0 B9R1.35 CC(C)C1CCC(=O)N1 CS-0046650 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.35 CN1CC[C@@H](C(=O)O)C1 CS-0054674 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 CN1CC[C@H](C(=O)O)C1 CS-0053278 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 CS-0053405 [0,0,0,0,0,0|1,0,1]=2 4 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 CS-0035602 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 CS-0089834 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.35 C[C@H](F)[C@H]1COC(=O)N1 CS-0069830 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.35 NC(=O)C1CNC(=O)C1 CS-0036847 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.35 NC1=N[C@@H](C(=O)O)CS1 CS-0112474 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.35 NC1=N[C@H](C(=O)O)CS1 CS-0112654 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.35 NC1CCC(C(=O)O)C1 CS-0051536 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 CS-0058718 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 CS-0053615 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.35 O=C(O)C1CCC(O)C1 CS-0112577 [0,0,0,0,0,0|1,0,2]=3 14 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 CS-0058696 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 CS-0053418 [0,0,0,0,0,0|2,1,1]=4 16 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 CS-0053410 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 CS-0058726 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 CS-0053409 [0,0,0,0,0,0|2,1,1]=4 19 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 CS-0053465 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 CS-0001913 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.35 O=C1CC(C(=O)O)CN1 CS-0050412 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.35 O=C1CCC(C(=O)O)S1 CS-0050411 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.35 O=C1CC[C@@H](C(=O)[O-])N1 CS-0112985 [0,0,0,0,0,0|0,0,1]=1 24 B9R1.35 O=C1CNC(C(=O)O)C1 CS-0050785 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.35 O=C1C[C@H](C(=O)O)CN1 CS-0053257 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.35 O=C1N=C(C(=O)O)NO1 CS-0068898 [0,0,0,0,0,0|2,0,2]=4 27 B9R1.35 O=C1NCC(C(=O)O)N1 CS-0062204 [0,0,0,0,0,0|1,0,0]=1 28 B9R1.35 O=C1N[C@H](C(=O)O)CO1 CS-0099760 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.35 O=C1N[C@H](C(F)F)CO1 CS-0053175 [0,0,0,0,0,0|3,0,1]=4 30 B8R1.1 CCC1CCC(=O)N1 CS-0046651 [1,0,0,0,0,0|1,0,1]=3 31 B8R1.1 CC[C@H]1COC(=O)N1 CS-0093963 [1,0,0,0,0,0|2,0,1]=4 32 B8R1.1 N#CC1CCC(=O)C1 CS-0035459 [1,0,0,0,0,0|2,0,1]=4 33 B8R1.1 N#CC1CCC(=O)N1 CS-0046588 [1,0,0,0,0,0|1,0,1]=3 34 B8R1.1 NCC1COC(=O)N1 CS-0051192 [1,0,0,0,0,0|2,0,1]=4 35 B8R1.1 O=C1CC(CO)CN1 CS-0046664 [1,0,0,0,0,0|2,0,1]=4 36 B8R1.1 O=C1CC(CO)CO1 CS-0037642 [1,0,0,0,0,0|2,0,1]=4 37 B8R1.1 O=C1CC[C@H](CO)O1 CS-0046919 [1,0,0,0,0,0|1,0,1]=3 38 B8R1.1 O=C1NCC(CO)O1 CS-0113076 [1,0,0,0,0,0|2,0,1]=4 39 B8R1.1 O=CC1CCC(=O)N1 CS-0046586 [1,0,0,0,0,0|0,0,0]=1 40 B8R1.1 O=CC1CNC(=O)C1 CS-0046595 [1,0,0,0,0,0|2,0,0]=3 41 B8R1.7 NC(=O)C1CCOC1 CS-0048761 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.7 NC(=O)[C@@H]1CCNC1 CS-0007633 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.7 NC(=O)[C@H]1CCCN1 CS-0099967 [1,0,0,0,0,0|1,0,1]=3 44 B8R1.7 NC(=O)[C@H]1CCNC1 CS-0053244 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.7 O=C(O)[C@@H]1CCNC1 CS-D1771 [1,0,0,0,0,0|2,0,0]=3 46 B8R1.7 O=C(O)[C@@H]1CCON1 CS-0097126 [1,0,0,0,0,0|1,0,0]=2 47 B8R1.7 O=C(O)[C@H]1CCCO1 CS-W005223 [1,0,0,0,0,0|1,0,1]=3 48 B8R1.7 O=C(O)[C@H]1CCOC1 CS-0053249 [1,0,0,0,0,0|2,0,0]=3 49 B8R1.7 [C@@H]1(C(=O)O)CCOC1 CS-W006196 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.14 COC(=O)C1CCC(=O)C1 CS-W019720 [0,1,0,0,0,0|1,0,0]=2 51 B10R1.14 COC(=O)C1CCC(Br)C1 CS-0049106 [0,1,0,0,0,0|2,0,1]=4 52 B10R1.14 COC(=O)C1CNC(=S)C1 CS-0089135 [0,1,0,0,0,0|2,1,0]=4 53 B10R1.14 COC(=O)[C@@H]1CCC(S)=N1 CS-0036085 [0,1,0,0,0,0|0,1,1]=3 54 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 CS-0049309 [0,1,0,0,0,0|2,0,1]=4 55 B10R1.14 COC(=O)[C@@H]1CC[C@@H](O)C1 CS-0055660 [0,1,0,0,0,0|1,0,2]=4 56 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 CS-0049307 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 CS-0038415 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.14 COC(=O)[C@@H]1CSC(C)N1 CS-0078777 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 CS-0049304 [0,1,0,0,0,0|1,0,0]=2 60 B10R1.14 COC(=O)[C@H]1CC[C@@H](C)N1 CS-0098427 [0,1,0,0,0,0|1,0,1]=3 61 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 CS-0048900 [0,1,0,0,0,0|1,0,2]=4 62 B10R1.14 COC(=O)[C@H]1CC[C@H](Br)C1 CS-0049300 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 CS-0058623 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.58 O=C1N[C@H](C(=O)O)C[C@@H]1F CS-0049676 [0,1,0,0,0,0|0,0,0]=1 65 B10R1.194 CN1CCC(C(=O)O)C1=O CS-0096284 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)N1C CS-0053406 [0,1,0,0,0,0|1,0,1]=3 67 B10R1.359 O=C(O)[C@@H]1CCC(F)(F)C1 CS-0053636 [0,1,0,0,0,0|2,0,1]=4 68 B8R0.8 C=CCC[C@@H](N)C(=O)O CS-0100555 [0,0,1,0,0,0|1,0,0]=2 69 B8R0.8 NCCC[C@H](O)C(=O)O CS-0105324 [0,0,1,0,0,0|2,0,1]=4 70 B8R0.23 C[C@@H](CC(=O)O)C(=O)O CS-0035659 [0,0,1,0,0,0|2,0,0]=3 71 B8R0.23 O=C(O)C[C@@H](O)C(=O)O CS-B0824 [0,0,1,0,0,0|3,0,0]=4 72 B8R0.28 CC(C)CCCC(=O)O CS-0096310 [0,0,1,0,0,0|2,0,1]=4 73 B8R0.28 O=C(O)\C=C\CC(=O)O CS-0106651 [0,0,1,0,0,0|1,0,2]=4 74 B10R2.178 O=C1CCC2CCC1N2 CS-0049978 [0,0,0,1,0,0|2,0,1]=4 75 B10R2.348 O=C(O)C12CCC(C1)C2 CS-0092006 [0,0,0,1,0,0|2,0,1]=4 76 B10R2.357 O=C(O)C1CC2CC2C1 CS-0046676 [0,0,0,1,0,0|2,0,1]=4 77 B10R2.357 [C@@H]12C[C@H](C(=O)O)N[C@@H]1C2 CS-0053616 [0,0,0,1,0,0|1,0,1]=3 78 B8R1.23 C=C1CC(C(=O)O)C1 CS-M1233 [0,0,0,0,1,0|2,0,0]=3 79 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 CS-0045557 [0,0,0,0,1,0|2,0,1]=4 80 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 CS-0045556 [0,0,0,0,1,0|2,0,1]=4 81 B8R1.23 NC1CC(C(=O)O)C1 CS-0051537 [0,0,0,0,1,0|2,0,1]=4 82 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 CS-W022614 [0,0,0,0,1,0|2,0,1]=4 83 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 CS-0047792 [0,0,0,0,1,0|2,0,1]=4 84 B8R1.23 O=C(O)C1CC(F)C1 CS-0036337 [0,0,0,0,1,0|2,0,1]=4 85 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 CS-0049707 [0,0,0,0,1,0|2,0,1]=4 86 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 CS-0047788 [0,0,0,0,1,0|2,0,1]=4 87 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 CS-0047785 [0,0,0,0,1,0|2,0,1]=4 88 B8R1.23 O=C1C[C@H](C(=O)O)N1 CS-0053483 [0,0,0,0,1,0|0,0,0]=1 89 B8R1.31 CC1NCC1C(=O)O CS-0091784 [0,0,0,0,1,0|2,0,1]=4 90 B8R1.31 CN1CC[C@@H]1C(=O)O CS-0052024 [0,0,0,0,1,0|2,0,0]=3 91 B8R1.31 CN1CC[C@H]1C(=O)O CS-0052023 [0,0,0,0,1,0|2,0,0]=3 92 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O CS-0053427 [0,0,0,0,1,0|2,0,1]=4 93 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O CS-0047827 [0,0,0,0,1,0|1,0,1]=3 94 B8R1.31 N[C@H]1CC[C@H]1C(=O)O CS-0049744 [0,0,0,0,1,0|1,0,1]=3 95 B8R1.31 O=C(O)C1CCC1O CS-0090873 [0,0,0,0,1,0|0,0,2]=3 96 B8R1.31 O=C(O)C1CNC1=O CS-0046609 [0,0,0,0,1,0|1,0,0]=2 97 B10R1.13 C[C@@H]1CC[C@H](C(=O)O)NC1 CS-0092847 [0,0,0,0,0,1|1,0,1]=3 98 B10R1.13 O=C(O)C1CCC(F)CC1 CS-0053674 [0,0,0,0,0,1|2,0,1]=4 99 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 CS-0054782 [0,0,0,0,0,1|0,0,2]=3 100 B10R1.13 O=C(O)[C@H]1CC[C@@H](F)CC1 CS-0049762 [0,0,0,0,0,1|2,0,1]=4 101 B10R1.13 O=C(O)[C@H]1CC[C@H](F)CC1 CS-0047846 [0,0,0,0,0,1|2,0,1]=4 102 B10R1.13 O=C1CCC(C(=O)O)CN1 CS-0050149 [0,0,0,0,0,1|0,0,0]=1 103 B10R1.113 CC(=O)C1CCNC(=O)C1 CS-0105512 [0,0,0,0,0,1|2,0,0]=3 104 B10R1.113 CC(=O)N1CCNC(=O)C1 CS-0051062 [0,0,0,0,0,1|3,0,0]=4 105 B10R1.113 CC1CC(C(=O)O)CCN1 CS-0056620 [0,0,0,0,0,1|2,0,1]=4 106 B10R1.113 CN1CCCC(C(=O)O)C1 CS-0052422 [0,0,0,0,0,1|3,0,0]=4 107 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 CS-0056390 [0,0,0,0,0,1|3,0,0]=4 108 B10R1.113 CN1CCC[C@H](C(=O)O)C1 CS-0053280 [0,0,0,0,0,1|3,0,0]=4 109 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)O1 CS-0092845 [0,0,0,0,0,1|2,0,1]=4 110 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 CS-0049713 [0,0,0,0,0,1|2,0,1]=4 111 B10R1.113 O=C(O)[C@@H]1CCC[C@H](O)C1 CS-0053614 [0,0,0,0,0,1|1,0,2]=4 112 B10R1.113 O=C(O)[C@H]1CCC[C@@H](O)C1 CS-0053564 [0,0,0,0,0,1|1,0,2]=4 113 B10R1.113 O=C(O)[C@H]1CCSC(=S)N1 CS-0108652 [0,0,0,0,0,1|0,1,0]=2 114 B10R1.113 O=C1CCCC(C(=O)O)N1 CS-0099890 [0,0,0,0,0,1|0,0,0]=1 115 B10R1.113 O=C1COCC(C(=O)O)N1 CS-0089149 [0,0,0,0,0,1|0,0,0]=1 116 B7R0.3 C=CCCC(N)CO CS-0091350 [1,0,1,0,0,0|1,0,1]=4 117 B7R0.4 C=CCOCC(=O)O CS-0112199 [1,0,1,0,0,0|2,0,0]=4 118 B7R0.4 NCCCCC(N)=O CS-0112084 [1,0,1,0,0,0|1,0,1]=4 119 B7R0.5 C=CCC(N)C(=O)O CS-0060001 [1,0,1,0,0,0|0,0,1]=3 120 B7R0.5 NCCC(F)C(=O)O CS-0095010 [1,0,1,0,0,0|2,0,0]=4 121 B7R0.6 C=C(Br)CNC(C)=O CS-0106982 [1,0,1,0,0,0|2,0,0]=4 122 B7R1.2 CC1CCC(=O)N1 CS-0046659 [2,0,0,0,0,0|0,0,1]=3 123 B7R1.2 C[C@@H]1CCC(=O)N1 CS-0046592 [2,0,0,0,0,0|0,0,1]=3 124 B7R1.2 C[C@H]1COC(=O)N1 CS-0059840 [2,0,0,0,0,0|1,0,1]=4 125 B7R1.2 NC1CCC(=O)N1 CS-0046591 [2,0,0,0,0,0|1,0,0]=3 126 B9R0.51 C=CCC[C@@](C)(N)C(=O)O CS-0100551 [0,1,1,0,0,0|1,0,0]=3 127 B9R0.51 C=CCC[C@](C)(N)C(=O)O CS-0100620 [0,1,1,0,0,0|1,0,0]=3 128 B9R0.24 COC(=O)CCC(=O)OC CS-0015787 [0,1,1,0,0,0|2,0,0]=4 129 B9R0.48 CCOC(=O)CCC(C)=O CS-W011009 [0,1,1,0,0,0|2,0,0]=4 130 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(=O)O CS-0037182 [0,1,1,0,0,0|2,0,0]=4 131 B9R0.1 COC(=O)CCC[N+](=O)[O-] CS-0039131 [0,1,1,0,0,0|2,0,0]=4 132 B9R1.22 C[C@@H]1OC(=O)N[C@@H]1CO CS-0094734 [1,1,0,0,0,0|1,0,1]=4 133 B9R1.11 COC(=O)C1CCCC1 CS-W005310 [1,1,0,0,0,0|1,0,1]=4 134 B9R1.11 COC(=O)C1CSCN1 CS-0079604 [1,1,0,0,0,0|1,0,1]=4 135 B9R1.11 COC(=O)[C@@H]1CCNC1 CS-0049282 [1,1,0,0,0,0|2,0,0]=4 136 B9R1.11 COC(=O)[C@@H]1CCOC1 CS-0049283 [1,1,0,0,0,0|2,0,0]=4 137 B9R1.11 COC(=O)[C@@H]1CSCN1 CS-0078994 [1,1,0,0,0,0|1,0,1]=4 138 B9R1.11 COC(=O)[C@H]1CCCO1 CS-0080541 [1,1,0,0,0,0|1,0,1]=4 139 B9R1.11 COC(=O)[C@H]1CCNC1 CS-0049275 [1,1,0,0,0,0|2,0,0]=4 140 B9R1.11 COC(=O)[C@H]1CCOC1 CS-0049276 [1,1,0,0,0,0|2,0,0]=4 141 B9R1.11 O=C(O[Na])[C@@H]1CCCN1 CS-0091626 [1,1,0,0,0,0|0,0,1]=3 142 B9R1.41 CN1CCC[C@@H]1C(=O)O CS-0053503 [1,1,0,0,0,0|0,0,1]=3 143 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O CS-0035981 [1,1,0,0,0,0|2,0,0]=4 144 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O CS-0089000 [1,1,0,0,0,0|0,0,1]=3 145 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O CS-WAA0104 [1,1,0,0,0,0|1,0,1]=4 146 B9R1.41 O=C(O)C1CCNC1=O CS-0051809 [1,1,0,0,0,0|2,0,0]=4 147 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O CS-0053472 [1,1,0,0,0,0|0,0,1]=3 148 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O CS-0053473 [1,1,0,0,0,0|0,0,1]=3 149 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O CS-0058698 [1,1,0,0,0,0|0,0,1]=3 150 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F CS-0102919 [1,1,0,0,0,0|0,0,1]=3 151 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O CS-0049702 [1,1,0,0,0,0|0,0,1]=3 152 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O CS-M2136 [1,1,0,0,0,0|0,0,1]=3 153 B9R1.163 CC1(C(=O)O)CCCO1 CS-0100004 [1,1,0,0,0,0|1,0,1]=4 154 B9R1.163 CC1(C(=O)O)CCOC1 CS-0051243 [1,1,0,0,0,0|2,0,0]=4 155 B9R1.163 C[C@@]1(C(=O)O)CCCO1 CS-0109877 [1,1,0,0,0,0|1,0,1]=4 156 B9R1.163 C[C@]1(C(=O)O)CCCO1 CS-0110145 [1,1,0,0,0,0|1,0,1]=4 157 B9R1.163 NC1(C(=O)O)CCOC1 CS-0003965 [1,1,0,0,0,0|2,0,0]=4 158 B9R1.163 N[C@@]1(C(=O)O)CCNC1 CS-0104837 [1,1,0,0,0,0|2,0,0]=4 159 B9R1.163 N[C@@]1(C(=O)O)CCOC1 CS-0096647 [1,1,0,0,0,0|2,0,0]=4 160 B9R1.163 N[C@]1(C(=O)O)CCOC1 CS-0096645 [1,1,0,0,0,0|2,0,0]=4 161 B9R1.163 O=C(O)C1(F)CCNC1 CS-0051353 [1,1,0,0,0,0|2,0,0]=4 162 B9R1.163 O=C(O)C1(O)CCCC1 CS-W006221 [1,1,0,0,0,0|1,0,1]=4 163 B9R1.152 C=C1CC(C)(C(=O)O)C1 CS-0052448 [0,1,0,0,1,0|2,0,0]=4 164 B9R1.152 CC1(C(=O)O)CC(=O)C1 CS-0052446 [0,1,0,0,1,0|1,0,0]=3 165 B9R1.52 CC1CN(C)[C@@H]1C(=O)O CS-0052352 [0,1,0,0,1,0|2,0,0]=4 166 B9R1.81 COC(=O)C1CNC1=O CS-0046610 [0,1,0,0,1,0|1,0,0]=3 167 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N CS-0003938 [0,1,0,0,1,0|1,0,1]=4 168 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N CS-0045471 [0,1,0,0,1,0|1,0,1]=4 169 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N CS-0045473 [0,1,0,0,1,0|1,0,1]=4 170 B9R1.96 CCN1CC[C@H]1C(=O)O CS-0052348 [0,1,0,0,1,0|2,0,0]=4 171 B9R1.96 O=C(O)C1CCC1CO CS-0098964 [0,1,0,0,1,0|0,0,2]=4 172 B9R1.166 O=C(O)C1CCC1(F)F CS-0055423 [0,1,0,0,1,0|1,0,1]=4 173 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 CS-0047823 [0,1,0,0,0,1|1,0,1]=4 174 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 CS-0048873 [0,1,0,0,0,1|1,0,1]=4 175 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 CS-0006703 [0,1,0,0,0,1|1,0,1]=4 176 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 CS-0058695 [0,1,0,0,0,1|1,0,1]=4 177 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 CS-0109587 [0,1,0,0,0,1|1,0,0]=3 178 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 CS-0102296 [0,1,0,0,0,1|1,0,1]=4 179 B11R1.166 O=C1NCC(C(=O)O)C(=O)N1 CS-0046489 [0,1,0,0,0,1|1,0,0]=3 180 B11R1.220 CC1(C(=O)O)CCC(=O)CC1 CS-0043933 [0,1,0,0,0,1|1,0,0]=3 181 B11R1.727 O=C(O)C1CCC(F)(F)CN1 CS-0050734 [0,1,0,0,0,1|1,0,1]=4 182 B11R1.23 COC(=O)C1COCC(=O)C1 CS-0048960 [0,1,0,0,0,1|1,0,0]=3 183 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 CS-0054133 [0,1,0,0,0,1|1,0,0]=3 184 B11R1.74 O=C1CC(C(=O)O)CC(=O)N1 CS-0071308 [0,1,0,0,0,1|1,0,1]=4 185 B11R1.74 O=C1CC(C(=O)O)NC(=O)N1 CS-0046700 [0,1,0,0,0,1|0,0,1]=3 186 B11R1.167 O=C1CNC(=O)C(C(=O)O)N1 CS-0046478 [0,1,0,0,0,1|0,0,1]=3 187 B11R1.15 CCOC(=O)N1CCC(=O)C1 CS-B0610 [0,2,0,0,0,0|2,0,0]=4 188 B11R1.44 COC(=O)[C@@H]1CCC(OC)=N1 CS-0092020 [0,2,0,0,0,0|0,0,2]=4 189 B11R1.226 COC(=O)C1CC(=O)C(Br)C1 CS-0061870 [0,2,0,0,0,0|1,0,0]=3 190 B11R1.226 COC(=O)C1CC(=O)N(C)C1 CS-0036090 [0,2,0,0,0,0|2,0,0]=4 191 B11R1.885 COC(=O)C1(C)CCC(=O)C1 CS-0049224 [0,2,0,0,0,0|1,0,0]=3 192 B11R1.175 O=C(O)C1CSC(C(=O)O)N1 CS-0060752 [0,2,0,0,0,0|1,0,1]=4 193 B9R1.6 O=C(O)C1CCCCN1 CS-0043825 [0,0,1,1,0,0|1,0,1]=4 194 B9R1.6 O=C(O)[C@H]1CC=CCC1 CS-0021761 [0,0,1,1,0,0|2,0,0]=4 195 B9R1.69 CC1CCC(=O)NC1=O CS-0061420 [0,0,1,1,0,0|2,0,0]=4 196 B9R1.110 NC(C(=O)O)C1CCC1 CS-D0530 [0,0,1,1,0,0|1,0,1]=4 197 B9R1.110 NC(C(=O)O)C1COC1 CS-0052062 [0,0,1,1,0,0|2,0,0]=4 198 B9R1.110 N[C@@H](C(=O)O)C1CCC1 CS-0053495 [0,0,1,1,0,0|1,0,1]=4 199 B9R1.110 N[C@H](C(=O)O)C1COC1 CS-0053444 [0,0,1,1,0,0|2,0,0]=4 200 B9R1.179 C=CCC1(C(=O)O)CC1 CS-0052808 [0,0,1,1,0,0|2,0,0]=4 201 B9R1.161 NC(=O)C1CC1C(=O)O CS-0051983 [0,0,1,1,0,0|2,0,0]=4 202 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O CS-0047742 [0,0,1,1,0,0|2,0,0]=4 203 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O CS-0053628 [0,0,1,1,0,0|2,0,0]=4 204 B9R1.53 NC1CC(CC(=O)O)C1 CS-0052288 [0,0,1,1,0,0|1,0,1]=4 205 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 CS-0049761 [0,0,1,1,0,0|1,0,1]=4 206 B9R1.53 O=C(O)CC1CC(=O)C1 CS-0040780 [0,0,1,1,0,0|1,0,0]=3 207 B9R2.139 O=C1CCC2(CC2)N1 CS-0088416 [1,0,0,1,0,0|1,0,1]=4 208 B11R2.898 COC(=O)C1NC2CC1C2 CS-0030105 [0,1,0,1,0,0|1,0,1]=4 209 B7R1.8 O=C1CCC1CO CS-0045469 [1,0,0,0,1,0|0,0,1]=3 210 B7R1.8 O=C1NCC1CO CS-0046606 [1,0,0,0,1,0|1,0,1]=4 211 B7R1.10 COC1CC(=O)N1 CS-0046571 [1,0,0,0,1,0|2,0,0]=4 212 B7R1.10 O=C1CC(CO)N1 CS-0051147 [1,0,0,0,1,0|0,0,1]=3 213 B7R1.18 O=C(O)C1CSC1 CS-0045516 [1,0,0,0,1,0|1,0,1]=4 214 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O CS-0055686 [0,0,0,0,2,0|1,0,1]=4 215 B7R1.12 C[C@@H]1C[C@H]1C(=O)O CS-0047824 [0,0,0,0,2,0|1,0,1]=4 216 B7R1.12 C[C@H]1C[C@@H]1C(=O)O CS-0089165 [0,0,0,0,2,0|1,0,1]=4 217 B7R1.12 NC1CC1C(=O)O CS-0067815 [0,0,0,0,2,0|1,0,1]=4 218 B7R1.12 O=C(O)[C@@H]1C[C@H]1F CS-0058705 [0,0,0,0,2,0|1,0,1]=4 219 B7R1.12 O=C(O)[C@H]1C[C@@H]1F CS-0053630 [0,0,0,0,2,0|1,0,1]=4 220 B7R1.12 [C@@H]1(C(=O)O)C[C@@H]1C CS-0049741 [0,0,0,0,2,0|1,0,1]=4 221 B9R0.4 CSCC[C@H](N)CC(=O)O CS-0062044 [0,0,1,0,0,1|2,0,0]=4 222 B9R1.2 O=C1CC(CO)CCN1 CS-0051145 [1,0,0,0,0,1|1,0,1]=4 223 B9R1.2 O=C1CCCC(CO)N1 CS-0099968 [1,0,0,0,0,1|0,0,1]=3 224 B9R1.13 O=C(O)CC1CCNC1 CS-0052205 [1,0,0,0,0,1|2,0,0]=4 225 B9R1.13 O=C(O)C[C@@H]1CCCN1 CS-0035426 [1,0,0,0,0,1|0,0,1]=3 226 B9R1.13 O=C(O)C[C@H]1CCCN1 CS-0035825 [1,0,0,0,0,1|0,0,1]=3 227 B9R1.13 O=C(O)C[C@H]1CCOC1 CS-0054371 [1,0,0,0,0,1|2,0,0]=4 228 B9R1.13 [C@@H]1(CC(=O)O)CCCN1 CS-W010817 [1,0,0,0,0,1|0,0,1]=3