0 B13R1.148 C/C(=C/C1=CC=CC(=C1)N)/C(=O)O PH008849 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.148 C/C(=C\C1=CC(=CC=C1)Br)/C(=O)O L129372 [0,0,0,0,0,0|2,0,2]=4 2 B13R1.148 C/C(=C\C1=CC(=CC=C1)Cl)/C(=O)O R151122 [0,0,0,0,0,0|2,0,2]=4 3 B13R1.148 CC(=O)C(Cl)CC1=CC=CC(=C1)Cl S567183 [0,0,0,0,0,0|3,0,0]=3 4 B13R1.148 CC(OC1=CC=CC(=C1)F)C(=O)O CDS002341 [0,0,0,0,0,0|3,0,0]=3 5 B13R1.148 CC1=CC(=CC=C1)/C=C(\C)/C(=O)O R151041 [0,0,0,0,0,0|1,0,2]=3 6 B13R1.148 O=C(O)/C(=C/C1=CC(=CC=C1)O)/S PH000774 [0,0,0,0,0,0|2,0,2]=4 7 B13R1.148 O=C(O)/C(=C/C1=CC=CC(=C1)Cl)/S S762601 [0,0,0,0,0,0|2,0,2]=4 8 B13R1.148 O=C(O)C(=S)CC1=CC(=CC=C1)O R627119 [0,0,0,0,0,0|2,0,1]=3 9 B13R1.148 O=C(O)C(Br)CC1=CC(=CC=C1)Cl L129844 [0,0,0,0,0,0|2,0,0]=2 10 B12R1.43 CC(CC1=CC=CC=C1)C(=O)N S101400 [1,0,0,0,0,0|2,0,0]=3 11 B12R1.43 CC(CC1=CC=CC=C1)C(=O)N S494143 [1,0,0,0,0,0|2,0,0]=3 12 B12R1.43 CC(CC1=CC=CC=C1)C(=O)N S497290 [1,0,0,0,0,0|2,0,0]=3 13 B12R1.43 CC(SC1=CC=CC=C1)C(=O)O T214256 [1,0,0,0,0,0|2,0,0]=3 14 B12R1.43 CC(SC1=NC=CC=C1)C(=O)O EME00360 [1,0,0,0,0,0|3,0,0]=4 15 B12R1.43 CN(CC1=CC=CC=C1)C(=O)Cl PH008817 [1,0,0,0,0,0|3,0,0]=4 16 B12R1.43 NC(CC1=CC=CC=N1)C(=O)O CDS020095 [1,0,0,0,0,0|1,0,0]=2 17 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O CDS020090 [1,0,0,0,0,0|1,0,0]=2 18 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O PH000113 [1,0,0,0,0,0|0,0,0]=1 19 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/Br S808768 [1,0,0,0,0,0|1,0,2]=4 20 B12R1.43 O=C(O)/C(=C/C1=CC=CC=C1)/Cl PH009328 [1,0,0,0,0,0|1,0,2]=4 21 B12R1.43 O=C(O)/C(=C\C1=CC=CC=C1)/Cl PH004529 [1,0,0,0,0,0|1,0,2]=4 22 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 T136158 [1,0,0,0,0,0|1,0,0]=2 23 B12R1.43 O=C(O)C(O)CC1=CC=CN=C1 CDS008837 [1,0,0,0,0,0|2,0,0]=3 24 B12R1.43 O=C([O-])C(O)CC1=CC=CC=C1 S789089 [1,0,0,0,0,0|1,0,1]=3 25 B12R1.50 CC1=CC(=CC=C1)C/C(=N/O)/N BOG00133 [1,0,0,0,0,0|1,0,1]=3 26 B12R1.226 CC(=O)COC1=CC=CC(=C1)Br OTV000350 [1,0,0,0,0,0|3,0,0]=4 27 B12R1.226 CC1=CC(=CC=C1)OCC(=O)O S353191 [1,0,0,0,0,0|1,0,0]=2 28 B12R1.226 CC1=CC=NC(=N1)SCC(=O)O S359351 [1,0,0,0,0,0|3,0,0]=4 29 B12R1.226 CC1=C[N+](=CC=C1)CCC(=O)N S343293 [1,0,0,0,0,0|2,0,0]=3 30 B12R1.226 NC1=CC(=CC=C1)CCC(=O)O CDS000895 [1,0,0,0,0,0|1,0,0]=2 31 B12R1.226 O=C(O)CCC1=CC=CC(=C1)O PH011597 [1,0,0,0,0,0|1,0,0]=2 32 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl L449121 [1,0,0,0,0,0|2,0,0]=3 33 B14R1.135 COC(=O)[C@H](N)CC1=CC(=CC=C1)F CDS020830 [0,1,0,0,0,0|1,0,0]=2 34 B14R1.153 CC1=C(C(=CC=C1)CC(N)C(=O)O)O S749753 [0,1,0,0,0,0|0,0,0]=1 35 B14R1.542 CCC(CC1=CC(=CC=C1)O)C(=O)O R648345 [0,1,0,0,0,0|2,0,0]=3 36 B14R1.686 CC1=C(C=C(C=C1)OC(C)C(=O)N)C EME00052 [0,1,0,0,0,0|3,0,0]=4 37 B14R1.4257 CC1=CC(=CC(=C1)OC(C)C(=O)O)C CDS005565 [0,1,0,0,0,0|2,0,0]=3 38 B14R1.4404 CC(C)(CC1=CC(=CC=C1)F)C(=O)O PH017258 [0,1,0,0,0,0|2,0,0]=3 39 B14R1.4404 CC(C)(OC1=CC=CC(=C1)Cl)C(=O)O CDS005607 [0,1,0,0,0,0|3,0,0]=4 40 B14R1.4474 CC(OC1=CC(=CC=C1Cl)Cl)C(=O)O S345520 [0,1,0,0,0,0|3,0,0]=4 41 B14R1.4474 CC1=CC=C(C(=C1)CC(N)C(=O)O)O S749664 [0,1,0,0,0,0|0,0,0]=1 42 B14R2.4476 O=C(O)C1CC1C2=CC=CC(=C2)F CDS023747 [0,0,0,1,0,0|2,0,0]=3 43 B14R2.4529 CC1=CC2=C(C=C1)OC(=C2)C(=O)O CDS008857 [0,0,0,1,0,0|1,0,2]=4 44 B14R2.4529 CC1=CC=C2C=C(OC2=C1)C(=O)O T325414 [0,0,0,1,0,0|2,0,1]=4 45 B14R2.4529 CC1=CC=C2CC(CC2=C1)C(=O)O PH017368 [0,0,0,1,0,0|1,0,0]=2 46 B14R2.4529 CC1=CC=C2CC(SC2=C1)C(=O)O T326569 [0,0,0,1,0,0|2,0,0]=3 47 B14R2.4529 CC1=CC=C2NC(CC2=C1)C(=O)O CBR00777 [0,0,0,1,0,0|0,0,0]=1 48 B14R2.4529 NC1=CC=C2NC(=CC2=C1)C(=O)O CDS018503 [0,0,0,1,0,0|1,0,2]=4 49 B14R2.4529 O=C(O)C1=NC2=CC(=CC=C2N1)F CDS022957 [0,0,0,1,0,0|2,0,1]=4 50 B14R2.4529 O=C(O)C1CC2=C(O1)C=CC(=C2)F CDS023496 [0,0,0,1,0,0|2,0,0]=3 51 B14R2.4529 O=C(O)C1CC2=CC(=CC=C2N1)Cl CDS021216 [0,0,0,1,0,0|1,0,0]=2 52 B14R2.7969 CC1=CC=CC2=C1C=C(N2)C(=O)O CDS008967 [0,0,0,1,0,0|2,0,1]=4 53 B14R2.7969 O=C(O)C1=CC2=C(N1)C(=CC=C2)O CDS007536 [0,0,0,1,0,0|1,0,2]=4 54 B14R2.7969 O=C(O)C1=CC2=CC=CC(=C2N1)Cl CDS002296 [0,0,0,1,0,0|1,0,2]=4 55 B14R2.8239 CC1=CC=C2NC(=O)C(OC2=C1)C OTV000465 [0,0,0,1,0,0|3,0,0]=4 56 B12R1.104 N[C@@H](CC1=CNC(=N1)S)C(=O)O CDS006825 [0,0,0,0,1,0|3,0,0]=4 57 B12R1.225 O=C(O)C(O)C1=CC=CC(=C1)Br PH011789 [0,0,0,0,1,0|2,0,0]=3 58 B11R1.40 N/C(=N\O)/CC1=CC=CC=C1 BOG00118 [2,0,0,0,0,0|1,0,1]=4 59 B11R1.40 N/C(=N\O)/CC1=CC=CC=C1 CDS003635 [2,0,0,0,0,0|1,0,1]=4 60 B11R1.91 CC(=O)CSC1=CC=CC=C1 PH011676 [2,0,0,0,0,0|2,0,0]=4 61 B11R1.91 NC(=O)CC[N+]1=CC=CC=C1 S343315 [2,0,0,0,0,0|2,0,0]=4 62 B11R1.91 NC(=O)CNC1=CC=CC=C1 PH010726 [2,0,0,0,0,0|2,0,0]=4 63 B11R1.91 NC(=O)CSC1=CC=CC=C1 PH011181 [2,0,0,0,0,0|2,0,0]=4 64 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 S826065 [2,0,0,0,0,0|0,0,2]=4 65 B11R1.91 O=C(O)CCC1=CC=NC=C1 CDS002094 [2,0,0,0,0,0|1,0,0]=3 66 B11R1.91 O=C(O)CCC1=NC=CC=N1 S217417 [2,0,0,0,0,0|2,0,0]=4 67 B11R1.91 O=C(O)CCC1=NC=CN=C1 CDS022931 [2,0,0,0,0,0|2,0,0]=4 68 B11R1.91 O=C(O)CNC1=NC=CC=C1 R411434 [2,0,0,0,0,0|2,0,0]=4 69 B11R1.91 O=C(O)CSC1=CC=CC=N1 CDS002508 [2,0,0,0,0,0|2,0,0]=4 70 B11R1.91 O=C([O-])COC1=CC=CC=C1 R257494 [2,0,0,0,0,0|1,0,1]=4 71 B11R1.91 O=C([O-])CSC1=CC=CC=C1 T288012 [2,0,0,0,0,0|1,0,1]=4 72 B11R1.91 O=P(O)OCC1=CC=CC=C1 S435015 [2,0,0,0,0,0|2,0,0]=4 73 B11R1.24 CC1=CC(=CC=C1)CCCN CBR00042 [2,0,0,0,0,0|1,0,1]=4 74 B11R1.24 CC1=CC(=CC=C1)OCCO S538558 [2,0,0,0,0,0|1,0,1]=4 75 B11R1.24 CC1=CC=CC(=C1)CCNN PH019073 [2,0,0,0,0,0|2,0,0]=4 76 B11R1.24 OCCCC1=CC=CC(=C1)Cl PH002730 [2,0,0,0,0,0|1,0,1]=4 77 B11R1.157 CC(=O)CC1=CC(=CC=C1)C CDS017452 [2,0,0,0,0,0|1,0,1]=4 78 B11R1.157 CC(N)CC1=CC=CC(=C1)Br CDS022739 [2,0,0,0,0,0|1,0,1]=4 79 B11R1.157 CC1=CC(=CC=C1)NC(=O)N S410233 [2,0,0,0,0,0|1,0,1]=4 80 B11R1.157 CC1=CC(=NC=C1)CC(C)O PH015436 [2,0,0,0,0,0|2,0,0]=4 81 B11R1.157 CC1=CC=CC(=N1)CC(C)O PH015426 [2,0,0,0,0,0|2,0,0]=4 82 B13R1.133 CC(=O)C(Cl)CC1=CC=C(C=C1)Cl S567140 [1,1,0,0,0,0|2,0,0]=4 83 B13R1.133 CC(CC1=CC=C(C=C1)O)C(=O)O PH008203 [1,1,0,0,0,0|1,0,0]=3 84 B13R1.133 CC(OC1=CC=C(C=C1)Br)C(=O)O CDS005545 [1,1,0,0,0,0|2,0,0]=4 85 B13R1.133 CC(OC1=CC=C(C=C1)Cl)C(=O)O R750298 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.133 CC(OC1=CC=C(C=C1)F)C(=O)O PH009975 [1,1,0,0,0,0|2,0,0]=4 87 B13R1.133 CC1=CC=C(C=C1)CC(C)C(=O)O R245267 [1,1,0,0,0,0|1,0,0]=3 88 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O PH011203 [1,1,0,0,0,0|0,0,0]=2 89 B13R1.133 C[C@H](CC1=CC=C(C=C1)N)C(=O)O PH001854 [1,1,0,0,0,0|1,0,0]=3 90 B13R1.133 NC(CC1=CC=[N+](C=C1)[O-])C(=O)O PH003272 [1,1,0,0,0,0|1,0,0]=3 91 B13R1.135 COC(=O)C(C)OC1=CC=CC=C1 JRD1262 [1,1,0,0,0,0|2,0,0]=4 92 B13R1.135 COC(=O)C(C)SC1=CC=CC=C1 S620203 [1,1,0,0,0,0|2,0,0]=4 93 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 PH011323 [1,1,0,0,0,0|0,0,0]=2 94 B13R1.135 COC(=O)C(N)CC1=NC=CC=C1 PH019122 [1,1,0,0,0,0|1,0,0]=3 95 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 PH000793 [1,1,0,0,0,0|1,0,0]=3 96 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 PH009923 [1,1,0,0,0,0|0,0,0]=2 97 B13R1.135 COC(=O)[C@H](N)CC1=CC=CN=C1 CDS006818 [1,1,0,0,0,0|1,0,0]=3 98 B13R1.152 CC(=O)C(Br)C(Br)C1=CC=CC=C1 S366706 [1,1,0,0,0,0|2,0,0]=4 99 B13R1.152 CC(C(=O)O)C(C)C1=CC=CC=C1 S697214 [1,1,0,0,0,0|1,0,0]=3 100 B13R1.152 C[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 T292249 [1,1,0,0,0,0|1,0,0]=3 101 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 S914851 [1,1,0,0,0,0|0,0,0]=2 102 B13R1.152 NC(C(=O)O)C(O)C1=CN=CC=C1 S914975 [1,1,0,0,0,0|1,0,0]=3 103 B13R1.152 O=C(Cl)C(Br)C(Br)C1=CC=CC=C1 S675954 [1,1,0,0,0,0|2,0,0]=4 104 B13R1.152 O=C(O)C(Br)C(Br)C1=CC=CC=C1 S764841 [1,1,0,0,0,0|1,0,0]=3 105 B13R1.152 O=C(O)C(Cl)C(Cl)C1=CC=CC=C1 PH009327 [1,1,0,0,0,0|1,0,0]=3 106 B13R1.202 CC(=O)C(Cl)CC1=CC=CC=C1Cl S567191 [1,1,0,0,0,0|2,0,0]=4 107 B13R1.202 CC(OC1=C(C=CC=C1)Cl)C(=O)O R425818 [1,1,0,0,0,0|2,0,0]=4 108 B13R1.202 CC(OC1=CC=CC=C1F)C(=O)O CDS011686 [1,1,0,0,0,0|2,0,0]=4 109 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O R410985 [1,1,0,0,0,0|0,0,0]=2 110 B13R1.202 CC1=CC=CC=C1OC(C)C(=O)O PH010162 [1,1,0,0,0,0|2,0,0]=4 111 B13R1.202 NC(CC1=CC=CC=C1Cl)C(=O)O R262129 [1,1,0,0,0,0|0,0,0]=2 112 B13R1.418 CCC(CC1=CC=CC=C1)C(=O)N PH008852 [1,1,0,0,0,0|2,0,0]=4 113 B13R1.418 CCC(OC1=CC=CC=C1)C(=O)O PH010776 [1,1,0,0,0,0|2,0,0]=4 114 B13R1.1073 CC(=O)C(C)(Cl)CC1=CC=CC=C1 S567248 [1,1,0,0,0,0|2,0,0]=4 115 B13R1.1073 CC(C)(CC1=CC=CC=C1)C(=O)N PH007307 [1,1,0,0,0,0|2,0,0]=4 116 B13R1.1073 CC(C)(OC1=CC=CC=C1)C(=O)O PH010089 [1,1,0,0,0,0|2,0,0]=4 117 B13R1.1073 CC(C)(SC1=CC=CC=C1)C(=O)O OTV000153 [1,1,0,0,0,0|2,0,0]=4 118 B13R1.15 COC(=O)/C=C/C1=CC(=CC=C1)C EME00166 [1,1,0,0,0,0|0,0,2]=4 119 B13R1.147 NC(CC(=O)O)C1=CC=CC(=C1)Cl PH006840 [1,1,0,0,0,0|1,0,0]=3 120 B13R1.150 CC1=C(C(=CC=C1)OCC(=O)O)C S361100 [1,1,0,0,0,0|1,0,0]=3 121 B13R1.150 CC1=C(C=CC=C1NCC(=O)O)Cl T110809 [1,1,0,0,0,0|2,0,0]=4 122 B13R1.150 CC1=CC=CC(=C1C)NCC(=O)O L172502 [1,1,0,0,0,0|1,0,0]=3 123 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)Br T303011 [1,1,0,0,0,0|1,0,0]=3 124 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)N)Cl R343048 [1,1,0,0,0,0|2,0,0]=4 125 B13R1.511 CC1=CC(=CC=C1Cl)OCC(=O)O CDS006826 [1,1,0,0,0,0|1,0,0]=3 126 B13R1.511 O=C(O)CSC1=CC=C(C(=C1)Cl)Cl R538639 [1,1,0,0,0,0|2,0,0]=4 127 B13R1.643 CSC1=CC(=CC=C1)/C=C/C(=O)O T285293 [1,1,0,0,0,0|0,0,2]=4 128 B13R1.893 CC1=CC(=C(C=C1)C)/C=C/C(=O)O PH011355 [1,1,0,0,0,0|0,0,2]=4 129 B13R1.893 CC1=CC(=C(C=C1)C)OCC(=O)O R435279 [1,1,0,0,0,0|1,0,0]=3 130 B13R1.893 CC1=CC(=C(C=C1)C)OCC(=O)O S408166 [1,1,0,0,0,0|1,0,0]=3 131 B13R1.893 O=C(O)CCC1=CC(=CC=C1Cl)Cl JRD0472 [1,1,0,0,0,0|1,0,0]=3 132 B13R1.893 O=C(O)COC1=C(C=CC(=C1)Cl)Cl OTV000322 [1,1,0,0,0,0|2,0,0]=4 133 B13R1.893 O=C(O)COC1=CC(=CC=C1Br)F CDS022259 [1,1,0,0,0,0|2,0,0]=4 134 B13R1.893 O=C(O)CSC1=C(C=CC(=C1)Cl)Cl PH011457 [1,1,0,0,0,0|2,0,0]=4 135 B13R1.3420 CC1=CC(=CC(=C1)CCC(=O)O)C CBR00487 [1,1,0,0,0,0|0,0,0]=2 136 B13R1.3420 CC1=CC(=CC(=C1)OCC(=O)O)C S408174 [1,1,0,0,0,0|1,0,0]=3 137 B13R1.510 NC(C(=O)O)C1=CC=C(C(=C1)F)F CDS022248 [0,1,0,0,1,0|1,0,0]=3 138 B13R1.716 COC(C(=O)O)C1=CC(=CC=C1)F PH018591 [0,1,0,0,1,0|2,0,0]=4 139 B13R1.716 COC(C(=O)O)C1=CC=CC(=C1)C PH014847 [0,1,0,0,1,0|1,0,0]=3 140 B13R1.716 COC(C(=O)O)C1=CC=CC(=C1)Cl PH018558 [0,1,0,0,1,0|2,0,0]=4 141 B13R1.897 O=C(O)C(O)C1=CC(=CC=C1F)F R436208 [0,1,0,0,1,0|2,0,0]=4 142 B13R1.3493 CC(C)(C(=O)O)C1=CC(=CC=C1)Br OTV000687 [0,1,0,0,1,0|2,0,0]=4 143 B13R1.3493 CC(C)(C(=O)O)C1=CC=CC(=C1)Cl OTV000681 [0,1,0,0,1,0|2,0,0]=4 144 B13R1.3493 CC1=CC(=CC=C1)C(C)(C)C(=O)O PH010805 [0,1,0,0,1,0|1,0,0]=3 145 B15R1.8422 CC1=CC(=C(C=C1)C)CCC(C)C(=O)O R245216 [0,1,0,0,0,1|1,0,0]=3 146 B15R1.66 COC1=CC(=CC=C1)C(Br)C(Br)C(=O)O PH016367 [0,2,0,0,0,0|1,0,0]=3 147 B15R1.501 CC(CC1=CC=CC(=C1)[N+](=O)[O-])C(=O)O T157538 [0,2,0,0,0,0|2,0,0]=4 148 B15R1.5515 COC(=O)C(C)OC1=CC(=CC(=C1)C)C JRD1267 [0,2,0,0,0,0|2,0,0]=4 149 B15R1.5521 COC(=O)C(C)OC1=CC=C(C(=C1)C)C JRD1268 [0,2,0,0,0,0|2,0,0]=4 150 B15R1.5521 COC(=O)C(C)OC1=CC=C(C(=C1)C)Cl JRD1266 [0,2,0,0,0,0|2,0,0]=4 151 B15R1.11653 COC(=O)C(C)(N)CC1=CC=CC(=C1)O S427721 [0,2,0,0,0,0|1,0,0]=3 152 B15R1.11316 CC1=CC(=CC=C1Cl)OC(C)(C)C(=O)O CDS005606 [0,2,0,0,0,0|2,0,0]=4 153 B15R1.28955 CC1=CC(=CC(=C1Cl)C)OC(C)C(=O)O CDS005563 [0,2,0,0,0,0|2,0,0]=4 154 B15R1.28955 [C@H](N)(CC1=CC(=C(C(=C1)Br)O)Br)C(=O)O S448923 [0,2,0,0,0,0|1,0,0]=3 155 B15R1.5833 CC1=CC=C(C(=C1)OC(C)(C)C(=O)O)C PH010178 [0,2,0,0,0,0|2,0,0]=4 156 B13R2.369 CC1CC2=CC=CC=C2NC1=O PH002978 [1,0,0,1,0,0|2,0,0]=4 157 B13R2.369 CC1CC2=CC=CC=C2OC1=O T217115 [1,0,0,1,0,0|1,0,0]=3 158 B13R2.423 O=C(O)C1CC1C2=CC=CC=N2 CDS022741 [1,0,0,1,0,0|2,0,0]=4 159 B13R2.423 O=C([O-])C1OC1C2=CC=CC=C2 S354562 [1,0,0,1,0,0|1,0,1]=4 160 B13R2.435 O=C(O)C1OC2=C(O1)C=CC=C2 PH010404 [1,0,0,1,0,0|2,0,0]=4 161 B13R2.162 O=C1CCC2=C(C1)C(=CC=C2)Br PH014667 [1,0,0,1,0,0|2,0,0]=4 162 B13R2.162 O=C1CCC2=CC=CC(=C2C1)Cl PH014571 [1,0,0,1,0,0|2,0,0]=4 163 B13R2.3683 CC1=CC=C2OC(=O)CCC2=C1 IDF00001 [1,0,0,1,0,0|0,0,0]=2 164 B13R2.3683 CC1=CC=C2SC(=O)CCC2=C1 IDF00008 [1,0,0,1,0,0|0,1,0]=3 165 B13R2.3683 CC1=CN=C2NC(=O)CCC2=C1 ADE000851 [1,0,0,1,0,0|2,0,0]=4 166 B13R2.3683 O=C1CCC2=CC(=CC=C2O1)Br PH010437 [1,0,0,1,0,0|1,0,0]=3 167 B13R2.3683 O=C1CCC2=CC(=CC=C2S1)Cl IDF00017 [1,0,0,1,0,0|1,1,0]=4 168 B13R2.3028 NC1C(=O)NC2=CC=C(C=C12)F CBR02325 [0,0,0,1,1,0|2,0,0]=4 169 B13R2.4825 NC1C(=O)NC2=C(C=CC=C12)Cl CBR01431 [0,0,0,1,1,0|2,0,0]=4 170 B15R2.7180 O=C(O)C1CCC2=CC(=CC=C2O1)F CDS022548 [0,0,0,1,0,1|2,0,0]=4 171 B15R2.7180 O=C(O)[C@H]1CC2=CC=C(C=C2CN1)O CDS010445 [0,0,0,1,0,1|2,0,0]=4 172 B15R2.4834 N1C(=CC2=C1C=CC(=C2)CC)C(=O)O S447730 [0,1,0,1,0,0|0,0,2]=4 173 B15R2.7174 O=C(O)C1CCC2=CC=C(C=C2C1)O CDS005584 [0,1,0,1,0,0|2,0,0]=4 174 B11R1.35 NC(CC1=CNC=N1)C(=O)O S580945 [1,0,0,0,1,0|2,0,0]=4 175 B11R1.35 N[C@@H](CC1=CSC=C1)C(=O)O CDS005041 [1,0,0,0,1,0|1,0,0]=3 176 B11R1.35 N[C@@H](CC1=CSC=N1)C(=O)O CDS005165 [1,0,0,0,1,0|2,0,0]=4 177 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 S881112 [1,0,0,0,1,0|2,0,0]=4 178 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 PH007480 [1,0,0,0,1,0|2,0,0]=4 179 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 CDS003589 [1,0,0,0,1,0|1,0,0]=3 180 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 S684473 [1,0,0,0,1,0|1,0,0]=3 181 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 TMT00523 [1,0,0,0,1,0|1,0,0]=3 182 B11R1.36 O=P(O)C(O)C1=CC=CC=C1 S576263 [1,0,0,0,1,0|2,0,0]=4 183 B11R1.75 CC1=CC=C(O1)CCC(=O)N T311464 [1,0,0,0,1,0|2,0,0]=4 184 B11R1.75 CC1=CN(N=C1)CCC(=O)O CBR00219 [1,0,0,0,1,0|2,0,0]=4 185 B11R1.75 CC1=NN(C=C1)CCC(=O)O CBR00193 [1,0,0,0,1,0|2,0,0]=4 186 B11R1.75 CN1C=C(C=N1)CCC(=O)O T312622 [1,0,0,0,1,0|2,0,0]=4 187 B11R1.90 CC1=C(SC=N1)CCC(=O)O CBR00359 [1,0,0,0,1,0|2,0,0]=4 188 B13R1.348 C[C@H](CC1=CC=CC=C1)NC(=O)N PH008163 [1,0,0,0,0,1|2,0,0]=4 189 B13R1.351 CC(CSC1=CC=CC=C1)C(=O)O PH010131 [1,0,0,0,0,1|1,0,0]=3 190 B13R1.351 C[C@H](SCC1=CC=CC=C1)C(=O)O PH017935 [1,0,0,0,0,1|1,0,0]=3 191 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 CDS007841 [1,0,0,0,0,1|1,0,1]=4 192 B13R1.149 O=C(O)CSCC1=CC(=CC=C1)Br EME00137 [1,0,0,0,0,1|1,0,0]=3