0 B14R1.6449 CC(CCOC1=CC=CC=C1)C(=O)O Z839123502 [0,0,0,0,0,0|3,0,0]=3 1 B14R1.6449 CC(CNCC1=CC=CC=C1)C(=O)O Z1762658341 [0,0,0,0,0,0|2,0,0]=2 2 B14R1.6449 CC(COCC1=CC=CC=C1)C(=O)O Z431541082 [0,0,0,0,0,0|1,1,0]=2 3 B14R1.6449 CC(CSCC1=CC=CC=C1)C(=O)O Z431541728 [0,0,0,0,0,0|1,0,0]=1 4 B14R1.6449 CC(CSCC1=CN=CC=C1)C(=O)O Z1251190240 [0,0,0,0,0,0|2,0,0]=2 5 B14R1.6449 CC(SCCC1=CC=CC=C1)C(=O)N Z1486300646 [0,0,0,0,0,0|4,0,0]=4 6 B14R1.6449 NC(CCCC1=CC=CC=C1)C(=O)O Z1259335833 [0,0,0,0,0,0|1,0,0]=1 7 B14R1.6449 NC(CCSC1=CC=CC=C1)C(=O)O Z1080372958 [0,0,0,0,0,0|2,0,0]=2 8 B14R1.6449 NC(CNCC1=CC=CC=C1)C(=O)O Z1945696031 [0,0,0,0,0,0|1,0,0]=1 9 B14R1.6449 N[C@@H](CCOC1=CC=CC=C1)C(=O)O Z1262524421 [0,0,0,0,0,0|2,0,0]=2 10 B14R1.6449 O=C(O)C(O)CCCC1=CC=CC=C1 Z1262514933 [0,0,0,0,0,0|2,0,0]=2 11 B13R1.337 CC(=O)CCCCC1=CC=CC=C1 Z820117496 [1,0,0,0,0,0|2,0,0]=3 12 B13R1.337 CC(=O)NCCCC1=CC=CC=C1 Z26437154 [1,0,0,0,0,0|3,0,0]=4 13 B13R1.337 NC(=O)CCCOC1=CC=CC=C1 Z33546386 [1,0,0,0,0,0|3,0,0]=4 14 B13R1.337 NC(=O)CCNCC1=CC=CC=C1 Z53116260 [1,0,0,0,0,0|2,0,0]=3 15 B13R1.337 NC(=O)CCNCC1=CN=CC=C1 Z1706585640 [1,0,0,0,0,0|3,0,0]=4 16 B13R1.337 NC(=O)CCSCC1=CC=CC=C1 Z102924572 [1,0,0,0,0,0|1,0,0]=2 17 B13R1.337 NC(=O)NCCCC1=CC=CC=C1 Z198194892 [1,0,0,0,0,0|3,0,0]=4 18 B13R1.337 O=C(O)C#CCCC1=CC=CC=C1 Z1235951037 [1,0,0,0,0,0|1,0,2]=4 19 B13R1.337 O=C(O)CC/C=C/C1=CC=CC=C1 Z1222331031 [1,0,0,0,0,0|1,0,1]=3 20 B13R1.337 O=C(O)CCC#CC1=CC=CC=C1 Z1262510757 [1,0,0,0,0,0|1,0,1]=3 21 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 Z361415662 [1,0,0,0,0,0|1,0,0]=2 22 B13R1.337 O=C(O)CCCNC1=CC=CC=C1 Z445129480 [1,0,0,0,0,0|2,0,0]=3 23 B13R1.337 O=C(O)CCCOC1=CC=CC=C1 Z104496174 [1,0,0,0,0,0|2,0,0]=3 24 B13R1.337 O=C(O)CCCOC1=CN=CC=C1 Z927645802 [1,0,0,0,0,0|3,0,0]=4 25 B13R1.337 O=C(O)CCCSC1=CC=CC=C1 Z56862233 [1,0,0,0,0,0|2,0,0]=3 26 B13R1.337 O=C(O)CCNCC1=CC=CC=C1 Z335451288 [1,0,0,0,0,0|1,0,0]=2 27 B13R1.337 O=C(O)CCNCC1=CC=NC=C1 Z444311616 [1,0,0,0,0,0|2,0,0]=3 28 B13R1.337 O=C(O)CCNCC1=CN=CC=C1 Z1272739864 [1,0,0,0,0,0|2,0,0]=3 29 B13R1.337 O=C(O)CCNCC1=NC=CC=C1 Z444311590 [1,0,0,0,0,0|2,0,0]=3 30 B13R1.337 O=C(O)CCNCC1=NC=CC=N1 Z995103122 [1,0,0,0,0,0|3,0,0]=4 31 B13R1.337 O=C(O)CCOCC1=CC=CC=C1 Z316258802 [1,0,0,0,0,0|0,1,0]=2 32 B13R1.337 O=C(O)CCSCC1=CC=CC=C1 Z54671437 [1,0,0,0,0,0|0,0,0]=1 33 B13R1.337 O=C(O)CCSCC1=NC=CC=C1 Z295403834 [1,0,0,0,0,0|1,0,0]=2 34 B13R1.337 O=C(O)CNCCC1=CC=CC=C1 Z1278590824 [1,0,0,0,0,0|2,0,0]=3 35 B13R1.337 O=C(O)COCCC1=CC=CC=C1 Z362795648 [1,0,0,0,0,0|2,0,0]=3 36 B13R1.337 O=C(O)CSCCC1=CC=CC=C1 Z228588554 [1,0,0,0,0,0|2,0,0]=3 37 B15R1.500 C=C(CN[C@H](C)C1=CC=CC=C1)C(=O)O Z5266789671 [0,1,0,0,0,0|2,0,1]=4 38 B15R1.500 CC(CNC(=O)C1=CC=CC=C1)C(=O)O Z994989346 [0,1,0,0,0,0|2,0,1]=4 39 B15R1.500 CC(NCC(N)C(=O)O)C1=CC=CC=C1 Z2519151303 [0,1,0,0,0,0|1,0,0]=2 40 B15R1.500 NC(CCC(=O)C1=CC=CC=C1)C(=O)O Z1723556613 [0,1,0,0,0,0|1,0,1]=3 41 B15R1.1321 COC(=O)C(C)CNCC1=CC=CC=C1 Z53116254 [0,1,0,0,0,0|2,0,0]=3 42 B15R1.1321 COC(=O)C(O)CCCC1=CC=CC=C1 Z1269030229 [0,1,0,0,0,0|2,0,0]=3 43 B15R1.3675 CN(CC1=CC=CC=C1)CC(N)C(=O)O Z854090108 [0,1,0,0,0,0|1,0,0]=2 44 B15R1.9012 CC(C)(CCCC1=CC=CC=C1)C(=O)O Z995179750 [0,1,0,0,0,0|2,0,0]=3 45 B15R1.9012 CC(C)(COCC1=CC=CC=C1)C(=O)O Z1335956862 [0,1,0,0,0,0|1,1,0]=3 46 B15R2.59 NC(=O)[C@H]1CC[C@@H](N1)C2=CC=CC=C2 Z2053902363 [0,0,0,1,0,0|2,0,0]=3 47 B15R2.59 O=C(O)C1CCC(C1)C2=CC=CC=C2 Z1255391877 [0,0,0,1,0,0|2,0,0]=3 48 B15R2.59 O=C(O)C1CCN(C1)C2=CC=CC=C2 Z1198235403 [0,0,0,1,0,0|3,0,0]=4 49 B15R2.59 O=C(O)C1CSC(N1)C2=CC=CC=C2 Z197509452 [0,0,0,1,0,0|0,0,0]=1 50 B15R2.59 O=C(O)C1CSC(N1)C2=CC=NC=C2 Z275466112 [0,0,0,1,0,0|1,0,0]=2 51 B15R2.59 O=C(O)[C@@H]1CC[C@@H](O1)C2=CC=CC=C2 Z2309988547 [0,0,0,1,0,0|2,0,0]=3 52 B15R2.59 O=C(O)[C@@H]1CC[C@H](C1)C2=CC=CC=C2 Z2620379353 [0,0,0,1,0,0|2,0,0]=3 53 B15R2.59 O=C(O)[C@@H]1CSC(=N1)C2=CC=CC=C2 Z1269209114 [0,0,0,1,0,0|0,0,2]=3 54 B15R2.59 O=C(O)[C@H]1CC[C@@H](N1)C2=CC=CC=C2 Z1861964101 [0,0,0,1,0,0|1,0,0]=2 55 B15R2.1237 O=C(O)C1CCCC2=C(C1)C=CC=C2 Z1262536404 [0,0,0,1,0,0|2,0,0]=3 56 B15R2.1237 O=C(O)C1CCNC2=C(C1)C=CC=C2 Z3768005323 [0,0,0,1,0,0|3,0,0]=4 57 B15R2.1255 NC(C(=O)O)C1CCC2=C1C=CC=C2 Z3267202784 [0,0,0,1,0,0|1,0,0]=2 58 B15R2.16364 CC1(CCCC2=C1C=CC=C2)C(=O)O Z234897187 [0,0,0,1,0,0|2,0,0]=3 59 B15R2.16364 CC1(CCOC2=C1C=CC=C2)C(=O)O Z1259316423 [0,0,0,1,0,0|3,0,0]=4 60 B15R2.16364 CC1(OCCC2=C1C=CC=C2)C(=O)O Z875079792 [0,0,0,1,0,0|3,0,0]=4 61 B15R2.16364 NC1(CCCC2=C1C=CN=C2)C(=O)[O-] Z2888802785 [0,0,0,1,0,0|2,0,1]=4 62 B15R2.16364 NC1(CCOC2=C1C=CC=C2)C(=O)O Z317024734 [0,0,0,1,0,0|2,0,0]=3 63 B13R1.351 C=C(COC1=CC=CC=C1)C(=O)O Z1197868054 [0,0,0,0,1,0|1,1,1]=4 64 B13R1.351 CC(/C=C/C1=CC=CC=C1)C(=O)O Z3241898772 [0,0,0,0,1,0|1,0,2]=4 65 B13R1.351 CC(=O)C(C)OCC1=CC=CC=C1 Z906195336 [0,0,0,0,1,0|2,1,0]=4 66 B13R1.351 CC(COC1=CC=CC=C1)C(=O)O Z425469932 [0,0,0,0,1,0|1,1,0]=3 67 B13R1.351 CC(CSC1=CC=CC=C1)C(=O)O Z431541708 [0,0,0,0,1,0|1,0,0]=2 68 B13R1.351 CC(NCC1=CC=CC=C1)C(=O)O Z426041612 [0,0,0,0,1,0|2,0,0]=3 69 B13R1.351 CC(NCC1=CN=CC=C1)C(=O)O Z440613690 [0,0,0,0,1,0|3,0,0]=4 70 B13R1.351 CC(NCC1=NC=CC=C1)C(=O)O Z1270255478 [0,0,0,0,1,0|3,0,0]=4 71 B13R1.351 CC(OCC1=CC=CC=C1)C(=O)N Z394696218 [0,0,0,0,1,0|2,1,0]=4 72 B13R1.351 CC(OCC1=CC=CC=C1)C(=O)O Z316258798 [0,0,0,0,1,0|1,1,0]=3 73 B13R1.351 CC(OCC1=CC=NC=C1)C(=O)O Z2235681270 [0,0,0,0,1,0|2,1,0]=4 74 B13R1.351 CC(SCC1=CC=CC=C1)C(=O)O Z18753939 [0,0,0,0,1,0|1,0,0]=2 75 B13R1.351 C[C@H](NCC1=NC=CC=C1)C(=O)O Z5717815294 [0,0,0,0,1,0|3,0,0]=4 76 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O Z1255498772 [0,0,0,0,1,0|1,1,0]=3 77 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O Z317025074 [0,0,0,0,1,0|0,0,0]=1 78 B13R1.351 NC(CCC1=CC=NC=C1)C(=O)O Z3004510439 [0,0,0,0,1,0|1,0,0]=2 79 B13R1.351 NC(CCC1=NC=CC=C1)C(=O)O Z2310672466 [0,0,0,0,1,0|1,0,0]=2 80 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O Z1255434715 [0,0,0,0,1,0|0,0,0]=1 81 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O Z1255399095 [0,0,0,0,1,0|0,0,0]=1 82 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 Z1201620725 [0,0,0,0,1,0|1,0,1]=3 83 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 Z1259340035 [0,0,0,0,1,0|1,0,0]=2 84 B15R1.3664 CC(NCCOC1=CC=CC=C1)C(=O)O Z1642389853 [0,0,0,0,0,1|3,0,0]=4 85 B15R1.3664 CC(OCCOC1=CC=CC=C1)C(=O)O Z316259124 [0,0,0,0,0,1|3,0,0]=4 86 B15R1.3664 NC(CCOCC1=CC=CC=C1)C(=O)O Z4120966915 [0,0,0,0,0,1|0,1,0]=2 87 B15R1.3664 O=C(O)C(=O)NCCCC1=CC=CC=C1 Z600586824 [0,0,0,0,0,1|2,0,1]=4 88 B15R1.9084 NC(=O)NC(=O)CSCC1=CC=CC=C1 Z18739605 [0,0,0,0,0,1|2,0,1]=4 89 B12R1.8 O=CCCCOC1=CC=CC=C1 Z993017686 [2,0,0,0,0,0|2,0,0]=4 90 B12R1.8 OCCCNCC1=CC=CC=C1 Z57079457 [2,0,0,0,0,0|1,0,1]=4 91 B12R1.8 OCCCOCC1=CC=CC=C1 Z1080358454 [2,0,0,0,0,0|0,1,1]=4 92 B12R1.8 OCCCSCC1=CC=CC=C1 Z104944808 [2,0,0,0,0,0|0,0,1]=3 93 B12R1.252 CC(N)COCC1=CC=CC=C1 Z271012730 [2,0,0,0,0,0|0,1,1]=4 94 B12R1.252 CC(O)CNCC1=CC=CC=C1 Z57326978 [2,0,0,0,0,0|2,0,0]=4 95 B12R1.252 N=C(N)CSCC1=CC=CC=C1 Z1795818268 [2,0,0,0,0,0|1,0,1]=4 96 B12R1.252 NC(=O)CNCC1=CC=CC=C1 Z90608463 [2,0,0,0,0,0|1,0,1]=4 97 B12R1.252 NC(=O)COCC1=CC=CC=C1 Z52214418 [2,0,0,0,0,0|0,1,1]=4 98 B12R1.252 O=C(O)CSCC1=CC=CC=C1 Z19691777 [2,0,0,0,0,0|1,0,1]=4 99 B14R1.148 CC1=CC(=CC=C1)CNCCC(=O)O Z415636682 [1,1,0,0,0,0|1,0,0]=3 100 B14R1.148 CC1=CC(=CC=C1)OCCCC(=O)O Z56887649 [1,1,0,0,0,0|2,0,0]=4 101 B14R1.148 O=C(O)CCCCC1=CC(=CC=C1)O Z1262513974 [1,1,0,0,0,0|1,0,0]=3 102 B14R1.148 O=C(O)CCCOC1=CC(=CC=C1)Br Z56886433 [1,1,0,0,0,0|2,0,0]=4 103 B14R1.148 O=C(O)CCCOC1=CC(=CC=C1)F Z274763238 [1,1,0,0,0,0|2,0,0]=4 104 B14R1.148 O=C(O)CCNCC1=CC(=CC=C1)Cl Z449369192 [1,1,0,0,0,0|1,0,0]=3 105 B14R1.148 O=C(O)CCNCC1=CC(=CC=C1)F Z1695822100 [1,1,0,0,0,0|1,0,0]=3 106 B14R1.159 CC1=C(C=CC=C1)OCCCC(=O)O Z235347059 [1,1,0,0,0,0|2,0,0]=4 107 B14R1.159 O=C(O)CCCOC1=C(C=CC=C1)Br Z295439190 [1,1,0,0,0,0|2,0,0]=4 108 B14R1.159 O=C(O)CCCOC1=C(C=CC=C1)Cl Z285049454 [1,1,0,0,0,0|2,0,0]=4 109 B14R1.159 O=C(O)CCCOC1=C(C=CC=C1)F Z274553234 [1,1,0,0,0,0|2,0,0]=4 110 B14R1.159 O=C(O)CCNCC1=C(C=CC=C1)Cl Z444311542 [1,1,0,0,0,0|1,0,0]=3 111 B14R1.159 O=C(O)CCNCC1=C(C=CC=C1)F Z56974823 [1,1,0,0,0,0|1,0,0]=3 112 B14R1.420 NC(CCCC(=O)O)C1=CC=CC=C1 Z2934530053 [1,1,0,0,0,0|1,0,0]=3 113 B14R1.420 O=C(O)CCCC(=O)C1=CC=CC=C1 Z361415342 [1,1,0,0,0,0|1,0,1]=4 114 B14R1.420 O=C(O)CCNC(=O)C1=CC=CC=C1 Z56854345 [1,1,0,0,0,0|1,0,1]=4 115 B14R1.420 O=C([O-])CCCC(O)C1=CC=CC=C1 Z2306083864 [1,1,0,0,0,0|1,0,1]=4 116 B14R1.423 CC(CC1=CC=CC=C1)NCC(=O)O Z2235792090 [1,1,0,0,0,0|2,0,0]=4 117 B14R1.423 CN(CCC(=O)O)CC1=NC=CC=C1 Z431976564 [1,1,0,0,0,0|2,0,0]=4 118 B14R1.423 NC(CC1=CC=CC=C1)NCC(=O)O Z57032609 [1,1,0,0,0,0|2,0,0]=4 119 B14R1.423 NC(CCC(=O)O)CC1=CC=CC=C1 Z1642061385 [1,1,0,0,0,0|1,0,0]=3 120 B14R1.423 O=C(O)CCC(=O)NC1=CC=CC=C1 Z56176896 [1,1,0,0,0,0|2,0,0]=4 121 B14R1.423 O=C(O)CNC(=O)CC1=CC=CC=C1 Z56963417 [1,1,0,0,0,0|2,0,0]=4 122 B14R1.677 CC1=CC=C(C=C1)CCCCC(=O)O Z361415536 [1,1,0,0,0,0|1,0,0]=3 123 B14R1.677 CC1=CC=C(C=C1)OCCCC(=O)O Z56862234 [1,1,0,0,0,0|2,0,0]=4 124 B14R1.677 CC1=CC=C(C=C1)SCCCC(=O)O Z285049588 [1,1,0,0,0,0|2,0,0]=4 125 B14R1.677 NC(=O)CCCCC1=CC=C(C=C1)F Z1704240604 [1,1,0,0,0,0|2,0,0]=4 126 B14R1.677 NC(=O)CCSCC1=CC=C(C=C1)I Z1276482268 [1,1,0,0,0,0|1,0,0]=3 127 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)Br Z361415666 [1,1,0,0,0,0|1,0,0]=3 128 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)Cl Z361415664 [1,1,0,0,0,0|1,0,0]=3 129 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)F Z361415604 [1,1,0,0,0,0|1,0,0]=3 130 B14R1.677 O=C(O)CCCCC1=CC=C(C=C1)I Z361415654 [1,1,0,0,0,0|1,0,0]=3 131 B14R1.677 O=C(O)CCCNC1=CC=C(C=C1)I Z362772186 [1,1,0,0,0,0|2,0,0]=4 132 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)Br Z56886468 [1,1,0,0,0,0|2,0,0]=4 133 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)Cl Z274553116 [1,1,0,0,0,0|2,0,0]=4 134 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)F Z235347019 [1,1,0,0,0,0|2,0,0]=4 135 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)I Z381427780 [1,1,0,0,0,0|2,0,0]=4 136 B14R1.677 O=C(O)CCCSC1=CC=C(C=C1)Br Z390051396 [1,1,0,0,0,0|2,0,0]=4 137 B14R1.677 O=C(O)CCCSC1=CC=C(C=C1)Cl Z56857874 [1,1,0,0,0,0|2,0,0]=4 138 B14R1.677 O=C(O)CCNCC1=CC=C(C=C1)Cl Z444311410 [1,1,0,0,0,0|1,0,0]=3 139 B14R1.677 O=C(O)CCNCC1=CC=C(C=C1)F Z444311612 [1,1,0,0,0,0|1,0,0]=3 140 B14R1.677 O=C(O)COCCC1=CC=C(C=C1)Br Z802811836 [1,1,0,0,0,0|2,0,0]=4 141 B14R1.716 COC(=O)CCCSC1=CC=CC=C1 Z15777497 [1,1,0,0,0,0|2,0,0]=4 142 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 Z235349199 [1,1,0,0,0,0|1,0,0]=3 143 B14R1.716 COC(=O)CCNCC1=CC=NC=C1 Z53116769 [1,1,0,0,0,0|2,0,0]=4 144 B14R1.818 CC(CC(=O)N)NCC1=CC=CC=C1 Z90503215 [1,1,0,0,0,0|2,0,0]=4 145 B14R1.818 CC(CCC1=CC=CC=C1)CC(=O)O Z352782432 [1,1,0,0,0,0|1,0,0]=3 146 B14R1.818 CN(CCC1=CC=CC=C1)CC(=O)O Z1459897052 [1,1,0,0,0,0|2,0,0]=4 147 B14R1.818 NC(CCC1=CC=CC=C1)CC(=O)O Z2832013470 [1,1,0,0,0,0|1,0,0]=3 148 B14R1.3331 O=P(O)(O)CCCCC1=CC=CC=C1 Z1269108857 [1,1,0,0,0,0|2,0,0]=4 149 B14R1.13 CC1=CC=C(C=C1)CSCC(O)CO Z1340655491 [1,1,0,0,0,0|1,0,1]=4 150 B14R1.13 OCC(O)CSCC1=CC=C(C=C1)F Z1340655891 [1,1,0,0,0,0|1,0,1]=4 151 B14R1.837 OCC(O)CSCC1=C(C=CC=C1)Cl Z1340656377 [1,1,0,0,0,0|1,0,1]=4 152 B14R1.837 OCC(O)CSCC1=C(C=CC=C1)F Z1340656245 [1,1,0,0,0,0|1,0,1]=4 153 B14R1.1025 OCC(O)CSCC1=CC(=CC=C1)F Z1340655705 [1,1,0,0,0,0|1,0,1]=4 154 B14R1.161 CC(CCC1=C(C=CC=C1)F)C(=O)O Z1218936074 [0,1,0,0,1,0|1,0,0]=3 155 B14R1.161 CC(NCC1=C(C=CC=C1)Cl)C(=O)O Z432066860 [0,1,0,0,1,0|2,0,0]=4 156 B14R1.161 CC1=C(C=CC=C1)CNC(C)C(=O)O Z425414584 [0,1,0,0,1,0|2,0,0]=4 157 B14R1.161 CC1=C(C=CC=C1)COC(C)C(=O)O Z1714302638 [0,1,0,0,1,0|1,1,0]=4 158 B14R1.415 CC(CC(N)C(=O)O)C1=CC=CC=C1 Z3018664835 [0,1,0,0,1,0|0,0,0]=2 159 B14R1.415 CC(NC(C)C1=CC=CC=C1)C(=O)O Z1762658315 [0,1,0,0,1,0|2,0,0]=4 160 B14R1.415 CN(CC(N)C(=O)O)C1=CC=CC=C1 Z854090074 [0,1,0,0,1,0|1,0,0]=3 161 B14R1.415 NC(CC(=O)C1=CC=CC=C1)C(=O)O Z1459947400 [0,1,0,0,1,0|0,0,1]=3 162 B14R1.425 CC(C(=O)O)N(C)CC1=CC=CC=C1 Z359351934 [0,1,0,0,1,0|2,0,0]=4 163 B14R1.425 C[C@@H](C(=O)O)N(C)CC1=CC=CC=C1 Z1198157192 [0,1,0,0,1,0|2,0,0]=4 164 B14R1.425 NC(=O)C(O)C(N)CC1=CC=CC=C1 Z2694742647 [0,1,0,0,1,0|2,0,0]=4 165 B14R1.425 NC(C(=O)O)C(O)CC1=CC=CC=C1 Z1262524640 [0,1,0,0,1,0|0,0,0]=2 166 B14R1.679 CC(CSC1=CC=C(C=C1)F)C(=O)O Z431541816 [0,1,0,0,1,0|1,0,0]=3 167 B14R1.679 CC(NCC1=CC=C(C=C1)F)C(=O)O Z363997798 [0,1,0,0,1,0|2,0,0]=4 168 B14R1.679 CC(OCC1=CC=C(C=C1)F)C(=O)O Z1262558351 [0,1,0,0,1,0|1,1,0]=4 169 B14R1.679 CC(SCC1=CC=C(C=C1)Br)C(=O)O Z18753942 [0,1,0,0,1,0|1,0,0]=3 170 B14R1.679 CC(SCC1=CC=C(C=C1)Cl)C(=O)N Z18432807 [0,1,0,0,1,0|2,0,0]=4 171 B14R1.679 CC(SCC1=CC=C(C=C1)I)C(=O)N Z1276481977 [0,1,0,0,1,0|2,0,0]=4 172 B14R1.679 CC1=CC=C(C=C1)COC(C)C(=O)O Z1714301562 [0,1,0,0,1,0|1,1,0]=4 173 B14R1.679 NC(CCC1=CC=C(C=C1)Br)C(=O)O Z4310725393 [0,1,0,0,1,0|0,0,0]=2 174 B14R1.679 NC1=CC=C(C=C1)SCC(N)C(=O)O Z1263568367 [0,1,0,0,1,0|0,0,0]=2 175 B14R1.4194 N#CC(CCC1=CC=CC=C1)C(=O)[O-] Z1881599031 [0,1,0,0,1,0|0,0,2]=4 176 B14R1.5956 CC(CCC1=CC(=CC=C1)F)C(=O)O Z1259341391 [0,1,0,0,1,0|1,0,0]=3 177 B14R1.5956 CC(NCC1=CC(=CC=C1)F)C(=O)O Z426041634 [0,1,0,0,1,0|2,0,0]=4 178 B14R1.5956 CC(SCC1=CC(=CC=C1)Cl)C(=O)N Z742590214 [0,1,0,0,1,0|2,0,0]=4 179 B14R1.6395 CC(N)(CCC1=CC=CC=C1)C(=O)O Z594271932 [0,1,0,0,1,0|0,0,0]=2 180 B14R1.6395 CC(N)(COC1=CC=CC=C1)C(=O)N Z898430760 [0,1,0,0,1,0|1,1,0]=4 181 B14R1.6395 CC(O)(CCC1=CC=CC=C1)C(=O)O Z788000488 [0,1,0,0,1,0|1,0,0]=3 182 B16R1.1037 NC(CCCC1=CC(=C(C=C1)O)O)C(=O)O Z3582628439 [0,2,0,0,0,0|1,0,0]=3 183 B16R1.42 COC1=CC(=CC=C1)CSCC(N)C(=O)O Z317025972 [0,2,0,0,0,0|0,0,0]=2 184 B16R1.7413 CC(CN(C)CC1=C(C=CC=C1)F)C(=O)O Z818739390 [0,2,0,0,0,0|2,0,0]=4 185 B16R1.8820 CC(NCC1=C(C=CC=C1)F)C(C)C(=O)O Z2512945462 [0,2,0,0,0,0|2,0,0]=4 186 B16R1.30284 CCC(C)(COCC1=CC=CC=C1)C(=O)O Z1813232750 [0,2,0,0,0,0|1,1,0]=4 187 B14R2.2 O=C(O)CC1CCC2=C1C=CC=C2 Z352782144 [1,0,0,1,0,0|1,0,0]=3 188 B14R2.2 O=C(O)CC1CNC2=C1C=CC=C2 Z1259339975 [1,0,0,1,0,0|2,0,0]=4 189 B14R2.2 O=C(O)CC1COC2=C1C=CC=C2 Z1198234596 [1,0,0,1,0,0|2,0,0]=4 190 B14R2.2 O=C(O)CC1OCC2=C1C=CC=N2 Z5457661360 [1,0,0,1,0,0|1,1,0]=4 191 B14R2.19 O=C1CCC(N1)CC2=CC=CC=C2 Z1270257271 [1,0,0,1,0,0|2,0,0]=4 192 B14R2.19 O=C1CCC(O1)CC2=CC=CC=C2 Z1342098372 [1,0,0,1,0,0|1,0,0]=3 193 B14R2.19 O=C1NCC(O1)CC2=CC=CC=C2 Z1255419800 [1,0,0,1,0,0|2,0,0]=4 194 B14R2.21 O=C1CCCC(C1)C2=CC=CC=C2 Z1198152074 [1,0,0,1,0,0|2,0,0]=4 195 B14R2.21 O=C1CCCC(N1)C2=CC=CC=C2 Z1255365075 [1,0,0,1,0,0|2,0,0]=4 196 B14R2.391 O=C1CCCCC2=C(N1)C=CC=C2 Z1255423561 [1,0,0,1,0,0|2,0,0]=4 197 B14R2.764 O=C(O)C1CC1CC2=CC=CC=C2 Z979743464 [1,0,0,1,0,0|1,0,0]=3 198 B14R2.764 O=C(O)[C@@H]1C[C@H]1SC2=CC=CC=C2 Z4550381864 [1,0,0,1,0,0|2,0,0]=4 199 B14R2.780 O=C(O)[C@@H]1NC[C@H]1C2=CC=CC=C2 Z3026488112 [1,0,0,1,0,0|2,0,0]=4 200 B14R2.31359 O=C(O)C1CC=CC2=C1C=CC=C2 Z1262514070 [1,0,0,1,0,0|1,0,1]=4 201 B14R2.31359 O=C(O)C1CCCC2=C1C=CC=C2 Z235361249 [1,0,0,1,0,0|1,0,0]=3 202 B14R2.31359 O=C(O)C1CCCC2=C1C=CC=N2 Z3463202985 [1,0,0,1,0,0|2,0,0]=4 203 B14R2.31359 O=C(O)C1CCCC2=C1N=CC=C2 Z1889710360 [1,0,0,1,0,0|2,0,0]=4 204 B14R2.31359 O=C(O)C1CCNC2=C1C=CC=C2 Z2568751807 [1,0,0,1,0,0|2,0,0]=4 205 B14R2.31359 O=C(O)C1CCOC2=C1C=CC=C2 Z792377210 [1,0,0,1,0,0|2,0,0]=4 206 B14R2.31359 O=C(O)C1CCSC2=C1C=CC=C2 Z1262395890 [1,0,0,1,0,0|2,0,0]=4 207 B14R2.31359 O=C(O)C1CNCC2=C1C=CC=C2 Z255149970 [1,0,0,1,0,0|1,0,0]=3 208 B14R2.31359 O=C(O)C1OCCC2=C1C=CC=C2 Z255149974 [1,0,0,1,0,0|2,0,0]=4 209 B14R2.31359 O=C(O)C1SCCC2=C1C=CC=C2 Z1198158777 [1,0,0,1,0,0|2,0,0]=4 210 B14R2.95 NC(CO)C1CCC2=C1C=CC=C2 Z3301766357 [1,0,0,1,0,0|1,0,1]=4 211 B14R2.3459 CC1(CCCC2=C1C=CC=C2)C=O Z1511786768 [1,0,0,1,0,0|2,0,0]=4 212 B14R2.3459 CC1(COCC2=C1C=CC=C2)C=O Z1486010878 [1,0,0,1,0,0|1,1,0]=4 213 B14R2.4514 NC1CCN(C1=O)C2=CC=CC=C2 Z825515886 [1,0,0,1,0,0|2,0,0]=4 214 B14R2.260 O=C1NC(CC1O)C2=CC=CC=C2 Z1509163936 [0,0,0,1,1,0|2,0,0]=4 215 B14R2.741 CC1CSC2=C(C=CC=C2)NC1=O Z1495921309 [0,0,0,1,1,0|2,0,0]=4 216 B14R2.741 NC1CCC2=C(C=CC=C2)NC1=O Z2489418689 [0,0,0,1,1,0|1,0,0]=3 217 B14R2.741 O=C1NC2=C(C=CC=C2)CCC1O Z2418194280 [0,0,0,1,1,0|2,0,0]=4 218 B14R2.779 O=C(O)C1CC(C1)C2=CC=CC=C2 Z858585502 [0,0,0,1,1,0|1,0,0]=3 219 B14R2.781 NC(=O)C1CCC2=C(N1)C=CC=C2 Z300072128 [0,0,0,1,1,0|1,0,0]=3 220 B14R2.781 O=C(O)C1CC2=C(C=CC=C2)CN1 Z56822177 [0,0,0,1,1,0|2,0,0]=4 221 B14R2.781 O=C(O)C1CC2=C(C=CC=C2)CO1 Z1255464869 [0,0,0,1,1,0|1,1,0]=4 222 B14R2.781 O=C(O)C1CCC2=C(C1)C=CC=C2 Z792377344 [0,0,0,1,1,0|1,0,0]=3 223 B14R2.781 O=C(O)C1CCC2=C(N1)C=CC=C2 Z2724443277 [0,0,0,1,1,0|0,0,0]=2 224 B14R2.781 O=C(O)C1CCC2=C(O1)C=CC=C2 Z1198148530 [0,0,0,1,1,0|1,0,0]=3 225 B14R2.781 O=C(O)C1CNC2=C(C1)C=CC=C2 Z3241252785 [0,0,0,1,1,0|2,0,0]=4 226 B14R2.781 O=C(O)C1CNC2=C(O1)C=CC=C2 Z90669210 [0,0,0,1,1,0|2,0,0]=4 227 B14R2.781 O=C(O)C1COC2=C(O1)C=CC=C2 Z56839652 [0,0,0,1,1,0|1,1,0]=4 228 B14R2.781 O=C(O)C1CSC2=C(O1)C=CC=C2 Z916847046 [0,0,0,1,1,0|1,0,0]=3 229 B14R2.781 O=C(O)[C@@H]1CC2=C(C=CC=C2)CN1 Z762926698 [0,0,0,1,1,0|2,0,0]=4 230 B14R2.781 O=C(O)[C@H]1CC2=C(C=CC=C2)CN1 Z359370254 [0,0,0,1,1,0|2,0,0]=4 231 B14R2.786 C[C@@]1(C[C@@H]1C2=CC=CC=C2)C(=O)O Z2298158000 [0,0,0,1,1,0|1,0,0]=3 232 B14R2.9535 CC1(CCC2=C1C=CC=C2)C(=O)O Z1259317290 [0,0,0,1,1,0|1,0,0]=3 233 B14R2.9535 NC1(CCC2=C1C=CC=C2)C(=O)O Z234896489 [0,0,0,1,1,0|0,0,0]=2 234 B14R2.53 O=C(O)C1CSC(N1)C2=CC=CO2 Z277469554 [0,0,0,1,1,0|1,0,0]=3 235 B14R2.53 O=C(O)C1CSC(N1)C2=CSC=C2 Z275176820 [0,0,0,1,1,0|1,0,0]=3 236 B14R2.53 O=C(O)[C@@H]1CC[C@H](N1)C2=CC=CS2 Z2490977335 [0,0,0,1,1,0|2,0,0]=4 237 B16R2.12 NC(CC1=CNC2=C1C=CC=C2)C(=O)O Z57248626 [0,0,0,1,0,1|1,0,1]=4 238 B16R2.12 NC(CC1=COC2=C1C=CC=C2)C(=O)O Z1416286798 [0,0,0,1,0,1|1,0,1]=4 239 B16R2.12 NC(CC1=CSC2=C1C=CC=C2)C(=O)O Z995104684 [0,0,0,1,0,1|1,0,1]=4 240 B16R2.12 NC(CN1C=NC2=C1C=CC=C2)C(=O)O Z2289798387 [0,0,0,1,0,1|1,0,1]=4 241 B16R2.12 NC(CN1CCC2=C1C=CC=C2)C(=O)O Z4327136236 [0,0,0,1,0,1|1,0,0]=3 242 B16R2.12 N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)O Z756440056 [0,0,0,1,0,1|1,0,1]=4 243 B16R2.12 N[C@H](CC1=CNC2=C1C=CC=C2)C(=O)O Z256709618 [0,0,0,1,0,1|1,0,1]=4 244 B16R2.84 O=C(O)C1CCN(C1)CC2=CC=CC=C2 Z1459885102 [0,0,0,1,0,1|2,0,0]=4 245 B16R2.84 O=C(O)C1CSC(N1)CC2=CC=CC=C2 Z317026376 [0,0,0,1,0,1|0,0,0]=2 246 B16R2.84 O=C(O)[C@@H]1C[C@@H](CN1)CC2=CC=CC=C2 Z3446302820 [0,0,0,1,0,1|2,0,0]=4 247 B16R2.86 O=C(O)C1CC(CCN1)C2=CC=CC=C2 Z4185364174 [0,0,0,1,0,1|2,0,0]=4 248 B16R2.86 O=C(O)[C@@H]1CCC[C@@H](O1)C2=CC=CC=C2 Z2309936219 [0,0,0,1,0,1|2,0,0]=4 249 B16R2.86 O=C(O)[C@@H]1CCN[C@@H](C1)C2=CC=CC=C2 Z4186362615 [0,0,0,1,0,1|2,0,0]=4 250 B16R2.27150 O=C(O)C1CC(C1)OCC2=CC=CC=C2 Z1250076635 [0,0,0,1,0,1|1,1,0]=4 251 B16R2.142990 NC1(CCCCC2=C1C=CC=C2)C(=O)O Z1276446908 [0,0,0,1,0,1|1,0,0]=3 252 B16R2.2865 O=C(O)C1CSC(N1)C2=CC=C(C=C2)F Z275466114 [0,1,0,1,0,0|0,0,0]=2 253 B16R2.2865 O=C(O)C1CSC(N1)C2=CC=C(C=C2)O Z276672002 [0,1,0,1,0,0|0,0,0]=2 254 B16R2.2865 O=C(O)[C@@H]1CC[C@H](N1)C2=CC=C(C=C2)Cl Z2311241259 [0,1,0,1,0,0|1,0,0]=3 255 B16R2.2865 O=C(O)[C@@H]1CC[C@H](N1)C2=CC=C(C=C2)F Z2465620189 [0,1,0,1,0,0|1,0,0]=3 256 B16R2.3270 O=C(O)C1CSC(=N1)C2=C(C=CC=C2)O Z1509577581 [0,1,0,1,0,0|0,0,2]=4 257 B16R2.6271 NC(CC1=CC2=C(O1)C=CC=C2)C(=O)O Z1762997257 [0,1,0,1,0,0|1,0,1]=4 258 B16R2.85 O=C(O)C1CCC(CC1)C2=CC=CC=C2 Z792377166 [0,1,0,1,0,0|2,0,0]=4 259 B16R2.85 O=C(O)C1CCC(CN1)C2=CC=CC=C2 Z4087380841 [0,1,0,1,0,0|1,0,0]=3 260 B16R2.27427 O=C(O)C1CCC(C1)(O)C2=CC=CC=C2 Z1982417560 [0,1,0,1,0,0|2,0,0]=4 261 B16R2.386322 CC1CCC(C2=C1C=CC=C2)(N)C(=O)O Z3005519413 [0,1,0,1,0,0|1,0,0]=3 262 B16R2.34194 COC(=O)C1(CCCC2=C1C=CC=C2)C Z1010801586 [0,1,0,1,0,0|2,0,0]=4 263 B16R3.35483 O=C(O)[C@@]12C[C@@H]([C@@H]1C2)C3=CC=CC=C3 Z3664675042 [0,0,0,2,0,0|2,0,0]=4 264 B16R3.35483 O=C(O)[C@]12C[C@H]1[C@@H](C2)C3=CC=CC=C3 Z3661727289 [0,0,0,2,0,0|2,0,0]=4 265 B16R3.426 O=C(O)C1CC12CCC3=C2C=CC=C3 Z979743412 [0,0,0,2,0,0|2,0,0]=4 266 B16R3.36464 CC1(C2C1C3=C(C2)C=CC=C3)C(=O)O Z1509079918 [0,0,0,2,0,0|2,0,0]=4 267 B12R1.27 CC(C=O)CCC1=CC=CC=C1 Z1238838034 [1,0,0,0,1,0|1,0,0]=3 268 B12R1.27 CCC(N)CCC1=CC=CC=C1 Z406453862 [1,0,0,0,1,0|1,0,1]=4 269 B12R1.27 CCC(N)CSC1=CC=CC=C1 Z1238715197 [1,0,0,0,1,0|1,0,1]=4 270 B12R1.27 N/C(=N\O)/CCC1=CC=CC=C1 Z285132818 [1,0,0,0,1,0|1,0,1]=4 271 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 Z90124995 [0,0,0,0,2,0|1,0,0]=3 272 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O Z513624710 [0,0,0,0,2,0|1,0,0]=3 273 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O Z3477804988 [0,0,0,0,2,0|2,0,0]=4 274 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O Z57982184 [0,0,0,0,2,0|2,0,0]=4 275 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O Z57825333 [0,0,0,0,2,0|1,1,0]=4 276 B12R1.43 CC(SC1=CC=CC=C1)C(=O)N Z19751098 [0,0,0,0,2,0|2,0,0]=4 277 B12R1.43 CC(SC1=CC=CC=C1)C(=O)O Z90122656 [0,0,0,0,2,0|1,0,0]=3 278 B12R1.43 CC(SC1=NC=CC=C1)C(=O)O Z31250551 [0,0,0,0,2,0|2,0,0]=4 279 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O Z1262510261 [0,0,0,0,2,0|1,0,0]=3 280 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 Z317075516 [0,0,0,0,2,0|1,0,0]=3 281 B12R1.43 NC(=O)C(N)CC1=NC=CC=C1 Z4981909244 [0,0,0,0,2,0|2,0,0]=4 282 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 Z760046820 [0,0,0,0,2,0|1,0,0]=3 283 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 Z933616656 [0,0,0,0,2,0|1,0,0]=3 284 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O Z57127433 [0,0,0,0,2,0|0,0,0]=2 285 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O Z1675026076 [0,0,0,0,2,0|1,0,0]=3 286 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O Z3235906342 [0,0,0,0,2,0|1,0,0]=3 287 B12R1.43 NC(CC1=CN=CN=C1)C(=O)O Z3697694105 [0,0,0,0,2,0|2,0,0]=4 288 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O Z3235025558 [0,0,0,0,2,0|1,0,0]=3 289 B12R1.43 NC(CC1=NC=CC=N1)C(=O)O Z2432992279 [0,0,0,0,2,0|2,0,0]=4 290 B12R1.43 NC(CC1=NC=NC=C1)C(=O)O Z2470415568 [0,0,0,0,2,0|2,0,0]=4 291 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O Z756430566 [0,0,0,0,2,0|0,0,0]=2 292 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O Z933646062 [0,0,0,0,2,0|0,0,0]=2 293 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 Z285151774 [0,0,0,0,2,0|1,0,1]=4 294 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 Z788000648 [0,0,0,0,2,0|1,0,0]=3 295 B12R1.43 O=C(O)C(O)CC1=NC=CC=C1 Z3486862716 [0,0,0,0,2,0|2,0,0]=4 296 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 Z1255386695 [0,0,0,0,2,0|1,0,0]=3 297 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 Z1255364914 [0,0,0,0,2,0|1,0,0]=3 298 B12R1.264 NC(CCC1=CNN=C1)C(=O)O Z3486116939 [0,0,0,0,2,0|2,0,0]=4 299 B14R1.422 O=C(O)CCCCCC1=CC=CC=C1 Z424791194 [1,0,0,0,0,1|1,0,0]=3 300 B14R1.422 O=C(O)CCCNCC1=CC=CC=C1 Z1569708913 [1,0,0,0,0,1|1,0,0]=3 301 B14R1.422 O=C(O)CCCNCC1=NC=CC=C1 Z363998446 [1,0,0,0,0,1|2,0,0]=4 302 B14R1.422 O=C(O)CCCOCC1=CC=CC=C1 Z316258810 [1,0,0,0,0,1|0,1,0]=3 303 B14R1.422 O=C(O)CCNCCC1=CC=CC=C1 Z1270173016 [1,0,0,0,0,1|1,0,0]=3 304 B14R1.422 O=C(O)COC/C=C/C1=CC=CC=C1 Z2887852692 [1,0,0,0,0,1|1,0,1]=4 305 B14R1.422 O=C(O)COCCOC1=CC=CC=C1 Z316259120 [1,0,0,0,0,1|2,0,0]=4 306 B14R1.422 O=C(O)CSCCCC1=CC=CC=C1 Z65517782 [1,0,0,0,0,1|1,0,0]=3 307 B16R1.4131 NC(CCCOCC1=CC=CC=C1)C(=O)O Z4917317246 [0,0,0,0,0,2|0,1,0]=3 308 B16R1.4131 NC(CSCCOC1=CC=CC=C1)C(=O)O Z424754356 [0,0,0,0,0,2|0,0,0]=2