0 B12R1.101 CC(=O)NC1=CC(=O)NC(=N1)C MCULE-1799711775 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.101 CC(=O)OC1=CC(=O)OC(=O)C1 MCULE-3383203911 [0,0,0,0,0,0|4,0,0]=4 2 B12R1.101 CC1=CC(=CC(=C1)Br)CC(=O)O MCULE-5402524354 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.101 CC1=CC(=CC(=C1)CC(=O)O)C MCULE-7232746562 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.101 CC1=CC(=CC(=C1)F)CC(=O)O MCULE-9010510716 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.101 CC1=CC(=CC(=N1)C)CC(=O)O MCULE-5095549442 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.101 CC1=CC(=CC(=N1)C)CC(=O)O MCULE-7026141183 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.101 CC1=NC(=CC(=C1)Br)CC(=O)O MCULE-3691040714 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.101 CC1=NC(=CC(=N1)O)CC(=O)O MCULE-9604422259 [0,0,0,0,0,0|1,0,3]=4 9 B12R1.101 NC(=O)CN1CC(=O)NC(=O)C1 MCULE-1096711529 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.101 NC1=CC(=CC(=C1)Br)CC(=O)O MCULE-4903102322 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.101 NC1=CC(=CC(=C1)Br)CC(=O)O MCULE-6786044026 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.101 NC1=NC(=CC(=O)N1)CC(=O)O MCULE-6580791851 [0,0,0,0,0,0|1,0,1]=2 13 B12R1.101 O=C(Cl)CC1CC(=O)NC(=O)C1 MCULE-5090456153 [0,0,0,0,0,0|2,0,2]=4 14 B12R1.101 O=C(O)CC1=CC(=CC(=C1)Br)Br MCULE-9469341584 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.101 O=C(O)CC1=CC(=CC(=C1)Br)Cl MCULE-5649330588 [0,0,0,0,0,0|4,0,0]=4 16 B12R1.101 O=C(O)CC1=CC(=CC(=C1)Cl)Cl MCULE-9358417140 [0,0,0,0,0,0|4,0,0]=4 17 B12R1.101 O=C(O)CC1=CC(=CC(=C1)F)Br MCULE-6841054832 [0,0,0,0,0,0|4,0,0]=4 18 B12R1.101 O=C(O)CC1=CC(=CC(=C1)F)Cl MCULE-9221021469 [0,0,0,0,0,0|4,0,0]=4 19 B12R1.101 O=C(O)CC1=CC(=CC(=C1)F)F MCULE-2148465033 [0,0,0,0,0,0|4,0,0]=4 20 B12R1.101 O=C(O)CC1=CC(=CC(=C1)I)I MCULE-9730380866 [0,0,0,0,0,0|4,0,0]=4 21 B12R1.101 O=C(O)CC1=CC(=CC(=C1)O)Br MCULE-6849175721 [0,0,0,0,0,0|3,0,1]=4 22 B12R1.101 O=C(O)CC1=CC(=CC(=C1)O)O MCULE-6159677517 [0,0,0,0,0,0|2,0,2]=4 23 B12R1.101 O=C(O)CC1=CC(=O)NC(=O)N1 MCULE-1559244599 [0,0,0,0,0,0|0,0,0]=0 24 B12R1.101 O=C(O)CC1CC(=O)NC(=O)C1 MCULE-1687956782 [0,0,0,0,0,0|1,0,2]=3 25 B12R1.101 O=C(O)CC1CC(=O)NC(=O)N1 MCULE-6179754914 [0,0,0,0,0,0|0,0,2]=2 26 B12R1.101 O=C(O)CN1CC(=O)NC(=O)C1 MCULE-6478189605 [0,0,0,0,0,0|2,0,1]=3 27 B12R1.101 O=C(O)CN1CC(=O)OC(=O)C1 MCULE-6278404161 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.34 C=CCC1=CC(=O)NC(=O)N1 MCULE-1243468197 [1,0,0,0,0,0|1,0,0]=2 29 B11R1.34 CC#CC1=CC(=O)NC(=O)N1 MCULE-7820995699 [1,0,0,0,0,0|1,0,2]=4 30 B11R1.34 CCCC1=CC(=O)NC(=S)N1 MCULE-9403710688 [1,0,0,0,0,0|1,1,1]=4 31 B11R1.34 CCOC1=CC(=O)NC(=O)N1 MCULE-9489557815 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.34 CSCC1=CC(=O)NC(=O)N1 MCULE-7457913087 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.157 CC(=O)NC1=CC(=O)NC=N1 MCULE-5348159136 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.157 CC1=CC(=CC=C1)CC(=O)O MCULE-8658748020 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.157 CC1=CC(=NC=C1)CC(=O)O MCULE-8064322897 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.157 CC1=CC(=NC=C1)CC(=O)O MCULE-9669688749 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.157 CC1=CC=CC(=N1)CC(=O)O MCULE-8295001903 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.157 CC1=NC(=CC=C1)CC(=O)O MCULE-1880396126 [1,0,0,0,0,0|2,0,1]=4 39 B11R1.157 NC1=CC(=CC=C1)CC(=O)O MCULE-5352536107 [1,0,0,0,0,0|3,0,0]=4 40 B11R1.157 NC1=CC(=CC=C1)CC(=O)O MCULE-9819576026 [1,0,0,0,0,0|3,0,0]=4 41 B11R1.157 NC1=CC(=CC=N1)CC(=O)O MCULE-6247213705 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.157 NC1=CC=CC(=N1)CC(=O)O MCULE-2837153519 [1,0,0,0,0,0|2,0,1]=4 43 B11R1.157 NC1=CC=CC(=N1)CC(=O)O MCULE-4172950099 [1,0,0,0,0,0|2,0,1]=4 44 B11R1.157 NC1=NC=CC(=C1)CC(=O)O MCULE-4781635467 [1,0,0,0,0,0|2,0,1]=4 45 B11R1.157 NC1=NC=CC(=C1)CC(=O)O MCULE-9600960343 [1,0,0,0,0,0|2,0,1]=4 46 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br MCULE-2691472298 [1,0,0,0,0,0|3,0,0]=4 47 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl MCULE-9578062015 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.157 O=C(O)CC1=CC(=CC=C1)F MCULE-1592227568 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.157 O=C(O)CC1=CC(=CC=C1)I MCULE-1379761880 [1,0,0,0,0,0|3,0,0]=4 50 B11R1.157 O=C(O)CC1=CC(=CC=C1)O MCULE-7425540066 [1,0,0,0,0,0|2,0,1]=4 51 B11R1.157 O=C(O)CC1=CC(=CC=C1)S MCULE-9429424270 [1,0,0,0,0,0|2,1,0]=4 52 B11R1.157 O=C(O)CC1=CC(=NC=C1)F MCULE-6683746214 [1,0,0,0,0,0|2,0,1]=4 53 B11R1.157 O=C(O)CC1=CC(=NC=C1)O MCULE-5818124487 [1,0,0,0,0,0|1,0,2]=4 54 B11R1.157 O=C(O)CC1=CC=CC(=N1)Cl MCULE-2707172059 [1,0,0,0,0,0|2,0,1]=4 55 B11R1.157 O=C(O)CC1=CC=CC(=N1)Cl MCULE-8001530692 [1,0,0,0,0,0|2,0,1]=4 56 B11R1.157 O=C(O)CC1=CC=CC(=N1)O MCULE-1446795458 [1,0,0,0,0,0|1,0,2]=4 57 B11R1.157 O=C(O)CC1=CC=NC(=C1)Br MCULE-2720460014 [1,0,0,0,0,0|2,0,1]=4 58 B11R1.157 O=C(O)CC1=CC=NC(=C1)Cl MCULE-9502305378 [1,0,0,0,0,0|2,0,1]=4 59 B11R1.157 O=C(O)CC1=NC(=CC=C1)Br MCULE-6056841739 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.157 O=C(O)CC1=NC(=CC=C1)F MCULE-4639319722 [1,0,0,0,0,0|2,0,1]=4 61 B11R1.157 O=C(O)CC1=NC(=NC=C1)Cl MCULE-3129800413 [1,0,0,0,0,0|1,0,2]=4 62 B11R1.157 O=C(O)CC1=NC=CC(=C1)Br MCULE-5562038403 [1,0,0,0,0,0|2,0,1]=4 63 B11R1.157 O=C(O)CC1=NC=CC(=C1)Cl MCULE-1380598350 [1,0,0,0,0,0|2,0,1]=4 64 B11R1.157 O=C(O)CC1=NC=CC(=C1)Cl MCULE-7541344932 [1,0,0,0,0,0|2,0,1]=4 65 B11R1.157 O=C(O)CC1=NC=NC(=C1)O MCULE-8484496585 [1,0,0,0,0,0|0,0,3]=4 66 B13R1.56 CSC1=NC(=CC(=O)N1)CC(=O)O MCULE-8762432411 [0,1,0,0,0,0|0,1,1]=3 67 B13R1.2874 CNC(=O)CC1=CC(=O)NC(=N1)S MCULE-6302059889 [0,1,0,0,0,0|1,1,1]=4 68 B13R1.2874 COC(=O)CC1=CC(=O)NC(=N1)N MCULE-6322261864 [0,1,0,0,0,0|1,0,1]=3 69 B13R1.2874 COC(=O)CC1=CC(=O)NC(=N1)S MCULE-7033236687 [0,1,0,0,0,0|0,1,1]=3 70 B13R1.2874 COC(=O)CC1=NC(=O)NC(=C1)O MCULE-6668401585 [0,1,0,0,0,0|0,0,2]=3 71 B13R1.2874 NNC(=O)CC1=CC(=O)NC(=N1)S MCULE-7240834599 [0,1,0,0,0,0|1,1,1]=4 72 B13R1.2874 NNC(=O)CC1=CC(=O)NC(=O)N1 MCULE-3778726423 [0,1,0,0,0,0|1,0,0]=2 73 B13R1.2874 O=C1C=C(NC(=S)N1)NC(=O)CCl MCULE-7511061630 [0,1,0,0,0,0|2,1,0]=4 74 B13R1.3421 CS(=O)(=O)CC1=CC(=O)NC(=O)N1 MCULE-3239220671 [0,1,0,0,0,0|1,0,1]=3 75 B13R2.5397 CC1=CC2=C(N1)C(=O)NC(=O)N2 MCULE-9758159999 [0,0,0,1,0,0|2,0,1]=4 76 B13R2.5397 CC1=CC2=C(N1)NC(=O)NC2=O MCULE-2581768690 [0,0,0,1,0,0|3,0,0]=4 77 B13R2.5397 CC1=CC2=C(S1)C(=O)NC(=O)N2 MCULE-8042819799 [0,0,0,1,0,0|1,1,1]=4 78 B13R2.5397 CC1=CC2=C(S1)NC(=O)NC2=O MCULE-9464800369 [0,0,0,1,0,0|3,0,0]=4 79 B13R2.5397 CC1=NC2=C(N1)C(=O)NC(=O)N2 MCULE-5490630927 [0,0,0,1,0,0|3,0,0]=4 80 B13R2.5397 NC1=C2NC(=O)N=C2NC(=O)N1 MCULE-9089934288 [0,0,0,1,0,0|3,0,0]=4 81 B13R2.5397 NC1=NC2=C(N1)C(=O)NC(=O)N2 MCULE-9314376719 [0,0,0,1,0,0|3,0,0]=4 82 B13R2.5397 O=C1NC(=O)C2=C(N1)N=C(N2)[O-] MCULE-1037424636 [0,0,0,1,0,0|2,0,1]=4 83 B13R2.5397 O=C1NC(=O)C2=C(N1)NC(=N2)Br MCULE-7243641884 [0,0,0,1,0,0|3,0,0]=4 84 B13R2.5397 O=C1NC(=O)C2=C(N1)NC(=N2)Cl MCULE-3803939687 [0,0,0,1,0,0|3,0,0]=4 85 B13R2.5397 O=C1NC(=O)C2=C(N1)NC(=O)N2 MCULE-3320087210 [0,0,0,1,0,0|2,0,0]=3 86 B13R2.5397 O=C1NC(=O)C2=C(N1)SC(=[Se])S2 MCULE-1906128285 [0,0,0,1,0,0|1,2,0]=4 87 B11R1.74 CC(C)C1=CC(=O)NC(=O)N1 MCULE-6397298934 [0,0,0,0,1,0|2,0,1]=4 88 B11R1.74 CC1=CC(=CC(=O)N1)C(=O)O MCULE-5062152880 [0,0,0,0,1,0|2,0,0]=3 89 B11R1.74 CC1=CC(=O)C=C(N1)C(=O)O MCULE-5508133838 [0,0,0,0,1,0|2,0,0]=3 90 B11R1.74 CC1=CC(=O)C=C(O1)C(=O)O MCULE-8546776417 [0,0,0,0,1,0|3,0,0]=4 91 B11R1.74 CC1=CC(=O)NC(=C1)C(=O)O MCULE-8099474609 [0,0,0,0,1,0|2,0,0]=3 92 B11R1.74 CC1=NC(=CC(=O)N1)C(=O)O MCULE-3984714130 [0,0,0,0,1,0|1,0,1]=3 93 B11R1.74 CC1=NC(=O)NC(=C1)C(=O)O MCULE-7921673628 [0,0,0,0,1,0|1,0,1]=3 94 B11R1.74 CN(C)C1=CC(=O)NC(=O)N1 MCULE-6182845897 [0,0,0,0,1,0|3,0,0]=4 95 B11R1.74 N=C1NC(=O)C=C(S1)C(=O)O MCULE-4278089351 [0,0,0,0,1,0|2,0,0]=3 96 B11R1.74 NC(=O)C1=CC(=O)NC(=O)N1 MCULE-6215871295 [0,0,0,0,1,0|1,0,0]=2 97 B11R1.74 NC(=O)C1=NC(=O)NC(=O)N1 MCULE-1501109502 [0,0,0,0,1,0|2,0,0]=3 98 B11R1.74 O=C1C=C(C=C(N1)Cl)C(=O)O MCULE-5716078367 [0,0,0,0,1,0|2,0,0]=3 99 B11R1.74 O=C1C=C(C=C(O1)C(=O)O)O MCULE-8801008848 [0,0,0,0,1,0|2,0,1]=4 100 B11R1.74 O=C1C=C(N=C(N1)C(=O)O)O MCULE-6837849203 [0,0,0,0,1,0|2,0,1]=4 101 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-1013719295 [0,0,0,0,1,0|0,0,0]=1 102 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-1063581454 [0,0,0,0,1,0|0,0,0]=1 103 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-4166125392 [0,0,0,0,1,0|0,0,0]=1 104 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-5733155947 [0,0,0,0,1,0|0,0,0]=1 105 B11R1.74 O=C1C=C(NC(=O)N1)C(=O)O MCULE-8576554569 [0,0,0,0,1,0|0,0,0]=1 106 B11R1.74 O=C1C=C(NC(=S)N1)C(=O)O MCULE-6748638642 [0,0,0,0,1,0|0,1,0]=2 107 B11R1.74 O=C1C=C(NC(=[Se])N1)C(=O)O MCULE-7353883477 [0,0,0,0,1,0|0,1,0]=2 108 B11R1.74 O=C1C=C([NH2+]C(=O)N1)C(=O)O MCULE-8213749858 [0,0,0,0,1,0|0,0,1]=2 109 B11R1.74 O=C1CC(CC(=O)N1)C(=O)O MCULE-5623787674 [0,0,0,0,1,0|1,0,2]=4 110 B11R1.74 O=C1CC(NC(=O)N1)C(=O)O MCULE-8091289320 [0,0,0,0,1,0|0,0,2]=3 111 B11R1.74 O=C1C[C@@H](NC(=O)N1)C(=O)O MCULE-4074220021 [0,0,0,0,1,0|0,0,2]=3 112 B11R1.74 O=C1C[C@@H](NC(=O)N1)C(=O)O MCULE-7764195040 [0,0,0,0,1,0|0,0,2]=3 113 B11R1.74 O=C1C[C@H](NC(=O)N1)C(=O)O MCULE-6513392402 [0,0,0,0,1,0|0,0,2]=3 114 B11R1.74 O=C1C[C@H](NC(=O)N1)C(=O)O MCULE-7404763627 [0,0,0,0,1,0|0,0,2]=3 115 B11R1.74 O=C1N=C(NC(=O)N1)C(=O)O MCULE-6395275914 [0,0,0,0,1,0|1,0,0]=2 116 B11R1.645 CC1=CC(=C(S1)C)CC(=O)O MCULE-3975103574 [0,0,0,0,1,0|3,0,0]=4 117 B11R1.645 N=C1NC(=C(S1)CC(=O)O)O MCULE-7412788904 [0,0,0,0,1,0|2,0,1]=4 118 B11R1.645 N=C1NC(=O)C(S1)CC(=O)O MCULE-8767681307 [0,0,0,0,1,0|2,0,1]=4 119 B11R1.645 NC(=O)CC1NC(=O)NC1=O MCULE-1318774728 [0,0,0,0,1,0|1,0,1]=3 120 B11R1.645 NC(=O)NC1=NC(=O)NC1=O MCULE-5112025434 [0,0,0,0,1,0|2,0,1]=4 121 B11R1.645 NC(=O)NC1NC(=O)NC1=O MCULE-1008326286 [0,0,0,0,1,0|2,0,1]=4 122 B11R1.645 NC(=O)N[C@@H]1NC(=O)NC1=O MCULE-5991865685 [0,0,0,0,1,0|2,0,1]=4 123 B11R1.645 O=C(Cl)CC1NC(=O)NC1=O MCULE-7494393064 [0,0,0,0,1,0|1,0,1]=3 124 B11R1.645 O=C(Cl)CC1SC(=O)NC1=O MCULE-8493672589 [0,0,0,0,1,0|2,0,1]=4 125 B11R1.645 O=C(O)/C=C/1\SC(=O)NC1=O MCULE-6113332823 [0,0,0,0,1,0|1,0,1]=3 126 B11R1.645 O=C(O)C=C1SC(=O)NC1=O MCULE-8903735773 [0,0,0,0,1,0|1,0,1]=3 127 B11R1.645 O=C(O)CC1=C(SC(=C1)Br)Br MCULE-6770897127 [0,0,0,0,1,0|3,0,0]=4 128 B11R1.645 O=C(O)CC1=C(SC(=C1)Cl)Cl MCULE-4824954538 [0,0,0,0,1,0|3,0,0]=4 129 B11R1.645 O=C(O)CC1=CC(=O)OC1=O MCULE-8420291771 [0,0,0,0,1,0|1,0,0]=2 130 B11R1.645 O=C(O)CC1CC(=O)NC1=O MCULE-4247988695 [0,0,0,0,1,0|0,0,2]=3 131 B11R1.645 O=C(O)CC1CC(=O)OC1=O MCULE-5201948185 [0,0,0,0,1,0|1,0,2]=4 132 B11R1.645 O=C(O)CC1NC(=O)NC1=O MCULE-4472768936 [0,0,0,0,1,0|0,0,1]=2 133 B11R1.645 O=C(O)CC1NC(=S)NC1=O MCULE-3693835311 [0,0,0,0,1,0|0,1,1]=3 134 B11R1.645 O=C(O)CC1SC(=O)NC1=O MCULE-8778282195 [0,0,0,0,1,0|1,0,1]=3 135 B11R1.645 O=C(O)CN1CC(=O)NC1=O MCULE-6009577973 [0,0,0,0,1,0|1,0,1]=3 136 B11R1.645 O=C(O)C[C@@H]1NC(=O)NC1=O MCULE-3659340200 [0,0,0,0,1,0|0,0,1]=2 137 B11R1.645 O=C(O)C[C@@H]1NC(=O)NC1=O MCULE-7657913540 [0,0,0,0,1,0|0,0,1]=2 138 B13R1.3420 CC(=O)NCC1=CC(=O)NC(=O)N1 MCULE-4528799253 [0,0,0,0,0,1|1,0,0]=2 139 B13R1.3420 CC1=CC(=O)NC(=N1)NCC(=O)O MCULE-8430442132 [0,0,0,0,0,1|3,0,0]=4 140 B13R1.3420 O=C(O)CNC1=NC(=CC(=O)N1)F MCULE-1105619226 [0,0,0,0,0,1|3,0,0]=4 141 B10R1.8 C=CC1=CC(=O)NC(=O)N1 MCULE-7194319105 [2,0,0,0,0,0|0,0,1]=3 142 B10R1.8 CCC1=CC(=O)NC(=O)N1 MCULE-1656089601 [2,0,0,0,0,0|0,0,1]=3 143 B10R1.8 CCC1=CC(=O)NC(=S)N1 MCULE-6071312738 [2,0,0,0,0,0|0,1,1]=4 144 B10R1.8 CNC1=CC(=O)NC(=O)N1 MCULE-5972679940 [2,0,0,0,0,0|1,0,1]=4 145 B10R1.8 COC1=CC(=O)NC(=O)N1 MCULE-5375145256 [2,0,0,0,0,0|1,0,1]=4 146 B10R1.8 NC1=NC(=O)C=C(N1)CO MCULE-8115067038 [2,0,0,0,0,0|1,0,1]=4 147 B10R1.8 NC1=NC(=O)NC(=C1)CO MCULE-6855905544 [2,0,0,0,0,0|1,0,1]=4 148 B10R1.8 NCC1=CC(=O)NC(=O)N1 MCULE-3879084303 [2,0,0,0,0,0|1,0,0]=3 149 B10R1.8 NCC1=CC(=O)NC(=O)N1 MCULE-8158860012 [2,0,0,0,0,0|1,0,0]=3 150 B10R1.8 NNC1=CC(=O)NC(=O)N1 MCULE-1469229530 [2,0,0,0,0,0|2,0,0]=4 151 B10R1.8 O=C1C/C(=N\O)/NC(=O)N1 MCULE-3947010417 [2,0,0,0,0,0|1,0,1]=4 152 B10R1.8 O=C1C=C(NC(=O)N1)CBr MCULE-1615723991 [2,0,0,0,0,0|1,0,0]=3 153 B10R1.8 O=C1C=C(NC(=O)N1)CCl MCULE-8212962530 [2,0,0,0,0,0|1,0,0]=3 154 B10R1.8 O=C1C=C(NC(=O)N1)CO MCULE-5458955186 [2,0,0,0,0,0|0,0,0]=2 155 B10R1.8 O=C1C=C(NC(=S)N1)CO MCULE-6688543299 [2,0,0,0,0,0|0,1,0]=3 156 B10R1.8 O=CC1=CC(=O)NC(=O)N1 MCULE-5989318185 [2,0,0,0,0,0|0,0,0]=2 157 B10R1.8 O=CC1=CC(=O)NC(=S)N1 MCULE-9142470762 [2,0,0,0,0,0|0,1,0]=3 158 B10R1.10 O=CNC1=NC(=O)NC=C1 MCULE-4230661945 [2,0,0,0,0,0|1,0,1]=4 159 B10R1.10 O=NC=C1C=CNC(=O)N1 MCULE-9712012004 [2,0,0,0,0,0|1,0,1]=4 160 B10R1.18 O=C(O)CC1=CC=CC=C1 MCULE-6701370784 [2,0,0,0,0,0|2,0,0]=4 161 B10R1.18 O=C(O)CC1=CC=NC=C1 MCULE-6196505642 [2,0,0,0,0,0|1,0,1]=4 162 B10R1.18 O=C(O)CC1=CC=NC=C1 MCULE-6918467554 [2,0,0,0,0,0|1,0,1]=4 163 B10R1.18 O=C(O)CC1=NC=CC=C1 MCULE-3223507615 [2,0,0,0,0,0|1,0,1]=4 164 B10R1.18 O=C(O)CC1=NC=CC=C1 MCULE-6540788884 [2,0,0,0,0,0|1,0,1]=4 165 B10R1.18 O=C(O)CC1=NC=NC=C1 MCULE-5590967773 [2,0,0,0,0,0|0,0,2]=4 166 B12R0.41 NC(=O)NN(CC(=O)O)CC(=O)O MCULE-1023550972 [0,1,1,0,0,0|1,0,1]=4 167 B12R1.40 CCCC1=CC(=O)NC(=O)N1C MCULE-7410631807 [1,1,0,0,0,0|1,0,1]=4 168 B12R1.100 C=CCCC1=CC(=O)NC(=O)N1 MCULE-4964997977 [1,1,0,0,0,0|1,0,0]=3 169 B12R1.358 O=C1C=C(NC(=O)N1)C(=O)NO MCULE-3155918779 [1,1,0,0,0,0|1,0,1]=4 170 B12R1.50 COC(=O)CC1=CC(=O)NC=N1 MCULE-8400566619 [1,1,0,0,0,0|0,0,1]=3 171 B12R1.127 CC1=C(NC(=O)C=C1)CC(=O)O MCULE-4200659862 [1,1,0,0,0,0|1,0,0]=3 172 B12R1.127 O=C(O)CC1=CC(=O)NNC1=O MCULE-4068609498 [1,1,0,0,0,0|2,0,0]=4 173 B12R1.438 O=CC1=CC(=CC=C1)CC(=O)O MCULE-2075127169 [1,1,0,0,0,0|2,0,0]=4 174 B12R1.11 CCC1=CC(=CC(=O)N1)C(=O)O MCULE-8490216410 [0,1,0,0,1,0|2,0,0]=4 175 B12R1.511 CC1=C(C(=NC(=O)N1)C(=O)O)C MCULE-1929892844 [0,1,0,0,1,0|1,0,1]=4 176 B12R1.511 CC1=C(NC(=O)NC1=O)C(=O)O MCULE-3566351709 [0,1,0,0,1,0|0,0,0]=2 177 B12R1.511 CC1=CC(=O)C=C(N1C)C(=O)O MCULE-6309616738 [0,1,0,0,1,0|2,0,0]=4 178 B12R1.511 CN1C(=O)N=C(C=C1C(=O)O)O MCULE-6928238023 [0,1,0,0,1,0|0,0,2]=4 179 B12R1.511 NC1=C(NC(=O)NC1=O)C(=O)O MCULE-8801103464 [0,1,0,0,1,0|0,0,0]=2 180 B12R1.511 O=C1NC(=O)C(=C(N1)C(=O)O)F MCULE-2856865842 [0,1,0,0,1,0|0,0,0]=2 181 B12R1.1005 CC1=CC(=CC(=O)N1C)C(=O)O MCULE-9607547984 [0,1,0,0,1,0|2,0,0]=4 182 B12R1.1005 CN1C(=O)C=C(NC1=O)C(=O)O MCULE-3579685567 [0,1,0,0,1,0|0,0,0]=2 183 B12R1.1005 CN1C(=O)CC(NC1=O)C(=O)O MCULE-2446459229 [0,1,0,0,1,0|0,0,2]=4 184 B12R1.1005 CN1C(=O)CC(NC1=O)C(=O)O MCULE-7100531134 [0,1,0,0,1,0|0,0,2]=4 185 B12R1.1005 CN1C(=O)C[C@H](NC1=O)C(=O)O MCULE-6596161512 [0,1,0,0,1,0|0,0,2]=4 186 B12R1.1005 CN1C(=O)C[C@H](NC1=O)C(=O)O MCULE-9696693758 [0,1,0,0,1,0|0,0,2]=4 187 B12R1.1005 CN1C(=O)N=C(C=C1O)C(=O)O MCULE-4258035885 [0,1,0,0,1,0|0,0,2]=4 188 B12R1.532 COC(=O)CC1NC(=O)NC1=O MCULE-2224728173 [0,1,0,0,1,0|0,0,1]=3 189 B12R1.857 CC1(SC(=O)NC1=O)CC(=O)O MCULE-8305018398 [0,1,0,0,1,0|1,0,1]=4 190 B12R1.864 CC(C(=O)O)C1SC(=O)NC1=O MCULE-5433868360 [0,1,0,0,1,0|1,0,1]=4 191 B14R1.952 CCOC(=O)CC1=CC(=O)NC(=N1)N MCULE-1593900094 [0,2,0,0,0,0|1,0,1]=4 192 B14R1.952 CCOC(=O)CC1=CC(=O)NC(=O)N1 MCULE-3953977943 [0,2,0,0,0,0|0,0,0]=2 193 B12R1.182 O=CNC1=NC(=CS1)CC(=O)O MCULE-5269231558 [0,0,1,1,0,0|0,1,1]=4 194 B12R1.1000 CC(=O)C1C(=O)NC(=O)NC1=O MCULE-1857279341 [0,0,1,1,0,0|2,0,0]=4 195 B12R1.861 O=C(O)CCC1NC(=O)NC1=O MCULE-4043775084 [0,0,1,1,0,0|0,0,2]=4 196 B12R1.861 O=C(O)CC[C@@H]1NC(=O)NC1=O MCULE-7004335123 [0,0,1,1,0,0|0,0,2]=4 197 B12R1.861 O=C(O)CC[C@@H]1NC(=O)NC1=O MCULE-9084301148 [0,0,1,1,0,0|0,0,2]=4 198 B12R1.1218 O=C1CCC(NC(=O)N1)C(=O)O MCULE-1500901584 [0,0,1,1,0,0|0,0,2]=4 199 B12R1.392 O=C(O)CC1=C(C=CN1)C(=O)O MCULE-9003066322 [0,0,1,1,0,0|2,0,0]=4 200 B12R2.246 O=C1NC(=O)C2=C(N1)C=CN2 MCULE-6069519505 [1,0,0,1,0,0|1,0,1]=4 201 B12R2.246 O=C1NC(=O)C2=C(N1)CCC2 MCULE-2036882434 [1,0,0,1,0,0|1,0,1]=4 202 B12R2.246 O=C1NC(=O)C2=C(N1)CCS2 MCULE-5307345388 [1,0,0,1,0,0|0,1,1]=4 203 B12R2.246 O=C1NC(=O)C2=C(N1)CNC2 MCULE-7586984034 [1,0,0,1,0,0|2,0,0]=4 204 B12R2.246 O=C1NC(=O)C2=C(N1)CNC2 MCULE-8653470026 [1,0,0,1,0,0|2,0,0]=4 205 B12R2.246 O=C1NC(=O)C2=C(N1)COC2 MCULE-7021590045 [1,0,0,1,0,0|2,0,0]=4 206 B12R2.246 O=C1NC(=O)C2=C(N1)N=CS2 MCULE-7384114601 [1,0,0,1,0,0|1,1,0]=4 207 B12R2.246 O=C1NC(=O)C2=C(N1)NC=N2 MCULE-6687728468 [1,0,0,1,0,0|2,0,0]=4 208 B12R2.246 O=C1NC(=O)C2=C(N1)SC=C2 MCULE-4550777126 [1,0,0,1,0,0|2,0,0]=4 209 B14R2.8235 O=C1NC(=O)C2=CC(=CC=C2N1)O MCULE-9352525631 [0,0,0,1,0,1|1,0,1]=4 210 B14R2.29365 O=C1N=C2NC(=O)NC(=O)C2=NN1 MCULE-3070970616 [0,1,0,1,0,0|2,0,0]=4 211 B14R2.29365 O=C1NC(=O)C2=C(N1)C=C(C=C2)O MCULE-6185496326 [0,1,0,1,0,0|1,0,1]=4 212 B14R2.27750 CN1C(=O)NC2=C1C(=O)NC(=O)N2 MCULE-4205321409 [0,1,0,1,0,0|2,0,0]=4 213 B14R2.2925 CN1C(=O)NC2=C(C1=O)NC(=O)N2 MCULE-4767907249 [0,1,0,1,0,0|2,0,0]=4 214 B10R0.96 C(=CC(=O)NC(=O)N)C(=O)O MCULE-4345604400 [0,0,1,0,1,0|0,0,0]=2 215 B10R0.96 C(=C\C(=O)NC(=O)N)\C(=O)O MCULE-8812884630 [0,0,1,0,1,0|0,0,0]=2 216 B10R0.96 CC(=O)CC(=O)NCC(=O)O MCULE-8793325864 [0,0,1,0,1,0|1,0,1]=4 217 B10R0.98 O=C(O)CONC(=O)C(=O)O MCULE-7932028761 [0,0,1,0,1,0|2,0,0]=4 218 B10R0.23 O=CNC(CC(=O)O)C(=O)O MCULE-1319737382 [0,0,1,0,1,0|1,0,1]=4 219 B10R1.54 CC1=CC(=CS1)CC(=O)O MCULE-8700180303 [1,0,0,0,1,0|2,0,0]=4 220 B10R1.54 CC1=CC(=NN1)CC(=O)O MCULE-9189935482 [1,0,0,0,1,0|1,0,1]=4 221 B10R1.54 CC1=CC=C(O1)CC(=O)O MCULE-4642905149 [1,0,0,0,1,0|2,0,0]=4 222 B10R1.54 CC1=CC=C(S1)CC(=O)O MCULE-6426499804 [1,0,0,0,1,0|2,0,0]=4 223 B10R1.54 CC1=CNC(=N1)CC(=O)O MCULE-2246684939 [1,0,0,0,1,0|2,0,0]=4 224 B10R1.54 CC1=CSC(=C1)CC(=O)O MCULE-6328016056 [1,0,0,0,1,0|2,0,0]=4 225 B10R1.54 CC1=NNC(=C1)CC(=O)O MCULE-4936433367 [1,0,0,0,1,0|1,0,1]=4 226 B10R1.54 NC1=NNC(=C1)CC(=O)O MCULE-3869915440 [1,0,0,0,1,0|1,0,1]=4 227 B10R1.54 O=C(O)CC1=CC(=CS1)Br MCULE-8160824250 [1,0,0,0,1,0|2,0,0]=4 228 B10R1.54 O=C(O)CC1=CC(=O)NN1 MCULE-5112159197 [1,0,0,0,1,0|0,0,0]=2 229 B10R1.54 O=C(O)CC1=CC=C(S1)Br MCULE-3689606723 [1,0,0,0,1,0|2,0,0]=4 230 B10R1.54 O=C(O)CC1=CC=C(S1)Cl MCULE-3750481360 [1,0,0,0,1,0|2,0,0]=4 231 B10R1.54 O=C(O)CC1=CC=C(S1)F MCULE-8890895288 [1,0,0,0,1,0|2,0,0]=4 232 B10R1.54 O=C(O)CC1=CSC(=C1)Br MCULE-2092123395 [1,0,0,0,1,0|2,0,0]=4 233 B10R1.54 O=C(O)CC1=CSC(=C1)Cl MCULE-5249616412 [1,0,0,0,1,0|2,0,0]=4 234 B10R1.64 CC1=C(C=CS1)CC(=O)O MCULE-1419046904 [1,0,0,0,1,0|2,0,0]=4 235 B10R1.64 CC1=C(N=CN1)CC(=O)O MCULE-5024867197 [1,0,0,0,1,0|1,0,1]=4 236 B10R1.64 CC1=C(N=CN1)CC(=O)O MCULE-9587919004 [1,0,0,0,1,0|1,0,1]=4 237 B10R1.64 O=C(O)CC1=C(SC=C1)Br MCULE-9300722210 [1,0,0,0,1,0|2,0,0]=4 238 B10R1.64 O=C(O)CC1=C(SC=C1)Cl MCULE-3906836942 [1,0,0,0,1,0|2,0,0]=4 239 B10R1.113 CC(=O)C1=CC(=O)NC=C1 MCULE-4212592174 [1,0,0,0,1,0|2,0,0]=4 240 B10R1.113 CC(=O)C1=CC=CC(=O)N1 MCULE-6452912207 [1,0,0,0,1,0|2,0,0]=4 241 B10R1.113 O=C1C=C(C=CN1)C(=O)O MCULE-8873155750 [1,0,0,0,1,0|1,0,0]=3 242 B10R1.113 O=C1C=C(C=NN1)C(=O)O MCULE-3854450321 [1,0,0,0,1,0|2,0,0]=4 243 B10R1.113 O=C1C=CC=C(O1)C(=O)O MCULE-4419556396 [1,0,0,0,1,0|2,0,0]=4 244 B10R1.113 O=C1C=CN=C(N1)C(=O)O MCULE-1040826314 [1,0,0,0,1,0|2,0,0]=4 245 B10R1.113 O=C1C=COC(=C1)C(=O)O MCULE-3051094771 [1,0,0,0,1,0|2,0,0]=4 246 B10R1.113 O=C1C=NC=C(N1)C(=O)O MCULE-6285474543 [1,0,0,0,1,0|2,0,0]=4 247 B10R1.113 O=C1CC(=CC=N1)C(=O)O MCULE-3789271459 [1,0,0,0,1,0|1,0,1]=4 248 B10R1.113 O=C1N=CC=C(N1)C(=O)O MCULE-6042406465 [1,0,0,0,1,0|0,0,1]=3 249 B10R1.58 CC1=C(NC(=C1)C(=O)O)C MCULE-6402473251 [0,0,0,0,2,0|2,0,0]=4 250 B10R1.58 CN1C=C(NC1=O)C(=O)O MCULE-2401585728 [0,0,0,0,2,0|2,0,0]=4 251 B10R1.58 O=C(O)C1=CC(=C(N1)Br)Br MCULE-2071966305 [0,0,0,0,2,0|2,0,0]=4 252 B10R1.58 O=C(O)C1=CC(=C(N1)Br)Cl MCULE-1126259888 [0,0,0,0,2,0|2,0,0]=4 253 B10R1.58 O=C(O)C1=CC(=C(N1)Cl)Br MCULE-8662935062 [0,0,0,0,2,0|2,0,0]=4 254 B10R1.58 O=C(O)C1=CC(=C(N1)Cl)Cl MCULE-8176278880 [0,0,0,0,2,0|2,0,0]=4 255 B10R1.59 CC(=C1NC(=O)NC1=O)C MCULE-7822860475 [0,0,0,0,2,0|2,0,0]=4 256 B10R1.59 CC(=O)C1=C(NC(=O)N1)C MCULE-7841084710 [0,0,0,0,2,0|2,0,0]=4 257 B10R1.59 CC1=C(NC(=O)N1)C(=O)O MCULE-4489172846 [0,0,0,0,2,0|1,0,0]=3 258 B10R1.59 CC1=C(NC(=O)O1)C(=O)O MCULE-3936623227 [0,0,0,0,2,0|2,0,0]=4 259 B10R1.59 CC1=C(SC(=O)N1)C(=O)O MCULE-8001416115 [0,0,0,0,2,0|2,0,0]=4 260 B10R1.59 CC1=CC(=C(N1)C)C(=O)O MCULE-8264342260 [0,0,0,0,2,0|2,0,0]=4 261 B10R1.59 O=C1CC(C(=O)N1)C(=O)O MCULE-7458355147 [0,0,0,0,2,0|0,0,2]=4 262 B12R1.226 O=C(O)CSC1=NC=CC(=O)N1 MCULE-1643961344 [1,0,0,0,0,1|2,0,0]=4 263 B12R1.233 CC(=O)CN1C=CC(=O)NC1=O MCULE-2274569922 [0,0,0,0,1,1|2,0,0]=4 264 B12R1.233 CC(=O)NC1=CNC(=O)NC1=O MCULE-1932795758 [0,0,0,0,1,1|2,0,0]=4 265 B12R1.233 CC(=O)OC1=CNC(=O)NC1=O MCULE-8982873943 [0,0,0,0,1,1|2,0,0]=4 266 B12R1.233 CC1=NC=C(C(=O)N1)CC(=O)O MCULE-3429376440 [0,0,0,0,1,1|1,0,0]=3 267 B12R1.233 NC(=O)CN1C=CC(=O)NC1=O MCULE-1683769362 [0,0,0,0,1,1|2,0,0]=4 268 B12R1.233 NC1=NC=C(C(=O)N1)CC(=O)O MCULE-5319226343 [0,0,0,0,1,1|1,0,0]=3 269 B12R1.233 O=C(O)CC1=CNC(=O)NC1=O MCULE-6693782917 [0,0,0,0,1,1|0,0,0]=2 270 B12R1.233 O=C(O)CN1C=CC(=O)NC1=O MCULE-4972491859 [0,0,0,0,1,1|1,0,0]=3 271 B12R1.233 O=C(O)CN1CCC(=O)NC1=O MCULE-9627673350 [0,0,0,0,1,1|1,0,1]=4 272 B12R1.233 O=C(O)CN1N=CC(=O)NC1=O MCULE-9617115602 [0,0,0,0,1,1|1,0,0]=3