0 B13R2.10 CC1CNC(C2=CC=CC=C2)C1 AT22579 [0,0,0,0,0,0|2,0,0]=2 1 B13R2.10 C[C@H]1CN=C(C2=CC=CC=C2)O1 V10353 [0,0,0,0,0,0|1,0,1]=2 2 B13R2.10 C[C@H]1CN=C(C2=CC=CC=C2)O1 V10354 [0,0,0,0,0,0|1,0,1]=2 3 B13R2.10 C[C@H]1COC(C2=CC=CC=C2)=N1 V10356 [0,0,0,0,0,0|1,0,1]=2 4 B13R2.10 C[C@H]1COC(C2=CC=CC=C2)=N1 V10357 [0,0,0,0,0,0|1,0,1]=2 5 B13R2.10 O=C1CC[C@@H](C2=CC=CC=C2)N1 C15346 [0,0,0,0,0,0|3,0,1]=4 6 B13R2.10 OC1COC(C2=CC=CC=C2)C1 AT10452 [0,0,0,0,0,0|2,0,0]=2 7 B12R2.2 C1=CC([C@@H]2CCCN2)=CC=N1 CS3573 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.2 C1=CC([C@@H]2CCCN2)=CC=N1 CS3576 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.2 C1=CC=C(C2=CCCC2)C=C1 F14027 [1,0,0,0,0,0|2,0,1]=4 10 B12R2.2 C1=CC=C(C2OCCO2)C=C1 H10024 [1,0,0,0,0,0|0,0,0]=1 11 B12R2.2 C1=CC=C([C@@H]2CCON2)C=C1 E70057 [1,0,0,0,0,0|3,0,0]=4 12 B12R2.2 C1=CN=C(C2CCCC2)C=C1 C91562 [1,0,0,0,0,0|3,0,0]=4 13 B12R2.2 C1=CN=C([C@@H]2CCCN2)C=C1 Y11599 [1,0,0,0,0,0|3,0,0]=4 14 B12R2.2 C1=CN=CC([C@@H]2CCCN2)=C1 N14317 [1,0,0,0,0,0|3,0,0]=4 15 B12R2.2 C1=CN=CC([C@@H]2CCCN2)=C1 Y10529 [1,0,0,0,0,0|3,0,0]=4 16 B14R2.8 CC[C@H]1COC(C2=CC=CC=C2)=N1 V10362 [0,1,0,0,0,0|1,0,1]=3 17 B14R2.8 CC[C@H]1COC(C2=CC=CC=C2)=N1 V10363 [0,1,0,0,0,0|1,0,1]=3 18 B14R2.8 OC[C@H]1COC(C2=CC=CC=C2)=N1 AC6881 [0,1,0,0,0,0|1,0,1]=3 19 B14R2.20 CC1=CC=C([C@H]2CCN(C)C2)C=C1 N13853 [0,1,0,0,0,0|3,0,0]=4 20 B14R2.20 CN1CC[C@H](C2=CC=C(Br)C=C2)C1 Y10652 [0,1,0,0,0,0|3,0,0]=4 21 B14R2.20 C[C@H]1CN=C(C2=CC=C(Cl)C=C2)O1 V10367 [0,1,0,0,0,0|1,0,1]=3 22 B14R2.20 C[C@H]1CN=C(C2=CC=C(Cl)C=C2)O1 V10368 [0,1,0,0,0,0|1,0,1]=3 23 B14R2.20 C[C@H]1COC(C2=CC=C(Cl)C=C2)=N1 V10370 [0,1,0,0,0,0|1,0,1]=3 24 B14R2.20 C[C@H]1COC(C2=CC=C(Cl)C=C2)=N1 V10371 [0,1,0,0,0,0|1,0,1]=3 25 B14R2.22 CN1CC[C@H](C2=CC=CC(Br)=C2)C1 N13851 [0,1,0,0,0,0|3,0,0]=4 26 B14R2.22 CN1CC[C@H](C2=CC=CC(Cl)=C2)C1 N13849 [0,1,0,0,0,0|3,0,0]=4 27 B14R2.22 CN1CC[C@H](C2=CC=CC(F)=C2)C1 N13848 [0,1,0,0,0,0|3,0,0]=4 28 B14R2.256 CC1=C([C@H]2CCN(C)C2)C=CC=C1 N13852 [0,1,0,0,0,0|3,0,0]=4 29 B14R2.256 CC1CNC(C2=C(F)C=CC=C2)C1 D76608 [0,1,0,0,0,0|2,0,0]=3 30 B14R2.256 CN1CC[C@H](C2=C(Br)C=CC=C2)C1 N13850 [0,1,0,0,0,0|3,0,0]=4 31 B14R2.256 CN1CC[C@H](C2=C(Cl)C=CC=C2)C1 F13492 [0,1,0,0,0,0|3,0,0]=4 32 B14R2.260 C[C@@H]1OC(C2=CC=CC=C2)O[C@H]1C AC8305 [0,1,0,0,0,0|0,0,0]=1 33 B14R2.403 CC1(C)CN=C(C2=CC=CC=C2)O1 V10355 [0,1,0,0,0,0|1,0,1]=3 34 B12R1.27 C[C@@H](C=O)OCC1=CC=CC=C1 C10570 [0,0,1,0,0,0|0,0,2]=3 35 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 AT22580 [0,0,1,0,0,0|0,0,0]=1 36 B12R1.30 CCCC[C@H](N)C1=CC=NC=C1 N12642 [0,0,1,0,0,0|3,0,0]=4 37 B12R1.30 CCCC[C@H](N)C1=NC=CC=C1 N12541 [0,0,1,0,0,0|3,0,0]=4 38 B12R1.30 CCOC[C@H](N)C1=CC=CC=C1 D73857 [0,0,1,0,0,0|3,0,0]=4 39 B12R1.30 C[C@H](NCCO)C1=CC=CC=C1 N12299 [0,0,1,0,0,0|3,0,0]=4 40 B12R1.30 C[C@H](NCCO)C1=CC=CC=C1 N12300 [0,0,1,0,0,0|3,0,0]=4 41 B12R1.30 O=C(OCCO)C1=CC=CC=C1 E72195 [0,0,1,0,0,0|1,0,2]=4 42 B12R1.107 CC(C)C[C@H](N)C1=CC=NC=C1 AC7589 [0,0,1,0,0,0|3,0,0]=4 43 B12R1.107 CC(C)C[C@H](O)C1=CN=CC=C1 F50992 [0,0,1,0,0,0|2,0,0]=3 44 B12R1.107 CC(C)N[C@@H](C)C1=CC=CC=C1 A11925 [0,0,1,0,0,0|2,0,0]=3 45 B12R1.107 CN(C)C[C@H](O)C1=CC=CC=C1 C78399 [0,0,1,0,0,0|2,0,0]=3 46 B12R1.252 C[C@H](Br)COCC1=CC=CC=C1 C92726 [0,0,1,0,0,0|1,0,0]=2 47 B12R1.252 C[C@H](Br)COCC1=CC=CC=C1 C92727 [0,0,1,0,0,0|1,0,0]=2 48 B12R1.252 C[C@H](O)CCCC1=CN=CC=C1 F53169 [0,0,1,0,0,0|2,0,0]=3 49 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 AC4615 [0,0,1,0,0,0|1,0,0]=2 50 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 AT23036 [0,0,1,0,0,0|1,0,0]=2 51 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 D71911 [0,0,1,0,0,0|1,0,0]=2 52 B12R2.22 BrC1CC(C2=CC=CC=C2)C1 AT17150 [0,0,0,0,1,0|2,0,0]=3 53 B12R2.22 NC1CC(C2=CC=CN=C2)C1 F53675 [0,0,0,0,1,0|3,0,0]=4 54 B12R2.22 NC1CN(C2=CC=CC=C2)C1 P20296 [0,0,0,0,1,0|3,0,0]=4 55 B12R2.22 O=C1C[C@@H](C2=CC=CC=C2)N1 76187 [0,0,0,0,1,0|2,0,1]=4 56 B12R2.22 OC1CC(C2=CC=CC=C2)C1 91859 [0,0,0,0,1,0|2,0,0]=3 57 B14R2.19 CN1CN[C@@H](CC2=CC=CC=C2)C1 98527 [0,0,0,0,0,1|3,0,0]=4 58 B14R2.21 BrC1CCOC(C2=CC=CC=C2)C1 C91908 [0,0,0,0,0,1|2,0,0]=3 59 B14R2.21 CC1CNCC(C2=CC=CC=C2)O1 F18853 [0,0,0,0,0,1|1,0,0]=2 60 B14R2.21 CN1CCO[C@H](C2=CC=CC=C2)C1 F18887 [0,0,0,0,0,1|2,0,0]=3 61 B14R2.21 C[C@@H]1CNC[C@@H](C2=CC=CC=C2)O1 F18886 [0,0,0,0,0,1|1,0,0]=2 62 B14R2.21 C[C@H]1CN(C2=CC=CC=C2)CCN1 AT25535 [0,0,0,0,0,1|3,0,0]=4 63 B14R2.21 C[C@H]1CNCC(C2=CC=CC=C2)O1 F18909 [0,0,0,0,0,1|1,0,0]=2 64 B14R2.21 C[C@H]1CNCC(C2=CC=CC=C2)O1 F18910 [0,0,0,0,0,1|1,0,0]=2 65 B14R2.21 C[C@H]1CNC[C@@H](C2=CC=CC=C2)O1 F19004 [0,0,0,0,0,1|1,0,0]=2 66 B14R2.21 NC1CCOC(C2=CC=CC=C2)C1 AT18935 [0,0,0,0,0,1|2,0,0]=3 67 B14R2.21 N[C@H]1CCO[C@H](C2=CC=CC=C2)C1 C77111 [0,0,0,0,0,1|2,0,0]=3 68 B14R2.21 OC1CCCC(C2=CC=CC=C2)C1 D85581 [0,0,0,0,0,1|3,0,0]=4 69 B14R2.21 O[C@@H]1CCO[C@H](C2=CC=CC=C2)C1 AT18948 [0,0,0,0,0,1|2,0,0]=3 70 B14R2.68 CC1CN[C@H](C2=CC=CC=C2)CO1 F52471 [0,0,0,0,0,1|1,0,0]=2 71 B14R2.68 CC1COC(C2=CC=CC=C2)CN1 F17617 [0,0,0,0,0,1|1,0,0]=2 72 B14R2.68 CC1COC(C2=CC=CC=C2)CN1 F18861 [0,0,0,0,0,1|1,0,0]=2 73 B14R2.68 C[C@@H]1CN[C@H](C2=CC=CC=C2)CO1 83572 [0,0,0,0,0,1|1,0,0]=2 74 B14R2.68 C[C@@H]1CN[C@H](C2=CC=CC=C2)CO1 F17071 [0,0,0,0,0,1|1,0,0]=2 75 B14R2.68 C[C@@H]1CO[C@H](C2=CC=CC=C2)CN1 F18847 [0,0,0,0,0,1|1,0,0]=2 76 B14R2.68 C[C@@H]1CO[C@H](C2=CC=CC=C2)CN1 F19008 [0,0,0,0,0,1|1,0,0]=2 77 B14R2.68 C[C@@H]1CO[C@H](C2=CC=CC=C2)CN1 F19009 [0,0,0,0,0,1|1,0,0]=2 78 B14R2.68 C[C@H]1CO[C@H](C2=CC=CC=C2)CN1 F19007 [0,0,0,0,0,1|1,0,0]=2 79 B14R2.68 C[C@H]1CO[C@H](C2=CC=CC=C2)CN1 F19010 [0,0,0,0,0,1|1,0,0]=2 80 B14R2.68 O=C1CN[C@H](C2=CC=CC=C2)CO1 77665 [0,0,0,0,0,1|2,0,1]=4 81 B14R2.68 O=C1CN[C@H](C2=CC=CC=C2)CO1 P18324 [0,0,0,0,0,1|2,0,1]=4 82 B11R1.12 CCC(CC)C1=CC=CC=C1 T71625 [1,0,1,0,0,0|1,0,0]=3 83 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 N12976 [1,0,1,0,0,0|2,0,0]=4 84 B11R1.12 COB(OC)C1=NC=CC=C1 60028 [1,0,1,0,0,0|2,0,0]=4 85 B11R1.16 C#CC[C@H](O)C1=CC=CC=C1 W15219 [1,0,1,0,0,0|0,0,2]=4 86 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 N12265 [1,0,1,0,0,0|1,0,0]=3 87 B11R1.16 CNC[C@H](C)C1=CC=CC=C1 C11240 [1,0,1,0,0,0|2,0,0]=4 88 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 C11214 [1,0,1,0,0,0|1,0,0]=3 89 B11R1.16 COC[C@H](N)C1=CC=CC=C1 AC6537 [1,0,1,0,0,0|2,0,0]=4 90 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14729 [1,0,1,0,0,0|2,0,0]=4 91 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14730 [1,0,1,0,0,0|2,0,0]=4 92 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 C80043 [1,0,1,0,0,0|1,0,0]=3 93 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [1,0,1,0,0,0|2,0,0]=4 94 B11R1.28 OCCCCC1=CC=NC=C1 31475 [1,0,1,0,0,0|2,0,0]=4 95 B11R1.91 CC(C)NCC1=CC=CN=C1 AC5151 [1,0,1,0,0,0|2,0,0]=4 96 B11R1.91 CC(C)NCC1=CC=NC=C1 AC6648 [1,0,1,0,0,0|2,0,0]=4 97 B13R1.405 CCO[C@@H](C(=O)O)C1=CC=CC=C1 AC5916 [0,1,1,0,0,0|2,0,0]=4 98 B13R1.254 C#CC(C)(C)OCC1=CC=CC=C1 70201 [0,1,1,0,0,0|1,0,1]=4 99 B13R1.254 CC(C)(CO)NCC1=CC=CC=C1 C14021 [0,1,1,0,0,0|1,0,0]=3 100 B13R1.254 CC(C)(CO)NCC1=CC=CC=C1 Y10251 [0,1,1,0,0,0|1,0,0]=3 101 B13R1.254 CC(C)(CO)OCC1=CC=CC=C1 AC7256 [0,1,1,0,0,0|0,0,0]=2 102 B13R1.351 C[C@H](O)[C@H](C)OCC1=CC=CC=C1 P19299 [0,1,1,0,0,0|0,0,0]=2 103 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O C12171 [0,1,1,0,0,0|0,0,1]=3 104 B13R1.417 CCC(CC)NCC1=CC=CC=C1 79980 [0,1,1,0,0,0|2,0,0]=4 105 B13R1.417 CC[C@@H](CO)NCC1=CC=CC=C1 AT20438 [0,1,1,0,0,0|1,0,0]=3 106 B13R1.417 CC[C@@H](CO)NCC1=CC=CC=C1 AT20477 [0,1,1,0,0,0|1,0,0]=3 107 B13R1.24 C=CCCC[C@H](O)C1=CC=CC=C1 96854 [0,1,1,0,0,0|1,0,1]=4 108 B13R1.24 CCCCC[C@H](N)C1=CC=CC=C1 N12530 [0,1,1,0,0,0|2,0,0]=4 109 B13R1.24 O=C(OCCCCl)C1=CC=CC=C1 N10696 [0,1,1,0,0,0|0,0,2]=4 110 B13R1.132 CC(C)C[C@H](N)C1=CC=C(Cl)C=C1 N12881 [0,1,1,0,0,0|2,0,0]=4 111 B13R1.132 CC(C)C[C@H](N)C1=CC=C(Cl)C=C1 N14470 [0,1,1,0,0,0|2,0,0]=4 112 B13R1.132 CC1=CC=C([C@@H](N)CC(C)C)C=C1 N14476 [0,1,1,0,0,0|2,0,0]=4 113 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Br)=C1 N14471 [0,1,1,0,0,0|2,0,0]=4 114 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Cl)=C1 N14468 [0,1,1,0,0,0|2,0,0]=4 115 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(Cl)=C1 N14469 [0,1,1,0,0,0|2,0,0]=4 116 B13R1.147 CC(C)C[C@H](N)C1=CC=CC(F)=C1 N14465 [0,1,1,0,0,0|2,0,0]=4 117 B13R1.147 CC1=CC=CC([C@@H](N)CC(C)C)=C1 N14475 [0,1,1,0,0,0|2,0,0]=4 118 B13R1.201 CC(C)C[C@H](N)C1=C(Cl)C=CC=C1 N14466 [0,1,1,0,0,0|2,0,0]=4 119 B13R1.201 CC(C)C[C@H](N)C1=C(Cl)C=CC=C1 N14467 [0,1,1,0,0,0|2,0,0]=4 120 B13R1.201 CC(C)C[C@H](N)C1=C(F)C=CC=C1 N14464 [0,1,1,0,0,0|2,0,0]=4 121 B13R1.201 CC(C)OC(=O)C1=C(N)C=CC=C1 24666 [0,1,1,0,0,0|0,0,2]=4 122 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14472 [0,1,1,0,0,0|2,0,0]=4 123 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14473 [0,1,1,0,0,0|2,0,0]=4 124 B13R1.201 CC1=C([C@@H](N)CC(C)C)C=CC=C1 N14474 [0,1,1,0,0,0|2,0,0]=4 125 B13R1.513 CC(C)CNCC1=CC=C(Br)C=C1 11874 [0,1,1,0,0,0|2,0,0]=4 126 B13R1.718 C[C@@H](CO)COCC1=CC=CC=C1 50122 [0,1,1,0,0,0|0,0,0]=2 127 B13R1.718 NC[C@H](F)COCC1=CC=CC=C1 92939 [0,1,1,0,0,0|1,0,0]=3 128 B13R1.718 NC[C@H](O)COCC1=CC=CC=C1 77446 [0,1,1,0,0,0|0,0,0]=2 129 B13R1.718 NC[C@H](O)COCC1=CC=CC=C1 AT18638 [0,1,1,0,0,0|0,0,0]=2 130 B13R1.718 NC[C@H](O)COCC1=CC=CC=C1 AT18639 [0,1,1,0,0,0|0,0,0]=2 131 B13R1.718 N[C@@H](CO)CSCC1=CC=CC=C1 AT13352 [0,1,1,0,0,0|1,1,0]=4 132 B13R1.718 O[C@H](CBr)COCC1=CC=CC=C1 T70304 [0,1,1,0,0,0|0,0,0]=2 133 B13R1.718 O[C@H](CCl)CNCC1=CC=CC=C1 C12977 [0,1,1,0,0,0|1,0,0]=3 134 B13R1.718 O[C@H](CCl)COCC1=CC=CC=C1 D72522 [0,1,1,0,0,0|0,0,0]=2 135 B13R2.12 ClC1=CC=C(C2=NCCO2)C=C1 V10297 [1,1,0,0,0,0|1,0,1]=4 136 B13R2.12 NC1=CC=C(C2OCCO2)C=C1 A51126 [1,1,0,0,0,0|0,0,0]=2 137 B13R2.12 OC1=CC=C([C@@H]2CCCN2)C=C1 N11133 [1,1,0,0,0,0|2,0,0]=4 138 B13R2.12 OC1=CC=C([C@@H]2CCCN2)C=C1 N11442 [1,1,0,0,0,0|2,0,0]=4 139 B13R2.13 ClC1=CC(C2OCCO2)=CC=C1 F12694 [1,1,0,0,0,0|0,0,0]=2 140 B13R2.13 NC1=CC=CC([C@@H]2CCCN2)=C1 N14348 [1,1,0,0,0,0|2,0,0]=4 141 B13R2.13 OC1=CC([C@@H]2CCCN2)=CC=C1 I11612 [1,1,0,0,0,0|2,0,0]=4 142 B13R2.15 O=C1CCC[C@@H]1C2=CC=CC=C2 E72778 [1,1,0,0,0,0|2,0,0]=4 143 B13R2.15 O[C@@H]1CCN[C@@H]1C2=CC=CC=C2 AT11756 [1,1,0,0,0,0|2,0,0]=4 144 B13R2.18 ClC1=C([C@@H]2CCCN2)C=CC=C1 N12754 [1,1,0,0,0,0|2,0,0]=4 145 B13R2.18 OC1=C([C@@H]2CCCN2)C=CC=C1 I11883 [1,1,0,0,0,0|2,0,0]=4 146 B13R2.52 CNC1CC(C2=CC=CN=C2)C1 F53680 [0,1,0,0,1,0|2,0,0]=4 147 B13R2.52 CNC1CC(C2=CC=NC=C2)C1 F53670 [0,1,0,0,1,0|2,0,0]=4 148 B13R2.147 NC1CC(C2=CC=C(Br)C=C2)C1 F53252 [0,1,0,0,1,0|2,0,0]=4 149 B13R2.147 NC1CC(C2=CC=C(Br)C=C2)C1 F53253 [0,1,0,0,1,0|2,0,0]=4 150 B13R2.147 NC1CC(C2=CC=C(F)C=C2)C1 F53254 [0,1,0,0,1,0|2,0,0]=4 151 B13R2.147 NC1CC(C2=CC=C(F)C=C2)C1 F53309 [0,1,0,0,1,0|2,0,0]=4 152 B13R2.147 O[C@H]1C[C@H](C2=CC=C(F)C=C2)C1 91836 [0,1,0,0,1,0|2,0,0]=4 153 B13R2.151 O[C@H]1C[C@H](C2=CC=CC(Br)=C2)C1 91840 [0,1,0,0,1,0|2,0,0]=4 154 B13R2.151 O[C@H]1C[C@H](C2=CC=CC(F)=C2)C1 91841 [0,1,0,0,1,0|2,0,0]=4 155 B13R2.238 CC1CC(N)(C2=CC=CC=C2)C1 92973 [0,1,0,0,1,0|1,0,0]=3 156 B15R2.17 IC[C@H]1CCCC(C2=CC=CC=C2)O1 96855 [0,1,0,0,0,1|1,0,0]=3 157 B15R2.17 NC[C@H]1CCCC(C2=CC=CC=C2)O1 96856 [0,1,0,0,0,1|1,0,0]=3 158 B15R2.30 CC1=CC=CC(C2CNCC(C)O2)=C1 F19095 [0,1,0,0,0,1|1,0,0]=3 159 B15R2.30 CC1=CC=CC([C@@H]2CNC[C@@H](C)O2)=C1 F19001 [0,1,0,0,0,1|1,0,0]=3 160 B15R2.30 CC1=CC=CC([C@@H]2CNC[C@@H](C)O2)=C1 F19003 [0,1,0,0,0,1|1,0,0]=3 161 B15R2.30 CC1=CC=CC([C@@H]2CNC[C@H](C)O2)=C1 F19000 [0,1,0,0,0,1|1,0,0]=3 162 B15R2.30 CC1=CC=CC([C@@H]2CNC[C@H](C)O2)=C1 F19002 [0,1,0,0,0,1|1,0,0]=3 163 B15R2.94 CC1CC(C2=CC=CC=C2)CCC1=O AC8439 [0,1,0,0,0,1|2,0,0]=4 164 B15R2.586 CC1(C)CNC[C@@H](C2=CC=CC=C2)O1 F18987 [0,1,0,0,0,1|1,0,0]=3 165 B15R2.586 CC1(C)CNC[C@@H](C2=CC=CC=C2)O1 F19140 [0,1,0,0,0,1|1,0,0]=3 166 B15R2.1 OC[C@H]1CCC(C2=CC=CC=C2)=NO1 W13077 [0,1,0,0,0,1|1,0,1]=4 167 B15R2.389 CC1COC(C2=CC=CC=C2)C(C)N1 A11950 [0,1,0,0,0,1|1,0,0]=3 168 B15R2.59 CC(C)[C@@H]1COC(C2=CC=CC=C2)=N1 V10335 [0,2,0,0,0,0|1,0,1]=4 169 B15R2.59 CC(C)[C@@H]1COC(C2=CC=CC=C2)=N1 V10358 [0,2,0,0,0,0|1,0,1]=4 170 B15R2.275 CC[C@H]1COC(C2=CC=C(Cl)C=C2)=N1 V10379 [0,2,0,0,0,0|1,0,1]=4 171 B15R2.275 CC[C@H]1COC(C2=CC=C(Cl)C=C2)=N1 V10380 [0,2,0,0,0,0|1,0,1]=4 172 B15R2.18934 CC1(C)CN=C(C2=CC=C(Cl)C=C2)O1 V10369 [0,2,0,0,0,0|1,0,1]=4 173 B15R2.18934 CC1(C)COC(C2=CC=C(Cl)C=C2)=N1 V10372 [0,2,0,0,0,0|1,0,1]=4 174 B13R2.3 C1=CC=C([C@@H]2CCCCN2)C=C1 AT22864 [0,0,1,1,0,0|2,0,0]=4 175 B13R2.3 C1=CC=C([C@@H]2CNCCO2)C=C1 F18968 [0,0,1,1,0,0|2,0,0]=4 176 B13R2.1613 CC[C@@H]1NCCC2=C1C=CC=C2 AT22655 [0,0,1,1,0,0|2,0,0]=4 177 B13R2.57 NC[C@H]1CC2=C(C=CC=C2)CN1 F13533 [0,0,1,1,0,0|2,0,0]=4 178 B13R2.57 NC[C@H]1CC2=C(C=CC=C2)CO1 AC5741 [0,0,1,1,0,0|1,0,0]=3 179 B13R2.57 OC[C@H]1CCC2=C(C=CC=C2)N1 C75079 [0,0,1,1,0,0|2,0,0]=4 180 B13R2.2383 C1=CC=C(CNC2COC2)C=C1 CS1296 [0,0,1,1,0,0|1,0,0]=3 181 B13R2.8137 N[C@H](C1=CC=CC=C1)C2CCC2 FD10505 [0,0,1,1,0,0|2,0,0]=4 182 B13R2.8137 O[C@H](C1=CC=CC=C1)C2CCC2 AT10653 [0,0,1,1,0,0|1,0,0]=3 183 B13R2.12159 CC1(C)C[C@H](N)C2=C1C=CC=C2 AT19561 [0,0,1,1,0,0|2,0,0]=4 184 B13R2.12159 CC1(C)OC(=O)C2=C1C=CC=C2 A10944 [0,0,1,1,0,0|0,0,2]=4 185 B13R2.31 NC1CN(CC2=CC=CC=C2)C1 30361 [0,0,1,1,0,0|2,0,0]=4 186 B13R3.1962 C1=CC2=C(C=C1)C3CCC2N3 C11347 [1,0,0,1,0,0|2,0,0]=4 187 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [0,0,1,0,1,0|2,0,0]=4 188 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [0,0,1,0,1,0|0,0,2]=4 189 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14383 [0,0,1,0,1,0|2,0,0]=4 190 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14384 [0,0,1,0,1,0|2,0,0]=4 191 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14385 [0,0,1,0,1,0|2,0,0]=4 192 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 C78372 [0,0,1,0,1,0|1,0,0]=3 193 B11R1.36 C=C(C1=CC=CC=C1)C(C)C W11468 [0,0,1,0,1,0|1,0,1]=4 194 B11R1.36 CC(C)[C@H](N)C1=CC=CN=C1 74043 [0,0,1,0,1,0|2,0,0]=4 195 B11R1.36 CC(C)[C@H](N)C1=NC=CC=C1 Y10672 [0,0,1,0,1,0|2,0,0]=4 196 B11R1.36 CC(C)[C@H](O)C1=CN=CC=C1 AC2743 [0,0,1,0,1,0|1,0,0]=3 197 B11R1.36 CC(O)C(N)C1=CC=CC=C1 N11175 [0,0,1,0,1,0|2,0,0]=4 198 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Y13368 [0,0,1,0,1,0|2,0,0]=4 199 B11R1.36 CC(O)[C@H](N)C1=CC=CC=C1 N15517 [0,0,1,0,1,0|2,0,0]=4 200 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N15522 [0,0,1,0,1,0|2,0,0]=4 201 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 N15519 [0,0,1,0,1,0|2,0,0]=4 202 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21493 [0,0,1,0,1,0|2,0,0]=4 203 B11R2.2 C1=CSC(C2OCCO2)=N1 P10341 [1,0,0,0,1,0|2,0,0]=4 204 B11R2.239 C1=CC=C(C2CCC2)C=C1 F52090 [1,0,0,0,1,0|1,0,0]=3 205 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 A50749 [1,0,0,0,1,0|1,0,0]=3 206 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C14923 [0,0,0,0,2,0|1,0,0]=3 207 B13R1.337 CC(C)CCNCC1=CC=CC=C1 F52160 [0,0,1,0,0,1|2,0,0]=4 208 B13R1.337 C[C@H](O)CCOCC1=CC=CC=C1 AT15545 [0,0,1,0,0,1|0,0,0]=2