0 B11R1.426 CC1(NC(=O)N(C1=O)CO)C MCULE-3291731066 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.426 CC1=C(C(=O)OC1(C)C)C#N MCULE-7358687892 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.426 CCN1C(=O)NC(C1=O)(C)C MCULE-1261172417 [0,0,0,0,0,0|1,0,0]=1 3 B10R1.33 CC1(CN(C(=O)O1)N=O)C MCULE-6183231952 [1,0,0,0,0,0|2,0,1]=4 4 B10R1.33 CCN1CC(N=C1C)(C)C MCULE-7624656927 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.33 CNC1CC(OC1=O)(C)C MCULE-1786341770 [1,0,0,0,0,0|2,0,1]=4 6 B10R1.33 CNC1CC(OC1=O)(C)C MCULE-2918613657 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.256 CCN1C(=O)C=C(C1=O)C MCULE-6445056699 [1,0,0,0,0,0|1,0,1]=3 8 B10R1.256 CCN1C(=O)CC(C1=O)O MCULE-3060345343 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.256 CCN1C(=O)CN(C1=S)C MCULE-1138691633 [1,0,0,0,0,0|2,1,0]=4 10 B10R1.256 CCN1C(=O)NC(=O)C1=O MCULE-3121866834 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.256 COC1=C(OC(C1=O)C)C MCULE-2886097661 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.271 CC1(NC(=O)N(C1=O)N)C MCULE-5997216429 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.271 CC1=C(C(OC1=O)(C)O)C MCULE-1508842425 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.271 CN1C(=O)NC(C1=O)(C)C MCULE-3004657157 [1,0,0,0,0,0|1,0,0]=2 15 B10R1.271 CN1C(=O)OC(C1=O)(C)C MCULE-4761457520 [1,0,0,0,0,0|0,0,0]=1 16 B12R1.860 CC(=O)C1=C(C(OC1=O)(C)C)C MCULE-6340426362 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.1116 C=CCN1C(=O)NC(C1=O)(C)C MCULE-6207654293 [0,1,0,0,0,0|1,0,1]=3 18 B12R1.1116 CC1(NC(=O)N(C1=O)CC#N)C MCULE-1131684889 [0,1,0,0,0,0|1,0,1]=3 19 B12R1.1116 CC1(NC(=O)N(C1=O)CCBr)C MCULE-3645761046 [0,1,0,0,0,0|1,0,0]=2 20 B12R1.1116 CC1(NC(=O)N(C1=O)CCCl)C MCULE-3137215047 [0,1,0,0,0,0|1,0,0]=2 21 B12R1.1116 CC1(NC(=O)N(C1=O)CCO)C MCULE-9392575871 [0,1,0,0,0,0|1,0,0]=2 22 B12R1.1116 CC1(OC(=O)N(C1=O)CCN)C MCULE-2142418040 [0,1,0,0,0,0|0,0,0]=1 23 B12R1.1116 CC1(OC(=O)N(C1=O)CCN)C MCULE-8251759908 [0,1,0,0,0,0|0,0,0]=1 24 B12R1.1116 CC1(SC(=O)N(C1=O)CCN)C MCULE-2960326528 [0,1,0,0,0,0|0,1,0]=2 25 B12R1.1116 CC1(SC(=O)N(C1=O)CCN)C MCULE-5895668306 [0,1,0,0,0,0|0,1,0]=2 26 B12R1.2551 CN1C(=O)N(C(=O)C1(C)C)CBr MCULE-4048995655 [0,1,0,0,0,0|2,0,0]=3 27 B10R0.7 CCOC(=O)CC(C)(C)C=O MCULE-4799490139 [0,0,1,0,0,0|2,0,0]=3 28 B10R0.9 CCN(CC)C(=O)C(C)(C)Br MCULE-5841392388 [0,0,1,0,0,0|2,0,1]=4 29 B10R0.9 CCN(CC)C(=O)C(C)(C)N MCULE-1684693524 [0,0,1,0,0,0|2,0,1]=4 30 B10R0.9 CCN(CC)C(=O)C(C)(C)N MCULE-5717524742 [0,0,1,0,0,0|2,0,1]=4 31 B10R0.129 C=CCC(C)(C)C(=O)OCC MCULE-1237143167 [0,0,1,0,0,0|3,0,0]=4 32 B12R1.451 CC1(NC(=O)C(NC1=O)CO)C MCULE-9164668115 [0,0,0,0,0,1|3,0,0]=4 33 B12R1.798 CC1(OC(=O)C(=CN)C(=O)O1)C MCULE-7126089992 [0,0,0,0,0,1|2,0,1]=4 34 B12R1.798 CC1(OC(=O)C(=NN)C(=O)O1)C MCULE-8134368949 [0,0,0,0,0,1|3,0,0]=4 35 B12R1.798 CC1(OC(=O)C(=NO)C(=O)O1)C MCULE-5920739404 [0,0,0,0,0,1|3,0,0]=4 36 B12R1.798 CCC1C(=O)OC(OC1=O)(C)C MCULE-7125817811 [0,0,0,0,0,1|1,0,0]=2 37 B9R0.44 CC(C)(C)OC(=O)NCO MCULE-6472739949 [1,0,1,0,0,0|1,0,1]=4 38 B9R0.44 CCCC(=O)OC(C)(C)C MCULE-8182416948 [1,0,1,0,0,0|1,0,1]=4 39 B9R0.44 CCNC(=O)OC(C)(C)C MCULE-4129719037 [1,0,1,0,0,0|0,0,1]=3 40 B9R0.44 CNNC(=O)OC(C)(C)C MCULE-9644859504 [1,0,1,0,0,0|1,0,1]=4 41 B9R0.44 CONC(=O)OC(C)(C)C MCULE-3630353720 [1,0,1,0,0,0|1,0,1]=4 42 B9R0.29 CCC(C(=O)O)C(=O)OC MCULE-1272120302 [1,0,1,0,0,0|2,0,0]=4 43 B9R0.39 CCC(CC(C)C)C(=O)O MCULE-5215518236 [1,0,1,0,0,0|1,0,1]=4 44 B9R0.39 CCC(NC(C)C)C(=O)O MCULE-7235932783 [1,0,1,0,0,0|2,0,0]=4 45 B9R0.39 CCC(NC(C)C)C(=O)O MCULE-7934342287 [1,0,1,0,0,0|2,0,0]=4 46 B9R0.79 CN(C)C(=O)N(C)C(=O)Cl MCULE-3418363806 [1,0,1,0,0,0|2,0,0]=4 47 B9R0.19 C=CC(C)(C)C(=O)OCC MCULE-5663180861 [1,0,1,0,0,0|2,0,0]=4 48 B9R0.19 CCNC(=O)C(C)(C)CCl MCULE-2842033963 [1,0,1,0,0,0|1,0,1]=4 49 B9R0.19 CCNC(=O)C(C)(C)CN MCULE-7606402990 [1,0,1,0,0,0|1,0,1]=4 50 B9R0.19 CCOC(=O)C(C)(C)ON MCULE-7664868259 [1,0,1,0,0,0|2,0,0]=4 51 B9R0.60 COC(=O)C(C)(C)CC=O MCULE-4092182602 [1,0,1,0,0,0|2,0,0]=4 52 B9R0.23 CC(C)OC(=O)C(=O)CBr MCULE-5394267565 [1,0,1,0,0,0|2,0,0]=4 53 B9R0.23 CC=C(C)C(=O)OC(C)C MCULE-9009554625 [1,0,1,0,0,0|2,0,0]=4 54 B9R0.23 CCC(C)C(=O)OC(C)C MCULE-1304634433 [1,0,1,0,0,0|1,0,1]=4 55 B9R0.23 CC[C@H](N)C(=O)OC(C)C MCULE-5109172330 [1,0,1,0,0,0|2,0,0]=4 56 B9R0.23 CC[C@H](N)C(=O)OC(C)C MCULE-6155197629 [1,0,1,0,0,0|2,0,0]=4 57 B9R0.37 CCOC(=O)C(C=O)CC MCULE-3620581208 [1,0,1,0,0,0|1,0,0]=3 58 B9R0.37 CCOC(=O)N(CC)CC MCULE-9734341294 [1,0,1,0,0,0|1,0,1]=4 59 B9R1.36 CC1OC(OC1=O)(C)C MCULE-1281784579 [2,0,0,0,0,0|2,0,0]=4 60 B9R1.36 CC1SC(OC1=O)(C)C MCULE-1070141041 [2,0,0,0,0,0|2,0,0]=4 61 B9R1.27 CCC1C(=O)CCC1=O MCULE-9997239659 [2,0,0,0,0,0|2,0,0]=4 62 B9R1.27 CCN1C(=O)C=CC1=O MCULE-9216989340 [2,0,0,0,0,0|1,0,1]=4 63 B9R1.27 CCN1C(=O)CCC1=O MCULE-3955479682 [2,0,0,0,0,0|1,0,0]=3 64 B9R1.27 CCN1C(=O)CNC1=O MCULE-7012305681 [2,0,0,0,0,0|1,0,0]=3 65 B9R1.27 CCN1C(=O)CNC1=S MCULE-4101647203 [2,0,0,0,0,0|1,1,0]=4 66 B9R1.27 CCN1C(=O)COC1=S MCULE-8441116729 [2,0,0,0,0,0|0,1,0]=3 67 B9R1.27 CCN1C(=O)CSC1=S MCULE-7069138767 [2,0,0,0,0,0|0,2,0]=4 68 B9R1.27 O=C1CCC(=O)N1CO MCULE-2404690751 [2,0,0,0,0,0|2,0,0]=4 69 B9R1.37 CC1=C(C(OC1=O)C)C MCULE-1587463592 [2,0,0,0,0,0|2,0,0]=4 70 B9R1.37 CC1=C(C(OC1=O)C)O MCULE-9804613276 [2,0,0,0,0,0|1,0,1]=4 71 B9R1.37 CC1NC(=O)N(C1=O)C MCULE-9574379568 [2,0,0,0,0,0|1,0,0]=3 72 B9R1.37 CN1C(=O)CC(C1=O)N MCULE-1881097860 [2,0,0,0,0,0|2,0,0]=4 73 B9R1.37 CN1C(=O)CC(C1=O)N MCULE-9743249390 [2,0,0,0,0,0|2,0,0]=4 74 B9R1.37 CN1C(=O)CC(C1=O)O MCULE-4159978894 [2,0,0,0,0,0|2,0,0]=4 75 B9R1.37 CN1C(=O)C[C@@H](C1=O)N MCULE-4253353358 [2,0,0,0,0,0|2,0,0]=4 76 B9R1.37 CN1C(=O)C[C@@H](C1=O)N MCULE-8722122900 [2,0,0,0,0,0|2,0,0]=4 77 B9R1.37 CN1C(=O)C[C@@H](C1=O)O MCULE-4702742954 [2,0,0,0,0,0|2,0,0]=4 78 B9R1.37 CN1CC(=O)N(C1=O)C MCULE-4679697256 [2,0,0,0,0,0|2,0,0]=4 79 B9R1.38 C=C1OC(=O)OC1(C)C MCULE-6317618259 [2,0,0,0,0,0|2,0,0]=4 80 B9R1.38 CC1(CC(=O)CC1=O)C MCULE-3397643509 [2,0,0,0,0,0|2,0,0]=4 81 B9R1.38 CC1(CC(=O)NC1=O)Br MCULE-2450694121 [2,0,0,0,0,0|2,0,0]=4 82 B9R1.38 CC1(CC(=O)NC1=O)C MCULE-3157279987 [2,0,0,0,0,0|1,0,0]=3 83 B9R1.38 CC1(CC(=O)OC1=O)C MCULE-3767285740 [2,0,0,0,0,0|2,0,0]=4 84 B9R1.38 CC1(NC(=O)CC1=O)C MCULE-8883060941 [2,0,0,0,0,0|2,0,0]=4 85 B9R1.38 CC1(NC(=O)NC1=O)C MCULE-9870409973 [2,0,0,0,0,0|1,0,0]=3 86 B9R1.38 CC1(NC(=S)NC1=O)C MCULE-8133524359 [2,0,0,0,0,0|1,1,0]=4 87 B9R1.38 CC1(OC(=O)C=C1O)C MCULE-8125069507 [2,0,0,0,0,0|1,0,1]=4 88 B9R1.38 CC1(OC(=O)CC1=O)C MCULE-9824471420 [2,0,0,0,0,0|1,0,0]=3 89 B9R1.38 CC1(OC(=O)N=C1N)C MCULE-1911233295 [2,0,0,0,0,0|1,0,1]=4 90 B9R1.38 CC1(OC(=O)NC1=O)C MCULE-2681916511 [2,0,0,0,0,0|0,0,0]=2 91 B9R1.38 CC1(SC(=O)NC1=O)C MCULE-6487661721 [2,0,0,0,0,0|0,1,0]=3 92 B11R0.10 CCNC(=O)NC(C)(C)C(=O)O MCULE-7476059103 [0,1,1,0,0,0|1,0,0]=3 93 B11R0.10 CCOC(=O)CC(C)(C)C(=O)O MCULE-5549660149 [0,1,1,0,0,0|2,0,0]=4 94 B11R0.240 CCOC(=O)C(C)(C)CC(=O)C MCULE-4498380902 [0,1,1,0,0,0|2,0,0]=4 95 B11R0.240 CCOC(=O)C(C)(C)CC(=O)O MCULE-1399412079 [0,1,1,0,0,0|2,0,0]=4 96 B11R0.240 CCOC(=O)C(C)(C)SC(=O)C MCULE-6544059143 [0,1,1,0,0,0|1,1,0]=4 97 B11R0.172 C=CN(C=O)C(=O)OC(C)(C)C MCULE-9313983662 [0,1,1,0,0,0|0,0,2]=4 98 B11R0.172 CCN(CC)C(=O)OC(C)(C)C MCULE-6482745846 [0,1,1,0,0,0|1,0,1]=4 99 B11R1.184 CC1(OC(=O)[C@@H](O1)CCO)C MCULE-3850668628 [1,1,0,0,0,0|2,0,0]=4 100 B11R1.598 CC1NC(=O)N(C1=O)CCCl MCULE-9896410254 [1,1,0,0,0,0|1,0,0]=3 101 B11R1.598 CCCN1C(=O)NN(C1=O)C MCULE-7175135426 [1,1,0,0,0,0|2,0,0]=4 102 B11R1.598 CN1CC(=O)N(C1=O)CCCl MCULE-4318882867 [1,1,0,0,0,0|2,0,0]=4 103 B11R1.419 CC1=C(C(OC1=O)(C)CO)O MCULE-7737989964 [1,1,0,0,0,0|1,0,1]=4 104 B11R1.419 CCC1(NC(=O)N(C1=O)N)C MCULE-8234611830 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.419 CC[C@@]1(OC(=O)N(C1=O)C)C MCULE-5441814919 [1,1,0,0,0,0|0,0,0]=2 106 B11R1.419 CC[C@@]1(OC(=O)N(C1=O)C)C MCULE-9664978042 [1,1,0,0,0,0|0,0,0]=2 107 B11R1.1330 CC1(C(=O)N(C(=O)N1Br)Br)C MCULE-7169148032 [1,1,0,0,0,0|2,0,0]=4 108 B11R1.1330 CC1(C(=O)N(C(=O)N1Br)Cl)C MCULE-3604459921 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.1330 CC1(C(=O)N(C(=O)N1Cl)Cl)C MCULE-4657544987 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.1330 CC1(C(=O)N(C(=O)N1I)I)C MCULE-8908869825 [1,1,0,0,0,0|2,0,0]=4 111 B13R1.2902 CC1=NN(C(=O)OC1(C)C)CCO MCULE-9870575719 [0,1,0,0,0,1|1,0,0]=3 112 B13R1.3946 CCCN1C(=O)CC(CC1=O)(C)C MCULE-5301796261 [0,1,0,0,0,1|1,0,0]=3 113 B13R1.3946 COC=C1C(=O)OC(OC1=O)(C)C MCULE-7174041710 [0,1,0,0,0,1|1,0,1]=4 114 B13R1.8379 CC(=C1C(=O)OC(OC1=O)(C)C)C MCULE-6004812566 [0,1,0,0,0,1|1,0,1]=4 115 B13R1.8379 CC(=C1C(=O)OC(OC1=O)(C)C)N MCULE-5901290446 [0,1,0,0,0,1|1,0,1]=4 116 B13R1.8379 CC(=C1C(=O)OC(OC1=O)(C)C)O MCULE-8518434376 [0,1,0,0,0,1|1,0,1]=4 117 B13R1.8379 CC(=O)C1C(=O)OC(OC1=O)(C)C MCULE-2077112264 [0,1,0,0,0,1|1,0,1]=4 118 B13R1.1623 C=C1N(C(=O)OC1(C)C)CCC#N MCULE-3913244824 [0,2,0,0,0,0|1,0,0]=3 119 B13R1.1623 CC1(NC(=O)N(C1=O)CCC#N)C MCULE-7244348419 [0,2,0,0,0,0|1,0,0]=3 120 B13R1.1623 CC1(NC(=O)N(C1=O)CCCCl)C MCULE-3939303669 [0,2,0,0,0,0|1,0,0]=3 121 B13R1.8103 CC1(OC(=O)N(C1(C)O)CCO)C MCULE-7837597695 [0,2,0,0,0,0|0,0,2]=4 122 B13R1.8499 CC1(CC(=O)N(C1=O)CC(=O)O)C MCULE-1909357187 [0,2,0,0,0,0|1,0,1]=4 123 B13R1.8499 CC1(NC(=O)N(C1=O)CC(=O)O)C MCULE-1694466713 [0,2,0,0,0,0|1,0,1]=4 124 B13R1.8499 CC1(OC(=O)N(C1=O)CC(=O)O)C MCULE-5291689001 [0,2,0,0,0,0|0,0,1]=3 125 B13R1.7158 CC1(C(=O)N(C(=O)N1CO)CO)C MCULE-7284808609 [0,2,0,0,0,0|2,0,0]=4 126 B11R1.325 CC1CC(=O)CC(C1=O)(C)C MCULE-1145217211 [0,0,1,1,0,0|2,0,0]=4 127 B11R1.72 CCN1C(=O)CCC(C1=O)N MCULE-5438763345 [0,0,1,1,0,0|2,0,0]=4 128 B11R1.89 CC(C)C(=O)N1CCCC1=O MCULE-4475531947 [0,0,1,1,0,0|1,0,0]=3 129 B11R1.89 CC(Cl)C(=O)N1CCNC1=O MCULE-1957685929 [0,0,1,1,0,0|2,0,0]=4 130 B11R1.159 O=C(O)C1CCCC(C1=O)Br MCULE-3186177717 [0,0,1,1,0,0|2,0,0]=4 131 B11R1.1109 CN(C)C(=O)C1(CC1)C(=O)O MCULE-6131436403 [0,0,1,1,0,0|2,0,0]=4 132 B11R1.833 CCOC(=O)C1(CC(=O)C1)C MCULE-9364139080 [0,0,1,1,0,0|2,0,0]=4 133 B13R2.22433 CC1(OC(=O)C2(CC2)C(=O)O1)C MCULE-4885193836 [0,0,0,1,0,1|1,0,0]=3 134 B13R2.12159 CC1(OC(=O)N2C1CNCC2)C MCULE-2843677704 [0,1,0,1,0,0|1,0,1]=4 135 B13R2.12159 CC1(OC(=O)N2C1CNCC2)C MCULE-7058187078 [0,1,0,1,0,0|1,0,1]=4 136 B13R2.12159 [C@@H]12CNCCN1C(=O)OC2(C)C MCULE-1191839089 [0,1,0,1,0,0|1,0,1]=4 137 B13R2.12159 [C@@H]12CNCCN1C(=O)OC2(C)C MCULE-1760855774 [0,1,0,1,0,0|1,0,1]=4 138 B13R2.12159 [C@@H]12CNCCN1C(=O)OC2(C)C MCULE-6507325419 [0,1,0,1,0,0|1,0,1]=4 139 B13R2.12159 [C@@H]12CNCCN1C(=O)OC2(C)C MCULE-8220135158 [0,1,0,1,0,0|1,0,1]=4 140 B11R0.275 CC(C)C(=O)N[C@@H](CO)C(=O)O MCULE-3454911567 [0,0,1,0,0,1|2,0,0]=4 141 B11R0.275 CC(C)C(=O)N[C@@H](CS)C(=O)O MCULE-1923581341 [0,0,1,0,0,1|2,0,0]=4 142 B11R0.275 CCC(NC(=O)C(C)N)C(=O)O MCULE-6209330743 [0,0,1,0,0,1|2,0,0]=4 143 B11R1.10 CCC1=CC(=O)OC(O1)(C)C MCULE-1615936283 [1,0,0,0,0,1|2,0,0]=4 144 B11R1.680 CC1C(=O)CCC(C1=O)(C)C MCULE-7007078724 [1,0,0,0,0,1|2,0,0]=4 145 B11R1.1361 CC1(OC(=O)C(C(=O)O1)Br)C MCULE-1203596555 [1,0,0,0,0,1|2,0,0]=4 146 B11R1.1361 CC1=C(C(=O)OC(O1)(C)C)C MCULE-9658985282 [1,0,0,0,0,1|2,0,0]=4 147 B11R1.1361 CC1C(=O)OC(OC1=O)(C)C MCULE-6456439568 [1,0,0,0,0,1|1,0,0]=3