0 B9R1.27 CCC1=C(CNC1=O)C MCULE-5181429749 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.27 CCC1C(=O)CCC1=O MCULE-9997239659 [0,0,0,0,0,0|1,0,0]=1 2 B9R1.27 CCC1C(=O)NCC1C MCULE-6984020668 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.27 CCC1C(=O)NN=C1C MCULE-4536947183 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.27 CCN1C(=CN=C1C)Cl MCULE-1384120340 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.27 CCN1C(=NN=C1S)N MCULE-2700531356 [0,0,0,0,0,0|3,1,0]=4 6 B9R1.27 CCN1C(=O)C=CC1=O MCULE-9216989340 [0,0,0,0,0,0|0,0,2]=2 7 B9R1.27 CCN1C(=O)CCC1=O MCULE-3955479682 [0,0,0,0,0,0|0,0,0]=0 8 B9R1.27 CCN1C(=O)CNC1=O MCULE-7012305681 [0,0,0,0,0,0|1,0,0]=1 9 B9R1.27 CCN1C(=O)CNC1=S MCULE-4101647203 [0,0,0,0,0,0|1,1,0]=2 10 B9R1.27 CCN1C(=O)COC1=S MCULE-8441116729 [0,0,0,0,0,0|1,1,0]=2 11 B9R1.27 CCN1C(=O)CSC1=S MCULE-7069138767 [0,0,0,0,0,0|1,1,0]=2 12 B9R1.27 CCN1C(=O)NN=C1C MCULE-1457027919 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.27 CCN1C(=S)NN=C1C MCULE-9120886653 [0,0,0,0,0,0|3,1,0]=4 14 B9R1.27 N#CN1C(=O)CCC1=O MCULE-3098343266 [0,0,0,0,0,0|1,0,1]=2 15 B9R1.27 O=C1C=CC(=O)N1CO MCULE-9063303630 [0,0,0,0,0,0|1,0,2]=3 16 B9R1.27 O=C1CCC(=O)N1CO MCULE-2404690751 [0,0,0,0,0,0|1,0,0]=1 17 B8R1.11 C=CN1CCCC1=O MCULE-3025814103 [1,0,0,0,0,0|0,0,3]=4 18 B8R1.11 CCC1CCCC1=O MCULE-1884299455 [1,0,0,0,0,0|1,0,1]=3 19 B8R1.11 CCC1CCNC1=O MCULE-8307536027 [1,0,0,0,0,0|2,0,1]=4 20 B8R1.11 CCC1CCOC1=O MCULE-2375464273 [1,0,0,0,0,0|2,0,1]=4 21 B8R1.11 CCC1COCC1=O MCULE-5486171882 [1,0,0,0,0,0|2,0,1]=4 22 B8R1.11 CCN1C=CN=C1Br MCULE-1274110254 [1,0,0,0,0,0|2,0,1]=4 23 B8R1.11 CCN1C=CN=C1Br MCULE-9017123039 [1,0,0,0,0,0|2,0,1]=4 24 B8R1.11 CCN1C=CN=C1C MCULE-5943654351 [1,0,0,0,0,0|2,0,1]=4 25 B8R1.11 CCN1C=CN=C1Cl MCULE-9748144212 [1,0,0,0,0,0|2,0,1]=4 26 B8R1.11 CCN1C=CN=C1N MCULE-3212193688 [1,0,0,0,0,0|2,0,1]=4 27 B8R1.11 CCN1C=CN=C1S MCULE-2490185112 [1,0,0,0,0,0|1,1,1]=4 28 B8R1.11 CCN1C=CNC1=O MCULE-8501991406 [1,0,0,0,0,0|1,0,1]=3 29 B8R1.11 CCN1C=CSC1=N MCULE-1692207080 [1,0,0,0,0,0|2,0,1]=4 30 B8R1.11 CCN1C=CSC1=[NH2+] MCULE-2182604989 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.11 CCN1C=NC=C1Br MCULE-2316890689 [1,0,0,0,0,0|2,0,1]=4 32 B8R1.11 CCN1C=NC=C1C MCULE-5010495596 [1,0,0,0,0,0|2,0,1]=4 33 B8R1.11 CCN1C=NC=C1N MCULE-9864212110 [1,0,0,0,0,0|2,0,1]=4 34 B8R1.11 CCN1C=NN=C1N MCULE-7342108691 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.11 CCN1C=NN=C1N MCULE-8110662600 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.11 CCN1C=NN=C1S MCULE-4081198605 [1,0,0,0,0,0|2,1,0]=4 37 B8R1.11 CCN1CCCC1=O MCULE-7206309773 [1,0,0,0,0,0|0,0,1]=2 38 B8R1.11 CCN1CCCC1=O MCULE-7415495937 [1,0,0,0,0,0|0,0,1]=2 39 B8R1.11 CCN1CCNC1=O MCULE-8168665695 [1,0,0,0,0,0|1,0,1]=3 40 B8R1.11 CCN1CCNC1=S MCULE-5878192181 [1,0,0,0,0,0|1,1,1]=4 41 B8R1.11 CCN1CNCC1=O MCULE-2327338525 [1,0,0,0,0,0|1,0,1]=3 42 B8R1.11 CCN1N=NNC1=O MCULE-2824266215 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.11 COC1=CCCC1=O MCULE-2849263860 [1,0,0,0,0,0|2,0,0]=3 44 B8R1.11 COC1CCCC1=O MCULE-2741778082 [1,0,0,0,0,0|2,0,1]=4 45 B8R1.11 NCC1CCCC1=O MCULE-4144323636 [1,0,0,0,0,0|2,0,1]=4 46 B8R1.11 NCC1CCCC1=O MCULE-8761719757 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.11 O=C1CCC=C1CO MCULE-5949194155 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [1,0,0,0,0,0|2,0,1]=4 49 B8R1.11 O=C1CCCN1CBr MCULE-1337183945 [1,0,0,0,0,0|1,0,1]=3 50 B8R1.11 O=C1CCCN1CCl MCULE-6204630639 [1,0,0,0,0,0|1,0,1]=3 51 B8R1.11 O=C1CCCN1CO MCULE-6508920438 [1,0,0,0,0,0|1,0,1]=3 52 B8R1.11 O=C1CNCN1CO MCULE-1880077159 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.11 O=C1CNCN1CO MCULE-4265247225 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.11 O=CN1CCCC1=O MCULE-1097328464 [1,0,0,0,0,0|1,0,2]=4 55 B8R1.50 CC1=C(C(=O)CC1)Br MCULE-4093496442 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.50 CC1=C(C(=O)CC1)C MCULE-6370073595 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.50 CC1=C(C(=O)CC1)O MCULE-2968247012 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.50 CC1=C(C(=O)CC1)O MCULE-9147894168 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.50 CC1=C(C(=O)NC1)C MCULE-4444366984 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.50 CC1=C(CCC1=O)O MCULE-6367252690 [1,0,0,0,0,0|1,0,1]=3 61 B8R1.50 CC1=C(COC1=O)Br MCULE-6953448957 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.50 CC1=C(COC1=O)O MCULE-4822806082 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.50 CC1=C(OCC1=O)O MCULE-1835077768 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.50 CC1=NNC(=O)N1C MCULE-7430385178 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.50 CC1C(=O)CCC1=O MCULE-4418458735 [1,0,0,0,0,0|1,0,0]=2 66 B8R1.50 CC1C(=O)CCN1C MCULE-8191851293 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.50 CC1C(=O)COC1=O MCULE-4188541096 [1,0,0,0,0,0|2,0,0]=3 68 B8R1.50 CC1CCC(=O)N1C MCULE-7405072604 [1,0,0,0,0,0|1,0,1]=3 69 B8R1.50 CN1C(=O)C=CC1=O MCULE-2337038549 [1,0,0,0,0,0|0,0,2]=3 70 B8R1.50 CN1C(=O)CCC1=O MCULE-6726005566 [1,0,0,0,0,0|0,0,0]=1 71 B8R1.50 CN1C(=O)CCC1O MCULE-1070053575 [1,0,0,0,0,0|0,0,2]=3 72 B8R1.50 CN1C(=O)CNC1=O MCULE-8997643894 [1,0,0,0,0,0|1,0,0]=2 73 B8R1.50 CN1C(=O)CNC1=S MCULE-6633485185 [1,0,0,0,0,0|1,1,0]=3 74 B8R1.50 CN1C(=O)COC1=O MCULE-1190604947 [1,0,0,0,0,0|1,0,0]=2 75 B8R1.50 CN1C(=O)CSC1=O MCULE-8837313577 [1,0,0,0,0,0|1,0,0]=2 76 B8R1.50 CN1C(=O)CSC1=S MCULE-8742608574 [1,0,0,0,0,0|1,1,0]=3 77 B8R1.50 CN1C(=O)N=NC1=O MCULE-3120186978 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.50 CN1C(=O)NN=C1S MCULE-4115576499 [1,0,0,0,0,0|2,1,0]=4 79 B8R1.50 CN1C(=O)NNC1=O MCULE-9990504316 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.50 NN1C(=O)CCC1=O MCULE-4432056181 [1,0,0,0,0,0|1,0,0]=2 81 B8R1.50 NN1C(=O)CCC1=O MCULE-8224510852 [1,0,0,0,0,0|1,0,0]=2 82 B8R1.50 NN1C(=O)CNC1=O MCULE-3172416594 [1,0,0,0,0,0|2,0,0]=3 83 B8R1.50 NN1C(=O)CSC1=S MCULE-7853752310 [1,0,0,0,0,0|2,1,0]=4 84 B8R1.50 NN1C(=O)NNC1=O MCULE-6234762498 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.50 O=C1C=CC(=O)N1Cl MCULE-3334700253 [1,0,0,0,0,0|1,0,2]=4 86 B8R1.50 O=C1C=CC(=O)N1O MCULE-9775072223 [1,0,0,0,0,0|1,0,2]=4 87 B8R1.50 O=C1CCC(=C1F)O MCULE-4719137849 [1,0,0,0,0,0|2,0,1]=4 88 B8R1.50 O=C1CCC(=O)C1Br MCULE-7463233898 [1,0,0,0,0,0|2,0,0]=3 89 B8R1.50 O=C1CCC(=O)C1Cl MCULE-9440848782 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.50 O=C1CCC(=O)N1Br MCULE-6561724377 [1,0,0,0,0,0|1,0,0]=2 91 B8R1.50 O=C1CCC(=O)N1Cl MCULE-3093539402 [1,0,0,0,0,0|1,0,0]=2 92 B8R1.50 O=C1CCC(=O)N1I MCULE-8261967194 [1,0,0,0,0,0|1,0,0]=2 93 B8R1.50 O=C1CCC(=O)N1O MCULE-5478278340 [1,0,0,0,0,0|1,0,0]=2 94 B8R1.50 O=C1COC(=O)C1Br MCULE-7458581655 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.50 O=C1COC(=O)C1Cl MCULE-1326411169 [1,0,0,0,0,0|3,0,0]=4 96 B10R1.187 C#CCN1C(=O)C=CC1=O MCULE-7990670928 [0,1,0,0,0,0|0,0,3]=4 97 B10R1.187 C#CCN1C(=O)CCC1=O MCULE-1865325975 [0,1,0,0,0,0|0,0,1]=2 98 B10R1.187 C#CCN1C(=O)NNC1=O MCULE-6089350706 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.187 C=CCN1C(=O)C=CC1=O MCULE-8273326462 [0,1,0,0,0,0|0,0,3]=4 100 B10R1.187 C=CCN1C(=O)CCC1=O MCULE-9965018818 [0,1,0,0,0,0|0,0,1]=2 101 B10R1.187 C=CCN1C(=O)CNC1=O MCULE-8825025020 [0,1,0,0,0,0|1,0,1]=3 102 B10R1.187 C=CCN1C(=O)CNC1=S MCULE-4705706303 [0,1,0,0,0,0|1,1,1]=4 103 B10R1.187 C=CCN1C(=O)CSC1=O MCULE-9914508748 [0,1,0,0,0,0|1,0,1]=3 104 B10R1.187 C=CCN1C(=O)CSC1=S MCULE-5452561380 [0,1,0,0,0,0|1,1,1]=4 105 B10R1.187 CC1=CSC(=O)N1CCBr MCULE-9666512809 [0,1,0,0,0,0|2,0,1]=4 106 B10R1.187 CC=NN1C(=O)CSC1=S MCULE-1848167956 [0,1,0,0,0,0|1,1,1]=4 107 B10R1.187 CCCN1C(=O)C=CC1=O MCULE-3671722315 [0,1,0,0,0,0|0,0,2]=3 108 B10R1.187 CCCN1C(=O)CCC1O MCULE-6879311728 [0,1,0,0,0,0|0,0,2]=3 109 B10R1.187 CCCN1C(=O)CN=C1S MCULE-9105110728 [0,1,0,0,0,0|1,1,0]=3 110 B10R1.187 CCCN1C(=O)CSC1=S MCULE-2218355920 [0,1,0,0,0,0|1,1,0]=3 111 B10R1.187 CCSN1C(=O)CCC1=O MCULE-1042875473 [0,1,0,0,0,0|0,0,0]=1 112 B10R1.187 CNCN1C(=O)CSC1=O MCULE-4544562317 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.187 N#CCN1C(=O)CCC1=O MCULE-5653788451 [0,1,0,0,0,0|0,0,1]=2 114 B10R1.187 NCCN1C(=O)C=CC1=O MCULE-2620497864 [0,1,0,0,0,0|0,0,2]=3 115 B10R1.187 NCCN1C(=O)C=CC1=O MCULE-5522116258 [0,1,0,0,0,0|0,0,2]=3 116 B10R1.187 NCCN1C(=O)C=CC1=O MCULE-6372231545 [0,1,0,0,0,0|0,0,2]=3 117 B10R1.187 NCCN1C(=O)CCC1=O MCULE-7083439201 [0,1,0,0,0,0|0,0,0]=1 118 B10R1.187 NCCN1C(=O)CCC1=O MCULE-7982894713 [0,1,0,0,0,0|0,0,0]=1 119 B10R1.187 NCCN1C(=O)CNC1=O MCULE-3181047283 [0,1,0,0,0,0|1,0,0]=2 120 B10R1.187 NCCN1C(=O)CNC1=O MCULE-9252448662 [0,1,0,0,0,0|1,0,0]=2 121 B10R1.187 NCCN1C(=O)COC1=O MCULE-1481126104 [0,1,0,0,0,0|1,0,0]=2 122 B10R1.187 NCCN1C(=O)COC1=O MCULE-4962480521 [0,1,0,0,0,0|1,0,0]=2 123 B10R1.187 NCCN1C(=O)CSC1=O MCULE-4692714638 [0,1,0,0,0,0|1,0,0]=2 124 B10R1.187 NCCN1C(=O)CSC1=O MCULE-5250524091 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.187 NCCN1C(=O)CSC1=S MCULE-6517029904 [0,1,0,0,0,0|1,1,0]=3 126 B10R1.187 NCCN1C(=O)CSC1=S MCULE-8297074245 [0,1,0,0,0,0|1,1,0]=3 127 B10R1.187 O=C1C=CC(=O)N1CCBr MCULE-9027768505 [0,1,0,0,0,0|0,0,2]=3 128 B10R1.187 O=C1C=CC(=O)N1CCO MCULE-4825864501 [0,1,0,0,0,0|0,0,2]=3 129 B10R1.187 O=C1CCC(=O)N1CCBr MCULE-5348025767 [0,1,0,0,0,0|0,0,0]=1 130 B10R1.187 O=C1CCC(=O)N1CCCl MCULE-1698523682 [0,1,0,0,0,0|0,0,0]=1 131 B10R1.187 O=C1CCC(=O)N1CCO MCULE-4761387796 [0,1,0,0,0,0|0,0,0]=1 132 B10R1.187 O=C1CNC(=O)N1CCBr MCULE-6872932586 [0,1,0,0,0,0|1,0,0]=2 133 B10R1.187 O=C1CNC(=O)N1CCCl MCULE-4205767382 [0,1,0,0,0,0|1,0,0]=2 134 B10R1.187 O=C1CNC(=O)N1CCO MCULE-4896916902 [0,1,0,0,0,0|1,0,0]=2 135 B10R1.187 O=C1CSC(=O)N1CCBr MCULE-5619957587 [0,1,0,0,0,0|1,0,0]=2 136 B10R1.187 O=C1CSC(=O)N1CCO MCULE-2314167382 [0,1,0,0,0,0|1,0,0]=2 137 B10R1.187 O=CCN1C(=O)CCC1=O MCULE-8830991294 [0,1,0,0,0,0|0,0,1]=2 138 B10R1.192 CC(=C1C(=O)COC1=O)N MCULE-6282072482 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.192 CC(=O)C1C(=O)CNC1=O MCULE-8169936316 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.192 CC(=O)N1C(=O)CCC1=O MCULE-5136593237 [0,1,0,0,0,0|0,0,1]=2 141 B10R1.192 CC(C)C1C(=O)CCC1=O MCULE-9825556082 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.192 CC(C)N1C(=O)C=CC1=O MCULE-6596841616 [0,1,0,0,0,0|0,0,2]=3 143 B10R1.192 CC(C)N1C(=O)CNC1=O MCULE-4825648113 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.192 CC(C)N1C(=O)CSC1=S MCULE-9965446406 [0,1,0,0,0,0|1,1,0]=3 145 B10R1.192 CN(C)N1C(=O)CCC1=O MCULE-5941986627 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.192 O=C1CCC(=O)N1N(=O)=O MCULE-1589250995 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.256 CCN1C(=O)C=C(C1=O)C MCULE-6445056699 [0,1,0,0,0,0|0,0,2]=3 148 B10R1.256 CCN1C(=O)CC(C1=O)O MCULE-3060345343 [0,1,0,0,0,0|0,0,0]=1 149 B10R1.256 CCN1C(=O)CN(C1=S)C MCULE-1138691633 [0,1,0,0,0,0|1,1,0]=3 150 B10R1.256 CCN1C(=O)NC(=O)C1=O MCULE-3121866834 [0,1,0,0,0,0|1,0,1]=3 151 B10R1.256 CON1C(=O)NC(=O)C1=O MCULE-7875391552 [0,1,0,0,0,0|2,0,1]=4 152 B10R1.257 CCC1=NNC(=O)N1CC MCULE-2942301790 [0,1,0,0,0,0|3,0,0]=4 153 B10R1.257 CCN1C(=CC=C1C=O)C MCULE-3556747192 [0,1,0,0,0,0|1,0,2]=4 154 B10R1.257 CCN1C(=CN=C1C=O)C MCULE-4909325065 [0,1,0,0,0,0|2,0,1]=4 155 B10R1.257 CCN1C(=O)NN=C1CO MCULE-8885211911 [0,1,0,0,0,0|2,0,1]=4 156 B8R0.1 C#CCCC(=O)OCC MCULE-9456160977 [0,0,1,0,0,0|2,0,1]=4 157 B8R0.1 C=CCCC(=O)CCC MCULE-9846709255 [0,0,1,0,0,0|2,0,0]=3 158 B8R0.1 C=CCCC(=O)OCC MCULE-4147956319 [0,0,1,0,0,0|2,0,0]=3 159 B8R0.1 C=CCOC(=O)CCC MCULE-7209016839 [0,0,1,0,0,0|3,0,0]=4 160 B8R0.1 C=CCOC(=O)OCC MCULE-4897941593 [0,0,1,0,0,0|3,0,0]=4 161 B8R0.1 CCCCC(=O)CCC MCULE-5459540473 [0,0,1,0,0,0|2,0,1]=4 162 B8R0.1 CCCCC(=O)OCC MCULE-1219537918 [0,0,1,0,0,0|2,0,1]=4 163 B8R0.1 CCCNC(=O)NCC MCULE-5842395608 [0,0,1,0,0,0|2,0,1]=4 164 B8R0.1 CCNC(=O)CN=N#N MCULE-8440782418 [0,0,1,0,0,0|3,0,0]=4 165 B8R0.1 CCNC(=O)NCCN MCULE-2782056393 [0,0,1,0,0,0|2,0,1]=4 166 B8R0.1 CCNC(=O)NCCN MCULE-3018091453 [0,0,1,0,0,0|2,0,1]=4 167 B8R0.1 CCNC(=O)NCCO MCULE-1039035778 [0,0,1,0,0,0|1,0,2]=4 168 B8R0.1 CCNC(=S)NNC=O MCULE-8861789073 [0,0,1,0,0,0|2,1,0]=4 169 B8R0.1 CCNCC(=O)NCC MCULE-2852589977 [0,0,1,0,0,0|2,0,1]=4 170 B8R0.1 CCOC(=O)/C=C/C=O MCULE-9219622537 [0,0,1,0,0,0|1,0,2]=4 171 B8R0.1 CCOC(=O)C=CC=O MCULE-7165096046 [0,0,1,0,0,0|1,0,2]=4 172 B8R0.1 CCOC(=O)CCC#N MCULE-9221721525 [0,0,1,0,0,0|2,0,1]=4 173 B8R0.1 CCOC(=O)CCC=O MCULE-2891201608 [0,0,1,0,0,0|1,0,0]=2 174 B8R0.1 CCOC(=O)CCCBr MCULE-5001503693 [0,0,1,0,0,0|2,0,1]=4 175 B8R0.1 CCOC(=O)CCCCl MCULE-4945067440 [0,0,1,0,0,0|2,0,1]=4 176 B8R0.1 CCOC(=O)CCCI MCULE-3229549270 [0,0,1,0,0,0|2,0,1]=4 177 B8R0.1 CCOC(=O)CCCN MCULE-3396270547 [0,0,1,0,0,0|2,0,1]=4 178 B8R0.1 CCOC(=O)CCCO MCULE-6165580365 [0,0,1,0,0,0|1,0,2]=4 179 B8R0.1 CCOC(=O)CCCS MCULE-6616511520 [0,0,1,0,0,0|1,1,1]=4 180 B8R0.1 CCOC(=O)CCC[NH3+] MCULE-4462126494 [0,0,1,0,0,0|2,0,1]=4 181 B8R0.1 CCOC(=O)CCNC MCULE-2052970996 [0,0,1,0,0,0|3,0,0]=4 182 B8R0.1 CCOC(=O)CCNC MCULE-5442289273 [0,0,1,0,0,0|3,0,0]=4 183 B8R0.1 CCOC(=O)CCNN MCULE-6880821012 [0,0,1,0,0,0|3,0,0]=4 184 B8R0.1 CCOC(=O)CCNN MCULE-9638408107 [0,0,1,0,0,0|3,0,0]=4 185 B8R0.1 CCOC(=O)CCOC MCULE-5983048130 [0,0,1,0,0,0|3,0,0]=4 186 B8R0.1 CCOC(=O)CCSC MCULE-6834820952 [0,0,1,0,0,0|3,0,0]=4 187 B8R0.1 CCOC(=O)CN=C=O MCULE-3309838122 [0,0,1,0,0,0|2,0,1]=4 188 B8R0.1 CCOC(=O)CNC=O MCULE-7904243111 [0,0,1,0,0,0|2,0,0]=3 189 B8R0.18 CC(=O)C(=CN)C(=O)C MCULE-1809554699 [0,0,1,0,0,0|2,0,1]=4 190 B8R0.18 CC(=O)C(=NO)C(=O)C MCULE-5277683993 [0,0,1,0,0,0|3,0,0]=4 191 B8R0.18 CC(=O)C(C=O)C(=O)C MCULE-8700117770 [0,0,1,0,0,0|2,0,1]=4 192 B8R0.18 CCC(C(=O)C)C(=O)C MCULE-2654310210 [0,0,1,0,0,0|1,0,0]=2 193 B8R0.18 CCC(C(=O)C)C(=O)[O-] MCULE-6595833151 [0,0,1,0,0,0|2,0,0]=3 194 B8R0.18 CCC(C(=O)C)C(=O)[O-] MCULE-8541174028 [0,0,1,0,0,0|2,0,0]=3 195 B8R0.18 CCC(C(=O)C)C(C)C MCULE-3028115393 [0,0,1,0,0,0|2,0,1]=4 196 B8R0.18 CCC(C(=O)Cl)C(=O)Cl MCULE-8542721391 [0,0,1,0,0,0|3,0,0]=4 197 B8R0.18 CCC(C(=O)O)C(=O)O MCULE-3288957588 [0,0,1,0,0,0|3,0,0]=4 198 B8R0.18 CCC(C(=O)[O-])C(=O)[O-] MCULE-5481544745 [0,0,1,0,0,0|3,0,0]=4 199 B8R0.18 CCN(C(=O)Cl)C(C)C MCULE-4651804534 [0,0,1,0,0,0|2,0,1]=4 200 B8R0.18 COC(C(=O)C)C(=O)C MCULE-2169553892 [0,0,1,0,0,0|2,0,0]=3 201 B8R0.18 CON(C(=O)C)C(=O)C MCULE-2051447741 [0,0,1,0,0,0|1,0,0]=2 202 B8R0.20 CCC(=O)N(CC)CC MCULE-4492225722 [0,0,1,0,0,0|1,0,1]=3 203 B8R0.20 CCN(CC)C(=O)CBr MCULE-5615626045 [0,0,1,0,0,0|2,0,1]=4 204 B8R0.20 CCN(CC)C(=O)CCl MCULE-5745155246 [0,0,1,0,0,0|2,0,1]=4 205 B8R0.20 CCN(CC)C(=O)CN MCULE-4877298593 [0,0,1,0,0,0|2,0,1]=4 206 B8R0.20 CCN(CC)C(=O)CN MCULE-7981871119 [0,0,1,0,0,0|2,0,1]=4 207 B8R0.20 CCN(CC)C(=O)CO MCULE-1108898893 [0,0,1,0,0,0|2,0,1]=4 208 B8R0.20 CCN(CC)C(=O)CS MCULE-6874868972 [0,0,1,0,0,0|2,0,1]=4 209 B8R0.20 CCN(CC)C(=O)SC MCULE-6776760270 [0,0,1,0,0,0|2,0,1]=4 210 B8R0.20 CCN(OC)C(=O)CN MCULE-2148404310 [0,0,1,0,0,0|3,0,0]=4 211 B8R0.20 CCN(OC)C(=O)CN MCULE-8510064396 [0,0,1,0,0,0|3,0,0]=4 212 B10R2.20 CN1C2CCC1C(=O)C2 MCULE-2169813004 [0,0,0,1,0,0|3,0,0]=4 213 B10R2.32 O=C1CCC2C1CCC2 MCULE-7663799084 [0,0,0,1,0,0|2,0,1]=4 214 B10R2.32 O=C1CCC2N1CCC2 MCULE-2278509511 [0,0,0,1,0,0|1,0,1]=3 215 B10R2.32 O=C1CCN2C1CCC2 MCULE-3092093752 [0,0,0,1,0,0|3,0,0]=4 216 B10R2.32 O=C1CCN2C1CCC2 MCULE-4507826088 [0,0,0,1,0,0|3,0,0]=4 217 B10R2.32 O=C1CCN2C1CCC2 MCULE-7547906890 [0,0,0,1,0,0|3,0,0]=4 218 B10R2.32 O=C1CSC2=NCCN12 MCULE-4492357028 [0,0,0,1,0,0|2,0,0]=3 219 B10R2.32 O=C1CSC2=NCCN12 MCULE-9460576557 [0,0,0,1,0,0|2,0,0]=3 220 B10R2.32 O=C1NN=C2N1CCC2 MCULE-5614237959 [0,0,0,1,0,0|3,0,0]=4 221 B10R1.30 CCC1CC(CCC1=O)C MCULE-9407073298 [0,0,0,0,0,1|2,0,1]=4 222 B10R1.30 CCN1C=C(C=CC1=O)Br MCULE-9423306897 [0,0,0,0,0,1|1,0,2]=4 223 B10R1.30 CCN1C=C(C=CC1=O)N MCULE-6337908725 [0,0,0,0,0,1|1,0,2]=4 224 B10R1.30 CCN1C=C(C=NC1=O)Br MCULE-9675407681 [0,0,0,0,0,1|2,0,1]=4 225 B10R1.30 CCN1C=C(N=CC1=O)Br MCULE-3634793492 [0,0,0,0,0,1|2,0,1]=4 226 B10R1.30 CCN1CC(CNC1=O)O MCULE-6464229406 [0,0,0,0,0,1|1,0,2]=4 227 B10R1.30 CCN1CC(NCC1=O)C MCULE-3972540043 [0,0,0,0,0,1|2,0,1]=4 228 B10R1.30 CCN1CC(NCC1=O)C MCULE-6088392849 [0,0,0,0,0,1|2,0,1]=4 229 B10R1.30 CCN1C[C@@H](NCC1=O)C MCULE-1491947673 [0,0,0,0,0,1|2,0,1]=4 230 B10R1.30 CCN1C[C@@H](NCC1=O)C MCULE-4517712810 [0,0,0,0,0,1|2,0,1]=4 231 B10R1.30 CCN1C[C@@H](NCC1=O)C MCULE-7978522317 [0,0,0,0,0,1|2,0,1]=4 232 B10R1.30 CCN1C[C@@H](NCC1=O)C MCULE-8806764849 [0,0,0,0,0,1|2,0,1]=4 233 B10R1.30 CCN1C[C@H](NCC1=O)C MCULE-3042321047 [0,0,0,0,0,1|2,0,1]=4 234 B10R1.30 CCN1C[C@H](NCC1=O)C MCULE-3582790333 [0,0,0,0,0,1|2,0,1]=4 235 B10R1.30 CCN1C[C@H](NCC1=O)C MCULE-6049661879 [0,0,0,0,0,1|2,0,1]=4 236 B10R1.30 CCN1N=C(C=CC1=O)Br MCULE-5898175178 [0,0,0,0,0,1|1,0,2]=4 237 B10R1.30 CCN1N=C(C=CC1=O)Cl MCULE-7512456276 [0,0,0,0,0,1|1,0,2]=4 238 B10R1.30 CC[C@@H]1NC(=O)CNC1=O MCULE-4523744319 [0,0,0,0,0,1|2,0,0]=3 239 B10R1.30 O=C1CNC(=O)C(N1)CO MCULE-6601689011 [0,0,0,0,0,1|3,0,0]=4 240 B10R1.30 O=C1CNC(=O)[C@@H](N1)CO MCULE-1937112846 [0,0,0,0,0,1|3,0,0]=4 241 B10R1.30 O=C1CNC(=O)[C@@H](N1)CO MCULE-7896009458 [0,0,0,0,0,1|3,0,0]=4 242 B10R1.245 CCC1C(=O)CCCC1=O MCULE-2763743652 [0,0,0,0,0,1|1,0,0]=2 243 B10R1.245 CCN1C(=O)C=CC=C1Br MCULE-7606546462 [0,0,0,0,0,1|1,0,2]=4 244 B10R1.245 CCN1C(=O)CNCC1=O MCULE-4359668565 [0,0,0,0,0,1|0,0,0]=1 245 B10R1.245 CCN1C(=O)CNCC1=O MCULE-7137901469 [0,0,0,0,0,1|0,0,0]=1 246 B10R1.245 N#CC1C(=O)CCCC1=O MCULE-3717660972 [0,0,0,0,0,1|2,0,1]=4 247 B10R1.245 N#CC1C(=O)CCNC1=O MCULE-5177321264 [0,0,0,0,0,1|2,0,1]=4 248 B10R1.245 NC=C1C(=O)CCCC1=O MCULE-9251952276 [0,0,0,0,0,1|2,0,1]=4 249 B10R1.245 NC=C1C(=O)CCOC1=O MCULE-5326001554 [0,0,0,0,0,1|2,0,1]=4 250 B7R0.1 C=CCCCNCC MCULE-2141378110 [1,0,1,0,0,0|1,0,1]=4 251 B7R0.1 C=CCCCNCC MCULE-4269657694 [1,0,1,0,0,0|1,0,1]=4 252 B7R0.1 CC/C=C\CCC=O MCULE-5862165111 [1,0,1,0,0,0|1,0,0]=3 253 B7R0.1 CCC=CCCC=O MCULE-1386777548 [1,0,1,0,0,0|1,0,0]=3 254 B7R0.1 CCCCCCC=O MCULE-5251820425 [1,0,1,0,0,0|1,0,1]=4 255 B7R0.3 C=CCCC(=O)CBr MCULE-8443541398 [1,0,1,0,0,0|2,0,0]=4 256 B7R0.3 C=CCCC(=O)CC MCULE-7933484898 [1,0,1,0,0,0|1,0,0]=3 257 B7R0.3 C=CCCC(=O)CCl MCULE-4669619111 [1,0,1,0,0,0|2,0,0]=4 258 B7R0.3 C=CCCC(=O)NC MCULE-9859680580 [1,0,1,0,0,0|1,0,0]=3 259 B7R0.3 C=CCCC(=O)NN MCULE-1170308182 [1,0,1,0,0,0|2,0,0]=4 260 B7R0.3 C=CCCC(=O)OC MCULE-8671478952 [1,0,1,0,0,0|2,0,0]=4 261 B7R0.3 CCC(=O)/C=C/C=O MCULE-5654548275 [1,0,1,0,0,0|0,0,2]=4 262 B7R0.3 CCC(=O)C=CC=O MCULE-8246295239 [1,0,1,0,0,0|0,0,2]=4 263 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [1,0,1,0,0,0|1,0,1]=4 264 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [1,0,1,0,0,0|1,0,1]=4 265 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [1,0,1,0,0,0|1,0,1]=4 266 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [1,0,1,0,0,0|1,0,1]=4 267 B7R0.3 CNC(=O)CCCCl MCULE-9460684794 [1,0,1,0,0,0|1,0,1]=4 268 B7R0.3 CNC(=O)CCCN MCULE-4766031038 [1,0,1,0,0,0|1,0,1]=4 269 B7R0.3 CNC(=O)CCCN MCULE-8992476653 [1,0,1,0,0,0|1,0,1]=4 270 B7R0.3 CNC(=O)CCCO MCULE-2592655912 [1,0,1,0,0,0|0,0,2]=4 271 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [1,0,1,0,0,0|2,0,0]=4 272 B7R0.3 CNCCC(=O)NC MCULE-1793457920 [1,0,1,0,0,0|2,0,0]=4 273 B7R0.3 CNCCC(=O)NC MCULE-7089073664 [1,0,1,0,0,0|2,0,0]=4 274 B7R0.3 COC(=O)CCC=O MCULE-2572188002 [1,0,1,0,0,0|1,0,0]=3 275 B7R0.3 COC(=O)CNC=O MCULE-1485317532 [1,0,1,0,0,0|2,0,0]=4 276 B7R0.7 C=CCC(=O)OCC MCULE-2006542536 [1,0,1,0,0,0|1,0,1]=4 277 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [1,0,1,0,0,0|1,0,1]=4 278 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [1,0,1,0,0,0|1,0,1]=4 279 B7R0.7 CCNC(=O)CC#N MCULE-4756290560 [1,0,1,0,0,0|1,0,1]=4 280 B7R0.7 CCNC(=O)CCCl MCULE-3246776319 [1,0,1,0,0,0|1,0,0]=3 281 B7R0.7 CCNC(=O)CCN MCULE-2856252531 [1,0,1,0,0,0|1,0,0]=3 282 B7R0.7 CCNC(=O)CCN MCULE-3929666209 [1,0,1,0,0,0|1,0,0]=3 283 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [1,0,1,0,0,0|0,0,1]=3 284 B7R0.7 CCNC(=O)CNC MCULE-1939824251 [1,0,1,0,0,0|1,0,1]=4 285 B7R0.7 CCNC(=O)CNC MCULE-2815515396 [1,0,1,0,0,0|1,0,1]=4 286 B7R0.7 CCNC(=O)NCC MCULE-2253571388 [1,0,1,0,0,0|1,0,1]=4 287 B7R0.7 CCNC(=O)OCC MCULE-3910060770 [1,0,1,0,0,0|1,0,1]=4 288 B7R0.7 CCOC(=O)CC=O MCULE-5042552247 [1,0,1,0,0,0|1,0,0]=3 289 B7R0.7 CCOC(=O)CCBr MCULE-1898467026 [1,0,1,0,0,0|2,0,0]=4 290 B7R0.7 CCOC(=O)CCCl MCULE-2623656770 [1,0,1,0,0,0|2,0,0]=4 291 B7R0.7 CCOC(=O)CCI MCULE-9651397551 [1,0,1,0,0,0|2,0,0]=4 292 B7R0.7 CCOC(=O)CCN MCULE-4383008445 [1,0,1,0,0,0|2,0,0]=4 293 B7R0.7 CCOC(=O)CCN MCULE-6873709061 [1,0,1,0,0,0|2,0,0]=4 294 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [1,0,1,0,0,0|1,0,1]=4 295 B7R0.7 CCOC(=O)CCS MCULE-3955367746 [1,0,1,0,0,0|1,1,0]=4 296 B7R0.7 CCOC(=O)[CH-]C=O MCULE-1944484299 [1,0,1,0,0,0|1,0,1]=4 297 B7R0.7 CCOC(=O)[CH-]C=O MCULE-5022028224 [1,0,1,0,0,0|1,0,1]=4 298 B7R0.15 CC=C(CC)C(=O)O MCULE-9303879981 [1,0,1,0,0,0|2,0,0]=4 299 B7R0.15 CCC(CC)C(=O)C MCULE-5291760485 [1,0,1,0,0,0|1,0,1]=4 300 B7R0.15 CCN(CC)C(=O)C MCULE-6584128098 [1,0,1,0,0,0|0,0,1]=3 301 B7R0.15 CCN(CC)C(=O)Cl MCULE-2162985195 [1,0,1,0,0,0|1,0,1]=4 302 B7R0.15 CCN(CC)C(=O)N MCULE-7011051295 [1,0,1,0,0,0|1,0,1]=4 303 B7R0.15 CCN(N=O)C(=O)N MCULE-1587704958 [1,0,1,0,0,0|2,0,0]=4 304 B7R0.16 C=C(C)C(C)C(=O)C MCULE-2480790812 [1,0,1,0,0,0|2,0,0]=4 305 B7R0.16 CC(=O)C(=C(C)[O-])C MCULE-1358390281 [1,0,1,0,0,0|1,0,1]=4 306 B7R0.16 CC(=O)C(=C(C)[O-])C MCULE-6098819264 [1,0,1,0,0,0|1,0,1]=4 307 B7R0.16 CC(=O)C(Br)C(=O)C MCULE-2980550700 [1,0,1,0,0,0|2,0,0]=4 308 B7R0.16 CC(=O)C(C)C(=O)C MCULE-9607259412 [1,0,1,0,0,0|1,0,0]=3 309 B7R0.16 CC(=O)C(Cl)C(=O)C MCULE-4716617423 [1,0,1,0,0,0|2,0,0]=4 310 B7R0.16 CC(=O)C(F)C(=O)C MCULE-4665621902 [1,0,1,0,0,0|2,0,0]=4 311 B7R0.16 CC(=O)C(N)C(=O)C MCULE-6440496769 [1,0,1,0,0,0|2,0,0]=4 312 B7R0.16 CC(=O)C(N)C(=O)C MCULE-8525737264 [1,0,1,0,0,0|2,0,0]=4 313 B7R0.16 CC(=O)N(C)C(=O)C MCULE-6245493539 [1,0,1,0,0,0|0,0,0]=2 314 B7R0.16 CN(C(=O)Cl)C(=O)Cl MCULE-8169088410 [1,0,1,0,0,0|2,0,0]=4 315 B7R0.10 C=C(CC)C(=O)OC MCULE-2064145693 [1,0,1,0,0,0|2,0,0]=4 316 B7R0.10 CCC(=O)C(=O)CC MCULE-4346857339 [1,0,1,0,0,0|1,0,0]=3 317 B7R0.10 CCC(=O)C(=O)OC MCULE-6526576267 [1,0,1,0,0,0|2,0,0]=4 318 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [1,0,1,0,0,0|1,0,1]=4 319 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [1,0,1,0,0,0|0,0,1]=3 320 B7R0.10 CCC(=O)N(C)OC MCULE-7450696534 [1,0,1,0,0,0|1,0,1]=4 321 B7R0.10 CCN(C)C(=O)CBr MCULE-4444194334 [1,0,1,0,0,0|1,0,1]=4 322 B7R0.10 CCN(C)C(=O)CCl MCULE-7762522604 [1,0,1,0,0,0|1,0,1]=4 323 B7R0.10 COC(=O)C(C)C=O MCULE-8461987901 [1,0,1,0,0,0|2,0,0]=4 324 B7R0.10 COC(=O)[C@H](C)C=O MCULE-9841785503 [1,0,1,0,0,0|2,0,0]=4 325 B7R1.1 CCC1=CCCC1 MCULE-5154730597 [2,0,0,0,0,0|1,0,1]=4 326 B7R1.1 CCN1C=CC=C1 MCULE-7636090544 [2,0,0,0,0,0|0,0,2]=4 327 B7R1.1 CCN1C=CN=C1 MCULE-1925854308 [2,0,0,0,0,0|1,0,1]=4 328 B7R1.1 CCN1CCCC1 MCULE-3590039255 [2,0,0,0,0,0|0,0,2]=4 329 B7R1.4 CC1=CCCC1=O MCULE-3713655264 [2,0,0,0,0,0|1,0,0]=3 330 B7R1.4 CC1=CCOC1=O MCULE-9785490540 [2,0,0,0,0,0|2,0,0]=4 331 B7R1.4 CC1CCCC1=O MCULE-3710290162 [2,0,0,0,0,0|1,0,1]=4 332 B7R1.4 CC1NCCC1=O MCULE-4206844406 [2,0,0,0,0,0|2,0,0]=4 333 B7R1.4 CC1NCCC1=O MCULE-7025918222 [2,0,0,0,0,0|2,0,0]=4 334 B7R1.4 CC1OCCC1=O MCULE-8278816952 [2,0,0,0,0,0|2,0,0]=4 335 B7R1.4 CC1SCCC1=O MCULE-5264322365 [2,0,0,0,0,0|2,0,0]=4 336 B7R1.4 CN1C=CNC1=O MCULE-9198950029 [2,0,0,0,0,0|1,0,1]=4 337 B7R1.4 CN1C=NNC1=O MCULE-2122203722 [2,0,0,0,0,0|2,0,0]=4 338 B7R1.4 CN1CCCC1=O MCULE-1381506705 [2,0,0,0,0,0|0,0,1]=3 339 B7R1.4 CN1CCCC1=S MCULE-1990879544 [2,0,0,0,0,0|0,1,1]=4 340 B7R1.4 CN1CCNC1=O MCULE-9774864412 [2,0,0,0,0,0|1,0,1]=4 341 B7R1.4 CN1CCOC1=O MCULE-7467321799 [2,0,0,0,0,0|1,0,1]=4 342 B7R1.4 CN1CNCC1=O MCULE-2252466841 [2,0,0,0,0,0|1,0,1]=4 343 B7R1.4 CN1N=CCC1=O MCULE-2362806196 [2,0,0,0,0,0|1,0,1]=4 344 B7R1.4 NN1CCCC1=O MCULE-2994786381 [2,0,0,0,0,0|1,0,1]=4 345 B7R1.4 NN1CCCC1=O MCULE-5599329775 [2,0,0,0,0,0|1,0,1]=4 346 B7R1.4 O=C1CCC=C1Br MCULE-1509582125 [2,0,0,0,0,0|2,0,0]=4 347 B7R1.4 O=C1CCC=C1I MCULE-2710048446 [2,0,0,0,0,0|2,0,0]=4 348 B7R1.4 O=C1CCC=C1O MCULE-8745661989 [2,0,0,0,0,0|2,0,0]=4 349 B7R1.2 C=C1CCC(=O)O1 MCULE-2485348963 [2,0,0,0,0,0|2,0,0]=4 350 B7R1.2 CC1=CC(=O)CC1 MCULE-5496838191 [2,0,0,0,0,0|2,0,0]=4 351 B7R1.2 CC1CCC(=O)N1 MCULE-8928464449 [2,0,0,0,0,0|1,0,1]=4 352 B7R1.2 CC1CCC(=O)N1 MCULE-9236321365 [2,0,0,0,0,0|1,0,1]=4 353 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-2915942259 [2,0,0,0,0,0|1,0,1]=4 354 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-8123247569 [2,0,0,0,0,0|1,0,1]=4 355 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-2618122031 [2,0,0,0,0,0|1,0,1]=4 356 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-6630066118 [2,0,0,0,0,0|1,0,1]=4 357 B7R1.2 N=C1CSC(=O)N1 MCULE-9647262906 [2,0,0,0,0,0|2,0,0]=4 358 B7R1.2 NC1=CC(=O)CC1 MCULE-9465243079 [2,0,0,0,0,0|2,0,0]=4 359 B7R1.2 NC1=NCC(=O)N1 MCULE-7816305365 [2,0,0,0,0,0|2,0,0]=4 360 B7R1.2 NC1=NCC(=O)N1 MCULE-9546104284 [2,0,0,0,0,0|2,0,0]=4 361 B7R1.2 NC1CCC(=O)N1 MCULE-1843033026 [2,0,0,0,0,0|1,0,1]=4 362 B7R1.2 NC1CCC(=O)N1 MCULE-7671057220 [2,0,0,0,0,0|1,0,1]=4 363 B7R1.2 O=C1C=C(CC1)Br MCULE-8421005141 [2,0,0,0,0,0|2,0,0]=4 364 B7R1.2 O=C1C=C(CC1)Cl MCULE-4481059890 [2,0,0,0,0,0|2,0,0]=4 365 B7R1.2 O=C1C=C(CC1)I MCULE-9887353763 [2,0,0,0,0,0|2,0,0]=4 366 B7R1.2 O=C1C=C(CC1)O MCULE-4815747510 [2,0,0,0,0,0|1,0,1]=4 367 B7R1.2 O=C1C=CC(=O)N1 MCULE-3677915339 [2,0,0,0,0,0|0,0,2]=4 368 B7R1.2 O=C1CCC(=O)C1 MCULE-6436831689 [2,0,0,0,0,0|1,0,0]=3 369 B7R1.2 O=C1CCC(=O)N1 MCULE-8278049979 [2,0,0,0,0,0|0,0,0]=2 370 B7R1.2 O=C1CCC(=O)O1 MCULE-1458819618 [2,0,0,0,0,0|1,0,0]=3 371 B7R1.2 O=C1CCC(N1)O MCULE-1790956080 [2,0,0,0,0,0|0,0,2]=4 372 B7R1.2 O=C1CNC(=O)C1 MCULE-6981924013 [2,0,0,0,0,0|2,0,0]=4 373 B7R1.2 O=C1CNC(=O)N1 MCULE-6812812243 [2,0,0,0,0,0|1,0,0]=3 374 B7R1.2 O=C1CNC(=O)O1 MCULE-7702120642 [2,0,0,0,0,0|2,0,0]=4 375 B7R1.2 O=C1CNC(=O)S1 MCULE-5050685903 [2,0,0,0,0,0|2,0,0]=4 376 B7R1.2 O=C1CNC(=S)N1 MCULE-3766479597 [2,0,0,0,0,0|1,1,0]=4 377 B7R1.2 O=C1COC(=O)C1 MCULE-3258090872 [2,0,0,0,0,0|2,0,0]=4 378 B7R1.2 O=C1COC(=O)N1 MCULE-3103815953 [2,0,0,0,0,0|1,0,0]=3 379 B7R1.2 O=C1COC(=O)[N-]1 MCULE-2786348217 [2,0,0,0,0,0|1,0,1]=4 380 B7R1.2 O=C1CSC(=O)N1 MCULE-8206580994 [2,0,0,0,0,0|1,0,0]=3 381 B7R1.2 O=C1CSC(=S)N1 MCULE-8840169234 [2,0,0,0,0,0|1,1,0]=4 382 B7R1.2 O=C1NC(=S)CS1 MCULE-8601205978 [2,0,0,0,0,0|1,1,0]=4 383 B7R1.2 O=C1NCC(=S)N1 MCULE-9753398150 [2,0,0,0,0,0|1,1,0]=4 384 B7R1.2 O=C1NNC(=O)N1 MCULE-5611157961 [2,0,0,0,0,0|2,0,0]=4 385 B7R1.2 O=C1NOC(=O)N1 MCULE-5599103299 [2,0,0,0,0,0|2,0,0]=4 386 B7R1.2 S=C1CCC(=S)N1 MCULE-1793012495 [2,0,0,0,0,0|0,2,0]=4 387 B9R0.4 C=CCNC(=O)NC(C)C MCULE-2756129340 [0,1,1,0,0,0|2,0,0]=4 388 B9R0.4 CNCCC(=O)NC(C)C MCULE-4794185618 [0,1,1,0,0,0|2,0,0]=4 389 B9R0.5 C#CCCNC(=O)NCC MCULE-6606583907 [0,1,1,0,0,0|1,0,1]=4 390 B9R0.5 C=CCCCC(=O)OCC MCULE-6747714335 [0,1,1,0,0,0|2,0,0]=4 391 B9R0.5 C=CCNCC(=O)OCC MCULE-2486419841 [0,1,1,0,0,0|2,0,0]=4 392 B9R0.5 C=CCOCC(=O)OCC MCULE-4979218308 [0,1,1,0,0,0|2,0,0]=4 393 B9R0.5 CCCCNC(=O)NCC MCULE-3629972521 [0,1,1,0,0,0|1,0,1]=4 394 B9R0.5 CCNC(=O)CCCCO MCULE-9325293372 [0,1,1,0,0,0|0,0,2]=4 395 B9R0.5 CCNC(=O)NCCCO MCULE-9582031605 [0,1,1,0,0,0|0,0,2]=4 396 B9R0.5 CCNCCC(=O)NCC MCULE-6441681901 [0,1,1,0,0,0|1,0,1]=4 397 B9R0.5 CCOC(=O)CCCC=O MCULE-3082074155 [0,1,1,0,0,0|1,0,0]=3 398 B9R0.5 CCOC(=O)CCN=C=O MCULE-3031378141 [0,1,1,0,0,0|1,0,1]=4 399 B9R0.5 CCOC(=O)OCNC=O MCULE-6299742526 [0,1,1,0,0,0|2,0,0]=4 400 B9R0.18 C#CCCC(=O)NCCN MCULE-4146121128 [0,1,1,0,0,0|1,0,1]=4 401 B9R0.18 C=CCNC(=O)NCCC MCULE-8298491756 [0,1,1,0,0,0|2,0,0]=4 402 B9R0.18 C=CCOC(=O)NCCBr MCULE-6576440406 [0,1,1,0,0,0|2,0,0]=4 403 B9R0.18 C=CCOC(=O)NCCN MCULE-6421369037 [0,1,1,0,0,0|2,0,0]=4 404 B9R0.18 C=CCOC(=O)NCCN MCULE-6961623399 [0,1,1,0,0,0|2,0,0]=4 405 B9R0.18 C=CCOC(=O)NCCO MCULE-4702516756 [0,1,1,0,0,0|2,0,0]=4 406 B9R0.18 C=CCOC(=O)NNCC MCULE-4151293991 [0,1,1,0,0,0|2,0,0]=4 407 B9R0.18 CCCNC(=O)CCCCl MCULE-1473811039 [0,1,1,0,0,0|1,0,1]=4 408 B9R0.18 O=C(CCCO)NCCO MCULE-3037964082 [0,1,1,0,0,0|0,0,2]=4 409 B9R0.34 C=CC(O)CC(=O)OCC MCULE-2209401732 [0,1,1,0,0,0|2,0,0]=4 410 B9R0.34 CCOC(=O)CC(Br)C=O MCULE-2487819242 [0,1,1,0,0,0|1,0,0]=3 411 B9R0.35 C=CCC(C)C(=O)OCC MCULE-9095443034 [0,1,1,0,0,0|2,0,0]=4 412 B9R0.35 C=CCC(N)C(=O)OCC MCULE-6988577150 [0,1,1,0,0,0|2,0,0]=4 413 B9R0.35 C=CCC(N)C(=O)OCC MCULE-9307872655 [0,1,1,0,0,0|2,0,0]=4 414 B9R0.35 C=CCC(O)C(=O)OCC MCULE-8778592130 [0,1,1,0,0,0|2,0,0]=4 415 B9R0.35 C=CC[C@@H](N)C(=O)OCC MCULE-3595098101 [0,1,1,0,0,0|2,0,0]=4 416 B9R0.35 C=CC[C@@H](N)C(=O)OCC MCULE-5727134719 [0,1,1,0,0,0|2,0,0]=4 417 B9R0.35 C=CC[C@@H](N)C(=O)OCC MCULE-5878141476 [0,1,1,0,0,0|2,0,0]=4 418 B9R0.35 C=CC[C@@H](N)C(=O)OCC MCULE-8963760852 [0,1,1,0,0,0|2,0,0]=4 419 B9R0.35 C=CC[C@H](N)C(=O)OCC MCULE-1611787862 [0,1,1,0,0,0|2,0,0]=4 420 B9R0.35 C=CC[C@H](N)C(=O)OCC MCULE-2812687218 [0,1,1,0,0,0|2,0,0]=4 421 B9R0.35 C=CC[C@H](N)C(=O)OCC MCULE-7811335758 [0,1,1,0,0,0|2,0,0]=4 422 B9R0.35 C=CC[C@H](N)C(=O)OCC MCULE-9759543265 [0,1,1,0,0,0|2,0,0]=4 423 B9R0.48 C=C(C)CCC(=O)OCC MCULE-1518145690 [0,1,1,0,0,0|2,0,0]=4 424 B9R0.48 CCCC(=O)CCC(=O)C MCULE-2562578971 [0,1,1,0,0,0|1,0,0]=3 425 B9R0.48 CCCC(=O)CCC(=O)O MCULE-4809633073 [0,1,1,0,0,0|1,0,0]=3 426 B9R0.48 CCCC(=O)NCC(=O)N MCULE-4903049688 [0,1,1,0,0,0|2,0,0]=4 427 B9R0.48 CCCC(=O)NCC(=O)O MCULE-1331310812 [0,1,1,0,0,0|2,0,0]=4 428 B9R0.48 CCNC(=O)C=CC(=O)O MCULE-3469131343 [0,1,1,0,0,0|0,0,2]=4 429 B9R0.48 CCNC(=O)CCC(=O)O MCULE-1979773964 [0,1,1,0,0,0|0,0,0]=2 430 B9R0.48 CCNC(=S)NCC(=O)O MCULE-3996581742 [0,1,1,0,0,0|1,1,0]=4 431 B9R0.48 CCOC(=O)CCC(=N)N MCULE-2941069504 [0,1,1,0,0,0|2,0,0]=4 432 B9R0.48 CCOC(=O)CCC(=O)C MCULE-1970388037 [0,1,1,0,0,0|1,0,0]=3 433 B9R0.48 CCOC(=O)CCC(=O)Cl MCULE-6113832364 [0,1,1,0,0,0|1,0,0]=3 434 B9R0.48 CCOC(=O)CCC(=O)N MCULE-4243878001 [0,1,1,0,0,0|1,0,0]=3 435 B9R0.48 CCOC(=O)CCC(=O)O MCULE-4329005000 [0,1,1,0,0,0|1,0,0]=3 436 B9R0.48 CCOC(=O)CCN(=O)=O MCULE-9024039721 [0,1,1,0,0,0|2,0,0]=4 437 B9R0.48 CCOC(=O)CNC(=O)C MCULE-3012556062 [0,1,1,0,0,0|2,0,0]=4 438 B9R0.48 CCOC(=O)CNC(=O)N MCULE-5545074396 [0,1,1,0,0,0|2,0,0]=4 439 B9R0.48 CCOC(=O)COC(=O)C MCULE-1796111350 [0,1,1,0,0,0|2,0,0]=4 440 B9R0.48 CCOC(=O)NCC(=O)O MCULE-6050328577 [0,1,1,0,0,0|2,0,0]=4 441 B9R0.29 CCC(C(=O)C)C(=O)OC MCULE-2050786752 [0,1,1,0,0,0|1,0,0]=3 442 B9R0.29 CCC(C(=O)O)C(=O)OC MCULE-1272120302 [0,1,1,0,0,0|2,0,0]=4 443 B9R0.29 COC(=O)C(OC)C(=O)C MCULE-5204145117 [0,1,1,0,0,0|2,0,0]=4 444 B9R0.33 C#CCC(C(=O)C)C(=O)C MCULE-5068651003 [0,1,1,0,0,0|1,0,1]=4 445 B9R0.54 CC(=O)C(C(=O)C)C(=O)C MCULE-5925324831 [0,1,1,0,0,0|1,0,1]=4 446 B9R0.54 CC(=O)N(C(C)C)C(C)C MCULE-9024194815 [0,1,1,0,0,0|1,0,1]=4 447 B9R0.37 CCCC(=O)N(CC)CC MCULE-7978944732 [0,1,1,0,0,0|1,0,1]=4 448 B9R0.37 CCN(CC)C(=O)CCCl MCULE-9985882525 [0,1,1,0,0,0|1,0,1]=4 449 B9R0.37 CCN(CC)C(=O)CCN MCULE-4753515103 [0,1,1,0,0,0|1,0,1]=4 450 B9R0.37 CCN(CC)C(=O)CCN MCULE-7096196257 [0,1,1,0,0,0|1,0,1]=4 451 B9R0.37 CCN(CC)C(=O)CNC MCULE-7519968123 [0,1,1,0,0,0|1,0,1]=4 452 B9R0.37 CCN(CC)C(=O)CNC MCULE-8059709675 [0,1,1,0,0,0|1,0,1]=4 453 B9R0.37 CCNC(=O)N(CC)CC MCULE-9047365342 [0,1,1,0,0,0|1,0,1]=4 454 B9R0.37 CCOC(=O)C(C=O)CC MCULE-3620581208 [0,1,1,0,0,0|1,0,0]=3 455 B9R0.37 CCOC(=O)N(CC)CC MCULE-9734341294 [0,1,1,0,0,0|1,0,1]=4 456 B9R0.41 CCN(CC)C(=O)C(C)Br MCULE-8832629522 [0,1,1,0,0,0|1,0,1]=4 457 B9R0.41 CCN(CC)C(=O)C(C)Cl MCULE-5016234064 [0,1,1,0,0,0|1,0,1]=4 458 B9R0.41 CCN(CC)C(=O)C(C)N MCULE-7348257966 [0,1,1,0,0,0|1,0,1]=4 459 B9R0.41 CCN(CC)C(=O)C(C)N MCULE-8280475654 [0,1,1,0,0,0|1,0,1]=4 460 B9R1.14 CCN1C=CC=C1C=O MCULE-8123073528 [1,1,0,0,0,0|0,0,2]=4 461 B9R1.14 CCN1C=CN=C1C=O MCULE-8093493884 [1,1,0,0,0,0|1,0,1]=4 462 B9R1.14 CCN1C=NC=C1C=O MCULE-8161647894 [1,1,0,0,0,0|1,0,1]=4 463 B9R1.14 CCN1C=NC=C1C=O MCULE-9726886265 [1,1,0,0,0,0|1,0,1]=4 464 B9R1.22 CCN1CC(CC1=O)N MCULE-3399064439 [1,1,0,0,0,0|0,0,1]=3 465 B9R1.22 CCN1CC(CC1=O)N MCULE-9447237222 [1,1,0,0,0,0|0,0,1]=3 466 B9R1.22 CCN1CC(CC1=O)O MCULE-3389024209 [1,1,0,0,0,0|0,0,1]=3 467 B9R1.22 CCN1C[C@H](CC1=O)O MCULE-9379641102 [1,1,0,0,0,0|0,0,1]=3 468 B9R1.22 CCN1N=C(CC1=O)C MCULE-4203337078 [1,1,0,0,0,0|1,0,1]=4 469 B9R1.22 O=C1CC(C=C1CO)O MCULE-4093197577 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.22 O=C1C[C@H](C=C1CO)O MCULE-3115775063 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.24 CCN1CCCS1(=O)=O MCULE-6506577756 [1,1,0,0,0,0|1,0,1]=4 472 B9R1.33 C#CCN1CCCC1=O MCULE-2593192702 [1,1,0,0,0,0|0,0,2]=4 473 B9R1.33 C=CCN1CCCC1=O MCULE-5813823289 [1,1,0,0,0,0|0,0,2]=4 474 B9R1.33 CCCC1CCCC1=O MCULE-6186440440 [1,1,0,0,0,0|1,0,1]=4 475 B9R1.33 CCCN1CCCC1=O MCULE-4645322719 [1,1,0,0,0,0|0,0,1]=3 476 B9R1.33 CCOC1CCCC1=O MCULE-2011374486 [1,1,0,0,0,0|1,0,1]=4 477 B9R1.33 COCC1CCCC1=O MCULE-9169493233 [1,1,0,0,0,0|1,0,1]=4 478 B9R1.33 N#CCN1CCCC1=O MCULE-7806752058 [1,1,0,0,0,0|0,0,2]=4 479 B9R1.33 NCCN1CCCC1=O MCULE-4385413489 [1,1,0,0,0,0|0,0,1]=3 480 B9R1.33 NCCN1CCCC1=O MCULE-6558299461 [1,1,0,0,0,0|0,0,1]=3 481 B9R1.33 NCCN1CCCC1=O MCULE-8578984383 [1,1,0,0,0,0|0,0,1]=3 482 B9R1.33 NCCN1CCNC1=O MCULE-8206548892 [1,1,0,0,0,0|1,0,1]=4 483 B9R1.33 NCCN1CCOC1=O MCULE-2249111154 [1,1,0,0,0,0|1,0,1]=4 484 B9R1.33 NCCN1CCOC1=O MCULE-5564763400 [1,1,0,0,0,0|1,0,1]=4 485 B9R1.33 O=C1CCCC1CCBr MCULE-3436975742 [1,1,0,0,0,0|1,0,1]=4 486 B9R1.33 O=C1CCCC1CCF MCULE-7227991716 [1,1,0,0,0,0|1,0,1]=4 487 B9R1.33 O=C1CCCN1CCBr MCULE-8609405083 [1,1,0,0,0,0|0,0,1]=3 488 B9R1.33 O=C1CCCN1CCCl MCULE-2170579993 [1,1,0,0,0,0|0,0,1]=3 489 B9R1.33 O=C1CCCN1CCI MCULE-5597930583 [1,1,0,0,0,0|0,0,1]=3 490 B9R1.33 O=C1CCCN1CCO MCULE-7117687978 [1,1,0,0,0,0|0,0,1]=3 491 B9R1.33 O=C1NC=CN1CCCl MCULE-5294942602 [1,1,0,0,0,0|1,0,1]=4 492 B9R1.33 O=C1NCCN1CCBr MCULE-8311634228 [1,1,0,0,0,0|1,0,1]=4 493 B9R1.33 O=C1NCCN1CCCl MCULE-8605766746 [1,1,0,0,0,0|1,0,1]=4 494 B9R1.33 O=C1NCCN1CCO MCULE-9247043792 [1,1,0,0,0,0|1,0,1]=4 495 B9R1.33 O=C1OCCN1CCBr MCULE-7101781971 [1,1,0,0,0,0|1,0,1]=4 496 B9R1.33 O=C1OCCN1CCCl MCULE-4112525203 [1,1,0,0,0,0|1,0,1]=4 497 B9R1.33 O=C1OCCN1CCO MCULE-9126918441 [1,1,0,0,0,0|1,0,1]=4 498 B9R1.41 CC(=O)N1CCCC1=O MCULE-3328735907 [1,1,0,0,0,0|0,0,2]=4 499 B9R1.41 CC(C)C1CCCC1=O MCULE-5590026729 [1,1,0,0,0,0|1,0,1]=4 500 B9R1.41 CC(C)N1CCCC1=O MCULE-9119033242 [1,1,0,0,0,0|0,0,1]=3 501 B9R1.41 CC(C)N1CCNC1=O MCULE-1546837295 [1,1,0,0,0,0|1,0,1]=4 502 B9R1.41 CC(C)N1CCOC1=O MCULE-9080716253 [1,1,0,0,0,0|1,0,1]=4 503 B9R1.132 CCN1CCC(=O)C1=O MCULE-7001636786 [1,1,0,0,0,0|0,0,2]=4 504 B9R1.132 CCN1CCC(C1=O)Br MCULE-9719570091 [1,1,0,0,0,0|0,0,1]=3 505 B9R1.132 CCN1CCC(C1=O)N MCULE-1999772787 [1,1,0,0,0,0|0,0,1]=3 506 B9R1.132 CCN1CCC(C1=O)N MCULE-9509776424 [1,1,0,0,0,0|0,0,1]=3 507 B9R1.132 CCN1OCC(C1=O)Br MCULE-8718196879 [1,1,0,0,0,0|1,0,0]=3 508 B9R1.132 CCN1OCC(C1=O)N MCULE-4385152972 [1,1,0,0,0,0|1,0,0]=3 509 B9R1.132 CCN1OCC(C1=O)N MCULE-5812509331 [1,1,0,0,0,0|1,0,0]=3 510 B9R1.132 CCN1OC[C@H](C1=O)N MCULE-7401475648 [1,1,0,0,0,0|1,0,0]=3 511 B9R1.132 CCN1OC[C@H](C1=O)N MCULE-9638386857 [1,1,0,0,0,0|1,0,0]=3 512 B9R1.132 CON1CCC(C1=O)Br MCULE-3657650268 [1,1,0,0,0,0|1,0,1]=4 513 B9R1.132 [C@H]1(CON(C1=O)CC)N MCULE-1369814962 [1,1,0,0,0,0|1,0,0]=3 514 B9R1.132 [C@H]1(CON(C1=O)CC)N MCULE-8554978843 [1,1,0,0,0,0|1,0,0]=3 515 B9R1.202 CCC1(CCCC1=O)C MCULE-6845043548 [1,1,0,0,0,0|1,0,1]=4 516 B9R1.37 CC1C(CC(=O)N1C)O MCULE-1269195673 [1,1,0,0,0,0|1,0,1]=4 517 B9R1.37 CC1NC(=O)N(C1=O)C MCULE-9574379568 [1,1,0,0,0,0|1,0,0]=3 518 B9R1.37 CN1C(=O)C=C(C1=O)Br MCULE-6711543006 [1,1,0,0,0,0|0,0,2]=4 519 B9R1.37 CN1C(=O)C=C(C1=O)N MCULE-4181324260 [1,1,0,0,0,0|0,0,2]=4 520 B9R1.37 CN1C(=O)CC(C1=O)N MCULE-1881097860 [1,1,0,0,0,0|0,0,0]=2 521 B9R1.37 CN1C(=O)CC(C1=O)N MCULE-9743249390 [1,1,0,0,0,0|0,0,0]=2 522 B9R1.37 CN1C(=O)CC(C1=O)O MCULE-4159978894 [1,1,0,0,0,0|0,0,0]=2 523 B9R1.37 CN1C(=O)C[C@@H](C1=O)N MCULE-4253353358 [1,1,0,0,0,0|0,0,0]=2 524 B9R1.37 CN1C(=O)C[C@@H](C1=O)N MCULE-8722122900 [1,1,0,0,0,0|0,0,0]=2 525 B9R1.37 CN1C(=O)C[C@@H](C1=O)O MCULE-4702742954 [1,1,0,0,0,0|0,0,0]=2 526 B9R1.37 CN1C(=O)NC(=O)C1=O MCULE-3910177119 [1,1,0,0,0,0|1,0,1]=4 527 B9R1.37 CN1CC(=O)N(C1=N)C MCULE-2819990793 [1,1,0,0,0,0|2,0,0]=4 528 B9R1.37 CN1CC(=O)N(C1=N)C MCULE-5017302963 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.37 CN1CC(=O)N(C1=O)C MCULE-4679697256 [1,1,0,0,0,0|1,0,0]=3 530 B9R1.37 CN1CC(=O)N(C1=O)N MCULE-1002182902 [1,1,0,0,0,0|2,0,0]=4 531 B9R1.37 CN1CC(=O)N(C1=S)C MCULE-4702271205 [1,1,0,0,0,0|1,1,0]=4 532 B9R1.106 CC1(C(=O)CCC1=O)C MCULE-2491276008 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.106 CC1(C(=O)COC1=O)C MCULE-4169378372 [1,1,0,0,0,0|2,0,0]=4 534 B9R1.106 O=C1CCC(=O)C1(F)F MCULE-8671792302 [1,1,0,0,0,0|2,0,0]=4 535 B11R1.8 CCC1NC(=O)CN(C1=O)C MCULE-8400693412 [0,1,0,0,0,1|2,0,0]=4 536 B11R1.72 CCN1C(=O)CCC(C1=O)N MCULE-5438763345 [0,1,0,0,0,1|1,0,1]=4 537 B11R1.167 CC(C)C1NC(=O)CNC1=O MCULE-4291970196 [0,1,0,0,0,1|2,0,0]=4 538 B11R1.167 CC(C)C1NC(=O)CNC1=O MCULE-4390994872 [0,1,0,0,0,1|2,0,0]=4 539 B11R1.167 CC(C)N1CC(CCC1=O)N MCULE-3219576796 [0,1,0,0,0,1|1,0,1]=4 540 B11R1.167 CC(C)[C@@H]1NC(=O)CNC1=O MCULE-8179867886 [0,1,0,0,0,1|2,0,0]=4 541 B11R1.167 CC(C)[C@H]1NC(=O)CNC1=O MCULE-6593694528 [0,1,0,0,0,1|2,0,0]=4 542 B11R1.167 CC(O)C1NC(=O)CNC1=O MCULE-8265308288 [0,1,0,0,0,1|2,0,0]=4 543 B11R1.167 [C@@H]1(NC(=O)CNC1=O)C(C)C MCULE-1212098069 [0,1,0,0,0,1|2,0,0]=4 544 B11R1.167 [C@H]1(NC(=O)CNC1=O)C(C)C MCULE-7643648003 [0,1,0,0,0,1|2,0,0]=4 545 B11R1.182 C=CCN1CC(=O)CCC1=O MCULE-4507934208 [0,1,0,0,0,1|0,0,1]=3 546 B11R1.182 NCCN1NC(=O)C=CC1=O MCULE-7380359618 [0,1,0,0,0,1|0,0,2]=4 547 B11R1.182 NCCN1NC(=O)C=CC1=O MCULE-7634394906 [0,1,0,0,0,1|0,0,2]=4 548 B11R1.156 CC(=O)C1C(=O)CCCC1=O MCULE-5567869384 [0,1,0,0,0,1|1,0,1]=4 549 B11R1.464 CCN1C(=O)C=C(NC1=O)Cl MCULE-2133837307 [0,1,0,0,0,1|0,0,2]=4 550 B11R1.464 CCN1C(=O)CC(=O)NC1=O MCULE-2482375358 [0,1,0,0,0,1|0,0,1]=3 551 B11R1.464 CCN1C(=O)CC(=O)NC1=S MCULE-4994427435 [0,1,0,0,0,1|0,1,1]=4 552 B11R1.605 NCCN1C(=O)CCCC1=O MCULE-1121840225 [0,1,0,0,0,1|0,0,0]=2 553 B11R1.605 NCCN1C(=O)CCCC1=O MCULE-4258204679 [0,1,0,0,0,1|0,0,0]=2 554 B11R1.465 C#CCCN1C(=O)CCC1=O MCULE-5229373560 [0,2,0,0,0,0|0,0,0]=2 555 B11R1.465 CCCCC1=C(CCC1=O)C MCULE-3854801059 [0,2,0,0,0,0|2,0,0]=4 556 B11R1.465 CCCCN1C(=O)C=CC1=O MCULE-3078317428 [0,2,0,0,0,0|0,0,2]=4 557 B11R1.465 CCCCN1C(=O)CNC1=S MCULE-3296839452 [0,2,0,0,0,0|1,1,0]=4 558 B11R1.465 CCCCN1C(=O)CSC1=S MCULE-7167258658 [0,2,0,0,0,0|1,1,0]=4 559 B11R1.465 CNCCN1C(=O)CCC1=O MCULE-4208096159 [0,2,0,0,0,0|0,0,0]=2 560 B11R1.465 CNCCN1C(=O)CCC1=O MCULE-4257805119 [0,2,0,0,0,0|0,0,0]=2 561 B11R1.465 COCCN1C(=O)C=CC1=O MCULE-1248785503 [0,2,0,0,0,0|0,0,2]=4 562 B11R1.465 COCCN1C(=O)CSC1=S MCULE-3050419739 [0,2,0,0,0,0|1,1,0]=4 563 B11R1.465 N#CCCN1C(=O)C=CC1=O MCULE-7794169933 [0,2,0,0,0,0|0,0,2]=4 564 B11R1.465 N#CCCN1C(=O)CSC1=O MCULE-1528294808 [0,2,0,0,0,0|1,0,0]=3 565 B11R1.465 NCCCN1C(=O)C=CC1=O MCULE-3480352309 [0,2,0,0,0,0|0,0,2]=4 566 B11R1.465 NCCCN1C(=O)C=CC1=O MCULE-4151742756 [0,2,0,0,0,0|0,0,2]=4 567 B11R1.465 NCCCN1C(=O)C=CC1=O MCULE-5913994325 [0,2,0,0,0,0|0,0,2]=4 568 B11R1.465 NCCCN1C(=O)CCC1=O MCULE-4086561319 [0,2,0,0,0,0|0,0,0]=2 569 B11R1.465 NCCCN1C(=O)CCC1=O MCULE-8647495086 [0,2,0,0,0,0|0,0,0]=2 570 B11R1.465 NCCCN1C(=O)CNC1=O MCULE-5154629318 [0,2,0,0,0,0|1,0,0]=3 571 B11R1.465 NCCCN1C(=O)CNC1=O MCULE-9326046744 [0,2,0,0,0,0|1,0,0]=3 572 B11R1.465 O=C1C=CC(=O)N1CCCBr MCULE-7903218660 [0,2,0,0,0,0|0,0,2]=4 573 B11R1.465 O=C1C=CC(=O)N1CCCO MCULE-7505082119 [0,2,0,0,0,0|0,0,2]=4 574 B11R1.465 O=C1CCC(=O)N1CCCBr MCULE-2309121474 [0,2,0,0,0,0|0,0,0]=2 575 B11R1.465 O=C1CCC(=O)N1CCCCl MCULE-9330606331 [0,2,0,0,0,0|0,0,0]=2 576 B11R1.465 O=C1CCC(=O)N1CCCO MCULE-8213368726 [0,2,0,0,0,0|0,0,0]=2 577 B11R1.465 O=C1CNC(=O)N1CCCCl MCULE-7557632634 [0,2,0,0,0,0|1,0,0]=3 578 B11R1.465 O=C1CNC(=O)N1CCCO MCULE-1633589910 [0,2,0,0,0,0|1,0,0]=3 579 B11R1.495 C=C(C)CN1C(=O)CCC1=O MCULE-4012779604 [0,2,0,0,0,0|0,0,0]=2 580 B11R1.495 C=C(C)CN1C(=O)CSC1=O MCULE-1469800060 [0,2,0,0,0,0|1,0,0]=3 581 B11R1.495 CC(=O)CN1C(=O)CCC1=O MCULE-2644034739 [0,2,0,0,0,0|0,0,0]=2 582 B11R1.495 CC(=O)NN1C(=O)CCC1=O MCULE-4348931758 [0,2,0,0,0,0|0,0,1]=3 583 B11R1.495 CC(=O)ON1C(=O)CCC1=O MCULE-2600853014 [0,2,0,0,0,0|0,0,1]=3 584 B11R1.495 CC(C)CN1C(=O)C=CC1=O MCULE-6498407063 [0,2,0,0,0,0|0,0,2]=4 585 B11R1.495 CC(C)CN1C(=O)CNC1=O MCULE-6601924393 [0,2,0,0,0,0|1,0,0]=3 586 B11R1.495 CC(C)CN1C(=O)CNC1=S MCULE-6273917945 [0,2,0,0,0,0|1,1,0]=4 587 B11R1.495 CC(C)CN1C(=O)CSC1=S MCULE-2790154703 [0,2,0,0,0,0|1,1,0]=4 588 B11R1.495 CN(C)C=C1C(=O)CCC1=O MCULE-9552976396 [0,2,0,0,0,0|1,0,1]=4 589 B11R1.495 CN(C)CN1C(=O)CSC1=O MCULE-1595332501 [0,2,0,0,0,0|1,0,0]=3 590 B11R1.495 NC(=S)CN1C(=O)CCC1=O MCULE-8715026530 [0,2,0,0,0,0|0,0,1]=3 591 B11R1.495 NC(=S)CN1C(=O)CNC1=O MCULE-2264011927 [0,2,0,0,0,0|1,0,1]=4 592 B11R1.495 O=C(O)CN1C(=O)CCC1=O MCULE-3966172669 [0,2,0,0,0,0|0,0,1]=3 593 B11R1.495 O=C(O)CN1C(=O)CNC1=O MCULE-1153504776 [0,2,0,0,0,0|1,0,1]=4 594 B11R1.495 O=C(O)CN1C(=O)CSC1=O MCULE-1474037824 [0,2,0,0,0,0|1,0,1]=4 595 B11R1.598 CC1NC(=O)N(C1=O)CCCl MCULE-9896410254 [0,2,0,0,0,0|1,0,0]=3 596 B11R1.598 CCCN1C(=O)NC(=O)C1=O MCULE-1291887289 [0,2,0,0,0,0|1,0,1]=4 597 B11R1.598 CCCN1C(=O)NN(C1=O)C MCULE-7175135426 [0,2,0,0,0,0|2,0,0]=4 598 B11R1.598 CN1CC(=O)N(C1=O)CCCl MCULE-4318882867 [0,2,0,0,0,0|1,0,0]=3 599 B11R1.875 CCC(C)N1C(=O)CSC1=S MCULE-9425306994 [0,2,0,0,0,0|1,1,0]=4 600 B11R1.1452 C#CCC1(C(=O)CCC1=O)C MCULE-7769111479 [0,2,0,0,0,0|1,0,1]=4 601 B11R1.1452 C=CCC1(C(=O)CCC1=O)C MCULE-4566234355 [0,2,0,0,0,0|1,0,1]=4 602 B11R1.496 CC(C)(C)N1C(=O)C=CC1=O MCULE-8370590041 [0,2,0,0,0,0|0,0,2]=4 603 B11R1.496 CS(=O)(=O)N1C(=O)CCC1=O MCULE-4368740447 [0,2,0,0,0,0|1,0,0]=3 604 B11R1.496 CS(=O)(=O)N1C(=O)CSC1=O MCULE-5964798642 [0,2,0,0,0,0|2,0,0]=4 605 B11R1.496 O=C1CCC(=O)C1C(F)(F)F MCULE-2991713387 [0,2,0,0,0,0|2,0,0]=4 606 B11R1.673 CC(C)N1C(=O)NC(=O)C1=O MCULE-7518139455 [0,2,0,0,0,0|1,0,1]=4 607 B11R1.426 CC1(NC(=O)N(C1=O)CO)C MCULE-3291731066 [0,2,0,0,0,0|2,0,0]=4 608 B11R1.426 CCN1C(=O)NC(C1=O)(C)C MCULE-1261172417 [0,2,0,0,0,0|1,0,0]=3 609 B11R1.978 CCN1C(=O)C(SC1=S)N=O MCULE-7830350964 [0,2,0,0,0,0|1,1,0]=4 610 B11R1.978 O=C1CN(C(=O)N1CO)CO MCULE-7376776104 [0,2,0,0,0,0|2,0,0]=4 611 B11R1.64 CCN1C(=O)CCC1C(=O)O MCULE-7704385738 [0,2,0,0,0,0|0,0,1]=3 612 B9R1.2 C=C1CC(CCO1)C=O MCULE-3057874524 [0,0,1,1,0,0|2,0,0]=4 613 B9R1.2 C=CC1CCCC(=O)C1 MCULE-4962666890 [0,0,1,1,0,0|2,0,0]=4 614 B9R1.2 CCC1CCNC(=O)C1 MCULE-7827721769 [0,0,1,1,0,0|1,0,1]=4 615 B9R1.2 N#CC1CCNC(=O)C1 MCULE-8868530643 [0,0,1,1,0,0|1,0,1]=4 616 B9R1.2 NCC1CCNC(=O)C1 MCULE-8340928139 [0,0,1,1,0,0|1,0,1]=4 617 B9R1.2 NCC1CCNC(=O)C1 MCULE-9503049309 [0,0,1,1,0,0|1,0,1]=4 618 B9R1.2 NC[C@H]1CCNC(=O)C1 MCULE-6439919372 [0,0,1,1,0,0|1,0,1]=4 619 B9R1.2 NC[C@H]1CCNC(=O)C1 MCULE-8074777058 [0,0,1,1,0,0|1,0,1]=4 620 B9R1.2 O=C1CC(CCN1)CBr MCULE-5514747029 [0,0,1,1,0,0|1,0,1]=4 621 B9R1.2 O=C1CC(CCN1)CO MCULE-9526076179 [0,0,1,1,0,0|0,0,2]=4 622 B9R1.2 O=C1C[C@H](CCN1)CO MCULE-5682710079 [0,0,1,1,0,0|0,0,2]=4 623 B9R1.2 O=CC1CCNC(C1)Br MCULE-8861349259 [0,0,1,1,0,0|1,0,1]=4 624 B9R1.7 CCOC1=CC(=O)CC1 MCULE-4336671577 [0,0,1,1,0,0|2,0,0]=4 625 B9R1.48 CC1CCCCC(=O)N1 MCULE-8985894348 [0,0,1,1,0,0|1,0,1]=4 626 B9R1.48 CC1CNCCC(=O)N1 MCULE-3663408616 [0,0,1,1,0,0|2,0,0]=4 627 B9R1.49 CC1CCNC(=O)CC1 MCULE-4158970437 [0,0,1,1,0,0|1,0,1]=4 628 B9R1.49 CN1CCNC(=O)CC1 MCULE-4386852783 [0,0,1,1,0,0|2,0,0]=4 629 B9R1.49 CN1CCNC(=O)CC1 MCULE-7599377981 [0,0,1,1,0,0|2,0,0]=4 630 B9R1.49 NC1CCNC(=O)CC1 MCULE-5608507579 [0,0,1,1,0,0|1,0,1]=4 631 B9R1.49 NC1CCNC(=O)CC1 MCULE-7880148448 [0,0,1,1,0,0|1,0,1]=4 632 B9R1.49 O=C1CCC(=O)COC1 MCULE-3449745230 [0,0,1,1,0,0|2,0,0]=4 633 B9R1.49 O=C1CCCC(=O)NC1 MCULE-4912384035 [0,0,1,1,0,0|2,0,0]=4 634 B9R1.49 O=C1CCCS(=O)CC1 MCULE-7517634998 [0,0,1,1,0,0|2,0,0]=4 635 B9R1.49 O=C1CCNC(=O)CC1 MCULE-7393024422 [0,0,1,1,0,0|0,0,0]=2 636 B9R1.50 O=C1CCCCCCN1 MCULE-4051743080 [0,0,1,1,0,0|1,0,1]=4 637 B9R1.50 O=C1CCNCCCN1 MCULE-8530271368 [0,0,1,1,0,0|2,0,0]=4 638 B9R1.50 O=C1CCNCCCN1 MCULE-9622115909 [0,0,1,1,0,0|2,0,0]=4 639 B9R1.69 CC1CC(=O)CCC1=O MCULE-2258739718 [0,0,1,1,0,0|1,0,0]=3 640 B9R1.69 CC1NC(=O)CCC1N MCULE-2884344617 [0,0,1,1,0,0|1,0,1]=4 641 B9R1.69 CC1NC(=O)CCC1O MCULE-3879531993 [0,0,1,1,0,0|0,0,2]=4 642 B9R1.69 CC1NC(=O)CNC1=O MCULE-3674832613 [0,0,1,1,0,0|1,0,0]=3 643 B9R1.69 CC1NC(=O)CNC1=O MCULE-9058910414 [0,0,1,1,0,0|1,0,0]=3 644 B9R1.69 CC1OC(=O)COC1=O MCULE-8718960339 [0,0,1,1,0,0|2,0,0]=4 645 B9R1.69 CN1CC(=O)CCC1=O MCULE-3870648341 [0,0,1,1,0,0|2,0,0]=4 646 B9R1.69 C[C@@H]1NC(=O)CNC1=O MCULE-2449320004 [0,0,1,1,0,0|1,0,0]=3 647 B9R1.69 C[C@@H]1NC(=O)CNC1=O MCULE-7629090482 [0,0,1,1,0,0|1,0,0]=3 648 B9R1.69 C[C@H]1NC(=O)CNC1=O MCULE-5376605309 [0,0,1,1,0,0|1,0,0]=3 649 B9R1.73 CCNC(=O)C1CCC1 MCULE-3367663751 [0,0,1,1,0,0|1,0,1]=4 650 B9R1.73 CCNC(=O)C1CNC1 MCULE-1123894818 [0,0,1,1,0,0|2,0,0]=4 651 B9R1.73 CCNC(=O)C1CNC1 MCULE-4134794801 [0,0,1,1,0,0|2,0,0]=4 652 B9R1.100 C=CCCC(=O)C1CC1 MCULE-7573892943 [0,0,1,1,0,0|2,0,0]=4 653 B9R1.168 CC(=O)C1(CC1)C(=O)C MCULE-1230306878 [0,0,1,1,0,0|1,0,0]=3 654 B9R1.168 CC(=O)C1(CC1)C(=O)O MCULE-4529598350 [0,0,1,1,0,0|2,0,0]=4 655 B9R1.11 CCC(=O)N1CCNC1 MCULE-8872332598 [0,0,1,1,0,0|1,0,1]=4 656 B9R1.190 COC(=O)C1(CC1)C=O MCULE-7912187746 [0,0,1,1,0,0|2,0,0]=4 657 B9R2.5 O=C1CCCC12CC2 MCULE-5278125581 [1,0,0,1,0,0|1,0,1]=4 658 B9R2.5 O=C1CCNC12CC2 MCULE-6498323713 [1,0,0,1,0,0|2,0,0]=4 659 B9R2.39 O=C1CC2CCC1C2 MCULE-2467634489 [1,0,0,1,0,0|1,0,1]=4 660 B9R2.39 O=C1CC2CCC1N2 MCULE-2060564396 [1,0,0,1,0,0|2,0,0]=4 661 B9R2.39 O=C1CC2CCC1N2 MCULE-3298355504 [1,0,0,1,0,0|2,0,0]=4 662 B9R2.39 O=C1CC2CCC1O2 MCULE-3122768457 [1,0,0,1,0,0|2,0,0]=4 663 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 MCULE-9992741520 [1,0,0,1,0,0|1,0,1]=4 664 B9R2.39 O=C1C[C@H]2CC[C@@H]1C2 MCULE-2228698965 [1,0,0,1,0,0|1,0,1]=4 665 B9R2.39 [C@H]12CC[C@H](C1)CC2=O MCULE-1488894938 [1,0,0,1,0,0|1,0,1]=4 666 B11R2.47 O=C1CC2CCC1CC2=O MCULE-3954884710 [0,0,0,1,0,1|1,0,0]=3 667 B11R2.47 O=C1NC2CCC1NC2=O MCULE-2265765938 [0,0,0,1,0,1|2,0,0]=4 668 B11R2.208 O=C1CNC(=O)C2(N1)CC2 MCULE-8085746439 [0,0,0,1,0,1|2,0,0]=4 669 B11R2.432 C=C1CC2CCC(C1)C2=O MCULE-8469947334 [0,0,0,1,0,1|2,0,0]=4 670 B11R2.106 O=C1CCCC2N1CCC2 MCULE-2502608278 [0,0,0,1,0,1|1,0,1]=4 671 B11R2.106 O=C1CCNC2N1CCC2 MCULE-7318485339 [0,0,0,1,0,1|1,0,1]=4 672 B11R2.106 O=C1CNCC2N1CCC2 MCULE-1706112434 [0,0,0,1,0,1|1,0,1]=4 673 B11R2.106 O=C1CNCC2N1CCC2 MCULE-8739911055 [0,0,0,1,0,1|1,0,1]=4 674 B11R2.106 O=C1CNC[C@@H]2N1CCC2 MCULE-5239005824 [0,0,0,1,0,1|1,0,1]=4 675 B11R2.106 [C@@H]12CCCN1C(=O)CNC2 MCULE-1047674194 [0,0,0,1,0,1|1,0,1]=4 676 B11R2.106 [C@@H]12CCCN1C(=O)CNC2 MCULE-1167650113 [0,0,0,1,0,1|1,0,1]=4 677 B11R2.106 [C@@H]12CCCN1C(=O)CNC2 MCULE-1846016170 [0,0,0,1,0,1|1,0,1]=4 678 B11R2.106 [C@@H]12CCCN1C(=O)CNC2 MCULE-7417021318 [0,0,0,1,0,1|1,0,1]=4 679 B11R2.106 [C@H]12CCCN1C(=O)CNC2 MCULE-1297799730 [0,0,0,1,0,1|1,0,1]=4 680 B11R2.106 [C@H]12CCCN1C(=O)CNC2 MCULE-3141191239 [0,0,0,1,0,1|1,0,1]=4 681 B11R2.106 [C@H]12CCCN1C(=O)CNC2 MCULE-7917319125 [0,0,0,1,0,1|1,0,1]=4 682 B11R2.118 O=C1CC2CCC1C(=O)N2 MCULE-9588308992 [0,0,0,1,0,1|1,0,0]=3 683 B11R2.786 O=C1CCCC(=O)C12CC2 MCULE-9638509254 [0,0,0,1,0,1|1,0,0]=3 684 B11R2.126 CC12CCC(=O)N1CCN2 MCULE-3500979360 [0,1,0,1,0,0|1,0,1]=4 685 B11R2.1 C12CCC(=O)N1CCNC2 MCULE-1513981705 [0,1,0,1,0,0|1,0,1]=4 686 B11R2.1 C12CCC(=O)N1CCNC2 MCULE-9215398601 [0,1,0,1,0,0|1,0,1]=4 687 B11R2.1 O=C1CCC2=C1CCCC2 MCULE-1175519180 [0,1,0,1,0,0|2,0,0]=4 688 B11R2.1 O=C1CCC2=C1COCO2 MCULE-6876135192 [0,1,0,1,0,0|1,0,1]=4 689 B11R2.1 O=C1CCC2N1CCNC2 MCULE-3552145137 [0,1,0,1,0,0|1,0,1]=4 690 B11R2.1 O=C1CCC2N1CCNC2 MCULE-6247915101 [0,1,0,1,0,0|1,0,1]=4 691 B11R2.1 O=C1CC[C@H]2N1CCNC2 MCULE-1535215477 [0,1,0,1,0,0|1,0,1]=4 692 B11R2.1 O=C1CSC2=NCCCN12 MCULE-3659098975 [0,1,0,1,0,0|2,0,0]=4 693 B11R2.1 O=C1CSC2=NCCCN12 MCULE-5684707141 [0,1,0,1,0,0|2,0,0]=4 694 B11R2.1 [C@@H]12CCC(=O)N1CCNC2 MCULE-2350592029 [0,1,0,1,0,0|1,0,1]=4 695 B11R2.1 [C@@H]12CCC(=O)N1CCNC2 MCULE-3048366829 [0,1,0,1,0,0|1,0,1]=4 696 B11R2.1 [C@@H]12CCC(=O)N1CCNC2 MCULE-7959549931 [0,1,0,1,0,0|1,0,1]=4 697 B11R2.1 [C@@H]12CCC(=O)N1CCNC2 MCULE-8311875816 [0,1,0,1,0,0|1,0,1]=4 698 B11R2.1 [C@H]12CCC(=O)N1CCNC2 MCULE-1390108219 [0,1,0,1,0,0|1,0,1]=4 699 B11R2.1 [C@H]12CCC(=O)N1CCNC2 MCULE-2266447687 [0,1,0,1,0,0|1,0,1]=4 700 B11R2.1 [C@H]12CCC(=O)N1CCNC2 MCULE-9921549426 [0,1,0,1,0,0|1,0,1]=4 701 B11R2.66 O=C1C=C2CCC(=O)N2C1 MCULE-4036320294 [0,1,0,1,0,0|1,0,1]=4 702 B11R2.206 O=C1C=CC(=O)N1C2CC2 MCULE-4538326978 [0,1,0,1,0,0|0,0,2]=4 703 B11R2.206 O=C1CNC(=O)N1C2CC2 MCULE-6346191950 [0,1,0,1,0,0|1,0,0]=3 704 B11R2.206 O=C1CNC(=S)N1C2CC2 MCULE-8771342863 [0,1,0,1,0,0|1,1,0]=4 705 B11R2.206 O=C1CSC(=S)N1C2CC2 MCULE-8690640628 [0,1,0,1,0,0|1,1,0]=4 706 B7R1.8 CCC1CCC1=O MCULE-5109615435 [1,0,0,0,1,0|1,0,0]=3 707 B7R1.8 COC1CCC1=O MCULE-6511996246 [1,0,0,0,1,0|2,0,0]=4 708 B7R1.8 CSC1CCC1=O MCULE-3892720319 [1,0,0,0,1,0|2,0,0]=4 709 B7R1.8 O=C1CCC1CO MCULE-5501600764 [1,0,0,0,1,0|2,0,0]=4 710 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [1,0,0,0,1,0|2,0,0]=4 711 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-1309294109 [0,0,1,0,0,1|2,0,0]=4 712 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-9698129539 [0,0,1,0,0,1|2,0,0]=4 713 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-4606830483 [0,0,1,0,0,1|2,0,0]=4 714 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-7396715663 [0,0,1,0,0,1|2,0,0]=4 715 B9R1.3 CC1=C(C(=O)CCC1)C MCULE-2092030294 [1,0,0,0,0,1|2,0,0]=4 716 B9R1.3 CC1=C(CCCC1=O)O MCULE-2811033912 [1,0,0,0,0,1|1,0,1]=4 717 B9R1.3 CC1C(=O)CCCC1=O MCULE-6372223277 [1,0,0,0,0,1|1,0,0]=3 718 B9R1.3 CC1CNCC(=O)N1C MCULE-6146515954 [1,0,0,0,0,1|1,0,1]=4 719 B9R1.3 CC1CNCC(=O)N1C MCULE-6324850501 [1,0,0,0,0,1|1,0,1]=4 720 B9R1.3 CN1C(=O)C=CNC1=O MCULE-5392412214 [1,0,0,0,0,1|0,0,2]=4 721 B9R1.3 CN1C(=O)C=NNC1=O MCULE-6864350387 [1,0,0,0,0,1|1,0,1]=4 722 B9R1.3 CN1C(=O)CCCC1=O MCULE-4787684091 [1,0,0,0,0,1|0,0,0]=2 723 B9R1.3 CN1C(=O)CNCC1=O MCULE-1069132233 [1,0,0,0,0,1|0,0,0]=2 724 B9R1.3 CN1C(=O)CNCC1=O MCULE-4060585109 [1,0,0,0,0,1|0,0,0]=2 725 B9R1.3 CN1C(=O)CNCC1=O MCULE-8726062423 [1,0,0,0,0,1|0,0,0]=2 726 B9R1.3 C[C@@H]1CNCC(=O)N1C MCULE-2631912609 [1,0,0,0,0,1|1,0,1]=4 727 B9R1.3 C[C@@H]1CNCC(=O)N1C MCULE-3626784899 [1,0,0,0,0,1|1,0,1]=4 728 B9R1.3 C[C@@H]1CNCC(=O)N1C MCULE-5129830315 [1,0,0,0,0,1|1,0,1]=4 729 B9R1.3 C[C@@H]1CNCC(=O)N1C MCULE-9747041418 [1,0,0,0,0,1|1,0,1]=4 730 B9R1.3 C[C@H]1CNCC(=O)N1C MCULE-1364393332 [1,0,0,0,0,1|1,0,1]=4 731 B9R1.3 C[C@H]1CNCC(=O)N1C MCULE-4965977180 [1,0,0,0,0,1|1,0,1]=4 732 B9R1.3 C[C@H]1CNCC(=O)N1C MCULE-5863604180 [1,0,0,0,0,1|1,0,1]=4 733 B9R1.3 C[C@H]1CNCC(=O)N1C MCULE-8897457682 [1,0,0,0,0,1|1,0,1]=4 734 B9R1.3 O=C1CCCC(=O)C1Br MCULE-7816833236 [1,0,0,0,0,1|2,0,0]=4 735 B9R1.3 O=C1CCCC(=O)C1Cl MCULE-7334645492 [1,0,0,0,0,1|2,0,0]=4 736 B9R1.3 O=C1CCCC(=O)N1Br MCULE-4460128380 [1,0,0,0,0,1|1,0,0]=3 737 B11R1.956 CCN1CC(NCCC1=O)C MCULE-2046456502 [0,0,0,0,0,2|1,0,1]=4