=CC(F)=NC=C1 97742 [0,2,0,0,0,0|2,0,0]=4 136 B15R1.8303 CC(C)(C)OC(=O)CC1=CC(N)=CC=C1 C77549 [0,2,0,0,0,0|1,0,0]=3 137 B15R1.8303 CC(C)(C)OC(=O)CC1=CC=CC(Br)=N1 C91632 [0,2,0,0,0,0|2,0,0]=4 138 B15R1.8303 CC(C)(C)OC(=O)CC1=CC=CC(Cl)=N1 97741 [0,2,0,0,0,0|2,0,0]=4 139 B15R1.8303 CC(C)(C)OC(=O)NC1=CC=CC(S)=C1 AT21190 [0,2,0,0,0,0|2,0,0]=4 140 B15R1.981 COC(=O)CC(=O)CC1=CC=C(Br)C=C1 C77937 [0,2,0,0,0,0|1,0,1]=4 141 B15R1.981 COC(=O)CC(=O)CC1=CC=C(F)C=C1 C78259 [0,2,0,0,0,0|1,0,1]=4 142 B15R1.982 COC(=O)CC(=O)CC1=CC=CC(F)=C1 C78619 [0,2,0,0,0,0|1,0,1]=4 143 B13R2.15 O=C1CCC[C@@H]1C2=CC=CC=C2 E72778 [1,0,0,1,0,0|0,0,0]=2 144 B13R2.15 O=C1OCC[C@@H]1C2=CC=CC=C2 D78713 [1,0,0,1,0,0|1,0,0]=3 145 B13R2.26 CCCC1=NC2=C(C=CC=C2)S1 I11407 [1,0,0,1,0,0|1,1,0]=4 146 B13R2.135 CC[C@@H]1C(=O)NC2=C1C=CC=C2 61576 [1,0,0,1,0,0|1,0,0]=3 147 B13R2.135 CN[C@@H]1C(=O)NC2=C1C=CC=C2 71829 [1,0,0,1,0,0|2,0,0]=4 148 B13R2.163 O=C1CCOC2=C(C=CC=C2)N1 W18693 [1,0,0,1,0,0|2,0,0]=4 149 B13R2.163 O=C1CNCC2=C(C=CC=C2)N1 D73440 [1,0,0,1,0,0|2,0,0]=4 150 B13R2.221 NC1(CC2=CC=CC=C2)CCC1 59756 [1,0,0,1,0,0|1,0,1]=4 151 B13R2.221 NC1(CC2=CC=CC=C2)CCC1 F14473 [1,0,0,1,0,0|1,0,1]=4 152 B13R2.328 C[C@H]1CC(=O)NC2=C1C=CC=C2 F18223 [1,0,0,1,0,0|1,0,0]=3 153 B13R2.10 CC1CNC(C2=CC=CC=C2)C1 AT22579 [1,0,0,1,0,0|1,0,0]=3 154 B13R2.10 OC1COC(C2=CC=CC=C2)C1 AT10452 [1,0,0,1,0,0|2,0,0]=4 155 B13R2.72 CC(C)[C@@H]1CNC2=C1C=CC=C2 S10855 [1,0,0,1,0,0|1,0,1]=4 156 B13R2.3122 CC1(C)CCNC2=C1C=CC=C2 86979 [1,0,0,1,0,0|1,0,1]=4 157 B13R2.3122 CC1(C)CCSC2=C1C=CC=C2 82057 [1,0,0,1,0,0|1,0,1]=4 158 B13R2.359 CC1(C)C(=O)NC2=C1C=NC=C2 85488 [0,0,0,1,1,0|2,0,0]=4 159 B13R2.369 C[C@@H]1SC2=C(C=CC=C2)NC1=O 77381 [0,0,0,1,1,0|2,0,0]=4 160 B13R2.369 N[C@H]1CC2=C(C=CC=C2)NC1=O 81089 [0,0,0,1,1,0|2,0,0]=4 161 B13R2.238 CC1CC(N)(C2=CC=CC=C2)C1 92973 [0,0,0,1,1,0|1,0,1]=4 162 B13R2.12159 CC1(C)C[C@H](N)C2=C1C=CC=C2 AT19561 [0,0,0,1,1,0|1,0,1]=4 163 B13R2.12159 CC1(C)OC(=O)C2=C1C=CC=C2 A10944 [0,0,0,1,1,0|1,0,0]=3 164 B15R2.33 CN1CCC(=O)[C@@H](C2=CC=CC=C2)C1 C12194 [0,0,0,1,0,1|1,0,0]=3 165 B15R2.325 N[C@H]1CC(=O)N(CC2=CC=CC=C2)C1 20344 [0,0,0,1,0,1|1,0,0]=3 166 B15R2.505 C[C@@H]1C[C@@H]1C(=O)OCC2=CC=CC=C2 W13680 [0,0,0,1,0,1|0,0,0]=2 167 B15R2.505 C[C@H]1C[C@@H]1C(=O)OCC2=CC=CC=C2 W15895 [0,0,0,1,0,1|0,0,0]=2 168 B15R2.24494 O=C(C=C1CC1)OCC2=CC=CC=C2 97890 [0,0,0,1,0,1|0,0,2]=4 169 B15R2.4244 CC(C)[C@H](N)C1=CC2=C(C=CC=C2)O1 N14711 [0,1,0,1,0,0|0,0,2]=4 170 B15R2.4244 CC(C)[C@H](N)C1=NC2=C(C=CC=C2)N1 AC3299 [0,1,0,1,0,0|2,0,0]=4 171 B15R2.4244 CC(C)[C@H](N)C1=NC2=C(C=CC=C2)N1 AC4964 [0,1,0,1,0,0|2,0,0]=4 172 B15R2.309 N[C@H]1CC(=O)N(C2=CC=C(Cl)C=C2)C1 66440 [0,1,0,1,0,0|2,0,0]=4 173 B15R2.13973 CC1(C)OC(=O)NC2=C1C=C(Br)C=C2 25726 [0,1,0,1,0,0|2,0,0]=4 174 B15R2.314 CC1CN(CC2=CC=CC=C2)CC1N AT11274 [0,1,0,1,0,0|2,0,0]=4 175 B15R2.7491 CC1(C)CC(=O)NC2=C1C=CC(Br)=C2 F53619 [0,1,0,1,0,0|1,0,0]=3 176 B15R2.7491 CC1(C)CC(=O)NC2=C1C=CC(F)=C2 F17619 [0,1,0,1,0,0|1,0,0]=3 177 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 N12265 [1,0,0,0,1,0|1,0,1]=4 178 B11R1.30 CCOC(=O)CC1=CC=CN1 P11574 [1,0,0,0,1,0|2,0,0]=4 179 B11R1.91 CC(C)NCC1=CC=CN=C1 AC5151 [1,0,0,0,1,0|2,0,0]=4 180 B11R1.91 CC(C)NCC1=CC=NC=C1 AC6648 [1,0,0,0,1,0|2,0,0]=4 181 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12753 [1,0,0,0,1,0|2,0,0]=4 182 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12763 [1,0,0,0,1,0|2,0,0]=4 183 B11R1.91 C[C@H](N)CSC1=CC=CC=C1 AT26670 [1,0,0,0,1,0|2,0,0]=4 184 B11R1.36 C=C(C1=CC=CC=C1)C(C)C W11468 [0,0,0,0,2,0|1,0,0]=3 185 B11R1.36 CC(C)C(=O)C1=CC=NC=C1 N12821 [0,0,0,0,2,0|1,0,0]=3 186 B11R1.36 C[C@H](N)C(=O)C1=CC=CC=C1 F13376 [0,0,0,0,2,0|1,0,0]=3 187 B13R1.42 CCC[C@H](O)CCC1=CC=CC=C1 F19746 [1,0,0,0,0,1|0,0,2]=4 188 B13R1.42 C\C=C/C(=O)OCC1=CC=CC=C1 W13679 [1,0,0,0,0,1|0,0,2]=4 189 B13R1.42 C\C=C\C(=O)OCC1=CC=CC=C1 W15659 [1,0,0,0,0,1|0,0,2]=4 190 B13R1.42 C\C=C\C(=O)OCC1=CC=CC=C1 W18720 [1,0,0,0,0,1|0,0,2]=4 191 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 31544 [1,0,0,0,0,1|1,0,0]=3 192 B13R1.337 CC(C)CCNCC1=CC=CC=C1 F52160 [1,0,0,0,0,1|0,0,1]=3 193 B13R1.337 CN(C)CCCOC1=CC=CC=C1 S10605 [1,0,0,0,0,1|1,0,1]=4 194 B13R1.337 C[C@H](O)CCOCC1=CC=CC=C1 AT15545 [1,0,0,0,0,1|1,0,1]=4