0 B19R1.5221 COc1cc(ccc1O)C=CC(=O)NC[C@@H](C)OC WXVL_AK00704SB1126 [0,0,0,0,0,0|4,0,0]=4 1 B19R1.5221 COc1cc(ccc1O)C=CC(=O)NC[C@@H](C)OC WXVL_AK00704SB1126 [0,0,0,0,0,0|4,0,0]=4 2 B19R1.5221 COc1cc(ccc1O)C=CC(=O)NC[C@@H](F)CO WXVL_AK00590SB1126 [0,0,0,0,0,0|2,0,0]=2 3 B19R1.5221 COc1cc(ccc1O)C=CC(=O)NC[C@@H](F)CO WXVL_AK00590SB1126 [0,0,0,0,0,0|2,0,0]=2 4 B19R1.5221 COc1cc(ccc1O)C=CC(=O)NC[C@H](O)CO WXVL_AK00483SB1126 [0,0,0,0,0,0|1,0,0]=1 5 B19R1.5221 COc1cc(ccc1O)C=CC(=O)NC[C@H](O)CO WXVL_AK00483SB1126 [0,0,0,0,0,0|1,0,0]=1 6 B18R1.2733 C#CCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK3109SB1126 [1,0,0,0,0,0|2,0,1]=4 7 B18R1.2733 C#CCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK3109SB1126 [1,0,0,0,0,0|2,0,1]=4 8 B18R1.2733 C=CCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00138SB1126 [1,0,0,0,0,0|2,0,1]=4 9 B18R1.2733 C=CCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00138SB1126 [1,0,0,0,0,0|2,0,1]=4 10 B18R1.2733 CCCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00588SB1126 [1,0,0,0,0,0|2,0,0]=3 11 B18R1.2733 CCCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00588SB1126 [1,0,0,0,0,0|2,0,0]=3 12 B18R1.2733 COc1cc(ccc1O)C=CC(=O)NCCC#N WXVL_AK0087SB1126 [1,0,0,0,0,0|2,0,1]=4 13 B18R1.2733 COc1cc(ccc1O)C=CC(=O)NCCC#N WXVL_AK0087SB1126 [1,0,0,0,0,0|2,0,1]=4 14 B18R1.2733 COc1cc(ccc1O)C=CC(=O)NCCCO WXVL_AK0073SB1126 [1,0,0,0,0,0|1,0,0]=2 15 B18R1.2733 COc1cc(ccc1O)C=CC(=O)NCCCO WXVL_AK0073SB1126 [1,0,0,0,0,0|1,0,0]=2 16 B18R1.2733 COc1cc(ccc1O)C=CC(=O)NCCSC WXVL_AK00440SB1126 [1,0,0,0,0,0|3,0,0]=4 17 B18R1.2733 COc1cc(ccc1O)C=CC(=O)NCCSC WXVL_AK00440SB1126 [1,0,0,0,0,0|3,0,0]=4 18 B18R1.5536 C=C(C)CNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK0761SB1126 [1,0,0,0,0,0|2,0,1]=4 19 B18R1.5536 C=C(C)CNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK0761SB1126 [1,0,0,0,0,0|2,0,1]=4 20 B18R1.5536 COc1cc(ccc1O)C=CC(=O)NCC(C)C WXVL_AK00544SB1126 [1,0,0,0,0,0|2,0,0]=3 21 B18R1.5536 COc1cc(ccc1O)C=CC(=O)NCC(C)C WXVL_AK00544SB1126 [1,0,0,0,0,0|2,0,0]=3 22 B18R1.5536 COc1cc(ccc1O)C=CC(=O)NCC(C)O WXVL_AK0052SB1126 [1,0,0,0,0,0|1,0,0]=2 23 B18R1.5536 COc1cc(ccc1O)C=CC(=O)NCC(C)O WXVL_AK0052SB1126 [1,0,0,0,0,0|1,0,0]=2 24 B18R1.5536 COc1cc(ccc1O)C=CC(=O)NCC(F)F WXVL_AK0136SB1126 [1,0,0,0,0,0|3,0,0]=4 25 B18R1.5536 COc1cc(ccc1O)C=CC(=O)NCC(F)F WXVL_AK0136SB1126 [1,0,0,0,0,0|3,0,0]=4 26 B18R1.5536 COc1cc(ccc1O)C=CC(=O)NC[C@H](C)O WXVL_AK0113SB1126 [1,0,0,0,0,0|1,0,0]=2 27 B18R1.5536 COc1cc(ccc1O)C=CC(=O)NC[C@H](C)O WXVL_AK0113SB1126 [1,0,0,0,0,0|1,0,0]=2 28 B18R1.37863 O=C(C=Cc1ccc(c(c1)Cl)Cl)NC[C@H](O)CO WXVL_AK00483SB0118 [1,0,0,0,0,0|3,0,0]=4 29 B18R1.37863 O=C(C=Cc1ccc(c(c1)Cl)Cl)NC[C@H](O)CO WXVL_AK00483SB0118 [1,0,0,0,0,0|3,0,0]=4 30 B18R1.37863 O=C(CCc1ccc(c(c1)O)O)NC[C@H](O)CO WXVL_AK00483SB3329 [1,0,0,0,0,0|1,0,2]=4 31 B18R1.37863 O=C(CCc1ccc(c(c1)O)O)NC[C@H](O)CO WXVL_AK00483SB3329 [1,0,0,0,0,0|1,0,2]=4 32 B18R1.39572 COc1cccc(c1)C=CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0458 [1,0,0,0,0,0|2,0,0]=3 33 B18R1.39572 COc1cccc(c1)C=CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0458 [1,0,0,0,0,0|2,0,0]=3 34 B18R1.39572 COc1cccc(c1)C=CC(=O)NC[C@H](O)CO WXVL_AK00483SB0458 [1,0,0,0,0,0|1,0,0]=2 35 B18R1.39572 COc1cccc(c1)C=CC(=O)NC[C@H](O)CO WXVL_AK00483SB0458 [1,0,0,0,0,0|1,0,0]=2 36 B18R1.39572 COc1cccc(c1)CCC(=O)NC[C@H](O)CO WXVL_AK00483SB0134 [1,0,0,0,0,0|1,0,2]=4 37 B18R1.39572 COc1cccc(c1)CCC(=O)NC[C@H](O)CO WXVL_AK00483SB0134 [1,0,0,0,0,0|1,0,2]=4 38 B18R1.39572 N#Cc1cccc(c1)/C=C/C(=O)NC[C@H](O)CO WXVL_AK00483SB2454 [1,0,0,0,0,0|3,0,0]=4 39 B18R1.39572 N#Cc1cccc(c1)/C=C/C(=O)NC[C@H](O)CO WXVL_AK00483SB2454 [1,0,0,0,0,0|3,0,0]=4 40 B20R1.727812 COc1ccc(cc1OC)CCC(=O)NC[C@H](O)CO WXVL_AK00483SB1218 [0,1,0,0,0,0|1,0,2]=4 41 B20R1.727812 COc1ccc(cc1OC)CCC(=O)NC[C@H](O)CO WXVL_AK00483SB1218 [0,1,0,0,0,0|1,0,2]=4 42 B20R1.3010962 COc1cc(ccc1O)C=CC(=O)NCC(C)(C)CO WXVL_AK0104SB1126 [0,1,0,0,0,0|2,0,0]=3 43 B20R1.3010962 COc1cc(ccc1O)C=CC(=O)NCC(C)(C)CO WXVL_AK0104SB1126 [0,1,0,0,0,0|2,0,0]=3 44 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)Br WXVL_AN00715SB1126 [0,0,0,1,0,0|3,0,0]=4 45 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)C WXVL_AN0556SB1126 [0,0,0,1,0,0|3,0,0]=4 46 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)C WXVL_AN0556SB1126 [0,0,0,1,0,0|3,0,0]=4 47 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)F WXVL_AN00338SB1126 [0,0,0,1,0,0|3,0,0]=4 48 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)F WXVL_AN00338SB1126 [0,0,0,1,0,0|3,0,0]=4 49 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)O WXVL_AN0158SB1126 [0,0,0,1,0,0|2,0,0]=3 50 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)O WXVL_AN0158SB1126 [0,0,0,1,0,0|2,0,0]=3 51 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@@H](C2)C WXVL_AN00094SB1126 [0,0,0,1,0,0|3,0,0]=4 52 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@@H](C2)C WXVL_AN00094SB1126 [0,0,0,1,0,0|3,0,0]=4 53 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@@H](C2)O WXVL_AN00391SB1126 [0,0,0,1,0,0|2,0,0]=3 54 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@@H](C2)O WXVL_AN00391SB1126 [0,0,0,1,0,0|2,0,0]=3 55 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@H](C2)C WXVL_AN00488SB1126 [0,0,0,1,0,0|3,0,0]=4 56 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@H](C2)C WXVL_AN00488SB1126 [0,0,0,1,0,0|3,0,0]=4 57 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@H](C2)F WXVL_AN00035SB1126 [0,0,0,1,0,0|3,0,0]=4 58 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@H](C2)F WXVL_AN00035SB1126 [0,0,0,1,0,0|3,0,0]=4 59 B20R2.2947 COc1cc(ccc1O)C=CC(=O)N2CC[C@H](C2)O WXVL_AN00543SB1126 [0,0,0,1,0,0|2,0,0]=3 60 B20R2.265766 O=C(CCc1ccc2c(c1)OCO2)NC[C@H](O)CO WXVL_AK00483SB0143 [0,0,0,1,0,0|1,0,2]=4 61 B20R2.265766 O=C(CCc1ccc2c(c1)OCO2)NC[C@H](O)CO WXVL_AK00483SB0143 [0,0,0,1,0,0|1,0,2]=4 62 B20R2.2308522 COc1cc(ccc1O)C=CC(=O)NCC2(CC2)C WXVL_AK00811SB1126 [0,0,0,1,0,0|3,0,0]=4 63 B20R2.2308522 COc1cc(ccc1O)C=CC(=O)NCC2(CC2)C WXVL_AK00811SB1126 [0,0,0,1,0,0|3,0,0]=4 64 B20R2.2308522 COc1cc(ccc1O)C=CC(=O)NCC2(CC2)O WXVL_AK0301SB1126 [0,0,0,1,0,0|2,0,0]=3 65 B20R2.2308522 COc1cc(ccc1O)C=CC(=O)NCC2(CC2)O WXVL_AK0301SB1126 [0,0,0,1,0,0|2,0,0]=3 66 B20R2.2308730 COc1cc(ccc1O)C=CC(=O)NCC2CCC2 WXVL_AK00492SB1126 [0,0,0,1,0,0|3,0,0]=4 67 B20R2.2308730 COc1cc(ccc1O)C=CC(=O)NCC2CCC2 WXVL_AK00492SB1126 [0,0,0,1,0,0|3,0,0]=4 68 B20R2.2308730 COc1cc(ccc1O)C=CC(=O)NCC2CCO2 WXVL_AK1433SB1126 [0,0,0,1,0,0|2,0,0]=3 69 B20R2.2308730 COc1cc(ccc1O)C=CC(=O)NCC2CCO2 WXVL_AK1433SB1126 [0,0,0,1,0,0|2,0,0]=3 70 B20R2.2308730 COc1cc(ccc1O)C=CC(=O)NCC2COC2 WXVL_AK0186SB1126 [0,0,0,1,0,0|2,0,0]=3 71 B20R2.2308730 COc1cc(ccc1O)C=CC(=O)NCC2COC2 WXVL_AK0186SB1126 [0,0,0,1,0,0|2,0,0]=3 72 B18R1.5478 CCC(O)CC(=O)NCc1ccc(c(c1)OC)O WXVL_AK00448SB4092 [0,0,0,0,1,0|2,0,1]=4 73 B18R1.5478 CCC(O)CC(=O)NCc1ccc(c(c1)OC)O WXVL_AK00448SB4092 [0,0,0,0,1,0|2,0,1]=4 74 B18R1.5478 CC[C@H](C)NC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00678SB1126 [0,0,0,0,1,0|3,0,0]=4 75 B18R1.5478 CC[C@H](C)NC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00678SB1126 [0,0,0,0,1,0|3,0,0]=4 76 B18R1.5478 COc1cc(ccc1O)C=CC(=O)N[C@@H](C)CF WXVL_AK00558SB1126 [0,0,0,0,1,0|3,0,0]=4 77 B18R1.5478 COc1cc(ccc1O)C=CC(=O)N[C@@H](C)CF WXVL_AK00558SB1126 [0,0,0,0,1,0|3,0,0]=4 78 B18R1.5478 COc1cc(ccc1O)C=CC(=O)N[C@@H](C)CO WXVL_AK0109SB1126 [0,0,0,0,1,0|2,0,0]=3 79 B18R1.5478 COc1cc(ccc1O)C=CC(=O)N[C@@H](C)CO WXVL_AK0109SB1126 [0,0,0,0,1,0|2,0,0]=3 80 B18R1.5551 COc1cc(ccc1F)CC(=O)NC[C@H](O)CO WXVL_AK00483SB1467 [0,0,0,0,1,0|2,0,1]=4 81 B18R1.5551 COc1cc(ccc1F)CC(=O)NC[C@H](O)CO WXVL_AK00483SB1467 [0,0,0,0,1,0|2,0,1]=4 82 B20R1.122966 COc1cc(ccc1O)C=CC(=O)NCCC(C)CO WXVL_AK4143SB1126 [0,0,0,0,0,1|2,0,0]=3 83 B20R1.122966 COc1cc(ccc1O)C=CC(=O)NCCC(C)CO WXVL_AK4143SB1126 [0,0,0,0,0,1|2,0,0]=3 84 B17R1.3343 CCCCNC(=O)C=Cc1cccc(c1)OC WXVL_AK00588SB0458 [2,0,0,0,0,0|2,0,0]=4 85 B17R1.3343 CCCCNC(=O)C=Cc1cccc(c1)OC WXVL_AK00588SB0458 [2,0,0,0,0,0|2,0,0]=4 86 B17R1.3343 COc1cccc(c1)C=CC(=O)NCCCO WXVL_AK0073SB0458 [2,0,0,0,0,0|1,0,0]=3 87 B17R1.3343 COc1cccc(c1)C=CC(=O)NCCCO WXVL_AK0073SB0458 [2,0,0,0,0,0|1,0,0]=3 88 B17R1.29943 CCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00504SB1126 [2,0,0,0,0,0|1,0,0]=3 89 B17R1.29943 CCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00504SB1126 [2,0,0,0,0,0|1,0,0]=3 90 B17R1.29943 COc1cc(ccc1O)C=CC(=O)NCCF WXVL_AK00466SB1126 [2,0,0,0,0,0|2,0,0]=4 91 B17R1.29943 COc1cc(ccc1O)C=CC(=O)NCCF WXVL_AK00466SB1126 [2,0,0,0,0,0|2,0,0]=4 92 B17R1.28454 COc1cccc(c1)C=CC(=O)NCC(C)C WXVL_AK00544SB0458 [2,0,0,0,0,0|2,0,0]=4 93 B17R1.28454 COc1cccc(c1)C=CC(=O)NCC(C)C WXVL_AK00544SB0458 [2,0,0,0,0,0|2,0,0]=4 94 B17R1.28454 COc1cccc(c1)C=CC(=O)NCC(C)O WXVL_AK0052SB0458 [2,0,0,0,0,0|1,0,0]=3 95 B17R1.28454 COc1cccc(c1)C=CC(=O)NCC(C)O WXVL_AK0052SB0458 [2,0,0,0,0,0|1,0,0]=3 96 B17R1.28454 COc1cccc(c1)C=CC(=O)NC[C@H](C)O WXVL_AK0113SB0458 [2,0,0,0,0,0|1,0,0]=3 97 B17R1.28454 COc1cccc(c1)C=CC(=O)NC[C@H](C)O WXVL_AK0113SB0458 [2,0,0,0,0,0|1,0,0]=3 98 B17R1.1402 Cc1ccc(cc1)C=CC(=O)NC[C@H](O)CO WXVL_AK00483SB0060 [2,0,0,0,0,0|2,0,0]=4 99 B17R1.1402 Cc1ccc(cc1)C=CC(=O)NC[C@H](O)CO WXVL_AK00483SB0060 [2,0,0,0,0,0|2,0,0]=4 100 B17R1.1402 O=C(/C=C/c1ccc(cc1)O)NC[C@@H](F)CO WXVL_AK00590SB0418 [2,0,0,0,0,0|2,0,0]=4 101 B17R1.1402 O=C(/C=C/c1ccc(cc1)O)NC[C@@H](F)CO WXVL_AK00590SB0418 [2,0,0,0,0,0|2,0,0]=4 102 B17R1.1402 O=C(/C=C/c1ccc(cc1)O)NC[C@H](O)CO WXVL_AK00483SB0418 [2,0,0,0,0,0|1,0,0]=3 103 B17R1.1402 O=C(/C=C/c1ccc(cc1)O)NC[C@H](O)CO WXVL_AK00483SB0418 [2,0,0,0,0,0|1,0,0]=3 104 B17R1.1402 O=C(C=Cc1ccc(cc1)Br)NC[C@H](O)CO WXVL_AK00483SB1122 [2,0,0,0,0,0|2,0,0]=4 105 B17R1.1402 O=C(C=Cc1ccc(cc1)Br)NC[C@H](O)CO WXVL_AK00483SB1122 [2,0,0,0,0,0|2,0,0]=4 106 B17R1.1402 O=C(C=Cc1ccc(cc1)Cl)NC[C@H](O)CO WXVL_AK00483SB0119 [2,0,0,0,0,0|2,0,0]=4 107 B17R1.1402 O=C(C=Cc1ccc(cc1)Cl)NC[C@H](O)CO WXVL_AK00483SB0119 [2,0,0,0,0,0|2,0,0]=4 108 B17R1.1402 O=C(C=Cc1ccc(cc1)F)NC[C@H](O)CO WXVL_AK00483SB1186 [2,0,0,0,0,0|2,0,0]=4 109 B17R1.1402 O=C(C=Cc1ccc(cc1)F)NC[C@H](O)CO WXVL_AK00483SB1186 [2,0,0,0,0,0|2,0,0]=4 110 B17R1.1403 O=C(C=Cc1cccc(c1)Cl)NC[C@H](O)CO WXVL_AK00483SB1601 [2,0,0,0,0,0|2,0,0]=4 111 B17R1.1403 O=C(C=Cc1cccc(c1)Cl)NC[C@H](O)CO WXVL_AK00483SB1601 [2,0,0,0,0,0|2,0,0]=4 112 B17R1.1403 O=C(C=Cc1cccc(c1)O)NC[C@@H](F)CO WXVL_AK00590SB0417 [2,0,0,0,0,0|2,0,0]=4 113 B17R1.1403 O=C(C=Cc1cccc(c1)O)NC[C@@H](F)CO WXVL_AK00590SB0417 [2,0,0,0,0,0|2,0,0]=4 114 B17R1.1403 O=C(C=Cc1cccc(c1)O)NC[C@H](O)CO WXVL_AK00483SB0417 [2,0,0,0,0,0|1,0,0]=3 115 B17R1.1403 O=C(C=Cc1cccc(c1)O)NC[C@H](O)CO WXVL_AK00483SB0417 [2,0,0,0,0,0|1,0,0]=3 116 B19R1.5220 COc1cc(ccc1O)C=CC(=O)NCCC(C)C WXVL_AK0068SB1126 [1,1,0,0,0,0|2,0,0]=4 117 B19R1.5220 COc1cc(ccc1O)C=CC(=O)NCCC(C)C WXVL_AK0068SB1126 [1,1,0,0,0,0|2,0,0]=4 118 B19R1.29387 C#CCCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00218SB1126 [1,1,0,0,0,0|2,0,0]=4 119 B19R1.29387 C#CCCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00218SB1126 [1,1,0,0,0,0|2,0,0]=4 120 B19R1.29387 CCCCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK0076SB1126 [1,1,0,0,0,0|2,0,0]=4 121 B19R1.29387 CCCCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK0076SB1126 [1,1,0,0,0,0|2,0,0]=4 122 B19R1.29387 CCSCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00494SB1126 [1,1,0,0,0,0|2,0,0]=4 123 B19R1.29387 CCSCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00494SB1126 [1,1,0,0,0,0|2,0,0]=4 124 B19R1.29387 COCCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00637SB1126 [1,1,0,0,0,0|1,0,0]=3 125 B19R1.29387 COCCCNC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00637SB1126 [1,1,0,0,0,0|1,0,0]=3 126 B19R1.29387 COc1cc(ccc1O)C=CC(=O)NCCCCO WXVL_AK0075SB1126 [1,1,0,0,0,0|1,0,0]=3 127 B19R1.29387 COc1cc(ccc1O)C=CC(=O)NCCCCO WXVL_AK0075SB1126 [1,1,0,0,0,0|1,0,0]=3 128 B19R1.29387 COc1cc(ccc1O)C=CC(=O)NCCCSC WXVL_AK0965SB1126 [1,1,0,0,0,0|1,1,0]=4 129 B19R1.29387 COc1cc(ccc1O)C=CC(=O)NCCCSC WXVL_AK0965SB1126 [1,1,0,0,0,0|1,1,0]=4 130 B19R1.58632 CCC[C@H](C)NC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00682SB1126 [1,1,0,0,0,0|2,0,0]=4 131 B19R1.58632 CCC[C@H](C)NC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00682SB1126 [1,1,0,0,0,0|2,0,0]=4 132 B19R1.58632 COc1cc(ccc1O)C=CC(=O)NC(C)CCO WXVL_AK1288SB1126 [1,1,0,0,0,0|1,0,0]=3 133 B19R1.58632 COc1cc(ccc1O)C=CC(=O)NC(C)CCO WXVL_AK1288SB1126 [1,1,0,0,0,0|1,0,0]=3 134 B19R1.89737 COc1cc(ccc1O)C=CC(=O)NCC(C)(C)C WXVL_AK00655SB1126 [1,1,0,0,0,0|2,0,0]=4 135 B19R1.89737 COc1cc(ccc1O)C=CC(=O)NCC(C)(C)C WXVL_AK00655SB1126 [1,1,0,0,0,0|2,0,0]=4 136 B19R1.89737 COc1cc(ccc1O)C=CC(=O)NCC(C)(C)F WXVL_AK00660SB1126 [1,1,0,0,0,0|2,0,0]=4 137 B19R1.89737 COc1cc(ccc1O)C=CC(=O)NCC(C)(C)F WXVL_AK00660SB1126 [1,1,0,0,0,0|2,0,0]=4 138 B19R1.89737 COc1cc(ccc1O)C=CC(=O)NCC(C)(C)O WXVL_AK0490SB1126 [1,1,0,0,0,0|1,0,0]=3 139 B19R1.89737 COc1cc(ccc1O)C=CC(=O)NCC(C)(C)O WXVL_AK0490SB1126 [1,1,0,0,0,0|1,0,0]=3 140 B19R1.89737 COc1cc(ccc1O)C=CC(=O)NCC(C)(F)F WXVL_AK0308SB1126 [1,1,0,0,0,0|2,0,0]=4 141 B19R1.89737 COc1cc(ccc1O)C=CC(=O)NCC(C)(F)F WXVL_AK0308SB1126 [1,1,0,0,0,0|2,0,0]=4 142 B19R1.22955 COc1cc(cc(c1)/C=C/C(=O)NC[C@@H](F)CO)F WXVL_AK00590SB7045 [1,1,0,0,0,0|2,0,0]=4 143 B19R1.22955 COc1cc(cc(c1)/C=C/C(=O)NC[C@@H](F)CO)F WXVL_AK00590SB7045 [1,1,0,0,0,0|2,0,0]=4 144 B19R1.22955 COc1cc(cc(c1)/C=C/C(=O)NC[C@H](O)CO)F WXVL_AK00483SB7045 [1,1,0,0,0,0|1,0,0]=3 145 B19R1.22955 COc1cc(cc(c1)/C=C/C(=O)NC[C@H](O)CO)F WXVL_AK00483SB7045 [1,1,0,0,0,0|1,0,0]=3 146 B19R1.103383 COc1cccc(c1)C=CC(=O)NCC(C)(C)CO WXVL_AK0104SB0458 [1,1,0,0,0,0|2,0,0]=4 147 B19R1.103383 COc1cccc(c1)C=CC(=O)NCC(C)(C)CO WXVL_AK0104SB0458 [1,1,0,0,0,0|2,0,0]=4 148 B19R1.5222 C=C[C@@H](CO)NC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00581SB1126 [0,1,0,0,1,0|2,0,0]=4 149 B19R1.5222 C=C[C@@H](CO)NC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK00581SB1126 [0,1,0,0,1,0|2,0,0]=4 150 B19R1.5222 CC[C@H](CO)NC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK0111SB1126 [0,1,0,0,1,0|2,0,0]=4 151 B19R1.5222 CC[C@H](CO)NC(=O)C=Cc1ccc(c(c1)OC)O WXVL_AK0111SB1126 [0,1,0,0,1,0|2,0,0]=4 152 B19R1.5222 COc1cc(ccc1O)C=CC(=O)NC(CO)CO WXVL_AK0741SB1126 [0,1,0,0,1,0|1,0,0]=3 153 B19R1.5222 COc1cc(ccc1O)C=CC(=O)NC(CO)CO WXVL_AK0741SB1126 [0,1,0,0,1,0|1,0,0]=3 154 B19R1.89784 COc1cc(ccc1O)C=CC(=O)NC(C)(C)CO WXVL_AK0025SB1126 [0,1,0,0,1,0|2,0,0]=4 155 B19R1.89784 COc1cc(ccc1O)C=CC(=O)NC(C)(C)CO WXVL_AK0025SB1126 [0,1,0,0,1,0|2,0,0]=4 156 B19R1.108351 COc1ccc(cc1OC)CC(=O)NC[C@H](O)CO WXVL_AK00483SB0230 [0,1,0,0,1,0|1,0,1]=4 157 B19R1.108351 COc1ccc(cc1OC)CC(=O)NC[C@H](O)CO WXVL_AK00483SB0230 [0,1,0,0,1,0|1,0,1]=4 158 B21R1.26289 COc1cc(cc(c1O)OC)C=CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0270 [0,2,0,0,0,0|2,0,0]=4 159 B21R1.26289 COc1cc(cc(c1O)OC)C=CC(=O)NC[C@@H](F)CO WXVL_AK00590SB0270 [0,2,0,0,0,0|2,0,0]=4 160 B21R1.26289 COc1cc(cc(c1O)OC)C=CC(=O)NC[C@H](O)CO WXVL_AK00483SB0270 [0,2,0,0,0,0|1,0,0]=3 161 B21R1.26289 COc1cc(cc(c1O)OC)C=CC(=O)NC[C@H](O)CO WXVL_AK00483SB0270 [0,2,0,0,0,0|1,0,0]=3 162 B21R1.158728 COc1cc(ccc1O)C=CC(=O)NCC(O)C(F)(F)F WXVL_AK2729SB1126 [0,2,0,0,0,0|2,0,0]=4 163 B21R1.158728 COc1cc(ccc1O)C=CC(=O)NCC(O)C(F)(F)F WXVL_AK2729SB1126 [0,2,0,0,0,0|2,0,0]=4 164 B19R2.2837 COc1cc(ccc1O)C=CC(=O)N2CCCC2 WXVL_AN0008SB1126 [1,0,0,1,0,0|2,0,0]=4 165 B19R2.2837 COc1cc(ccc1O)C=CC(=O)N2CCCC2 WXVL_AN0008SB1126 [1,0,0,1,0,0|2,0,0]=4 166 B19R2.21886 COc1cc(ccc1O)C=CC(=O)N2CC(C2)C WXVL_AN0291SB1126 [1,0,0,1,0,0|2,0,0]=4 167 B19R2.21886 COc1cc(ccc1O)C=CC(=O)N2CC(C2)C WXVL_AN0291SB1126 [1,0,0,1,0,0|2,0,0]=4 168 B19R2.21886 COc1cc(ccc1O)C=CC(=O)N2CC(C2)O WXVL_AN0284SB1126 [1,0,0,1,0,0|1,0,0]=3 169 B19R2.21886 COc1cc(ccc1O)C=CC(=O)N2CC(C2)O WXVL_AN0284SB1126 [1,0,0,1,0,0|1,0,0]=3 170 B19R2.884 COc1cccc(c1)C=CC(=O)N2CCC(C2)O WXVL_AN0158SB0458 [1,0,0,1,0,0|2,0,0]=4 171 B19R2.884 COc1cccc(c1)C=CC(=O)N2CCC(C2)O WXVL_AN0158SB0458 [1,0,0,1,0,0|2,0,0]=4 172 B19R2.884 COc1cccc(c1)C=CC(=O)N2CC[C@@H](C2)O WXVL_AN00391SB0458 [1,0,0,1,0,0|2,0,0]=4 173 B19R2.884 COc1cccc(c1)C=CC(=O)N2CC[C@@H](C2)O WXVL_AN00391SB0458 [1,0,0,1,0,0|2,0,0]=4 174 B19R2.884 COc1cccc(c1)C=CC(=O)N2CC[C@H](C2)O WXVL_AN00543SB0458 [1,0,0,1,0,0|2,0,0]=4 175 B19R2.26207 COc1cccc(c1)C=CC(=O)NCC2(CC2)O WXVL_AK0301SB0458 [1,0,0,1,0,0|2,0,0]=4 176 B19R2.26207 COc1cccc(c1)C=CC(=O)NCC2(CC2)O WXVL_AK0301SB0458 [1,0,0,1,0,0|2,0,0]=4 177 B19R2.1608284 COc1cccc(c1)C=CC(=O)NCC2CCO2 WXVL_AK1433SB0458 [1,0,0,1,0,0|2,0,0]=4 178 B19R2.1608284 COc1cccc(c1)C=CC(=O)NCC2CCO2 WXVL_AK1433SB0458 [1,0,0,1,0,0|2,0,0]=4 179 B19R2.1608284 COc1cccc(c1)C=CC(=O)NCC2COC2 WXVL_AK0186SB0458 [1,0,0,1,0,0|2,0,0]=4 180 B19R2.1608284 COc1cccc(c1)C=CC(=O)NCC2COC2 WXVL_AK0186SB0458 [1,0,0,1,0,0|2,0,0]=4 181 B19R2.155259 O=C(Cc1ccc2c(c1)OCO2)NC[C@H](O)CO WXVL_AK00483SB0139 [0,0,0,1,1,0|1,0,1]=4 182 B19R2.155259 O=C(Cc1ccc2c(c1)OCO2)NC[C@H](O)CO WXVL_AK00483SB0139 [0,0,0,1,1,0|1,0,1]=4 183 B19R2.155259 O=C(NC[C@H](O)CO)Nc1ccc2c(c1)OCO2 WXVL_AK00483YV0105 [0,0,0,1,1,0|2,0,0]=4 184 B19R2.155259 O=C(NC[C@H](O)CO)Nc1ccc2c(c1)OCO2 WXVL_AK00483YV0105 [0,0,0,1,1,0|2,0,0]=4 185 B21R2.41661 COc1cc(ccc1O)C=CC(=O)N2CCC(CC2)O WXVL_AN0023SB1126 [0,0,0,1,0,1|2,0,0]=4 186 B21R2.41661 COc1cc(ccc1O)C=CC(=O)N2CCC(CC2)O WXVL_AN0023SB1126 [0,0,0,1,0,1|2,0,0]=4 187 B21R2.46244 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)CO WXVL_AN2273SB1126 [0,0,0,1,0,1|2,0,0]=4 188 B21R2.46244 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)CO WXVL_AN2273SB1126 [0,0,0,1,0,1|2,0,0]=4 189 B21R2.46244 COc1cc(ccc1O)C=CC(=O)N2CC[C@@H](C2)CO WXVL_AN00661SB1126 [0,0,0,1,0,1|2,0,0]=4 190 B21R2.42190 COc1cc(ccc1O)C=CC(=O)N[C@@H]2COC[C@H]2O WXVL_AK0348SB1126 [0,1,0,1,0,0|1,0,0]=3 191 B21R2.42190 COc1cc(ccc1O)C=CC(=O)N[C@@H]2COC[C@H]2O WXVL_AK0348SB1126 [0,1,0,1,0,0|1,0,0]=3 192 B21R2.2987 COc1cc(ccc1O)C=CC(=O)N2CCCC(C2)O WXVL_AN0622SB1126 [0,1,0,1,0,0|2,0,0]=4 193 B21R2.2987 COc1cc(ccc1O)C=CC(=O)N2CCC[C@H](C2)O WXVL_AN00535SB1126 [0,1,0,1,0,0|2,0,0]=4 194 B21R2.2987 COc1cc(ccc1O)C=CC(=O)N2CCOC(C2)O WXVL_AN00776SB1126 [0,1,0,1,0,0|2,0,0]=4 195 B21R2.42186 COc1cc(ccc1O)C=CC(=O)N2C[C@@H]([C@@H](C2)O)F WXVL_AN00676SB1126 [0,1,0,1,0,0|2,0,0]=4 196 B21R2.42186 COc1cc(ccc1O)C=CC(=O)N2C[C@@H]([C@@H](C2)O)O WXVL_AN00637SB1126 [0,1,0,1,0,0|1,0,0]=3 197 B21R2.42186 COc1cc(ccc1O)C=CC(=O)N2C[C@@H]([C@H](C2)F)O WXVL_AN00685SB1126 [0,1,0,1,0,0|2,0,0]=4 198 B21R2.42186 COc1cc(ccc1O)C=CC(=O)N2C[C@H]([C@H](C2)O)C WXVL_AN00697SB1126 [0,1,0,1,0,0|2,0,0]=4 199 B21R2.41650 COc1cc(ccc1O)C=CC(=O)NCC2CCOC2 WXVL_AK00634SB1126 [0,1,0,1,0,0|2,0,0]=4 200 B21R2.41650 COc1cc(ccc1O)C=CC(=O)NCC2CCOC2 WXVL_AK00634SB1126 [0,1,0,1,0,0|2,0,0]=4 201 B21R2.41650 COc1cc(ccc1O)C=CC(=O)NC[C@@H]2CCCO2 WXVL_AK00754SB1126 [0,1,0,1,0,0|2,0,0]=4 202 B21R2.41650 COc1cc(ccc1O)C=CC(=O)NC[C@@H]2CCCO2 WXVL_AK00754SB1126 [0,1,0,1,0,0|2,0,0]=4 203 B21R2.41650 COc1cc(ccc1O)C=CC(=O)NC[C@H]2CCOC2 WXVL_AK2110SB1126 [0,1,0,1,0,0|2,0,0]=4 204 B21R2.41650 COc1cc(ccc1O)C=CC(=O)NC[C@H]2CCOC2 WXVL_AK2110SB1126 [0,1,0,1,0,0|2,0,0]=4 205 B21R2.42189 COc1cc(ccc1O)C=CC(=O)N2C[C@@H](C[C@@H]2C)O WXVL_AN00544SB1126 [0,1,0,1,0,0|2,0,0]=4 206 B21R2.8422416 COc1cc(ccc1O)C=CC(=O)NCC2(CCC2)O WXVL_AK2855SB1126 [0,1,0,1,0,0|2,0,0]=4 207 B21R2.8422416 COc1cc(ccc1O)C=CC(=O)NCC2(CCC2)O WXVL_AK2855SB1126 [0,1,0,1,0,0|2,0,0]=4 208 B21R2.8422416 COc1cc(ccc1O)C=CC(=O)NCC2(COC2)F WXVL_AK2103SB1126 [0,1,0,1,0,0|2,0,0]=4 209 B21R2.8422416 COc1cc(ccc1O)C=CC(=O)NCC2(COC2)F WXVL_AK2103SB1126 [0,1,0,1,0,0|2,0,0]=4 210 B21R2.8422416 COc1cc(ccc1O)C=CC(=O)NCC2(COC2)O WXVL_AK1349SB1126 [0,1,0,1,0,0|1,0,0]=3 211 B21R2.8422416 COc1cc(ccc1O)C=CC(=O)NCC2(COC2)O WXVL_AK1349SB1126 [0,1,0,1,0,0|1,0,0]=3 212 B21R2.8429240 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)(C)O WXVL_AN00096SB1126 [0,1,0,1,0,0|2,0,0]=4 213 B21R2.8429240 COc1cc(ccc1O)C=CC(=O)N2CCC(C2)(C)O WXVL_AN00096SB1126 [0,1,0,1,0,0|2,0,0]=4 214 B17R1.5260 COc1cc(ccc1O)C=CC(=O)NC(C)C WXVL_AK0030SB1126 [1,0,0,0,1,0|2,0,0]=4 215 B17R1.5260 COc1cc(ccc1O)C=CC(=O)NC(C)C WXVL_AK0030SB1126 [1,0,0,0,1,0|2,0,0]=4 216 B17R1.5260 COc1cc(ccc1O)CNC(=O)CC(C)O WXVL_AK00448SB3643 [1,0,0,0,1,0|1,0,1]=4 217 B17R1.5260 COc1cc(ccc1O)CNC(=O)CC(C)O WXVL_AK00448SB3643 [1,0,0,0,1,0|1,0,1]=4 218 B17R1.24481 O=C(Cc1ccc(c(c1)O)O)NC[C@H](O)CO WXVL_AK00483SB1141 [1,0,0,0,1,0|1,0,1]=4 219 B17R1.24481 O=C(Cc1ccc(c(c1)O)O)NC[C@H](O)CO WXVL_AK00483SB1141 [1,0,0,0,1,0|1,0,1]=4 220 B17R1.28393 COc1cccc(c1)C=CC(=O)N[C@@H](C)CO WXVL_AK0109SB0458 [1,0,0,0,1,0|2,0,0]=4 221 B17R1.28393 COc1cccc(c1)C=CC(=O)N[C@@H](C)CO WXVL_AK0109SB0458 [1,0,0,0,1,0|2,0,0]=4 222 B17R1.28471 COc1cccc(c1)CC(=O)NC[C@H](O)CO WXVL_AK00483SB0103 [1,0,0,0,1,0|1,0,1]=4 223 B17R1.28471 COc1cccc(c1)CC(=O)NC[C@H](O)CO WXVL_AK00483SB0103 [1,0,0,0,1,0|1,0,1]=4 224 B17R1.28471 COc1cccc(c1)NC(=O)NC[C@H](O)CO WXVL_AK00483YV0018 [1,0,0,0,1,0|2,0,0]=4 225 B17R1.28471 COc1cccc(c1)NC(=O)NC[C@H](O)CO WXVL_AK00483YV0018 [1,0,0,0,1,0|2,0,0]=4 226 B17R1.5345 CCC(O)CC(=O)Nc1ccc(c(c1)OC)O WXVL_AG0769SB4092 [0,0,0,0,2,0|2,0,0]=4 227 B17R1.5345 CCC(O)CC(=O)Nc1ccc(c(c1)OC)O WXVL_AG0769SB4092 [0,0,0,0,2,0|2,0,0]=4 228 B17R1.5281 COc1cc(ccc1Br)C(=O)NC[C@H](O)CO WXVL_AK00483SD0466 [0,0,0,0,2,0|2,0,0]=4 229 B17R1.5281 COc1cc(ccc1Br)C(=O)NC[C@H](O)CO WXVL_AK00483SD0466 [0,0,0,0,2,0|2,0,0]=4 230 B17R1.5281 COc1cc(ccc1C)C(=O)NC[C@H](O)CO WXVL_AK00483SD0079 [0,0,0,0,2,0|2,0,0]=4 231 B17R1.5281 COc1cc(ccc1C)C(=O)NC[C@H](O)CO WXVL_AK00483SD0079 [0,0,0,0,2,0|2,0,0]=4 232 B17R1.5281 COc1cc(ccc1Cl)C(=O)NC[C@H](O)CO WXVL_AK00483SD0364 [0,0,0,0,2,0|2,0,0]=4 233 B17R1.5281 COc1cc(ccc1Cl)C(=O)NC[C@H](O)CO WXVL_AK00483SD0364 [0,0,0,0,2,0|2,0,0]=4 234 B17R1.5281 COc1cc(ccc1F)C(=O)NC[C@H](O)CO WXVL_AK00483SD0165 [0,0,0,0,2,0|2,0,0]=4 235 B17R1.5281 COc1cc(ccc1F)C(=O)NC[C@H](O)CO WXVL_AK00483SD0165 [0,0,0,0,2,0|2,0,0]=4 236 B17R1.5281 COc1cc(ccc1I)C(=O)NC[C@H](O)CO WXVL_AK00483SD2600 [0,0,0,0,2,0|2,0,0]=4 237 B17R1.5281 COc1cc(ccc1I)C(=O)NC[C@H](O)CO WXVL_AK00483SD2600 [0,0,0,0,2,0|2,0,0]=4 238 B17R1.5281 COc1cc(ccc1O)C(=O)NC[C@@H](F)CO WXVL_AK00590SD0070 [0,0,0,0,2,0|2,0,0]=4 239 B17R1.5281 COc1cc(ccc1O)C(=O)NC[C@@H](F)CO WXVL_AK00590SD0070 [0,0,0,0,2,0|2,0,0]=4 240 B17R1.5281 COc1cc(ccc1O)C(=O)NC[C@H](O)CO WXVL_AK00483SD0070 [0,0,0,0,2,0|1,0,0]=3 241 B17R1.5281 COc1cc(ccc1O)C(=O)NC[C@H](O)CO WXVL_AK00483SD0070 [0,0,0,0,2,0|1,0,0]=3 242 B19R1.6912 COc1cccc(c1)C=CC(=O)NCCC(C)CO WXVL_AK4143SB0458 [1,0,0,0,0,1|2,0,0]=4 243 B19R1.6912 COc1cccc(c1)C=CC(=O)NCCC(C)CO WXVL_AK4143SB0458 [1,0,0,0,0,1|2,0,0]=4