0 B14R1.540 CC(C)C/C=C(/C=O)\C1=CC=CC=C1 MCULE-6387347700 [0,0,0,0,0,0|0,0,0]=0 1 B14R1.540 CC(C)CC=C(C=O)C1=CC=CC=C1 MCULE-7113688530 [0,0,0,0,0,0|0,0,0]=0 2 B14R1.540 CCC(NCC(C)C)C1=CC=CC=C1 MCULE-7486049335 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.540 CCC(NCC(C)C)C1=CC=CC=C1 MCULE-8578984843 [0,0,0,0,0,0|2,0,2]=4 4 B14R1.540 CN(C)CCC(=NO)C1=CC=CC=C1 MCULE-8958586900 [0,0,0,0,0,0|2,0,2]=4 5 B14R1.540 CNC(CCC(C)C)C1=CC=CC=C1 MCULE-6863678391 [0,0,0,0,0,0|2,0,2]=4 6 B14R1.540 C[NH+](C)CCC(=NO)C1=CC=CC=C1 MCULE-7079937460 [0,0,0,0,0,0|2,0,2]=4 7 B13R1.45 C=C(C)COC(=O)C1=CC=CC=C1 MCULE-5785891494 [1,0,0,0,0,0|1,0,2]=4 8 B13R1.45 CC(=NNC(=O)C1=CC=CC=C1)C MCULE-4464244926 [1,0,0,0,0,0|2,0,1]=4 9 B13R1.45 CC(=NOC(=O)C1=CC=CC=C1)C MCULE-3613370706 [1,0,0,0,0,0|2,0,1]=4 10 B13R1.45 CC(=O)CCC(=O)C1=CC=CC=C1 MCULE-7185754790 [1,0,0,0,0,0|1,0,2]=4 11 B13R1.45 CC(=O)CNC(=O)C1=CC=CC=C1 MCULE-9561319105 [1,0,0,0,0,0|2,0,1]=4 12 B13R1.45 CC(=O)COC(=O)C1=CC=CC=C1 MCULE-2410376645 [1,0,0,0,0,0|2,0,1]=4 13 B13R1.45 CC(Br)CCC(=O)C1=CC=CC=C1 MCULE-7280773803 [1,0,0,0,0,0|1,0,1]=3 14 B13R1.45 CC(C)CCC(=O)C1=CC=CC=C1 MCULE-1823903499 [1,0,0,0,0,0|0,0,1]=2 15 B13R1.45 CC(C)CCC(=O)C1=NC=CC=C1 MCULE-7257626354 [1,0,0,0,0,0|1,0,1]=3 16 B13R1.45 CC(C)CC[C@@H](N)C1=CC=CC=C1 MCULE-1291319448 [1,0,0,0,0,0|1,0,2]=4 17 B13R1.45 CC(C)CC[C@@H](N)C1=CC=CC=C1 MCULE-6924881366 [1,0,0,0,0,0|1,0,2]=4 18 B13R1.45 CC(C)CC[C@H](N)C1=CC=CC=C1 MCULE-4502227889 [1,0,0,0,0,0|1,0,2]=4 19 B13R1.45 CC(C)CC[C@H](N)C1=CC=CC=C1 MCULE-8423089033 [1,0,0,0,0,0|1,0,2]=4 20 B13R1.45 CC(C)CNC(=O)C1=CC=CC=C1 MCULE-2872359130 [1,0,0,0,0,0|1,0,0]=2 21 B13R1.45 CC(C)CNC(=O)C1=CC=CN=C1 MCULE-2725669291 [1,0,0,0,0,0|2,0,0]=3 22 B13R1.45 CC(C)COC(=O)C1=CC=CC=C1 MCULE-7961298209 [1,0,0,0,0,0|1,0,0]=2 23 B13R1.45 CC(C)NCC(=O)C1=CC=CC=C1 MCULE-2551286707 [1,0,0,0,0,0|1,0,1]=3 24 B13R1.45 CC(C)NNC(=O)C1=CC=CC=C1 MCULE-2852555827 [1,0,0,0,0,0|2,0,0]=3 25 B13R1.45 CC(C)NNC(=O)C1=CC=NC=C1 MCULE-1824332602 [1,0,0,0,0,0|3,0,0]=4 26 B13R1.45 CC(C)NNC(=O)C1=CC=NC=C1 MCULE-9007368136 [1,0,0,0,0,0|3,0,0]=4 27 B13R1.45 CC(C)NNC(=S)C1=CC=CC=C1 MCULE-3495623612 [1,0,0,0,0,0|2,1,0]=4 28 B13R1.45 CC(O)CNC(=O)C1=CC=CC=C1 MCULE-2076833592 [1,0,0,0,0,0|2,0,0]=3 29 B13R1.45 CC(O)COC(=O)C1=CC=CC=C1 MCULE-4649003528 [1,0,0,0,0,0|2,0,0]=3 30 B13R1.45 CN(C)/C=C/C(=O)C1=CC=CC=C1 MCULE-8764130459 [1,0,0,0,0,0|1,0,1]=3 31 B13R1.45 CN(C)/C=C/C(=O)C1=CC=NC=C1 MCULE-8612938624 [1,0,0,0,0,0|2,0,1]=4 32 B13R1.45 CN(C)/C=C/C(=O)C1=CN=CC=C1 MCULE-2570174011 [1,0,0,0,0,0|2,0,1]=4 33 B13R1.45 CN(C)/C=C/C(=O)C1=NC=CC=C1 MCULE-8215733636 [1,0,0,0,0,0|2,0,1]=4 34 B13R1.45 CN(C)/C=N/C(=O)C1=CC=CC=C1 MCULE-9636224251 [1,0,0,0,0,0|2,0,1]=4 35 B13R1.45 CN(C)C=CC(=O)C1=CC=CC=C1 MCULE-2511980413 [1,0,0,0,0,0|1,0,1]=3 36 B13R1.45 CN(C)C=CC(=O)C1=CC=NC=C1 MCULE-6885328414 [1,0,0,0,0,0|2,0,1]=4 37 B13R1.45 CN(C)C=CC(=O)C1=CN=CC=C1 MCULE-2307059593 [1,0,0,0,0,0|2,0,1]=4 38 B13R1.45 CN(C)C=CC(=O)C1=NC=CC=C1 MCULE-8040701519 [1,0,0,0,0,0|2,0,1]=4 39 B13R1.45 CN(C)C=NC(=O)C1=CC=CC=C1 MCULE-6685833311 [1,0,0,0,0,0|2,0,1]=4 40 B13R1.45 CN(C)CCC(=O)C1=CC=CC=C1 MCULE-4031792903 [1,0,0,0,0,0|1,0,1]=3 41 B13R1.45 CN(C)CCS(=O)C1=CC=CC=C1 MCULE-5200877785 [1,0,0,0,0,0|2,0,1]=4 42 B13R1.45 C[N+](=CC=C(Cl)C1=CC=CC=C1)C MCULE-2147474295 [1,0,0,0,0,0|2,0,1]=4 43 B13R1.45 C[N+](=CC=C(Cl)C1=CC=CC=C1)C MCULE-2905915184 [1,0,0,0,0,0|2,0,1]=4 44 B13R1.45 C[NH+](C)CCC(=O)C1=CC=CC=C1 MCULE-4520702289 [1,0,0,0,0,0|1,0,1]=3 45 B13R1.45 O=C(CCC(F)Cl)C1=CC=CC=C1 MCULE-7401821452 [1,0,0,0,0,0|2,0,1]=4 46 B15R1.1350 CC(C)NC(=O)C(=NO)C1=CC=CC=C1 MCULE-3863103014 [0,1,0,0,0,0|2,0,1]=4 47 B15R2.6 CC(C)CCN1C=NC2=CC=CC=C12 MCULE-5210091043 [0,0,0,1,0,0|2,0,1]=4 48 B15R2.6 CN(C)CCC1=CNC2=C1C=CC=C2 MCULE-1451594833 [0,0,0,1,0,0|2,0,1]=4 49 B15R2.59 CC(C)C1=NC(=CN1)C2=CC=CC=C2 MCULE-9227079966 [0,0,0,1,0,0|2,0,1]=4 50 B15R2.59 CC(C)C1NC(=NO1)C2=CC=CC=C2 MCULE-2948504843 [0,0,0,1,0,0|2,0,1]=4 51 B15R2.59 CC(C)C1NN=C(S1)C2=CC=CC=C2 MCULE-4578161902 [0,0,0,1,0,0|3,0,0]=4 52 B15R2.59 CC(N)C1=CC(=CS1)C2=CC=CC=C2 MCULE-2116905864 [0,0,0,1,0,0|1,1,1]=4 53 B15R2.389 CC1CC=C(C(=S)N1)C2=CC=CC=C2 MCULE-2361157084 [0,0,0,1,0,0|1,1,0]=3 54 B15R2.39201 CC(=O)N1C=C(C2=C1C=CC=C2)C=O MCULE-9607429633 [0,0,0,1,0,0|2,0,1]=4 55 B15R2.39201 CC(C)C1=NC(=C2N1C=CC=C2)C=O MCULE-9498246990 [0,0,0,1,0,0|2,0,1]=4 56 B15R2.39201 CC(C)N1C=C(C2=CC=CC=C12)C=O MCULE-3264894555 [0,0,0,1,0,0|1,0,0]=2 57 B15R2.39201 O=CC1=CN(C2=C1C=CC=C2)C(F)F MCULE-4185555222 [0,0,0,1,0,0|3,0,0]=4 58 B13R1.713 CC(C)C=C(C=O)C1=CC=CC=C1 MCULE-6844623149 [0,0,0,0,1,0|0,0,0]=1 59 B13R1.713 CC(C)CC(C=O)C1=CC=CC=C1 MCULE-1509810170 [0,0,0,0,1,0|0,0,1]=2 60 B13R1.713 CC(C)OC(C=O)C1=CC=CC=C1 MCULE-3760585313 [0,0,0,0,1,0|1,0,1]=3 61 B13R1.713 CN(C)/C=C(/C=O)\C1=CC=CC=C1 MCULE-9736489676 [0,0,0,0,1,0|1,0,0]=2 62 B13R1.713 CN(C)/C=C(\C#N)/C1=CC=CC=C1 MCULE-2160061116 [0,0,0,0,1,0|2,0,1]=4 63 B13R1.713 CN(C)C=C(C#N)C1=CC=CC=C1 MCULE-6135941933 [0,0,0,0,1,0|2,0,1]=4 64 B13R1.713 CN(C)C=C(C=O)C1=CC=CC=C1 MCULE-9227191445 [0,0,0,0,1,0|1,0,0]=2 65 B12R1.3 CC/C=C(/C=O)\C1=CC=CC=C1 MCULE-7691971925 [2,0,0,0,0,0|0,0,0]=2 66 B12R1.3 CCC=C(C=O)C1=CC=CC=C1 MCULE-5468646625 [2,0,0,0,0,0|0,0,0]=2 67 B12R1.3 CCCC(C=O)C1=CC=CC=C1 MCULE-6791633860 [2,0,0,0,0,0|0,0,1]=3 68 B12R1.3 CCCN(N=O)C1=CC=CC=C1 MCULE-8892393921 [2,0,0,0,0,0|2,0,0]=4 69 B12R1.30 CCCCC(=O)C1=CC=CC=C1 MCULE-2120491215 [2,0,0,0,0,0|0,0,1]=3 70 B12R1.30 CCCCC(=O)C1=CC=CN=C1 MCULE-1762810564 [2,0,0,0,0,0|1,0,1]=4 71 B12R1.30 CCCCC(=O)C1=CC=NC=C1 MCULE-2175442415 [2,0,0,0,0,0|1,0,1]=4 72 B12R1.30 CCCCC(=O)C1=NC=CC=C1 MCULE-8455541974 [2,0,0,0,0,0|1,0,1]=4 73 B12R1.30 CCCNC(=O)C1=CC=CC=C1 MCULE-4241205995 [2,0,0,0,0,0|1,0,0]=3 74 B12R1.30 CCCNC(=O)C1=CN=CC=C1 MCULE-6346494359 [2,0,0,0,0,0|2,0,0]=4 75 B12R1.30 CCCOC(=O)C1=CC=CC=C1 MCULE-8178011188 [2,0,0,0,0,0|1,0,0]=3 76 B12R1.30 CCCOC(=O)C1=CN=CC=C1 MCULE-3317018482 [2,0,0,0,0,0|2,0,0]=4 77 B12R1.30 CCCOC(=O)C1=NC=CC=C1 MCULE-8227166107 [2,0,0,0,0,0|2,0,0]=4 78 B12R1.30 CCNNC(=O)C1=CC=CC=C1 MCULE-4553557168 [2,0,0,0,0,0|2,0,0]=4 79 B12R1.30 CCOCC(=O)C1=CC=CC=C1 MCULE-6786448756 [2,0,0,0,0,0|1,0,1]=4 80 B12R1.30 CCONC(=O)C1=CC=CC=C1 MCULE-7749362693 [2,0,0,0,0,0|2,0,0]=4 81 B12R1.30 CCSCC(=O)C1=CC=CC=C1 MCULE-5125059464 [2,0,0,0,0,0|1,0,1]=4 82 B12R1.30 CNCC=C(C)C1=CC=CC=C1 MCULE-6747244384 [2,0,0,0,0,0|1,0,1]=4 83 B12R1.30 CNCCC(=O)C1=CC=CC=C1 MCULE-2208291090 [2,0,0,0,0,0|1,0,1]=4 84 B12R1.30 CNCCC(=O)C1=CC=CC=C1 MCULE-4546614173 [2,0,0,0,0,0|1,0,1]=4 85 B12R1.30 CSCCC(=O)C1=CC=CC=C1 MCULE-6046193142 [2,0,0,0,0,0|1,0,1]=4 86 B12R1.30 NCCNC(=O)C1=CC=CC=C1 MCULE-5943442537 [2,0,0,0,0,0|2,0,0]=4 87 B12R1.30 NCCNC(=O)C1=CC=CC=C1 MCULE-7097378808 [2,0,0,0,0,0|2,0,0]=4 88 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 MCULE-2148211370 [2,0,0,0,0,0|1,0,1]=4 89 B12R1.30 O=C(CCCO)C1=CC=CC=C1 MCULE-5662678881 [2,0,0,0,0,0|1,0,1]=4 90 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 MCULE-5248066172 [2,0,0,0,0,0|2,0,0]=4 91 B12R1.30 O=C(NCCO)C1=CC=CC=C1 MCULE-2581769437 [2,0,0,0,0,0|2,0,0]=4 92 B12R1.30 O=C(OCCBr)C1=CC=CC=C1 MCULE-9574981361 [2,0,0,0,0,0|2,0,0]=4 93 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 MCULE-3499936969 [2,0,0,0,0,0|2,0,0]=4 94 B12R1.30 O=C(OCCI)C1=CC=CC=C1 MCULE-3515879165 [2,0,0,0,0,0|2,0,0]=4 95 B12R1.30 O=C(OCCO)C1=CC=CC=C1 MCULE-8134930207 [2,0,0,0,0,0|2,0,0]=4 96 B12R1.30 O=C(SCCS)C1=CC=CC=C1 MCULE-2283197813 [2,0,0,0,0,0|2,0,0]=4 97 B12R1.252 CC(=CC=CC1=CC=CC=C1)C MCULE-5833999233 [2,0,0,0,0,0|0,0,2]=4 98 B12R1.252 CC(C)CC#CC1=CC=CC=C1 MCULE-2543638448 [2,0,0,0,0,0|0,0,2]=4 99 B12R1.252 CC(C)CNCC1=CC=CC=C1 MCULE-4058217424 [2,0,0,0,0,0|1,0,1]=4 100 B12R1.252 CC(C)CNCC1=CC=CC=C1 MCULE-5935329785 [2,0,0,0,0,0|1,0,1]=4 101 B12R1.252 CC(O)CN=CC1=CC=CC=C1 MCULE-3054431232 [2,0,0,0,0,0|2,0,0]=4 102 B14R1.178 CCCCN(C(=O)C)C1=CC=CC=C1 MCULE-7268888590 [1,1,0,0,0,0|1,0,1]=4 103 B14R1.604 CCOC(=O)C(=CO)C1=CC=CC=C1 MCULE-4532342603 [1,1,0,0,0,0|1,0,1]=4 104 B14R1.604 CCOC(=O)C(C=O)C1=CC=CC=C1 MCULE-1702850121 [1,1,0,0,0,0|1,0,1]=4 105 B14R1.149 CC(C)CCC(=O)C1=CC(=NC=C1)Cl MCULE-4379076207 [1,1,0,0,0,0|1,0,1]=4 106 B14R1.149 CC(C)CNC(=O)C1=CC(=CC=C1)Br MCULE-4889438066 [1,1,0,0,0,0|1,0,0]=3 107 B14R1.149 CC(C)CNC(=O)C1=CC(=CC=C1)Cl MCULE-8660049822 [1,1,0,0,0,0|1,0,0]=3 108 B14R1.149 CC(C)CNC(=O)C1=CC(=CC=C1)N MCULE-6753619030 [1,1,0,0,0,0|1,0,0]=3 109 B14R1.149 CC(C)CNC(=O)C1=CC=CC(=C1)F MCULE-1998428812 [1,1,0,0,0,0|1,0,0]=3 110 B14R1.149 CC(O)CNC(=O)C1=CC(=CC=C1)O MCULE-7725753780 [1,1,0,0,0,0|2,0,0]=4 111 B14R1.149 CC(O)CNC(=O)C1=CC=CC(=C1)F MCULE-1037718431 [1,1,0,0,0,0|2,0,0]=4 112 B14R1.149 CC1=CC(=CC=C1)C(=O)NCC(C)O MCULE-4570223479 [1,1,0,0,0,0|2,0,0]=4 113 B14R1.149 CC1=CC=CC(=C1)C(=O)C=CN(C)C MCULE-2464176225 [1,1,0,0,0,0|1,0,1]=4 114 B14R1.149 CC1=CC=CC(=C1)C(=O)NCC(C)C MCULE-4460924514 [1,1,0,0,0,0|1,0,0]=3 115 B14R1.149 CN(C)/C=C/C(=O)C1=CC(=CC=C1)Cl MCULE-6112203642 [1,1,0,0,0,0|1,0,1]=4 116 B14R1.149 CN(C)/C=C/C(=O)C1=CC=CC(=C1)Br MCULE-3643967705 [1,1,0,0,0,0|1,0,1]=4 117 B14R1.149 CN(C)C=CC(=O)C1=CC(=CC=C1)Br MCULE-7583140518 [1,1,0,0,0,0|1,0,1]=4 118 B14R1.149 CN(C)C=CC(=O)C1=CC(=CC=C1)Cl MCULE-9503098982 [1,1,0,0,0,0|1,0,1]=4 119 B14R1.149 CN(C)C=CC(=O)C1=CC(=CC=C1)F MCULE-7752666626 [1,1,0,0,0,0|1,0,1]=4 120 B14R1.149 CN(C)CCC(=O)C1=CC(=CC=C1)Br MCULE-4964904164 [1,1,0,0,0,0|1,0,1]=4 121 B14R1.149 CN(C)CCC(=O)C1=CC(=CC=C1)Br MCULE-6185074043 [1,1,0,0,0,0|1,0,1]=4 122 B14R1.160 CC(C)CCC(=O)C1=CC=NC=C1Cl MCULE-1294272521 [1,1,0,0,0,0|1,0,1]=4 123 B14R1.160 CC(C)CNC(=O)C1=C(C=CC=C1)Br MCULE-5325865868 [1,1,0,0,0,0|1,0,0]=3 124 B14R1.160 CC(C)CNC(=O)C1=C(C=CC=C1)Cl MCULE-9608071725 [1,1,0,0,0,0|1,0,0]=3 125 B14R1.160 CC(C)CNC(=O)C1=C(C=CC=C1)F MCULE-4976401929 [1,1,0,0,0,0|1,0,0]=3 126 B14R1.160 CC(C)CNC(=O)C1=C(C=CC=C1)I MCULE-8151958288 [1,1,0,0,0,0|1,0,0]=3 127 B14R1.160 CC(C)CNC(=O)C1=C(C=CC=C1)N MCULE-9841541518 [1,1,0,0,0,0|1,0,0]=3 128 B14R1.160 CC(C)CNC(=O)C1=C(C=CC=N1)Br MCULE-6816855533 [1,1,0,0,0,0|2,0,0]=4 129 B14R1.160 CC(C)CNC(=O)C1=C(C=NC=C1)Br MCULE-7183384805 [1,1,0,0,0,0|2,0,0]=4 130 B14R1.160 CC(C)CNC(=O)C1=CC=CN=C1Cl MCULE-8312053283 [1,1,0,0,0,0|2,0,0]=4 131 B14R1.160 CC(C)COC(=O)C1=C(C=CC=C1)N MCULE-2088196075 [1,1,0,0,0,0|1,0,0]=3 132 B14R1.160 CC(C)COC(=O)C1=CC=CC=C1O MCULE-1258001308 [1,1,0,0,0,0|1,0,0]=3 133 B14R1.160 CC(O)CNC(=O)C1=CC=CC=C1Cl MCULE-3345526304 [1,1,0,0,0,0|2,0,0]=4 134 B14R1.160 CC1=C(C=CC=C1)C(=O)NCC(C)C MCULE-5148636150 [1,1,0,0,0,0|1,0,0]=3 135 B14R1.160 CN(C)/C=C/C(=O)C1=C(C=CC=C1)Cl MCULE-2382604304 [1,1,0,0,0,0|1,0,1]=4 136 B14R1.160 CN(C)/C=C/C(=O)C1=CC=CC=C1F MCULE-9805112273 [1,1,0,0,0,0|1,0,1]=4 137 B14R1.160 CN(C)/C=C/C(=O)C1=CC=CC=C1O MCULE-1135439197 [1,1,0,0,0,0|1,0,1]=4 138 B14R1.160 CN(C)C=CC(=O)C1=C(C=CC=C1)Cl MCULE-1724128345 [1,1,0,0,0,0|1,0,1]=4 139 B14R1.160 CN(C)C=CC(=O)C1=C(C=CC=C1)Cl MCULE-5324014241 [1,1,0,0,0,0|1,0,1]=4 140 B14R1.160 CN(C)C=CC(=O)C1=C(C=CC=C1)F MCULE-1380080891 [1,1,0,0,0,0|1,0,1]=4 141 B14R1.160 CN(C)C=CC(=O)C1=C(C=CC=C1)O MCULE-6093513677 [1,1,0,0,0,0|1,0,1]=4 142 B14R1.163 CC(C#N)CNC(=O)C1=CC=CC=C1 MCULE-8824964230 [1,1,0,0,0,0|1,0,1]=4 143 B14R1.163 CC(CO)COC(=O)C1=CC=CC=C1 MCULE-7768955040 [1,1,0,0,0,0|1,0,0]=3 144 B14R1.163 CCC(Br)CCC(=O)C1=CC=CC=C1 MCULE-8656139462 [1,1,0,0,0,0|1,0,1]=4 145 B14R1.163 CCC(C)COC(=O)C1=CC=CC=C1 MCULE-5385627986 [1,1,0,0,0,0|1,0,0]=3 146 B14R1.163 CCC(N)CCC(=O)C1=CC=CC=C1 MCULE-6916860187 [1,1,0,0,0,0|1,0,1]=4 147 B14R1.163 O=C(OCC(O)CO)C1=CC=CC=C1 MCULE-4692738472 [1,1,0,0,0,0|2,0,0]=4 148 B14R1.163 [NH3+]C(CCl)COC(=O)C1=CC=CC=C1 MCULE-7099656309 [1,1,0,0,0,0|2,0,0]=4 149 B14R1.163 [NH3+]C(CCl)COC(=O)C1=CC=CC=C1 MCULE-7102209439 [1,1,0,0,0,0|2,0,0]=4 150 B14R1.415 C/C(=C\C(=O)C1=CC=CC=C1)/N(C)C MCULE-1928897991 [1,1,0,0,0,0|1,0,1]=4 151 B14R1.415 CC(=CC(=O)C1=CC=CC=C1)N(C)C MCULE-5443963773 [1,1,0,0,0,0|1,0,1]=4 152 B14R1.415 CC(Cl)C(C)NC(=O)C1=CC=CC=C1 MCULE-2789068951 [1,1,0,0,0,0|2,0,0]=4 153 B14R1.417 CC(CN(C)C)C(=O)C1=CC=CC=C1 MCULE-7049388770 [1,1,0,0,0,0|1,0,1]=4 154 B14R1.417 CC(CN(C)C)C(=O)C1=CC=CC=C1 MCULE-7529461725 [1,1,0,0,0,0|1,0,1]=4 155 B14R1.417 CC(Cl)CC(Cl)C(=O)C1=CC=CC=C1 MCULE-6730979332 [1,1,0,0,0,0|1,0,1]=4 156 B14R1.417 CN(C)CC(=C(Cl)C1=CC=CC=C1)Cl MCULE-6772148562 [1,1,0,0,0,0|2,0,0]=4 157 B14R1.678 CC(C)CCC(=O)C1=CC=C(C=C1)Cl MCULE-3625173489 [1,1,0,0,0,0|0,0,1]=3 158 B14R1.678 CC(C)CNC(=O)C1=CC=C(C=C1)Br MCULE-2920330657 [1,1,0,0,0,0|1,0,0]=3 159 B14R1.678 CC(C)CNC(=O)C1=CC=C(C=C1)F MCULE-9822517373 [1,1,0,0,0,0|1,0,0]=3 160 B14R1.678 CC(C)CNC(=O)C1=CC=C(C=C1)I MCULE-3938057628 [1,1,0,0,0,0|1,0,0]=3 161 B14R1.678 CC(C)CNC(=O)C1=CC=C(C=C1)N MCULE-4199450900 [1,1,0,0,0,0|1,0,0]=3 162 B14R1.678 CC(C)CNC(=O)C1=CN=C(C=C1)Cl MCULE-5993519835 [1,1,0,0,0,0|2,0,0]=4 163 B14R1.678 CC(C)CNC(=O)C1=COC(=O)C=C1 MCULE-3115438272 [1,1,0,0,0,0|2,0,0]=4 164 B14R1.678 CC(C)CNC(=O)C1=NC=C(C=C1)Br MCULE-5045132541 [1,1,0,0,0,0|2,0,0]=4 165 B14R1.678 CC(C)COC(=O)C1=CC=C(C=C1)N MCULE-8884056311 [1,1,0,0,0,0|1,0,0]=3 166 B14R1.678 CC(C)COC(=O)C1=CC=C(C=C1)O MCULE-4335589438 [1,1,0,0,0,0|1,0,0]=3 167 B14R1.678 CC(C)NOC(=O)C1=CC=C(C=C1)Cl MCULE-1511596580 [1,1,0,0,0,0|2,0,0]=4 168 B14R1.678 CC(O)CNC(=O)C1=CC=C(C=C1)Br MCULE-8564535133 [1,1,0,0,0,0|2,0,0]=4 169 B14R1.678 CC1=CC=C(C=C1)C(=O)/C=C/N(C)C MCULE-7173848303 [1,1,0,0,0,0|1,0,1]=4 170 B14R1.678 CC1=CC=C(C=C1)C(=O)C=CN(C)C MCULE-4599452416 [1,1,0,0,0,0|1,0,1]=4 171 B14R1.678 CC1=CC=C(C=C1)C(=O)CCN(C)C MCULE-3071418769 [1,1,0,0,0,0|1,0,1]=4 172 B14R1.678 CC1=CC=C(C=C1)C(=O)CC[NH+](C)C MCULE-5820319174 [1,1,0,0,0,0|1,0,1]=4 173 B14R1.678 CC1=CC=C(C=C1)C(=O)NCC(C)C MCULE-5135180680 [1,1,0,0,0,0|1,0,0]=3 174 B14R1.678 CC1=CC=C(C=C1)C(=O)NCC(C)O MCULE-5826885027 [1,1,0,0,0,0|2,0,0]=4 175 B14R1.678 CN(C)/C=C/C(=O)C1=CC=C(C=C1)Br MCULE-2489249832 [1,1,0,0,0,0|1,0,1]=4 176 B14R1.678 CN(C)/C=C/C(=O)C1=CC=C(C=C1)Cl MCULE-4599443998 [1,1,0,0,0,0|1,0,1]=4 177 B14R1.678 CN(C)/C=C/C(=O)C1=CC=C(C=C1)F MCULE-9697893060 [1,1,0,0,0,0|1,0,1]=4 178 B14R1.678 CN(C)C=CC(=O)C1=CC=C(C=C1)Br MCULE-9657271448 [1,1,0,0,0,0|1,0,1]=4 179 B14R1.678 CN(C)C=CC(=O)C1=CC=C(C=C1)Cl MCULE-5912544473 [1,1,0,0,0,0|1,0,1]=4 180 B14R1.678 CN(C)C=CC(=O)C1=CC=C(C=C1)F MCULE-6243663691 [1,1,0,0,0,0|1,0,1]=4 181 B14R1.678 CN(C)C=CC(=O)C1=CC=C(C=C1)I MCULE-7563561949 [1,1,0,0,0,0|1,0,1]=4 182 B14R1.678 CN(C)CCC(=O)C1=CC=C(C=C1)Br MCULE-4145925069 [1,1,0,0,0,0|1,0,1]=4 183 B14R1.678 CN(C)CCC(=O)C1=CC=C(C=C1)Br MCULE-6049726410 [1,1,0,0,0,0|1,0,1]=4 184 B14R1.678 CN(C)CCC(=O)C1=CC=C(C=C1)Cl MCULE-6613638206 [1,1,0,0,0,0|1,0,1]=4 185 B14R1.678 CN(C)CCC(=O)C1=CC=C(C=C1)F MCULE-4947845312 [1,1,0,0,0,0|1,0,1]=4 186 B14R1.678 CN(C)CCC(=O)C1=CC=C(C=C1)O MCULE-2841190604 [1,1,0,0,0,0|1,0,1]=4 187 B14R1.678 CN(C)CCC(=O)C1=CC=C(C=C1)O MCULE-9409137769 [1,1,0,0,0,0|1,0,1]=4 188 B14R1.678 C[C@H](O)CNC(=O)C1=CC=C(C=C1)O MCULE-1869169720 [1,1,0,0,0,0|2,0,0]=4 189 B14R1.678 C[NH+](C)CCC(=O)C1=CC=C(C=C1)Cl MCULE-3689595845 [1,1,0,0,0,0|1,0,1]=4 190 B14R1.678 C[NH+](C)CCC(=O)C1=CC=C(C=C1)F MCULE-1045421379 [1,1,0,0,0,0|1,0,1]=4 191 B14R1.813 CC(C)CCP(=O)(O)C1=CC=CC=C1 MCULE-1014890010 [1,1,0,0,0,0|1,0,1]=4 192 B14R1.813 CC(C)CNS(=O)(=O)C1=CC=CC=C1 MCULE-4804350355 [1,1,0,0,0,0|2,0,0]=4 193 B14R1.813 CC(C)COS(=O)(=O)C1=CC=CC=C1 MCULE-4480979893 [1,1,0,0,0,0|2,0,0]=4 194 B14R1.3098 CC(C)(C)COC(=O)C1=CC=CC=C1 MCULE-9199028682 [1,1,0,0,0,0|1,0,0]=3 195 B14R1.3098 CC(C)(C)NOC(=O)C1=CC=CC=C1 MCULE-1777393017 [1,1,0,0,0,0|2,0,0]=4 196 B14R1.3098 CC(C)(C)NOC(=O)C1=CC=CC=C1 MCULE-4108578809 [1,1,0,0,0,0|2,0,0]=4 197 B14R1.3098 CC(C)(S)CNC(=O)C1=CC=CN=C1 MCULE-6994410151 [1,1,0,0,0,0|2,0,0]=4 198 B14R1.3098 CC(C)([NH3+])COC(=O)C1=CC=CC=C1 MCULE-2320206879 [1,1,0,0,0,0|1,0,0]=3 199 B14R1.3098 CC(C)([NH3+])COC(=O)C1=CC=CC=C1 MCULE-4089164978 [1,1,0,0,0,0|1,0,0]=3 200 B14R1.3098 C[N+](C)(C)CCC(=O)C1=CC=CC=C1 MCULE-2993527231 [1,1,0,0,0,0|1,0,1]=4 201 B14R1.3098 C[N+](C)(C)CCC(=O)C1=CC=CC=C1 MCULE-6276245552 [1,1,0,0,0,0|1,0,1]=4 202 B14R1.544 CC(C)(C)CC(=NO)C1=CC=CC=C1 MCULE-3561233301 [0,1,0,0,1,0|1,0,1]=4 203 B14R1.1019 CC1=CC=C(C=C1)/C(=C/N(C)C)/C=O MCULE-4727044840 [0,1,0,0,1,0|1,0,0]=3 204 B14R1.1019 CC1=CC=C(C=C1)C(=CN(C)C)C=O MCULE-9835945416 [0,1,0,0,1,0|1,0,0]=3 205 B14R1.1019 CN(C)/C=C(\C=O)/C1=CC=C(C=C1)Cl MCULE-4681080064 [0,1,0,0,1,0|1,0,0]=3 206 B14R1.1019 CN(C)C=C(C=O)C1=CC=C(C=C1)Cl MCULE-5996695943 [0,1,0,0,1,0|1,0,0]=3 207 B14R1.1019 CN(C)CC(C=O)C1=CC=C(C=C1)Cl MCULE-9722036848 [0,1,0,0,1,0|1,0,1]=4 208 B14R1.1020 CN(C)/C=C(\C=O)/C1=CC(=CC=C1)Cl MCULE-7130022702 [0,1,0,0,1,0|1,0,0]=3 209 B14R1.1020 CN(C)C=C(C=O)C1=CC(=CC=C1)Cl MCULE-6514983023 [0,1,0,0,1,0|1,0,0]=3 210 B14R1.3642 CN(C)CC(C)(C=O)C1=CC=CC=C1 MCULE-6052937643 [0,1,0,0,1,0|1,0,1]=4 211 B14R1.3642 CN(C)CC(C)(C=O)C1=CC=CC=C1 MCULE-9922670258 [0,1,0,0,1,0|1,0,1]=4 212 B14R1.6455 CC(=O)C(=CN(C)C)C1=CC=CC=C1 MCULE-5017192285 [0,1,0,0,1,0|1,0,0]=3 213 B14R1.6455 CC(C)CC(C(=O)O)C1=CC=CC=C1 MCULE-9846556781 [0,1,0,0,1,0|0,0,1]=3 214 B14R1.6455 CC(C)OC(C(=O)O)C1=CC=CC=C1 MCULE-7020634902 [0,1,0,0,1,0|1,0,1]=4 215 B14R1.6455 CN(C)CC(C(=O)O)C1=CC=CC=C1 MCULE-3415271884 [0,1,0,0,1,0|1,0,1]=4 216 B14R1.6455 CN(C)CC(C(=O)O)C1=CC=CC=C1 MCULE-8074380718 [0,1,0,0,1,0|1,0,1]=4 217 B16R1.6623 CC(C)(C)C/C=C(\C#N)/C1=CC=C(C=C1)Cl MCULE-6090195455 [0,2,0,0,0,0|1,0,1]=4 218 B16R1.18212 CC(C)CNC(CC(=O)O)C1=CC=CC=C1 MCULE-5653706390 [0,2,0,0,0,0|1,0,1]=4 219 B14R1.2172 C=CC1=C(C(=CC=C1)Cl)OCC(C)C MCULE-2521788996 [0,0,1,1,0,0|2,0,0]=4 220 B14R1.2172 C=CC1=C(C(=CC=C1)F)OCC(C)C MCULE-9765315003 [0,0,1,1,0,0|2,0,0]=4 221 B14R2.24 O=C1CCCC=C1C2=CC=CC=C2 MCULE-7566864552 [1,0,0,1,0,0|0,0,0]=2 222 B14R2.24 O=C1CCCCC1C2=CC=CC=C2 MCULE-1879758913 [1,0,0,1,0,0|0,0,2]=4 223 B14R2.24 O=C1CCCCN1C2=CC=CC=C2 MCULE-3003309389 [1,0,0,1,0,0|1,0,1]=4 224 B14R2.1131 CC1=C2C=CC=CC2=C(C=C1)C=O MCULE-4706584692 [1,0,0,1,0,0|0,0,2]=4 225 B14R2.1253 C1=CC=C(C=C1)C2=CCCCCC2 MCULE-3898536856 [1,0,0,1,0,0|1,0,1]=4 226 B14R2.2014 O=CC1CCCCC2=C1C=CC=C2 MCULE-2006457582 [1,0,0,1,0,0|0,0,2]=4 227 B14R2.2850 O=CC(C1=CC=CC=C1)C2CCC2 MCULE-5474720845 [1,0,0,1,0,0|0,0,2]=4 228 B14R2.2974 O=CC1(CCCC1)C2=CC=CC=C2 MCULE-1263751823 [1,0,0,1,0,0|0,0,2]=4 229 B14R2.4514 CC1CNN(C1=O)C2=CC=CC=C2 MCULE-6926382287 [1,0,0,1,0,0|2,0,0]=4 230 B14R2.19587 CCN1C=C(C2=C1C=CC=C2)C=O MCULE-8599075597 [1,0,0,1,0,0|1,0,0]=3 231 B14R2.19587 CCN1C=C(C2=CC=CN=C12)C=O MCULE-5493409000 [1,0,0,1,0,0|2,0,0]=4 232 B14R2.19587 CCN1N=C(C2=C1C=CC=C2)C=O MCULE-6258128394 [1,0,0,1,0,0|2,0,0]=4 233 B14R2.403 CC1(COC(=N1)C2=CC=CC=C2)C MCULE-5590438464 [1,0,0,1,0,0|2,0,0]=4 234 B14R2.422 NC1CN(C1)C(=O)C2=CC=CC=C2 MCULE-3534225848 [1,0,0,1,0,0|2,0,0]=4 235 B14R2.422 NC1CN(C1)C(=O)C2=CC=CC=C2 MCULE-8015685500 [1,0,0,1,0,0|2,0,0]=4 236 B14R2.422 O=C(C1=CC=CC=C1)N2CC(C2)O MCULE-2199855781 [1,0,0,1,0,0|2,0,0]=4 237 B14R2.792 O=C(CNC1CC1)C2=CC=CC=C2 MCULE-9577566256 [1,0,0,1,0,0|1,0,1]=4 238 B14R2.792 O=C(NCC1CC1)C2=NC=CC=C2 MCULE-9933276513 [1,0,0,1,0,0|2,0,0]=4 239 B14R2.792 O=C(OCC1CO1)C2=CC=CC=C2 MCULE-6693631238 [1,0,0,1,0,0|2,0,0]=4 240 B14R2.25733 CC(C)C1CC(=O)C2=C1C=CC=C2 MCULE-2654594223 [1,0,0,1,0,0|0,0,1]=3 241 B14R2.29285 CC1(CCC(=O)C2=C1C=CC=C2)C MCULE-7611202749 [1,0,0,1,0,0|0,0,1]=3 242 B14R2.29285 CC1(CNC(=O)C2=CC=CC=C12)C MCULE-3814911877 [1,0,0,1,0,0|1,0,0]=3 243 B14R2.29285 C[Si]1(CNC(=O)C2=CC=CC=C12)C MCULE-8674407876 [1,0,0,1,0,0|1,1,0]=4 244 B14R2.2 CC(C)CN1C=NC2=CC=CC=C12 MCULE-8756634288 [0,0,0,1,1,0|2,0,0]=4 245 B14R2.2 CC(N)CC1=CNC2=CC=CC=C12 MCULE-6417482430 [0,0,0,1,1,0|2,0,0]=4 246 B14R2.2 CC(N)CC1=CSC2=CC=CC=C12 MCULE-6169331711 [0,0,0,1,1,0|1,1,0]=4 247 B14R2.2 CC(O)CC1=CNC2=CC=CC=C12 MCULE-4095237423 [0,0,0,1,1,0|2,0,0]=4 248 B14R2.2 CC([NH3+])CC1=CNC2=C1C=CC=C2 MCULE-6948366681 [0,0,0,1,1,0|2,0,0]=4 249 B14R2.2 CN(C)CC1=CNC2=C1C=CC=C2 MCULE-6015845238 [0,0,0,1,1,0|2,0,0]=4 250 B14R2.2 CN(C)CC1=CNC2=CC=CC=C12 MCULE-3643815953 [0,0,0,1,1,0|2,0,0]=4 251 B14R2.2 C[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-8293811191 [0,0,0,1,1,0|2,0,0]=4 252 B14R2.598 CC1CC(=O)N(N1)C2=CC=CC=C2 MCULE-2637230482 [0,0,0,1,1,0|2,0,0]=4 253 B14R2.598 NC1CC(=O)N(C1)C2=CC=CC=C2 MCULE-1475375543 [0,0,0,1,1,0|2,0,0]=4 254 B14R2.598 NC1CC(=O)N(C1)C2=CC=CC=C2 MCULE-9371391226 [0,0,0,1,1,0|2,0,0]=4 255 B14R2.1146 CC1=CC(=C2C=CC=CC2=C1)C=O MCULE-7840069875 [0,0,0,1,1,0|0,0,2]=4 256 B14R2.1146 CC1=NC2=C(C=CC=C2)C(=C1)C=O MCULE-6434321147 [0,0,0,1,1,0|1,0,1]=4 257 B16R2.477 CC(C)COC1=CC=C2C=CC=CC2=C1 MCULE-3337979629 [0,0,0,1,0,1|2,0,0]=4 258 B16R2.1625 CC(C)CN1C2=CC=CC=C2N=C1C=O MCULE-4070698346 [0,0,0,1,0,1|1,0,0]=3 259 B16R2.12350 CC1(CCN(C1=O)CC2=CC=CC=C2)C MCULE-5494894665 [0,0,0,1,0,1|1,0,1]=4 260 B16R2.36 CC(C)NCCC1=CNC2=C1C=CC=C2 MCULE-3624253378 [0,0,0,1,0,1|1,0,1]=4 261 B16R2.36 CC(C)NCCC1=CNC2=C1C=CC=C2 MCULE-6669922334 [0,0,0,1,0,1|1,0,1]=4 262 B16R2.36 CC(C)NCCC1=CNC2=C1C=CC=C2 MCULE-7927210820 [0,0,0,1,0,1|1,0,1]=4 263 B16R2.85 CC(C)C1=CC=C(C=C1)C2=CC=CC=C2 MCULE-4077816307 [0,0,0,1,0,1|1,0,1]=4 264 B16R2.157 CC(C)NC1=NC(=CS1)C2=CC=CC=C2 MCULE-9396434274 [0,0,0,1,0,1|1,1,0]=4 265 B16R2.12348 CC(C)N1C=NC(=C1N)C2=CC=CC=C2 MCULE-9017721984 [0,0,0,1,0,1|2,0,0]=4 266 B16R2.39178 CN(C)C1=C2C=CC=CC2=C(C=C1)C=O MCULE-8443416755 [0,0,0,1,0,1|1,0,1]=4 267 B16R2.75436 CC(C)CN1C=C(C2=C1C=CC=C2)C=O MCULE-9892683412 [0,0,0,1,0,1|0,0,0]=2 268 B16R2.86 CC(C)C1=CC(=CC=C1)C2=CC=CC=C2 MCULE-4329905352 [0,1,0,1,0,0|1,0,1]=4 269 B16R2.26109 CC1(NCC(=CC1=O)C2=CC=CC=C2)C MCULE-3484119039 [0,1,0,1,0,0|1,0,1]=4 270 B16R2.26109 CC1(NCC(=CC1=O)C2=CC=CC=C2)C MCULE-4204790824 [0,1,0,1,0,0|1,0,1]=4 271 B16R2.2865 CC(C)N1C=C(C=N1)C2=CC=C(C=C2)Br MCULE-4268731550 [0,1,0,1,0,0|2,0,0]=4 272 B16R2.48623 CC(C)N1C=C(C2=C1C=C(C=C2)F)C=O MCULE-7420258319 [0,1,0,1,0,0|1,0,0]=3 273 B16R2.48623 CC(C)N1C=C(C2=C1C=C(N=C2)Cl)C=O MCULE-5688663628 [0,1,0,1,0,0|2,0,0]=4 274 B16R2.2918 CC(C)N1C=C(C=N1)C2=CC=CC(=C2)N MCULE-4847297662 [0,1,0,1,0,0|2,0,0]=4 275 B16R2.48620 CC(C)N1C=C(C2=CC=CC(=C12)Cl)C=O MCULE-4279084266 [0,1,0,1,0,0|1,0,0]=3 276 B16R2.48620 CC1=C2C(=CC=C1)C(=CN2C(C)C)C=O MCULE-2314693690 [0,1,0,1,0,0|1,0,0]=3 277 B16R2.241316 CC(C)N1C=C(C2=CC(=CC=C12)F)C=O MCULE-9532797744 [0,1,0,1,0,0|1,0,0]=3 278 B16R2.14 C[C@@H](CO)CCC1=CNC2=C1C=CC=C2 MCULE-7278157577 [0,1,0,1,0,0|1,0,1]=4 279 B16R2.14 C[C@@H](CO)CCC1=CNC2=CC=CC=C12 MCULE-1570166301 [0,1,0,1,0,0|1,0,1]=4 280 B16R2.75437 CCC(C)N1C=C(C2=C1C=CC=C2)C=O MCULE-9829678771 [0,1,0,1,0,0|1,0,0]=3 281 B16R2.75437 O=CC1=CN(C2=C1C=CC=C2)C(O)CO MCULE-4230260678 [0,1,0,1,0,0|2,0,0]=4 282 B16R2.2888 CC(C)C1N=C(OC1=O)C2=CC=CC=C2 MCULE-7969327554 [0,1,0,1,0,0|1,0,0]=3 283 B16R2.2888 CC(C)N1N=C(CC1=O)C2=CC=CC=C2 MCULE-7815056754 [0,1,0,1,0,0|2,0,0]=4 284 B16R2.179941 CC(C)CNC1=NC=NC2=C1C=CC=C2 MCULE-3862986838 [0,1,0,1,0,0|2,0,0]=4 285 B16R2.179941 CC(C)CNC1=NC=NC2=C1C=CC=C2 MCULE-6818883024 [0,1,0,1,0,0|2,0,0]=4 286 B16R2.520 CC(C)CC(=O)C1=CNC2=CC=CC=C12 MCULE-7426484095 [0,1,0,1,0,0|1,0,0]=3 287 B16R2.520 CC(C)CC(=O)C1=CSC2=C1C=CC=C2 MCULE-4055260485 [0,1,0,1,0,0|0,1,0]=3 288 B16R2.520 CC(C)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-1348433218 [0,1,0,1,0,0|1,0,1]=4 289 B16R2.520 CC(C)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-6771201918 [0,1,0,1,0,0|1,0,1]=4 290 B16R2.520 CC(C)C[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-1710694651 [0,1,0,1,0,0|0,1,1]=4 291 B16R2.520 CC(C)C[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-4926384770 [0,1,0,1,0,0|0,1,1]=4 292 B16R2.520 CC(C)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-6371460252 [0,1,0,1,0,0|1,0,1]=4 293 B16R2.520 CC(C)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-6841396035 [0,1,0,1,0,0|1,0,1]=4 294 B16R2.520 CC(C)C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-1016932551 [0,1,0,1,0,0|0,1,1]=4 295 B16R2.520 CC(C)C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-5522557677 [0,1,0,1,0,0|0,1,1]=4 296 B16R2.520 CN(C)CC(=O)C1=CNC2=C1C=CC=C2 MCULE-2717451928 [0,1,0,1,0,0|2,0,0]=4 297 B16R2.6150 CC(C)OC1=C(C2=CC=CC=C2N1)C=O MCULE-9413533503 [0,1,0,1,0,0|1,0,0]=3 298 B16R2.4003 CC(C)CCN1C(=O)NC2=C1C=CC=C2 MCULE-3961070963 [0,1,0,1,0,0|1,0,1]=4 299 B16R2.4003 CC(C)CCN1C(=O)OC2=CC=CC=C12 MCULE-6680900854 [0,1,0,1,0,0|1,0,1]=4 300 B16R2.4003 CN(C)NC=C1C(=O)NC2=C1C=CC=C2 MCULE-9903814737 [0,1,0,1,0,0|2,0,0]=4 301 B16R2.241288 CC(C)N1C=C(C2=C(C=CC=C12)Br)C=O MCULE-7285183614 [0,1,0,1,0,0|1,0,0]=3 302 B16R2.241288 CC(C)N1C=C(C2=C(C=CN=C12)Br)C=O MCULE-8746529763 [0,1,0,1,0,0|2,0,0]=4 303 B16R2.400351 CC(=O)C1=CN(C2=C1C=CC=C2)C(C)C MCULE-1263456376 [0,1,0,1,0,0|1,0,0]=3 304 B16R2.400351 CC(=O)C1=CN(C2=C1C=CN=C2)C(C)C MCULE-6550944165 [0,1,0,1,0,0|2,0,0]=4 305 B16R2.400351 CC(C)N1C=C(C2=CC=CC=C12)C(=O)O MCULE-3697564900 [0,1,0,1,0,0|1,0,0]=3 306 B16R2.400351 CC(C)N1N=C(C2=C1C=CC=C2)C(=O)O MCULE-1719322355 [0,1,0,1,0,0|2,0,0]=4 307 B16R2.403705 CC1(CCC(C2=C1C=CC=C2)C(=O)O)C MCULE-5988824023 [0,1,0,1,0,0|0,0,2]=4 308 B16R2.403705 CC1(CNC(C2=C1C=CC=C2)C(=O)O)C MCULE-6141253160 [0,1,0,1,0,0|1,0,1]=4 309 B16R2.403705 CC1(CNC(C2=CC=CC=C12)C(=O)N)C MCULE-8527760604 [0,1,0,1,0,0|1,0,1]=4 310 B12R1.54 CC(C)CCC(=O)C1=COC=C1 MCULE-5519057736 [1,0,0,0,1,0|1,0,1]=4 311 B12R1.54 CC(C)CNC(=O)C1=CC=CS1 MCULE-4879651474 [1,0,0,0,1,0|2,0,0]=4 312 B12R1.107 CC(=CC(=O)C1=CC=CC=C1)C MCULE-7053628107 [1,0,0,0,1,0|0,0,1]=3 313 B12R1.107 CC(=CC(=O)C1=CC=CC=C1)N MCULE-7047297092 [1,0,0,0,1,0|1,0,1]=4 314 B12R1.107 CC(=CC(=O)C1=CC=CC=C1)O MCULE-6103512840 [1,0,0,0,1,0|1,0,1]=4 315 B12R1.107 CC(=N)CC(=O)C1=CC=CC=C1 MCULE-8441112827 [1,0,0,0,1,0|1,0,1]=4 316 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 MCULE-5543155182 [1,0,0,0,1,0|1,0,1]=4 317 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 MCULE-7723289231 [1,0,0,0,1,0|0,0,0]=2 318 B12R1.107 CC(C)CC(=O)C1=CC=CN=C1 MCULE-4799798644 [1,0,0,0,1,0|1,0,0]=3 319 B12R1.107 CC(C)CC(=O)C1=CC=NC=C1 MCULE-9177412428 [1,0,0,0,1,0|1,0,0]=3 320 B12R1.107 CC(C)CC(=O)C1=NC=CC=C1 MCULE-2702794528 [1,0,0,0,1,0|1,0,0]=3 321 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 MCULE-1198803949 [1,0,0,0,1,0|1,0,1]=4 322 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 MCULE-1271307984 [1,0,0,0,1,0|1,0,1]=4 323 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 MCULE-7151481598 [1,0,0,0,1,0|1,0,1]=4 324 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 MCULE-7203571883 [1,0,0,0,1,0|1,0,1]=4 325 B12R1.107 CC(C)CC(O)C1=CC=CC=C1 MCULE-7183094881 [1,0,0,0,1,0|0,0,2]=4 326 B12R1.107 CC(C)C[C@@H](N)C1=CC=CC=C1 MCULE-1592172990 [1,0,0,0,1,0|1,0,1]=4 327 B12R1.107 CC(C)C[C@@H](N)C1=CC=CC=C1 MCULE-1695120707 [1,0,0,0,1,0|1,0,1]=4 328 B12R1.107 CC(C)C[C@@H](N)C1=CC=CC=C1 MCULE-2559764622 [1,0,0,0,1,0|1,0,1]=4 329 B12R1.107 CC(C)C[C@@H](N)C1=CC=CC=C1 MCULE-4348071665 [1,0,0,0,1,0|1,0,1]=4 330 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 MCULE-1371538882 [1,0,0,0,1,0|1,0,1]=4 331 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 MCULE-1526219635 [1,0,0,0,1,0|1,0,1]=4 332 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 MCULE-4248897776 [1,0,0,0,1,0|1,0,1]=4 333 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 MCULE-6351419173 [1,0,0,0,1,0|1,0,1]=4 334 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 MCULE-3510524493 [1,0,0,0,1,0|1,0,0]=3 335 B12R1.107 CC(C)OC(=O)C1=CC=CC=C1 MCULE-3225788147 [1,0,0,0,1,0|1,0,0]=3 336 B12R1.107 CC(C)OC(=O)C1=CN=CC=C1 MCULE-6762352186 [1,0,0,0,1,0|2,0,0]=4 337 B12R1.107 CC(Cl)OC(=O)C1=CC=CC=C1 MCULE-9147177862 [1,0,0,0,1,0|2,0,0]=4 338 B12R1.107 CC(N)CC(=O)C1=CC=CC=C1 MCULE-2688802608 [1,0,0,0,1,0|1,0,0]=3 339 B12R1.107 CN(C)CC(=O)C1=CC=CC=C1 MCULE-3356134562 [1,0,0,0,1,0|1,0,0]=3 340 B12R1.107 CN(C)CC(=O)C1=CC=CC=C1 MCULE-8189107722 [1,0,0,0,1,0|1,0,0]=3 341 B12R1.107 CN(C)NC(=O)C1=CC=CC=C1 MCULE-5055291924 [1,0,0,0,1,0|2,0,0]=4 342 B12R1.107 C[NH+](C)NC(=O)C1=CC=CC=C1 MCULE-3329240200 [1,0,0,0,1,0|2,0,0]=4 343 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 MCULE-1788879258 [1,0,0,0,1,0|1,0,0]=3 344 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 MCULE-4966573635 [1,0,0,0,1,0|1,0,0]=3 345 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 MCULE-7892093912 [1,0,0,0,1,0|1,0,0]=3 346 B12R1.478 CC(C)C(=NO)C1=CC=CC=C1 MCULE-9688923472 [0,0,0,0,2,0|1,0,1]=4 347 B12R1.478 CC(C)C(C=O)C1=CC=CC=C1 MCULE-5991839124 [0,0,0,0,2,0|0,0,1]=3 348 B14R1.467 CCCCC(=CC1=CC=CC=C1)C=O MCULE-4768541536 [1,0,0,0,0,1|0,0,1]=3 349 B14R1.420 CC(=CCOC(=O)C1=CC=CC=C1)C MCULE-3944591398 [1,0,0,0,0,1|1,0,1]=4 350 B14R1.420 CC(C)/C=N/NC(=O)C1=CC=CC=C1 MCULE-8171139258 [1,0,0,0,0,1|1,0,1]=4 351 B14R1.420 CC(C)C=NNC(=O)C1=CC=CC=C1 MCULE-4385778230 [1,0,0,0,0,1|1,0,1]=4 352 B14R1.420 CC(C)CCCC(=O)C1=CC=CC=C1 MCULE-9879541702 [1,0,0,0,0,1|0,0,1]=3 353 B14R1.420 CC(C)CCNC(=O)C1=CC=CC=C1 MCULE-5226416248 [1,0,0,0,0,1|0,0,1]=3 354 B14R1.420 CC(C)CCNC(=O)C1=CN=CC=C1 MCULE-3432411680 [1,0,0,0,0,1|1,0,1]=4 355 B14R1.420 CC(C)CCOC(=O)C1=CC=CC=C1 MCULE-5093143033 [1,0,0,0,0,1|0,0,1]=3 356 B14R1.420 CC(C)CCOC(=O)C1=CC=NC=C1 MCULE-3850516956 [1,0,0,0,0,1|1,0,1]=4 357 B14R1.420 CN(C)CCCC(=O)C1=CC=CC=C1 MCULE-2578275329 [1,0,0,0,0,1|1,0,1]=4 358 B14R1.420 CN(C)CCCC(=O)C1=CC=CC=C1 MCULE-7718718280 [1,0,0,0,0,1|1,0,1]=4 359 B14R1.420 CN(C)CCOC(=O)C1=CC=CC=C1 MCULE-5915009701 [1,0,0,0,0,1|1,0,1]=4 360 B14R1.420 CN(C)CCOC(=O)C1=CC=CC=C1 MCULE-6744521871 [1,0,0,0,0,1|1,0,1]=4 361 B14R1.423 CC(=C=CC(=O)NC1=CC=CC=C1)C MCULE-4319278404 [1,0,0,0,0,1|0,0,2]=4 362 B14R1.423 CC(C)CNC(=O)CC1=CC=CC=C1 MCULE-7095510227 [1,0,0,0,0,1|1,0,0]=3 363 B14R1.423 CC(C)CNC(=O)NC1=CC=CC=C1 MCULE-4809649587 [1,0,0,0,0,1|1,0,0]=3 364 B14R1.423 CC(C)CNC(=O)OC1=CC=CC=C1 MCULE-9594855698 [1,0,0,0,0,1|1,0,0]=3 365 B14R1.423 CC(C)CNC(=S)NC1=CC=CC=C1 MCULE-8137715348 [1,0,0,0,0,1|1,1,0]=4 366 B14R1.423 CC(C)COC(=O)CC1=CC=CC=C1 MCULE-8394601169 [1,0,0,0,0,1|1,0,0]=3 367 B14R1.423 CC(C)COC(=S)NC1=CC=CC=C1 MCULE-3999277924 [1,0,0,0,0,1|1,1,0]=4 368 B14R1.423 CC(C)ONC(=O)NC1=CC=CC=C1 MCULE-6065905573 [1,0,0,0,0,1|2,0,0]=4 369 B14R1.423 CC(C)SCC(=O)NC1=CC=CC=C1 MCULE-2537008711 [1,0,0,0,0,1|1,0,1]=4 370 B14R1.423 CN(C)C=CC(=O)NC1=CC=CC=C1 MCULE-8540690629 [1,0,0,0,0,1|1,0,1]=4 371 B14R1.549 C=C(C)CC(=CC1=CC=CC=C1)C=O MCULE-6497042241 [0,0,0,0,1,1|0,0,2]=4