0 B15R2.6 CC(=O)C=CC1=CNC2=CC=CC=C12 MCULE-1503677397 [0,0,0,0,0,0|2,0,2]=4 1 B15R2.6 CC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-7392845361 [0,0,0,0,0,0|2,0,0]=2 2 B15R2.6 CC(=O)CCN1C=NC2=C1C=CC=C2 MCULE-3225504435 [0,0,0,0,0,0|3,0,1]=4 3 B15R2.6 CC(=O)CSC1=CNC2=C1C=CC=C2 MCULE-3315787994 [0,0,0,0,0,0|3,0,0]=3 4 B15R2.6 CC(C)CCN1C=NC2=CC=CC=C12 MCULE-5210091043 [0,0,0,0,0,0|2,0,1]=3 5 B15R2.6 CC(N)CCC1CNC2=C1C=CC=C2 MCULE-5713152074 [0,0,0,0,0,0|2,0,2]=4 6 B15R2.6 CN(C)CCC1=CNC2=C1C=CC=C2 MCULE-1451594833 [0,0,0,0,0,0|0,0,0]=0 7 B15R2.6 CN(C)CCN1C=NC2=C1C=CC=C2 MCULE-7942301929 [0,0,0,0,0,0|1,0,1]=2 8 B15R2.6 CN(C)CCN1CCC2=C1C=CC=C2 MCULE-2181030057 [0,0,0,0,0,0|2,0,1]=3 9 B15R2.6 CN(C)CCN1CCC2=C1C=CC=C2 MCULE-5924756581 [0,0,0,0,0,0|2,0,1]=3 10 B15R2.6 C[NH+](C)CCN1C=[NH+]C2=C1C=CC=C2 MCULE-5185022752 [0,0,0,0,0,0|1,0,2]=3 11 B15R2.6 NC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-3897886792 [0,0,0,0,0,0|3,0,0]=3 12 B15R2.6 NC(=O)CSC1=CNC2=C1C=CC=C2 MCULE-9969213922 [0,0,0,0,0,0|4,0,0]=4 13 B15R2.6 O=C(O)CCC1=CNC2=C1C=CC=C2 MCULE-4395981703 [0,0,0,0,0,0|3,0,0]=3 14 B15R2.6 O=C(O)CCC1=CNC2=C1C=CC=N2 MCULE-3968966198 [0,0,0,0,0,0|4,0,0]=4 15 B15R2.6 O=C(O)CCC1=CSC2=C1C=CC=C2 MCULE-9447024037 [0,0,0,0,0,0|4,0,0]=4 16 B15R2.6 O=C(O)CSC1=CNC2=C1C=CC=C2 MCULE-3383554611 [0,0,0,0,0,0|4,0,0]=4 17 B14R2.3 CCCCN1C=CC2=CC=CC=C12 MCULE-5111709732 [1,0,0,0,0,0|3,0,0]=4 18 B14R2.3 CCCCN1C=NC2=C1C=CC=C2 MCULE-6256443076 [1,0,0,0,0,0|2,0,1]=4 19 B14R2.3 CCCCN1C=NC2=CC=CC=C12 MCULE-4822937951 [1,0,0,0,0,0|2,0,1]=4 20 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 MCULE-4097971327 [1,0,0,0,0,0|2,0,0]=3 21 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 MCULE-9425269407 [1,0,0,0,0,0|2,0,0]=3 22 B14R2.3 CNCCC1=CNC2=CC=CN=C12 MCULE-6308406696 [1,0,0,0,0,0|1,0,0]=2 23 B14R2.3 CNCCN1C=CC2=C1C=CC=C2 MCULE-7890173199 [1,0,0,0,0,0|2,0,0]=3 24 B14R2.3 CNCCN1C=CC2=C1C=CC=C2 MCULE-8023975556 [1,0,0,0,0,0|2,0,0]=3 25 B14R2.3 CNCCN1C=NC2=C1C=CC=C2 MCULE-5310546291 [1,0,0,0,0,0|1,0,1]=3 26 B14R2.3 CNCCN1C=NC2=CC=CC=C12 MCULE-9749496948 [1,0,0,0,0,0|1,0,1]=3 27 B14R2.3 COCCN1C=NC2=CC=CC=C12 MCULE-2657961041 [1,0,0,0,0,0|2,0,1]=4 28 B14R2.3 N#CCCC1=CNC2=CC=CC=C12 MCULE-9844349638 [1,0,0,0,0,0|2,0,0]=3 29 B14R2.3 NCCCC1=CNC2=C1C=CC=N2 MCULE-6962821583 [1,0,0,0,0,0|3,0,0]=4 30 B14R2.3 NCCCC1=CNC2=CC=CC=C12 MCULE-4742640218 [1,0,0,0,0,0|2,0,0]=3 31 B14R2.3 NCCSC1=CNC2=C1C=CC=C2 MCULE-5852531217 [1,0,0,0,0,0|3,0,0]=4 32 B14R2.3 NCCSC1=CNC2=C1C=CC=C2 MCULE-6122840857 [1,0,0,0,0,0|3,0,0]=4 33 B14R2.3 NNCCC1=CNC2=CC=CC=C12 MCULE-3881420803 [1,0,0,0,0,0|1,0,0]=2 34 B14R2.3 O=CCCC1=CNC2=CC=CC=C12 MCULE-6631491514 [1,0,0,0,0,0|2,0,0]=3 35 B14R2.3 OCCCC1=CNC2=C1C=CC=C2 MCULE-2483523215 [1,0,0,0,0,0|2,0,0]=3 36 B14R2.3 ON=CCC1=CNC2=C1C=CC=C2 MCULE-2984317759 [1,0,0,0,0,0|1,0,2]=4 37 B14R2.3 OOCCC1=CNC2=CC=CC=C12 MCULE-6615259809 [1,0,0,0,0,0|2,0,0]=3 38 B16R2.12 C(N)(CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-7691364516 [0,1,0,0,0,0|3,0,0]=4 39 B16R2.12 CC(CC1=CNC2=CC=CC=C12)C(=O)O MCULE-2892960681 [0,1,0,0,0,0|3,0,0]=4 40 B16R2.12 CC(O)C(O)CC1=CNC2=C1C=CC=C2 MCULE-5963536990 [0,1,0,0,0,0|2,0,0]=3 41 B16R2.12 CN(C)C(=O)CC1=CNC2=C1C=CC=C2 MCULE-7719721008 [0,1,0,0,0,0|0,0,1]=2 42 B16R2.12 CN(C)C(=O)NC1=CNC2=C1C=CC=C2 MCULE-6902671281 [0,1,0,0,0,0|1,0,1]=3 43 B16R2.12 NC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-3066097949 [0,1,0,0,0,0|3,0,0]=4 44 B16R2.12 NC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-8443491955 [0,1,0,0,0,0|3,0,0]=4 45 B16R2.12 NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-1545475984 [0,1,0,0,0,0|3,0,0]=4 46 B16R2.12 NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-2495284243 [0,1,0,0,0,0|3,0,0]=4 47 B16R2.12 NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-6670583047 [0,1,0,0,0,0|3,0,0]=4 48 B16R2.12 NC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-7340384638 [0,1,0,0,0,0|3,0,0]=4 49 B16R2.12 NC(=O)[C@H](O)CC1=CNC2=C1C=CC=C2 MCULE-6002866157 [0,1,0,0,0,0|3,0,0]=4 50 B16R2.12 NC(CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-5675773208 [0,1,0,0,0,0|3,0,0]=4 51 B16R2.12 N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-3721322622 [0,1,0,0,0,0|3,0,0]=4 52 B16R2.12 N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-8004234494 [0,1,0,0,0,0|3,0,0]=4 53 B16R2.12 N[C@H](CC1=CNC2=C1C=CC=C2)C(=O)O MCULE-4102614655 [0,1,0,0,0,0|3,0,0]=4 54 B16R2.12 N[C@H](CC1=CNC2=CC=CC=C12)C(=O)O MCULE-3038020375 [0,1,0,0,0,0|3,0,0]=4 55 B16R2.12 N[C@H](CC1=CNC2=CC=CC=C12)C(=O)O MCULE-9808999085 [0,1,0,0,0,0|3,0,0]=4 56 B16R2.12 O=C(O)C(O)CC1=CNC2=C1C=CC=C2 MCULE-9202778593 [0,1,0,0,0,0|3,0,0]=4 57 B16R2.12 O=C(O)[C@@H](O)CC1=CNC2=C1C=CC=C2 MCULE-9292718284 [0,1,0,0,0,0|3,0,0]=4 58 B16R2.14 CC(=NO)CCC1=CNC2=C1C=CC=C2 MCULE-4117218273 [0,1,0,0,0,0|2,0,0]=3 59 B16R2.14 CC(=NO)CSC1=CNC2=C1C=CC=C2 MCULE-3134182243 [0,1,0,0,0,0|3,0,0]=4 60 B16R2.14 CCC(=O)NCC1=CNC2=CC=CC=C12 MCULE-4306442128 [0,1,0,0,0,0|3,0,0]=4 61 B16R2.14 CCC(C)NCC1=CNC2=CC=CC=C12 MCULE-1336945671 [0,1,0,0,0,0|2,0,0]=3 62 B16R2.14 CCN(C)CCC1=CNC2=C1C=CC=C2 MCULE-1754547837 [0,1,0,0,0,0|0,0,0]=1 63 B16R2.14 CCN(C)CCC1=CNC2=C1C=CC=C2 MCULE-5519543071 [0,1,0,0,0,0|0,0,0]=1 64 B16R2.14 CCN(C)CCN1C=NC2=CC=CC=C12 MCULE-3762229192 [0,1,0,0,0,0|1,0,1]=3 65 B16R2.14 COC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-6058936857 [0,1,0,0,0,0|2,0,0]=3 66 B16R2.14 CSC(=S)NCC1=CNC2=C1C=CC=C2 MCULE-5878389514 [0,1,0,0,0,0|3,0,0]=4 67 B16R2.14 C[C@@H](CO)CCC1=CNC2=C1C=CC=C2 MCULE-7278157577 [0,1,0,0,0,0|1,0,0]=2 68 B16R2.14 C[C@@H](CO)CCC1=CNC2=CC=CC=C12 MCULE-1570166301 [0,1,0,0,0,0|1,0,0]=2 69 B16R2.14 NNC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-2439340262 [0,1,0,0,0,0|3,0,0]=4 70 B16R2.520 C=C(C)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-3165794084 [0,1,0,0,0,0|1,0,1]=3 71 B16R2.520 C=C(C)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-4423247369 [0,1,0,0,0,0|1,0,1]=3 72 B16R2.520 C=C(C)C[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-6901441990 [0,1,0,0,0,0|2,0,1]=4 73 B16R2.520 C=C(C)C[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-8088801013 [0,1,0,0,0,0|2,0,1]=4 74 B16R2.520 C=C(C)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-1451859789 [0,1,0,0,0,0|1,0,1]=3 75 B16R2.520 C=C(C)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-1911385013 [0,1,0,0,0,0|1,0,1]=3 76 B16R2.520 C=C(C)C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-6500816597 [0,1,0,0,0,0|2,0,1]=4 77 B16R2.520 C=C(C)C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-8411166886 [0,1,0,0,0,0|2,0,1]=4 78 B16R2.520 CC(=O)CC(=O)C1=CNC2=C1C=CC=C2 MCULE-7778035018 [0,1,0,0,0,0|2,0,1]=4 79 B16R2.520 CC(C)CC(=O)C1=CNC2=CC=CC=C12 MCULE-7426484095 [0,1,0,0,0,0|1,0,1]=3 80 B16R2.520 CC(C)CC(=O)C1=CSC2=C1C=CC=C2 MCULE-4055260485 [0,1,0,0,0,0|2,0,1]=4 81 B16R2.520 CC(C)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-1348433218 [0,1,0,0,0,0|1,0,0]=2 82 B16R2.520 CC(C)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-6771201918 [0,1,0,0,0,0|1,0,0]=2 83 B16R2.520 CC(C)C[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-1710694651 [0,1,0,0,0,0|2,0,0]=3 84 B16R2.520 CC(C)C[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-4926384770 [0,1,0,0,0,0|2,0,0]=3 85 B16R2.520 CC(C)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-6371460252 [0,1,0,0,0,0|1,0,0]=2 86 B16R2.520 CC(C)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-6841396035 [0,1,0,0,0,0|1,0,0]=2 87 B16R2.520 CC(C)C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-1016932551 [0,1,0,0,0,0|2,0,0]=3 88 B16R2.520 CC(C)C[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-5522557677 [0,1,0,0,0,0|2,0,0]=3 89 B16R2.520 CC(CC(=O)O)C1=CNC2=C1C=CC=C2 MCULE-1656451925 [0,1,0,0,0,0|3,0,0]=4 90 B16R2.520 CN(C)CC(=O)C1=CNC2=C1C=CC=C2 MCULE-2717451928 [0,1,0,0,0,0|0,0,1]=2 91 B16R2.520 NC(CC(=O)O)C1=CNC2=C1C=CC=C2 MCULE-2298347249 [0,1,0,0,0,0|3,0,0]=4 92 B16R2.520 N[C@@H](CC(=O)O)C1=CNC2=C1C=CC=C2 MCULE-4436493722 [0,1,0,0,0,0|3,0,0]=4 93 B16R2.520 N[C@@H](CC(F)F)C1=CNC2=CC=CC=C12 MCULE-4624496033 [0,1,0,0,0,0|3,0,0]=4 94 B16R2.520 N[C@@H](CC(F)F)C1=CNC2=CC=CC=C12 MCULE-8997762947 [0,1,0,0,0,0|3,0,0]=4 95 B16R2.520 N[C@H](CC(F)F)C1=CNC2=CC=CC=C12 MCULE-3972888230 [0,1,0,0,0,0|3,0,0]=4 96 B16R2.520 N[C@H](CC(F)F)C1=CNC2=CC=CC=C12 MCULE-5600130733 [0,1,0,0,0,0|3,0,0]=4 97 B16R2.2947 CC(C)(C)NCC1=CNC2=C1C=CC=C2 MCULE-8070331450 [0,1,0,0,0,0|2,0,0]=3 98 B16R2.2947 CC(C)(C)NCC1=CNC2=C1C=CC=C2 MCULE-9189699425 [0,1,0,0,0,0|2,0,0]=3 99 B16R2.2947 CN(=O)(C)CCC1=CNC2=C1C=CC=C2 MCULE-1626095060 [0,1,0,0,0,0|0,0,1]=2 100 B16R2.2976 CC(C)CCN1C=CC2=C1C=CC(=C2)N MCULE-7075955702 [0,1,0,0,0,0|3,0,0]=4 101 B16R2.2976 CC1=CC2=C(C=C1)C(=CN2)CCC(=O)O MCULE-1094026609 [0,1,0,0,0,0|3,0,0]=4 102 B16R2.2976 CN(C)CCN1C=CC2=C1C=CC(=C2)N MCULE-2583549765 [0,1,0,0,0,0|2,0,0]=3 103 B16R2.2976 CN(C)CCN1C=NC2=C1C=CC(=C2)N MCULE-3084180090 [0,1,0,0,0,0|1,0,1]=3 104 B16R2.2976 CN(C)CCN1C=NC2=C1C=CC(=C2)N MCULE-7974030552 [0,1,0,0,0,0|1,0,1]=3 105 B16R2.2976 O=C(O)CCC1=CNC2=CC(=CC=C12)Br MCULE-7968399311 [0,1,0,0,0,0|3,0,0]=4 106 B16R2.2976 O=C(O)CCC1=CNC2=CC(=CC=C12)Cl MCULE-1091258850 [0,1,0,0,0,0|3,0,0]=4 107 B16R2.2976 O=C(O)CCC1=CNC2=CC(=CC=C12)F MCULE-5084506987 [0,1,0,0,0,0|3,0,0]=4 108 B16R2.4003 CC(C)CCN1C(=NC2=C1C=CC=C2)N MCULE-4590535795 [0,1,0,0,0,0|2,0,1]=4 109 B16R2.4003 CC(C)CCN1C(=O)NC2=C1C=CC=C2 MCULE-3961070963 [0,1,0,0,0,0|2,0,0]=3 110 B16R2.4003 CC(C)CCN1C(=O)OC2=CC=CC=C12 MCULE-6680900854 [0,1,0,0,0,0|3,0,0]=4 111 B16R2.4003 CC(C)CCN1C2=CC=CC=C2N=C1S MCULE-4846724174 [0,1,0,0,0,0|2,0,1]=4 112 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)CCC(=O)N MCULE-2768308411 [0,1,0,0,0,0|3,0,0]=4 113 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)CCN(C)C MCULE-8080330116 [0,1,0,0,0,0|0,0,0]=1 114 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)CNC(C)C MCULE-3632119158 [0,1,0,0,0,0|2,0,0]=3 115 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)CNC(C)C MCULE-6629438719 [0,1,0,0,0,0|2,0,0]=3 116 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)N=CN(C)C MCULE-5544558630 [0,1,0,0,0,0|1,0,1]=3 117 B16R2.4003 CC1=C(C2=CC=CC=C2N1)CCC(=O)O MCULE-2157412879 [0,1,0,0,0,0|3,0,0]=4 118 B16R2.4003 CC1=NC2=C(N1CCC(C)C)C=CC=C2 MCULE-5585722992 [0,1,0,0,0,0|2,0,1]=4 119 B16R2.4003 CN(C)CCN1C(=NC2=C1C=CC=C2)N MCULE-2057399802 [0,1,0,0,0,0|1,0,1]=3 120 B16R2.4003 CN(C)CCN1C(=NC2=C1C=CC=C2)N MCULE-5078768263 [0,1,0,0,0,0|1,0,1]=3 121 B16R2.4003 CN(C)CCN1C2=CC=CC=C2N=C1N MCULE-6718110507 [0,1,0,0,0,0|1,0,1]=3 122 B16R2.4003 CN(C)NC=C1C(=O)NC2=C1C=CC=C2 MCULE-9903814737 [0,1,0,0,0,0|1,0,1]=3 123 B16R2.15551 CC(=O)CCC1=CNC2=C1C=C(C=C2)Br MCULE-9077149693 [0,1,0,0,0,0|2,0,0]=3 124 B16R2.15551 CC(=O)CCC1=CNC2=CC=C(C=C12)F MCULE-9993709905 [0,1,0,0,0,0|2,0,0]=3 125 B16R2.15551 CC1=CC2=C(C=C1)NC=C2CCC(=O)N MCULE-3339794781 [0,1,0,0,0,0|3,0,0]=4 126 B16R2.15551 CC1=CC2=C(C=C1)NC=C2CCC(=O)O MCULE-1239455157 [0,1,0,0,0,0|3,0,0]=4 127 B16R2.15551 CN(C)CCC1=CNC2=C1C=C(C=C2)Cl MCULE-1556032580 [0,1,0,0,0,0|0,0,0]=1 128 B16R2.15551 CN(C)CCC1=CNC2=C1C=C(C=C2)Cl MCULE-4252363733 [0,1,0,0,0,0|0,0,0]=1 129 B16R2.15551 CN(C)CCC1=CNC2=C1C=C(C=C2)N MCULE-2093808664 [0,1,0,0,0,0|0,0,0]=1 130 B16R2.15551 CN(C)CCC1=CNC2=CC=C(C=C12)Br MCULE-4875343540 [0,1,0,0,0,0|0,0,0]=1 131 B16R2.15551 CN(C)CCC1=CSC2=C1C=C(C=C2)Cl MCULE-4931315082 [0,1,0,0,0,0|1,0,0]=2 132 B16R2.15551 CN(C)CCC1=CSC2=C1C=C(C=C2)Cl MCULE-6558653146 [0,1,0,0,0,0|1,0,0]=2 133 B16R2.15551 CN(C)CCN1C=CC2=C1C=C(C=C2)Br MCULE-6347826155 [0,1,0,0,0,0|2,0,0]=3 134 B16R2.15551 CN(C)CCN1C=CC2=C1C=C(C=C2)N MCULE-9994824293 [0,1,0,0,0,0|2,0,0]=3 135 B16R2.15551 O=C(O)CCC1=CNC2=C1C=C(C=C2)Br MCULE-3024032932 [0,1,0,0,0,0|3,0,0]=4 136 B16R2.15551 O=C(O)CCC1=CNC2=C1C=C(C=C2)I MCULE-5257779988 [0,1,0,0,0,0|3,0,0]=4 137 B16R2.15551 O=C(O)CCC1=CNC2=C1C=C(C=C2)O MCULE-4117735882 [0,1,0,0,0,0|3,0,0]=4 138 B16R2.15551 O=C(O)CCC1=CNC2=CC=C(C=C12)Cl MCULE-6818418889 [0,1,0,0,0,0|3,0,0]=4 139 B16R2.15551 O=C(O)CCC1=CNC2=CC=C(C=C12)F MCULE-4199273131 [0,1,0,0,0,0|3,0,0]=4 140 B16R2.22833 CC(C)CCN1C=CC2=C1C=CC=C2N MCULE-2313270456 [0,1,0,0,0,0|3,0,0]=4 141 B16R2.22833 CC(C)CCN1C=CC2=C1C=CC=C2N MCULE-4006470740 [0,1,0,0,0,0|3,0,0]=4 142 B16R2.22833 CC1=C2NC=C(C2=CC=C1)CCC(=O)O MCULE-4873321993 [0,1,0,0,0,0|3,0,0]=4 143 B16R2.22833 O=C(O)CCC1=CNC2=C(C=CC=C12)Br MCULE-3881669082 [0,1,0,0,0,0|3,0,0]=4 144 B16R2.22833 O=C(O)CCC1=CNC2=C(C=CC=C12)F MCULE-5570346888 [0,1,0,0,0,0|3,0,0]=4 145 B16R2.22904 CC1=C2C(=CNC2=CC=C1)CCC(=O)O MCULE-3911363614 [0,1,0,0,0,0|3,0,0]=4 146 B16R2.22904 CN(C)CCC1=CNC2=C1C(=CC=C2)O MCULE-3450497263 [0,1,0,0,0,0|0,0,0]=1 147 B16R2.22904 CN(C)CCN1C=CC2=C1C(=O)NC=C2 MCULE-1496091325 [0,1,0,0,0,0|3,0,0]=4 148 B16R2.22904 O=C(O)CCC1=CNC2=CC=CC(=C12)Br MCULE-4118032651 [0,1,0,0,0,0|3,0,0]=4 149 B16R2.22904 O=C(O)CCC1=CNC2=CC=CC(=C12)Cl MCULE-4256140437 [0,1,0,0,0,0|3,0,0]=4 150 B16R2.22904 O=C(O)CCC1=CNC2=CC=CC(=C12)F MCULE-7647345792 [0,1,0,0,0,0|3,0,0]=4 151 B16R2.104522 CN1C=C(C2=C1C=CC=C2)CCC(=O)O MCULE-1723021666 [0,1,0,0,0,0|3,0,0]=4 152 B14R1.96 CN(C)CCOC1=C(C=CC=C1)C#N MCULE-9915353395 [0,0,1,0,0,0|3,0,0]=4 153 B14R1.96 CN(C)CCOC1=C(C=CC=C1)C=O MCULE-8241626666 [0,0,1,0,0,0|3,0,0]=4 154 B14R1.96 CN(C)CCOC1=C(C=CC=C1)CN MCULE-1475415398 [0,0,1,0,0,0|3,0,0]=4 155 B14R1.96 CN(C)CCOC1=C(C=CC=C1)CO MCULE-1749487396 [0,0,1,0,0,0|3,0,0]=4 156 B14R1.96 CN(C)CCOC1=CC=CC=C1C=O MCULE-9212455451 [0,0,1,0,0,0|3,0,0]=4 157 B14R1.160 CC(C)CNC(=O)C1=C(C=CC=C1)N MCULE-9841541518 [0,0,1,0,0,0|3,0,0]=4 158 B14R1.160 CC(C)COC(=O)C1=C(C=CC=C1)N MCULE-2088196075 [0,0,1,0,0,0|3,0,0]=4 159 B14R1.422 CN(C)CCCNCC1=CC=CC=C1 MCULE-1634979608 [0,0,1,0,0,0|2,0,1]=4 160 B14R1.422 CN(C)CCCNCC1=CC=CC=C1 MCULE-7801168748 [0,0,1,0,0,0|2,0,1]=4 161 B14R1.422 CN(C)CCNCCC1=CC=CC=C1 MCULE-7425135449 [0,0,1,0,0,0|2,0,1]=4 162 B14R1.540 CC(C)C/C=C(/C=O)\C1=CC=CC=C1 MCULE-6387347700 [0,0,1,0,0,0|2,0,1]=4 163 B14R1.540 CC(C)CC=C(C=O)C1=CC=CC=C1 MCULE-7113688530 [0,0,1,0,0,0|2,0,1]=4 164 B14R1.540 CCN(CCN(C)C)C1=CC=CC=C1 MCULE-7515401483 [0,0,1,0,0,0|2,0,1]=4 165 B14R1.540 CN(C)CCC(=NO)C1=CC=CC=C1 MCULE-8958586900 [0,0,1,0,0,0|2,0,0]=3 166 B14R1.540 CN(C)CCC(C#N)C1=CC=CC=C1 MCULE-8147410471 [0,0,1,0,0,0|0,0,3]=4 167 B14R1.540 C[NH+](C)CCC(=NO)C1=CC=CC=C1 MCULE-7079937460 [0,0,1,0,0,0|2,0,1]=4 168 B16R3.2637 CC1CCN2C(=NC3=C2C=CC=C3)C1 MCULE-8492664804 [0,0,0,1,0,0|2,0,1]=4 169 B16R3.2637 CN1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-2318549673 [0,0,0,1,0,0|0,0,0]=1 170 B16R3.2637 CN1CCN2C(=NC3=C2C=CC=C3)C1 MCULE-3331176682 [0,0,0,1,0,0|1,0,1]=3 171 B16R3.2637 C[N+]1=CC2=C(CC1)C3=C(N2)C=CC=C3 MCULE-1304770593 [0,0,0,1,0,0|0,0,2]=3 172 B16R3.2637 C[N+]1=CC2=C(CC1)C3=C(N2)C=CC=C3 MCULE-4957211827 [0,0,0,1,0,0|0,0,2]=3 173 B16R3.2637 NC1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-7431006251 [0,0,0,1,0,0|2,0,0]=3 174 B16R3.2637 O=C1CC2=C(CN1)C3=C(N2)C=CC=C3 MCULE-3979644775 [0,0,0,1,0,0|3,0,0]=4 175 B16R3.2637 O=C1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-1954151692 [0,0,0,1,0,0|2,0,0]=3 176 B16R3.17569 O=C1CCC2=CNC3=C2C(=CC=C3)N1 MCULE-1424890738 [0,0,0,1,0,0|3,0,0]=4 177 B14R2.2 CC(=O)CC1=CNC2=CC=CC=C12 MCULE-4629595835 [0,0,0,0,1,0|2,0,0]=3 178 B14R2.2 CC(=O)CC1=COC2=C1C=CC=C2 MCULE-3973293992 [0,0,0,0,1,0|3,0,0]=4 179 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 MCULE-7756909848 [0,0,0,0,1,0|3,0,0]=4 180 B14R2.2 CC(C)CN1C=NC2=CC=CC=C12 MCULE-8756634288 [0,0,0,0,1,0|2,0,1]=4 181 B14R2.2 CC(C)NC1=NNC2=CC=CC=C12 MCULE-6904882908 [0,0,0,0,1,0|3,0,0]=4 182 B14R2.2 CC(N)CC1=CNC2=CC=CC=C12 MCULE-6417482430 [0,0,0,0,1,0|2,0,0]=3 183 B14R2.2 CC(N)CC1=CSC2=CC=CC=C12 MCULE-6169331711 [0,0,0,0,1,0|3,0,0]=4 184 B14R2.2 CC(O)CC1=CNC2=CC=CC=C12 MCULE-4095237423 [0,0,0,0,1,0|2,0,0]=3 185 B14R2.2 CC([NH3+])CC1=CNC2=C1C=CC=C2 MCULE-6948366681 [0,0,0,0,1,0|2,0,0]=3 186 B14R2.2 CN(C)CC1=CN=C2N1C=CC=C2 MCULE-5264516838 [0,0,0,0,1,0|1,0,1]=3 187 B14R2.2 CN(C)CC1=CNC2=C1C=CC=C2 MCULE-6015845238 [0,0,0,0,1,0|0,0,0]=1 188 B14R2.2 CN(C)CC1=CNC2=C1NC=CN2 MCULE-4908356684 [0,0,0,0,1,0|2,0,0]=3 189 B14R2.2 CN(C)CC1=CNC2=CC=CC=C12 MCULE-3643815953 [0,0,0,0,1,0|0,0,0]=1 190 B14R2.2 CN(C)CC1=CNC2=NC=CC=C12 MCULE-5826370064 [0,0,0,0,1,0|1,0,0]=2 191 B14R2.2 CN(C)CC1=NNC2=C1C=CC=C2 MCULE-7229788604 [0,0,0,0,1,0|1,0,0]=2 192 B14R2.2 CN(C)CN1C=CC2=CC=CC=C12 MCULE-6940369354 [0,0,0,0,1,0|2,0,0]=3 193 B14R2.2 CN(C)CN1N=NC2=C1C=CC=C2 MCULE-3944985225 [0,0,0,0,1,0|2,0,1]=4 194 B14R2.2 C[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-8293811191 [0,0,0,0,1,0|2,0,0]=3 195 B14R2.2 N=C(N)CC1=CNC2=C1C=CC=C2 MCULE-5882898867 [0,0,0,0,1,0|3,0,0]=4 196 B14R2.2 N=C(N)CC1=CNC2=C1C=CC=C2 MCULE-6089875221 [0,0,0,0,1,0|3,0,0]=4 197 B14R2.2 NC(=O)CC1=CNC2=CC=CC=C12 MCULE-8683047927 [0,0,0,0,1,0|3,0,0]=4 198 B14R2.2 NC(=S)CC1=CNC2=C1C=CC=C2 MCULE-8809650069 [0,0,0,0,1,0|3,0,0]=4 199 B14R2.2 O=C(Cl)CC1=CNC2=CC=CC=C12 MCULE-6562481749 [0,0,0,0,1,0|3,0,0]=4 200 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 MCULE-9266736782 [0,0,0,0,1,0|3,0,0]=4 201 B14R2.2 O=C([O-])CC1=CNC2=C1C=CC=C2 MCULE-3608225852 [0,0,0,0,1,0|3,0,0]=4 202 B14R2.2 O=C([O-])CC1=CNC2=C1C=CC=C2 MCULE-7228643156 [0,0,0,0,1,0|3,0,0]=4 203 B16R2.36 CC(=O)NCCC1=CNC2=C1C=CC=C2 MCULE-3484861085 [0,0,0,0,0,1|2,0,0]=3 204 B16R2.36 CC(=O)OCCC1=CNC2=C1C=CC=C2 MCULE-8819515006 [0,0,0,0,0,1|2,0,0]=3 205 B16R2.36 CC(C)NCCC1=CNC2=C1C=CC=C2 MCULE-3624253378 [0,0,0,0,0,1|1,0,0]=2 206 B16R2.36 CC(C)NCCC1=CNC2=C1C=CC=C2 MCULE-6669922334 [0,0,0,0,0,1|1,0,0]=2 207 B16R2.36 CC(C)NCCC1=CNC2=C1C=CC=C2 MCULE-7927210820 [0,0,0,0,0,1|1,0,0]=2 208 B16R2.36 CN(C)CCCN1C=CC2=C1C=CC=C2 MCULE-9906266423 [0,0,0,0,0,1|2,0,0]=3 209 B16R2.36 CN(C)CCCN1C=NC2=C1C=CC=C2 MCULE-5625301706 [0,0,0,0,0,1|1,0,1]=3 210 B16R2.36 C[NH+](C)CCCN1C=[NH+]C2=C1C=CC=C2 MCULE-4422414451 [0,0,0,0,0,1|1,0,2]=4 211 B16R2.36 NC(=O)CCCC1=CNC2=C1C=CC=C2 MCULE-7880098416 [0,0,0,0,0,1|3,0,0]=4 212 B16R2.36 NC(=O)CSCC1=CNC2=CC=CC=C12 MCULE-2182477897 [0,0,0,0,0,1|3,0,0]=4 213 B16R2.36 NC(=O)NCCC1=CNC2=CC=CC=C12 MCULE-5405095437 [0,0,0,0,0,1|3,0,0]=4 214 B16R2.36 NC(=S)CCCC1=CNC2=C1C=CC=C2 MCULE-9048575666 [0,0,0,0,0,1|3,0,0]=4 215 B16R2.36 NC(=S)NCCC1=CNC2=CC=CC=C12 MCULE-5137799018 [0,0,0,0,0,1|3,0,0]=4 216 B16R2.36 O=C(Cl)CCCC1=CNC2=CC=CC=C12 MCULE-5202346383 [0,0,0,0,0,1|3,0,0]=4 217 B16R2.36 O=C(O)CCCC1=CNC2=CC=CC=C12 MCULE-1997278353 [0,0,0,0,0,1|3,0,0]=4 218 B16R2.36 O=C(O)CCSC1=CNC2=C1C=CC=C2 MCULE-1489776866 [0,0,0,0,0,1|3,0,0]=4 219 B16R2.36 O=C(O)CSCC1=CNC2=CC=CC=C12 MCULE-1572443329 [0,0,0,0,0,1|3,0,0]=4 220 B16R2.36 O=C([O-])CCCC1=CNC2=C1C=CC=C2 MCULE-4353856647 [0,0,0,0,0,1|3,0,0]=4 221 B16R2.477 C=C(C)CCC1=CC2=C(C=CC=C2)C=C1 MCULE-2167541389 [0,0,0,0,0,1|2,0,1]=4 222 B16R2.477 CC(C)COC1=CC=C2C=CC=CC2=C1 MCULE-3337979629 [0,0,0,0,0,1|3,0,0]=4 223 B16R2.179941 C=C(C)CCC1=CC=CC2=CC=CC=C12 MCULE-9602797463 [0,0,0,0,0,1|2,0,1]=4 224 B16R2.179941 CC(=O)CCC1=C2C=CC=CC2=CC=C1 MCULE-8933922318 [0,0,0,0,0,1|3,0,0]=4 225 B16R2.179941 CC(=O)CCC1=C2C=CC=CC2=CN=C1 MCULE-6509347005 [0,0,0,0,0,1|2,0,1]=4 226 B16R2.179941 CC(C)CC[N+]1=C2C=CC=CC2=CC=C1 MCULE-1864310346 [0,0,0,0,0,1|3,0,0]=4 227 B16R2.179941 CC(C)CC[N+]1=C2C=CC=CC2=CC=C1 MCULE-3945775066 [0,0,0,0,0,1|3,0,0]=4 228 B16R2.179941 CC(C)CNC1=NC=NC2=C1C=CC=C2 MCULE-3862986838 [0,0,0,0,0,1|2,0,1]=4 229 B16R2.179941 CC(C)CNC1=NC=NC2=C1C=CC=C2 MCULE-6818883024 [0,0,0,0,0,1|2,0,1]=4 230 B16R2.179941 CC(C)NCC1=CC=CC2=CC=CC=C12 MCULE-4511437561 [0,0,0,0,0,1|3,0,0]=4 231 B16R2.179941 CC(C)NCC1=CC=CC2=CC=CC=C12 MCULE-5399676424 [0,0,0,0,0,1|3,0,0]=4 232 B16R2.179941 CC(C)NCC1=CC=NC2=C1C=CC=C2 MCULE-6694900360 [0,0,0,0,0,1|2,0,1]=4 233 B16R2.179941 CC(C)NCC1=NC=CC2=C1C=CC=C2 MCULE-4205178366 [0,0,0,0,0,1|3,0,0]=4 234 B16R2.179941 CN(C)CCC1=C2C=CC=CC2=CC=C1 MCULE-7267224706 [0,0,0,0,0,1|1,0,0]=2 235 B16R2.179941 CN(C)CCN1CCNC2=CC=CC=C12 MCULE-8728943322 [0,0,0,0,0,1|1,0,1]=3 236 B16R2.179941 CN(C)CNC1=C2C=CC=CC2=CC=C1 MCULE-2965864318 [0,0,0,0,0,1|2,0,0]=3 237 B13R1.158 CC(C)CCOC1=C(C=CC=C1)N MCULE-1943680863 [1,0,1,0,0,0|2,0,0]=4 238 B13R1.158 CN(C)CCNC1=C(C=CC=C1)N MCULE-1959013735 [1,0,1,0,0,0|1,0,0]=3 239 B13R1.158 CN(C)CCNC1=C(C=CC=N1)N MCULE-7161712348 [1,0,1,0,0,0|2,0,0]=4 240 B13R1.158 CN(C)CCOC1=C(C=CC=C1)N MCULE-3273915469 [1,0,1,0,0,0|1,0,0]=3 241 B13R1.158 CN(C)CCOC1=C(C=CC=C1)N MCULE-4894750104 [1,0,1,0,0,0|1,0,0]=3 242 B13R1.158 CN(C)CCOC1=C(C=CC=C1)N MCULE-9223196458 [1,0,1,0,0,0|1,0,0]=3 243 B13R1.158 CN(C)CCOC1=CC=CC=C1Br MCULE-8721188188 [1,0,1,0,0,0|2,0,0]=4 244 B13R1.158 CN(C)CCOC1=CC=CC=C1I MCULE-2708053810 [1,0,1,0,0,0|2,0,0]=4 245 B13R1.158 CN(C)CCOC1=CC=CC=C1I MCULE-9806049614 [1,0,1,0,0,0|2,0,0]=4 246 B13R1.45 CC(C)CCC(=O)C1=CC=CC=C1 MCULE-1823903499 [1,0,1,0,0,0|2,0,0]=4 247 B13R1.45 CC(C)CC[C@@H](N)C1=CC=CC=C1 MCULE-1291319448 [1,0,1,0,0,0|1,0,1]=4 248 B13R1.45 CC(C)CC[C@@H](N)C1=CC=CC=C1 MCULE-6924881366 [1,0,1,0,0,0|1,0,1]=4 249 B13R1.45 CC(C)CC[C@H](N)C1=CC=CC=C1 MCULE-4502227889 [1,0,1,0,0,0|1,0,1]=4 250 B13R1.45 CC(C)CC[C@H](N)C1=CC=CC=C1 MCULE-8423089033 [1,0,1,0,0,0|1,0,1]=4 251 B13R1.45 CN(C)CCC(=O)C1=CC=CC=C1 MCULE-4031792903 [1,0,1,0,0,0|1,0,0]=3 252 B13R1.45 CN(C)CCC(Cl)C1=CC=CC=C1 MCULE-5018750463 [1,0,1,0,0,0|1,0,1]=4 253 B13R1.45 CN(C)CCC(Cl)C1=CC=CC=C1 MCULE-5462243414 [1,0,1,0,0,0|1,0,1]=4 254 B13R1.45 CN(C)CCC(N)C1=CC=CC=C1 MCULE-2965437641 [1,0,1,0,0,0|0,0,1]=3 255 B13R1.45 CN(C)CCC(N)C1=CC=CC=C1 MCULE-6392382585 [1,0,1,0,0,0|0,0,1]=3 256 B13R1.45 CN(C)CCC(N)C1=CN=CC=C1 MCULE-4836679113 [1,0,1,0,0,0|1,0,1]=4 257 B13R1.45 CN(C)CCC(O)C1=CC=CC=C1 MCULE-2318002743 [1,0,1,0,0,0|1,0,1]=4 258 B13R1.45 CN(C)CCC(O)C1=CC=CC=C1 MCULE-7787611298 [1,0,1,0,0,0|1,0,1]=4 259 B13R1.45 CN(C)CCS(=O)C1=CC=CC=C1 MCULE-5200877785 [1,0,1,0,0,0|2,0,0]=4 260 B13R1.45 CN(C)CC[C@@H](O)C1=CC=CC=C1 MCULE-4528954489 [1,0,1,0,0,0|1,0,1]=4 261 B13R1.45 CN(C)CC[C@@H](O)C1=CC=CC=C1 MCULE-5623245528 [1,0,1,0,0,0|1,0,1]=4 262 B13R1.45 CN(C)CC[C@@H](O)C1=CC=CC=C1 MCULE-6847524445 [1,0,1,0,0,0|1,0,1]=4 263 B13R1.45 CN(C)CC[C@@H](O)C1=CC=CC=C1 MCULE-8110200441 [1,0,1,0,0,0|1,0,1]=4 264 B13R1.45 CN(C)CC[C@H](O)C1=CC=CC=C1 MCULE-9513828216 [1,0,1,0,0,0|1,0,1]=4 265 B13R1.45 CN(C)CC[C@H](O)C1=CC=CC=C1 MCULE-9590476960 [1,0,1,0,0,0|1,0,1]=4 266 B13R1.45 C[NH+](C)CCC(=O)C1=CC=CC=C1 MCULE-4520702289 [1,0,1,0,0,0|1,0,1]=4 267 B13R2.1 BrCCC1=CNC2=CC=CC=C12 MCULE-7970040548 [2,0,0,0,0,0|1,0,0]=3 268 B13R2.1 C=CCC1=CNC2=C1C=CC=C2 MCULE-3755785484 [2,0,0,0,0,0|0,0,2]=4 269 B13R2.1 CCCN1C=CC2=C1C=CC=C2 MCULE-1860139388 [2,0,0,0,0,0|2,0,0]=4 270 B13R2.1 CCCN1C=NC2=C1C=CC=C2 MCULE-6531641989 [2,0,0,0,0,0|1,0,1]=4 271 B13R2.1 CCCN1C=NC2=C1C=CC=C2 MCULE-6800421343 [2,0,0,0,0,0|1,0,1]=4 272 B13R2.1 CCCN1C=NC2=CC=CC=C12 MCULE-1523679554 [2,0,0,0,0,0|1,0,1]=4 273 B13R2.1 CCOC1=NNC2=CC=CC=C12 MCULE-8037093270 [2,0,0,0,0,0|2,0,0]=4 274 B13R2.1 CNCC1=CN=C2N1C=CC=C2 MCULE-1159612009 [2,0,0,0,0,0|1,0,1]=4 275 B13R2.1 CNCC1=CN=C2N1C=CC=C2 MCULE-2872900939 [2,0,0,0,0,0|1,0,1]=4 276 B13R2.1 CNCC1=CNC2=C1C=CC=C2 MCULE-9047737801 [2,0,0,0,0,0|0,0,0]=2 277 B13R2.1 CNCC1=CNC2=NC=CC=C12 MCULE-5684641489 [2,0,0,0,0,0|1,0,0]=3 278 B13R2.1 CNCC1=CNC2=NC=CC=C12 MCULE-6551207812 [2,0,0,0,0,0|1,0,0]=3 279 B13R2.1 CNCC1=COC2=CC=CC=C12 MCULE-6950410380 [2,0,0,0,0,0|1,0,0]=3 280 B13R2.1 CNCC1=COC2=CC=CC=C12 MCULE-9111623154 [2,0,0,0,0,0|1,0,0]=3 281 B13R2.1 CNCC1=CSC2=C1C=CC=C2 MCULE-4376202521 [2,0,0,0,0,0|1,0,0]=3 282 B13R2.1 CNCC1=CSC2=C1C=CC=C2 MCULE-5470793084 [2,0,0,0,0,0|1,0,0]=3 283 B13R2.1 COCC1=CNC2=CC=CC=C12 MCULE-1453715736 [2,0,0,0,0,0|1,0,0]=3 284 B13R2.1 ClCCC1=CNC2=C1C=CC=C2 MCULE-9877505951 [2,0,0,0,0,0|1,0,0]=3 285 B13R2.1 ClCCC1=CNC2=NC=CC=C12 MCULE-3079129470 [2,0,0,0,0,0|2,0,0]=4 286 B13R2.1 N#CCC1=CNC2=C1C=CC=C2 MCULE-6428652739 [2,0,0,0,0,0|0,0,2]=4 287 B13R2.1 NCCC1=CCC2=C1C=CC=C2 MCULE-2661013112 [2,0,0,0,0,0|1,0,0]=3 288 B13R2.1 NCCC1=CCC2=C1C=CC=C2 MCULE-5998677222 [2,0,0,0,0,0|1,0,0]=3 289 B13R2.1 NCCC1=CN=C2N1C=CC=C2 MCULE-3232960845 [2,0,0,0,0,0|1,0,1]=4 290 B13R2.1 NCCC1=CN=C2N1C=CC=C2 MCULE-6491492151 [2,0,0,0,0,0|1,0,1]=4 291 B13R2.1 NCCC1=CNC2=C1C=CC=C2 MCULE-6402431765 [2,0,0,0,0,0|0,0,0]=2 292 B13R2.1 NCCC1=CNC2=C1C=CC=N2 MCULE-6871527636 [2,0,0,0,0,0|1,0,0]=3 293 B13R2.1 NCCC1=CNC2=C1C=CN=C2 MCULE-1726648661 [2,0,0,0,0,0|1,0,0]=3 294 B13R2.1 NCCC1=CNC2=C1C=CN=C2 MCULE-7587127908 [2,0,0,0,0,0|1,0,0]=3 295 B13R2.1 NCCC1=CNC2=C1C=NC=C2 MCULE-3986262249 [2,0,0,0,0,0|1,0,0]=3 296 B13R2.1 NCCC1=CNC2=C1C=NC=C2 MCULE-7073983222 [2,0,0,0,0,0|1,0,0]=3 297 B13R2.1 NCCC1=CNC2=C1N=CC=C2 MCULE-5172198608 [2,0,0,0,0,0|1,0,0]=3 298 B13R2.1 NCCC1=CNC2=CC=CN=C12 MCULE-5751228184 [2,0,0,0,0,0|1,0,0]=3 299 B13R2.1 NCCC1=CNC2=NC=CC=C12 MCULE-5729961356 [2,0,0,0,0,0|1,0,0]=3 300 B13R2.1 NCCC1=CNC2=NC=CC=C12 MCULE-9632213722 [2,0,0,0,0,0|1,0,0]=3 301 B13R2.1 NCCC1=COC2=CC=CC=C12 MCULE-7528617628 [2,0,0,0,0,0|1,0,0]=3 302 B13R2.1 NCCC1=COC2=CC=CC=C12 MCULE-7867750419 [2,0,0,0,0,0|1,0,0]=3 303 B13R2.1 NCCC1=CSC2=C1C=CC=C2 MCULE-4237424815 [2,0,0,0,0,0|1,0,0]=3 304 B13R2.1 NCCC1=CSC2=C1C=CC=C2 MCULE-4439041927 [2,0,0,0,0,0|1,0,0]=3 305 B13R2.1 NCCC1=NNC2=C1C=CC=C2 MCULE-1354507733 [2,0,0,0,0,0|1,0,0]=3 306 B13R2.1 NCCC1=NNC2=C1C=CC=C2 MCULE-8325758175 [2,0,0,0,0,0|1,0,0]=3 307 B13R2.1 NCCC1=NOC2=C1C=CC=C2 MCULE-3151664736 [2,0,0,0,0,0|2,0,0]=4 308 B13R2.1 NCCC1=NOC2=C1C=CC=C2 MCULE-5047657632 [2,0,0,0,0,0|2,0,0]=4 309 B13R2.1 NCCC1=NSC2=C1C=CC=C2 MCULE-2503660518 [2,0,0,0,0,0|2,0,0]=4 310 B13R2.1 NCCC1=NSC2=C1C=CC=C2 MCULE-3141745623 [2,0,0,0,0,0|2,0,0]=4 311 B13R2.1 NCCC1CNC2=C1C=CC=C2 MCULE-4011745440 [2,0,0,0,0,0|0,0,2]=4 312 B13R2.1 NCCN1C=CC2=C1C=CC=C2 MCULE-9137752201 [2,0,0,0,0,0|2,0,0]=4 313 B13R2.1 NCCN1C=CC2=CC=CC=C12 MCULE-3588787751 [2,0,0,0,0,0|2,0,0]=4 314 B13R2.1 NCCN1C=CC2=CC=CC=C12 MCULE-7768705028 [2,0,0,0,0,0|2,0,0]=4 315 B13R2.1 NCCN1C=NC2=C1C=CC=C2 MCULE-4986998211 [2,0,0,0,0,0|1,0,1]=4 316 B13R2.1 NCCN1C=NC2=C1C=CC=C2 MCULE-6950259320 [2,0,0,0,0,0|1,0,1]=4 317 B13R2.1 NCCN1C=NC2=CC=CC=C12 MCULE-1272920132 [2,0,0,0,0,0|1,0,1]=4 318 B13R2.1 NN=CC1=CNC2=C1C=CC=C2 MCULE-5380513489 [2,0,0,0,0,0|1,0,1]=4 319 B13R2.1 O=CCC1=CNC2=C1C=CC=C2 MCULE-2893533280 [2,0,0,0,0,0|1,0,1]=4 320 B13R2.1 OCCC1=CNC2=C1C=CC=C2 MCULE-8363712085 [2,0,0,0,0,0|1,0,0]=3 321 B13R2.1 OCCC1=COC2=C1C=CC=C2 MCULE-7695308896 [2,0,0,0,0,0|2,0,0]=4 322 B13R2.1 OCCC1=CSC2=C1C=CC=C2 MCULE-5213360412 [2,0,0,0,0,0|2,0,0]=4 323 B13R2.1 SCCC1=CNC2=C1C=CC=C2 MCULE-4961164716 [2,0,0,0,0,0|1,0,0]=3 324 B13R2.1 [NH3+]CCC1=CNC2=C1C=CC=C2 MCULE-2705006421 [2,0,0,0,0,0|0,0,1]=3 325 B15R1.589 CNCC1=C(C=CC=C1)OCCN(C)C MCULE-7533331025 [0,1,1,0,0,0|1,0,1]=4 326 B15R1.5822 CN(C)CCN(C)C1=C(C=C(C=C1)Br)N MCULE-6664256502 [0,1,1,0,0,0|1,0,1]=4 327 B15R1.8420 CN(C)CCC(=O)C1=CC(=CC=C1Cl)Cl MCULE-5121950123 [0,1,1,0,0,0|2,0,0]=4 328 B15R1.8420 CN(C)CCC(=O)C1=CC(=CC=C1Cl)Cl MCULE-9321453358 [0,1,1,0,0,0|2,0,0]=4 329 B15R1.1081 CC(C)CCNC(=O)NC1=CC=CC=C1 MCULE-7220928545 [0,1,1,0,0,0|2,0,0]=4 330 B15R1.1081 CC(C)CCSC(=O)NC1=CC=CC=C1 MCULE-3760407688 [0,1,1,0,0,0|2,0,0]=4 331 B15R1.1081 CN(C)CCNC(=O)CC1=CC=CC=C1 MCULE-5915900957 [0,1,1,0,0,0|2,0,0]=4 332 B15R1.1081 CN(C)CCNC(=O)NC1=CC=CC=C1 MCULE-4708401070 [0,1,1,0,0,0|1,0,0]=3 333 B15R1.1081 CN(C)CCNC(=O)OC1=CC=CC=C1 MCULE-1314352944 [0,1,1,0,0,0|2,0,0]=4 334 B15R1.1081 CN(C)CCNC(=O)OC1=CC=CC=C1 MCULE-6241386190 [0,1,1,0,0,0|2,0,0]=4 335 B15R1.1081 CN(C)CCNC(=S)NC1=CC=CC=C1 MCULE-9340237716 [0,1,1,0,0,0|1,0,0]=3 336 B15R1.1081 CN(C)CCOC(=O)CC1=CC=CC=C1 MCULE-4005529359 [0,1,1,0,0,0|2,0,0]=4 337 B15R1.1081 CN(C)CCOC(=O)CC1=CC=CC=C1 MCULE-7371115686 [0,1,1,0,0,0|2,0,0]=4 338 B15R1.5919 CN(C)CCC(=O)/C=C/C1=CC=CC=C1 MCULE-1758251385 [0,1,1,0,0,0|1,0,0]=3 339 B15R1.5919 CN(C)CCC(=O)/C=C/C1=CC=CC=C1 MCULE-9618011686 [0,1,1,0,0,0|1,0,0]=3 340 B15R1.5919 CN(C)CCC(=O)C=CC1=CC=CC=C1 MCULE-1562405363 [0,1,1,0,0,0|1,0,0]=3 341 B15R1.5919 C[NH+](C)CCC(=O)C=CC1=CC=CC=C1 MCULE-3054063612 [0,1,1,0,0,0|1,0,1]=4 342 B15R1.659 CC1=CC=C(C=C1)C(=NO)CCN(C)C MCULE-3971496112 [0,1,1,0,0,0|2,0,0]=4 343 B15R2.4 CCC(N)CC1=CNC2=C1C=CC=C2 MCULE-5651076502 [1,1,0,0,0,0|1,0,0]=3 344 B15R2.4 CCC(N)CC1=CNC2=C1C=CC=C2 MCULE-8710039661 [1,1,0,0,0,0|1,0,0]=3 345 B15R2.4 CCC(N)CC1=CNC2=CC=CC=C12 MCULE-7617108096 [1,1,0,0,0,0|1,0,0]=3 346 B15R2.4 CC[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-2042856337 [1,1,0,0,0,0|1,0,0]=3 347 B15R2.4 CC[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-9961177523 [1,1,0,0,0,0|1,0,0]=3 348 B15R2.4 CNC(=O)CC1=CNC2=C1C=CC=C2 MCULE-3992305884 [1,1,0,0,0,0|0,0,1]=3 349 B15R2.4 CNC(C)CC1=CNC2=C1C=CC=C2 MCULE-7812720422 [1,1,0,0,0,0|0,0,0]=2 350 B15R2.4 COC(=O)CC1=CNC2=C1C=CC=C2 MCULE-4496787216 [1,1,0,0,0,0|1,0,1]=4 351 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-4101569242 [1,1,0,0,0,0|2,0,0]=4 352 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-4419819481 [1,1,0,0,0,0|2,0,0]=4 353 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-8757853264 [1,1,0,0,0,0|2,0,0]=4 354 B15R2.4 NNC(=O)CC1=CNC2=C1C=CC=C2 MCULE-8651125112 [1,1,0,0,0,0|1,0,1]=4 355 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-5057169498 [1,1,0,0,0,0|2,0,0]=4 356 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-6263792283 [1,1,0,0,0,0|2,0,0]=4 357 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-7147570312 [1,1,0,0,0,0|2,0,0]=4 358 B15R2.4 N[C@@H](CO)CC1=CNC2=CC=CC=C12 MCULE-9591598328 [1,1,0,0,0,0|2,0,0]=4 359 B15R2.4 N[C@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-1258780591 [1,1,0,0,0,0|2,0,0]=4 360 B15R2.4 [C@@H](N)(CO)CC1=CNC2=C1C=CC=C2 MCULE-7424777740 [1,1,0,0,0,0|2,0,0]=4 361 B15R2.5 N#CSCCC1=CNC2=C1C=CC=C2 MCULE-3179312754 [1,1,0,0,0,0|1,0,1]=4 362 B15R2.5 N#N=NCCC1=CNC2=C1C=CC=C2 MCULE-3761251765 [1,1,0,0,0,0|1,0,1]=4 363 B15R2.5 NCCCCC1=CNC2=C1C=CC=C2 MCULE-6711010140 [1,1,0,0,0,0|1,0,0]=3 364 B15R2.5 O=CNCCC1=CNC2=C1C=CC=C2 MCULE-2222832478 [1,1,0,0,0,0|0,0,1]=3 365 B15R2.5 O=CNCCC1=COC2=C1C=CC=C2 MCULE-6735163920 [1,1,0,0,0,0|1,0,1]=4 366 B15R2.65 CC1=C2NC=C(C2=CC=C1)CCCN MCULE-5373656763 [1,1,0,0,0,0|2,0,0]=4 367 B15R2.65 NCCCC1=CNC2=C(C=CC=C12)Br MCULE-7271294699 [1,1,0,0,0,0|2,0,0]=4 368 B15R2.65 NCCCC1=CNC2=C(C=CC=C12)Cl MCULE-5863200997 [1,1,0,0,0,0|2,0,0]=4 369 B15R2.65 NCCCC1=CNC2=C(C=CC=C12)Cl MCULE-7303623768 [1,1,0,0,0,0|2,0,0]=4 370 B15R2.65 NCCCC1=CNC2=C(C=CC=C12)F MCULE-2128097137 [1,1,0,0,0,0|2,0,0]=4 371 B15R2.73 C=CC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-4303906411 [1,1,0,0,0,0|1,0,1]=4 372 B15R2.73 C=CC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-8105214425 [1,1,0,0,0,0|1,0,1]=4 373 B15R2.73 C=CC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-1094918969 [1,1,0,0,0,0|1,0,1]=4 374 B15R2.73 C=CC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-8337021197 [1,1,0,0,0,0|1,0,1]=4 375 B15R2.73 CC(CCO)C1=CNC2=C1C=CC=C2 MCULE-6633467549 [1,1,0,0,0,0|2,0,0]=4 376 B15R2.73 CCCC(=O)C1=CNC2=C1C=CC=C2 MCULE-8914700052 [1,1,0,0,0,0|1,0,1]=4 377 B15R2.73 CCC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-5688639569 [1,1,0,0,0,0|1,0,0]=3 378 B15R2.73 CCC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-9253056994 [1,1,0,0,0,0|1,0,0]=3 379 B15R2.73 CCC[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-4609952049 [1,1,0,0,0,0|2,0,0]=4 380 B15R2.73 CCC[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-9804155180 [1,1,0,0,0,0|2,0,0]=4 381 B15R2.73 CCC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-2511301077 [1,1,0,0,0,0|1,0,0]=3 382 B15R2.73 CCC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-3683609765 [1,1,0,0,0,0|1,0,0]=3 383 B15R2.73 CCC[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-2582391673 [1,1,0,0,0,0|2,0,0]=4 384 B15R2.73 CCC[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-6102194116 [1,1,0,0,0,0|2,0,0]=4 385 B15R2.73 CNCC(=O)C1=CNC2=CC=CC=C12 MCULE-9770901689 [1,1,0,0,0,0|0,0,1]=3 386 B15R2.73 CNCC(O)C1=CNC2=CC=CC=C12 MCULE-3654098678 [1,1,0,0,0,0|0,0,0]=2 387 B15R2.73 N#CC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-3781565270 [1,1,0,0,0,0|2,0,0]=4 388 B15R2.73 N#CC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-8136554076 [1,1,0,0,0,0|2,0,0]=4 389 B15R2.73 N#CC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-2425681728 [1,1,0,0,0,0|2,0,0]=4 390 B15R2.73 N#CC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-7777820268 [1,1,0,0,0,0|2,0,0]=4 391 B15R2.73 NCC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-7377468942 [1,1,0,0,0,0|2,0,0]=4 392 B15R2.73 NCC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-7714574859 [1,1,0,0,0,0|2,0,0]=4 393 B15R2.73 NCC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-1380158962 [1,1,0,0,0,0|2,0,0]=4 394 B15R2.73 NCC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-2080068518 [1,1,0,0,0,0|2,0,0]=4 395 B15R2.73 N[C@@H](CCF)C1=CNC2=CC=CC=C12 MCULE-1298680018 [1,1,0,0,0,0|2,0,0]=4 396 B15R2.73 N[C@@H](CCF)C1=CNC2=CC=CC=C12 MCULE-6534899465 [1,1,0,0,0,0|2,0,0]=4 397 B15R2.73 N[C@@H](CCO)C1=CNC2=C1C=CC=C2 MCULE-9609971524 [1,1,0,0,0,0|2,0,0]=4 398 B15R2.73 N[C@@H](CCO)C1=CNC2=CC=CC=C12 MCULE-1168622067 [1,1,0,0,0,0|2,0,0]=4 399 B15R2.73 N[C@H](CCF)C1=CNC2=CC=CC=C12 MCULE-2667311895 [1,1,0,0,0,0|2,0,0]=4 400 B15R2.73 N[C@H](CCF)C1=CNC2=CC=CC=C12 MCULE-9166741831 [1,1,0,0,0,0|2,0,0]=4 401 B15R2.73 N[C@H](CCO)C1=CNC2=C1C=CC=C2 MCULE-7580504004 [1,1,0,0,0,0|2,0,0]=4 402 B15R2.73 N[C@H](CCO)C1=CNC2=CC=CC=C12 MCULE-7951381447 [1,1,0,0,0,0|2,0,0]=4 403 B15R2.1385 CC1=CC=C2C(=CNC2=C1)CCCN MCULE-3054127477 [1,1,0,0,0,0|2,0,0]=4 404 B15R2.1385 CCCCC1=NNC2=C1C=CC(=C2)Br MCULE-9085489875 [1,1,0,0,0,0|2,0,0]=4 405 B15R2.1385 CNCCC1=CNC2=C1C=CC(=C2)F MCULE-1164505597 [1,1,0,0,0,0|0,0,0]=2 406 B15R2.1385 NCCCC1=CNC2=CC(=CC=C12)Br MCULE-9688231998 [1,1,0,0,0,0|2,0,0]=4 407 B15R2.1385 NCCCC1=CNC2=CC(=CC=C12)Cl MCULE-4624630045 [1,1,0,0,0,0|2,0,0]=4 408 B15R2.1385 NCCCC1=CNC2=CC(=CC=C12)F MCULE-4098011357 [1,1,0,0,0,0|2,0,0]=4 409 B15R2.1428 CN1C=C(C2=C1C=CC=C2)CCC#N MCULE-9135070503 [1,1,0,0,0,0|2,0,0]=4 410 B15R2.1428 CN1C=C(C2=C1C=CC=C2)CCCN MCULE-8434906058 [1,1,0,0,0,0|2,0,0]=4 411 B15R2.1435 CC1=C(C2=C(N1)C=CC=C2)CCC#N MCULE-3534539435 [1,1,0,0,0,0|2,0,0]=4 412 B15R2.1435 CC1=C(C2=C(N1)C=CC=C2)CCCN MCULE-4019613679 [1,1,0,0,0,0|2,0,0]=4 413 B15R2.1435 CC1=C(C2=C(N1)C=CC=C2)CCCN MCULE-7229320259 [1,1,0,0,0,0|2,0,0]=4 414 B15R2.1435 CCCCN1C(=O)NC2=CC=CC=C12 MCULE-6515463975 [1,1,0,0,0,0|2,0,0]=4 415 B15R2.1435 CNCCN1C(=O)OC2=C1C=CC=C2 MCULE-3740371167 [1,1,0,0,0,0|2,0,0]=4 416 B15R2.1435 CNCCN1C(=O)OC2=C1C=CC=C2 MCULE-7748758373 [1,1,0,0,0,0|2,0,0]=4 417 B15R2.17667 CC1=C2C(=CNC2=CC=C1)CCCN MCULE-1445788470 [1,1,0,0,0,0|2,0,0]=4 418 B15R2.17667 CNCCC1=CNC2=C1C(=CC=C2)O MCULE-9180683232 [1,1,0,0,0,0|0,0,0]=2 419 B15R2.17667 NCCCC1=CNC2=CC=CC(=C12)Br MCULE-4354390075 [1,1,0,0,0,0|2,0,0]=4 420 B15R2.17667 NCCCC1=CNC2=CC=CC(=C12)Cl MCULE-4816142346 [1,1,0,0,0,0|2,0,0]=4 421 B15R2.17667 NCCCC1=CNC2=CC=CC(=C12)F MCULE-7123316991 [1,1,0,0,0,0|2,0,0]=4 422 B15R2.17719 CC1=CC=C2NC=C(C2=C1)CCCN MCULE-4520003199 [1,1,0,0,0,0|2,0,0]=4 423 B15R2.17719 CCCCC1=NNC2=C1C=C(C=C2)Br MCULE-7097367441 [1,1,0,0,0,0|2,0,0]=4 424 B15R2.17719 CNCCC1=CNC2=C1C=C(C=C2)O MCULE-1823155663 [1,1,0,0,0,0|0,0,0]=2 425 B15R2.17719 CNCCC1=CNC2=C1C=C(C=C2)O MCULE-2918354234 [1,1,0,0,0,0|0,0,0]=2 426 B15R2.17719 NCCCC1=CNC2=C1C=C(C=C2)Br MCULE-5589265218 [1,1,0,0,0,0|2,0,0]=4 427 B15R2.17719 NCCCC1=CNC2=C1C=C(C=C2)F MCULE-2533283808 [1,1,0,0,0,0|2,0,0]=4 428 B15R2.17719 NCCCC1=CNC2=C1C=C(C=C2)F MCULE-9966650311 [1,1,0,0,0,0|2,0,0]=4 429 B15R2.17719 NCCCC1=CNC2=C1C=C(C=C2)I MCULE-4038685690 [1,1,0,0,0,0|2,0,0]=4 430 B15R2.17719 NCCCC1=CNC2=CC=C(C=C12)Br MCULE-9581223794 [1,1,0,0,0,0|2,0,0]=4 431 B15R2.17719 NCCCC1=CNC2=CC=C(C=C12)Cl MCULE-8078485200 [1,1,0,0,0,0|2,0,0]=4 432 B15R2.17719 OCCCC1=CNC2=C1C=C(C=C2)Br MCULE-1084149320 [1,1,0,0,0,0|2,0,0]=4 433 B15R2.17719 OCCCC1=CNC2=C1C=C(C=C2)F MCULE-4395974853 [1,1,0,0,0,0|2,0,0]=4 434 B15R2.17719 OCCCC1=CNC2=CC=C(C=C12)Cl MCULE-2821445160 [1,1,0,0,0,0|2,0,0]=4 435 B15R2.17719 [NH3+]CCCC1=CNC2=C1C=C(C=C2)C MCULE-6315348922 [1,1,0,0,0,0|2,0,0]=4 436 B15R2.17719 [NH3+]CCCC1=CNC2=C1C=C(C=C2)Cl MCULE-8195978965 [1,1,0,0,0,0|2,0,0]=4 437 B15R2.11 CC(C)(N)CC1=CNC2=CC=CC=C12 MCULE-3158163903 [0,1,0,0,1,0|1,0,0]=3 438 B15R2.11 C[N+](C)(C)CC1=CNC2=C1C=CC=C2 MCULE-3399862006 [0,1,0,0,1,0|0,0,1]=3 439 B15R2.11 C[N+](C)(C)CC1=CNC2=C1C=CC=C2 MCULE-5988746515 [0,1,0,0,1,0|0,0,1]=3 440 B15R2.377 CC(=O)CC1=CNC2=CC(=CC=C12)Cl MCULE-4367006692 [0,1,0,0,1,0|2,0,0]=4 441 B15R2.377 CC(C)CC1=CNC2=C1C=CC(=C2)F MCULE-1460562565 [0,1,0,0,1,0|1,0,0]=3 442 B15R2.377 CC1=CC2=C(C=C1)C(=CN2)CN(C)C MCULE-7449562890 [0,1,0,0,1,0|0,0,0]=2 443 B15R2.377 CC1=CC=C2C(=CNC2=C1)CC(C)N MCULE-8619656770 [0,1,0,0,1,0|2,0,0]=4 444 B15R2.377 CN(C)CC1=CNC2=C1C=CC(=C2)Br MCULE-9631552390 [0,1,0,0,1,0|0,0,0]=2 445 B15R2.377 CN(C)CC1=CNC2=C1C=CC(=C2)Cl MCULE-4662916771 [0,1,0,0,1,0|0,0,0]=2 446 B15R2.377 CN(C)CC1=CNC2=C1C=CC(=C2)F MCULE-8902688711 [0,1,0,0,1,0|0,0,0]=2 447 B15R2.993 CC(C)CC1C(=O)NC2=CC=CC=C12 MCULE-4377388576 [0,1,0,0,1,0|1,0,1]=4 448 B15R2.993 CC(C)CN1C(=O)NC2=CC=CC=C12 MCULE-6300421815 [0,1,0,0,1,0|2,0,0]=4 449 B15R2.993 CC(C)CN1C(=S)NC2=CC=CC=C12 MCULE-6531439805 [0,1,0,0,1,0|2,0,0]=4 450 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CN(C)C MCULE-4516162416 [0,1,0,0,1,0|0,0,0]=2 451 B15R2.993 CC1=C(C2=CC=CN=C2N1)CN(C)C MCULE-4456562498 [0,1,0,0,1,0|1,0,0]=3 452 B15R2.993 CN(C)/C=C/1\C(=O)NC2=CC=CC=C12 MCULE-7652735203 [0,1,0,0,1,0|0,0,1]=3 453 B15R2.993 CN(C)/N=C\1/C(=O)NC2=C1C=CC=C2 MCULE-6899132123 [0,1,0,0,1,0|1,0,0]=3 454 B15R2.993 CN(C)C=C1C(=O)NC2=C1C=CC=C2 MCULE-1931770998 [0,1,0,0,1,0|0,0,1]=3 455 B15R2.993 CN(O)C=C1C(=O)NC2=C1C=CC=C2 MCULE-1568649354 [0,1,0,0,1,0|1,0,1]=4 456 B15R2.1255 CC(C)C(=O)C1=CNC2=CC=CC=C12 MCULE-8593977271 [0,1,0,0,1,0|1,0,1]=4 457 B15R2.1255 CN(C)C(=O)C1=CNC2=C1C=CC=C2 MCULE-4890792331 [0,1,0,0,1,0|0,0,1]=3 458 B15R2.1255 CN(C)C(=O)C1=NNC2=C1C=CC=C2 MCULE-8229653999 [0,1,0,0,1,0|1,0,1]=4 459 B15R2.9410 CC(=O)CC1=CNC2=CC=C(C=C12)Cl MCULE-9615898504 [0,1,0,0,1,0|2,0,0]=4 460 B15R2.9410 CC(C)CC1=CNC2=C1C=C(C=C2)F MCULE-1453913066 [0,1,0,0,1,0|1,0,0]=3 461 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)Cl MCULE-5875373928 [0,1,0,0,1,0|2,0,0]=4 462 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)Cl MCULE-9955720207 [0,1,0,0,1,0|2,0,0]=4 463 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)F MCULE-2837435802 [0,1,0,0,1,0|2,0,0]=4 464 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)F MCULE-8954408176 [0,1,0,0,1,0|2,0,0]=4 465 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)O MCULE-7600122348 [0,1,0,0,1,0|2,0,0]=4 466 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)O MCULE-7768148728 [0,1,0,0,1,0|2,0,0]=4 467 B15R2.9410 CC(N)CC1=CNC2=CC=C(C=C12)O MCULE-2734017010 [0,1,0,0,1,0|2,0,0]=4 468 B15R2.9410 CC1=CC2=C(C=C1)NC=C2CC(C)N MCULE-4929700306 [0,1,0,0,1,0|2,0,0]=4 469 B15R2.9410 CC1=CC=C2NC=C(C2=C1)CN(C)C MCULE-1239304316 [0,1,0,0,1,0|0,0,0]=2 470 B15R2.9410 CC1=CN2C(=CN=C2C=C1)CN(C)C MCULE-8827475975 [0,1,0,0,1,0|1,0,1]=4 471 B15R2.9410 CN(C)CC1=CN=C2N1C=C(C=C2)Br MCULE-1224594450 [0,1,0,0,1,0|1,0,1]=4 472 B15R2.9410 CN(C)CC1=CN=C2N1C=C(C=C2)Br MCULE-7829505384 [0,1,0,0,1,0|1,0,1]=4 473 B15R2.9410 CN(C)CC1=CN=C2N1C=C(C=C2)Cl MCULE-5329591641 [0,1,0,0,1,0|1,0,1]=4 474 B15R2.9410 CN(C)CC1=CN=C2N1C=C(C=C2)Cl MCULE-9070474605 [0,1,0,0,1,0|1,0,1]=4 475 B15R2.9410 CN(C)CC1=CNC2=C1C=C(C=C2)Br MCULE-7969751778 [0,1,0,0,1,0|0,0,0]=2 476 B15R2.9410 CN(C)CC1=CNC2=C1C=C(C=C2)Cl MCULE-6526064946 [0,1,0,0,1,0|0,0,0]=2 477 B15R2.9410 CN(C)CC1=CNC2=C1C=C(C=C2)N MCULE-8554220221 [0,1,0,0,1,0|0,0,0]=2 478 B15R2.9410 CN(C)CC1=CNC2=CC=C(C=C12)F MCULE-1783162847 [0,1,0,0,1,0|0,0,0]=2 479 B15R2.9410 CN(C)CC1=CNC2=NC=C(C=C12)Br MCULE-8524184964 [0,1,0,0,1,0|1,0,0]=3 480 B15R2.9410 C[C@@H](N)CC1=CNC2=CC=C(C=C12)F MCULE-7398131426 [0,1,0,0,1,0|2,0,0]=4 481 B15R2.9410 C[C@@H](N)CC1=CNC2=CC=C(C=C12)O MCULE-2319511262 [0,1,0,0,1,0|2,0,0]=4 482 B15R2.9410 C[C@@H](N)CC1=CNC2=CC=C(C=C12)O MCULE-5638747243 [0,1,0,0,1,0|2,0,0]=4 483 B15R2.13587 CC(C)CC1=CNC2=C1C=CC=C2F MCULE-4719562494 [0,1,0,0,1,0|1,0,0]=3 484 B15R2.13587 CC1=CC=CC2=C1NC=C2CC(C)N MCULE-2012819762 [0,1,0,0,1,0|2,0,0]=4 485 B15R2.13587 CC1=CC=CC2=C1NC=C2CC(C)N MCULE-8183855027 [0,1,0,0,1,0|2,0,0]=4 486 B15R2.13587 CC1=CC=CC2=C1NC=C2CN(C)C MCULE-5198958845 [0,1,0,0,1,0|0,0,0]=2 487 B15R2.13587 CN(C)CC1=CNC2=C1C=CC=C2Br MCULE-7047700294 [0,1,0,0,1,0|0,0,0]=2 488 B15R2.13587 CN(C)CC1=CNC2=C1C=CC=C2Cl MCULE-2834986242 [0,1,0,0,1,0|0,0,0]=2 489 B15R2.13624 CC(=O)CC1=CNC2=CC=CC(=C12)Cl MCULE-6944176404 [0,1,0,0,1,0|2,0,0]=4 490 B15R2.13624 CC(=O)CC1=CNC2=CC=CC(=C12)F MCULE-6372707059 [0,1,0,0,1,0|2,0,0]=4 491 B15R2.13624 CC(C)CC1=CNC2=C1C(=CC=C2)F MCULE-3544868367 [0,1,0,0,1,0|1,0,0]=3 492 B15R2.13624 CN(C)CC1=CNC2=C1C(=CC=C2)Br MCULE-5007676335 [0,1,0,0,1,0|0,0,0]=2 493 B15R2.13624 CN(C)CC1=CNC2=C1C(=CC=C2)F MCULE-5797929285 [0,1,0,0,1,0|0,0,0]=2 494 B15R2.53147 CC(N)CC1=CN(C2=C1C=CC=C2)C MCULE-8078196971 [0,1,0,0,1,0|2,0,0]=4 495 B15R2.53147 CC(N)CC1=CN(C2=CC=CC=C12)C MCULE-5211414288 [0,1,0,0,1,0|2,0,0]=4 496 B15R2.53147 CN(C)CC1=CN(C2=C1C=CC=C2)C MCULE-1488429538 [0,1,0,0,1,0|0,0,0]=2 497 B17R2.4 CCC(=O)NCCC1=CNC2=C1C=CC=C2 MCULE-9497470499 [0,1,0,0,0,1|2,0,0]=4 498 B17R2.4 CNC(=S)NCCC1=CNC2=C1C=CC=C2 MCULE-4645011852 [0,1,0,0,0,1|2,0,0]=4 499 B17R2.4 COC(=O)CCCC1=CNC2=C1C=CC=C2 MCULE-3786832869 [0,1,0,0,0,1|2,0,0]=4 500 B17R2.4 COC(=O)NCCC1=CNC2=C1C=CC=C2 MCULE-5458659698 [0,1,0,0,0,1|2,0,0]=4 501 B17R2.4 NCC(=O)NCCC1=CNC2=C1C=CC=C2 MCULE-1113251537 [0,1,0,0,0,1|2,0,0]=4 502 B17R2.4 NCC(=O)NCCC1=CNC2=C1C=CC=C2 MCULE-4950900726 [0,1,0,0,0,1|2,0,0]=4 503 B17R2.4 O=C(CCl)NCCC1=CNC2=C1C=CC=C2 MCULE-6387956078 [0,1,0,0,0,1|2,0,0]=4 504 B17R2.16 CC(C)C(=O)NCC1=CNC2=CC=CC=C12 MCULE-1913610311 [0,1,0,0,0,1|1,0,1]=4 505 B17R2.16 CC(C)N(C)CCC1=CNC2=CC=CC=C12 MCULE-1200318789 [0,1,0,0,0,1|1,0,0]=3 506 B17R2.39 CC(=O)NC(C)CC1=CNC2=C1C=CC=C2 MCULE-3550791751 [0,1,0,0,0,1|2,0,0]=4 507 B17R2.877 CC(=O)NCC(O)C1=CNC2=C1C=CC=C2 MCULE-6719748377 [0,1,0,0,0,1|2,0,0]=4 508 B17R2.877 CC(C)CC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-6239858203 [0,1,0,0,0,1|1,0,0]=3 509 B17R2.877 CC(C)CC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-8708442943 [0,1,0,0,0,1|1,0,0]=3 510 B17R2.877 CC(C)CC[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-2931534858 [0,1,0,0,0,1|2,0,0]=4 511 B17R2.877 CC(C)CC[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-8691592508 [0,1,0,0,0,1|2,0,0]=4 512 B17R2.877 CC(C)CC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-6429518375 [0,1,0,0,0,1|1,0,0]=3 513 B17R2.877 CC(C)CC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-6837423949 [0,1,0,0,0,1|1,0,0]=3 514 B17R2.877 CC(C)CC[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-8414309834 [0,1,0,0,0,1|2,0,0]=4 515 B17R2.877 CC(C)CC[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-8921432313 [0,1,0,0,0,1|2,0,0]=4 516 B17R2.877 CN(C)/C=C/C(=O)C1=CNC2=C1C=CC=C2 MCULE-8322684871 [0,1,0,0,0,1|0,0,2]=4 517 B17R2.877 CN(C)C=CC(=O)C1=CNC2=C1C=CC=C2 MCULE-4445316119 [0,1,0,0,0,1|0,0,2]=4 518 B17R2.877 CN(C)CCC(=O)C1=CSC2=CC=CC=C12 MCULE-1230944816 [0,1,0,0,0,1|1,0,0]=3 519 B17R2.877 CN(C)CCC(=O)C1=CSC2=CC=CC=C12 MCULE-5309867203 [0,1,0,0,0,1|1,0,0]=3 520 B17R2.3451 CN(C)CCCN1C=NC2=CC(=CC=C12)N MCULE-2729232085 [0,1,0,0,0,1|1,0,1]=4 521 B17R2.3451 CN(C)CCCN1C=NC2=CC(=CC=C12)N MCULE-7540725741 [0,1,0,0,0,1|1,0,1]=4 522 B17R2.5025 CC(=O)NCCC1=C(NC2=C1C=CC=C2)Br MCULE-2178569993 [0,1,0,0,0,1|2,0,0]=4 523 B17R2.5025 CC(=O)NCCC1=C(NC2=CC=CC=C12)C MCULE-1737840553 [0,1,0,0,0,1|2,0,0]=4 524 B17R2.5025 CN(C)CCCN1C(=NC2=C1C=CC=C2)N MCULE-1971707144 [0,1,0,0,0,1|1,0,1]=4 525 B17R2.25462 CC(=O)NCCC1=CNC2=C1C=C(C=C2)C MCULE-7874779669 [0,1,0,0,0,1|2,0,0]=4 526 B17R2.25462 CC(=O)NCCC1=CNC2=C1C=C(C=C2)F MCULE-9702651152 [0,1,0,0,0,1|2,0,0]=4 527 B17R2.25462 CC(=O)NCCC1=CNC2=C1C=C(C=C2)N MCULE-6046660193 [0,1,0,0,0,1|2,0,0]=4 528 B17R2.25462 CC(=O)NCCC1=CNC2=C1C=C(C=C2)O MCULE-4114943625 [0,1,0,0,0,1|2,0,0]=4 529 B17R2.25462 CC(=O)NCCC1=CNC2=CC=C(C=C12)Cl MCULE-8524378306 [0,1,0,0,0,1|2,0,0]=4 530 B17R2.18967 CC(C)C[C@@H](N)C1=CC2=C(C=CC=C2)C=C1 MCULE-5314594869 [0,1,0,0,0,1|2,0,0]=4 531 B17R2.18967 CC(C)C[C@@H](N)C1=CC2=C(C=CC=C2)C=C1 MCULE-8736502176 [0,1,0,0,0,1|2,0,0]=4 532 B17R2.18967 CC(C)C[C@@H](N)C1=NC2=C(C=CC=C2)C=C1 MCULE-9496115776 [0,1,0,0,0,1|2,0,0]=4 533 B17R2.18967 CC(C)C[C@@H](N)C1=NC2=C(C=CC=C2)C=C1 MCULE-9735753195 [0,1,0,0,0,1|2,0,0]=4 534 B17R2.18967 CC(C)C[C@H](N)C1=CC2=C(C=CC=C2)C=C1 MCULE-5188509318 [0,1,0,0,0,1|2,0,0]=4 535 B17R2.18967 CC(C)C[C@H](N)C1=CC2=C(C=CC=C2)C=C1 MCULE-8614943649 [0,1,0,0,0,1|2,0,0]=4 536 B17R2.18967 CC(C)C[C@H](N)C1=NC2=C(C=CC=C2)C=C1 MCULE-3336313297 [0,1,0,0,0,1|2,0,0]=4 537 B17R2.18967 CC(C)C[C@H](N)C1=NC2=C(C=CC=C2)C=C1 MCULE-3767841591 [0,1,0,0,0,1|2,0,0]=4 538 B17R2.155580 CN(C)CCN1C=NC2=CC=CC=C2C1=O MCULE-5304819976 [0,1,0,0,0,1|1,0,1]=4 539 B17R2.155580 CN(C)CCN1C=NC2=CC=CC=C2C1=O MCULE-8158551045 [0,1,0,0,0,1|1,0,1]=4 540 B17R2.249732 CN(C)CCN1C(=O)N=C2C1=CC=CC=C2 MCULE-5225602729 [0,1,0,0,0,1|1,0,1]=4 541 B17R2.712041 CC(C)CC(N)C1=C2C=CC=CC2=CC=C1 MCULE-3248776920 [0,1,0,0,0,1|2,0,0]=4 542 B17R2.712041 CC(C)CC(N)C1=C2C=CC=CC2=CC=C1 MCULE-3962729324 [0,1,0,0,0,1|2,0,0]=4 543 B17R2.712041 CC(C)C[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-6302314835 [0,1,0,0,0,1|2,0,0]=4 544 B17R2.712041 CC(C)C[C@@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-6878997732 [0,1,0,0,0,1|2,0,0]=4 545 B17R2.712041 CC(C)C[C@@H](N)C1=CC=NC2=C1C=CC=C2 MCULE-7748453290 [0,1,0,0,0,1|1,0,1]=4 546 B17R2.712041 CC(C)C[C@@H](N)C1=CC=NC2=C1C=CC=C2 MCULE-8403441583 [0,1,0,0,0,1|1,0,1]=4 547 B17R2.712041 CC(C)C[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-6728859729 [0,1,0,0,0,1|2,0,0]=4 548 B17R2.712041 CC(C)C[C@H](N)C1=CC=CC2=C1C=CC=C2 MCULE-7081790929 [0,1,0,0,0,1|2,0,0]=4 549 B17R2.712041 CC(C)C[C@H](N)C1=CC=NC2=C1C=CC=C2 MCULE-7492891229 [0,1,0,0,0,1|1,0,1]=4 550 B17R2.712041 CC(C)C[C@H](N)C1=CC=NC2=C1C=CC=C2 MCULE-9864212186 [0,1,0,0,0,1|1,0,1]=4 551 B17R2.7 CNC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-4418170102 [0,2,0,0,0,0|2,0,0]=4 552 B17R2.7 CNC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-8806874695 [0,2,0,0,0,0|2,0,0]=4 553 B17R2.7 CNC(=O)[C@H](N)CC1=CNC2=CC=CC=C12 MCULE-2035601601 [0,2,0,0,0,0|2,0,0]=4 554 B17R2.7 CNC(=O)[C@H](N)CC1=CNC2=CC=CC=C12 MCULE-6400798643 [0,2,0,0,0,0|2,0,0]=4 555 B17R2.7 COC(=O)C(C)CC1=CNC2=CC=CC=C12 MCULE-1180328243 [0,2,0,0,0,0|2,0,0]=4 556 B17R2.7 COC(=O)C(C)CC1=CNC2=CC=CC=C12 MCULE-7472928093 [0,2,0,0,0,0|2,0,0]=4 557 B17R2.7 COC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-1375533696 [0,2,0,0,0,0|2,0,0]=4 558 B17R2.7 COC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-4257766936 [0,2,0,0,0,0|2,0,0]=4 559 B17R2.7 COC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-6127245906 [0,2,0,0,0,0|2,0,0]=4 560 B17R2.7 COC(=O)C(N)CC1=CNC2=C1C=CC=C2 MCULE-6598811236 [0,2,0,0,0,0|2,0,0]=4 561 B17R2.7 COC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-3606983263 [0,2,0,0,0,0|2,0,0]=4 562 B17R2.7 COC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-4257219539 [0,2,0,0,0,0|2,0,0]=4 563 B17R2.7 COC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-5014804775 [0,2,0,0,0,0|2,0,0]=4 564 B17R2.7 COC(=O)[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-9077719590 [0,2,0,0,0,0|2,0,0]=4 565 B17R2.7 COC(=O)[C@H](N)CC1=CNC2=C1C=CC=C2 MCULE-7078756778 [0,2,0,0,0,0|2,0,0]=4 566 B17R2.7 COC(=O)[C@H](N)CC1=CNC2=C1C=CC=C2 MCULE-8527952510 [0,2,0,0,0,0|2,0,0]=4 567 B17R2.7 COC(=O)[C@H](N)CC1=CNC2=CC=CC=C12 MCULE-7129192240 [0,2,0,0,0,0|2,0,0]=4 568 B17R2.7 COC(=O)[C@H](N)CC1=CNC2=CC=CC=C12 MCULE-9568756958 [0,2,0,0,0,0|2,0,0]=4 569 B17R2.7 CON(C)C(=O)CC1=CNC2=C1C=CC=C2 MCULE-7348654049 [0,2,0,0,0,0|0,0,1]=3 570 B17R2.3450 CC1=CC=C2C(=COC2=C1)CC(=O)N(C)C MCULE-8873091792 [0,2,0,0,0,0|1,0,1]=4 571 B17R2.5003 CN(C)C(=O)CC1=C(SC2=C1C=CC=C2)Cl MCULE-5480459775 [0,2,0,0,0,0|1,0,1]=4 572 B17R2.45515 CN(C)C(=O)C(=O)C1=CNC2=C1C=CC=C2 MCULE-7038551289 [0,2,0,0,0,0|0,0,2]=4 573 B17R2.6 C=CCN(C)CCC1=CNC2=C1C=CC=C2 MCULE-1577359209 [0,2,0,0,0,0|0,0,0]=2 574 B17R2.6 CCOC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-4502243780 [0,2,0,0,0,0|2,0,0]=4 575 B17R2.41 CCC(CC)NCC1=CNC2=C1C=CC=C2 MCULE-8615423894 [0,2,0,0,0,0|2,0,0]=4 576 B17R2.41 CCN(CC)CCC1=CNC2=CC=CC=C12 MCULE-7553399168 [0,2,0,0,0,0|0,0,0]=2 577 B17R2.41 CCN(CC)CCN1C=NC2=C1C=CC=C2 MCULE-2439417036 [0,2,0,0,0,0|1,0,1]=4 578 B17R2.693 COC(=O)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-6740249331 [0,2,0,0,0,0|2,0,0]=4 579 B17R2.693 COC(=O)C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-7937462863 [0,2,0,0,0,0|2,0,0]=4 580 B17R2.693 COC(=O)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-1271839301 [0,2,0,0,0,0|2,0,0]=4 581 B17R2.693 COC(=O)C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-4131734409 [0,2,0,0,0,0|2,0,0]=4 582 B17R2.2442 COC(=O)CCC1=CNC2=C1C=CC=C2Br MCULE-1903673605 [0,2,0,0,0,0|2,0,0]=4 583 B17R2.2442 COC(=O)CCC1=CNC2=C1C=CC=C2C MCULE-9689078793 [0,2,0,0,0,0|2,0,0]=4 584 B17R2.2442 COC(=O)CCC1=CNC2=C1C=CC=C2F MCULE-5228162624 [0,2,0,0,0,0|2,0,0]=4 585 B17R2.57589 COC(=O)CCC1=CNC2=C1C=CC(=C2)Br MCULE-3166218761 [0,2,0,0,0,0|2,0,0]=4 586 B17R2.57589 COC(=O)CCC1=CNC2=C1C=CC(=C2)C MCULE-1008280957 [0,2,0,0,0,0|2,0,0]=4 587 B17R2.57589 COC(=O)CCC1=CNC2=C1C=CC(=C2)Cl MCULE-7262880194 [0,2,0,0,0,0|2,0,0]=4 588 B17R2.57589 COC(=O)CCC1=CNC2=C1C=CC(=C2)F MCULE-5893327248 [0,2,0,0,0,0|2,0,0]=4 589 B17R2.87547 COC(=O)CCC1=CN(C2=C1C=CC=C2)C MCULE-8101326870 [0,2,0,0,0,0|2,0,0]=4 590 B17R2.376007 COC(=O)CCC1=CNC2=C1C=C(C=C2)Br MCULE-1962792611 [0,2,0,0,0,0|2,0,0]=4 591 B17R2.376007 COC(=O)CCC1=CNC2=C1C=C(C=C2)Cl MCULE-8328181453 [0,2,0,0,0,0|2,0,0]=4 592 B17R2.376007 COC(=O)CCC1=CNC2=C1C=C(C=C2)F MCULE-6542444313 [0,2,0,0,0,0|2,0,0]=4 593 B17R2.376007 COC(=O)CCC1=CNC2=C1C=C(C=C2)I MCULE-2361592011 [0,2,0,0,0,0|2,0,0]=4 594 B17R2.376041 COC(=O)CCC1=CNC2=C1C(=CC=C2)Br MCULE-2973034884 [0,2,0,0,0,0|2,0,0]=4 595 B17R2.376041 COC(=O)CCC1=CNC2=C1C(=CC=C2)C MCULE-9011186884 [0,2,0,0,0,0|2,0,0]=4 596 B17R2.376041 COC(=O)CCC1=CNC2=C1C(=CC=C2)Cl MCULE-4277614267 [0,2,0,0,0,0|2,0,0]=4 597 B17R2.376041 COC(=O)CCC1=CNC2=C1C(=CC=C2)F MCULE-9162803561 [0,2,0,0,0,0|2,0,0]=4 598 B17R2.144 CC(C)CC(=NO)C1=CNC2=C1C=CC=C2 MCULE-3412658998 [0,2,0,0,0,0|1,0,1]=4 599 B17R2.144 CN(C)C=C(C#N)C1=CNC2=CC=CC=C12 MCULE-7786515389 [0,2,0,0,0,0|0,0,2]=4 600 B17R2.853 CC(=O)CC(C)(C)C1=CNC2=C1C=CC=C2 MCULE-5145991109 [0,2,0,0,0,0|2,0,0]=4 601 B17R2.5002 C=C(C)C[C@@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-3375482528 [0,2,0,0,0,0|1,0,1]=4 602 B17R2.5002 C=C(C)C[C@@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-5708994700 [0,2,0,0,0,0|1,0,1]=4 603 B17R2.5002 C=C(C)C[C@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-4744231382 [0,2,0,0,0,0|1,0,1]=4 604 B17R2.5002 C=C(C)C[C@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-6445225495 [0,2,0,0,0,0|1,0,1]=4 605 B17R2.5002 CC1=C(C2=C(N1)C=CC=C2)C(=O)CN(C)C MCULE-2639464610 [0,2,0,0,0,0|0,0,1]=3 606 B17R2.5002 CC1=C(C2=C(N1)C=CC=C2)[C@@H](N)CC(C)C MCULE-6542644161 [0,2,0,0,0,0|1,0,0]=3 607 B17R2.5002 CC1=C(C2=C(N1)C=CC=C2)[C@@H](N)CC(C)C MCULE-6703335072 [0,2,0,0,0,0|1,0,0]=3 608 B17R2.5002 CC1=C(C2=C(N1)C=CC=C2)[C@H](N)CC(C)C MCULE-3790136625 [0,2,0,0,0,0|1,0,0]=3 609 B17R2.5002 CC1=C(C2=C(N1)C=CC=C2)[C@H](N)CC(C)C MCULE-9499475016 [0,2,0,0,0,0|1,0,0]=3 610 B17R2.5002 CC1=C(C2=CC=CC=C2N1)C(=O)CC(C)C MCULE-3782703989 [0,2,0,0,0,0|1,0,1]=4 611 B17R2.25460 C=C(C)C[C@@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-3261320871 [0,2,0,0,0,0|1,0,1]=4 612 B17R2.25460 C=C(C)C[C@@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-5225706889 [0,2,0,0,0,0|1,0,1]=4 613 B17R2.25460 C=C(C)C[C@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-3966043224 [0,2,0,0,0,0|1,0,1]=4 614 B17R2.25460 C=C(C)C[C@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-8468088945 [0,2,0,0,0,0|1,0,1]=4 615 B17R2.25460 CC(C)C[C@@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-3810626894 [0,2,0,0,0,0|1,0,0]=3 616 B17R2.25460 CC(C)C[C@@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-5581693765 [0,2,0,0,0,0|1,0,0]=3 617 B17R2.25460 CC(C)C[C@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-3545743509 [0,2,0,0,0,0|1,0,0]=3 618 B17R2.25460 CC(C)C[C@H](N)C1=CNC2=C1C=C(C=C2)Br MCULE-8673573564 [0,2,0,0,0,0|1,0,0]=3 619 B17R2.78535 C=C(C)C[C@@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-7748755350 [0,2,0,0,0,0|1,0,1]=4 620 B17R2.78535 C=C(C)C[C@@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-8567705988 [0,2,0,0,0,0|1,0,1]=4 621 B17R2.78535 C=C(C)C[C@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-2416161447 [0,2,0,0,0,0|1,0,1]=4 622 B17R2.78535 C=C(C)C[C@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-9166313882 [0,2,0,0,0,0|1,0,1]=4 623 B17R2.78535 CC(C)CC(=O)C1=CN(C2=C1C=CC=C2)C MCULE-2420690085 [0,2,0,0,0,0|1,0,1]=4 624 B17R2.78535 CC(C)C[C@@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-7261088334 [0,2,0,0,0,0|1,0,0]=3 625 B17R2.78535 CC(C)C[C@@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-9770022285 [0,2,0,0,0,0|1,0,0]=3 626 B17R2.78535 CC(C)C[C@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-5988888158 [0,2,0,0,0,0|1,0,0]=3 627 B17R2.78535 CC(C)C[C@H](N)C1=CN(C2=C1C=CC=C2)C MCULE-7216065764 [0,2,0,0,0,0|1,0,0]=3 628 B17R2.188266 C[N+](C)(C)CCC1=CNC2=CC=C(C=C12)[O-] MCULE-5838327819 [0,2,0,0,0,0|0,0,1]=3 629 B17R2.2764 COC1=CC=C2C(=CNC2=C1)CCN(C)C MCULE-4327237078 [0,2,0,0,0,0|0,0,0]=2 630 B17R2.1273 CN(C)C=NC1=C(NC2=C1C=CC=C2)C=O MCULE-8722270273 [0,2,0,0,0,0|1,0,1]=4 631 B17R2.1273 CN(C)CCN1C(=CC2=C1C=CC=C2)C#N MCULE-4763675965 [0,2,0,0,0,0|2,0,0]=4 632 B17R2.1273 CN(C)CCN1C(=CC2=C1C=CC=C2)C#N MCULE-9896256617 [0,2,0,0,0,0|2,0,0]=4 633 B17R2.150937 CC1=C(C2=C(N1)C=CC(=C2)Cl)CCN(C)C MCULE-6045221315 [0,2,0,0,0,0|0,0,0]=2 634 B17R2.150937 CC1=C(C2=C(N1)C=CC(=C2)Cl)CCN(C)C MCULE-7074886803 [0,2,0,0,0,0|0,0,0]=2 635 B17R2.150937 CN(C)CCN1C(=O)OC2=C1C=C(C=C2)N MCULE-6712174849 [0,2,0,0,0,0|2,0,0]=4 636 B17R2.150937 CN(C)CCN1C(=O)OC2=CC=C(C=C12)Br MCULE-8336236233 [0,2,0,0,0,0|2,0,0]=4 637 B17R2.464799 CN(C)CCN1C(=O)C(=O)C2=C1C=CC=C2 MCULE-4724778349 [0,2,0,0,0,0|2,0,0]=4 638 B17R2.464799 CN(C)CCN1C(=O)C(=O)C2=C1C=CC=C2 MCULE-8725507061 [0,2,0,0,0,0|2,0,0]=4 639 B17R2.464799 CN(C)NC=C1C(=O)N(C2=C1C=CC=C2)C MCULE-8903580318 [0,2,0,0,0,0|1,0,1]=4 640 B17R2.73242 COC1=CC2=C(C=C1)NC=C2CCN(C)C MCULE-1161800007 [0,2,0,0,0,0|0,0,0]=2 641 B17R2.37564 CN(C)CCC1=CN(C2=C1C(=CC=C2)O)C MCULE-5100506447 [0,2,0,0,0,0|0,0,0]=2 642 B17R2.63388 COC1=CC=CC2=C1C(=CN2)CCN(C)C MCULE-9780270462 [0,2,0,0,0,0|0,0,0]=2 643 B17R2.140478 CCN1C=C(C2=C1C=CC=C2)CNC(C)C MCULE-1549138705 [0,2,0,0,0,0|2,0,0]=4 644 B17R2.140478 CCN1C=C(C2=C1C=CC=C2)CNC(C)C MCULE-2376165567 [0,2,0,0,0,0|2,0,0]=4 645 B17R2.140478 CN(C)CCN1C=C(C2=CC=CC=C12)C=O MCULE-6620997706 [0,2,0,0,0,0|2,0,0]=4 646 B15R2.1245 CN(C)C1CCC2=C(C=CC=C2)NC1 MCULE-2492454891 [0,0,1,1,0,0|0,0,2]=4 647 B15R2.1668 CN(C)CC1CNC2=C(O1)C=CC=C2 MCULE-4366358839 [0,0,1,1,0,0|1,0,1]=4 648 B15R2.308 CC1=CC=CC=C1C2=CCC(CC2)C MCULE-6467799612 [0,0,1,1,0,0|2,0,0]=4 649 B15R2.308 CN1CC=C(CC1)C2=CC=CC=C2Cl MCULE-7572832572 [0,0,1,1,0,0|1,0,0]=3 650 B15R2.308 CN1CCN(CC1)C2=C(C=CC=C2)N MCULE-6697091827 [0,0,1,1,0,0|1,0,1]=4 651 B15R2.68122 CN(C)CC1=CC=CC2=CC=CC=C12 MCULE-9350001826 [0,0,1,1,0,0|1,0,1]=4 652 B15R2.68122 CN(C)CC1=CC=NC2=C1C=CC=C2 MCULE-2159534408 [0,0,1,1,0,0|0,0,2]=4 653 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)C=NCC3 MCULE-6354656291 [1,0,0,1,0,0|0,0,2]=4 654 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CCCC3 MCULE-3200900424 [1,0,0,1,0,0|1,0,0]=3 655 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CCNC3 MCULE-8381914634 [1,0,0,1,0,0|2,0,0]=4 656 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CNCC3 MCULE-4828650242 [1,0,0,1,0,0|0,0,0]=2 657 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CNCC3 MCULE-6905321940 [1,0,0,1,0,0|0,0,0]=2 658 B15R3.3 C1=CC2=C(C=C1)N3CCNCC3=C2 MCULE-3078447775 [1,0,0,1,0,0|2,0,0]=4 659 B15R3.3 C1=CC2=C(C=C1)N3CCNCC3=C2 MCULE-5044267728 [1,0,0,1,0,0|2,0,0]=4 660 B15R3.3 C1=CC2=C(C=C1)N3CCNCC3=N2 MCULE-4319801830 [1,0,0,1,0,0|1,0,1]=4 661 B15R3.3 C1=CC2=C(N=C1)C3=C(N2)CCCC3 MCULE-2436551783 [1,0,0,1,0,0|2,0,0]=4 662 B15R3.3 C1=CC2=C(N=C1)NC3=C2CCCC3 MCULE-4747769341 [1,0,0,1,0,0|2,0,0]=4 663 B15R3.3 C1=CC=C2C(=C1)C=C3N2CCNC3 MCULE-9045893120 [1,0,0,1,0,0|2,0,0]=4 664 B15R3.3 C1=CC=C2C(=C1)CC3=C2CCCC3 MCULE-7831803792 [1,0,0,1,0,0|2,0,0]=4 665 B15R3.3 C1=CC=C2C(=C1)NC3=C2CNCC3 MCULE-4930882559 [1,0,0,1,0,0|2,0,0]=4 666 B15R3.3 C1=CC=C2C(=C1)NC3=C2CSCC3 MCULE-7167351202 [1,0,0,1,0,0|2,0,0]=4 667 B15R3.3 C1=CC=C2C(=C1)NC3C2CCNC3 MCULE-2741135452 [1,0,0,1,0,0|0,0,2]=4 668 B15R3.3 C1=CC=C2C(=C1)OC3=C2CCNC3 MCULE-1229221862 [1,0,0,1,0,0|1,0,0]=3 669 B15R3.3 C1=CC=C2C(=C1)OC3=C2CCNC3 MCULE-2801127557 [1,0,0,1,0,0|1,0,0]=3 670 B15R3.3 C1=CN=C2NC3=C(C2=C1)CCNC3 MCULE-1362231090 [1,0,0,1,0,0|1,0,0]=3 671 B15R3.3 C1=CN=C2NC3=C(C2=C1)CCNC3 MCULE-2558946277 [1,0,0,1,0,0|1,0,0]=3 672 B15R3.1736 C1=CC2=C(C=C1)C(=CN2)C3CNC3 MCULE-7321182053 [1,0,0,1,0,0|0,0,0]=2 673 B15R3.1736 C1=CC2=C(C=C1)C(=CN2)C3CNC3 MCULE-7379467677 [1,0,0,1,0,0|0,0,0]=2 674 B15R3.1736 C1=CC2=C(C=C1)N(C=N2)C3CNC3 MCULE-2349045516 [1,0,0,1,0,0|1,0,1]=4 675 B15R3.1736 C1=CC2=C(C=C1)N(C=N2)C3CNC3 MCULE-4017742846 [1,0,0,1,0,0|1,0,1]=4 676 B15R3.1736 C1=CC=C2C(=C1)NC=C2[C@@H]3CCN3 MCULE-3618592433 [1,0,0,1,0,0|2,0,0]=4 677 B15R3.1736 C1=CC=C2C(=C1)NC=C2[C@@H]3CCN3 MCULE-4132878112 [1,0,0,1,0,0|2,0,0]=4 678 B15R3.1736 C1=CC=C2C(=C1)NC=C2[C@H]3CCN3 MCULE-3125843188 [1,0,0,1,0,0|2,0,0]=4 679 B15R3.1736 C1=CC=C2C(=C1)NC=C2[C@H]3CCN3 MCULE-5348642925 [1,0,0,1,0,0|2,0,0]=4 680 B15R3.1736 C1=CC=C2C(=C1)NN=C2C3CCC3 MCULE-6508405162 [1,0,0,1,0,0|2,0,0]=4 681 B15R3.1736 C1=CN=C2NN=C(C2=C1)C3CNC3 MCULE-3526969453 [1,0,0,1,0,0|2,0,0]=4 682 B15R3.1736 C1=CN=C2NN=C(C2=C1)C3CNC3 MCULE-4638348523 [1,0,0,1,0,0|2,0,0]=4 683 B15R3.1738 C1=CC2=C(C=C1)C3(CCNC3)CN2 MCULE-1162706939 [1,0,0,1,0,0|0,0,2]=4 684 B15R3.1738 C1=CC2=C(C=C1)C3(CCNC3)CN2 MCULE-9110303447 [1,0,0,1,0,0|0,0,2]=4 685 B15R3.2249 O=C1CCC2=C1NC3=C2C=CC=C3 MCULE-4237567663 [1,0,0,1,0,0|2,0,0]=4 686 B15R3.3513 C1=CC2=C3C(=C1)CNCCN3C=C2 MCULE-1631493742 [1,0,0,1,0,0|2,0,0]=4 687 B15R3.2009 NC1CC2=C(C1)C3=C(N2)C=CC=C3 MCULE-3220302711 [0,0,0,1,1,0|2,0,0]=4 688 B15R3.2009 O=C1CC2=C(C1)C3=C(N2)C=CC=C3 MCULE-4808786300 [0,0,0,1,1,0|2,0,0]=4 689 B15R3.14764 NC1CC2=CNC3=CC=CC(=C23)C1 MCULE-2932698296 [0,0,0,1,1,0|2,0,0]=4 690 B17R3.26 CN1CCC(C1)C2=NNC3=NC=CC=C23 MCULE-9113849611 [0,0,0,1,0,1|2,0,0]=4 691 B17R3.26 O=C1CC(CN1)C2=CNC3=C2C=CC=C3 MCULE-8314344011 [0,0,0,1,0,1|2,0,0]=4 692 B17R3.18998 CN1COC2=C(C1)C3=CC=CC=C3C=C2 MCULE-6718681004 [0,0,0,1,0,1|2,0,0]=4 693 B17R3.477140 CN(C)C1CC2=CNC3=CC=CC(=C23)C1 MCULE-2990275156 [0,1,0,1,0,0|0,0,0]=2 694 B17R3.1577 CCN1CCN2C(=NC3=C2C=CC=C3)C1 MCULE-5221048509 [0,1,0,1,0,0|1,0,1]=4 695 B17R3.1577 O/N=C\1/CCC2=C(C1)NC3=C2C=CC=C3 MCULE-7541399736 [0,1,0,1,0,0|2,0,0]=4 696 B17R3.1577 ON=C1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-2112787079 [0,1,0,1,0,0|2,0,0]=4 697 B17R3.3210 CN1CCC2=C(CC1)C3=CC=CC=C3N2 MCULE-3016982666 [0,1,0,1,0,0|0,0,0]=2 698 B17R3.4804 CN1CCC2(CC1)CNC3=CC=CC=C23 MCULE-1136114112 [0,1,0,1,0,0|0,0,2]=4 699 B17R3.31811 CN1CCC2=C(C1=O)NC3=CC=CC=C23 MCULE-9691326573 [0,1,0,1,0,0|0,0,1]=3 700 B17R3.9637 N[C@@H](CC1CC1)C2=CNC3=CC=CC=C23 MCULE-8822342970 [0,1,0,1,0,0|1,0,0]=3 701 B17R3.9637 N[C@@H](CC1CC1)C2=CNC3=CC=CC=C23 MCULE-9287634481 [0,1,0,1,0,0|1,0,0]=3 702 B17R3.9637 N[C@@H](CC1CC1)C2=CSC3=C2C=CC=C3 MCULE-2042841662 [0,1,0,1,0,0|2,0,0]=4 703 B17R3.9637 N[C@@H](CC1CC1)C2=CSC3=C2C=CC=C3 MCULE-4280747623 [0,1,0,1,0,0|2,0,0]=4 704 B17R3.9637 N[C@H](CC1CC1)C2=CNC3=CC=CC=C23 MCULE-1110996089 [0,1,0,1,0,0|1,0,0]=3 705 B17R3.9637 N[C@H](CC1CC1)C2=CNC3=CC=CC=C23 MCULE-8914826006 [0,1,0,1,0,0|1,0,0]=3 706 B17R3.9637 N[C@H](CC1CC1)C2=CSC3=C2C=CC=C3 MCULE-4728281155 [0,1,0,1,0,0|2,0,0]=4 707 B17R3.9637 N[C@H](CC1CC1)C2=CSC3=C2C=CC=C3 MCULE-8195273338 [0,1,0,1,0,0|2,0,0]=4 708 B17R3.9637 O=C(CN1CC1)C2=CNC3=C2C=CC=C3 MCULE-8744468390 [0,1,0,1,0,0|0,0,1]=3 709 B17R3.34323 CC1CC(=O)C2=C(C1)NC3=C2C=CC=C3 MCULE-7929521818 [0,1,0,1,0,0|1,0,1]=4 710 B17R3.30284 CN1CCC2=C(C1)NC3=C2C=CC(=C3)F MCULE-9608301732 [0,1,0,1,0,0|0,0,0]=2 711 B17R3.30284 CN1CCN2C(=NC3=C2C=CC(=C3)N)C1 MCULE-3128523794 [0,1,0,1,0,0|1,0,1]=4 712 B17R3.30284 CN1CCN2C3=CC=C(C=C3N=C2C1)N MCULE-4269293858 [0,1,0,1,0,0|1,0,1]=4 713 B17R3.4667 CC1=C(C2=C(N1)C=CC=C2)CNC3CC3 MCULE-6647941887 [0,1,0,1,0,0|2,0,0]=4 714 B17R3.4667 CC1=C(C2=C(N1)C=CC=C2)CNC3CC3 MCULE-7573424254 [0,1,0,1,0,0|2,0,0]=4 715 B17R3.19747 CC1=CC2=C(C=C1)NC3=C2CCC(C3)N MCULE-3152013269 [0,1,0,1,0,0|2,0,0]=4 716 B17R3.19747 CC1=CC2=C(C=C1)NC3=C2CCN(C3)C MCULE-8945861219 [0,1,0,1,0,0|0,0,0]=2 717 B17R3.19747 NC1CCC2=C(C1)NC3=C2C=C(C=C3)F MCULE-3447275997 [0,1,0,1,0,0|2,0,0]=4 718 B17R3.19747 O=C1CCC2=C(C1)NC3=C2C=C(C=C3)F MCULE-7410192469 [0,1,0,1,0,0|2,0,0]=4 719 B17R3.19746 CN1CCN2C(=NC3=C2C(=CC=C3)Cl)C1 MCULE-5946393458 [0,1,0,1,0,0|1,0,1]=4 720 B17R3.19746 CN1CCN2C(=NC3=CC=CC(=C23)Cl)C1 MCULE-7888792762 [0,1,0,1,0,0|1,0,1]=4 721 B17R3.59758 CN1CC(C1)C2=NN(C3=NC=CC=C23)C MCULE-8310551872 [0,1,0,1,0,0|2,0,0]=4 722 B17R3.102390 CN1C=C(C2=C1C=CC=C2)CNC3CC3 MCULE-4636219318 [0,1,0,1,0,0|2,0,0]=4 723 B13R1.337 CC(C)NCC=CC1=CC=CC=C1 MCULE-3715121814 [0,0,1,0,1,0|2,0,0]=4 724 B13R1.337 CC(C)NCC=CC1=CC=CC=C1 MCULE-8181895099 [0,0,1,0,1,0|2,0,0]=4 725 B13R1.337 CN(C)CCNCC1=CC=CC=C1 MCULE-4110797432 [0,0,1,0,1,0|1,0,1]=4 726 B13R1.337 CN(C)CCNCC1=CC=CC=C1 MCULE-4280889991 [0,0,1,0,1,0|1,0,1]=4 727 B13R1.337 CN(C)CCOCC1=CC=CC=C1 MCULE-1001882833 [0,0,1,0,1,0|1,0,1]=4 728 B13R1.337 CN(C)CCOCC1=CC=CC=C1 MCULE-4113994773 [0,0,1,0,1,0|1,0,1]=4 729 B13R1.713 CN(C)/C=C(/C=O)\C1=CC=CC=C1 MCULE-9736489676 [0,0,1,0,1,0|1,0,1]=4 730 B13R1.713 CN(C)C=C(C=O)C1=CC=CC=C1 MCULE-9227191445 [0,0,1,0,1,0|1,0,1]=4 731 B13R1.713 CN(C)CC(CN)C1=CC=CC=C1 MCULE-6039427858 [0,0,1,0,1,0|0,0,2]=4 732 B13R2.72 CC(=O)C1=CNC2=CC=CC=C12 MCULE-5994992193 [0,0,0,0,2,0|2,0,0]=4 733 B13R2.72 CC(Br)C1=CNC2=CC=CC=C12 MCULE-1227110359 [0,0,0,0,2,0|2,0,0]=4 734 B13R2.72 CC(C)C1=CNC2=C1C=CC=C2 MCULE-9596446013 [0,0,0,0,2,0|1,0,0]=3 735 B13R2.72 CC(C)C1=NNC2=CC=CC=C12 MCULE-8917157375 [0,0,0,0,2,0|2,0,0]=4 736 B13R2.72 CC(N)C1=CNC2=CC=CC=C12 MCULE-1459797926 [0,0,0,0,2,0|2,0,0]=4 737 B13R2.72 CC(N)C1=CNC2=CC=CC=C12 MCULE-5345457509 [0,0,0,0,2,0|2,0,0]=4 738 B13R2.72 CN(C)C1=CN=C2N1C=CC=C2 MCULE-2848423821 [0,0,0,0,2,0|1,0,1]=4 739 B13R2.72 CN(C)C1=CN=C2N1C=CC=C2 MCULE-9232784355 [0,0,0,0,2,0|1,0,1]=4 740 B13R2.72 CS(=O)C1=CNC2=C1C=CC=C2 MCULE-5973421190 [0,0,0,0,2,0|2,0,0]=4 741 B13R2.72 C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-3508718350 [0,0,0,0,2,0|2,0,0]=4 742 B13R2.72 C[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-3630046097 [0,0,0,0,2,0|2,0,0]=4 743 B13R2.72 C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-3023778123 [0,0,0,0,2,0|2,0,0]=4 744 B13R2.72 C[C@H](N)C1=CNC2=CC=CC=C12 MCULE-5029928307 [0,0,0,0,2,0|2,0,0]=4 745 B15R1.8019 CC1=C(C=CC=C1)C(=O)OCCN(C)C MCULE-2030135566 [0,0,1,0,0,1|2,0,0]=4 746 B15R1.8019 CC1=C(C=CC=C1)C(=O)OCCN(C)C MCULE-5490898039 [0,0,1,0,0,1|2,0,0]=4 747 B15R1.8019 CC1=CC=CC=C1C(=O)NCCN(C)C MCULE-9086484939 [0,0,1,0,0,1|2,0,0]=4 748 B15R1.8019 CN(C)CCNC(=O)C1=C(C=CC=C1)Br MCULE-4159334431 [0,0,1,0,0,1|2,0,0]=4 749 B15R1.8019 CN(C)CCNC(=O)C1=C(C=CC=C1)Br MCULE-5844076589 [0,0,1,0,0,1|2,0,0]=4 750 B15R1.8019 CN(C)CCNC(=O)C1=C(C=CC=C1)Cl MCULE-8171021904 [0,0,1,0,0,1|2,0,0]=4 751 B15R1.8019 CN(C)CCNC(=O)C1=C(C=CC=C1)F MCULE-1273331163 [0,0,1,0,0,1|2,0,0]=4 752 B15R1.8019 CN(C)CCNC(=O)C1=C(C=CC=C1)N MCULE-8753657137 [0,0,1,0,0,1|1,0,0]=3 753 B15R1.8019 CN(C)CCNC(=O)C1=C(C=CC=C1)O MCULE-4759386440 [0,0,1,0,0,1|2,0,0]=4 754 B15R1.8019 CN(C)CCNC(=O)C1=CC=CC=C1Cl MCULE-6785607862 [0,0,1,0,0,1|2,0,0]=4 755 B15R1.8019 CN(C)CCNC(=O)C1=CC=CC=C1I MCULE-4454126349 [0,0,1,0,0,1|2,0,0]=4 756 B15R1.8019 CN(C)CCNC(=O)C1=CC=CC=C1I MCULE-8536038115 [0,0,1,0,0,1|2,0,0]=4 757 B15R1.8019 CN(C)CCNC(=O)C1=CC=CC=C1O MCULE-7265446480 [0,0,1,0,0,1|2,0,0]=4 758 B15R1.8019 CN(C)CCOC(=O)C1=CC=CC=C1Br MCULE-3383369961 [0,0,1,0,0,1|2,0,0]=4 759 B15R1.8019 CN(C)CCOC(=O)C1=CC=CC=C1Br MCULE-5172103714 [0,0,1,0,0,1|2,0,0]=4 760 B15R1.8019 CN(C)CCOC(=O)C1=CC=CC=C1Cl MCULE-2031043254 [0,0,1,0,0,1|2,0,0]=4 761 B15R1.8019 CN(C)CCOC(=O)C1=CC=CC=C1Cl MCULE-9008329499 [0,0,1,0,0,1|2,0,0]=4 762 B15R1.8019 CN(C)CCOC(=O)C1=CC=CC=C1F MCULE-3032360362 [0,0,1,0,0,1|2,0,0]=4 763 B15R1.8019 CN(C)CCOC(=O)C1=CC=CC=C1F MCULE-7509117140 [0,0,1,0,0,1|2,0,0]=4 764 B15R1.8019 CN(C)CCOC(=O)C1=CC=CC=C1I MCULE-5008318519 [0,0,1,0,0,1|2,0,0]=4 765 B15R1.8019 CN(C)CCOC(=O)C1=CC=CC=C1I MCULE-5228195139 [0,0,1,0,0,1|2,0,0]=4 766 B15R2.352 CCCCC1=CC=C2C=CC=CC2=C1 MCULE-5002783646 [1,0,0,0,0,1|2,0,0]=4 767 B15R2.18471 CCCCC1=C2C=CC=CC2=CC=C1 MCULE-8903925113 [1,0,0,0,0,1|2,0,0]=4 768 B15R2.18471 CNCCC1=C2C=CC=CC2=CC=C1 MCULE-8882281750 [1,0,0,0,0,1|1,0,0]=3 769 B17R2.137 CN(C)CCCOC1=NNC2=CC=CC=C12 MCULE-3074612289 [0,0,0,0,0,2|1,0,0]=3 770 B17R2.5669 CN(C)CCOC1=CC=C2C=CC=CC2=C1 MCULE-2560046184 [0,0,0,0,0,2|1,0,0]=3 771 B17R2.5669 CN(C)CCOC1=CC=C2C=CC=CC2=C1 MCULE-8701769560 [0,0,0,0,0,2|1,0,0]=3 772 B17R2.291558 CC(C)CCNC1=NC=NC2=CC=CC=C12 MCULE-7767090477 [0,0,0,0,0,2|1,0,1]=4 773 B17R2.291558 CN(C)CC#CC1=CC=CC2=CC=CC=C12 MCULE-3176783488 [0,0,0,0,0,2|1,0,1]=4 774 B17R2.291558 CN(C)CCNC1=NC=NC2=CC=CC=C12 MCULE-2288591217 [0,0,0,0,0,2|0,0,1]=3 775 B17R2.291558 CN(C)CCNC1=NC=NC2=CC=CC=C12 MCULE-3612945556 [0,0,0,0,0,2|0,0,1]=3 776 B17R2.290165 CN(C)CCN1CCCNC2=CC=CC=C12 MCULE-6262042701 [0,0,0,0,0,2|1,0,1]=4