0 B14R1.4474 CC1=C(C[C@H](N)C(=O)O)C=C(I)C=C1 Y14650 [0,0,0,0,0,0|1,1,0]=2 1 B14R1.4474 CC1=C(C[C@H](N)C(=O)O)C=C(I)C=C1 Y14805 [0,0,0,0,0,0|1,1,0]=2 2 B14R1.4474 N[C@@H](CC1=C(Cl)C=CC(I)=C1)C(=O)O Y13408 [0,0,0,0,0,0|0,1,0]=1 3 B14R1.4474 N[C@@H](CC1=C(Cl)C=CC(I)=C1)C(=O)O Y13409 [0,0,0,0,0,0|0,1,0]=1 4 B14R1.4474 N[C@@H](CC1=C(F)C=CC(I)=C1)C(=O)O Y14618 [0,0,0,0,0,0|0,2,0]=2 5 B14R1.4474 N[C@@H](CC1=C(F)C=CC(I)=C1)C(=O)O Y14802 [0,0,0,0,0,0|0,2,0]=2 6 B14R1.4474 N[C@@H](CC1=C(F)C=CC(O)=C1)C(=O)O Y13731 [0,0,0,0,0,0|1,1,0]=2 7 B14R1.4474 N[C@@H](CC1=C(F)C=CC(O)=C1)C(=O)O Y14012 [0,0,0,0,0,0|1,1,0]=2 8 B14R1.4474 N[C@@H](CC1=C(F)C=CC(O)=C1)C(=O)O Y14179 [0,0,0,0,0,0|1,1,0]=2 9 B14R1.4474 N[C@@H](CC1=C(O)C=CC(F)=C1)C(=O)O Y12872 [0,0,0,0,0,0|1,1,0]=2 10 B14R1.4474 N[C@@H](CC1=C(O)C=CC(F)=C1)C(=O)O Y12904 [0,0,0,0,0,0|1,1,0]=2 11 B14R1.4474 N[C@@H](CC1=C(O)C=CC(F)=C1)C(=O)O Y12926 [0,0,0,0,0,0|1,1,0]=2 12 B13R1.148 CC1=CC(C[C@H](N)C(=O)O)=CN=C1 Y12875 [1,0,0,0,0,0|2,0,0]=3 13 B13R1.148 CC1=CC(C[C@H](N)C(=O)O)=CN=C1 Y12906 [1,0,0,0,0,0|2,0,0]=3 14 B13R1.148 N[C@@H](CC1=CC(Cl)=CN=C1)C(=O)O Y12876 [1,0,0,0,0,0|1,0,0]=2 15 B13R1.148 N[C@@H](CC1=CC(Cl)=CN=C1)C(=O)O Y12907 [1,0,0,0,0,0|1,0,0]=2 16 B13R1.148 N[C@@H](CC1=CC(F)=CN=C1)C(=O)O Y10843 [1,0,0,0,0,0|1,1,0]=3 17 B13R1.148 N[C@@H](CC1=CC(O)=CC=C1)C(=O)O Y11468 [1,0,0,0,0,0|1,0,0]=2 18 B13R1.202 NC1=C(C[C@H](N)C(=O)O)C=CC=C1 Y12214 [1,0,0,0,0,0|1,0,0]=2 19 B13R1.202 NC1=C(C[C@H](N)C(=O)O)C=CC=C1 Y13935 [1,0,0,0,0,0|1,0,0]=2 20 B13R1.202 N[C@@H](CC1=C(F)C=CC=N1)C(=O)O Y14252 [1,0,0,0,0,0|1,1,0]=3 21 B13R1.202 N[C@@H](CC1=CC=CN=C1Cl)C(=O)O Y13942 [1,0,0,0,0,0|1,0,0]=2 22 B13R1.202 N[C@@H](CC1=CC=CN=C1Cl)C(=O)O Y14211 [1,0,0,0,0,0|1,0,0]=2 23 B15R1.5513 COC(=O)[C@@H](N)CC1=C(O)C=CC(F)=C1 Y11935 [0,1,0,0,0,0|1,1,0]=3 24 B15R1.5513 COC(=O)[C@@H](N)CC1=C(O)C=CC(F)=C1 Y11936 [0,1,0,0,0,0|1,1,0]=3 25 B15R1.5513 COC(=O)[C@@H](N)CC1=C(O)C=CC(F)=C1 Y13317 [0,1,0,0,0,0|1,1,0]=3 26 B15R1.8394 N[C@@H](CC1=C(O)C=C(O)C(O)=C1)C(=O)O P19978 [0,1,0,0,0,0|2,0,0]=3 27 B15R2.7174 O=C(O)[C@@H]1CC2=C(C=CC(F)=C2)CN1 AT18811 [0,0,0,1,0,0|1,1,0]=3 28 B13R1.897 CC1=C([C@@H](N)C(=O)O)C=C(Br)C=C1 D85219 [0,0,0,0,1,0|1,1,0]=3 29 B13R1.897 CC1=C([C@@H](N)C(=O)O)C=C(F)C=C1 Y12499 [0,0,0,0,1,0|1,1,0]=3 30 B13R1.897 CC1=C([C@@H](N)C(=O)O)C=C(F)C=C1 Y12500 [0,0,0,0,1,0|1,1,0]=3 31 B13R1.897 CC1=CC([C@@H](N)C(=O)O)=C(F)C=C1 D96425 [0,0,0,0,1,0|1,1,0]=3 32 B13R1.897 N[C@@H](C(=O)O)C1=C(Br)C=CC(F)=C1 Y12497 [0,0,0,0,1,0|0,2,0]=3 33 B13R1.897 N[C@@H](C(=O)O)C1=C(Br)C=CC(F)=C1 Y13418 [0,0,0,0,1,0|0,2,0]=3 34 B13R1.897 N[C@@H](C(=O)O)C1=C(Cl)C=CC(Cl)=C1 Y14094 [0,0,0,0,1,0|0,0,0]=1 35 B13R1.897 N[C@@H](C(=O)O)C1=C(Cl)C=CC(Cl)=C1 Y14095 [0,0,0,0,1,0|0,0,0]=1 36 B13R1.897 N[C@@H](C(=O)O)C1=C(Cl)C=CC(F)=C1 Y12527 [0,0,0,0,1,0|0,1,0]=2 37 B13R1.897 N[C@@H](C(=O)O)C1=C(Cl)C=CC(F)=C1 Y12528 [0,0,0,0,1,0|0,1,0]=2 38 B13R1.897 N[C@@H](C(=O)O)C1=C(O)C=CC(Br)=C1 Y13068 [0,0,0,0,1,0|1,1,0]=3 39 B13R1.897 N[C@@H](C(=O)O)C1=C(O)C=CC(F)=C1 Y11480 [0,0,0,0,1,0|1,1,0]=3 40 B12R1.226 CC1=CC(CCC(=O)O)=NC=C1 71960 [2,0,0,0,0,0|2,0,0]=4 41 B12R1.226 O=C(O)COC1=NC=CC(Cl)=C1 W18283 [2,0,0,0,0,0|2,0,0]=4 42 B12R1.125 CC1=C(CCC(=O)O)C=CN=C1 72786 [2,0,0,0,0,0|2,0,0]=4 43 B12R1.125 O=C(O)CCC1=C(Br)C=CC=N1 F30873 [2,0,0,0,0,0|1,1,0]=4 44 B14R1.135 COC(=O)[C@@H](N)CC1=CC(Cl)=CN=C1 Y12125 [1,1,0,0,0,0|1,0,0]=3 45 B14R1.135 COC(=O)[C@@H](N)CC1=CC(Cl)=CN=C1 Y12126 [1,1,0,0,0,0|1,0,0]=3 46 B14R1.135 COC(=O)[C@@H](N)CC1=CN=CC(C)=C1 Y12224 [1,1,0,0,0,0|2,0,0]=4 47 B14R1.135 COC(=O)[C@@H](N)CC1=CN=CC(C)=C1 Y12225 [1,1,0,0,0,0|2,0,0]=4 48 B14R1.153 CC1=C(I)C=CC=C1C[C@H](N)C(=O)O Y14619 [1,1,0,0,0,0|0,1,0]=3 49 B14R1.153 CC1=C(I)C=CC=C1C[C@H](N)C(=O)O Y14810 [1,1,0,0,0,0|0,1,0]=3 50 B14R1.153 N[C@@H](CC1=CC=CC(F)=C1O)C(=O)O Y14210 [1,1,0,0,0,0|0,1,0]=3 51 B14R1.153 N[C@@H](CC1=CC=CC(F)=C1O)C(=O)O Y14231 [1,1,0,0,0,0|0,1,0]=3 52 B14R1.153 N[C@@H](CC1=CC=CC(F)=C1O)C(=O)O Y14250 [1,1,0,0,0,0|0,1,0]=3 53 B14R1.686 CC1=C(F)C=C(C[C@H](N)C(=O)O)C=C1 Y12213 [1,1,0,0,0,0|0,1,0]=3 54 B14R1.686 CC1=C(F)C=C(C[C@H](N)C(=O)O)C=C1 Y12503 [1,1,0,0,0,0|0,1,0]=3 55 B14R1.686 CC1=C(F)C=C(C[C@H](N)C(=O)O)C=C1 Y12504 [1,1,0,0,0,0|0,1,0]=3 56 B14R1.686 CC1=C(I)C=C(C[C@H](N)C(=O)O)C=C1 Y14808 [1,1,0,0,0,0|0,1,0]=3 57 B14R1.686 CC1=C(I)C=C(C[C@H](N)C(=O)O)C=C1 Y14809 [1,1,0,0,0,0|0,1,0]=3 58 B14R1.686 CC1=C(O)C=CC(C[C@H](N)C(=O)O)=C1 50865 [1,1,0,0,0,0|1,0,0]=3 59 B14R1.686 CC1=C(O)C=CC(C[C@H](N)C(=O)O)=C1 Y14826 [1,1,0,0,0,0|1,0,0]=3 60 B14R1.686 N[C@@H](CC1=CC(F)=C(Br)C=C1)C(=O)O Y12869 [1,1,0,0,0,0|0,1,0]=3 61 B14R1.686 N[C@@H](CC1=CC(F)=C(Br)C=C1)C(=O)O Y12902 [1,1,0,0,0,0|0,1,0]=3 62 B14R1.686 N[C@@H](CC1=CC(I)=C(Cl)C=C1)C(=O)O Y13414 [1,1,0,0,0,0|0,1,0]=3 63 B14R1.686 N[C@@H](CC1=CC(I)=C(F)C=C1)C(=O)O Y13412 [1,1,0,0,0,0|0,1,0]=3 64 B14R1.686 N[C@@H](CC1=CC(I)=C(F)C=C1)C(=O)O Y13413 [1,1,0,0,0,0|0,1,0]=3 65 B14R1.686 N[C@@H](CC1=CC(O)=C(F)C=C1)C(=O)O Y14209 [1,1,0,0,0,0|1,0,0]=3 66 B14R1.686 N[C@@H](CC1=CC(O)=C(F)C=C1)C(=O)O Y14230 [1,1,0,0,0,0|1,0,0]=3 67 B14R1.686 N[C@@H](CC1=CC(O)=C(F)C=C1)C(=O)O Y14248 [1,1,0,0,0,0|1,0,0]=3 68 B14R1.686 O=C(O)[C@@H](O)CC1=CC(O)=C(O)C=C1 A12835 [1,1,0,0,0,0|2,0,0]=4 69 B14R1.4257 CC1=CC(C[C@H](N)C(=O)O)=CC(O)=C1 Y13062 [1,1,0,0,0,0|1,0,0]=3 70 B14R1.4257 CC1=CC(I)=CC(C[C@H](N)C(=O)O)=C1 Y14806 [1,1,0,0,0,0|0,1,0]=3 71 B14R1.4257 CC1=CC(I)=CC(C[C@H](N)C(=O)O)=C1 Y14807 [1,1,0,0,0,0|0,1,0]=3 72 B14R1.4257 N[C@@H](CC1=CC(F)=CC(O)=C1)C(=O)O Y12871 [1,1,0,0,0,0|0,1,0]=3 73 B14R1.4257 N[C@@H](CC1=CC(F)=CC(O)=C1)C(=O)O Y12903 [1,1,0,0,0,0|0,1,0]=3 74 B14R1.4257 N[C@@H](CC1=CC(F)=CC(O)=C1)C(=O)O Y12925 [1,1,0,0,0,0|0,1,0]=3 75 B14R1.4257 N[C@@H](CC1=CC(I)=CC(Cl)=C1)C(=O)O Y13410 [1,1,0,0,0,0|0,0,0]=2 76 B14R1.4257 N[C@@H](CC1=CC(I)=CC(Cl)=C1)C(=O)O Y13411 [1,1,0,0,0,0|0,0,0]=2 77 B14R1.4404 CC(C)(CC1=CC=CC(Br)=C1)C(=O)O C90966 [1,1,0,0,0,0|1,1,0]=4 78 B14R1.1007 COC(=O)[C@@H](N)CC1=CC=CN=C1Cl Y13864 [1,1,0,0,0,0|1,0,0]=3 79 B14R1.5971 N[C@@H](CC1=C(F)C=CC=C1O)C(=O)O Y14340 [1,1,0,0,0,0|0,1,0]=3 80 B14R1.5971 N[C@@H](CC1=C(F)C=CC=C1O)C(=O)O Y14371 [1,1,0,0,0,0|0,1,0]=3 81 B14R1.5971 N[C@@H](CC1=C(F)C=CC=C1O)C(=O)O Y14485 [1,1,0,0,0,0|0,1,0]=3 82 B14R1.6049 CC1=CC(F)=C(C[C@H](N)C(=O)O)C=C1 Y12873 [1,1,0,0,0,0|0,1,0]=3 83 B14R1.6049 CC1=CC(F)=C(C[C@H](N)C(=O)O)C=C1 Y12905 [1,1,0,0,0,0|0,1,0]=3 84 B14R1.6049 NC1=C(C[C@H](N)C(=O)O)C=CC(F)=C1 Y11237 [1,1,0,0,0,0|1,0,0]=3 85 B14R1.6049 N[C@@H](CC1=C(Cl)C=C(O)C=C1)C(=O)O Y14207 [1,1,0,0,0,0|0,0,0]=2 86 B14R1.6049 N[C@@H](CC1=C(F)C=C(Cl)C=C1)C(=O)O Y14020 [1,1,0,0,0,0|0,1,0]=3 87 B14R1.6049 N[C@@H](CC1=C(F)C=C(O)C=C1)C(=O)O D85255 [1,1,0,0,0,0|0,1,0]=3 88 B14R1.6049 N[C@@H](CC1=C(F)C=C(O)C=C1)C(=O)O D85955 [1,1,0,0,0,0|0,1,0]=3 89 B14R1.6049 N[C@@H](CC1=C(F)C=C(O)C=C1)C(=O)O Y13603 [1,1,0,0,0,0|0,1,0]=3 90 B14R1.6049 N[C@@H](CC1=C(F)C=C(O)C=C1)C(=O)O Y13604 [1,1,0,0,0,0|0,1,0]=3 91 B14R1.6049 N[C@@H](CC1=C(O)C=C(F)C=C1)C(=O)O Y14208 [1,1,0,0,0,0|1,0,0]=3 92 B14R1.6049 N[C@@H](CC1=C(O)C=C(O)C=C1)C(=O)O Y11694 [1,1,0,0,0,0|1,0,0]=3 93 B14R1.6049 N[C@@H](CC1=CC=C(F)N=C1F)C(=O)O Y11236 [1,1,0,0,0,0|1,1,0]=4 94 B14R1.6049 N[C@@H](CC1=CC=C(F)N=C1F)C(=O)O Y12908 [1,1,0,0,0,0|1,1,0]=4 95 B14R1.6052 CC1=C([C@@H](N)CC(=O)O)C=C(F)C=C1 Y11740 [1,1,0,0,0,0|1,1,0]=4 96 B14R1.6052 CC1=C([C@@H](N)CC(=O)O)C=C(F)C=C1 Y12501 [1,1,0,0,0,0|1,1,0]=4 97 B14R1.6052 CC1=C([C@@H](N)CC(=O)O)C=C(F)C=C1 Y12502 [1,1,0,0,0,0|1,1,0]=4 98 B14R1.6052 CC1=CC([C@@H](N)CC(=O)O)=C(C)C=C1 D85213 [1,1,0,0,0,0|2,0,0]=4 99 B14R1.6052 CC1=CC([C@@H](N)CC(=O)O)=C(C)C=C1 Y12495 [1,1,0,0,0,0|2,0,0]=4 100 B14R1.6052 CC1=CC([C@@H](N)CC(=O)O)=C(C)C=C1 Y12496 [1,1,0,0,0,0|2,0,0]=4 101 B14R1.6052 N[C@@H](CC(=O)O)C1=C(Br)C=CC(F)=C1 Y11677 [1,1,0,0,0,0|0,2,0]=4 102 B14R1.6052 N[C@@H](CC(=O)O)C1=C(Br)C=CC(F)=C1 Y11741 [1,1,0,0,0,0|0,2,0]=4 103 B14R1.6052 N[C@@H](CC(=O)O)C1=C(Br)C=CC(F)=C1 Y12498 [1,1,0,0,0,0|0,2,0]=4 104 B14R1.6052 N[C@@H](CC(=O)O)C1=C(Cl)C=CC(F)=C1 Y12878 [1,1,0,0,0,0|0,1,0]=3 105 B14R1.6052 N[C@@H](CC(=O)O)C1=C(Cl)C=CC(F)=C1 Y12910 [1,1,0,0,0,0|0,1,0]=3 106 B14R1.6052 N[C@@H](CC(=O)O)C1=C(F)C=CC(Br)=C1 Y12461 [1,1,0,0,0,0|0,2,0]=4 107 B14R1.6052 N[C@@H](CC(=O)O)C1=C(F)C=CC(Br)=C1 Y12464 [1,1,0,0,0,0|0,2,0]=4 108 B14R1.6052 N[C@@H](CC(=O)O)C1=C(O)C=CC(F)=C1 Y11708 [1,1,0,0,0,0|1,1,0]=4 109 B14R1.6052 N[C@@H](CC(=O)O)C1=C(O)C=CC(F)=C1 Y12887 [1,1,0,0,0,0|1,1,0]=4 110 B14R1.6052 N[C@@H](CC(=O)O)C1=C(O)C=CC(F)=C1 Y12915 [1,1,0,0,0,0|1,1,0]=4 111 B14R1.6075 N[C@@H](C(=O)O)C1=C(F)C=CC(F)=C1F Y14052 [0,1,0,0,1,0|0,2,0]=4 112 B14R1.6075 N[C@@H](C(=O)O)C1=C(F)C=CC(F)=C1F Y14053 [0,1,0,0,1,0|0,2,0]=4 113 B14R2.781 O=C(O)[C@@H]1COC2=C(C=CC=C2)C1 85684 [1,0,0,1,0,0|2,0,0]=4 114 B12R1.225 CC1=CC=CC([C@@H](C)C(=O)O)=C1 Y11075 [1,0,0,0,1,0|2,0,0]=4 115 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 Y11001 [1,0,0,0,1,0|0,0,0]=2 116 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 Y11226 [1,0,0,0,1,0|1,0,0]=3 117 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Br)=C1 Y14076 [1,0,0,0,1,0|0,1,1]=4 118 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(Br)=C1 Y14077 [1,0,0,0,1,0|0,1,1]=4 119 B12R1.354 N[C@@H](CO)C1=C(Cl)C=CC(F)=C1 Y12158 [1,0,0,0,1,0|0,1,1]=4 120 B14R1.337 N[C@@H](CC(=O)O)CC1=C(Br)C=CC=C1 FD10120 [1,0,0,0,0,1|0,1,0]=3