0 B9R1.35 CN1CC[C@H](C(=O)O)C1 08-7670 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 08-7357 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 04-1821 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 04-2401 [0,0,0,0,0,0|0,0,0]=0 4 B9R1.35 O=C1CC[C@H](C(=O)O)C1 08-7809 [0,0,0,0,0,0|1,0,0]=1 5 B8R1.1 O=C1CC[C@H](CO)N1 020980S [1,0,0,0,0,0|0,0,1]=2 6 B8R1.1 O=C1CC[C@H](CO)N1 04-2405 [1,0,0,0,0,0|0,0,1]=2 7 B8R1.7 CC(=O)[C@H]1CCNC1 08-10165 [1,0,0,0,0,0|3,0,0]=4 8 B8R1.7 NC(=O)[C@@H]1CCCN1 04-2362 [1,0,0,0,0,0|1,0,1]=3 9 B8R1.7 NC(=O)[C@@H]1CCCN1 24-1863 [1,0,0,0,0,0|1,0,1]=3 10 B8R1.7 NC(=O)[C@H]1CCNC1 021340S [1,0,0,0,0,0|3,0,0]=4 11 B8R1.7 NC(=O)[C@H]1CCNC1 08-5570 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.7 NC(=O)[C@H]1CCNC1 20-2113 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.7 NC(=O)[C@H]1CCNC1 20-2210 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.7 NC(=O)[C@H]1CCNC1 26-2701 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.7 O=C(O)C1=COCC1 08-7224 [1,0,0,0,0,0|2,0,1]=4 16 B8R1.7 O=C(O)[C@@H]1CCCN1 020707 [1,0,0,0,0,0|0,0,1]=2 17 B8R1.7 O=C(O)[C@@H]1CCCN1 025642 [1,0,0,0,0,0|0,0,1]=2 18 B8R1.7 O=C(O)[C@@H]1CCCN1 BIO-410 [1,0,0,0,0,0|0,0,1]=2 19 B8R1.7 O=C(O)[C@H]1CCNC1 020984 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.7 O=C(O)[C@H]1CCOC1 08-5648 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.14 COC(=O)C1=CC(=O)CC1 08-10045 [0,1,0,0,0,0|1,0,1]=3 22 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 08-3265 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 08-2478 [0,1,0,0,0,0|1,0,0]=2 24 B10R1.359 O=C(O)[C@H]1CCC(F)(F)C1 08-7218 [0,1,0,0,0,0|2,0,1]=4 25 B10R1.470 CN1CC[C@](C)(C(=O)O)C1 08-10194 [0,1,0,0,0,0|3,0,0]=4 26 B8R0.8 CCCC[C@H](N)C(=O)O 025863 [0,0,1,0,0,0|1,0,1]=3 27 B8R0.8 CCCC[C@H](N)C(=O)O 24-1855 [0,0,1,0,0,0|1,0,1]=3 28 B8R0.8 CCCC[C@H](N)C(=O)O 25-080 [0,0,1,0,0,0|1,0,1]=3 29 B8R0.8 CCCC[C@H](N)C(N)=O 04-2195 [0,0,1,0,0,0|2,0,1]=4 30 B8R0.8 CSCC[C@H](N)C(=O)O 025848 [0,0,1,0,0,0|2,0,0]=3 31 B8R0.8 CSCC[C@H](N)C(=O)O 25-041 [0,0,1,0,0,0|2,0,0]=3 32 B8R0.8 CSCC[C@H](N)C(=O)O BIO-438 [0,0,1,0,0,0|2,0,0]=3 33 B8R0.8 CSCC[C@H](N)C(N)=O 04-2070 [0,0,1,0,0,0|3,0,0]=4 34 B8R0.8 C[Se]CC[C@H](N)C(=O)O 06-1368 [0,0,1,0,0,0|2,0,0]=3 35 B8R0.8 NCCC[C@H](N)C(=O)O 04-2220 [0,0,1,0,0,0|1,0,1]=3 36 B8R0.8 NCCC[C@H](N)C(=O)O 22-402 [0,0,1,0,0,0|1,0,1]=3 37 B8R0.9 CCC(=O)NCC(=O)O 41-0303 [0,0,1,0,0,0|0,0,0]=1 38 B8R0.9 COC(=O)CCC(=O)Cl 08-6945 [0,0,1,0,0,0|3,0,0]=4 39 B8R0.9 COC(=O)NCC(=O)O 04-2147 [0,0,1,0,0,0|1,0,0]=2 40 B8R0.9 NCC(=O)NCC(=O)O 04-1104 [0,0,1,0,0,0|1,0,0]=2 41 B8R0.9 O=C(O)CNC(=O)CCl 04-1014 [0,0,1,0,0,0|1,0,0]=2 42 B8R0.9 O=C(O)CNC(=O)CO 19-1559 [0,0,1,0,0,0|1,0,0]=2 43 B8R0.23 C=C(NC(C)=O)C(=O)O BIO-461 [0,0,1,0,0,0|0,0,2]=3 44 B8R0.23 CC(=O)N[C@@H](C)C(=O)O 04-015 [0,0,1,0,0,0|0,0,0]=1 45 B8R0.23 CC(=O)N[C@@H](C)C(=O)O 04-016 [0,0,1,0,0,0|0,0,0]=1 46 B8R0.23 CC(=O)N[C@@H](C)C(=O)O BIO-475 [0,0,1,0,0,0|0,0,0]=1 47 B8R0.23 CC(=O)N[C@@H](C)C(N)=O 04-017 [0,0,1,0,0,0|1,0,0]=2 48 B8R0.23 NC(=O)C[C@H](N)C(=O)O 025771 [0,0,1,0,0,0|3,0,0]=4 49 B8R0.23 NC(=O)C[C@H](N)C(=O)O 04-331 [0,0,1,0,0,0|3,0,0]=4 50 B8R0.23 NC(=O)C[C@H](N)C(=O)O 06-1846 [0,0,1,0,0,0|3,0,0]=4 51 B8R0.23 NC(=O)C[C@H](N)C(=O)O 20-2407 [0,0,1,0,0,0|3,0,0]=4 52 B8R0.23 NC(=O)C[C@H](N)C(=O)O 22-1810 [0,0,1,0,0,0|3,0,0]=4 53 B8R0.23 N[C@@H](CC(=O)O)C(=O)O 025511 [0,0,1,0,0,0|3,0,0]=4 54 B8R0.23 N[C@@H](CC(=O)O)C(=O)O BIO-038 [0,0,1,0,0,0|3,0,0]=4 55 B8R0.23 N[C@@H](CC(=O)O)C(=O)O BIO-114 [0,0,1,0,0,0|3,0,0]=4 56 B8R0.23 O=C(O)C[C@H](O)C(=O)O 020741 [0,0,1,0,0,0|3,0,0]=4 57 B8R0.23 O=C(O)C[C@H](O)C(=O)O BIO-641 [0,0,1,0,0,0|3,0,0]=4 58 B8R0.28 CC(=O)NCCC(=O)O 04-013 [0,0,1,0,0,0|2,0,0]=3 59 B8R0.28 O=C(Cl)COCC(=O)Cl 19-1143 [0,0,1,0,0,0|3,0,0]=4 60 B8R0.28 O=C(O)CCCC(=O)O 15-0500 [0,0,1,0,0,0|1,0,0]=2 61 B8R1.23 CN1CC(C(=O)O)C1 08-5371 [0,0,0,0,1,0|3,0,0]=4 62 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 08-4576 [0,0,0,0,1,0|2,0,1]=4 63 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 08-4577 [0,0,0,0,1,0|2,0,1]=4 64 B8R1.23 O=C(O)C1CC(F)C1 08-5243 [0,0,0,0,1,0|2,0,1]=4 65 B8R1.23 O=C1CC(C(=O)O)C1 08-5737 [0,0,0,0,1,0|1,0,0]=2 66 B10R1.13 CN1CCC(C(=O)O)CC1 08-9995 [0,0,0,0,0,1|3,0,0]=4 67 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 08-6409 [0,0,0,0,0,1|2,0,1]=4 68 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 08-7961 [0,0,0,0,0,1|2,0,1]=4 69 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 08-5736 [0,0,0,0,0,1|0,0,0]=1 70 B10R1.13 O=C1CC[C@H](C(=O)O)CN1 08-8049 [0,0,0,0,0,1|0,0,0]=1 71 B10R1.113 O=C1C[C@@H](C(=O)O)CCN1 08-8048 [0,0,0,0,0,1|1,0,0]=2 72 B7R0.4 CCCCCC(=O)O 10-0600 [1,0,1,0,0,0|1,0,1]=4 73 B7R0.4 NCCCCC(=O)O 12-902 [1,0,1,0,0,0|0,0,1]=3 74 B7R0.5 CCC[C@H](C)C(=O)O CS-800 [1,0,1,0,0,0|1,0,1]=4 75 B7R0.5 CCC[C@H](N)C(=O)O 021880 [1,0,1,0,0,0|0,0,1]=3 76 B7R0.5 CCC[C@H](N)C(=O)O 04-2202 [1,0,1,0,0,0|0,0,1]=3 77 B7R0.5 CCC[C@H](N)C(N)=O 04-2207 [1,0,1,0,0,0|1,0,1]=4 78 B7R0.5 CSC[C@H](N)C(=O)O 025849 [1,0,1,0,0,0|1,0,1]=4 79 B7R0.5 C[C@H](NC=O)C(=O)O 04-1420 [1,0,1,0,0,0|0,0,0]=2 80 B7R0.5 N#CC[C@H](N)C(=O)O 04-112 [1,0,1,0,0,0|1,0,1]=4 81 B7R0.5 N[C@@H](CCS)C(=O)O BIO-615 [1,0,1,0,0,0|0,1,0]=3 82 B7R0.6 CC(=O)NCC(=O)O 04-2739 [1,0,1,0,0,0|0,0,0]=2 83 B7R0.6 O=C(O)CCC(=O)O 15-0400 [1,0,1,0,0,0|2,0,0]=4 84 B7R0.15 CN[C@@H](CO)C(=O)O 22-409 [1,0,1,0,0,0|1,0,1]=4 85 B7R1.1 OC[C@H]1CCCN1 04-1811 [2,0,0,0,0,0|0,0,2]=4 86 B7R1.1 OC[C@H]1CCCN1 04-1812 [2,0,0,0,0,0|0,0,2]=4 87 B7R1.1 OC[C@H]1CCCN1 24-1413 [2,0,0,0,0,0|0,0,2]=4 88 B7R1.2 O=C1CCC(=O)N1 BIO-450 [2,0,0,0,0,0|0,0,1]=3 89 B9R0.7 CS(=O)CCC(N)C(=O)O BIO-644 [0,1,1,0,0,0|1,0,0]=3 90 B9R0.7 NC(=O)CC[C@H](N)C(=O)O 04-1528 [0,1,1,0,0,0|0,0,0]=2 91 B9R0.7 NC(=O)CC[C@H](N)C(=O)O 04-1529 [0,1,1,0,0,0|0,0,0]=2 92 B9R0.7 NC(=O)NC[C@H](N)C(=O)O BIO-495 [0,1,1,0,0,0|1,0,0]=3 93 B9R0.7 NC(=O)SC[C@H](N)C(=O)O BIO-738 [0,1,1,0,0,0|1,0,0]=3 94 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O 025589 [0,1,1,0,0,0|0,0,0]=2 95 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O BIO-130 [0,1,1,0,0,0|0,0,0]=2 96 B9R0.7 O=C(O)CCC(=O)C(=O)O 04-1880 [0,1,1,0,0,0|1,0,1]=4 97 B9R0.7 O=C(O)CCC(=O)C(=O)O BIO-231 [0,1,1,0,0,0|1,0,1]=4 98 B9R0.7 O=C(O)CCC(=O)C(=O)O BIO-853 [0,1,1,0,0,0|1,0,1]=4 99 B9R0.8 CCCC[C@H](N)C(=O)OC 04-2197 [0,1,1,0,0,0|1,0,1]=4 100 B9R0.8 COC(=O)[C@@H](N)CCCN 04-2219 [0,1,1,0,0,0|1,0,1]=4 101 B9R0.8 COC(=O)[C@@H](N)CCSC 04-2076 [0,1,1,0,0,0|2,0,0]=4 102 B9R0.8 COC(=O)[C@@H](N)CCSC 20-1871 [0,1,1,0,0,0|2,0,0]=4 103 B9R0.47 C=CCSC[C@H](N)C(=O)O 027255S [0,1,1,0,0,0|1,0,0]=3 104 B9R0.47 CCSCC[C@H](N)C(=O)O 04-1135 [0,1,1,0,0,0|1,0,1]=4 105 B9R0.47 NCCCC[C@H](N)C(=O)O 025601 [0,1,1,0,0,0|1,0,1]=4 106 B9R0.47 NCCCC[C@H](N)C(=O)O 19-2841 [0,1,1,0,0,0|1,0,1]=4 107 B9R0.47 NCCCC[C@H](N)C(=O)O 20-1830 [0,1,1,0,0,0|1,0,1]=4 108 B9R0.47 NCCCC[C@H](N)C(=O)O BIO-437 [0,1,1,0,0,0|1,0,1]=4 109 B9R0.47 NCCCC[C@H](N)C(=O)O BIO-857 [0,1,1,0,0,0|1,0,1]=4 110 B9R0.23 CN(CC(=O)O)C(=O)CN 04-1722 [0,1,1,0,0,0|1,0,0]=3 111 B9R0.23 CN(CC(=O)O)C(=O)CO 19-1637 [0,1,1,0,0,0|1,0,0]=3 112 B9R0.24 COC(=O)CCC(=O)OC 25-0400 [0,1,1,0,0,0|2,0,0]=4 113 B9R0.24 COC(=O)CNC(=O)CN 04-1629 [0,1,1,0,0,0|1,0,0]=3 114 B9R0.48 CCCC(=O)NCC(=O)O 41-0403 [0,1,1,0,0,0|0,0,0]=2 115 B9R0.48 NCCC(=O)NCC(=O)O 04-189 [0,1,1,0,0,0|0,0,0]=2 116 B9R0.33 CC(C)[C@H](NC=O)C(=O)O 04-1436 [0,1,1,0,0,0|0,0,0]=2 117 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O BIO-458 [0,1,1,0,0,0|1,0,0]=3 118 B9R0.1 NCC(=O)NCCC(N)=O 04-1601 [0,1,1,0,0,0|2,0,0]=4 119 B9R0.1 O=C(O)CCNC(=O)CO 19-1455 [0,1,1,0,0,0|2,0,0]=4 120 B9R1.11 COC(=O)[C@@H]1CCCN1 04-2369 [1,1,0,0,0,0|0,0,1]=3 121 B9R1.11 COC(=O)[C@@H]1CCCN1 20-2305 [1,1,0,0,0,0|0,0,1]=3 122 B9R1.11 COC(=O)[C@H]1CCOC1 08-7659 [1,1,0,0,0,0|2,0,0]=4 123 B9R1.163 NC1(C(=O)O)CCCC1 04-263 [1,1,0,0,0,0|1,0,1]=4 124 B9R1.163 N[C@@]1(C(=O)O)CCOC1 08-4623 [1,1,0,0,0,0|2,0,0]=4 125 B9R1.82 COC(=O)C1CC(=O)C1 08-5372 [0,1,0,0,1,0|1,0,0]=3 126 B11R1.22 COC(=O)[C@H]1CCC(=O)NC1 08-5435 [0,1,0,0,0,1|0,0,0]=2 127 B11R1.727 O=C(O)C1CCS(=O)(=O)CC1 08-7214 [0,1,0,0,0,1|2,0,0]=4 128 B11R1.23 COC(=O)[C@H]1CCNC(=O)C1 08-7680 [0,1,0,0,0,1|1,0,0]=3 129 B11R1.15 CCOC(=O)N1CCC(=O)C1 08-5214 [0,2,0,0,0,0|2,0,0]=4 130 B11R1.175 O=C(O)[C@H]1CC[C@@H](C(=O)O)C1 08-10633 [0,2,0,0,0,0|1,0,1]=4 131 B9R1.6 O=C(O)[C@@H]1CCCCN1 BIO-933 [0,0,1,1,0,0|1,0,1]=4 132 B9R1.110 N[C@H](C(=O)O)C1COC1 08-6414 [0,0,1,1,0,0|2,0,0]=4 133 B9R1.110 N[C@H](C(=O)O)C1COC1 22-1862 [0,0,1,1,0,0|2,0,0]=4 134 B9R1.110 N[C@H](C(=O)O)C1COC1 22-1876 [0,0,1,1,0,0|2,0,0]=4 135 B9R2.39 O=C1N[C@@H]2C=C[C@H]1C2 08-4632 [1,0,0,1,0,0|1,0,0]=3 136 B7R1.10 O=C1CC(CO)C1 08-5307 [1,0,0,0,1,0|1,0,1]=4 137 B7R1.18 O=C(O)C1CNC1 08-4541 [1,0,0,0,1,0|1,0,1]=4 138 B7R1.18 O=C(O)[C@@H]1CCN1 024375 [1,0,0,0,1,0|0,0,0]=2 139 B7R1.18 O=C(O)[C@@H]1CCN1 024439 [1,0,0,0,1,0|0,0,0]=2 140 B7R1.18 O=C(O)[C@@H]1CCN1 024974S [1,0,0,0,1,0|0,0,0]=2 141 B7R1.18 O=C(O)[C@@H]1CCN1 04-395 [1,0,0,0,1,0|0,0,0]=2 142 B7R1.18 O=C(O)[C@@H]1CCO1 08-8067 [1,0,0,0,1,0|1,0,0]=3 143 B9R0.55 O=C(O)CCCCC(=O)O 15-0600 [0,0,1,0,0,1|1,0,0]=3 144 B9R1.2 O=C1C[C@@H](CO)CCN1 08-5731 [1,0,0,0,0,1|1,0,1]=4