0 B14R2.6 C1=CC(CCC1)Oc2ccccc2 7a_100000210340_100000751183 [0,0,0,0,0,0|0,0,4]=4 1 B14R2.6 c1cc(ccn1)Sc2ccncc2 62a_100000728582_100000728582 [0,0,0,0,0,0|2,1,0]=3 2 B14R2.6 c1cc(ccn1)Sc2ccncn2 62a_100000703185_100000728582 [0,0,0,0,0,0|3,1,0]=4 3 B14R2.6 c1cc(ccn1)Sc2ccncn2 62a_100000728582_100000703185 [0,0,0,0,0,0|3,1,0]=4 4 B14R2.6 c1cc(ccn1)Sc2ccnnc2 62a_100000728582_100000732662 [0,0,0,0,0,0|3,1,0]=4 5 B14R2.6 c1cc(ccn1)Sc2ccnnc2 62a_100000732662_100000728582 [0,0,0,0,0,0|3,1,0]=4 6 B14R2.6 c1cc(ccn1)Sc2cnccn2 62a_100000211759_100000728582 [0,0,0,0,0,0|3,1,0]=4 7 B14R2.6 c1cc(ccn1)Sc2cnccn2 62a_100000728582_100000211759 [0,0,0,0,0,0|3,1,0]=4 8 B14R2.6 c1cc(ccn1)Sc2cncnc2 62a_100000728582_100011206942 [0,0,0,0,0,0|3,1,0]=4 9 B14R2.6 c1cc(ccn1)Sc2cncnc2 62a_100011206942_100000728582 [0,0,0,0,0,0|3,1,0]=4 10 B14R2.6 c1ccc(cc1)Nc2cccnn2 27a_100000106764_100016991348 [0,0,0,0,0,0|3,0,0]=3 11 B14R2.6 c1ccc(cc1)Nc2ccncn2 27a_100000106764_100000703185 [0,0,0,0,0,0|3,0,0]=3 12 B14R2.6 c1ccc(cc1)Nc2cnccn2 27a_100000106764_100000211759 [0,0,0,0,0,0|3,0,0]=3 13 B14R2.6 c1ccc(cc1)Nc2ncccn2 27a_100000106764_100000211032 [0,0,0,0,0,0|3,0,0]=3 14 B14R2.6 c1ccc(cc1)Sc2ccccc2 62a_100000719477_100000041952 [0,0,0,0,0,0|0,1,0]=1 15 B14R2.6 c1ccc(cc1)Sc2ccccn2 62a_100000719477_100011216584 [0,0,0,0,0,0|1,1,0]=2 16 B14R2.6 c1ccc(cc1)Sc2ccccn2 62a_100011216584_100000041952 [0,0,0,0,0,0|1,1,0]=2 17 B14R2.6 c1ccc(cc1)Sc2cccnc2 62a_100000210063_100000041952 [0,0,0,0,0,0|1,1,0]=2 18 B14R2.6 c1ccc(cc1)Sc2cccnc2 62a_100000719477_100000210063 [0,0,0,0,0,0|1,1,0]=2 19 B14R2.6 c1ccc(cc1)Sc2cccnn2 62a_100000719477_100016991348 [0,0,0,0,0,0|2,1,0]=3 20 B14R2.6 c1ccc(cc1)Sc2cccnn2 62a_100016991348_100000041952 [0,0,0,0,0,0|2,1,0]=3 21 B14R2.6 c1ccc(cc1)Sc2ccncc2 62a_100000719477_100000728582 [0,0,0,0,0,0|1,1,0]=2 22 B14R2.6 c1ccc(cc1)Sc2ccncc2 62a_100000728582_100000041952 [0,0,0,0,0,0|1,1,0]=2 23 B14R2.6 c1ccc(cc1)Sc2ccncn2 62a_100000703185_100000041952 [0,0,0,0,0,0|2,1,0]=3 24 B14R2.6 c1ccc(cc1)Sc2ccncn2 62a_100000719477_100000703185 [0,0,0,0,0,0|2,1,0]=3 25 B14R2.6 c1ccc(cc1)Sc2ccnnc2 62a_100000719477_100000732662 [0,0,0,0,0,0|2,1,0]=3 26 B14R2.6 c1ccc(cc1)Sc2ccnnc2 62a_100000732662_100000041952 [0,0,0,0,0,0|2,1,0]=3 27 B14R2.6 c1ccc(cc1)Sc2cnccn2 62a_100000211759_100000041952 [0,0,0,0,0,0|2,1,0]=3 28 B14R2.6 c1ccc(cc1)Sc2cnccn2 62a_100000719477_100000211759 [0,0,0,0,0,0|2,1,0]=3 29 B14R2.6 c1ccc(cc1)Sc2cncnc2 62a_100000719477_100011206942 [0,0,0,0,0,0|2,1,0]=3 30 B14R2.6 c1ccc(cc1)Sc2cncnc2 62a_100011206942_100000041952 [0,0,0,0,0,0|2,1,0]=3 31 B14R2.6 c1ccc(cc1)Sc2cnnnc2 62a_100000719477_100009846058 [0,0,0,0,0,0|3,1,0]=4 32 B14R2.6 c1ccc(cc1)Sc2cnnnc2 62a_100009846058_100000041952 [0,0,0,0,0,0|3,1,0]=4 33 B14R2.6 c1ccc(cc1)Sc2ncccn2 62a_100000211032_100000041952 [0,0,0,0,0,0|2,1,0]=3 34 B14R2.6 c1ccc(cc1)Sc2ncccn2 62a_100000719477_100000211032 [0,0,0,0,0,0|2,1,0]=3 35 B14R2.6 c1ccc(nc1)Sc2ccccn2 62a_100011216584_100011216584 [0,0,0,0,0,0|2,1,0]=3 36 B14R2.6 c1ccc(nc1)Sc2cccnc2 62a_100000210063_100011216584 [0,0,0,0,0,0|2,1,0]=3 37 B14R2.6 c1ccc(nc1)Sc2cccnc2 62a_100011216584_100000210063 [0,0,0,0,0,0|2,1,0]=3 38 B14R2.6 c1ccc(nc1)Sc2cccnn2 62a_100011216584_100016991348 [0,0,0,0,0,0|3,1,0]=4 39 B14R2.6 c1ccc(nc1)Sc2cccnn2 62a_100016991348_100011216584 [0,0,0,0,0,0|3,1,0]=4 40 B14R2.6 c1ccc(nc1)Sc2ccncc2 62a_100000728582_100011216584 [0,0,0,0,0,0|2,1,0]=3 41 B14R2.6 c1ccc(nc1)Sc2ccncc2 62a_100011216584_100000728582 [0,0,0,0,0,0|2,1,0]=3 42 B14R2.6 c1ccc(nc1)Sc2ccncn2 62a_100000703185_100011216584 [0,0,0,0,0,0|3,1,0]=4 43 B14R2.6 c1ccc(nc1)Sc2ccncn2 62a_100011216584_100000703185 [0,0,0,0,0,0|3,1,0]=4 44 B14R2.6 c1ccc(nc1)Sc2ccnnc2 62a_100000732662_100011216584 [0,0,0,0,0,0|3,1,0]=4 45 B14R2.6 c1ccc(nc1)Sc2ccnnc2 62a_100011216584_100000732662 [0,0,0,0,0,0|3,1,0]=4 46 B14R2.6 c1ccc(nc1)Sc2cnccn2 62a_100000211759_100011216584 [0,0,0,0,0,0|3,1,0]=4 47 B14R2.6 c1ccc(nc1)Sc2cnccn2 62a_100011216584_100000211759 [0,0,0,0,0,0|3,1,0]=4 48 B14R2.6 c1ccc(nc1)Sc2cncnc2 62a_100011206942_100011216584 [0,0,0,0,0,0|3,1,0]=4 49 B14R2.6 c1ccc(nc1)Sc2cncnc2 62a_100011216584_100011206942 [0,0,0,0,0,0|3,1,0]=4 50 B14R2.6 c1ccc(nc1)Sc2ncccn2 62a_100000211032_100011216584 [0,0,0,0,0,0|3,1,0]=4 51 B14R2.6 c1ccc(nc1)Sc2ncccn2 62a_100011216584_100000211032 [0,0,0,0,0,0|3,1,0]=4 52 B14R2.6 c1cnc(nc1)Sc2cccnc2 62a_100000210063_100000211032 [0,0,0,0,0,0|3,1,0]=4 53 B14R2.6 c1cnc(nc1)Sc2cccnc2 62a_100000211032_100000210063 [0,0,0,0,0,0|3,1,0]=4 54 B14R2.6 c1cnc(nc1)Sc2ccncc2 62a_100000211032_100000728582 [0,0,0,0,0,0|3,1,0]=4 55 B14R2.6 c1cnc(nc1)Sc2ccncc2 62a_100000728582_100000211032 [0,0,0,0,0,0|3,1,0]=4 56 B14R2.6 c1cncc(c1)Sc2cccnc2 62a_100000210063_100000210063 [0,0,0,0,0,0|2,1,0]=3 57 B14R2.6 c1cncc(c1)Sc2cccnn2 62a_100000210063_100016991348 [0,0,0,0,0,0|3,1,0]=4 58 B14R2.6 c1cncc(c1)Sc2cccnn2 62a_100016991348_100000210063 [0,0,0,0,0,0|3,1,0]=4 59 B14R2.6 c1cncc(c1)Sc2ccncc2 62a_100000210063_100000728582 [0,0,0,0,0,0|2,1,0]=3 60 B14R2.6 c1cncc(c1)Sc2ccncc2 62a_100000728582_100000210063 [0,0,0,0,0,0|2,1,0]=3 61 B14R2.6 c1cncc(c1)Sc2ccncn2 62a_100000210063_100000703185 [0,0,0,0,0,0|3,1,0]=4 62 B14R2.6 c1cncc(c1)Sc2ccncn2 62a_100000703185_100000210063 [0,0,0,0,0,0|3,1,0]=4 63 B14R2.6 c1cncc(c1)Sc2ccnnc2 62a_100000210063_100000732662 [0,0,0,0,0,0|3,1,0]=4 64 B14R2.6 c1cncc(c1)Sc2ccnnc2 62a_100000732662_100000210063 [0,0,0,0,0,0|3,1,0]=4 65 B14R2.6 c1cncc(c1)Sc2cnccn2 62a_100000210063_100000211759 [0,0,0,0,0,0|3,1,0]=4 66 B14R2.6 c1cncc(c1)Sc2cnccn2 62a_100000211759_100000210063 [0,0,0,0,0,0|3,1,0]=4 67 B14R2.6 c1cncc(c1)Sc2cncnc2 62a_100000210063_100011206942 [0,0,0,0,0,0|3,1,0]=4 68 B14R2.6 c1cncc(c1)Sc2cncnc2 62a_100011206942_100000210063 [0,0,0,0,0,0|3,1,0]=4 69 B14R2.6 c1cnnc(c1)Sc2ccncc2 62a_100000728582_100016991348 [0,0,0,0,0,0|3,1,0]=4 70 B14R2.6 c1cnnc(c1)Sc2ccncc2 62a_100016991348_100000728582 [0,0,0,0,0,0|3,1,0]=4 71 B15R2.29 Brc1ccc(cc1)Nc2cccnn2 27a_100000210018_100016991348 [0,1,0,0,0,0|3,0,0]=4 72 B15R2.29 Brc1ccc(cc1)Nc2ccncn2 27a_100000210018_100000703185 [0,1,0,0,0,0|3,0,0]=4 73 B15R2.29 Brc1ccc(cc1)Nc2cnccn2 27a_100000210018_100000211759 [0,1,0,0,0,0|3,0,0]=4 74 B15R2.29 Brc1ccc(cc1)Nc2ncccn2 27a_100000210018_100000211032 [0,1,0,0,0,0|3,0,0]=4 75 B15R2.29 Brc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000752885 [0,1,0,0,0,0|0,1,0]=2 76 B15R2.29 Brc1ccc(cc1)Sc2ccccc2 62a_100000752885_100000041952 [0,1,0,0,0,0|0,1,0]=2 77 B15R2.29 Brc1ccc(cc1)Sc2ccccn2 62a_100000752885_100011216584 [0,1,0,0,0,0|1,1,0]=3 78 B15R2.29 Brc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000752885 [0,1,0,0,0,0|1,1,0]=3 79 B15R2.29 Brc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000752885 [0,1,0,0,0,0|1,1,0]=3 80 B15R2.29 Brc1ccc(cc1)Sc2cccnc2 62a_100000752885_100000210063 [0,1,0,0,0,0|1,1,0]=3 81 B15R2.29 Brc1ccc(cc1)Sc2cccnn2 62a_100000752885_100016991348 [0,1,0,0,0,0|2,1,0]=4 82 B15R2.29 Brc1ccc(cc1)Sc2cccnn2 62a_100016991348_100000752885 [0,1,0,0,0,0|2,1,0]=4 83 B15R2.29 Brc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000752885 [0,1,0,0,0,0|1,1,0]=3 84 B15R2.29 Brc1ccc(cc1)Sc2ccncc2 62a_100000752885_100000728582 [0,1,0,0,0,0|1,1,0]=3 85 B15R2.29 Brc1ccc(cc1)Sc2ccncn2 62a_100000703185_100000752885 [0,1,0,0,0,0|2,1,0]=4 86 B15R2.29 Brc1ccc(cc1)Sc2ccncn2 62a_100000752885_100000703185 [0,1,0,0,0,0|2,1,0]=4 87 B15R2.29 Brc1ccc(cc1)Sc2ccnnc2 62a_100000732662_100000752885 [0,1,0,0,0,0|2,1,0]=4 88 B15R2.29 Brc1ccc(cc1)Sc2ccnnc2 62a_100000752885_100000732662 [0,1,0,0,0,0|2,1,0]=4 89 B15R2.29 Brc1ccc(cc1)Sc2cnccn2 62a_100000211759_100000752885 [0,1,0,0,0,0|2,1,0]=4 90 B15R2.29 Brc1ccc(cc1)Sc2cnccn2 62a_100000752885_100000211759 [0,1,0,0,0,0|2,1,0]=4 91 B15R2.29 Brc1ccc(cc1)Sc2cncnc2 62a_100000752885_100011206942 [0,1,0,0,0,0|2,1,0]=4 92 B15R2.29 Brc1ccc(cc1)Sc2cncnc2 62a_100011206942_100000752885 [0,1,0,0,0,0|2,1,0]=4 93 B15R2.29 Brc1ccc(cc1)Sc2ncccn2 62a_100000211032_100000752885 [0,1,0,0,0,0|2,1,0]=4 94 B15R2.29 Brc1ccc(cc1)Sc2ncccn2 62a_100000752885_100000211032 [0,1,0,0,0,0|2,1,0]=4 95 B15R2.29 Brc1ccc(cn1)Sc2ccccc2 62a_100000719477_100009814638 [0,1,0,0,0,0|1,1,0]=3 96 B15R2.29 Brc1ccc(cn1)Sc2ccccc2 62a_100009814638_100000041952 [0,1,0,0,0,0|1,1,0]=3 97 B15R2.29 Brc1ccc(cn1)Sc2ccccn2 62a_100009814638_100011216584 [0,1,0,0,0,0|2,1,0]=4 98 B15R2.29 Brc1ccc(cn1)Sc2ccccn2 62a_100011216584_100009814638 [0,1,0,0,0,0|2,1,0]=4 99 B15R2.29 Brc1ccc(cn1)Sc2cccnc2 62a_100000210063_100009814638 [0,1,0,0,0,0|2,1,0]=4 100 B15R2.29 Brc1ccc(cn1)Sc2cccnc2 62a_100009814638_100000210063 [0,1,0,0,0,0|2,1,0]=4 101 B15R2.29 Brc1ccc(cn1)Sc2ccncc2 62a_100000728582_100009814638 [0,1,0,0,0,0|2,1,0]=4 102 B15R2.29 Brc1ccc(cn1)Sc2ccncc2 62a_100009814638_100000728582 [0,1,0,0,0,0|2,1,0]=4 103 B15R2.29 Brc1ccc(nc1)Nc2ccccc2 27a_100000106764_100000686858 [0,1,0,0,0,0|2,0,0]=3 104 B15R2.29 Brc1ccc(nc1)Sc2ccccc2 62a_100000686858_100000041952 [0,1,0,0,0,0|1,1,0]=3 105 B15R2.29 Brc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000686858 [0,1,0,0,0,0|1,1,0]=3 106 B15R2.29 Brc1ccc(nc1)Sc2ccccn2 62a_100000686858_100011216584 [0,1,0,0,0,0|2,1,0]=4 107 B15R2.29 Brc1ccc(nc1)Sc2ccccn2 62a_100011216584_100000686858 [0,1,0,0,0,0|2,1,0]=4 108 B15R2.29 Brc1ccc(nc1)Sc2cccnc2 62a_100000210063_100000686858 [0,1,0,0,0,0|2,1,0]=4 109 B15R2.29 Brc1ccc(nc1)Sc2cccnc2 62a_100000686858_100000210063 [0,1,0,0,0,0|2,1,0]=4 110 B15R2.29 Brc1ccc(nc1)Sc2ccncc2 62a_100000686858_100000728582 [0,1,0,0,0,0|2,1,0]=4 111 B15R2.29 Brc1ccc(nc1)Sc2ccncc2 62a_100000728582_100000686858 [0,1,0,0,0,0|2,1,0]=4 112 B15R2.29 Brc1cnc(cn1)Nc2ccccc2 27a_100000106764_100010187541 [0,1,0,0,0,0|3,0,0]=4 113 B15R2.29 Brc1cnc(cn1)Sc2ccccc2 62a_100000719477_100010187541 [0,1,0,0,0,0|2,1,0]=4 114 B15R2.29 Brc1cnc(cn1)Sc2ccccc2 62a_100010187541_100000041952 [0,1,0,0,0,0|2,1,0]=4 115 B15R2.29 Brc1cnc(nc1)Nc2ccccc2 27a_100000106764_100000690281 [0,1,0,0,0,0|3,0,0]=4 116 B15R2.29 Brc1cnc(nc1)Sc2ccccc2 62a_100000690281_100000041952 [0,1,0,0,0,0|2,1,0]=4 117 B15R2.29 Brc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000690281 [0,1,0,0,0,0|2,1,0]=4 118 B15R2.29 Brc1ncc(cn1)Sc2ccccc2 62a_100000719477_200012349914 [0,1,0,0,0,0|2,1,0]=4 119 B15R2.29 Brc1ncc(cn1)Sc2ccccc2 62a_200012349914_100000041952 [0,1,0,0,0,0|2,1,0]=4 120 B15R2.29 Cc1ccc(cc1)Nc2cccnn2 27a_100000124888_100016991348 [0,1,0,0,0,0|3,0,0]=4 121 B15R2.29 Cc1ccc(cc1)Nc2ccncn2 27a_100000124888_100000703185 [0,1,0,0,0,0|3,0,0]=4 122 B15R2.29 Cc1ccc(cc1)Nc2cnccn2 27a_100000124888_100000211759 [0,1,0,0,0,0|3,0,0]=4 123 B15R2.29 Cc1ccc(cc1)Nc2ncccn2 27a_100000124888_100000211032 [0,1,0,0,0,0|3,0,0]=4 124 B15R2.29 Cc1ccc(cc1)Sc2ccccc2 62a_100000186775_100000041952 [0,1,0,0,0,0|0,1,0]=2 125 B15R2.29 Cc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000186775 [0,1,0,0,0,0|0,1,0]=2 126 B15R2.29 Cc1ccc(cc1)Sc2ccccn2 62a_100000186775_100011216584 [0,1,0,0,0,0|1,1,0]=3 127 B15R2.29 Cc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000186775 [0,1,0,0,0,0|1,1,0]=3 128 B15R2.29 Cc1ccc(cc1)Sc2cccnc2 62a_100000186775_100000210063 [0,1,0,0,0,0|1,1,0]=3 129 B15R2.29 Cc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000186775 [0,1,0,0,0,0|1,1,0]=3 130 B15R2.29 Cc1ccc(cc1)Sc2cccnn2 62a_100000186775_100016991348 [0,1,0,0,0,0|2,1,0]=4 131 B15R2.29 Cc1ccc(cc1)Sc2cccnn2 62a_100016991348_100000186775 [0,1,0,0,0,0|2,1,0]=4 132 B15R2.29 Cc1ccc(cc1)Sc2ccncc2 62a_100000186775_100000728582 [0,1,0,0,0,0|1,1,0]=3 133 B15R2.29 Cc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000186775 [0,1,0,0,0,0|1,1,0]=3 134 B15R2.29 Cc1ccc(cc1)Sc2ccncn2 62a_100000186775_100000703185 [0,1,0,0,0,0|2,1,0]=4 135 B15R2.29 Cc1ccc(cc1)Sc2ccncn2 62a_100000703185_100000186775 [0,1,0,0,0,0|2,1,0]=4 136 B15R2.29 Cc1ccc(cc1)Sc2ccnnc2 62a_100000186775_100000732662 [0,1,0,0,0,0|2,1,0]=4 137 B15R2.29 Cc1ccc(cc1)Sc2ccnnc2 62a_100000732662_100000186775 [0,1,0,0,0,0|2,1,0]=4 138 B15R2.29 Cc1ccc(cc1)Sc2cnccn2 62a_100000186775_100000211759 [0,1,0,0,0,0|2,1,0]=4 139 B15R2.29 Cc1ccc(cc1)Sc2cnccn2 62a_100000211759_100000186775 [0,1,0,0,0,0|2,1,0]=4 140 B15R2.29 Cc1ccc(cc1)Sc2cncnc2 62a_100000186775_100011206942 [0,1,0,0,0,0|2,1,0]=4 141 B15R2.29 Cc1ccc(cc1)Sc2cncnc2 62a_100011206942_100000186775 [0,1,0,0,0,0|2,1,0]=4 142 B15R2.29 Cc1ccc(cc1)Sc2ncccn2 62a_100000186775_100000211032 [0,1,0,0,0,0|2,1,0]=4 143 B15R2.29 Cc1ccc(cc1)Sc2ncccn2 62a_100000211032_100000186775 [0,1,0,0,0,0|2,1,0]=4 144 B15R2.29 Cc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000751577 [0,1,0,0,0,0|1,1,0]=3 145 B15R2.29 Cc1ccc(cn1)Sc2ccccc2 62a_100000751577_100000041952 [0,1,0,0,0,0|1,1,0]=3 146 B15R2.29 Cc1ccc(cn1)Sc2ccccn2 62a_100000751577_100011216584 [0,1,0,0,0,0|2,1,0]=4 147 B15R2.29 Cc1ccc(cn1)Sc2ccccn2 62a_100011216584_100000751577 [0,1,0,0,0,0|2,1,0]=4 148 B15R2.29 Cc1ccc(cn1)Sc2cccnc2 62a_100000210063_100000751577 [0,1,0,0,0,0|2,1,0]=4 149 B15R2.29 Cc1ccc(cn1)Sc2cccnc2 62a_100000751577_100000210063 [0,1,0,0,0,0|2,1,0]=4 150 B15R2.29 Cc1ccc(cn1)Sc2ccncc2 62a_100000728582_100000751577 [0,1,0,0,0,0|2,1,0]=4 151 B15R2.29 Cc1ccc(cn1)Sc2ccncc2 62a_100000751577_100000728582 [0,1,0,0,0,0|2,1,0]=4 152 B15R2.29 Cc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000754016 [0,1,0,0,0,0|1,1,0]=3 153 B15R2.29 Cc1ccc(nc1)Sc2ccccc2 62a_100011192072_100000041952 [0,1,0,0,0,0|1,1,0]=3 154 B15R2.29 Cc1ccc(nc1)Sc2ccccn2 62a_100011192072_100011216584 [0,1,0,0,0,0|2,1,0]=4 155 B15R2.29 Cc1ccc(nc1)Sc2ccccn2 62a_100011216584_100000754016 [0,1,0,0,0,0|2,1,0]=4 156 B15R2.29 Cc1ccc(nc1)Sc2cccnc2 62a_100000210063_100000754016 [0,1,0,0,0,0|2,1,0]=4 157 B15R2.29 Cc1ccc(nc1)Sc2cccnc2 62a_100011192072_100000210063 [0,1,0,0,0,0|2,1,0]=4 158 B15R2.29 Cc1ccc(nc1)Sc2ccncc2 62a_100000728582_100000754016 [0,1,0,0,0,0|2,1,0]=4 159 B15R2.29 Cc1ccc(nc1)Sc2ccncc2 62a_100011192072_100000728582 [0,1,0,0,0,0|2,1,0]=4 160 B15R2.29 Cc1ccc(nn1)Nc2ccccc2 27a_100000106764_100000744512 [0,1,0,0,0,0|3,0,0]=4 161 B15R2.29 Cc1ccc(nn1)Sc2ccccc2 62a_100000719477_100000744512 [0,1,0,0,0,0|2,1,0]=4 162 B15R2.29 Cc1ccc(nn1)Sc2ccccc2 62a_100000744512_100000041952 [0,1,0,0,0,0|2,1,0]=4 163 B15R2.29 Cc1cnc(cn1)Nc2ccccc2 27a_100000106764_100000074397 [0,1,0,0,0,0|3,0,0]=4 164 B15R2.29 Cc1cnc(cn1)Sc2ccccc2 62a_100000719477_100011999403 [0,1,0,0,0,0|2,1,0]=4 165 B15R2.29 Cc1cnc(cn1)Sc2ccccc2 62a_100011999403_100000041952 [0,1,0,0,0,0|2,1,0]=4 166 B15R2.29 Cc1cnc(nc1)Nc2ccccc2 27a_100000106764_100000061069 [0,1,0,0,0,0|3,0,0]=4 167 B15R2.29 Cc1cnc(nc1)Sc2ccccc2 62a_100000061069_100000041952 [0,1,0,0,0,0|2,1,0]=4 168 B15R2.29 Cc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000061069 [0,1,0,0,0,0|2,1,0]=4 169 B15R2.29 Cc1ncc(cn1)Sc2ccccc2 62a_100000686985_100000041952 [0,1,0,0,0,0|2,1,0]=4 170 B15R2.29 Cc1ncc(cn1)Sc2ccccc2 62a_100000719477_100000686985 [0,1,0,0,0,0|2,1,0]=4 171 B15R2.29 Clc1ccc(cc1)Nc2cccnn2 27a_100000210052_100016991348 [0,1,0,0,0,0|3,0,0]=4 172 B15R2.29 Clc1ccc(cc1)Nc2ccncn2 27a_100000210052_100000703185 [0,1,0,0,0,0|3,0,0]=4 173 B15R2.29 Clc1ccc(cc1)Nc2cnccn2 27a_100000210052_100000211759 [0,1,0,0,0,0|3,0,0]=4 174 B15R2.29 Clc1ccc(cc1)Nc2ncccn2 27a_100000210052_100000211032 [0,1,0,0,0,0|3,0,0]=4 175 B15R2.29 Clc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000755918 [0,1,0,0,0,0|0,1,0]=2 176 B15R2.29 Clc1ccc(cc1)Sc2ccccc2 62a_100000755918_100000041952 [0,1,0,0,0,0|0,1,0]=2 177 B15R2.29 Clc1ccc(cc1)Sc2ccccn2 62a_100000755918_100011216584 [0,1,0,0,0,0|1,1,0]=3 178 B15R2.29 Clc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000755918 [0,1,0,0,0,0|1,1,0]=3 179 B15R2.29 Clc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000755918 [0,1,0,0,0,0|1,1,0]=3 180 B15R2.29 Clc1ccc(cc1)Sc2cccnc2 62a_100000755918_100000210063 [0,1,0,0,0,0|1,1,0]=3 181 B15R2.29 Clc1ccc(cc1)Sc2cccnn2 62a_100000755918_100016991348 [0,1,0,0,0,0|2,1,0]=4 182 B15R2.29 Clc1ccc(cc1)Sc2cccnn2 62a_100016991348_100000755918 [0,1,0,0,0,0|2,1,0]=4 183 B15R2.29 Clc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000755918 [0,1,0,0,0,0|1,1,0]=3 184 B15R2.29 Clc1ccc(cc1)Sc2ccncc2 62a_100000755918_100000728582 [0,1,0,0,0,0|1,1,0]=3 185 B15R2.29 Clc1ccc(cc1)Sc2ccncn2 62a_100000703185_100000755918 [0,1,0,0,0,0|2,1,0]=4 186 B15R2.29 Clc1ccc(cc1)Sc2ccncn2 62a_100000755918_100000703185 [0,1,0,0,0,0|2,1,0]=4 187 B15R2.29 Clc1ccc(cc1)Sc2ccnnc2 62a_100000732662_100000755918 [0,1,0,0,0,0|2,1,0]=4 188 B15R2.29 Clc1ccc(cc1)Sc2ccnnc2 62a_100000755918_100000732662 [0,1,0,0,0,0|2,1,0]=4 189 B15R2.29 Clc1ccc(cc1)Sc2cnccn2 62a_100000211759_100000755918 [0,1,0,0,0,0|2,1,0]=4 190 B15R2.29 Clc1ccc(cc1)Sc2cnccn2 62a_100000755918_100000211759 [0,1,0,0,0,0|2,1,0]=4 191 B15R2.29 Clc1ccc(cc1)Sc2cncnc2 62a_100000755918_100011206942 [0,1,0,0,0,0|2,1,0]=4 192 B15R2.29 Clc1ccc(cc1)Sc2cncnc2 62a_100011206942_100000755918 [0,1,0,0,0,0|2,1,0]=4 193 B15R2.29 Clc1ccc(cc1)Sc2ncccn2 62a_100000211032_100000755918 [0,1,0,0,0,0|2,1,0]=4 194 B15R2.29 Clc1ccc(cc1)Sc2ncccn2 62a_100000755918_100000211032 [0,1,0,0,0,0|2,1,0]=4 195 B15R2.29 Clc1ccc(cn1)Sc2ccccc2 62a_100000034144_100000041952 [0,1,0,0,0,0|1,1,0]=3 196 B15R2.29 Clc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000034144 [0,1,0,0,0,0|1,1,0]=3 197 B15R2.29 Clc1ccc(cn1)Sc2ccccn2 62a_100000034144_100011216584 [0,1,0,0,0,0|2,1,0]=4 198 B15R2.29 Clc1ccc(cn1)Sc2ccccn2 62a_100011216584_100000034144 [0,1,0,0,0,0|2,1,0]=4 199 B15R2.29 Clc1ccc(cn1)Sc2cccnc2 62a_100000034144_100000210063 [0,1,0,0,0,0|2,1,0]=4 200 B15R2.29 Clc1ccc(cn1)Sc2cccnc2 62a_100000210063_100000034144 [0,1,0,0,0,0|2,1,0]=4 201 B15R2.29 Clc1ccc(cn1)Sc2ccncc2 62a_100000034144_100000728582 [0,1,0,0,0,0|2,1,0]=4 202 B15R2.29 Clc1ccc(cn1)Sc2ccncc2 62a_100000728582_100000034144 [0,1,0,0,0,0|2,1,0]=4 203 B15R2.29 Clc1ccc(nc1)Sc2ccccc2 62a_100000719477_100011356976 [0,1,0,0,0,0|1,1,0]=3 204 B15R2.29 Clc1ccc(nc1)Sc2ccccc2 62a_100011356976_100000041952 [0,1,0,0,0,0|1,1,0]=3 205 B15R2.29 Clc1ccc(nc1)Sc2ccccn2 62a_100011216584_100011356976 [0,1,0,0,0,0|2,1,0]=4 206 B15R2.29 Clc1ccc(nc1)Sc2ccccn2 62a_100011356976_100011216584 [0,1,0,0,0,0|2,1,0]=4 207 B15R2.29 Clc1ccc(nc1)Sc2cccnc2 62a_100000210063_100011356976 [0,1,0,0,0,0|2,1,0]=4 208 B15R2.29 Clc1ccc(nc1)Sc2cccnc2 62a_100011356976_100000210063 [0,1,0,0,0,0|2,1,0]=4 209 B15R2.29 Clc1ccc(nc1)Sc2ccncc2 62a_100000728582_100011356976 [0,1,0,0,0,0|2,1,0]=4 210 B15R2.29 Clc1ccc(nc1)Sc2ccncc2 62a_100011356976_100000728582 [0,1,0,0,0,0|2,1,0]=4 211 B15R2.29 Clc1ccc(nn1)Sc2ccccc2 62a_100000068654_100000041952 [0,1,0,0,0,0|2,1,0]=4 212 B15R2.29 Clc1ccc(nn1)Sc2ccccc2 62a_100000719477_100000068654 [0,1,0,0,0,0|2,1,0]=4 213 B15R2.29 Clc1cnc(cn1)Sc2ccccc2 62a_100000719477_100010214907 [0,1,0,0,0,0|2,1,0]=4 214 B15R2.29 Clc1cnc(cn1)Sc2ccccc2 62a_100010214907_100000041952 [0,1,0,0,0,0|2,1,0]=4 215 B15R2.29 Clc1cnc(nc1)Nc2ccccc2 27a_100000106764_100011356929 [0,1,0,0,0,0|3,0,0]=4 216 B15R2.29 Clc1cnc(nc1)Sc2ccccc2 62a_100000719477_100011356929 [0,1,0,0,0,0|2,1,0]=4 217 B15R2.29 Clc1cnc(nc1)Sc2ccccc2 62a_100011356929_100000041952 [0,1,0,0,0,0|2,1,0]=4 218 B15R2.29 Clc1ncc(cn1)Sc2ccccc2 62a_100000059775_100000041952 [0,1,0,0,0,0|2,1,0]=4 219 B15R2.29 Clc1ncc(cn1)Sc2ccccc2 62a_100000719477_100000059775 [0,1,0,0,0,0|2,1,0]=4 220 B15R2.29 Fc1ccc(cc1)Nc2cccnn2 27a_100000185862_100016991348 [0,1,0,0,0,0|3,0,0]=4 221 B15R2.29 Fc1ccc(cc1)Nc2ccncn2 27a_100000185862_100000703185 [0,1,0,0,0,0|3,0,0]=4 222 B15R2.29 Fc1ccc(cc1)Nc2cnccn2 27a_100000185862_100000211759 [0,1,0,0,0,0|3,0,0]=4 223 B15R2.29 Fc1ccc(cc1)Nc2ncccn2 27a_100000185862_100000211032 [0,1,0,0,0,0|3,0,0]=4 224 B15R2.29 Fc1ccc(cc1)Sc2ccccc2 62a_100000211213_100000041952 [0,1,0,0,0,0|0,1,0]=2 225 B15R2.29 Fc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000211213 [0,1,0,0,0,0|0,1,0]=2 226 B15R2.29 Fc1ccc(cc1)Sc2ccccn2 62a_100000211213_100011216584 [0,1,0,0,0,0|1,1,0]=3 227 B15R2.29 Fc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000211213 [0,1,0,0,0,0|1,1,0]=3 228 B15R2.29 Fc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000211213 [0,1,0,0,0,0|1,1,0]=3 229 B15R2.29 Fc1ccc(cc1)Sc2cccnc2 62a_100000211213_100000210063 [0,1,0,0,0,0|1,1,0]=3 230 B15R2.29 Fc1ccc(cc1)Sc2cccnn2 62a_100000211213_100016991348 [0,1,0,0,0,0|2,1,0]=4 231 B15R2.29 Fc1ccc(cc1)Sc2cccnn2 62a_100016991348_100000211213 [0,1,0,0,0,0|2,1,0]=4 232 B15R2.29 Fc1ccc(cc1)Sc2ccncc2 62a_100000211213_100000728582 [0,1,0,0,0,0|1,1,0]=3 233 B15R2.29 Fc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000211213 [0,1,0,0,0,0|1,1,0]=3 234 B15R2.29 Fc1ccc(cc1)Sc2ccncn2 62a_100000211213_100000703185 [0,1,0,0,0,0|2,1,0]=4 235 B15R2.29 Fc1ccc(cc1)Sc2ccncn2 62a_100000703185_100000211213 [0,1,0,0,0,0|2,1,0]=4 236 B15R2.29 Fc1ccc(cc1)Sc2ccnnc2 62a_100000211213_100000732662 [0,1,0,0,0,0|2,1,0]=4 237 B15R2.29 Fc1ccc(cc1)Sc2ccnnc2 62a_100000732662_100000211213 [0,1,0,0,0,0|2,1,0]=4 238 B15R2.29 Fc1ccc(cc1)Sc2cnccn2 62a_100000211213_100000211759 [0,1,0,0,0,0|2,1,0]=4 239 B15R2.29 Fc1ccc(cc1)Sc2cnccn2 62a_100000211759_100000211213 [0,1,0,0,0,0|2,1,0]=4 240 B15R2.29 Fc1ccc(cc1)Sc2cncnc2 62a_100000211213_100011206942 [0,1,0,0,0,0|2,1,0]=4 241 B15R2.29 Fc1ccc(cc1)Sc2cncnc2 62a_100011206942_100000211213 [0,1,0,0,0,0|2,1,0]=4 242 B15R2.29 Fc1ccc(cc1)Sc2ncccn2 62a_100000211032_100000211213 [0,1,0,0,0,0|2,1,0]=4 243 B15R2.29 Fc1ccc(cc1)Sc2ncccn2 62a_100000211213_100000211032 [0,1,0,0,0,0|2,1,0]=4 244 B15R2.29 Fc1ccc(cn1)Sc2ccccc2 62a_100000042367_100000041952 [0,1,0,0,0,0|1,1,0]=3 245 B15R2.29 Fc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000042367 [0,1,0,0,0,0|1,1,0]=3 246 B15R2.29 Fc1ccc(cn1)Sc2ccccn2 62a_100000042367_100011216584 [0,1,0,0,0,0|2,1,0]=4 247 B15R2.29 Fc1ccc(cn1)Sc2ccccn2 62a_100011216584_100000042367 [0,1,0,0,0,0|2,1,0]=4 248 B15R2.29 Fc1ccc(cn1)Sc2cccnc2 62a_100000042367_100000210063 [0,1,0,0,0,0|2,1,0]=4 249 B15R2.29 Fc1ccc(cn1)Sc2cccnc2 62a_100000210063_100000042367 [0,1,0,0,0,0|2,1,0]=4 250 B15R2.29 Fc1ccc(cn1)Sc2ccncc2 62a_100000042367_100000728582 [0,1,0,0,0,0|2,1,0]=4 251 B15R2.29 Fc1ccc(cn1)Sc2ccncc2 62a_100000728582_100000042367 [0,1,0,0,0,0|2,1,0]=4 252 B15R2.29 Fc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000744514 [0,1,0,0,0,0|1,1,0]=3 253 B15R2.29 Fc1ccc(nc1)Sc2ccccc2 62a_100000744514_100000041952 [0,1,0,0,0,0|1,1,0]=3 254 B15R2.29 Fc1ccc(nc1)Sc2ccccn2 62a_100000744514_100011216584 [0,1,0,0,0,0|2,1,0]=4 255 B15R2.29 Fc1ccc(nc1)Sc2ccccn2 62a_100011216584_100000744514 [0,1,0,0,0,0|2,1,0]=4 256 B15R2.29 Fc1ccc(nc1)Sc2cccnc2 62a_100000210063_100000744514 [0,1,0,0,0,0|2,1,0]=4 257 B15R2.29 Fc1ccc(nc1)Sc2cccnc2 62a_100000744514_100000210063 [0,1,0,0,0,0|2,1,0]=4 258 B15R2.29 Fc1ccc(nc1)Sc2ccncc2 62a_100000728582_100000744514 [0,1,0,0,0,0|2,1,0]=4 259 B15R2.29 Fc1ccc(nc1)Sc2ccncc2 62a_100000744514_100000728582 [0,1,0,0,0,0|2,1,0]=4 260 B15R2.29 Fc1cnc(cn1)Nc2ccccc2 27a_100000106764_100009856528 [0,1,0,0,0,0|3,0,0]=4 261 B15R2.29 Fc1cnc(cn1)Sc2ccccc2 62a_100000719477_100009856528 [0,1,0,0,0,0|2,1,0]=4 262 B15R2.29 Fc1cnc(cn1)Sc2ccccc2 62a_100009856528_100000041952 [0,1,0,0,0,0|2,1,0]=4 263 B15R2.29 Fc1cnc(nc1)Nc2ccccc2 27a_100000106764_100000685220 [0,1,0,0,0,0|3,0,0]=4 264 B15R2.29 Fc1cnc(nc1)Sc2ccccc2 62a_100000685220_100000041952 [0,1,0,0,0,0|2,1,0]=4 265 B15R2.29 Fc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000685220 [0,1,0,0,0,0|2,1,0]=4 266 B15R2.29 Fc1ncc(cn1)Sc2ccccc2 62a_100000685262_100000041952 [0,1,0,0,0,0|2,1,0]=4 267 B15R2.29 Fc1ncc(cn1)Sc2ccccc2 62a_100000719477_100000685262 [0,1,0,0,0,0|2,1,0]=4 268 B15R2.29 Ic1ccc(cc1)Nc2cccnn2 27a_100000185761_100016991348 [0,1,0,0,0,0|3,0,0]=4 269 B15R2.29 Ic1ccc(cc1)Nc2ccncn2 27a_100000185761_100000703185 [0,1,0,0,0,0|3,0,0]=4 270 B15R2.29 Ic1ccc(cc1)Nc2cnccn2 27a_100000185761_100000211759 [0,1,0,0,0,0|3,0,0]=4 271 B15R2.29 Ic1ccc(cc1)Nc2ncccn2 27a_100000185761_100000211032 [0,1,0,0,0,0|3,0,0]=4 272 B15R2.29 Nc1ccc(cc1)Sc2ccccc2 62a_100000185761_100000041952 [0,1,0,0,0,0|0,1,0]=2 273 B15R2.29 Nc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000185761 [0,1,0,0,0,0|0,1,0]=2 274 B15R2.29 Nc1ccc(cc1)Sc2ccccn2 62a_100000185761_100011216584 [0,1,0,0,0,0|1,1,0]=3 275 B15R2.29 Nc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000185761 [0,1,0,0,0,0|1,1,0]=3 276 B15R2.29 Nc1ccc(cc1)Sc2cccnc2 62a_100000185761_100000210063 [0,1,0,0,0,0|1,1,0]=3 277 B15R2.29 Nc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000185761 [0,1,0,0,0,0|1,1,0]=3 278 B15R2.29 Nc1ccc(cc1)Sc2cccnn2 62a_100000185761_100016991348 [0,1,0,0,0,0|2,1,0]=4 279 B15R2.29 Nc1ccc(cc1)Sc2cccnn2 62a_100016991348_100000185761 [0,1,0,0,0,0|2,1,0]=4 280 B15R2.29 Nc1ccc(cc1)Sc2ccncc2 62a_100000185761_100000728582 [0,1,0,0,0,0|1,1,0]=3 281 B15R2.29 Nc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000185761 [0,1,0,0,0,0|1,1,0]=3 282 B15R2.29 Nc1ccc(cc1)Sc2ccncn2 62a_100000185761_100000703185 [0,1,0,0,0,0|2,1,0]=4 283 B15R2.29 Nc1ccc(cc1)Sc2ccncn2 62a_100000703185_100000185761 [0,1,0,0,0,0|2,1,0]=4 284 B15R2.29 Nc1ccc(cc1)Sc2ccnnc2 62a_100000185761_100000732662 [0,1,0,0,0,0|2,1,0]=4 285 B15R2.29 Nc1ccc(cc1)Sc2ccnnc2 62a_100000732662_100000185761 [0,1,0,0,0,0|2,1,0]=4 286 B15R2.29 Nc1ccc(cc1)Sc2cnccn2 62a_100000185761_100000211759 [0,1,0,0,0,0|2,1,0]=4 287 B15R2.29 Nc1ccc(cc1)Sc2cnccn2 62a_100000211759_100000185761 [0,1,0,0,0,0|2,1,0]=4 288 B15R2.29 Nc1ccc(cc1)Sc2cncnc2 62a_100000185761_100011206942 [0,1,0,0,0,0|2,1,0]=4 289 B15R2.29 Nc1ccc(cc1)Sc2cncnc2 62a_100011206942_100000185761 [0,1,0,0,0,0|2,1,0]=4 290 B15R2.29 Nc1ccc(cc1)Sc2ncccn2 62a_100000185761_100000211032 [0,1,0,0,0,0|2,1,0]=4 291 B15R2.29 Nc1ccc(cc1)Sc2ncccn2 62a_100000211032_100000185761 [0,1,0,0,0,0|2,1,0]=4 292 B15R2.29 Nc1ccc(cn1)Sc2ccccc2 62a_100000187370_100000041952 [0,1,0,0,0,0|1,1,0]=3 293 B15R2.29 Nc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000187370 [0,1,0,0,0,0|1,1,0]=3 294 B15R2.29 Nc1ccc(cn1)Sc2ccccn2 62a_100000187370_100011216584 [0,1,0,0,0,0|2,1,0]=4 295 B15R2.29 Nc1ccc(cn1)Sc2ccccn2 62a_100011216584_100000187370 [0,1,0,0,0,0|2,1,0]=4 296 B15R2.29 Nc1ccc(cn1)Sc2cccnc2 62a_100000187370_100000210063 [0,1,0,0,0,0|2,1,0]=4 297 B15R2.29 Nc1ccc(cn1)Sc2cccnc2 62a_100000210063_100000187370 [0,1,0,0,0,0|2,1,0]=4 298 B15R2.29 Nc1ccc(cn1)Sc2ccncc2 62a_100000187370_100000728582 [0,1,0,0,0,0|2,1,0]=4 299 B15R2.29 Nc1ccc(cn1)Sc2ccncc2 62a_100000728582_100000187370 [0,1,0,0,0,0|2,1,0]=4 300 B15R2.29 Nc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000737798 [0,1,0,0,0,0|1,1,0]=3 301 B15R2.29 Nc1ccc(nc1)Sc2ccccc2 62a_100000737798_100000041952 [0,1,0,0,0,0|1,1,0]=3 302 B15R2.29 Nc1ccc(nc1)Sc2ccccn2 62a_100000737798_100011216584 [0,1,0,0,0,0|2,1,0]=4 303 B15R2.29 Nc1ccc(nc1)Sc2ccccn2 62a_100011216584_100000737798 [0,1,0,0,0,0|2,1,0]=4 304 B15R2.29 Nc1ccc(nc1)Sc2cccnc2 62a_100000210063_100000737798 [0,1,0,0,0,0|2,1,0]=4 305 B15R2.29 Nc1ccc(nc1)Sc2cccnc2 62a_100000737798_100000210063 [0,1,0,0,0,0|2,1,0]=4 306 B15R2.29 Nc1ccc(nc1)Sc2ccncc2 62a_100000728582_100000737798 [0,1,0,0,0,0|2,1,0]=4 307 B15R2.29 Nc1ccc(nc1)Sc2ccncc2 62a_100000737798_100000728582 [0,1,0,0,0,0|2,1,0]=4 308 B15R2.29 Nc1ccc(nn1)Sc2ccccc2 62a_100000719477_100010219413 [0,1,0,0,0,0|2,1,0]=4 309 B15R2.29 Nc1ccc(nn1)Sc2ccccc2 62a_100010219413_100000041952 [0,1,0,0,0,0|2,1,0]=4 310 B15R2.29 Nc1cnc(cn1)Sc2ccccc2 62a_100000719477_100000744751 [0,1,0,0,0,0|2,1,0]=4 311 B15R2.29 Nc1cnc(cn1)Sc2ccccc2 62a_100000744751_100000041952 [0,1,0,0,0,0|2,1,0]=4 312 B15R2.29 Nc1cnc(nc1)Sc2ccccc2 62a_100000068403_100000041952 [0,1,0,0,0,0|2,1,0]=4 313 B15R2.29 Nc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000068403 [0,1,0,0,0,0|2,1,0]=4 314 B15R2.29 Nc1ncc(cn1)Sc2ccccc2 62a_100000719477_100000766020 [0,1,0,0,0,0|2,1,0]=4 315 B15R2.29 Nc1ncc(cn1)Sc2ccccc2 62a_100000766020_100000041952 [0,1,0,0,0,0|2,1,0]=4 316 B15R2.29 O=c1ccc(c[nH]1)Sc2ccccc2 62a_100000212171_100000041952 [0,1,0,0,0,0|1,1,0]=3 317 B15R2.29 O=c1ccc(c[nH]1)Sc2ccccc2 62a_100000719477_100000212171 [0,1,0,0,0,0|1,1,0]=3 318 B15R2.29 O=c1ccc(c[nH]1)Sc2ccccn2 62a_100000212171_100011216584 [0,1,0,0,0,0|2,1,0]=4 319 B15R2.29 O=c1ccc(c[nH]1)Sc2ccccn2 62a_100011216584_100000212171 [0,1,0,0,0,0|2,1,0]=4 320 B15R2.29 O=c1ccc(c[nH]1)Sc2cccnc2 62a_100000210063_100000212171 [0,1,0,0,0,0|2,1,0]=4 321 B15R2.29 O=c1ccc(c[nH]1)Sc2cccnc2 62a_100000212171_100000210063 [0,1,0,0,0,0|2,1,0]=4 322 B15R2.29 O=c1ccc(c[nH]1)Sc2ccncc2 62a_100000212171_100000728582 [0,1,0,0,0,0|2,1,0]=4 323 B15R2.29 O=c1ccc(c[nH]1)Sc2ccncc2 62a_100000728582_100000212171 [0,1,0,0,0,0|2,1,0]=4 324 B15R2.29 O=c1ccc(n[nH]1)Sc2ccccc2 62a_100000719477_100009820020 [0,1,0,0,0,0|2,1,0]=4 325 B15R2.29 O=c1ccc(n[nH]1)Sc2ccccc2 62a_100009820020_100000041952 [0,1,0,0,0,0|2,1,0]=4 326 B15R2.29 O=c1ncc(c[nH]1)Sc2ccccc2 62a_100000719477_102495366499 [0,1,0,0,0,0|2,1,0]=4 327 B15R2.29 O=c1ncc(c[nH]1)Sc2ccccc2 62a_102495366499_100000041952 [0,1,0,0,0,0|2,1,0]=4 328 B15R2.29 Oc1cc[n+](cc1)Cc2ccccc2 271570a_203496583355_200011068538 [0,1,0,0,0,0|2,0,0]=3 329 B15R2.29 Oc1ccc(cc1)Cc2ccccc2 271570a_203496583355_100011356940 [0,1,0,0,0,0|1,0,0]=2 330 B15R2.29 Oc1ccc(cc1)Nc2ccccc2 271570a_203496583355_100009815781 [0,1,0,0,0,0|1,0,0]=2 331 B15R2.29 Oc1ccc(cc1)Nc2cccnn2 27a_100000185829_100016991348 [0,1,0,0,0,0|3,0,0]=4 332 B15R2.29 Oc1ccc(cc1)Nc2ccncn2 27a_100000185829_100000703185 [0,1,0,0,0,0|3,0,0]=4 333 B15R2.29 Oc1ccc(cc1)Nc2cnccn2 27a_100000185829_100000211759 [0,1,0,0,0,0|3,0,0]=4 334 B15R2.29 Oc1ccc(cc1)Nc2ncccn2 27a_100000185829_100000211032 [0,1,0,0,0,0|3,0,0]=4 335 B15R2.29 Oc1ccc(cc1)Oc2ccccc2 271570a_203496583355_100011215699 [0,1,0,0,0,0|0,0,0]=1 336 B15R2.29 Oc1ccc(cc1)Oc2ccccn2 271570a_203496583355_100000173464 [0,1,0,0,0,0|1,0,0]=2 337 B15R2.29 Oc1ccc(cc1)Oc2ncccn2 271570a_203496583355_100000170942 [0,1,0,0,0,0|2,0,0]=3 338 B15R2.29 Oc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000185759 [0,1,0,0,0,0|0,1,0]=2 339 B15R2.29 Oc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000185759 [0,1,0,0,0,0|1,1,0]=3 340 B15R2.29 Oc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000185759 [0,1,0,0,0,0|1,1,0]=3 341 B15R2.29 Oc1ccc(cc1)Sc2cccnn2 62a_100016991348_100000185759 [0,1,0,0,0,0|2,1,0]=4 342 B15R2.29 Oc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000185759 [0,1,0,0,0,0|1,1,0]=3 343 B15R2.29 Oc1ccc(cc1)Sc2ccncn2 62a_100000703185_100000185759 [0,1,0,0,0,0|2,1,0]=4 344 B15R2.29 Oc1ccc(cc1)Sc2ccnnc2 62a_100000732662_100000185759 [0,1,0,0,0,0|2,1,0]=4 345 B15R2.29 Oc1ccc(cc1)Sc2cnccn2 62a_100000211759_100000185759 [0,1,0,0,0,0|2,1,0]=4 346 B15R2.29 Oc1ccc(cc1)Sc2cncnc2 62a_100011206942_100000185759 [0,1,0,0,0,0|2,1,0]=4 347 B15R2.29 Oc1ccc(cc1)Sc2ncccn2 62a_100000211032_100000185759 [0,1,0,0,0,0|2,1,0]=4 348 B15R2.29 Oc1ccc(nc1)Oc2ccccc2 271570a_203496583355_200011465514 [0,1,0,0,0,0|1,0,0]=2 349 B15R2.29 Oc1ccc(nc1)Sc2ccccc2 271570a_203496583355_100011465531 [0,1,0,0,0,0|1,1,0]=3 350 B15R2.29 Oc1ccc(nc1)Sc2ccccc2 62a_100000685995_100000041952 [0,1,0,0,0,0|1,1,0]=3 351 B15R2.29 Oc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000744096 [0,1,0,0,0,0|1,1,0]=3 352 B15R2.29 Oc1ccc(nc1)Sc2ccccn2 62a_100000685995_100011216584 [0,1,0,0,0,0|2,1,0]=4 353 B15R2.29 Oc1ccc(nc1)Sc2ccccn2 62a_100011216584_100000744096 [0,1,0,0,0,0|2,1,0]=4 354 B15R2.29 Oc1ccc(nc1)Sc2cccnc2 62a_100000210063_100000744096 [0,1,0,0,0,0|2,1,0]=4 355 B15R2.29 Oc1ccc(nc1)Sc2cccnc2 62a_100000685995_100000210063 [0,1,0,0,0,0|2,1,0]=4 356 B15R2.29 Oc1ccc(nc1)Sc2ccncc2 62a_100000685995_100000728582 [0,1,0,0,0,0|2,1,0]=4 357 B15R2.29 Oc1ccc(nc1)Sc2ccncc2 62a_100000728582_100000744096 [0,1,0,0,0,0|2,1,0]=4 358 B15R2.29 Oc1ccc(nn1)Nc2ccccc2 271570a_203496583355_200000215334 [0,1,0,0,0,0|3,0,0]=4 359 B15R2.29 Oc1ccc(nn1)Oc2ccccc2 271570a_203496583355_200000215291 [0,1,0,0,0,0|2,0,0]=3 360 B15R2.29 Oc1cnc(cn1)Sc2ccccc2 62a_100000719477_100015839800 [0,1,0,0,0,0|2,1,0]=4 361 B15R2.29 Oc1cnc(cn1)Sc2ccccc2 62a_100011934580_100000041952 [0,1,0,0,0,0|2,1,0]=4 362 B15R2.29 Oc1cnc(nc1)Nc2ccccc2 271570a_203496583355_100011939124 [0,1,0,0,0,0|3,0,0]=4 363 B15R2.29 Oc1cnc(nc1)Oc2ccccc2 271570a_203496583355_100011939432 [0,1,0,0,0,0|2,0,0]=3 364 B15R2.29 Oc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000092845 [0,1,0,0,0,0|2,1,0]=4 365 B15R2.29 Oc1cnc(nc1)Sc2ccccc2 62a_100000730009_100000041952 [0,1,0,0,0,0|2,1,0]=4 366 B15R2.29 [O-][n+]1ccc(cc1)Sc2ccccc2 62a_100000719477_100000039755 [0,1,0,0,0,0|1,1,0]=3 367 B15R2.29 [O-][n+]1ccc(cc1)Sc2ccccn2 62a_100011216584_100000039755 [0,1,0,0,0,0|2,1,0]=4 368 B15R2.29 [O-][n+]1ccc(cc1)Sc2cccnc2 62a_100000210063_100000039755 [0,1,0,0,0,0|2,1,0]=4 369 B15R2.29 [O-][n+]1ccc(cc1)Sc2ccncc2 62a_100000728582_100000039755 [0,1,0,0,0,0|2,1,0]=4 370 B15R2.31 Brc1cc(ccn1)Sc2ccccc2 62a_100000719477_100009814637 [0,1,0,0,0,0|1,1,0]=3 371 B15R2.31 Brc1cc(ccn1)Sc2ccccc2 62a_100009814637_100000041952 [0,1,0,0,0,0|1,1,0]=3 372 B15R2.31 Brc1cc(ccn1)Sc2ccccn2 62a_100009814637_100011216584 [0,1,0,0,0,0|2,1,0]=4 373 B15R2.31 Brc1cc(ccn1)Sc2ccccn2 62a_100011216584_100009814637 [0,1,0,0,0,0|2,1,0]=4 374 B15R2.31 Brc1cc(ccn1)Sc2cccnc2 62a_100000210063_100009814637 [0,1,0,0,0,0|2,1,0]=4 375 B15R2.31 Brc1cc(ccn1)Sc2cccnc2 62a_100009814637_100000210063 [0,1,0,0,0,0|2,1,0]=4 376 B15R2.31 Brc1cc(ccn1)Sc2ccncc2 62a_100000728582_100009814637 [0,1,0,0,0,0|2,1,0]=4 377 B15R2.31 Brc1cc(ccn1)Sc2ccncc2 62a_100009814637_100000728582 [0,1,0,0,0,0|2,1,0]=4 378 B15R2.31 Brc1cccc(c1)Nc2cccnn2 27a_100000210019_100016991348 [0,1,0,0,0,0|3,0,0]=4 379 B15R2.31 Brc1cccc(c1)Nc2ccncn2 27a_100000210019_100000703185 [0,1,0,0,0,0|3,0,0]=4 380 B15R2.31 Brc1cccc(c1)Nc2cnccn2 27a_100000210019_100000211759 [0,1,0,0,0,0|3,0,0]=4 381 B15R2.31 Brc1cccc(c1)Nc2ncccn2 27a_100000210019_100000211032 [0,1,0,0,0,0|3,0,0]=4 382 B15R2.31 Brc1cccc(c1)Sc2ccccc2 62a_100000691529_100000041952 [0,1,0,0,0,0|0,1,0]=2 383 B15R2.31 Brc1cccc(c1)Sc2ccccc2 62a_100000719477_100000691529 [0,1,0,0,0,0|0,1,0]=2 384 B15R2.31 Brc1cccc(c1)Sc2ccccn2 62a_100000691529_100011216584 [0,1,0,0,0,0|1,1,0]=3 385 B15R2.31 Brc1cccc(c1)Sc2ccccn2 62a_100011216584_100000691529 [0,1,0,0,0,0|1,1,0]=3 386 B15R2.31 Brc1cccc(c1)Sc2cccnc2 62a_100000210063_100000691529 [0,1,0,0,0,0|1,1,0]=3 387 B15R2.31 Brc1cccc(c1)Sc2cccnc2 62a_100000691529_100000210063 [0,1,0,0,0,0|1,1,0]=3 388 B15R2.31 Brc1cccc(c1)Sc2cccnn2 62a_100000691529_100016991348 [0,1,0,0,0,0|2,1,0]=4 389 B15R2.31 Brc1cccc(c1)Sc2cccnn2 62a_100016991348_100000691529 [0,1,0,0,0,0|2,1,0]=4 390 B15R2.31 Brc1cccc(c1)Sc2ccncc2 62a_100000691529_100000728582 [0,1,0,0,0,0|1,1,0]=3 391 B15R2.31 Brc1cccc(c1)Sc2ccncc2 62a_100000728582_100000691529 [0,1,0,0,0,0|1,1,0]=3 392 B15R2.31 Brc1cccc(c1)Sc2ccncn2 62a_100000691529_100000703185 [0,1,0,0,0,0|2,1,0]=4 393 B15R2.31 Brc1cccc(c1)Sc2ccncn2 62a_100000703185_100000691529 [0,1,0,0,0,0|2,1,0]=4 394 B15R2.31 Brc1cccc(c1)Sc2ccnnc2 62a_100000691529_100000732662 [0,1,0,0,0,0|2,1,0]=4 395 B15R2.31 Brc1cccc(c1)Sc2ccnnc2 62a_100000732662_100000691529 [0,1,0,0,0,0|2,1,0]=4 396 B15R2.31 Brc1cccc(c1)Sc2cnccn2 62a_100000211759_100000691529 [0,1,0,0,0,0|2,1,0]=4 397 B15R2.31 Brc1cccc(c1)Sc2cnccn2 62a_100000691529_100000211759 [0,1,0,0,0,0|2,1,0]=4 398 B15R2.31 Brc1cccc(c1)Sc2cncnc2 62a_100000691529_100011206942 [0,1,0,0,0,0|2,1,0]=4 399 B15R2.31 Brc1cccc(c1)Sc2cncnc2 62a_100011206942_100000691529 [0,1,0,0,0,0|2,1,0]=4 400 B15R2.31 Brc1cccc(c1)Sc2ncccn2 62a_100000211032_100000691529 [0,1,0,0,0,0|2,1,0]=4 401 B15R2.31 Brc1cccc(c1)Sc2ncccn2 62a_100000691529_100000211032 [0,1,0,0,0,0|2,1,0]=4 402 B15R2.31 Brc1cccc(n1)Sc2ccccc2 62a_100000684672_100000041952 [0,1,0,0,0,0|1,1,0]=3 403 B15R2.31 Brc1cccc(n1)Sc2ccccc2 62a_100000719477_100000684672 [0,1,0,0,0,0|1,1,0]=3 404 B15R2.31 Brc1cccc(n1)Sc2ccccn2 62a_100000684672_100011216584 [0,1,0,0,0,0|2,1,0]=4 405 B15R2.31 Brc1cccc(n1)Sc2ccccn2 62a_100011216584_100000684672 [0,1,0,0,0,0|2,1,0]=4 406 B15R2.31 Brc1cccc(n1)Sc2cccnc2 62a_100000210063_100000684672 [0,1,0,0,0,0|2,1,0]=4 407 B15R2.31 Brc1cccc(n1)Sc2cccnc2 62a_100000684672_100000210063 [0,1,0,0,0,0|2,1,0]=4 408 B15R2.31 Brc1cccc(n1)Sc2ccncc2 62a_100000684672_100000728582 [0,1,0,0,0,0|2,1,0]=4 409 B15R2.31 Brc1cccc(n1)Sc2ccncc2 62a_100000728582_100000684672 [0,1,0,0,0,0|2,1,0]=4 410 B15R2.31 Brc1cncc(c1)Sc2ccccc2 62a_100000719477_100000728054 [0,1,0,0,0,0|1,1,0]=3 411 B15R2.31 Brc1cncc(c1)Sc2ccccc2 62a_100000728054_100000041952 [0,1,0,0,0,0|1,1,0]=3 412 B15R2.31 Brc1cncc(c1)Sc2ccccn2 62a_100000728054_100011216584 [0,1,0,0,0,0|2,1,0]=4 413 B15R2.31 Brc1cncc(c1)Sc2ccccn2 62a_100011216584_100000728054 [0,1,0,0,0,0|2,1,0]=4 414 B15R2.31 Brc1cncc(c1)Sc2cccnc2 62a_100000210063_100000728054 [0,1,0,0,0,0|2,1,0]=4 415 B15R2.31 Brc1cncc(c1)Sc2cccnc2 62a_100000728054_100000210063 [0,1,0,0,0,0|2,1,0]=4 416 B15R2.31 Brc1cncc(c1)Sc2ccncc2 62a_100000728054_100000728582 [0,1,0,0,0,0|2,1,0]=4 417 B15R2.31 Brc1cncc(c1)Sc2ccncc2 62a_100000728582_100000728054 [0,1,0,0,0,0|2,1,0]=4 418 B15R2.31 C[n+]1cccc(c1)Sc2ccccc2 62a_100000719477_100009996589 [0,1,0,0,0,0|1,1,0]=3 419 B15R2.31 C[n+]1cccc(c1)Sc2ccccc2 62a_100009996589_100000041952 [0,1,0,0,0,0|1,1,0]=3 420 B15R2.31 C[n+]1cccc(c1)Sc2ccccn2 62a_100009996589_100011216584 [0,1,0,0,0,0|2,1,0]=4 421 B15R2.31 C[n+]1cccc(c1)Sc2ccccn2 62a_100011216584_100009996589 [0,1,0,0,0,0|2,1,0]=4 422 B15R2.31 C[n+]1cccc(c1)Sc2cccnc2 62a_100000210063_100009996589 [0,1,0,0,0,0|2,1,0]=4 423 B15R2.31 C[n+]1cccc(c1)Sc2cccnc2 62a_100009996589_100000210063 [0,1,0,0,0,0|2,1,0]=4 424 B15R2.31 C[n+]1cccc(c1)Sc2ccncc2 62a_100000728582_100009996589 [0,1,0,0,0,0|2,1,0]=4 425 B15R2.31 C[n+]1cccc(c1)Sc2ccncc2 62a_100009996589_100000728582 [0,1,0,0,0,0|2,1,0]=4 426 B15R2.31 Cc1cc(ccn1)Nc2ccccc2 27a_100000106764_100000758586 [0,1,0,0,0,0|2,0,0]=3 427 B15R2.31 Cc1cc(ccn1)Sc2ccccc2 62a_100000719477_100000758586 [0,1,0,0,0,0|1,1,0]=3 428 B15R2.31 Cc1cc(ccn1)Sc2ccccc2 62a_100000758586_100000041952 [0,1,0,0,0,0|1,1,0]=3 429 B15R2.31 Cc1cc(ccn1)Sc2ccccn2 62a_100000758586_100011216584 [0,1,0,0,0,0|2,1,0]=4 430 B15R2.31 Cc1cc(ccn1)Sc2ccccn2 62a_100011216584_100000758586 [0,1,0,0,0,0|2,1,0]=4 431 B15R2.31 Cc1cc(ccn1)Sc2cccnc2 62a_100000210063_100000758586 [0,1,0,0,0,0|2,1,0]=4 432 B15R2.31 Cc1cc(ccn1)Sc2cccnc2 62a_100000758586_100000210063 [0,1,0,0,0,0|2,1,0]=4 433 B15R2.31 Cc1cc(ccn1)Sc2ccncc2 62a_100000728582_100000758586 [0,1,0,0,0,0|2,1,0]=4 434 B15R2.31 Cc1cc(ccn1)Sc2ccncc2 62a_100000758586_100000728582 [0,1,0,0,0,0|2,1,0]=4 435 B15R2.31 Cc1cc(ncn1)Nc2ccccc2 27a_100000106764_100000744208 [0,1,0,0,0,0|3,0,0]=4 436 B15R2.31 Cc1cc(ncn1)Sc2ccccc2 62a_100000719477_100000744208 [0,1,0,0,0,0|2,1,0]=4 437 B15R2.31 Cc1cc(ncn1)Sc2ccccc2 62a_100000744208_100000041952 [0,1,0,0,0,0|2,1,0]=4 438 B15R2.31 Cc1cccc(c1)Nc2cccnn2 27a_100000188690_100016991348 [0,1,0,0,0,0|3,0,0]=4 439 B15R2.31 Cc1cccc(c1)Nc2ccncn2 27a_100000188690_100000703185 [0,1,0,0,0,0|3,0,0]=4 440 B15R2.31 Cc1cccc(c1)Nc2cnccn2 27a_100000188690_100000211759 [0,1,0,0,0,0|3,0,0]=4 441 B15R2.31 Cc1cccc(c1)Nc2ncccn2 27a_100000188690_100000211032 [0,1,0,0,0,0|3,0,0]=4 442 B15R2.31 Cc1cccc(c1)Sc2ccccc2 62a_100000719477_100011215228 [0,1,0,0,0,0|0,1,0]=2 443 B15R2.31 Cc1cccc(c1)Sc2ccccc2 62a_100011215228_100000041952 [0,1,0,0,0,0|0,1,0]=2 444 B15R2.31 Cc1cccc(c1)Sc2ccccn2 62a_100011215228_100011216584 [0,1,0,0,0,0|1,1,0]=3 445 B15R2.31 Cc1cccc(c1)Sc2ccccn2 62a_100011216584_100011215228 [0,1,0,0,0,0|1,1,0]=3 446 B15R2.31 Cc1cccc(c1)Sc2cccnc2 62a_100000210063_100011215228 [0,1,0,0,0,0|1,1,0]=3 447 B15R2.31 Cc1cccc(c1)Sc2cccnc2 62a_100011215228_100000210063 [0,1,0,0,0,0|1,1,0]=3 448 B15R2.31 Cc1cccc(c1)Sc2cccnn2 62a_100011215228_100016991348 [0,1,0,0,0,0|2,1,0]=4 449 B15R2.31 Cc1cccc(c1)Sc2cccnn2 62a_100016991348_100011215228 [0,1,0,0,0,0|2,1,0]=4 450 B15R2.31 Cc1cccc(c1)Sc2ccncc2 62a_100000728582_100011215228 [0,1,0,0,0,0|1,1,0]=3 451 B15R2.31 Cc1cccc(c1)Sc2ccncc2 62a_100011215228_100000728582 [0,1,0,0,0,0|1,1,0]=3 452 B15R2.31 Cc1cccc(c1)Sc2ccncn2 62a_100000703185_100011215228 [0,1,0,0,0,0|2,1,0]=4 453 B15R2.31 Cc1cccc(c1)Sc2ccncn2 62a_100011215228_100000703185 [0,1,0,0,0,0|2,1,0]=4 454 B15R2.31 Cc1cccc(c1)Sc2ccnnc2 62a_100000732662_100011215228 [0,1,0,0,0,0|2,1,0]=4 455 B15R2.31 Cc1cccc(c1)Sc2ccnnc2 62a_100011215228_100000732662 [0,1,0,0,0,0|2,1,0]=4 456 B15R2.31 Cc1cccc(c1)Sc2cnccn2 62a_100000211759_100011215228 [0,1,0,0,0,0|2,1,0]=4 457 B15R2.31 Cc1cccc(c1)Sc2cnccn2 62a_100011215228_100000211759 [0,1,0,0,0,0|2,1,0]=4 458 B15R2.31 Cc1cccc(c1)Sc2cncnc2 62a_100011206942_100011215228 [0,1,0,0,0,0|2,1,0]=4 459 B15R2.31 Cc1cccc(c1)Sc2cncnc2 62a_100011215228_100011206942 [0,1,0,0,0,0|2,1,0]=4 460 B15R2.31 Cc1cccc(c1)Sc2ncccn2 62a_100000211032_100011215228 [0,1,0,0,0,0|2,1,0]=4 461 B15R2.31 Cc1cccc(c1)Sc2ncccn2 62a_100011215228_100000211032 [0,1,0,0,0,0|2,1,0]=4 462 B15R2.31 Cc1cccc(n1)Sc2ccccc2 62a_100000719477_100000742759 [0,1,0,0,0,0|1,1,0]=3 463 B15R2.31 Cc1cccc(n1)Sc2ccccc2 62a_100000742759_100000041952 [0,1,0,0,0,0|1,1,0]=3 464 B15R2.31 Cc1cccc(n1)Sc2ccccn2 62a_100000742759_100011216584 [0,1,0,0,0,0|2,1,0]=4 465 B15R2.31 Cc1cccc(n1)Sc2ccccn2 62a_100011216584_100000742759 [0,1,0,0,0,0|2,1,0]=4 466 B15R2.31 Cc1cccc(n1)Sc2cccnc2 62a_100000210063_100000742759 [0,1,0,0,0,0|2,1,0]=4 467 B15R2.31 Cc1cccc(n1)Sc2cccnc2 62a_100000742759_100000210063 [0,1,0,0,0,0|2,1,0]=4 468 B15R2.31 Cc1cccc(n1)Sc2ccncc2 62a_100000728582_100000742759 [0,1,0,0,0,0|2,1,0]=4 469 B15R2.31 Cc1cccc(n1)Sc2ccncc2 62a_100000742759_100000728582 [0,1,0,0,0,0|2,1,0]=4 470 B15R2.31 Cc1ccnc(c1)Sc2ccccc2 62a_100000719477_100000750283 [0,1,0,0,0,0|1,1,0]=3 471 B15R2.31 Cc1ccnc(c1)Sc2ccccc2 62a_100000750283_100000041952 [0,1,0,0,0,0|1,1,0]=3 472 B15R2.31 Cc1ccnc(c1)Sc2ccccn2 62a_100000750283_100011216584 [0,1,0,0,0,0|2,1,0]=4 473 B15R2.31 Cc1ccnc(c1)Sc2ccccn2 62a_100011216584_100000750283 [0,1,0,0,0,0|2,1,0]=4 474 B15R2.31 Cc1ccnc(c1)Sc2cccnc2 62a_100000210063_100000750283 [0,1,0,0,0,0|2,1,0]=4 475 B15R2.31 Cc1ccnc(c1)Sc2cccnc2 62a_100000750283_100000210063 [0,1,0,0,0,0|2,1,0]=4 476 B15R2.31 Cc1ccnc(c1)Sc2ccncc2 62a_100000728582_100000750283 [0,1,0,0,0,0|2,1,0]=4 477 B15R2.31 Cc1ccnc(c1)Sc2ccncc2 62a_100000750283_100000728582 [0,1,0,0,0,0|2,1,0]=4 478 B15R2.31 Cc1ccnc(n1)Nc2ccccc2 27a_100000106764_100000750684 [0,1,0,0,0,0|3,0,0]=4 479 B15R2.31 Cc1ccnc(n1)Sc2ccccc2 62a_100000719477_100011243806 [0,1,0,0,0,0|2,1,0]=4 480 B15R2.31 Cc1ccnc(n1)Sc2ccccc2 62a_100011243806_100000041952 [0,1,0,0,0,0|2,1,0]=4 481 B15R2.31 Cc1cncc(c1)Sc2ccccc2 62a_100000719477_100000760492 [0,1,0,0,0,0|1,1,0]=3 482 B15R2.31 Cc1cncc(c1)Sc2ccccc2 62a_100000760492_100000041952 [0,1,0,0,0,0|1,1,0]=3 483 B15R2.31 Cc1cncc(c1)Sc2ccccn2 62a_100000760492_100011216584 [0,1,0,0,0,0|2,1,0]=4 484 B15R2.31 Cc1cncc(c1)Sc2ccccn2 62a_100011216584_100000760492 [0,1,0,0,0,0|2,1,0]=4 485 B15R2.31 Cc1cncc(c1)Sc2cccnc2 62a_100000210063_100000760492 [0,1,0,0,0,0|2,1,0]=4 486 B15R2.31 Cc1cncc(c1)Sc2cccnc2 62a_100000760492_100000210063 [0,1,0,0,0,0|2,1,0]=4 487 B15R2.31 Cc1cncc(c1)Sc2ccncc2 62a_100000728582_100000760492 [0,1,0,0,0,0|2,1,0]=4 488 B15R2.31 Cc1cncc(c1)Sc2ccncc2 62a_100000760492_100000728582 [0,1,0,0,0,0|2,1,0]=4 489 B15R2.31 Cc1cncc(n1)Nc2ccccc2 27a_100000106764_100000754123 [0,1,0,0,0,0|3,0,0]=4 490 B15R2.31 Cc1cncc(n1)Sc2ccccc2 62a_100000719477_100000754123 [0,1,0,0,0,0|2,1,0]=4 491 B15R2.31 Cc1cncc(n1)Sc2ccccc2 62a_100000754123_100000041952 [0,1,0,0,0,0|2,1,0]=4 492 B15R2.31 Cc1cnnc(c1)Nc2ccccc2 27a_100000106764_100000070100 [0,1,0,0,0,0|3,0,0]=4 493 B15R2.31 Cc1cnnc(c1)Sc2ccccc2 62a_100000070100_100000041952 [0,1,0,0,0,0|2,1,0]=4 494 B15R2.31 Cc1cnnc(c1)Sc2ccccc2 62a_100000719477_100000070100 [0,1,0,0,0,0|2,1,0]=4 495 B15R2.31 Cc1nccc(n1)Nc2ccccc2 27a_100000106764_100000749937 [0,1,0,0,0,0|3,0,0]=4 496 B15R2.31 Cc1nccc(n1)Sc2ccccc2 62a_100000719477_100000749937 [0,1,0,0,0,0|2,1,0]=4 497 B15R2.31 Cc1nccc(n1)Sc2ccccc2 62a_100000749937_100000041952 [0,1,0,0,0,0|2,1,0]=4 498 B15R2.31 Clc1cc(ccn1)Sc2ccccc2 62a_100000035001_100000041952 [0,1,0,0,0,0|1,1,0]=3 499 B15R2.31 Clc1cc(ccn1)Sc2ccccc2 62a_100000719477_100000035001 [0,1,0,0,0,0|1,1,0]=3 500 B15R2.31 Clc1cc(ccn1)Sc2ccccn2 62a_100000035001_100011216584 [0,1,0,0,0,0|2,1,0]=4 501 B15R2.31 Clc1cc(ccn1)Sc2ccccn2 62a_100011216584_100000035001 [0,1,0,0,0,0|2,1,0]=4 502 B15R2.31 Clc1cc(ccn1)Sc2cccnc2 62a_100000035001_100000210063 [0,1,0,0,0,0|2,1,0]=4 503 B15R2.31 Clc1cc(ccn1)Sc2cccnc2 62a_100000210063_100000035001 [0,1,0,0,0,0|2,1,0]=4 504 B15R2.31 Clc1cc(ccn1)Sc2ccncc2 62a_100000035001_100000728582 [0,1,0,0,0,0|2,1,0]=4 505 B15R2.31 Clc1cc(ccn1)Sc2ccncc2 62a_100000728582_100000035001 [0,1,0,0,0,0|2,1,0]=4 506 B15R2.31 Clc1cc(ncn1)Sc2ccccc2 62a_100000719477_100010161198 [0,1,0,0,0,0|2,1,0]=4 507 B15R2.31 Clc1cc(ncn1)Sc2ccccc2 62a_100010161198_100000041952 [0,1,0,0,0,0|2,1,0]=4 508 B15R2.31 Clc1cccc(c1)Nc2cccnn2 27a_100000185859_100016991348 [0,1,0,0,0,0|3,0,0]=4 509 B15R2.31 Clc1cccc(c1)Nc2ccncn2 27a_100000185859_100000703185 [0,1,0,0,0,0|3,0,0]=4 510 B15R2.31 Clc1cccc(c1)Nc2cnccn2 27a_100000185859_100000211759 [0,1,0,0,0,0|3,0,0]=4 511 B15R2.31 Clc1cccc(c1)Nc2ncccn2 27a_100000185859_100000211032 [0,1,0,0,0,0|3,0,0]=4 512 B15R2.31 Clc1cccc(c1)Sc2ccccc2 62a_100000699651_100000041952 [0,1,0,0,0,0|0,1,0]=2 513 B15R2.31 Clc1cccc(c1)Sc2ccccc2 62a_100000719477_100000699651 [0,1,0,0,0,0|0,1,0]=2 514 B15R2.31 Clc1cccc(c1)Sc2ccccn2 62a_100000699651_100011216584 [0,1,0,0,0,0|1,1,0]=3 515 B15R2.31 Clc1cccc(c1)Sc2ccccn2 62a_100011216584_100000699651 [0,1,0,0,0,0|1,1,0]=3 516 B15R2.31 Clc1cccc(c1)Sc2cccnc2 62a_100000210063_100000699651 [0,1,0,0,0,0|1,1,0]=3 517 B15R2.31 Clc1cccc(c1)Sc2cccnc2 62a_100000699651_100000210063 [0,1,0,0,0,0|1,1,0]=3 518 B15R2.31 Clc1cccc(c1)Sc2cccnn2 62a_100000699651_100016991348 [0,1,0,0,0,0|2,1,0]=4 519 B15R2.31 Clc1cccc(c1)Sc2cccnn2 62a_100016991348_100000699651 [0,1,0,0,0,0|2,1,0]=4 520 B15R2.31 Clc1cccc(c1)Sc2ccncc2 62a_100000699651_100000728582 [0,1,0,0,0,0|1,1,0]=3 521 B15R2.31 Clc1cccc(c1)Sc2ccncc2 62a_100000728582_100000699651 [0,1,0,0,0,0|1,1,0]=3 522 B15R2.31 Clc1cccc(c1)Sc2ccncn2 62a_100000699651_100000703185 [0,1,0,0,0,0|2,1,0]=4 523 B15R2.31 Clc1cccc(c1)Sc2ccncn2 62a_100000703185_100000699651 [0,1,0,0,0,0|2,1,0]=4 524 B15R2.31 Clc1cccc(c1)Sc2ccnnc2 62a_100000699651_100000732662 [0,1,0,0,0,0|2,1,0]=4 525 B15R2.31 Clc1cccc(c1)Sc2ccnnc2 62a_100000732662_100000699651 [0,1,0,0,0,0|2,1,0]=4 526 B15R2.31 Clc1cccc(c1)Sc2cnccn2 62a_100000211759_100000699651 [0,1,0,0,0,0|2,1,0]=4 527 B15R2.31 Clc1cccc(c1)Sc2cnccn2 62a_100000699651_100000211759 [0,1,0,0,0,0|2,1,0]=4 528 B15R2.31 Clc1cccc(c1)Sc2cncnc2 62a_100000699651_100011206942 [0,1,0,0,0,0|2,1,0]=4 529 B15R2.31 Clc1cccc(c1)Sc2cncnc2 62a_100011206942_100000699651 [0,1,0,0,0,0|2,1,0]=4 530 B15R2.31 Clc1cccc(c1)Sc2ncccn2 62a_100000211032_100000699651 [0,1,0,0,0,0|2,1,0]=4 531 B15R2.31 Clc1cccc(c1)Sc2ncccn2 62a_100000699651_100000211032 [0,1,0,0,0,0|2,1,0]=4 532 B15R2.31 Clc1cccc(n1)Sc2ccccc2 62a_100000051397_100000041952 [0,1,0,0,0,0|1,1,0]=3 533 B15R2.31 Clc1cccc(n1)Sc2ccccc2 62a_100000719477_100000051397 [0,1,0,0,0,0|1,1,0]=3 534 B15R2.31 Clc1cccc(n1)Sc2ccccn2 62a_100000051397_100011216584 [0,1,0,0,0,0|2,1,0]=4 535 B15R2.31 Clc1cccc(n1)Sc2ccccn2 62a_100011216584_100000051397 [0,1,0,0,0,0|2,1,0]=4 536 B15R2.31 Clc1cccc(n1)Sc2cccnc2 62a_100000051397_100000210063 [0,1,0,0,0,0|2,1,0]=4 537 B15R2.31 Clc1cccc(n1)Sc2cccnc2 62a_100000210063_100000051397 [0,1,0,0,0,0|2,1,0]=4 538 B15R2.31 Clc1cccc(n1)Sc2ccncc2 62a_100000051397_100000728582 [0,1,0,0,0,0|2,1,0]=4 539 B15R2.31 Clc1cccc(n1)Sc2ccncc2 62a_100000728582_100000051397 [0,1,0,0,0,0|2,1,0]=4 540 B15R2.31 Clc1ccnc(c1)Sc2ccccc2 62a_100000719477_100010167805 [0,1,0,0,0,0|1,1,0]=3 541 B15R2.31 Clc1ccnc(c1)Sc2ccccc2 62a_100010167805_100000041952 [0,1,0,0,0,0|1,1,0]=3 542 B15R2.31 Clc1ccnc(c1)Sc2ccccn2 62a_100010167805_100011216584 [0,1,0,0,0,0|2,1,0]=4 543 B15R2.31 Clc1ccnc(c1)Sc2ccccn2 62a_100011216584_100010167805 [0,1,0,0,0,0|2,1,0]=4 544 B15R2.31 Clc1ccnc(c1)Sc2cccnc2 62a_100000210063_100010167805 [0,1,0,0,0,0|2,1,0]=4 545 B15R2.31 Clc1ccnc(c1)Sc2cccnc2 62a_100010167805_100000210063 [0,1,0,0,0,0|2,1,0]=4 546 B15R2.31 Clc1ccnc(c1)Sc2ccncc2 62a_100000728582_100010167805 [0,1,0,0,0,0|2,1,0]=4 547 B15R2.31 Clc1ccnc(c1)Sc2ccncc2 62a_100010167805_100000728582 [0,1,0,0,0,0|2,1,0]=4 548 B15R2.31 Clc1cncc(c1)Sc2ccccc2 62a_100000049639_100000041952 [0,1,0,0,0,0|1,1,0]=3 549 B15R2.31 Clc1cncc(c1)Sc2ccccc2 62a_100000719477_100000049639 [0,1,0,0,0,0|1,1,0]=3 550 B15R2.31 Clc1cncc(c1)Sc2ccccn2 62a_100000049639_100011216584 [0,1,0,0,0,0|2,1,0]=4 551 B15R2.31 Clc1cncc(c1)Sc2ccccn2 62a_100011216584_100000049639 [0,1,0,0,0,0|2,1,0]=4 552 B15R2.31 Clc1cncc(c1)Sc2cccnc2 62a_100000049639_100000210063 [0,1,0,0,0,0|2,1,0]=4 553 B15R2.31 Clc1cncc(c1)Sc2cccnc2 62a_100000210063_100000049639 [0,1,0,0,0,0|2,1,0]=4 554 B15R2.31 Clc1cncc(c1)Sc2ccncc2 62a_100000049639_100000728582 [0,1,0,0,0,0|2,1,0]=4 555 B15R2.31 Clc1cncc(c1)Sc2ccncc2 62a_100000728582_100000049639 [0,1,0,0,0,0|2,1,0]=4 556 B15R2.31 Clc1cncc(n1)Nc2ccccc2 27a_100000106764_100010892449 [0,1,0,0,0,0|3,0,0]=4 557 B15R2.31 Clc1cncc(n1)Sc2ccccc2 62a_100000719477_100010892449 [0,1,0,0,0,0|2,1,0]=4 558 B15R2.31 Clc1cncc(n1)Sc2ccccc2 62a_100010892449_100000041952 [0,1,0,0,0,0|2,1,0]=4 559 B15R2.31 Clc1nccc(n1)Sc2ccccc2 62a_100000719477_100010154678 [0,1,0,0,0,0|2,1,0]=4 560 B15R2.31 Clc1nccc(n1)Sc2ccccc2 62a_100010154678_100000041952 [0,1,0,0,0,0|2,1,0]=4 561 B15R2.31 Fc1cc(ccn1)Nc2ccccc2 27a_100000106764_100009816116 [0,1,0,0,0,0|2,0,0]=3 562 B15R2.31 Fc1cc(ccn1)Sc2ccccc2 62a_100000719477_100009816116 [0,1,0,0,0,0|1,1,0]=3 563 B15R2.31 Fc1cc(ccn1)Sc2ccccc2 62a_100009816116_100000041952 [0,1,0,0,0,0|1,1,0]=3 564 B15R2.31 Fc1cc(ccn1)Sc2ccccn2 62a_100009816116_100011216584 [0,1,0,0,0,0|2,1,0]=4 565 B15R2.31 Fc1cc(ccn1)Sc2ccccn2 62a_100011216584_100009816116 [0,1,0,0,0,0|2,1,0]=4 566 B15R2.31 Fc1cc(ccn1)Sc2cccnc2 62a_100000210063_100009816116 [0,1,0,0,0,0|2,1,0]=4 567 B15R2.31 Fc1cc(ccn1)Sc2cccnc2 62a_100009816116_100000210063 [0,1,0,0,0,0|2,1,0]=4 568 B15R2.31 Fc1cc(ccn1)Sc2ccncc2 62a_100000728582_100009816116 [0,1,0,0,0,0|2,1,0]=4 569 B15R2.31 Fc1cc(ccn1)Sc2ccncc2 62a_100009816116_100000728582 [0,1,0,0,0,0|2,1,0]=4 570 B15R2.31 Fc1cc(ncn1)Nc2ccccc2 27a_100000106764_200009880791 [0,1,0,0,0,0|3,0,0]=4 571 B15R2.31 Fc1cc(ncn1)Sc2ccccc2 62a_100000719477_200009880791 [0,1,0,0,0,0|2,1,0]=4 572 B15R2.31 Fc1cc(ncn1)Sc2ccccc2 62a_200009880791_100000041952 [0,1,0,0,0,0|2,1,0]=4 573 B15R2.31 Fc1cccc(c1)Nc2cccnn2 27a_100000210047_100016991348 [0,1,0,0,0,0|3,0,0]=4 574 B15R2.31 Fc1cccc(c1)Nc2ccncn2 27a_100000210047_100000703185 [0,1,0,0,0,0|3,0,0]=4 575 B15R2.31 Fc1cccc(c1)Nc2cnccn2 27a_100000210047_100000211759 [0,1,0,0,0,0|3,0,0]=4 576 B15R2.31 Fc1cccc(c1)Nc2ncccn2 27a_100000210047_100000211032 [0,1,0,0,0,0|3,0,0]=4 577 B15R2.31 Fc1cccc(c1)Sc2ccccc2 62a_100000685547_100000041952 [0,1,0,0,0,0|0,1,0]=2 578 B15R2.31 Fc1cccc(c1)Sc2ccccc2 62a_100000719477_100000685547 [0,1,0,0,0,0|0,1,0]=2 579 B15R2.31 Fc1cccc(c1)Sc2ccccn2 62a_100000685547_100011216584 [0,1,0,0,0,0|1,1,0]=3 580 B15R2.31 Fc1cccc(c1)Sc2ccccn2 62a_100011216584_100000685547 [0,1,0,0,0,0|1,1,0]=3 581 B15R2.31 Fc1cccc(c1)Sc2cccnc2 62a_100000210063_100000685547 [0,1,0,0,0,0|1,1,0]=3 582 B15R2.31 Fc1cccc(c1)Sc2cccnc2 62a_100000685547_100000210063 [0,1,0,0,0,0|1,1,0]=3 583 B15R2.31 Fc1cccc(c1)Sc2cccnn2 62a_100000685547_100016991348 [0,1,0,0,0,0|2,1,0]=4 584 B15R2.31 Fc1cccc(c1)Sc2cccnn2 62a_100016991348_100000685547 [0,1,0,0,0,0|2,1,0]=4 585 B15R2.31 Fc1cccc(c1)Sc2ccncc2 62a_100000685547_100000728582 [0,1,0,0,0,0|1,1,0]=3 586 B15R2.31 Fc1cccc(c1)Sc2ccncc2 62a_100000728582_100000685547 [0,1,0,0,0,0|1,1,0]=3 587 B15R2.31 Fc1cccc(c1)Sc2ccncn2 62a_100000685547_100000703185 [0,1,0,0,0,0|2,1,0]=4 588 B15R2.31 Fc1cccc(c1)Sc2ccncn2 62a_100000703185_100000685547 [0,1,0,0,0,0|2,1,0]=4 589 B15R2.31 Fc1cccc(c1)Sc2ccnnc2 62a_100000685547_100000732662 [0,1,0,0,0,0|2,1,0]=4 590 B15R2.31 Fc1cccc(c1)Sc2ccnnc2 62a_100000732662_100000685547 [0,1,0,0,0,0|2,1,0]=4 591 B15R2.31 Fc1cccc(c1)Sc2cnccn2 62a_100000211759_100000685547 [0,1,0,0,0,0|2,1,0]=4 592 B15R2.31 Fc1cccc(c1)Sc2cnccn2 62a_100000685547_100000211759 [0,1,0,0,0,0|2,1,0]=4 593 B15R2.31 Fc1cccc(c1)Sc2cncnc2 62a_100000685547_100011206942 [0,1,0,0,0,0|2,1,0]=4 594 B15R2.31 Fc1cccc(c1)Sc2cncnc2 62a_100011206942_100000685547 [0,1,0,0,0,0|2,1,0]=4 595 B15R2.31 Fc1cccc(c1)Sc2ncccn2 62a_100000211032_100000685547 [0,1,0,0,0,0|2,1,0]=4 596 B15R2.31 Fc1cccc(c1)Sc2ncccn2 62a_100000685547_100000211032 [0,1,0,0,0,0|2,1,0]=4 597 B15R2.31 Fc1cccc(n1)Nc2ccccc2 27a_100000106764_100009815982 [0,1,0,0,0,0|2,0,0]=3 598 B15R2.31 Fc1cccc(n1)Sc2ccccc2 62a_100000719477_100009815982 [0,1,0,0,0,0|1,1,0]=3 599 B15R2.31 Fc1cccc(n1)Sc2ccccc2 62a_100009815982_100000041952 [0,1,0,0,0,0|1,1,0]=3 600 B15R2.31 Fc1cccc(n1)Sc2ccccn2 62a_100009815982_100011216584 [0,1,0,0,0,0|2,1,0]=4 601 B15R2.31 Fc1cccc(n1)Sc2ccccn2 62a_100011216584_100009815982 [0,1,0,0,0,0|2,1,0]=4 602 B15R2.31 Fc1cccc(n1)Sc2cccnc2 62a_100000210063_100009815982 [0,1,0,0,0,0|2,1,0]=4 603 B15R2.31 Fc1cccc(n1)Sc2cccnc2 62a_100009815982_100000210063 [0,1,0,0,0,0|2,1,0]=4 604 B15R2.31 Fc1cccc(n1)Sc2ccncc2 62a_100000728582_100009815982 [0,1,0,0,0,0|2,1,0]=4 605 B15R2.31 Fc1cccc(n1)Sc2ccncc2 62a_100009815982_100000728582 [0,1,0,0,0,0|2,1,0]=4 606 B15R2.31 Fc1ccnc(c1)Nc2ccccc2 27a_100000106764_100000764206 [0,1,0,0,0,0|2,0,0]=3 607 B15R2.31 Fc1ccnc(c1)Sc2ccccc2 62a_100000719477_100000764206 [0,1,0,0,0,0|1,1,0]=3 608 B15R2.31 Fc1ccnc(c1)Sc2ccccc2 62a_100000764206_100000041952 [0,1,0,0,0,0|1,1,0]=3 609 B15R2.31 Fc1ccnc(c1)Sc2ccccn2 62a_100000764206_100011216584 [0,1,0,0,0,0|2,1,0]=4 610 B15R2.31 Fc1ccnc(c1)Sc2ccccn2 62a_100011216584_100000764206 [0,1,0,0,0,0|2,1,0]=4 611 B15R2.31 Fc1ccnc(c1)Sc2cccnc2 62a_100000210063_100000764206 [0,1,0,0,0,0|2,1,0]=4 612 B15R2.31 Fc1ccnc(c1)Sc2cccnc2 62a_100000764206_100000210063 [0,1,0,0,0,0|2,1,0]=4 613 B15R2.31 Fc1ccnc(c1)Sc2ccncc2 62a_100000728582_100000764206 [0,1,0,0,0,0|2,1,0]=4 614 B15R2.31 Fc1ccnc(c1)Sc2ccncc2 62a_100000764206_100000728582 [0,1,0,0,0,0|2,1,0]=4 615 B15R2.31 Fc1cncc(c1)Sc2ccccc2 62a_100000719477_100000744099 [0,1,0,0,0,0|1,1,0]=3 616 B15R2.31 Fc1cncc(c1)Sc2ccccc2 62a_100000744099_100000041952 [0,1,0,0,0,0|1,1,0]=3 617 B15R2.31 Fc1cncc(c1)Sc2ccccn2 62a_100000744099_100011216584 [0,1,0,0,0,0|2,1,0]=4 618 B15R2.31 Fc1cncc(c1)Sc2ccccn2 62a_100011216584_100000744099 [0,1,0,0,0,0|2,1,0]=4 619 B15R2.31 Fc1cncc(c1)Sc2cccnc2 62a_100000210063_100000744099 [0,1,0,0,0,0|2,1,0]=4 620 B15R2.31 Fc1cncc(c1)Sc2cccnc2 62a_100000744099_100000210063 [0,1,0,0,0,0|2,1,0]=4 621 B15R2.31 Fc1cncc(c1)Sc2ccncc2 62a_100000728582_100000744099 [0,1,0,0,0,0|2,1,0]=4 622 B15R2.31 Fc1cncc(c1)Sc2ccncc2 62a_100000744099_100000728582 [0,1,0,0,0,0|2,1,0]=4 623 B15R2.31 Fc1cncc(n1)Nc2ccccc2 27a_100000106764_200009863489 [0,1,0,0,0,0|3,0,0]=4 624 B15R2.31 Fc1cncc(n1)Sc2ccccc2 62a_100000719477_200009863489 [0,1,0,0,0,0|2,1,0]=4 625 B15R2.31 Fc1cncc(n1)Sc2ccccc2 62a_200009863489_100000041952 [0,1,0,0,0,0|2,1,0]=4 626 B15R2.31 Ic1cccc(c1)Nc2cccnn2 27a_100000211102_100016991348 [0,1,0,0,0,0|3,0,0]=4 627 B15R2.31 Ic1cccc(c1)Nc2ccncn2 27a_100000211102_100000703185 [0,1,0,0,0,0|3,0,0]=4 628 B15R2.31 Ic1cccc(c1)Nc2cnccn2 27a_100000211102_100000211759 [0,1,0,0,0,0|3,0,0]=4 629 B15R2.31 Ic1cccc(c1)Nc2ncccn2 27a_100000211102_100000211032 [0,1,0,0,0,0|3,0,0]=4 630 B15R2.31 Nc1cc(ccn1)Sc2ccccc2 62a_100000049665_100000041952 [0,1,0,0,0,0|1,1,0]=3 631 B15R2.31 Nc1cc(ccn1)Sc2ccccc2 62a_100000719477_100000049665 [0,1,0,0,0,0|1,1,0]=3 632 B15R2.31 Nc1cc(ccn1)Sc2ccccn2 62a_100000049665_100011216584 [0,1,0,0,0,0|2,1,0]=4 633 B15R2.31 Nc1cc(ccn1)Sc2ccccn2 62a_100011216584_100000049665 [0,1,0,0,0,0|2,1,0]=4 634 B15R2.31 Nc1cc(ccn1)Sc2cccnc2 62a_100000049665_100000210063 [0,1,0,0,0,0|2,1,0]=4 635 B15R2.31 Nc1cc(ccn1)Sc2cccnc2 62a_100000210063_100000049665 [0,1,0,0,0,0|2,1,0]=4 636 B15R2.31 Nc1cc(ccn1)Sc2ccncc2 62a_100000049665_100000728582 [0,1,0,0,0,0|2,1,0]=4 637 B15R2.31 Nc1cc(ccn1)Sc2ccncc2 62a_100000728582_100000049665 [0,1,0,0,0,0|2,1,0]=4 638 B15R2.31 Nc1cc(cnn1)Sc2ccccc2 62a_100000130277_100000041952 [0,1,0,0,0,0|2,1,0]=4 639 B15R2.31 Nc1cc(cnn1)Sc2ccccc2 62a_100000719477_100000130277 [0,1,0,0,0,0|2,1,0]=4 640 B15R2.31 Nc1cc(ncn1)Nc2ccccc2 27a_100000106764_100000701291 [0,1,0,0,0,0|3,0,0]=4 641 B15R2.31 Nc1cc(ncn1)Sc2ccccc2 62a_100000701291_100000041952 [0,1,0,0,0,0|2,1,0]=4 642 B15R2.31 Nc1cc(ncn1)Sc2ccccc2 62a_100000719477_100000701291 [0,1,0,0,0,0|2,1,0]=4 643 B15R2.31 Nc1cccc(c1)Sc2ccccc2 62a_100000210019_100000041952 [0,1,0,0,0,0|0,1,0]=2 644 B15R2.31 Nc1cccc(c1)Sc2ccccc2 62a_100000719477_100000210019 [0,1,0,0,0,0|0,1,0]=2 645 B15R2.31 Nc1cccc(c1)Sc2ccccn2 62a_100000210019_100011216584 [0,1,0,0,0,0|1,1,0]=3 646 B15R2.31 Nc1cccc(c1)Sc2ccccn2 62a_100011216584_100000210019 [0,1,0,0,0,0|1,1,0]=3 647 B15R2.31 Nc1cccc(c1)Sc2cccnc2 62a_100000210019_100000210063 [0,1,0,0,0,0|1,1,0]=3 648 B15R2.31 Nc1cccc(c1)Sc2cccnc2 62a_100000210063_100000210019 [0,1,0,0,0,0|1,1,0]=3 649 B15R2.31 Nc1cccc(c1)Sc2cccnn2 62a_100000210019_100016991348 [0,1,0,0,0,0|2,1,0]=4 650 B15R2.31 Nc1cccc(c1)Sc2cccnn2 62a_100016991348_100000210019 [0,1,0,0,0,0|2,1,0]=4 651 B15R2.31 Nc1cccc(c1)Sc2ccncc2 62a_100000210019_100000728582 [0,1,0,0,0,0|1,1,0]=3 652 B15R2.31 Nc1cccc(c1)Sc2ccncc2 62a_100000728582_100000210019 [0,1,0,0,0,0|1,1,0]=3 653 B15R2.31 Nc1cccc(c1)Sc2ccncn2 62a_100000210019_100000703185 [0,1,0,0,0,0|2,1,0]=4 654 B15R2.31 Nc1cccc(c1)Sc2ccncn2 62a_100000703185_100000210019 [0,1,0,0,0,0|2,1,0]=4 655 B15R2.31 Nc1cccc(c1)Sc2ccnnc2 62a_100000210019_100000732662 [0,1,0,0,0,0|2,1,0]=4 656 B15R2.31 Nc1cccc(c1)Sc2ccnnc2 62a_100000732662_100000210019 [0,1,0,0,0,0|2,1,0]=4 657 B15R2.31 Nc1cccc(c1)Sc2cnccn2 62a_100000210019_100000211759 [0,1,0,0,0,0|2,1,0]=4 658 B15R2.31 Nc1cccc(c1)Sc2cnccn2 62a_100000211759_100000210019 [0,1,0,0,0,0|2,1,0]=4 659 B15R2.31 Nc1cccc(c1)Sc2cncnc2 62a_100000210019_100011206942 [0,1,0,0,0,0|2,1,0]=4 660 B15R2.31 Nc1cccc(c1)Sc2cncnc2 62a_100011206942_100000210019 [0,1,0,0,0,0|2,1,0]=4 661 B15R2.31 Nc1cccc(c1)Sc2ncccn2 62a_100000210019_100000211032 [0,1,0,0,0,0|2,1,0]=4 662 B15R2.31 Nc1cccc(c1)Sc2ncccn2 62a_100000211032_100000210019 [0,1,0,0,0,0|2,1,0]=4 663 B15R2.31 Nc1cccc(n1)Sc2ccccc2 62a_100000719477_100000740741 [0,1,0,0,0,0|1,1,0]=3 664 B15R2.31 Nc1cccc(n1)Sc2ccccc2 62a_100000740741_100000041952 [0,1,0,0,0,0|1,1,0]=3 665 B15R2.31 Nc1cccc(n1)Sc2ccccn2 62a_100000740741_100011216584 [0,1,0,0,0,0|2,1,0]=4 666 B15R2.31 Nc1cccc(n1)Sc2ccccn2 62a_100011216584_100000740741 [0,1,0,0,0,0|2,1,0]=4 667 B15R2.31 Nc1cccc(n1)Sc2cccnc2 62a_100000210063_100000740741 [0,1,0,0,0,0|2,1,0]=4 668 B15R2.31 Nc1cccc(n1)Sc2cccnc2 62a_100000740741_100000210063 [0,1,0,0,0,0|2,1,0]=4 669 B15R2.31 Nc1cccc(n1)Sc2ccncc2 62a_100000728582_100000740741 [0,1,0,0,0,0|2,1,0]=4 670 B15R2.31 Nc1cccc(n1)Sc2ccncc2 62a_100000740741_100000728582 [0,1,0,0,0,0|2,1,0]=4 671 B15R2.31 Nc1ccnc(c1)Sc2ccccc2 62a_100000719477_100009814236 [0,1,0,0,0,0|1,1,0]=3 672 B15R2.31 Nc1ccnc(c1)Sc2ccccc2 62a_100009814236_100000041952 [0,1,0,0,0,0|1,1,0]=3 673 B15R2.31 Nc1ccnc(c1)Sc2ccccn2 62a_100009814236_100011216584 [0,1,0,0,0,0|2,1,0]=4 674 B15R2.31 Nc1ccnc(c1)Sc2ccccn2 62a_100011216584_100009814236 [0,1,0,0,0,0|2,1,0]=4 675 B15R2.31 Nc1ccnc(c1)Sc2cccnc2 62a_100000210063_100009814236 [0,1,0,0,0,0|2,1,0]=4 676 B15R2.31 Nc1ccnc(c1)Sc2cccnc2 62a_100009814236_100000210063 [0,1,0,0,0,0|2,1,0]=4 677 B15R2.31 Nc1ccnc(c1)Sc2ccncc2 62a_100000728582_100009814236 [0,1,0,0,0,0|2,1,0]=4 678 B15R2.31 Nc1ccnc(c1)Sc2ccncc2 62a_100009814236_100000728582 [0,1,0,0,0,0|2,1,0]=4 679 B15R2.31 Nc1ccnc(n1)Nc2ccccc2 27a_100000106764_100000757536 [0,1,0,0,0,0|3,0,0]=4 680 B15R2.31 Nc1ccnc(n1)Sc2ccccc2 62a_100000719477_100000757536 [0,1,0,0,0,0|2,1,0]=4 681 B15R2.31 Nc1ccnc(n1)Sc2ccccc2 62a_100000757536_100000041952 [0,1,0,0,0,0|2,1,0]=4 682 B15R2.31 Nc1cncc(c1)Sc2ccccc2 62a_100000687067_100000041952 [0,1,0,0,0,0|1,1,0]=3 683 B15R2.31 Nc1cncc(c1)Sc2ccccc2 62a_100000719477_100000687067 [0,1,0,0,0,0|1,1,0]=3 684 B15R2.31 Nc1cncc(c1)Sc2ccccn2 62a_100000687067_100011216584 [0,1,0,0,0,0|2,1,0]=4 685 B15R2.31 Nc1cncc(c1)Sc2ccccn2 62a_100011216584_100000687067 [0,1,0,0,0,0|2,1,0]=4 686 B15R2.31 Nc1cncc(c1)Sc2cccnc2 62a_100000210063_100000687067 [0,1,0,0,0,0|2,1,0]=4 687 B15R2.31 Nc1cncc(c1)Sc2cccnc2 62a_100000687067_100000210063 [0,1,0,0,0,0|2,1,0]=4 688 B15R2.31 Nc1cncc(c1)Sc2ccncc2 62a_100000687067_100000728582 [0,1,0,0,0,0|2,1,0]=4 689 B15R2.31 Nc1cncc(c1)Sc2ccncc2 62a_100000728582_100000687067 [0,1,0,0,0,0|2,1,0]=4 690 B15R2.31 Nc1cncc(n1)Sc2ccccc2 62a_100000719477_100000747728 [0,1,0,0,0,0|2,1,0]=4 691 B15R2.31 Nc1cncc(n1)Sc2ccccc2 62a_100000747728_100000041952 [0,1,0,0,0,0|2,1,0]=4 692 B15R2.31 Nc1cnnc(c1)Sc2ccccc2 62a_100000719477_100011996757 [0,1,0,0,0,0|2,1,0]=4 693 B15R2.31 Nc1cnnc(c1)Sc2ccccc2 62a_100011996757_100000041952 [0,1,0,0,0,0|2,1,0]=4 694 B15R2.31 Nc1nccc(n1)Nc2ccccc2 27a_100000106764_100000055538 [0,1,0,0,0,0|3,0,0]=4 695 B15R2.31 Nc1nccc(n1)Sc2ccccc2 62a_100000055538_100000041952 [0,1,0,0,0,0|2,1,0]=4 696 B15R2.31 Nc1nccc(n1)Sc2ccccc2 62a_100000719477_100000055538 [0,1,0,0,0,0|2,1,0]=4 697 B15R2.31 O=c1cc(cc[nH]1)Nc2ccccc2 27a_100000106764_100000061649 [0,1,0,0,0,0|2,0,0]=3 698 B15R2.31 O=c1cc(cc[nH]1)Sc2ccccc2 62a_100000719477_100009816521 [0,1,0,0,0,0|1,1,0]=3 699 B15R2.31 O=c1cc(cc[nH]1)Sc2ccccc2 62a_100009816521_100000041952 [0,1,0,0,0,0|1,1,0]=3 700 B15R2.31 O=c1cc(cc[nH]1)Sc2ccccn2 62a_100009816521_100011216584 [0,1,0,0,0,0|2,1,0]=4 701 B15R2.31 O=c1cc(cc[nH]1)Sc2ccccn2 62a_100011216584_100009816521 [0,1,0,0,0,0|2,1,0]=4 702 B15R2.31 O=c1cc(cc[nH]1)Sc2cccnc2 62a_100000210063_100009816521 [0,1,0,0,0,0|2,1,0]=4 703 B15R2.31 O=c1cc(cc[nH]1)Sc2cccnc2 62a_100009816521_100000210063 [0,1,0,0,0,0|2,1,0]=4 704 B15R2.31 O=c1cc(cc[nH]1)Sc2ccncc2 62a_100000728582_100009816521 [0,1,0,0,0,0|2,1,0]=4 705 B15R2.31 O=c1cc(cc[nH]1)Sc2ccncc2 62a_100009816521_100000728582 [0,1,0,0,0,0|2,1,0]=4 706 B15R2.31 O=c1cc(cn[nH]1)Sc2ccccc2 62a_100000719477_100010197405 [0,1,0,0,0,0|2,1,0]=4 707 B15R2.31 O=c1cc(nc[nH]1)Sc2ccccc2 62a_100012002517_100000041952 [0,1,0,0,0,0|2,1,0]=4 708 B15R2.31 O=c1cc[nH]c(c1)Sc2ccccc2 62a_100009817434_100000041952 [0,1,0,0,0,0|1,1,0]=3 709 B15R2.31 O=c1cc[nH]c(c1)Sc2ccccn2 62a_100009817434_100011216584 [0,1,0,0,0,0|2,1,0]=4 710 B15R2.31 O=c1cc[nH]c(c1)Sc2cccnc2 62a_100009817434_100000210063 [0,1,0,0,0,0|2,1,0]=4 711 B15R2.31 O=c1cc[nH]c(c1)Sc2ccncc2 62a_100009817434_100000728582 [0,1,0,0,0,0|2,1,0]=4 712 B15R2.31 O=c1cccc([nH]1)Sc2ccccc2 62a_100000719477_100000752884 [0,1,0,0,0,0|1,1,0]=3 713 B15R2.31 O=c1cccc([nH]1)Sc2ccccn2 62a_100011216584_100000752884 [0,1,0,0,0,0|2,1,0]=4 714 B15R2.31 O=c1cccc([nH]1)Sc2cccnc2 62a_100000210063_100000752884 [0,1,0,0,0,0|2,1,0]=4 715 B15R2.31 O=c1cccc([nH]1)Sc2ccncc2 62a_100000728582_100000752884 [0,1,0,0,0,0|2,1,0]=4 716 B15R2.31 O=c1nc(cc[nH]1)Nc2ccccc2 27a_100000106764_200000134032 [0,1,0,0,0,0|3,0,0]=4 717 B15R2.31 O=c1nc(cc[nH]1)Sc2ccccc2 62a_100000719477_200000134032 [0,1,0,0,0,0|2,1,0]=4 718 B15R2.31 Oc1cc(ncn1)Nc2ccccc2 27a_100000106764_100000765262 [0,1,0,0,0,0|3,0,0]=4 719 B15R2.31 Oc1cc(ncn1)Oc2ccccc2 271570a_203496583355_100000242500 [0,1,0,0,0,0|2,0,0]=3 720 B15R2.31 Oc1cc(ncn1)Sc2ccccc2 62a_100000719477_100000765262 [0,1,0,0,0,0|2,1,0]=4 721 B15R2.31 Oc1ccc[n+](c1)Cc2ccccc2 271570a_203496583355_200009812568 [0,1,0,0,0,0|2,0,0]=3 722 B15R2.31 Oc1cccc(c1)Nc2ccccc2 271570a_203496583355_100000701362 [0,1,0,0,0,0|1,0,0]=2 723 B15R2.31 Oc1cccc(c1)Nc2cccnn2 27a_100000210217_100016991348 [0,1,0,0,0,0|3,0,0]=4 724 B15R2.31 Oc1cccc(c1)Nc2ccncn2 27a_100000210217_100000703185 [0,1,0,0,0,0|3,0,0]=4 725 B15R2.31 Oc1cccc(c1)Nc2cnccn2 27a_100000210217_100000211759 [0,1,0,0,0,0|3,0,0]=4 726 B15R2.31 Oc1cccc(c1)Nc2ncccn2 27a_100000210217_100000211032 [0,1,0,0,0,0|3,0,0]=4 727 B15R2.31 Oc1cccc(c1)Oc2ccccc2 271570a_203496583355_100009814285 [0,1,0,0,0,0|0,0,0]=1 728 B15R2.31 Oc1cccc(c1)Oc2ccccn2 271570a_203496583355_200000173466 [0,1,0,0,0,0|1,0,0]=2 729 B15R2.31 Oc1cccc(c1)Sc2ccccc2 62a_100000719477_100000211634 [0,1,0,0,0,0|0,1,0]=2 730 B15R2.31 Oc1cccc(c1)Sc2ccccn2 62a_100011216584_100000211634 [0,1,0,0,0,0|1,1,0]=3 731 B15R2.31 Oc1cccc(c1)Sc2cccnc2 62a_100000210063_100000211634 [0,1,0,0,0,0|1,1,0]=3 732 B15R2.31 Oc1cccc(c1)Sc2cccnn2 62a_100016991348_100000211634 [0,1,0,0,0,0|2,1,0]=4 733 B15R2.31 Oc1cccc(c1)Sc2ccncc2 62a_100000728582_100000211634 [0,1,0,0,0,0|1,1,0]=3 734 B15R2.31 Oc1cccc(c1)Sc2ccncn2 62a_100000703185_100000211634 [0,1,0,0,0,0|2,1,0]=4 735 B15R2.31 Oc1cccc(c1)Sc2ccnnc2 62a_100000732662_100000211634 [0,1,0,0,0,0|2,1,0]=4 736 B15R2.31 Oc1cccc(c1)Sc2cnccn2 62a_100000211759_100000211634 [0,1,0,0,0,0|2,1,0]=4 737 B15R2.31 Oc1cccc(c1)Sc2cncnc2 62a_100011206942_100000211634 [0,1,0,0,0,0|2,1,0]=4 738 B15R2.31 Oc1cccc(c1)Sc2ncccn2 62a_100000211032_100000211634 [0,1,0,0,0,0|2,1,0]=4 739 B15R2.31 Oc1cccc(n1)Oc2ccccc2 271570a_203496583355_100011960278 [0,1,0,0,0,0|1,0,0]=2 740 B15R2.31 Oc1ccnc(c1)Sc2ccccc2 62a_100000719477_100000762945 [0,1,0,0,0,0|1,1,0]=3 741 B15R2.31 Oc1ccnc(c1)Sc2ccccn2 62a_100011216584_100000762945 [0,1,0,0,0,0|2,1,0]=4 742 B15R2.31 Oc1ccnc(c1)Sc2cccnc2 62a_100000210063_100000762945 [0,1,0,0,0,0|2,1,0]=4 743 B15R2.31 Oc1ccnc(c1)Sc2ccncc2 62a_100000728582_100000762945 [0,1,0,0,0,0|2,1,0]=4 744 B15R2.31 Oc1ccnc(n1)Nc2ccccc2 27a_100000106764_100011649813 [0,1,0,0,0,0|3,0,0]=4 745 B15R2.31 Oc1ccnc(n1)Sc2ccccc2 62a_100000719477_100011649813 [0,1,0,0,0,0|2,1,0]=4 746 B15R2.31 Oc1cncc(c1)Cc2ccccc2 271570a_203496583355_200010295753 [0,1,0,0,0,0|2,0,0]=3 747 B15R2.31 Oc1cncc(c1)Oc2ccccc2 271570a_203496583355_100012359384 [0,1,0,0,0,0|1,0,0]=2 748 B15R2.31 Oc1cncc(c1)Sc2ccccc2 62a_100000719477_100000754920 [0,1,0,0,0,0|1,1,0]=3 749 B15R2.31 Oc1cncc(c1)Sc2ccccc2 62a_100000754920_100000041952 [0,1,0,0,0,0|1,1,0]=3 750 B15R2.31 Oc1cncc(c1)Sc2ccccn2 62a_100000754920_100011216584 [0,1,0,0,0,0|2,1,0]=4 751 B15R2.31 Oc1cncc(c1)Sc2ccccn2 62a_100011216584_100000754920 [0,1,0,0,0,0|2,1,0]=4 752 B15R2.31 Oc1cncc(c1)Sc2cccnc2 62a_100000210063_100000754920 [0,1,0,0,0,0|2,1,0]=4 753 B15R2.31 Oc1cncc(c1)Sc2cccnc2 62a_100000754920_100000210063 [0,1,0,0,0,0|2,1,0]=4 754 B15R2.31 Oc1cncc(c1)Sc2ccncc2 62a_100000728582_100000754920 [0,1,0,0,0,0|2,1,0]=4 755 B15R2.31 Oc1cncc(c1)Sc2ccncc2 62a_100000754920_100000728582 [0,1,0,0,0,0|2,1,0]=4 756 B15R2.31 Oc1cncc(n1)Oc2ccccc2 271570a_203496583355_200011210009 [0,1,0,0,0,0|2,0,0]=3 757 B15R2.31 Oc1cncc(n1)Sc2ccccc2 62a_100000719477_100011269956 [0,1,0,0,0,0|2,1,0]=4 758 B15R2.31 Oc1cnnc(c1)Sc2ccccc2 62a_100000719477_200010734679 [0,1,0,0,0,0|2,1,0]=4 759 B15R2.31 Oc1nccc(n1)Nc2ccccc2 271570a_203496583355_200011209915 [0,1,0,0,0,0|3,0,0]=4 760 B15R2.31 Oc1nccc(n1)Oc2ccccc2 271570a_203496583355_100000722766 [0,1,0,0,0,0|2,0,0]=3 761 B15R2.31 [O-][n+]1cccc(c1)Sc2ccccc2 62a_100000719477_100009815978 [0,1,0,0,0,0|1,1,0]=3 762 B15R2.31 [O-][n+]1cccc(c1)Sc2ccccn2 62a_100011216584_100009815978 [0,1,0,0,0,0|2,1,0]=4 763 B15R2.31 [O-][n+]1cccc(c1)Sc2cccnc2 62a_100000210063_100009815978 [0,1,0,0,0,0|2,1,0]=4 764 B15R2.31 [O-][n+]1cccc(c1)Sc2ccncc2 62a_100000728582_100009815978 [0,1,0,0,0,0|2,1,0]=4 765 B15R2.31 [O-][n+]1ccnc(c1)Nc2ccccc2 27a_100000106764_100009880115 [0,1,0,0,0,0|3,0,0]=4 766 B15R2.31 [O-][n+]1ccnc(c1)Sc2ccccc2 62a_100000719477_100009880115 [0,1,0,0,0,0|2,1,0]=4 767 B15R2.31 [S]c1cccc(c1)Sc2ccccc2 62a_100000719477_114929384022 [0,1,0,0,0,0|0,1,0]=2 768 B15R2.31 [S]c1cccc(c1)Sc2ccccc2 62a_114929384022_100000041952 [0,1,0,0,0,0|0,1,0]=2 769 B15R2.31 [S]c1cccc(c1)Sc2ccccn2 62a_100011216584_114929384022 [0,1,0,0,0,0|1,1,0]=3 770 B15R2.31 [S]c1cccc(c1)Sc2ccccn2 62a_114929384022_100011216584 [0,1,0,0,0,0|1,1,0]=3 771 B15R2.31 [S]c1cccc(c1)Sc2cccnc2 62a_100000210063_114929384022 [0,1,0,0,0,0|1,1,0]=3 772 B15R2.31 [S]c1cccc(c1)Sc2cccnc2 62a_114929384022_100000210063 [0,1,0,0,0,0|1,1,0]=3 773 B15R2.31 [S]c1cccc(c1)Sc2cccnn2 62a_100016991348_114929384022 [0,1,0,0,0,0|2,1,0]=4 774 B15R2.31 [S]c1cccc(c1)Sc2cccnn2 62a_114929384022_100016991348 [0,1,0,0,0,0|2,1,0]=4 775 B15R2.31 [S]c1cccc(c1)Sc2ccncc2 62a_100000728582_114929384022 [0,1,0,0,0,0|1,1,0]=3 776 B15R2.31 [S]c1cccc(c1)Sc2ccncc2 62a_114929384022_100000728582 [0,1,0,0,0,0|1,1,0]=3 777 B15R2.31 [S]c1cccc(c1)Sc2ccncn2 62a_100000703185_114929384022 [0,1,0,0,0,0|2,1,0]=4 778 B15R2.31 [S]c1cccc(c1)Sc2ccncn2 62a_114929384022_100000703185 [0,1,0,0,0,0|2,1,0]=4 779 B15R2.31 [S]c1cccc(c1)Sc2ccnnc2 62a_100000732662_114929384022 [0,1,0,0,0,0|2,1,0]=4 780 B15R2.31 [S]c1cccc(c1)Sc2ccnnc2 62a_114929384022_100000732662 [0,1,0,0,0,0|2,1,0]=4 781 B15R2.31 [S]c1cccc(c1)Sc2cnccn2 62a_100000211759_114929384022 [0,1,0,0,0,0|2,1,0]=4 782 B15R2.31 [S]c1cccc(c1)Sc2cnccn2 62a_114929384022_100000211759 [0,1,0,0,0,0|2,1,0]=4 783 B15R2.31 [S]c1cccc(c1)Sc2cncnc2 62a_100011206942_114929384022 [0,1,0,0,0,0|2,1,0]=4 784 B15R2.31 [S]c1cccc(c1)Sc2cncnc2 62a_114929384022_100011206942 [0,1,0,0,0,0|2,1,0]=4 785 B15R2.31 [S]c1cccc(c1)Sc2ncccn2 62a_100000211032_114929384022 [0,1,0,0,0,0|2,1,0]=4 786 B15R2.31 [S]c1cccc(c1)Sc2ncccn2 62a_114929384022_100000211032 [0,1,0,0,0,0|2,1,0]=4 787 B15R2.38 Brc1ccccc1Sc2ccccc2 62a_100000695589_100000041952 [0,1,0,0,0,0|0,1,0]=2 788 B15R2.38 Brc1ccccc1Sc2ccccc2 62a_100000719477_100000695589 [0,1,0,0,0,0|0,1,0]=2 789 B15R2.38 Brc1ccccc1Sc2ccccn2 62a_100000695589_100011216584 [0,1,0,0,0,0|1,1,0]=3 790 B15R2.38 Brc1ccccc1Sc2ccccn2 62a_100011216584_100000695589 [0,1,0,0,0,0|1,1,0]=3 791 B15R2.38 Brc1ccccc1Sc2cccnc2 62a_100000210063_100000695589 [0,1,0,0,0,0|1,1,0]=3 792 B15R2.38 Brc1ccccc1Sc2cccnc2 62a_100000695589_100000210063 [0,1,0,0,0,0|1,1,0]=3 793 B15R2.38 Brc1ccccc1Sc2cccnn2 62a_100000695589_100016991348 [0,1,0,0,0,0|2,1,0]=4 794 B15R2.38 Brc1ccccc1Sc2cccnn2 62a_100016991348_100000695589 [0,1,0,0,0,0|2,1,0]=4 795 B15R2.38 Brc1ccccc1Sc2ccncc2 62a_100000695589_100000728582 [0,1,0,0,0,0|1,1,0]=3 796 B15R2.38 Brc1ccccc1Sc2ccncc2 62a_100000728582_100000695589 [0,1,0,0,0,0|1,1,0]=3 797 B15R2.38 Brc1ccccc1Sc2ccncn2 62a_100000695589_100000703185 [0,1,0,0,0,0|2,1,0]=4 798 B15R2.38 Brc1ccccc1Sc2ccncn2 62a_100000703185_100000695589 [0,1,0,0,0,0|2,1,0]=4 799 B15R2.38 Brc1ccccc1Sc2ccnnc2 62a_100000695589_100000732662 [0,1,0,0,0,0|2,1,0]=4 800 B15R2.38 Brc1ccccc1Sc2ccnnc2 62a_100000732662_100000695589 [0,1,0,0,0,0|2,1,0]=4 801 B15R2.38 Brc1ccccc1Sc2cnccn2 62a_100000211759_100000695589 [0,1,0,0,0,0|2,1,0]=4 802 B15R2.38 Brc1ccccc1Sc2cnccn2 62a_100000695589_100000211759 [0,1,0,0,0,0|2,1,0]=4 803 B15R2.38 Brc1ccccc1Sc2cncnc2 62a_100000695589_100011206942 [0,1,0,0,0,0|2,1,0]=4 804 B15R2.38 Brc1ccccc1Sc2cncnc2 62a_100011206942_100000695589 [0,1,0,0,0,0|2,1,0]=4 805 B15R2.38 Brc1ccccc1Sc2ncccn2 62a_100000211032_100000695589 [0,1,0,0,0,0|2,1,0]=4 806 B15R2.38 Brc1ccccc1Sc2ncccn2 62a_100000695589_100000211032 [0,1,0,0,0,0|2,1,0]=4 807 B15R2.38 Brc1cccnc1Nc2ccccc2 27a_100000106764_100000696092 [0,1,0,0,0,0|2,0,0]=3 808 B15R2.38 Brc1cccnc1Sc2ccccc2 62a_100000696092_100000041952 [0,1,0,0,0,0|1,1,0]=3 809 B15R2.38 Brc1cccnc1Sc2ccccc2 62a_100000719477_100000696092 [0,1,0,0,0,0|1,1,0]=3 810 B15R2.38 Brc1cccnc1Sc2ccccn2 62a_100000696092_100011216584 [0,1,0,0,0,0|2,1,0]=4 811 B15R2.38 Brc1cccnc1Sc2ccccn2 62a_100011216584_100000696092 [0,1,0,0,0,0|2,1,0]=4 812 B15R2.38 Brc1cccnc1Sc2cccnc2 62a_100000210063_100000696092 [0,1,0,0,0,0|2,1,0]=4 813 B15R2.38 Brc1cccnc1Sc2cccnc2 62a_100000696092_100000210063 [0,1,0,0,0,0|2,1,0]=4 814 B15R2.38 Brc1cccnc1Sc2ccncc2 62a_100000696092_100000728582 [0,1,0,0,0,0|2,1,0]=4 815 B15R2.38 Brc1cccnc1Sc2ccncc2 62a_100000728582_100000696092 [0,1,0,0,0,0|2,1,0]=4 816 B15R2.38 Brc1ccncc1Sc2ccccc2 62a_100000719477_100010138639 [0,1,0,0,0,0|1,1,0]=3 817 B15R2.38 Brc1ccncc1Sc2ccccc2 62a_100010138639_100000041952 [0,1,0,0,0,0|1,1,0]=3 818 B15R2.38 Brc1ccncc1Sc2ccccn2 62a_100010138639_100011216584 [0,1,0,0,0,0|2,1,0]=4 819 B15R2.38 Brc1ccncc1Sc2ccccn2 62a_100011216584_100010138639 [0,1,0,0,0,0|2,1,0]=4 820 B15R2.38 Brc1ccncc1Sc2cccnc2 62a_100000210063_100010138639 [0,1,0,0,0,0|2,1,0]=4 821 B15R2.38 Brc1ccncc1Sc2cccnc2 62a_100010138639_100000210063 [0,1,0,0,0,0|2,1,0]=4 822 B15R2.38 Brc1ccncc1Sc2ccncc2 62a_100000728582_100010138639 [0,1,0,0,0,0|2,1,0]=4 823 B15R2.38 Brc1ccncc1Sc2ccncc2 62a_100010138639_100000728582 [0,1,0,0,0,0|2,1,0]=4 824 B15R2.38 Brc1cnccc1Nc2ccccc2 27a_100000106764_100000726257 [0,1,0,0,0,0|2,0,0]=3 825 B15R2.38 Brc1cnccc1Sc2ccccc2 62a_100000719477_100000726257 [0,1,0,0,0,0|1,1,0]=3 826 B15R2.38 Brc1cnccc1Sc2ccccc2 62a_100000726257_100000041952 [0,1,0,0,0,0|1,1,0]=3 827 B15R2.38 Brc1cnccc1Sc2ccccn2 62a_100000726257_100011216584 [0,1,0,0,0,0|2,1,0]=4 828 B15R2.38 Brc1cnccc1Sc2ccccn2 62a_100011216584_100000726257 [0,1,0,0,0,0|2,1,0]=4 829 B15R2.38 Brc1cnccc1Sc2cccnc2 62a_100000210063_100000726257 [0,1,0,0,0,0|2,1,0]=4 830 B15R2.38 Brc1cnccc1Sc2cccnc2 62a_100000726257_100000210063 [0,1,0,0,0,0|2,1,0]=4 831 B15R2.38 Brc1cnccc1Sc2ccncc2 62a_100000726257_100000728582 [0,1,0,0,0,0|2,1,0]=4 832 B15R2.38 Brc1cnccc1Sc2ccncc2 62a_100000728582_100000726257 [0,1,0,0,0,0|2,1,0]=4 833 B15R2.38 Brc1ncccc1Sc2ccccc2 62a_100000719477_100010202626 [0,1,0,0,0,0|1,1,0]=3 834 B15R2.38 Brc1ncccc1Sc2ccccc2 62a_100010202626_100000041952 [0,1,0,0,0,0|1,1,0]=3 835 B15R2.38 Brc1ncccc1Sc2ccccn2 62a_100010202626_100011216584 [0,1,0,0,0,0|2,1,0]=4 836 B15R2.38 Brc1ncccc1Sc2ccccn2 62a_100011216584_100010202626 [0,1,0,0,0,0|2,1,0]=4 837 B15R2.38 Brc1ncccc1Sc2cccnc2 62a_100000210063_100010202626 [0,1,0,0,0,0|2,1,0]=4 838 B15R2.38 Brc1ncccc1Sc2cccnc2 62a_100010202626_100000210063 [0,1,0,0,0,0|2,1,0]=4 839 B15R2.38 Brc1ncccc1Sc2ccncc2 62a_100000728582_100010202626 [0,1,0,0,0,0|2,1,0]=4 840 B15R2.38 Brc1ncccc1Sc2ccncc2 62a_100010202626_100000728582 [0,1,0,0,0,0|2,1,0]=4 841 B15R2.38 Brc1ncncc1Sc2ccccc2 62a_100000719477_200012461658 [0,1,0,0,0,0|2,1,0]=4 842 B15R2.38 Brc1ncncc1Sc2ccccc2 62a_200012461658_100000041952 [0,1,0,0,0,0|2,1,0]=4 843 B15R2.38 C[n+]1ccccc1Sc2ccccc2 62a_100000719477_100000212160 [0,1,0,0,0,0|1,1,0]=3 844 B15R2.38 C[n+]1ccccc1Sc2ccccn2 62a_100011216584_100000212160 [0,1,0,0,0,0|2,1,0]=4 845 B15R2.38 C[n+]1ccccc1Sc2cccnc2 62a_100000210063_100000212160 [0,1,0,0,0,0|2,1,0]=4 846 B15R2.38 C[n+]1ccccc1Sc2ccncc2 62a_100000728582_100000212160 [0,1,0,0,0,0|2,1,0]=4 847 B15R2.38 Cc1ccccc1Nc2cccnn2 27a_100015192222_100016991348 [0,1,0,0,0,0|3,0,0]=4 848 B15R2.38 Cc1ccccc1Nc2ccncn2 27a_100015192222_100000703185 [0,1,0,0,0,0|3,0,0]=4 849 B15R2.38 Cc1ccccc1Nc2cnccn2 27a_100015192222_100000211759 [0,1,0,0,0,0|3,0,0]=4 850 B15R2.38 Cc1ccccc1Nc2ncccn2 27a_100015192222_100000211032 [0,1,0,0,0,0|3,0,0]=4 851 B15R2.38 Cc1ccccc1Sc2ccccc2 62a_100000210755_100000041952 [0,1,0,0,0,0|0,1,0]=2 852 B15R2.38 Cc1ccccc1Sc2ccccc2 62a_100000719477_100000210755 [0,1,0,0,0,0|0,1,0]=2 853 B15R2.38 Cc1ccccc1Sc2ccccn2 62a_100000210755_100011216584 [0,1,0,0,0,0|1,1,0]=3 854 B15R2.38 Cc1ccccc1Sc2ccccn2 62a_100011216584_100000210755 [0,1,0,0,0,0|1,1,0]=3 855 B15R2.38 Cc1ccccc1Sc2cccnc2 62a_100000210063_100000210755 [0,1,0,0,0,0|1,1,0]=3 856 B15R2.38 Cc1ccccc1Sc2cccnc2 62a_100000210755_100000210063 [0,1,0,0,0,0|1,1,0]=3 857 B15R2.38 Cc1ccccc1Sc2cccnn2 62a_100000210755_100016991348 [0,1,0,0,0,0|2,1,0]=4 858 B15R2.38 Cc1ccccc1Sc2cccnn2 62a_100016991348_100000210755 [0,1,0,0,0,0|2,1,0]=4 859 B15R2.38 Cc1ccccc1Sc2ccncc2 62a_100000210755_100000728582 [0,1,0,0,0,0|1,1,0]=3 860 B15R2.38 Cc1ccccc1Sc2ccncc2 62a_100000728582_100000210755 [0,1,0,0,0,0|1,1,0]=3 861 B15R2.38 Cc1ccccc1Sc2ccncn2 62a_100000210755_100000703185 [0,1,0,0,0,0|2,1,0]=4 862 B15R2.38 Cc1ccccc1Sc2ccncn2 62a_100000703185_100000210755 [0,1,0,0,0,0|2,1,0]=4 863 B15R2.38 Cc1ccccc1Sc2ccnnc2 62a_100000210755_100000732662 [0,1,0,0,0,0|2,1,0]=4 864 B15R2.38 Cc1ccccc1Sc2ccnnc2 62a_100000732662_100000210755 [0,1,0,0,0,0|2,1,0]=4 865 B15R2.38 Cc1ccccc1Sc2cnccn2 62a_100000210755_100000211759 [0,1,0,0,0,0|2,1,0]=4 866 B15R2.38 Cc1ccccc1Sc2cnccn2 62a_100000211759_100000210755 [0,1,0,0,0,0|2,1,0]=4 867 B15R2.38 Cc1ccccc1Sc2cncnc2 62a_100000210755_100011206942 [0,1,0,0,0,0|2,1,0]=4 868 B15R2.38 Cc1ccccc1Sc2cncnc2 62a_100011206942_100000210755 [0,1,0,0,0,0|2,1,0]=4 869 B15R2.38 Cc1ccccc1Sc2ncccn2 62a_100000210755_100000211032 [0,1,0,0,0,0|2,1,0]=4 870 B15R2.38 Cc1ccccc1Sc2ncccn2 62a_100000211032_100000210755 [0,1,0,0,0,0|2,1,0]=4 871 B15R2.38 Cc1cccnc1Sc2ccccc2 62a_100000719477_100000751373 [0,1,0,0,0,0|1,1,0]=3 872 B15R2.38 Cc1cccnc1Sc2ccccc2 62a_100000751373_100000041952 [0,1,0,0,0,0|1,1,0]=3 873 B15R2.38 Cc1cccnc1Sc2ccccn2 62a_100000751373_100011216584 [0,1,0,0,0,0|2,1,0]=4 874 B15R2.38 Cc1cccnc1Sc2ccccn2 62a_100011216584_100000751373 [0,1,0,0,0,0|2,1,0]=4 875 B15R2.38 Cc1cccnc1Sc2cccnc2 62a_100000210063_100000751373 [0,1,0,0,0,0|2,1,0]=4 876 B15R2.38 Cc1cccnc1Sc2cccnc2 62a_100000751373_100000210063 [0,1,0,0,0,0|2,1,0]=4 877 B15R2.38 Cc1cccnc1Sc2ccncc2 62a_100000728582_100000751373 [0,1,0,0,0,0|2,1,0]=4 878 B15R2.38 Cc1cccnc1Sc2ccncc2 62a_100000751373_100000728582 [0,1,0,0,0,0|2,1,0]=4 879 B15R2.38 Cc1ccncc1Sc2ccccc2 62a_100000719477_100000761580 [0,1,0,0,0,0|1,1,0]=3 880 B15R2.38 Cc1ccncc1Sc2ccccc2 62a_100000761580_100000041952 [0,1,0,0,0,0|1,1,0]=3 881 B15R2.38 Cc1ccncc1Sc2ccccn2 62a_100000761580_100011216584 [0,1,0,0,0,0|2,1,0]=4 882 B15R2.38 Cc1ccncc1Sc2ccccn2 62a_100011216584_100000761580 [0,1,0,0,0,0|2,1,0]=4 883 B15R2.38 Cc1ccncc1Sc2cccnc2 62a_100000210063_100000761580 [0,1,0,0,0,0|2,1,0]=4 884 B15R2.38 Cc1ccncc1Sc2cccnc2 62a_100000761580_100000210063 [0,1,0,0,0,0|2,1,0]=4 885 B15R2.38 Cc1ccncc1Sc2ccncc2 62a_100000728582_100000761580 [0,1,0,0,0,0|2,1,0]=4 886 B15R2.38 Cc1ccncc1Sc2ccncc2 62a_100000761580_100000728582 [0,1,0,0,0,0|2,1,0]=4 887 B15R2.38 Cc1ccnnc1Nc2ccccc2 27a_100000106764_100000089043 [0,1,0,0,0,0|3,0,0]=4 888 B15R2.38 Cc1ccnnc1Sc2ccccc2 62a_100000719477_100000089043 [0,1,0,0,0,0|2,1,0]=4 889 B15R2.38 Cc1cnccc1Nc2ccccc2 27a_100000106764_100000765111 [0,1,0,0,0,0|2,0,0]=3 890 B15R2.38 Cc1cnccc1Sc2ccccc2 62a_100000719477_100000765111 [0,1,0,0,0,0|1,1,0]=3 891 B15R2.38 Cc1cnccc1Sc2ccccc2 62a_100000765111_100000041952 [0,1,0,0,0,0|1,1,0]=3 892 B15R2.38 Cc1cnccc1Sc2ccccn2 62a_100000765111_100011216584 [0,1,0,0,0,0|2,1,0]=4 893 B15R2.38 Cc1cnccc1Sc2ccccn2 62a_100011216584_100000765111 [0,1,0,0,0,0|2,1,0]=4 894 B15R2.38 Cc1cnccc1Sc2cccnc2 62a_100000210063_100000765111 [0,1,0,0,0,0|2,1,0]=4 895 B15R2.38 Cc1cnccc1Sc2cccnc2 62a_100000765111_100000210063 [0,1,0,0,0,0|2,1,0]=4 896 B15R2.38 Cc1cnccc1Sc2ccncc2 62a_100000728582_100000765111 [0,1,0,0,0,0|2,1,0]=4 897 B15R2.38 Cc1cnccc1Sc2ccncc2 62a_100000765111_100000728582 [0,1,0,0,0,0|2,1,0]=4 898 B15R2.38 Cc1cncnc1Nc2ccccc2 27a_100000106764_100011998708 [0,1,0,0,0,0|3,0,0]=4 899 B15R2.38 Cc1cncnc1Sc2ccccc2 62a_100000719477_100011998708 [0,1,0,0,0,0|2,1,0]=4 900 B15R2.38 Cc1cncnc1Sc2ccccc2 62a_100011998708_100000041952 [0,1,0,0,0,0|2,1,0]=4 901 B15R2.38 Cc1ncccc1Sc2ccccc2 62a_100000719477_100000751574 [0,1,0,0,0,0|1,1,0]=3 902 B15R2.38 Cc1ncccc1Sc2ccccc2 62a_100000751574_100000041952 [0,1,0,0,0,0|1,1,0]=3 903 B15R2.38 Cc1ncccc1Sc2ccccn2 62a_100000751574_100011216584 [0,1,0,0,0,0|2,1,0]=4 904 B15R2.38 Cc1ncccc1Sc2ccccn2 62a_100011216584_100000751574 [0,1,0,0,0,0|2,1,0]=4 905 B15R2.38 Cc1ncccc1Sc2cccnc2 62a_100000210063_100000751574 [0,1,0,0,0,0|2,1,0]=4 906 B15R2.38 Cc1ncccc1Sc2cccnc2 62a_100000751574_100000210063 [0,1,0,0,0,0|2,1,0]=4 907 B15R2.38 Cc1ncccc1Sc2ccncc2 62a_100000728582_100000751574 [0,1,0,0,0,0|2,1,0]=4 908 B15R2.38 Cc1ncccc1Sc2ccncc2 62a_100000751574_100000728582 [0,1,0,0,0,0|2,1,0]=4 909 B15R2.38 Cc1nccnc1Nc2ccccc2 27a_100000106764_100011999405 [0,1,0,0,0,0|3,0,0]=4 910 B15R2.38 Cc1nccnc1Sc2ccccc2 62a_100000719477_100011999405 [0,1,0,0,0,0|2,1,0]=4 911 B15R2.38 Cc1nccnc1Sc2ccccc2 62a_100011999405_100000041952 [0,1,0,0,0,0|2,1,0]=4 912 B15R2.38 Cc1ncncc1Sc2ccccc2 62a_100000719477_100009819671 [0,1,0,0,0,0|2,1,0]=4 913 B15R2.38 Cc1ncncc1Sc2ccccc2 62a_100009819671_100000041952 [0,1,0,0,0,0|2,1,0]=4 914 B15R2.38 Clc1ccccc1Nc2cccnn2 27a_100000185783_100016991348 [0,1,0,0,0,0|3,0,0]=4 915 B15R2.38 Clc1ccccc1Nc2ccncn2 27a_100000185783_100000703185 [0,1,0,0,0,0|3,0,0]=4 916 B15R2.38 Clc1ccccc1Nc2cnccn2 27a_100000185783_100000211759 [0,1,0,0,0,0|3,0,0]=4 917 B15R2.38 Clc1ccccc1Nc2ncccn2 27a_100000185783_100000211032 [0,1,0,0,0,0|3,0,0]=4 918 B15R2.38 Clc1ccccc1Sc2ccccc2 62a_100000719477_100000764095 [0,1,0,0,0,0|0,1,0]=2 919 B15R2.38 Clc1ccccc1Sc2ccccc2 62a_100000764095_100000041952 [0,1,0,0,0,0|0,1,0]=2 920 B15R2.38 Clc1ccccc1Sc2ccccn2 62a_100000764095_100011216584 [0,1,0,0,0,0|1,1,0]=3 921 B15R2.38 Clc1ccccc1Sc2ccccn2 62a_100011216584_100000764095 [0,1,0,0,0,0|1,1,0]=3 922 B15R2.38 Clc1ccccc1Sc2cccnc2 62a_100000210063_100000764095 [0,1,0,0,0,0|1,1,0]=3 923 B15R2.38 Clc1ccccc1Sc2cccnc2 62a_100000764095_100000210063 [0,1,0,0,0,0|1,1,0]=3 924 B15R2.38 Clc1ccccc1Sc2cccnn2 62a_100000764095_100016991348 [0,1,0,0,0,0|2,1,0]=4 925 B15R2.38 Clc1ccccc1Sc2cccnn2 62a_100016991348_100000764095 [0,1,0,0,0,0|2,1,0]=4 926 B15R2.38 Clc1ccccc1Sc2ccncc2 62a_100000728582_100000764095 [0,1,0,0,0,0|1,1,0]=3 927 B15R2.38 Clc1ccccc1Sc2ccncc2 62a_100000764095_100000728582 [0,1,0,0,0,0|1,1,0]=3 928 B15R2.38 Clc1ccccc1Sc2ccncn2 62a_100000703185_100000764095 [0,1,0,0,0,0|2,1,0]=4 929 B15R2.38 Clc1ccccc1Sc2ccncn2 62a_100000764095_100000703185 [0,1,0,0,0,0|2,1,0]=4 930 B15R2.38 Clc1ccccc1Sc2ccnnc2 62a_100000732662_100000764095 [0,1,0,0,0,0|2,1,0]=4 931 B15R2.38 Clc1ccccc1Sc2ccnnc2 62a_100000764095_100000732662 [0,1,0,0,0,0|2,1,0]=4 932 B15R2.38 Clc1ccccc1Sc2cnccn2 62a_100000211759_100000764095 [0,1,0,0,0,0|2,1,0]=4 933 B15R2.38 Clc1ccccc1Sc2cnccn2 62a_100000764095_100000211759 [0,1,0,0,0,0|2,1,0]=4 934 B15R2.38 Clc1ccccc1Sc2cncnc2 62a_100000764095_100011206942 [0,1,0,0,0,0|2,1,0]=4 935 B15R2.38 Clc1ccccc1Sc2cncnc2 62a_100011206942_100000764095 [0,1,0,0,0,0|2,1,0]=4 936 B15R2.38 Clc1ccccc1Sc2ncccn2 62a_100000211032_100000764095 [0,1,0,0,0,0|2,1,0]=4 937 B15R2.38 Clc1ccccc1Sc2ncccn2 62a_100000764095_100000211032 [0,1,0,0,0,0|2,1,0]=4 938 B15R2.38 Clc1cccnc1Sc2ccccc2 62a_100000719477_100011356963 [0,1,0,0,0,0|1,1,0]=3 939 B15R2.38 Clc1cccnc1Sc2ccccc2 62a_100011356963_100000041952 [0,1,0,0,0,0|1,1,0]=3 940 B15R2.38 Clc1cccnc1Sc2ccccn2 62a_100011216584_100011356963 [0,1,0,0,0,0|2,1,0]=4 941 B15R2.38 Clc1cccnc1Sc2ccccn2 62a_100011356963_100011216584 [0,1,0,0,0,0|2,1,0]=4 942 B15R2.38 Clc1cccnc1Sc2cccnc2 62a_100000210063_100011356963 [0,1,0,0,0,0|2,1,0]=4 943 B15R2.38 Clc1cccnc1Sc2cccnc2 62a_100011356963_100000210063 [0,1,0,0,0,0|2,1,0]=4 944 B15R2.38 Clc1cccnc1Sc2ccncc2 62a_100000728582_100011356963 [0,1,0,0,0,0|2,1,0]=4 945 B15R2.38 Clc1cccnc1Sc2ccncc2 62a_100011356963_100000728582 [0,1,0,0,0,0|2,1,0]=4 946 B15R2.38 Clc1ccncc1Sc2ccccc2 62a_100000719477_100009995489 [0,1,0,0,0,0|1,1,0]=3 947 B15R2.38 Clc1ccncc1Sc2ccccc2 62a_100009995489_100000041952 [0,1,0,0,0,0|1,1,0]=3 948 B15R2.38 Clc1ccncc1Sc2ccccn2 62a_100009995489_100011216584 [0,1,0,0,0,0|2,1,0]=4 949 B15R2.38 Clc1ccncc1Sc2ccccn2 62a_100011216584_100009995489 [0,1,0,0,0,0|2,1,0]=4 950 B15R2.38 Clc1ccncc1Sc2cccnc2 62a_100000210063_100009995489 [0,1,0,0,0,0|2,1,0]=4 951 B15R2.38 Clc1ccncc1Sc2cccnc2 62a_100009995489_100000210063 [0,1,0,0,0,0|2,1,0]=4 952 B15R2.38 Clc1ccncc1Sc2ccncc2 62a_100000728582_100009995489 [0,1,0,0,0,0|2,1,0]=4 953 B15R2.38 Clc1ccncc1Sc2ccncc2 62a_100009995489_100000728582 [0,1,0,0,0,0|2,1,0]=4 954 B15R2.38 Clc1cnccc1Sc2ccccc2 62a_100000708259_100000041952 [0,1,0,0,0,0|1,1,0]=3 955 B15R2.38 Clc1cnccc1Sc2ccccc2 62a_100000719477_100000708259 [0,1,0,0,0,0|1,1,0]=3 956 B15R2.38 Clc1cnccc1Sc2ccccn2 62a_100000708259_100011216584 [0,1,0,0,0,0|2,1,0]=4 957 B15R2.38 Clc1cnccc1Sc2ccccn2 62a_100011216584_100000708259 [0,1,0,0,0,0|2,1,0]=4 958 B15R2.38 Clc1cnccc1Sc2cccnc2 62a_100000210063_100000708259 [0,1,0,0,0,0|2,1,0]=4 959 B15R2.38 Clc1cnccc1Sc2cccnc2 62a_100000708259_100000210063 [0,1,0,0,0,0|2,1,0]=4 960 B15R2.38 Clc1cnccc1Sc2ccncc2 62a_100000708259_100000728582 [0,1,0,0,0,0|2,1,0]=4 961 B15R2.38 Clc1cnccc1Sc2ccncc2 62a_100000728582_100000708259 [0,1,0,0,0,0|2,1,0]=4 962 B15R2.38 Clc1ncccc1Sc2ccccc2 62a_100000036424_100000041952 [0,1,0,0,0,0|1,1,0]=3 963 B15R2.38 Clc1ncccc1Sc2ccccc2 62a_100000719477_100000036424 [0,1,0,0,0,0|1,1,0]=3 964 B15R2.38 Clc1ncccc1Sc2ccccn2 62a_100000036424_100011216584 [0,1,0,0,0,0|2,1,0]=4 965 B15R2.38 Clc1ncccc1Sc2ccccn2 62a_100011216584_100000036424 [0,1,0,0,0,0|2,1,0]=4 966 B15R2.38 Clc1ncccc1Sc2cccnc2 62a_100000036424_100000210063 [0,1,0,0,0,0|2,1,0]=4 967 B15R2.38 Clc1ncccc1Sc2cccnc2 62a_100000210063_100000036424 [0,1,0,0,0,0|2,1,0]=4 968 B15R2.38 Clc1ncccc1Sc2ccncc2 62a_100000036424_100000728582 [0,1,0,0,0,0|2,1,0]=4 969 B15R2.38 Clc1ncccc1Sc2ccncc2 62a_100000728582_100000036424 [0,1,0,0,0,0|2,1,0]=4 970 B15R2.38 Clc1nccnc1Sc2ccccc2 62a_100000719477_100010886584 [0,1,0,0,0,0|2,1,0]=4 971 B15R2.38 Clc1nccnc1Sc2ccccc2 62a_100010886584_100000041952 [0,1,0,0,0,0|2,1,0]=4 972 B15R2.38 Clc1ncncc1Sc2ccccc2 62a_100000719477_100000758962 [0,1,0,0,0,0|2,1,0]=4 973 B15R2.38 Clc1ncncc1Sc2ccccc2 62a_100000758962_100000041952 [0,1,0,0,0,0|2,1,0]=4 974 B15R2.38 Fc1ccccc1Nc2cccnn2 27a_100000210422_100016991348 [0,1,0,0,0,0|3,0,0]=4 975 B15R2.38 Fc1ccccc1Nc2ccncn2 27a_100000210422_100000703185 [0,1,0,0,0,0|3,0,0]=4 976 B15R2.38 Fc1ccccc1Nc2cnccn2 27a_100000210422_100000211759 [0,1,0,0,0,0|3,0,0]=4 977 B15R2.38 Fc1ccccc1Nc2ncccn2 27a_100000210422_100000211032 [0,1,0,0,0,0|3,0,0]=4 978 B15R2.38 Fc1ccccc1Sc2ccccc2 62a_100000719477_100011215700 [0,1,0,0,0,0|0,1,0]=2 979 B15R2.38 Fc1ccccc1Sc2ccccc2 62a_100011215700_100000041952 [0,1,0,0,0,0|0,1,0]=2 980 B15R2.38 Fc1ccccc1Sc2ccccn2 62a_100011215700_100011216584 [0,1,0,0,0,0|1,1,0]=3 981 B15R2.38 Fc1ccccc1Sc2ccccn2 62a_100011216584_100011215700 [0,1,0,0,0,0|1,1,0]=3 982 B15R2.38 Fc1ccccc1Sc2cccnc2 62a_100000210063_100011215700 [0,1,0,0,0,0|1,1,0]=3 983 B15R2.38 Fc1ccccc1Sc2cccnc2 62a_100011215700_100000210063 [0,1,0,0,0,0|1,1,0]=3 984 B15R2.38 Fc1ccccc1Sc2cccnn2 62a_100011215700_100016991348 [0,1,0,0,0,0|2,1,0]=4 985 B15R2.38 Fc1ccccc1Sc2cccnn2 62a_100016991348_100011215700 [0,1,0,0,0,0|2,1,0]=4 986 B15R2.38 Fc1ccccc1Sc2ccncc2 62a_100000728582_100011215700 [0,1,0,0,0,0|1,1,0]=3 987 B15R2.38 Fc1ccccc1Sc2ccncc2 62a_100011215700_100000728582 [0,1,0,0,0,0|1,1,0]=3 988 B15R2.38 Fc1ccccc1Sc2ccncn2 62a_100000703185_100011215700 [0,1,0,0,0,0|2,1,0]=4 989 B15R2.38 Fc1ccccc1Sc2ccncn2 62a_100011215700_100000703185 [0,1,0,0,0,0|2,1,0]=4 990 B15R2.38 Fc1ccccc1Sc2ccnnc2 62a_100000732662_100011215700 [0,1,0,0,0,0|2,1,0]=4 991 B15R2.38 Fc1ccccc1Sc2ccnnc2 62a_100011215700_100000732662 [0,1,0,0,0,0|2,1,0]=4 992 B15R2.38 Fc1ccccc1Sc2cnccn2 62a_100000211759_100011215700 [0,1,0,0,0,0|2,1,0]=4 993 B15R2.38 Fc1ccccc1Sc2cnccn2 62a_100011215700_100000211759 [0,1,0,0,0,0|2,1,0]=4 994 B15R2.38 Fc1ccccc1Sc2cncnc2 62a_100011206942_100011215700 [0,1,0,0,0,0|2,1,0]=4 995 B15R2.38 Fc1ccccc1Sc2cncnc2 62a_100011215700_100011206942 [0,1,0,0,0,0|2,1,0]=4 996 B15R2.38 Fc1ccccc1Sc2ncccn2 62a_100000211032_100011215700 [0,1,0,0,0,0|2,1,0]=4 997 B15R2.38 Fc1ccccc1Sc2ncccn2 62a_100011215700_100000211032 [0,1,0,0,0,0|2,1,0]=4 998 B15R2.38 Fc1cccnc1Sc2ccccc2 62a_100000685392_100000041952 [0,1,0,0,0,0|1,1,0]=3 999 B15R2.38 Fc1cccnc1Sc2ccccc2 62a_100000719477_100000685392 [0,1,0,0,0,0|1,1,0]=3 1000 B15R2.38 Fc1cccnc1Sc2ccccn2 62a_100000685392_100011216584 [0,1,0,0,0,0|2,1,0]=4 1001 B15R2.38 Fc1cccnc1Sc2ccccn2 62a_100011216584_100000685392 [0,1,0,0,0,0|2,1,0]=4 1002 B15R2.38 Fc1cccnc1Sc2cccnc2 62a_100000210063_100000685392 [0,1,0,0,0,0|2,1,0]=4 1003 B15R2.38 Fc1cccnc1Sc2cccnc2 62a_100000685392_100000210063 [0,1,0,0,0,0|2,1,0]=4 1004 B15R2.38 Fc1cccnc1Sc2ccncc2 62a_100000685392_100000728582 [0,1,0,0,0,0|2,1,0]=4 1005 B15R2.38 Fc1cccnc1Sc2ccncc2 62a_100000728582_100000685392 [0,1,0,0,0,0|2,1,0]=4 1006 B15R2.38 Fc1ccncc1Sc2ccccc2 62a_100000719477_100009820683 [0,1,0,0,0,0|1,1,0]=3 1007 B15R2.38 Fc1ccncc1Sc2ccccc2 62a_100009820683_100000041952 [0,1,0,0,0,0|1,1,0]=3 1008 B15R2.38 Fc1ccncc1Sc2ccccn2 62a_100009820683_100011216584 [0,1,0,0,0,0|2,1,0]=4 1009 B15R2.38 Fc1ccncc1Sc2ccccn2 62a_100011216584_100009820683 [0,1,0,0,0,0|2,1,0]=4 1010 B15R2.38 Fc1ccncc1Sc2cccnc2 62a_100000210063_100009820683 [0,1,0,0,0,0|2,1,0]=4 1011 B15R2.38 Fc1ccncc1Sc2cccnc2 62a_100009820683_100000210063 [0,1,0,0,0,0|2,1,0]=4 1012 B15R2.38 Fc1ccncc1Sc2ccncc2 62a_100000728582_100009820683 [0,1,0,0,0,0|2,1,0]=4 1013 B15R2.38 Fc1ccncc1Sc2ccncc2 62a_100009820683_100000728582 [0,1,0,0,0,0|2,1,0]=4 1014 B15R2.38 Fc1cnccc1Nc2ccccc2 27a_100000106764_100000035921 [0,1,0,0,0,0|2,0,0]=3 1015 B15R2.38 Fc1cnccc1Sc2ccccc2 62a_100000047030_100000041952 [0,1,0,0,0,0|1,1,0]=3 1016 B15R2.38 Fc1cnccc1Sc2ccccc2 62a_100000719477_100000047030 [0,1,0,0,0,0|1,1,0]=3 1017 B15R2.38 Fc1cnccc1Sc2ccccn2 62a_100000047030_100011216584 [0,1,0,0,0,0|2,1,0]=4 1018 B15R2.38 Fc1cnccc1Sc2ccccn2 62a_100011216584_100000047030 [0,1,0,0,0,0|2,1,0]=4 1019 B15R2.38 Fc1cnccc1Sc2cccnc2 62a_100000047030_100000210063 [0,1,0,0,0,0|2,1,0]=4 1020 B15R2.38 Fc1cnccc1Sc2cccnc2 62a_100000210063_100000047030 [0,1,0,0,0,0|2,1,0]=4 1021 B15R2.38 Fc1cnccc1Sc2ccncc2 62a_100000047030_100000728582 [0,1,0,0,0,0|2,1,0]=4 1022 B15R2.38 Fc1cnccc1Sc2ccncc2 62a_100000728582_100000047030 [0,1,0,0,0,0|2,1,0]=4 1023 B15R2.38 Fc1cncnc1Nc2ccccc2 27a_100000106764_100000069762 [0,1,0,0,0,0|3,0,0]=4 1024 B15R2.38 Fc1cncnc1Sc2ccccc2 62a_100000069762_100000041952 [0,1,0,0,0,0|2,1,0]=4 1025 B15R2.38 Fc1cncnc1Sc2ccccc2 62a_100000719477_100000069762 [0,1,0,0,0,0|2,1,0]=4 1026 B15R2.38 Fc1ncccc1Sc2ccccc2 62a_100000719477_100009816115 [0,1,0,0,0,0|1,1,0]=3 1027 B15R2.38 Fc1ncccc1Sc2ccccc2 62a_100009816115_100000041952 [0,1,0,0,0,0|1,1,0]=3 1028 B15R2.38 Fc1ncccc1Sc2ccccn2 62a_100009816115_100011216584 [0,1,0,0,0,0|2,1,0]=4 1029 B15R2.38 Fc1ncccc1Sc2ccccn2 62a_100011216584_100009816115 [0,1,0,0,0,0|2,1,0]=4 1030 B15R2.38 Fc1ncccc1Sc2cccnc2 62a_100000210063_100009816115 [0,1,0,0,0,0|2,1,0]=4 1031 B15R2.38 Fc1ncccc1Sc2cccnc2 62a_100009816115_100000210063 [0,1,0,0,0,0|2,1,0]=4 1032 B15R2.38 Fc1ncccc1Sc2ccncc2 62a_100000728582_100009816115 [0,1,0,0,0,0|2,1,0]=4 1033 B15R2.38 Fc1ncccc1Sc2ccncc2 62a_100009816115_100000728582 [0,1,0,0,0,0|2,1,0]=4 1034 B15R2.38 Fc1nccnc1Nc2ccccc2 27a_100000106764_200010125657 [0,1,0,0,0,0|3,0,0]=4 1035 B15R2.38 Fc1nccnc1Sc2ccccc2 62a_100000719477_200010125657 [0,1,0,0,0,0|2,1,0]=4 1036 B15R2.38 Fc1nccnc1Sc2ccccc2 62a_200010125657_100000041952 [0,1,0,0,0,0|2,1,0]=4 1037 B15R2.38 Ic1ccccc1Nc2cccnn2 27a_100000210053_100016991348 [0,1,0,0,0,0|3,0,0]=4 1038 B15R2.38 Ic1ccccc1Nc2ccncn2 27a_100000210053_100000703185 [0,1,0,0,0,0|3,0,0]=4 1039 B15R2.38 Ic1ccccc1Nc2cnccn2 27a_100000210053_100000211759 [0,1,0,0,0,0|3,0,0]=4 1040 B15R2.38 Ic1ccccc1Nc2ncccn2 27a_100000210053_100000211032 [0,1,0,0,0,0|3,0,0]=4 1041 B15R2.38 Nc1ccccc1Sc2ccccc2 62a_100000210017_100000041952 [0,1,0,0,0,0|0,1,0]=2 1042 B15R2.38 Nc1ccccc1Sc2ccccc2 62a_100000719477_100000210017 [0,1,0,0,0,0|0,1,0]=2 1043 B15R2.38 Nc1ccccc1Sc2ccccn2 62a_100000210017_100011216584 [0,1,0,0,0,0|1,1,0]=3 1044 B15R2.38 Nc1ccccc1Sc2ccccn2 62a_100011216584_100000210017 [0,1,0,0,0,0|1,1,0]=3 1045 B15R2.38 Nc1ccccc1Sc2cccnc2 62a_100000210017_100000210063 [0,1,0,0,0,0|1,1,0]=3 1046 B15R2.38 Nc1ccccc1Sc2cccnc2 62a_100000210063_100000210017 [0,1,0,0,0,0|1,1,0]=3 1047 B15R2.38 Nc1ccccc1Sc2cccnn2 62a_100000210017_100016991348 [0,1,0,0,0,0|2,1,0]=4 1048 B15R2.38 Nc1ccccc1Sc2cccnn2 62a_100016991348_100000210017 [0,1,0,0,0,0|2,1,0]=4 1049 B15R2.38 Nc1ccccc1Sc2ccncc2 62a_100000210017_100000728582 [0,1,0,0,0,0|1,1,0]=3 1050 B15R2.38 Nc1ccccc1Sc2ccncc2 62a_100000728582_100000210017 [0,1,0,0,0,0|1,1,0]=3 1051 B15R2.38 Nc1ccccc1Sc2ccncn2 62a_100000210017_100000703185 [0,1,0,0,0,0|2,1,0]=4 1052 B15R2.38 Nc1ccccc1Sc2ccncn2 62a_100000703185_100000210017 [0,1,0,0,0,0|2,1,0]=4 1053 B15R2.38 Nc1ccccc1Sc2ccnnc2 62a_100000210017_100000732662 [0,1,0,0,0,0|2,1,0]=4 1054 B15R2.38 Nc1ccccc1Sc2ccnnc2 62a_100000732662_100000210017 [0,1,0,0,0,0|2,1,0]=4 1055 B15R2.38 Nc1ccccc1Sc2cnccn2 62a_100000210017_100000211759 [0,1,0,0,0,0|2,1,0]=4 1056 B15R2.38 Nc1ccccc1Sc2cnccn2 62a_100000211759_100000210017 [0,1,0,0,0,0|2,1,0]=4 1057 B15R2.38 Nc1ccccc1Sc2cncnc2 62a_100000210017_100011206942 [0,1,0,0,0,0|2,1,0]=4 1058 B15R2.38 Nc1ccccc1Sc2cncnc2 62a_100011206942_100000210017 [0,1,0,0,0,0|2,1,0]=4 1059 B15R2.38 Nc1ccccc1Sc2ncccn2 62a_100000210017_100000211032 [0,1,0,0,0,0|2,1,0]=4 1060 B15R2.38 Nc1ccccc1Sc2ncccn2 62a_100000211032_100000210017 [0,1,0,0,0,0|2,1,0]=4 1061 B15R2.38 Nc1cccnc1Sc2ccccc2 62a_100000688686_100000041952 [0,1,0,0,0,0|1,1,0]=3 1062 B15R2.38 Nc1cccnc1Sc2ccccc2 62a_100000719477_100000688686 [0,1,0,0,0,0|1,1,0]=3 1063 B15R2.38 Nc1cccnc1Sc2ccccn2 62a_100000688686_100011216584 [0,1,0,0,0,0|2,1,0]=4 1064 B15R2.38 Nc1cccnc1Sc2ccccn2 62a_100011216584_100000688686 [0,1,0,0,0,0|2,1,0]=4 1065 B15R2.38 Nc1cccnc1Sc2cccnc2 62a_100000210063_100000688686 [0,1,0,0,0,0|2,1,0]=4 1066 B15R2.38 Nc1cccnc1Sc2cccnc2 62a_100000688686_100000210063 [0,1,0,0,0,0|2,1,0]=4 1067 B15R2.38 Nc1cccnc1Sc2ccncc2 62a_100000688686_100000728582 [0,1,0,0,0,0|2,1,0]=4 1068 B15R2.38 Nc1cccnc1Sc2ccncc2 62a_100000728582_100000688686 [0,1,0,0,0,0|2,1,0]=4 1069 B15R2.38 Nc1ccncc1Sc2ccccc2 62a_100000047001_100000041952 [0,1,0,0,0,0|1,1,0]=3 1070 B15R2.38 Nc1ccncc1Sc2ccccc2 62a_100000719477_100000047001 [0,1,0,0,0,0|1,1,0]=3 1071 B15R2.38 Nc1ccncc1Sc2ccccn2 62a_100000047001_100011216584 [0,1,0,0,0,0|2,1,0]=4 1072 B15R2.38 Nc1ccncc1Sc2ccccn2 62a_100011216584_100000047001 [0,1,0,0,0,0|2,1,0]=4 1073 B15R2.38 Nc1ccncc1Sc2cccnc2 62a_100000047001_100000210063 [0,1,0,0,0,0|2,1,0]=4 1074 B15R2.38 Nc1ccncc1Sc2cccnc2 62a_100000210063_100000047001 [0,1,0,0,0,0|2,1,0]=4 1075 B15R2.38 Nc1ccncc1Sc2ccncc2 62a_100000047001_100000728582 [0,1,0,0,0,0|2,1,0]=4 1076 B15R2.38 Nc1ccncc1Sc2ccncc2 62a_100000728582_100000047001 [0,1,0,0,0,0|2,1,0]=4 1077 B15R2.38 Nc1cnccc1Sc2ccccc2 62a_100000719477_100000756074 [0,1,0,0,0,0|1,1,0]=3 1078 B15R2.38 Nc1cnccc1Sc2ccccc2 62a_100000756074_100000041952 [0,1,0,0,0,0|1,1,0]=3 1079 B15R2.38 Nc1cnccc1Sc2ccccn2 62a_100000756074_100011216584 [0,1,0,0,0,0|2,1,0]=4 1080 B15R2.38 Nc1cnccc1Sc2ccccn2 62a_100011216584_100000756074 [0,1,0,0,0,0|2,1,0]=4 1081 B15R2.38 Nc1cnccc1Sc2cccnc2 62a_100000210063_100000756074 [0,1,0,0,0,0|2,1,0]=4 1082 B15R2.38 Nc1cnccc1Sc2cccnc2 62a_100000756074_100000210063 [0,1,0,0,0,0|2,1,0]=4 1083 B15R2.38 Nc1cnccc1Sc2ccncc2 62a_100000728582_100000756074 [0,1,0,0,0,0|2,1,0]=4 1084 B15R2.38 Nc1cnccc1Sc2ccncc2 62a_100000756074_100000728582 [0,1,0,0,0,0|2,1,0]=4 1085 B15R2.38 Nc1cncnc1Nc2ccccc2 27a_100000106764_100000709731 [0,1,0,0,0,0|3,0,0]=4 1086 B15R2.38 Nc1cncnc1Sc2ccccc2 62a_100000709731_100000041952 [0,1,0,0,0,0|2,1,0]=4 1087 B15R2.38 Nc1cncnc1Sc2ccccc2 62a_100000719477_100000709731 [0,1,0,0,0,0|2,1,0]=4 1088 B15R2.38 Nc1cnncc1Sc2ccccc2 62a_100000719477_100009829405 [0,1,0,0,0,0|2,1,0]=4 1089 B15R2.38 Nc1cnncc1Sc2ccccc2 62a_100009829405_100000041952 [0,1,0,0,0,0|2,1,0]=4 1090 B15R2.38 Nc1ncccc1Sc2ccccc2 62a_100000045569_100000041952 [0,1,0,0,0,0|1,1,0]=3 1091 B15R2.38 Nc1ncccc1Sc2ccccc2 62a_100000719477_100000045569 [0,1,0,0,0,0|1,1,0]=3 1092 B15R2.38 Nc1ncccc1Sc2ccccn2 62a_100000045569_100011216584 [0,1,0,0,0,0|2,1,0]=4 1093 B15R2.38 Nc1ncccc1Sc2ccccn2 62a_100011216584_100000045569 [0,1,0,0,0,0|2,1,0]=4 1094 B15R2.38 Nc1ncccc1Sc2cccnc2 62a_100000045569_100000210063 [0,1,0,0,0,0|2,1,0]=4 1095 B15R2.38 Nc1ncccc1Sc2cccnc2 62a_100000210063_100000045569 [0,1,0,0,0,0|2,1,0]=4 1096 B15R2.38 Nc1ncccc1Sc2ccncc2 62a_100000045569_100000728582 [0,1,0,0,0,0|2,1,0]=4 1097 B15R2.38 Nc1ncccc1Sc2ccncc2 62a_100000728582_100000045569 [0,1,0,0,0,0|2,1,0]=4 1098 B15R2.38 Nc1nccnc1Sc2ccccc2 62a_100000719477_100000747729 [0,1,0,0,0,0|2,1,0]=4 1099 B15R2.38 Nc1nccnc1Sc2ccccc2 62a_100000747729_100000041952 [0,1,0,0,0,0|2,1,0]=4 1100 B15R2.38 Nc1ncncc1Sc2ccccc2 62a_100000719477_100011996079 [0,1,0,0,0,0|2,1,0]=4 1101 B15R2.38 Nc1ncncc1Sc2ccccc2 62a_100011996079_100000041952 [0,1,0,0,0,0|2,1,0]=4 1102 B15R2.38 O=c1[nH]ccnc1Sc2ccccc2 62a_100000719477_100000763361 [0,1,0,0,0,0|2,1,0]=4 1103 B15R2.38 O=c1[nH]nccc1Nc2ccccc2 27a_100000106764_100000087129 [0,1,0,0,0,0|3,0,0]=4 1104 B15R2.38 O=c1[nH]nccc1Sc2ccccc2 62a_100000719477_100000087129 [0,1,0,0,0,0|2,1,0]=4 1105 B15R2.38 O=c1cc[nH]cc1Sc2ccccc2 62a_100000719477_100009998708 [0,1,0,0,0,0|1,1,0]=3 1106 B15R2.38 O=c1cc[nH]cc1Sc2ccccc2 62a_100009998708_100000041952 [0,1,0,0,0,0|1,1,0]=3 1107 B15R2.38 O=c1cc[nH]cc1Sc2ccccn2 62a_100009998708_100011216584 [0,1,0,0,0,0|2,1,0]=4 1108 B15R2.38 O=c1cc[nH]cc1Sc2ccccn2 62a_100011216584_100009998708 [0,1,0,0,0,0|2,1,0]=4 1109 B15R2.38 O=c1cc[nH]cc1Sc2cccnc2 62a_100000210063_100009998708 [0,1,0,0,0,0|2,1,0]=4 1110 B15R2.38 O=c1cc[nH]cc1Sc2cccnc2 62a_100009998708_100000210063 [0,1,0,0,0,0|2,1,0]=4 1111 B15R2.38 O=c1cc[nH]cc1Sc2ccncc2 62a_100000728582_100009998708 [0,1,0,0,0,0|2,1,0]=4 1112 B15R2.38 O=c1cc[nH]cc1Sc2ccncc2 62a_100009998708_100000728582 [0,1,0,0,0,0|2,1,0]=4 1113 B15R2.38 Oc1ccccc1Cc2ccccc2 271570a_203496583355_200011216382 [0,1,0,0,0,0|1,0,0]=2 1114 B15R2.38 Oc1ccccc1Nc2cccnn2 27a_100000185747_100016991348 [0,1,0,0,0,0|3,0,0]=4 1115 B15R2.38 Oc1ccccc1Nc2ccncn2 27a_100000185747_100000703185 [0,1,0,0,0,0|3,0,0]=4 1116 B15R2.38 Oc1ccccc1Nc2cnccn2 27a_100000185747_100000211759 [0,1,0,0,0,0|3,0,0]=4 1117 B15R2.38 Oc1ccccc1Nc2ncccn2 27a_100000185747_100000211032 [0,1,0,0,0,0|3,0,0]=4 1118 B15R2.38 Oc1ccccc1Oc2ccccc2 271570a_203496583355_100000049502 [0,1,0,0,0,0|0,0,0]=1 1119 B15R2.38 Oc1ccccc1Sc2ccccc2 62a_100000719477_100000739446 [0,1,0,0,0,0|0,1,0]=2 1120 B15R2.38 Oc1ccccc1Sc2ccccc2 62a_100000739446_100000041952 [0,1,0,0,0,0|0,1,0]=2 1121 B15R2.38 Oc1ccccc1Sc2ccccn2 62a_100000739446_100011216584 [0,1,0,0,0,0|1,1,0]=3 1122 B15R2.38 Oc1ccccc1Sc2ccccn2 62a_100011216584_100000739446 [0,1,0,0,0,0|1,1,0]=3 1123 B15R2.38 Oc1ccccc1Sc2cccnc2 62a_100000210063_100000739446 [0,1,0,0,0,0|1,1,0]=3 1124 B15R2.38 Oc1ccccc1Sc2cccnc2 62a_100000739446_100000210063 [0,1,0,0,0,0|1,1,0]=3 1125 B15R2.38 Oc1ccccc1Sc2cccnn2 62a_100000739446_100016991348 [0,1,0,0,0,0|2,1,0]=4 1126 B15R2.38 Oc1ccccc1Sc2cccnn2 62a_100016991348_100000739446 [0,1,0,0,0,0|2,1,0]=4 1127 B15R2.38 Oc1ccccc1Sc2ccncc2 62a_100000728582_100000739446 [0,1,0,0,0,0|1,1,0]=3 1128 B15R2.38 Oc1ccccc1Sc2ccncc2 62a_100000739446_100000728582 [0,1,0,0,0,0|1,1,0]=3 1129 B15R2.38 Oc1ccccc1Sc2ccncn2 62a_100000703185_100000739446 [0,1,0,0,0,0|2,1,0]=4 1130 B15R2.38 Oc1ccccc1Sc2ccncn2 62a_100000739446_100000703185 [0,1,0,0,0,0|2,1,0]=4 1131 B15R2.38 Oc1ccccc1Sc2ccnnc2 62a_100000732662_100000739446 [0,1,0,0,0,0|2,1,0]=4 1132 B15R2.38 Oc1ccccc1Sc2ccnnc2 62a_100000739446_100000732662 [0,1,0,0,0,0|2,1,0]=4 1133 B15R2.38 Oc1ccccc1Sc2cnccn2 62a_100000211759_100000739446 [0,1,0,0,0,0|2,1,0]=4 1134 B15R2.38 Oc1ccccc1Sc2cnccn2 62a_100000739446_100000211759 [0,1,0,0,0,0|2,1,0]=4 1135 B15R2.38 Oc1ccccc1Sc2cncnc2 62a_100000739446_100011206942 [0,1,0,0,0,0|2,1,0]=4 1136 B15R2.38 Oc1ccccc1Sc2cncnc2 62a_100011206942_100000739446 [0,1,0,0,0,0|2,1,0]=4 1137 B15R2.38 Oc1ccccc1Sc2ncccn2 62a_100000211032_100000739446 [0,1,0,0,0,0|2,1,0]=4 1138 B15R2.38 Oc1ccccc1Sc2ncccn2 62a_100000739446_100000211032 [0,1,0,0,0,0|2,1,0]=4 1139 B15R2.38 Oc1cccnc1Sc2ccccc2 62a_100000034122_100000041952 [0,1,0,0,0,0|1,1,0]=3 1140 B15R2.38 Oc1cccnc1Sc2ccccc2 62a_100000719477_100000034122 [0,1,0,0,0,0|1,1,0]=3 1141 B15R2.38 Oc1cccnc1Sc2ccccn2 62a_100000034122_100011216584 [0,1,0,0,0,0|2,1,0]=4 1142 B15R2.38 Oc1cccnc1Sc2ccccn2 62a_100011216584_100000034122 [0,1,0,0,0,0|2,1,0]=4 1143 B15R2.38 Oc1cccnc1Sc2cccnc2 62a_100000034122_100000210063 [0,1,0,0,0,0|2,1,0]=4 1144 B15R2.38 Oc1cccnc1Sc2cccnc2 62a_100000210063_100000034122 [0,1,0,0,0,0|2,1,0]=4 1145 B15R2.38 Oc1cccnc1Sc2ccncc2 62a_100000034122_100000728582 [0,1,0,0,0,0|2,1,0]=4 1146 B15R2.38 Oc1cccnc1Sc2ccncc2 62a_100000728582_100000034122 [0,1,0,0,0,0|2,1,0]=4 1147 B15R2.38 Oc1cnccc1Sc2ccccc2 62a_100000719477_100009817591 [0,1,0,0,0,0|1,1,0]=3 1148 B15R2.38 Oc1cnccc1Sc2ccccc2 62a_100009817591_100000041952 [0,1,0,0,0,0|1,1,0]=3 1149 B15R2.38 Oc1cnccc1Sc2ccccn2 62a_100009817591_100011216584 [0,1,0,0,0,0|2,1,0]=4 1150 B15R2.38 Oc1cnccc1Sc2ccccn2 62a_100011216584_100009817591 [0,1,0,0,0,0|2,1,0]=4 1151 B15R2.38 Oc1cnccc1Sc2cccnc2 62a_100000210063_100009817591 [0,1,0,0,0,0|2,1,0]=4 1152 B15R2.38 Oc1cnccc1Sc2cccnc2 62a_100009817591_100000210063 [0,1,0,0,0,0|2,1,0]=4 1153 B15R2.38 Oc1cnccc1Sc2ccncc2 62a_100000728582_100009817591 [0,1,0,0,0,0|2,1,0]=4 1154 B15R2.38 Oc1cnccc1Sc2ccncc2 62a_100009817591_100000728582 [0,1,0,0,0,0|2,1,0]=4 1155 B15R2.38 Oc1ncccc1Sc2ccccc2 62a_100000719477_100000760158 [0,1,0,0,0,0|1,1,0]=3 1156 B15R2.38 Oc1ncccc1Sc2ccccc2 62a_100000760158_100000041952 [0,1,0,0,0,0|1,1,0]=3 1157 B15R2.38 Oc1ncccc1Sc2ccccn2 62a_100000760158_100011216584 [0,1,0,0,0,0|2,1,0]=4 1158 B15R2.38 Oc1ncccc1Sc2ccccn2 62a_100011216584_100000760158 [0,1,0,0,0,0|2,1,0]=4 1159 B15R2.38 Oc1ncccc1Sc2cccnc2 62a_100000210063_100000760158 [0,1,0,0,0,0|2,1,0]=4 1160 B15R2.38 Oc1ncccc1Sc2cccnc2 62a_100000760158_100000210063 [0,1,0,0,0,0|2,1,0]=4 1161 B15R2.38 Oc1ncccc1Sc2ccncc2 62a_100000728582_100000760158 [0,1,0,0,0,0|2,1,0]=4 1162 B15R2.38 Oc1ncccc1Sc2ccncc2 62a_100000760158_100000728582 [0,1,0,0,0,0|2,1,0]=4 1163 B15R2.38 Oc1ncncc1Sc2ccccc2 62a_100000719477_100000751107 [0,1,0,0,0,0|2,1,0]=4 1164 B15R2.38 Oc1ncncc1Sc2ccccc2 62a_100000751107_100000041952 [0,1,0,0,0,0|2,1,0]=4 1165 B15R2.38 S=c1cc[nH]cc1Sc2ccccc2 62a_100000719477_200012280681 [0,1,0,0,0,0|1,1,0]=3 1166 B15R2.38 S=c1cc[nH]cc1Sc2ccccc2 62a_200012280681_100000041952 [0,1,0,0,0,0|1,1,0]=3 1167 B15R2.38 S=c1cc[nH]cc1Sc2ccccn2 62a_100011216584_200012280681 [0,1,0,0,0,0|2,1,0]=4 1168 B15R2.38 S=c1cc[nH]cc1Sc2ccccn2 62a_200012280681_100011216584 [0,1,0,0,0,0|2,1,0]=4 1169 B15R2.38 S=c1cc[nH]cc1Sc2cccnc2 62a_100000210063_200012280681 [0,1,0,0,0,0|2,1,0]=4 1170 B15R2.38 S=c1cc[nH]cc1Sc2cccnc2 62a_200012280681_100000210063 [0,1,0,0,0,0|2,1,0]=4 1171 B15R2.38 S=c1cc[nH]cc1Sc2ccncc2 62a_100000728582_200012280681 [0,1,0,0,0,0|2,1,0]=4 1172 B15R2.38 S=c1cc[nH]cc1Sc2ccncc2 62a_200012280681_100000728582 [0,1,0,0,0,0|2,1,0]=4 1173 B15R2.38 [O-][n+]1ccccc1Sc2ccccc2 62a_100000719477_200000042595 [0,1,0,0,0,0|1,1,0]=3 1174 B15R2.38 [O-][n+]1ccccc1Sc2ccccn2 62a_100011216584_200000042595 [0,1,0,0,0,0|2,1,0]=4 1175 B15R2.38 [O-][n+]1ccccc1Sc2cccnc2 62a_100000210063_200000042595 [0,1,0,0,0,0|2,1,0]=4 1176 B15R2.38 [O-][n+]1ccccc1Sc2ccncc2 62a_100000728582_200000042595 [0,1,0,0,0,0|2,1,0]=4 1177 B15R2.2226 C=C(c1ccccc1)c2ccccc2 271570a_100000068269_100000210277 [0,1,0,0,0,0|1,0,0]=2 1178 B15R2.2226 C=C(c1ccccc1)c2ccccn2 271570a_100000068269_100011216584 [0,1,0,0,0,0|2,0,0]=3 1179 B15R2.2226 C=C(c1ccccc1)c2cccnc2 271570a_100000068269_100000752921 [0,1,0,0,0,0|2,0,0]=3 1180 B15R2.2226 C=C(c1ccccc1)c2cccnn2 271570a_100000068269_100016991348 [0,1,0,0,0,0|3,0,0]=4 1181 B15R2.2226 C=C(c1ccccc1)c2ccncc2 271570a_100000068269_100000035832 [0,1,0,0,0,0|2,0,0]=3 1182 B15R2.2226 C=C(c1ccccc1)c2ccncn2 271570a_100000068269_100000703185 [0,1,0,0,0,0|3,0,0]=4 1183 B15R2.2226 C=C(c1ccccc1)c2ccnnc2 271570a_100000068269_100000732662 [0,1,0,0,0,0|3,0,0]=4 1184 B15R2.2226 C=C(c1ccccc1)c2cnccn2 271570a_100000068269_100000758340 [0,1,0,0,0,0|3,0,0]=4 1185 B15R2.2226 C=C(c1ccccc1)c2cncnc2 271570a_100000068269_100011206942 [0,1,0,0,0,0|3,0,0]=4 1186 B15R2.2226 C=C(c1ccccc1)c2ncccn2 271570a_100000068269_100000211032 [0,1,0,0,0,0|3,0,0]=4 1187 B13R1.44 C=CC=CC(=O)Cc1ccccc1 1458a_100016291481_100015291786 [0,0,1,0,0,0|2,0,0]=3 1188 B13R1.44 C=CC=CC(=O)Cc1ccccn1 1458a_100016291481_100000721315 [0,0,1,0,0,0|3,0,0]=4 1189 B13R1.44 C=CC=CC(=O)Cc1cccnc1 1458a_100016291481_100000733263 [0,0,1,0,0,0|3,0,0]=4 1190 B13R1.44 C=CC=CC(=O)Cc1ccncc1 1458a_100016291481_100000705612 [0,0,1,0,0,0|3,0,0]=4 1191 B13R1.44 C=CC=CC(=O)Nc1ccccc1 1626a_100000106764_100016291481 [0,0,1,0,0,0|2,0,0]=3 1192 B13R1.44 C=CC=CC(=O)Nc1ccccc1 22a_100000106764_100016291481 [0,0,1,0,0,0|2,0,0]=3 1193 B13R2.3 c1cc(ccn1)c2ccncc2 271570a_100000752145_100000035832 [0,0,0,0,1,0|2,0,0]=3 1194 B13R2.3 c1cc(ccn1)c2ccncn2 271570a_100000752145_100000703185 [0,0,0,0,1,0|3,0,0]=4 1195 B13R2.3 c1cc(ccn1)c2ccnnc2 271570a_100000752145_100000732662 [0,0,0,0,1,0|3,0,0]=4 1196 B13R2.3 c1cc(ccn1)c2cnccn2 271570a_100000752145_100000758340 [0,0,0,0,1,0|3,0,0]=4 1197 B13R2.3 c1cc(ccn1)c2cnccn2 271570a_100011962566_100000035832 [0,0,0,0,1,0|3,0,0]=4 1198 B13R2.3 c1cc(ccn1)c2cncnc2 271570a_100000707473_100000035832 [0,0,0,0,1,0|3,0,0]=4 1199 B13R2.3 c1cc(ccn1)c2cncnc2 271570a_100000752145_100011206942 [0,0,0,0,1,0|3,0,0]=4 1200 B13R2.3 c1ccc(cc1)c2ccccc2 271570a_100011218836_100000210277 [0,0,0,0,1,0|0,0,0]=1 1201 B13R2.3 c1ccc(cc1)c2ccccn2 271570a_100011218836_100011216584 [0,0,0,0,1,0|1,0,0]=2 1202 B13R2.3 c1ccc(cc1)c2ccccn2 271570a_100011264011_100000210277 [0,0,0,0,1,0|1,0,0]=2 1203 B13R2.3 c1ccc(cc1)c2cccnc2 271570a_100000757648_100000210277 [0,0,0,0,1,0|1,0,0]=2 1204 B13R2.3 c1ccc(cc1)c2cccnc2 271570a_100011218836_100000752921 [0,0,0,0,1,0|1,0,0]=2 1205 B13R2.3 c1ccc(cc1)c2cccnn2 271570a_100011218836_100016991348 [0,0,0,0,1,0|2,0,0]=3 1206 B13R2.3 c1ccc(cc1)c2ccncc2 271570a_100000752145_100000210277 [0,0,0,0,1,0|1,0,0]=2 1207 B13R2.3 c1ccc(cc1)c2ccncc2 271570a_100011218836_100000035832 [0,0,0,0,1,0|1,0,0]=2 1208 B13R2.3 c1ccc(cc1)c2ccncn2 271570a_100011218836_100000703185 [0,0,0,0,1,0|2,0,0]=3 1209 B13R2.3 c1ccc(cc1)c2ccnnc2 271570a_100011218836_100000732662 [0,0,0,0,1,0|2,0,0]=3 1210 B13R2.3 c1ccc(cc1)c2cnccn2 271570a_100011218836_100000758340 [0,0,0,0,1,0|2,0,0]=3 1211 B13R2.3 c1ccc(cc1)c2cnccn2 271570a_100011962566_100000210277 [0,0,0,0,1,0|2,0,0]=3 1212 B13R2.3 c1ccc(cc1)c2cncnc2 271570a_100000707473_100000210277 [0,0,0,0,1,0|2,0,0]=3 1213 B13R2.3 c1ccc(cc1)c2cncnc2 271570a_100011218836_100011206942 [0,0,0,0,1,0|2,0,0]=3 1214 B13R2.3 c1ccc(cc1)c2cnnnc2 271570a_100011218836_100009846058 [0,0,0,0,1,0|3,0,0]=4 1215 B13R2.3 c1ccc(cc1)c2ncccn2 271570a_100011218836_100000211032 [0,0,0,0,1,0|2,0,0]=3 1216 B13R2.3 c1ccc(nc1)c2ccccn2 271570a_100011264011_100011216584 [0,0,0,0,1,0|2,0,0]=3 1217 B13R2.3 c1ccc(nc1)c2cccnc2 271570a_100000757648_100011216584 [0,0,0,0,1,0|2,0,0]=3 1218 B13R2.3 c1ccc(nc1)c2cccnc2 271570a_100011264011_100000752921 [0,0,0,0,1,0|2,0,0]=3 1219 B13R2.3 c1ccc(nc1)c2cccnn2 271570a_100011264011_100016991348 [0,0,0,0,1,0|3,0,0]=4 1220 B13R2.3 c1ccc(nc1)c2ccncc2 271570a_100000752145_100011216584 [0,0,0,0,1,0|2,0,0]=3 1221 B13R2.3 c1ccc(nc1)c2ccncc2 271570a_100011264011_100000035832 [0,0,0,0,1,0|2,0,0]=3 1222 B13R2.3 c1ccc(nc1)c2ccncn2 271570a_100011264011_100000703185 [0,0,0,0,1,0|3,0,0]=4 1223 B13R2.3 c1ccc(nc1)c2ccnnc2 271570a_100011264011_100000732662 [0,0,0,0,1,0|3,0,0]=4 1224 B13R2.3 c1ccc(nc1)c2cnccn2 271570a_100011264011_100000758340 [0,0,0,0,1,0|3,0,0]=4 1225 B13R2.3 c1ccc(nc1)c2cnccn2 271570a_100011962566_100011216584 [0,0,0,0,1,0|3,0,0]=4 1226 B13R2.3 c1ccc(nc1)c2cncnc2 271570a_100000707473_100011216584 [0,0,0,0,1,0|3,0,0]=4 1227 B13R2.3 c1ccc(nc1)c2cncnc2 271570a_100011264011_100011206942 [0,0,0,0,1,0|3,0,0]=4 1228 B13R2.3 c1ccc(nc1)c2ncccn2 271570a_100011264011_100000211032 [0,0,0,0,1,0|3,0,0]=4 1229 B13R2.3 c1cnc(nc1)c2cccnc2 271570a_100000757648_100000211032 [0,0,0,0,1,0|3,0,0]=4 1230 B13R2.3 c1cnc(nc1)c2ccncc2 271570a_100000752145_100000211032 [0,0,0,0,1,0|3,0,0]=4 1231 B13R2.3 c1cncc(c1)c2cccnc2 271570a_100000757648_100000752921 [0,0,0,0,1,0|2,0,0]=3 1232 B13R2.3 c1cncc(c1)c2cccnn2 271570a_100000757648_100016991348 [0,0,0,0,1,0|3,0,0]=4 1233 B13R2.3 c1cncc(c1)c2ccncc2 271570a_100000752145_100000752921 [0,0,0,0,1,0|2,0,0]=3 1234 B13R2.3 c1cncc(c1)c2ccncc2 271570a_100000757648_100000035832 [0,0,0,0,1,0|2,0,0]=3 1235 B13R2.3 c1cncc(c1)c2ccncn2 271570a_100000757648_100000703185 [0,0,0,0,1,0|3,0,0]=4 1236 B13R2.3 c1cncc(c1)c2ccnnc2 271570a_100000757648_100000732662 [0,0,0,0,1,0|3,0,0]=4 1237 B13R2.3 c1cncc(c1)c2cnccn2 271570a_100000757648_100000758340 [0,0,0,0,1,0|3,0,0]=4 1238 B13R2.3 c1cncc(c1)c2cnccn2 271570a_100011962566_100000752921 [0,0,0,0,1,0|3,0,0]=4 1239 B13R2.3 c1cncc(c1)c2cncnc2 271570a_100000707473_100000752921 [0,0,0,0,1,0|3,0,0]=4 1240 B13R2.3 c1cncc(c1)c2cncnc2 271570a_100000757648_100011206942 [0,0,0,0,1,0|3,0,0]=4 1241 B13R2.3 c1cnnc(c1)c2ccncc2 271570a_100000752145_100016991348 [0,0,0,0,1,0|3,0,0]=4 1242 B13R2.64 c1cc(ccn1)Sc2ccoc2 62a_100000728582_100011215275 [0,0,0,0,1,0|2,1,0]=4 1243 B13R2.64 c1cc(ccn1)Sc2ccoc2 62a_100011215275_100000728582 [0,0,0,0,1,0|2,1,0]=4 1244 B13R2.64 c1cc(ccn1)Sc2ccsc2 62a_100000728582_100000738268 [0,0,0,0,1,0|2,1,0]=4 1245 B13R2.64 c1cc(ccn1)Sc2ccsc2 62a_100000738268_100000728582 [0,0,0,0,1,0|2,1,0]=4 1246 B13R2.64 c1ccc(cc1)Sc2c[nH]cn2 62a_100000719477_100000756875 [0,0,0,0,1,0|2,1,0]=4 1247 B13R2.64 c1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000041952 [0,0,0,0,1,0|2,1,0]=4 1248 B13R2.64 c1ccc(cc1)Sc2cc[nH]n2 62a_100000062575_100000041952 [0,0,0,0,1,0|2,1,0]=4 1249 B13R2.64 c1ccc(cc1)Sc2cc[nH]n2 62a_100000719477_100000062575 [0,0,0,0,1,0|2,1,0]=4 1250 B13R2.64 c1ccc(cc1)Sc2ccco2 62a_100000719477_100009814098 [0,0,0,0,1,0|1,1,0]=3 1251 B13R2.64 c1ccc(cc1)Sc2ccco2 62a_100009814098_100000041952 [0,0,0,0,1,0|1,1,0]=3 1252 B13R2.64 c1ccc(cc1)Sc2cccs2 62a_100000719477_100011215356 [0,0,0,0,1,0|1,1,0]=3 1253 B13R2.64 c1ccc(cc1)Sc2cccs2 62a_100011215356_100000041952 [0,0,0,0,1,0|1,1,0]=3 1254 B13R2.64 c1ccc(cc1)Sc2ccoc2 62a_100000719477_100011215275 [0,0,0,0,1,0|1,1,0]=3 1255 B13R2.64 c1ccc(cc1)Sc2ccoc2 62a_100011215275_100000041952 [0,0,0,0,1,0|1,1,0]=3 1256 B13R2.64 c1ccc(cc1)Sc2ccon2 62a_100000719477_100009818083 [0,0,0,0,1,0|2,1,0]=4 1257 B13R2.64 c1ccc(cc1)Sc2ccon2 62a_100009818083_100000041952 [0,0,0,0,1,0|2,1,0]=4 1258 B13R2.64 c1ccc(cc1)Sc2ccsc2 62a_100000719477_100000738268 [0,0,0,0,1,0|1,1,0]=3 1259 B13R2.64 c1ccc(cc1)Sc2ccsc2 62a_100000738268_100000041952 [0,0,0,0,1,0|1,1,0]=3 1260 B13R2.64 c1ccc(cc1)Sc2ccsn2 62a_100000719477_100009818082 [0,0,0,0,1,0|2,1,0]=4 1261 B13R2.64 c1ccc(cc1)Sc2ccsn2 62a_100009818082_100000041952 [0,0,0,0,1,0|2,1,0]=4 1262 B13R2.64 c1ccc(cc1)Sc2cn[nH]c2 62a_100000238712_100000041952 [0,0,0,0,1,0|2,1,0]=4 1263 B13R2.64 c1ccc(cc1)Sc2cn[nH]c2 62a_100000719477_100000238712 [0,0,0,0,1,0|2,1,0]=4 1264 B13R2.64 c1ccc(cc1)Sc2cnco2 62a_100000719477_100020591547 [0,0,0,0,1,0|2,1,0]=4 1265 B13R2.64 c1ccc(cc1)Sc2cnco2 62a_100020591547_100000041952 [0,0,0,0,1,0|2,1,0]=4 1266 B13R2.64 c1ccc(cc1)Sc2cncs2 62a_100000719477_100011934649 [0,0,0,0,1,0|2,1,0]=4 1267 B13R2.64 c1ccc(cc1)Sc2cncs2 62a_100011934649_100000041952 [0,0,0,0,1,0|2,1,0]=4 1268 B13R2.64 c1ccc(cc1)Sc2cnoc2 62a_100000719477_100009815712 [0,0,0,0,1,0|2,1,0]=4 1269 B13R2.64 c1ccc(cc1)Sc2cnoc2 62a_100009815712_100000041952 [0,0,0,0,1,0|2,1,0]=4 1270 B13R2.64 c1ccc(cc1)Sc2cnsc2 62a_100000719477_100009815736 [0,0,0,0,1,0|2,1,0]=4 1271 B13R2.64 c1ccc(cc1)Sc2cnsc2 62a_100009815736_100000041952 [0,0,0,0,1,0|2,1,0]=4 1272 B13R2.64 c1ccc(cc1)Sc2cscn2 62a_100000719477_100000751502 [0,0,0,0,1,0|2,1,0]=4 1273 B13R2.64 c1ccc(cc1)Sc2cscn2 62a_100000751502_100000041952 [0,0,0,0,1,0|2,1,0]=4 1274 B13R2.64 c1ccc(cc1)Sc2ncc[nH]2 62a_100000719477_100025796157 [0,0,0,0,1,0|2,1,0]=4 1275 B13R2.64 c1ccc(cc1)Sc2ncc[nH]2 62a_100025796157_100000041952 [0,0,0,0,1,0|2,1,0]=4 1276 B13R2.64 c1ccc(cc1)Sc2ncco2 62a_100000719477_100011787736 [0,0,0,0,1,0|2,1,0]=4 1277 B13R2.64 c1ccc(cc1)Sc2ncco2 62a_100011787736_100000041952 [0,0,0,0,1,0|2,1,0]=4 1278 B13R2.64 c1ccc(cc1)Sc2nccs2 62a_100000211983_100000041952 [0,0,0,0,1,0|2,1,0]=4 1279 B13R2.64 c1ccc(cc1)Sc2nccs2 62a_100000719477_100000211983 [0,0,0,0,1,0|2,1,0]=4 1280 B13R2.64 c1ccc(nc1)Sc2ccco2 62a_100009814098_100011216584 [0,0,0,0,1,0|2,1,0]=4 1281 B13R2.64 c1ccc(nc1)Sc2ccco2 62a_100011216584_100009814098 [0,0,0,0,1,0|2,1,0]=4 1282 B13R2.64 c1ccc(nc1)Sc2cccs2 62a_100011215356_100011216584 [0,0,0,0,1,0|2,1,0]=4 1283 B13R2.64 c1ccc(nc1)Sc2cccs2 62a_100011216584_100011215356 [0,0,0,0,1,0|2,1,0]=4 1284 B13R2.64 c1ccc(nc1)Sc2ccoc2 62a_100011215275_100011216584 [0,0,0,0,1,0|2,1,0]=4 1285 B13R2.64 c1ccc(nc1)Sc2ccoc2 62a_100011216584_100011215275 [0,0,0,0,1,0|2,1,0]=4 1286 B13R2.64 c1ccc(nc1)Sc2ccsc2 62a_100000738268_100011216584 [0,0,0,0,1,0|2,1,0]=4 1287 B13R2.64 c1ccc(nc1)Sc2ccsc2 62a_100011216584_100000738268 [0,0,0,0,1,0|2,1,0]=4 1288 B13R2.64 c1cncc(c1)Sc2ccco2 62a_100000210063_100009814098 [0,0,0,0,1,0|2,1,0]=4 1289 B13R2.64 c1cncc(c1)Sc2ccco2 62a_100009814098_100000210063 [0,0,0,0,1,0|2,1,0]=4 1290 B13R2.64 c1cncc(c1)Sc2cccs2 62a_100000210063_100011215356 [0,0,0,0,1,0|2,1,0]=4 1291 B13R2.64 c1cncc(c1)Sc2cccs2 62a_100011215356_100000210063 [0,0,0,0,1,0|2,1,0]=4 1292 B13R2.64 c1cncc(c1)Sc2ccoc2 62a_100000210063_100011215275 [0,0,0,0,1,0|2,1,0]=4 1293 B13R2.64 c1cncc(c1)Sc2ccoc2 62a_100011215275_100000210063 [0,0,0,0,1,0|2,1,0]=4 1294 B13R2.64 c1cncc(c1)Sc2ccsc2 62a_100000210063_100000738268 [0,0,0,0,1,0|2,1,0]=4 1295 B13R2.64 c1cncc(c1)Sc2ccsc2 62a_100000738268_100000210063 [0,0,0,0,1,0|2,1,0]=4 1296 B13R2.64 c1coc(c1)Sc2ccncc2 62a_100000728582_100009814098 [0,0,0,0,1,0|2,1,0]=4 1297 B13R2.64 c1coc(c1)Sc2ccncc2 62a_100009814098_100000728582 [0,0,0,0,1,0|2,1,0]=4 1298 B13R2.64 c1csc(c1)Sc2ccncc2 62a_100000728582_100011215356 [0,0,0,0,1,0|2,1,0]=4 1299 B13R2.64 c1csc(c1)Sc2ccncc2 62a_100011215356_100000728582 [0,0,0,0,1,0|2,1,0]=4 1300 B15R2.2195 C(#Cc1ccccc1)c2ccccc2 271570a_100000069678_100000210277 [0,0,0,0,0,1|1,0,0]=2 1301 B15R2.2195 C(#Cc1ccccn1)c2ccccc2 271570a_100000069678_100011216584 [0,0,0,0,0,1|2,0,0]=3 1302 B15R2.2195 C(#Cc1cccnc1)c2ccccc2 271570a_100000069678_100000752921 [0,0,0,0,0,1|2,0,0]=3 1303 B15R2.2195 C(#Cc1cccnn1)c2ccccc2 271570a_100000069678_100016991348 [0,0,0,0,0,1|3,0,0]=4 1304 B15R2.2195 C(#Cc1ccncc1)c2ccccc2 271570a_100000069678_100000035832 [0,0,0,0,0,1|2,0,0]=3 1305 B15R2.2195 C(#Cc1ccncn1)c2ccccc2 271570a_100000069678_100000703185 [0,0,0,0,0,1|3,0,0]=4 1306 B15R2.2195 C(#Cc1ccnnc1)c2ccccc2 271570a_100000069678_100000732662 [0,0,0,0,0,1|3,0,0]=4 1307 B15R2.2195 C(#Cc1cnccn1)c2ccccc2 271570a_100000069678_100000758340 [0,0,0,0,0,1|3,0,0]=4 1308 B15R2.2195 C(#Cc1cncnc1)c2ccccc2 271570a_100000069678_100011206942 [0,0,0,0,0,1|3,0,0]=4 1309 B15R2.2195 C(#Cc1ncccn1)c2ccccc2 271570a_100000069678_100000211032 [0,0,0,0,0,1|3,0,0]=4 1310 B15R2.2195 C(=Cc1ccccc1)c2ccccc2 271570a_100102527694_100000210277 [0,0,0,0,0,1|1,0,0]=2 1311 B15R2.2195 C(=Cc1ccccn1)c2ccccc2 271570a_100102527694_100011216584 [0,0,0,0,0,1|2,0,0]=3 1312 B15R2.2195 C(=Cc1ccccn1)c2cccnc2 271570a_100102525586_100011216584 [0,0,0,0,0,1|3,0,0]=4 1313 B15R2.2195 C(=Cc1cccnc1)c2ccccc2 271570a_100102525586_100000210277 [0,0,0,0,0,1|2,0,0]=3 1314 B15R2.2195 C(=Cc1cccnc1)c2ccccc2 271570a_100102527694_100000752921 [0,0,0,0,0,1|2,0,0]=3 1315 B15R2.2195 C(=Cc1cccnc1)c2cccnc2 271570a_100102525586_100000752921 [0,0,0,0,0,1|3,0,0]=4 1316 B15R2.2195 C(=Cc1cccnc1)c2ccncc2 271570a_100102525586_100000035832 [0,0,0,0,0,1|3,0,0]=4 1317 B15R2.2195 C(=Cc1cccnn1)c2ccccc2 271570a_100102527694_100016991348 [0,0,0,0,0,1|3,0,0]=4 1318 B15R2.2195 C(=Cc1ccncc1)c2ccccc2 271570a_100102527694_100000035832 [0,0,0,0,0,1|2,0,0]=3 1319 B15R2.2195 C(=Cc1ccncn1)c2ccccc2 271570a_100102527694_100000703185 [0,0,0,0,0,1|3,0,0]=4 1320 B15R2.2195 C(=Cc1ccnnc1)c2ccccc2 271570a_100102527694_100000732662 [0,0,0,0,0,1|3,0,0]=4 1321 B15R2.2195 C(=Cc1cnccn1)c2ccccc2 271570a_100102527694_100000758340 [0,0,0,0,0,1|3,0,0]=4 1322 B15R2.2195 C(=Cc1cncnc1)c2ccccc2 271570a_100102527694_100011206942 [0,0,0,0,0,1|3,0,0]=4 1323 B15R2.2195 C(=Cc1ncccn1)c2ccccc2 271570a_100102527694_100000211032 [0,0,0,0,0,1|3,0,0]=4 1324 B15R2.2195 c1cc(ccn1)COc2cncnc2 7a_100000754086_100015193705 [0,0,0,0,0,1|3,0,0]=4 1325 B15R2.2195 c1cc(ccn1)CSc2ccncc2 62a_100000728582_100015193705 [0,0,0,0,0,1|2,1,0]=4 1326 B15R2.2195 c1cc(ccn1)CSc2ccncc2 62a_100015193705_100000728582 [0,0,0,0,0,1|2,1,0]=4 1327 B15R2.2195 c1cc(ccn1)OCc2cnccn2 34a_100000212176_100016995436 [0,0,0,0,0,1|3,0,0]=4 1328 B15R2.2195 c1cc(ccn1)OCc2cncnc2 34a_100000212176_100015196519 [0,0,0,0,0,1|3,0,0]=4 1329 B15R2.2195 c1ccc(cc1)CNc2ccccc2 207a_100000106764_100015611070 [0,0,0,0,0,1|1,0,0]=2 1330 B15R2.2195 c1ccc(cc1)CNc2ccccc2 270302a_100000106764_100015611070 [0,0,0,0,0,1|1,0,0]=2 1331 B15R2.2195 c1ccc(cc1)CNc2ccccc2 34a_100000106764_100015291786 [0,0,0,0,0,1|1,0,0]=2 1332 B15R2.2195 c1ccc(cc1)CNc2cccnn2 27a_100015324214_100016991348 [0,0,0,0,0,1|3,0,0]=4 1333 B15R2.2195 c1ccc(cc1)CNc2ccncn2 27a_100015324214_100000703185 [0,0,0,0,0,1|3,0,0]=4 1334 B15R2.2195 c1ccc(cc1)CNc2cnccn2 27a_100015324214_100000211759 [0,0,0,0,0,1|3,0,0]=4 1335 B15R2.2195 c1ccc(cc1)CNc2ncccn2 27a_100015324214_100000211032 [0,0,0,0,0,1|3,0,0]=4 1336 B15R2.2195 c1ccc(cc1)COc2ccccc2 34a_100000210340_100015291786 [0,0,0,0,0,1|0,0,0]=1 1337 B15R2.2195 c1ccc(cc1)COc2ccccc2 7a_100000210340_100000211182 [0,0,0,0,0,1|0,0,0]=1 1338 B15R2.2195 c1ccc(cc1)COc2cccnc2 34a_100000210849_100015291786 [0,0,0,0,0,1|1,0,0]=2 1339 B15R2.2195 c1ccc(cc1)COc2cccnc2 7a_100000210849_100000211182 [0,0,0,0,0,1|1,0,0]=2 1340 B15R2.2195 c1ccc(cc1)COc2ccncc2 34a_100000212176_100015291786 [0,0,0,0,0,1|1,0,0]=2 1341 B15R2.2195 c1ccc(cc1)COc2ccnnc2 34a_100015204005_100015291786 [0,0,0,0,0,1|2,0,0]=3 1342 B15R2.2195 c1ccc(cc1)COc2cncnc2 7a_100000754086_100000211182 [0,0,0,0,0,1|2,0,0]=3 1343 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000211182_100000041952 [0,0,0,0,0,1|0,1,0]=2 1344 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000719477_100015291786 [0,0,0,0,0,1|0,1,0]=2 1345 B15R2.2195 c1ccc(cc1)CSc2ccccn2 62a_100000211182_100011216584 [0,0,0,0,0,1|1,1,0]=3 1346 B15R2.2195 c1ccc(cc1)CSc2ccccn2 62a_100011216584_100015291786 [0,0,0,0,0,1|1,1,0]=3 1347 B15R2.2195 c1ccc(cc1)CSc2cccnc2 62a_100000210063_100015291786 [0,0,0,0,0,1|1,1,0]=3 1348 B15R2.2195 c1ccc(cc1)CSc2cccnc2 62a_100000211182_100000210063 [0,0,0,0,0,1|1,1,0]=3 1349 B15R2.2195 c1ccc(cc1)CSc2cccnn2 62a_100000211182_100016991348 [0,0,0,0,0,1|2,1,0]=4 1350 B15R2.2195 c1ccc(cc1)CSc2cccnn2 62a_100016991348_100015291786 [0,0,0,0,0,1|2,1,0]=4 1351 B15R2.2195 c1ccc(cc1)CSc2ccncc2 62a_100000211182_100000728582 [0,0,0,0,0,1|1,1,0]=3 1352 B15R2.2195 c1ccc(cc1)CSc2ccncc2 62a_100000728582_100015291786 [0,0,0,0,0,1|1,1,0]=3 1353 B15R2.2195 c1ccc(cc1)CSc2ccncn2 62a_100000211182_100000703185 [0,0,0,0,0,1|2,1,0]=4 1354 B15R2.2195 c1ccc(cc1)CSc2ccncn2 62a_100000703185_100015291786 [0,0,0,0,0,1|2,1,0]=4 1355 B15R2.2195 c1ccc(cc1)CSc2ccnnc2 62a_100000211182_100000732662 [0,0,0,0,0,1|2,1,0]=4 1356 B15R2.2195 c1ccc(cc1)CSc2ccnnc2 62a_100000732662_100015291786 [0,0,0,0,0,1|2,1,0]=4 1357 B15R2.2195 c1ccc(cc1)CSc2cnccn2 62a_100000211182_100000211759 [0,0,0,0,0,1|2,1,0]=4 1358 B15R2.2195 c1ccc(cc1)CSc2cnccn2 62a_100000211759_100015291786 [0,0,0,0,0,1|2,1,0]=4 1359 B15R2.2195 c1ccc(cc1)CSc2cncnc2 62a_100000211182_100011206942 [0,0,0,0,0,1|2,1,0]=4 1360 B15R2.2195 c1ccc(cc1)CSc2cncnc2 62a_100011206942_100015291786 [0,0,0,0,0,1|2,1,0]=4 1361 B15R2.2195 c1ccc(cc1)CSc2ncccn2 62a_100000211032_100015291786 [0,0,0,0,0,1|2,1,0]=4 1362 B15R2.2195 c1ccc(cc1)CSc2ncccn2 62a_100000211182_100000211032 [0,0,0,0,0,1|2,1,0]=4 1363 B15R2.2195 c1ccc(cc1)NCc2ccccn2 207a_100000106764_100000209966 [0,0,0,0,0,1|2,0,0]=3 1364 B15R2.2195 c1ccc(cc1)NCc2ccccn2 270302a_100000106764_100000209966 [0,0,0,0,0,1|2,0,0]=3 1365 B15R2.2195 c1ccc(cc1)NCc2ccccn2 34a_100000106764_100000721315 [0,0,0,0,0,1|2,0,0]=3 1366 B15R2.2195 c1ccc(cc1)NCc2cccnc2 207a_100000106764_100000209961 [0,0,0,0,0,1|2,0,0]=3 1367 B15R2.2195 c1ccc(cc1)NCc2cccnc2 270302a_100000106764_100000209961 [0,0,0,0,0,1|2,0,0]=3 1368 B15R2.2195 c1ccc(cc1)NCc2cccnc2 34a_100000106764_100000733263 [0,0,0,0,0,1|2,0,0]=3 1369 B15R2.2195 c1ccc(cc1)NCc2cccnn2 34a_100000106764_100016990269 [0,0,0,0,0,1|3,0,0]=4 1370 B15R2.2195 c1ccc(cc1)NCc2ccncc2 207a_100000106764_100000186114 [0,0,0,0,0,1|2,0,0]=3 1371 B15R2.2195 c1ccc(cc1)NCc2ccnnc2 270302a_100000106764_100011934578 [0,0,0,0,0,1|3,0,0]=4 1372 B15R2.2195 c1ccc(cc1)NCc2cnccn2 34a_100000106764_100016995436 [0,0,0,0,0,1|3,0,0]=4 1373 B15R2.2195 c1ccc(cc1)NCc2cncnc2 270302a_100000106764_100000749868 [0,0,0,0,0,1|3,0,0]=4 1374 B15R2.2195 c1ccc(cc1)NCc2cncnc2 34a_100000106764_100015196519 [0,0,0,0,0,1|3,0,0]=4 1375 B15R2.2195 c1ccc(cc1)NCc2ncccn2 34a_100000106764_100000703007 [0,0,0,0,0,1|3,0,0]=4 1376 B15R2.2195 c1ccc(cc1)OCc2ccccn2 34a_100000210340_100000721315 [0,0,0,0,0,1|1,0,0]=2 1377 B15R2.2195 c1ccc(cc1)OCc2ccccn2 7a_100000210340_100000721315 [0,0,0,0,0,1|1,0,0]=2 1378 B15R2.2195 c1ccc(cc1)OCc2cccnc2 34a_100000210340_100000733263 [0,0,0,0,0,1|1,0,0]=2 1379 B15R2.2195 c1ccc(cc1)OCc2cccnc2 7a_100000210340_100000741622 [0,0,0,0,0,1|1,0,0]=2 1380 B15R2.2195 c1ccc(cc1)OCc2cccnn2 34a_100000210340_100016990269 [0,0,0,0,0,1|2,0,0]=3 1381 B15R2.2195 c1ccc(cc1)OCc2cccnn2 7a_100000210340_100016990269 [0,0,0,0,0,1|2,0,0]=3 1382 B15R2.2195 c1ccc(cc1)OCc2ccncc2 7a_100000210340_100015193705 [0,0,0,0,0,1|1,0,0]=2 1383 B15R2.2195 c1ccc(cc1)OCc2cnccn2 34a_100000210340_100016995436 [0,0,0,0,0,1|2,0,0]=3 1384 B15R2.2195 c1ccc(cc1)OCc2cnccn2 7a_100000210340_100016995436 [0,0,0,0,0,1|2,0,0]=3 1385 B15R2.2195 c1ccc(cc1)OCc2cncnc2 34a_100000210340_100015196519 [0,0,0,0,0,1|2,0,0]=3 1386 B15R2.2195 c1ccc(cc1)OCc2cncnc2 7a_100000210340_100015196519 [0,0,0,0,0,1|2,0,0]=3 1387 B15R2.2195 c1ccc(cc1)OCc2ncccn2 34a_100000210340_100000703007 [0,0,0,0,0,1|2,0,0]=3 1388 B15R2.2195 c1ccc(cc1)OCc2ncccn2 7a_100000210340_100000703007 [0,0,0,0,0,1|2,0,0]=3 1389 B15R2.2195 c1ccc(cc1)SCc2ccccn2 62a_100000719477_100000721315 [0,0,0,0,0,1|1,1,0]=3 1390 B15R2.2195 c1ccc(cc1)SCc2ccccn2 62a_100000721315_100000041952 [0,0,0,0,0,1|1,1,0]=3 1391 B15R2.2195 c1ccc(cc1)SCc2cccnc2 62a_100000719477_100000741622 [0,0,0,0,0,1|1,1,0]=3 1392 B15R2.2195 c1ccc(cc1)SCc2cccnc2 62a_100000741622_100000041952 [0,0,0,0,0,1|1,1,0]=3 1393 B15R2.2195 c1ccc(cc1)SCc2cccnn2 62a_100000719477_100016990269 [0,0,0,0,0,1|2,1,0]=4 1394 B15R2.2195 c1ccc(cc1)SCc2cccnn2 62a_100016990269_100000041952 [0,0,0,0,0,1|2,1,0]=4 1395 B15R2.2195 c1ccc(cc1)SCc2ccncc2 62a_100000719477_100015193705 [0,0,0,0,0,1|1,1,0]=3 1396 B15R2.2195 c1ccc(cc1)SCc2ccncc2 62a_100015193705_100000041952 [0,0,0,0,0,1|1,1,0]=3 1397 B15R2.2195 c1ccc(cc1)SCc2cnccn2 62a_100000719477_100016995436 [0,0,0,0,0,1|2,1,0]=4 1398 B15R2.2195 c1ccc(cc1)SCc2cnccn2 62a_100016995436_100000041952 [0,0,0,0,0,1|2,1,0]=4 1399 B15R2.2195 c1ccc(cc1)SCc2cncnc2 62a_100000719477_100015196519 [0,0,0,0,0,1|2,1,0]=4 1400 B15R2.2195 c1ccc(cc1)SCc2cncnc2 62a_100015196519_100000041952 [0,0,0,0,0,1|2,1,0]=4 1401 B15R2.2195 c1ccc(cc1)SCc2ncccn2 62a_100000703007_100000041952 [0,0,0,0,0,1|2,1,0]=4 1402 B15R2.2195 c1ccc(cc1)SCc2ncccn2 62a_100000719477_100000703007 [0,0,0,0,0,1|2,1,0]=4 1403 B15R2.2195 c1ccc(nc1)COc2cccnc2 34a_100000210849_100000721315 [0,0,0,0,0,1|2,0,0]=3 1404 B15R2.2195 c1ccc(nc1)COc2cccnc2 7a_100000210849_100000721315 [0,0,0,0,0,1|2,0,0]=3 1405 B15R2.2195 c1ccc(nc1)COc2ccncc2 34a_100000212176_100000721315 [0,0,0,0,0,1|2,0,0]=3 1406 B15R2.2195 c1ccc(nc1)COc2ccnnc2 34a_100015204005_100000721315 [0,0,0,0,0,1|3,0,0]=4 1407 B15R2.2195 c1ccc(nc1)COc2cncnc2 7a_100000754086_100000721315 [0,0,0,0,0,1|3,0,0]=4 1408 B15R2.2195 c1ccc(nc1)CSc2ccccn2 62a_100000721315_100011216584 [0,0,0,0,0,1|2,1,0]=4 1409 B15R2.2195 c1ccc(nc1)CSc2ccccn2 62a_100011216584_100000721315 [0,0,0,0,0,1|2,1,0]=4 1410 B15R2.2195 c1ccc(nc1)CSc2cccnc2 62a_100000210063_100000721315 [0,0,0,0,0,1|2,1,0]=4 1411 B15R2.2195 c1ccc(nc1)CSc2cccnc2 62a_100000721315_100000210063 [0,0,0,0,0,1|2,1,0]=4 1412 B15R2.2195 c1ccc(nc1)CSc2ccncc2 62a_100000721315_100000728582 [0,0,0,0,0,1|2,1,0]=4 1413 B15R2.2195 c1ccc(nc1)CSc2ccncc2 62a_100000728582_100000721315 [0,0,0,0,0,1|2,1,0]=4 1414 B15R2.2195 c1ccc(nc1)SCc2cccnc2 62a_100000741622_100011216584 [0,0,0,0,0,1|2,1,0]=4 1415 B15R2.2195 c1ccc(nc1)SCc2cccnc2 62a_100011216584_100000741622 [0,0,0,0,0,1|2,1,0]=4 1416 B15R2.2195 c1ccc(nc1)SCc2ccncc2 62a_100011216584_100015193705 [0,0,0,0,0,1|2,1,0]=4 1417 B15R2.2195 c1ccc(nc1)SCc2ccncc2 62a_100015193705_100011216584 [0,0,0,0,0,1|2,1,0]=4 1418 B15R2.2195 c1cnc(nc1)COc2cccnc2 34a_100000210849_100000703007 [0,0,0,0,0,1|3,0,0]=4 1419 B15R2.2195 c1cnc(nc1)COc2cccnc2 7a_100000210849_100000703007 [0,0,0,0,0,1|3,0,0]=4 1420 B15R2.2195 c1cnc(nc1)COc2ccncc2 34a_100000212176_100000703007 [0,0,0,0,0,1|3,0,0]=4 1421 B15R2.2195 c1cncc(c1)COc2cccnc2 34a_100000210849_100000733263 [0,0,0,0,0,1|2,0,0]=3 1422 B15R2.2195 c1cncc(c1)COc2cccnc2 7a_100000210849_100000741622 [0,0,0,0,0,1|2,0,0]=3 1423 B15R2.2195 c1cncc(c1)COc2ccncc2 34a_100000212176_100000733263 [0,0,0,0,0,1|2,0,0]=3 1424 B15R2.2195 c1cncc(c1)COc2ccnnc2 34a_100015204005_100000733263 [0,0,0,0,0,1|3,0,0]=4 1425 B15R2.2195 c1cncc(c1)COc2cncnc2 7a_100000754086_100000741622 [0,0,0,0,0,1|3,0,0]=4 1426 B15R2.2195 c1cncc(c1)CSc2cccnc2 62a_100000210063_100000741622 [0,0,0,0,0,1|2,1,0]=4 1427 B15R2.2195 c1cncc(c1)CSc2cccnc2 62a_100000741622_100000210063 [0,0,0,0,0,1|2,1,0]=4 1428 B15R2.2195 c1cncc(c1)CSc2ccncc2 62a_100000728582_100000741622 [0,0,0,0,0,1|2,1,0]=4 1429 B15R2.2195 c1cncc(c1)CSc2ccncc2 62a_100000741622_100000728582 [0,0,0,0,0,1|2,1,0]=4 1430 B15R2.2195 c1cncc(c1)OCc2cccnn2 34a_100000210849_100016990269 [0,0,0,0,0,1|3,0,0]=4 1431 B15R2.2195 c1cncc(c1)OCc2cccnn2 7a_100000210849_100016990269 [0,0,0,0,0,1|3,0,0]=4 1432 B15R2.2195 c1cncc(c1)OCc2ccncc2 7a_100000210849_100015193705 [0,0,0,0,0,1|2,0,0]=3 1433 B15R2.2195 c1cncc(c1)OCc2cnccn2 34a_100000210849_100016995436 [0,0,0,0,0,1|3,0,0]=4 1434 B15R2.2195 c1cncc(c1)OCc2cnccn2 7a_100000210849_100016995436 [0,0,0,0,0,1|3,0,0]=4 1435 B15R2.2195 c1cncc(c1)OCc2cncnc2 34a_100000210849_100015196519 [0,0,0,0,0,1|3,0,0]=4 1436 B15R2.2195 c1cncc(c1)OCc2cncnc2 7a_100000210849_100015196519 [0,0,0,0,0,1|3,0,0]=4 1437 B15R2.2195 c1cncc(c1)SCc2ccncc2 62a_100000210063_100015193705 [0,0,0,0,0,1|2,1,0]=4 1438 B15R2.2195 c1cncc(c1)SCc2ccncc2 62a_100015193705_100000210063 [0,0,0,0,0,1|2,1,0]=4 1439 B15R2.2195 c1cnnc(c1)COc2ccncc2 34a_100000212176_100016990269 [0,0,0,0,0,1|3,0,0]=4 1440 B14R1.123 C/C=C/C=C/COCc1ccccc1 34a_100016283227_100015291786 [0,1,1,0,0,0|0,0,2]=4 1441 B14R1.123 CC=CC=CC=NNc1ccccc1 4a_100015195140_100000691131 [0,1,1,0,0,0|1,0,1]=4 1442 B14R1.156 C=CC=CC(=O)CCc1ccccc1 1458a_100016291481_100000765856 [0,1,1,0,0,0|1,0,1]=4 1443 B14R1.156 C=CC=CC(=O)NCc1ccccc1 1626a_100015324214_100016291481 [0,1,1,0,0,0|2,0,0]=4 1444 B14R1.156 C=CC=CC(=O)NNc1ccccc1 22a_100015195140_100016291481 [0,1,1,0,0,0|2,0,0]=4 1445 B14R1.158 C/C=C/C=CC(=O)Cc1ccccc1 1458a_100000185730_100015291786 [0,1,1,0,0,0|1,0,1]=4 1446 B14R1.158 C/C=C/C=CC(=O)Nc1ccccc1 11a_100000106764_100000185730 [0,1,1,0,0,0|1,0,1]=4 1447 B14R1.158 C/C=C/C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185730 [0,1,1,0,0,0|1,0,1]=4 1448 B14R1.158 C/C=C/C=CC(=O)Nc1ccccc1 22a_100000106764_100000185730 [0,1,1,0,0,0|1,0,1]=4 1449 B14R1.520 C=CCC(=O)C=CSc1ccccc1 1458a_100016262050_100000210623 [0,1,1,0,0,0|0,1,1]=4 1450 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)Br 1458a_100016291481_100000189115 [0,1,1,0,0,0|2,0,0]=4 1451 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)C 1458a_100016291481_100000210814 [0,1,1,0,0,0|2,0,0]=4 1452 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)Cl 1458a_100016291481_100000694040 [0,1,1,0,0,0|2,0,0]=4 1453 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)F 1458a_100016291481_100000198546 [0,1,1,0,0,0|2,0,0]=4 1454 B14R1.33 C=CC=CC(=O)Cc1ccc(cc1)I 1458a_100016291481_100000189116 [0,1,1,0,0,0|2,0,0]=4 1455 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100016291481 [0,1,1,0,0,0|2,0,0]=4 1456 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100016291481 [0,1,1,0,0,0|2,0,0]=4 1457 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100016291481 [0,1,1,0,0,0|2,0,0]=4 1458 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100016291481 [0,1,1,0,0,0|2,0,0]=4 1459 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100016291481 [0,1,1,0,0,0|2,0,0]=4 1460 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100016291481 [0,1,1,0,0,0|2,0,0]=4 1461 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100016291481 [0,1,1,0,0,0|2,0,0]=4 1462 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100016291481 [0,1,1,0,0,0|2,0,0]=4 1463 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100016291481 [0,1,1,0,0,0|2,0,0]=4 1464 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100016291481 [0,1,1,0,0,0|2,0,0]=4 1465 B14R1.33 C=CC=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100016291481 [0,1,1,0,0,0|2,0,0]=4 1466 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)Br 1458a_100016291481_100000211773 [0,1,1,0,0,0|2,0,0]=4 1467 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)C 1458a_100016291481_100000211840 [0,1,1,0,0,0|2,0,0]=4 1468 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)Cl 1458a_100016291481_100000181238 [0,1,1,0,0,0|2,0,0]=4 1469 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)F 1458a_100016291481_100000230114 [0,1,1,0,0,0|2,0,0]=4 1470 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)I 1458a_100016291481_100011218688 [0,1,1,0,0,0|2,0,0]=4 1471 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)O 1458a_100016291481_100011660834 [0,1,1,0,0,0|2,0,0]=4 1472 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100016291481 [0,1,1,0,0,0|2,0,0]=4 1473 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100016291481 [0,1,1,0,0,0|2,0,0]=4 1474 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100016291481 [0,1,1,0,0,0|2,0,0]=4 1475 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)C 22a_100000188690_100016291481 [0,1,1,0,0,0|2,0,0]=4 1476 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100016291481 [0,1,1,0,0,0|2,0,0]=4 1477 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100016291481 [0,1,1,0,0,0|2,0,0]=4 1478 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100016291481 [0,1,1,0,0,0|2,0,0]=4 1479 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)F 22a_100000210047_100016291481 [0,1,1,0,0,0|2,0,0]=4 1480 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100016291481 [0,1,1,0,0,0|2,0,0]=4 1481 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)I 22a_100000211102_100016291481 [0,1,1,0,0,0|2,0,0]=4 1482 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100016291481 [0,1,1,0,0,0|2,0,0]=4 1483 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100016291481 [0,1,1,0,0,0|2,0,0]=4 1484 B14R1.166 C=CC=CC(=O)C(C)c1ccccc1 1458a_100016291481_100000230085 [0,1,1,0,0,0|2,0,0]=4 1485 B14R1.166 C=CC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100016291481 [0,1,1,0,0,0|2,0,0]=4 1486 B14R1.166 C=CC=CC(=O)N(C)c1ccccc1 22a_100000210012_100016291481 [0,1,1,0,0,0|2,0,0]=4 1487 B14R1.743 C=CC(=O)CC(=O)Oc1ccccc1 1458a_100000185746_100009813826 [0,1,1,0,0,0|1,0,1]=4 1488 B14R1.946 C=CC=CC(=O)Cc1ccccc1Br 1458a_100016291481_100000184730 [0,1,1,0,0,0|2,0,0]=4 1489 B14R1.946 C=CC=CC(=O)Cc1ccccc1C 1458a_100016291481_100000211839 [0,1,1,0,0,0|2,0,0]=4 1490 B14R1.946 C=CC=CC(=O)Cc1ccccc1Cl 1458a_100016291481_100000187162 [0,1,1,0,0,0|2,0,0]=4 1491 B14R1.946 C=CC=CC(=O)Cc1ccccc1F 1458a_100016291481_100000187165 [0,1,1,0,0,0|2,0,0]=4 1492 B14R1.946 C=CC=CC(=O)Cc1ccccc1I 1458a_100016291481_100011216222 [0,1,1,0,0,0|2,0,0]=4 1493 B14R1.946 C=CC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100016291481 [0,1,1,0,0,0|2,0,0]=4 1494 B14R1.946 C=CC=CC(=O)Nc1ccccc1C 1626a_100015192222_100016291481 [0,1,1,0,0,0|2,0,0]=4 1495 B14R1.946 C=CC=CC(=O)Nc1ccccc1C 22a_100015192222_100016291481 [0,1,1,0,0,0|2,0,0]=4 1496 B14R1.946 C=CC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100016291481 [0,1,1,0,0,0|2,0,0]=4 1497 B14R1.946 C=CC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100016291481 [0,1,1,0,0,0|2,0,0]=4 1498 B14R1.946 C=CC=CC(=O)Nc1ccccc1F 1626a_100000210422_100016291481 [0,1,1,0,0,0|2,0,0]=4 1499 B14R1.946 C=CC=CC(=O)Nc1ccccc1F 22a_100000210422_100016291481 [0,1,1,0,0,0|2,0,0]=4 1500 B14R1.946 C=CC=CC(=O)Nc1ccccc1I 1626a_100000210053_100016291481 [0,1,1,0,0,0|2,0,0]=4 1501 B14R1.946 C=CC=CC(=O)Nc1ccccc1O 22a_100000185747_100016291481 [0,1,1,0,0,0|2,0,0]=4 1502 B14R2.21 Brc1cc(ccn1)c2ccccc2 271570a_100011218836_100009814637 [0,1,0,0,1,0|1,0,0]=3 1503 B14R2.21 Brc1cc(ccn1)c2ccccn2 271570a_100011264011_100009814637 [0,1,0,0,1,0|2,0,0]=4 1504 B14R2.21 Brc1cc(ccn1)c2cccnc2 271570a_100000757648_100009814637 [0,1,0,0,1,0|2,0,0]=4 1505 B14R2.21 Brc1cc(ccn1)c2ccncc2 271570a_100000752145_100009814637 [0,1,0,0,1,0|2,0,0]=4 1506 B14R2.21 Brc1cccc(c1)c2ccccc2 271570a_100011218836_100000691529 [0,1,0,0,1,0|0,0,0]=2 1507 B14R2.21 Brc1cccc(c1)c2ccccn2 271570a_100011264011_100000691529 [0,1,0,0,1,0|1,0,0]=3 1508 B14R2.21 Brc1cccc(c1)c2cccnc2 271570a_100000757648_100000691529 [0,1,0,0,1,0|1,0,0]=3 1509 B14R2.21 Brc1cccc(c1)c2ccncc2 271570a_100000752145_100000691529 [0,1,0,0,1,0|1,0,0]=3 1510 B14R2.21 Brc1cccc(c1)c2cnccn2 271570a_100011962566_100000691529 [0,1,0,0,1,0|2,0,0]=4 1511 B14R2.21 Brc1cccc(c1)c2cncnc2 271570a_100000707473_100000691529 [0,1,0,0,1,0|2,0,0]=4 1512 B14R2.21 Brc1cccc(n1)c2ccccc2 271570a_100011218836_100000684672 [0,1,0,0,1,0|1,0,0]=3 1513 B14R2.21 Brc1cccc(n1)c2ccccn2 271570a_100011264011_100000684672 [0,1,0,0,1,0|2,0,0]=4 1514 B14R2.21 Brc1cccc(n1)c2cccnc2 271570a_100000757648_100000684672 [0,1,0,0,1,0|2,0,0]=4 1515 B14R2.21 Brc1cccc(n1)c2ccncc2 271570a_100000752145_100000684672 [0,1,0,0,1,0|2,0,0]=4 1516 B14R2.21 Brc1cncc(c1)c2ccccc2 271570a_100011218836_100000728054 [0,1,0,0,1,0|1,0,0]=3 1517 B14R2.21 Brc1cncc(c1)c2ccccc2 271570a_200009814628_100000210277 [0,1,0,0,1,0|1,0,0]=3 1518 B14R2.21 Brc1cncc(c1)c2ccccn2 271570a_100011264011_100000728054 [0,1,0,0,1,0|2,0,0]=4 1519 B14R2.21 Brc1cncc(c1)c2ccccn2 271570a_200009814628_100011216584 [0,1,0,0,1,0|2,0,0]=4 1520 B14R2.21 Brc1cncc(c1)c2cccnc2 271570a_100000757648_100000728054 [0,1,0,0,1,0|2,0,0]=4 1521 B14R2.21 Brc1cncc(c1)c2cccnc2 271570a_200009814628_100000752921 [0,1,0,0,1,0|2,0,0]=4 1522 B14R2.21 Brc1cncc(c1)c2ccncc2 271570a_100000752145_100000728054 [0,1,0,0,1,0|2,0,0]=4 1523 B14R2.21 Brc1cncc(c1)c2ccncc2 271570a_200009814628_100000035832 [0,1,0,0,1,0|2,0,0]=4 1524 B14R2.21 C[n+]1cccc(c1)c2ccccc2 271570a_100011218836_100009996589 [0,1,0,0,1,0|1,0,0]=3 1525 B14R2.21 C[n+]1cccc(c1)c2ccccn2 271570a_100011264011_100009996589 [0,1,0,0,1,0|2,0,0]=4 1526 B14R2.21 C[n+]1cccc(c1)c2cccnc2 271570a_100000757648_100009996589 [0,1,0,0,1,0|2,0,0]=4 1527 B14R2.21 C[n+]1cccc(c1)c2ccncc2 271570a_100000752145_100009996589 [0,1,0,0,1,0|2,0,0]=4 1528 B14R2.21 Cc1cc(ccn1)c2ccccc2 271570a_100011218836_100000758586 [0,1,0,0,1,0|1,0,0]=3 1529 B14R2.21 Cc1cc(ccn1)c2ccccc2 271570a_100011830414_100000210277 [0,1,0,0,1,0|1,0,0]=3 1530 B14R2.21 Cc1cc(ccn1)c2ccccn2 271570a_100011264011_100000758586 [0,1,0,0,1,0|2,0,0]=4 1531 B14R2.21 Cc1cc(ccn1)c2ccccn2 271570a_100011830414_100011216584 [0,1,0,0,1,0|2,0,0]=4 1532 B14R2.21 Cc1cc(ccn1)c2cccnc2 271570a_100000757648_100000758586 [0,1,0,0,1,0|2,0,0]=4 1533 B14R2.21 Cc1cc(ccn1)c2cccnc2 271570a_100011830414_100000752921 [0,1,0,0,1,0|2,0,0]=4 1534 B14R2.21 Cc1cc(ccn1)c2ccncc2 271570a_100000752145_100000758586 [0,1,0,0,1,0|2,0,0]=4 1535 B14R2.21 Cc1cc(ccn1)c2ccncc2 271570a_100011830414_100000035832 [0,1,0,0,1,0|2,0,0]=4 1536 B14R2.21 Cc1cc(cnn1)c2ccccc2 271570a_100010138862_100000210277 [0,1,0,0,1,0|2,0,0]=4 1537 B14R2.21 Cc1cc(ncn1)c2ccccc2 271570a_100011218836_100000744208 [0,1,0,0,1,0|2,0,0]=4 1538 B14R2.21 Cc1cccc(c1)c2ccccc2 271570a_100000749446_100000210277 [0,1,0,0,1,0|0,0,0]=2 1539 B14R2.21 Cc1cccc(c1)c2ccccc2 271570a_100011218836_100011215228 [0,1,0,0,1,0|0,0,0]=2 1540 B14R2.21 Cc1cccc(c1)c2ccccn2 271570a_100000749446_100011216584 [0,1,0,0,1,0|1,0,0]=3 1541 B14R2.21 Cc1cccc(c1)c2ccccn2 271570a_100011264011_100011215228 [0,1,0,0,1,0|1,0,0]=3 1542 B14R2.21 Cc1cccc(c1)c2cccnc2 271570a_100000749446_100000752921 [0,1,0,0,1,0|1,0,0]=3 1543 B14R2.21 Cc1cccc(c1)c2cccnc2 271570a_100000757648_100011215228 [0,1,0,0,1,0|1,0,0]=3 1544 B14R2.21 Cc1cccc(c1)c2cccnn2 271570a_100000749446_100016991348 [0,1,0,0,1,0|2,0,0]=4 1545 B14R2.21 Cc1cccc(c1)c2ccncc2 271570a_100000749446_100000035832 [0,1,0,0,1,0|1,0,0]=3 1546 B14R2.21 Cc1cccc(c1)c2ccncc2 271570a_100000752145_100011215228 [0,1,0,0,1,0|1,0,0]=3 1547 B14R2.21 Cc1cccc(c1)c2ccncn2 271570a_100000749446_100000703185 [0,1,0,0,1,0|2,0,0]=4 1548 B14R2.21 Cc1cccc(c1)c2ccnnc2 271570a_100000749446_100000732662 [0,1,0,0,1,0|2,0,0]=4 1549 B14R2.21 Cc1cccc(c1)c2cnccn2 271570a_100000749446_100000758340 [0,1,0,0,1,0|2,0,0]=4 1550 B14R2.21 Cc1cccc(c1)c2cnccn2 271570a_100011962566_100011215228 [0,1,0,0,1,0|2,0,0]=4 1551 B14R2.21 Cc1cccc(c1)c2cncnc2 271570a_100000707473_100011215228 [0,1,0,0,1,0|2,0,0]=4 1552 B14R2.21 Cc1cccc(c1)c2cncnc2 271570a_100000749446_100011206942 [0,1,0,0,1,0|2,0,0]=4 1553 B14R2.21 Cc1cccc(c1)c2ncccn2 271570a_100000749446_100000211032 [0,1,0,0,1,0|2,0,0]=4 1554 B14R2.21 Cc1cccc(n1)c2ccccc2 271570a_100000046275_100000210277 [0,1,0,0,1,0|1,0,0]=3 1555 B14R2.21 Cc1cccc(n1)c2ccccc2 271570a_100011218836_100000742759 [0,1,0,0,1,0|1,0,0]=3 1556 B14R2.21 Cc1cccc(n1)c2ccccn2 271570a_100000046275_100011216584 [0,1,0,0,1,0|2,0,0]=4 1557 B14R2.21 Cc1cccc(n1)c2ccccn2 271570a_100011264011_100000742759 [0,1,0,0,1,0|2,0,0]=4 1558 B14R2.21 Cc1cccc(n1)c2cccnc2 271570a_100000046275_100000752921 [0,1,0,0,1,0|2,0,0]=4 1559 B14R2.21 Cc1cccc(n1)c2cccnc2 271570a_100000757648_100000742759 [0,1,0,0,1,0|2,0,0]=4 1560 B14R2.21 Cc1cccc(n1)c2ccncc2 271570a_100000046275_100000035832 [0,1,0,0,1,0|2,0,0]=4 1561 B14R2.21 Cc1cccc(n1)c2ccncc2 271570a_100000752145_100000742759 [0,1,0,0,1,0|2,0,0]=4 1562 B14R2.21 Cc1ccnc(c1)c2ccccc2 271570a_100000049243_100000210277 [0,1,0,0,1,0|1,0,0]=3 1563 B14R2.21 Cc1ccnc(c1)c2ccccc2 271570a_100011218836_100000750283 [0,1,0,0,1,0|1,0,0]=3 1564 B14R2.21 Cc1ccnc(c1)c2ccccn2 271570a_100000049243_100011216584 [0,1,0,0,1,0|2,0,0]=4 1565 B14R2.21 Cc1ccnc(c1)c2ccccn2 271570a_100011264011_100000750283 [0,1,0,0,1,0|2,0,0]=4 1566 B14R2.21 Cc1ccnc(c1)c2cccnc2 271570a_100000049243_100000752921 [0,1,0,0,1,0|2,0,0]=4 1567 B14R2.21 Cc1ccnc(c1)c2cccnc2 271570a_100000757648_100000750283 [0,1,0,0,1,0|2,0,0]=4 1568 B14R2.21 Cc1ccnc(c1)c2ccncc2 271570a_100000049243_100000035832 [0,1,0,0,1,0|2,0,0]=4 1569 B14R2.21 Cc1ccnc(c1)c2ccncc2 271570a_100000752145_100000750283 [0,1,0,0,1,0|2,0,0]=4 1570 B14R2.21 Cc1ccnc(n1)c2ccccc2 271570a_100011218836_100011243806 [0,1,0,0,1,0|2,0,0]=4 1571 B14R2.21 Cc1cncc(c1)c2ccccc2 271570a_100011218836_100000760492 [0,1,0,0,1,0|1,0,0]=3 1572 B14R2.21 Cc1cncc(c1)c2ccccc2 271570a_100012355712_100000210277 [0,1,0,0,1,0|1,0,0]=3 1573 B14R2.21 Cc1cncc(c1)c2ccccn2 271570a_100011264011_100000760492 [0,1,0,0,1,0|2,0,0]=4 1574 B14R2.21 Cc1cncc(c1)c2ccccn2 271570a_100012355712_100011216584 [0,1,0,0,1,0|2,0,0]=4 1575 B14R2.21 Cc1cncc(c1)c2cccnc2 271570a_100000757648_100000760492 [0,1,0,0,1,0|2,0,0]=4 1576 B14R2.21 Cc1cncc(c1)c2cccnc2 271570a_100012355712_100000752921 [0,1,0,0,1,0|2,0,0]=4 1577 B14R2.21 Cc1cncc(c1)c2ccncc2 271570a_100000752145_100000760492 [0,1,0,0,1,0|2,0,0]=4 1578 B14R2.21 Cc1cncc(c1)c2ccncc2 271570a_100012355712_100000035832 [0,1,0,0,1,0|2,0,0]=4 1579 B14R2.21 Cc1cncc(n1)c2ccccc2 271570a_100011218836_100009842155 [0,1,0,0,1,0|2,0,0]=4 1580 B14R2.21 Cc1cnnc(c1)c2ccccc2 271570a_100011218836_100000070100 [0,1,0,0,1,0|2,0,0]=4 1581 B14R2.21 Cc1nccc(n1)c2ccccc2 271570a_100011218836_100000749937 [0,1,0,0,1,0|2,0,0]=4 1582 B14R2.21 Clc1cc(ccn1)c2ccccc2 271570a_100000049459_100000210277 [0,1,0,0,1,0|1,0,0]=3 1583 B14R2.21 Clc1cc(ccn1)c2ccccc2 271570a_100011218836_100000035001 [0,1,0,0,1,0|1,0,0]=3 1584 B14R2.21 Clc1cc(ccn1)c2ccccn2 271570a_100000049459_100011216584 [0,1,0,0,1,0|2,0,0]=4 1585 B14R2.21 Clc1cc(ccn1)c2ccccn2 271570a_100011264011_100000035001 [0,1,0,0,1,0|2,0,0]=4 1586 B14R2.21 Clc1cc(ccn1)c2cccnc2 271570a_100000049459_100000752921 [0,1,0,0,1,0|2,0,0]=4 1587 B14R2.21 Clc1cc(ccn1)c2cccnc2 271570a_100000757648_100000035001 [0,1,0,0,1,0|2,0,0]=4 1588 B14R2.21 Clc1cc(ccn1)c2ccncc2 271570a_100000049459_100000035832 [0,1,0,0,1,0|2,0,0]=4 1589 B14R2.21 Clc1cc(ccn1)c2ccncc2 271570a_100000752145_100000035001 [0,1,0,0,1,0|2,0,0]=4 1590 B14R2.21 Clc1cccc(c1)c2ccccc2 271570a_100011214927_100000210277 [0,1,0,0,1,0|0,0,0]=2 1591 B14R2.21 Clc1cccc(c1)c2ccccc2 271570a_100011218836_100000699651 [0,1,0,0,1,0|0,0,0]=2 1592 B14R2.21 Clc1cccc(c1)c2ccccn2 271570a_100011214927_100011216584 [0,1,0,0,1,0|1,0,0]=3 1593 B14R2.21 Clc1cccc(c1)c2ccccn2 271570a_100011264011_100000699651 [0,1,0,0,1,0|1,0,0]=3 1594 B14R2.21 Clc1cccc(c1)c2cccnc2 271570a_100000757648_100000699651 [0,1,0,0,1,0|1,0,0]=3 1595 B14R2.21 Clc1cccc(c1)c2cccnc2 271570a_100011214927_100000752921 [0,1,0,0,1,0|1,0,0]=3 1596 B14R2.21 Clc1cccc(c1)c2cccnn2 271570a_100011214927_100016991348 [0,1,0,0,1,0|2,0,0]=4 1597 B14R2.21 Clc1cccc(c1)c2ccncc2 271570a_100000752145_100000699651 [0,1,0,0,1,0|1,0,0]=3 1598 B14R2.21 Clc1cccc(c1)c2ccncc2 271570a_100011214927_100000035832 [0,1,0,0,1,0|1,0,0]=3 1599 B14R2.21 Clc1cccc(c1)c2ccncn2 271570a_100011214927_100000703185 [0,1,0,0,1,0|2,0,0]=4 1600 B14R2.21 Clc1cccc(c1)c2ccnnc2 271570a_100011214927_100000732662 [0,1,0,0,1,0|2,0,0]=4 1601 B14R2.21 Clc1cccc(c1)c2cnccn2 271570a_100011214927_100000758340 [0,1,0,0,1,0|2,0,0]=4 1602 B14R2.21 Clc1cccc(c1)c2cnccn2 271570a_100011962566_100000699651 [0,1,0,0,1,0|2,0,0]=4 1603 B14R2.21 Clc1cccc(c1)c2cncnc2 271570a_100000707473_100000699651 [0,1,0,0,1,0|2,0,0]=4 1604 B14R2.21 Clc1cccc(c1)c2cncnc2 271570a_100011214927_100011206942 [0,1,0,0,1,0|2,0,0]=4 1605 B14R2.21 Clc1cccc(c1)c2ncccn2 271570a_100011214927_100000211032 [0,1,0,0,1,0|2,0,0]=4 1606 B14R2.21 Clc1cccc(n1)c2ccccc2 271570a_100000062326_100000210277 [0,1,0,0,1,0|1,0,0]=3 1607 B14R2.21 Clc1cccc(n1)c2ccccn2 271570a_100000062326_100011216584 [0,1,0,0,1,0|2,0,0]=4 1608 B14R2.21 Clc1cccc(n1)c2cccnc2 271570a_100000062326_100000752921 [0,1,0,0,1,0|2,0,0]=4 1609 B14R2.21 Clc1cccc(n1)c2ccncc2 271570a_100000062326_100000035832 [0,1,0,0,1,0|2,0,0]=4 1610 B14R2.21 Clc1ccnc(c1)c2ccccc2 271570a_100011218836_100010167805 [0,1,0,0,1,0|1,0,0]=3 1611 B14R2.21 Clc1ccnc(c1)c2ccccn2 271570a_100011264011_100010167805 [0,1,0,0,1,0|2,0,0]=4 1612 B14R2.21 Clc1ccnc(c1)c2cccnc2 271570a_100000757648_100010167805 [0,1,0,0,1,0|2,0,0]=4 1613 B14R2.21 Clc1ccnc(c1)c2ccncc2 271570a_100000752145_100010167805 [0,1,0,0,1,0|2,0,0]=4 1614 B14R2.21 Clc1cncc(c1)c2ccccc2 271570a_100000049213_100000210277 [0,1,0,0,1,0|1,0,0]=3 1615 B14R2.21 Clc1cncc(c1)c2ccccc2 271570a_100011218836_100000049639 [0,1,0,0,1,0|1,0,0]=3 1616 B14R2.21 Clc1cncc(c1)c2ccccn2 271570a_100000049213_100011216584 [0,1,0,0,1,0|2,0,0]=4 1617 B14R2.21 Clc1cncc(c1)c2ccccn2 271570a_100011264011_100000049639 [0,1,0,0,1,0|2,0,0]=4 1618 B14R2.21 Clc1cncc(c1)c2cccnc2 271570a_100000049213_100000752921 [0,1,0,0,1,0|2,0,0]=4 1619 B14R2.21 Clc1cncc(c1)c2cccnc2 271570a_100000757648_100000049639 [0,1,0,0,1,0|2,0,0]=4 1620 B14R2.21 Clc1cncc(c1)c2ccncc2 271570a_100000049213_100000035832 [0,1,0,0,1,0|2,0,0]=4 1621 B14R2.21 Clc1cncc(c1)c2ccncc2 271570a_100000752145_100000049639 [0,1,0,0,1,0|2,0,0]=4 1622 B14R2.21 Fc1cc(ccn1)c2ccccc2 271570a_100000062321_100000210277 [0,1,0,0,1,0|1,0,0]=3 1623 B14R2.21 Fc1cc(ccn1)c2ccccc2 271570a_100011218836_100009816116 [0,1,0,0,1,0|1,0,0]=3 1624 B14R2.21 Fc1cc(ccn1)c2ccccn2 271570a_100000062321_100011216584 [0,1,0,0,1,0|2,0,0]=4 1625 B14R2.21 Fc1cc(ccn1)c2ccccn2 271570a_100011264011_100009816116 [0,1,0,0,1,0|2,0,0]=4 1626 B14R2.21 Fc1cc(ccn1)c2cccnc2 271570a_100000062321_100000752921 [0,1,0,0,1,0|2,0,0]=4 1627 B14R2.21 Fc1cc(ccn1)c2cccnc2 271570a_100000757648_100009816116 [0,1,0,0,1,0|2,0,0]=4 1628 B14R2.21 Fc1cc(ccn1)c2ccncc2 271570a_100000062321_100000035832 [0,1,0,0,1,0|2,0,0]=4 1629 B14R2.21 Fc1cc(ccn1)c2ccncc2 271570a_100000752145_100009816116 [0,1,0,0,1,0|2,0,0]=4 1630 B14R2.21 Fc1cc(ncn1)c2ccccc2 271570a_100011218836_200009880791 [0,1,0,0,1,0|2,0,0]=4 1631 B14R2.21 Fc1cccc(c1)c2ccccc2 271570a_100011218836_100000685547 [0,1,0,0,1,0|0,0,0]=2 1632 B14R2.21 Fc1cccc(c1)c2ccccc2 271570a_100012349223_100000210277 [0,1,0,0,1,0|0,0,0]=2 1633 B14R2.21 Fc1cccc(c1)c2ccccn2 271570a_100011264011_100000685547 [0,1,0,0,1,0|1,0,0]=3 1634 B14R2.21 Fc1cccc(c1)c2ccccn2 271570a_100012349223_100011216584 [0,1,0,0,1,0|1,0,0]=3 1635 B14R2.21 Fc1cccc(c1)c2cccnc2 271570a_100000757648_100000685547 [0,1,0,0,1,0|1,0,0]=3 1636 B14R2.21 Fc1cccc(c1)c2cccnc2 271570a_100012349223_100000752921 [0,1,0,0,1,0|1,0,0]=3 1637 B14R2.21 Fc1cccc(c1)c2cccnn2 271570a_100012349223_100016991348 [0,1,0,0,1,0|2,0,0]=4 1638 B14R2.21 Fc1cccc(c1)c2ccncc2 271570a_100000752145_100000685547 [0,1,0,0,1,0|1,0,0]=3 1639 B14R2.21 Fc1cccc(c1)c2ccncc2 271570a_100012349223_100000035832 [0,1,0,0,1,0|1,0,0]=3 1640 B14R2.21 Fc1cccc(c1)c2ccncn2 271570a_100012349223_100000703185 [0,1,0,0,1,0|2,0,0]=4 1641 B14R2.21 Fc1cccc(c1)c2ccnnc2 271570a_100012349223_100000732662 [0,1,0,0,1,0|2,0,0]=4 1642 B14R2.21 Fc1cccc(c1)c2cnccn2 271570a_100011962566_100000685547 [0,1,0,0,1,0|2,0,0]=4 1643 B14R2.21 Fc1cccc(c1)c2cnccn2 271570a_100012349223_100000758340 [0,1,0,0,1,0|2,0,0]=4 1644 B14R2.21 Fc1cccc(c1)c2cncnc2 271570a_100000707473_100000685547 [0,1,0,0,1,0|2,0,0]=4 1645 B14R2.21 Fc1cccc(c1)c2cncnc2 271570a_100012349223_100011206942 [0,1,0,0,1,0|2,0,0]=4 1646 B14R2.21 Fc1cccc(c1)c2ncccn2 271570a_100012349223_100000211032 [0,1,0,0,1,0|2,0,0]=4 1647 B14R2.21 Fc1cccc(n1)c2ccccc2 271570a_100000090185_100000210277 [0,1,0,0,1,0|1,0,0]=3 1648 B14R2.21 Fc1cccc(n1)c2ccccc2 271570a_100011218836_100009815982 [0,1,0,0,1,0|1,0,0]=3 1649 B14R2.21 Fc1cccc(n1)c2ccccn2 271570a_100000090185_100011216584 [0,1,0,0,1,0|2,0,0]=4 1650 B14R2.21 Fc1cccc(n1)c2ccccn2 271570a_100011264011_100009815982 [0,1,0,0,1,0|2,0,0]=4 1651 B14R2.21 Fc1cccc(n1)c2cccnc2 271570a_100000090185_100000752921 [0,1,0,0,1,0|2,0,0]=4 1652 B14R2.21 Fc1cccc(n1)c2cccnc2 271570a_100000757648_100009815982 [0,1,0,0,1,0|2,0,0]=4 1653 B14R2.21 Fc1cccc(n1)c2ccncc2 271570a_100000090185_100000035832 [0,1,0,0,1,0|2,0,0]=4 1654 B14R2.21 Fc1cccc(n1)c2ccncc2 271570a_100000752145_100009815982 [0,1,0,0,1,0|2,0,0]=4 1655 B14R2.21 Fc1ccnc(c1)c2ccccc2 271570a_100011218836_100009817058 [0,1,0,0,1,0|1,0,0]=3 1656 B14R2.21 Fc1ccnc(c1)c2ccccc2 271570a_200000087102_100000210277 [0,1,0,0,1,0|1,0,0]=3 1657 B14R2.21 Fc1ccnc(c1)c2ccccn2 271570a_100011264011_100009817058 [0,1,0,0,1,0|2,0,0]=4 1658 B14R2.21 Fc1ccnc(c1)c2ccccn2 271570a_200000087102_100011216584 [0,1,0,0,1,0|2,0,0]=4 1659 B14R2.21 Fc1ccnc(c1)c2cccnc2 271570a_100000757648_100009817058 [0,1,0,0,1,0|2,0,0]=4 1660 B14R2.21 Fc1ccnc(c1)c2cccnc2 271570a_200000087102_100000752921 [0,1,0,0,1,0|2,0,0]=4 1661 B14R2.21 Fc1ccnc(c1)c2ccncc2 271570a_100000752145_100009817058 [0,1,0,0,1,0|2,0,0]=4 1662 B14R2.21 Fc1ccnc(c1)c2ccncc2 271570a_200000087102_100000035832 [0,1,0,0,1,0|2,0,0]=4 1663 B14R2.21 Fc1cncc(c1)c2ccccc2 271570a_100000757375_100000210277 [0,1,0,0,1,0|1,0,0]=3 1664 B14R2.21 Fc1cncc(c1)c2ccccc2 271570a_100011218836_100000744099 [0,1,0,0,1,0|1,0,0]=3 1665 B14R2.21 Fc1cncc(c1)c2ccccn2 271570a_100000757375_100011216584 [0,1,0,0,1,0|2,0,0]=4 1666 B14R2.21 Fc1cncc(c1)c2ccccn2 271570a_100011264011_100000744099 [0,1,0,0,1,0|2,0,0]=4 1667 B14R2.21 Fc1cncc(c1)c2cccnc2 271570a_100000757375_100000752921 [0,1,0,0,1,0|2,0,0]=4 1668 B14R2.21 Fc1cncc(c1)c2cccnc2 271570a_100000757648_100000744099 [0,1,0,0,1,0|2,0,0]=4 1669 B14R2.21 Fc1cncc(c1)c2ccncc2 271570a_100000752145_100000744099 [0,1,0,0,1,0|2,0,0]=4 1670 B14R2.21 Fc1cncc(c1)c2ccncc2 271570a_100000757375_100000035832 [0,1,0,0,1,0|2,0,0]=4 1671 B14R2.21 Fc1cncc(n1)c2ccccc2 271570a_100011218836_200009863489 [0,1,0,0,1,0|2,0,0]=4 1672 B14R2.21 Ic1cccc(c1)c2ccccc2 271570a_100000043368_100000210277 [0,1,0,0,1,0|0,0,0]=2 1673 B14R2.21 Ic1cccc(c1)c2ccccn2 271570a_100000043368_100011216584 [0,1,0,0,1,0|1,0,0]=3 1674 B14R2.21 Ic1cccc(c1)c2cccnc2 271570a_100000043368_100000752921 [0,1,0,0,1,0|1,0,0]=3 1675 B14R2.21 Ic1cccc(c1)c2cccnn2 271570a_100000043368_100016991348 [0,1,0,0,1,0|2,0,0]=4 1676 B14R2.21 Ic1cccc(c1)c2ccncc2 271570a_100000043368_100000035832 [0,1,0,0,1,0|1,0,0]=3 1677 B14R2.21 Ic1cccc(c1)c2ccncn2 271570a_100000043368_100000703185 [0,1,0,0,1,0|2,0,0]=4 1678 B14R2.21 Ic1cccc(c1)c2ccnnc2 271570a_100000043368_100000732662 [0,1,0,0,1,0|2,0,0]=4 1679 B14R2.21 Ic1cccc(c1)c2cnccn2 271570a_100000043368_100000758340 [0,1,0,0,1,0|2,0,0]=4 1680 B14R2.21 Ic1cccc(c1)c2cncnc2 271570a_100000043368_100011206942 [0,1,0,0,1,0|2,0,0]=4 1681 B14R2.21 Ic1cccc(c1)c2ncccn2 271570a_100000043368_100000211032 [0,1,0,0,1,0|2,0,0]=4 1682 B14R2.21 Nc1cc(ccn1)c2ccccc2 271570a_100011218836_100000744379 [0,1,0,0,1,0|1,0,0]=3 1683 B14R2.21 Nc1cc(ccn1)c2ccccc2 271570a_102125402725_100000210277 [0,1,0,0,1,0|1,0,0]=3 1684 B14R2.21 Nc1cc(ccn1)c2ccccn2 271570a_100011264011_100000744379 [0,1,0,0,1,0|2,0,0]=4 1685 B14R2.21 Nc1cc(ccn1)c2ccccn2 271570a_102125402725_100011216584 [0,1,0,0,1,0|2,0,0]=4 1686 B14R2.21 Nc1cc(ccn1)c2cccnc2 271570a_100000757648_100000744379 [0,1,0,0,1,0|2,0,0]=4 1687 B14R2.21 Nc1cc(ccn1)c2cccnc2 271570a_102125402725_100000752921 [0,1,0,0,1,0|2,0,0]=4 1688 B14R2.21 Nc1cc(ccn1)c2ccncc2 271570a_100000752145_100000744379 [0,1,0,0,1,0|2,0,0]=4 1689 B14R2.21 Nc1cc(ccn1)c2ccncc2 271570a_102125402725_100000035832 [0,1,0,0,1,0|2,0,0]=4 1690 B14R2.21 Nc1cc(cnn1)c2ccccc2 271570a_100011218836_100000130277 [0,1,0,0,1,0|2,0,0]=4 1691 B14R2.21 Nc1cc(ncn1)c2ccccc2 271570a_100011218836_100000701291 [0,1,0,0,1,0|2,0,0]=4 1692 B14R2.21 Nc1cccc(c1)c2ccccc2 271570a_100000699968_100000210277 [0,1,0,0,1,0|0,0,0]=2 1693 B14R2.21 Nc1cccc(c1)c2ccccc2 271570a_100011218836_100000210019 [0,1,0,0,1,0|0,0,0]=2 1694 B14R2.21 Nc1cccc(c1)c2ccccn2 271570a_100000699968_100011216584 [0,1,0,0,1,0|1,0,0]=3 1695 B14R2.21 Nc1cccc(c1)c2ccccn2 271570a_100011264011_100000210019 [0,1,0,0,1,0|1,0,0]=3 1696 B14R2.21 Nc1cccc(c1)c2cccnc2 271570a_100000699968_100000752921 [0,1,0,0,1,0|1,0,0]=3 1697 B14R2.21 Nc1cccc(c1)c2cccnc2 271570a_100000757648_100000210019 [0,1,0,0,1,0|1,0,0]=3 1698 B14R2.21 Nc1cccc(c1)c2cccnn2 271570a_100000699968_100016991348 [0,1,0,0,1,0|2,0,0]=4 1699 B14R2.21 Nc1cccc(c1)c2ccncc2 271570a_100000699968_100000035832 [0,1,0,0,1,0|1,0,0]=3 1700 B14R2.21 Nc1cccc(c1)c2ccncc2 271570a_100000752145_100000210019 [0,1,0,0,1,0|1,0,0]=3 1701 B14R2.21 Nc1cccc(c1)c2ccncn2 271570a_100000699968_100000703185 [0,1,0,0,1,0|2,0,0]=4 1702 B14R2.21 Nc1cccc(c1)c2ccnnc2 271570a_100000699968_100000732662 [0,1,0,0,1,0|2,0,0]=4 1703 B14R2.21 Nc1cccc(c1)c2cnccn2 271570a_100000699968_100000758340 [0,1,0,0,1,0|2,0,0]=4 1704 B14R2.21 Nc1cccc(c1)c2cnccn2 271570a_100011962566_100000210019 [0,1,0,0,1,0|2,0,0]=4 1705 B14R2.21 Nc1cccc(c1)c2cncnc2 271570a_100000699968_100011206942 [0,1,0,0,1,0|2,0,0]=4 1706 B14R2.21 Nc1cccc(c1)c2cncnc2 271570a_100000707473_100000210019 [0,1,0,0,1,0|2,0,0]=4 1707 B14R2.21 Nc1cccc(c1)c2ncccn2 271570a_100000699968_100000211032 [0,1,0,0,1,0|2,0,0]=4 1708 B14R2.21 Nc1cccc(n1)c2ccccc2 271570a_100011218836_100000740741 [0,1,0,0,1,0|1,0,0]=3 1709 B14R2.21 Nc1cccc(n1)c2ccccn2 271570a_100011264011_100000740741 [0,1,0,0,1,0|2,0,0]=4 1710 B14R2.21 Nc1cccc(n1)c2cccnc2 271570a_100000757648_100000740741 [0,1,0,0,1,0|2,0,0]=4 1711 B14R2.21 Nc1cccc(n1)c2ccncc2 271570a_100000752145_100000740741 [0,1,0,0,1,0|2,0,0]=4 1712 B14R2.21 Nc1ccnc(c1)c2ccccc2 271570a_100011218836_100009814236 [0,1,0,0,1,0|1,0,0]=3 1713 B14R2.21 Nc1ccnc(c1)c2ccccn2 271570a_100011264011_100009814236 [0,1,0,0,1,0|2,0,0]=4 1714 B14R2.21 Nc1ccnc(c1)c2cccnc2 271570a_100000757648_100009814236 [0,1,0,0,1,0|2,0,0]=4 1715 B14R2.21 Nc1ccnc(c1)c2ccncc2 271570a_100000752145_100009814236 [0,1,0,0,1,0|2,0,0]=4 1716 B14R2.21 Nc1ccnc(n1)c2ccccc2 271570a_100011218836_100000757536 [0,1,0,0,1,0|2,0,0]=4 1717 B14R2.21 Nc1cncc(c1)c2ccccc2 271570a_100000069896_100000210277 [0,1,0,0,1,0|1,0,0]=3 1718 B14R2.21 Nc1cncc(c1)c2ccccc2 271570a_100011218836_100000687067 [0,1,0,0,1,0|1,0,0]=3 1719 B14R2.21 Nc1cncc(c1)c2ccccn2 271570a_100000069896_100011216584 [0,1,0,0,1,0|2,0,0]=4 1720 B14R2.21 Nc1cncc(c1)c2ccccn2 271570a_100011264011_100000687067 [0,1,0,0,1,0|2,0,0]=4 1721 B14R2.21 Nc1cncc(c1)c2cccnc2 271570a_100000069896_100000752921 [0,1,0,0,1,0|2,0,0]=4 1722 B14R2.21 Nc1cncc(c1)c2cccnc2 271570a_100000757648_100000687067 [0,1,0,0,1,0|2,0,0]=4 1723 B14R2.21 Nc1cncc(c1)c2ccncc2 271570a_100000069896_100000035832 [0,1,0,0,1,0|2,0,0]=4 1724 B14R2.21 Nc1cncc(c1)c2ccncc2 271570a_100000752145_100000687067 [0,1,0,0,1,0|2,0,0]=4 1725 B14R2.21 Nc1cncc(n1)c2ccccc2 271570a_100011218836_100009819714 [0,1,0,0,1,0|2,0,0]=4 1726 B14R2.21 Nc1nccc(n1)c2ccccc2 271570a_100011218836_100009820717 [0,1,0,0,1,0|2,0,0]=4 1727 B14R2.21 O=c1cc(cc[nH]1)c2ccccc2 271570a_100011218836_100009816521 [0,1,0,0,1,0|1,0,0]=3 1728 B14R2.21 O=c1cc(cc[nH]1)c2ccccn2 271570a_100011264011_100009816521 [0,1,0,0,1,0|2,0,0]=4 1729 B14R2.21 O=c1cc(cc[nH]1)c2cccnc2 271570a_100000757648_100009816521 [0,1,0,0,1,0|2,0,0]=4 1730 B14R2.21 O=c1cc(cc[nH]1)c2ccncc2 271570a_100000752145_100009816521 [0,1,0,0,1,0|2,0,0]=4 1731 B14R2.21 O=c1cc(cn[nH]1)c2ccccc2 271570a_100011218836_100010197405 [0,1,0,0,1,0|2,0,0]=4 1732 B14R2.21 O=c1cccc([nH]1)c2ccccc2 271570a_100011218836_100000761760 [0,1,0,0,1,0|1,0,0]=3 1733 B14R2.21 O=c1cccc([nH]1)c2ccccn2 271570a_100011264011_100000761760 [0,1,0,0,1,0|2,0,0]=4 1734 B14R2.21 O=c1cccc([nH]1)c2cccnc2 271570a_100000757648_100000761760 [0,1,0,0,1,0|2,0,0]=4 1735 B14R2.21 O=c1cccc([nH]1)c2ccncc2 271570a_100000752145_100000761760 [0,1,0,0,1,0|2,0,0]=4 1736 B14R2.21 O=c1nc(cc[nH]1)c2ccccc2 271570a_100011218836_200000134032 [0,1,0,0,1,0|2,0,0]=4 1737 B14R2.21 Oc1cc(ccn1)c2ccccc2 271570a_100010237957_100000210277 [0,1,0,0,1,0|1,0,0]=3 1738 B14R2.21 Oc1cc(ccn1)c2ccccc2 271570a_203496583355_100000733892 [0,1,0,0,1,0|1,0,0]=3 1739 B14R2.21 Oc1cc(ccn1)c2ccccn2 271570a_100010237957_100011216584 [0,1,0,0,1,0|2,0,0]=4 1740 B14R2.21 Oc1cc(ccn1)c2cccnc2 271570a_100010237957_100000752921 [0,1,0,0,1,0|2,0,0]=4 1741 B14R2.21 Oc1cc(ccn1)c2ccncc2 271570a_100010237957_100000035832 [0,1,0,0,1,0|2,0,0]=4 1742 B14R2.21 Oc1cc(ccn1)c2ccncc2 271570a_203496583355_200000102548 [0,1,0,0,1,0|2,0,0]=4 1743 B14R2.21 Oc1cc(ncn1)c2ccccc2 271570a_100011218836_100000765262 [0,1,0,0,1,0|2,0,0]=4 1744 B14R2.21 Oc1cc(ncn1)c2ccccc2 271570a_203496583355_100011438037 [0,1,0,0,1,0|2,0,0]=4 1745 B14R2.21 Oc1cccc(c1)c2ccccc2 271570a_100000693801_100000210277 [0,1,0,0,1,0|0,0,0]=2 1746 B14R2.21 Oc1cccc(c1)c2ccccc2 271570a_100011218836_100000211634 [0,1,0,0,1,0|0,0,0]=2 1747 B14R2.21 Oc1cccc(c1)c2ccccc2 271570a_203496583355_100009813342 [0,1,0,0,1,0|0,0,0]=2 1748 B14R2.21 Oc1cccc(c1)c2ccccn2 271570a_100000693801_100011216584 [0,1,0,0,1,0|1,0,0]=3 1749 B14R2.21 Oc1cccc(c1)c2ccccn2 271570a_100011264011_100000211634 [0,1,0,0,1,0|1,0,0]=3 1750 B14R2.21 Oc1cccc(c1)c2ccccn2 271570a_203496583355_100010206771 [0,1,0,0,1,0|1,0,0]=3 1751 B14R2.21 Oc1cccc(c1)c2cccnc2 271570a_100000693801_100000752921 [0,1,0,0,1,0|1,0,0]=3 1752 B14R2.21 Oc1cccc(c1)c2cccnc2 271570a_100000757648_100000211634 [0,1,0,0,1,0|1,0,0]=3 1753 B14R2.21 Oc1cccc(c1)c2cccnc2 271570a_203496583355_100010074666 [0,1,0,0,1,0|1,0,0]=3 1754 B14R2.21 Oc1cccc(c1)c2cccnn2 271570a_100000693801_100016991348 [0,1,0,0,1,0|2,0,0]=4 1755 B14R2.21 Oc1cccc(c1)c2ccncc2 271570a_100000693801_100000035832 [0,1,0,0,1,0|1,0,0]=3 1756 B14R2.21 Oc1cccc(c1)c2ccncc2 271570a_100000752145_100000211634 [0,1,0,0,1,0|1,0,0]=3 1757 B14R2.21 Oc1cccc(c1)c2ccncc2 271570a_203496583355_100010218207 [0,1,0,0,1,0|1,0,0]=3 1758 B14R2.21 Oc1cccc(c1)c2ccncn2 271570a_100000693801_100000703185 [0,1,0,0,1,0|2,0,0]=4 1759 B14R2.21 Oc1cccc(c1)c2ccnnc2 271570a_100000693801_100000732662 [0,1,0,0,1,0|2,0,0]=4 1760 B14R2.21 Oc1cccc(c1)c2cnccn2 271570a_100000693801_100000758340 [0,1,0,0,1,0|2,0,0]=4 1761 B14R2.21 Oc1cccc(c1)c2cnccn2 271570a_100011962566_100000211634 [0,1,0,0,1,0|2,0,0]=4 1762 B14R2.21 Oc1cccc(c1)c2cncnc2 271570a_100000693801_100011206942 [0,1,0,0,1,0|2,0,0]=4 1763 B14R2.21 Oc1cccc(c1)c2cncnc2 271570a_100000707473_100000211634 [0,1,0,0,1,0|2,0,0]=4 1764 B14R2.21 Oc1cccc(c1)c2ncccn2 271570a_100000693801_100000211032 [0,1,0,0,1,0|2,0,0]=4 1765 B14R2.21 Oc1cccc(n1)c2ccccc2 271570a_100010195584_100000210277 [0,1,0,0,1,0|1,0,0]=3 1766 B14R2.21 Oc1cccc(n1)c2ccccc2 271570a_203496583355_100012022076 [0,1,0,0,1,0|1,0,0]=3 1767 B14R2.21 Oc1cccc(n1)c2ccccn2 271570a_100010195584_100011216584 [0,1,0,0,1,0|2,0,0]=4 1768 B14R2.21 Oc1cccc(n1)c2ccccn2 271570a_203496583355_100011934167 [0,1,0,0,1,0|2,0,0]=4 1769 B14R2.21 Oc1cccc(n1)c2cccnc2 271570a_100010195584_100000752921 [0,1,0,0,1,0|2,0,0]=4 1770 B14R2.21 Oc1cccc(n1)c2cccnc2 271570a_203496583355_100012317994 [0,1,0,0,1,0|2,0,0]=4 1771 B14R2.21 Oc1cccc(n1)c2ccncc2 271570a_100010195584_100000035832 [0,1,0,0,1,0|2,0,0]=4 1772 B14R2.21 Oc1cccc(n1)c2ccncc2 271570a_203496583355_200012318261 [0,1,0,0,1,0|2,0,0]=4 1773 B14R2.21 Oc1ccnc(c1)c2ccccc2 271570a_100011218836_100000762945 [0,1,0,0,1,0|1,0,0]=3 1774 B14R2.21 Oc1ccnc(c1)c2ccccc2 271570a_203496583355_100010243831 [0,1,0,0,1,0|1,0,0]=3 1775 B14R2.21 Oc1ccnc(c1)c2ccccn2 271570a_100011264011_100000762945 [0,1,0,0,1,0|2,0,0]=4 1776 B14R2.21 Oc1ccnc(c1)c2ccccn2 271570a_203496583355_100010214981 [0,1,0,0,1,0|2,0,0]=4 1777 B14R2.21 Oc1ccnc(c1)c2cccnc2 271570a_100000757648_100000762945 [0,1,0,0,1,0|2,0,0]=4 1778 B14R2.21 Oc1ccnc(c1)c2ccncc2 271570a_100000752145_100000762945 [0,1,0,0,1,0|2,0,0]=4 1779 B14R2.21 Oc1ccnc(n1)c2ccccc2 271570a_100011218836_100011649813 [0,1,0,0,1,0|2,0,0]=4 1780 B14R2.21 Oc1ccnc(n1)c2ccccc2 271570a_203496583355_100000750259 [0,1,0,0,1,0|2,0,0]=4 1781 B14R2.21 Oc1cncc(c1)c2ccccc2 271570a_100010248756_100000210277 [0,1,0,0,1,0|1,0,0]=3 1782 B14R2.21 Oc1cncc(c1)c2ccccc2 271570a_100011218836_100000754920 [0,1,0,0,1,0|1,0,0]=3 1783 B14R2.21 Oc1cncc(c1)c2ccccc2 271570a_203496583355_100010138719 [0,1,0,0,1,0|1,0,0]=3 1784 B14R2.21 Oc1cncc(c1)c2ccccn2 271570a_100010248756_100011216584 [0,1,0,0,1,0|2,0,0]=4 1785 B14R2.21 Oc1cncc(c1)c2ccccn2 271570a_100011264011_100000754920 [0,1,0,0,1,0|2,0,0]=4 1786 B14R2.21 Oc1cncc(c1)c2cccnc2 271570a_100000757648_100000754920 [0,1,0,0,1,0|2,0,0]=4 1787 B14R2.21 Oc1cncc(c1)c2cccnc2 271570a_100010248756_100000752921 [0,1,0,0,1,0|2,0,0]=4 1788 B14R2.21 Oc1cncc(c1)c2ccncc2 271570a_100000752145_100000754920 [0,1,0,0,1,0|2,0,0]=4 1789 B14R2.21 Oc1cncc(c1)c2ccncc2 271570a_100010248756_100000035832 [0,1,0,0,1,0|2,0,0]=4 1790 B14R2.21 Oc1cncc(n1)c2ccccc2 271570a_100011218836_100011269956 [0,1,0,0,1,0|2,0,0]=4 1791 B14R2.21 Oc1cncc(n1)c2ccccc2 271570a_203496583355_100000691699 [0,1,0,0,1,0|2,0,0]=4 1792 B14R2.21 Oc1cnnc(c1)c2ccccc2 271570a_100011218836_200010734679 [0,1,0,0,1,0|2,0,0]=4 1793 B14R2.21 Oc1nccc(n1)c2ccccc2 271570a_203496583355_100011448968 [0,1,0,0,1,0|2,0,0]=4 1794 B14R2.21 [O-][n+]1cccc(c1)c2ccccc2 271570a_100011218836_100009815978 [0,1,0,0,1,0|1,0,0]=3 1795 B14R2.21 [O-][n+]1cccc(c1)c2ccccn2 271570a_100011264011_100009815978 [0,1,0,0,1,0|2,0,0]=4 1796 B14R2.21 [O-][n+]1cccc(c1)c2cccnc2 271570a_100000757648_100009815978 [0,1,0,0,1,0|2,0,0]=4 1797 B14R2.21 [O-][n+]1cccc(c1)c2ccncc2 271570a_100000752145_100009815978 [0,1,0,0,1,0|2,0,0]=4 1798 B14R2.21 [O-][n+]1ccnc(c1)c2ccccc2 271570a_100011218836_100009880115 [0,1,0,0,1,0|2,0,0]=4 1799 B14R2.21 [S]c1cccc(c1)c2ccccc2 271570a_100011218836_114929384022 [0,1,0,0,1,0|0,0,0]=2 1800 B14R2.21 [S]c1cccc(c1)c2ccccn2 271570a_100011264011_114929384022 [0,1,0,0,1,0|1,0,0]=3 1801 B14R2.21 [S]c1cccc(c1)c2cccnc2 271570a_100000757648_114929384022 [0,1,0,0,1,0|1,0,0]=3 1802 B14R2.21 [S]c1cccc(c1)c2ccncc2 271570a_100000752145_114929384022 [0,1,0,0,1,0|1,0,0]=3 1803 B14R2.21 [S]c1cccc(c1)c2cnccn2 271570a_100011962566_114929384022 [0,1,0,0,1,0|2,0,0]=4 1804 B14R2.21 [S]c1cccc(c1)c2cncnc2 271570a_100000707473_114929384022 [0,1,0,0,1,0|2,0,0]=4 1805 B14R2.24 Brc1ccccc1c2ccccc2 271570a_100011218836_100000695589 [0,1,0,0,1,0|0,0,0]=2 1806 B14R2.24 Brc1ccccc1c2ccccn2 271570a_100011264011_100000695589 [0,1,0,0,1,0|1,0,0]=3 1807 B14R2.24 Brc1ccccc1c2cccnc2 271570a_100000757648_100000695589 [0,1,0,0,1,0|1,0,0]=3 1808 B14R2.24 Brc1ccccc1c2ccncc2 271570a_100000752145_100000695589 [0,1,0,0,1,0|1,0,0]=3 1809 B14R2.24 Brc1ccccc1c2cnccn2 271570a_100011962566_100000695589 [0,1,0,0,1,0|2,0,0]=4 1810 B14R2.24 Brc1ccccc1c2cncnc2 271570a_100000707473_100000695589 [0,1,0,0,1,0|2,0,0]=4 1811 B14R2.24 Brc1cccnc1c2ccccc2 271570a_100011218836_100000696092 [0,1,0,0,1,0|1,0,0]=3 1812 B14R2.24 Brc1cccnc1c2ccccn2 271570a_100011264011_100000696092 [0,1,0,0,1,0|2,0,0]=4 1813 B14R2.24 Brc1cccnc1c2cccnc2 271570a_100000757648_100000696092 [0,1,0,0,1,0|2,0,0]=4 1814 B14R2.24 Brc1cccnc1c2ccncc2 271570a_100000752145_100000696092 [0,1,0,0,1,0|2,0,0]=4 1815 B14R2.24 Brc1ccncc1c2ccccc2 271570a_100011218836_100010138639 [0,1,0,0,1,0|1,0,0]=3 1816 B14R2.24 Brc1ccncc1c2ccccn2 271570a_100011264011_100010138639 [0,1,0,0,1,0|2,0,0]=4 1817 B14R2.24 Brc1ccncc1c2cccnc2 271570a_100000757648_100010138639 [0,1,0,0,1,0|2,0,0]=4 1818 B14R2.24 Brc1ccncc1c2ccncc2 271570a_100000752145_100010138639 [0,1,0,0,1,0|2,0,0]=4 1819 B14R2.24 Brc1cnccc1c2ccccc2 271570a_100011218836_100000726257 [0,1,0,0,1,0|1,0,0]=3 1820 B14R2.24 Brc1cnccc1c2ccccn2 271570a_100011264011_100000726257 [0,1,0,0,1,0|2,0,0]=4 1821 B14R2.24 Brc1cnccc1c2cccnc2 271570a_100000757648_100000726257 [0,1,0,0,1,0|2,0,0]=4 1822 B14R2.24 Brc1cnccc1c2ccncc2 271570a_100000752145_100000726257 [0,1,0,0,1,0|2,0,0]=4 1823 B14R2.24 Brc1ncccc1c2ccccc2 271570a_100011218836_100010202626 [0,1,0,0,1,0|1,0,0]=3 1824 B14R2.24 Brc1ncccc1c2ccccn2 271570a_100011264011_100010202626 [0,1,0,0,1,0|2,0,0]=4 1825 B14R2.24 Brc1ncccc1c2cccnc2 271570a_100000757648_100010202626 [0,1,0,0,1,0|2,0,0]=4 1826 B14R2.24 Brc1ncccc1c2ccncc2 271570a_100000752145_100010202626 [0,1,0,0,1,0|2,0,0]=4 1827 B14R2.24 Brc1ncncc1c2ccccc2 271570a_100011218836_200012461658 [0,1,0,0,1,0|2,0,0]=4 1828 B14R2.24 C[n+]1ccccc1c2ccccc2 271570a_100011218836_100000212160 [0,1,0,0,1,0|1,0,0]=3 1829 B14R2.24 C[n+]1ccccc1c2ccccn2 271570a_100011264011_100000212160 [0,1,0,0,1,0|2,0,0]=4 1830 B14R2.24 C[n+]1ccccc1c2cccnc2 271570a_100000757648_100000212160 [0,1,0,0,1,0|2,0,0]=4 1831 B14R2.24 C[n+]1ccccc1c2ccncc2 271570a_100000752145_100000212160 [0,1,0,0,1,0|2,0,0]=4 1832 B14R2.24 Cc1ccccc1c2ccccc2 271570a_100000747142_100000210277 [0,1,0,0,1,0|0,0,0]=2 1833 B14R2.24 Cc1ccccc1c2ccccc2 271570a_100011218836_100000210755 [0,1,0,0,1,0|0,0,0]=2 1834 B14R2.24 Cc1ccccc1c2ccccn2 271570a_100000747142_100011216584 [0,1,0,0,1,0|1,0,0]=3 1835 B14R2.24 Cc1ccccc1c2ccccn2 271570a_100011264011_100000210755 [0,1,0,0,1,0|1,0,0]=3 1836 B14R2.24 Cc1ccccc1c2cccnc2 271570a_100000747142_100000752921 [0,1,0,0,1,0|1,0,0]=3 1837 B14R2.24 Cc1ccccc1c2cccnc2 271570a_100000757648_100000210755 [0,1,0,0,1,0|1,0,0]=3 1838 B14R2.24 Cc1ccccc1c2cccnn2 271570a_100000747142_100016991348 [0,1,0,0,1,0|2,0,0]=4 1839 B14R2.24 Cc1ccccc1c2ccncc2 271570a_100000747142_100000035832 [0,1,0,0,1,0|1,0,0]=3 1840 B14R2.24 Cc1ccccc1c2ccncc2 271570a_100000752145_100000210755 [0,1,0,0,1,0|1,0,0]=3 1841 B14R2.24 Cc1ccccc1c2ccncn2 271570a_100000747142_100000703185 [0,1,0,0,1,0|2,0,0]=4 1842 B14R2.24 Cc1ccccc1c2ccnnc2 271570a_100000747142_100000732662 [0,1,0,0,1,0|2,0,0]=4 1843 B14R2.24 Cc1ccccc1c2cnccn2 271570a_100000747142_100000758340 [0,1,0,0,1,0|2,0,0]=4 1844 B14R2.24 Cc1ccccc1c2cnccn2 271570a_100011962566_100000210755 [0,1,0,0,1,0|2,0,0]=4 1845 B14R2.24 Cc1ccccc1c2cncnc2 271570a_100000707473_100000210755 [0,1,0,0,1,0|2,0,0]=4 1846 B14R2.24 Cc1ccccc1c2cncnc2 271570a_100000747142_100011206942 [0,1,0,0,1,0|2,0,0]=4 1847 B14R2.24 Cc1ccccc1c2ncccn2 271570a_100000747142_100000211032 [0,1,0,0,1,0|2,0,0]=4 1848 B14R2.24 Cc1cccnc1c2ccccc2 271570a_100011218836_100000751373 [0,1,0,0,1,0|1,0,0]=3 1849 B14R2.24 Cc1cccnc1c2ccccn2 271570a_100011264011_100000751373 [0,1,0,0,1,0|2,0,0]=4 1850 B14R2.24 Cc1cccnc1c2cccnc2 271570a_100000757648_100000751373 [0,1,0,0,1,0|2,0,0]=4 1851 B14R2.24 Cc1cccnc1c2ccncc2 271570a_100000752145_100000751373 [0,1,0,0,1,0|2,0,0]=4 1852 B14R2.24 Cc1ccncc1c2ccccc2 271570a_100011218836_100000761580 [0,1,0,0,1,0|1,0,0]=3 1853 B14R2.24 Cc1ccncc1c2ccccc2 271570a_100011935247_100000210277 [0,1,0,0,1,0|1,0,0]=3 1854 B14R2.24 Cc1ccncc1c2ccccn2 271570a_100011264011_100000761580 [0,1,0,0,1,0|2,0,0]=4 1855 B14R2.24 Cc1ccncc1c2ccccn2 271570a_100011935247_100011216584 [0,1,0,0,1,0|2,0,0]=4 1856 B14R2.24 Cc1ccncc1c2cccnc2 271570a_100000757648_100000761580 [0,1,0,0,1,0|2,0,0]=4 1857 B14R2.24 Cc1ccncc1c2cccnc2 271570a_100011935247_100000752921 [0,1,0,0,1,0|2,0,0]=4 1858 B14R2.24 Cc1ccncc1c2ccncc2 271570a_100000752145_100000761580 [0,1,0,0,1,0|2,0,0]=4 1859 B14R2.24 Cc1ccncc1c2ccncc2 271570a_100011935247_100000035832 [0,1,0,0,1,0|2,0,0]=4 1860 B14R2.24 Cc1ccnnc1c2ccccc2 271570a_100011218836_100000089043 [0,1,0,0,1,0|2,0,0]=4 1861 B14R2.24 Cc1cnccc1c2ccccc2 271570a_100000701363_100000210277 [0,1,0,0,1,0|1,0,0]=3 1862 B14R2.24 Cc1cnccc1c2ccccc2 271570a_100011218836_100015191297 [0,1,0,0,1,0|1,0,0]=3 1863 B14R2.24 Cc1cnccc1c2ccccn2 271570a_100000701363_100011216584 [0,1,0,0,1,0|2,0,0]=4 1864 B14R2.24 Cc1cnccc1c2ccccn2 271570a_100011264011_100015191297 [0,1,0,0,1,0|2,0,0]=4 1865 B14R2.24 Cc1cnccc1c2cccnc2 271570a_100000701363_100000752921 [0,1,0,0,1,0|2,0,0]=4 1866 B14R2.24 Cc1cnccc1c2cccnc2 271570a_100000757648_100015191297 [0,1,0,0,1,0|2,0,0]=4 1867 B14R2.24 Cc1cnccc1c2ccncc2 271570a_100000701363_100000035832 [0,1,0,0,1,0|2,0,0]=4 1868 B14R2.24 Cc1cnccc1c2ccncc2 271570a_100000752145_100015191297 [0,1,0,0,1,0|2,0,0]=4 1869 B14R2.24 Cc1cncnc1c2ccccc2 271570a_100011218836_100011998708 [0,1,0,0,1,0|2,0,0]=4 1870 B14R2.24 Cc1ncccc1c2ccccc2 271570a_100011218836_100000751574 [0,1,0,0,1,0|1,0,0]=3 1871 B14R2.24 Cc1ncccc1c2ccccc2 271570a_100011934933_100000210277 [0,1,0,0,1,0|1,0,0]=3 1872 B14R2.24 Cc1ncccc1c2ccccn2 271570a_100011264011_100000751574 [0,1,0,0,1,0|2,0,0]=4 1873 B14R2.24 Cc1ncccc1c2ccccn2 271570a_100011934933_100011216584 [0,1,0,0,1,0|2,0,0]=4 1874 B14R2.24 Cc1ncccc1c2cccnc2 271570a_100000757648_100000751574 [0,1,0,0,1,0|2,0,0]=4 1875 B14R2.24 Cc1ncccc1c2cccnc2 271570a_100011934933_100000752921 [0,1,0,0,1,0|2,0,0]=4 1876 B14R2.24 Cc1ncccc1c2ccncc2 271570a_100000752145_100000751574 [0,1,0,0,1,0|2,0,0]=4 1877 B14R2.24 Cc1ncccc1c2ccncc2 271570a_100011934933_100000035832 [0,1,0,0,1,0|2,0,0]=4 1878 B14R2.24 Cc1nccnc1c2ccccc2 271570a_100011218836_100011999405 [0,1,0,0,1,0|2,0,0]=4 1879 B14R2.24 Cc1ncncc1c2ccccc2 271570a_100011218836_100009819671 [0,1,0,0,1,0|2,0,0]=4 1880 B14R2.24 Cc1ncncc1c2ccccc2 271570a_200010046012_100000210277 [0,1,0,0,1,0|2,0,0]=4 1881 B14R2.24 Clc1ccccc1c2ccccc2 271570a_100011218836_100000764095 [0,1,0,0,1,0|0,0,0]=2 1882 B14R2.24 Clc1ccccc1c2ccccc2 271570a_100011934419_100000210277 [0,1,0,0,1,0|0,0,0]=2 1883 B14R2.24 Clc1ccccc1c2ccccn2 271570a_100011264011_100000764095 [0,1,0,0,1,0|1,0,0]=3 1884 B14R2.24 Clc1ccccc1c2ccccn2 271570a_100011934419_100011216584 [0,1,0,0,1,0|1,0,0]=3 1885 B14R2.24 Clc1ccccc1c2cccnc2 271570a_100000757648_100000764095 [0,1,0,0,1,0|1,0,0]=3 1886 B14R2.24 Clc1ccccc1c2cccnc2 271570a_100011934419_100000752921 [0,1,0,0,1,0|1,0,0]=3 1887 B14R2.24 Clc1ccccc1c2cccnn2 271570a_100011934419_100016991348 [0,1,0,0,1,0|2,0,0]=4 1888 B14R2.24 Clc1ccccc1c2ccncc2 271570a_100000752145_100000764095 [0,1,0,0,1,0|1,0,0]=3 1889 B14R2.24 Clc1ccccc1c2ccncc2 271570a_100011934419_100000035832 [0,1,0,0,1,0|1,0,0]=3 1890 B14R2.24 Clc1ccccc1c2ccncn2 271570a_100011934419_100000703185 [0,1,0,0,1,0|2,0,0]=4 1891 B14R2.24 Clc1ccccc1c2ccnnc2 271570a_100011934419_100000732662 [0,1,0,0,1,0|2,0,0]=4 1892 B14R2.24 Clc1ccccc1c2cnccn2 271570a_100011934419_100000758340 [0,1,0,0,1,0|2,0,0]=4 1893 B14R2.24 Clc1ccccc1c2cnccn2 271570a_100011962566_100000764095 [0,1,0,0,1,0|2,0,0]=4 1894 B14R2.24 Clc1ccccc1c2cncnc2 271570a_100000707473_100000764095 [0,1,0,0,1,0|2,0,0]=4 1895 B14R2.24 Clc1ccccc1c2cncnc2 271570a_100011934419_100011206942 [0,1,0,0,1,0|2,0,0]=4 1896 B14R2.24 Clc1ccccc1c2ncccn2 271570a_100011934419_100000211032 [0,1,0,0,1,0|2,0,0]=4 1897 B14R2.24 Clc1cccnc1c2ccccc2 271570a_100009857861_100000210277 [0,1,0,0,1,0|1,0,0]=3 1898 B14R2.24 Clc1cccnc1c2ccccc2 271570a_100011218836_100011356963 [0,1,0,0,1,0|1,0,0]=3 1899 B14R2.24 Clc1cccnc1c2ccccn2 271570a_100009857861_100011216584 [0,1,0,0,1,0|2,0,0]=4 1900 B14R2.24 Clc1cccnc1c2ccccn2 271570a_100011264011_100011356963 [0,1,0,0,1,0|2,0,0]=4 1901 B14R2.24 Clc1cccnc1c2cccnc2 271570a_100000757648_100011356963 [0,1,0,0,1,0|2,0,0]=4 1902 B14R2.24 Clc1cccnc1c2cccnc2 271570a_100009857861_100000752921 [0,1,0,0,1,0|2,0,0]=4 1903 B14R2.24 Clc1cccnc1c2ccncc2 271570a_100000752145_100011356963 [0,1,0,0,1,0|2,0,0]=4 1904 B14R2.24 Clc1cccnc1c2ccncc2 271570a_100009857861_100000035832 [0,1,0,0,1,0|2,0,0]=4 1905 B14R2.24 Clc1ccncc1c2ccccc2 271570a_100000062317_100000210277 [0,1,0,0,1,0|1,0,0]=3 1906 B14R2.24 Clc1ccncc1c2ccccc2 271570a_100011218836_100009995489 [0,1,0,0,1,0|1,0,0]=3 1907 B14R2.24 Clc1ccncc1c2ccccn2 271570a_100000062317_100011216584 [0,1,0,0,1,0|2,0,0]=4 1908 B14R2.24 Clc1ccncc1c2ccccn2 271570a_100011264011_100009995489 [0,1,0,0,1,0|2,0,0]=4 1909 B14R2.24 Clc1ccncc1c2cccnc2 271570a_100000062317_100000752921 [0,1,0,0,1,0|2,0,0]=4 1910 B14R2.24 Clc1ccncc1c2cccnc2 271570a_100000757648_100009995489 [0,1,0,0,1,0|2,0,0]=4 1911 B14R2.24 Clc1ccncc1c2ccncc2 271570a_100000062317_100000035832 [0,1,0,0,1,0|2,0,0]=4 1912 B14R2.24 Clc1ccncc1c2ccncc2 271570a_100000752145_100009995489 [0,1,0,0,1,0|2,0,0]=4 1913 B14R2.24 Clc1cnccc1c2ccccc2 271570a_100000062318_100000210277 [0,1,0,0,1,0|1,0,0]=3 1914 B14R2.24 Clc1cnccc1c2ccccc2 271570a_100011218836_100000708259 [0,1,0,0,1,0|1,0,0]=3 1915 B14R2.24 Clc1cnccc1c2ccccn2 271570a_100000062318_100011216584 [0,1,0,0,1,0|2,0,0]=4 1916 B14R2.24 Clc1cnccc1c2ccccn2 271570a_100011264011_100000708259 [0,1,0,0,1,0|2,0,0]=4 1917 B14R2.24 Clc1cnccc1c2cccnc2 271570a_100000062318_100000752921 [0,1,0,0,1,0|2,0,0]=4 1918 B14R2.24 Clc1cnccc1c2cccnc2 271570a_100000757648_100000708259 [0,1,0,0,1,0|2,0,0]=4 1919 B14R2.24 Clc1cnccc1c2ccncc2 271570a_100000062318_100000035832 [0,1,0,0,1,0|2,0,0]=4 1920 B14R2.24 Clc1cnccc1c2ccncc2 271570a_100000752145_100000708259 [0,1,0,0,1,0|2,0,0]=4 1921 B14R2.24 Clc1ncccc1c2ccccc2 271570a_100000047009_100000210277 [0,1,0,0,1,0|1,0,0]=3 1922 B14R2.24 Clc1ncccc1c2ccccc2 271570a_100011218836_100000036424 [0,1,0,0,1,0|1,0,0]=3 1923 B14R2.24 Clc1ncccc1c2ccccn2 271570a_100000047009_100011216584 [0,1,0,0,1,0|2,0,0]=4 1924 B14R2.24 Clc1ncccc1c2ccccn2 271570a_100011264011_100000036424 [0,1,0,0,1,0|2,0,0]=4 1925 B14R2.24 Clc1ncccc1c2cccnc2 271570a_100000047009_100000752921 [0,1,0,0,1,0|2,0,0]=4 1926 B14R2.24 Clc1ncccc1c2cccnc2 271570a_100000757648_100000036424 [0,1,0,0,1,0|2,0,0]=4 1927 B14R2.24 Clc1ncccc1c2ccncc2 271570a_100000047009_100000035832 [0,1,0,0,1,0|2,0,0]=4 1928 B14R2.24 Clc1ncccc1c2ccncc2 271570a_100000752145_100000036424 [0,1,0,0,1,0|2,0,0]=4 1929 B14R2.24 Clc1ncncc1c2ccccc2 271570a_100011218836_100000758962 [0,1,0,0,1,0|2,0,0]=4 1930 B14R2.24 Fc1ccccc1c2ccccc2 271570a_100000761933_100000210277 [0,1,0,0,1,0|0,0,0]=2 1931 B14R2.24 Fc1ccccc1c2ccccc2 271570a_100011218836_100011215700 [0,1,0,0,1,0|0,0,0]=2 1932 B14R2.24 Fc1ccccc1c2ccccn2 271570a_100000761933_100011216584 [0,1,0,0,1,0|1,0,0]=3 1933 B14R2.24 Fc1ccccc1c2ccccn2 271570a_100011264011_100011215700 [0,1,0,0,1,0|1,0,0]=3 1934 B14R2.24 Fc1ccccc1c2cccnc2 271570a_100000757648_100011215700 [0,1,0,0,1,0|1,0,0]=3 1935 B14R2.24 Fc1ccccc1c2cccnc2 271570a_100000761933_100000752921 [0,1,0,0,1,0|1,0,0]=3 1936 B14R2.24 Fc1ccccc1c2cccnn2 271570a_100000761933_100016991348 [0,1,0,0,1,0|2,0,0]=4 1937 B14R2.24 Fc1ccccc1c2ccncc2 271570a_100000752145_100011215700 [0,1,0,0,1,0|1,0,0]=3 1938 B14R2.24 Fc1ccccc1c2ccncc2 271570a_100000761933_100000035832 [0,1,0,0,1,0|1,0,0]=3 1939 B14R2.24 Fc1ccccc1c2ccncn2 271570a_100000761933_100000703185 [0,1,0,0,1,0|2,0,0]=4 1940 B14R2.24 Fc1ccccc1c2ccnnc2 271570a_100000761933_100000732662 [0,1,0,0,1,0|2,0,0]=4 1941 B14R2.24 Fc1ccccc1c2cnccn2 271570a_100000761933_100000758340 [0,1,0,0,1,0|2,0,0]=4 1942 B14R2.24 Fc1ccccc1c2cnccn2 271570a_100011962566_100011215700 [0,1,0,0,1,0|2,0,0]=4 1943 B14R2.24 Fc1ccccc1c2cncnc2 271570a_100000707473_100011215700 [0,1,0,0,1,0|2,0,0]=4 1944 B14R2.24 Fc1ccccc1c2cncnc2 271570a_100000761933_100011206942 [0,1,0,0,1,0|2,0,0]=4 1945 B14R2.24 Fc1ccccc1c2ncccn2 271570a_100000761933_100000211032 [0,1,0,0,1,0|2,0,0]=4 1946 B14R2.24 Fc1cccnc1c2ccccc2 271570a_100011218836_100000685392 [0,1,0,0,1,0|1,0,0]=3 1947 B14R2.24 Fc1cccnc1c2ccccn2 271570a_100011264011_100000685392 [0,1,0,0,1,0|2,0,0]=4 1948 B14R2.24 Fc1cccnc1c2cccnc2 271570a_100000757648_100000685392 [0,1,0,0,1,0|2,0,0]=4 1949 B14R2.24 Fc1cccnc1c2ccncc2 271570a_100000752145_100000685392 [0,1,0,0,1,0|2,0,0]=4 1950 B14R2.24 Fc1ccncc1c2ccccc2 271570a_100011218836_100009820683 [0,1,0,0,1,0|1,0,0]=3 1951 B14R2.24 Fc1ccncc1c2ccccn2 271570a_100011264011_100009820683 [0,1,0,0,1,0|2,0,0]=4 1952 B14R2.24 Fc1ccncc1c2cccnc2 271570a_100000757648_100009820683 [0,1,0,0,1,0|2,0,0]=4 1953 B14R2.24 Fc1ccncc1c2ccncc2 271570a_100000752145_100009820683 [0,1,0,0,1,0|2,0,0]=4 1954 B14R2.24 Fc1cnccc1c2ccccc2 271570a_100011218836_100000047030 [0,1,0,0,1,0|1,0,0]=3 1955 B14R2.24 Fc1cnccc1c2ccccc2 271570a_100011290801_100000210277 [0,1,0,0,1,0|1,0,0]=3 1956 B14R2.24 Fc1cnccc1c2ccccn2 271570a_100011264011_100000047030 [0,1,0,0,1,0|2,0,0]=4 1957 B14R2.24 Fc1cnccc1c2ccccn2 271570a_100011290801_100011216584 [0,1,0,0,1,0|2,0,0]=4 1958 B14R2.24 Fc1cnccc1c2cccnc2 271570a_100000757648_100000047030 [0,1,0,0,1,0|2,0,0]=4 1959 B14R2.24 Fc1cnccc1c2cccnc2 271570a_100011290801_100000752921 [0,1,0,0,1,0|2,0,0]=4 1960 B14R2.24 Fc1cnccc1c2ccncc2 271570a_100000752145_100000047030 [0,1,0,0,1,0|2,0,0]=4 1961 B14R2.24 Fc1cnccc1c2ccncc2 271570a_100011290801_100000035832 [0,1,0,0,1,0|2,0,0]=4 1962 B14R2.24 Fc1cncnc1c2ccccc2 271570a_100011218836_100000069762 [0,1,0,0,1,0|2,0,0]=4 1963 B14R2.24 Fc1ncccc1c2ccccc2 271570a_100000042387_100000210277 [0,1,0,0,1,0|1,0,0]=3 1964 B14R2.24 Fc1ncccc1c2ccccc2 271570a_100011218836_100009816115 [0,1,0,0,1,0|1,0,0]=3 1965 B14R2.24 Fc1ncccc1c2ccccn2 271570a_100000042387_100011216584 [0,1,0,0,1,0|2,0,0]=4 1966 B14R2.24 Fc1ncccc1c2ccccn2 271570a_100011264011_100009816115 [0,1,0,0,1,0|2,0,0]=4 1967 B14R2.24 Fc1ncccc1c2cccnc2 271570a_100000042387_100000752921 [0,1,0,0,1,0|2,0,0]=4 1968 B14R2.24 Fc1ncccc1c2cccnc2 271570a_100000757648_100009816115 [0,1,0,0,1,0|2,0,0]=4 1969 B14R2.24 Fc1ncccc1c2ccncc2 271570a_100000042387_100000035832 [0,1,0,0,1,0|2,0,0]=4 1970 B14R2.24 Fc1ncccc1c2ccncc2 271570a_100000752145_100009816115 [0,1,0,0,1,0|2,0,0]=4 1971 B14R2.24 Fc1nccnc1c2ccccc2 271570a_100011218836_200010125657 [0,1,0,0,1,0|2,0,0]=4 1972 B14R2.24 Ic1ccccc1c2ccccc2 271570a_100000069755_100000210277 [0,1,0,0,1,0|0,0,0]=2 1973 B14R2.24 Ic1ccccc1c2ccccn2 271570a_100000069755_100011216584 [0,1,0,0,1,0|1,0,0]=3 1974 B14R2.24 Ic1ccccc1c2cccnc2 271570a_100000069755_100000752921 [0,1,0,0,1,0|1,0,0]=3 1975 B14R2.24 Ic1ccccc1c2cccnn2 271570a_100000069755_100016991348 [0,1,0,0,1,0|2,0,0]=4 1976 B14R2.24 Ic1ccccc1c2ccncc2 271570a_100000069755_100000035832 [0,1,0,0,1,0|1,0,0]=3 1977 B14R2.24 Ic1ccccc1c2ccncn2 271570a_100000069755_100000703185 [0,1,0,0,1,0|2,0,0]=4 1978 B14R2.24 Ic1ccccc1c2ccnnc2 271570a_100000069755_100000732662 [0,1,0,0,1,0|2,0,0]=4 1979 B14R2.24 Ic1ccccc1c2cnccn2 271570a_100000069755_100000758340 [0,1,0,0,1,0|2,0,0]=4 1980 B14R2.24 Ic1ccccc1c2cncnc2 271570a_100000069755_100011206942 [0,1,0,0,1,0|2,0,0]=4 1981 B14R2.24 Ic1ccccc1c2ncccn2 271570a_100000069755_100000211032 [0,1,0,0,1,0|2,0,0]=4 1982 B14R2.24 Nc1ccccc1c2ccccc2 271570a_100000034411_100000210277 [0,1,0,0,1,0|0,0,0]=2 1983 B14R2.24 Nc1ccccc1c2ccccc2 271570a_100011218836_100000210017 [0,1,0,0,1,0|0,0,0]=2 1984 B14R2.24 Nc1ccccc1c2ccccn2 271570a_100000034411_100011216584 [0,1,0,0,1,0|1,0,0]=3 1985 B14R2.24 Nc1ccccc1c2ccccn2 271570a_100011264011_100000210017 [0,1,0,0,1,0|1,0,0]=3 1986 B14R2.24 Nc1ccccc1c2cccnc2 271570a_100000034411_100000752921 [0,1,0,0,1,0|1,0,0]=3 1987 B14R2.24 Nc1ccccc1c2cccnc2 271570a_100000757648_100000210017 [0,1,0,0,1,0|1,0,0]=3 1988 B14R2.24 Nc1ccccc1c2cccnn2 271570a_100000034411_100016991348 [0,1,0,0,1,0|2,0,0]=4 1989 B14R2.24 Nc1ccccc1c2ccncc2 271570a_100000034411_100000035832 [0,1,0,0,1,0|1,0,0]=3 1990 B14R2.24 Nc1ccccc1c2ccncc2 271570a_100000752145_100000210017 [0,1,0,0,1,0|1,0,0]=3 1991 B14R2.24 Nc1ccccc1c2ccncn2 271570a_100000034411_100000703185 [0,1,0,0,1,0|2,0,0]=4 1992 B14R2.24 Nc1ccccc1c2ccnnc2 271570a_100000034411_100000732662 [0,1,0,0,1,0|2,0,0]=4 1993 B14R2.24 Nc1ccccc1c2cnccn2 271570a_100000034411_100000758340 [0,1,0,0,1,0|2,0,0]=4 1994 B14R2.24 Nc1ccccc1c2cnccn2 271570a_100011962566_100000210017 [0,1,0,0,1,0|2,0,0]=4 1995 B14R2.24 Nc1ccccc1c2cncnc2 271570a_100000034411_100011206942 [0,1,0,0,1,0|2,0,0]=4 1996 B14R2.24 Nc1ccccc1c2cncnc2 271570a_100000707473_100000210017 [0,1,0,0,1,0|2,0,0]=4 1997 B14R2.24 Nc1ccccc1c2ncccn2 271570a_100000034411_100000211032 [0,1,0,0,1,0|2,0,0]=4 1998 B14R2.24 Nc1cccnc1c2ccccc2 271570a_100011218836_100000688686 [0,1,0,0,1,0|1,0,0]=3 1999 B14R2.24 Nc1cccnc1c2ccccn2 271570a_100011264011_100000688686 [0,1,0,0,1,0|2,0,0]=4 2000 B14R2.24 Nc1cccnc1c2cccnc2 271570a_100000757648_100000688686 [0,1,0,0,1,0|2,0,0]=4 2001 B14R2.24 Nc1cccnc1c2ccncc2 271570a_100000752145_100000688686 [0,1,0,0,1,0|2,0,0]=4 2002 B14R2.24 Nc1ccncc1c2ccccc2 271570a_100011218836_100000047001 [0,1,0,0,1,0|1,0,0]=3 2003 B14R2.24 Nc1ccncc1c2ccccc2 271570a_200010248739_100000210277 [0,1,0,0,1,0|1,0,0]=3 2004 B14R2.24 Nc1ccncc1c2ccccn2 271570a_100011264011_100000047001 [0,1,0,0,1,0|2,0,0]=4 2005 B14R2.24 Nc1ccncc1c2ccccn2 271570a_200010248739_100011216584 [0,1,0,0,1,0|2,0,0]=4 2006 B14R2.24 Nc1ccncc1c2cccnc2 271570a_100000757648_100000047001 [0,1,0,0,1,0|2,0,0]=4 2007 B14R2.24 Nc1ccncc1c2cccnc2 271570a_200010248739_100000752921 [0,1,0,0,1,0|2,0,0]=4 2008 B14R2.24 Nc1ccncc1c2ccncc2 271570a_100000752145_100000047001 [0,1,0,0,1,0|2,0,0]=4 2009 B14R2.24 Nc1ccncc1c2ccncc2 271570a_200010248739_100000035832 [0,1,0,0,1,0|2,0,0]=4 2010 B14R2.24 Nc1cnccc1c2ccccc2 271570a_100011218836_100009815883 [0,1,0,0,1,0|1,0,0]=3 2011 B14R2.24 Nc1cnccc1c2ccccn2 271570a_100011264011_100009815883 [0,1,0,0,1,0|2,0,0]=4 2012 B14R2.24 Nc1cnccc1c2cccnc2 271570a_100000757648_100009815883 [0,1,0,0,1,0|2,0,0]=4 2013 B14R2.24 Nc1cnccc1c2ccncc2 271570a_100000752145_100009815883 [0,1,0,0,1,0|2,0,0]=4 2014 B14R2.24 Nc1cncnc1c2ccccc2 271570a_100011218836_100000709731 [0,1,0,0,1,0|2,0,0]=4 2015 B14R2.24 Nc1cnncc1c2ccccc2 271570a_100011218836_100009829405 [0,1,0,0,1,0|2,0,0]=4 2016 B14R2.24 Nc1ncccc1c2ccccc2 271570a_100000071976_100000210277 [0,1,0,0,1,0|1,0,0]=3 2017 B14R2.24 Nc1ncccc1c2ccccc2 271570a_100011218836_100000045569 [0,1,0,0,1,0|1,0,0]=3 2018 B14R2.24 Nc1ncccc1c2ccccn2 271570a_100000071976_100011216584 [0,1,0,0,1,0|2,0,0]=4 2019 B14R2.24 Nc1ncccc1c2ccccn2 271570a_100011264011_100000045569 [0,1,0,0,1,0|2,0,0]=4 2020 B14R2.24 Nc1ncccc1c2cccnc2 271570a_100000071976_100000752921 [0,1,0,0,1,0|2,0,0]=4 2021 B14R2.24 Nc1ncccc1c2cccnc2 271570a_100000757648_100000045569 [0,1,0,0,1,0|2,0,0]=4 2022 B14R2.24 Nc1ncccc1c2ccncc2 271570a_100000071976_100000035832 [0,1,0,0,1,0|2,0,0]=4 2023 B14R2.24 Nc1ncccc1c2ccncc2 271570a_100000752145_100000045569 [0,1,0,0,1,0|2,0,0]=4 2024 B14R2.24 Nc1nccnc1c2ccccc2 271570a_100011218836_100000747729 [0,1,0,0,1,0|2,0,0]=4 2025 B14R2.24 Nc1ncncc1c2ccccc2 271570a_100011218836_100011996079 [0,1,0,0,1,0|2,0,0]=4 2026 B14R2.24 O=c1[nH]cccc1c2ccccc2 271570a_100000099769_100000210277 [0,1,0,0,1,0|1,0,0]=3 2027 B14R2.24 O=c1[nH]cccc1c2ccccc2 271570a_100011218836_100000050042 [0,1,0,0,1,0|1,0,0]=3 2028 B14R2.24 O=c1[nH]cccc1c2ccccn2 271570a_100000099769_100011216584 [0,1,0,0,1,0|2,0,0]=4 2029 B14R2.24 O=c1[nH]cccc1c2ccccn2 271570a_100011264011_100000050042 [0,1,0,0,1,0|2,0,0]=4 2030 B14R2.24 O=c1[nH]cccc1c2cccnc2 271570a_100000099769_100000752921 [0,1,0,0,1,0|2,0,0]=4 2031 B14R2.24 O=c1[nH]cccc1c2cccnc2 271570a_100000757648_100000050042 [0,1,0,0,1,0|2,0,0]=4 2032 B14R2.24 O=c1[nH]cccc1c2ccncc2 271570a_100000099769_100000035832 [0,1,0,0,1,0|2,0,0]=4 2033 B14R2.24 O=c1[nH]cccc1c2ccncc2 271570a_100000752145_100000050042 [0,1,0,0,1,0|2,0,0]=4 2034 B14R2.24 O=c1[nH]ccnc1c2ccccc2 271570a_100011218836_100000763361 [0,1,0,0,1,0|2,0,0]=4 2035 B14R2.24 O=c1[nH]nccc1c2ccccc2 271570a_100011218836_100000087129 [0,1,0,0,1,0|2,0,0]=4 2036 B14R2.24 O=c1cc[nH]cc1c2ccccc2 271570a_100011218836_100009998708 [0,1,0,0,1,0|1,0,0]=3 2037 B14R2.24 O=c1cc[nH]cc1c2ccccn2 271570a_100011264011_100009998708 [0,1,0,0,1,0|2,0,0]=4 2038 B14R2.24 O=c1cc[nH]cc1c2cccnc2 271570a_100000757648_100009998708 [0,1,0,0,1,0|2,0,0]=4 2039 B14R2.24 O=c1cc[nH]cc1c2ccncc2 271570a_100000752145_100009998708 [0,1,0,0,1,0|2,0,0]=4 2040 B14R2.24 Oc1ccccc1c2ccccc2 271570a_100000035170_100000210277 [0,1,0,0,1,0|0,0,0]=2 2041 B14R2.24 Oc1ccccc1c2ccccc2 271570a_100011218836_100000739446 [0,1,0,0,1,0|0,0,0]=2 2042 B14R2.24 Oc1ccccc1c2ccccc2 271570a_203496583355_100000033479 [0,1,0,0,1,0|0,0,0]=2 2043 B14R2.24 Oc1ccccc1c2ccccn2 271570a_100000035170_100011216584 [0,1,0,0,1,0|1,0,0]=3 2044 B14R2.24 Oc1ccccc1c2ccccn2 271570a_100011264011_100000739446 [0,1,0,0,1,0|1,0,0]=3 2045 B14R2.24 Oc1ccccc1c2ccccn2 271570a_203496583355_100010202516 [0,1,0,0,1,0|1,0,0]=3 2046 B14R2.24 Oc1ccccc1c2cccnc2 271570a_100000035170_100000752921 [0,1,0,0,1,0|1,0,0]=3 2047 B14R2.24 Oc1ccccc1c2cccnc2 271570a_100000757648_100000739446 [0,1,0,0,1,0|1,0,0]=3 2048 B14R2.24 Oc1ccccc1c2cccnn2 271570a_100000035170_100016991348 [0,1,0,0,1,0|2,0,0]=4 2049 B14R2.24 Oc1ccccc1c2ccncc2 271570a_100000035170_100000035832 [0,1,0,0,1,0|1,0,0]=3 2050 B14R2.24 Oc1ccccc1c2ccncc2 271570a_100000752145_100000739446 [0,1,0,0,1,0|1,0,0]=3 2051 B14R2.24 Oc1ccccc1c2ccncc2 271570a_203496583355_100010154595 [0,1,0,0,1,0|1,0,0]=3 2052 B14R2.24 Oc1ccccc1c2ccncn2 271570a_100000035170_100000703185 [0,1,0,0,1,0|2,0,0]=4 2053 B14R2.24 Oc1ccccc1c2ccnnc2 271570a_100000035170_100000732662 [0,1,0,0,1,0|2,0,0]=4 2054 B14R2.24 Oc1ccccc1c2cnccn2 271570a_100000035170_100000758340 [0,1,0,0,1,0|2,0,0]=4 2055 B14R2.24 Oc1ccccc1c2cnccn2 271570a_100011962566_100000739446 [0,1,0,0,1,0|2,0,0]=4 2056 B14R2.24 Oc1ccccc1c2cncnc2 271570a_100000035170_100011206942 [0,1,0,0,1,0|2,0,0]=4 2057 B14R2.24 Oc1ccccc1c2cncnc2 271570a_100000707473_100000739446 [0,1,0,0,1,0|2,0,0]=4 2058 B14R2.24 Oc1ccccc1c2ncccn2 271570a_100000035170_100000211032 [0,1,0,0,1,0|2,0,0]=4 2059 B14R2.24 Oc1cccnc1c2ccccc2 271570a_100011218836_100000034122 [0,1,0,0,1,0|1,0,0]=3 2060 B14R2.24 Oc1cccnc1c2ccccc2 271570a_203496583355_100010138707 [0,1,0,0,1,0|1,0,0]=3 2061 B14R2.24 Oc1cccnc1c2ccccn2 271570a_100011264011_100000034122 [0,1,0,0,1,0|2,0,0]=4 2062 B14R2.24 Oc1cccnc1c2cccnc2 271570a_100000757648_100000034122 [0,1,0,0,1,0|2,0,0]=4 2063 B14R2.24 Oc1cccnc1c2ccncc2 271570a_100000752145_100000034122 [0,1,0,0,1,0|2,0,0]=4 2064 B14R2.24 Oc1cnccc1c2ccccc2 271570a_100011218836_100009817591 [0,1,0,0,1,0|1,0,0]=3 2065 B14R2.24 Oc1cnccc1c2ccccc2 271570a_203496583355_100009816686 [0,1,0,0,1,0|1,0,0]=3 2066 B14R2.24 Oc1cnccc1c2ccccn2 271570a_100011264011_100009817591 [0,1,0,0,1,0|2,0,0]=4 2067 B14R2.24 Oc1cnccc1c2cccnc2 271570a_100000757648_100009817591 [0,1,0,0,1,0|2,0,0]=4 2068 B14R2.24 Oc1cnccc1c2ccncc2 271570a_100000752145_100009817591 [0,1,0,0,1,0|2,0,0]=4 2069 B14R2.24 Oc1cncnc1c2ccccc2 271570a_203496583355_200009816525 [0,1,0,0,1,0|2,0,0]=4 2070 B14R2.24 Oc1ncncc1c2ccccc2 271570a_100011218836_100000751107 [0,1,0,0,1,0|2,0,0]=4 2071 B14R2.24 S=c1cc[nH]cc1c2ccccc2 271570a_100011218836_200012280681 [0,1,0,0,1,0|1,0,0]=3 2072 B14R2.24 S=c1cc[nH]cc1c2ccccn2 271570a_100011264011_200012280681 [0,1,0,0,1,0|2,0,0]=4 2073 B14R2.24 S=c1cc[nH]cc1c2cccnc2 271570a_100000757648_200012280681 [0,1,0,0,1,0|2,0,0]=4 2074 B14R2.24 S=c1cc[nH]cc1c2ccncc2 271570a_100000752145_200012280681 [0,1,0,0,1,0|2,0,0]=4 2075 B14R2.24 [O-][n+]1ccccc1c2ccccc2 271570a_100011218836_200000042595 [0,1,0,0,1,0|1,0,0]=3 2076 B14R2.24 [O-][n+]1ccccc1c2ccccn2 271570a_100011264011_200000042595 [0,1,0,0,1,0|2,0,0]=4 2077 B14R2.24 [O-][n+]1ccccc1c2cccnc2 271570a_100000757648_200000042595 [0,1,0,0,1,0|2,0,0]=4 2078 B14R2.24 [O-][n+]1ccccc1c2ccncc2 271570a_100000752145_200000042595 [0,1,0,0,1,0|2,0,0]=4 2079 B14R2.68 Brc1ccc(cc1)c2ccccc2 271570a_100010235827_100000210277 [0,1,0,0,1,0|0,0,0]=2 2080 B14R2.68 Brc1ccc(cc1)c2ccccc2 271570a_100011218836_100000752885 [0,1,0,0,1,0|0,0,0]=2 2081 B14R2.68 Brc1ccc(cc1)c2ccccn2 271570a_100010235827_100011216584 [0,1,0,0,1,0|1,0,0]=3 2082 B14R2.68 Brc1ccc(cc1)c2ccccn2 271570a_100011264011_100000752885 [0,1,0,0,1,0|1,0,0]=3 2083 B14R2.68 Brc1ccc(cc1)c2cccnc2 271570a_100000757648_100000752885 [0,1,0,0,1,0|1,0,0]=3 2084 B14R2.68 Brc1ccc(cc1)c2cccnc2 271570a_100010235827_100000752921 [0,1,0,0,1,0|1,0,0]=3 2085 B14R2.68 Brc1ccc(cc1)c2cccnn2 271570a_100010235827_100016991348 [0,1,0,0,1,0|2,0,0]=4 2086 B14R2.68 Brc1ccc(cc1)c2ccncc2 271570a_100000752145_100000752885 [0,1,0,0,1,0|1,0,0]=3 2087 B14R2.68 Brc1ccc(cc1)c2ccncc2 271570a_100010235827_100000035832 [0,1,0,0,1,0|1,0,0]=3 2088 B14R2.68 Brc1ccc(cc1)c2ccncn2 271570a_100010235827_100000703185 [0,1,0,0,1,0|2,0,0]=4 2089 B14R2.68 Brc1ccc(cc1)c2ccnnc2 271570a_100010235827_100000732662 [0,1,0,0,1,0|2,0,0]=4 2090 B14R2.68 Brc1ccc(cc1)c2cnccn2 271570a_100010235827_100000758340 [0,1,0,0,1,0|2,0,0]=4 2091 B14R2.68 Brc1ccc(cc1)c2cnccn2 271570a_100011962566_100000752885 [0,1,0,0,1,0|2,0,0]=4 2092 B14R2.68 Brc1ccc(cc1)c2cncnc2 271570a_100000707473_100000752885 [0,1,0,0,1,0|2,0,0]=4 2093 B14R2.68 Brc1ccc(cc1)c2cncnc2 271570a_100010235827_100011206942 [0,1,0,0,1,0|2,0,0]=4 2094 B14R2.68 Brc1ccc(cc1)c2ncccn2 271570a_100010235827_100000211032 [0,1,0,0,1,0|2,0,0]=4 2095 B14R2.68 Brc1ccc(cn1)c2ccccc2 271570a_100011218836_100009814638 [0,1,0,0,1,0|1,0,0]=3 2096 B14R2.68 Brc1ccc(cn1)c2ccccn2 271570a_100011264011_100009814638 [0,1,0,0,1,0|2,0,0]=4 2097 B14R2.68 Brc1ccc(cn1)c2cccnc2 271570a_100000757648_100009814638 [0,1,0,0,1,0|2,0,0]=4 2098 B14R2.68 Brc1ccc(cn1)c2ccncc2 271570a_100000752145_100009814638 [0,1,0,0,1,0|2,0,0]=4 2099 B14R2.68 Brc1ccc(nc1)c2ccccc2 271570a_100011218836_100000686858 [0,1,0,0,1,0|1,0,0]=3 2100 B14R2.68 Brc1ccc(nc1)c2ccccn2 271570a_100011264011_100000686858 [0,1,0,0,1,0|2,0,0]=4 2101 B14R2.68 Brc1ccc(nc1)c2cccnc2 271570a_100000757648_100000686858 [0,1,0,0,1,0|2,0,0]=4 2102 B14R2.68 Brc1ccc(nc1)c2ccncc2 271570a_100000752145_100000686858 [0,1,0,0,1,0|2,0,0]=4 2103 B14R2.68 Brc1cnc(nc1)c2ccccc2 271570a_100011218836_100000690281 [0,1,0,0,1,0|2,0,0]=4 2104 B14R2.68 Brc1ncc(cn1)c2ccccc2 271570a_100011218836_200012349914 [0,1,0,0,1,0|2,0,0]=4 2105 B14R2.68 C[n+]1ccc(cc1)c2ccccc2 271570a_100010897472_100000210277 [0,1,0,0,1,0|1,0,0]=3 2106 B14R2.68 C[n+]1ccc(cc1)c2ccccn2 271570a_100010897472_100011216584 [0,1,0,0,1,0|2,0,0]=4 2107 B14R2.68 C[n+]1ccc(cc1)c2cccnc2 271570a_100010897472_100000752921 [0,1,0,0,1,0|2,0,0]=4 2108 B14R2.68 C[n+]1ccc(cc1)c2ccncc2 271570a_100010897472_100000035832 [0,1,0,0,1,0|2,0,0]=4 2109 B14R2.68 Cc1ccc(cc1)c2ccccc2 271570a_100000708704_100000210277 [0,1,0,0,1,0|0,0,0]=2 2110 B14R2.68 Cc1ccc(cc1)c2ccccc2 271570a_100011218836_100000186775 [0,1,0,0,1,0|0,0,0]=2 2111 B14R2.68 Cc1ccc(cc1)c2ccccn2 271570a_100000708704_100011216584 [0,1,0,0,1,0|1,0,0]=3 2112 B14R2.68 Cc1ccc(cc1)c2ccccn2 271570a_100011264011_100000186775 [0,1,0,0,1,0|1,0,0]=3 2113 B14R2.68 Cc1ccc(cc1)c2cccnc2 271570a_100000708704_100000752921 [0,1,0,0,1,0|1,0,0]=3 2114 B14R2.68 Cc1ccc(cc1)c2cccnc2 271570a_100000757648_100000186775 [0,1,0,0,1,0|1,0,0]=3 2115 B14R2.68 Cc1ccc(cc1)c2cccnn2 271570a_100000708704_100016991348 [0,1,0,0,1,0|2,0,0]=4 2116 B14R2.68 Cc1ccc(cc1)c2ccncc2 271570a_100000708704_100000035832 [0,1,0,0,1,0|1,0,0]=3 2117 B14R2.68 Cc1ccc(cc1)c2ccncc2 271570a_100000752145_100000186775 [0,1,0,0,1,0|1,0,0]=3 2118 B14R2.68 Cc1ccc(cc1)c2ccncn2 271570a_100000708704_100000703185 [0,1,0,0,1,0|2,0,0]=4 2119 B14R2.68 Cc1ccc(cc1)c2ccnnc2 271570a_100000708704_100000732662 [0,1,0,0,1,0|2,0,0]=4 2120 B14R2.68 Cc1ccc(cc1)c2cnccn2 271570a_100000708704_100000758340 [0,1,0,0,1,0|2,0,0]=4 2121 B14R2.68 Cc1ccc(cc1)c2cnccn2 271570a_100011962566_100000186775 [0,1,0,0,1,0|2,0,0]=4 2122 B14R2.68 Cc1ccc(cc1)c2cncnc2 271570a_100000707473_100000186775 [0,1,0,0,1,0|2,0,0]=4 2123 B14R2.68 Cc1ccc(cc1)c2cncnc2 271570a_100000708704_100011206942 [0,1,0,0,1,0|2,0,0]=4 2124 B14R2.68 Cc1ccc(cc1)c2ncccn2 271570a_100000708704_100000211032 [0,1,0,0,1,0|2,0,0]=4 2125 B14R2.68 Cc1ccc(cn1)c2ccccc2 271570a_100011218836_100000751577 [0,1,0,0,1,0|1,0,0]=3 2126 B14R2.68 Cc1ccc(cn1)c2ccccc2 271570a_100012354835_100000210277 [0,1,0,0,1,0|1,0,0]=3 2127 B14R2.68 Cc1ccc(cn1)c2ccccn2 271570a_100011264011_100000751577 [0,1,0,0,1,0|2,0,0]=4 2128 B14R2.68 Cc1ccc(cn1)c2ccccn2 271570a_100012354835_100011216584 [0,1,0,0,1,0|2,0,0]=4 2129 B14R2.68 Cc1ccc(cn1)c2cccnc2 271570a_100000757648_100000751577 [0,1,0,0,1,0|2,0,0]=4 2130 B14R2.68 Cc1ccc(cn1)c2cccnc2 271570a_100012354835_100000752921 [0,1,0,0,1,0|2,0,0]=4 2131 B14R2.68 Cc1ccc(cn1)c2ccncc2 271570a_100000752145_100000751577 [0,1,0,0,1,0|2,0,0]=4 2132 B14R2.68 Cc1ccc(cn1)c2ccncc2 271570a_100012354835_100000035832 [0,1,0,0,1,0|2,0,0]=4 2133 B14R2.68 Cc1ccc(nc1)c2ccccc2 271570a_100000066433_100000210277 [0,1,0,0,1,0|1,0,0]=3 2134 B14R2.68 Cc1ccc(nc1)c2ccccc2 271570a_100011218836_100000754016 [0,1,0,0,1,0|1,0,0]=3 2135 B14R2.68 Cc1ccc(nc1)c2ccccn2 271570a_100000066433_100011216584 [0,1,0,0,1,0|2,0,0]=4 2136 B14R2.68 Cc1ccc(nc1)c2ccccn2 271570a_100011264011_100000754016 [0,1,0,0,1,0|2,0,0]=4 2137 B14R2.68 Cc1ccc(nc1)c2cccnc2 271570a_100000066433_100000752921 [0,1,0,0,1,0|2,0,0]=4 2138 B14R2.68 Cc1ccc(nc1)c2cccnc2 271570a_100000757648_100000754016 [0,1,0,0,1,0|2,0,0]=4 2139 B14R2.68 Cc1ccc(nc1)c2ccncc2 271570a_100000066433_100000035832 [0,1,0,0,1,0|2,0,0]=4 2140 B14R2.68 Cc1ccc(nc1)c2ccncc2 271570a_100000752145_100000754016 [0,1,0,0,1,0|2,0,0]=4 2141 B14R2.68 Cc1ccc(nn1)c2ccccc2 271570a_100011218836_100011450037 [0,1,0,0,1,0|2,0,0]=4 2142 B14R2.68 Cc1cnc(cn1)c2ccccc2 271570a_100011218836_100011999403 [0,1,0,0,1,0|2,0,0]=4 2143 B14R2.68 Cc1cnc(nc1)c2ccccc2 271570a_100011218836_100011825175 [0,1,0,0,1,0|2,0,0]=4 2144 B14R2.68 Cc1ncc(cn1)c2ccccc2 271570a_100010255633_100000210277 [0,1,0,0,1,0|2,0,0]=4 2145 B14R2.68 Cc1ncc(cn1)c2ccccc2 271570a_100011218836_100000686985 [0,1,0,0,1,0|2,0,0]=4 2146 B14R2.68 Clc1ccc(cc1)c2ccccc2 271570a_100011213355_100000210277 [0,1,0,0,1,0|0,0,0]=2 2147 B14R2.68 Clc1ccc(cc1)c2ccccc2 271570a_100011218836_100000755918 [0,1,0,0,1,0|0,0,0]=2 2148 B14R2.68 Clc1ccc(cc1)c2ccccn2 271570a_100011213355_100011216584 [0,1,0,0,1,0|1,0,0]=3 2149 B14R2.68 Clc1ccc(cc1)c2ccccn2 271570a_100011264011_100000755918 [0,1,0,0,1,0|1,0,0]=3 2150 B14R2.68 Clc1ccc(cc1)c2cccnc2 271570a_100000757648_100000755918 [0,1,0,0,1,0|1,0,0]=3 2151 B14R2.68 Clc1ccc(cc1)c2cccnc2 271570a_100011213355_100000752921 [0,1,0,0,1,0|1,0,0]=3 2152 B14R2.68 Clc1ccc(cc1)c2cccnn2 271570a_100011213355_100016991348 [0,1,0,0,1,0|2,0,0]=4 2153 B14R2.68 Clc1ccc(cc1)c2ccncc2 271570a_100000752145_100000755918 [0,1,0,0,1,0|1,0,0]=3 2154 B14R2.68 Clc1ccc(cc1)c2ccncc2 271570a_100011213355_100000035832 [0,1,0,0,1,0|1,0,0]=3 2155 B14R2.68 Clc1ccc(cc1)c2ccncn2 271570a_100011213355_100000703185 [0,1,0,0,1,0|2,0,0]=4 2156 B14R2.68 Clc1ccc(cc1)c2ccnnc2 271570a_100011213355_100000732662 [0,1,0,0,1,0|2,0,0]=4 2157 B14R2.68 Clc1ccc(cc1)c2cnccn2 271570a_100011213355_100000758340 [0,1,0,0,1,0|2,0,0]=4 2158 B14R2.68 Clc1ccc(cc1)c2cnccn2 271570a_100011962566_100000755918 [0,1,0,0,1,0|2,0,0]=4 2159 B14R2.68 Clc1ccc(cc1)c2cncnc2 271570a_100000707473_100000755918 [0,1,0,0,1,0|2,0,0]=4 2160 B14R2.68 Clc1ccc(cc1)c2cncnc2 271570a_100011213355_100011206942 [0,1,0,0,1,0|2,0,0]=4 2161 B14R2.68 Clc1ccc(cc1)c2ncccn2 271570a_100011213355_100000211032 [0,1,0,0,1,0|2,0,0]=4 2162 B14R2.68 Clc1ccc(cn1)c2ccccc2 271570a_100000037156_100000210277 [0,1,0,0,1,0|1,0,0]=3 2163 B14R2.68 Clc1ccc(cn1)c2ccccc2 271570a_100011218836_100000034144 [0,1,0,0,1,0|1,0,0]=3 2164 B14R2.68 Clc1ccc(cn1)c2ccccn2 271570a_100000037156_100011216584 [0,1,0,0,1,0|2,0,0]=4 2165 B14R2.68 Clc1ccc(cn1)c2ccccn2 271570a_100011264011_100000034144 [0,1,0,0,1,0|2,0,0]=4 2166 B14R2.68 Clc1ccc(cn1)c2cccnc2 271570a_100000037156_100000752921 [0,1,0,0,1,0|2,0,0]=4 2167 B14R2.68 Clc1ccc(cn1)c2cccnc2 271570a_100000757648_100000034144 [0,1,0,0,1,0|2,0,0]=4 2168 B14R2.68 Clc1ccc(cn1)c2ccncc2 271570a_100000037156_100000035832 [0,1,0,0,1,0|2,0,0]=4 2169 B14R2.68 Clc1ccc(cn1)c2ccncc2 271570a_100000752145_100000034144 [0,1,0,0,1,0|2,0,0]=4 2170 B14R2.68 Clc1ccc(nc1)c2ccccc2 271570a_100011218836_100011356976 [0,1,0,0,1,0|1,0,0]=3 2171 B14R2.68 Clc1ccc(nc1)c2ccccc2 271570a_200000049369_100000210277 [0,1,0,0,1,0|1,0,0]=3 2172 B14R2.68 Clc1ccc(nc1)c2ccccn2 271570a_100011264011_100011356976 [0,1,0,0,1,0|2,0,0]=4 2173 B14R2.68 Clc1ccc(nc1)c2ccccn2 271570a_200000049369_100011216584 [0,1,0,0,1,0|2,0,0]=4 2174 B14R2.68 Clc1ccc(nc1)c2cccnc2 271570a_100000757648_100011356976 [0,1,0,0,1,0|2,0,0]=4 2175 B14R2.68 Clc1ccc(nc1)c2cccnc2 271570a_200000049369_100000752921 [0,1,0,0,1,0|2,0,0]=4 2176 B14R2.68 Clc1ccc(nc1)c2ccncc2 271570a_100000752145_100011356976 [0,1,0,0,1,0|2,0,0]=4 2177 B14R2.68 Clc1ccc(nc1)c2ccncc2 271570a_200000049369_100000035832 [0,1,0,0,1,0|2,0,0]=4 2178 B14R2.68 Clc1cnc(nc1)c2ccccc2 271570a_100011218836_100011356929 [0,1,0,0,1,0|2,0,0]=4 2179 B14R2.68 Clc1ncc(cn1)c2ccccc2 271570a_100000087307_100000210277 [0,1,0,0,1,0|2,0,0]=4 2180 B14R2.68 Fc1ccc(cc1)c2ccccc2 271570a_100011218836_100000211213 [0,1,0,0,1,0|0,0,0]=2 2181 B14R2.68 Fc1ccc(cc1)c2ccccc2 271570a_100011934326_100000210277 [0,1,0,0,1,0|0,0,0]=2 2182 B14R2.68 Fc1ccc(cc1)c2ccccn2 271570a_100011264011_100000211213 [0,1,0,0,1,0|1,0,0]=3 2183 B14R2.68 Fc1ccc(cc1)c2ccccn2 271570a_100011934326_100011216584 [0,1,0,0,1,0|1,0,0]=3 2184 B14R2.68 Fc1ccc(cc1)c2cccnc2 271570a_100000757648_100000211213 [0,1,0,0,1,0|1,0,0]=3 2185 B14R2.68 Fc1ccc(cc1)c2cccnc2 271570a_100011934326_100000752921 [0,1,0,0,1,0|1,0,0]=3 2186 B14R2.68 Fc1ccc(cc1)c2cccnn2 271570a_100011934326_100016991348 [0,1,0,0,1,0|2,0,0]=4 2187 B14R2.68 Fc1ccc(cc1)c2ccncc2 271570a_100000752145_100000211213 [0,1,0,0,1,0|1,0,0]=3 2188 B14R2.68 Fc1ccc(cc1)c2ccncc2 271570a_100011934326_100000035832 [0,1,0,0,1,0|1,0,0]=3 2189 B14R2.68 Fc1ccc(cc1)c2ccncn2 271570a_100011934326_100000703185 [0,1,0,0,1,0|2,0,0]=4 2190 B14R2.68 Fc1ccc(cc1)c2ccnnc2 271570a_100011934326_100000732662 [0,1,0,0,1,0|2,0,0]=4 2191 B14R2.68 Fc1ccc(cc1)c2cnccn2 271570a_100011934326_100000758340 [0,1,0,0,1,0|2,0,0]=4 2192 B14R2.68 Fc1ccc(cc1)c2cnccn2 271570a_100011962566_100000211213 [0,1,0,0,1,0|2,0,0]=4 2193 B14R2.68 Fc1ccc(cc1)c2cncnc2 271570a_100000707473_100000211213 [0,1,0,0,1,0|2,0,0]=4 2194 B14R2.68 Fc1ccc(cc1)c2cncnc2 271570a_100011934326_100011206942 [0,1,0,0,1,0|2,0,0]=4 2195 B14R2.68 Fc1ccc(cc1)c2ncccn2 271570a_100011934326_100000211032 [0,1,0,0,1,0|2,0,0]=4 2196 B14R2.68 Fc1ccc(cn1)c2ccccc2 271570a_100000041719_100000210277 [0,1,0,0,1,0|1,0,0]=3 2197 B14R2.68 Fc1ccc(cn1)c2ccccc2 271570a_100011218836_100000748661 [0,1,0,0,1,0|1,0,0]=3 2198 B14R2.68 Fc1ccc(cn1)c2ccccn2 271570a_100000041719_100011216584 [0,1,0,0,1,0|2,0,0]=4 2199 B14R2.68 Fc1ccc(cn1)c2ccccn2 271570a_100011264011_100000748661 [0,1,0,0,1,0|2,0,0]=4 2200 B14R2.68 Fc1ccc(cn1)c2cccnc2 271570a_100000041719_100000752921 [0,1,0,0,1,0|2,0,0]=4 2201 B14R2.68 Fc1ccc(cn1)c2cccnc2 271570a_100000757648_100000748661 [0,1,0,0,1,0|2,0,0]=4 2202 B14R2.68 Fc1ccc(cn1)c2ccncc2 271570a_100000041719_100000035832 [0,1,0,0,1,0|2,0,0]=4 2203 B14R2.68 Fc1ccc(cn1)c2ccncc2 271570a_100000752145_100000748661 [0,1,0,0,1,0|2,0,0]=4 2204 B14R2.68 Fc1ccc(nc1)c2ccccc2 271570a_100000117362_100000210277 [0,1,0,0,1,0|1,0,0]=3 2205 B14R2.68 Fc1ccc(nc1)c2ccccc2 271570a_100011218836_100000744514 [0,1,0,0,1,0|1,0,0]=3 2206 B14R2.68 Fc1ccc(nc1)c2ccccn2 271570a_100000117362_100011216584 [0,1,0,0,1,0|2,0,0]=4 2207 B14R2.68 Fc1ccc(nc1)c2ccccn2 271570a_100011264011_100000744514 [0,1,0,0,1,0|2,0,0]=4 2208 B14R2.68 Fc1ccc(nc1)c2cccnc2 271570a_100000117362_100000752921 [0,1,0,0,1,0|2,0,0]=4 2209 B14R2.68 Fc1ccc(nc1)c2cccnc2 271570a_100000757648_100000744514 [0,1,0,0,1,0|2,0,0]=4 2210 B14R2.68 Fc1ccc(nc1)c2ccncc2 271570a_100000117362_100000035832 [0,1,0,0,1,0|2,0,0]=4 2211 B14R2.68 Fc1ccc(nc1)c2ccncc2 271570a_100000752145_100000744514 [0,1,0,0,1,0|2,0,0]=4 2212 B14R2.68 Fc1cnc(cn1)c2ccccc2 271570a_100011218836_100009856528 [0,1,0,0,1,0|2,0,0]=4 2213 B14R2.68 Fc1cnc(nc1)c2ccccc2 271570a_100011218836_100000685220 [0,1,0,0,1,0|2,0,0]=4 2214 B14R2.68 Fc1ncc(cn1)c2ccccc2 271570a_100010172013_100000210277 [0,1,0,0,1,0|2,0,0]=4 2215 B14R2.68 Fc1ncc(cn1)c2ccccc2 271570a_100011218836_100000685262 [0,1,0,0,1,0|2,0,0]=4 2216 B14R2.68 Ic1ccc(cc1)c2ccccc2 271570a_100000033156_100000210277 [0,1,0,0,1,0|0,0,0]=2 2217 B14R2.68 Ic1ccc(cc1)c2ccccn2 271570a_100000033156_100011216584 [0,1,0,0,1,0|1,0,0]=3 2218 B14R2.68 Ic1ccc(cc1)c2cccnc2 271570a_100000033156_100000752921 [0,1,0,0,1,0|1,0,0]=3 2219 B14R2.68 Ic1ccc(cc1)c2cccnn2 271570a_100000033156_100016991348 [0,1,0,0,1,0|2,0,0]=4 2220 B14R2.68 Ic1ccc(cc1)c2ccncc2 271570a_100000033156_100000035832 [0,1,0,0,1,0|1,0,0]=3 2221 B14R2.68 Ic1ccc(cc1)c2ccncn2 271570a_100000033156_100000703185 [0,1,0,0,1,0|2,0,0]=4 2222 B14R2.68 Ic1ccc(cc1)c2ccnnc2 271570a_100000033156_100000732662 [0,1,0,0,1,0|2,0,0]=4 2223 B14R2.68 Ic1ccc(cc1)c2cnccn2 271570a_100000033156_100000758340 [0,1,0,0,1,0|2,0,0]=4 2224 B14R2.68 Ic1ccc(cc1)c2cncnc2 271570a_100000033156_100011206942 [0,1,0,0,1,0|2,0,0]=4 2225 B14R2.68 Ic1ccc(cc1)c2ncccn2 271570a_100000033156_100000211032 [0,1,0,0,1,0|2,0,0]=4 2226 B14R2.68 Nc1ccc(cc1)c2ccccc2 271570a_100011218836_100000185761 [0,1,0,0,1,0|0,0,0]=2 2227 B14R2.68 Nc1ccc(cc1)c2ccccc2 271570a_100015188457_100000210277 [0,1,0,0,1,0|0,0,0]=2 2228 B14R2.68 Nc1ccc(cc1)c2ccccn2 271570a_100011264011_100000185761 [0,1,0,0,1,0|1,0,0]=3 2229 B14R2.68 Nc1ccc(cc1)c2ccccn2 271570a_100015188457_100011216584 [0,1,0,0,1,0|1,0,0]=3 2230 B14R2.68 Nc1ccc(cc1)c2cccnc2 271570a_100000757648_100000185761 [0,1,0,0,1,0|1,0,0]=3 2231 B14R2.68 Nc1ccc(cc1)c2cccnc2 271570a_100015188457_100000752921 [0,1,0,0,1,0|1,0,0]=3 2232 B14R2.68 Nc1ccc(cc1)c2cccnn2 271570a_100015188457_100016991348 [0,1,0,0,1,0|2,0,0]=4 2233 B14R2.68 Nc1ccc(cc1)c2ccncc2 271570a_100000752145_100000185761 [0,1,0,0,1,0|1,0,0]=3 2234 B14R2.68 Nc1ccc(cc1)c2ccncc2 271570a_100015188457_100000035832 [0,1,0,0,1,0|1,0,0]=3 2235 B14R2.68 Nc1ccc(cc1)c2ccncn2 271570a_100015188457_100000703185 [0,1,0,0,1,0|2,0,0]=4 2236 B14R2.68 Nc1ccc(cc1)c2ccnnc2 271570a_100015188457_100000732662 [0,1,0,0,1,0|2,0,0]=4 2237 B14R2.68 Nc1ccc(cc1)c2cnccn2 271570a_100011962566_100000185761 [0,1,0,0,1,0|2,0,0]=4 2238 B14R2.68 Nc1ccc(cc1)c2cnccn2 271570a_100015188457_100000758340 [0,1,0,0,1,0|2,0,0]=4 2239 B14R2.68 Nc1ccc(cc1)c2cncnc2 271570a_100000707473_100000185761 [0,1,0,0,1,0|2,0,0]=4 2240 B14R2.68 Nc1ccc(cc1)c2cncnc2 271570a_100015188457_100011206942 [0,1,0,0,1,0|2,0,0]=4 2241 B14R2.68 Nc1ccc(cc1)c2ncccn2 271570a_100015188457_100000211032 [0,1,0,0,1,0|2,0,0]=4 2242 B14R2.68 Nc1ccc(cn1)c2ccccc2 271570a_100000062249_100000210277 [0,1,0,0,1,0|1,0,0]=3 2243 B14R2.68 Nc1ccc(cn1)c2ccccc2 271570a_100011218836_100000187370 [0,1,0,0,1,0|1,0,0]=3 2244 B14R2.68 Nc1ccc(cn1)c2ccccn2 271570a_100000062249_100011216584 [0,1,0,0,1,0|2,0,0]=4 2245 B14R2.68 Nc1ccc(cn1)c2ccccn2 271570a_100011264011_100000187370 [0,1,0,0,1,0|2,0,0]=4 2246 B14R2.68 Nc1ccc(cn1)c2cccnc2 271570a_100000062249_100000752921 [0,1,0,0,1,0|2,0,0]=4 2247 B14R2.68 Nc1ccc(cn1)c2cccnc2 271570a_100000757648_100000187370 [0,1,0,0,1,0|2,0,0]=4 2248 B14R2.68 Nc1ccc(cn1)c2ccncc2 271570a_100000062249_100000035832 [0,1,0,0,1,0|2,0,0]=4 2249 B14R2.68 Nc1ccc(cn1)c2ccncc2 271570a_100000752145_100000187370 [0,1,0,0,1,0|2,0,0]=4 2250 B14R2.68 Nc1ccc(nc1)c2ccccc2 271570a_100011218836_100000744251 [0,1,0,0,1,0|1,0,0]=3 2251 B14R2.68 Nc1ccc(nc1)c2ccccn2 271570a_100011264011_100000744251 [0,1,0,0,1,0|2,0,0]=4 2252 B14R2.68 Nc1ccc(nc1)c2cccnc2 271570a_100000757648_100000744251 [0,1,0,0,1,0|2,0,0]=4 2253 B14R2.68 Nc1ccc(nc1)c2ccncc2 271570a_100000752145_100000744251 [0,1,0,0,1,0|2,0,0]=4 2254 B14R2.68 Nc1ccc(nn1)c2ccccc2 271570a_100011218836_100009816609 [0,1,0,0,1,0|2,0,0]=4 2255 B14R2.68 Nc1cnc(cn1)c2ccccc2 271570a_100011218836_100000761932 [0,1,0,0,1,0|2,0,0]=4 2256 B14R2.68 Nc1cnc(nc1)c2ccccc2 271570a_100011218836_100000068403 [0,1,0,0,1,0|2,0,0]=4 2257 B14R2.68 Nc1ncc(cn1)c2ccccc2 271570a_100000068091_100000210277 [0,1,0,0,1,0|2,0,0]=4 2258 B14R2.68 Nc1ncc(cn1)c2ccccc2 271570a_100011218836_100000760574 [0,1,0,0,1,0|2,0,0]=4 2259 B14R2.68 O=c1ccc(c[nH]1)c2ccccc2 271570a_100011218836_100000212171 [0,1,0,0,1,0|1,0,0]=3 2260 B14R2.68 O=c1ccc(c[nH]1)c2ccccn2 271570a_100011264011_100000212171 [0,1,0,0,1,0|2,0,0]=4 2261 B14R2.68 O=c1ccc(c[nH]1)c2cccnc2 271570a_100000757648_100000212171 [0,1,0,0,1,0|2,0,0]=4 2262 B14R2.68 O=c1ccc(c[nH]1)c2ccncc2 271570a_100000752145_100000212171 [0,1,0,0,1,0|2,0,0]=4 2263 B14R2.68 O=c1ccc(n[nH]1)c2ccccc2 271570a_100011218836_100009820020 [0,1,0,0,1,0|2,0,0]=4 2264 B14R2.68 O=c1ncc(c[nH]1)c2ccccc2 271570a_100000079150_100000210277 [0,1,0,0,1,0|2,0,0]=4 2265 B14R2.68 O=c1ncc(c[nH]1)c2ccccc2 271570a_100011218836_102495366499 [0,1,0,0,1,0|2,0,0]=4 2266 B14R2.68 Oc1ccc(cc1)c2ccccc2 271570a_100011218836_100000185759 [0,1,0,0,1,0|0,0,0]=2 2267 B14R2.68 Oc1ccc(cc1)c2ccccc2 271570a_100015205159_100000210277 [0,1,0,0,1,0|0,0,0]=2 2268 B14R2.68 Oc1ccc(cc1)c2ccccc2 271570a_203496583355_100000185799 [0,1,0,0,1,0|0,0,0]=2 2269 B14R2.68 Oc1ccc(cc1)c2ccccn2 271570a_100011264011_100000185759 [0,1,0,0,1,0|1,0,0]=3 2270 B14R2.68 Oc1ccc(cc1)c2ccccn2 271570a_100015205159_100011216584 [0,1,0,0,1,0|1,0,0]=3 2271 B14R2.68 Oc1ccc(cc1)c2ccccn2 271570a_203496583355_100010140346 [0,1,0,0,1,0|1,0,0]=3 2272 B14R2.68 Oc1ccc(cc1)c2cccnc2 271570a_100000757648_100000185759 [0,1,0,0,1,0|1,0,0]=3 2273 B14R2.68 Oc1ccc(cc1)c2cccnc2 271570a_100015205159_100000752921 [0,1,0,0,1,0|1,0,0]=3 2274 B14R2.68 Oc1ccc(cc1)c2cccnc2 271570a_203496583355_100010140347 [0,1,0,0,1,0|1,0,0]=3 2275 B14R2.68 Oc1ccc(cc1)c2cccnn2 271570a_100015205159_100016991348 [0,1,0,0,1,0|2,0,0]=4 2276 B14R2.68 Oc1ccc(cc1)c2ccncc2 271570a_100000752145_100000185759 [0,1,0,0,1,0|1,0,0]=3 2277 B14R2.68 Oc1ccc(cc1)c2ccncc2 271570a_100015205159_100000035832 [0,1,0,0,1,0|1,0,0]=3 2278 B14R2.68 Oc1ccc(cc1)c2ccncc2 271570a_203496583355_100009998738 [0,1,0,0,1,0|1,0,0]=3 2279 B14R2.68 Oc1ccc(cc1)c2ccncn2 271570a_100015205159_100000703185 [0,1,0,0,1,0|2,0,0]=4 2280 B14R2.68 Oc1ccc(cc1)c2ccnnc2 271570a_100015205159_100000732662 [0,1,0,0,1,0|2,0,0]=4 2281 B14R2.68 Oc1ccc(cc1)c2cnccn2 271570a_100011962566_100000185759 [0,1,0,0,1,0|2,0,0]=4 2282 B14R2.68 Oc1ccc(cc1)c2cnccn2 271570a_100015205159_100000758340 [0,1,0,0,1,0|2,0,0]=4 2283 B14R2.68 Oc1ccc(cc1)c2cncnc2 271570a_100000707473_100000185759 [0,1,0,0,1,0|2,0,0]=4 2284 B14R2.68 Oc1ccc(cc1)c2cncnc2 271570a_100015205159_100011206942 [0,1,0,0,1,0|2,0,0]=4 2285 B14R2.68 Oc1ccc(cc1)c2cncnc2 271570a_203496583355_200010687498 [0,1,0,0,1,0|2,0,0]=4 2286 B14R2.68 Oc1ccc(cc1)c2ncccn2 271570a_100015205159_100000211032 [0,1,0,0,1,0|2,0,0]=4 2287 B14R2.68 Oc1ccc(cc1)c2ncccn2 271570a_203496583355_100010187184 [0,1,0,0,1,0|2,0,0]=4 2288 B14R2.68 Oc1ccc(cn1)c2ccccc2 271570a_100000062254_100000210277 [0,1,0,0,1,0|1,0,0]=3 2289 B14R2.68 Oc1ccc(cn1)c2ccccc2 271570a_203496583355_100000073102 [0,1,0,0,1,0|1,0,0]=3 2290 B14R2.68 Oc1ccc(cn1)c2ccccn2 271570a_100000062254_100011216584 [0,1,0,0,1,0|2,0,0]=4 2291 B14R2.68 Oc1ccc(cn1)c2cccnc2 271570a_100000062254_100000752921 [0,1,0,0,1,0|2,0,0]=4 2292 B14R2.68 Oc1ccc(cn1)c2ccncc2 271570a_100000062254_100000035832 [0,1,0,0,1,0|2,0,0]=4 2293 B14R2.68 Oc1ccc(nc1)c2ccccc2 271570a_100011218836_100000685995 [0,1,0,0,1,0|1,0,0]=3 2294 B14R2.68 Oc1ccc(nc1)c2ccccc2 271570a_203496583355_100009815993 [0,1,0,0,1,0|1,0,0]=3 2295 B14R2.68 Oc1ccc(nc1)c2ccccn2 271570a_100011264011_100000685995 [0,1,0,0,1,0|2,0,0]=4 2296 B14R2.68 Oc1ccc(nc1)c2ccccn2 271570a_203496583355_100010188100 [0,1,0,0,1,0|2,0,0]=4 2297 B14R2.68 Oc1ccc(nc1)c2cccnc2 271570a_100000757648_100000685995 [0,1,0,0,1,0|2,0,0]=4 2298 B14R2.68 Oc1ccc(nc1)c2ccncc2 271570a_100000752145_100000685995 [0,1,0,0,1,0|2,0,0]=4 2299 B14R2.68 Oc1ccc(nn1)c2ccccc2 271570a_203496583355_100000740919 [0,1,0,0,1,0|2,0,0]=4 2300 B14R2.68 Oc1cnc(cn1)c2ccccc2 271570a_203496583355_100000080043 [0,1,0,0,1,0|2,0,0]=4 2301 B14R2.68 Oc1cnc(nc1)c2ccccc2 271570a_100011218836_100000730009 [0,1,0,0,1,0|2,0,0]=4 2302 B14R2.68 Oc1cnc(nc1)c2ccccc2 271570a_203496583355_100009814910 [0,1,0,0,1,0|2,0,0]=4 2303 B14R2.68 Oc1ncc(cn1)c2ccccc2 271570a_203496583355_100000059769 [0,1,0,0,1,0|2,0,0]=4 2304 B14R2.68 [O-][n+]1ccc(cc1)c2ccccc2 271570a_100011218836_100000039755 [0,1,0,0,1,0|1,0,0]=3 2305 B14R2.68 [O-][n+]1ccc(cc1)c2ccccn2 271570a_100011264011_100000039755 [0,1,0,0,1,0|2,0,0]=4 2306 B14R2.68 [O-][n+]1ccc(cc1)c2cccnc2 271570a_100000757648_100000039755 [0,1,0,0,1,0|2,0,0]=4 2307 B14R2.68 [O-][n+]1ccc(cc1)c2ccncc2 271570a_100000752145_100000039755 [0,1,0,0,1,0|2,0,0]=4 2308 B14R2.19 Brc1ccc(s1)Sc2ccccc2 62a_100000719477_100010197418 [0,1,0,0,1,0|1,1,0]=4 2309 B14R2.19 Brc1ccc(s1)Sc2ccccc2 62a_100010197418_100000041952 [0,1,0,0,1,0|1,1,0]=4 2310 B14R2.19 Cc1cc(cs1)Sc2ccccc2 62a_100000719477_100000759034 [0,1,0,0,1,0|1,1,0]=4 2311 B14R2.19 Cc1cc(cs1)Sc2ccccc2 62a_100000759034_100000041952 [0,1,0,0,1,0|1,1,0]=4 2312 B14R2.19 Cc1ccc(s1)Sc2ccccc2 62a_100000031368_100000041952 [0,1,0,0,1,0|1,1,0]=4 2313 B14R2.19 Cc1ccc(s1)Sc2ccccc2 62a_100000719477_100000031368 [0,1,0,0,1,0|1,1,0]=4 2314 B14R2.19 Cc1csc(c1)Sc2ccccc2 62a_100000719477_100009876951 [0,1,0,0,1,0|1,1,0]=4 2315 B14R2.19 Cc1csc(c1)Sc2ccccc2 62a_100009876951_100000041952 [0,1,0,0,1,0|1,1,0]=4 2316 B14R2.19 Oc1csc(n1)Oc2ccccc2 271570a_203496583355_200012359905 [0,1,0,0,1,0|2,0,0]=4 2317 B14R2.30 Brc1ccsc1Sc2ccccc2 62a_100000719477_100012361411 [0,1,0,0,1,0|1,1,0]=4 2318 B14R2.30 Brc1ccsc1Sc2ccccc2 62a_100012361411_100000041952 [0,1,0,0,1,0|1,1,0]=4 2319 B14R2.30 Brc1cscc1Sc2ccccc2 62a_100000719477_100010143727 [0,1,0,0,1,0|1,1,0]=4 2320 B14R2.30 Brc1cscc1Sc2ccccc2 62a_100010143727_100000041952 [0,1,0,0,1,0|1,1,0]=4 2321 B14R2.30 Cc1ccsc1Sc2ccccc2 62a_100000719477_100010247149 [0,1,0,0,1,0|1,1,0]=4 2322 B14R2.30 Cc1ccsc1Sc2ccccc2 62a_100010247149_100000041952 [0,1,0,0,1,0|1,1,0]=4 2323 B14R2.30 Cc1cscc1Sc2ccccc2 62a_100000719477_100000759966 [0,1,0,0,1,0|1,1,0]=4 2324 B14R2.30 Cc1cscc1Sc2ccccc2 62a_100000759966_100000041952 [0,1,0,0,1,0|1,1,0]=4 2325 B14R2.30 Cc1sccc1Sc2ccccc2 62a_100000684487_100000041952 [0,1,0,0,1,0|1,1,0]=4 2326 B14R2.30 Cc1sccc1Sc2ccccc2 62a_100000719477_100000684487 [0,1,0,0,1,0|1,1,0]=4 2327 B14R2.50 Brc1ccccc1Sc2ccco2 62a_100000695589_100009814098 [0,1,0,0,1,0|1,1,0]=4 2328 B14R2.50 Brc1ccccc1Sc2ccco2 62a_100009814098_100000695589 [0,1,0,0,1,0|1,1,0]=4 2329 B14R2.50 Brc1ccccc1Sc2cccs2 62a_100000695589_100011215356 [0,1,0,0,1,0|1,1,0]=4 2330 B14R2.50 Brc1ccccc1Sc2cccs2 62a_100011215356_100000695589 [0,1,0,0,1,0|1,1,0]=4 2331 B14R2.50 Brc1ccccc1Sc2ccoc2 62a_100000695589_100011215275 [0,1,0,0,1,0|1,1,0]=4 2332 B14R2.50 Brc1ccccc1Sc2ccoc2 62a_100011215275_100000695589 [0,1,0,0,1,0|1,1,0]=4 2333 B14R2.50 Brc1ccccc1Sc2ccsc2 62a_100000695589_100000738268 [0,1,0,0,1,0|1,1,0]=4 2334 B14R2.50 Brc1ccccc1Sc2ccsc2 62a_100000738268_100000695589 [0,1,0,0,1,0|1,1,0]=4 2335 B14R2.50 Cc1ccccc1Sc2ccco2 62a_100000210755_100009814098 [0,1,0,0,1,0|1,1,0]=4 2336 B14R2.50 Cc1ccccc1Sc2ccco2 62a_100009814098_100000210755 [0,1,0,0,1,0|1,1,0]=4 2337 B14R2.50 Cc1ccccc1Sc2cccs2 62a_100000210755_100011215356 [0,1,0,0,1,0|1,1,0]=4 2338 B14R2.50 Cc1ccccc1Sc2cccs2 62a_100011215356_100000210755 [0,1,0,0,1,0|1,1,0]=4 2339 B14R2.50 Cc1ccccc1Sc2ccoc2 62a_100000210755_100011215275 [0,1,0,0,1,0|1,1,0]=4 2340 B14R2.50 Cc1ccccc1Sc2ccoc2 62a_100011215275_100000210755 [0,1,0,0,1,0|1,1,0]=4 2341 B14R2.50 Cc1ccccc1Sc2ccsc2 62a_100000210755_100000738268 [0,1,0,0,1,0|1,1,0]=4 2342 B14R2.50 Cc1ccccc1Sc2ccsc2 62a_100000738268_100000210755 [0,1,0,0,1,0|1,1,0]=4 2343 B14R2.50 Clc1ccccc1Sc2ccco2 62a_100000764095_100009814098 [0,1,0,0,1,0|1,1,0]=4 2344 B14R2.50 Clc1ccccc1Sc2ccco2 62a_100009814098_100000764095 [0,1,0,0,1,0|1,1,0]=4 2345 B14R2.50 Clc1ccccc1Sc2cccs2 62a_100000764095_100011215356 [0,1,0,0,1,0|1,1,0]=4 2346 B14R2.50 Clc1ccccc1Sc2cccs2 62a_100011215356_100000764095 [0,1,0,0,1,0|1,1,0]=4 2347 B14R2.50 Clc1ccccc1Sc2ccoc2 62a_100000764095_100011215275 [0,1,0,0,1,0|1,1,0]=4 2348 B14R2.50 Clc1ccccc1Sc2ccoc2 62a_100011215275_100000764095 [0,1,0,0,1,0|1,1,0]=4 2349 B14R2.50 Clc1ccccc1Sc2ccsc2 62a_100000738268_100000764095 [0,1,0,0,1,0|1,1,0]=4 2350 B14R2.50 Clc1ccccc1Sc2ccsc2 62a_100000764095_100000738268 [0,1,0,0,1,0|1,1,0]=4 2351 B14R2.50 Fc1ccccc1Sc2ccco2 62a_100009814098_100011215700 [0,1,0,0,1,0|1,1,0]=4 2352 B14R2.50 Fc1ccccc1Sc2ccco2 62a_100011215700_100009814098 [0,1,0,0,1,0|1,1,0]=4 2353 B14R2.50 Fc1ccccc1Sc2cccs2 62a_100011215356_100011215700 [0,1,0,0,1,0|1,1,0]=4 2354 B14R2.50 Fc1ccccc1Sc2cccs2 62a_100011215700_100011215356 [0,1,0,0,1,0|1,1,0]=4 2355 B14R2.50 Fc1ccccc1Sc2ccoc2 62a_100011215275_100011215700 [0,1,0,0,1,0|1,1,0]=4 2356 B14R2.50 Fc1ccccc1Sc2ccoc2 62a_100011215700_100011215275 [0,1,0,0,1,0|1,1,0]=4 2357 B14R2.50 Fc1ccccc1Sc2ccsc2 62a_100000738268_100011215700 [0,1,0,0,1,0|1,1,0]=4 2358 B14R2.50 Fc1ccccc1Sc2ccsc2 62a_100011215700_100000738268 [0,1,0,0,1,0|1,1,0]=4 2359 B14R2.50 Nc1ccccc1Sc2ccco2 62a_100000210017_100009814098 [0,1,0,0,1,0|1,1,0]=4 2360 B14R2.50 Nc1ccccc1Sc2ccco2 62a_100009814098_100000210017 [0,1,0,0,1,0|1,1,0]=4 2361 B14R2.50 Nc1ccccc1Sc2cccs2 62a_100000210017_100011215356 [0,1,0,0,1,0|1,1,0]=4 2362 B14R2.50 Nc1ccccc1Sc2cccs2 62a_100011215356_100000210017 [0,1,0,0,1,0|1,1,0]=4 2363 B14R2.50 Nc1ccccc1Sc2ccoc2 62a_100000210017_100011215275 [0,1,0,0,1,0|1,1,0]=4 2364 B14R2.50 Nc1ccccc1Sc2ccoc2 62a_100011215275_100000210017 [0,1,0,0,1,0|1,1,0]=4 2365 B14R2.50 Nc1ccccc1Sc2ccsc2 62a_100000210017_100000738268 [0,1,0,0,1,0|1,1,0]=4 2366 B14R2.50 Nc1ccccc1Sc2ccsc2 62a_100000738268_100000210017 [0,1,0,0,1,0|1,1,0]=4 2367 B14R2.50 Oc1ccccc1Sc2ccco2 62a_100000739446_100009814098 [0,1,0,0,1,0|1,1,0]=4 2368 B14R2.50 Oc1ccccc1Sc2ccco2 62a_100009814098_100000739446 [0,1,0,0,1,0|1,1,0]=4 2369 B14R2.50 Oc1ccccc1Sc2cccs2 62a_100000739446_100011215356 [0,1,0,0,1,0|1,1,0]=4 2370 B14R2.50 Oc1ccccc1Sc2cccs2 62a_100011215356_100000739446 [0,1,0,0,1,0|1,1,0]=4 2371 B14R2.50 Oc1ccccc1Sc2ccoc2 62a_100000739446_100011215275 [0,1,0,0,1,0|1,1,0]=4 2372 B14R2.50 Oc1ccccc1Sc2ccoc2 62a_100011215275_100000739446 [0,1,0,0,1,0|1,1,0]=4 2373 B14R2.50 Oc1ccccc1Sc2ccsc2 62a_100000738268_100000739446 [0,1,0,0,1,0|1,1,0]=4 2374 B14R2.50 Oc1ccccc1Sc2ccsc2 62a_100000739446_100000738268 [0,1,0,0,1,0|1,1,0]=4 2375 B14R2.72 Brc1ccc(cc1)Sc2ccco2 62a_100000752885_100009814098 [0,1,0,0,1,0|1,1,0]=4 2376 B14R2.72 Brc1ccc(cc1)Sc2ccco2 62a_100009814098_100000752885 [0,1,0,0,1,0|1,1,0]=4 2377 B14R2.72 Brc1ccc(cc1)Sc2cccs2 62a_100000752885_100011215356 [0,1,0,0,1,0|1,1,0]=4 2378 B14R2.72 Brc1ccc(cc1)Sc2cccs2 62a_100011215356_100000752885 [0,1,0,0,1,0|1,1,0]=4 2379 B14R2.72 Brc1ccc(cc1)Sc2ccoc2 62a_100000752885_100011215275 [0,1,0,0,1,0|1,1,0]=4 2380 B14R2.72 Brc1ccc(cc1)Sc2ccoc2 62a_100011215275_100000752885 [0,1,0,0,1,0|1,1,0]=4 2381 B14R2.72 Brc1ccc(cc1)Sc2ccsc2 62a_100000738268_100000752885 [0,1,0,0,1,0|1,1,0]=4 2382 B14R2.72 Brc1ccc(cc1)Sc2ccsc2 62a_100000752885_100000738268 [0,1,0,0,1,0|1,1,0]=4 2383 B14R2.72 Cc1ccc(cc1)Sc2ccco2 62a_100000186775_100009814098 [0,1,0,0,1,0|1,1,0]=4 2384 B14R2.72 Cc1ccc(cc1)Sc2ccco2 62a_100009814098_100000186775 [0,1,0,0,1,0|1,1,0]=4 2385 B14R2.72 Cc1ccc(cc1)Sc2cccs2 62a_100000186775_100011215356 [0,1,0,0,1,0|1,1,0]=4 2386 B14R2.72 Cc1ccc(cc1)Sc2cccs2 62a_100011215356_100000186775 [0,1,0,0,1,0|1,1,0]=4 2387 B14R2.72 Cc1ccc(cc1)Sc2ccoc2 62a_100000186775_100011215275 [0,1,0,0,1,0|1,1,0]=4 2388 B14R2.72 Cc1ccc(cc1)Sc2ccoc2 62a_100011215275_100000186775 [0,1,0,0,1,0|1,1,0]=4 2389 B14R2.72 Cc1ccc(cc1)Sc2ccsc2 62a_100000186775_100000738268 [0,1,0,0,1,0|1,1,0]=4 2390 B14R2.72 Cc1ccc(cc1)Sc2ccsc2 62a_100000738268_100000186775 [0,1,0,0,1,0|1,1,0]=4 2391 B14R2.72 Clc1ccc(cc1)Sc2ccco2 62a_100000755918_100009814098 [0,1,0,0,1,0|1,1,0]=4 2392 B14R2.72 Clc1ccc(cc1)Sc2ccco2 62a_100009814098_100000755918 [0,1,0,0,1,0|1,1,0]=4 2393 B14R2.72 Clc1ccc(cc1)Sc2cccs2 62a_100000755918_100011215356 [0,1,0,0,1,0|1,1,0]=4 2394 B14R2.72 Clc1ccc(cc1)Sc2cccs2 62a_100011215356_100000755918 [0,1,0,0,1,0|1,1,0]=4 2395 B14R2.72 Clc1ccc(cc1)Sc2ccoc2 62a_100000755918_100011215275 [0,1,0,0,1,0|1,1,0]=4 2396 B14R2.72 Clc1ccc(cc1)Sc2ccoc2 62a_100011215275_100000755918 [0,1,0,0,1,0|1,1,0]=4 2397 B14R2.72 Clc1ccc(cc1)Sc2ccsc2 62a_100000738268_100000755918 [0,1,0,0,1,0|1,1,0]=4 2398 B14R2.72 Clc1ccc(cc1)Sc2ccsc2 62a_100000755918_100000738268 [0,1,0,0,1,0|1,1,0]=4 2399 B14R2.72 Fc1ccc(cc1)Sc2ccco2 62a_100000211213_100009814098 [0,1,0,0,1,0|1,1,0]=4 2400 B14R2.72 Fc1ccc(cc1)Sc2ccco2 62a_100009814098_100000211213 [0,1,0,0,1,0|1,1,0]=4 2401 B14R2.72 Fc1ccc(cc1)Sc2cccs2 62a_100000211213_100011215356 [0,1,0,0,1,0|1,1,0]=4 2402 B14R2.72 Fc1ccc(cc1)Sc2cccs2 62a_100011215356_100000211213 [0,1,0,0,1,0|1,1,0]=4 2403 B14R2.72 Fc1ccc(cc1)Sc2ccoc2 62a_100000211213_100011215275 [0,1,0,0,1,0|1,1,0]=4 2404 B14R2.72 Fc1ccc(cc1)Sc2ccoc2 62a_100011215275_100000211213 [0,1,0,0,1,0|1,1,0]=4 2405 B14R2.72 Fc1ccc(cc1)Sc2ccsc2 62a_100000211213_100000738268 [0,1,0,0,1,0|1,1,0]=4 2406 B14R2.72 Fc1ccc(cc1)Sc2ccsc2 62a_100000738268_100000211213 [0,1,0,0,1,0|1,1,0]=4 2407 B14R2.72 Nc1ccc(cc1)Sc2ccco2 62a_100000185761_100009814098 [0,1,0,0,1,0|1,1,0]=4 2408 B14R2.72 Nc1ccc(cc1)Sc2ccco2 62a_100009814098_100000185761 [0,1,0,0,1,0|1,1,0]=4 2409 B14R2.72 Nc1ccc(cc1)Sc2cccs2 62a_100000185761_100011215356 [0,1,0,0,1,0|1,1,0]=4 2410 B14R2.72 Nc1ccc(cc1)Sc2cccs2 62a_100011215356_100000185761 [0,1,0,0,1,0|1,1,0]=4 2411 B14R2.72 Nc1ccc(cc1)Sc2ccoc2 62a_100000185761_100011215275 [0,1,0,0,1,0|1,1,0]=4 2412 B14R2.72 Nc1ccc(cc1)Sc2ccoc2 62a_100011215275_100000185761 [0,1,0,0,1,0|1,1,0]=4 2413 B14R2.72 Nc1ccc(cc1)Sc2ccsc2 62a_100000185761_100000738268 [0,1,0,0,1,0|1,1,0]=4 2414 B14R2.72 Nc1ccc(cc1)Sc2ccsc2 62a_100000738268_100000185761 [0,1,0,0,1,0|1,1,0]=4 2415 B14R2.72 Oc1ccc(cc1)Sc2ccco2 62a_100009814098_100000185759 [0,1,0,0,1,0|1,1,0]=4 2416 B14R2.72 Oc1ccc(cc1)Sc2cccs2 62a_100011215356_100000185759 [0,1,0,0,1,0|1,1,0]=4 2417 B14R2.72 Oc1ccc(cc1)Sc2ccoc2 62a_100011215275_100000185759 [0,1,0,0,1,0|1,1,0]=4 2418 B14R2.72 Oc1ccc(cc1)Sc2ccsc2 62a_100000738268_100000185759 [0,1,0,0,1,0|1,1,0]=4 2419 B14R2.114 C=C(c1ccccc1)c2ccco2 271570a_100000068269_100009814098 [0,1,0,0,1,0|2,0,0]=4 2420 B14R2.114 C=C(c1ccccc1)c2cccs2 271570a_100000068269_100011215356 [0,1,0,0,1,0|2,0,0]=4 2421 B14R2.114 C=C(c1ccccc1)c2ccoc2 271570a_100000068269_100011215275 [0,1,0,0,1,0|2,0,0]=4 2422 B14R2.114 C=C(c1ccccc1)c2ccsc2 271570a_100000068269_100000738268 [0,1,0,0,1,0|2,0,0]=4 2423 B14R2.716 Brc1cccc(c1)Sc2ccco2 62a_100000691529_100009814098 [0,1,0,0,1,0|1,1,0]=4 2424 B14R2.716 Brc1cccc(c1)Sc2ccco2 62a_100009814098_100000691529 [0,1,0,0,1,0|1,1,0]=4 2425 B14R2.716 Brc1cccc(c1)Sc2cccs2 62a_100000691529_100011215356 [0,1,0,0,1,0|1,1,0]=4 2426 B14R2.716 Brc1cccc(c1)Sc2cccs2 62a_100011215356_100000691529 [0,1,0,0,1,0|1,1,0]=4 2427 B14R2.716 Brc1cccc(c1)Sc2ccoc2 62a_100000691529_100011215275 [0,1,0,0,1,0|1,1,0]=4 2428 B14R2.716 Brc1cccc(c1)Sc2ccoc2 62a_100011215275_100000691529 [0,1,0,0,1,0|1,1,0]=4 2429 B14R2.716 Brc1cccc(c1)Sc2ccsc2 62a_100000691529_100000738268 [0,1,0,0,1,0|1,1,0]=4 2430 B14R2.716 Brc1cccc(c1)Sc2ccsc2 62a_100000738268_100000691529 [0,1,0,0,1,0|1,1,0]=4 2431 B14R2.716 Cc1cccc(c1)Sc2ccco2 62a_100009814098_100011215228 [0,1,0,0,1,0|1,1,0]=4 2432 B14R2.716 Cc1cccc(c1)Sc2ccco2 62a_100011215228_100009814098 [0,1,0,0,1,0|1,1,0]=4 2433 B14R2.716 Cc1cccc(c1)Sc2cccs2 62a_100011215228_100011215356 [0,1,0,0,1,0|1,1,0]=4 2434 B14R2.716 Cc1cccc(c1)Sc2cccs2 62a_100011215356_100011215228 [0,1,0,0,1,0|1,1,0]=4 2435 B14R2.716 Cc1cccc(c1)Sc2ccoc2 62a_100011215228_100011215275 [0,1,0,0,1,0|1,1,0]=4 2436 B14R2.716 Cc1cccc(c1)Sc2ccoc2 62a_100011215275_100011215228 [0,1,0,0,1,0|1,1,0]=4 2437 B14R2.716 Cc1cccc(c1)Sc2ccsc2 62a_100000738268_100011215228 [0,1,0,0,1,0|1,1,0]=4 2438 B14R2.716 Cc1cccc(c1)Sc2ccsc2 62a_100011215228_100000738268 [0,1,0,0,1,0|1,1,0]=4 2439 B14R2.716 Clc1cccc(c1)Sc2ccco2 62a_100000699651_100009814098 [0,1,0,0,1,0|1,1,0]=4 2440 B14R2.716 Clc1cccc(c1)Sc2ccco2 62a_100009814098_100000699651 [0,1,0,0,1,0|1,1,0]=4 2441 B14R2.716 Clc1cccc(c1)Sc2cccs2 62a_100000699651_100011215356 [0,1,0,0,1,0|1,1,0]=4 2442 B14R2.716 Clc1cccc(c1)Sc2cccs2 62a_100011215356_100000699651 [0,1,0,0,1,0|1,1,0]=4 2443 B14R2.716 Clc1cccc(c1)Sc2ccoc2 62a_100000699651_100011215275 [0,1,0,0,1,0|1,1,0]=4 2444 B14R2.716 Clc1cccc(c1)Sc2ccoc2 62a_100011215275_100000699651 [0,1,0,0,1,0|1,1,0]=4 2445 B14R2.716 Clc1cccc(c1)Sc2ccsc2 62a_100000699651_100000738268 [0,1,0,0,1,0|1,1,0]=4 2446 B14R2.716 Clc1cccc(c1)Sc2ccsc2 62a_100000738268_100000699651 [0,1,0,0,1,0|1,1,0]=4 2447 B14R2.716 Fc1cccc(c1)Sc2ccco2 62a_100000685547_100009814098 [0,1,0,0,1,0|1,1,0]=4 2448 B14R2.716 Fc1cccc(c1)Sc2ccco2 62a_100009814098_100000685547 [0,1,0,0,1,0|1,1,0]=4 2449 B14R2.716 Fc1cccc(c1)Sc2cccs2 62a_100000685547_100011215356 [0,1,0,0,1,0|1,1,0]=4 2450 B14R2.716 Fc1cccc(c1)Sc2cccs2 62a_100011215356_100000685547 [0,1,0,0,1,0|1,1,0]=4 2451 B14R2.716 Fc1cccc(c1)Sc2ccoc2 62a_100000685547_100011215275 [0,1,0,0,1,0|1,1,0]=4 2452 B14R2.716 Fc1cccc(c1)Sc2ccoc2 62a_100011215275_100000685547 [0,1,0,0,1,0|1,1,0]=4 2453 B14R2.716 Fc1cccc(c1)Sc2ccsc2 62a_100000685547_100000738268 [0,1,0,0,1,0|1,1,0]=4 2454 B14R2.716 Fc1cccc(c1)Sc2ccsc2 62a_100000738268_100000685547 [0,1,0,0,1,0|1,1,0]=4 2455 B14R2.716 Nc1cccc(c1)Sc2ccco2 62a_100000210019_100009814098 [0,1,0,0,1,0|1,1,0]=4 2456 B14R2.716 Nc1cccc(c1)Sc2ccco2 62a_100009814098_100000210019 [0,1,0,0,1,0|1,1,0]=4 2457 B14R2.716 Nc1cccc(c1)Sc2cccs2 62a_100000210019_100011215356 [0,1,0,0,1,0|1,1,0]=4 2458 B14R2.716 Nc1cccc(c1)Sc2cccs2 62a_100011215356_100000210019 [0,1,0,0,1,0|1,1,0]=4 2459 B14R2.716 Nc1cccc(c1)Sc2ccoc2 62a_100000210019_100011215275 [0,1,0,0,1,0|1,1,0]=4 2460 B14R2.716 Nc1cccc(c1)Sc2ccoc2 62a_100011215275_100000210019 [0,1,0,0,1,0|1,1,0]=4 2461 B14R2.716 Nc1cccc(c1)Sc2ccsc2 62a_100000210019_100000738268 [0,1,0,0,1,0|1,1,0]=4 2462 B14R2.716 Nc1cccc(c1)Sc2ccsc2 62a_100000738268_100000210019 [0,1,0,0,1,0|1,1,0]=4 2463 B14R2.716 Oc1cccc(c1)Sc2ccco2 62a_100009814098_100000211634 [0,1,0,0,1,0|1,1,0]=4 2464 B14R2.716 Oc1cccc(c1)Sc2cccs2 62a_100011215356_100000211634 [0,1,0,0,1,0|1,1,0]=4 2465 B14R2.716 Oc1cccc(c1)Sc2ccoc2 62a_100011215275_100000211634 [0,1,0,0,1,0|1,1,0]=4 2466 B14R2.716 Oc1cccc(c1)Sc2ccsc2 62a_100000738268_100000211634 [0,1,0,0,1,0|1,1,0]=4 2467 B14R2.716 [S]c1cccc(c1)Sc2ccco2 62a_100009814098_114929384022 [0,1,0,0,1,0|1,1,0]=4 2468 B14R2.716 [S]c1cccc(c1)Sc2ccco2 62a_114929384022_100009814098 [0,1,0,0,1,0|1,1,0]=4 2469 B14R2.716 [S]c1cccc(c1)Sc2cccs2 62a_100011215356_114929384022 [0,1,0,0,1,0|1,1,0]=4 2470 B14R2.716 [S]c1cccc(c1)Sc2cccs2 62a_114929384022_100011215356 [0,1,0,0,1,0|1,1,0]=4 2471 B14R2.716 [S]c1cccc(c1)Sc2ccoc2 62a_100011215275_114929384022 [0,1,0,0,1,0|1,1,0]=4 2472 B14R2.716 [S]c1cccc(c1)Sc2ccoc2 62a_114929384022_100011215275 [0,1,0,0,1,0|1,1,0]=4 2473 B14R2.716 [S]c1cccc(c1)Sc2ccsc2 62a_100000738268_114929384022 [0,1,0,0,1,0|1,1,0]=4 2474 B14R2.716 [S]c1cccc(c1)Sc2ccsc2 62a_114929384022_100000738268 [0,1,0,0,1,0|1,1,0]=4 2475 B16R2.71 Brc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000695589 [0,1,0,0,0,1|1,0,0]=3 2476 B16R2.71 Brc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000695589 [0,1,0,0,0,1|1,0,0]=3 2477 B16R2.71 Brc1ccccc1C=Cc2cccnc2 271570a_100102525586_100000695589 [0,1,0,0,0,1|2,0,0]=4 2478 B16R2.71 Brc1ccccc1CNc2ccccc2 207a_100000106764_100000211189 [0,1,0,0,0,1|1,0,0]=3 2479 B16R2.71 Brc1ccccc1CNc2ccccc2 270302a_100000106764_100000211189 [0,1,0,0,0,1|1,0,0]=3 2480 B16R2.71 Brc1ccccc1CNc2ccccc2 34a_100000106764_100000184730 [0,1,0,0,0,1|1,0,0]=3 2481 B16R2.71 Brc1ccccc1COc2ccccc2 34a_100000210340_100000184730 [0,1,0,0,0,1|0,0,0]=2 2482 B16R2.71 Brc1ccccc1COc2ccccc2 7a_100000210340_100000184730 [0,1,0,0,0,1|0,0,0]=2 2483 B16R2.71 Brc1ccccc1COc2cccnc2 34a_100000210849_100000184730 [0,1,0,0,0,1|1,0,0]=3 2484 B16R2.71 Brc1ccccc1COc2cccnc2 7a_100000210849_100000184730 [0,1,0,0,0,1|1,0,0]=3 2485 B16R2.71 Brc1ccccc1COc2ccncc2 34a_100000212176_100000184730 [0,1,0,0,0,1|1,0,0]=3 2486 B16R2.71 Brc1ccccc1COc2ccnnc2 34a_100015204005_100000184730 [0,1,0,0,0,1|2,0,0]=4 2487 B16R2.71 Brc1ccccc1COc2cncnc2 7a_100000754086_100000184730 [0,1,0,0,0,1|2,0,0]=4 2488 B16R2.71 Brc1ccccc1CSc2ccccc2 62a_100000184730_100000041952 [0,1,0,0,0,1|0,1,0]=3 2489 B16R2.71 Brc1ccccc1CSc2ccccc2 62a_100000719477_100000184730 [0,1,0,0,0,1|0,1,0]=3 2490 B16R2.71 Brc1ccccc1CSc2ccccn2 62a_100000184730_100011216584 [0,1,0,0,0,1|1,1,0]=4 2491 B16R2.71 Brc1ccccc1CSc2ccccn2 62a_100011216584_100000184730 [0,1,0,0,0,1|1,1,0]=4 2492 B16R2.71 Brc1ccccc1CSc2cccnc2 62a_100000184730_100000210063 [0,1,0,0,0,1|1,1,0]=4 2493 B16R2.71 Brc1ccccc1CSc2cccnc2 62a_100000210063_100000184730 [0,1,0,0,0,1|1,1,0]=4 2494 B16R2.71 Brc1ccccc1CSc2ccncc2 62a_100000184730_100000728582 [0,1,0,0,0,1|1,1,0]=4 2495 B16R2.71 Brc1ccccc1CSc2ccncc2 62a_100000728582_100000184730 [0,1,0,0,0,1|1,1,0]=4 2496 B16R2.71 Brc1ccccc1NCc2ccccc2 207a_100000210017_100015611070 [0,1,0,0,0,1|1,0,0]=3 2497 B16R2.71 Brc1ccccc1NCc2ccccc2 34a_100000210017_100015291786 [0,1,0,0,0,1|1,0,0]=3 2498 B16R2.71 Brc1ccccc1NCc2ccccn2 207a_100000210017_100000209966 [0,1,0,0,0,1|2,0,0]=4 2499 B16R2.71 Brc1ccccc1NCc2ccccn2 34a_100000210017_100000721315 [0,1,0,0,0,1|2,0,0]=4 2500 B16R2.71 Brc1ccccc1NCc2cccnc2 207a_100000210017_100000209961 [0,1,0,0,0,1|2,0,0]=4 2501 B16R2.71 Brc1ccccc1NCc2cccnc2 34a_100000210017_100000733263 [0,1,0,0,0,1|2,0,0]=4 2502 B16R2.71 Brc1ccccc1NCc2ccncc2 207a_100000210017_100000186114 [0,1,0,0,0,1|2,0,0]=4 2503 B16R2.71 Brc1ccccc1OCc2ccccc2 34a_100000181306_100015291786 [0,1,0,0,0,1|0,0,0]=2 2504 B16R2.71 Brc1ccccc1OCc2ccccc2 7a_100000181306_100000211182 [0,1,0,0,0,1|0,0,0]=2 2505 B16R2.71 Brc1ccccc1OCc2ccccn2 34a_100000181306_100000721315 [0,1,0,0,0,1|1,0,0]=3 2506 B16R2.71 Brc1ccccc1OCc2ccccn2 7a_100000181306_100000721315 [0,1,0,0,0,1|1,0,0]=3 2507 B16R2.71 Brc1ccccc1OCc2cccnc2 34a_100000181306_100000733263 [0,1,0,0,0,1|1,0,0]=3 2508 B16R2.71 Brc1ccccc1OCc2cccnc2 7a_100000181306_100000741622 [0,1,0,0,0,1|1,0,0]=3 2509 B16R2.71 Brc1ccccc1OCc2cccnn2 34a_100000181306_100016990269 [0,1,0,0,0,1|2,0,0]=4 2510 B16R2.71 Brc1ccccc1OCc2cccnn2 7a_100000181306_100016990269 [0,1,0,0,0,1|2,0,0]=4 2511 B16R2.71 Brc1ccccc1OCc2ccncc2 7a_100000181306_100015193705 [0,1,0,0,0,1|1,0,0]=3 2512 B16R2.71 Brc1ccccc1OCc2cnccn2 34a_100000181306_100016995436 [0,1,0,0,0,1|2,0,0]=4 2513 B16R2.71 Brc1ccccc1OCc2cnccn2 7a_100000181306_100016995436 [0,1,0,0,0,1|2,0,0]=4 2514 B16R2.71 Brc1ccccc1OCc2cncnc2 34a_100000181306_100015196519 [0,1,0,0,0,1|2,0,0]=4 2515 B16R2.71 Brc1ccccc1OCc2cncnc2 7a_100000181306_100015196519 [0,1,0,0,0,1|2,0,0]=4 2516 B16R2.71 Brc1ccccc1OCc2ncccn2 34a_100000181306_100000703007 [0,1,0,0,0,1|2,0,0]=4 2517 B16R2.71 Brc1ccccc1OCc2ncccn2 7a_100000181306_100000703007 [0,1,0,0,0,1|2,0,0]=4 2518 B16R2.71 Brc1ccccc1SCc2ccccc2 62a_100000211182_100000695589 [0,1,0,0,0,1|0,1,0]=3 2519 B16R2.71 Brc1ccccc1SCc2ccccc2 62a_100000695589_100015291786 [0,1,0,0,0,1|0,1,0]=3 2520 B16R2.71 Brc1ccccc1SCc2ccccn2 62a_100000695589_100000721315 [0,1,0,0,0,1|1,1,0]=4 2521 B16R2.71 Brc1ccccc1SCc2ccccn2 62a_100000721315_100000695589 [0,1,0,0,0,1|1,1,0]=4 2522 B16R2.71 Brc1ccccc1SCc2cccnc2 62a_100000695589_100000741622 [0,1,0,0,0,1|1,1,0]=4 2523 B16R2.71 Brc1ccccc1SCc2cccnc2 62a_100000741622_100000695589 [0,1,0,0,0,1|1,1,0]=4 2524 B16R2.71 Brc1ccccc1SCc2ccncc2 62a_100000695589_100015193705 [0,1,0,0,0,1|1,1,0]=4 2525 B16R2.71 Brc1ccccc1SCc2ccncc2 62a_100015193705_100000695589 [0,1,0,0,0,1|1,1,0]=4 2526 B16R2.71 Brc1cccnc1C#Cc2ccccc2 271570a_100000069678_100000696092 [0,1,0,0,0,1|2,0,0]=4 2527 B16R2.71 Brc1cccnc1C=Cc2ccccc2 271570a_100102527694_100000696092 [0,1,0,0,0,1|2,0,0]=4 2528 B16R2.71 Brc1cccnc1CNc2ccccc2 207a_100000106764_100011934733 [0,1,0,0,0,1|2,0,0]=4 2529 B16R2.71 Brc1cccnc1CNc2ccccc2 34a_100000106764_100025702911 [0,1,0,0,0,1|2,0,0]=4 2530 B16R2.71 Brc1cccnc1COc2ccccc2 34a_100000210340_100025702911 [0,1,0,0,0,1|1,0,0]=3 2531 B16R2.71 Brc1cccnc1COc2ccccc2 7a_100000210340_100025702911 [0,1,0,0,0,1|1,0,0]=3 2532 B16R2.71 Brc1cccnc1COc2cccnc2 34a_100000210849_100025702911 [0,1,0,0,0,1|2,0,0]=4 2533 B16R2.71 Brc1cccnc1COc2cccnc2 7a_100000210849_100025702911 [0,1,0,0,0,1|2,0,0]=4 2534 B16R2.71 Brc1cccnc1COc2ccncc2 34a_100000212176_100025702911 [0,1,0,0,0,1|2,0,0]=4 2535 B16R2.71 Brc1cccnc1CSc2ccccc2 62a_100000719477_100025702911 [0,1,0,0,0,1|1,1,0]=4 2536 B16R2.71 Brc1cccnc1CSc2ccccc2 62a_100025702911_100000041952 [0,1,0,0,0,1|1,1,0]=4 2537 B16R2.71 Brc1cccnc1NCc2ccccc2 27a_100015324214_100000696092 [0,1,0,0,0,1|2,0,0]=4 2538 B16R2.71 Brc1cccnc1SCc2ccccc2 62a_100000211182_100000696092 [0,1,0,0,0,1|1,1,0]=4 2539 B16R2.71 Brc1cccnc1SCc2ccccc2 62a_100000696092_100015291786 [0,1,0,0,0,1|1,1,0]=4 2540 B16R2.71 Brc1ccncc1C#Cc2ccccc2 271570a_100000069678_100010138639 [0,1,0,0,0,1|2,0,0]=4 2541 B16R2.71 Brc1ccncc1C=Cc2ccccc2 271570a_100102527694_100010138639 [0,1,0,0,0,1|2,0,0]=4 2542 B16R2.71 Brc1ccncc1SCc2ccccc2 62a_100000211182_100010138639 [0,1,0,0,0,1|1,1,0]=4 2543 B16R2.71 Brc1ccncc1SCc2ccccc2 62a_100010138639_100015291786 [0,1,0,0,0,1|1,1,0]=4 2544 B16R2.71 Brc1cnccc1C#Cc2ccccc2 271570a_100000069678_100000726257 [0,1,0,0,0,1|2,0,0]=4 2545 B16R2.71 Brc1cnccc1C=Cc2ccccc2 271570a_100102527694_100000726257 [0,1,0,0,0,1|2,0,0]=4 2546 B16R2.71 Brc1cnccc1NCc2ccccc2 27a_100015324214_100000726257 [0,1,0,0,0,1|2,0,0]=4 2547 B16R2.71 Brc1cnccc1OCc2ccccc2 34a_100011996408_100015291786 [0,1,0,0,0,1|1,0,0]=3 2548 B16R2.71 Brc1cnccc1OCc2ccccn2 34a_100011996408_100000721315 [0,1,0,0,0,1|2,0,0]=4 2549 B16R2.71 Brc1cnccc1OCc2cccnc2 34a_100011996408_100000733263 [0,1,0,0,0,1|2,0,0]=4 2550 B16R2.71 Brc1cnccc1SCc2ccccc2 62a_100000211182_100000726257 [0,1,0,0,0,1|1,1,0]=4 2551 B16R2.71 Brc1cnccc1SCc2ccccc2 62a_100000726257_100015291786 [0,1,0,0,0,1|1,1,0]=4 2552 B16R2.71 Brc1ncccc1C#Cc2ccccc2 271570a_100000069678_100010202626 [0,1,0,0,0,1|2,0,0]=4 2553 B16R2.71 Brc1ncccc1C=Cc2ccccc2 271570a_100102527694_100010202626 [0,1,0,0,0,1|2,0,0]=4 2554 B16R2.71 Brc1ncccc1CNc2ccccc2 34a_100000106764_100010140945 [0,1,0,0,0,1|2,0,0]=4 2555 B16R2.71 Brc1ncccc1COc2ccccc2 34a_100000210340_100010140945 [0,1,0,0,0,1|1,0,0]=3 2556 B16R2.71 Brc1ncccc1COc2ccccc2 7a_100000210340_100010140945 [0,1,0,0,0,1|1,0,0]=3 2557 B16R2.71 Brc1ncccc1COc2cccnc2 34a_100000210849_100010140945 [0,1,0,0,0,1|2,0,0]=4 2558 B16R2.71 Brc1ncccc1COc2cccnc2 7a_100000210849_100010140945 [0,1,0,0,0,1|2,0,0]=4 2559 B16R2.71 Brc1ncccc1COc2ccncc2 34a_100000212176_100010140945 [0,1,0,0,0,1|2,0,0]=4 2560 B16R2.71 Brc1ncccc1CSc2ccccc2 62a_100000719477_100010140945 [0,1,0,0,0,1|1,1,0]=4 2561 B16R2.71 Brc1ncccc1CSc2ccccc2 62a_100010140945_100000041952 [0,1,0,0,0,1|1,1,0]=4 2562 B16R2.71 Brc1ncccc1OCc2ccccc2 34a_100000744436_100015291786 [0,1,0,0,0,1|1,0,0]=3 2563 B16R2.71 Brc1ncccc1OCc2ccccc2 7a_100000744436_100000211182 [0,1,0,0,0,1|1,0,0]=3 2564 B16R2.71 Brc1ncccc1OCc2ccccn2 34a_100000744436_100000721315 [0,1,0,0,0,1|2,0,0]=4 2565 B16R2.71 Brc1ncccc1OCc2ccccn2 7a_100000744436_100000721315 [0,1,0,0,0,1|2,0,0]=4 2566 B16R2.71 Brc1ncccc1OCc2cccnc2 34a_100000744436_100000733263 [0,1,0,0,0,1|2,0,0]=4 2567 B16R2.71 Brc1ncccc1OCc2cccnc2 7a_100000744436_100000741622 [0,1,0,0,0,1|2,0,0]=4 2568 B16R2.71 Brc1ncccc1OCc2ccncc2 7a_100000744436_100015193705 [0,1,0,0,0,1|2,0,0]=4 2569 B16R2.71 Brc1ncccc1SCc2ccccc2 62a_100000211182_100010202626 [0,1,0,0,0,1|1,1,0]=4 2570 B16R2.71 Brc1ncccc1SCc2ccccc2 62a_100010202626_100015291786 [0,1,0,0,0,1|1,1,0]=4 2571 B16R2.71 C[n+]1ccccc1C#Cc2ccccc2 271570a_100000069678_100000212160 [0,1,0,0,0,1|2,0,0]=4 2572 B16R2.71 C[n+]1ccccc1C=Cc2ccccc2 271570a_100102527694_100000212160 [0,1,0,0,0,1|2,0,0]=4 2573 B16R2.71 C[n+]1ccccc1SCc2ccccc2 62a_100000211182_100000212160 [0,1,0,0,0,1|1,1,0]=4 2574 B16R2.71 Cc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000210755 [0,1,0,0,0,1|1,0,0]=3 2575 B16R2.71 Cc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000210755 [0,1,0,0,0,1|1,0,0]=3 2576 B16R2.71 Cc1ccccc1C=Cc2cccnc2 271570a_100102525586_100000210755 [0,1,0,0,0,1|2,0,0]=4 2577 B16R2.71 Cc1ccccc1CNc2ccccc2 207a_100000106764_100000211143 [0,1,0,0,0,1|1,0,0]=3 2578 B16R2.71 Cc1ccccc1CNc2ccccc2 270302a_100000106764_100000211143 [0,1,0,0,0,1|1,0,0]=3 2579 B16R2.71 Cc1ccccc1CNc2ccccc2 34a_100000106764_100000211839 [0,1,0,0,0,1|1,0,0]=3 2580 B16R2.71 Cc1ccccc1COc2ccccc2 34a_100000210340_100000211839 [0,1,0,0,0,1|0,0,0]=2 2581 B16R2.71 Cc1ccccc1COc2ccccc2 7a_100000210340_100000211839 [0,1,0,0,0,1|0,0,0]=2 2582 B16R2.71 Cc1ccccc1COc2cccnc2 34a_100000210849_100000211839 [0,1,0,0,0,1|1,0,0]=3 2583 B16R2.71 Cc1ccccc1COc2cccnc2 7a_100000210849_100000211839 [0,1,0,0,0,1|1,0,0]=3 2584 B16R2.71 Cc1ccccc1COc2ccncc2 34a_100000212176_100000211839 [0,1,0,0,0,1|1,0,0]=3 2585 B16R2.71 Cc1ccccc1COc2ccnnc2 34a_100015204005_100000211839 [0,1,0,0,0,1|2,0,0]=4 2586 B16R2.71 Cc1ccccc1COc2cncnc2 7a_100000754086_100000211839 [0,1,0,0,0,1|2,0,0]=4 2587 B16R2.71 Cc1ccccc1CSc2ccccc2 62a_100000211839_100000041952 [0,1,0,0,0,1|0,1,0]=3 2588 B16R2.71 Cc1ccccc1CSc2ccccc2 62a_100000719477_100000211839 [0,1,0,0,0,1|0,1,0]=3 2589 B16R2.71 Cc1ccccc1CSc2ccccn2 62a_100000211839_100011216584 [0,1,0,0,0,1|1,1,0]=4 2590 B16R2.71 Cc1ccccc1CSc2ccccn2 62a_100011216584_100000211839 [0,1,0,0,0,1|1,1,0]=4 2591 B16R2.71 Cc1ccccc1CSc2cccnc2 62a_100000210063_100000211839 [0,1,0,0,0,1|1,1,0]=4 2592 B16R2.71 Cc1ccccc1CSc2cccnc2 62a_100000211839_100000210063 [0,1,0,0,0,1|1,1,0]=4 2593 B16R2.71 Cc1ccccc1CSc2ccncc2 62a_100000211839_100000728582 [0,1,0,0,0,1|1,1,0]=4 2594 B16R2.71 Cc1ccccc1CSc2ccncc2 62a_100000728582_100000211839 [0,1,0,0,0,1|1,1,0]=4 2595 B16R2.71 Cc1ccccc1NCc2ccccc2 207a_100015192222_100015611070 [0,1,0,0,0,1|1,0,0]=3 2596 B16R2.71 Cc1ccccc1NCc2ccccc2 270302a_100015192222_100015611070 [0,1,0,0,0,1|1,0,0]=3 2597 B16R2.71 Cc1ccccc1NCc2ccccc2 34a_100015192222_100015291786 [0,1,0,0,0,1|1,0,0]=3 2598 B16R2.71 Cc1ccccc1NCc2ccccn2 207a_100015192222_100000209966 [0,1,0,0,0,1|2,0,0]=4 2599 B16R2.71 Cc1ccccc1NCc2ccccn2 270302a_100015192222_100000209966 [0,1,0,0,0,1|2,0,0]=4 2600 B16R2.71 Cc1ccccc1NCc2ccccn2 34a_100015192222_100000721315 [0,1,0,0,0,1|2,0,0]=4 2601 B16R2.71 Cc1ccccc1NCc2cccnc2 207a_100015192222_100000209961 [0,1,0,0,0,1|2,0,0]=4 2602 B16R2.71 Cc1ccccc1NCc2cccnc2 270302a_100015192222_100000209961 [0,1,0,0,0,1|2,0,0]=4 2603 B16R2.71 Cc1ccccc1NCc2cccnc2 34a_100015192222_100000733263 [0,1,0,0,0,1|2,0,0]=4 2604 B16R2.71 Cc1ccccc1NCc2ccncc2 207a_100015192222_100000186114 [0,1,0,0,0,1|2,0,0]=4 2605 B16R2.71 Cc1ccccc1OCc2ccccc2 34a_100000210338_100015291786 [0,1,0,0,0,1|0,0,0]=2 2606 B16R2.71 Cc1ccccc1OCc2ccccc2 7a_100000210338_100000211182 [0,1,0,0,0,1|0,0,0]=2 2607 B16R2.71 Cc1ccccc1OCc2ccccn2 34a_100000210338_100000721315 [0,1,0,0,0,1|1,0,0]=3 2608 B16R2.71 Cc1ccccc1OCc2ccccn2 7a_100000210338_100000721315 [0,1,0,0,0,1|1,0,0]=3 2609 B16R2.71 Cc1ccccc1OCc2cccnc2 34a_100000210338_100000733263 [0,1,0,0,0,1|1,0,0]=3 2610 B16R2.71 Cc1ccccc1OCc2cccnc2 7a_100000210338_100000741622 [0,1,0,0,0,1|1,0,0]=3 2611 B16R2.71 Cc1ccccc1OCc2cccnn2 34a_100000210338_100016990269 [0,1,0,0,0,1|2,0,0]=4 2612 B16R2.71 Cc1ccccc1OCc2cccnn2 7a_100000210338_100016990269 [0,1,0,0,0,1|2,0,0]=4 2613 B16R2.71 Cc1ccccc1OCc2ccncc2 7a_100000210338_100015193705 [0,1,0,0,0,1|1,0,0]=3 2614 B16R2.71 Cc1ccccc1OCc2cnccn2 34a_100000210338_100016995436 [0,1,0,0,0,1|2,0,0]=4 2615 B16R2.71 Cc1ccccc1OCc2cnccn2 7a_100000210338_100016995436 [0,1,0,0,0,1|2,0,0]=4 2616 B16R2.71 Cc1ccccc1OCc2cncnc2 34a_100000210338_100015196519 [0,1,0,0,0,1|2,0,0]=4 2617 B16R2.71 Cc1ccccc1OCc2cncnc2 7a_100000210338_100015196519 [0,1,0,0,0,1|2,0,0]=4 2618 B16R2.71 Cc1ccccc1OCc2ncccn2 34a_100000210338_100000703007 [0,1,0,0,0,1|2,0,0]=4 2619 B16R2.71 Cc1ccccc1OCc2ncccn2 7a_100000210338_100000703007 [0,1,0,0,0,1|2,0,0]=4 2620 B16R2.71 Cc1ccccc1SCc2ccccc2 62a_100000210755_100015291786 [0,1,0,0,0,1|0,1,0]=3 2621 B16R2.71 Cc1ccccc1SCc2ccccc2 62a_100000211182_100000210755 [0,1,0,0,0,1|0,1,0]=3 2622 B16R2.71 Cc1ccccc1SCc2ccccn2 62a_100000210755_100000721315 [0,1,0,0,0,1|1,1,0]=4 2623 B16R2.71 Cc1ccccc1SCc2ccccn2 62a_100000721315_100000210755 [0,1,0,0,0,1|1,1,0]=4 2624 B16R2.71 Cc1ccccc1SCc2cccnc2 62a_100000210755_100000741622 [0,1,0,0,0,1|1,1,0]=4 2625 B16R2.71 Cc1ccccc1SCc2cccnc2 62a_100000741622_100000210755 [0,1,0,0,0,1|1,1,0]=4 2626 B16R2.71 Cc1ccccc1SCc2ccncc2 62a_100000210755_100015193705 [0,1,0,0,0,1|1,1,0]=4 2627 B16R2.71 Cc1ccccc1SCc2ccncc2 62a_100015193705_100000210755 [0,1,0,0,0,1|1,1,0]=4 2628 B16R2.71 Cc1cccnc1C#Cc2ccccc2 271570a_100000069678_100000751373 [0,1,0,0,0,1|2,0,0]=4 2629 B16R2.71 Cc1cccnc1C=Cc2ccccc2 271570a_100102527694_100000751373 [0,1,0,0,0,1|2,0,0]=4 2630 B16R2.71 Cc1cccnc1CNc2ccccc2 207a_100000106764_100000698913 [0,1,0,0,0,1|2,0,0]=4 2631 B16R2.71 Cc1cccnc1CNc2ccccc2 34a_100000106764_100000696600 [0,1,0,0,0,1|2,0,0]=4 2632 B16R2.71 Cc1cccnc1COc2ccccc2 34a_100000210340_100000696600 [0,1,0,0,0,1|1,0,0]=3 2633 B16R2.71 Cc1cccnc1COc2ccccc2 7a_100000210340_100000696600 [0,1,0,0,0,1|1,0,0]=3 2634 B16R2.71 Cc1cccnc1COc2cccnc2 34a_100000210849_100000696600 [0,1,0,0,0,1|2,0,0]=4 2635 B16R2.71 Cc1cccnc1COc2cccnc2 7a_100000210849_100000696600 [0,1,0,0,0,1|2,0,0]=4 2636 B16R2.71 Cc1cccnc1COc2ccncc2 34a_100000212176_100000696600 [0,1,0,0,0,1|2,0,0]=4 2637 B16R2.71 Cc1cccnc1CSc2ccccc2 62a_100000696600_100000041952 [0,1,0,0,0,1|1,1,0]=4 2638 B16R2.71 Cc1cccnc1CSc2ccccc2 62a_100000719477_100000696600 [0,1,0,0,0,1|1,1,0]=4 2639 B16R2.71 Cc1cccnc1SCc2ccccc2 62a_100000211182_100000751373 [0,1,0,0,0,1|1,1,0]=4 2640 B16R2.71 Cc1cccnc1SCc2ccccc2 62a_100000751373_100015291786 [0,1,0,0,0,1|1,1,0]=4 2641 B16R2.71 Cc1ccncc1C#Cc2ccccc2 271570a_100000069678_100000761580 [0,1,0,0,0,1|2,0,0]=4 2642 B16R2.71 Cc1ccncc1C=Cc2ccccc2 271570a_100102527694_100000761580 [0,1,0,0,0,1|2,0,0]=4 2643 B16R2.71 Cc1ccncc1CNc2ccccc2 207a_100000106764_100000685662 [0,1,0,0,0,1|2,0,0]=4 2644 B16R2.71 Cc1ccncc1CNc2ccccc2 34a_100000106764_100000690890 [0,1,0,0,0,1|2,0,0]=4 2645 B16R2.71 Cc1ccncc1COc2ccccc2 34a_100000210340_100000690890 [0,1,0,0,0,1|1,0,0]=3 2646 B16R2.71 Cc1ccncc1COc2ccccc2 7a_100000210340_100000690890 [0,1,0,0,0,1|1,0,0]=3 2647 B16R2.71 Cc1ccncc1COc2cccnc2 34a_100000210849_100000690890 [0,1,0,0,0,1|2,0,0]=4 2648 B16R2.71 Cc1ccncc1COc2cccnc2 7a_100000210849_100000690890 [0,1,0,0,0,1|2,0,0]=4 2649 B16R2.71 Cc1ccncc1COc2ccncc2 34a_100000212176_100000690890 [0,1,0,0,0,1|2,0,0]=4 2650 B16R2.71 Cc1ccncc1CSc2ccccc2 62a_100000690890_100000041952 [0,1,0,0,0,1|1,1,0]=4 2651 B16R2.71 Cc1ccncc1CSc2ccccc2 62a_100000719477_100000690890 [0,1,0,0,0,1|1,1,0]=4 2652 B16R2.71 Cc1ccncc1OCc2ccccc2 34a_100011997053_100015291786 [0,1,0,0,0,1|1,0,0]=3 2653 B16R2.71 Cc1ccncc1OCc2ccccc2 7a_100011997053_100000211182 [0,1,0,0,0,1|1,0,0]=3 2654 B16R2.71 Cc1ccncc1OCc2ccccn2 34a_100011997053_100000721315 [0,1,0,0,0,1|2,0,0]=4 2655 B16R2.71 Cc1ccncc1OCc2ccccn2 7a_100011997053_100000721315 [0,1,0,0,0,1|2,0,0]=4 2656 B16R2.71 Cc1ccncc1OCc2cccnc2 34a_100011997053_100000733263 [0,1,0,0,0,1|2,0,0]=4 2657 B16R2.71 Cc1ccncc1OCc2cccnc2 7a_100011997053_100000741622 [0,1,0,0,0,1|2,0,0]=4 2658 B16R2.71 Cc1ccncc1OCc2ccncc2 7a_100011997053_100015193705 [0,1,0,0,0,1|2,0,0]=4 2659 B16R2.71 Cc1ccncc1SCc2ccccc2 62a_100000211182_100000761580 [0,1,0,0,0,1|1,1,0]=4 2660 B16R2.71 Cc1ccncc1SCc2ccccc2 62a_100000761580_100015291786 [0,1,0,0,0,1|1,1,0]=4 2661 B16R2.71 Cc1cnccc1C#Cc2ccccc2 271570a_100000069678_100015191297 [0,1,0,0,0,1|2,0,0]=4 2662 B16R2.71 Cc1cnccc1C=Cc2ccccc2 271570a_100102527694_100015191297 [0,1,0,0,0,1|2,0,0]=4 2663 B16R2.71 Cc1cnccc1CNc2ccccc2 34a_100000106764_100020672809 [0,1,0,0,0,1|2,0,0]=4 2664 B16R2.71 Cc1cnccc1COc2ccccc2 34a_100000210340_100020672809 [0,1,0,0,0,1|1,0,0]=3 2665 B16R2.71 Cc1cnccc1COc2ccccc2 7a_100000210340_100020672808 [0,1,0,0,0,1|1,0,0]=3 2666 B16R2.71 Cc1cnccc1COc2cccnc2 34a_100000210849_100020672809 [0,1,0,0,0,1|2,0,0]=4 2667 B16R2.71 Cc1cnccc1COc2cccnc2 7a_100000210849_100020672808 [0,1,0,0,0,1|2,0,0]=4 2668 B16R2.71 Cc1cnccc1COc2ccncc2 34a_100000212176_100020672809 [0,1,0,0,0,1|2,0,0]=4 2669 B16R2.71 Cc1cnccc1CSc2ccccc2 62a_100000719477_100020672808 [0,1,0,0,0,1|1,1,0]=4 2670 B16R2.71 Cc1cnccc1CSc2ccccc2 62a_100020672808_100000041952 [0,1,0,0,0,1|1,1,0]=4 2671 B16R2.71 Cc1cnccc1NCc2ccccc2 27a_100015324214_100000765111 [0,1,0,0,0,1|2,0,0]=4 2672 B16R2.71 Cc1cnccc1OCc2ccccc2 34a_100000694293_100015291786 [0,1,0,0,0,1|1,0,0]=3 2673 B16R2.71 Cc1cnccc1OCc2ccccn2 34a_100000694293_100000721315 [0,1,0,0,0,1|2,0,0]=4 2674 B16R2.71 Cc1cnccc1OCc2cccnc2 34a_100000694293_100000733263 [0,1,0,0,0,1|2,0,0]=4 2675 B16R2.71 Cc1cnccc1SCc2ccccc2 62a_100000211182_100000765111 [0,1,0,0,0,1|1,1,0]=4 2676 B16R2.71 Cc1cnccc1SCc2ccccc2 62a_100000765111_100015291786 [0,1,0,0,0,1|1,1,0]=4 2677 B16R2.71 Cc1ncccc1C#Cc2ccccc2 271570a_100000069678_100000751574 [0,1,0,0,0,1|2,0,0]=4 2678 B16R2.71 Cc1ncccc1C=Cc2ccccc2 271570a_100102527694_100000751574 [0,1,0,0,0,1|2,0,0]=4 2679 B16R2.71 Cc1ncccc1CNc2ccccc2 207a_100000106764_100000751968 [0,1,0,0,0,1|2,0,0]=4 2680 B16R2.71 Cc1ncccc1CNc2ccccc2 34a_100000106764_100000732876 [0,1,0,0,0,1|2,0,0]=4 2681 B16R2.71 Cc1ncccc1COc2ccccc2 34a_100000210340_100000732876 [0,1,0,0,0,1|1,0,0]=3 2682 B16R2.71 Cc1ncccc1COc2ccccc2 7a_100000210340_100000732876 [0,1,0,0,0,1|1,0,0]=3 2683 B16R2.71 Cc1ncccc1COc2cccnc2 34a_100000210849_100000732876 [0,1,0,0,0,1|2,0,0]=4 2684 B16R2.71 Cc1ncccc1COc2cccnc2 7a_100000210849_100000732876 [0,1,0,0,0,1|2,0,0]=4 2685 B16R2.71 Cc1ncccc1COc2ccncc2 34a_100000212176_100000732876 [0,1,0,0,0,1|2,0,0]=4 2686 B16R2.71 Cc1ncccc1CSc2ccccc2 62a_100000719477_100000732876 [0,1,0,0,0,1|1,1,0]=4 2687 B16R2.71 Cc1ncccc1CSc2ccccc2 62a_100000732876_100000041952 [0,1,0,0,0,1|1,1,0]=4 2688 B16R2.71 Cc1ncccc1OCc2ccccc2 34a_100000745507_100015291786 [0,1,0,0,0,1|1,0,0]=3 2689 B16R2.71 Cc1ncccc1OCc2ccccc2 7a_100000745507_100000211182 [0,1,0,0,0,1|1,0,0]=3 2690 B16R2.71 Cc1ncccc1OCc2ccccn2 34a_100000745507_100000721315 [0,1,0,0,0,1|2,0,0]=4 2691 B16R2.71 Cc1ncccc1OCc2ccccn2 7a_100000745507_100000721315 [0,1,0,0,0,1|2,0,0]=4 2692 B16R2.71 Cc1ncccc1OCc2cccnc2 34a_100000745507_100000733263 [0,1,0,0,0,1|2,0,0]=4 2693 B16R2.71 Cc1ncccc1OCc2cccnc2 7a_100000745507_100000741622 [0,1,0,0,0,1|2,0,0]=4 2694 B16R2.71 Cc1ncccc1OCc2ccncc2 7a_100000745507_100015193705 [0,1,0,0,0,1|2,0,0]=4 2695 B16R2.71 Cc1ncccc1SCc2ccccc2 62a_100000211182_100000751574 [0,1,0,0,0,1|1,1,0]=4 2696 B16R2.71 Cc1ncccc1SCc2ccccc2 62a_100000751574_100015291786 [0,1,0,0,0,1|1,1,0]=4 2697 B16R2.71 Cc1nccnc1OCc2ccccc2 34a_100000766352_100015291786 [0,1,0,0,0,1|2,0,0]=4 2698 B16R2.71 Clc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000764095 [0,1,0,0,0,1|1,0,0]=3 2699 B16R2.71 Clc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000764095 [0,1,0,0,0,1|1,0,0]=3 2700 B16R2.71 Clc1ccccc1C=Cc2cccnc2 271570a_100102525586_100000764095 [0,1,0,0,0,1|2,0,0]=4 2701 B16R2.71 Clc1ccccc1CNc2ccccc2 207a_100000106764_100000210073 [0,1,0,0,0,1|1,0,0]=3 2702 B16R2.71 Clc1ccccc1CNc2ccccc2 270302a_100000106764_100000210073 [0,1,0,0,0,1|1,0,0]=3 2703 B16R2.71 Clc1ccccc1CNc2ccccc2 34a_100000106764_100000187162 [0,1,0,0,0,1|1,0,0]=3 2704 B16R2.71 Clc1ccccc1COc2ccccc2 34a_100000210340_100000187162 [0,1,0,0,0,1|0,0,0]=2 2705 B16R2.71 Clc1ccccc1COc2ccccc2 7a_100000210340_100000187162 [0,1,0,0,0,1|0,0,0]=2 2706 B16R2.71 Clc1ccccc1COc2cccnc2 34a_100000210849_100000187162 [0,1,0,0,0,1|1,0,0]=3 2707 B16R2.71 Clc1ccccc1COc2cccnc2 7a_100000210849_100000187162 [0,1,0,0,0,1|1,0,0]=3 2708 B16R2.71 Clc1ccccc1COc2ccncc2 34a_100000212176_100000187162 [0,1,0,0,0,1|1,0,0]=3 2709 B16R2.71 Clc1ccccc1COc2ccnnc2 34a_100015204005_100000187162 [0,1,0,0,0,1|2,0,0]=4 2710 B16R2.71 Clc1ccccc1COc2cncnc2 7a_100000754086_100000187162 [0,1,0,0,0,1|2,0,0]=4 2711 B16R2.71 Clc1ccccc1CSc2ccccc2 62a_100000187162_100000041952 [0,1,0,0,0,1|0,1,0]=3 2712 B16R2.71 Clc1ccccc1CSc2ccccc2 62a_100000719477_100000187162 [0,1,0,0,0,1|0,1,0]=3 2713 B16R2.71 Clc1ccccc1CSc2ccccn2 62a_100000187162_100011216584 [0,1,0,0,0,1|1,1,0]=4 2714 B16R2.71 Clc1ccccc1CSc2ccccn2 62a_100011216584_100000187162 [0,1,0,0,0,1|1,1,0]=4 2715 B16R2.71 Clc1ccccc1CSc2cccnc2 62a_100000187162_100000210063 [0,1,0,0,0,1|1,1,0]=4 2716 B16R2.71 Clc1ccccc1CSc2cccnc2 62a_100000210063_100000187162 [0,1,0,0,0,1|1,1,0]=4 2717 B16R2.71 Clc1ccccc1CSc2ccncc2 62a_100000187162_100000728582 [0,1,0,0,0,1|1,1,0]=4 2718 B16R2.71 Clc1ccccc1CSc2ccncc2 62a_100000728582_100000187162 [0,1,0,0,0,1|1,1,0]=4 2719 B16R2.71 Clc1ccccc1NCc2ccccc2 207a_100000185783_100015611070 [0,1,0,0,0,1|1,0,0]=3 2720 B16R2.71 Clc1ccccc1NCc2ccccc2 34a_100000185783_100015291786 [0,1,0,0,0,1|1,0,0]=3 2721 B16R2.71 Clc1ccccc1NCc2ccccn2 207a_100000185783_100000209966 [0,1,0,0,0,1|2,0,0]=4 2722 B16R2.71 Clc1ccccc1NCc2ccccn2 34a_100000185783_100000721315 [0,1,0,0,0,1|2,0,0]=4 2723 B16R2.71 Clc1ccccc1NCc2cccnc2 207a_100000185783_100000209961 [0,1,0,0,0,1|2,0,0]=4 2724 B16R2.71 Clc1ccccc1NCc2cccnc2 34a_100000185783_100000733263 [0,1,0,0,0,1|2,0,0]=4 2725 B16R2.71 Clc1ccccc1NCc2ccncc2 207a_100000185783_100000186114 [0,1,0,0,0,1|2,0,0]=4 2726 B16R2.71 Clc1ccccc1OCc2ccccc2 34a_100000210172_100015291786 [0,1,0,0,0,1|0,0,0]=2 2727 B16R2.71 Clc1ccccc1OCc2ccccc2 7a_100000210172_100000211182 [0,1,0,0,0,1|0,0,0]=2 2728 B16R2.71 Clc1ccccc1OCc2ccccn2 34a_100000210172_100000721315 [0,1,0,0,0,1|1,0,0]=3 2729 B16R2.71 Clc1ccccc1OCc2ccccn2 7a_100000210172_100000721315 [0,1,0,0,0,1|1,0,0]=3 2730 B16R2.71 Clc1ccccc1OCc2cccnc2 34a_100000210172_100000733263 [0,1,0,0,0,1|1,0,0]=3 2731 B16R2.71 Clc1ccccc1OCc2cccnc2 7a_100000210172_100000741622 [0,1,0,0,0,1|1,0,0]=3 2732 B16R2.71 Clc1ccccc1OCc2cccnn2 34a_100000210172_100016990269 [0,1,0,0,0,1|2,0,0]=4 2733 B16R2.71 Clc1ccccc1OCc2cccnn2 7a_100000210172_100016990269 [0,1,0,0,0,1|2,0,0]=4 2734 B16R2.71 Clc1ccccc1OCc2ccncc2 7a_100000210172_100015193705 [0,1,0,0,0,1|1,0,0]=3 2735 B16R2.71 Clc1ccccc1OCc2cnccn2 34a_100000210172_100016995436 [0,1,0,0,0,1|2,0,0]=4 2736 B16R2.71 Clc1ccccc1OCc2cnccn2 7a_100000210172_100016995436 [0,1,0,0,0,1|2,0,0]=4 2737 B16R2.71 Clc1ccccc1OCc2cncnc2 34a_100000210172_100015196519 [0,1,0,0,0,1|2,0,0]=4 2738 B16R2.71 Clc1ccccc1OCc2cncnc2 7a_100000210172_100015196519 [0,1,0,0,0,1|2,0,0]=4 2739 B16R2.71 Clc1ccccc1OCc2ncccn2 34a_100000210172_100000703007 [0,1,0,0,0,1|2,0,0]=4 2740 B16R2.71 Clc1ccccc1OCc2ncccn2 7a_100000210172_100000703007 [0,1,0,0,0,1|2,0,0]=4 2741 B16R2.71 Clc1ccccc1SCc2ccccc2 62a_100000211182_100000764095 [0,1,0,0,0,1|0,1,0]=3 2742 B16R2.71 Clc1ccccc1SCc2ccccc2 62a_100000764095_100015291786 [0,1,0,0,0,1|0,1,0]=3 2743 B16R2.71 Clc1ccccc1SCc2ccccn2 62a_100000721315_100000764095 [0,1,0,0,0,1|1,1,0]=4 2744 B16R2.71 Clc1ccccc1SCc2ccccn2 62a_100000764095_100000721315 [0,1,0,0,0,1|1,1,0]=4 2745 B16R2.71 Clc1ccccc1SCc2cccnc2 62a_100000741622_100000764095 [0,1,0,0,0,1|1,1,0]=4 2746 B16R2.71 Clc1ccccc1SCc2cccnc2 62a_100000764095_100000741622 [0,1,0,0,0,1|1,1,0]=4 2747 B16R2.71 Clc1ccccc1SCc2ccncc2 62a_100000764095_100015193705 [0,1,0,0,0,1|1,1,0]=4 2748 B16R2.71 Clc1ccccc1SCc2ccncc2 62a_100015193705_100000764095 [0,1,0,0,0,1|1,1,0]=4 2749 B16R2.71 Clc1cccnc1C#Cc2ccccc2 271570a_100000069678_100011356963 [0,1,0,0,0,1|2,0,0]=4 2750 B16R2.71 Clc1cccnc1C=Cc2ccccc2 271570a_100102527694_100011356963 [0,1,0,0,0,1|2,0,0]=4 2751 B16R2.71 Clc1cccnc1CNc2ccccc2 207a_100000106764_100012001307 [0,1,0,0,0,1|2,0,0]=4 2752 B16R2.71 Clc1cccnc1COc2ccccc2 7a_100000210340_100000099807 [0,1,0,0,0,1|1,0,0]=3 2753 B16R2.71 Clc1cccnc1COc2cccnc2 7a_100000210849_100000099807 [0,1,0,0,0,1|2,0,0]=4 2754 B16R2.71 Clc1cccnc1CSc2ccccc2 62a_100000099807_100000041952 [0,1,0,0,0,1|1,1,0]=4 2755 B16R2.71 Clc1cccnc1CSc2ccccc2 62a_100000719477_100000099807 [0,1,0,0,0,1|1,1,0]=4 2756 B16R2.71 Clc1cccnc1OCc2ccccc2 34a_100011290957_100015291786 [0,1,0,0,0,1|1,0,0]=3 2757 B16R2.71 Clc1cccnc1OCc2ccccn2 34a_100011290957_100000721315 [0,1,0,0,0,1|2,0,0]=4 2758 B16R2.71 Clc1cccnc1OCc2cccnc2 34a_100011290957_100000733263 [0,1,0,0,0,1|2,0,0]=4 2759 B16R2.71 Clc1cccnc1SCc2ccccc2 62a_100000211182_100011356963 [0,1,0,0,0,1|1,1,0]=4 2760 B16R2.71 Clc1cccnc1SCc2ccccc2 62a_100011356963_100015291786 [0,1,0,0,0,1|1,1,0]=4 2761 B16R2.71 Clc1ccncc1C#Cc2ccccc2 271570a_100000069678_100009995489 [0,1,0,0,0,1|2,0,0]=4 2762 B16R2.71 Clc1ccncc1C=Cc2ccccc2 271570a_100102527694_100009995489 [0,1,0,0,0,1|2,0,0]=4 2763 B16R2.71 Clc1ccncc1OCc2ccccc2 34a_100011996695_100015291786 [0,1,0,0,0,1|1,0,0]=3 2764 B16R2.71 Clc1ccncc1OCc2ccccn2 34a_100011996695_100000721315 [0,1,0,0,0,1|2,0,0]=4 2765 B16R2.71 Clc1ccncc1OCc2cccnc2 34a_100011996695_100000733263 [0,1,0,0,0,1|2,0,0]=4 2766 B16R2.71 Clc1ccncc1SCc2ccccc2 62a_100000211182_100009995489 [0,1,0,0,0,1|1,1,0]=4 2767 B16R2.71 Clc1ccncc1SCc2ccccc2 62a_100009995489_100015291786 [0,1,0,0,0,1|1,1,0]=4 2768 B16R2.71 Clc1cnccc1C#Cc2ccccc2 271570a_100000069678_100000708259 [0,1,0,0,0,1|2,0,0]=4 2769 B16R2.71 Clc1cnccc1C=Cc2ccccc2 271570a_100102527694_100000708259 [0,1,0,0,0,1|2,0,0]=4 2770 B16R2.71 Clc1cnccc1CNc2ccccc2 207a_100000106764_100011934409 [0,1,0,0,0,1|2,0,0]=4 2771 B16R2.71 Clc1cnccc1COc2ccccc2 7a_100000210340_100000763264 [0,1,0,0,0,1|1,0,0]=3 2772 B16R2.71 Clc1cnccc1COc2cccnc2 7a_100000210849_100000763264 [0,1,0,0,0,1|2,0,0]=4 2773 B16R2.71 Clc1cnccc1CSc2ccccc2 62a_100000719477_100000763264 [0,1,0,0,0,1|1,1,0]=4 2774 B16R2.71 Clc1cnccc1CSc2ccccc2 62a_100000763264_100000041952 [0,1,0,0,0,1|1,1,0]=4 2775 B16R2.71 Clc1cnccc1OCc2ccccc2 34a_100011997054_100015291786 [0,1,0,0,0,1|1,0,0]=3 2776 B16R2.71 Clc1cnccc1OCc2ccccn2 34a_100011997054_100000721315 [0,1,0,0,0,1|2,0,0]=4 2777 B16R2.71 Clc1cnccc1OCc2cccnc2 34a_100011997054_100000733263 [0,1,0,0,0,1|2,0,0]=4 2778 B16R2.71 Clc1cnccc1SCc2ccccc2 62a_100000211182_100000708259 [0,1,0,0,0,1|1,1,0]=4 2779 B16R2.71 Clc1cnccc1SCc2ccccc2 62a_100000708259_100015291786 [0,1,0,0,0,1|1,1,0]=4 2780 B16R2.71 Clc1ncccc1C#Cc2ccccc2 271570a_100000069678_100000036424 [0,1,0,0,0,1|2,0,0]=4 2781 B16R2.71 Clc1ncccc1C=Cc2ccccc2 271570a_100102527694_100000036424 [0,1,0,0,0,1|2,0,0]=4 2782 B16R2.71 Clc1ncccc1CNc2ccccc2 34a_100000106764_100000045678 [0,1,0,0,0,1|2,0,0]=4 2783 B16R2.71 Clc1ncccc1COc2ccccc2 34a_100000210340_100000045678 [0,1,0,0,0,1|1,0,0]=3 2784 B16R2.71 Clc1ncccc1COc2ccccc2 7a_100000210340_100000045678 [0,1,0,0,0,1|1,0,0]=3 2785 B16R2.71 Clc1ncccc1COc2cccnc2 34a_100000210849_100000045678 [0,1,0,0,0,1|2,0,0]=4 2786 B16R2.71 Clc1ncccc1COc2cccnc2 7a_100000210849_100000045678 [0,1,0,0,0,1|2,0,0]=4 2787 B16R2.71 Clc1ncccc1COc2ccncc2 34a_100000212176_100000045678 [0,1,0,0,0,1|2,0,0]=4 2788 B16R2.71 Clc1ncccc1CSc2ccccc2 62a_100000045678_100000041952 [0,1,0,0,0,1|1,1,0]=4 2789 B16R2.71 Clc1ncccc1CSc2ccccc2 62a_100000719477_100000045678 [0,1,0,0,0,1|1,1,0]=4 2790 B16R2.71 Clc1ncccc1OCc2ccccc2 34a_100000757616_100015291786 [0,1,0,0,0,1|1,0,0]=3 2791 B16R2.71 Clc1ncccc1OCc2ccccc2 7a_100000757616_100000211182 [0,1,0,0,0,1|1,0,0]=3 2792 B16R2.71 Clc1ncccc1OCc2ccccn2 34a_100000757616_100000721315 [0,1,0,0,0,1|2,0,0]=4 2793 B16R2.71 Clc1ncccc1OCc2ccccn2 7a_100000757616_100000721315 [0,1,0,0,0,1|2,0,0]=4 2794 B16R2.71 Clc1ncccc1OCc2cccnc2 34a_100000757616_100000733263 [0,1,0,0,0,1|2,0,0]=4 2795 B16R2.71 Clc1ncccc1OCc2cccnc2 7a_100000757616_100000741622 [0,1,0,0,0,1|2,0,0]=4 2796 B16R2.71 Clc1ncccc1OCc2ccncc2 7a_100000757616_100015193705 [0,1,0,0,0,1|2,0,0]=4 2797 B16R2.71 Clc1ncccc1SCc2ccccc2 62a_100000036424_100015291786 [0,1,0,0,0,1|1,1,0]=4 2798 B16R2.71 Clc1ncccc1SCc2ccccc2 62a_100000211182_100000036424 [0,1,0,0,0,1|1,1,0]=4 2799 B16R2.71 Fc1ccccc1C#Cc2ccccc2 271570a_100000069678_100011215700 [0,1,0,0,0,1|1,0,0]=3 2800 B16R2.71 Fc1ccccc1C=Cc2ccccc2 271570a_100102527694_100011215700 [0,1,0,0,0,1|1,0,0]=3 2801 B16R2.71 Fc1ccccc1C=Cc2ccccc2 271570a_200102527919_100000210277 [0,1,0,0,0,1|1,0,0]=3 2802 B16R2.71 Fc1ccccc1C=Cc2ccccn2 271570a_200102527919_100011216584 [0,1,0,0,0,1|2,0,0]=4 2803 B16R2.71 Fc1ccccc1C=Cc2cccnc2 271570a_100102525586_100011215700 [0,1,0,0,0,1|2,0,0]=4 2804 B16R2.71 Fc1ccccc1C=Cc2cccnc2 271570a_200102527919_100000752921 [0,1,0,0,0,1|2,0,0]=4 2805 B16R2.71 Fc1ccccc1C=Cc2ccncc2 271570a_200102527919_100000035832 [0,1,0,0,0,1|2,0,0]=4 2806 B16R2.71 Fc1ccccc1CNc2ccccc2 207a_100000106764_100000210811 [0,1,0,0,0,1|1,0,0]=3 2807 B16R2.71 Fc1ccccc1CNc2ccccc2 270302a_100000106764_100000210811 [0,1,0,0,0,1|1,0,0]=3 2808 B16R2.71 Fc1ccccc1CNc2ccccc2 34a_100000106764_100000211605 [0,1,0,0,0,1|1,0,0]=3 2809 B16R2.71 Fc1ccccc1COc2ccccc2 34a_100000210340_100000211605 [0,1,0,0,0,1|0,0,0]=2 2810 B16R2.71 Fc1ccccc1COc2ccccc2 7a_100000210340_100000211605 [0,1,0,0,0,1|0,0,0]=2 2811 B16R2.71 Fc1ccccc1COc2cccnc2 34a_100000210849_100000211605 [0,1,0,0,0,1|1,0,0]=3 2812 B16R2.71 Fc1ccccc1COc2cccnc2 7a_100000210849_100000211605 [0,1,0,0,0,1|1,0,0]=3 2813 B16R2.71 Fc1ccccc1COc2ccncc2 34a_100000212176_100000211605 [0,1,0,0,0,1|1,0,0]=3 2814 B16R2.71 Fc1ccccc1COc2ccnnc2 34a_100015204005_100000211605 [0,1,0,0,0,1|2,0,0]=4 2815 B16R2.71 Fc1ccccc1COc2cncnc2 7a_100000754086_100000211605 [0,1,0,0,0,1|2,0,0]=4 2816 B16R2.71 Fc1ccccc1CSc2ccccc2 62a_100000211605_100000041952 [0,1,0,0,0,1|0,1,0]=3 2817 B16R2.71 Fc1ccccc1CSc2ccccc2 62a_100000719477_100000211605 [0,1,0,0,0,1|0,1,0]=3 2818 B16R2.71 Fc1ccccc1CSc2ccccn2 62a_100000211605_100011216584 [0,1,0,0,0,1|1,1,0]=4 2819 B16R2.71 Fc1ccccc1CSc2ccccn2 62a_100011216584_100000211605 [0,1,0,0,0,1|1,1,0]=4 2820 B16R2.71 Fc1ccccc1CSc2cccnc2 62a_100000210063_100000211605 [0,1,0,0,0,1|1,1,0]=4 2821 B16R2.71 Fc1ccccc1CSc2cccnc2 62a_100000211605_100000210063 [0,1,0,0,0,1|1,1,0]=4 2822 B16R2.71 Fc1ccccc1CSc2ccncc2 62a_100000211605_100000728582 [0,1,0,0,0,1|1,1,0]=4 2823 B16R2.71 Fc1ccccc1CSc2ccncc2 62a_100000728582_100000211605 [0,1,0,0,0,1|1,1,0]=4 2824 B16R2.71 Fc1ccccc1NCc2ccccc2 207a_100000210422_100015611070 [0,1,0,0,0,1|1,0,0]=3 2825 B16R2.71 Fc1ccccc1NCc2ccccc2 34a_100000210422_100015291786 [0,1,0,0,0,1|1,0,0]=3 2826 B16R2.71 Fc1ccccc1NCc2ccccn2 207a_100000210422_100000209966 [0,1,0,0,0,1|2,0,0]=4 2827 B16R2.71 Fc1ccccc1NCc2ccccn2 34a_100000210422_100000721315 [0,1,0,0,0,1|2,0,0]=4 2828 B16R2.71 Fc1ccccc1NCc2cccnc2 207a_100000210422_100000209961 [0,1,0,0,0,1|2,0,0]=4 2829 B16R2.71 Fc1ccccc1NCc2cccnc2 34a_100000210422_100000733263 [0,1,0,0,0,1|2,0,0]=4 2830 B16R2.71 Fc1ccccc1NCc2ccncc2 207a_100000210422_100000186114 [0,1,0,0,0,1|2,0,0]=4 2831 B16R2.71 Fc1ccccc1OCc2ccccc2 34a_100000210171_100015291786 [0,1,0,0,0,1|0,0,0]=2 2832 B16R2.71 Fc1ccccc1OCc2ccccc2 7a_100000210171_100000211182 [0,1,0,0,0,1|0,0,0]=2 2833 B16R2.71 Fc1ccccc1OCc2ccccn2 34a_100000210171_100000721315 [0,1,0,0,0,1|1,0,0]=3 2834 B16R2.71 Fc1ccccc1OCc2ccccn2 7a_100000210171_100000721315 [0,1,0,0,0,1|1,0,0]=3 2835 B16R2.71 Fc1ccccc1OCc2cccnc2 34a_100000210171_100000733263 [0,1,0,0,0,1|1,0,0]=3 2836 B16R2.71 Fc1ccccc1OCc2cccnc2 7a_100000210171_100000741622 [0,1,0,0,0,1|1,0,0]=3 2837 B16R2.71 Fc1ccccc1OCc2cccnn2 34a_100000210171_100016990269 [0,1,0,0,0,1|2,0,0]=4 2838 B16R2.71 Fc1ccccc1OCc2cccnn2 7a_100000210171_100016990269 [0,1,0,0,0,1|2,0,0]=4 2839 B16R2.71 Fc1ccccc1OCc2ccncc2 7a_100000210171_100015193705 [0,1,0,0,0,1|1,0,0]=3 2840 B16R2.71 Fc1ccccc1OCc2cnccn2 34a_100000210171_100016995436 [0,1,0,0,0,1|2,0,0]=4 2841 B16R2.71 Fc1ccccc1OCc2cnccn2 7a_100000210171_100016995436 [0,1,0,0,0,1|2,0,0]=4 2842 B16R2.71 Fc1ccccc1OCc2cncnc2 34a_100000210171_100015196519 [0,1,0,0,0,1|2,0,0]=4 2843 B16R2.71 Fc1ccccc1OCc2cncnc2 7a_100000210171_100015196519 [0,1,0,0,0,1|2,0,0]=4 2844 B16R2.71 Fc1ccccc1OCc2ncccn2 34a_100000210171_100000703007 [0,1,0,0,0,1|2,0,0]=4 2845 B16R2.71 Fc1ccccc1OCc2ncccn2 7a_100000210171_100000703007 [0,1,0,0,0,1|2,0,0]=4 2846 B16R2.71 Fc1ccccc1SCc2ccccc2 62a_100000211182_100011215700 [0,1,0,0,0,1|0,1,0]=3 2847 B16R2.71 Fc1ccccc1SCc2ccccc2 62a_100011215700_100015291786 [0,1,0,0,0,1|0,1,0]=3 2848 B16R2.71 Fc1ccccc1SCc2ccccn2 62a_100000721315_100011215700 [0,1,0,0,0,1|1,1,0]=4 2849 B16R2.71 Fc1ccccc1SCc2ccccn2 62a_100011215700_100000721315 [0,1,0,0,0,1|1,1,0]=4 2850 B16R2.71 Fc1ccccc1SCc2cccnc2 62a_100000741622_100011215700 [0,1,0,0,0,1|1,1,0]=4 2851 B16R2.71 Fc1ccccc1SCc2cccnc2 62a_100011215700_100000741622 [0,1,0,0,0,1|1,1,0]=4 2852 B16R2.71 Fc1ccccc1SCc2ccncc2 62a_100011215700_100015193705 [0,1,0,0,0,1|1,1,0]=4 2853 B16R2.71 Fc1ccccc1SCc2ccncc2 62a_100015193705_100011215700 [0,1,0,0,0,1|1,1,0]=4 2854 B16R2.71 Fc1cccnc1C#Cc2ccccc2 271570a_100000069678_100000685392 [0,1,0,0,0,1|2,0,0]=4 2855 B16R2.71 Fc1cccnc1C=Cc2ccccc2 271570a_100102527694_100000685392 [0,1,0,0,0,1|2,0,0]=4 2856 B16R2.71 Fc1cccnc1CNc2ccccc2 207a_100000106764_100011934734 [0,1,0,0,0,1|2,0,0]=4 2857 B16R2.71 Fc1cccnc1CNc2ccccc2 34a_100000106764_100000104219 [0,1,0,0,0,1|2,0,0]=4 2858 B16R2.71 Fc1cccnc1COc2ccccc2 34a_100000210340_100000104219 [0,1,0,0,0,1|1,0,0]=3 2859 B16R2.71 Fc1cccnc1COc2ccccc2 7a_100000210340_100000104219 [0,1,0,0,0,1|1,0,0]=3 2860 B16R2.71 Fc1cccnc1COc2cccnc2 34a_100000210849_100000104219 [0,1,0,0,0,1|2,0,0]=4 2861 B16R2.71 Fc1cccnc1COc2cccnc2 7a_100000210849_100000104219 [0,1,0,0,0,1|2,0,0]=4 2862 B16R2.71 Fc1cccnc1COc2ccncc2 34a_100000212176_100000104219 [0,1,0,0,0,1|2,0,0]=4 2863 B16R2.71 Fc1cccnc1CSc2ccccc2 62a_100000104219_100000041952 [0,1,0,0,0,1|1,1,0]=4 2864 B16R2.71 Fc1cccnc1CSc2ccccc2 62a_100000719477_100000104219 [0,1,0,0,0,1|1,1,0]=4 2865 B16R2.71 Fc1cccnc1OCc2ccccc2 34a_100011219419_100015291786 [0,1,0,0,0,1|1,0,0]=3 2866 B16R2.71 Fc1cccnc1OCc2ccccn2 34a_100011219419_100000721315 [0,1,0,0,0,1|2,0,0]=4 2867 B16R2.71 Fc1cccnc1OCc2cccnc2 34a_100011219419_100000733263 [0,1,0,0,0,1|2,0,0]=4 2868 B16R2.71 Fc1cccnc1SCc2ccccc2 62a_100000211182_100000685392 [0,1,0,0,0,1|1,1,0]=4 2869 B16R2.71 Fc1cccnc1SCc2ccccc2 62a_100000685392_100015291786 [0,1,0,0,0,1|1,1,0]=4 2870 B16R2.71 Fc1ccncc1C#Cc2ccccc2 271570a_100000069678_100009820683 [0,1,0,0,0,1|2,0,0]=4 2871 B16R2.71 Fc1ccncc1C=Cc2ccccc2 271570a_100102527694_100009820683 [0,1,0,0,0,1|2,0,0]=4 2872 B16R2.71 Fc1ccncc1SCc2ccccc2 62a_100000211182_100009820683 [0,1,0,0,0,1|1,1,0]=4 2873 B16R2.71 Fc1ccncc1SCc2ccccc2 62a_100009820683_100015291786 [0,1,0,0,0,1|1,1,0]=4 2874 B16R2.71 Fc1cnccc1C#Cc2ccccc2 271570a_100000069678_100000047030 [0,1,0,0,0,1|2,0,0]=4 2875 B16R2.71 Fc1cnccc1C=Cc2ccccc2 271570a_100102527694_100000047030 [0,1,0,0,0,1|2,0,0]=4 2876 B16R2.71 Fc1cnccc1NCc2ccccc2 27a_100015324214_100000035921 [0,1,0,0,0,1|2,0,0]=4 2877 B16R2.71 Fc1cnccc1OCc2ccccc2 34a_200000081243_100015291786 [0,1,0,0,0,1|1,0,0]=3 2878 B16R2.71 Fc1cnccc1OCc2ccccn2 34a_200000081243_100000721315 [0,1,0,0,0,1|2,0,0]=4 2879 B16R2.71 Fc1cnccc1OCc2cccnc2 34a_200000081243_100000733263 [0,1,0,0,0,1|2,0,0]=4 2880 B16R2.71 Fc1cnccc1SCc2ccccc2 62a_100000047030_100015291786 [0,1,0,0,0,1|1,1,0]=4 2881 B16R2.71 Fc1cnccc1SCc2ccccc2 62a_100000211182_100000047030 [0,1,0,0,0,1|1,1,0]=4 2882 B16R2.71 Fc1ncccc1C#Cc2ccccc2 271570a_100000069678_100009816115 [0,1,0,0,0,1|2,0,0]=4 2883 B16R2.71 Fc1ncccc1C=Cc2ccccc2 271570a_100102527694_100009816115 [0,1,0,0,0,1|2,0,0]=4 2884 B16R2.71 Fc1ncccc1CNc2ccccc2 34a_100000106764_100000099810 [0,1,0,0,0,1|2,0,0]=4 2885 B16R2.71 Fc1ncccc1COc2ccccc2 34a_100000210340_100000099810 [0,1,0,0,0,1|1,0,0]=3 2886 B16R2.71 Fc1ncccc1COc2ccccc2 7a_100000210340_100000099810 [0,1,0,0,0,1|1,0,0]=3 2887 B16R2.71 Fc1ncccc1COc2cccnc2 34a_100000210849_100000099810 [0,1,0,0,0,1|2,0,0]=4 2888 B16R2.71 Fc1ncccc1COc2cccnc2 7a_100000210849_100000099810 [0,1,0,0,0,1|2,0,0]=4 2889 B16R2.71 Fc1ncccc1COc2ccncc2 34a_100000212176_100000099810 [0,1,0,0,0,1|2,0,0]=4 2890 B16R2.71 Fc1ncccc1CSc2ccccc2 62a_100000099810_100000041952 [0,1,0,0,0,1|1,1,0]=4 2891 B16R2.71 Fc1ncccc1CSc2ccccc2 62a_100000719477_100000099810 [0,1,0,0,0,1|1,1,0]=4 2892 B16R2.71 Fc1ncccc1OCc2ccccc2 34a_100000061740_100015291786 [0,1,0,0,0,1|1,0,0]=3 2893 B16R2.71 Fc1ncccc1OCc2ccccc2 7a_100000061740_100000211182 [0,1,0,0,0,1|1,0,0]=3 2894 B16R2.71 Fc1ncccc1OCc2ccccn2 34a_100000061740_100000721315 [0,1,0,0,0,1|2,0,0]=4 2895 B16R2.71 Fc1ncccc1OCc2ccccn2 7a_100000061740_100000721315 [0,1,0,0,0,1|2,0,0]=4 2896 B16R2.71 Fc1ncccc1OCc2cccnc2 34a_100000061740_100000733263 [0,1,0,0,0,1|2,0,0]=4 2897 B16R2.71 Fc1ncccc1OCc2cccnc2 7a_100000061740_100000741622 [0,1,0,0,0,1|2,0,0]=4 2898 B16R2.71 Fc1ncccc1OCc2ccncc2 7a_100000061740_100015193705 [0,1,0,0,0,1|2,0,0]=4 2899 B16R2.71 Fc1ncccc1SCc2ccccc2 62a_100000211182_100009816115 [0,1,0,0,0,1|1,1,0]=4 2900 B16R2.71 Fc1ncccc1SCc2ccccc2 62a_100009816115_100015291786 [0,1,0,0,0,1|1,1,0]=4 2901 B16R2.71 Ic1ccccc1CNc2ccccc2 207a_100000106764_100000010305 [0,1,0,0,0,1|1,0,0]=3 2902 B16R2.71 Ic1ccccc1CNc2ccccc2 34a_100000106764_100011215278 [0,1,0,0,0,1|1,0,0]=3 2903 B16R2.71 Ic1ccccc1COc2ccccc2 34a_100000210340_100011215278 [0,1,0,0,0,1|0,0,0]=2 2904 B16R2.71 Ic1ccccc1COc2ccccc2 7a_100000210340_100011215278 [0,1,0,0,0,1|0,0,0]=2 2905 B16R2.71 Ic1ccccc1COc2cccnc2 34a_100000210849_100011215278 [0,1,0,0,0,1|1,0,0]=3 2906 B16R2.71 Ic1ccccc1COc2cccnc2 7a_100000210849_100011215278 [0,1,0,0,0,1|1,0,0]=3 2907 B16R2.71 Ic1ccccc1COc2ccncc2 34a_100000212176_100011215278 [0,1,0,0,0,1|1,0,0]=3 2908 B16R2.71 Ic1ccccc1COc2ccnnc2 34a_100015204005_100011215278 [0,1,0,0,0,1|2,0,0]=4 2909 B16R2.71 Ic1ccccc1COc2cncnc2 7a_100000754086_100011215278 [0,1,0,0,0,1|2,0,0]=4 2910 B16R2.71 Ic1ccccc1CSc2ccccc2 62a_100000719477_100011216222 [0,1,0,0,0,1|0,1,0]=3 2911 B16R2.71 Ic1ccccc1CSc2ccccc2 62a_100011216222_100000041952 [0,1,0,0,0,1|0,1,0]=3 2912 B16R2.71 Ic1ccccc1CSc2ccccn2 62a_100011216222_100011216584 [0,1,0,0,0,1|1,1,0]=4 2913 B16R2.71 Ic1ccccc1CSc2ccccn2 62a_100011216584_100011216222 [0,1,0,0,0,1|1,1,0]=4 2914 B16R2.71 Ic1ccccc1CSc2cccnc2 62a_100000210063_100011216222 [0,1,0,0,0,1|1,1,0]=4 2915 B16R2.71 Ic1ccccc1CSc2cccnc2 62a_100011216222_100000210063 [0,1,0,0,0,1|1,1,0]=4 2916 B16R2.71 Ic1ccccc1CSc2ccncc2 62a_100000728582_100011216222 [0,1,0,0,0,1|1,1,0]=4 2917 B16R2.71 Ic1ccccc1CSc2ccncc2 62a_100011216222_100000728582 [0,1,0,0,0,1|1,1,0]=4 2918 B16R2.71 Ic1ccccc1NCc2ccccc2 207a_100000210053_100015611070 [0,1,0,0,0,1|1,0,0]=3 2919 B16R2.71 Ic1ccccc1NCc2ccccc2 34a_100000210053_100015291786 [0,1,0,0,0,1|1,0,0]=3 2920 B16R2.71 Ic1ccccc1NCc2ccccn2 207a_100000210053_100000209966 [0,1,0,0,0,1|2,0,0]=4 2921 B16R2.71 Ic1ccccc1NCc2ccccn2 34a_100000210053_100000721315 [0,1,0,0,0,1|2,0,0]=4 2922 B16R2.71 Ic1ccccc1NCc2cccnc2 207a_100000210053_100000209961 [0,1,0,0,0,1|2,0,0]=4 2923 B16R2.71 Ic1ccccc1NCc2cccnc2 34a_100000210053_100000733263 [0,1,0,0,0,1|2,0,0]=4 2924 B16R2.71 Ic1ccccc1NCc2ccncc2 207a_100000210053_100000186114 [0,1,0,0,0,1|2,0,0]=4 2925 B16R2.71 Ic1ccccc1OCc2ccccc2 34a_100000739446_100015291786 [0,1,0,0,0,1|0,0,0]=2 2926 B16R2.71 Ic1ccccc1OCc2ccccc2 7a_100000739446_100000211182 [0,1,0,0,0,1|0,0,0]=2 2927 B16R2.71 Ic1ccccc1OCc2ccccn2 34a_100000739446_100000721315 [0,1,0,0,0,1|1,0,0]=3 2928 B16R2.71 Ic1ccccc1OCc2ccccn2 7a_100000739446_100000721315 [0,1,0,0,0,1|1,0,0]=3 2929 B16R2.71 Ic1ccccc1OCc2cccnc2 34a_100000739446_100000733263 [0,1,0,0,0,1|1,0,0]=3 2930 B16R2.71 Ic1ccccc1OCc2cccnc2 7a_100000739446_100000741622 [0,1,0,0,0,1|1,0,0]=3 2931 B16R2.71 Ic1ccccc1OCc2cccnn2 34a_100000739446_100016990269 [0,1,0,0,0,1|2,0,0]=4 2932 B16R2.71 Ic1ccccc1OCc2cccnn2 7a_100000739446_100016990269 [0,1,0,0,0,1|2,0,0]=4 2933 B16R2.71 Ic1ccccc1OCc2ccncc2 7a_100000739446_100015193705 [0,1,0,0,0,1|1,0,0]=3 2934 B16R2.71 Ic1ccccc1OCc2cnccn2 34a_100000739446_100016995436 [0,1,0,0,0,1|2,0,0]=4 2935 B16R2.71 Ic1ccccc1OCc2cnccn2 7a_100000739446_100016995436 [0,1,0,0,0,1|2,0,0]=4 2936 B16R2.71 Ic1ccccc1OCc2cncnc2 34a_100000739446_100015196519 [0,1,0,0,0,1|2,0,0]=4 2937 B16R2.71 Ic1ccccc1OCc2cncnc2 7a_100000739446_100015196519 [0,1,0,0,0,1|2,0,0]=4 2938 B16R2.71 Ic1ccccc1OCc2ncccn2 34a_100000739446_100000703007 [0,1,0,0,0,1|2,0,0]=4 2939 B16R2.71 Ic1ccccc1OCc2ncccn2 7a_100000739446_100000703007 [0,1,0,0,0,1|2,0,0]=4 2940 B16R2.71 Ic1ccncc1OCc2ccccc2 34a_100000050107_100015291786 [0,1,0,0,0,1|1,0,0]=3 2941 B16R2.71 Ic1ccncc1OCc2ccccn2 34a_100000050107_100000721315 [0,1,0,0,0,1|2,0,0]=4 2942 B16R2.71 Ic1ccncc1OCc2cccnc2 34a_100000050107_100000733263 [0,1,0,0,0,1|2,0,0]=4 2943 B16R2.71 Ic1ncccc1OCc2ccccc2 34a_100000034122_100015291786 [0,1,0,0,0,1|1,0,0]=3 2944 B16R2.71 Ic1ncccc1OCc2ccccc2 7a_100000034122_100000211182 [0,1,0,0,0,1|1,0,0]=3 2945 B16R2.71 Ic1ncccc1OCc2ccccn2 34a_100000034122_100000721315 [0,1,0,0,0,1|2,0,0]=4 2946 B16R2.71 Ic1ncccc1OCc2ccccn2 7a_100000034122_100000721315 [0,1,0,0,0,1|2,0,0]=4 2947 B16R2.71 Ic1ncccc1OCc2cccnc2 34a_100000034122_100000733263 [0,1,0,0,0,1|2,0,0]=4 2948 B16R2.71 Ic1ncccc1OCc2cccnc2 7a_100000034122_100000741622 [0,1,0,0,0,1|2,0,0]=4 2949 B16R2.71 Ic1ncccc1OCc2ccncc2 7a_100000034122_100015193705 [0,1,0,0,0,1|2,0,0]=4 2950 B16R2.71 Nc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000210017 [0,1,0,0,0,1|1,0,0]=3 2951 B16R2.71 Nc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000210017 [0,1,0,0,0,1|1,0,0]=3 2952 B16R2.71 Nc1ccccc1C=Cc2cccnc2 271570a_100102525586_100000210017 [0,1,0,0,0,1|2,0,0]=4 2953 B16R2.71 Nc1ccccc1OCc2ccccc2 34a_100000185747_100015291786 [0,1,0,0,0,1|0,0,0]=2 2954 B16R2.71 Nc1ccccc1OCc2ccccc2 7a_100000185747_100000211182 [0,1,0,0,0,1|0,0,0]=2 2955 B16R2.71 Nc1ccccc1OCc2ccccn2 34a_100000185747_100000721315 [0,1,0,0,0,1|1,0,0]=3 2956 B16R2.71 Nc1ccccc1OCc2ccccn2 7a_100000185747_100000721315 [0,1,0,0,0,1|1,0,0]=3 2957 B16R2.71 Nc1ccccc1OCc2cccnc2 34a_100000185747_100000733263 [0,1,0,0,0,1|1,0,0]=3 2958 B16R2.71 Nc1ccccc1OCc2cccnc2 7a_100000185747_100000741622 [0,1,0,0,0,1|1,0,0]=3 2959 B16R2.71 Nc1ccccc1OCc2cccnn2 34a_100000185747_100016990269 [0,1,0,0,0,1|2,0,0]=4 2960 B16R2.71 Nc1ccccc1OCc2cccnn2 7a_100000185747_100016990269 [0,1,0,0,0,1|2,0,0]=4 2961 B16R2.71 Nc1ccccc1OCc2ccncc2 7a_100000185747_100015193705 [0,1,0,0,0,1|1,0,0]=3 2962 B16R2.71 Nc1ccccc1OCc2cnccn2 34a_100000185747_100016995436 [0,1,0,0,0,1|2,0,0]=4 2963 B16R2.71 Nc1ccccc1OCc2cnccn2 7a_100000185747_100016995436 [0,1,0,0,0,1|2,0,0]=4 2964 B16R2.71 Nc1ccccc1OCc2cncnc2 34a_100000185747_100015196519 [0,1,0,0,0,1|2,0,0]=4 2965 B16R2.71 Nc1ccccc1OCc2cncnc2 7a_100000185747_100015196519 [0,1,0,0,0,1|2,0,0]=4 2966 B16R2.71 Nc1ccccc1OCc2ncccn2 34a_100000185747_100000703007 [0,1,0,0,0,1|2,0,0]=4 2967 B16R2.71 Nc1ccccc1OCc2ncccn2 7a_100000185747_100000703007 [0,1,0,0,0,1|2,0,0]=4 2968 B16R2.71 Nc1ccccc1SCc2ccccc2 62a_100000210017_100015291786 [0,1,0,0,0,1|0,1,0]=3 2969 B16R2.71 Nc1ccccc1SCc2ccccc2 62a_100000211182_100000210017 [0,1,0,0,0,1|0,1,0]=3 2970 B16R2.71 Nc1ccccc1SCc2ccccn2 62a_100000210017_100000721315 [0,1,0,0,0,1|1,1,0]=4 2971 B16R2.71 Nc1ccccc1SCc2ccccn2 62a_100000721315_100000210017 [0,1,0,0,0,1|1,1,0]=4 2972 B16R2.71 Nc1ccccc1SCc2cccnc2 62a_100000210017_100000741622 [0,1,0,0,0,1|1,1,0]=4 2973 B16R2.71 Nc1ccccc1SCc2cccnc2 62a_100000741622_100000210017 [0,1,0,0,0,1|1,1,0]=4 2974 B16R2.71 Nc1ccccc1SCc2ccncc2 62a_100000210017_100015193705 [0,1,0,0,0,1|1,1,0]=4 2975 B16R2.71 Nc1ccccc1SCc2ccncc2 62a_100015193705_100000210017 [0,1,0,0,0,1|1,1,0]=4 2976 B16R2.71 Nc1cccnc1C#Cc2ccccc2 271570a_100000069678_100000688686 [0,1,0,0,0,1|2,0,0]=4 2977 B16R2.71 Nc1cccnc1C=Cc2ccccc2 271570a_100102527694_100000688686 [0,1,0,0,0,1|2,0,0]=4 2978 B16R2.71 Nc1cccnc1OCc2ccccc2 34a_100000746358_100015291786 [0,1,0,0,0,1|1,0,0]=3 2979 B16R2.71 Nc1cccnc1OCc2ccccn2 34a_100000746358_100000721315 [0,1,0,0,0,1|2,0,0]=4 2980 B16R2.71 Nc1cccnc1OCc2cccnc2 34a_100000746358_100000733263 [0,1,0,0,0,1|2,0,0]=4 2981 B16R2.71 Nc1cccnc1SCc2ccccc2 62a_100000211182_100000688686 [0,1,0,0,0,1|1,1,0]=4 2982 B16R2.71 Nc1cccnc1SCc2ccccc2 62a_100000688686_100015291786 [0,1,0,0,0,1|1,1,0]=4 2983 B16R2.71 Nc1ccncc1C#Cc2ccccc2 271570a_100000069678_100000047001 [0,1,0,0,0,1|2,0,0]=4 2984 B16R2.71 Nc1ccncc1C=Cc2ccccc2 271570a_100102527694_100000047001 [0,1,0,0,0,1|2,0,0]=4 2985 B16R2.71 Nc1ccncc1OCc2ccccc2 34a_100000753702_100015291786 [0,1,0,0,0,1|1,0,0]=3 2986 B16R2.71 Nc1ccncc1OCc2ccccn2 34a_100000753702_100000721315 [0,1,0,0,0,1|2,0,0]=4 2987 B16R2.71 Nc1ccncc1OCc2cccnc2 34a_100000753702_100000733263 [0,1,0,0,0,1|2,0,0]=4 2988 B16R2.71 Nc1ccncc1SCc2ccccc2 62a_100000047001_100015291786 [0,1,0,0,0,1|1,1,0]=4 2989 B16R2.71 Nc1ccncc1SCc2ccccc2 62a_100000211182_100000047001 [0,1,0,0,0,1|1,1,0]=4 2990 B16R2.71 Nc1cnccc1C#Cc2ccccc2 271570a_100000069678_100009815883 [0,1,0,0,0,1|2,0,0]=4 2991 B16R2.71 Nc1cnccc1C=Cc2ccccc2 271570a_100102527694_100009815883 [0,1,0,0,0,1|2,0,0]=4 2992 B16R2.71 Nc1cnccc1SCc2ccccc2 62a_100000211182_100000756074 [0,1,0,0,0,1|1,1,0]=4 2993 B16R2.71 Nc1cnccc1SCc2ccccc2 62a_100000756074_100015291786 [0,1,0,0,0,1|1,1,0]=4 2994 B16R2.71 Nc1ncccc1C#Cc2ccccc2 271570a_100000069678_100000045569 [0,1,0,0,0,1|2,0,0]=4 2995 B16R2.71 Nc1ncccc1C=Cc2ccccc2 271570a_100102527694_100000045569 [0,1,0,0,0,1|2,0,0]=4 2996 B16R2.71 Nc1ncccc1OCc2ccccc2 34a_100000211975_100015291786 [0,1,0,0,0,1|1,0,0]=3 2997 B16R2.71 Nc1ncccc1OCc2ccccc2 7a_100000211975_100000211182 [0,1,0,0,0,1|1,0,0]=3 2998 B16R2.71 Nc1ncccc1OCc2ccccn2 34a_100000211975_100000721315 [0,1,0,0,0,1|2,0,0]=4 2999 B16R2.71 Nc1ncccc1OCc2ccccn2 7a_100000211975_100000721315 [0,1,0,0,0,1|2,0,0]=4 3000 B16R2.71 Nc1ncccc1OCc2cccnc2 34a_100000211975_100000733263 [0,1,0,0,0,1|2,0,0]=4 3001 B16R2.71 Nc1ncccc1OCc2cccnc2 7a_100000211975_100000741622 [0,1,0,0,0,1|2,0,0]=4 3002 B16R2.71 Nc1ncccc1OCc2ccncc2 7a_100000211975_100015193705 [0,1,0,0,0,1|2,0,0]=4 3003 B16R2.71 Nc1ncccc1SCc2ccccc2 62a_100000045569_100015291786 [0,1,0,0,0,1|1,1,0]=4 3004 B16R2.71 Nc1ncccc1SCc2ccccc2 62a_100000211182_100000045569 [0,1,0,0,0,1|1,1,0]=4 3005 B16R2.71 Nc1ncncc1OCc2ccccc2 7a_100000112926_100000211182 [0,1,0,0,0,1|2,0,0]=4 3006 B16R2.71 O=c1[nH]cccc1C#Cc2ccccc2 271570a_100000069678_100000050042 [0,1,0,0,0,1|2,0,0]=4 3007 B16R2.71 O=c1[nH]cccc1C=Cc2ccccc2 271570a_100102527694_100000050042 [0,1,0,0,0,1|2,0,0]=4 3008 B16R2.71 O=c1cc[nH]cc1C#Cc2ccccc2 271570a_100000069678_100009998708 [0,1,0,0,0,1|2,0,0]=4 3009 B16R2.71 O=c1cc[nH]cc1C=Cc2ccccc2 271570a_100102527694_100009998708 [0,1,0,0,0,1|2,0,0]=4 3010 B16R2.71 O=c1cc[nH]cc1SCc2ccccc2 62a_100000211182_100009998708 [0,1,0,0,0,1|1,1,0]=4 3011 B16R2.71 O=c1cc[nH]cc1SCc2ccccc2 62a_100009998708_100015291786 [0,1,0,0,0,1|1,1,0]=4 3012 B16R2.71 O=c1ccocc1OCc2ccccc2 34a_100000060831_100015291786 [0,1,0,0,0,1|1,0,0]=3 3013 B16R2.71 O=c1ccocc1OCc2ccccn2 34a_100000060831_100000721315 [0,1,0,0,0,1|2,0,0]=4 3014 B16R2.71 O=c1ccocc1OCc2cccnc2 34a_100000060831_100000733263 [0,1,0,0,0,1|2,0,0]=4 3015 B16R2.71 O=c1occcc1OCc2ccccc2 34a_100000077404_100015291786 [0,1,0,0,0,1|1,0,0]=3 3016 B16R2.71 O=c1occcc1OCc2ccccc2 7a_100000077404_100000211182 [0,1,0,0,0,1|1,0,0]=3 3017 B16R2.71 O=c1occcc1OCc2ccccn2 34a_100000077404_100000721315 [0,1,0,0,0,1|2,0,0]=4 3018 B16R2.71 O=c1occcc1OCc2ccccn2 7a_100000077404_100000721315 [0,1,0,0,0,1|2,0,0]=4 3019 B16R2.71 O=c1occcc1OCc2cccnc2 34a_100000077404_100000733263 [0,1,0,0,0,1|2,0,0]=4 3020 B16R2.71 O=c1occcc1OCc2cccnc2 7a_100000077404_100000741622 [0,1,0,0,0,1|2,0,0]=4 3021 B16R2.71 O=c1occcc1OCc2ccncc2 7a_100000077404_100015193705 [0,1,0,0,0,1|2,0,0]=4 3022 B16R2.71 Oc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000739446 [0,1,0,0,0,1|1,0,0]=3 3023 B16R2.71 Oc1ccccc1C#Cc2ccccc2 271570a_203496583355_100010200916 [0,1,0,0,0,1|1,0,0]=3 3024 B16R2.71 Oc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000739446 [0,1,0,0,0,1|1,0,0]=3 3025 B16R2.71 Oc1ccccc1C=Cc2cccnc2 271570a_100102525586_100000739446 [0,1,0,0,0,1|2,0,0]=4 3026 B16R2.71 Oc1ccccc1CNc2ccccc2 270302a_100000106764_100000185834 [0,1,0,0,0,1|1,0,0]=3 3027 B16R2.71 Oc1ccccc1NCc2ccccc2 34a_100000185747_100015291786 [0,1,0,0,0,1|1,0,0]=3 3028 B16R2.71 Oc1ccccc1NCc2ccccn2 34a_100000185747_100000721315 [0,1,0,0,0,1|2,0,0]=4 3029 B16R2.71 Oc1ccccc1NCc2cccnc2 34a_100000185747_100000733263 [0,1,0,0,0,1|2,0,0]=4 3030 B16R2.71 Oc1ccccc1OCc2ccccc2 271570a_203496583355_100000151716 [0,1,0,0,0,1|0,0,0]=2 3031 B16R2.71 Oc1ccccc1SCc2ccccc2 62a_100000211182_100000739446 [0,1,0,0,0,1|0,1,0]=3 3032 B16R2.71 Oc1ccccc1SCc2ccccc2 62a_100000739446_100015291786 [0,1,0,0,0,1|0,1,0]=3 3033 B16R2.71 Oc1ccccc1SCc2ccccn2 62a_100000721315_100000739446 [0,1,0,0,0,1|1,1,0]=4 3034 B16R2.71 Oc1ccccc1SCc2ccccn2 62a_100000739446_100000721315 [0,1,0,0,0,1|1,1,0]=4 3035 B16R2.71 Oc1ccccc1SCc2cccnc2 62a_100000739446_100000741622 [0,1,0,0,0,1|1,1,0]=4 3036 B16R2.71 Oc1ccccc1SCc2cccnc2 62a_100000741622_100000739446 [0,1,0,0,0,1|1,1,0]=4 3037 B16R2.71 Oc1ccccc1SCc2ccncc2 62a_100000739446_100015193705 [0,1,0,0,0,1|1,1,0]=4 3038 B16R2.71 Oc1ccccc1SCc2ccncc2 62a_100015193705_100000739446 [0,1,0,0,0,1|1,1,0]=4 3039 B16R2.71 Oc1cccnc1C#Cc2ccccc2 271570a_100000069678_100000034122 [0,1,0,0,0,1|2,0,0]=4 3040 B16R2.71 Oc1cccnc1C=Cc2ccccc2 271570a_100102527694_100000034122 [0,1,0,0,0,1|2,0,0]=4 3041 B16R2.71 Oc1cccnc1CNc2ccccc2 34a_100000106764_200020655725 [0,1,0,0,0,1|2,0,0]=4 3042 B16R2.71 Oc1cccnc1COc2ccccc2 34a_100000210340_200020655725 [0,1,0,0,0,1|1,0,0]=3 3043 B16R2.71 Oc1cccnc1COc2ccccc2 7a_100000210340_200020655725 [0,1,0,0,0,1|1,0,0]=3 3044 B16R2.71 Oc1cccnc1COc2cccnc2 34a_100000210849_200020655725 [0,1,0,0,0,1|2,0,0]=4 3045 B16R2.71 Oc1cccnc1COc2cccnc2 7a_100000210849_200020655725 [0,1,0,0,0,1|2,0,0]=4 3046 B16R2.71 Oc1cccnc1COc2ccncc2 34a_100000212176_200020655725 [0,1,0,0,0,1|2,0,0]=4 3047 B16R2.71 Oc1cccnc1CSc2ccccc2 62a_100000719477_200020655725 [0,1,0,0,0,1|1,1,0]=4 3048 B16R2.71 Oc1cccnc1CSc2ccccc2 62a_200020655725_100000041952 [0,1,0,0,0,1|1,1,0]=4 3049 B16R2.71 Oc1cccnc1OCc2ccccc2 271570a_203496583355_200011465151 [0,1,0,0,0,1|1,0,0]=3 3050 B16R2.71 Oc1cccnc1SCc2ccccc2 62a_100000034122_100015291786 [0,1,0,0,0,1|1,1,0]=4 3051 B16R2.71 Oc1cccnc1SCc2ccccc2 62a_100000211182_100000034122 [0,1,0,0,0,1|1,1,0]=4 3052 B16R2.71 Oc1cnccc1C#Cc2ccccc2 271570a_100000069678_100009817591 [0,1,0,0,0,1|2,0,0]=4 3053 B16R2.71 Oc1cnccc1C=Cc2ccccc2 271570a_100102527694_100009817591 [0,1,0,0,0,1|2,0,0]=4 3054 B16R2.71 Oc1cnccc1SCc2ccccc2 62a_100000211182_100009817591 [0,1,0,0,0,1|1,1,0]=4 3055 B16R2.71 Oc1cnccc1SCc2ccccc2 62a_100009817591_100015291786 [0,1,0,0,0,1|1,1,0]=4 3056 B16R2.71 Oc1ncccc1CNc2ccccc2 207a_100000106764_100011998315 [0,1,0,0,0,1|2,0,0]=4 3057 B16R2.71 Oc1ncccc1CNc2ccccc2 270302a_100000106764_100011998315 [0,1,0,0,0,1|2,0,0]=4 3058 B16R2.71 Oc1ncccc1OCc2ccccc2 271570a_203496583355_100011501402 [0,1,0,0,0,1|1,0,0]=3 3059 B16R2.71 Oc1ncccc1SCc2ccccc2 62a_100000211182_100000760158 [0,1,0,0,0,1|1,1,0]=4 3060 B16R2.71 Oc1ncccc1SCc2ccccc2 62a_100000760158_100015291786 [0,1,0,0,0,1|1,1,0]=4 3061 B16R2.71 Oc1ncncc1OCc2ccccc2 271570a_203496583355_100010760880 [0,1,0,0,0,1|2,0,0]=4 3062 B16R2.71 S=c1cc[nH]cc1C#Cc2ccccc2 271570a_100000069678_200012280681 [0,1,0,0,0,1|2,0,0]=4 3063 B16R2.71 S=c1cc[nH]cc1C=Cc2ccccc2 271570a_100102527694_200012280681 [0,1,0,0,0,1|2,0,0]=4 3064 B16R2.71 S=c1cc[nH]cc1SCc2ccccc2 62a_100000211182_200012280681 [0,1,0,0,0,1|1,1,0]=4 3065 B16R2.71 S=c1cc[nH]cc1SCc2ccccc2 62a_200012280681_100015291786 [0,1,0,0,0,1|1,1,0]=4 3066 B16R2.71 [O-][n+]1ccccc1C#Cc2ccccc2 271570a_100000069678_200000042595 [0,1,0,0,0,1|2,0,0]=4 3067 B16R2.71 [O-][n+]1ccccc1C=Cc2ccccc2 271570a_100102527694_200000042595 [0,1,0,0,0,1|2,0,0]=4 3068 B16R2.71 [O-][n+]1ccccc1OCc2ccccc2 7a_100000211761_100000211182 [0,1,0,0,0,1|1,0,0]=3 3069 B16R2.71 [O-][n+]1ccccc1OCc2ccccn2 7a_100000211761_100000721315 [0,1,0,0,0,1|2,0,0]=4 3070 B16R2.71 [O-][n+]1ccccc1OCc2cccnc2 7a_100000211761_100000741622 [0,1,0,0,0,1|2,0,0]=4 3071 B16R2.71 [O-][n+]1ccccc1OCc2ccncc2 7a_100000211761_100015193705 [0,1,0,0,0,1|2,0,0]=4 3072 B16R2.71 [O-][n+]1ccccc1SCc2ccccc2 62a_100000211182_200000042595 [0,1,0,0,0,1|1,1,0]=4 3073 B16R2.88 CC(Cc1ccccc1)c2ccccc2 271570a_100000062452_100000210277 [0,1,0,0,0,1|1,0,0]=3 3074 B16R2.88 CC(Cc1ccccn1)c2ccccc2 271570a_100000062452_100011216584 [0,1,0,0,0,1|2,0,0]=4 3075 B16R2.88 CC(Cc1cccnc1)c2ccccc2 271570a_100000062452_100000752921 [0,1,0,0,0,1|2,0,0]=4 3076 B16R2.88 CC(Cc1ccncc1)c2ccccc2 271570a_100000062452_100000035832 [0,1,0,0,0,1|2,0,0]=4 3077 B16R2.88 CC(Nc1ccccc1)c2ccccc2 34a_100000106764_100000211855 [0,1,0,0,0,1|1,0,0]=3 3078 B16R2.88 CC(Oc1ccccc1)c2ccccc2 34a_100000210340_100000211855 [0,1,0,0,0,1|0,0,0]=2 3079 B16R2.88 CC(Oc1ccccc1)c2ccccc2 7a_100000210340_100000230085 [0,1,0,0,0,1|0,0,0]=2 3080 B16R2.88 CC(Oc1ccccc1)c2cnccn2 7a_100000210340_200000703233 [0,1,0,0,0,1|2,0,0]=4 3081 B16R2.88 CC(Oc1cccnc1)c2ccccc2 34a_100000210849_100000211855 [0,1,0,0,0,1|1,0,0]=3 3082 B16R2.88 CC(Oc1cccnc1)c2ccccc2 7a_100000210849_100000230085 [0,1,0,0,0,1|1,0,0]=3 3083 B16R2.88 CC(Oc1ccncc1)c2ccccc2 34a_100000212176_100000211855 [0,1,0,0,0,1|1,0,0]=3 3084 B16R2.88 CC(Oc1ccnnc1)c2ccccc2 34a_100015204005_100000211855 [0,1,0,0,0,1|2,0,0]=4 3085 B16R2.88 CC(Oc1cncnc1)c2ccccc2 7a_100000754086_100000230085 [0,1,0,0,0,1|2,0,0]=4 3086 B16R2.88 CC(Sc1ccccc1)c2ccccc2 62a_100000230085_100000041952 [0,1,0,0,0,1|0,1,0]=3 3087 B16R2.88 CC(Sc1ccccc1)c2ccccc2 62a_100000719477_100000230085 [0,1,0,0,0,1|0,1,0]=3 3088 B16R2.88 CC(Sc1ccccn1)c2ccccc2 62a_100000230085_100011216584 [0,1,0,0,0,1|1,1,0]=4 3089 B16R2.88 CC(Sc1ccccn1)c2ccccc2 62a_100011216584_100000230085 [0,1,0,0,0,1|1,1,0]=4 3090 B16R2.88 CC(Sc1cccnc1)c2ccccc2 62a_100000210063_100000230085 [0,1,0,0,0,1|1,1,0]=4 3091 B16R2.88 CC(Sc1cccnc1)c2ccccc2 62a_100000230085_100000210063 [0,1,0,0,0,1|1,1,0]=4 3092 B16R2.88 CC(Sc1ccncc1)c2ccccc2 62a_100000230085_100000728582 [0,1,0,0,0,1|1,1,0]=4 3093 B16R2.88 CC(Sc1ccncc1)c2ccccc2 62a_100000728582_100000230085 [0,1,0,0,0,1|1,1,0]=4 3094 B16R2.88 CN(Cc1ccccc1)c2ccccc2 2230a_100000188819_200000210301 [0,1,0,0,0,1|1,0,0]=3 3095 B16R2.88 CN(Cc1ccccc1)c2ccccc2 2230a_100000210012_100015291786 [0,1,0,0,0,1|1,0,0]=3 3096 B16R2.88 CN(Cc1ccccc1)c2ccccc2 269982a_100000188819_200000210301 [0,1,0,0,0,1|1,0,0]=3 3097 B16R2.88 CN(Cc1ccccc1)c2ccccc2 269982a_100000210012_100000211182 [0,1,0,0,0,1|1,0,0]=3 3098 B16R2.88 CN(Cc1ccccc1)c2ccccc2 34a_100000188819_200000210301 [0,1,0,0,0,1|1,0,0]=3 3099 B16R2.88 CN(Cc1ccccc1)c2ccccc2 34a_100000210012_100015291786 [0,1,0,0,0,1|1,0,0]=3 3100 B16R2.88 CN(Cc1ccccn1)c2ccccc2 2230a_100000210012_100000721315 [0,1,0,0,0,1|2,0,0]=4 3101 B16R2.88 CN(Cc1ccccn1)c2ccccc2 269982a_100000210012_100000721315 [0,1,0,0,0,1|2,0,0]=4 3102 B16R2.88 CN(Cc1ccccn1)c2ccccc2 34a_100000210012_100000721315 [0,1,0,0,0,1|2,0,0]=4 3103 B16R2.88 CN(Cc1cccnc1)c2ccccc2 2230a_100000210012_100000741622 [0,1,0,0,0,1|2,0,0]=4 3104 B16R2.88 CN(Cc1cccnc1)c2ccccc2 269982a_100000210012_100000733263 [0,1,0,0,0,1|2,0,0]=4 3105 B16R2.88 CN(Cc1cccnc1)c2ccccc2 34a_100000210012_100000733263 [0,1,0,0,0,1|2,0,0]=4 3106 B16R2.88 CN(Cc1ccncc1)c2ccccc2 2230a_100000210012_100015193705 [0,1,0,0,0,1|2,0,0]=4 3107 B16R2.88 CN(Cc1ccncc1)c2ccccc2 269982a_100000210012_100015193705 [0,1,0,0,0,1|2,0,0]=4 3108 B16R2.88 O=C(Cc1ccccc1)c2ccccc2 1458a_100000185807_100015291786 [0,1,0,0,0,1|1,0,0]=3 3109 B16R2.88 O=C(Cc1ccccn1)c2ccccc2 1458a_100000185807_100000721315 [0,1,0,0,0,1|2,0,0]=4 3110 B16R2.88 O=C(Cc1cccnc1)c2ccccc2 1458a_100000185807_100000733263 [0,1,0,0,0,1|2,0,0]=4 3111 B16R2.88 O=C(Cc1ccncc1)c2ccccc2 1458a_100000185807_100000705612 [0,1,0,0,0,1|2,0,0]=4 3112 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 11a_100000106764_100000185807 [0,1,0,0,0,1|1,0,0]=3 3113 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 1626a_100000106764_100000185807 [0,1,0,0,0,1|1,0,0]=3 3114 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 22a_100000106764_100000185807 [0,1,0,0,0,1|1,0,0]=3 3115 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 527a_100000106764_100000185807 [0,1,0,0,0,1|1,0,0]=3 3116 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 2230a_100000188819_200025704644 [0,1,0,0,0,1|1,0,0]=3 3117 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 269982a_100000188819_200025704644 [0,1,0,0,0,1|1,0,0]=3 3118 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 34a_100000188819_200025704644 [0,1,0,0,0,1|1,0,0]=3 3119 B16R2.132 Brc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000752885 [0,1,0,0,0,1|1,0,0]=3 3120 B16R2.132 Brc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000752885 [0,1,0,0,0,1|1,0,0]=3 3121 B16R2.132 Brc1ccc(cc1)C=Cc2ccccc2 271570a_100102527914_100000210277 [0,1,0,0,0,1|1,0,0]=3 3122 B16R2.132 Brc1ccc(cc1)C=Cc2ccccn2 271570a_100102527914_100011216584 [0,1,0,0,0,1|2,0,0]=4 3123 B16R2.132 Brc1ccc(cc1)C=Cc2cccnc2 271570a_100102525586_100000752885 [0,1,0,0,0,1|2,0,0]=4 3124 B16R2.132 Brc1ccc(cc1)C=Cc2cccnc2 271570a_100102527914_100000752921 [0,1,0,0,0,1|2,0,0]=4 3125 B16R2.132 Brc1ccc(cc1)C=Cc2ccncc2 271570a_100102527914_100000035832 [0,1,0,0,0,1|2,0,0]=4 3126 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000186029 [0,1,0,0,0,1|1,0,0]=3 3127 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000186029 [0,1,0,0,0,1|1,0,0]=3 3128 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000189115 [0,1,0,0,0,1|1,0,0]=3 3129 B16R2.132 Brc1ccc(cc1)COc2ccccc2 34a_100000210340_100000189115 [0,1,0,0,0,1|0,0,0]=2 3130 B16R2.132 Brc1ccc(cc1)COc2ccccc2 7a_100000210340_100011217064 [0,1,0,0,0,1|0,0,0]=2 3131 B16R2.132 Brc1ccc(cc1)COc2cccnc2 34a_100000210849_100000189115 [0,1,0,0,0,1|1,0,0]=3 3132 B16R2.132 Brc1ccc(cc1)COc2cccnc2 7a_100000210849_100011217064 [0,1,0,0,0,1|1,0,0]=3 3133 B16R2.132 Brc1ccc(cc1)COc2ccncc2 34a_100000212176_100000189115 [0,1,0,0,0,1|1,0,0]=3 3134 B16R2.132 Brc1ccc(cc1)COc2ccnnc2 34a_100015204005_100000189115 [0,1,0,0,0,1|2,0,0]=4 3135 B16R2.132 Brc1ccc(cc1)COc2cncnc2 7a_100000754086_100011217064 [0,1,0,0,0,1|2,0,0]=4 3136 B16R2.132 Brc1ccc(cc1)CSc2ccccc2 62a_100000189115_100000041952 [0,1,0,0,0,1|0,1,0]=3 3137 B16R2.132 Brc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000189115 [0,1,0,0,0,1|0,1,0]=3 3138 B16R2.132 Brc1ccc(cc1)CSc2ccccn2 62a_100000189115_100011216584 [0,1,0,0,0,1|1,1,0]=4 3139 B16R2.132 Brc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000189115 [0,1,0,0,0,1|1,1,0]=4 3140 B16R2.132 Brc1ccc(cc1)CSc2cccnc2 62a_100000189115_100000210063 [0,1,0,0,0,1|1,1,0]=4 3141 B16R2.132 Brc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000189115 [0,1,0,0,0,1|1,1,0]=4 3142 B16R2.132 Brc1ccc(cc1)CSc2ccncc2 62a_100000189115_100000728582 [0,1,0,0,0,1|1,1,0]=4 3143 B16R2.132 Brc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000189115 [0,1,0,0,0,1|1,1,0]=4 3144 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 207a_100000210018_100015611070 [0,1,0,0,0,1|1,0,0]=3 3145 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 2230a_100000210018_100015291786 [0,1,0,0,0,1|1,0,0]=3 3146 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 270302a_100000210018_100015611070 [0,1,0,0,0,1|1,0,0]=3 3147 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 34a_100000210018_100015291786 [0,1,0,0,0,1|1,0,0]=3 3148 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 207a_100000210018_100000209966 [0,1,0,0,0,1|2,0,0]=4 3149 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 2230a_100000210018_100000721315 [0,1,0,0,0,1|2,0,0]=4 3150 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 270302a_100000210018_100000209966 [0,1,0,0,0,1|2,0,0]=4 3151 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 34a_100000210018_100000721315 [0,1,0,0,0,1|2,0,0]=4 3152 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 207a_100000210018_100000209961 [0,1,0,0,0,1|2,0,0]=4 3153 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 2230a_100000210018_100000741622 [0,1,0,0,0,1|2,0,0]=4 3154 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 270302a_100000210018_100000209961 [0,1,0,0,0,1|2,0,0]=4 3155 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 34a_100000210018_100000733263 [0,1,0,0,0,1|2,0,0]=4 3156 B16R2.132 Brc1ccc(cc1)NCc2ccncc2 207a_100000210018_100000186114 [0,1,0,0,0,1|2,0,0]=4 3157 B16R2.132 Brc1ccc(cc1)NCc2ccncc2 2230a_100000210018_100015193705 [0,1,0,0,0,1|2,0,0]=4 3158 B16R2.132 Brc1ccc(cc1)OCc2ccccc2 34a_100000185759_100015291786 [0,1,0,0,0,1|0,0,0]=2 3159 B16R2.132 Brc1ccc(cc1)OCc2ccccc2 7a_100000185759_100000211182 [0,1,0,0,0,1|0,0,0]=2 3160 B16R2.132 Brc1ccc(cc1)OCc2ccccn2 34a_100000185759_100000721315 [0,1,0,0,0,1|1,0,0]=3 3161 B16R2.132 Brc1ccc(cc1)OCc2ccccn2 7a_100000185759_100000721315 [0,1,0,0,0,1|1,0,0]=3 3162 B16R2.132 Brc1ccc(cc1)OCc2cccnc2 34a_100000185759_100000733263 [0,1,0,0,0,1|1,0,0]=3 3163 B16R2.132 Brc1ccc(cc1)OCc2cccnc2 7a_100000185759_100000741622 [0,1,0,0,0,1|1,0,0]=3 3164 B16R2.132 Brc1ccc(cc1)OCc2cccnn2 34a_100000185759_100016990269 [0,1,0,0,0,1|2,0,0]=4 3165 B16R2.132 Brc1ccc(cc1)OCc2cccnn2 7a_100000185759_100016990269 [0,1,0,0,0,1|2,0,0]=4 3166 B16R2.132 Brc1ccc(cc1)OCc2ccncc2 7a_100000185759_100015193705 [0,1,0,0,0,1|1,0,0]=3 3167 B16R2.132 Brc1ccc(cc1)OCc2cnccn2 34a_100000185759_100016995436 [0,1,0,0,0,1|2,0,0]=4 3168 B16R2.132 Brc1ccc(cc1)OCc2cnccn2 7a_100000185759_100016995436 [0,1,0,0,0,1|2,0,0]=4 3169 B16R2.132 Brc1ccc(cc1)OCc2cncnc2 34a_100000185759_100015196519 [0,1,0,0,0,1|2,0,0]=4 3170 B16R2.132 Brc1ccc(cc1)OCc2cncnc2 7a_100000185759_100015196519 [0,1,0,0,0,1|2,0,0]=4 3171 B16R2.132 Brc1ccc(cc1)OCc2ncccn2 34a_100000185759_100000703007 [0,1,0,0,0,1|2,0,0]=4 3172 B16R2.132 Brc1ccc(cc1)OCc2ncccn2 7a_100000185759_100000703007 [0,1,0,0,0,1|2,0,0]=4 3173 B16R2.132 Brc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000752885 [0,1,0,0,0,1|0,1,0]=3 3174 B16R2.132 Brc1ccc(cc1)SCc2ccccc2 62a_100000752885_100015291786 [0,1,0,0,0,1|0,1,0]=3 3175 B16R2.132 Brc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000752885 [0,1,0,0,0,1|1,1,0]=4 3176 B16R2.132 Brc1ccc(cc1)SCc2ccccn2 62a_100000752885_100000721315 [0,1,0,0,0,1|1,1,0]=4 3177 B16R2.132 Brc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000752885 [0,1,0,0,0,1|1,1,0]=4 3178 B16R2.132 Brc1ccc(cc1)SCc2cccnc2 62a_100000752885_100000741622 [0,1,0,0,0,1|1,1,0]=4 3179 B16R2.132 Brc1ccc(cc1)SCc2ccncc2 62a_100000752885_100015193705 [0,1,0,0,0,1|1,1,0]=4 3180 B16R2.132 Brc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000752885 [0,1,0,0,0,1|1,1,0]=4 3181 B16R2.132 Brc1ccc(cn1)C#Cc2ccccc2 271570a_100000069678_100009814638 [0,1,0,0,0,1|2,0,0]=4 3182 B16R2.132 Brc1ccc(cn1)C=Cc2ccccc2 271570a_100102527694_100009814638 [0,1,0,0,0,1|2,0,0]=4 3183 B16R2.132 Brc1ccc(cn1)CNc2ccccc2 34a_100000106764_100009831999 [0,1,0,0,0,1|2,0,0]=4 3184 B16R2.132 Brc1ccc(cn1)COc2ccccc2 34a_100000210340_100009831999 [0,1,0,0,0,1|1,0,0]=3 3185 B16R2.132 Brc1ccc(cn1)COc2ccccc2 7a_100000210340_100009831999 [0,1,0,0,0,1|1,0,0]=3 3186 B16R2.132 Brc1ccc(cn1)COc2cccnc2 34a_100000210849_100009831999 [0,1,0,0,0,1|2,0,0]=4 3187 B16R2.132 Brc1ccc(cn1)COc2cccnc2 7a_100000210849_100009831999 [0,1,0,0,0,1|2,0,0]=4 3188 B16R2.132 Brc1ccc(cn1)COc2ccncc2 34a_100000212176_100009831999 [0,1,0,0,0,1|2,0,0]=4 3189 B16R2.132 Brc1ccc(cn1)CSc2ccccc2 62a_100000719477_100009831999 [0,1,0,0,0,1|1,1,0]=4 3190 B16R2.132 Brc1ccc(cn1)CSc2ccccc2 62a_100009831999_100000041952 [0,1,0,0,0,1|1,1,0]=4 3191 B16R2.132 Brc1ccc(cn1)OCc2ccccc2 34a_100000685995_100015291786 [0,1,0,0,0,1|1,0,0]=3 3192 B16R2.132 Brc1ccc(cn1)OCc2ccccc2 7a_100000685995_100000211182 [0,1,0,0,0,1|1,0,0]=3 3193 B16R2.132 Brc1ccc(cn1)OCc2ccccn2 34a_100000685995_100000721315 [0,1,0,0,0,1|2,0,0]=4 3194 B16R2.132 Brc1ccc(cn1)OCc2ccccn2 7a_100000685995_100000721315 [0,1,0,0,0,1|2,0,0]=4 3195 B16R2.132 Brc1ccc(cn1)OCc2cccnc2 34a_100000685995_100000733263 [0,1,0,0,0,1|2,0,0]=4 3196 B16R2.132 Brc1ccc(cn1)OCc2cccnc2 7a_100000685995_100000741622 [0,1,0,0,0,1|2,0,0]=4 3197 B16R2.132 Brc1ccc(cn1)OCc2ccncc2 7a_100000685995_100015193705 [0,1,0,0,0,1|2,0,0]=4 3198 B16R2.132 Brc1ccc(cn1)SCc2ccccc2 62a_100000211182_100009814638 [0,1,0,0,0,1|1,1,0]=4 3199 B16R2.132 Brc1ccc(cn1)SCc2ccccc2 62a_100009814638_100015291786 [0,1,0,0,0,1|1,1,0]=4 3200 B16R2.132 Brc1ccc(nc1)C#Cc2ccccc2 271570a_100000069678_100000686858 [0,1,0,0,0,1|2,0,0]=4 3201 B16R2.132 Brc1ccc(nc1)C=Cc2ccccc2 271570a_100102527694_100000686858 [0,1,0,0,0,1|2,0,0]=4 3202 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000754260 [0,1,0,0,0,1|2,0,0]=4 3203 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 270302a_100000106764_100000754260 [0,1,0,0,0,1|2,0,0]=4 3204 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000702658 [0,1,0,0,0,1|2,0,0]=4 3205 B16R2.132 Brc1ccc(nc1)COc2ccccc2 34a_100000210340_100000702658 [0,1,0,0,0,1|1,0,0]=3 3206 B16R2.132 Brc1ccc(nc1)COc2ccccc2 7a_100000210340_100000702658 [0,1,0,0,0,1|1,0,0]=3 3207 B16R2.132 Brc1ccc(nc1)COc2cccnc2 34a_100000210849_100000702658 [0,1,0,0,0,1|2,0,0]=4 3208 B16R2.132 Brc1ccc(nc1)COc2cccnc2 7a_100000210849_100000702658 [0,1,0,0,0,1|2,0,0]=4 3209 B16R2.132 Brc1ccc(nc1)COc2ccncc2 34a_100000212176_100000702658 [0,1,0,0,0,1|2,0,0]=4 3210 B16R2.132 Brc1ccc(nc1)CSc2ccccc2 62a_100000702658_100000041952 [0,1,0,0,0,1|1,1,0]=4 3211 B16R2.132 Brc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000702658 [0,1,0,0,0,1|1,1,0]=4 3212 B16R2.132 Brc1ccc(nc1)NCc2ccccc2 27a_100015324214_100000686858 [0,1,0,0,0,1|2,0,0]=4 3213 B16R2.132 Brc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000686858 [0,1,0,0,0,1|1,1,0]=4 3214 B16R2.132 Brc1ccc(nc1)SCc2ccccc2 62a_100000686858_100015291786 [0,1,0,0,0,1|1,1,0]=4 3215 B16R2.132 Brc1cnc(cn1)OCc2ccccc2 34a_100011934580_100015291786 [0,1,0,0,0,1|2,0,0]=4 3216 B16R2.132 Brc1cnc(nc1)COc2ccccc2 34a_100000210340_100010064664 [0,1,0,0,0,1|2,0,0]=4 3217 B16R2.132 Brc1cnc(nc1)COc2ccccc2 7a_100000210340_100010064664 [0,1,0,0,0,1|2,0,0]=4 3218 B16R2.132 Brc1ncc(cn1)OCc2ccccc2 34a_100000730009_100015291786 [0,1,0,0,0,1|2,0,0]=4 3219 B16R2.132 Brc1ncc(cn1)OCc2ccccc2 7a_100000730009_100000211182 [0,1,0,0,0,1|2,0,0]=4 3220 B16R2.132 Cc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000186775 [0,1,0,0,0,1|1,0,0]=3 3221 B16R2.132 Cc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000186775 [0,1,0,0,0,1|1,0,0]=3 3222 B16R2.132 Cc1ccc(cc1)C=Cc2ccccc2 271570a_100102527916_100000210277 [0,1,0,0,0,1|1,0,0]=3 3223 B16R2.132 Cc1ccc(cc1)C=Cc2ccccn2 271570a_100102527916_100011216584 [0,1,0,0,0,1|2,0,0]=4 3224 B16R2.132 Cc1ccc(cc1)C=Cc2cccnc2 271570a_100102525586_100000186775 [0,1,0,0,0,1|2,0,0]=4 3225 B16R2.132 Cc1ccc(cc1)C=Cc2cccnc2 271570a_100102527916_100000752921 [0,1,0,0,0,1|2,0,0]=4 3226 B16R2.132 Cc1ccc(cc1)C=Cc2ccncc2 271570a_100102527916_100000035832 [0,1,0,0,0,1|2,0,0]=4 3227 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000211033 [0,1,0,0,0,1|1,0,0]=3 3228 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000211033 [0,1,0,0,0,1|1,0,0]=3 3229 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000210814 [0,1,0,0,0,1|1,0,0]=3 3230 B16R2.132 Cc1ccc(cc1)COc2ccccc2 34a_100000210340_100000210814 [0,1,0,0,0,1|0,0,0]=2 3231 B16R2.132 Cc1ccc(cc1)COc2ccccc2 7a_100000210340_100000210814 [0,1,0,0,0,1|0,0,0]=2 3232 B16R2.132 Cc1ccc(cc1)COc2cccnc2 34a_100000210849_100000210814 [0,1,0,0,0,1|1,0,0]=3 3233 B16R2.132 Cc1ccc(cc1)COc2cccnc2 7a_100000210849_100000210814 [0,1,0,0,0,1|1,0,0]=3 3234 B16R2.132 Cc1ccc(cc1)COc2ccncc2 34a_100000212176_100000210814 [0,1,0,0,0,1|1,0,0]=3 3235 B16R2.132 Cc1ccc(cc1)COc2ccnnc2 34a_100015204005_100000210814 [0,1,0,0,0,1|2,0,0]=4 3236 B16R2.132 Cc1ccc(cc1)COc2cncnc2 7a_100000754086_100000210814 [0,1,0,0,0,1|2,0,0]=4 3237 B16R2.132 Cc1ccc(cc1)CSc2ccccc2 62a_100000210814_100000041952 [0,1,0,0,0,1|0,1,0]=3 3238 B16R2.132 Cc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000210814 [0,1,0,0,0,1|0,1,0]=3 3239 B16R2.132 Cc1ccc(cc1)CSc2ccccn2 62a_100000210814_100011216584 [0,1,0,0,0,1|1,1,0]=4 3240 B16R2.132 Cc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000210814 [0,1,0,0,0,1|1,1,0]=4 3241 B16R2.132 Cc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000210814 [0,1,0,0,0,1|1,1,0]=4 3242 B16R2.132 Cc1ccc(cc1)CSc2cccnc2 62a_100000210814_100000210063 [0,1,0,0,0,1|1,1,0]=4 3243 B16R2.132 Cc1ccc(cc1)CSc2ccncc2 62a_100000210814_100000728582 [0,1,0,0,0,1|1,1,0]=4 3244 B16R2.132 Cc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000210814 [0,1,0,0,0,1|1,1,0]=4 3245 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 207a_100000124888_100015611070 [0,1,0,0,0,1|1,0,0]=3 3246 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 270302a_100000124888_100015611070 [0,1,0,0,0,1|1,0,0]=3 3247 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 34a_100000124888_100015291786 [0,1,0,0,0,1|1,0,0]=3 3248 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 207a_100000124888_100000209966 [0,1,0,0,0,1|2,0,0]=4 3249 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 270302a_100000124888_100000209966 [0,1,0,0,0,1|2,0,0]=4 3250 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 34a_100000124888_100000721315 [0,1,0,0,0,1|2,0,0]=4 3251 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 207a_100000124888_100000209961 [0,1,0,0,0,1|2,0,0]=4 3252 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 270302a_100000124888_100000209961 [0,1,0,0,0,1|2,0,0]=4 3253 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 34a_100000124888_100000733263 [0,1,0,0,0,1|2,0,0]=4 3254 B16R2.132 Cc1ccc(cc1)NCc2ccncc2 207a_100000124888_100000186114 [0,1,0,0,0,1|2,0,0]=4 3255 B16R2.132 Cc1ccc(cc1)OCc2ccccc2 34a_100000210336_100015291786 [0,1,0,0,0,1|0,0,0]=2 3256 B16R2.132 Cc1ccc(cc1)OCc2ccccc2 7a_100000210336_100000211182 [0,1,0,0,0,1|0,0,0]=2 3257 B16R2.132 Cc1ccc(cc1)OCc2ccccn2 34a_100000210336_100000721315 [0,1,0,0,0,1|1,0,0]=3 3258 B16R2.132 Cc1ccc(cc1)OCc2ccccn2 7a_100000210336_100000721315 [0,1,0,0,0,1|1,0,0]=3 3259 B16R2.132 Cc1ccc(cc1)OCc2cccnc2 34a_100000210336_100000733263 [0,1,0,0,0,1|1,0,0]=3 3260 B16R2.132 Cc1ccc(cc1)OCc2cccnc2 7a_100000210336_100000741622 [0,1,0,0,0,1|1,0,0]=3 3261 B16R2.132 Cc1ccc(cc1)OCc2cccnn2 34a_100000210336_100016990269 [0,1,0,0,0,1|2,0,0]=4 3262 B16R2.132 Cc1ccc(cc1)OCc2cccnn2 7a_100000210336_100016990269 [0,1,0,0,0,1|2,0,0]=4 3263 B16R2.132 Cc1ccc(cc1)OCc2ccncc2 7a_100000210336_100015193705 [0,1,0,0,0,1|1,0,0]=3 3264 B16R2.132 Cc1ccc(cc1)OCc2cnccn2 34a_100000210336_100016995436 [0,1,0,0,0,1|2,0,0]=4 3265 B16R2.132 Cc1ccc(cc1)OCc2cnccn2 7a_100000210336_100016995436 [0,1,0,0,0,1|2,0,0]=4 3266 B16R2.132 Cc1ccc(cc1)OCc2cncnc2 34a_100000210336_100015196519 [0,1,0,0,0,1|2,0,0]=4 3267 B16R2.132 Cc1ccc(cc1)OCc2cncnc2 7a_100000210336_100015196519 [0,1,0,0,0,1|2,0,0]=4 3268 B16R2.132 Cc1ccc(cc1)OCc2ncccn2 34a_100000210336_100000703007 [0,1,0,0,0,1|2,0,0]=4 3269 B16R2.132 Cc1ccc(cc1)OCc2ncccn2 7a_100000210336_100000703007 [0,1,0,0,0,1|2,0,0]=4 3270 B16R2.132 Cc1ccc(cc1)SCc2ccccc2 62a_100000186775_100015291786 [0,1,0,0,0,1|0,1,0]=3 3271 B16R2.132 Cc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000186775 [0,1,0,0,0,1|0,1,0]=3 3272 B16R2.132 Cc1ccc(cc1)SCc2ccccn2 62a_100000186775_100000721315 [0,1,0,0,0,1|1,1,0]=4 3273 B16R2.132 Cc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000186775 [0,1,0,0,0,1|1,1,0]=4 3274 B16R2.132 Cc1ccc(cc1)SCc2cccnc2 62a_100000186775_100000741622 [0,1,0,0,0,1|1,1,0]=4 3275 B16R2.132 Cc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000186775 [0,1,0,0,0,1|1,1,0]=4 3276 B16R2.132 Cc1ccc(cc1)SCc2ccncc2 62a_100000186775_100015193705 [0,1,0,0,0,1|1,1,0]=4 3277 B16R2.132 Cc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000186775 [0,1,0,0,0,1|1,1,0]=4 3278 B16R2.132 Cc1ccc(cn1)C#Cc2ccccc2 271570a_100000069678_100000751577 [0,1,0,0,0,1|2,0,0]=4 3279 B16R2.132 Cc1ccc(cn1)C=Cc2ccccc2 271570a_100102527694_100000751577 [0,1,0,0,0,1|2,0,0]=4 3280 B16R2.132 Cc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000743784 [0,1,0,0,0,1|2,0,0]=4 3281 B16R2.132 Cc1ccc(cn1)CNc2ccccc2 34a_100000106764_100016987292 [0,1,0,0,0,1|2,0,0]=4 3282 B16R2.132 Cc1ccc(cn1)COc2ccccc2 34a_100000210340_100016987292 [0,1,0,0,0,1|1,0,0]=3 3283 B16R2.132 Cc1ccc(cn1)COc2ccccc2 7a_100000210340_100016987292 [0,1,0,0,0,1|1,0,0]=3 3284 B16R2.132 Cc1ccc(cn1)COc2cccnc2 34a_100000210849_100016987292 [0,1,0,0,0,1|2,0,0]=4 3285 B16R2.132 Cc1ccc(cn1)COc2cccnc2 7a_100000210849_100016987292 [0,1,0,0,0,1|2,0,0]=4 3286 B16R2.132 Cc1ccc(cn1)COc2ccncc2 34a_100000212176_100016987292 [0,1,0,0,0,1|2,0,0]=4 3287 B16R2.132 Cc1ccc(cn1)CSc2ccccc2 62a_100000719477_100016987292 [0,1,0,0,0,1|1,1,0]=4 3288 B16R2.132 Cc1ccc(cn1)CSc2ccccc2 62a_100016987292_100000041952 [0,1,0,0,0,1|1,1,0]=4 3289 B16R2.132 Cc1ccc(cn1)OCc2ccccc2 34a_100000745506_100015291786 [0,1,0,0,0,1|1,0,0]=3 3290 B16R2.132 Cc1ccc(cn1)OCc2ccccc2 7a_100000745506_100000211182 [0,1,0,0,0,1|1,0,0]=3 3291 B16R2.132 Cc1ccc(cn1)OCc2ccccn2 34a_100000745506_100000721315 [0,1,0,0,0,1|2,0,0]=4 3292 B16R2.132 Cc1ccc(cn1)OCc2ccccn2 7a_100000745506_100000721315 [0,1,0,0,0,1|2,0,0]=4 3293 B16R2.132 Cc1ccc(cn1)OCc2cccnc2 34a_100000745506_100000733263 [0,1,0,0,0,1|2,0,0]=4 3294 B16R2.132 Cc1ccc(cn1)OCc2cccnc2 7a_100000745506_100000741622 [0,1,0,0,0,1|2,0,0]=4 3295 B16R2.132 Cc1ccc(cn1)OCc2ccncc2 7a_100000745506_100015193705 [0,1,0,0,0,1|2,0,0]=4 3296 B16R2.132 Cc1ccc(cn1)SCc2ccccc2 62a_100000211182_100000751577 [0,1,0,0,0,1|1,1,0]=4 3297 B16R2.132 Cc1ccc(cn1)SCc2ccccc2 62a_100000751577_100015291786 [0,1,0,0,0,1|1,1,0]=4 3298 B16R2.132 Cc1ccc(nc1)C#Cc2ccccc2 271570a_100000069678_100000754016 [0,1,0,0,0,1|2,0,0]=4 3299 B16R2.132 Cc1ccc(nc1)C=Cc2ccccc2 271570a_100102527694_100000754016 [0,1,0,0,0,1|2,0,0]=4 3300 B16R2.132 Cc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000050478 [0,1,0,0,0,1|2,0,0]=4 3301 B16R2.132 Cc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000691093 [0,1,0,0,0,1|2,0,0]=4 3302 B16R2.132 Cc1ccc(nc1)COc2ccccc2 34a_100000210340_100000691093 [0,1,0,0,0,1|1,0,0]=3 3303 B16R2.132 Cc1ccc(nc1)COc2ccccc2 7a_100000210340_100000691093 [0,1,0,0,0,1|1,0,0]=3 3304 B16R2.132 Cc1ccc(nc1)COc2cccnc2 34a_100000210849_100000691093 [0,1,0,0,0,1|2,0,0]=4 3305 B16R2.132 Cc1ccc(nc1)COc2cccnc2 7a_100000210849_100000691093 [0,1,0,0,0,1|2,0,0]=4 3306 B16R2.132 Cc1ccc(nc1)COc2ccncc2 34a_100000212176_100000691093 [0,1,0,0,0,1|2,0,0]=4 3307 B16R2.132 Cc1ccc(nc1)CSc2ccccc2 62a_100000691093_100000041952 [0,1,0,0,0,1|1,1,0]=4 3308 B16R2.132 Cc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000691093 [0,1,0,0,0,1|1,1,0]=4 3309 B16R2.132 Cc1ccc(nc1)OCc2ccccc2 34a_100000759353_100015291786 [0,1,0,0,0,1|1,0,0]=3 3310 B16R2.132 Cc1ccc(nc1)OCc2ccccn2 34a_100000759353_100000721315 [0,1,0,0,0,1|2,0,0]=4 3311 B16R2.132 Cc1ccc(nc1)OCc2cccnc2 34a_100000759353_100000733263 [0,1,0,0,0,1|2,0,0]=4 3312 B16R2.132 Cc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000754016 [0,1,0,0,0,1|1,1,0]=4 3313 B16R2.132 Cc1ccc(nc1)SCc2ccccc2 62a_100011192072_100015291786 [0,1,0,0,0,1|1,1,0]=4 3314 B16R2.132 Cc1cnc(cn1)COc2ccccc2 7a_100000210340_100000752025 [0,1,0,0,0,1|2,0,0]=4 3315 B16R2.132 Cc1cnc(nc1)COc2ccccc2 34a_100000210340_100000685645 [0,1,0,0,0,1|2,0,0]=4 3316 B16R2.132 Cc1cnc(nc1)COc2ccccc2 7a_100000210340_100000685645 [0,1,0,0,0,1|2,0,0]=4 3317 B16R2.132 Cc1ncc(cn1)OCc2ccccc2 34a_100000062939_100015291786 [0,1,0,0,0,1|2,0,0]=4 3318 B16R2.132 Cc1ncc(cn1)OCc2ccccc2 7a_100000062939_100000211182 [0,1,0,0,0,1|2,0,0]=4 3319 B16R2.132 Clc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000755918 [0,1,0,0,0,1|1,0,0]=3 3320 B16R2.132 Clc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000755918 [0,1,0,0,0,1|1,0,0]=3 3321 B16R2.132 Clc1ccc(cc1)C=Cc2ccccc2 271570a_100102527930_100000210277 [0,1,0,0,0,1|1,0,0]=3 3322 B16R2.132 Clc1ccc(cc1)C=Cc2ccccn2 271570a_100102527930_100011216584 [0,1,0,0,0,1|2,0,0]=4 3323 B16R2.132 Clc1ccc(cc1)C=Cc2cccnc2 271570a_100102525586_100000755918 [0,1,0,0,0,1|2,0,0]=4 3324 B16R2.132 Clc1ccc(cc1)C=Cc2cccnc2 271570a_100102527930_100000752921 [0,1,0,0,0,1|2,0,0]=4 3325 B16R2.132 Clc1ccc(cc1)C=Cc2ccncc2 271570a_100102527930_100000035832 [0,1,0,0,0,1|2,0,0]=4 3326 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000189385 [0,1,0,0,0,1|1,0,0]=3 3327 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000189385 [0,1,0,0,0,1|1,0,0]=3 3328 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000694040 [0,1,0,0,0,1|1,0,0]=3 3329 B16R2.132 Clc1ccc(cc1)COc2ccccc2 34a_100000210340_100000694040 [0,1,0,0,0,1|0,0,0]=2 3330 B16R2.132 Clc1ccc(cc1)COc2ccccc2 7a_100000210340_100000187161 [0,1,0,0,0,1|0,0,0]=2 3331 B16R2.132 Clc1ccc(cc1)COc2cccnc2 34a_100000210849_100000694040 [0,1,0,0,0,1|1,0,0]=3 3332 B16R2.132 Clc1ccc(cc1)COc2cccnc2 7a_100000210849_100000187161 [0,1,0,0,0,1|1,0,0]=3 3333 B16R2.132 Clc1ccc(cc1)COc2ccncc2 34a_100000212176_100000694040 [0,1,0,0,0,1|1,0,0]=3 3334 B16R2.132 Clc1ccc(cc1)COc2ccnnc2 34a_100015204005_100000694040 [0,1,0,0,0,1|2,0,0]=4 3335 B16R2.132 Clc1ccc(cc1)COc2cncnc2 7a_100000754086_100000187161 [0,1,0,0,0,1|2,0,0]=4 3336 B16R2.132 Clc1ccc(cc1)CSc2ccccc2 62a_100000187161_100000041952 [0,1,0,0,0,1|0,1,0]=3 3337 B16R2.132 Clc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000187161 [0,1,0,0,0,1|0,1,0]=3 3338 B16R2.132 Clc1ccc(cc1)CSc2ccccn2 62a_100000187161_100011216584 [0,1,0,0,0,1|1,1,0]=4 3339 B16R2.132 Clc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000187161 [0,1,0,0,0,1|1,1,0]=4 3340 B16R2.132 Clc1ccc(cc1)CSc2cccnc2 62a_100000187161_100000210063 [0,1,0,0,0,1|1,1,0]=4 3341 B16R2.132 Clc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000187161 [0,1,0,0,0,1|1,1,0]=4 3342 B16R2.132 Clc1ccc(cc1)CSc2ccncc2 62a_100000187161_100000728582 [0,1,0,0,0,1|1,1,0]=4 3343 B16R2.132 Clc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000187161 [0,1,0,0,0,1|1,1,0]=4 3344 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 207a_100000210052_100015611070 [0,1,0,0,0,1|1,0,0]=3 3345 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 2230a_100000210052_100015291786 [0,1,0,0,0,1|1,0,0]=3 3346 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 270302a_100000210052_100015611070 [0,1,0,0,0,1|1,0,0]=3 3347 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 34a_100000210052_100015291786 [0,1,0,0,0,1|1,0,0]=3 3348 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 207a_100000210052_100000209966 [0,1,0,0,0,1|2,0,0]=4 3349 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 2230a_100000210052_100000721315 [0,1,0,0,0,1|2,0,0]=4 3350 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 270302a_100000210052_100000209966 [0,1,0,0,0,1|2,0,0]=4 3351 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 34a_100000210052_100000721315 [0,1,0,0,0,1|2,0,0]=4 3352 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 207a_100000210052_100000209961 [0,1,0,0,0,1|2,0,0]=4 3353 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 2230a_100000210052_100000741622 [0,1,0,0,0,1|2,0,0]=4 3354 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 270302a_100000210052_100000209961 [0,1,0,0,0,1|2,0,0]=4 3355 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 34a_100000210052_100000733263 [0,1,0,0,0,1|2,0,0]=4 3356 B16R2.132 Clc1ccc(cc1)NCc2ccncc2 207a_100000210052_100000186114 [0,1,0,0,0,1|2,0,0]=4 3357 B16R2.132 Clc1ccc(cc1)NCc2ccncc2 2230a_100000210052_100015193705 [0,1,0,0,0,1|2,0,0]=4 3358 B16R2.132 Clc1ccc(cc1)OCc2ccccc2 34a_100000210216_100015291786 [0,1,0,0,0,1|0,0,0]=2 3359 B16R2.132 Clc1ccc(cc1)OCc2ccccc2 7a_100000210216_100000211182 [0,1,0,0,0,1|0,0,0]=2 3360 B16R2.132 Clc1ccc(cc1)OCc2ccccn2 34a_100000210216_100000721315 [0,1,0,0,0,1|1,0,0]=3 3361 B16R2.132 Clc1ccc(cc1)OCc2ccccn2 7a_100000210216_100000721315 [0,1,0,0,0,1|1,0,0]=3 3362 B16R2.132 Clc1ccc(cc1)OCc2cccnc2 34a_100000210216_100000733263 [0,1,0,0,0,1|1,0,0]=3 3363 B16R2.132 Clc1ccc(cc1)OCc2cccnc2 7a_100000210216_100000741622 [0,1,0,0,0,1|1,0,0]=3 3364 B16R2.132 Clc1ccc(cc1)OCc2cccnn2 34a_100000210216_100016990269 [0,1,0,0,0,1|2,0,0]=4 3365 B16R2.132 Clc1ccc(cc1)OCc2cccnn2 7a_100000210216_100016990269 [0,1,0,0,0,1|2,0,0]=4 3366 B16R2.132 Clc1ccc(cc1)OCc2ccncc2 7a_100000210216_100015193705 [0,1,0,0,0,1|1,0,0]=3 3367 B16R2.132 Clc1ccc(cc1)OCc2cnccn2 34a_100000210216_100016995436 [0,1,0,0,0,1|2,0,0]=4 3368 B16R2.132 Clc1ccc(cc1)OCc2cnccn2 7a_100000210216_100016995436 [0,1,0,0,0,1|2,0,0]=4 3369 B16R2.132 Clc1ccc(cc1)OCc2cncnc2 34a_100000210216_100015196519 [0,1,0,0,0,1|2,0,0]=4 3370 B16R2.132 Clc1ccc(cc1)OCc2cncnc2 7a_100000210216_100015196519 [0,1,0,0,0,1|2,0,0]=4 3371 B16R2.132 Clc1ccc(cc1)OCc2ncccn2 34a_100000210216_100000703007 [0,1,0,0,0,1|2,0,0]=4 3372 B16R2.132 Clc1ccc(cc1)OCc2ncccn2 7a_100000210216_100000703007 [0,1,0,0,0,1|2,0,0]=4 3373 B16R2.132 Clc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000755918 [0,1,0,0,0,1|0,1,0]=3 3374 B16R2.132 Clc1ccc(cc1)SCc2ccccc2 62a_100000755918_100015291786 [0,1,0,0,0,1|0,1,0]=3 3375 B16R2.132 Clc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000755918 [0,1,0,0,0,1|1,1,0]=4 3376 B16R2.132 Clc1ccc(cc1)SCc2ccccn2 62a_100000755918_100000721315 [0,1,0,0,0,1|1,1,0]=4 3377 B16R2.132 Clc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000755918 [0,1,0,0,0,1|1,1,0]=4 3378 B16R2.132 Clc1ccc(cc1)SCc2cccnc2 62a_100000755918_100000741622 [0,1,0,0,0,1|1,1,0]=4 3379 B16R2.132 Clc1ccc(cc1)SCc2ccncc2 62a_100000755918_100015193705 [0,1,0,0,0,1|1,1,0]=4 3380 B16R2.132 Clc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000755918 [0,1,0,0,0,1|1,1,0]=4 3381 B16R2.132 Clc1ccc(cn1)C#Cc2ccccc2 271570a_100000069678_100000034144 [0,1,0,0,0,1|2,0,0]=4 3382 B16R2.132 Clc1ccc(cn1)C=Cc2ccccc2 271570a_100102527694_100000034144 [0,1,0,0,0,1|2,0,0]=4 3383 B16R2.132 Clc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000766901 [0,1,0,0,0,1|2,0,0]=4 3384 B16R2.132 Clc1ccc(cn1)CNc2ccccc2 34a_100000106764_100000735431 [0,1,0,0,0,1|2,0,0]=4 3385 B16R2.132 Clc1ccc(cn1)COc2ccccc2 34a_100000210340_100000735431 [0,1,0,0,0,1|1,0,0]=3 3386 B16R2.132 Clc1ccc(cn1)COc2ccccc2 7a_100000210340_100000735431 [0,1,0,0,0,1|1,0,0]=3 3387 B16R2.132 Clc1ccc(cn1)COc2cccnc2 34a_100000210849_100000735431 [0,1,0,0,0,1|2,0,0]=4 3388 B16R2.132 Clc1ccc(cn1)COc2cccnc2 7a_100000210849_100000735431 [0,1,0,0,0,1|2,0,0]=4 3389 B16R2.132 Clc1ccc(cn1)COc2ccncc2 34a_100000212176_100000735431 [0,1,0,0,0,1|2,0,0]=4 3390 B16R2.132 Clc1ccc(cn1)CSc2ccccc2 62a_100000719477_100000735431 [0,1,0,0,0,1|1,1,0]=4 3391 B16R2.132 Clc1ccc(cn1)CSc2ccccc2 62a_100000735431_100000041952 [0,1,0,0,0,1|1,1,0]=4 3392 B16R2.132 Clc1ccc(cn1)OCc2ccccc2 34a_100000744096_100015291786 [0,1,0,0,0,1|1,0,0]=3 3393 B16R2.132 Clc1ccc(cn1)OCc2ccccc2 7a_100000744096_100000211182 [0,1,0,0,0,1|1,0,0]=3 3394 B16R2.132 Clc1ccc(cn1)OCc2ccccn2 34a_100000744096_100000721315 [0,1,0,0,0,1|2,0,0]=4 3395 B16R2.132 Clc1ccc(cn1)OCc2ccccn2 7a_100000744096_100000721315 [0,1,0,0,0,1|2,0,0]=4 3396 B16R2.132 Clc1ccc(cn1)OCc2cccnc2 34a_100000744096_100000733263 [0,1,0,0,0,1|2,0,0]=4 3397 B16R2.132 Clc1ccc(cn1)OCc2cccnc2 7a_100000744096_100000741622 [0,1,0,0,0,1|2,0,0]=4 3398 B16R2.132 Clc1ccc(cn1)OCc2ccncc2 7a_100000744096_100015193705 [0,1,0,0,0,1|2,0,0]=4 3399 B16R2.132 Clc1ccc(cn1)SCc2ccccc2 62a_100000034144_100015291786 [0,1,0,0,0,1|1,1,0]=4 3400 B16R2.132 Clc1ccc(cn1)SCc2ccccc2 62a_100000211182_100000034144 [0,1,0,0,0,1|1,1,0]=4 3401 B16R2.132 Clc1ccc(nc1)C#Cc2ccccc2 271570a_100000069678_100011356976 [0,1,0,0,0,1|2,0,0]=4 3402 B16R2.132 Clc1ccc(nc1)C=Cc2ccccc2 271570a_100102527694_100011356976 [0,1,0,0,0,1|2,0,0]=4 3403 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 207a_100000106764_100011361569 [0,1,0,0,0,1|2,0,0]=4 3404 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 270302a_100000106764_100011361569 [0,1,0,0,0,1|2,0,0]=4 3405 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 34a_100000106764_100012066911 [0,1,0,0,0,1|2,0,0]=4 3406 B16R2.132 Clc1ccc(nc1)COc2ccccc2 34a_100000210340_100012066911 [0,1,0,0,0,1|1,0,0]=3 3407 B16R2.132 Clc1ccc(nc1)COc2ccccc2 7a_100000210340_100012066911 [0,1,0,0,0,1|1,0,0]=3 3408 B16R2.132 Clc1ccc(nc1)COc2cccnc2 34a_100000210849_100012066911 [0,1,0,0,0,1|2,0,0]=4 3409 B16R2.132 Clc1ccc(nc1)COc2cccnc2 7a_100000210849_100012066911 [0,1,0,0,0,1|2,0,0]=4 3410 B16R2.132 Clc1ccc(nc1)COc2ccncc2 34a_100000212176_100012066911 [0,1,0,0,0,1|2,0,0]=4 3411 B16R2.132 Clc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000697101 [0,1,0,0,0,1|1,1,0]=4 3412 B16R2.132 Clc1ccc(nc1)CSc2ccccc2 62a_100012066911_100000041952 [0,1,0,0,0,1|1,1,0]=4 3413 B16R2.132 Clc1ccc(nc1)OCc2ccccc2 34a_100011215309_100015291786 [0,1,0,0,0,1|1,0,0]=3 3414 B16R2.132 Clc1ccc(nc1)OCc2ccccn2 34a_100011215309_100000721315 [0,1,0,0,0,1|2,0,0]=4 3415 B16R2.132 Clc1ccc(nc1)OCc2cccnc2 34a_100011215309_100000733263 [0,1,0,0,0,1|2,0,0]=4 3416 B16R2.132 Clc1ccc(nc1)SCc2ccccc2 62a_100000211182_100011356976 [0,1,0,0,0,1|1,1,0]=4 3417 B16R2.132 Clc1ccc(nc1)SCc2ccccc2 62a_100011356976_100015291786 [0,1,0,0,0,1|1,1,0]=4 3418 B16R2.132 Clc1ccc(nn1)COc2ccccc2 34a_100000210340_100016992710 [0,1,0,0,0,1|2,0,0]=4 3419 B16R2.132 Clc1ccc(nn1)COc2ccccc2 7a_100000210340_100016992710 [0,1,0,0,0,1|2,0,0]=4 3420 B16R2.132 Clc1cnc(cn1)OCc2ccccc2 34a_100015839800_100015291786 [0,1,0,0,0,1|2,0,0]=4 3421 B16R2.132 Clc1ncc(cn1)OCc2ccccc2 34a_100000092845_100015291786 [0,1,0,0,0,1|2,0,0]=4 3422 B16R2.132 Clc1ncc(cn1)OCc2ccccc2 7a_100000092845_100000211182 [0,1,0,0,0,1|2,0,0]=4 3423 B16R2.132 Fc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000211213 [0,1,0,0,0,1|1,0,0]=3 3424 B16R2.132 Fc1ccc(cc1)C=Cc2ccccc2 271570a_100102525539_100000210277 [0,1,0,0,0,1|1,0,0]=3 3425 B16R2.132 Fc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000211213 [0,1,0,0,0,1|1,0,0]=3 3426 B16R2.132 Fc1ccc(cc1)C=Cc2ccccn2 271570a_100102525539_100011216584 [0,1,0,0,0,1|2,0,0]=4 3427 B16R2.132 Fc1ccc(cc1)C=Cc2cccnc2 271570a_100102525539_100000752921 [0,1,0,0,0,1|2,0,0]=4 3428 B16R2.132 Fc1ccc(cc1)C=Cc2cccnc2 271570a_100102525586_100000211213 [0,1,0,0,0,1|2,0,0]=4 3429 B16R2.132 Fc1ccc(cc1)C=Cc2ccncc2 271570a_100102525539_100000035832 [0,1,0,0,0,1|2,0,0]=4 3430 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000210084 [0,1,0,0,0,1|1,0,0]=3 3431 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000210084 [0,1,0,0,0,1|1,0,0]=3 3432 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000198546 [0,1,0,0,0,1|1,0,0]=3 3433 B16R2.132 Fc1ccc(cc1)COc2ccccc2 34a_100000210340_100000198546 [0,1,0,0,0,1|0,0,0]=2 3434 B16R2.132 Fc1ccc(cc1)COc2ccccc2 7a_100000210340_100000198546 [0,1,0,0,0,1|0,0,0]=2 3435 B16R2.132 Fc1ccc(cc1)COc2cccnc2 34a_100000210849_100000198546 [0,1,0,0,0,1|1,0,0]=3 3436 B16R2.132 Fc1ccc(cc1)COc2cccnc2 7a_100000210849_100000198546 [0,1,0,0,0,1|1,0,0]=3 3437 B16R2.132 Fc1ccc(cc1)COc2ccncc2 34a_100000212176_100000198546 [0,1,0,0,0,1|1,0,0]=3 3438 B16R2.132 Fc1ccc(cc1)COc2ccnnc2 34a_100015204005_100000198546 [0,1,0,0,0,1|2,0,0]=4 3439 B16R2.132 Fc1ccc(cc1)COc2cncnc2 7a_100000754086_100000198546 [0,1,0,0,0,1|2,0,0]=4 3440 B16R2.132 Fc1ccc(cc1)CSc2ccccc2 62a_100000198546_100000041952 [0,1,0,0,0,1|0,1,0]=3 3441 B16R2.132 Fc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000187164 [0,1,0,0,0,1|0,1,0]=3 3442 B16R2.132 Fc1ccc(cc1)CSc2ccccn2 62a_100000198546_100011216584 [0,1,0,0,0,1|1,1,0]=4 3443 B16R2.132 Fc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000187164 [0,1,0,0,0,1|1,1,0]=4 3444 B16R2.132 Fc1ccc(cc1)CSc2cccnc2 62a_100000198546_100000210063 [0,1,0,0,0,1|1,1,0]=4 3445 B16R2.132 Fc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000187164 [0,1,0,0,0,1|1,1,0]=4 3446 B16R2.132 Fc1ccc(cc1)CSc2ccncc2 62a_100000198546_100000728582 [0,1,0,0,0,1|1,1,0]=4 3447 B16R2.132 Fc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000187164 [0,1,0,0,0,1|1,1,0]=4 3448 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 207a_100000185862_100015611070 [0,1,0,0,0,1|1,0,0]=3 3449 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 270302a_100000185862_100015611070 [0,1,0,0,0,1|1,0,0]=3 3450 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 34a_100000185862_100015291786 [0,1,0,0,0,1|1,0,0]=3 3451 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 207a_100000185862_100000209966 [0,1,0,0,0,1|2,0,0]=4 3452 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 270302a_100000185862_100000209966 [0,1,0,0,0,1|2,0,0]=4 3453 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 34a_100000185862_100000721315 [0,1,0,0,0,1|2,0,0]=4 3454 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 207a_100000185862_100000209961 [0,1,0,0,0,1|2,0,0]=4 3455 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 270302a_100000185862_100000209961 [0,1,0,0,0,1|2,0,0]=4 3456 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 34a_100000185862_100000733263 [0,1,0,0,0,1|2,0,0]=4 3457 B16R2.132 Fc1ccc(cc1)NCc2ccncc2 207a_100000185862_100000186114 [0,1,0,0,0,1|2,0,0]=4 3458 B16R2.132 Fc1ccc(cc1)OCc2ccccc2 34a_100000210339_100015291786 [0,1,0,0,0,1|0,0,0]=2 3459 B16R2.132 Fc1ccc(cc1)OCc2ccccn2 34a_100000210339_100000721315 [0,1,0,0,0,1|1,0,0]=3 3460 B16R2.132 Fc1ccc(cc1)OCc2cccnc2 34a_100000210339_100000733263 [0,1,0,0,0,1|1,0,0]=3 3461 B16R2.132 Fc1ccc(cc1)OCc2cccnn2 34a_100000210339_100016990269 [0,1,0,0,0,1|2,0,0]=4 3462 B16R2.132 Fc1ccc(cc1)OCc2cnccn2 34a_100000210339_100016995436 [0,1,0,0,0,1|2,0,0]=4 3463 B16R2.132 Fc1ccc(cc1)OCc2cncnc2 34a_100000210339_100015196519 [0,1,0,0,0,1|2,0,0]=4 3464 B16R2.132 Fc1ccc(cc1)OCc2ncccn2 34a_100000210339_100000703007 [0,1,0,0,0,1|2,0,0]=4 3465 B16R2.132 Fc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000211213 [0,1,0,0,0,1|0,1,0]=3 3466 B16R2.132 Fc1ccc(cc1)SCc2ccccc2 62a_100000211213_100015291786 [0,1,0,0,0,1|0,1,0]=3 3467 B16R2.132 Fc1ccc(cc1)SCc2ccccn2 62a_100000211213_100000721315 [0,1,0,0,0,1|1,1,0]=4 3468 B16R2.132 Fc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000211213 [0,1,0,0,0,1|1,1,0]=4 3469 B16R2.132 Fc1ccc(cc1)SCc2cccnc2 62a_100000211213_100000741622 [0,1,0,0,0,1|1,1,0]=4 3470 B16R2.132 Fc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000211213 [0,1,0,0,0,1|1,1,0]=4 3471 B16R2.132 Fc1ccc(cc1)SCc2ccncc2 62a_100000211213_100015193705 [0,1,0,0,0,1|1,1,0]=4 3472 B16R2.132 Fc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000211213 [0,1,0,0,0,1|1,1,0]=4 3473 B16R2.132 Fc1ccc(cn1)C#Cc2ccccc2 271570a_100000069678_100000748661 [0,1,0,0,0,1|2,0,0]=4 3474 B16R2.132 Fc1ccc(cn1)C=Cc2ccccc2 271570a_100102527694_100000748661 [0,1,0,0,0,1|2,0,0]=4 3475 B16R2.132 Fc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000068566 [0,1,0,0,0,1|2,0,0]=4 3476 B16R2.132 Fc1ccc(cn1)CNc2ccccc2 34a_100000106764_100000099788 [0,1,0,0,0,1|2,0,0]=4 3477 B16R2.132 Fc1ccc(cn1)COc2ccccc2 34a_100000210340_100000099788 [0,1,0,0,0,1|1,0,0]=3 3478 B16R2.132 Fc1ccc(cn1)COc2ccccc2 7a_100000210340_100009820150 [0,1,0,0,0,1|1,0,0]=3 3479 B16R2.132 Fc1ccc(cn1)COc2cccnc2 34a_100000210849_100000099788 [0,1,0,0,0,1|2,0,0]=4 3480 B16R2.132 Fc1ccc(cn1)COc2cccnc2 7a_100000210849_100009820150 [0,1,0,0,0,1|2,0,0]=4 3481 B16R2.132 Fc1ccc(cn1)COc2ccncc2 34a_100000212176_100000099788 [0,1,0,0,0,1|2,0,0]=4 3482 B16R2.132 Fc1ccc(cn1)CSc2ccccc2 62a_100000719477_100000099788 [0,1,0,0,0,1|1,1,0]=4 3483 B16R2.132 Fc1ccc(cn1)CSc2ccccc2 62a_100009820150_100000041952 [0,1,0,0,0,1|1,1,0]=4 3484 B16R2.132 Fc1ccc(cn1)OCc2ccccc2 34a_100000688820_100015291786 [0,1,0,0,0,1|1,0,0]=3 3485 B16R2.132 Fc1ccc(cn1)OCc2ccccc2 7a_100000688820_100000211182 [0,1,0,0,0,1|1,0,0]=3 3486 B16R2.132 Fc1ccc(cn1)OCc2ccccn2 34a_100000688820_100000721315 [0,1,0,0,0,1|2,0,0]=4 3487 B16R2.132 Fc1ccc(cn1)OCc2ccccn2 7a_100000688820_100000721315 [0,1,0,0,0,1|2,0,0]=4 3488 B16R2.132 Fc1ccc(cn1)OCc2cccnc2 34a_100000688820_100000733263 [0,1,0,0,0,1|2,0,0]=4 3489 B16R2.132 Fc1ccc(cn1)OCc2cccnc2 7a_100000688820_100000741622 [0,1,0,0,0,1|2,0,0]=4 3490 B16R2.132 Fc1ccc(cn1)OCc2ccncc2 7a_100000688820_100015193705 [0,1,0,0,0,1|2,0,0]=4 3491 B16R2.132 Fc1ccc(cn1)SCc2ccccc2 62a_100000042367_100015291786 [0,1,0,0,0,1|1,1,0]=4 3492 B16R2.132 Fc1ccc(cn1)SCc2ccccc2 62a_100000211182_100000042367 [0,1,0,0,0,1|1,1,0]=4 3493 B16R2.132 Fc1ccc(nc1)C#Cc2ccccc2 271570a_100000069678_100000744514 [0,1,0,0,0,1|2,0,0]=4 3494 B16R2.132 Fc1ccc(nc1)C=Cc2ccccc2 271570a_100102527694_100000744514 [0,1,0,0,0,1|2,0,0]=4 3495 B16R2.132 Fc1ccc(nc1)CNc2ccccc2 207a_100000106764_100011934744 [0,1,0,0,0,1|2,0,0]=4 3496 B16R2.132 Fc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000703193 [0,1,0,0,0,1|2,0,0]=4 3497 B16R2.132 Fc1ccc(nc1)COc2ccccc2 34a_100000210340_100000703193 [0,1,0,0,0,1|1,0,0]=3 3498 B16R2.132 Fc1ccc(nc1)COc2ccccc2 7a_100000210340_100000703193 [0,1,0,0,0,1|1,0,0]=3 3499 B16R2.132 Fc1ccc(nc1)COc2cccnc2 34a_100000210849_100000703193 [0,1,0,0,0,1|2,0,0]=4 3500 B16R2.132 Fc1ccc(nc1)COc2cccnc2 7a_100000210849_100000703193 [0,1,0,0,0,1|2,0,0]=4 3501 B16R2.132 Fc1ccc(nc1)COc2ccncc2 34a_100000212176_100000703193 [0,1,0,0,0,1|2,0,0]=4 3502 B16R2.132 Fc1ccc(nc1)CSc2ccccc2 62a_100000703193_100000041952 [0,1,0,0,0,1|1,1,0]=4 3503 B16R2.132 Fc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000703193 [0,1,0,0,0,1|1,1,0]=4 3504 B16R2.132 Fc1ccc(nc1)OCc2ccccc2 34a_100000742473_100015291786 [0,1,0,0,0,1|1,0,0]=3 3505 B16R2.132 Fc1ccc(nc1)OCc2ccccn2 34a_100000742473_100000721315 [0,1,0,0,0,1|2,0,0]=4 3506 B16R2.132 Fc1ccc(nc1)OCc2cccnc2 34a_100000742473_100000733263 [0,1,0,0,0,1|2,0,0]=4 3507 B16R2.132 Fc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000744514 [0,1,0,0,0,1|1,1,0]=4 3508 B16R2.132 Fc1ccc(nc1)SCc2ccccc2 62a_100000744514_100015291786 [0,1,0,0,0,1|1,1,0]=4 3509 B16R2.132 Fc1cnc(nc1)OCc2ccccc2 34a_100011934040_100015291786 [0,1,0,0,0,1|2,0,0]=4 3510 B16R2.132 Fc1ncc(cn1)OCc2ccccc2 34a_200009874573_100015291786 [0,1,0,0,0,1|2,0,0]=4 3511 B16R2.132 Fc1ncc(cn1)OCc2ccccc2 7a_200009874573_100000211182 [0,1,0,0,0,1|2,0,0]=4 3512 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 207a_100000106764_100000188517 [0,1,0,0,0,1|1,0,0]=3 3513 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000188517 [0,1,0,0,0,1|1,0,0]=3 3514 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 34a_100000106764_100000189116 [0,1,0,0,0,1|1,0,0]=3 3515 B16R2.132 Ic1ccc(cc1)COc2ccccc2 34a_100000210340_100000189116 [0,1,0,0,0,1|0,0,0]=2 3516 B16R2.132 Ic1ccc(cc1)COc2ccccc2 7a_100000210340_100000189116 [0,1,0,0,0,1|0,0,0]=2 3517 B16R2.132 Ic1ccc(cc1)COc2cccnc2 34a_100000210849_100000189116 [0,1,0,0,0,1|1,0,0]=3 3518 B16R2.132 Ic1ccc(cc1)COc2cccnc2 7a_100000210849_100000189116 [0,1,0,0,0,1|1,0,0]=3 3519 B16R2.132 Ic1ccc(cc1)COc2ccncc2 34a_100000212176_100000189116 [0,1,0,0,0,1|1,0,0]=3 3520 B16R2.132 Ic1ccc(cc1)COc2ccnnc2 34a_100015204005_100000189116 [0,1,0,0,0,1|2,0,0]=4 3521 B16R2.132 Ic1ccc(cc1)COc2cncnc2 7a_100000754086_100000189116 [0,1,0,0,0,1|2,0,0]=4 3522 B16R2.132 Ic1ccc(cc1)CSc2ccccc2 62a_100000189116_100000041952 [0,1,0,0,0,1|0,1,0]=3 3523 B16R2.132 Ic1ccc(cc1)CSc2ccccc2 62a_100000719477_100000189116 [0,1,0,0,0,1|0,1,0]=3 3524 B16R2.132 Ic1ccc(cc1)CSc2ccccn2 62a_100000189116_100011216584 [0,1,0,0,0,1|1,1,0]=4 3525 B16R2.132 Ic1ccc(cc1)CSc2ccccn2 62a_100011216584_100000189116 [0,1,0,0,0,1|1,1,0]=4 3526 B16R2.132 Ic1ccc(cc1)CSc2cccnc2 62a_100000189116_100000210063 [0,1,0,0,0,1|1,1,0]=4 3527 B16R2.132 Ic1ccc(cc1)CSc2cccnc2 62a_100000210063_100000189116 [0,1,0,0,0,1|1,1,0]=4 3528 B16R2.132 Ic1ccc(cc1)CSc2ccncc2 62a_100000189116_100000728582 [0,1,0,0,0,1|1,1,0]=4 3529 B16R2.132 Ic1ccc(cc1)CSc2ccncc2 62a_100000728582_100000189116 [0,1,0,0,0,1|1,1,0]=4 3530 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 207a_100000185761_100015611070 [0,1,0,0,0,1|1,0,0]=3 3531 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 270302a_100000185761_100015611070 [0,1,0,0,0,1|1,0,0]=3 3532 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 34a_100000185761_100015291786 [0,1,0,0,0,1|1,0,0]=3 3533 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 207a_100000185761_100000209966 [0,1,0,0,0,1|2,0,0]=4 3534 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 270302a_100000185761_100000209966 [0,1,0,0,0,1|2,0,0]=4 3535 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 34a_100000185761_100000721315 [0,1,0,0,0,1|2,0,0]=4 3536 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 207a_100000185761_100000209961 [0,1,0,0,0,1|2,0,0]=4 3537 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 270302a_100000185761_100000209961 [0,1,0,0,0,1|2,0,0]=4 3538 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 34a_100000185761_100000733263 [0,1,0,0,0,1|2,0,0]=4 3539 B16R2.132 Ic1ccc(cc1)NCc2ccncc2 207a_100000185761_100000186114 [0,1,0,0,0,1|2,0,0]=4 3540 B16R2.132 Ic1ccc(cc1)OCc2ccccc2 34a_100000212066_100015291786 [0,1,0,0,0,1|0,0,0]=2 3541 B16R2.132 Ic1ccc(cc1)OCc2ccccc2 7a_100000212066_100000211182 [0,1,0,0,0,1|0,0,0]=2 3542 B16R2.132 Ic1ccc(cc1)OCc2ccccn2 34a_100000212066_100000721315 [0,1,0,0,0,1|1,0,0]=3 3543 B16R2.132 Ic1ccc(cc1)OCc2ccccn2 7a_100000212066_100000721315 [0,1,0,0,0,1|1,0,0]=3 3544 B16R2.132 Ic1ccc(cc1)OCc2cccnc2 34a_100000212066_100000733263 [0,1,0,0,0,1|1,0,0]=3 3545 B16R2.132 Ic1ccc(cc1)OCc2cccnc2 7a_100000212066_100000741622 [0,1,0,0,0,1|1,0,0]=3 3546 B16R2.132 Ic1ccc(cc1)OCc2cccnn2 34a_100000212066_100016990269 [0,1,0,0,0,1|2,0,0]=4 3547 B16R2.132 Ic1ccc(cc1)OCc2cccnn2 7a_100000212066_100016990269 [0,1,0,0,0,1|2,0,0]=4 3548 B16R2.132 Ic1ccc(cc1)OCc2ccncc2 7a_100000212066_100015193705 [0,1,0,0,0,1|1,0,0]=3 3549 B16R2.132 Ic1ccc(cc1)OCc2cnccn2 34a_100000212066_100016995436 [0,1,0,0,0,1|2,0,0]=4 3550 B16R2.132 Ic1ccc(cc1)OCc2cnccn2 7a_100000212066_100016995436 [0,1,0,0,0,1|2,0,0]=4 3551 B16R2.132 Ic1ccc(cc1)OCc2cncnc2 34a_100000212066_100015196519 [0,1,0,0,0,1|2,0,0]=4 3552 B16R2.132 Ic1ccc(cc1)OCc2cncnc2 7a_100000212066_100015196519 [0,1,0,0,0,1|2,0,0]=4 3553 B16R2.132 Ic1ccc(cc1)OCc2ncccn2 34a_100000212066_100000703007 [0,1,0,0,0,1|2,0,0]=4 3554 B16R2.132 Ic1ccc(cc1)OCc2ncccn2 7a_100000212066_100000703007 [0,1,0,0,0,1|2,0,0]=4 3555 B16R2.132 Ic1ccc(cn1)OCc2ccccc2 34a_100000687607_100015291786 [0,1,0,0,0,1|1,0,0]=3 3556 B16R2.132 Ic1ccc(cn1)OCc2ccccc2 7a_100000687607_100000211182 [0,1,0,0,0,1|1,0,0]=3 3557 B16R2.132 Ic1ccc(cn1)OCc2ccccn2 34a_100000687607_100000721315 [0,1,0,0,0,1|2,0,0]=4 3558 B16R2.132 Ic1ccc(cn1)OCc2ccccn2 7a_100000687607_100000721315 [0,1,0,0,0,1|2,0,0]=4 3559 B16R2.132 Ic1ccc(cn1)OCc2cccnc2 34a_100000687607_100000733263 [0,1,0,0,0,1|2,0,0]=4 3560 B16R2.132 Ic1ccc(cn1)OCc2cccnc2 7a_100000687607_100000741622 [0,1,0,0,0,1|2,0,0]=4 3561 B16R2.132 Ic1ccc(cn1)OCc2ccncc2 7a_100000687607_100015193705 [0,1,0,0,0,1|2,0,0]=4 3562 B16R2.132 Nc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000185761 [0,1,0,0,0,1|1,0,0]=3 3563 B16R2.132 Nc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000185761 [0,1,0,0,0,1|1,0,0]=3 3564 B16R2.132 Nc1ccc(cc1)C=Cc2cccnc2 271570a_100102525586_100000185761 [0,1,0,0,0,1|2,0,0]=4 3565 B16R2.132 Nc1ccc(cc1)OCc2ccccc2 34a_100000185829_100015291786 [0,1,0,0,0,1|0,0,0]=2 3566 B16R2.132 Nc1ccc(cc1)OCc2ccccn2 34a_100000185829_100000721315 [0,1,0,0,0,1|1,0,0]=3 3567 B16R2.132 Nc1ccc(cc1)OCc2cccnc2 34a_100000185829_100000733263 [0,1,0,0,0,1|1,0,0]=3 3568 B16R2.132 Nc1ccc(cc1)OCc2cccnn2 34a_100000185829_100016990269 [0,1,0,0,0,1|2,0,0]=4 3569 B16R2.132 Nc1ccc(cc1)OCc2cnccn2 34a_100000185829_100016995436 [0,1,0,0,0,1|2,0,0]=4 3570 B16R2.132 Nc1ccc(cc1)OCc2cncnc2 34a_100000185829_100015196519 [0,1,0,0,0,1|2,0,0]=4 3571 B16R2.132 Nc1ccc(cc1)OCc2ncccn2 34a_100000185829_100000703007 [0,1,0,0,0,1|2,0,0]=4 3572 B16R2.132 Nc1ccc(cc1)SCc2ccccc2 62a_100000185761_100015291786 [0,1,0,0,0,1|0,1,0]=3 3573 B16R2.132 Nc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000185761 [0,1,0,0,0,1|0,1,0]=3 3574 B16R2.132 Nc1ccc(cc1)SCc2ccccn2 62a_100000185761_100000721315 [0,1,0,0,0,1|1,1,0]=4 3575 B16R2.132 Nc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000185761 [0,1,0,0,0,1|1,1,0]=4 3576 B16R2.132 Nc1ccc(cc1)SCc2cccnc2 62a_100000185761_100000741622 [0,1,0,0,0,1|1,1,0]=4 3577 B16R2.132 Nc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000185761 [0,1,0,0,0,1|1,1,0]=4 3578 B16R2.132 Nc1ccc(cc1)SCc2ccncc2 62a_100000185761_100015193705 [0,1,0,0,0,1|1,1,0]=4 3579 B16R2.132 Nc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000185761 [0,1,0,0,0,1|1,1,0]=4 3580 B16R2.132 Nc1ccc(cn1)C#Cc2ccccc2 271570a_100000069678_100000187370 [0,1,0,0,0,1|2,0,0]=4 3581 B16R2.132 Nc1ccc(cn1)C=Cc2ccccc2 271570a_100102527694_100000187370 [0,1,0,0,0,1|2,0,0]=4 3582 B16R2.132 Nc1ccc(cn1)OCc2ccccc2 34a_100015188713_100015291786 [0,1,0,0,0,1|1,0,0]=3 3583 B16R2.132 Nc1ccc(cn1)OCc2ccccc2 7a_100015188713_100000211182 [0,1,0,0,0,1|1,0,0]=3 3584 B16R2.132 Nc1ccc(cn1)OCc2ccccn2 34a_100015188713_100000721315 [0,1,0,0,0,1|2,0,0]=4 3585 B16R2.132 Nc1ccc(cn1)OCc2ccccn2 7a_100015188713_100000721315 [0,1,0,0,0,1|2,0,0]=4 3586 B16R2.132 Nc1ccc(cn1)OCc2cccnc2 34a_100015188713_100000733263 [0,1,0,0,0,1|2,0,0]=4 3587 B16R2.132 Nc1ccc(cn1)OCc2cccnc2 7a_100015188713_100000741622 [0,1,0,0,0,1|2,0,0]=4 3588 B16R2.132 Nc1ccc(cn1)OCc2ccncc2 7a_100015188713_100015193705 [0,1,0,0,0,1|2,0,0]=4 3589 B16R2.132 Nc1ccc(cn1)SCc2ccccc2 62a_100000187370_100015291786 [0,1,0,0,0,1|1,1,0]=4 3590 B16R2.132 Nc1ccc(cn1)SCc2ccccc2 62a_100000211182_100000187370 [0,1,0,0,0,1|1,1,0]=4 3591 B16R2.132 Nc1ccc(nc1)C#Cc2ccccc2 271570a_100000069678_100000744251 [0,1,0,0,0,1|2,0,0]=4 3592 B16R2.132 Nc1ccc(nc1)C=Cc2ccccc2 271570a_100102527694_100000744251 [0,1,0,0,0,1|2,0,0]=4 3593 B16R2.132 Nc1ccc(nc1)OCc2ccccc2 34a_100000729260_100015291786 [0,1,0,0,0,1|1,0,0]=3 3594 B16R2.132 Nc1ccc(nc1)OCc2ccccn2 34a_100000729260_100000721315 [0,1,0,0,0,1|2,0,0]=4 3595 B16R2.132 Nc1ccc(nc1)OCc2cccnc2 34a_100000729260_100000733263 [0,1,0,0,0,1|2,0,0]=4 3596 B16R2.132 Nc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000737798 [0,1,0,0,0,1|1,1,0]=4 3597 B16R2.132 Nc1ccc(nc1)SCc2ccccc2 62a_100000737798_100015291786 [0,1,0,0,0,1|1,1,0]=4 3598 B16R2.132 Nc1ncc(cn1)OCc2ccccc2 34a_100000087137_100015291786 [0,1,0,0,0,1|2,0,0]=4 3599 B16R2.132 Nc1ncc(cn1)OCc2ccccc2 7a_100000087137_100000211182 [0,1,0,0,0,1|2,0,0]=4 3600 B16R2.132 O=c1ccc(c[nH]1)C#Cc2ccccc2 271570a_100000069678_100000212171 [0,1,0,0,0,1|2,0,0]=4 3601 B16R2.132 O=c1ccc(c[nH]1)C=Cc2ccccc2 271570a_100102527694_100000212171 [0,1,0,0,0,1|2,0,0]=4 3602 B16R2.132 O=c1ccc(c[nH]1)OCc2ccccc2 34a_100000075641_100015291786 [0,1,0,0,0,1|1,0,0]=3 3603 B16R2.132 O=c1ccc(c[nH]1)OCc2ccccn2 34a_100000075641_100000721315 [0,1,0,0,0,1|2,0,0]=4 3604 B16R2.132 O=c1ccc(c[nH]1)OCc2cccnc2 34a_100000075641_100000733263 [0,1,0,0,0,1|2,0,0]=4 3605 B16R2.132 O=c1ccc(c[nH]1)SCc2ccccc2 62a_100000211182_100000212171 [0,1,0,0,0,1|1,1,0]=4 3606 B16R2.132 O=c1ccc(c[nH]1)SCc2ccccc2 62a_100000212171_100015291786 [0,1,0,0,0,1|1,1,0]=4 3607 B16R2.132 Oc1ccc(cc1)/C=C/c2ccccc2 271570a_203496583355_100016990502 [0,1,0,0,0,1|1,0,0]=3 3608 B16R2.132 Oc1ccc(cc1)/N=N/c2ccccc2 271570a_203496583355_100029724385 [0,1,0,0,0,1|1,0,0]=3 3609 B16R2.132 Oc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000185759 [0,1,0,0,0,1|1,0,0]=3 3610 B16R2.132 Oc1ccc(cc1)C#Cc2ccccc2 271570a_203496583355_100010000412 [0,1,0,0,0,1|1,0,0]=3 3611 B16R2.132 Oc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000185759 [0,1,0,0,0,1|1,0,0]=3 3612 B16R2.132 Oc1ccc(cc1)C=Cc2cccnc2 271570a_100102525586_100000185759 [0,1,0,0,0,1|2,0,0]=4 3613 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 270302a_100000185829_100015611070 [0,1,0,0,0,1|1,0,0]=3 3614 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 271570a_203496583355_100000187040 [0,1,0,0,0,1|1,0,0]=3 3615 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 34a_100000185829_100015291786 [0,1,0,0,0,1|1,0,0]=3 3616 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 270302a_100000185829_100000209966 [0,1,0,0,0,1|2,0,0]=4 3617 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 271570a_203496583355_100000238286 [0,1,0,0,0,1|2,0,0]=4 3618 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 34a_100000185829_100000721315 [0,1,0,0,0,1|2,0,0]=4 3619 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 270302a_100000185829_100000209961 [0,1,0,0,0,1|2,0,0]=4 3620 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 271570a_203496583355_100000189165 [0,1,0,0,0,1|2,0,0]=4 3621 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 34a_100000185829_100000733263 [0,1,0,0,0,1|2,0,0]=4 3622 B16R2.132 Oc1ccc(cc1)OCc2ccccc2 271570a_203496583355_100000151783 [0,1,0,0,0,1|0,0,0]=2 3623 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 271570a_203496583355_100009811532 [0,1,0,0,0,1|0,1,0]=3 3624 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000185759 [0,1,0,0,0,1|0,1,0]=3 3625 B16R2.132 Oc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000185759 [0,1,0,0,0,1|1,1,0]=4 3626 B16R2.132 Oc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000185759 [0,1,0,0,0,1|1,1,0]=4 3627 B16R2.132 Oc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000185759 [0,1,0,0,0,1|1,1,0]=4 3628 B16R2.132 Oc1ccc(cn1)CNc2ccccc2 207a_100000106764_100011361521 [0,1,0,0,0,1|2,0,0]=4 3629 B16R2.132 Oc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100011361521 [0,1,0,0,0,1|2,0,0]=4 3630 B16R2.132 Oc1ccc(cn1)OCc2ccccc2 271570a_203496583355_200012361712 [0,1,0,0,0,1|1,0,0]=3 3631 B16R2.132 Oc1ccc(cn1)OCc2ccccn2 271570a_203496583355_100013423275 [0,1,0,0,0,1|2,0,0]=4 3632 B16R2.132 Oc1ccc(nc1)C#Cc2ccccc2 271570a_100000069678_100000685995 [0,1,0,0,0,1|2,0,0]=4 3633 B16R2.132 Oc1ccc(nc1)C=Cc2ccccc2 271570a_100102527694_100000685995 [0,1,0,0,0,1|2,0,0]=4 3634 B16R2.132 Oc1ccc(nc1)NCc2ccccc2 271570a_203496583355_200000239955 [0,1,0,0,0,1|2,0,0]=4 3635 B16R2.132 Oc1ccc(nc1)OCc2ccccc2 271570a_203496583355_100011465491 [0,1,0,0,0,1|1,0,0]=3 3636 B16R2.132 Oc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000744096 [0,1,0,0,0,1|1,1,0]=4 3637 B16R2.132 Oc1ccc(nc1)SCc2ccccc2 62a_100000685995_100015291786 [0,1,0,0,0,1|1,1,0]=4 3638 B16R2.132 Oc1ccc(nn1)OCc2ccccc2 271570a_203496583355_100011211657 [0,1,0,0,0,1|2,0,0]=4 3639 B16R2.132 Oc1cnc(nc1)OCc2ccccc2 271570a_203496583355_100011830389 [0,1,0,0,0,1|2,0,0]=4 3640 B16R2.132 Oc1ncc(cn1)OCc2ccccc2 271570a_203496583355_100010205888 [0,1,0,0,0,1|2,0,0]=4 3641 B16R2.132 [O-][n+]1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000039755 [0,1,0,0,0,1|2,0,0]=4 3642 B16R2.132 [O-][n+]1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000039755 [0,1,0,0,0,1|2,0,0]=4 3643 B16R2.132 [O-][n+]1ccc(cc1)SCc2ccccc2 62a_100000211182_100000039755 [0,1,0,0,0,1|1,1,0]=4 3644 B16R2.252 Brc1cc(ccn1)C#Cc2ccccc2 271570a_100000069678_100009814637 [0,1,0,0,0,1|2,0,0]=4 3645 B16R2.252 Brc1cc(ccn1)C=Cc2ccccc2 271570a_100102527694_100009814637 [0,1,0,0,0,1|2,0,0]=4 3646 B16R2.252 Brc1cc(ccn1)CNc2ccccc2 34a_100000106764_100010243470 [0,1,0,0,0,1|2,0,0]=4 3647 B16R2.252 Brc1cc(ccn1)COc2ccccc2 34a_100000210340_100010243470 [0,1,0,0,0,1|1,0,0]=3 3648 B16R2.252 Brc1cc(ccn1)COc2ccccc2 7a_100000210340_100010254460 [0,1,0,0,0,1|1,0,0]=3 3649 B16R2.252 Brc1cc(ccn1)COc2cccnc2 34a_100000210849_100010243470 [0,1,0,0,0,1|2,0,0]=4 3650 B16R2.252 Brc1cc(ccn1)COc2cccnc2 7a_100000210849_100010254460 [0,1,0,0,0,1|2,0,0]=4 3651 B16R2.252 Brc1cc(ccn1)COc2ccncc2 34a_100000212176_100010243470 [0,1,0,0,0,1|2,0,0]=4 3652 B16R2.252 Brc1cc(ccn1)CSc2ccccc2 62a_100000719477_100010243470 [0,1,0,0,0,1|1,1,0]=4 3653 B16R2.252 Brc1cc(ccn1)CSc2ccccc2 62a_100010254460_100000041952 [0,1,0,0,0,1|1,1,0]=4 3654 B16R2.252 Brc1cc(ccn1)SCc2ccccc2 62a_100000211182_100009814637 [0,1,0,0,0,1|1,1,0]=4 3655 B16R2.252 Brc1cc(ccn1)SCc2ccccc2 62a_100009814637_100015291786 [0,1,0,0,0,1|1,1,0]=4 3656 B16R2.252 Brc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000691529 [0,1,0,0,0,1|1,0,0]=3 3657 B16R2.252 Brc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000691529 [0,1,0,0,0,1|1,0,0]=3 3658 B16R2.252 Brc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100000691529 [0,1,0,0,0,1|2,0,0]=4 3659 B16R2.252 Brc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210085 [0,1,0,0,0,1|1,0,0]=3 3660 B16R2.252 Brc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210085 [0,1,0,0,0,1|1,0,0]=3 3661 B16R2.252 Brc1cccc(c1)CNc2ccccc2 34a_100000106764_100000698116 [0,1,0,0,0,1|1,0,0]=3 3662 B16R2.252 Brc1cccc(c1)COc2ccccc2 34a_100000210340_100000698116 [0,1,0,0,0,1|0,0,0]=2 3663 B16R2.252 Brc1cccc(c1)COc2ccccc2 7a_100000210340_100000211773 [0,1,0,0,0,1|0,0,0]=2 3664 B16R2.252 Brc1cccc(c1)COc2cccnc2 34a_100000210849_100000698116 [0,1,0,0,0,1|1,0,0]=3 3665 B16R2.252 Brc1cccc(c1)COc2cccnc2 7a_100000210849_100000211773 [0,1,0,0,0,1|1,0,0]=3 3666 B16R2.252 Brc1cccc(c1)COc2ccncc2 34a_100000212176_100000698116 [0,1,0,0,0,1|1,0,0]=3 3667 B16R2.252 Brc1cccc(c1)COc2ccnnc2 34a_100015204005_100000698116 [0,1,0,0,0,1|2,0,0]=4 3668 B16R2.252 Brc1cccc(c1)COc2cncnc2 7a_100000754086_100000211773 [0,1,0,0,0,1|2,0,0]=4 3669 B16R2.252 Brc1cccc(c1)CSc2ccccc2 62a_100000211773_100000041952 [0,1,0,0,0,1|0,1,0]=3 3670 B16R2.252 Brc1cccc(c1)CSc2ccccc2 62a_100000719477_100000211773 [0,1,0,0,0,1|0,1,0]=3 3671 B16R2.252 Brc1cccc(c1)CSc2ccccn2 62a_100000211773_100011216584 [0,1,0,0,0,1|1,1,0]=4 3672 B16R2.252 Brc1cccc(c1)CSc2ccccn2 62a_100011216584_100000211773 [0,1,0,0,0,1|1,1,0]=4 3673 B16R2.252 Brc1cccc(c1)CSc2cccnc2 62a_100000210063_100000211773 [0,1,0,0,0,1|1,1,0]=4 3674 B16R2.252 Brc1cccc(c1)CSc2cccnc2 62a_100000211773_100000210063 [0,1,0,0,0,1|1,1,0]=4 3675 B16R2.252 Brc1cccc(c1)CSc2ccncc2 62a_100000211773_100000728582 [0,1,0,0,0,1|1,1,0]=4 3676 B16R2.252 Brc1cccc(c1)CSc2ccncc2 62a_100000728582_100000211773 [0,1,0,0,0,1|1,1,0]=4 3677 B16R2.252 Brc1cccc(c1)NCc2ccccc2 207a_100000210019_100015611070 [0,1,0,0,0,1|1,0,0]=3 3678 B16R2.252 Brc1cccc(c1)NCc2ccccc2 270302a_100000210019_100015611070 [0,1,0,0,0,1|1,0,0]=3 3679 B16R2.252 Brc1cccc(c1)NCc2ccccc2 34a_100000210019_100015291786 [0,1,0,0,0,1|1,0,0]=3 3680 B16R2.252 Brc1cccc(c1)NCc2ccccn2 207a_100000210019_100000209966 [0,1,0,0,0,1|2,0,0]=4 3681 B16R2.252 Brc1cccc(c1)NCc2ccccn2 270302a_100000210019_100000209966 [0,1,0,0,0,1|2,0,0]=4 3682 B16R2.252 Brc1cccc(c1)NCc2ccccn2 34a_100000210019_100000721315 [0,1,0,0,0,1|2,0,0]=4 3683 B16R2.252 Brc1cccc(c1)NCc2cccnc2 207a_100000210019_100000209961 [0,1,0,0,0,1|2,0,0]=4 3684 B16R2.252 Brc1cccc(c1)NCc2cccnc2 270302a_100000210019_100000209961 [0,1,0,0,0,1|2,0,0]=4 3685 B16R2.252 Brc1cccc(c1)NCc2cccnc2 34a_100000210019_100000733263 [0,1,0,0,0,1|2,0,0]=4 3686 B16R2.252 Brc1cccc(c1)NCc2ccncc2 207a_100000210019_100000186114 [0,1,0,0,0,1|2,0,0]=4 3687 B16R2.252 Brc1cccc(c1)OCc2ccccc2 34a_100000210342_100015291786 [0,1,0,0,0,1|0,0,0]=2 3688 B16R2.252 Brc1cccc(c1)OCc2ccccc2 7a_100000210342_100000211182 [0,1,0,0,0,1|0,0,0]=2 3689 B16R2.252 Brc1cccc(c1)OCc2ccccn2 34a_100000210342_100000721315 [0,1,0,0,0,1|1,0,0]=3 3690 B16R2.252 Brc1cccc(c1)OCc2ccccn2 7a_100000210342_100000721315 [0,1,0,0,0,1|1,0,0]=3 3691 B16R2.252 Brc1cccc(c1)OCc2cccnc2 34a_100000210342_100000733263 [0,1,0,0,0,1|1,0,0]=3 3692 B16R2.252 Brc1cccc(c1)OCc2cccnc2 7a_100000210342_100000741622 [0,1,0,0,0,1|1,0,0]=3 3693 B16R2.252 Brc1cccc(c1)OCc2cccnn2 34a_100000210342_100016990269 [0,1,0,0,0,1|2,0,0]=4 3694 B16R2.252 Brc1cccc(c1)OCc2cccnn2 7a_100000210342_100016990269 [0,1,0,0,0,1|2,0,0]=4 3695 B16R2.252 Brc1cccc(c1)OCc2ccncc2 7a_100000210342_100015193705 [0,1,0,0,0,1|1,0,0]=3 3696 B16R2.252 Brc1cccc(c1)OCc2cnccn2 34a_100000210342_100016995436 [0,1,0,0,0,1|2,0,0]=4 3697 B16R2.252 Brc1cccc(c1)OCc2cnccn2 7a_100000210342_100016995436 [0,1,0,0,0,1|2,0,0]=4 3698 B16R2.252 Brc1cccc(c1)OCc2cncnc2 34a_100000210342_100015196519 [0,1,0,0,0,1|2,0,0]=4 3699 B16R2.252 Brc1cccc(c1)OCc2cncnc2 7a_100000210342_100015196519 [0,1,0,0,0,1|2,0,0]=4 3700 B16R2.252 Brc1cccc(c1)OCc2ncccn2 34a_100000210342_100000703007 [0,1,0,0,0,1|2,0,0]=4 3701 B16R2.252 Brc1cccc(c1)OCc2ncccn2 7a_100000210342_100000703007 [0,1,0,0,0,1|2,0,0]=4 3702 B16R2.252 Brc1cccc(c1)SCc2ccccc2 62a_100000211182_100000691529 [0,1,0,0,0,1|0,1,0]=3 3703 B16R2.252 Brc1cccc(c1)SCc2ccccc2 62a_100000691529_100015291786 [0,1,0,0,0,1|0,1,0]=3 3704 B16R2.252 Brc1cccc(c1)SCc2ccccn2 62a_100000691529_100000721315 [0,1,0,0,0,1|1,1,0]=4 3705 B16R2.252 Brc1cccc(c1)SCc2ccccn2 62a_100000721315_100000691529 [0,1,0,0,0,1|1,1,0]=4 3706 B16R2.252 Brc1cccc(c1)SCc2cccnc2 62a_100000691529_100000741622 [0,1,0,0,0,1|1,1,0]=4 3707 B16R2.252 Brc1cccc(c1)SCc2cccnc2 62a_100000741622_100000691529 [0,1,0,0,0,1|1,1,0]=4 3708 B16R2.252 Brc1cccc(c1)SCc2ccncc2 62a_100000691529_100015193705 [0,1,0,0,0,1|1,1,0]=4 3709 B16R2.252 Brc1cccc(c1)SCc2ccncc2 62a_100015193705_100000691529 [0,1,0,0,0,1|1,1,0]=4 3710 B16R2.252 Brc1cccc(n1)C#Cc2ccccc2 271570a_100000069678_100000684672 [0,1,0,0,0,1|2,0,0]=4 3711 B16R2.252 Brc1cccc(n1)C=Cc2ccccc2 271570a_100102527694_100000684672 [0,1,0,0,0,1|2,0,0]=4 3712 B16R2.252 Brc1cccc(n1)CNc2ccccc2 34a_100000106764_100009889011 [0,1,0,0,0,1|2,0,0]=4 3713 B16R2.252 Brc1cccc(n1)COc2ccccc2 34a_100000210340_100009889011 [0,1,0,0,0,1|1,0,0]=3 3714 B16R2.252 Brc1cccc(n1)COc2ccccc2 7a_100000210340_100009889011 [0,1,0,0,0,1|1,0,0]=3 3715 B16R2.252 Brc1cccc(n1)COc2cccnc2 34a_100000210849_100009889011 [0,1,0,0,0,1|2,0,0]=4 3716 B16R2.252 Brc1cccc(n1)COc2cccnc2 7a_100000210849_100009889011 [0,1,0,0,0,1|2,0,0]=4 3717 B16R2.252 Brc1cccc(n1)COc2ccncc2 34a_100000212176_100009889011 [0,1,0,0,0,1|2,0,0]=4 3718 B16R2.252 Brc1cccc(n1)CSc2ccccc2 62a_100000719477_100009889011 [0,1,0,0,0,1|1,1,0]=4 3719 B16R2.252 Brc1cccc(n1)CSc2ccccc2 62a_100009889011_100000041952 [0,1,0,0,0,1|1,1,0]=4 3720 B16R2.252 Brc1cccc(n1)SCc2ccccc2 62a_100000211182_100000684672 [0,1,0,0,0,1|1,1,0]=4 3721 B16R2.252 Brc1cccc(n1)SCc2ccccc2 62a_100000684672_100015291786 [0,1,0,0,0,1|1,1,0]=4 3722 B16R2.252 Brc1ccnc(c1)CNc2ccccc2 34a_100000106764_100010173614 [0,1,0,0,0,1|2,0,0]=4 3723 B16R2.252 Brc1ccnc(c1)COc2ccccc2 34a_100000210340_100010173614 [0,1,0,0,0,1|1,0,0]=3 3724 B16R2.252 Brc1ccnc(c1)COc2ccccc2 7a_100000210340_100010173614 [0,1,0,0,0,1|1,0,0]=3 3725 B16R2.252 Brc1ccnc(c1)COc2cccnc2 34a_100000210849_100010173614 [0,1,0,0,0,1|2,0,0]=4 3726 B16R2.252 Brc1ccnc(c1)COc2cccnc2 7a_100000210849_100010173614 [0,1,0,0,0,1|2,0,0]=4 3727 B16R2.252 Brc1ccnc(c1)COc2ccncc2 34a_100000212176_100010173614 [0,1,0,0,0,1|2,0,0]=4 3728 B16R2.252 Brc1ccnc(c1)CSc2ccccc2 62a_100000719477_100010173614 [0,1,0,0,0,1|1,1,0]=4 3729 B16R2.252 Brc1ccnc(c1)CSc2ccccc2 62a_100010173614_100000041952 [0,1,0,0,0,1|1,1,0]=4 3730 B16R2.252 Brc1cncc(c1)C#Cc2ccccc2 271570a_100000069678_100000728054 [0,1,0,0,0,1|2,0,0]=4 3731 B16R2.252 Brc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100000728054 [0,1,0,0,0,1|2,0,0]=4 3732 B16R2.252 Brc1cncc(c1)CNc2ccccc2 207a_100000106764_100000687066 [0,1,0,0,0,1|2,0,0]=4 3733 B16R2.252 Brc1cncc(c1)CNc2ccccc2 270302a_100000106764_100000687066 [0,1,0,0,0,1|2,0,0]=4 3734 B16R2.252 Brc1cncc(c1)CNc2ccccc2 34a_100000106764_100000738771 [0,1,0,0,0,1|2,0,0]=4 3735 B16R2.252 Brc1cncc(c1)COc2ccccc2 34a_100000210340_100000738771 [0,1,0,0,0,1|1,0,0]=3 3736 B16R2.252 Brc1cncc(c1)COc2ccccc2 7a_100000210340_100000738771 [0,1,0,0,0,1|1,0,0]=3 3737 B16R2.252 Brc1cncc(c1)COc2cccnc2 34a_100000210849_100000738771 [0,1,0,0,0,1|2,0,0]=4 3738 B16R2.252 Brc1cncc(c1)COc2cccnc2 7a_100000210849_100000738771 [0,1,0,0,0,1|2,0,0]=4 3739 B16R2.252 Brc1cncc(c1)COc2ccncc2 34a_100000212176_100000738771 [0,1,0,0,0,1|2,0,0]=4 3740 B16R2.252 Brc1cncc(c1)CSc2ccccc2 62a_100000719477_100000738771 [0,1,0,0,0,1|1,1,0]=4 3741 B16R2.252 Brc1cncc(c1)CSc2ccccc2 62a_100000738771_100000041952 [0,1,0,0,0,1|1,1,0]=4 3742 B16R2.252 Brc1cncc(c1)OCc2ccccc2 34a_100000754920_100015291786 [0,1,0,0,0,1|1,0,0]=3 3743 B16R2.252 Brc1cncc(c1)OCc2ccccc2 7a_100000754920_100000211182 [0,1,0,0,0,1|1,0,0]=3 3744 B16R2.252 Brc1cncc(c1)OCc2ccccn2 34a_100000754920_100000721315 [0,1,0,0,0,1|2,0,0]=4 3745 B16R2.252 Brc1cncc(c1)OCc2ccccn2 7a_100000754920_100000721315 [0,1,0,0,0,1|2,0,0]=4 3746 B16R2.252 Brc1cncc(c1)OCc2cccnc2 34a_100000754920_100000733263 [0,1,0,0,0,1|2,0,0]=4 3747 B16R2.252 Brc1cncc(c1)OCc2cccnc2 7a_100000754920_100000741622 [0,1,0,0,0,1|2,0,0]=4 3748 B16R2.252 Brc1cncc(c1)OCc2ccncc2 7a_100000754920_100015193705 [0,1,0,0,0,1|2,0,0]=4 3749 B16R2.252 Brc1cncc(c1)SCc2ccccc2 62a_100000211182_100000728054 [0,1,0,0,0,1|1,1,0]=4 3750 B16R2.252 Brc1cncc(c1)SCc2ccccc2 62a_100000728054_100015291786 [0,1,0,0,0,1|1,1,0]=4 3751 B16R2.252 C[n+]1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100009996589 [0,1,0,0,0,1|2,0,0]=4 3752 B16R2.252 C[n+]1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100009996589 [0,1,0,0,0,1|2,0,0]=4 3753 B16R2.252 C[n+]1cccc(c1)SCc2ccccc2 62a_100000211182_100009996589 [0,1,0,0,0,1|1,1,0]=4 3754 B16R2.252 C[n+]1cccc(c1)SCc2ccccc2 62a_100009996589_100015291786 [0,1,0,0,0,1|1,1,0]=4 3755 B16R2.252 Cc1cc(ccn1)C#Cc2ccccc2 271570a_100000069678_100000758586 [0,1,0,0,0,1|2,0,0]=4 3756 B16R2.252 Cc1cc(ccn1)C=Cc2ccccc2 271570a_100102527694_100000758586 [0,1,0,0,0,1|2,0,0]=4 3757 B16R2.252 Cc1cc(ccn1)CNc2ccccc2 207a_100000106764_100011361630 [0,1,0,0,0,1|2,0,0]=4 3758 B16R2.252 Cc1cc(ccn1)CNc2ccccc2 34a_100000106764_200020672517 [0,1,0,0,0,1|2,0,0]=4 3759 B16R2.252 Cc1cc(ccn1)COc2ccccc2 34a_100000210340_200020672517 [0,1,0,0,0,1|1,0,0]=3 3760 B16R2.252 Cc1cc(ccn1)COc2ccccc2 7a_100000210340_200020672517 [0,1,0,0,0,1|1,0,0]=3 3761 B16R2.252 Cc1cc(ccn1)COc2cccnc2 34a_100000210849_200020672517 [0,1,0,0,0,1|2,0,0]=4 3762 B16R2.252 Cc1cc(ccn1)COc2cccnc2 7a_100000210849_200020672517 [0,1,0,0,0,1|2,0,0]=4 3763 B16R2.252 Cc1cc(ccn1)COc2ccncc2 34a_100000212176_200020672517 [0,1,0,0,0,1|2,0,0]=4 3764 B16R2.252 Cc1cc(ccn1)CSc2ccccc2 62a_100000719477_200020672517 [0,1,0,0,0,1|1,1,0]=4 3765 B16R2.252 Cc1cc(ccn1)CSc2ccccc2 62a_200020672517_100000041952 [0,1,0,0,0,1|1,1,0]=4 3766 B16R2.252 Cc1cc(ccn1)NCc2ccccc2 27a_100015324214_100000758586 [0,1,0,0,0,1|2,0,0]=4 3767 B16R2.252 Cc1cc(ccn1)OCc2ccccc2 34a_100000688365_100015291786 [0,1,0,0,0,1|1,0,0]=3 3768 B16R2.252 Cc1cc(ccn1)OCc2ccccn2 34a_100000688365_100000721315 [0,1,0,0,0,1|2,0,0]=4 3769 B16R2.252 Cc1cc(ccn1)OCc2cccnc2 34a_100000688365_100000733263 [0,1,0,0,0,1|2,0,0]=4 3770 B16R2.252 Cc1cc(ccn1)SCc2ccccc2 62a_100000211182_100000758586 [0,1,0,0,0,1|1,1,0]=4 3771 B16R2.252 Cc1cc(ccn1)SCc2ccccc2 62a_100000758586_100015291786 [0,1,0,0,0,1|1,1,0]=4 3772 B16R2.252 Cc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100011215228 [0,1,0,0,0,1|1,0,0]=3 3773 B16R2.252 Cc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100011215228 [0,1,0,0,0,1|1,0,0]=3 3774 B16R2.252 Cc1cccc(c1)C=Cc2ccccc2 271570a_200135466880_100000210277 [0,1,0,0,0,1|1,0,0]=3 3775 B16R2.252 Cc1cccc(c1)C=Cc2ccccn2 271570a_200135466880_100011216584 [0,1,0,0,0,1|2,0,0]=4 3776 B16R2.252 Cc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100011215228 [0,1,0,0,0,1|2,0,0]=4 3777 B16R2.252 Cc1cccc(c1)C=Cc2cccnc2 271570a_200135466880_100000752921 [0,1,0,0,0,1|2,0,0]=4 3778 B16R2.252 Cc1cccc(c1)C=Cc2ccncc2 271570a_200135466880_100000035832 [0,1,0,0,0,1|2,0,0]=4 3779 B16R2.252 Cc1cccc(c1)CNc2ccccc2 207a_100000106764_100000211157 [0,1,0,0,0,1|1,0,0]=3 3780 B16R2.252 Cc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000211157 [0,1,0,0,0,1|1,0,0]=3 3781 B16R2.252 Cc1cccc(c1)CNc2ccccc2 34a_100000106764_100000211840 [0,1,0,0,0,1|1,0,0]=3 3782 B16R2.252 Cc1cccc(c1)COc2ccccc2 34a_100000210340_100000211840 [0,1,0,0,0,1|0,0,0]=2 3783 B16R2.252 Cc1cccc(c1)COc2ccccc2 7a_100000210340_100000211840 [0,1,0,0,0,1|0,0,0]=2 3784 B16R2.252 Cc1cccc(c1)COc2cccnc2 34a_100000210849_100000211840 [0,1,0,0,0,1|1,0,0]=3 3785 B16R2.252 Cc1cccc(c1)COc2cccnc2 7a_100000210849_100000211840 [0,1,0,0,0,1|1,0,0]=3 3786 B16R2.252 Cc1cccc(c1)COc2ccncc2 34a_100000212176_100000211840 [0,1,0,0,0,1|1,0,0]=3 3787 B16R2.252 Cc1cccc(c1)COc2ccnnc2 34a_100015204005_100000211840 [0,1,0,0,0,1|2,0,0]=4 3788 B16R2.252 Cc1cccc(c1)COc2cncnc2 7a_100000754086_100000211840 [0,1,0,0,0,1|2,0,0]=4 3789 B16R2.252 Cc1cccc(c1)CSc2ccccc2 62a_100000211840_100000041952 [0,1,0,0,0,1|0,1,0]=3 3790 B16R2.252 Cc1cccc(c1)CSc2ccccc2 62a_100000719477_100000211840 [0,1,0,0,0,1|0,1,0]=3 3791 B16R2.252 Cc1cccc(c1)CSc2ccccn2 62a_100000211840_100011216584 [0,1,0,0,0,1|1,1,0]=4 3792 B16R2.252 Cc1cccc(c1)CSc2ccccn2 62a_100011216584_100000211840 [0,1,0,0,0,1|1,1,0]=4 3793 B16R2.252 Cc1cccc(c1)CSc2cccnc2 62a_100000210063_100000211840 [0,1,0,0,0,1|1,1,0]=4 3794 B16R2.252 Cc1cccc(c1)CSc2cccnc2 62a_100000211840_100000210063 [0,1,0,0,0,1|1,1,0]=4 3795 B16R2.252 Cc1cccc(c1)CSc2ccncc2 62a_100000211840_100000728582 [0,1,0,0,0,1|1,1,0]=4 3796 B16R2.252 Cc1cccc(c1)CSc2ccncc2 62a_100000728582_100000211840 [0,1,0,0,0,1|1,1,0]=4 3797 B16R2.252 Cc1cccc(c1)NCc2ccccc2 207a_100000188690_100015611070 [0,1,0,0,0,1|1,0,0]=3 3798 B16R2.252 Cc1cccc(c1)NCc2ccccc2 2230a_100000188690_100015291786 [0,1,0,0,0,1|1,0,0]=3 3799 B16R2.252 Cc1cccc(c1)NCc2ccccc2 270302a_100000188690_100015611070 [0,1,0,0,0,1|1,0,0]=3 3800 B16R2.252 Cc1cccc(c1)NCc2ccccc2 34a_100000188690_100015291786 [0,1,0,0,0,1|1,0,0]=3 3801 B16R2.252 Cc1cccc(c1)NCc2ccccn2 207a_100000188690_100000209966 [0,1,0,0,0,1|2,0,0]=4 3802 B16R2.252 Cc1cccc(c1)NCc2ccccn2 2230a_100000188690_100000721315 [0,1,0,0,0,1|2,0,0]=4 3803 B16R2.252 Cc1cccc(c1)NCc2ccccn2 270302a_100000188690_100000209966 [0,1,0,0,0,1|2,0,0]=4 3804 B16R2.252 Cc1cccc(c1)NCc2ccccn2 34a_100000188690_100000721315 [0,1,0,0,0,1|2,0,0]=4 3805 B16R2.252 Cc1cccc(c1)NCc2cccnc2 207a_100000188690_100000209961 [0,1,0,0,0,1|2,0,0]=4 3806 B16R2.252 Cc1cccc(c1)NCc2cccnc2 2230a_100000188690_100000741622 [0,1,0,0,0,1|2,0,0]=4 3807 B16R2.252 Cc1cccc(c1)NCc2cccnc2 270302a_100000188690_100000209961 [0,1,0,0,0,1|2,0,0]=4 3808 B16R2.252 Cc1cccc(c1)NCc2cccnc2 34a_100000188690_100000733263 [0,1,0,0,0,1|2,0,0]=4 3809 B16R2.252 Cc1cccc(c1)NCc2ccncc2 207a_100000188690_100000186114 [0,1,0,0,0,1|2,0,0]=4 3810 B16R2.252 Cc1cccc(c1)NCc2ccncc2 2230a_100000188690_100015193705 [0,1,0,0,0,1|2,0,0]=4 3811 B16R2.252 Cc1cccc(c1)OCc2ccccc2 34a_100000210337_100015291786 [0,1,0,0,0,1|0,0,0]=2 3812 B16R2.252 Cc1cccc(c1)OCc2ccccc2 7a_100000210337_100000211182 [0,1,0,0,0,1|0,0,0]=2 3813 B16R2.252 Cc1cccc(c1)OCc2ccccn2 34a_100000210337_100000721315 [0,1,0,0,0,1|1,0,0]=3 3814 B16R2.252 Cc1cccc(c1)OCc2ccccn2 7a_100000210337_100000721315 [0,1,0,0,0,1|1,0,0]=3 3815 B16R2.252 Cc1cccc(c1)OCc2cccnc2 34a_100000210337_100000733263 [0,1,0,0,0,1|1,0,0]=3 3816 B16R2.252 Cc1cccc(c1)OCc2cccnc2 7a_100000210337_100000741622 [0,1,0,0,0,1|1,0,0]=3 3817 B16R2.252 Cc1cccc(c1)OCc2cccnn2 34a_100000210337_100016990269 [0,1,0,0,0,1|2,0,0]=4 3818 B16R2.252 Cc1cccc(c1)OCc2cccnn2 7a_100000210337_100016990269 [0,1,0,0,0,1|2,0,0]=4 3819 B16R2.252 Cc1cccc(c1)OCc2ccncc2 7a_100000210337_100015193705 [0,1,0,0,0,1|1,0,0]=3 3820 B16R2.252 Cc1cccc(c1)OCc2cnccn2 34a_100000210337_100016995436 [0,1,0,0,0,1|2,0,0]=4 3821 B16R2.252 Cc1cccc(c1)OCc2cnccn2 7a_100000210337_100016995436 [0,1,0,0,0,1|2,0,0]=4 3822 B16R2.252 Cc1cccc(c1)OCc2cncnc2 34a_100000210337_100015196519 [0,1,0,0,0,1|2,0,0]=4 3823 B16R2.252 Cc1cccc(c1)OCc2cncnc2 7a_100000210337_100015196519 [0,1,0,0,0,1|2,0,0]=4 3824 B16R2.252 Cc1cccc(c1)OCc2ncccn2 34a_100000210337_100000703007 [0,1,0,0,0,1|2,0,0]=4 3825 B16R2.252 Cc1cccc(c1)OCc2ncccn2 7a_100000210337_100000703007 [0,1,0,0,0,1|2,0,0]=4 3826 B16R2.252 Cc1cccc(c1)SCc2ccccc2 62a_100000211182_100011215228 [0,1,0,0,0,1|0,1,0]=3 3827 B16R2.252 Cc1cccc(c1)SCc2ccccc2 62a_100011215228_100015291786 [0,1,0,0,0,1|0,1,0]=3 3828 B16R2.252 Cc1cccc(c1)SCc2ccccn2 62a_100000721315_100011215228 [0,1,0,0,0,1|1,1,0]=4 3829 B16R2.252 Cc1cccc(c1)SCc2ccccn2 62a_100011215228_100000721315 [0,1,0,0,0,1|1,1,0]=4 3830 B16R2.252 Cc1cccc(c1)SCc2cccnc2 62a_100000741622_100011215228 [0,1,0,0,0,1|1,1,0]=4 3831 B16R2.252 Cc1cccc(c1)SCc2cccnc2 62a_100011215228_100000741622 [0,1,0,0,0,1|1,1,0]=4 3832 B16R2.252 Cc1cccc(c1)SCc2ccncc2 62a_100011215228_100015193705 [0,1,0,0,0,1|1,1,0]=4 3833 B16R2.252 Cc1cccc(c1)SCc2ccncc2 62a_100015193705_100011215228 [0,1,0,0,0,1|1,1,0]=4 3834 B16R2.252 Cc1cccc(n1)C#Cc2ccccc2 271570a_100000069678_100000742759 [0,1,0,0,0,1|2,0,0]=4 3835 B16R2.252 Cc1cccc(n1)C=Cc2ccccc2 271570a_100102527694_100000742759 [0,1,0,0,0,1|2,0,0]=4 3836 B16R2.252 Cc1cccc(n1)CNc2ccccc2 207a_100000106764_100011215050 [0,1,0,0,0,1|2,0,0]=4 3837 B16R2.252 Cc1cccc(n1)CNc2ccccc2 34a_100000106764_100000757606 [0,1,0,0,0,1|2,0,0]=4 3838 B16R2.252 Cc1cccc(n1)COc2ccccc2 34a_100000210340_100000757606 [0,1,0,0,0,1|1,0,0]=3 3839 B16R2.252 Cc1cccc(n1)COc2ccccc2 7a_100000210340_100000757606 [0,1,0,0,0,1|1,0,0]=3 3840 B16R2.252 Cc1cccc(n1)COc2cccnc2 34a_100000210849_100000757606 [0,1,0,0,0,1|2,0,0]=4 3841 B16R2.252 Cc1cccc(n1)COc2cccnc2 7a_100000210849_100000757606 [0,1,0,0,0,1|2,0,0]=4 3842 B16R2.252 Cc1cccc(n1)COc2ccncc2 34a_100000212176_100000757606 [0,1,0,0,0,1|2,0,0]=4 3843 B16R2.252 Cc1cccc(n1)CSc2ccccc2 62a_100000719477_100000757606 [0,1,0,0,0,1|1,1,0]=4 3844 B16R2.252 Cc1cccc(n1)CSc2ccccc2 62a_100000757606_100000041952 [0,1,0,0,0,1|1,1,0]=4 3845 B16R2.252 Cc1cccc(n1)SCc2ccccc2 62a_100000211182_100000742759 [0,1,0,0,0,1|1,1,0]=4 3846 B16R2.252 Cc1cccc(n1)SCc2ccccc2 62a_100000742759_100015291786 [0,1,0,0,0,1|1,1,0]=4 3847 B16R2.252 Cc1ccnc(c1)C#Cc2ccccc2 271570a_100000069678_100000750283 [0,1,0,0,0,1|2,0,0]=4 3848 B16R2.252 Cc1ccnc(c1)C=Cc2ccccc2 271570a_100102527694_100000750283 [0,1,0,0,0,1|2,0,0]=4 3849 B16R2.252 Cc1ccnc(c1)CNc2ccccc2 207a_100000106764_100011361488 [0,1,0,0,0,1|2,0,0]=4 3850 B16R2.252 Cc1ccnc(c1)CNc2ccccc2 34a_100000106764_100000718516 [0,1,0,0,0,1|2,0,0]=4 3851 B16R2.252 Cc1ccnc(c1)COc2ccccc2 34a_100000210340_100000718516 [0,1,0,0,0,1|1,0,0]=3 3852 B16R2.252 Cc1ccnc(c1)COc2ccccc2 7a_100000210340_100000718516 [0,1,0,0,0,1|1,0,0]=3 3853 B16R2.252 Cc1ccnc(c1)COc2cccnc2 34a_100000210849_100000718516 [0,1,0,0,0,1|2,0,0]=4 3854 B16R2.252 Cc1ccnc(c1)COc2cccnc2 7a_100000210849_100000718516 [0,1,0,0,0,1|2,0,0]=4 3855 B16R2.252 Cc1ccnc(c1)COc2ccncc2 34a_100000212176_100000718516 [0,1,0,0,0,1|2,0,0]=4 3856 B16R2.252 Cc1ccnc(c1)CSc2ccccc2 62a_100000718516_100000041952 [0,1,0,0,0,1|1,1,0]=4 3857 B16R2.252 Cc1ccnc(c1)CSc2ccccc2 62a_100000719477_100000718516 [0,1,0,0,0,1|1,1,0]=4 3858 B16R2.252 Cc1ccnc(c1)SCc2ccccc2 62a_100000211182_100000750283 [0,1,0,0,0,1|1,1,0]=4 3859 B16R2.252 Cc1ccnc(c1)SCc2ccccc2 62a_100000750283_100015291786 [0,1,0,0,0,1|1,1,0]=4 3860 B16R2.252 Cc1cncc(c1)C#Cc2ccccc2 271570a_100000069678_100000760492 [0,1,0,0,0,1|2,0,0]=4 3861 B16R2.252 Cc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100000760492 [0,1,0,0,0,1|2,0,0]=4 3862 B16R2.252 Cc1cncc(c1)CNc2ccccc2 207a_100000106764_100011998712 [0,1,0,0,0,1|2,0,0]=4 3863 B16R2.252 Cc1cncc(c1)CNc2ccccc2 270302a_100000106764_100011998712 [0,1,0,0,0,1|2,0,0]=4 3864 B16R2.252 Cc1cncc(c1)CNc2ccccc2 34a_100000106764_100000716715 [0,1,0,0,0,1|2,0,0]=4 3865 B16R2.252 Cc1cncc(c1)COc2ccccc2 34a_100000210340_100000716715 [0,1,0,0,0,1|1,0,0]=3 3866 B16R2.252 Cc1cncc(c1)COc2ccccc2 7a_100000210340_100000716715 [0,1,0,0,0,1|1,0,0]=3 3867 B16R2.252 Cc1cncc(c1)COc2cccnc2 34a_100000210849_100000716715 [0,1,0,0,0,1|2,0,0]=4 3868 B16R2.252 Cc1cncc(c1)COc2cccnc2 7a_100000210849_100000716715 [0,1,0,0,0,1|2,0,0]=4 3869 B16R2.252 Cc1cncc(c1)COc2ccncc2 34a_100000212176_100000716715 [0,1,0,0,0,1|2,0,0]=4 3870 B16R2.252 Cc1cncc(c1)CSc2ccccc2 62a_100000716715_100000041952 [0,1,0,0,0,1|1,1,0]=4 3871 B16R2.252 Cc1cncc(c1)CSc2ccccc2 62a_100000719477_100000716715 [0,1,0,0,0,1|1,1,0]=4 3872 B16R2.252 Cc1cncc(c1)OCc2ccccc2 34a_100011830280_100015291786 [0,1,0,0,0,1|1,0,0]=3 3873 B16R2.252 Cc1cncc(c1)OCc2ccccc2 7a_100011830280_100000211182 [0,1,0,0,0,1|1,0,0]=3 3874 B16R2.252 Cc1cncc(c1)OCc2ccccn2 34a_100011830280_100000721315 [0,1,0,0,0,1|2,0,0]=4 3875 B16R2.252 Cc1cncc(c1)OCc2ccccn2 7a_100011830280_100000721315 [0,1,0,0,0,1|2,0,0]=4 3876 B16R2.252 Cc1cncc(c1)OCc2cccnc2 34a_100011830280_100000733263 [0,1,0,0,0,1|2,0,0]=4 3877 B16R2.252 Cc1cncc(c1)OCc2cccnc2 7a_100011830280_100000741622 [0,1,0,0,0,1|2,0,0]=4 3878 B16R2.252 Cc1cncc(c1)OCc2ccncc2 7a_100011830280_100015193705 [0,1,0,0,0,1|2,0,0]=4 3879 B16R2.252 Cc1cncc(c1)SCc2ccccc2 62a_100000211182_100000760492 [0,1,0,0,0,1|1,1,0]=4 3880 B16R2.252 Cc1cncc(c1)SCc2ccccc2 62a_100000760492_100015291786 [0,1,0,0,0,1|1,1,0]=4 3881 B16R2.252 Cc1cnnc(c1)OCc2ccccc2 34a_100000766097_100015291786 [0,1,0,0,0,1|2,0,0]=4 3882 B16R2.252 Clc1cc(ccn1)C#Cc2ccccc2 271570a_100000069678_100000035001 [0,1,0,0,0,1|2,0,0]=4 3883 B16R2.252 Clc1cc(ccn1)C=Cc2ccccc2 271570a_100102527694_100000035001 [0,1,0,0,0,1|2,0,0]=4 3884 B16R2.252 Clc1cc(ccn1)CNc2ccccc2 34a_100000106764_100000764220 [0,1,0,0,0,1|2,0,0]=4 3885 B16R2.252 Clc1cc(ccn1)COc2ccccc2 34a_100000210340_100000764220 [0,1,0,0,0,1|1,0,0]=3 3886 B16R2.252 Clc1cc(ccn1)COc2ccccc2 7a_100000210340_100000764220 [0,1,0,0,0,1|1,0,0]=3 3887 B16R2.252 Clc1cc(ccn1)COc2cccnc2 34a_100000210849_100000764220 [0,1,0,0,0,1|2,0,0]=4 3888 B16R2.252 Clc1cc(ccn1)COc2cccnc2 7a_100000210849_100000764220 [0,1,0,0,0,1|2,0,0]=4 3889 B16R2.252 Clc1cc(ccn1)COc2ccncc2 34a_100000212176_100000764220 [0,1,0,0,0,1|2,0,0]=4 3890 B16R2.252 Clc1cc(ccn1)CSc2ccccc2 62a_100000719477_100000764220 [0,1,0,0,0,1|1,1,0]=4 3891 B16R2.252 Clc1cc(ccn1)CSc2ccccc2 62a_100000764220_100000041952 [0,1,0,0,0,1|1,1,0]=4 3892 B16R2.252 Clc1cc(ccn1)OCc2ccccc2 34a_100000762945_100015291786 [0,1,0,0,0,1|1,0,0]=3 3893 B16R2.252 Clc1cc(ccn1)OCc2ccccn2 34a_100000762945_100000721315 [0,1,0,0,0,1|2,0,0]=4 3894 B16R2.252 Clc1cc(ccn1)OCc2cccnc2 34a_100000762945_100000733263 [0,1,0,0,0,1|2,0,0]=4 3895 B16R2.252 Clc1cc(ccn1)SCc2ccccc2 62a_100000035001_100015291786 [0,1,0,0,0,1|1,1,0]=4 3896 B16R2.252 Clc1cc(ccn1)SCc2ccccc2 62a_100000211182_100000035001 [0,1,0,0,0,1|1,1,0]=4 3897 B16R2.252 Clc1cc(cnn1)OCc2ccccc2 34a_200010734679_100015291786 [0,1,0,0,0,1|2,0,0]=4 3898 B16R2.252 Clc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000699651 [0,1,0,0,0,1|1,0,0]=3 3899 B16R2.252 Clc1cccc(c1)C=Cc2ccccc2 271570a_100102525933_100000210277 [0,1,0,0,0,1|1,0,0]=3 3900 B16R2.252 Clc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000699651 [0,1,0,0,0,1|1,0,0]=3 3901 B16R2.252 Clc1cccc(c1)C=Cc2ccccn2 271570a_100102525933_100011216584 [0,1,0,0,0,1|2,0,0]=4 3902 B16R2.252 Clc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100000699651 [0,1,0,0,0,1|2,0,0]=4 3903 B16R2.252 Clc1cccc(c1)C=Cc2cccnc2 271570a_100102525933_100000752921 [0,1,0,0,0,1|2,0,0]=4 3904 B16R2.252 Clc1cccc(c1)C=Cc2ccncc2 271570a_100102525933_100000035832 [0,1,0,0,0,1|2,0,0]=4 3905 B16R2.252 Clc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210801 [0,1,0,0,0,1|1,0,0]=3 3906 B16R2.252 Clc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210801 [0,1,0,0,0,1|1,0,0]=3 3907 B16R2.252 Clc1cccc(c1)CNc2ccccc2 34a_100000106764_100000187163 [0,1,0,0,0,1|1,0,0]=3 3908 B16R2.252 Clc1cccc(c1)COc2ccccc2 34a_100000210340_100000187163 [0,1,0,0,0,1|0,0,0]=2 3909 B16R2.252 Clc1cccc(c1)COc2ccccc2 7a_100000210340_100000187163 [0,1,0,0,0,1|0,0,0]=2 3910 B16R2.252 Clc1cccc(c1)COc2cccnc2 34a_100000210849_100000187163 [0,1,0,0,0,1|1,0,0]=3 3911 B16R2.252 Clc1cccc(c1)COc2cccnc2 7a_100000210849_100000187163 [0,1,0,0,0,1|1,0,0]=3 3912 B16R2.252 Clc1cccc(c1)COc2ccncc2 34a_100000212176_100000187163 [0,1,0,0,0,1|1,0,0]=3 3913 B16R2.252 Clc1cccc(c1)COc2ccnnc2 34a_100015204005_100000187163 [0,1,0,0,0,1|2,0,0]=4 3914 B16R2.252 Clc1cccc(c1)COc2cncnc2 7a_100000754086_100000187163 [0,1,0,0,0,1|2,0,0]=4 3915 B16R2.252 Clc1cccc(c1)CSc2ccccc2 62a_100000187163_100000041952 [0,1,0,0,0,1|0,1,0]=3 3916 B16R2.252 Clc1cccc(c1)CSc2ccccc2 62a_100000719477_100000187163 [0,1,0,0,0,1|0,1,0]=3 3917 B16R2.252 Clc1cccc(c1)CSc2ccccn2 62a_100000187163_100011216584 [0,1,0,0,0,1|1,1,0]=4 3918 B16R2.252 Clc1cccc(c1)CSc2ccccn2 62a_100011216584_100000187163 [0,1,0,0,0,1|1,1,0]=4 3919 B16R2.252 Clc1cccc(c1)CSc2cccnc2 62a_100000187163_100000210063 [0,1,0,0,0,1|1,1,0]=4 3920 B16R2.252 Clc1cccc(c1)CSc2cccnc2 62a_100000210063_100000187163 [0,1,0,0,0,1|1,1,0]=4 3921 B16R2.252 Clc1cccc(c1)CSc2ccncc2 62a_100000187163_100000728582 [0,1,0,0,0,1|1,1,0]=4 3922 B16R2.252 Clc1cccc(c1)CSc2ccncc2 62a_100000728582_100000187163 [0,1,0,0,0,1|1,1,0]=4 3923 B16R2.252 Clc1cccc(c1)NCc2ccccc2 207a_100000185859_100015611070 [0,1,0,0,0,1|1,0,0]=3 3924 B16R2.252 Clc1cccc(c1)NCc2ccccc2 270302a_100000185859_100015611070 [0,1,0,0,0,1|1,0,0]=3 3925 B16R2.252 Clc1cccc(c1)NCc2ccccc2 34a_100000185859_100015291786 [0,1,0,0,0,1|1,0,0]=3 3926 B16R2.252 Clc1cccc(c1)NCc2ccccn2 207a_100000185859_100000209966 [0,1,0,0,0,1|2,0,0]=4 3927 B16R2.252 Clc1cccc(c1)NCc2ccccn2 270302a_100000185859_100000209966 [0,1,0,0,0,1|2,0,0]=4 3928 B16R2.252 Clc1cccc(c1)NCc2ccccn2 34a_100000185859_100000721315 [0,1,0,0,0,1|2,0,0]=4 3929 B16R2.252 Clc1cccc(c1)NCc2cccnc2 207a_100000185859_100000209961 [0,1,0,0,0,1|2,0,0]=4 3930 B16R2.252 Clc1cccc(c1)NCc2cccnc2 270302a_100000185859_100000209961 [0,1,0,0,0,1|2,0,0]=4 3931 B16R2.252 Clc1cccc(c1)NCc2cccnc2 34a_100000185859_100000733263 [0,1,0,0,0,1|2,0,0]=4 3932 B16R2.252 Clc1cccc(c1)NCc2ccncc2 207a_100000185859_100000186114 [0,1,0,0,0,1|2,0,0]=4 3933 B16R2.252 Clc1cccc(c1)OCc2ccccc2 34a_100000210295_100015291786 [0,1,0,0,0,1|0,0,0]=2 3934 B16R2.252 Clc1cccc(c1)OCc2ccccc2 7a_100000210295_100000211182 [0,1,0,0,0,1|0,0,0]=2 3935 B16R2.252 Clc1cccc(c1)OCc2ccccn2 34a_100000210295_100000721315 [0,1,0,0,0,1|1,0,0]=3 3936 B16R2.252 Clc1cccc(c1)OCc2ccccn2 7a_100000210295_100000721315 [0,1,0,0,0,1|1,0,0]=3 3937 B16R2.252 Clc1cccc(c1)OCc2cccnc2 34a_100000210295_100000733263 [0,1,0,0,0,1|1,0,0]=3 3938 B16R2.252 Clc1cccc(c1)OCc2cccnc2 7a_100000210295_100000741622 [0,1,0,0,0,1|1,0,0]=3 3939 B16R2.252 Clc1cccc(c1)OCc2cccnn2 34a_100000210295_100016990269 [0,1,0,0,0,1|2,0,0]=4 3940 B16R2.252 Clc1cccc(c1)OCc2cccnn2 7a_100000210295_100016990269 [0,1,0,0,0,1|2,0,0]=4 3941 B16R2.252 Clc1cccc(c1)OCc2ccncc2 7a_100000210295_100015193705 [0,1,0,0,0,1|1,0,0]=3 3942 B16R2.252 Clc1cccc(c1)OCc2cnccn2 34a_100000210295_100016995436 [0,1,0,0,0,1|2,0,0]=4 3943 B16R2.252 Clc1cccc(c1)OCc2cnccn2 7a_100000210295_100016995436 [0,1,0,0,0,1|2,0,0]=4 3944 B16R2.252 Clc1cccc(c1)OCc2cncnc2 34a_100000210295_100015196519 [0,1,0,0,0,1|2,0,0]=4 3945 B16R2.252 Clc1cccc(c1)OCc2cncnc2 7a_100000210295_100015196519 [0,1,0,0,0,1|2,0,0]=4 3946 B16R2.252 Clc1cccc(c1)OCc2ncccn2 34a_100000210295_100000703007 [0,1,0,0,0,1|2,0,0]=4 3947 B16R2.252 Clc1cccc(c1)OCc2ncccn2 7a_100000210295_100000703007 [0,1,0,0,0,1|2,0,0]=4 3948 B16R2.252 Clc1cccc(c1)SCc2ccccc2 62a_100000211182_100000699651 [0,1,0,0,0,1|0,1,0]=3 3949 B16R2.252 Clc1cccc(c1)SCc2ccccc2 62a_100000699651_100015291786 [0,1,0,0,0,1|0,1,0]=3 3950 B16R2.252 Clc1cccc(c1)SCc2ccccn2 62a_100000699651_100000721315 [0,1,0,0,0,1|1,1,0]=4 3951 B16R2.252 Clc1cccc(c1)SCc2ccccn2 62a_100000721315_100000699651 [0,1,0,0,0,1|1,1,0]=4 3952 B16R2.252 Clc1cccc(c1)SCc2cccnc2 62a_100000699651_100000741622 [0,1,0,0,0,1|1,1,0]=4 3953 B16R2.252 Clc1cccc(c1)SCc2cccnc2 62a_100000741622_100000699651 [0,1,0,0,0,1|1,1,0]=4 3954 B16R2.252 Clc1cccc(c1)SCc2ccncc2 62a_100000699651_100015193705 [0,1,0,0,0,1|1,1,0]=4 3955 B16R2.252 Clc1cccc(c1)SCc2ccncc2 62a_100015193705_100000699651 [0,1,0,0,0,1|1,1,0]=4 3956 B16R2.252 Clc1cccc(n1)CNc2ccccc2 34a_100000106764_100000086093 [0,1,0,0,0,1|2,0,0]=4 3957 B16R2.252 Clc1cccc(n1)COc2ccccc2 34a_100000210340_100000086093 [0,1,0,0,0,1|1,0,0]=3 3958 B16R2.252 Clc1cccc(n1)COc2ccccc2 7a_100000210340_100000086093 [0,1,0,0,0,1|1,0,0]=3 3959 B16R2.252 Clc1cccc(n1)COc2cccnc2 34a_100000210849_100000086093 [0,1,0,0,0,1|2,0,0]=4 3960 B16R2.252 Clc1cccc(n1)COc2cccnc2 7a_100000210849_100000086093 [0,1,0,0,0,1|2,0,0]=4 3961 B16R2.252 Clc1cccc(n1)COc2ccncc2 34a_100000212176_100000086093 [0,1,0,0,0,1|2,0,0]=4 3962 B16R2.252 Clc1cccc(n1)CSc2ccccc2 62a_100000086093_100000041952 [0,1,0,0,0,1|1,1,0]=4 3963 B16R2.252 Clc1cccc(n1)CSc2ccccc2 62a_100000719477_100000086093 [0,1,0,0,0,1|1,1,0]=4 3964 B16R2.252 Clc1cccc(n1)SCc2ccccc2 62a_100000051397_100015291786 [0,1,0,0,0,1|1,1,0]=4 3965 B16R2.252 Clc1cccc(n1)SCc2ccccc2 62a_100000211182_100000051397 [0,1,0,0,0,1|1,1,0]=4 3966 B16R2.252 Clc1ccnc(c1)C#Cc2ccccc2 271570a_100000069678_100010167805 [0,1,0,0,0,1|2,0,0]=4 3967 B16R2.252 Clc1ccnc(c1)C=Cc2ccccc2 271570a_100102527694_100010167805 [0,1,0,0,0,1|2,0,0]=4 3968 B16R2.252 Clc1ccnc(c1)CNc2ccccc2 34a_100000106764_100016988179 [0,1,0,0,0,1|2,0,0]=4 3969 B16R2.252 Clc1ccnc(c1)COc2ccccc2 34a_100000210340_100016988179 [0,1,0,0,0,1|1,0,0]=3 3970 B16R2.252 Clc1ccnc(c1)COc2ccccc2 7a_100000210340_100016988179 [0,1,0,0,0,1|1,0,0]=3 3971 B16R2.252 Clc1ccnc(c1)COc2cccnc2 34a_100000210849_100016988179 [0,1,0,0,0,1|2,0,0]=4 3972 B16R2.252 Clc1ccnc(c1)COc2cccnc2 7a_100000210849_100016988179 [0,1,0,0,0,1|2,0,0]=4 3973 B16R2.252 Clc1ccnc(c1)COc2ccncc2 34a_100000212176_100016988179 [0,1,0,0,0,1|2,0,0]=4 3974 B16R2.252 Clc1ccnc(c1)CSc2ccccc2 62a_100000719477_100016988179 [0,1,0,0,0,1|1,1,0]=4 3975 B16R2.252 Clc1ccnc(c1)CSc2ccccc2 62a_100016988179_100000041952 [0,1,0,0,0,1|1,1,0]=4 3976 B16R2.252 Clc1ccnc(c1)SCc2ccccc2 62a_100000211182_100010167805 [0,1,0,0,0,1|1,1,0]=4 3977 B16R2.252 Clc1ccnc(c1)SCc2ccccc2 62a_100010167805_100015291786 [0,1,0,0,0,1|1,1,0]=4 3978 B16R2.252 Clc1cncc(c1)C#Cc2ccccc2 271570a_100000069678_100000049639 [0,1,0,0,0,1|2,0,0]=4 3979 B16R2.252 Clc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100000049639 [0,1,0,0,0,1|2,0,0]=4 3980 B16R2.252 Clc1cncc(c1)CNc2ccccc2 207a_100000106764_100000088910 [0,1,0,0,0,1|2,0,0]=4 3981 B16R2.252 Clc1cncc(c1)CNc2ccccc2 270302a_100000106764_100000088910 [0,1,0,0,0,1|2,0,0]=4 3982 B16R2.252 Clc1cncc(c1)CNc2ccccc2 34a_100000106764_100016992070 [0,1,0,0,0,1|2,0,0]=4 3983 B16R2.252 Clc1cncc(c1)COc2ccccc2 34a_100000210340_100016992070 [0,1,0,0,0,1|1,0,0]=3 3984 B16R2.252 Clc1cncc(c1)COc2ccccc2 7a_100000210340_100016992070 [0,1,0,0,0,1|1,0,0]=3 3985 B16R2.252 Clc1cncc(c1)COc2cccnc2 34a_100000210849_100016992070 [0,1,0,0,0,1|2,0,0]=4 3986 B16R2.252 Clc1cncc(c1)COc2cccnc2 7a_100000210849_100016992070 [0,1,0,0,0,1|2,0,0]=4 3987 B16R2.252 Clc1cncc(c1)COc2ccncc2 34a_100000212176_100016992070 [0,1,0,0,0,1|2,0,0]=4 3988 B16R2.252 Clc1cncc(c1)CSc2ccccc2 62a_100000719477_100016992070 [0,1,0,0,0,1|1,1,0]=4 3989 B16R2.252 Clc1cncc(c1)CSc2ccccc2 62a_100016992070_100000041952 [0,1,0,0,0,1|1,1,0]=4 3990 B16R2.252 Clc1cncc(c1)OCc2ccccc2 7a_100000032511_100000211182 [0,1,0,0,0,1|1,0,0]=3 3991 B16R2.252 Clc1cncc(c1)OCc2ccccn2 7a_100000032511_100000721315 [0,1,0,0,0,1|2,0,0]=4 3992 B16R2.252 Clc1cncc(c1)OCc2cccnc2 7a_100000032511_100000741622 [0,1,0,0,0,1|2,0,0]=4 3993 B16R2.252 Clc1cncc(c1)OCc2ccncc2 7a_100000032511_100015193705 [0,1,0,0,0,1|2,0,0]=4 3994 B16R2.252 Clc1cncc(c1)SCc2ccccc2 62a_100000049639_100015291786 [0,1,0,0,0,1|1,1,0]=4 3995 B16R2.252 Clc1cncc(c1)SCc2ccccc2 62a_100000211182_100000049639 [0,1,0,0,0,1|1,1,0]=4 3996 B16R2.252 Clc1nccc(n1)COc2ccccc2 34a_100000210340_100000099655 [0,1,0,0,0,1|2,0,0]=4 3997 B16R2.252 Clc1nccc(n1)COc2ccccc2 7a_100000210340_100000099655 [0,1,0,0,0,1|2,0,0]=4 3998 B16R2.252 Fc1cc(ccn1)C#Cc2ccccc2 271570a_100000069678_100009816116 [0,1,0,0,0,1|2,0,0]=4 3999 B16R2.252 Fc1cc(ccn1)C=Cc2ccccc2 271570a_100102527694_100009816116 [0,1,0,0,0,1|2,0,0]=4 4000 B16R2.252 Fc1cc(ccn1)NCc2ccccc2 27a_100015324214_100009816116 [0,1,0,0,0,1|2,0,0]=4 4001 B16R2.252 Fc1cc(ccn1)OCc2ccccc2 34a_100000732698_100015291786 [0,1,0,0,0,1|1,0,0]=3 4002 B16R2.252 Fc1cc(ccn1)OCc2ccccn2 34a_100000732698_100000721315 [0,1,0,0,0,1|2,0,0]=4 4003 B16R2.252 Fc1cc(ccn1)OCc2cccnc2 34a_100000732698_100000733263 [0,1,0,0,0,1|2,0,0]=4 4004 B16R2.252 Fc1cc(ccn1)SCc2ccccc2 62a_100000211182_100009816116 [0,1,0,0,0,1|1,1,0]=4 4005 B16R2.252 Fc1cc(ccn1)SCc2ccccc2 62a_100009816116_100015291786 [0,1,0,0,0,1|1,1,0]=4 4006 B16R2.252 Fc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000685547 [0,1,0,0,0,1|1,0,0]=3 4007 B16R2.252 Fc1cccc(c1)C=Cc2ccccc2 271570a_100102525537_100000210277 [0,1,0,0,0,1|1,0,0]=3 4008 B16R2.252 Fc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000685547 [0,1,0,0,0,1|1,0,0]=3 4009 B16R2.252 Fc1cccc(c1)C=Cc2ccccn2 271570a_100102525537_100011216584 [0,1,0,0,0,1|2,0,0]=4 4010 B16R2.252 Fc1cccc(c1)C=Cc2cccnc2 271570a_100102525537_100000752921 [0,1,0,0,0,1|2,0,0]=4 4011 B16R2.252 Fc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100000685547 [0,1,0,0,0,1|2,0,0]=4 4012 B16R2.252 Fc1cccc(c1)C=Cc2ccncc2 271570a_100102525537_100000035832 [0,1,0,0,0,1|2,0,0]=4 4013 B16R2.252 Fc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210812 [0,1,0,0,0,1|1,0,0]=3 4014 B16R2.252 Fc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210812 [0,1,0,0,0,1|1,0,0]=3 4015 B16R2.252 Fc1cccc(c1)CNc2ccccc2 34a_100000106764_100000187166 [0,1,0,0,0,1|1,0,0]=3 4016 B16R2.252 Fc1cccc(c1)COc2ccccc2 34a_100000210340_100000187166 [0,1,0,0,0,1|0,0,0]=2 4017 B16R2.252 Fc1cccc(c1)COc2ccccc2 7a_100000210340_100000230114 [0,1,0,0,0,1|0,0,0]=2 4018 B16R2.252 Fc1cccc(c1)COc2cccnc2 34a_100000210849_100000187166 [0,1,0,0,0,1|1,0,0]=3 4019 B16R2.252 Fc1cccc(c1)COc2cccnc2 7a_100000210849_100000230114 [0,1,0,0,0,1|1,0,0]=3 4020 B16R2.252 Fc1cccc(c1)COc2ccncc2 34a_100000212176_100000187166 [0,1,0,0,0,1|1,0,0]=3 4021 B16R2.252 Fc1cccc(c1)COc2ccnnc2 34a_100015204005_100000187166 [0,1,0,0,0,1|2,0,0]=4 4022 B16R2.252 Fc1cccc(c1)COc2cncnc2 7a_100000754086_100000230114 [0,1,0,0,0,1|2,0,0]=4 4023 B16R2.252 Fc1cccc(c1)CSc2ccccc2 62a_100000230114_100000041952 [0,1,0,0,0,1|0,1,0]=3 4024 B16R2.252 Fc1cccc(c1)CSc2ccccc2 62a_100000719477_100000230114 [0,1,0,0,0,1|0,1,0]=3 4025 B16R2.252 Fc1cccc(c1)CSc2ccccn2 62a_100000230114_100011216584 [0,1,0,0,0,1|1,1,0]=4 4026 B16R2.252 Fc1cccc(c1)CSc2ccccn2 62a_100011216584_100000230114 [0,1,0,0,0,1|1,1,0]=4 4027 B16R2.252 Fc1cccc(c1)CSc2cccnc2 62a_100000210063_100000230114 [0,1,0,0,0,1|1,1,0]=4 4028 B16R2.252 Fc1cccc(c1)CSc2cccnc2 62a_100000230114_100000210063 [0,1,0,0,0,1|1,1,0]=4 4029 B16R2.252 Fc1cccc(c1)CSc2ccncc2 62a_100000230114_100000728582 [0,1,0,0,0,1|1,1,0]=4 4030 B16R2.252 Fc1cccc(c1)CSc2ccncc2 62a_100000728582_100000230114 [0,1,0,0,0,1|1,1,0]=4 4031 B16R2.252 Fc1cccc(c1)NCc2ccccc2 207a_100000210047_100015611070 [0,1,0,0,0,1|1,0,0]=3 4032 B16R2.252 Fc1cccc(c1)NCc2ccccc2 270302a_100000210047_100015611070 [0,1,0,0,0,1|1,0,0]=3 4033 B16R2.252 Fc1cccc(c1)NCc2ccccc2 34a_100000210047_100015291786 [0,1,0,0,0,1|1,0,0]=3 4034 B16R2.252 Fc1cccc(c1)NCc2ccccn2 207a_100000210047_100000209966 [0,1,0,0,0,1|2,0,0]=4 4035 B16R2.252 Fc1cccc(c1)NCc2ccccn2 270302a_100000210047_100000209966 [0,1,0,0,0,1|2,0,0]=4 4036 B16R2.252 Fc1cccc(c1)NCc2ccccn2 34a_100000210047_100000721315 [0,1,0,0,0,1|2,0,0]=4 4037 B16R2.252 Fc1cccc(c1)NCc2cccnc2 207a_100000210047_100000209961 [0,1,0,0,0,1|2,0,0]=4 4038 B16R2.252 Fc1cccc(c1)NCc2cccnc2 270302a_100000210047_100000209961 [0,1,0,0,0,1|2,0,0]=4 4039 B16R2.252 Fc1cccc(c1)NCc2cccnc2 34a_100000210047_100000733263 [0,1,0,0,0,1|2,0,0]=4 4040 B16R2.252 Fc1cccc(c1)NCc2ccncc2 207a_100000210047_100000186114 [0,1,0,0,0,1|2,0,0]=4 4041 B16R2.252 Fc1cccc(c1)OCc2ccccc2 34a_100000210426_100015291786 [0,1,0,0,0,1|0,0,0]=2 4042 B16R2.252 Fc1cccc(c1)OCc2ccccc2 7a_100000210426_100000211182 [0,1,0,0,0,1|0,0,0]=2 4043 B16R2.252 Fc1cccc(c1)OCc2ccccn2 34a_100000210426_100000721315 [0,1,0,0,0,1|1,0,0]=3 4044 B16R2.252 Fc1cccc(c1)OCc2ccccn2 7a_100000210426_100000721315 [0,1,0,0,0,1|1,0,0]=3 4045 B16R2.252 Fc1cccc(c1)OCc2cccnc2 34a_100000210426_100000733263 [0,1,0,0,0,1|1,0,0]=3 4046 B16R2.252 Fc1cccc(c1)OCc2cccnc2 7a_100000210426_100000741622 [0,1,0,0,0,1|1,0,0]=3 4047 B16R2.252 Fc1cccc(c1)OCc2cccnn2 34a_100000210426_100016990269 [0,1,0,0,0,1|2,0,0]=4 4048 B16R2.252 Fc1cccc(c1)OCc2cccnn2 7a_100000210426_100016990269 [0,1,0,0,0,1|2,0,0]=4 4049 B16R2.252 Fc1cccc(c1)OCc2ccncc2 7a_100000210426_100015193705 [0,1,0,0,0,1|1,0,0]=3 4050 B16R2.252 Fc1cccc(c1)OCc2cnccn2 34a_100000210426_100016995436 [0,1,0,0,0,1|2,0,0]=4 4051 B16R2.252 Fc1cccc(c1)OCc2cnccn2 7a_100000210426_100016995436 [0,1,0,0,0,1|2,0,0]=4 4052 B16R2.252 Fc1cccc(c1)OCc2cncnc2 34a_100000210426_100015196519 [0,1,0,0,0,1|2,0,0]=4 4053 B16R2.252 Fc1cccc(c1)OCc2cncnc2 7a_100000210426_100015196519 [0,1,0,0,0,1|2,0,0]=4 4054 B16R2.252 Fc1cccc(c1)OCc2ncccn2 34a_100000210426_100000703007 [0,1,0,0,0,1|2,0,0]=4 4055 B16R2.252 Fc1cccc(c1)OCc2ncccn2 7a_100000210426_100000703007 [0,1,0,0,0,1|2,0,0]=4 4056 B16R2.252 Fc1cccc(c1)SCc2ccccc2 62a_100000211182_100000685547 [0,1,0,0,0,1|0,1,0]=3 4057 B16R2.252 Fc1cccc(c1)SCc2ccccc2 62a_100000685547_100015291786 [0,1,0,0,0,1|0,1,0]=3 4058 B16R2.252 Fc1cccc(c1)SCc2ccccn2 62a_100000685547_100000721315 [0,1,0,0,0,1|1,1,0]=4 4059 B16R2.252 Fc1cccc(c1)SCc2ccccn2 62a_100000721315_100000685547 [0,1,0,0,0,1|1,1,0]=4 4060 B16R2.252 Fc1cccc(c1)SCc2cccnc2 62a_100000685547_100000741622 [0,1,0,0,0,1|1,1,0]=4 4061 B16R2.252 Fc1cccc(c1)SCc2cccnc2 62a_100000741622_100000685547 [0,1,0,0,0,1|1,1,0]=4 4062 B16R2.252 Fc1cccc(c1)SCc2ccncc2 62a_100000685547_100015193705 [0,1,0,0,0,1|1,1,0]=4 4063 B16R2.252 Fc1cccc(c1)SCc2ccncc2 62a_100015193705_100000685547 [0,1,0,0,0,1|1,1,0]=4 4064 B16R2.252 Fc1cccc(n1)C#Cc2ccccc2 271570a_100000069678_100009815982 [0,1,0,0,0,1|2,0,0]=4 4065 B16R2.252 Fc1cccc(n1)C=Cc2ccccc2 271570a_100102527694_100009815982 [0,1,0,0,0,1|2,0,0]=4 4066 B16R2.252 Fc1cccc(n1)CNc2ccccc2 34a_100000106764_100009819644 [0,1,0,0,0,1|2,0,0]=4 4067 B16R2.252 Fc1cccc(n1)COc2ccccc2 34a_100000210340_100009819644 [0,1,0,0,0,1|1,0,0]=3 4068 B16R2.252 Fc1cccc(n1)COc2ccccc2 7a_100000210340_100009819644 [0,1,0,0,0,1|1,0,0]=3 4069 B16R2.252 Fc1cccc(n1)COc2cccnc2 34a_100000210849_100009819644 [0,1,0,0,0,1|2,0,0]=4 4070 B16R2.252 Fc1cccc(n1)COc2cccnc2 7a_100000210849_100009819644 [0,1,0,0,0,1|2,0,0]=4 4071 B16R2.252 Fc1cccc(n1)COc2ccncc2 34a_100000212176_100009819644 [0,1,0,0,0,1|2,0,0]=4 4072 B16R2.252 Fc1cccc(n1)CSc2ccccc2 62a_100000719477_100009819644 [0,1,0,0,0,1|1,1,0]=4 4073 B16R2.252 Fc1cccc(n1)CSc2ccccc2 62a_100009819644_100000041952 [0,1,0,0,0,1|1,1,0]=4 4074 B16R2.252 Fc1cccc(n1)NCc2ccccc2 27a_100015324214_100009815982 [0,1,0,0,0,1|2,0,0]=4 4075 B16R2.252 Fc1cccc(n1)OCc2ccccc2 34a_100011432558_100015291786 [0,1,0,0,0,1|1,0,0]=3 4076 B16R2.252 Fc1cccc(n1)OCc2ccccn2 34a_100011432558_100000721315 [0,1,0,0,0,1|2,0,0]=4 4077 B16R2.252 Fc1cccc(n1)OCc2cccnc2 34a_100011432558_100000733263 [0,1,0,0,0,1|2,0,0]=4 4078 B16R2.252 Fc1cccc(n1)SCc2ccccc2 62a_100000211182_100009815982 [0,1,0,0,0,1|1,1,0]=4 4079 B16R2.252 Fc1cccc(n1)SCc2ccccc2 62a_100009815982_100015291786 [0,1,0,0,0,1|1,1,0]=4 4080 B16R2.252 Fc1ccnc(c1)C#Cc2ccccc2 271570a_100000069678_100009817058 [0,1,0,0,0,1|2,0,0]=4 4081 B16R2.252 Fc1ccnc(c1)C=Cc2ccccc2 271570a_100102527694_100009817058 [0,1,0,0,0,1|2,0,0]=4 4082 B16R2.252 Fc1ccnc(c1)NCc2ccccc2 27a_100015324214_100000764206 [0,1,0,0,0,1|2,0,0]=4 4083 B16R2.252 Fc1ccnc(c1)SCc2ccccc2 62a_100000211182_100000764206 [0,1,0,0,0,1|1,1,0]=4 4084 B16R2.252 Fc1ccnc(c1)SCc2ccccc2 62a_100000764206_100015291786 [0,1,0,0,0,1|1,1,0]=4 4085 B16R2.252 Fc1cncc(c1)C#Cc2ccccc2 271570a_100000069678_100000744099 [0,1,0,0,0,1|2,0,0]=4 4086 B16R2.252 Fc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100000744099 [0,1,0,0,0,1|2,0,0]=4 4087 B16R2.252 Fc1cncc(c1)CNc2ccccc2 207a_100000106764_100011361476 [0,1,0,0,0,1|2,0,0]=4 4088 B16R2.252 Fc1cncc(c1)CNc2ccccc2 270302a_100000106764_100011361476 [0,1,0,0,0,1|2,0,0]=4 4089 B16R2.252 Fc1cncc(c1)CNc2ccccc2 34a_100000106764_100000725299 [0,1,0,0,0,1|2,0,0]=4 4090 B16R2.252 Fc1cncc(c1)COc2ccccc2 34a_100000210340_100000725299 [0,1,0,0,0,1|1,0,0]=3 4091 B16R2.252 Fc1cncc(c1)COc2ccccc2 7a_100000210340_100000725299 [0,1,0,0,0,1|1,0,0]=3 4092 B16R2.252 Fc1cncc(c1)COc2cccnc2 34a_100000210849_100000725299 [0,1,0,0,0,1|2,0,0]=4 4093 B16R2.252 Fc1cncc(c1)COc2cccnc2 7a_100000210849_100000725299 [0,1,0,0,0,1|2,0,0]=4 4094 B16R2.252 Fc1cncc(c1)COc2ccncc2 34a_100000212176_100000725299 [0,1,0,0,0,1|2,0,0]=4 4095 B16R2.252 Fc1cncc(c1)CSc2ccccc2 62a_100000719477_100000725299 [0,1,0,0,0,1|1,1,0]=4 4096 B16R2.252 Fc1cncc(c1)CSc2ccccc2 62a_100000725299_100000041952 [0,1,0,0,0,1|1,1,0]=4 4097 B16R2.252 Fc1cncc(c1)OCc2ccccc2 34a_100011830296_100015291786 [0,1,0,0,0,1|1,0,0]=3 4098 B16R2.252 Fc1cncc(c1)OCc2ccccc2 7a_100011830296_100000211182 [0,1,0,0,0,1|1,0,0]=3 4099 B16R2.252 Fc1cncc(c1)OCc2ccccn2 34a_100011830296_100000721315 [0,1,0,0,0,1|2,0,0]=4 4100 B16R2.252 Fc1cncc(c1)OCc2ccccn2 7a_100011830296_100000721315 [0,1,0,0,0,1|2,0,0]=4 4101 B16R2.252 Fc1cncc(c1)OCc2cccnc2 34a_100011830296_100000733263 [0,1,0,0,0,1|2,0,0]=4 4102 B16R2.252 Fc1cncc(c1)OCc2cccnc2 7a_100011830296_100000741622 [0,1,0,0,0,1|2,0,0]=4 4103 B16R2.252 Fc1cncc(c1)OCc2ccncc2 7a_100011830296_100015193705 [0,1,0,0,0,1|2,0,0]=4 4104 B16R2.252 Fc1cncc(c1)SCc2ccccc2 62a_100000211182_100000744099 [0,1,0,0,0,1|1,1,0]=4 4105 B16R2.252 Fc1cncc(c1)SCc2ccccc2 62a_100000744099_100015291786 [0,1,0,0,0,1|1,1,0]=4 4106 B16R2.252 Ic1cccc(c1)CNc2ccccc2 207a_100000106764_100000014684 [0,1,0,0,0,1|1,0,0]=3 4107 B16R2.252 Ic1cccc(c1)CNc2ccccc2 270302a_100000106764_100000014684 [0,1,0,0,0,1|1,0,0]=3 4108 B16R2.252 Ic1cccc(c1)CNc2ccccc2 34a_100000106764_100011218688 [0,1,0,0,0,1|1,0,0]=3 4109 B16R2.252 Ic1cccc(c1)COc2ccccc2 34a_100000210340_100011218688 [0,1,0,0,0,1|0,0,0]=2 4110 B16R2.252 Ic1cccc(c1)COc2ccccc2 7a_100000210340_100011218688 [0,1,0,0,0,1|0,0,0]=2 4111 B16R2.252 Ic1cccc(c1)COc2cccnc2 34a_100000210849_100011218688 [0,1,0,0,0,1|1,0,0]=3 4112 B16R2.252 Ic1cccc(c1)COc2cccnc2 7a_100000210849_100011218688 [0,1,0,0,0,1|1,0,0]=3 4113 B16R2.252 Ic1cccc(c1)COc2ccncc2 34a_100000212176_100011218688 [0,1,0,0,0,1|1,0,0]=3 4114 B16R2.252 Ic1cccc(c1)COc2ccnnc2 34a_100015204005_100011218688 [0,1,0,0,0,1|2,0,0]=4 4115 B16R2.252 Ic1cccc(c1)COc2cncnc2 7a_100000754086_100011218688 [0,1,0,0,0,1|2,0,0]=4 4116 B16R2.252 Ic1cccc(c1)CSc2ccccc2 62a_100000719477_100011218688 [0,1,0,0,0,1|0,1,0]=3 4117 B16R2.252 Ic1cccc(c1)CSc2ccccc2 62a_100011218688_100000041952 [0,1,0,0,0,1|0,1,0]=3 4118 B16R2.252 Ic1cccc(c1)CSc2ccccn2 62a_100011216584_100011218688 [0,1,0,0,0,1|1,1,0]=4 4119 B16R2.252 Ic1cccc(c1)CSc2ccccn2 62a_100011218688_100011216584 [0,1,0,0,0,1|1,1,0]=4 4120 B16R2.252 Ic1cccc(c1)CSc2cccnc2 62a_100000210063_100011218688 [0,1,0,0,0,1|1,1,0]=4 4121 B16R2.252 Ic1cccc(c1)CSc2cccnc2 62a_100011218688_100000210063 [0,1,0,0,0,1|1,1,0]=4 4122 B16R2.252 Ic1cccc(c1)CSc2ccncc2 62a_100000728582_100011218688 [0,1,0,0,0,1|1,1,0]=4 4123 B16R2.252 Ic1cccc(c1)CSc2ccncc2 62a_100011218688_100000728582 [0,1,0,0,0,1|1,1,0]=4 4124 B16R2.252 Ic1cccc(c1)NCc2ccccc2 207a_100000211102_100015611070 [0,1,0,0,0,1|1,0,0]=3 4125 B16R2.252 Ic1cccc(c1)NCc2ccccc2 270302a_100000211102_100015611070 [0,1,0,0,0,1|1,0,0]=3 4126 B16R2.252 Ic1cccc(c1)NCc2ccccc2 34a_100000211102_100015291786 [0,1,0,0,0,1|1,0,0]=3 4127 B16R2.252 Ic1cccc(c1)NCc2ccccn2 207a_100000211102_100000209966 [0,1,0,0,0,1|2,0,0]=4 4128 B16R2.252 Ic1cccc(c1)NCc2ccccn2 270302a_100000211102_100000209966 [0,1,0,0,0,1|2,0,0]=4 4129 B16R2.252 Ic1cccc(c1)NCc2ccccn2 34a_100000211102_100000721315 [0,1,0,0,0,1|2,0,0]=4 4130 B16R2.252 Ic1cccc(c1)NCc2cccnc2 207a_100000211102_100000209961 [0,1,0,0,0,1|2,0,0]=4 4131 B16R2.252 Ic1cccc(c1)NCc2cccnc2 270302a_100000211102_100000209961 [0,1,0,0,0,1|2,0,0]=4 4132 B16R2.252 Ic1cccc(c1)NCc2cccnc2 34a_100000211102_100000733263 [0,1,0,0,0,1|2,0,0]=4 4133 B16R2.252 Ic1cccc(c1)NCc2ccncc2 207a_100000211102_100000186114 [0,1,0,0,0,1|2,0,0]=4 4134 B16R2.252 Ic1cccc(c1)OCc2ccccc2 34a_100000211634_100015291786 [0,1,0,0,0,1|0,0,0]=2 4135 B16R2.252 Ic1cccc(c1)OCc2ccccc2 7a_100000211634_100000211182 [0,1,0,0,0,1|0,0,0]=2 4136 B16R2.252 Ic1cccc(c1)OCc2ccccn2 34a_100000211634_100000721315 [0,1,0,0,0,1|1,0,0]=3 4137 B16R2.252 Ic1cccc(c1)OCc2ccccn2 7a_100000211634_100000721315 [0,1,0,0,0,1|1,0,0]=3 4138 B16R2.252 Ic1cccc(c1)OCc2cccnc2 34a_100000211634_100000733263 [0,1,0,0,0,1|1,0,0]=3 4139 B16R2.252 Ic1cccc(c1)OCc2cccnc2 7a_100000211634_100000741622 [0,1,0,0,0,1|1,0,0]=3 4140 B16R2.252 Ic1cccc(c1)OCc2cccnn2 34a_100000211634_100016990269 [0,1,0,0,0,1|2,0,0]=4 4141 B16R2.252 Ic1cccc(c1)OCc2cccnn2 7a_100000211634_100016990269 [0,1,0,0,0,1|2,0,0]=4 4142 B16R2.252 Ic1cccc(c1)OCc2ccncc2 7a_100000211634_100015193705 [0,1,0,0,0,1|1,0,0]=3 4143 B16R2.252 Ic1cccc(c1)OCc2cnccn2 34a_100000211634_100016995436 [0,1,0,0,0,1|2,0,0]=4 4144 B16R2.252 Ic1cccc(c1)OCc2cnccn2 7a_100000211634_100016995436 [0,1,0,0,0,1|2,0,0]=4 4145 B16R2.252 Ic1cccc(c1)OCc2cncnc2 34a_100000211634_100015196519 [0,1,0,0,0,1|2,0,0]=4 4146 B16R2.252 Ic1cccc(c1)OCc2cncnc2 7a_100000211634_100015196519 [0,1,0,0,0,1|2,0,0]=4 4147 B16R2.252 Ic1cccc(c1)OCc2ncccn2 34a_100000211634_100000703007 [0,1,0,0,0,1|2,0,0]=4 4148 B16R2.252 Ic1cccc(c1)OCc2ncccn2 7a_100000211634_100000703007 [0,1,0,0,0,1|2,0,0]=4 4149 B16R2.252 Nc1cc(ccn1)C#Cc2ccccc2 271570a_100000069678_100000744379 [0,1,0,0,0,1|2,0,0]=4 4150 B16R2.252 Nc1cc(ccn1)C=Cc2ccccc2 271570a_100102527694_100000744379 [0,1,0,0,0,1|2,0,0]=4 4151 B16R2.252 Nc1cc(ccn1)OCc2ccccc2 34a_100011834064_100015291786 [0,1,0,0,0,1|1,0,0]=3 4152 B16R2.252 Nc1cc(ccn1)OCc2ccccn2 34a_100011834064_100000721315 [0,1,0,0,0,1|2,0,0]=4 4153 B16R2.252 Nc1cc(ccn1)OCc2cccnc2 34a_100011834064_100000733263 [0,1,0,0,0,1|2,0,0]=4 4154 B16R2.252 Nc1cc(ccn1)SCc2ccccc2 62a_100000049665_100015291786 [0,1,0,0,0,1|1,1,0]=4 4155 B16R2.252 Nc1cc(ccn1)SCc2ccccc2 62a_100000211182_100000049665 [0,1,0,0,0,1|1,1,0]=4 4156 B16R2.252 Nc1cc(cnn1)OCc2ccccc2 34a_200015193112_100015291786 [0,1,0,0,0,1|2,0,0]=4 4157 B16R2.252 Nc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000210019 [0,1,0,0,0,1|1,0,0]=3 4158 B16R2.252 Nc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000210019 [0,1,0,0,0,1|1,0,0]=3 4159 B16R2.252 Nc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100000210019 [0,1,0,0,0,1|2,0,0]=4 4160 B16R2.252 Nc1cccc(c1)OCc2ccccc2 34a_100000210217_100015291786 [0,1,0,0,0,1|0,0,0]=2 4161 B16R2.252 Nc1cccc(c1)OCc2ccccn2 34a_100000210217_100000721315 [0,1,0,0,0,1|1,0,0]=3 4162 B16R2.252 Nc1cccc(c1)OCc2cccnc2 34a_100000210217_100000733263 [0,1,0,0,0,1|1,0,0]=3 4163 B16R2.252 Nc1cccc(c1)OCc2cccnn2 34a_100000210217_100016990269 [0,1,0,0,0,1|2,0,0]=4 4164 B16R2.252 Nc1cccc(c1)OCc2cnccn2 34a_100000210217_100016995436 [0,1,0,0,0,1|2,0,0]=4 4165 B16R2.252 Nc1cccc(c1)OCc2cncnc2 34a_100000210217_100015196519 [0,1,0,0,0,1|2,0,0]=4 4166 B16R2.252 Nc1cccc(c1)OCc2ncccn2 34a_100000210217_100000703007 [0,1,0,0,0,1|2,0,0]=4 4167 B16R2.252 Nc1cccc(c1)SCc2ccccc2 62a_100000210019_100015291786 [0,1,0,0,0,1|0,1,0]=3 4168 B16R2.252 Nc1cccc(c1)SCc2ccccc2 62a_100000211182_100000210019 [0,1,0,0,0,1|0,1,0]=3 4169 B16R2.252 Nc1cccc(c1)SCc2ccccn2 62a_100000210019_100000721315 [0,1,0,0,0,1|1,1,0]=4 4170 B16R2.252 Nc1cccc(c1)SCc2ccccn2 62a_100000721315_100000210019 [0,1,0,0,0,1|1,1,0]=4 4171 B16R2.252 Nc1cccc(c1)SCc2cccnc2 62a_100000210019_100000741622 [0,1,0,0,0,1|1,1,0]=4 4172 B16R2.252 Nc1cccc(c1)SCc2cccnc2 62a_100000741622_100000210019 [0,1,0,0,0,1|1,1,0]=4 4173 B16R2.252 Nc1cccc(c1)SCc2ccncc2 62a_100000210019_100015193705 [0,1,0,0,0,1|1,1,0]=4 4174 B16R2.252 Nc1cccc(c1)SCc2ccncc2 62a_100015193705_100000210019 [0,1,0,0,0,1|1,1,0]=4 4175 B16R2.252 Nc1cccc(n1)C#Cc2ccccc2 271570a_100000069678_100000740741 [0,1,0,0,0,1|2,0,0]=4 4176 B16R2.252 Nc1cccc(n1)C=Cc2ccccc2 271570a_100102527694_100000740741 [0,1,0,0,0,1|2,0,0]=4 4177 B16R2.252 Nc1cccc(n1)SCc2ccccc2 62a_100000211182_100000740741 [0,1,0,0,0,1|1,1,0]=4 4178 B16R2.252 Nc1cccc(n1)SCc2ccccc2 62a_100000740741_100015291786 [0,1,0,0,0,1|1,1,0]=4 4179 B16R2.252 Nc1ccnc(c1)C#Cc2ccccc2 271570a_100000069678_100009814236 [0,1,0,0,0,1|2,0,0]=4 4180 B16R2.252 Nc1ccnc(c1)C=Cc2ccccc2 271570a_100102527694_100009814236 [0,1,0,0,0,1|2,0,0]=4 4181 B16R2.252 Nc1ccnc(c1)SCc2ccccc2 62a_100000211182_100009814236 [0,1,0,0,0,1|1,1,0]=4 4182 B16R2.252 Nc1ccnc(c1)SCc2ccccc2 62a_100009814236_100015291786 [0,1,0,0,0,1|1,1,0]=4 4183 B16R2.252 Nc1cncc(c1)C#Cc2ccccc2 271570a_100000069678_100000687067 [0,1,0,0,0,1|2,0,0]=4 4184 B16R2.252 Nc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100000687067 [0,1,0,0,0,1|2,0,0]=4 4185 B16R2.252 Nc1cncc(c1)OCc2ccccc2 34a_100011997051_100015291786 [0,1,0,0,0,1|1,0,0]=3 4186 B16R2.252 Nc1cncc(c1)OCc2ccccn2 34a_100011997051_100000721315 [0,1,0,0,0,1|2,0,0]=4 4187 B16R2.252 Nc1cncc(c1)OCc2cccnc2 34a_100011997051_100000733263 [0,1,0,0,0,1|2,0,0]=4 4188 B16R2.252 Nc1cncc(c1)SCc2ccccc2 62a_100000211182_100000687067 [0,1,0,0,0,1|1,1,0]=4 4189 B16R2.252 Nc1cncc(c1)SCc2ccccc2 62a_100000687067_100015291786 [0,1,0,0,0,1|1,1,0]=4 4190 B16R2.252 O=c1cc(cc[nH]1)C#Cc2ccccc2 271570a_100000069678_100009816521 [0,1,0,0,0,1|2,0,0]=4 4191 B16R2.252 O=c1cc(cc[nH]1)C=Cc2ccccc2 271570a_100102527694_100009816521 [0,1,0,0,0,1|2,0,0]=4 4192 B16R2.252 O=c1cc(cc[nH]1)NCc2ccccc2 27a_100015324214_100000061649 [0,1,0,0,0,1|2,0,0]=4 4193 B16R2.252 O=c1cc(cc[nH]1)OCc2ccccc2 34a_100000032262_100015291786 [0,1,0,0,0,1|1,0,0]=3 4194 B16R2.252 O=c1cc(cc[nH]1)OCc2ccccn2 34a_100000032262_100000721315 [0,1,0,0,0,1|2,0,0]=4 4195 B16R2.252 O=c1cc(cc[nH]1)OCc2cccnc2 34a_100000032262_100000733263 [0,1,0,0,0,1|2,0,0]=4 4196 B16R2.252 O=c1cc(cc[nH]1)SCc2ccccc2 62a_100000211182_100009816521 [0,1,0,0,0,1|1,1,0]=4 4197 B16R2.252 O=c1cc(cc[nH]1)SCc2ccccc2 62a_100009816521_100015291786 [0,1,0,0,0,1|1,1,0]=4 4198 B16R2.252 O=c1cc[nH]c(c1)SCc2ccccc2 62a_100009817434_100015291786 [0,1,0,0,0,1|1,1,0]=4 4199 B16R2.252 O=c1cccc([nH]1)C#Cc2ccccc2 271570a_100000069678_100000761760 [0,1,0,0,0,1|2,0,0]=4 4200 B16R2.252 O=c1cccc([nH]1)C=Cc2ccccc2 271570a_100102527694_100000761760 [0,1,0,0,0,1|2,0,0]=4 4201 B16R2.252 O=c1cccc([nH]1)CNc2ccccc2 207a_100000106764_100011935257 [0,1,0,0,0,1|2,0,0]=4 4202 B16R2.252 O=c1cccc([nH]1)OCc2ccccc2 34a_100000033347_100015291786 [0,1,0,0,0,1|1,0,0]=3 4203 B16R2.252 O=c1cccc([nH]1)OCc2ccccn2 34a_100000033347_100000721315 [0,1,0,0,0,1|2,0,0]=4 4204 B16R2.252 O=c1cccc([nH]1)OCc2cccnc2 34a_100000033347_100000733263 [0,1,0,0,0,1|2,0,0]=4 4205 B16R2.252 O=c1cccc([nH]1)SCc2ccccc2 62a_100000211182_100000752884 [0,1,0,0,0,1|1,1,0]=4 4206 B16R2.252 Oc1cc(ccn1)CNc2ccccc2 207a_100000106764_100000688113 [0,1,0,0,0,1|2,0,0]=4 4207 B16R2.252 Oc1cc(ccn1)OCc2ccccc2 271570a_203496583355_200000766317 [0,1,0,0,0,1|1,0,0]=3 4208 B16R2.252 Oc1cc(cnn1)OCc2ccccc2 271570a_203496583355_200010116973 [0,1,0,0,0,1|2,0,0]=4 4209 B16R2.252 Oc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000211634 [0,1,0,0,0,1|1,0,0]=3 4210 B16R2.252 Oc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000211634 [0,1,0,0,0,1|1,0,0]=3 4211 B16R2.252 Oc1cccc(c1)C=Cc2cccnc2 271570a_100102525586_100000211634 [0,1,0,0,0,1|2,0,0]=4 4212 B16R2.252 Oc1cccc(c1)CNc2ccccc2 207a_100000106764_100000188321 [0,1,0,0,0,1|1,0,0]=3 4213 B16R2.252 Oc1cccc(c1)CNc2ccccc2 34a_100000106764_100011660834 [0,1,0,0,0,1|1,0,0]=3 4214 B16R2.252 Oc1cccc(c1)COc2ccccc2 271570a_203496583355_100000173242 [0,1,0,0,0,1|0,0,0]=2 4215 B16R2.252 Oc1cccc(c1)COc2ccccc2 34a_100000210340_100011660834 [0,1,0,0,0,1|0,0,0]=2 4216 B16R2.252 Oc1cccc(c1)COc2ccccc2 7a_100000210340_100000084143 [0,1,0,0,0,1|0,0,0]=2 4217 B16R2.252 Oc1cccc(c1)COc2cccnc2 34a_100000210849_100011660834 [0,1,0,0,0,1|1,0,0]=3 4218 B16R2.252 Oc1cccc(c1)COc2cccnc2 7a_100000210849_100000084143 [0,1,0,0,0,1|1,0,0]=3 4219 B16R2.252 Oc1cccc(c1)COc2ccncc2 34a_100000212176_100011660834 [0,1,0,0,0,1|1,0,0]=3 4220 B16R2.252 Oc1cccc(c1)COc2ccnnc2 34a_100015204005_100011660834 [0,1,0,0,0,1|2,0,0]=4 4221 B16R2.252 Oc1cccc(c1)COc2cncnc2 7a_100000754086_100000084143 [0,1,0,0,0,1|2,0,0]=4 4222 B16R2.252 Oc1cccc(c1)CSc2ccccc2 62a_100000719477_100011660834 [0,1,0,0,0,1|0,1,0]=3 4223 B16R2.252 Oc1cccc(c1)CSc2ccccc2 62a_100011660834_100000041952 [0,1,0,0,0,1|0,1,0]=3 4224 B16R2.252 Oc1cccc(c1)CSc2ccccn2 62a_100011216584_100011660834 [0,1,0,0,0,1|1,1,0]=4 4225 B16R2.252 Oc1cccc(c1)CSc2ccccn2 62a_100011660834_100011216584 [0,1,0,0,0,1|1,1,0]=4 4226 B16R2.252 Oc1cccc(c1)CSc2cccnc2 62a_100000210063_100011660834 [0,1,0,0,0,1|1,1,0]=4 4227 B16R2.252 Oc1cccc(c1)CSc2cccnc2 62a_100011660834_100000210063 [0,1,0,0,0,1|1,1,0]=4 4228 B16R2.252 Oc1cccc(c1)CSc2ccncc2 62a_100000728582_100011660834 [0,1,0,0,0,1|1,1,0]=4 4229 B16R2.252 Oc1cccc(c1)CSc2ccncc2 62a_100011660834_100000728582 [0,1,0,0,0,1|1,1,0]=4 4230 B16R2.252 Oc1cccc(c1)NCc2ccccc2 270302a_100000210217_100015611070 [0,1,0,0,0,1|1,0,0]=3 4231 B16R2.252 Oc1cccc(c1)NCc2ccccc2 271570a_203496583355_100000224063 [0,1,0,0,0,1|1,0,0]=3 4232 B16R2.252 Oc1cccc(c1)NCc2ccccc2 34a_100000210217_100015291786 [0,1,0,0,0,1|1,0,0]=3 4233 B16R2.252 Oc1cccc(c1)NCc2ccccn2 270302a_100000210217_100000209966 [0,1,0,0,0,1|2,0,0]=4 4234 B16R2.252 Oc1cccc(c1)NCc2ccccn2 34a_100000210217_100000721315 [0,1,0,0,0,1|2,0,0]=4 4235 B16R2.252 Oc1cccc(c1)NCc2cccnc2 270302a_100000210217_100000209961 [0,1,0,0,0,1|2,0,0]=4 4236 B16R2.252 Oc1cccc(c1)NCc2cccnc2 34a_100000210217_100000733263 [0,1,0,0,0,1|2,0,0]=4 4237 B16R2.252 Oc1cccc(c1)OCc2ccccc2 271570a_203496583355_100000151840 [0,1,0,0,0,1|0,0,0]=2 4238 B16R2.252 Oc1cccc(c1)OCc2ccccn2 271570a_203496583355_200011214830 [0,1,0,0,0,1|1,0,0]=3 4239 B16R2.252 Oc1cccc(c1)SCc2ccccc2 271570a_203496583355_100103287807 [0,1,0,0,0,1|0,1,0]=3 4240 B16R2.252 Oc1cccc(c1)SCc2ccccc2 62a_100000211182_100000211634 [0,1,0,0,0,1|0,1,0]=3 4241 B16R2.252 Oc1cccc(c1)SCc2ccccn2 62a_100000721315_100000211634 [0,1,0,0,0,1|1,1,0]=4 4242 B16R2.252 Oc1cccc(c1)SCc2cccnc2 62a_100000741622_100000211634 [0,1,0,0,0,1|1,1,0]=4 4243 B16R2.252 Oc1cccc(c1)SCc2ccncc2 62a_100015193705_100000211634 [0,1,0,0,0,1|1,1,0]=4 4244 B16R2.252 Oc1cccc(n1)NCc2ccccc2 271570a_203496583355_200011960457 [0,1,0,0,0,1|2,0,0]=4 4245 B16R2.252 Oc1cccc(n1)OCc2ccccc2 271570a_203496583355_100011960212 [0,1,0,0,0,1|1,0,0]=3 4246 B16R2.252 Oc1ccnc(c1)C#Cc2ccccc2 271570a_100000069678_100000762945 [0,1,0,0,0,1|2,0,0]=4 4247 B16R2.252 Oc1ccnc(c1)C=Cc2ccccc2 271570a_100102527694_100000762945 [0,1,0,0,0,1|2,0,0]=4 4248 B16R2.252 Oc1ccnc(c1)OCc2ccccc2 271570a_203496583355_200010986176 [0,1,0,0,0,1|1,0,0]=3 4249 B16R2.252 Oc1ccnc(c1)SCc2ccccc2 271570a_203496583355_100042452854 [0,1,0,0,0,1|1,1,0]=4 4250 B16R2.252 Oc1ccnc(c1)SCc2ccccc2 62a_100000211182_100000762945 [0,1,0,0,0,1|1,1,0]=4 4251 B16R2.252 Oc1cncc(c1)C#Cc2ccccc2 271570a_100000069678_100000754920 [0,1,0,0,0,1|2,0,0]=4 4252 B16R2.252 Oc1cncc(c1)C=Cc2ccccc2 271570a_100102527694_100000754920 [0,1,0,0,0,1|2,0,0]=4 4253 B16R2.252 Oc1cncc(c1)CNc2ccccc2 207a_100000106764_100012187055 [0,1,0,0,0,1|2,0,0]=4 4254 B16R2.252 Oc1cncc(c1)OCc2ccccc2 271570a_203496583355_100012029532 [0,1,0,0,0,1|1,0,0]=3 4255 B16R2.252 Oc1cncc(c1)SCc2ccccc2 62a_100000211182_100000754920 [0,1,0,0,0,1|1,1,0]=4 4256 B16R2.252 Oc1cncc(c1)SCc2ccccc2 62a_100000754920_100015291786 [0,1,0,0,0,1|1,1,0]=4 4257 B16R2.252 Oc1cncc(n1)OCc2ccccc2 271570a_203496583355_100000243162 [0,1,0,0,0,1|2,0,0]=4 4258 B16R2.252 Oc1nccc(n1)OCc2ccccc2 271570a_203496583355_100000694416 [0,1,0,0,0,1|2,0,0]=4 4259 B16R2.252 [O-][n+]1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100009815978 [0,1,0,0,0,1|2,0,0]=4 4260 B16R2.252 [O-][n+]1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100009815978 [0,1,0,0,0,1|2,0,0]=4 4261 B16R2.252 [O-][n+]1cccc(c1)OCc2ccccc2 34a_100000039713_100015291786 [0,1,0,0,0,1|1,0,0]=3 4262 B16R2.252 [O-][n+]1cccc(c1)OCc2ccccc2 7a_100000039713_100000211182 [0,1,0,0,0,1|1,0,0]=3 4263 B16R2.252 [O-][n+]1cccc(c1)OCc2ccccn2 34a_100000039713_100000721315 [0,1,0,0,0,1|2,0,0]=4 4264 B16R2.252 [O-][n+]1cccc(c1)OCc2ccccn2 7a_100000039713_100000721315 [0,1,0,0,0,1|2,0,0]=4 4265 B16R2.252 [O-][n+]1cccc(c1)OCc2cccnc2 34a_100000039713_100000733263 [0,1,0,0,0,1|2,0,0]=4 4266 B16R2.252 [O-][n+]1cccc(c1)OCc2cccnc2 7a_100000039713_100000741622 [0,1,0,0,0,1|2,0,0]=4 4267 B16R2.252 [O-][n+]1cccc(c1)OCc2ccncc2 7a_100000039713_100015193705 [0,1,0,0,0,1|2,0,0]=4 4268 B16R2.252 [O-][n+]1cccc(c1)SCc2ccccc2 62a_100000211182_100009815978 [0,1,0,0,0,1|1,1,0]=4 4269 B16R2.252 [S]c1cccc(c1)C#Cc2ccccc2 271570a_100000069678_114929384022 [0,1,0,0,0,1|1,0,0]=3 4270 B16R2.252 [S]c1cccc(c1)C=Cc2ccccc2 271570a_100102527694_114929384022 [0,1,0,0,0,1|1,0,0]=3 4271 B16R2.252 [S]c1cccc(c1)C=Cc2cccnc2 271570a_100102525586_114929384022 [0,1,0,0,0,1|2,0,0]=4 4272 B16R2.252 [S]c1cccc(c1)SCc2ccccc2 62a_100000211182_114929384022 [0,1,0,0,0,1|0,1,0]=3 4273 B16R2.252 [S]c1cccc(c1)SCc2ccccc2 62a_114929384022_100015291786 [0,1,0,0,0,1|0,1,0]=3 4274 B16R2.252 [S]c1cccc(c1)SCc2ccccn2 62a_100000721315_114929384022 [0,1,0,0,0,1|1,1,0]=4 4275 B16R2.252 [S]c1cccc(c1)SCc2ccccn2 62a_114929384022_100000721315 [0,1,0,0,0,1|1,1,0]=4 4276 B16R2.252 [S]c1cccc(c1)SCc2cccnc2 62a_100000741622_114929384022 [0,1,0,0,0,1|1,1,0]=4 4277 B16R2.252 [S]c1cccc(c1)SCc2cccnc2 62a_114929384022_100000741622 [0,1,0,0,0,1|1,1,0]=4 4278 B16R2.252 [S]c1cccc(c1)SCc2ccncc2 62a_100015193705_114929384022 [0,1,0,0,0,1|1,1,0]=4 4279 B16R2.252 [S]c1cccc(c1)SCc2ccncc2 62a_114929384022_100015193705 [0,1,0,0,0,1|1,1,0]=4 4280 B16R2.2 C=Cc1cc[n+](cc1)Cc2ccccc2 271570a_100011290941_200011068538 [0,2,0,0,0,0|2,0,0]=4 4281 B16R2.2 C=Cc1ccc(cc1)Cc2ccccc2 271570a_100011290941_100011356940 [0,2,0,0,0,0|1,0,0]=3 4282 B16R2.2 C=Cc1ccc(cc1)Nc2ccccc2 271570a_100011290941_100009815781 [0,2,0,0,0,0|1,0,0]=3 4283 B16R2.2 C=Cc1ccc(cc1)Oc2ccccc2 271570a_100011290941_100011215699 [0,2,0,0,0,0|0,0,0]=2 4284 B16R2.2 C=Cc1ccc(cc1)Oc2ccccn2 271570a_100011290941_100000173464 [0,2,0,0,0,0|1,0,0]=3 4285 B16R2.2 C=Cc1ccc(cc1)Oc2ncccn2 271570a_100011290941_100000170942 [0,2,0,0,0,0|2,0,0]=4 4286 B16R2.2 C=Cc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000748128 [0,2,0,0,0,0|0,1,0]=3 4287 B16R2.2 C=Cc1ccc(cc1)Sc2ccccc2 62a_100000748128_100000041952 [0,2,0,0,0,0|0,1,0]=3 4288 B16R2.2 C=Cc1ccc(cc1)Sc2ccccn2 62a_100000748128_100011216584 [0,2,0,0,0,0|1,1,0]=4 4289 B16R2.2 C=Cc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000748128 [0,2,0,0,0,0|1,1,0]=4 4290 B16R2.2 C=Cc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000748128 [0,2,0,0,0,0|1,1,0]=4 4291 B16R2.2 C=Cc1ccc(cc1)Sc2cccnc2 62a_100000748128_100000210063 [0,2,0,0,0,0|1,1,0]=4 4292 B16R2.2 C=Cc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000748128 [0,2,0,0,0,0|1,1,0]=4 4293 B16R2.2 C=Cc1ccc(cc1)Sc2ccncc2 62a_100000748128_100000728582 [0,2,0,0,0,0|1,1,0]=4 4294 B16R2.2 C=Cc1ccc(nc1)Oc2ccccc2 271570a_100011290941_200011465514 [0,2,0,0,0,0|1,0,0]=3 4295 B16R2.2 C=Cc1ccc(nc1)Sc2ccccc2 271570a_100011290941_100011465531 [0,2,0,0,0,0|1,1,0]=4 4296 B16R2.2 C=Cc1ccc(nc1)Sc2ccccc2 62a_100000719477_103436540071 [0,2,0,0,0,0|1,1,0]=4 4297 B16R2.2 C=Cc1ccc(nc1)Sc2ccccc2 62a_103436540071_100000041952 [0,2,0,0,0,0|1,1,0]=4 4298 B16R2.2 C=Cc1ccc(nn1)Oc2ccccc2 271570a_100011290941_200000215291 [0,2,0,0,0,0|2,0,0]=4 4299 B16R2.2 C=Cc1cnc(nc1)Oc2ccccc2 271570a_100011290941_100011939432 [0,2,0,0,0,0|2,0,0]=4 4300 B16R2.2 CCc1ccc(cc1)Sc2ccccc2 62a_100000719477_100011215824 [0,2,0,0,0,0|0,1,0]=3 4301 B16R2.2 CCc1ccc(cc1)Sc2ccccc2 62a_100011215824_100000041952 [0,2,0,0,0,0|0,1,0]=3 4302 B16R2.2 CCc1ccc(cc1)Sc2ccccn2 62a_100011215824_100011216584 [0,2,0,0,0,0|1,1,0]=4 4303 B16R2.2 CCc1ccc(cc1)Sc2ccccn2 62a_100011216584_100011215824 [0,2,0,0,0,0|1,1,0]=4 4304 B16R2.2 CCc1ccc(cc1)Sc2cccnc2 62a_100000210063_100011215824 [0,2,0,0,0,0|1,1,0]=4 4305 B16R2.2 CCc1ccc(cc1)Sc2cccnc2 62a_100011215824_100000210063 [0,2,0,0,0,0|1,1,0]=4 4306 B16R2.2 CCc1ccc(cc1)Sc2ccncc2 62a_100000728582_100011215824 [0,2,0,0,0,0|1,1,0]=4 4307 B16R2.2 CCc1ccc(cc1)Sc2ccncc2 62a_100011215824_100000728582 [0,2,0,0,0,0|1,1,0]=4 4308 B16R2.2 CCc1ccc(cn1)Sc2ccccc2 62a_100000719477_100009820025 [0,2,0,0,0,0|1,1,0]=4 4309 B16R2.2 CCc1ccc(cn1)Sc2ccccc2 62a_100009820025_100000041952 [0,2,0,0,0,0|1,1,0]=4 4310 B16R2.2 CCc1ccc(nc1)Sc2ccccc2 62a_100000719477_100009843584 [0,2,0,0,0,0|1,1,0]=4 4311 B16R2.2 CCc1ccc(nc1)Sc2ccccc2 62a_100009843584_100000041952 [0,2,0,0,0,0|1,1,0]=4 4312 B16R2.2 CNc1ccc(cc1)Cc2ccccc2 2230a_100011216381_200000210301 [0,2,0,0,0,0|1,0,0]=3 4313 B16R2.2 CNc1ccc(cc1)Cc2ccccc2 34a_100011216381_200000210301 [0,2,0,0,0,0|1,0,0]=3 4314 B16R2.2 CNc1ccc(cc1)Cc2ccccn2 34a_100015184005_200000210301 [0,2,0,0,0,0|2,0,0]=4 4315 B16R2.2 CNc1ccc(cc1)Cc2ccncc2 34a_100000181721_200000210301 [0,2,0,0,0,0|2,0,0]=4 4316 B16R2.2 CNc1ccc(cc1)Oc2ccccc2 2230a_100000185715_200000210301 [0,2,0,0,0,0|0,0,0]=2 4317 B16R2.2 CNc1ccc(cc1)Oc2ccccc2 34a_100000185715_200000210301 [0,2,0,0,0,0|0,0,0]=2 4318 B16R2.2 CNc1ccc(cc1)Oc2cccnc2 2230a_100000729134_200000210301 [0,2,0,0,0,0|1,0,0]=3 4319 B16R2.2 CNc1ccc(cc1)Oc2cccnc2 34a_100000729134_200000210301 [0,2,0,0,0,0|1,0,0]=3 4320 B16R2.2 CNc1ccc(cc1)Oc2ccncc2 34a_100011277206_200000210301 [0,2,0,0,0,0|1,0,0]=3 4321 B16R2.2 CNc1ccc(cc1)Oc2ncccn2 2230a_100000742644_200000210301 [0,2,0,0,0,0|2,0,0]=4 4322 B16R2.2 CNc1ccc(cc1)Oc2ncccn2 34a_100000742644_200000210301 [0,2,0,0,0,0|2,0,0]=4 4323 B16R2.2 CNc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000743151 [0,2,0,0,0,0|0,1,0]=3 4324 B16R2.2 CNc1ccc(cc1)Sc2ccccc2 62a_100000743151_100000041952 [0,2,0,0,0,0|0,1,0]=3 4325 B16R2.2 CNc1ccc(cc1)Sc2ccccn2 62a_100000743151_100011216584 [0,2,0,0,0,0|1,1,0]=4 4326 B16R2.2 CNc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000743151 [0,2,0,0,0,0|1,1,0]=4 4327 B16R2.2 CNc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000743151 [0,2,0,0,0,0|1,1,0]=4 4328 B16R2.2 CNc1ccc(cc1)Sc2cccnc2 62a_100000743151_100000210063 [0,2,0,0,0,0|1,1,0]=4 4329 B16R2.2 CNc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000743151 [0,2,0,0,0,0|1,1,0]=4 4330 B16R2.2 CNc1ccc(cc1)Sc2ccncc2 62a_100000743151_100000728582 [0,2,0,0,0,0|1,1,0]=4 4331 B16R2.2 CNc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000741341 [0,2,0,0,0,0|1,1,0]=4 4332 B16R2.2 CNc1ccc(cn1)Sc2ccccc2 62a_100000741341_100000041952 [0,2,0,0,0,0|1,1,0]=4 4333 B16R2.2 CNc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000764248 [0,2,0,0,0,0|1,1,0]=4 4334 B16R2.2 CNc1ccc(nc1)Sc2ccccc2 62a_100000764248_100000041952 [0,2,0,0,0,0|1,1,0]=4 4335 B16R2.2 COc1ccc(cc1)Cc2ccccc2 34a_100000243809_200000210301 [0,2,0,0,0,0|1,0,0]=3 4336 B16R2.2 COc1ccc(cc1)Cc2ccccc2 7a_100000243809_200000210301 [0,2,0,0,0,0|1,0,0]=3 4337 B16R2.2 COc1ccc(cc1)Nc2ccccc2 34a_100000210697_200000210301 [0,2,0,0,0,0|1,0,0]=3 4338 B16R2.2 COc1ccc(cc1)Oc2ccccc2 34a_100000211195_200000210301 [0,2,0,0,0,0|0,0,0]=2 4339 B16R2.2 COc1ccc(cc1)Oc2ccccc2 7a_100000211195_200000210301 [0,2,0,0,0,0|0,0,0]=2 4340 B16R2.2 COc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000171711 [0,2,0,0,0,0|0,1,0]=3 4341 B16R2.2 COc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000171711 [0,2,0,0,0,0|1,1,0]=4 4342 B16R2.2 COc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000171711 [0,2,0,0,0,0|1,1,0]=4 4343 B16R2.2 COc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000171711 [0,2,0,0,0,0|1,1,0]=4 4344 B16R2.2 COc1ccc(cn1)Sc2ccccc2 62a_100000047065_100000041952 [0,2,0,0,0,0|1,1,0]=4 4345 B16R2.2 COc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000047065 [0,2,0,0,0,0|1,1,0]=4 4346 B16R2.2 COc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000744180 [0,2,0,0,0,0|1,1,0]=4 4347 B16R2.2 COc1ccc(nc1)Sc2ccccc2 62a_100000755202_100000041952 [0,2,0,0,0,0|1,1,0]=4 4348 B16R2.2 CSc1cc[n+](cc1)Cc2ccccc2 62a_200011068538_200000210301 [0,2,0,0,0,0|2,0,0]=4 4349 B16R2.2 CSc1ccc(cc1)Cc2ccccc2 62a_100011356940_200000210301 [0,2,0,0,0,0|1,0,0]=3 4350 B16R2.2 CSc1ccc(cc1)Cc2ccccc2 62a_200000210301_100011356940 [0,2,0,0,0,0|1,0,0]=3 4351 B16R2.2 CSc1ccc(cc1)Nc2ccccc2 62a_200000210301_100009815781 [0,2,0,0,0,0|1,0,0]=3 4352 B16R2.2 CSc1ccc(cc1)Oc2ccccc2 62a_200000210301_100011215699 [0,2,0,0,0,0|0,0,0]=2 4353 B16R2.2 CSc1ccc(cc1)Oc2ccccn2 62a_100000173464_200000210301 [0,2,0,0,0,0|1,0,0]=3 4354 B16R2.2 CSc1ccc(cc1)Oc2ccccn2 62a_200000210301_100000173464 [0,2,0,0,0,0|1,0,0]=3 4355 B16R2.2 CSc1ccc(cc1)Oc2ncccn2 62a_100000170942_200000210301 [0,2,0,0,0,0|2,0,0]=4 4356 B16R2.2 CSc1ccc(cc1)Oc2ncccn2 62a_200000210301_100000170942 [0,2,0,0,0,0|2,0,0]=4 4357 B16R2.2 CSc1ccc(cc1)Sc2ccccc2 62a_100000719477_100011263217 [0,2,0,0,0,0|0,1,0]=3 4358 B16R2.2 CSc1ccc(cc1)Sc2ccccc2 62a_100011263217_100000041952 [0,2,0,0,0,0|0,1,0]=3 4359 B16R2.2 CSc1ccc(cc1)Sc2ccccn2 62a_100011216584_100011263217 [0,2,0,0,0,0|1,1,0]=4 4360 B16R2.2 CSc1ccc(cc1)Sc2ccccn2 62a_100011263217_100011216584 [0,2,0,0,0,0|1,1,0]=4 4361 B16R2.2 CSc1ccc(cc1)Sc2cccnc2 62a_100000210063_100011263217 [0,2,0,0,0,0|1,1,0]=4 4362 B16R2.2 CSc1ccc(cc1)Sc2cccnc2 62a_100011263217_100000210063 [0,2,0,0,0,0|1,1,0]=4 4363 B16R2.2 CSc1ccc(cc1)Sc2ccncc2 62a_100000728582_100011263217 [0,2,0,0,0,0|1,1,0]=4 4364 B16R2.2 CSc1ccc(cc1)Sc2ccncc2 62a_100011263217_100000728582 [0,2,0,0,0,0|1,1,0]=4 4365 B16R2.2 CSc1ccc(cn1)Sc2ccccc2 62a_100000719477_100011408404 [0,2,0,0,0,0|1,1,0]=4 4366 B16R2.2 CSc1ccc(cn1)Sc2ccccc2 62a_100011408404_100000041952 [0,2,0,0,0,0|1,1,0]=4 4367 B16R2.2 CSc1ccc(nc1)Nc2ccccc2 27a_100000106764_100009820866 [0,2,0,0,0,0|2,0,0]=4 4368 B16R2.2 CSc1ccc(nc1)Oc2ccccc2 62a_200000210301_200011465514 [0,2,0,0,0,0|1,0,0]=3 4369 B16R2.2 CSc1ccc(nc1)Oc2ccccc2 62a_200011465514_200000210301 [0,2,0,0,0,0|1,0,0]=3 4370 B16R2.2 CSc1ccc(nc1)Sc2ccccc2 62a_100000719477_100009820866 [0,2,0,0,0,0|1,1,0]=4 4371 B16R2.2 CSc1ccc(nc1)Sc2ccccc2 62a_100009820866_100000041952 [0,2,0,0,0,0|1,1,0]=4 4372 B16R2.2 CSc1ccc(nc1)Sc2ccccc2 62a_100011465531_200000210301 [0,2,0,0,0,0|1,1,0]=4 4373 B16R2.2 CSc1ccc(nc1)Sc2ccccc2 62a_200000210301_100011465531 [0,2,0,0,0,0|1,1,0]=4 4374 B16R2.2 CSc1ccc(nn1)Oc2ccccc2 62a_200000210301_200000215291 [0,2,0,0,0,0|2,0,0]=4 4375 B16R2.2 CSc1cnc(nc1)Oc2ccccc2 62a_100011939432_200000210301 [0,2,0,0,0,0|2,0,0]=4 4376 B16R2.2 CSc1cnc(nc1)Oc2ccccc2 62a_200000210301_100011939432 [0,2,0,0,0,0|2,0,0]=4 4377 B16R2.2 FCc1ccc(cc1)Sc2ccccc2 62a_100000719477_100010268989 [0,2,0,0,0,0|0,1,0]=3 4378 B16R2.2 FCc1ccc(cc1)Sc2ccccc2 62a_100010268989_100000041952 [0,2,0,0,0,0|0,1,0]=3 4379 B16R2.2 FCc1ccc(cc1)Sc2ccccn2 62a_100010268989_100011216584 [0,2,0,0,0,0|1,1,0]=4 4380 B16R2.2 FCc1ccc(cc1)Sc2ccccn2 62a_100011216584_100010268989 [0,2,0,0,0,0|1,1,0]=4 4381 B16R2.2 FCc1ccc(cc1)Sc2cccnc2 62a_100000210063_100010268989 [0,2,0,0,0,0|1,1,0]=4 4382 B16R2.2 FCc1ccc(cc1)Sc2cccnc2 62a_100010268989_100000210063 [0,2,0,0,0,0|1,1,0]=4 4383 B16R2.2 FCc1ccc(cc1)Sc2ccncc2 62a_100000728582_100010268989 [0,2,0,0,0,0|1,1,0]=4 4384 B16R2.2 FCc1ccc(cc1)Sc2ccncc2 62a_100010268989_100000728582 [0,2,0,0,0,0|1,1,0]=4 4385 B16R2.2 N#Cc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000184291 [0,2,0,0,0,0|0,1,0]=3 4386 B16R2.2 N#Cc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000184291 [0,2,0,0,0,0|1,1,0]=4 4387 B16R2.2 N#Cc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000184291 [0,2,0,0,0,0|1,1,0]=4 4388 B16R2.2 N#Cc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000184291 [0,2,0,0,0,0|1,1,0]=4 4389 B16R2.2 N#Cc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000760455 [0,2,0,0,0,0|1,1,0]=4 4390 B16R2.2 N#Cc1ccc(nc1)Nc2ccccc2 27a_100000106764_100000241038 [0,2,0,0,0,0|2,0,0]=4 4391 B16R2.2 N#Cc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000241038 [0,2,0,0,0,0|1,1,0]=4 4392 B16R2.2 NCc1ccc(cc1)Sc2ccccc2 62a_100000719477_100016989417 [0,2,0,0,0,0|0,1,0]=3 4393 B16R2.2 NCc1ccc(cc1)Sc2ccccc2 62a_100016989417_100000041952 [0,2,0,0,0,0|0,1,0]=3 4394 B16R2.2 NCc1ccc(cc1)Sc2ccccn2 62a_100011216584_100016989417 [0,2,0,0,0,0|1,1,0]=4 4395 B16R2.2 NCc1ccc(cc1)Sc2ccccn2 62a_100016989417_100011216584 [0,2,0,0,0,0|1,1,0]=4 4396 B16R2.2 NCc1ccc(cc1)Sc2cccnc2 62a_100000210063_100016989417 [0,2,0,0,0,0|1,1,0]=4 4397 B16R2.2 NCc1ccc(cc1)Sc2cccnc2 62a_100016989417_100000210063 [0,2,0,0,0,0|1,1,0]=4 4398 B16R2.2 NCc1ccc(cc1)Sc2ccncc2 62a_100000728582_100016989417 [0,2,0,0,0,0|1,1,0]=4 4399 B16R2.2 NCc1ccc(cc1)Sc2ccncc2 62a_100016989417_100000728582 [0,2,0,0,0,0|1,1,0]=4 4400 B16R2.2 NCc1ccc(cn1)Sc2ccccc2 62a_100000719477_100015188789 [0,2,0,0,0,0|1,1,0]=4 4401 B16R2.2 NCc1ccc(cn1)Sc2ccccc2 62a_100015188789_100000041952 [0,2,0,0,0,0|1,1,0]=4 4402 B16R2.2 NCc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000735879 [0,2,0,0,0,0|1,1,0]=4 4403 B16R2.2 NCc1ccc(nc1)Sc2ccccc2 62a_100000735879_100000041952 [0,2,0,0,0,0|1,1,0]=4 4404 B16R2.2 NNc1ccc(cc1)Sc2ccccc2 62a_100000719477_100016988836 [0,2,0,0,0,0|0,1,0]=3 4405 B16R2.2 NNc1ccc(cc1)Sc2ccccc2 62a_100016988836_100000041952 [0,2,0,0,0,0|0,1,0]=3 4406 B16R2.2 NNc1ccc(cc1)Sc2ccccn2 62a_100011216584_100016988836 [0,2,0,0,0,0|1,1,0]=4 4407 B16R2.2 NNc1ccc(cc1)Sc2ccccn2 62a_100016988836_100011216584 [0,2,0,0,0,0|1,1,0]=4 4408 B16R2.2 NNc1ccc(cc1)Sc2cccnc2 62a_100000210063_100016988836 [0,2,0,0,0,0|1,1,0]=4 4409 B16R2.2 NNc1ccc(cc1)Sc2cccnc2 62a_100016988836_100000210063 [0,2,0,0,0,0|1,1,0]=4 4410 B16R2.2 NNc1ccc(cc1)Sc2ccncc2 62a_100000728582_100016988836 [0,2,0,0,0,0|1,1,0]=4 4411 B16R2.2 NNc1ccc(cc1)Sc2ccncc2 62a_100016988836_100000728582 [0,2,0,0,0,0|1,1,0]=4 4412 B16R2.2 NNc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000750576 [0,2,0,0,0,0|1,1,0]=4 4413 B16R2.2 NNc1ccc(cn1)Sc2ccccc2 62a_100000750576_100000041952 [0,2,0,0,0,0|1,1,0]=4 4414 B16R2.2 NNc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000119030 [0,2,0,0,0,0|1,1,0]=4 4415 B16R2.2 NNc1ccc(nc1)Sc2ccccc2 62a_100000755011_100000041952 [0,2,0,0,0,0|1,1,0]=4 4416 B16R2.2 O=Cc1ccc(cc1)Sc2ccccc2 62a_100000188517_100000041952 [0,2,0,0,0,0|0,1,0]=3 4417 B16R2.2 O=Cc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000188517 [0,2,0,0,0,0|0,1,0]=3 4418 B16R2.2 O=Cc1ccc(cc1)Sc2ccccn2 62a_100000188517_100011216584 [0,2,0,0,0,0|1,1,0]=4 4419 B16R2.2 O=Cc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000188517 [0,2,0,0,0,0|1,1,0]=4 4420 B16R2.2 O=Cc1ccc(cc1)Sc2cccnc2 62a_100000188517_100000210063 [0,2,0,0,0,0|1,1,0]=4 4421 B16R2.2 O=Cc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000188517 [0,2,0,0,0,0|1,1,0]=4 4422 B16R2.2 O=Cc1ccc(cc1)Sc2ccncc2 62a_100000188517_100000728582 [0,2,0,0,0,0|1,1,0]=4 4423 B16R2.2 O=Cc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000188517 [0,2,0,0,0,0|1,1,0]=4 4424 B16R2.2 O=Cc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000754260 [0,2,0,0,0,0|1,1,0]=4 4425 B16R2.2 O=Cc1ccc(cn1)Sc2ccccc2 62a_100000754260_100000041952 [0,2,0,0,0,0|1,1,0]=4 4426 B16R2.2 O=Cc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000766901 [0,2,0,0,0,0|1,1,0]=4 4427 B16R2.2 O=Cc1ccc(nc1)Sc2ccccc2 62a_100000766901_100000041952 [0,2,0,0,0,0|1,1,0]=4 4428 B16R2.2 OCc1ccc(cc1)Sc2ccccc2 62a_100000690907_100000041952 [0,2,0,0,0,0|0,1,0]=3 4429 B16R2.2 OCc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000690907 [0,2,0,0,0,0|0,1,0]=3 4430 B16R2.2 OCc1ccc(cc1)Sc2ccccn2 62a_100000690907_100011216584 [0,2,0,0,0,0|1,1,0]=4 4431 B16R2.2 OCc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000690907 [0,2,0,0,0,0|1,1,0]=4 4432 B16R2.2 OCc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000690907 [0,2,0,0,0,0|1,1,0]=4 4433 B16R2.2 OCc1ccc(cc1)Sc2cccnc2 62a_100000690907_100000210063 [0,2,0,0,0,0|1,1,0]=4 4434 B16R2.2 OCc1ccc(cc1)Sc2ccncc2 62a_100000690907_100000728582 [0,2,0,0,0,0|1,1,0]=4 4435 B16R2.2 OCc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000690907 [0,2,0,0,0,0|1,1,0]=4 4436 B16R2.2 OCc1ccc(cn1)Sc2ccccc2 62a_100000719477_100000754261 [0,2,0,0,0,0|1,1,0]=4 4437 B16R2.2 OCc1ccc(cn1)Sc2ccccc2 62a_100000754261_100000041952 [0,2,0,0,0,0|1,1,0]=4 4438 B16R2.2 OCc1ccc(nc1)Sc2ccccc2 62a_100000719477_100009816760 [0,2,0,0,0,0|1,1,0]=4 4439 B16R2.2 OCc1ccc(nc1)Sc2ccccc2 62a_100009816760_100000041952 [0,2,0,0,0,0|1,1,0]=4 4440 B16R2.2 [13CH3]Nc1ccc(cc1)Cc2ccccc2 2230a_100011216381_200025704644 [0,2,0,0,0,0|1,0,0]=3 4441 B16R2.2 [13CH3]Nc1ccc(cc1)Cc2ccccc2 34a_100011216381_200025704644 [0,2,0,0,0,0|1,0,0]=3 4442 B16R2.2 [13CH3]Nc1ccc(cc1)Cc2ccccn2 34a_100015184005_200025704644 [0,2,0,0,0,0|2,0,0]=4 4443 B16R2.2 [13CH3]Nc1ccc(cc1)Cc2ccncc2 34a_100000181721_200025704644 [0,2,0,0,0,0|2,0,0]=4 4444 B16R2.2 [13CH3]Nc1ccc(cc1)Oc2ccccc2 2230a_100000185715_200025704644 [0,2,0,0,0,0|0,0,0]=2 4445 B16R2.2 [13CH3]Nc1ccc(cc1)Oc2ccccc2 34a_100000185715_200025704644 [0,2,0,0,0,0|0,0,0]=2 4446 B16R2.2 [13CH3]Nc1ccc(cc1)Oc2cccnc2 2230a_100000729134_200025704644 [0,2,0,0,0,0|1,0,0]=3 4447 B16R2.2 [13CH3]Nc1ccc(cc1)Oc2cccnc2 34a_100000729134_200025704644 [0,2,0,0,0,0|1,0,0]=3 4448 B16R2.2 [13CH3]Nc1ccc(cc1)Oc2ccncc2 34a_100011277206_200025704644 [0,2,0,0,0,0|1,0,0]=3 4449 B16R2.2 [13CH3]Nc1ccc(cc1)Oc2ncccn2 2230a_100000742644_200025704644 [0,2,0,0,0,0|2,0,0]=4 4450 B16R2.2 [13CH3]Nc1ccc(cc1)Oc2ncccn2 34a_100000742644_200025704644 [0,2,0,0,0,0|2,0,0]=4 4451 B16R2.2 [13CH3]Oc1ccc(cc1)Cc2ccccc2 34a_100000243809_200025704644 [0,2,0,0,0,0|1,0,0]=3 4452 B16R2.2 [13CH3]Oc1ccc(cc1)Cc2ccccc2 7a_100000243809_200025704644 [0,2,0,0,0,0|1,0,0]=3 4453 B16R2.2 [13CH3]Oc1ccc(cc1)Nc2ccccc2 34a_100000210697_200025704644 [0,2,0,0,0,0|1,0,0]=3 4454 B16R2.2 [13CH3]Oc1ccc(cc1)Oc2ccccc2 34a_100000211195_200025704644 [0,2,0,0,0,0|0,0,0]=2 4455 B16R2.2 [13CH3]Oc1ccc(cc1)Oc2ccccc2 7a_100000211195_200025704644 [0,2,0,0,0,0|0,0,0]=2 4456 B16R2.2 [13CH3]Sc1cc[n+](cc1)Cc2ccccc2 62a_200011068538_200025704644 [0,2,0,0,0,0|2,0,0]=4 4457 B16R2.2 [13CH3]Sc1ccc(cc1)Cc2ccccc2 62a_100011356940_200025704644 [0,2,0,0,0,0|1,0,0]=3 4458 B16R2.2 [13CH3]Sc1ccc(cc1)Cc2ccccc2 62a_200025704644_100011356940 [0,2,0,0,0,0|1,0,0]=3 4459 B16R2.2 [13CH3]Sc1ccc(cc1)Nc2ccccc2 62a_200025704644_100009815781 [0,2,0,0,0,0|1,0,0]=3 4460 B16R2.2 [13CH3]Sc1ccc(cc1)Oc2ccccc2 62a_200025704644_100011215699 [0,2,0,0,0,0|0,0,0]=2 4461 B16R2.2 [13CH3]Sc1ccc(cc1)Oc2ccccn2 62a_100000173464_200025704644 [0,2,0,0,0,0|1,0,0]=3 4462 B16R2.2 [13CH3]Sc1ccc(cc1)Oc2ccccn2 62a_200025704644_100000173464 [0,2,0,0,0,0|1,0,0]=3 4463 B16R2.2 [13CH3]Sc1ccc(cc1)Oc2ncccn2 62a_100000170942_200025704644 [0,2,0,0,0,0|2,0,0]=4 4464 B16R2.2 [13CH3]Sc1ccc(cc1)Oc2ncccn2 62a_200025704644_100000170942 [0,2,0,0,0,0|2,0,0]=4 4465 B16R2.2 [13CH3]Sc1ccc(nc1)Oc2ccccc2 62a_200011465514_200025704644 [0,2,0,0,0,0|1,0,0]=3 4466 B16R2.2 [13CH3]Sc1ccc(nc1)Oc2ccccc2 62a_200025704644_200011465514 [0,2,0,0,0,0|1,0,0]=3 4467 B16R2.2 [13CH3]Sc1ccc(nc1)Sc2ccccc2 62a_100011465531_200025704644 [0,2,0,0,0,0|1,1,0]=4 4468 B16R2.2 [13CH3]Sc1ccc(nc1)Sc2ccccc2 62a_200025704644_100011465531 [0,2,0,0,0,0|1,1,0]=4 4469 B16R2.2 [13CH3]Sc1ccc(nn1)Oc2ccccc2 62a_200025704644_200000215291 [0,2,0,0,0,0|2,0,0]=4 4470 B16R2.2 [13CH3]Sc1cnc(nc1)Oc2ccccc2 62a_100011939432_200025704644 [0,2,0,0,0,0|2,0,0]=4 4471 B16R2.2 [13CH3]Sc1cnc(nc1)Oc2ccccc2 62a_200025704644_100011939432 [0,2,0,0,0,0|2,0,0]=4 4472 B16R2.33 Brc1ccc(cc1)Nc2ccc(cn2)Br 27a_100000210018_100000686858 [0,2,0,0,0,0|2,0,0]=4 4473 B16R2.33 Brc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000752885_100000752885 [0,2,0,0,0,0|0,1,0]=3 4474 B16R2.33 Brc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000686858_100000752885 [0,2,0,0,0,0|1,1,0]=4 4475 B16R2.33 Brc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000752885_100000686858 [0,2,0,0,0,0|1,1,0]=4 4476 B16R2.33 Brc1ccc(cc1)Sc2ccc(nc2)Br 62a_100000752885_100009814638 [0,2,0,0,0,0|1,1,0]=4 4477 B16R2.33 Brc1ccc(cc1)Sc2ccc(nc2)Br 62a_100009814638_100000752885 [0,2,0,0,0,0|1,1,0]=4 4478 B16R2.33 Brc1ccc(nc1)Nc2ccc(cc2)I 27a_100000185761_100000686858 [0,2,0,0,0,0|2,0,0]=4 4479 B16R2.33 Cc1ccc(cc1)Nc2ccc(cc2)O 271570a_203496583355_200010219254 [0,2,0,0,0,0|1,0,0]=3 4480 B16R2.33 Cc1ccc(cc1)Nc2ccc(cn2)Br 27a_100000124888_100000686858 [0,2,0,0,0,0|2,0,0]=4 4481 B16R2.33 Cc1ccc(cc1)Oc2ccc(cc2)O 271570a_203496583355_100000035512 [0,2,0,0,0,0|0,0,0]=2 4482 B16R2.33 Cc1ccc(cc1)Oc2ncc(cn2)O 271570a_203496583355_200011939449 [0,2,0,0,0,0|2,0,0]=4 4483 B16R2.33 Cc1ccc(cc1)Sc2cc[n+](cc2)[O-] 62a_100000186775_100000039755 [0,2,0,0,0,0|1,1,0]=4 4484 B16R2.33 Cc1ccc(cc1)Sc2ccc(=O)[nH]c2 62a_100000186775_100000212171 [0,2,0,0,0,0|1,1,0]=4 4485 B16R2.33 Cc1ccc(cc1)Sc2ccc(=O)[nH]c2 62a_100000212171_100000186775 [0,2,0,0,0,0|1,1,0]=4 4486 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000186775_100000752885 [0,2,0,0,0,0|0,1,0]=3 4487 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000752885_100000186775 [0,2,0,0,0,0|0,1,0]=3 4488 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)C 62a_100000186775_100000186775 [0,2,0,0,0,0|0,1,0]=3 4489 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000186775_100000755918 [0,2,0,0,0,0|0,1,0]=3 4490 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000755918_100000186775 [0,2,0,0,0,0|0,1,0]=3 4491 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)F 62a_100000186775_100000211213 [0,2,0,0,0,0|0,1,0]=3 4492 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)F 62a_100000211213_100000186775 [0,2,0,0,0,0|0,1,0]=3 4493 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)N 62a_100000185761_100000186775 [0,2,0,0,0,0|0,1,0]=3 4494 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)N 62a_100000186775_100000185761 [0,2,0,0,0,0|0,1,0]=3 4495 B16R2.33 Cc1ccc(cc1)Sc2ccc(cc2)O 62a_100000186775_100000185759 [0,2,0,0,0,0|0,1,0]=3 4496 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000186775_100000686858 [0,2,0,0,0,0|1,1,0]=4 4497 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000686858_100000186775 [0,2,0,0,0,0|1,1,0]=4 4498 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)C 62a_100000186775_100000754016 [0,2,0,0,0,0|1,1,0]=4 4499 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)C 62a_100011192072_100000186775 [0,2,0,0,0,0|1,1,0]=4 4500 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100000186775_100011356976 [0,2,0,0,0,0|1,1,0]=4 4501 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100011356976_100000186775 [0,2,0,0,0,0|1,1,0]=4 4502 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)F 62a_100000186775_100000744514 [0,2,0,0,0,0|1,1,0]=4 4503 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)F 62a_100000744514_100000186775 [0,2,0,0,0,0|1,1,0]=4 4504 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)N 62a_100000186775_100000737798 [0,2,0,0,0,0|1,1,0]=4 4505 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)N 62a_100000737798_100000186775 [0,2,0,0,0,0|1,1,0]=4 4506 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)O 62a_100000186775_100000744096 [0,2,0,0,0,0|1,1,0]=4 4507 B16R2.33 Cc1ccc(cc1)Sc2ccc(cn2)O 62a_100000685995_100000186775 [0,2,0,0,0,0|1,1,0]=4 4508 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)Br 62a_100000186775_100009814638 [0,2,0,0,0,0|1,1,0]=4 4509 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)Br 62a_100009814638_100000186775 [0,2,0,0,0,0|1,1,0]=4 4510 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)C 62a_100000186775_100000751577 [0,2,0,0,0,0|1,1,0]=4 4511 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)C 62a_100000751577_100000186775 [0,2,0,0,0,0|1,1,0]=4 4512 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000034144_100000186775 [0,2,0,0,0,0|1,1,0]=4 4513 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000186775_100000034144 [0,2,0,0,0,0|1,1,0]=4 4514 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)F 62a_100000042367_100000186775 [0,2,0,0,0,0|1,1,0]=4 4515 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)F 62a_100000186775_100000042367 [0,2,0,0,0,0|1,1,0]=4 4516 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)N 62a_100000186775_100000187370 [0,2,0,0,0,0|1,1,0]=4 4517 B16R2.33 Cc1ccc(cc1)Sc2ccc(nc2)N 62a_100000187370_100000186775 [0,2,0,0,0,0|1,1,0]=4 4518 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)Br 62a_100000751577_100000752885 [0,2,0,0,0,0|1,1,0]=4 4519 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)Br 62a_100000752885_100000751577 [0,2,0,0,0,0|1,1,0]=4 4520 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)Cl 62a_100000751577_100000755918 [0,2,0,0,0,0|1,1,0]=4 4521 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)Cl 62a_100000755918_100000751577 [0,2,0,0,0,0|1,1,0]=4 4522 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)F 62a_100000211213_100000751577 [0,2,0,0,0,0|1,1,0]=4 4523 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)F 62a_100000751577_100000211213 [0,2,0,0,0,0|1,1,0]=4 4524 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)N 62a_100000185761_100000751577 [0,2,0,0,0,0|1,1,0]=4 4525 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)N 62a_100000751577_100000185761 [0,2,0,0,0,0|1,1,0]=4 4526 B16R2.33 Cc1ccc(cn1)Sc2ccc(cc2)O 62a_100000751577_100000185759 [0,2,0,0,0,0|1,1,0]=4 4527 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)Br 62a_100000752885_100000754016 [0,2,0,0,0,0|1,1,0]=4 4528 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)Br 62a_100011192072_100000752885 [0,2,0,0,0,0|1,1,0]=4 4529 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)Cl 62a_100000755918_100000754016 [0,2,0,0,0,0|1,1,0]=4 4530 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)Cl 62a_100011192072_100000755918 [0,2,0,0,0,0|1,1,0]=4 4531 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)F 62a_100000211213_100000754016 [0,2,0,0,0,0|1,1,0]=4 4532 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)F 62a_100011192072_100000211213 [0,2,0,0,0,0|1,1,0]=4 4533 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)N 62a_100000185761_100000754016 [0,2,0,0,0,0|1,1,0]=4 4534 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)N 62a_100011192072_100000185761 [0,2,0,0,0,0|1,1,0]=4 4535 B16R2.33 Cc1ccc(nc1)Sc2ccc(cc2)O 62a_100011192072_100000185759 [0,2,0,0,0,0|1,1,0]=4 4536 B16R2.33 Clc1ccc(cc1)Nc2ccc(cn2)Br 27a_100000210052_100000686858 [0,2,0,0,0,0|2,0,0]=4 4537 B16R2.33 Clc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000752885_100000755918 [0,2,0,0,0,0|0,1,0]=3 4538 B16R2.33 Clc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000755918_100000752885 [0,2,0,0,0,0|0,1,0]=3 4539 B16R2.33 Clc1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000755918_100000755918 [0,2,0,0,0,0|0,1,0]=3 4540 B16R2.33 Clc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000686858_100000755918 [0,2,0,0,0,0|1,1,0]=4 4541 B16R2.33 Clc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000755918_100000686858 [0,2,0,0,0,0|1,1,0]=4 4542 B16R2.33 Clc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100000755918_100011356976 [0,2,0,0,0,0|1,1,0]=4 4543 B16R2.33 Clc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100011356976_100000755918 [0,2,0,0,0,0|1,1,0]=4 4544 B16R2.33 Clc1ccc(cc1)Sc2ccc(nc2)Br 62a_100000755918_100009814638 [0,2,0,0,0,0|1,1,0]=4 4545 B16R2.33 Clc1ccc(cc1)Sc2ccc(nc2)Br 62a_100009814638_100000755918 [0,2,0,0,0,0|1,1,0]=4 4546 B16R2.33 Clc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000034144_100000755918 [0,2,0,0,0,0|1,1,0]=4 4547 B16R2.33 Clc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000755918_100000034144 [0,2,0,0,0,0|1,1,0]=4 4548 B16R2.33 Clc1ccc(cn1)Sc2ccc(cc2)Br 62a_100000034144_100000752885 [0,2,0,0,0,0|1,1,0]=4 4549 B16R2.33 Clc1ccc(cn1)Sc2ccc(cc2)Br 62a_100000752885_100000034144 [0,2,0,0,0,0|1,1,0]=4 4550 B16R2.33 Clc1ccc(nc1)Sc2ccc(cc2)Br 62a_100000752885_100011356976 [0,2,0,0,0,0|1,1,0]=4 4551 B16R2.33 Clc1ccc(nc1)Sc2ccc(cc2)Br 62a_100011356976_100000752885 [0,2,0,0,0,0|1,1,0]=4 4552 B16R2.33 Fc1ccc(cc1)Nc2ccc(cn2)Br 27a_100000185862_100000686858 [0,2,0,0,0,0|2,0,0]=4 4553 B16R2.33 Fc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000211213_100000752885 [0,2,0,0,0,0|0,1,0]=3 4554 B16R2.33 Fc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000752885_100000211213 [0,2,0,0,0,0|0,1,0]=3 4555 B16R2.33 Fc1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000211213_100000755918 [0,2,0,0,0,0|0,1,0]=3 4556 B16R2.33 Fc1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000755918_100000211213 [0,2,0,0,0,0|0,1,0]=3 4557 B16R2.33 Fc1ccc(cc1)Sc2ccc(cc2)F 62a_100000211213_100000211213 [0,2,0,0,0,0|0,1,0]=3 4558 B16R2.33 Fc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000211213_100000686858 [0,2,0,0,0,0|1,1,0]=4 4559 B16R2.33 Fc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000686858_100000211213 [0,2,0,0,0,0|1,1,0]=4 4560 B16R2.33 Fc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100000211213_100011356976 [0,2,0,0,0,0|1,1,0]=4 4561 B16R2.33 Fc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100011356976_100000211213 [0,2,0,0,0,0|1,1,0]=4 4562 B16R2.33 Fc1ccc(cc1)Sc2ccc(cn2)F 62a_100000211213_100000744514 [0,2,0,0,0,0|1,1,0]=4 4563 B16R2.33 Fc1ccc(cc1)Sc2ccc(cn2)F 62a_100000744514_100000211213 [0,2,0,0,0,0|1,1,0]=4 4564 B16R2.33 Fc1ccc(cc1)Sc2ccc(nc2)Br 62a_100000211213_100009814638 [0,2,0,0,0,0|1,1,0]=4 4565 B16R2.33 Fc1ccc(cc1)Sc2ccc(nc2)Br 62a_100009814638_100000211213 [0,2,0,0,0,0|1,1,0]=4 4566 B16R2.33 Fc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000034144_100000211213 [0,2,0,0,0,0|1,1,0]=4 4567 B16R2.33 Fc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000211213_100000034144 [0,2,0,0,0,0|1,1,0]=4 4568 B16R2.33 Fc1ccc(cc1)Sc2ccc(nc2)F 62a_100000042367_100000211213 [0,2,0,0,0,0|1,1,0]=4 4569 B16R2.33 Fc1ccc(cc1)Sc2ccc(nc2)F 62a_100000211213_100000042367 [0,2,0,0,0,0|1,1,0]=4 4570 B16R2.33 Fc1ccc(cn1)Sc2ccc(cc2)Br 62a_100000042367_100000752885 [0,2,0,0,0,0|1,1,0]=4 4571 B16R2.33 Fc1ccc(cn1)Sc2ccc(cc2)Br 62a_100000752885_100000042367 [0,2,0,0,0,0|1,1,0]=4 4572 B16R2.33 Fc1ccc(cn1)Sc2ccc(cc2)Cl 62a_100000042367_100000755918 [0,2,0,0,0,0|1,1,0]=4 4573 B16R2.33 Fc1ccc(cn1)Sc2ccc(cc2)Cl 62a_100000755918_100000042367 [0,2,0,0,0,0|1,1,0]=4 4574 B16R2.33 Fc1ccc(nc1)Sc2ccc(cc2)Br 62a_100000744514_100000752885 [0,2,0,0,0,0|1,1,0]=4 4575 B16R2.33 Fc1ccc(nc1)Sc2ccc(cc2)Br 62a_100000752885_100000744514 [0,2,0,0,0,0|1,1,0]=4 4576 B16R2.33 Fc1ccc(nc1)Sc2ccc(cc2)Cl 62a_100000744514_100000755918 [0,2,0,0,0,0|1,1,0]=4 4577 B16R2.33 Fc1ccc(nc1)Sc2ccc(cc2)Cl 62a_100000755918_100000744514 [0,2,0,0,0,0|1,1,0]=4 4578 B16R2.33 Nc1ccc(cc1)Oc2ccc(cc2)O 271570a_203496583355_100000184261 [0,2,0,0,0,0|0,0,0]=2 4579 B16R2.33 Nc1ccc(cc1)Oc2ncc(cn2)O 271570a_203496583355_100011938920 [0,2,0,0,0,0|2,0,0]=4 4580 B16R2.33 Nc1ccc(cc1)Sc2cc[n+](cc2)[O-] 62a_100000185761_100000039755 [0,2,0,0,0,0|1,1,0]=4 4581 B16R2.33 Nc1ccc(cc1)Sc2ccc(=O)[nH]c2 62a_100000185761_100000212171 [0,2,0,0,0,0|1,1,0]=4 4582 B16R2.33 Nc1ccc(cc1)Sc2ccc(=O)[nH]c2 62a_100000212171_100000185761 [0,2,0,0,0,0|1,1,0]=4 4583 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000185761_100000752885 [0,2,0,0,0,0|0,1,0]=3 4584 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000752885_100000185761 [0,2,0,0,0,0|0,1,0]=3 4585 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000185761_100000755918 [0,2,0,0,0,0|0,1,0]=3 4586 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000755918_100000185761 [0,2,0,0,0,0|0,1,0]=3 4587 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)F 62a_100000185761_100000211213 [0,2,0,0,0,0|0,1,0]=3 4588 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)F 62a_100000211213_100000185761 [0,2,0,0,0,0|0,1,0]=3 4589 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)N 62a_100000185761_100000185761 [0,2,0,0,0,0|0,1,0]=3 4590 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)O 271570a_203496583355_100000682706 [0,2,0,0,0,0|0,1,0]=3 4591 B16R2.33 Nc1ccc(cc1)Sc2ccc(cc2)O 62a_100000185761_100000185759 [0,2,0,0,0,0|0,1,0]=3 4592 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000185761_100000686858 [0,2,0,0,0,0|1,1,0]=4 4593 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000686858_100000185761 [0,2,0,0,0,0|1,1,0]=4 4594 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100000185761_100011356976 [0,2,0,0,0,0|1,1,0]=4 4595 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100011356976_100000185761 [0,2,0,0,0,0|1,1,0]=4 4596 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)F 62a_100000185761_100000744514 [0,2,0,0,0,0|1,1,0]=4 4597 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)F 62a_100000744514_100000185761 [0,2,0,0,0,0|1,1,0]=4 4598 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)N 62a_100000185761_100000737798 [0,2,0,0,0,0|1,1,0]=4 4599 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)N 62a_100000737798_100000185761 [0,2,0,0,0,0|1,1,0]=4 4600 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)O 62a_100000185761_100000744096 [0,2,0,0,0,0|1,1,0]=4 4601 B16R2.33 Nc1ccc(cc1)Sc2ccc(cn2)O 62a_100000685995_100000185761 [0,2,0,0,0,0|1,1,0]=4 4602 B16R2.33 Nc1ccc(cc1)Sc2ccc(nc2)Br 62a_100000185761_100009814638 [0,2,0,0,0,0|1,1,0]=4 4603 B16R2.33 Nc1ccc(cc1)Sc2ccc(nc2)Br 62a_100009814638_100000185761 [0,2,0,0,0,0|1,1,0]=4 4604 B16R2.33 Nc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000034144_100000185761 [0,2,0,0,0,0|1,1,0]=4 4605 B16R2.33 Nc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000185761_100000034144 [0,2,0,0,0,0|1,1,0]=4 4606 B16R2.33 Nc1ccc(cc1)Sc2ccc(nc2)F 62a_100000042367_100000185761 [0,2,0,0,0,0|1,1,0]=4 4607 B16R2.33 Nc1ccc(cc1)Sc2ccc(nc2)F 62a_100000185761_100000042367 [0,2,0,0,0,0|1,1,0]=4 4608 B16R2.33 Nc1ccc(cc1)Sc2ccc(nc2)N 62a_100000185761_100000187370 [0,2,0,0,0,0|1,1,0]=4 4609 B16R2.33 Nc1ccc(cc1)Sc2ccc(nc2)N 62a_100000187370_100000185761 [0,2,0,0,0,0|1,1,0]=4 4610 B16R2.33 Nc1ccc(cn1)Sc2ccc(cc2)Br 62a_100000187370_100000752885 [0,2,0,0,0,0|1,1,0]=4 4611 B16R2.33 Nc1ccc(cn1)Sc2ccc(cc2)Br 62a_100000752885_100000187370 [0,2,0,0,0,0|1,1,0]=4 4612 B16R2.33 Nc1ccc(cn1)Sc2ccc(cc2)Cl 62a_100000187370_100000755918 [0,2,0,0,0,0|1,1,0]=4 4613 B16R2.33 Nc1ccc(cn1)Sc2ccc(cc2)Cl 62a_100000755918_100000187370 [0,2,0,0,0,0|1,1,0]=4 4614 B16R2.33 Nc1ccc(cn1)Sc2ccc(cc2)F 62a_100000187370_100000211213 [0,2,0,0,0,0|1,1,0]=4 4615 B16R2.33 Nc1ccc(cn1)Sc2ccc(cc2)F 62a_100000211213_100000187370 [0,2,0,0,0,0|1,1,0]=4 4616 B16R2.33 Nc1ccc(cn1)Sc2ccc(cc2)O 62a_100000187370_100000185759 [0,2,0,0,0,0|1,1,0]=4 4617 B16R2.33 Nc1ccc(nc1)Oc2ccc(cc2)O 271570a_203496583355_200011194747 [0,2,0,0,0,0|1,0,0]=3 4618 B16R2.33 Nc1ccc(nc1)Sc2ccc(cc2)Br 62a_100000737798_100000752885 [0,2,0,0,0,0|1,1,0]=4 4619 B16R2.33 Nc1ccc(nc1)Sc2ccc(cc2)Br 62a_100000752885_100000737798 [0,2,0,0,0,0|1,1,0]=4 4620 B16R2.33 Nc1ccc(nc1)Sc2ccc(cc2)Cl 62a_100000737798_100000755918 [0,2,0,0,0,0|1,1,0]=4 4621 B16R2.33 Nc1ccc(nc1)Sc2ccc(cc2)Cl 62a_100000755918_100000737798 [0,2,0,0,0,0|1,1,0]=4 4622 B16R2.33 Nc1ccc(nc1)Sc2ccc(cc2)F 62a_100000211213_100000737798 [0,2,0,0,0,0|1,1,0]=4 4623 B16R2.33 Nc1ccc(nc1)Sc2ccc(cc2)F 62a_100000737798_100000211213 [0,2,0,0,0,0|1,1,0]=4 4624 B16R2.33 Nc1ccc(nc1)Sc2ccc(cc2)O 62a_100000737798_100000185759 [0,2,0,0,0,0|1,1,0]=4 4625 B16R2.33 O=c1ccc(c[nH]1)Sc2ccc(cc2)Br 62a_100000212171_100000752885 [0,2,0,0,0,0|1,1,0]=4 4626 B16R2.33 O=c1ccc(c[nH]1)Sc2ccc(cc2)Br 62a_100000752885_100000212171 [0,2,0,0,0,0|1,1,0]=4 4627 B16R2.33 O=c1ccc(c[nH]1)Sc2ccc(cc2)Cl 62a_100000212171_100000755918 [0,2,0,0,0,0|1,1,0]=4 4628 B16R2.33 O=c1ccc(c[nH]1)Sc2ccc(cc2)Cl 62a_100000755918_100000212171 [0,2,0,0,0,0|1,1,0]=4 4629 B16R2.33 O=c1ccc(c[nH]1)Sc2ccc(cc2)F 62a_100000211213_100000212171 [0,2,0,0,0,0|1,1,0]=4 4630 B16R2.33 O=c1ccc(c[nH]1)Sc2ccc(cc2)F 62a_100000212171_100000211213 [0,2,0,0,0,0|1,1,0]=4 4631 B16R2.33 O=c1ccc(c[nH]1)Sc2ccc(cc2)O 62a_100000212171_100000185759 [0,2,0,0,0,0|1,1,0]=4 4632 B16R2.33 Oc1ccc(cc1)Nc2ccc(cn2)Br 27a_100000185829_100000686858 [0,2,0,0,0,0|2,0,0]=4 4633 B16R2.33 Oc1ccc(cc1)Oc2ccc(cc2)Cl 271570a_203496583355_100000035638 [0,2,0,0,0,0|0,0,0]=2 4634 B16R2.33 Oc1ccc(cc1)Oc2ccc(cc2)F 271570a_203496583355_200009990925 [0,2,0,0,0,0|0,0,0]=2 4635 B16R2.33 Oc1ccc(cc1)Oc2ccc(cc2)O 271570a_203496583355_200010192157 [0,2,0,0,0,0|0,0,0]=2 4636 B16R2.33 Oc1ccc(cc1)Sc2ccc(cc2)Br 62a_100000752885_100000185759 [0,2,0,0,0,0|0,1,0]=3 4637 B16R2.33 Oc1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000755918_100000185759 [0,2,0,0,0,0|0,1,0]=3 4638 B16R2.33 Oc1ccc(cc1)Sc2ccc(cc2)F 62a_100000211213_100000185759 [0,2,0,0,0,0|0,1,0]=3 4639 B16R2.33 Oc1ccc(cc1)Sc2ccc(cn2)Br 62a_100000686858_100000185759 [0,2,0,0,0,0|1,1,0]=4 4640 B16R2.33 Oc1ccc(cc1)Sc2ccc(cn2)Cl 62a_100011356976_100000185759 [0,2,0,0,0,0|1,1,0]=4 4641 B16R2.33 Oc1ccc(cc1)Sc2ccc(cn2)F 62a_100000744514_100000185759 [0,2,0,0,0,0|1,1,0]=4 4642 B16R2.33 Oc1ccc(cc1)Sc2ccc(cn2)O 62a_100000685995_100000185759 [0,2,0,0,0,0|1,1,0]=4 4643 B16R2.33 Oc1ccc(cc1)Sc2ccc(nc2)Br 62a_100009814638_100000185759 [0,2,0,0,0,0|1,1,0]=4 4644 B16R2.33 Oc1ccc(cc1)Sc2ccc(nc2)Cl 62a_100000034144_100000185759 [0,2,0,0,0,0|1,1,0]=4 4645 B16R2.33 Oc1ccc(cc1)Sc2ccc(nc2)F 62a_100000042367_100000185759 [0,2,0,0,0,0|1,1,0]=4 4646 B16R2.33 Oc1ccc(nc1)Oc2ccc(cc2)F 271570a_203496583355_100011256011 [0,2,0,0,0,0|1,0,0]=3 4647 B16R2.33 Oc1ccc(nc1)Sc2ccc(cc2)Br 62a_100000685995_100000752885 [0,2,0,0,0,0|1,1,0]=4 4648 B16R2.33 Oc1ccc(nc1)Sc2ccc(cc2)Br 62a_100000752885_100000744096 [0,2,0,0,0,0|1,1,0]=4 4649 B16R2.33 Oc1ccc(nc1)Sc2ccc(cc2)Cl 62a_100000685995_100000755918 [0,2,0,0,0,0|1,1,0]=4 4650 B16R2.33 Oc1ccc(nc1)Sc2ccc(cc2)Cl 62a_100000755918_100000744096 [0,2,0,0,0,0|1,1,0]=4 4651 B16R2.33 Oc1ccc(nc1)Sc2ccc(cc2)F 62a_100000211213_100000744096 [0,2,0,0,0,0|1,1,0]=4 4652 B16R2.33 Oc1ccc(nc1)Sc2ccc(cc2)F 62a_100000685995_100000211213 [0,2,0,0,0,0|1,1,0]=4 4653 B16R2.33 [O-][n+]1ccc(cc1)Sc2ccc(cc2)Br 62a_100000752885_100000039755 [0,2,0,0,0,0|1,1,0]=4 4654 B16R2.33 [O-][n+]1ccc(cc1)Sc2ccc(cc2)Cl 62a_100000755918_100000039755 [0,2,0,0,0,0|1,1,0]=4 4655 B16R2.33 [O-][n+]1ccc(cc1)Sc2ccc(cc2)F 62a_100000211213_100000039755 [0,2,0,0,0,0|1,1,0]=4 4656 B16R2.120 C=C(c1ccc(cc1)C)c2ccccn2 271570a_100010895218_100011216584 [0,2,0,0,0,0|2,0,0]=4 4657 B16R2.120 C=C(c1ccc(cc1)C)c2cccnc2 271570a_100010895218_100000752921 [0,2,0,0,0,0|2,0,0]=4 4658 B16R2.120 C=C(c1ccc(cc1)Cl)c2ccccn2 271570a_100010171417_100011216584 [0,2,0,0,0,0|2,0,0]=4 4659 B16R2.120 C=C(c1ccc(cc1)Cl)c2cccnc2 271570a_100010171417_100000752921 [0,2,0,0,0,0|2,0,0]=4 4660 B16R2.120 C=C(c1ccc(cc1)F)c2ccccn2 271570a_100000068270_100011216584 [0,2,0,0,0,0|2,0,0]=4 4661 B16R2.120 C=C(c1ccc(cc1)F)c2cccnc2 271570a_100000068270_100000752921 [0,2,0,0,0,0|2,0,0]=4 4662 B16R2.120 C=C(c1ccccc1)c2cc[n+](cc2)[O-] 271570a_100000068269_100000039755 [0,2,0,0,0,0|2,0,0]=4 4663 B16R2.120 C=C(c1ccccc1)c2ccc(=O)[nH]c2 271570a_100000068269_100000212171 [0,2,0,0,0,0|2,0,0]=4 4664 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)Br 271570a_100000068269_100000752885 [0,2,0,0,0,0|1,0,0]=3 4665 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)C 271570a_100000068269_100000186775 [0,2,0,0,0,0|1,0,0]=3 4666 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)C 271570a_100010895218_100000210277 [0,2,0,0,0,0|1,0,0]=3 4667 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)Cl 271570a_100000068269_100000755918 [0,2,0,0,0,0|1,0,0]=3 4668 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)Cl 271570a_100010171417_100000210277 [0,2,0,0,0,0|1,0,0]=3 4669 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)F 271570a_100000068269_100000211213 [0,2,0,0,0,0|1,0,0]=3 4670 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)F 271570a_100000068270_100000210277 [0,2,0,0,0,0|1,0,0]=3 4671 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)N 271570a_100000068269_100000185761 [0,2,0,0,0,0|1,0,0]=3 4672 B16R2.120 C=C(c1ccccc1)c2ccc(cc2)O 271570a_100000068269_100000185759 [0,2,0,0,0,0|1,0,0]=3 4673 B16R2.120 C=C(c1ccccc1)c2ccc(cn2)Br 271570a_100000068269_100000686858 [0,2,0,0,0,0|2,0,0]=4 4674 B16R2.120 C=C(c1ccccc1)c2ccc(cn2)C 271570a_100000068269_100000754016 [0,2,0,0,0,0|2,0,0]=4 4675 B16R2.120 C=C(c1ccccc1)c2ccc(cn2)Cl 271570a_100000068269_100011356976 [0,2,0,0,0,0|2,0,0]=4 4676 B16R2.120 C=C(c1ccccc1)c2ccc(cn2)F 271570a_100000068269_100000744514 [0,2,0,0,0,0|2,0,0]=4 4677 B16R2.120 C=C(c1ccccc1)c2ccc(cn2)N 271570a_100000068269_100000744251 [0,2,0,0,0,0|2,0,0]=4 4678 B16R2.120 C=C(c1ccccc1)c2ccc(cn2)O 271570a_100000068269_100000685995 [0,2,0,0,0,0|2,0,0]=4 4679 B16R2.120 C=C(c1ccccc1)c2ccc(nc2)Br 271570a_100000068269_100009814638 [0,2,0,0,0,0|2,0,0]=4 4680 B16R2.120 C=C(c1ccccc1)c2ccc(nc2)C 271570a_100000068269_100000751577 [0,2,0,0,0,0|2,0,0]=4 4681 B16R2.120 C=C(c1ccccc1)c2ccc(nc2)Cl 271570a_100000068269_100000034144 [0,2,0,0,0,0|2,0,0]=4 4682 B16R2.120 C=C(c1ccccc1)c2ccc(nc2)F 271570a_100000068269_100000748661 [0,2,0,0,0,0|2,0,0]=4 4683 B16R2.120 C=C(c1ccccc1)c2ccc(nc2)N 271570a_100000068269_100000187370 [0,2,0,0,0,0|2,0,0]=4 4684 B16R2.120 C=C(c1ccncc1)c2ccc(cc2)C 271570a_100010895218_100000035832 [0,2,0,0,0,0|2,0,0]=4 4685 B16R2.120 C=C(c1ccncc1)c2ccc(cc2)Cl 271570a_100010171417_100000035832 [0,2,0,0,0,0|2,0,0]=4 4686 B16R2.120 C=C(c1ccncc1)c2ccc(cc2)F 271570a_100000068270_100000035832 [0,2,0,0,0,0|2,0,0]=4 4687 B16R2.120 NC(c1ccccc1)c2ccc(cc2)O 271570a_203496583355_100000745999 [0,2,0,0,0,0|1,0,0]=3 4688 B16R2.120 O=C(c1ccc(cc1)O)c2ccccn2 271570a_203496583355_200010179208 [0,2,0,0,0,0|2,0,0]=4 4689 B16R2.120 O=C(c1ccc(cc1)O)c2cccnc2 271570a_203496583355_100000753996 [0,2,0,0,0,0|2,0,0]=4 4690 B16R2.120 O=C(c1ccccc1)c2ccc(cc2)O 271570a_203496583355_100000718703 [0,2,0,0,0,0|1,0,0]=3 4691 B16R2.120 Oc1ccc(cc1)C(O)c2ccccc2 271570a_203496583355_100011217567 [0,2,0,0,0,0|1,0,0]=3 4692 B16R2.124 Brc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100012356285 [0,2,0,0,0,0|0,1,0]=3 4693 B16R2.124 Brc1ccc(cc1Br)Sc2ccccc2 62a_100012356285_100000041952 [0,2,0,0,0,0|0,1,0]=3 4694 B16R2.124 Brc1ccc(cc1Br)Sc2ccccn2 62a_100011216584_100012356285 [0,2,0,0,0,0|1,1,0]=4 4695 B16R2.124 Brc1ccc(cc1Br)Sc2ccccn2 62a_100012356285_100011216584 [0,2,0,0,0,0|1,1,0]=4 4696 B16R2.124 Brc1ccc(cc1Br)Sc2cccnc2 62a_100000210063_100012356285 [0,2,0,0,0,0|1,1,0]=4 4697 B16R2.124 Brc1ccc(cc1Br)Sc2cccnc2 62a_100012356285_100000210063 [0,2,0,0,0,0|1,1,0]=4 4698 B16R2.124 Brc1ccc(cc1Br)Sc2ccncc2 62a_100000728582_100012356285 [0,2,0,0,0,0|1,1,0]=4 4699 B16R2.124 Brc1ccc(cc1Br)Sc2ccncc2 62a_100012356285_100000728582 [0,2,0,0,0,0|1,1,0]=4 4700 B16R2.124 Cc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100009813585 [0,2,0,0,0,0|0,1,0]=3 4701 B16R2.124 Cc1cc(ccc1Br)Sc2ccccc2 62a_100009813585_100000041952 [0,2,0,0,0,0|0,1,0]=3 4702 B16R2.124 Cc1cc(ccc1Br)Sc2ccccn2 62a_100009813585_100011216584 [0,2,0,0,0,0|1,1,0]=4 4703 B16R2.124 Cc1cc(ccc1Br)Sc2ccccn2 62a_100011216584_100009813585 [0,2,0,0,0,0|1,1,0]=4 4704 B16R2.124 Cc1cc(ccc1Br)Sc2cccnc2 62a_100000210063_100009813585 [0,2,0,0,0,0|1,1,0]=4 4705 B16R2.124 Cc1cc(ccc1Br)Sc2cccnc2 62a_100009813585_100000210063 [0,2,0,0,0,0|1,1,0]=4 4706 B16R2.124 Cc1cc(ccc1Br)Sc2ccncc2 62a_100000728582_100009813585 [0,2,0,0,0,0|1,1,0]=4 4707 B16R2.124 Cc1cc(ccc1Br)Sc2ccncc2 62a_100009813585_100000728582 [0,2,0,0,0,0|1,1,0]=4 4708 B16R2.124 Cc1cc(ccc1Cl)Sc2ccccc2 62a_100000049509_100000041952 [0,2,0,0,0,0|0,1,0]=3 4709 B16R2.124 Cc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_100000049509 [0,2,0,0,0,0|0,1,0]=3 4710 B16R2.124 Cc1cc(ccc1Cl)Sc2ccccn2 62a_100000049509_100011216584 [0,2,0,0,0,0|1,1,0]=4 4711 B16R2.124 Cc1cc(ccc1Cl)Sc2ccccn2 62a_100011216584_100000049509 [0,2,0,0,0,0|1,1,0]=4 4712 B16R2.124 Cc1cc(ccc1Cl)Sc2cccnc2 62a_100000049509_100000210063 [0,2,0,0,0,0|1,1,0]=4 4713 B16R2.124 Cc1cc(ccc1Cl)Sc2cccnc2 62a_100000210063_100000049509 [0,2,0,0,0,0|1,1,0]=4 4714 B16R2.124 Cc1cc(ccc1Cl)Sc2ccncc2 62a_100000049509_100000728582 [0,2,0,0,0,0|1,1,0]=4 4715 B16R2.124 Cc1cc(ccc1Cl)Sc2ccncc2 62a_100000728582_100000049509 [0,2,0,0,0,0|1,1,0]=4 4716 B16R2.124 Cc1cc(ccc1F)Sc2ccccc2 62a_100000719477_100011218330 [0,2,0,0,0,0|0,1,0]=3 4717 B16R2.124 Cc1cc(ccc1F)Sc2ccccc2 62a_100011218330_100000041952 [0,2,0,0,0,0|0,1,0]=3 4718 B16R2.124 Cc1cc(ccc1F)Sc2ccccn2 62a_100011216584_100011218330 [0,2,0,0,0,0|1,1,0]=4 4719 B16R2.124 Cc1cc(ccc1F)Sc2ccccn2 62a_100011218330_100011216584 [0,2,0,0,0,0|1,1,0]=4 4720 B16R2.124 Cc1cc(ccc1F)Sc2cccnc2 62a_100000210063_100011218330 [0,2,0,0,0,0|1,1,0]=4 4721 B16R2.124 Cc1cc(ccc1F)Sc2cccnc2 62a_100011218330_100000210063 [0,2,0,0,0,0|1,1,0]=4 4722 B16R2.124 Cc1cc(ccc1F)Sc2ccncc2 62a_100000728582_100011218330 [0,2,0,0,0,0|1,1,0]=4 4723 B16R2.124 Cc1cc(ccc1F)Sc2ccncc2 62a_100011218330_100000728582 [0,2,0,0,0,0|1,1,0]=4 4724 B16R2.124 Cc1cc(ccc1N)Sc2ccccc2 62a_100000211769_100000041952 [0,2,0,0,0,0|0,1,0]=3 4725 B16R2.124 Cc1cc(ccc1N)Sc2ccccc2 62a_100000719477_100000211769 [0,2,0,0,0,0|0,1,0]=3 4726 B16R2.124 Cc1cc(ccc1N)Sc2ccccn2 62a_100000211769_100011216584 [0,2,0,0,0,0|1,1,0]=4 4727 B16R2.124 Cc1cc(ccc1N)Sc2ccccn2 62a_100011216584_100000211769 [0,2,0,0,0,0|1,1,0]=4 4728 B16R2.124 Cc1cc(ccc1N)Sc2cccnc2 62a_100000210063_100000211769 [0,2,0,0,0,0|1,1,0]=4 4729 B16R2.124 Cc1cc(ccc1N)Sc2cccnc2 62a_100000211769_100000210063 [0,2,0,0,0,0|1,1,0]=4 4730 B16R2.124 Cc1cc(ccc1N)Sc2ccncc2 62a_100000211769_100000728582 [0,2,0,0,0,0|1,1,0]=4 4731 B16R2.124 Cc1cc(ccc1N)Sc2ccncc2 62a_100000728582_100000211769 [0,2,0,0,0,0|1,1,0]=4 4732 B16R2.124 Cc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000186361 [0,2,0,0,0,0|0,1,0]=3 4733 B16R2.124 Cc1cc(ccc1O)Sc2ccccn2 62a_100011216584_100000186361 [0,2,0,0,0,0|1,1,0]=4 4734 B16R2.124 Cc1cc(ccc1O)Sc2cccnc2 62a_100000210063_100000186361 [0,2,0,0,0,0|1,1,0]=4 4735 B16R2.124 Cc1cc(ccc1O)Sc2ccncc2 62a_100000728582_100000186361 [0,2,0,0,0,0|1,1,0]=4 4736 B16R2.124 Cc1cc(cnc1Br)Sc2ccccc2 62a_100000719477_100009816107 [0,2,0,0,0,0|1,1,0]=4 4737 B16R2.124 Cc1cc(cnc1Br)Sc2ccccc2 62a_100009816107_100000041952 [0,2,0,0,0,0|1,1,0]=4 4738 B16R2.124 Cc1cc(cnc1C)Sc2ccccc2 62a_100000697892_100000041952 [0,2,0,0,0,0|1,1,0]=4 4739 B16R2.124 Cc1cc(cnc1C)Sc2ccccc2 62a_100000719477_100000697892 [0,2,0,0,0,0|1,1,0]=4 4740 B16R2.124 Cc1cc(cnc1Cl)Sc2ccccc2 62a_100000719477_100009922867 [0,2,0,0,0,0|1,1,0]=4 4741 B16R2.124 Cc1cc(cnc1Cl)Sc2ccccc2 62a_100009922867_100000041952 [0,2,0,0,0,0|1,1,0]=4 4742 B16R2.124 Cc1cc(cnc1F)Sc2ccccc2 62a_100000709442_100000041952 [0,2,0,0,0,0|1,1,0]=4 4743 B16R2.124 Cc1cc(cnc1F)Sc2ccccc2 62a_100000719477_100000709442 [0,2,0,0,0,0|1,1,0]=4 4744 B16R2.124 Cc1cc(cnc1N)Sc2ccccc2 62a_100000684428_100000041952 [0,2,0,0,0,0|1,1,0]=4 4745 B16R2.124 Cc1cc(cnc1N)Sc2ccccc2 62a_100000719477_100000684428 [0,2,0,0,0,0|1,1,0]=4 4746 B16R2.124 Cc1cc(cnc1O)Sc2ccccc2 62a_100000685391_100000041952 [0,2,0,0,0,0|1,1,0]=4 4747 B16R2.124 Cc1cc(cnc1O)Sc2ccccc2 62a_100000719477_100000685391 [0,2,0,0,0,0|1,1,0]=4 4748 B16R2.124 Cc1cc(ncc1Br)Sc2ccccc2 62a_100000719477_100012356354 [0,2,0,0,0,0|1,1,0]=4 4749 B16R2.124 Cc1cc(ncc1Br)Sc2ccccc2 62a_100012356354_100000041952 [0,2,0,0,0,0|1,1,0]=4 4750 B16R2.124 Cc1cc(ncc1F)Sc2ccccc2 62a_100000719477_100009818257 [0,2,0,0,0,0|1,1,0]=4 4751 B16R2.124 Cc1cc(ncc1F)Sc2ccccc2 62a_100009818257_100000041952 [0,2,0,0,0,0|1,1,0]=4 4752 B16R2.124 Cc1cc(ncc1N)Sc2ccccc2 62a_100000067204_100000041952 [0,2,0,0,0,0|1,1,0]=4 4753 B16R2.124 Cc1cc(ncc1N)Sc2ccccc2 62a_100000719477_100000067204 [0,2,0,0,0,0|1,1,0]=4 4754 B16R2.124 Cc1cc(ncc1O)Sc2ccccc2 62a_100000719477_100000692680 [0,2,0,0,0,0|1,1,0]=4 4755 B16R2.124 Cc1ccc(c[n+]1[O-])Sc2ccccc2 62a_100000719477_100000703231 [0,2,0,0,0,0|1,1,0]=4 4756 B16R2.124 Cc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100011847877 [0,2,0,0,0,0|0,1,0]=3 4757 B16R2.124 Cc1ccc(cc1Br)Sc2ccccc2 62a_100011847877_100000041952 [0,2,0,0,0,0|0,1,0]=3 4758 B16R2.124 Cc1ccc(cc1Br)Sc2ccccn2 62a_100011216584_100011847877 [0,2,0,0,0,0|1,1,0]=4 4759 B16R2.124 Cc1ccc(cc1Br)Sc2ccccn2 62a_100011847877_100011216584 [0,2,0,0,0,0|1,1,0]=4 4760 B16R2.124 Cc1ccc(cc1Br)Sc2cccnc2 62a_100000210063_100011847877 [0,2,0,0,0,0|1,1,0]=4 4761 B16R2.124 Cc1ccc(cc1Br)Sc2cccnc2 62a_100011847877_100000210063 [0,2,0,0,0,0|1,1,0]=4 4762 B16R2.124 Cc1ccc(cc1Br)Sc2ccncc2 62a_100000728582_100011847877 [0,2,0,0,0,0|1,1,0]=4 4763 B16R2.124 Cc1ccc(cc1Br)Sc2ccncc2 62a_100011847877_100000728582 [0,2,0,0,0,0|1,1,0]=4 4764 B16R2.124 Cc1ccc(cc1C)Sc2ccccc2 62a_100000719477_100011215607 [0,2,0,0,0,0|0,1,0]=3 4765 B16R2.124 Cc1ccc(cc1C)Sc2ccccc2 62a_100011215607_100000041952 [0,2,0,0,0,0|0,1,0]=3 4766 B16R2.124 Cc1ccc(cc1C)Sc2ccccn2 62a_100011215607_100011216584 [0,2,0,0,0,0|1,1,0]=4 4767 B16R2.124 Cc1ccc(cc1C)Sc2ccccn2 62a_100011216584_100011215607 [0,2,0,0,0,0|1,1,0]=4 4768 B16R2.124 Cc1ccc(cc1C)Sc2cccnc2 62a_100000210063_100011215607 [0,2,0,0,0,0|1,1,0]=4 4769 B16R2.124 Cc1ccc(cc1C)Sc2cccnc2 62a_100011215607_100000210063 [0,2,0,0,0,0|1,1,0]=4 4770 B16R2.124 Cc1ccc(cc1C)Sc2ccncc2 62a_100000728582_100011215607 [0,2,0,0,0,0|1,1,0]=4 4771 B16R2.124 Cc1ccc(cc1C)Sc2ccncc2 62a_100011215607_100000728582 [0,2,0,0,0,0|1,1,0]=4 4772 B16R2.124 Cc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100011216363 [0,2,0,0,0,0|0,1,0]=3 4773 B16R2.124 Cc1ccc(cc1Cl)Sc2ccccc2 62a_100011216363_100000041952 [0,2,0,0,0,0|0,1,0]=3 4774 B16R2.124 Cc1ccc(cc1Cl)Sc2ccccn2 62a_100011216363_100011216584 [0,2,0,0,0,0|1,1,0]=4 4775 B16R2.124 Cc1ccc(cc1Cl)Sc2ccccn2 62a_100011216584_100011216363 [0,2,0,0,0,0|1,1,0]=4 4776 B16R2.124 Cc1ccc(cc1Cl)Sc2cccnc2 62a_100000210063_100011216363 [0,2,0,0,0,0|1,1,0]=4 4777 B16R2.124 Cc1ccc(cc1Cl)Sc2cccnc2 62a_100011216363_100000210063 [0,2,0,0,0,0|1,1,0]=4 4778 B16R2.124 Cc1ccc(cc1Cl)Sc2ccncc2 62a_100000728582_100011216363 [0,2,0,0,0,0|1,1,0]=4 4779 B16R2.124 Cc1ccc(cc1Cl)Sc2ccncc2 62a_100011216363_100000728582 [0,2,0,0,0,0|1,1,0]=4 4780 B16R2.124 Cc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100000720648 [0,2,0,0,0,0|0,1,0]=3 4781 B16R2.124 Cc1ccc(cc1F)Sc2ccccc2 62a_100000720648_100000041952 [0,2,0,0,0,0|0,1,0]=3 4782 B16R2.124 Cc1ccc(cc1F)Sc2ccccn2 62a_100000720648_100011216584 [0,2,0,0,0,0|1,1,0]=4 4783 B16R2.124 Cc1ccc(cc1F)Sc2ccccn2 62a_100011216584_100000720648 [0,2,0,0,0,0|1,1,0]=4 4784 B16R2.124 Cc1ccc(cc1F)Sc2cccnc2 62a_100000210063_100000720648 [0,2,0,0,0,0|1,1,0]=4 4785 B16R2.124 Cc1ccc(cc1F)Sc2cccnc2 62a_100000720648_100000210063 [0,2,0,0,0,0|1,1,0]=4 4786 B16R2.124 Cc1ccc(cc1F)Sc2ccncc2 62a_100000720648_100000728582 [0,2,0,0,0,0|1,1,0]=4 4787 B16R2.124 Cc1ccc(cc1F)Sc2ccncc2 62a_100000728582_100000720648 [0,2,0,0,0,0|1,1,0]=4 4788 B16R2.124 Cc1ccc(cc1N)Sc2ccccc2 62a_100000719477_100000761890 [0,2,0,0,0,0|0,1,0]=3 4789 B16R2.124 Cc1ccc(cc1N)Sc2ccccc2 62a_100000761890_100000041952 [0,2,0,0,0,0|0,1,0]=3 4790 B16R2.124 Cc1ccc(cc1N)Sc2ccccn2 62a_100000761890_100011216584 [0,2,0,0,0,0|1,1,0]=4 4791 B16R2.124 Cc1ccc(cc1N)Sc2ccccn2 62a_100011216584_100000761890 [0,2,0,0,0,0|1,1,0]=4 4792 B16R2.124 Cc1ccc(cc1N)Sc2cccnc2 62a_100000210063_100000761890 [0,2,0,0,0,0|1,1,0]=4 4793 B16R2.124 Cc1ccc(cc1N)Sc2cccnc2 62a_100000761890_100000210063 [0,2,0,0,0,0|1,1,0]=4 4794 B16R2.124 Cc1ccc(cc1N)Sc2ccncc2 62a_100000728582_100000761890 [0,2,0,0,0,0|1,1,0]=4 4795 B16R2.124 Cc1ccc(cc1N)Sc2ccncc2 62a_100000761890_100000728582 [0,2,0,0,0,0|1,1,0]=4 4796 B16R2.124 Cc1ccc(cc1O)Sc2ccccc2 62a_100000685420_100000041952 [0,2,0,0,0,0|0,1,0]=3 4797 B16R2.124 Cc1ccc(cc1O)Sc2ccccc2 62a_100000719477_100000685420 [0,2,0,0,0,0|0,1,0]=3 4798 B16R2.124 Cc1ccc(cc1O)Sc2ccccn2 62a_100000685420_100011216584 [0,2,0,0,0,0|1,1,0]=4 4799 B16R2.124 Cc1ccc(cc1O)Sc2ccccn2 62a_100011216584_100000685420 [0,2,0,0,0,0|1,1,0]=4 4800 B16R2.124 Cc1ccc(cc1O)Sc2cccnc2 62a_100000210063_100000685420 [0,2,0,0,0,0|1,1,0]=4 4801 B16R2.124 Cc1ccc(cc1O)Sc2cccnc2 62a_100000685420_100000210063 [0,2,0,0,0,0|1,1,0]=4 4802 B16R2.124 Cc1ccc(cc1O)Sc2ccncc2 62a_100000685420_100000728582 [0,2,0,0,0,0|1,1,0]=4 4803 B16R2.124 Cc1ccc(cc1O)Sc2ccncc2 62a_100000728582_100000685420 [0,2,0,0,0,0|1,1,0]=4 4804 B16R2.124 Cc1ccc(nc1C)Sc2ccccc2 62a_100000103781_100000041952 [0,2,0,0,0,0|1,1,0]=4 4805 B16R2.124 Cc1ccc(nc1C)Sc2ccccc2 62a_100000719477_100000103781 [0,2,0,0,0,0|1,1,0]=4 4806 B16R2.124 Cc1ccc(nc1N)Sc2ccccc2 62a_100000719477_100009857032 [0,2,0,0,0,0|1,1,0]=4 4807 B16R2.124 Cc1ccc(nc1N)Sc2ccccc2 62a_100009857032_100000041952 [0,2,0,0,0,0|1,1,0]=4 4808 B16R2.124 Cc1cnc(cc1C)Sc2ccccc2 62a_100000719477_100009850809 [0,2,0,0,0,0|1,1,0]=4 4809 B16R2.124 Cc1cnc(cc1C)Sc2ccccc2 62a_100009850809_100000041952 [0,2,0,0,0,0|1,1,0]=4 4810 B16R2.124 Cc1cnc(cc1F)Nc2ccccc2 27a_100000106764_100009841206 [0,2,0,0,0,0|2,0,0]=4 4811 B16R2.124 Cc1cnc(cc1F)Sc2ccccc2 62a_100000719477_100009841206 [0,2,0,0,0,0|1,1,0]=4 4812 B16R2.124 Cc1cnc(cc1F)Sc2ccccc2 62a_100009841206_100000041952 [0,2,0,0,0,0|1,1,0]=4 4813 B16R2.124 Cc1cnc(cc1N)Sc2ccccc2 62a_100000126663_100000041952 [0,2,0,0,0,0|1,1,0]=4 4814 B16R2.124 Cc1cnc(cc1N)Sc2ccccc2 62a_100000719477_100000126663 [0,2,0,0,0,0|1,1,0]=4 4815 B16R2.124 Cc1cnc(cc1O)Sc2ccccc2 62a_100000704368_100000041952 [0,2,0,0,0,0|1,1,0]=4 4816 B16R2.124 Cc1cnc(cc1O)Sc2ccccc2 62a_100000719477_100000704368 [0,2,0,0,0,0|1,1,0]=4 4817 B16R2.124 Cc1nc(ccc1Br)Sc2ccccc2 62a_100000719477_100012360386 [0,2,0,0,0,0|1,1,0]=4 4818 B16R2.124 Cc1nc(ccc1Br)Sc2ccccc2 62a_100012360386_100000041952 [0,2,0,0,0,0|1,1,0]=4 4819 B16R2.124 Cc1nc(ccc1F)Sc2ccccc2 62a_100000719477_100009814307 [0,2,0,0,0,0|1,1,0]=4 4820 B16R2.124 Cc1nc(ccc1F)Sc2ccccc2 62a_100009814307_100000041952 [0,2,0,0,0,0|1,1,0]=4 4821 B16R2.124 Cc1nc(ccc1N)Sc2ccccc2 62a_100000719477_100000720120 [0,2,0,0,0,0|1,1,0]=4 4822 B16R2.124 Cc1nc(ccc1N)Sc2ccccc2 62a_100000720120_100000041952 [0,2,0,0,0,0|1,1,0]=4 4823 B16R2.124 Cc1nc(ccc1O)Sc2ccccc2 62a_100000719477_100010233687 [0,2,0,0,0,0|1,1,0]=4 4824 B16R2.124 Cc1nc(ccc1O)Sc2ccccc2 62a_100010233687_100000041952 [0,2,0,0,0,0|1,1,0]=4 4825 B16R2.124 Cc1ncc(cc1F)Sc2ccccc2 62a_100000719477_100009845756 [0,2,0,0,0,0|1,1,0]=4 4826 B16R2.124 Cc1ncc(cc1F)Sc2ccccc2 62a_100009845756_100000041952 [0,2,0,0,0,0|1,1,0]=4 4827 B16R2.124 Cc1ncc(cc1N)Sc2ccccc2 62a_100000719477_100011999542 [0,2,0,0,0,0|1,1,0]=4 4828 B16R2.124 Cc1ncc(cc1N)Sc2ccccc2 62a_100011999542_100000041952 [0,2,0,0,0,0|1,1,0]=4 4829 B16R2.124 Cc1ncc(cc1O)Sc2ccccc2 62a_100000719477_100009864810 [0,2,0,0,0,0|1,1,0]=4 4830 B16R2.124 Cc1ncc(cc1O)Sc2ccccc2 62a_100009864810_100000041952 [0,2,0,0,0,0|1,1,0]=4 4831 B16R2.124 Clc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100012047281 [0,2,0,0,0,0|0,1,0]=3 4832 B16R2.124 Clc1cc(ccc1Br)Sc2ccccc2 62a_100012047281_100000041952 [0,2,0,0,0,0|0,1,0]=3 4833 B16R2.124 Clc1cc(ccc1Br)Sc2ccccn2 62a_100011216584_100012047281 [0,2,0,0,0,0|1,1,0]=4 4834 B16R2.124 Clc1cc(ccc1Br)Sc2ccccn2 62a_100012047281_100011216584 [0,2,0,0,0,0|1,1,0]=4 4835 B16R2.124 Clc1cc(ccc1Br)Sc2cccnc2 62a_100000210063_100012047281 [0,2,0,0,0,0|1,1,0]=4 4836 B16R2.124 Clc1cc(ccc1Br)Sc2cccnc2 62a_100012047281_100000210063 [0,2,0,0,0,0|1,1,0]=4 4837 B16R2.124 Clc1cc(ccc1Br)Sc2ccncc2 62a_100000728582_100012047281 [0,2,0,0,0,0|1,1,0]=4 4838 B16R2.124 Clc1cc(ccc1Br)Sc2ccncc2 62a_100012047281_100000728582 [0,2,0,0,0,0|1,1,0]=4 4839 B16R2.124 Clc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100012353702 [0,2,0,0,0,0|0,1,0]=3 4840 B16R2.124 Clc1ccc(cc1Br)Sc2ccccc2 62a_100012353702_100000041952 [0,2,0,0,0,0|0,1,0]=3 4841 B16R2.124 Clc1ccc(cc1Br)Sc2ccccn2 62a_100011216584_100012353702 [0,2,0,0,0,0|1,1,0]=4 4842 B16R2.124 Clc1ccc(cc1Br)Sc2ccccn2 62a_100012353702_100011216584 [0,2,0,0,0,0|1,1,0]=4 4843 B16R2.124 Clc1ccc(cc1Br)Sc2cccnc2 62a_100000210063_100012353702 [0,2,0,0,0,0|1,1,0]=4 4844 B16R2.124 Clc1ccc(cc1Br)Sc2cccnc2 62a_100012353702_100000210063 [0,2,0,0,0,0|1,1,0]=4 4845 B16R2.124 Clc1ccc(cc1Br)Sc2ccncc2 62a_100000728582_100012353702 [0,2,0,0,0,0|1,1,0]=4 4846 B16R2.124 Clc1ccc(cc1Br)Sc2ccncc2 62a_100012353702_100000728582 [0,2,0,0,0,0|1,1,0]=4 4847 B16R2.124 Clc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100011214914 [0,2,0,0,0,0|0,1,0]=3 4848 B16R2.124 Clc1ccc(cc1Cl)Sc2ccccc2 62a_100011214914_100000041952 [0,2,0,0,0,0|0,1,0]=3 4849 B16R2.124 Clc1ccc(cc1Cl)Sc2ccccn2 62a_100011214914_100011216584 [0,2,0,0,0,0|1,1,0]=4 4850 B16R2.124 Clc1ccc(cc1Cl)Sc2ccccn2 62a_100011216584_100011214914 [0,2,0,0,0,0|1,1,0]=4 4851 B16R2.124 Clc1ccc(cc1Cl)Sc2cccnc2 62a_100000210063_100011214914 [0,2,0,0,0,0|1,1,0]=4 4852 B16R2.124 Clc1ccc(cc1Cl)Sc2cccnc2 62a_100011214914_100000210063 [0,2,0,0,0,0|1,1,0]=4 4853 B16R2.124 Clc1ccc(cc1Cl)Sc2ccncc2 62a_100000728582_100011214914 [0,2,0,0,0,0|1,1,0]=4 4854 B16R2.124 Clc1ccc(cc1Cl)Sc2ccncc2 62a_100011214914_100000728582 [0,2,0,0,0,0|1,1,0]=4 4855 B16R2.124 Clc1ncc(cc1Br)Sc2ccccc2 62a_100000719477_100010172733 [0,2,0,0,0,0|1,1,0]=4 4856 B16R2.124 Clc1ncc(cc1Br)Sc2ccccc2 62a_100010172733_100000041952 [0,2,0,0,0,0|1,1,0]=4 4857 B16R2.124 Cn1cc(ccc1=O)Sc2ccccc2 62a_100000719477_100011245003 [0,2,0,0,0,0|1,1,0]=4 4858 B16R2.124 Cn1cc(ccc1=O)Sc2ccccc2 62a_100011245003_100000041952 [0,2,0,0,0,0|1,1,0]=4 4859 B16R2.124 Cn1ccc(cc1=O)Nc2ccccc2 27a_100000106764_100009820031 [0,2,0,0,0,0|2,0,0]=4 4860 B16R2.124 Cn1ccc(cc1=O)Sc2ccccc2 62a_100000719477_100009820031 [0,2,0,0,0,0|1,1,0]=4 4861 B16R2.124 Cn1ccc(cc1=O)Sc2ccccc2 62a_100009820031_100000041952 [0,2,0,0,0,0|1,1,0]=4 4862 B16R2.124 Fc1cc(ccc1Br)Sc2ccccc2 62a_100000685389_100000041952 [0,2,0,0,0,0|0,1,0]=3 4863 B16R2.124 Fc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100000685389 [0,2,0,0,0,0|0,1,0]=3 4864 B16R2.124 Fc1cc(ccc1Br)Sc2ccccn2 62a_100000685389_100011216584 [0,2,0,0,0,0|1,1,0]=4 4865 B16R2.124 Fc1cc(ccc1Br)Sc2ccccn2 62a_100011216584_100000685389 [0,2,0,0,0,0|1,1,0]=4 4866 B16R2.124 Fc1cc(ccc1Br)Sc2cccnc2 62a_100000210063_100000685389 [0,2,0,0,0,0|1,1,0]=4 4867 B16R2.124 Fc1cc(ccc1Br)Sc2cccnc2 62a_100000685389_100000210063 [0,2,0,0,0,0|1,1,0]=4 4868 B16R2.124 Fc1cc(ccc1Br)Sc2ccncc2 62a_100000685389_100000728582 [0,2,0,0,0,0|1,1,0]=4 4869 B16R2.124 Fc1cc(ccc1Br)Sc2ccncc2 62a_100000728582_100000685389 [0,2,0,0,0,0|1,1,0]=4 4870 B16R2.124 Fc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_100011216805 [0,2,0,0,0,0|0,1,0]=3 4871 B16R2.124 Fc1cc(ccc1Cl)Sc2ccccc2 62a_100011216805_100000041952 [0,2,0,0,0,0|0,1,0]=3 4872 B16R2.124 Fc1cc(ccc1Cl)Sc2ccccn2 62a_100011216584_100011216805 [0,2,0,0,0,0|1,1,0]=4 4873 B16R2.124 Fc1cc(ccc1Cl)Sc2ccccn2 62a_100011216805_100011216584 [0,2,0,0,0,0|1,1,0]=4 4874 B16R2.124 Fc1cc(ccc1Cl)Sc2cccnc2 62a_100000210063_100011216805 [0,2,0,0,0,0|1,1,0]=4 4875 B16R2.124 Fc1cc(ccc1Cl)Sc2cccnc2 62a_100011216805_100000210063 [0,2,0,0,0,0|1,1,0]=4 4876 B16R2.124 Fc1cc(ccc1Cl)Sc2ccncc2 62a_100000728582_100011216805 [0,2,0,0,0,0|1,1,0]=4 4877 B16R2.124 Fc1cc(ccc1Cl)Sc2ccncc2 62a_100011216805_100000728582 [0,2,0,0,0,0|1,1,0]=4 4878 B16R2.124 Fc1cc(cnc1F)Sc2ccccc2 62a_100000719477_100009817721 [0,2,0,0,0,0|1,1,0]=4 4879 B16R2.124 Fc1cc(cnc1F)Sc2ccccc2 62a_100009817721_100000041952 [0,2,0,0,0,0|1,1,0]=4 4880 B16R2.124 Fc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100012047266 [0,2,0,0,0,0|0,1,0]=3 4881 B16R2.124 Fc1ccc(cc1Br)Sc2ccccc2 62a_100012047266_100000041952 [0,2,0,0,0,0|0,1,0]=3 4882 B16R2.124 Fc1ccc(cc1Br)Sc2ccccn2 62a_100011216584_100012047266 [0,2,0,0,0,0|1,1,0]=4 4883 B16R2.124 Fc1ccc(cc1Br)Sc2ccccn2 62a_100012047266_100011216584 [0,2,0,0,0,0|1,1,0]=4 4884 B16R2.124 Fc1ccc(cc1Br)Sc2cccnc2 62a_100000210063_100012047266 [0,2,0,0,0,0|1,1,0]=4 4885 B16R2.124 Fc1ccc(cc1Br)Sc2cccnc2 62a_100012047266_100000210063 [0,2,0,0,0,0|1,1,0]=4 4886 B16R2.124 Fc1ccc(cc1Br)Sc2ccncc2 62a_100000728582_100012047266 [0,2,0,0,0,0|1,1,0]=4 4887 B16R2.124 Fc1ccc(cc1Br)Sc2ccncc2 62a_100012047266_100000728582 [0,2,0,0,0,0|1,1,0]=4 4888 B16R2.124 Fc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100011215976 [0,2,0,0,0,0|0,1,0]=3 4889 B16R2.124 Fc1ccc(cc1Cl)Sc2ccccc2 62a_100011215976_100000041952 [0,2,0,0,0,0|0,1,0]=3 4890 B16R2.124 Fc1ccc(cc1Cl)Sc2ccccn2 62a_100011215976_100011216584 [0,2,0,0,0,0|1,1,0]=4 4891 B16R2.124 Fc1ccc(cc1Cl)Sc2ccccn2 62a_100011216584_100011215976 [0,2,0,0,0,0|1,1,0]=4 4892 B16R2.124 Fc1ccc(cc1Cl)Sc2cccnc2 62a_100000210063_100011215976 [0,2,0,0,0,0|1,1,0]=4 4893 B16R2.124 Fc1ccc(cc1Cl)Sc2cccnc2 62a_100011215976_100000210063 [0,2,0,0,0,0|1,1,0]=4 4894 B16R2.124 Fc1ccc(cc1Cl)Sc2ccncc2 62a_100000728582_100011215976 [0,2,0,0,0,0|1,1,0]=4 4895 B16R2.124 Fc1ccc(cc1Cl)Sc2ccncc2 62a_100011215976_100000728582 [0,2,0,0,0,0|1,1,0]=4 4896 B16R2.124 Fc1ccc(cc1F)Sc2ccccc2 62a_100000703953_100000041952 [0,2,0,0,0,0|0,1,0]=3 4897 B16R2.124 Fc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100000703953 [0,2,0,0,0,0|0,1,0]=3 4898 B16R2.124 Fc1ccc(cc1F)Sc2ccccn2 62a_100000703953_100011216584 [0,2,0,0,0,0|1,1,0]=4 4899 B16R2.124 Fc1ccc(cc1F)Sc2ccccn2 62a_100011216584_100000703953 [0,2,0,0,0,0|1,1,0]=4 4900 B16R2.124 Fc1ccc(cc1F)Sc2cccnc2 62a_100000210063_100000703953 [0,2,0,0,0,0|1,1,0]=4 4901 B16R2.124 Fc1ccc(cc1F)Sc2cccnc2 62a_100000703953_100000210063 [0,2,0,0,0,0|1,1,0]=4 4902 B16R2.124 Fc1ccc(cc1F)Sc2ccncc2 62a_100000703953_100000728582 [0,2,0,0,0,0|1,1,0]=4 4903 B16R2.124 Fc1ccc(cc1F)Sc2ccncc2 62a_100000728582_100000703953 [0,2,0,0,0,0|1,1,0]=4 4904 B16R2.124 Fc1nc(ccc1Br)Nc2ccccc2 27a_100000106764_100010134343 [0,2,0,0,0,0|2,0,0]=4 4905 B16R2.124 Fc1nc(ccc1Br)Sc2ccccc2 62a_100000719477_100010134343 [0,2,0,0,0,0|1,1,0]=4 4906 B16R2.124 Fc1nc(ccc1Br)Sc2ccccc2 62a_100010134343_100000041952 [0,2,0,0,0,0|1,1,0]=4 4907 B16R2.124 Nc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100000750456 [0,2,0,0,0,0|0,1,0]=3 4908 B16R2.124 Nc1cc(ccc1Br)Sc2ccccc2 62a_100000750456_100000041952 [0,2,0,0,0,0|0,1,0]=3 4909 B16R2.124 Nc1cc(ccc1Br)Sc2ccccn2 62a_100000750456_100011216584 [0,2,0,0,0,0|1,1,0]=4 4910 B16R2.124 Nc1cc(ccc1Br)Sc2ccccn2 62a_100011216584_100000750456 [0,2,0,0,0,0|1,1,0]=4 4911 B16R2.124 Nc1cc(ccc1Br)Sc2cccnc2 62a_100000210063_100000750456 [0,2,0,0,0,0|1,1,0]=4 4912 B16R2.124 Nc1cc(ccc1Br)Sc2cccnc2 62a_100000750456_100000210063 [0,2,0,0,0,0|1,1,0]=4 4913 B16R2.124 Nc1cc(ccc1Br)Sc2ccncc2 62a_100000728582_100000750456 [0,2,0,0,0,0|1,1,0]=4 4914 B16R2.124 Nc1cc(ccc1Br)Sc2ccncc2 62a_100000750456_100000728582 [0,2,0,0,0,0|1,1,0]=4 4915 B16R2.124 Nc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_200000761891 [0,2,0,0,0,0|0,1,0]=3 4916 B16R2.124 Nc1cc(ccc1Cl)Sc2ccccc2 62a_200000761891_100000041952 [0,2,0,0,0,0|0,1,0]=3 4917 B16R2.124 Nc1cc(ccc1Cl)Sc2ccccn2 62a_100011216584_200000761891 [0,2,0,0,0,0|1,1,0]=4 4918 B16R2.124 Nc1cc(ccc1Cl)Sc2ccccn2 62a_200000761891_100011216584 [0,2,0,0,0,0|1,1,0]=4 4919 B16R2.124 Nc1cc(ccc1Cl)Sc2cccnc2 62a_100000210063_200000761891 [0,2,0,0,0,0|1,1,0]=4 4920 B16R2.124 Nc1cc(ccc1Cl)Sc2cccnc2 62a_200000761891_100000210063 [0,2,0,0,0,0|1,1,0]=4 4921 B16R2.124 Nc1cc(ccc1Cl)Sc2ccncc2 62a_100000728582_200000761891 [0,2,0,0,0,0|1,1,0]=4 4922 B16R2.124 Nc1cc(ccc1Cl)Sc2ccncc2 62a_200000761891_100000728582 [0,2,0,0,0,0|1,1,0]=4 4923 B16R2.124 Nc1cc(ccc1F)Sc2ccccc2 62a_100000719477_100000740924 [0,2,0,0,0,0|0,1,0]=3 4924 B16R2.124 Nc1cc(ccc1F)Sc2ccccc2 62a_100000740924_100000041952 [0,2,0,0,0,0|0,1,0]=3 4925 B16R2.124 Nc1cc(ccc1F)Sc2ccccn2 62a_100000740924_100011216584 [0,2,0,0,0,0|1,1,0]=4 4926 B16R2.124 Nc1cc(ccc1F)Sc2ccccn2 62a_100011216584_100000740924 [0,2,0,0,0,0|1,1,0]=4 4927 B16R2.124 Nc1cc(ccc1F)Sc2cccnc2 62a_100000210063_100000740924 [0,2,0,0,0,0|1,1,0]=4 4928 B16R2.124 Nc1cc(ccc1F)Sc2cccnc2 62a_100000740924_100000210063 [0,2,0,0,0,0|1,1,0]=4 4929 B16R2.124 Nc1cc(ccc1F)Sc2ccncc2 62a_100000728582_100000740924 [0,2,0,0,0,0|1,1,0]=4 4930 B16R2.124 Nc1cc(ccc1F)Sc2ccncc2 62a_100000740924_100000728582 [0,2,0,0,0,0|1,1,0]=4 4931 B16R2.124 Nc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000752626 [0,2,0,0,0,0|0,1,0]=3 4932 B16R2.124 Nc1cc(ccc1O)Sc2ccccc2 62a_100000752626_100000041952 [0,2,0,0,0,0|0,1,0]=3 4933 B16R2.124 Nc1cc(ccc1O)Sc2ccccn2 62a_100000752626_100011216584 [0,2,0,0,0,0|1,1,0]=4 4934 B16R2.124 Nc1cc(ccc1O)Sc2ccccn2 62a_100011216584_100000752626 [0,2,0,0,0,0|1,1,0]=4 4935 B16R2.124 Nc1cc(ccc1O)Sc2cccnc2 62a_100000210063_100000752626 [0,2,0,0,0,0|1,1,0]=4 4936 B16R2.124 Nc1cc(ccc1O)Sc2cccnc2 62a_100000752626_100000210063 [0,2,0,0,0,0|1,1,0]=4 4937 B16R2.124 Nc1cc(ccc1O)Sc2ccncc2 62a_100000728582_100000752626 [0,2,0,0,0,0|1,1,0]=4 4938 B16R2.124 Nc1cc(ccc1O)Sc2ccncc2 62a_100000752626_100000728582 [0,2,0,0,0,0|1,1,0]=4 4939 B16R2.124 Nc1cc(cnc1Cl)Sc2ccccc2 62a_100000719477_100009828400 [0,2,0,0,0,0|1,1,0]=4 4940 B16R2.124 Nc1cc(cnc1Cl)Sc2ccccc2 62a_100009828400_100000041952 [0,2,0,0,0,0|1,1,0]=4 4941 B16R2.124 Nc1cc(cnc1F)Sc2ccccc2 62a_100000719477_100009816798 [0,2,0,0,0,0|1,1,0]=4 4942 B16R2.124 Nc1cc(cnc1F)Sc2ccccc2 62a_100009816798_100000041952 [0,2,0,0,0,0|1,1,0]=4 4943 B16R2.124 Nc1cc(cnc1N)Sc2ccccc2 62a_100000184470_100000041952 [0,2,0,0,0,0|1,1,0]=4 4944 B16R2.124 Nc1cc(cnc1N)Sc2ccccc2 62a_100000719477_100000184470 [0,2,0,0,0,0|1,1,0]=4 4945 B16R2.124 Nc1cc(cnc1O)Sc2ccccc2 62a_100000719477_100000743729 [0,2,0,0,0,0|1,1,0]=4 4946 B16R2.124 Nc1cc(cnc1O)Sc2ccccc2 62a_100000743729_100000041952 [0,2,0,0,0,0|1,1,0]=4 4947 B16R2.124 Nc1cc(ncc1F)Sc2ccccc2 62a_100000126464_100000041952 [0,2,0,0,0,0|1,1,0]=4 4948 B16R2.124 Nc1cc(ncc1F)Sc2ccccc2 62a_100000719477_100000126464 [0,2,0,0,0,0|1,1,0]=4 4949 B16R2.124 Nc1cc(ncc1O)Sc2ccccc2 62a_100000719477_100009819941 [0,2,0,0,0,0|1,1,0]=4 4950 B16R2.124 Nc1cc(ncc1O)Sc2ccccc2 62a_100009819941_100000041952 [0,2,0,0,0,0|1,1,0]=4 4951 B16R2.124 Nc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100000750455 [0,2,0,0,0,0|0,1,0]=3 4952 B16R2.124 Nc1ccc(cc1Br)Sc2ccccc2 62a_100000750455_100000041952 [0,2,0,0,0,0|0,1,0]=3 4953 B16R2.124 Nc1ccc(cc1Br)Sc2ccccn2 62a_100000750455_100011216584 [0,2,0,0,0,0|1,1,0]=4 4954 B16R2.124 Nc1ccc(cc1Br)Sc2ccccn2 62a_100011216584_100000750455 [0,2,0,0,0,0|1,1,0]=4 4955 B16R2.124 Nc1ccc(cc1Br)Sc2cccnc2 62a_100000210063_100000750455 [0,2,0,0,0,0|1,1,0]=4 4956 B16R2.124 Nc1ccc(cc1Br)Sc2cccnc2 62a_100000750455_100000210063 [0,2,0,0,0,0|1,1,0]=4 4957 B16R2.124 Nc1ccc(cc1Br)Sc2ccncc2 62a_100000728582_100000750455 [0,2,0,0,0,0|1,1,0]=4 4958 B16R2.124 Nc1ccc(cc1Br)Sc2ccncc2 62a_100000750455_100000728582 [0,2,0,0,0,0|1,1,0]=4 4959 B16R2.124 Nc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100011218065 [0,2,0,0,0,0|0,1,0]=3 4960 B16R2.124 Nc1ccc(cc1Cl)Sc2ccccc2 62a_100011218065_100000041952 [0,2,0,0,0,0|0,1,0]=3 4961 B16R2.124 Nc1ccc(cc1Cl)Sc2ccccn2 62a_100011216584_100011218065 [0,2,0,0,0,0|1,1,0]=4 4962 B16R2.124 Nc1ccc(cc1Cl)Sc2ccccn2 62a_100011218065_100011216584 [0,2,0,0,0,0|1,1,0]=4 4963 B16R2.124 Nc1ccc(cc1Cl)Sc2cccnc2 62a_100000210063_100011218065 [0,2,0,0,0,0|1,1,0]=4 4964 B16R2.124 Nc1ccc(cc1Cl)Sc2cccnc2 62a_100011218065_100000210063 [0,2,0,0,0,0|1,1,0]=4 4965 B16R2.124 Nc1ccc(cc1Cl)Sc2ccncc2 62a_100000728582_100011218065 [0,2,0,0,0,0|1,1,0]=4 4966 B16R2.124 Nc1ccc(cc1Cl)Sc2ccncc2 62a_100011218065_100000728582 [0,2,0,0,0,0|1,1,0]=4 4967 B16R2.124 Nc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100011215594 [0,2,0,0,0,0|0,1,0]=3 4968 B16R2.124 Nc1ccc(cc1F)Sc2ccccc2 62a_100011215594_100000041952 [0,2,0,0,0,0|0,1,0]=3 4969 B16R2.124 Nc1ccc(cc1F)Sc2ccccn2 62a_100011215594_100011216584 [0,2,0,0,0,0|1,1,0]=4 4970 B16R2.124 Nc1ccc(cc1F)Sc2ccccn2 62a_100011216584_100011215594 [0,2,0,0,0,0|1,1,0]=4 4971 B16R2.124 Nc1ccc(cc1F)Sc2cccnc2 62a_100000210063_100011215594 [0,2,0,0,0,0|1,1,0]=4 4972 B16R2.124 Nc1ccc(cc1F)Sc2cccnc2 62a_100011215594_100000210063 [0,2,0,0,0,0|1,1,0]=4 4973 B16R2.124 Nc1ccc(cc1F)Sc2ccncc2 62a_100000728582_100011215594 [0,2,0,0,0,0|1,1,0]=4 4974 B16R2.124 Nc1ccc(cc1F)Sc2ccncc2 62a_100011215594_100000728582 [0,2,0,0,0,0|1,1,0]=4 4975 B16R2.124 Nc1ccc(cc1N)Sc2ccccc2 62a_100000719477_100011534411 [0,2,0,0,0,0|0,1,0]=3 4976 B16R2.124 Nc1ccc(cc1N)Sc2ccccc2 62a_100000741789_100000041952 [0,2,0,0,0,0|0,1,0]=3 4977 B16R2.124 Nc1ccc(cc1N)Sc2ccccn2 62a_100000741789_100011216584 [0,2,0,0,0,0|1,1,0]=4 4978 B16R2.124 Nc1ccc(cc1N)Sc2ccccn2 62a_100011216584_100011534411 [0,2,0,0,0,0|1,1,0]=4 4979 B16R2.124 Nc1ccc(cc1N)Sc2cccnc2 62a_100000210063_100011534411 [0,2,0,0,0,0|1,1,0]=4 4980 B16R2.124 Nc1ccc(cc1N)Sc2cccnc2 62a_100000741789_100000210063 [0,2,0,0,0,0|1,1,0]=4 4981 B16R2.124 Nc1ccc(cc1N)Sc2ccncc2 62a_100000728582_100011534411 [0,2,0,0,0,0|1,1,0]=4 4982 B16R2.124 Nc1ccc(cc1N)Sc2ccncc2 62a_100000741789_100000728582 [0,2,0,0,0,0|1,1,0]=4 4983 B16R2.124 Nc1ccc(cc1O)Sc2ccccc2 62a_100000719477_100000739049 [0,2,0,0,0,0|0,1,0]=3 4984 B16R2.124 Nc1ccc(cc1O)Sc2ccccc2 62a_100000739049_100000041952 [0,2,0,0,0,0|0,1,0]=3 4985 B16R2.124 Nc1ccc(cc1O)Sc2ccccn2 62a_100000739049_100011216584 [0,2,0,0,0,0|1,1,0]=4 4986 B16R2.124 Nc1ccc(cc1O)Sc2ccccn2 62a_100011216584_100000739049 [0,2,0,0,0,0|1,1,0]=4 4987 B16R2.124 Nc1ccc(cc1O)Sc2cccnc2 62a_100000210063_100000739049 [0,2,0,0,0,0|1,1,0]=4 4988 B16R2.124 Nc1ccc(cc1O)Sc2cccnc2 62a_100000739049_100000210063 [0,2,0,0,0,0|1,1,0]=4 4989 B16R2.124 Nc1ccc(cc1O)Sc2ccncc2 62a_100000728582_100000739049 [0,2,0,0,0,0|1,1,0]=4 4990 B16R2.124 Nc1ccc(cc1O)Sc2ccncc2 62a_100000739049_100000728582 [0,2,0,0,0,0|1,1,0]=4 4991 B16R2.124 Nc1ccc(nc1Cl)Sc2ccccc2 62a_100000719477_200010233646 [0,2,0,0,0,0|1,1,0]=4 4992 B16R2.124 Nc1ccc(nc1Cl)Sc2ccccc2 62a_200010233646_100000041952 [0,2,0,0,0,0|1,1,0]=4 4993 B16R2.124 Nc1ccc(nc1F)Sc2ccccc2 62a_100000719477_100009856439 [0,2,0,0,0,0|1,1,0]=4 4994 B16R2.124 Nc1ccc(nc1F)Sc2ccccc2 62a_100009856439_100000041952 [0,2,0,0,0,0|1,1,0]=4 4995 B16R2.124 Nc1ccc(nc1N)Sc2ccccc2 62a_100000747239_100000041952 [0,2,0,0,0,0|1,1,0]=4 4996 B16R2.124 Nc1ccc(nc1O)Sc2ccccc2 62a_100000718904_100000041952 [0,2,0,0,0,0|1,1,0]=4 4997 B16R2.124 Nc1cnc(cc1N)Sc2ccccc2 62a_100000067514_100000041952 [0,2,0,0,0,0|1,1,0]=4 4998 B16R2.124 Nc1cnc(cc1N)Sc2ccccc2 62a_100000719477_100000067514 [0,2,0,0,0,0|1,1,0]=4 4999 B16R2.124 Nc1nc(ccc1F)Sc2ccccc2 62a_100000719477_100016091773 [0,2,0,0,0,0|1,1,0]=4 5000 B16R2.124 Nc1nc(ccc1F)Sc2ccccc2 62a_100016091773_100000041952 [0,2,0,0,0,0|1,1,0]=4 5001 B16R2.124 Nc1nc(ccc1O)Sc2ccccc2 62a_100000685527_100000041952 [0,2,0,0,0,0|1,1,0]=4 5002 B16R2.124 Nc1nc(ccc1O)Sc2ccccc2 62a_100000719477_100000685527 [0,2,0,0,0,0|1,1,0]=4 5003 B16R2.124 Nc1ncc(cc1Br)Sc2ccccc2 62a_100000719477_100012353989 [0,2,0,0,0,0|1,1,0]=4 5004 B16R2.124 Nc1ncc(cc1Br)Sc2ccccc2 62a_100012353989_100000041952 [0,2,0,0,0,0|1,1,0]=4 5005 B16R2.124 Nc1ncc(cc1Cl)Sc2ccccc2 62a_100000719477_100012356299 [0,2,0,0,0,0|1,1,0]=4 5006 B16R2.124 Nc1ncc(cc1Cl)Sc2ccccc2 62a_100012356299_100000041952 [0,2,0,0,0,0|1,1,0]=4 5007 B16R2.124 Nc1ncc(cc1F)Sc2ccccc2 62a_100000693161_100000041952 [0,2,0,0,0,0|1,1,0]=4 5008 B16R2.124 Nc1ncc(cc1F)Sc2ccccc2 62a_100000719477_100000693161 [0,2,0,0,0,0|1,1,0]=4 5009 B16R2.124 Nc1ncc(cc1O)Sc2ccccc2 62a_100000719477_100009819042 [0,2,0,0,0,0|1,1,0]=4 5010 B16R2.124 Nc1ncc(cc1O)Sc2ccccc2 62a_100009819042_100000041952 [0,2,0,0,0,0|1,1,0]=4 5011 B16R2.124 O=c1[nH]cc(cc1Br)Sc2ccccc2 62a_100000719477_100010125443 [0,2,0,0,0,0|1,1,0]=4 5012 B16R2.124 O=c1[nH]cc(cc1Br)Sc2ccccc2 62a_100010125443_100000041952 [0,2,0,0,0,0|1,1,0]=4 5013 B16R2.124 O=c1[nH]cc(cc1F)Sc2ccccc2 62a_100000719477_100000723523 [0,2,0,0,0,0|1,1,0]=4 5014 B16R2.124 O=c1[nH]cc(cc1F)Sc2ccccc2 62a_100000723523_100000041952 [0,2,0,0,0,0|1,1,0]=4 5015 B16R2.124 O=c1[nH]cc(cc1O)Sc2ccccc2 62a_100000719477_100009814561 [0,2,0,0,0,0|1,1,0]=4 5016 B16R2.124 Oc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100012356990 [0,2,0,0,0,0|0,1,0]=3 5017 B16R2.124 Oc1cc(ccc1Br)Sc2ccccc2 62a_100012356990_100000041952 [0,2,0,0,0,0|0,1,0]=3 5018 B16R2.124 Oc1cc(ccc1Br)Sc2ccccn2 62a_100011216584_100012356990 [0,2,0,0,0,0|1,1,0]=4 5019 B16R2.124 Oc1cc(ccc1Br)Sc2ccccn2 62a_100012356990_100011216584 [0,2,0,0,0,0|1,1,0]=4 5020 B16R2.124 Oc1cc(ccc1Br)Sc2cccnc2 62a_100000210063_100012356990 [0,2,0,0,0,0|1,1,0]=4 5021 B16R2.124 Oc1cc(ccc1Br)Sc2cccnc2 62a_100012356990_100000210063 [0,2,0,0,0,0|1,1,0]=4 5022 B16R2.124 Oc1cc(ccc1Br)Sc2ccncc2 62a_100000728582_100012356990 [0,2,0,0,0,0|1,1,0]=4 5023 B16R2.124 Oc1cc(ccc1Br)Sc2ccncc2 62a_100012356990_100000728582 [0,2,0,0,0,0|1,1,0]=4 5024 B16R2.124 Oc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_100011356854 [0,2,0,0,0,0|0,1,0]=3 5025 B16R2.124 Oc1cc(ccc1Cl)Sc2ccccc2 62a_100011356854_100000041952 [0,2,0,0,0,0|0,1,0]=3 5026 B16R2.124 Oc1cc(ccc1Cl)Sc2ccccn2 62a_100011216584_100011356854 [0,2,0,0,0,0|1,1,0]=4 5027 B16R2.124 Oc1cc(ccc1Cl)Sc2ccccn2 62a_100011356854_100011216584 [0,2,0,0,0,0|1,1,0]=4 5028 B16R2.124 Oc1cc(ccc1Cl)Sc2cccnc2 62a_100000210063_100011356854 [0,2,0,0,0,0|1,1,0]=4 5029 B16R2.124 Oc1cc(ccc1Cl)Sc2cccnc2 62a_100011356854_100000210063 [0,2,0,0,0,0|1,1,0]=4 5030 B16R2.124 Oc1cc(ccc1Cl)Sc2ccncc2 62a_100000728582_100011356854 [0,2,0,0,0,0|1,1,0]=4 5031 B16R2.124 Oc1cc(ccc1Cl)Sc2ccncc2 62a_100011356854_100000728582 [0,2,0,0,0,0|1,1,0]=4 5032 B16R2.124 Oc1cc(ccc1F)Sc2ccccc2 62a_100000686035_100000041952 [0,2,0,0,0,0|0,1,0]=3 5033 B16R2.124 Oc1cc(ccc1F)Sc2ccccc2 62a_100000719477_100000686035 [0,2,0,0,0,0|0,1,0]=3 5034 B16R2.124 Oc1cc(ccc1F)Sc2ccccn2 62a_100000686035_100011216584 [0,2,0,0,0,0|1,1,0]=4 5035 B16R2.124 Oc1cc(ccc1F)Sc2ccccn2 62a_100011216584_100000686035 [0,2,0,0,0,0|1,1,0]=4 5036 B16R2.124 Oc1cc(ccc1F)Sc2cccnc2 62a_100000210063_100000686035 [0,2,0,0,0,0|1,1,0]=4 5037 B16R2.124 Oc1cc(ccc1F)Sc2cccnc2 62a_100000686035_100000210063 [0,2,0,0,0,0|1,1,0]=4 5038 B16R2.124 Oc1cc(ccc1F)Sc2ccncc2 62a_100000686035_100000728582 [0,2,0,0,0,0|1,1,0]=4 5039 B16R2.124 Oc1cc(ccc1F)Sc2ccncc2 62a_100000728582_100000686035 [0,2,0,0,0,0|1,1,0]=4 5040 B16R2.124 Oc1cc(cnc1F)Sc2ccccc2 62a_100000719477_100009819871 [0,2,0,0,0,0|1,1,0]=4 5041 B16R2.124 Oc1cc(cnc1F)Sc2ccccc2 62a_100009819871_100000041952 [0,2,0,0,0,0|1,1,0]=4 5042 B16R2.124 Oc1cc(ncc1F)Sc2ccccc2 62a_100000719477_100009854642 [0,2,0,0,0,0|1,1,0]=4 5043 B16R2.124 Oc1cc(ncc1F)Sc2ccccc2 62a_100009854642_100000041952 [0,2,0,0,0,0|1,1,0]=4 5044 B16R2.124 Oc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100012361655 [0,2,0,0,0,0|0,1,0]=3 5045 B16R2.124 Oc1ccc(cc1Br)Sc2ccccc2 62a_100012361655_100000041952 [0,2,0,0,0,0|0,1,0]=3 5046 B16R2.124 Oc1ccc(cc1Br)Sc2ccccn2 62a_100011216584_100012361655 [0,2,0,0,0,0|1,1,0]=4 5047 B16R2.124 Oc1ccc(cc1Br)Sc2ccccn2 62a_100012361655_100011216584 [0,2,0,0,0,0|1,1,0]=4 5048 B16R2.124 Oc1ccc(cc1Br)Sc2cccnc2 62a_100000210063_100012361655 [0,2,0,0,0,0|1,1,0]=4 5049 B16R2.124 Oc1ccc(cc1Br)Sc2cccnc2 62a_100012361655_100000210063 [0,2,0,0,0,0|1,1,0]=4 5050 B16R2.124 Oc1ccc(cc1Br)Sc2ccncc2 62a_100000728582_100012361655 [0,2,0,0,0,0|1,1,0]=4 5051 B16R2.124 Oc1ccc(cc1Br)Sc2ccncc2 62a_100012361655_100000728582 [0,2,0,0,0,0|1,1,0]=4 5052 B16R2.124 Oc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100012360047 [0,2,0,0,0,0|0,1,0]=3 5053 B16R2.124 Oc1ccc(cc1Cl)Sc2ccccc2 62a_100012360047_100000041952 [0,2,0,0,0,0|0,1,0]=3 5054 B16R2.124 Oc1ccc(cc1Cl)Sc2ccccn2 62a_100011216584_100012360047 [0,2,0,0,0,0|1,1,0]=4 5055 B16R2.124 Oc1ccc(cc1Cl)Sc2ccccn2 62a_100012360047_100011216584 [0,2,0,0,0,0|1,1,0]=4 5056 B16R2.124 Oc1ccc(cc1Cl)Sc2cccnc2 62a_100000210063_100012360047 [0,2,0,0,0,0|1,1,0]=4 5057 B16R2.124 Oc1ccc(cc1Cl)Sc2cccnc2 62a_100012360047_100000210063 [0,2,0,0,0,0|1,1,0]=4 5058 B16R2.124 Oc1ccc(cc1Cl)Sc2ccncc2 62a_100000728582_100012360047 [0,2,0,0,0,0|1,1,0]=4 5059 B16R2.124 Oc1ccc(cc1Cl)Sc2ccncc2 62a_100012360047_100000728582 [0,2,0,0,0,0|1,1,0]=4 5060 B16R2.124 Oc1ccc(cc1F)Sc2ccccc2 62a_100000185481_100000041952 [0,2,0,0,0,0|0,1,0]=3 5061 B16R2.124 Oc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100000185481 [0,2,0,0,0,0|0,1,0]=3 5062 B16R2.124 Oc1ccc(cc1F)Sc2ccccn2 62a_100000185481_100011216584 [0,2,0,0,0,0|1,1,0]=4 5063 B16R2.124 Oc1ccc(cc1F)Sc2ccccn2 62a_100011216584_100000185481 [0,2,0,0,0,0|1,1,0]=4 5064 B16R2.124 Oc1ccc(cc1F)Sc2cccnc2 62a_100000185481_100000210063 [0,2,0,0,0,0|1,1,0]=4 5065 B16R2.124 Oc1ccc(cc1F)Sc2cccnc2 62a_100000210063_100000185481 [0,2,0,0,0,0|1,1,0]=4 5066 B16R2.124 Oc1ccc(cc1F)Sc2ccncc2 62a_100000185481_100000728582 [0,2,0,0,0,0|1,1,0]=4 5067 B16R2.124 Oc1ccc(cc1F)Sc2ccncc2 62a_100000728582_100000185481 [0,2,0,0,0,0|1,1,0]=4 5068 B16R2.124 Oc1ccc(cc1O)Oc2ccccc2 271570a_203496583355_200010989656 [0,2,0,0,0,0|0,0,0]=2 5069 B16R2.124 Oc1ccc(cc1O)Sc2ccccc2 62a_100000719477_100009813601 [0,2,0,0,0,0|0,1,0]=3 5070 B16R2.124 Oc1ccc(cc1O)Sc2ccccn2 62a_100011216584_100009813601 [0,2,0,0,0,0|1,1,0]=4 5071 B16R2.124 Oc1ccc(cc1O)Sc2cccnc2 62a_100000210063_100009813601 [0,2,0,0,0,0|1,1,0]=4 5072 B16R2.124 Oc1ccc(cc1O)Sc2ccncc2 62a_100000728582_100009813601 [0,2,0,0,0,0|1,1,0]=4 5073 B16R2.124 Oc1ccc(nc1Br)Sc2ccccc2 62a_100000719477_100000725334 [0,2,0,0,0,0|1,1,0]=4 5074 B16R2.124 Oc1ccc(nc1Br)Sc2ccccc2 62a_100000725334_100000041952 [0,2,0,0,0,0|1,1,0]=4 5075 B16R2.124 Oc1ccc(nc1Cl)Sc2ccccc2 62a_100000719477_100000721234 [0,2,0,0,0,0|1,1,0]=4 5076 B16R2.124 Oc1ccc(nc1F)Sc2ccccc2 62a_100000719477_100009819667 [0,2,0,0,0,0|1,1,0]=4 5077 B16R2.124 Oc1ccc(nc1F)Sc2ccccc2 62a_100009819667_100000041952 [0,2,0,0,0,0|1,1,0]=4 5078 B16R2.124 Oc1nc(ccc1F)Sc2ccccc2 62a_100000719477_100010729010 [0,2,0,0,0,0|1,1,0]=4 5079 B16R2.124 Oc1ncc(cc1Cl)Sc2ccccc2 62a_100000719477_100010238531 [0,2,0,0,0,0|1,1,0]=4 5080 B16R2.124 Oc1ncc(cc1Cl)Sc2ccccc2 62a_100010238531_100000041952 [0,2,0,0,0,0|1,1,0]=4 5081 B16R2.131 Brc1ccc(cc1)Sc2cccc(c2)Br 62a_100000691529_100000752885 [0,2,0,0,0,0|0,1,0]=3 5082 B16R2.131 Brc1ccc(cc1)Sc2cccc(c2)Br 62a_100000752885_100000691529 [0,2,0,0,0,0|0,1,0]=3 5083 B16R2.131 Brc1ccc(cc1)Sc2cccc(n2)Br 62a_100000684672_100000752885 [0,2,0,0,0,0|1,1,0]=4 5084 B16R2.131 Brc1ccc(cc1)Sc2cccc(n2)Br 62a_100000752885_100000684672 [0,2,0,0,0,0|1,1,0]=4 5085 B16R2.131 Brc1ccc(cc1)Sc2ccnc(c2)Br 62a_100000752885_100009814637 [0,2,0,0,0,0|1,1,0]=4 5086 B16R2.131 Brc1ccc(cc1)Sc2ccnc(c2)Br 62a_100009814637_100000752885 [0,2,0,0,0,0|1,1,0]=4 5087 B16R2.131 Brc1ccc(cc1)Sc2cncc(c2)Br 62a_100000728054_100000752885 [0,2,0,0,0,0|1,1,0]=4 5088 B16R2.131 Brc1ccc(cc1)Sc2cncc(c2)Br 62a_100000752885_100000728054 [0,2,0,0,0,0|1,1,0]=4 5089 B16R2.131 Brc1ccc(nc1)Nc2cccc(c2)Br 27a_100000210019_100000686858 [0,2,0,0,0,0|2,0,0]=4 5090 B16R2.131 Brc1ccc(nc1)Nc2cccc(c2)I 27a_100000211102_100000686858 [0,2,0,0,0,0|2,0,0]=4 5091 B16R2.131 Brc1ccc(nc1)Sc2cccc(c2)Br 62a_100000686858_100000691529 [0,2,0,0,0,0|1,1,0]=4 5092 B16R2.131 Brc1ccc(nc1)Sc2cccc(c2)Br 62a_100000691529_100000686858 [0,2,0,0,0,0|1,1,0]=4 5093 B16R2.131 Brc1cccc(c1)Sc2ccc(nc2)Br 62a_100000691529_100009814638 [0,2,0,0,0,0|1,1,0]=4 5094 B16R2.131 Brc1cccc(c1)Sc2ccc(nc2)Br 62a_100009814638_100000691529 [0,2,0,0,0,0|1,1,0]=4 5095 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)Br 62a_100000752885_100009996589 [0,2,0,0,0,0|1,1,0]=4 5096 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)Br 62a_100009996589_100000752885 [0,2,0,0,0,0|1,1,0]=4 5097 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100009996589 [0,2,0,0,0,0|1,1,0]=4 5098 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)Cl 62a_100009996589_100000755918 [0,2,0,0,0,0|1,1,0]=4 5099 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)F 62a_100000211213_100009996589 [0,2,0,0,0,0|1,1,0]=4 5100 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)F 62a_100009996589_100000211213 [0,2,0,0,0,0|1,1,0]=4 5101 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)N 62a_100000185761_100009996589 [0,2,0,0,0,0|1,1,0]=4 5102 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)N 62a_100009996589_100000185761 [0,2,0,0,0,0|1,1,0]=4 5103 B16R2.131 C[n+]1cccc(c1)Sc2ccc(cc2)O 62a_100009996589_100000185759 [0,2,0,0,0,0|1,1,0]=4 5104 B16R2.131 Cc1cc(ccn1)Nc2ccc(cc2)Br 27a_100000210018_100000758586 [0,2,0,0,0,0|2,0,0]=4 5105 B16R2.131 Cc1cc(ccn1)Nc2ccc(cc2)Cl 27a_100000210052_100000758586 [0,2,0,0,0,0|2,0,0]=4 5106 B16R2.131 Cc1cc(ccn1)Nc2ccc(cc2)F 27a_100000185862_100000758586 [0,2,0,0,0,0|2,0,0]=4 5107 B16R2.131 Cc1cc(ccn1)Nc2ccc(cc2)I 27a_100000185761_100000758586 [0,2,0,0,0,0|2,0,0]=4 5108 B16R2.131 Cc1cc(ccn1)Nc2ccc(cc2)O 27a_100000185829_100000758586 [0,2,0,0,0,0|2,0,0]=4 5109 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)Br 62a_100000752885_100000758586 [0,2,0,0,0,0|1,1,0]=4 5110 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)Br 62a_100000758586_100000752885 [0,2,0,0,0,0|1,1,0]=4 5111 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)Cl 62a_100000755918_100000758586 [0,2,0,0,0,0|1,1,0]=4 5112 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)Cl 62a_100000758586_100000755918 [0,2,0,0,0,0|1,1,0]=4 5113 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)F 62a_100000211213_100000758586 [0,2,0,0,0,0|1,1,0]=4 5114 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)F 62a_100000758586_100000211213 [0,2,0,0,0,0|1,1,0]=4 5115 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)N 62a_100000185761_100000758586 [0,2,0,0,0,0|1,1,0]=4 5116 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)N 62a_100000758586_100000185761 [0,2,0,0,0,0|1,1,0]=4 5117 B16R2.131 Cc1cc(ccn1)Sc2ccc(cc2)O 62a_100000758586_100000185759 [0,2,0,0,0,0|1,1,0]=4 5118 B16R2.131 Cc1ccc(cc1)Nc2cc(ccn2)F 27a_100000124888_100000764206 [0,2,0,0,0,0|2,0,0]=4 5119 B16R2.131 Cc1ccc(cc1)Nc2cc[nH]c(=O)c2 27a_100000124888_100000061649 [0,2,0,0,0,0|2,0,0]=4 5120 B16R2.131 Cc1ccc(cc1)Nc2cccc(n2)F 27a_100000124888_100009815982 [0,2,0,0,0,0|2,0,0]=4 5121 B16R2.131 Cc1ccc(cc1)Nc2ccnc(c2)C 27a_100000124888_100000758586 [0,2,0,0,0,0|2,0,0]=4 5122 B16R2.131 Cc1ccc(cc1)Nc2ccnc(c2)F 27a_100000124888_100009816116 [0,2,0,0,0,0|2,0,0]=4 5123 B16R2.131 Cc1ccc(cc1)Sc2cc(=O)cc[nH]2 62a_100009817434_100000186775 [0,2,0,0,0,0|1,1,0]=4 5124 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)C 62a_100000186775_100000750283 [0,2,0,0,0,0|1,1,0]=4 5125 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)C 62a_100000750283_100000186775 [0,2,0,0,0,0|1,1,0]=4 5126 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100000186775_100010167805 [0,2,0,0,0,0|1,1,0]=4 5127 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100010167805_100000186775 [0,2,0,0,0,0|1,1,0]=4 5128 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)F 62a_100000186775_100000764206 [0,2,0,0,0,0|1,1,0]=4 5129 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)F 62a_100000764206_100000186775 [0,2,0,0,0,0|1,1,0]=4 5130 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)N 62a_100000186775_100009814236 [0,2,0,0,0,0|1,1,0]=4 5131 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)N 62a_100009814236_100000186775 [0,2,0,0,0,0|1,1,0]=4 5132 B16R2.131 Cc1ccc(cc1)Sc2cc(ccn2)O 62a_100000186775_100000762945 [0,2,0,0,0,0|1,1,0]=4 5133 B16R2.131 Cc1ccc(cc1)Sc2cc[nH]c(=O)c2 62a_100000186775_100009816521 [0,2,0,0,0,0|1,1,0]=4 5134 B16R2.131 Cc1ccc(cc1)Sc2cc[nH]c(=O)c2 62a_100009816521_100000186775 [0,2,0,0,0,0|1,1,0]=4 5135 B16R2.131 Cc1ccc(cc1)Sc2ccc[n+](c2)C 62a_100000186775_100009996589 [0,2,0,0,0,0|1,1,0]=4 5136 B16R2.131 Cc1ccc(cc1)Sc2ccc[n+](c2)C 62a_100009996589_100000186775 [0,2,0,0,0,0|1,1,0]=4 5137 B16R2.131 Cc1ccc(cc1)Sc2ccc[n+](c2)[O-] 62a_100000186775_100009815978 [0,2,0,0,0,0|1,1,0]=4 5138 B16R2.131 Cc1ccc(cc1)Sc2cccc(=O)[nH]2 62a_100000186775_100000752884 [0,2,0,0,0,0|1,1,0]=4 5139 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)Br 62a_100000186775_100000691529 [0,2,0,0,0,0|0,1,0]=3 5140 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)Br 62a_100000691529_100000186775 [0,2,0,0,0,0|0,1,0]=3 5141 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)C 62a_100000186775_100011215228 [0,2,0,0,0,0|0,1,0]=3 5142 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)C 62a_100011215228_100000186775 [0,2,0,0,0,0|0,1,0]=3 5143 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000186775_100000699651 [0,2,0,0,0,0|0,1,0]=3 5144 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000699651_100000186775 [0,2,0,0,0,0|0,1,0]=3 5145 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)F 62a_100000186775_100000685547 [0,2,0,0,0,0|0,1,0]=3 5146 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)F 62a_100000685547_100000186775 [0,2,0,0,0,0|0,1,0]=3 5147 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)N 62a_100000186775_100000210019 [0,2,0,0,0,0|0,1,0]=3 5148 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)N 62a_100000210019_100000186775 [0,2,0,0,0,0|0,1,0]=3 5149 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)O 62a_100000186775_100000211634 [0,2,0,0,0,0|0,1,0]=3 5150 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)[S] 62a_100000186775_114929384022 [0,2,0,0,0,0|0,1,0]=3 5151 B16R2.131 Cc1ccc(cc1)Sc2cccc(c2)[S] 62a_114929384022_100000186775 [0,2,0,0,0,0|0,1,0]=3 5152 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)Br 62a_100000186775_100000684672 [0,2,0,0,0,0|1,1,0]=4 5153 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)Br 62a_100000684672_100000186775 [0,2,0,0,0,0|1,1,0]=4 5154 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)C 62a_100000186775_100000742759 [0,2,0,0,0,0|1,1,0]=4 5155 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)C 62a_100000742759_100000186775 [0,2,0,0,0,0|1,1,0]=4 5156 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000051397_100000186775 [0,2,0,0,0,0|1,1,0]=4 5157 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000186775_100000051397 [0,2,0,0,0,0|1,1,0]=4 5158 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)F 62a_100000186775_100009815982 [0,2,0,0,0,0|1,1,0]=4 5159 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)F 62a_100009815982_100000186775 [0,2,0,0,0,0|1,1,0]=4 5160 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)N 62a_100000186775_100000740741 [0,2,0,0,0,0|1,1,0]=4 5161 B16R2.131 Cc1ccc(cc1)Sc2cccc(n2)N 62a_100000740741_100000186775 [0,2,0,0,0,0|1,1,0]=4 5162 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)Br 62a_100000186775_100009814637 [0,2,0,0,0,0|1,1,0]=4 5163 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)Br 62a_100009814637_100000186775 [0,2,0,0,0,0|1,1,0]=4 5164 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)C 62a_100000186775_100000758586 [0,2,0,0,0,0|1,1,0]=4 5165 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)C 62a_100000758586_100000186775 [0,2,0,0,0,0|1,1,0]=4 5166 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000035001_100000186775 [0,2,0,0,0,0|1,1,0]=4 5167 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000186775_100000035001 [0,2,0,0,0,0|1,1,0]=4 5168 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)F 62a_100000186775_100009816116 [0,2,0,0,0,0|1,1,0]=4 5169 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)F 62a_100009816116_100000186775 [0,2,0,0,0,0|1,1,0]=4 5170 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)N 62a_100000049665_100000186775 [0,2,0,0,0,0|1,1,0]=4 5171 B16R2.131 Cc1ccc(cc1)Sc2ccnc(c2)N 62a_100000186775_100000049665 [0,2,0,0,0,0|1,1,0]=4 5172 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)Br 62a_100000186775_100000728054 [0,2,0,0,0,0|1,1,0]=4 5173 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)Br 62a_100000728054_100000186775 [0,2,0,0,0,0|1,1,0]=4 5174 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)C 62a_100000186775_100000760492 [0,2,0,0,0,0|1,1,0]=4 5175 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)C 62a_100000760492_100000186775 [0,2,0,0,0,0|1,1,0]=4 5176 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000049639_100000186775 [0,2,0,0,0,0|1,1,0]=4 5177 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000186775_100000049639 [0,2,0,0,0,0|1,1,0]=4 5178 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)F 62a_100000186775_100000744099 [0,2,0,0,0,0|1,1,0]=4 5179 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)F 62a_100000744099_100000186775 [0,2,0,0,0,0|1,1,0]=4 5180 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)N 62a_100000186775_100000687067 [0,2,0,0,0,0|1,1,0]=4 5181 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)N 62a_100000687067_100000186775 [0,2,0,0,0,0|1,1,0]=4 5182 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)O 62a_100000186775_100000754920 [0,2,0,0,0,0|1,1,0]=4 5183 B16R2.131 Cc1ccc(cc1)Sc2cncc(c2)O 62a_100000754920_100000186775 [0,2,0,0,0,0|1,1,0]=4 5184 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)Br 62a_100000691529_100000751577 [0,2,0,0,0,0|1,1,0]=4 5185 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)Br 62a_100000751577_100000691529 [0,2,0,0,0,0|1,1,0]=4 5186 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)Cl 62a_100000699651_100000751577 [0,2,0,0,0,0|1,1,0]=4 5187 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)Cl 62a_100000751577_100000699651 [0,2,0,0,0,0|1,1,0]=4 5188 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)F 62a_100000685547_100000751577 [0,2,0,0,0,0|1,1,0]=4 5189 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)F 62a_100000751577_100000685547 [0,2,0,0,0,0|1,1,0]=4 5190 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)N 62a_100000210019_100000751577 [0,2,0,0,0,0|1,1,0]=4 5191 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)N 62a_100000751577_100000210019 [0,2,0,0,0,0|1,1,0]=4 5192 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)O 62a_100000751577_100000211634 [0,2,0,0,0,0|1,1,0]=4 5193 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)[S] 62a_100000751577_114929384022 [0,2,0,0,0,0|1,1,0]=4 5194 B16R2.131 Cc1ccc(cn1)Sc2cccc(c2)[S] 62a_114929384022_100000751577 [0,2,0,0,0,0|1,1,0]=4 5195 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)Br 62a_100000691529_100000754016 [0,2,0,0,0,0|1,1,0]=4 5196 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)Br 62a_100011192072_100000691529 [0,2,0,0,0,0|1,1,0]=4 5197 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)C 62a_100011192072_100011215228 [0,2,0,0,0,0|1,1,0]=4 5198 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)C 62a_100011215228_100000754016 [0,2,0,0,0,0|1,1,0]=4 5199 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)Cl 62a_100000699651_100000754016 [0,2,0,0,0,0|1,1,0]=4 5200 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)Cl 62a_100011192072_100000699651 [0,2,0,0,0,0|1,1,0]=4 5201 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)F 62a_100000685547_100000754016 [0,2,0,0,0,0|1,1,0]=4 5202 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)F 62a_100011192072_100000685547 [0,2,0,0,0,0|1,1,0]=4 5203 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)N 62a_100000210019_100000754016 [0,2,0,0,0,0|1,1,0]=4 5204 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)N 62a_100011192072_100000210019 [0,2,0,0,0,0|1,1,0]=4 5205 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)O 62a_100011192072_100000211634 [0,2,0,0,0,0|1,1,0]=4 5206 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)[S] 62a_100011192072_114929384022 [0,2,0,0,0,0|1,1,0]=4 5207 B16R2.131 Cc1ccc(nc1)Sc2cccc(c2)[S] 62a_114929384022_100000754016 [0,2,0,0,0,0|1,1,0]=4 5208 B16R2.131 Cc1cccc(c1)Nc2ccc(cn2)Br 27a_100000188690_100000686858 [0,2,0,0,0,0|2,0,0]=4 5209 B16R2.131 Cc1cccc(c1)Sc2cc[n+](cc2)[O-] 62a_100011215228_100000039755 [0,2,0,0,0,0|1,1,0]=4 5210 B16R2.131 Cc1cccc(c1)Sc2ccc(=O)[nH]c2 62a_100000212171_100011215228 [0,2,0,0,0,0|1,1,0]=4 5211 B16R2.131 Cc1cccc(c1)Sc2ccc(=O)[nH]c2 62a_100011215228_100000212171 [0,2,0,0,0,0|1,1,0]=4 5212 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)Br 62a_100000752885_100011215228 [0,2,0,0,0,0|0,1,0]=3 5213 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)Br 62a_100011215228_100000752885 [0,2,0,0,0,0|0,1,0]=3 5214 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100011215228 [0,2,0,0,0,0|0,1,0]=3 5215 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)Cl 62a_100011215228_100000755918 [0,2,0,0,0,0|0,1,0]=3 5216 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)F 62a_100000211213_100011215228 [0,2,0,0,0,0|0,1,0]=3 5217 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)F 62a_100011215228_100000211213 [0,2,0,0,0,0|0,1,0]=3 5218 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)N 62a_100000185761_100011215228 [0,2,0,0,0,0|0,1,0]=3 5219 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)N 62a_100011215228_100000185761 [0,2,0,0,0,0|0,1,0]=3 5220 B16R2.131 Cc1cccc(c1)Sc2ccc(cc2)O 62a_100011215228_100000185759 [0,2,0,0,0,0|0,1,0]=3 5221 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)Br 62a_100000686858_100011215228 [0,2,0,0,0,0|1,1,0]=4 5222 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)Br 62a_100011215228_100000686858 [0,2,0,0,0,0|1,1,0]=4 5223 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)Cl 62a_100011215228_100011356976 [0,2,0,0,0,0|1,1,0]=4 5224 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)Cl 62a_100011356976_100011215228 [0,2,0,0,0,0|1,1,0]=4 5225 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)F 62a_100000744514_100011215228 [0,2,0,0,0,0|1,1,0]=4 5226 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)F 62a_100011215228_100000744514 [0,2,0,0,0,0|1,1,0]=4 5227 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)N 62a_100000737798_100011215228 [0,2,0,0,0,0|1,1,0]=4 5228 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)N 62a_100011215228_100000737798 [0,2,0,0,0,0|1,1,0]=4 5229 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)O 62a_100000685995_100011215228 [0,2,0,0,0,0|1,1,0]=4 5230 B16R2.131 Cc1cccc(c1)Sc2ccc(cn2)O 62a_100011215228_100000744096 [0,2,0,0,0,0|1,1,0]=4 5231 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)Br 62a_100009814638_100011215228 [0,2,0,0,0,0|1,1,0]=4 5232 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)Br 62a_100011215228_100009814638 [0,2,0,0,0,0|1,1,0]=4 5233 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)C 62a_100000751577_100011215228 [0,2,0,0,0,0|1,1,0]=4 5234 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)C 62a_100011215228_100000751577 [0,2,0,0,0,0|1,1,0]=4 5235 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)Cl 62a_100000034144_100011215228 [0,2,0,0,0,0|1,1,0]=4 5236 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)Cl 62a_100011215228_100000034144 [0,2,0,0,0,0|1,1,0]=4 5237 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)F 62a_100000042367_100011215228 [0,2,0,0,0,0|1,1,0]=4 5238 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)F 62a_100011215228_100000042367 [0,2,0,0,0,0|1,1,0]=4 5239 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)N 62a_100000187370_100011215228 [0,2,0,0,0,0|1,1,0]=4 5240 B16R2.131 Cc1cccc(c1)Sc2ccc(nc2)N 62a_100011215228_100000187370 [0,2,0,0,0,0|1,1,0]=4 5241 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)Br 62a_100000742759_100000752885 [0,2,0,0,0,0|1,1,0]=4 5242 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)Br 62a_100000752885_100000742759 [0,2,0,0,0,0|1,1,0]=4 5243 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)Cl 62a_100000742759_100000755918 [0,2,0,0,0,0|1,1,0]=4 5244 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)Cl 62a_100000755918_100000742759 [0,2,0,0,0,0|1,1,0]=4 5245 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)F 62a_100000211213_100000742759 [0,2,0,0,0,0|1,1,0]=4 5246 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)F 62a_100000742759_100000211213 [0,2,0,0,0,0|1,1,0]=4 5247 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)N 62a_100000185761_100000742759 [0,2,0,0,0,0|1,1,0]=4 5248 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)N 62a_100000742759_100000185761 [0,2,0,0,0,0|1,1,0]=4 5249 B16R2.131 Cc1cccc(n1)Sc2ccc(cc2)O 62a_100000742759_100000185759 [0,2,0,0,0,0|1,1,0]=4 5250 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)Br 62a_100000750283_100000752885 [0,2,0,0,0,0|1,1,0]=4 5251 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000750283 [0,2,0,0,0,0|1,1,0]=4 5252 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)Cl 62a_100000750283_100000755918 [0,2,0,0,0,0|1,1,0]=4 5253 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000750283 [0,2,0,0,0,0|1,1,0]=4 5254 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)F 62a_100000211213_100000750283 [0,2,0,0,0,0|1,1,0]=4 5255 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)F 62a_100000750283_100000211213 [0,2,0,0,0,0|1,1,0]=4 5256 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)N 62a_100000185761_100000750283 [0,2,0,0,0,0|1,1,0]=4 5257 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)N 62a_100000750283_100000185761 [0,2,0,0,0,0|1,1,0]=4 5258 B16R2.131 Cc1ccnc(c1)Sc2ccc(cc2)O 62a_100000750283_100000185759 [0,2,0,0,0,0|1,1,0]=4 5259 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000760492 [0,2,0,0,0,0|1,1,0]=4 5260 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)Br 62a_100000760492_100000752885 [0,2,0,0,0,0|1,1,0]=4 5261 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000760492 [0,2,0,0,0,0|1,1,0]=4 5262 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)Cl 62a_100000760492_100000755918 [0,2,0,0,0,0|1,1,0]=4 5263 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)F 62a_100000211213_100000760492 [0,2,0,0,0,0|1,1,0]=4 5264 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)F 62a_100000760492_100000211213 [0,2,0,0,0,0|1,1,0]=4 5265 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)N 62a_100000185761_100000760492 [0,2,0,0,0,0|1,1,0]=4 5266 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)N 62a_100000760492_100000185761 [0,2,0,0,0,0|1,1,0]=4 5267 B16R2.131 Cc1cncc(c1)Sc2ccc(cc2)O 62a_100000760492_100000185759 [0,2,0,0,0,0|1,1,0]=4 5268 B16R2.131 Clc1cc(ccn1)Sc2ccc(cc2)Br 62a_100000035001_100000752885 [0,2,0,0,0,0|1,1,0]=4 5269 B16R2.131 Clc1cc(ccn1)Sc2ccc(cc2)Br 62a_100000752885_100000035001 [0,2,0,0,0,0|1,1,0]=4 5270 B16R2.131 Clc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100000755918_100010167805 [0,2,0,0,0,0|1,1,0]=4 5271 B16R2.131 Clc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100010167805_100000755918 [0,2,0,0,0,0|1,1,0]=4 5272 B16R2.131 Clc1ccc(cc1)Sc2cccc(c2)Br 62a_100000691529_100000755918 [0,2,0,0,0,0|0,1,0]=3 5273 B16R2.131 Clc1ccc(cc1)Sc2cccc(c2)Br 62a_100000755918_100000691529 [0,2,0,0,0,0|0,1,0]=3 5274 B16R2.131 Clc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000699651_100000755918 [0,2,0,0,0,0|0,1,0]=3 5275 B16R2.131 Clc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000755918_100000699651 [0,2,0,0,0,0|0,1,0]=3 5276 B16R2.131 Clc1ccc(cc1)Sc2cccc(n2)Br 62a_100000684672_100000755918 [0,2,0,0,0,0|1,1,0]=4 5277 B16R2.131 Clc1ccc(cc1)Sc2cccc(n2)Br 62a_100000755918_100000684672 [0,2,0,0,0,0|1,1,0]=4 5278 B16R2.131 Clc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000051397_100000755918 [0,2,0,0,0,0|1,1,0]=4 5279 B16R2.131 Clc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000755918_100000051397 [0,2,0,0,0,0|1,1,0]=4 5280 B16R2.131 Clc1ccc(cc1)Sc2ccnc(c2)Br 62a_100000755918_100009814637 [0,2,0,0,0,0|1,1,0]=4 5281 B16R2.131 Clc1ccc(cc1)Sc2ccnc(c2)Br 62a_100009814637_100000755918 [0,2,0,0,0,0|1,1,0]=4 5282 B16R2.131 Clc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000035001_100000755918 [0,2,0,0,0,0|1,1,0]=4 5283 B16R2.131 Clc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000755918_100000035001 [0,2,0,0,0,0|1,1,0]=4 5284 B16R2.131 Clc1ccc(cc1)Sc2cncc(c2)Br 62a_100000728054_100000755918 [0,2,0,0,0,0|1,1,0]=4 5285 B16R2.131 Clc1ccc(cc1)Sc2cncc(c2)Br 62a_100000755918_100000728054 [0,2,0,0,0,0|1,1,0]=4 5286 B16R2.131 Clc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000049639_100000755918 [0,2,0,0,0,0|1,1,0]=4 5287 B16R2.131 Clc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000755918_100000049639 [0,2,0,0,0,0|1,1,0]=4 5288 B16R2.131 Clc1ccc(cn1)Sc2cccc(c2)Br 62a_100000034144_100000691529 [0,2,0,0,0,0|1,1,0]=4 5289 B16R2.131 Clc1ccc(cn1)Sc2cccc(c2)Br 62a_100000691529_100000034144 [0,2,0,0,0,0|1,1,0]=4 5290 B16R2.131 Clc1ccc(nc1)Sc2cccc(c2)Br 62a_100000691529_100011356976 [0,2,0,0,0,0|1,1,0]=4 5291 B16R2.131 Clc1ccc(nc1)Sc2cccc(c2)Br 62a_100011356976_100000691529 [0,2,0,0,0,0|1,1,0]=4 5292 B16R2.131 Clc1ccc(nc1)Sc2cccc(c2)Cl 62a_100000699651_100011356976 [0,2,0,0,0,0|1,1,0]=4 5293 B16R2.131 Clc1ccc(nc1)Sc2cccc(c2)Cl 62a_100011356976_100000699651 [0,2,0,0,0,0|1,1,0]=4 5294 B16R2.131 Clc1cccc(c1)Nc2ccc(cn2)Br 27a_100000185859_100000686858 [0,2,0,0,0,0|2,0,0]=4 5295 B16R2.131 Clc1cccc(c1)Sc2ccc(cc2)Br 62a_100000699651_100000752885 [0,2,0,0,0,0|0,1,0]=3 5296 B16R2.131 Clc1cccc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000699651 [0,2,0,0,0,0|0,1,0]=3 5297 B16R2.131 Clc1cccc(c1)Sc2ccc(cn2)Br 62a_100000686858_100000699651 [0,2,0,0,0,0|1,1,0]=4 5298 B16R2.131 Clc1cccc(c1)Sc2ccc(cn2)Br 62a_100000699651_100000686858 [0,2,0,0,0,0|1,1,0]=4 5299 B16R2.131 Clc1cccc(c1)Sc2ccc(nc2)Br 62a_100000699651_100009814638 [0,2,0,0,0,0|1,1,0]=4 5300 B16R2.131 Clc1cccc(c1)Sc2ccc(nc2)Br 62a_100009814638_100000699651 [0,2,0,0,0,0|1,1,0]=4 5301 B16R2.131 Clc1cccc(c1)Sc2ccc(nc2)Cl 62a_100000034144_100000699651 [0,2,0,0,0,0|1,1,0]=4 5302 B16R2.131 Clc1cccc(c1)Sc2ccc(nc2)Cl 62a_100000699651_100000034144 [0,2,0,0,0,0|1,1,0]=4 5303 B16R2.131 Clc1cccc(n1)Sc2ccc(cc2)Br 62a_100000051397_100000752885 [0,2,0,0,0,0|1,1,0]=4 5304 B16R2.131 Clc1cccc(n1)Sc2ccc(cc2)Br 62a_100000752885_100000051397 [0,2,0,0,0,0|1,1,0]=4 5305 B16R2.131 Clc1ccnc(c1)Sc2ccc(cc2)Br 62a_100000752885_100010167805 [0,2,0,0,0,0|1,1,0]=4 5306 B16R2.131 Clc1ccnc(c1)Sc2ccc(cc2)Br 62a_100010167805_100000752885 [0,2,0,0,0,0|1,1,0]=4 5307 B16R2.131 Clc1cncc(c1)Sc2ccc(cc2)Br 62a_100000049639_100000752885 [0,2,0,0,0,0|1,1,0]=4 5308 B16R2.131 Clc1cncc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000049639 [0,2,0,0,0,0|1,1,0]=4 5309 B16R2.131 Fc1cc(ccn1)Nc2ccc(cc2)Br 27a_100000210018_100009816116 [0,2,0,0,0,0|2,0,0]=4 5310 B16R2.131 Fc1cc(ccn1)Nc2ccc(cc2)Cl 27a_100000210052_100009816116 [0,2,0,0,0,0|2,0,0]=4 5311 B16R2.131 Fc1cc(ccn1)Nc2ccc(cc2)I 27a_100000185761_100009816116 [0,2,0,0,0,0|2,0,0]=4 5312 B16R2.131 Fc1cc(ccn1)Sc2ccc(cc2)Br 62a_100000752885_100009816116 [0,2,0,0,0,0|1,1,0]=4 5313 B16R2.131 Fc1cc(ccn1)Sc2ccc(cc2)Br 62a_100009816116_100000752885 [0,2,0,0,0,0|1,1,0]=4 5314 B16R2.131 Fc1cc(ccn1)Sc2ccc(cc2)Cl 62a_100000755918_100009816116 [0,2,0,0,0,0|1,1,0]=4 5315 B16R2.131 Fc1cc(ccn1)Sc2ccc(cc2)Cl 62a_100009816116_100000755918 [0,2,0,0,0,0|1,1,0]=4 5316 B16R2.131 Fc1ccc(cc1)Nc2cc(ccn2)F 27a_100000185862_100000764206 [0,2,0,0,0,0|2,0,0]=4 5317 B16R2.131 Fc1ccc(cc1)Nc2cccc(n2)F 27a_100000185862_100009815982 [0,2,0,0,0,0|2,0,0]=4 5318 B16R2.131 Fc1ccc(cc1)Nc2ccnc(c2)F 27a_100000185862_100009816116 [0,2,0,0,0,0|2,0,0]=4 5319 B16R2.131 Fc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100000211213_100010167805 [0,2,0,0,0,0|1,1,0]=4 5320 B16R2.131 Fc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100010167805_100000211213 [0,2,0,0,0,0|1,1,0]=4 5321 B16R2.131 Fc1ccc(cc1)Sc2cc(ccn2)F 62a_100000211213_100000764206 [0,2,0,0,0,0|1,1,0]=4 5322 B16R2.131 Fc1ccc(cc1)Sc2cc(ccn2)F 62a_100000764206_100000211213 [0,2,0,0,0,0|1,1,0]=4 5323 B16R2.131 Fc1ccc(cc1)Sc2cccc(c2)Br 62a_100000211213_100000691529 [0,2,0,0,0,0|0,1,0]=3 5324 B16R2.131 Fc1ccc(cc1)Sc2cccc(c2)Br 62a_100000691529_100000211213 [0,2,0,0,0,0|0,1,0]=3 5325 B16R2.131 Fc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000211213_100000699651 [0,2,0,0,0,0|0,1,0]=3 5326 B16R2.131 Fc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000699651_100000211213 [0,2,0,0,0,0|0,1,0]=3 5327 B16R2.131 Fc1ccc(cc1)Sc2cccc(c2)F 62a_100000211213_100000685547 [0,2,0,0,0,0|0,1,0]=3 5328 B16R2.131 Fc1ccc(cc1)Sc2cccc(c2)F 62a_100000685547_100000211213 [0,2,0,0,0,0|0,1,0]=3 5329 B16R2.131 Fc1ccc(cc1)Sc2cccc(c2)[S] 62a_100000211213_114929384022 [0,2,0,0,0,0|0,1,0]=3 5330 B16R2.131 Fc1ccc(cc1)Sc2cccc(c2)[S] 62a_114929384022_100000211213 [0,2,0,0,0,0|0,1,0]=3 5331 B16R2.131 Fc1ccc(cc1)Sc2cccc(n2)Br 62a_100000211213_100000684672 [0,2,0,0,0,0|1,1,0]=4 5332 B16R2.131 Fc1ccc(cc1)Sc2cccc(n2)Br 62a_100000684672_100000211213 [0,2,0,0,0,0|1,1,0]=4 5333 B16R2.131 Fc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000051397_100000211213 [0,2,0,0,0,0|1,1,0]=4 5334 B16R2.131 Fc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000211213_100000051397 [0,2,0,0,0,0|1,1,0]=4 5335 B16R2.131 Fc1ccc(cc1)Sc2cccc(n2)F 62a_100000211213_100009815982 [0,2,0,0,0,0|1,1,0]=4 5336 B16R2.131 Fc1ccc(cc1)Sc2cccc(n2)F 62a_100009815982_100000211213 [0,2,0,0,0,0|1,1,0]=4 5337 B16R2.131 Fc1ccc(cc1)Sc2ccnc(c2)Br 62a_100000211213_100009814637 [0,2,0,0,0,0|1,1,0]=4 5338 B16R2.131 Fc1ccc(cc1)Sc2ccnc(c2)Br 62a_100009814637_100000211213 [0,2,0,0,0,0|1,1,0]=4 5339 B16R2.131 Fc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000035001_100000211213 [0,2,0,0,0,0|1,1,0]=4 5340 B16R2.131 Fc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000211213_100000035001 [0,2,0,0,0,0|1,1,0]=4 5341 B16R2.131 Fc1ccc(cc1)Sc2ccnc(c2)F 62a_100000211213_100009816116 [0,2,0,0,0,0|1,1,0]=4 5342 B16R2.131 Fc1ccc(cc1)Sc2ccnc(c2)F 62a_100009816116_100000211213 [0,2,0,0,0,0|1,1,0]=4 5343 B16R2.131 Fc1ccc(cc1)Sc2cncc(c2)Br 62a_100000211213_100000728054 [0,2,0,0,0,0|1,1,0]=4 5344 B16R2.131 Fc1ccc(cc1)Sc2cncc(c2)Br 62a_100000728054_100000211213 [0,2,0,0,0,0|1,1,0]=4 5345 B16R2.131 Fc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000049639_100000211213 [0,2,0,0,0,0|1,1,0]=4 5346 B16R2.131 Fc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000211213_100000049639 [0,2,0,0,0,0|1,1,0]=4 5347 B16R2.131 Fc1ccc(cc1)Sc2cncc(c2)F 62a_100000211213_100000744099 [0,2,0,0,0,0|1,1,0]=4 5348 B16R2.131 Fc1ccc(cc1)Sc2cncc(c2)F 62a_100000744099_100000211213 [0,2,0,0,0,0|1,1,0]=4 5349 B16R2.131 Fc1ccc(cn1)Sc2cccc(c2)Br 62a_100000042367_100000691529 [0,2,0,0,0,0|1,1,0]=4 5350 B16R2.131 Fc1ccc(cn1)Sc2cccc(c2)Br 62a_100000691529_100000042367 [0,2,0,0,0,0|1,1,0]=4 5351 B16R2.131 Fc1ccc(cn1)Sc2cccc(c2)Cl 62a_100000042367_100000699651 [0,2,0,0,0,0|1,1,0]=4 5352 B16R2.131 Fc1ccc(cn1)Sc2cccc(c2)Cl 62a_100000699651_100000042367 [0,2,0,0,0,0|1,1,0]=4 5353 B16R2.131 Fc1ccc(cn1)Sc2cccc(c2)[S] 62a_100000042367_114929384022 [0,2,0,0,0,0|1,1,0]=4 5354 B16R2.131 Fc1ccc(cn1)Sc2cccc(c2)[S] 62a_114929384022_100000042367 [0,2,0,0,0,0|1,1,0]=4 5355 B16R2.131 Fc1ccc(nc1)Sc2cccc(c2)Br 62a_100000691529_100000744514 [0,2,0,0,0,0|1,1,0]=4 5356 B16R2.131 Fc1ccc(nc1)Sc2cccc(c2)Br 62a_100000744514_100000691529 [0,2,0,0,0,0|1,1,0]=4 5357 B16R2.131 Fc1ccc(nc1)Sc2cccc(c2)Cl 62a_100000699651_100000744514 [0,2,0,0,0,0|1,1,0]=4 5358 B16R2.131 Fc1ccc(nc1)Sc2cccc(c2)Cl 62a_100000744514_100000699651 [0,2,0,0,0,0|1,1,0]=4 5359 B16R2.131 Fc1ccc(nc1)Sc2cccc(c2)F 62a_100000685547_100000744514 [0,2,0,0,0,0|1,1,0]=4 5360 B16R2.131 Fc1ccc(nc1)Sc2cccc(c2)F 62a_100000744514_100000685547 [0,2,0,0,0,0|1,1,0]=4 5361 B16R2.131 Fc1ccc(nc1)Sc2cccc(c2)[S] 62a_100000744514_114929384022 [0,2,0,0,0,0|1,1,0]=4 5362 B16R2.131 Fc1ccc(nc1)Sc2cccc(c2)[S] 62a_114929384022_100000744514 [0,2,0,0,0,0|1,1,0]=4 5363 B16R2.131 Fc1cccc(c1)Nc2ccc(cn2)Br 27a_100000210047_100000686858 [0,2,0,0,0,0|2,0,0]=4 5364 B16R2.131 Fc1cccc(c1)Sc2ccc(cc2)Br 62a_100000685547_100000752885 [0,2,0,0,0,0|0,1,0]=3 5365 B16R2.131 Fc1cccc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000685547 [0,2,0,0,0,0|0,1,0]=3 5366 B16R2.131 Fc1cccc(c1)Sc2ccc(cc2)Cl 62a_100000685547_100000755918 [0,2,0,0,0,0|0,1,0]=3 5367 B16R2.131 Fc1cccc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000685547 [0,2,0,0,0,0|0,1,0]=3 5368 B16R2.131 Fc1cccc(c1)Sc2ccc(cn2)Br 62a_100000685547_100000686858 [0,2,0,0,0,0|1,1,0]=4 5369 B16R2.131 Fc1cccc(c1)Sc2ccc(cn2)Br 62a_100000686858_100000685547 [0,2,0,0,0,0|1,1,0]=4 5370 B16R2.131 Fc1cccc(c1)Sc2ccc(cn2)Cl 62a_100000685547_100011356976 [0,2,0,0,0,0|1,1,0]=4 5371 B16R2.131 Fc1cccc(c1)Sc2ccc(cn2)Cl 62a_100011356976_100000685547 [0,2,0,0,0,0|1,1,0]=4 5372 B16R2.131 Fc1cccc(c1)Sc2ccc(nc2)Br 62a_100000685547_100009814638 [0,2,0,0,0,0|1,1,0]=4 5373 B16R2.131 Fc1cccc(c1)Sc2ccc(nc2)Br 62a_100009814638_100000685547 [0,2,0,0,0,0|1,1,0]=4 5374 B16R2.131 Fc1cccc(c1)Sc2ccc(nc2)Cl 62a_100000034144_100000685547 [0,2,0,0,0,0|1,1,0]=4 5375 B16R2.131 Fc1cccc(c1)Sc2ccc(nc2)Cl 62a_100000685547_100000034144 [0,2,0,0,0,0|1,1,0]=4 5376 B16R2.131 Fc1cccc(c1)Sc2ccc(nc2)F 62a_100000042367_100000685547 [0,2,0,0,0,0|1,1,0]=4 5377 B16R2.131 Fc1cccc(c1)Sc2ccc(nc2)F 62a_100000685547_100000042367 [0,2,0,0,0,0|1,1,0]=4 5378 B16R2.131 Fc1cccc(n1)Nc2ccc(cc2)Br 27a_100000210018_100009815982 [0,2,0,0,0,0|2,0,0]=4 5379 B16R2.131 Fc1cccc(n1)Nc2ccc(cc2)Cl 27a_100000210052_100009815982 [0,2,0,0,0,0|2,0,0]=4 5380 B16R2.131 Fc1cccc(n1)Nc2ccc(cc2)I 27a_100000185761_100009815982 [0,2,0,0,0,0|2,0,0]=4 5381 B16R2.131 Fc1cccc(n1)Sc2ccc(cc2)Br 62a_100000752885_100009815982 [0,2,0,0,0,0|1,1,0]=4 5382 B16R2.131 Fc1cccc(n1)Sc2ccc(cc2)Br 62a_100009815982_100000752885 [0,2,0,0,0,0|1,1,0]=4 5383 B16R2.131 Fc1cccc(n1)Sc2ccc(cc2)Cl 62a_100000755918_100009815982 [0,2,0,0,0,0|1,1,0]=4 5384 B16R2.131 Fc1cccc(n1)Sc2ccc(cc2)Cl 62a_100009815982_100000755918 [0,2,0,0,0,0|1,1,0]=4 5385 B16R2.131 Fc1ccnc(c1)Nc2ccc(cc2)Br 27a_100000210018_100000764206 [0,2,0,0,0,0|2,0,0]=4 5386 B16R2.131 Fc1ccnc(c1)Nc2ccc(cc2)Cl 27a_100000210052_100000764206 [0,2,0,0,0,0|2,0,0]=4 5387 B16R2.131 Fc1ccnc(c1)Nc2ccc(cc2)I 27a_100000185761_100000764206 [0,2,0,0,0,0|2,0,0]=4 5388 B16R2.131 Fc1ccnc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000764206 [0,2,0,0,0,0|1,1,0]=4 5389 B16R2.131 Fc1ccnc(c1)Sc2ccc(cc2)Br 62a_100000764206_100000752885 [0,2,0,0,0,0|1,1,0]=4 5390 B16R2.131 Fc1ccnc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000764206 [0,2,0,0,0,0|1,1,0]=4 5391 B16R2.131 Fc1ccnc(c1)Sc2ccc(cc2)Cl 62a_100000764206_100000755918 [0,2,0,0,0,0|1,1,0]=4 5392 B16R2.131 Fc1cncc(c1)Sc2ccc(cc2)Br 62a_100000744099_100000752885 [0,2,0,0,0,0|1,1,0]=4 5393 B16R2.131 Fc1cncc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000744099 [0,2,0,0,0,0|1,1,0]=4 5394 B16R2.131 Fc1cncc(c1)Sc2ccc(cc2)Cl 62a_100000744099_100000755918 [0,2,0,0,0,0|1,1,0]=4 5395 B16R2.131 Fc1cncc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000744099 [0,2,0,0,0,0|1,1,0]=4 5396 B16R2.131 Nc1cc(ccn1)Sc2ccc(cc2)Br 62a_100000049665_100000752885 [0,2,0,0,0,0|1,1,0]=4 5397 B16R2.131 Nc1cc(ccn1)Sc2ccc(cc2)Br 62a_100000752885_100000049665 [0,2,0,0,0,0|1,1,0]=4 5398 B16R2.131 Nc1cc(ccn1)Sc2ccc(cc2)Cl 62a_100000049665_100000755918 [0,2,0,0,0,0|1,1,0]=4 5399 B16R2.131 Nc1cc(ccn1)Sc2ccc(cc2)Cl 62a_100000755918_100000049665 [0,2,0,0,0,0|1,1,0]=4 5400 B16R2.131 Nc1cc(ccn1)Sc2ccc(cc2)F 62a_100000049665_100000211213 [0,2,0,0,0,0|1,1,0]=4 5401 B16R2.131 Nc1cc(ccn1)Sc2ccc(cc2)F 62a_100000211213_100000049665 [0,2,0,0,0,0|1,1,0]=4 5402 B16R2.131 Nc1cc(ccn1)Sc2ccc(cc2)O 62a_100000049665_100000185759 [0,2,0,0,0,0|1,1,0]=4 5403 B16R2.131 Nc1ccc(cc1)Oc2ccnc(n2)O 271570a_203496583355_106744499882 [0,2,0,0,0,0|2,0,0]=4 5404 B16R2.131 Nc1ccc(cc1)Sc2cc(=O)cc[nH]2 62a_100009817434_100000185761 [0,2,0,0,0,0|1,1,0]=4 5405 B16R2.131 Nc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100000185761_100010167805 [0,2,0,0,0,0|1,1,0]=4 5406 B16R2.131 Nc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100010167805_100000185761 [0,2,0,0,0,0|1,1,0]=4 5407 B16R2.131 Nc1ccc(cc1)Sc2cc(ccn2)F 62a_100000185761_100000764206 [0,2,0,0,0,0|1,1,0]=4 5408 B16R2.131 Nc1ccc(cc1)Sc2cc(ccn2)F 62a_100000764206_100000185761 [0,2,0,0,0,0|1,1,0]=4 5409 B16R2.131 Nc1ccc(cc1)Sc2cc(ccn2)N 62a_100000185761_100009814236 [0,2,0,0,0,0|1,1,0]=4 5410 B16R2.131 Nc1ccc(cc1)Sc2cc(ccn2)N 62a_100009814236_100000185761 [0,2,0,0,0,0|1,1,0]=4 5411 B16R2.131 Nc1ccc(cc1)Sc2cc(ccn2)O 62a_100000185761_100000762945 [0,2,0,0,0,0|1,1,0]=4 5412 B16R2.131 Nc1ccc(cc1)Sc2cc[nH]c(=O)c2 62a_100000185761_100009816521 [0,2,0,0,0,0|1,1,0]=4 5413 B16R2.131 Nc1ccc(cc1)Sc2cc[nH]c(=O)c2 62a_100009816521_100000185761 [0,2,0,0,0,0|1,1,0]=4 5414 B16R2.131 Nc1ccc(cc1)Sc2ccc[n+](c2)[O-] 62a_100000185761_100009815978 [0,2,0,0,0,0|1,1,0]=4 5415 B16R2.131 Nc1ccc(cc1)Sc2cccc(=O)[nH]2 62a_100000185761_100000752884 [0,2,0,0,0,0|1,1,0]=4 5416 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)Br 62a_100000185761_100000691529 [0,2,0,0,0,0|0,1,0]=3 5417 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)Br 62a_100000691529_100000185761 [0,2,0,0,0,0|0,1,0]=3 5418 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000185761_100000699651 [0,2,0,0,0,0|0,1,0]=3 5419 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000699651_100000185761 [0,2,0,0,0,0|0,1,0]=3 5420 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)F 62a_100000185761_100000685547 [0,2,0,0,0,0|0,1,0]=3 5421 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)F 62a_100000685547_100000185761 [0,2,0,0,0,0|0,1,0]=3 5422 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)N 62a_100000185761_100000210019 [0,2,0,0,0,0|0,1,0]=3 5423 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)N 62a_100000210019_100000185761 [0,2,0,0,0,0|0,1,0]=3 5424 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)O 62a_100000185761_100000211634 [0,2,0,0,0,0|0,1,0]=3 5425 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)[S] 62a_100000185761_114929384022 [0,2,0,0,0,0|0,1,0]=3 5426 B16R2.131 Nc1ccc(cc1)Sc2cccc(c2)[S] 62a_114929384022_100000185761 [0,2,0,0,0,0|0,1,0]=3 5427 B16R2.131 Nc1ccc(cc1)Sc2cccc(n2)Br 62a_100000185761_100000684672 [0,2,0,0,0,0|1,1,0]=4 5428 B16R2.131 Nc1ccc(cc1)Sc2cccc(n2)Br 62a_100000684672_100000185761 [0,2,0,0,0,0|1,1,0]=4 5429 B16R2.131 Nc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000051397_100000185761 [0,2,0,0,0,0|1,1,0]=4 5430 B16R2.131 Nc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000185761_100000051397 [0,2,0,0,0,0|1,1,0]=4 5431 B16R2.131 Nc1ccc(cc1)Sc2cccc(n2)F 62a_100000185761_100009815982 [0,2,0,0,0,0|1,1,0]=4 5432 B16R2.131 Nc1ccc(cc1)Sc2cccc(n2)F 62a_100009815982_100000185761 [0,2,0,0,0,0|1,1,0]=4 5433 B16R2.131 Nc1ccc(cc1)Sc2cccc(n2)N 62a_100000185761_100000740741 [0,2,0,0,0,0|1,1,0]=4 5434 B16R2.131 Nc1ccc(cc1)Sc2cccc(n2)N 62a_100000740741_100000185761 [0,2,0,0,0,0|1,1,0]=4 5435 B16R2.131 Nc1ccc(cc1)Sc2ccnc(c2)Br 62a_100000185761_100009814637 [0,2,0,0,0,0|1,1,0]=4 5436 B16R2.131 Nc1ccc(cc1)Sc2ccnc(c2)Br 62a_100009814637_100000185761 [0,2,0,0,0,0|1,1,0]=4 5437 B16R2.131 Nc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000035001_100000185761 [0,2,0,0,0,0|1,1,0]=4 5438 B16R2.131 Nc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000185761_100000035001 [0,2,0,0,0,0|1,1,0]=4 5439 B16R2.131 Nc1ccc(cc1)Sc2ccnc(c2)F 62a_100000185761_100009816116 [0,2,0,0,0,0|1,1,0]=4 5440 B16R2.131 Nc1ccc(cc1)Sc2ccnc(c2)F 62a_100009816116_100000185761 [0,2,0,0,0,0|1,1,0]=4 5441 B16R2.131 Nc1ccc(cc1)Sc2ccnc(c2)N 62a_100000049665_100000185761 [0,2,0,0,0,0|1,1,0]=4 5442 B16R2.131 Nc1ccc(cc1)Sc2ccnc(c2)N 62a_100000185761_100000049665 [0,2,0,0,0,0|1,1,0]=4 5443 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)Br 62a_100000185761_100000728054 [0,2,0,0,0,0|1,1,0]=4 5444 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)Br 62a_100000728054_100000185761 [0,2,0,0,0,0|1,1,0]=4 5445 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000049639_100000185761 [0,2,0,0,0,0|1,1,0]=4 5446 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000185761_100000049639 [0,2,0,0,0,0|1,1,0]=4 5447 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)F 62a_100000185761_100000744099 [0,2,0,0,0,0|1,1,0]=4 5448 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)F 62a_100000744099_100000185761 [0,2,0,0,0,0|1,1,0]=4 5449 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)N 62a_100000185761_100000687067 [0,2,0,0,0,0|1,1,0]=4 5450 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)N 62a_100000687067_100000185761 [0,2,0,0,0,0|1,1,0]=4 5451 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)O 62a_100000185761_100000754920 [0,2,0,0,0,0|1,1,0]=4 5452 B16R2.131 Nc1ccc(cc1)Sc2cncc(c2)O 62a_100000754920_100000185761 [0,2,0,0,0,0|1,1,0]=4 5453 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)Br 62a_100000187370_100000691529 [0,2,0,0,0,0|1,1,0]=4 5454 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)Br 62a_100000691529_100000187370 [0,2,0,0,0,0|1,1,0]=4 5455 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)Cl 62a_100000187370_100000699651 [0,2,0,0,0,0|1,1,0]=4 5456 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)Cl 62a_100000699651_100000187370 [0,2,0,0,0,0|1,1,0]=4 5457 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)F 62a_100000187370_100000685547 [0,2,0,0,0,0|1,1,0]=4 5458 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)F 62a_100000685547_100000187370 [0,2,0,0,0,0|1,1,0]=4 5459 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)O 62a_100000187370_100000211634 [0,2,0,0,0,0|1,1,0]=4 5460 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)[S] 62a_100000187370_114929384022 [0,2,0,0,0,0|1,1,0]=4 5461 B16R2.131 Nc1ccc(cn1)Sc2cccc(c2)[S] 62a_114929384022_100000187370 [0,2,0,0,0,0|1,1,0]=4 5462 B16R2.131 Nc1ccc(nc1)Oc2cccc(c2)O 271570a_203496583355_100000748485 [0,2,0,0,0,0|1,0,0]=3 5463 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)Br 62a_100000691529_100000737798 [0,2,0,0,0,0|1,1,0]=4 5464 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)Br 62a_100000737798_100000691529 [0,2,0,0,0,0|1,1,0]=4 5465 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)Cl 62a_100000699651_100000737798 [0,2,0,0,0,0|1,1,0]=4 5466 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)Cl 62a_100000737798_100000699651 [0,2,0,0,0,0|1,1,0]=4 5467 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)F 62a_100000685547_100000737798 [0,2,0,0,0,0|1,1,0]=4 5468 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)F 62a_100000737798_100000685547 [0,2,0,0,0,0|1,1,0]=4 5469 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)N 62a_100000210019_100000737798 [0,2,0,0,0,0|1,1,0]=4 5470 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)N 62a_100000737798_100000210019 [0,2,0,0,0,0|1,1,0]=4 5471 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)O 62a_100000737798_100000211634 [0,2,0,0,0,0|1,1,0]=4 5472 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)[S] 62a_100000737798_114929384022 [0,2,0,0,0,0|1,1,0]=4 5473 B16R2.131 Nc1ccc(nc1)Sc2cccc(c2)[S] 62a_114929384022_100000737798 [0,2,0,0,0,0|1,1,0]=4 5474 B16R2.131 Nc1cccc(c1)Oc2ncc(cn2)O 271570a_203496583355_100000690465 [0,2,0,0,0,0|2,0,0]=4 5475 B16R2.131 Nc1cccc(c1)Sc2cc[n+](cc2)[O-] 62a_100000210019_100000039755 [0,2,0,0,0,0|1,1,0]=4 5476 B16R2.131 Nc1cccc(c1)Sc2ccc(=O)[nH]c2 62a_100000210019_100000212171 [0,2,0,0,0,0|1,1,0]=4 5477 B16R2.131 Nc1cccc(c1)Sc2ccc(=O)[nH]c2 62a_100000212171_100000210019 [0,2,0,0,0,0|1,1,0]=4 5478 B16R2.131 Nc1cccc(c1)Sc2ccc(cc2)Br 62a_100000210019_100000752885 [0,2,0,0,0,0|0,1,0]=3 5479 B16R2.131 Nc1cccc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000210019 [0,2,0,0,0,0|0,1,0]=3 5480 B16R2.131 Nc1cccc(c1)Sc2ccc(cc2)Cl 62a_100000210019_100000755918 [0,2,0,0,0,0|0,1,0]=3 5481 B16R2.131 Nc1cccc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000210019 [0,2,0,0,0,0|0,1,0]=3 5482 B16R2.131 Nc1cccc(c1)Sc2ccc(cc2)F 62a_100000210019_100000211213 [0,2,0,0,0,0|0,1,0]=3 5483 B16R2.131 Nc1cccc(c1)Sc2ccc(cc2)F 62a_100000211213_100000210019 [0,2,0,0,0,0|0,1,0]=3 5484 B16R2.131 Nc1cccc(c1)Sc2ccc(cc2)O 62a_100000210019_100000185759 [0,2,0,0,0,0|0,1,0]=3 5485 B16R2.131 Nc1cccc(c1)Sc2ccc(cn2)Br 62a_100000210019_100000686858 [0,2,0,0,0,0|1,1,0]=4 5486 B16R2.131 Nc1cccc(c1)Sc2ccc(cn2)Br 62a_100000686858_100000210019 [0,2,0,0,0,0|1,1,0]=4 5487 B16R2.131 Nc1cccc(c1)Sc2ccc(cn2)Cl 62a_100000210019_100011356976 [0,2,0,0,0,0|1,1,0]=4 5488 B16R2.131 Nc1cccc(c1)Sc2ccc(cn2)Cl 62a_100011356976_100000210019 [0,2,0,0,0,0|1,1,0]=4 5489 B16R2.131 Nc1cccc(c1)Sc2ccc(cn2)F 62a_100000210019_100000744514 [0,2,0,0,0,0|1,1,0]=4 5490 B16R2.131 Nc1cccc(c1)Sc2ccc(cn2)F 62a_100000744514_100000210019 [0,2,0,0,0,0|1,1,0]=4 5491 B16R2.131 Nc1cccc(c1)Sc2ccc(cn2)O 62a_100000210019_100000744096 [0,2,0,0,0,0|1,1,0]=4 5492 B16R2.131 Nc1cccc(c1)Sc2ccc(cn2)O 62a_100000685995_100000210019 [0,2,0,0,0,0|1,1,0]=4 5493 B16R2.131 Nc1cccc(c1)Sc2ccc(nc2)Br 62a_100000210019_100009814638 [0,2,0,0,0,0|1,1,0]=4 5494 B16R2.131 Nc1cccc(c1)Sc2ccc(nc2)Br 62a_100009814638_100000210019 [0,2,0,0,0,0|1,1,0]=4 5495 B16R2.131 Nc1cccc(c1)Sc2ccc(nc2)Cl 62a_100000034144_100000210019 [0,2,0,0,0,0|1,1,0]=4 5496 B16R2.131 Nc1cccc(c1)Sc2ccc(nc2)Cl 62a_100000210019_100000034144 [0,2,0,0,0,0|1,1,0]=4 5497 B16R2.131 Nc1cccc(c1)Sc2ccc(nc2)F 62a_100000042367_100000210019 [0,2,0,0,0,0|1,1,0]=4 5498 B16R2.131 Nc1cccc(c1)Sc2ccc(nc2)F 62a_100000210019_100000042367 [0,2,0,0,0,0|1,1,0]=4 5499 B16R2.131 Nc1cccc(c1)Sc2ccc(nc2)N 62a_100000187370_100000210019 [0,2,0,0,0,0|1,1,0]=4 5500 B16R2.131 Nc1cccc(c1)Sc2ccc(nc2)N 62a_100000210019_100000187370 [0,2,0,0,0,0|1,1,0]=4 5501 B16R2.131 Nc1cccc(n1)Sc2ccc(cc2)Br 62a_100000740741_100000752885 [0,2,0,0,0,0|1,1,0]=4 5502 B16R2.131 Nc1cccc(n1)Sc2ccc(cc2)Br 62a_100000752885_100000740741 [0,2,0,0,0,0|1,1,0]=4 5503 B16R2.131 Nc1cccc(n1)Sc2ccc(cc2)Cl 62a_100000740741_100000755918 [0,2,0,0,0,0|1,1,0]=4 5504 B16R2.131 Nc1cccc(n1)Sc2ccc(cc2)Cl 62a_100000755918_100000740741 [0,2,0,0,0,0|1,1,0]=4 5505 B16R2.131 Nc1cccc(n1)Sc2ccc(cc2)F 62a_100000211213_100000740741 [0,2,0,0,0,0|1,1,0]=4 5506 B16R2.131 Nc1cccc(n1)Sc2ccc(cc2)F 62a_100000740741_100000211213 [0,2,0,0,0,0|1,1,0]=4 5507 B16R2.131 Nc1cccc(n1)Sc2ccc(cc2)O 62a_100000740741_100000185759 [0,2,0,0,0,0|1,1,0]=4 5508 B16R2.131 Nc1ccnc(c1)Sc2ccc(cc2)Br 62a_100000752885_100009814236 [0,2,0,0,0,0|1,1,0]=4 5509 B16R2.131 Nc1ccnc(c1)Sc2ccc(cc2)Br 62a_100009814236_100000752885 [0,2,0,0,0,0|1,1,0]=4 5510 B16R2.131 Nc1ccnc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100009814236 [0,2,0,0,0,0|1,1,0]=4 5511 B16R2.131 Nc1ccnc(c1)Sc2ccc(cc2)Cl 62a_100009814236_100000755918 [0,2,0,0,0,0|1,1,0]=4 5512 B16R2.131 Nc1ccnc(c1)Sc2ccc(cc2)F 62a_100000211213_100009814236 [0,2,0,0,0,0|1,1,0]=4 5513 B16R2.131 Nc1ccnc(c1)Sc2ccc(cc2)F 62a_100009814236_100000211213 [0,2,0,0,0,0|1,1,0]=4 5514 B16R2.131 Nc1ccnc(c1)Sc2ccc(cc2)O 62a_100009814236_100000185759 [0,2,0,0,0,0|1,1,0]=4 5515 B16R2.131 Nc1cncc(c1)Sc2ccc(cc2)Br 62a_100000687067_100000752885 [0,2,0,0,0,0|1,1,0]=4 5516 B16R2.131 Nc1cncc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000687067 [0,2,0,0,0,0|1,1,0]=4 5517 B16R2.131 Nc1cncc(c1)Sc2ccc(cc2)Cl 62a_100000687067_100000755918 [0,2,0,0,0,0|1,1,0]=4 5518 B16R2.131 Nc1cncc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000687067 [0,2,0,0,0,0|1,1,0]=4 5519 B16R2.131 Nc1cncc(c1)Sc2ccc(cc2)F 62a_100000211213_100000687067 [0,2,0,0,0,0|1,1,0]=4 5520 B16R2.131 Nc1cncc(c1)Sc2ccc(cc2)F 62a_100000687067_100000211213 [0,2,0,0,0,0|1,1,0]=4 5521 B16R2.131 Nc1cncc(c1)Sc2ccc(cc2)O 62a_100000687067_100000185759 [0,2,0,0,0,0|1,1,0]=4 5522 B16R2.131 O=c1cc(cc[nH]1)Nc2ccc(cc2)Br 27a_100000210018_100000061649 [0,2,0,0,0,0|2,0,0]=4 5523 B16R2.131 O=c1cc(cc[nH]1)Nc2ccc(cc2)Cl 27a_100000210052_100000061649 [0,2,0,0,0,0|2,0,0]=4 5524 B16R2.131 O=c1cc(cc[nH]1)Nc2ccc(cc2)F 27a_100000185862_100000061649 [0,2,0,0,0,0|2,0,0]=4 5525 B16R2.131 O=c1cc(cc[nH]1)Nc2ccc(cc2)I 27a_100000185761_100000061649 [0,2,0,0,0,0|2,0,0]=4 5526 B16R2.131 O=c1cc(cc[nH]1)Nc2ccc(cc2)O 27a_100000185829_100000061649 [0,2,0,0,0,0|2,0,0]=4 5527 B16R2.131 O=c1cc(cc[nH]1)Sc2ccc(cc2)Br 62a_100000752885_100009816521 [0,2,0,0,0,0|1,1,0]=4 5528 B16R2.131 O=c1cc(cc[nH]1)Sc2ccc(cc2)Br 62a_100009816521_100000752885 [0,2,0,0,0,0|1,1,0]=4 5529 B16R2.131 O=c1cc(cc[nH]1)Sc2ccc(cc2)Cl 62a_100000755918_100009816521 [0,2,0,0,0,0|1,1,0]=4 5530 B16R2.131 O=c1cc(cc[nH]1)Sc2ccc(cc2)Cl 62a_100009816521_100000755918 [0,2,0,0,0,0|1,1,0]=4 5531 B16R2.131 O=c1cc(cc[nH]1)Sc2ccc(cc2)F 62a_100000211213_100009816521 [0,2,0,0,0,0|1,1,0]=4 5532 B16R2.131 O=c1cc(cc[nH]1)Sc2ccc(cc2)F 62a_100009816521_100000211213 [0,2,0,0,0,0|1,1,0]=4 5533 B16R2.131 O=c1cc(cc[nH]1)Sc2ccc(cc2)O 62a_100009816521_100000185759 [0,2,0,0,0,0|1,1,0]=4 5534 B16R2.131 O=c1cc[nH]c(c1)Sc2ccc(cc2)Br 62a_100009817434_100000752885 [0,2,0,0,0,0|1,1,0]=4 5535 B16R2.131 O=c1cc[nH]c(c1)Sc2ccc(cc2)Cl 62a_100009817434_100000755918 [0,2,0,0,0,0|1,1,0]=4 5536 B16R2.131 O=c1cc[nH]c(c1)Sc2ccc(cc2)F 62a_100009817434_100000211213 [0,2,0,0,0,0|1,1,0]=4 5537 B16R2.131 O=c1cc[nH]c(c1)Sc2ccc(cc2)O 62a_100009817434_100000185759 [0,2,0,0,0,0|1,1,0]=4 5538 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)Br 62a_100000212171_100000691529 [0,2,0,0,0,0|1,1,0]=4 5539 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)Br 62a_100000691529_100000212171 [0,2,0,0,0,0|1,1,0]=4 5540 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)Cl 62a_100000212171_100000699651 [0,2,0,0,0,0|1,1,0]=4 5541 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)Cl 62a_100000699651_100000212171 [0,2,0,0,0,0|1,1,0]=4 5542 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)F 62a_100000212171_100000685547 [0,2,0,0,0,0|1,1,0]=4 5543 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)F 62a_100000685547_100000212171 [0,2,0,0,0,0|1,1,0]=4 5544 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)O 62a_100000212171_100000211634 [0,2,0,0,0,0|1,1,0]=4 5545 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)[S] 62a_100000212171_114929384022 [0,2,0,0,0,0|1,1,0]=4 5546 B16R2.131 O=c1ccc(c[nH]1)Sc2cccc(c2)[S] 62a_114929384022_100000212171 [0,2,0,0,0,0|1,1,0]=4 5547 B16R2.131 O=c1cccc([nH]1)Sc2ccc(cc2)Br 62a_100000752885_100000752884 [0,2,0,0,0,0|1,1,0]=4 5548 B16R2.131 O=c1cccc([nH]1)Sc2ccc(cc2)Cl 62a_100000755918_100000752884 [0,2,0,0,0,0|1,1,0]=4 5549 B16R2.131 O=c1cccc([nH]1)Sc2ccc(cc2)F 62a_100000211213_100000752884 [0,2,0,0,0,0|1,1,0]=4 5550 B16R2.131 Oc1ccc(cc1)Nc2cc(ccn2)F 27a_100000185829_100000764206 [0,2,0,0,0,0|2,0,0]=4 5551 B16R2.131 Oc1ccc(cc1)Nc2cccc(n2)F 27a_100000185829_100009815982 [0,2,0,0,0,0|2,0,0]=4 5552 B16R2.131 Oc1ccc(cc1)Nc2ccnc(c2)F 27a_100000185829_100009816116 [0,2,0,0,0,0|2,0,0]=4 5553 B16R2.131 Oc1ccc(cc1)Sc2cc(ccn2)Cl 62a_100010167805_100000185759 [0,2,0,0,0,0|1,1,0]=4 5554 B16R2.131 Oc1ccc(cc1)Sc2cc(ccn2)F 62a_100000764206_100000185759 [0,2,0,0,0,0|1,1,0]=4 5555 B16R2.131 Oc1ccc(cc1)Sc2cccc(c2)Br 62a_100000691529_100000185759 [0,2,0,0,0,0|0,1,0]=3 5556 B16R2.131 Oc1ccc(cc1)Sc2cccc(c2)Cl 62a_100000699651_100000185759 [0,2,0,0,0,0|0,1,0]=3 5557 B16R2.131 Oc1ccc(cc1)Sc2cccc(c2)F 62a_100000685547_100000185759 [0,2,0,0,0,0|0,1,0]=3 5558 B16R2.131 Oc1ccc(cc1)Sc2cccc(c2)[S] 62a_114929384022_100000185759 [0,2,0,0,0,0|0,1,0]=3 5559 B16R2.131 Oc1ccc(cc1)Sc2cccc(n2)Br 62a_100000684672_100000185759 [0,2,0,0,0,0|1,1,0]=4 5560 B16R2.131 Oc1ccc(cc1)Sc2cccc(n2)Cl 62a_100000051397_100000185759 [0,2,0,0,0,0|1,1,0]=4 5561 B16R2.131 Oc1ccc(cc1)Sc2cccc(n2)F 62a_100009815982_100000185759 [0,2,0,0,0,0|1,1,0]=4 5562 B16R2.131 Oc1ccc(cc1)Sc2ccnc(c2)Br 62a_100009814637_100000185759 [0,2,0,0,0,0|1,1,0]=4 5563 B16R2.131 Oc1ccc(cc1)Sc2ccnc(c2)Cl 62a_100000035001_100000185759 [0,2,0,0,0,0|1,1,0]=4 5564 B16R2.131 Oc1ccc(cc1)Sc2ccnc(c2)F 62a_100009816116_100000185759 [0,2,0,0,0,0|1,1,0]=4 5565 B16R2.131 Oc1ccc(cc1)Sc2cncc(c2)Br 62a_100000728054_100000185759 [0,2,0,0,0,0|1,1,0]=4 5566 B16R2.131 Oc1ccc(cc1)Sc2cncc(c2)Cl 62a_100000049639_100000185759 [0,2,0,0,0,0|1,1,0]=4 5567 B16R2.131 Oc1ccc(cc1)Sc2cncc(c2)F 62a_100000744099_100000185759 [0,2,0,0,0,0|1,1,0]=4 5568 B16R2.131 Oc1ccc(cc1)Sc2cncc(c2)O 62a_100000754920_100000185759 [0,2,0,0,0,0|1,1,0]=4 5569 B16R2.131 Oc1ccc(nc1)Oc2cccc(c2)F 271570a_203496583355_200011465519 [0,2,0,0,0,0|1,0,0]=3 5570 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)Br 62a_100000685995_100000691529 [0,2,0,0,0,0|1,1,0]=4 5571 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)Br 62a_100000691529_100000744096 [0,2,0,0,0,0|1,1,0]=4 5572 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)Cl 62a_100000685995_100000699651 [0,2,0,0,0,0|1,1,0]=4 5573 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)Cl 62a_100000699651_100000744096 [0,2,0,0,0,0|1,1,0]=4 5574 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)F 62a_100000685547_100000744096 [0,2,0,0,0,0|1,1,0]=4 5575 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)F 62a_100000685995_100000685547 [0,2,0,0,0,0|1,1,0]=4 5576 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)O 62a_100000685995_100000211634 [0,2,0,0,0,0|1,1,0]=4 5577 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)[S] 62a_100000685995_114929384022 [0,2,0,0,0,0|1,1,0]=4 5578 B16R2.131 Oc1ccc(nc1)Sc2cccc(c2)[S] 62a_114929384022_100000744096 [0,2,0,0,0,0|1,1,0]=4 5579 B16R2.131 Oc1cccc(c1)Nc2ccc(cn2)Br 27a_100000210217_100000686858 [0,2,0,0,0,0|2,0,0]=4 5580 B16R2.131 Oc1cccc(c1)Oc2ccc(cc2)F 271570a_203496583355_200009814353 [0,2,0,0,0,0|0,0,0]=2 5581 B16R2.131 Oc1cccc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000211634 [0,2,0,0,0,0|0,1,0]=3 5582 B16R2.131 Oc1cccc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000211634 [0,2,0,0,0,0|0,1,0]=3 5583 B16R2.131 Oc1cccc(c1)Sc2ccc(cc2)F 62a_100000211213_100000211634 [0,2,0,0,0,0|0,1,0]=3 5584 B16R2.131 Oc1cccc(c1)Sc2ccc(cn2)Br 62a_100000686858_100000211634 [0,2,0,0,0,0|1,1,0]=4 5585 B16R2.131 Oc1cccc(c1)Sc2ccc(cn2)Cl 62a_100011356976_100000211634 [0,2,0,0,0,0|1,1,0]=4 5586 B16R2.131 Oc1cccc(c1)Sc2ccc(cn2)F 62a_100000744514_100000211634 [0,2,0,0,0,0|1,1,0]=4 5587 B16R2.131 Oc1cccc(c1)Sc2ccc(nc2)Br 62a_100009814638_100000211634 [0,2,0,0,0,0|1,1,0]=4 5588 B16R2.131 Oc1cccc(c1)Sc2ccc(nc2)Cl 62a_100000034144_100000211634 [0,2,0,0,0,0|1,1,0]=4 5589 B16R2.131 Oc1cccc(c1)Sc2ccc(nc2)F 62a_100000042367_100000211634 [0,2,0,0,0,0|1,1,0]=4 5590 B16R2.131 Oc1ccnc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000762945 [0,2,0,0,0,0|1,1,0]=4 5591 B16R2.131 Oc1ccnc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000762945 [0,2,0,0,0,0|1,1,0]=4 5592 B16R2.131 Oc1ccnc(c1)Sc2ccc(cc2)F 62a_100000211213_100000762945 [0,2,0,0,0,0|1,1,0]=4 5593 B16R2.131 Oc1cncc(c1)Sc2ccc(cc2)Br 62a_100000752885_100000754920 [0,2,0,0,0,0|1,1,0]=4 5594 B16R2.131 Oc1cncc(c1)Sc2ccc(cc2)Br 62a_100000754920_100000752885 [0,2,0,0,0,0|1,1,0]=4 5595 B16R2.131 Oc1cncc(c1)Sc2ccc(cc2)Cl 62a_100000754920_100000755918 [0,2,0,0,0,0|1,1,0]=4 5596 B16R2.131 Oc1cncc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100000754920 [0,2,0,0,0,0|1,1,0]=4 5597 B16R2.131 Oc1cncc(c1)Sc2ccc(cc2)F 62a_100000211213_100000754920 [0,2,0,0,0,0|1,1,0]=4 5598 B16R2.131 Oc1cncc(c1)Sc2ccc(cc2)F 62a_100000754920_100000211213 [0,2,0,0,0,0|1,1,0]=4 5599 B16R2.131 [O-][n+]1ccc(cc1)Sc2cccc(c2)Br 62a_100000691529_100000039755 [0,2,0,0,0,0|1,1,0]=4 5600 B16R2.131 [O-][n+]1ccc(cc1)Sc2cccc(c2)Cl 62a_100000699651_100000039755 [0,2,0,0,0,0|1,1,0]=4 5601 B16R2.131 [O-][n+]1ccc(cc1)Sc2cccc(c2)F 62a_100000685547_100000039755 [0,2,0,0,0,0|1,1,0]=4 5602 B16R2.131 [O-][n+]1ccc(cc1)Sc2cccc(c2)[S] 62a_114929384022_100000039755 [0,2,0,0,0,0|1,1,0]=4 5603 B16R2.131 [O-][n+]1cccc(c1)Sc2ccc(cc2)Br 62a_100000752885_100009815978 [0,2,0,0,0,0|1,1,0]=4 5604 B16R2.131 [O-][n+]1cccc(c1)Sc2ccc(cc2)Cl 62a_100000755918_100009815978 [0,2,0,0,0,0|1,1,0]=4 5605 B16R2.131 [O-][n+]1cccc(c1)Sc2ccc(cc2)F 62a_100000211213_100009815978 [0,2,0,0,0,0|1,1,0]=4 5606 B16R2.131 [S]c1cccc(c1)Sc2ccc(cc2)Br 62a_100000752885_114929384022 [0,2,0,0,0,0|0,1,0]=3 5607 B16R2.131 [S]c1cccc(c1)Sc2ccc(cc2)Br 62a_114929384022_100000752885 [0,2,0,0,0,0|0,1,0]=3 5608 B16R2.131 [S]c1cccc(c1)Sc2ccc(cc2)Cl 62a_100000755918_114929384022 [0,2,0,0,0,0|0,1,0]=3 5609 B16R2.131 [S]c1cccc(c1)Sc2ccc(cc2)Cl 62a_114929384022_100000755918 [0,2,0,0,0,0|0,1,0]=3 5610 B16R2.131 [S]c1cccc(c1)Sc2ccc(cn2)Br 62a_100000686858_114929384022 [0,2,0,0,0,0|1,1,0]=4 5611 B16R2.131 [S]c1cccc(c1)Sc2ccc(cn2)Br 62a_114929384022_100000686858 [0,2,0,0,0,0|1,1,0]=4 5612 B16R2.131 [S]c1cccc(c1)Sc2ccc(cn2)Cl 62a_100011356976_114929384022 [0,2,0,0,0,0|1,1,0]=4 5613 B16R2.131 [S]c1cccc(c1)Sc2ccc(cn2)Cl 62a_114929384022_100011356976 [0,2,0,0,0,0|1,1,0]=4 5614 B16R2.131 [S]c1cccc(c1)Sc2ccc(nc2)Br 62a_100009814638_114929384022 [0,2,0,0,0,0|1,1,0]=4 5615 B16R2.131 [S]c1cccc(c1)Sc2ccc(nc2)Br 62a_114929384022_100009814638 [0,2,0,0,0,0|1,1,0]=4 5616 B16R2.131 [S]c1cccc(c1)Sc2ccc(nc2)Cl 62a_100000034144_114929384022 [0,2,0,0,0,0|1,1,0]=4 5617 B16R2.131 [S]c1cccc(c1)Sc2ccc(nc2)Cl 62a_114929384022_100000034144 [0,2,0,0,0,0|1,1,0]=4 5618 B16R2.312 Brc1ccc(c(c1)Br)Sc2ccccc2 62a_100000719477_100011484698 [0,2,0,0,0,0|0,1,0]=3 5619 B16R2.312 Brc1ccc(c(c1)Br)Sc2ccccc2 62a_100011484698_100000041952 [0,2,0,0,0,0|0,1,0]=3 5620 B16R2.312 Brc1ccc(c(c1)Br)Sc2ccccn2 62a_100011216584_100011484698 [0,2,0,0,0,0|1,1,0]=4 5621 B16R2.312 Brc1ccc(c(c1)Br)Sc2ccccn2 62a_100011484698_100011216584 [0,2,0,0,0,0|1,1,0]=4 5622 B16R2.312 Brc1ccc(c(c1)Br)Sc2cccnc2 62a_100000210063_100011484698 [0,2,0,0,0,0|1,1,0]=4 5623 B16R2.312 Brc1ccc(c(c1)Br)Sc2cccnc2 62a_100011484698_100000210063 [0,2,0,0,0,0|1,1,0]=4 5624 B16R2.312 Brc1ccc(c(c1)Br)Sc2ccncc2 62a_100000728582_100011484698 [0,2,0,0,0,0|1,1,0]=4 5625 B16R2.312 Brc1ccc(c(c1)Br)Sc2ccncc2 62a_100011484698_100000728582 [0,2,0,0,0,0|1,1,0]=4 5626 B16R2.312 Cc1c[n+](ccc1Sc2ccccc2)[O-] 62a_100000719477_100000074940 [0,2,0,0,0,0|1,1,0]=4 5627 B16R2.312 Cc1cc(c(cn1)Sc2ccccc2)C 62a_100000719477_100009819613 [0,2,0,0,0,0|1,1,0]=4 5628 B16R2.312 Cc1cc(c(cn1)Sc2ccccc2)C 62a_100009819613_100000041952 [0,2,0,0,0,0|1,1,0]=4 5629 B16R2.312 Cc1cc(c(cn1)Sc2ccccc2)N 62a_100000719477_100009817891 [0,2,0,0,0,0|1,1,0]=4 5630 B16R2.312 Cc1cc(c(cn1)Sc2ccccc2)N 62a_100009817891_100000041952 [0,2,0,0,0,0|1,1,0]=4 5631 B16R2.312 Cc1cc(c(cn1)Sc2ccccc2)O 62a_100000719477_100011016184 [0,2,0,0,0,0|1,1,0]=4 5632 B16R2.312 Cc1cc(c(cn1)Sc2ccccc2)O 62a_100011016184_100000041952 [0,2,0,0,0,0|1,1,0]=4 5633 B16R2.312 Cc1cc(ccc1Sc2ccccc2)Br 62a_100000701812_100000041952 [0,2,0,0,0,0|0,1,0]=3 5634 B16R2.312 Cc1cc(ccc1Sc2ccccc2)Br 62a_100000719477_100000701812 [0,2,0,0,0,0|0,1,0]=3 5635 B16R2.312 Cc1cc(ccc1Sc2ccccc2)Cl 62a_100000719477_100011219607 [0,2,0,0,0,0|0,1,0]=3 5636 B16R2.312 Cc1cc(ccc1Sc2ccccc2)Cl 62a_100011219607_100000041952 [0,2,0,0,0,0|0,1,0]=3 5637 B16R2.312 Cc1cc(ccc1Sc2ccccc2)F 62a_100000719477_100011205405 [0,2,0,0,0,0|0,1,0]=3 5638 B16R2.312 Cc1cc(ccc1Sc2ccccc2)F 62a_100011205405_100000041952 [0,2,0,0,0,0|0,1,0]=3 5639 B16R2.312 Cc1cc(ccc1Sc2ccccc2)N 62a_100000210723_100000041952 [0,2,0,0,0,0|0,1,0]=3 5640 B16R2.312 Cc1cc(ccc1Sc2ccccc2)N 62a_100000719477_100000210723 [0,2,0,0,0,0|0,1,0]=3 5641 B16R2.312 Cc1cc(ccc1Sc2ccccc2)O 62a_100000719477_100000690111 [0,2,0,0,0,0|0,1,0]=3 5642 B16R2.312 Cc1cc(ccc1Sc2ccccn2)Br 62a_100000701812_100011216584 [0,2,0,0,0,0|1,1,0]=4 5643 B16R2.312 Cc1cc(ccc1Sc2ccccn2)Br 62a_100011216584_100000701812 [0,2,0,0,0,0|1,1,0]=4 5644 B16R2.312 Cc1cc(ccc1Sc2ccccn2)Cl 62a_100011216584_100011219607 [0,2,0,0,0,0|1,1,0]=4 5645 B16R2.312 Cc1cc(ccc1Sc2ccccn2)Cl 62a_100011219607_100011216584 [0,2,0,0,0,0|1,1,0]=4 5646 B16R2.312 Cc1cc(ccc1Sc2ccccn2)F 62a_100011205405_100011216584 [0,2,0,0,0,0|1,1,0]=4 5647 B16R2.312 Cc1cc(ccc1Sc2ccccn2)F 62a_100011216584_100011205405 [0,2,0,0,0,0|1,1,0]=4 5648 B16R2.312 Cc1cc(ccc1Sc2ccccn2)N 62a_100000210723_100011216584 [0,2,0,0,0,0|1,1,0]=4 5649 B16R2.312 Cc1cc(ccc1Sc2ccccn2)N 62a_100011216584_100000210723 [0,2,0,0,0,0|1,1,0]=4 5650 B16R2.312 Cc1cc(ccc1Sc2ccccn2)O 62a_100011216584_100000690111 [0,2,0,0,0,0|1,1,0]=4 5651 B16R2.312 Cc1cc(ccc1Sc2cccnc2)Br 62a_100000210063_100000701812 [0,2,0,0,0,0|1,1,0]=4 5652 B16R2.312 Cc1cc(ccc1Sc2cccnc2)Br 62a_100000701812_100000210063 [0,2,0,0,0,0|1,1,0]=4 5653 B16R2.312 Cc1cc(ccc1Sc2cccnc2)Cl 62a_100000210063_100011219607 [0,2,0,0,0,0|1,1,0]=4 5654 B16R2.312 Cc1cc(ccc1Sc2cccnc2)Cl 62a_100011219607_100000210063 [0,2,0,0,0,0|1,1,0]=4 5655 B16R2.312 Cc1cc(ccc1Sc2cccnc2)F 62a_100000210063_100011205405 [0,2,0,0,0,0|1,1,0]=4 5656 B16R2.312 Cc1cc(ccc1Sc2cccnc2)F 62a_100011205405_100000210063 [0,2,0,0,0,0|1,1,0]=4 5657 B16R2.312 Cc1cc(ccc1Sc2cccnc2)N 62a_100000210063_100000210723 [0,2,0,0,0,0|1,1,0]=4 5658 B16R2.312 Cc1cc(ccc1Sc2cccnc2)N 62a_100000210723_100000210063 [0,2,0,0,0,0|1,1,0]=4 5659 B16R2.312 Cc1cc(ccc1Sc2cccnc2)O 62a_100000210063_100000690111 [0,2,0,0,0,0|1,1,0]=4 5660 B16R2.312 Cc1cc(ccc1Sc2ccncc2)Br 62a_100000701812_100000728582 [0,2,0,0,0,0|1,1,0]=4 5661 B16R2.312 Cc1cc(ccc1Sc2ccncc2)Br 62a_100000728582_100000701812 [0,2,0,0,0,0|1,1,0]=4 5662 B16R2.312 Cc1cc(ccc1Sc2ccncc2)Cl 62a_100000728582_100011219607 [0,2,0,0,0,0|1,1,0]=4 5663 B16R2.312 Cc1cc(ccc1Sc2ccncc2)Cl 62a_100011219607_100000728582 [0,2,0,0,0,0|1,1,0]=4 5664 B16R2.312 Cc1cc(ccc1Sc2ccncc2)F 62a_100000728582_100011205405 [0,2,0,0,0,0|1,1,0]=4 5665 B16R2.312 Cc1cc(ccc1Sc2ccncc2)F 62a_100011205405_100000728582 [0,2,0,0,0,0|1,1,0]=4 5666 B16R2.312 Cc1cc(ccc1Sc2ccncc2)N 62a_100000210723_100000728582 [0,2,0,0,0,0|1,1,0]=4 5667 B16R2.312 Cc1cc(ccc1Sc2ccncc2)N 62a_100000728582_100000210723 [0,2,0,0,0,0|1,1,0]=4 5668 B16R2.312 Cc1cc(ccc1Sc2ccncc2)O 62a_100000728582_100000690111 [0,2,0,0,0,0|1,1,0]=4 5669 B16R2.312 Cc1cc(cnc1Sc2ccccc2)Br 62a_100000719477_100012353652 [0,2,0,0,0,0|1,1,0]=4 5670 B16R2.312 Cc1cc(cnc1Sc2ccccc2)Br 62a_100012353652_100000041952 [0,2,0,0,0,0|1,1,0]=4 5671 B16R2.312 Cc1cc(cnc1Sc2ccccc2)F 62a_100000719477_100009817009 [0,2,0,0,0,0|1,1,0]=4 5672 B16R2.312 Cc1cc(cnc1Sc2ccccc2)F 62a_100009817009_100000041952 [0,2,0,0,0,0|1,1,0]=4 5673 B16R2.312 Cc1cc(cnc1Sc2ccccc2)N 62a_100000719477_100000761747 [0,2,0,0,0,0|1,1,0]=4 5674 B16R2.312 Cc1cc(cnc1Sc2ccccc2)N 62a_100000761747_100000041952 [0,2,0,0,0,0|1,1,0]=4 5675 B16R2.312 Cc1cc(cnc1Sc2ccccc2)O 62a_100000719477_100012000486 [0,2,0,0,0,0|1,1,0]=4 5676 B16R2.312 Cc1cc(cnc1Sc2ccccc2)O 62a_100012000486_100000041952 [0,2,0,0,0,0|1,1,0]=4 5677 B16R2.312 Cc1cc(ncc1Sc2ccccc2)Br 62a_100000719477_100009816104 [0,2,0,0,0,0|1,1,0]=4 5678 B16R2.312 Cc1cc(ncc1Sc2ccccc2)Br 62a_100009816104_100000041952 [0,2,0,0,0,0|1,1,0]=4 5679 B16R2.312 Cc1cc(ncc1Sc2ccccc2)Cl 62a_100000719477_100010172789 [0,2,0,0,0,0|1,1,0]=4 5680 B16R2.312 Cc1cc(ncc1Sc2ccccc2)Cl 62a_100010172789_100000041952 [0,2,0,0,0,0|1,1,0]=4 5681 B16R2.312 Cc1cc(ncc1Sc2ccccc2)F 62a_100000719477_100009820716 [0,2,0,0,0,0|1,1,0]=4 5682 B16R2.312 Cc1cc(ncc1Sc2ccccc2)F 62a_100009820716_100000041952 [0,2,0,0,0,0|1,1,0]=4 5683 B16R2.312 Cc1cc(ncc1Sc2ccccc2)N 62a_100000050067_100000041952 [0,2,0,0,0,0|1,1,0]=4 5684 B16R2.312 Cc1cc(ncc1Sc2ccccc2)N 62a_100000719477_100000050067 [0,2,0,0,0,0|1,1,0]=4 5685 B16R2.312 Cc1cc(ncc1Sc2ccccc2)O 62a_100000719477_100000766222 [0,2,0,0,0,0|1,1,0]=4 5686 B16R2.312 Cc1cc(ncc1Sc2ccccc2)O 62a_100000766222_100000041952 [0,2,0,0,0,0|1,1,0]=4 5687 B16R2.312 Cc1ccc([n+](c1)[O-])Sc2ccccc2 62a_100000719477_100009819918 [0,2,0,0,0,0|1,1,0]=4 5688 B16R2.312 Cc1ccc(c(c1)Br)Sc2ccccc2 62a_100000719477_100009813563 [0,2,0,0,0,0|0,1,0]=3 5689 B16R2.312 Cc1ccc(c(c1)Br)Sc2ccccc2 62a_100009813563_100000041952 [0,2,0,0,0,0|0,1,0]=3 5690 B16R2.312 Cc1ccc(c(c1)Br)Sc2ccccn2 62a_100009813563_100011216584 [0,2,0,0,0,0|1,1,0]=4 5691 B16R2.312 Cc1ccc(c(c1)Br)Sc2ccccn2 62a_100011216584_100009813563 [0,2,0,0,0,0|1,1,0]=4 5692 B16R2.312 Cc1ccc(c(c1)Br)Sc2cccnc2 62a_100000210063_100009813563 [0,2,0,0,0,0|1,1,0]=4 5693 B16R2.312 Cc1ccc(c(c1)Br)Sc2cccnc2 62a_100009813563_100000210063 [0,2,0,0,0,0|1,1,0]=4 5694 B16R2.312 Cc1ccc(c(c1)Br)Sc2ccncc2 62a_100000728582_100009813563 [0,2,0,0,0,0|1,1,0]=4 5695 B16R2.312 Cc1ccc(c(c1)Br)Sc2ccncc2 62a_100009813563_100000728582 [0,2,0,0,0,0|1,1,0]=4 5696 B16R2.312 Cc1ccc(c(c1)C)Sc2ccccc2 62a_100000719477_100011217332 [0,2,0,0,0,0|0,1,0]=3 5697 B16R2.312 Cc1ccc(c(c1)C)Sc2ccccc2 62a_100011217332_100000041952 [0,2,0,0,0,0|0,1,0]=3 5698 B16R2.312 Cc1ccc(c(c1)C)Sc2ccccn2 62a_100011216584_100011217332 [0,2,0,0,0,0|1,1,0]=4 5699 B16R2.312 Cc1ccc(c(c1)C)Sc2ccccn2 62a_100011217332_100011216584 [0,2,0,0,0,0|1,1,0]=4 5700 B16R2.312 Cc1ccc(c(c1)C)Sc2cccnc2 62a_100000210063_100011217332 [0,2,0,0,0,0|1,1,0]=4 5701 B16R2.312 Cc1ccc(c(c1)C)Sc2cccnc2 62a_100011217332_100000210063 [0,2,0,0,0,0|1,1,0]=4 5702 B16R2.312 Cc1ccc(c(c1)C)Sc2ccncc2 62a_100000728582_100011217332 [0,2,0,0,0,0|1,1,0]=4 5703 B16R2.312 Cc1ccc(c(c1)C)Sc2ccncc2 62a_100011217332_100000728582 [0,2,0,0,0,0|1,1,0]=4 5704 B16R2.312 Cc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000719477_100011263221 [0,2,0,0,0,0|0,1,0]=3 5705 B16R2.312 Cc1ccc(c(c1)Cl)Sc2ccccc2 62a_100011263221_100000041952 [0,2,0,0,0,0|0,1,0]=3 5706 B16R2.312 Cc1ccc(c(c1)Cl)Sc2ccccn2 62a_100011216584_100011263221 [0,2,0,0,0,0|1,1,0]=4 5707 B16R2.312 Cc1ccc(c(c1)Cl)Sc2ccccn2 62a_100011263221_100011216584 [0,2,0,0,0,0|1,1,0]=4 5708 B16R2.312 Cc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000210063_100011263221 [0,2,0,0,0,0|1,1,0]=4 5709 B16R2.312 Cc1ccc(c(c1)Cl)Sc2cccnc2 62a_100011263221_100000210063 [0,2,0,0,0,0|1,1,0]=4 5710 B16R2.312 Cc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000728582_100011263221 [0,2,0,0,0,0|1,1,0]=4 5711 B16R2.312 Cc1ccc(c(c1)Cl)Sc2ccncc2 62a_100011263221_100000728582 [0,2,0,0,0,0|1,1,0]=4 5712 B16R2.312 Cc1ccc(c(c1)F)Sc2ccccc2 62a_100000719477_100011216119 [0,2,0,0,0,0|0,1,0]=3 5713 B16R2.312 Cc1ccc(c(c1)F)Sc2ccccc2 62a_100011216119_100000041952 [0,2,0,0,0,0|0,1,0]=3 5714 B16R2.312 Cc1ccc(c(c1)F)Sc2ccccn2 62a_100011216119_100011216584 [0,2,0,0,0,0|1,1,0]=4 5715 B16R2.312 Cc1ccc(c(c1)F)Sc2ccccn2 62a_100011216584_100011216119 [0,2,0,0,0,0|1,1,0]=4 5716 B16R2.312 Cc1ccc(c(c1)F)Sc2cccnc2 62a_100000210063_100011216119 [0,2,0,0,0,0|1,1,0]=4 5717 B16R2.312 Cc1ccc(c(c1)F)Sc2cccnc2 62a_100011216119_100000210063 [0,2,0,0,0,0|1,1,0]=4 5718 B16R2.312 Cc1ccc(c(c1)F)Sc2ccncc2 62a_100000728582_100011216119 [0,2,0,0,0,0|1,1,0]=4 5719 B16R2.312 Cc1ccc(c(c1)F)Sc2ccncc2 62a_100011216119_100000728582 [0,2,0,0,0,0|1,1,0]=4 5720 B16R2.312 Cc1ccc(c(c1)N)Sc2ccccc2 62a_100000719477_100011216686 [0,2,0,0,0,0|0,1,0]=3 5721 B16R2.312 Cc1ccc(c(c1)N)Sc2ccccc2 62a_100011216686_100000041952 [0,2,0,0,0,0|0,1,0]=3 5722 B16R2.312 Cc1ccc(c(c1)N)Sc2ccccn2 62a_100011216584_100011216686 [0,2,0,0,0,0|1,1,0]=4 5723 B16R2.312 Cc1ccc(c(c1)N)Sc2ccccn2 62a_100011216686_100011216584 [0,2,0,0,0,0|1,1,0]=4 5724 B16R2.312 Cc1ccc(c(c1)N)Sc2cccnc2 62a_100000210063_100011216686 [0,2,0,0,0,0|1,1,0]=4 5725 B16R2.312 Cc1ccc(c(c1)N)Sc2cccnc2 62a_100011216686_100000210063 [0,2,0,0,0,0|1,1,0]=4 5726 B16R2.312 Cc1ccc(c(c1)N)Sc2ccncc2 62a_100000728582_100011216686 [0,2,0,0,0,0|1,1,0]=4 5727 B16R2.312 Cc1ccc(c(c1)N)Sc2ccncc2 62a_100011216686_100000728582 [0,2,0,0,0,0|1,1,0]=4 5728 B16R2.312 Cc1ccc(c(c1)O)Sc2ccccc2 62a_100000719477_100012002257 [0,2,0,0,0,0|0,1,0]=3 5729 B16R2.312 Cc1ccc(c(c1)O)Sc2ccccc2 62a_100012002257_100000041952 [0,2,0,0,0,0|0,1,0]=3 5730 B16R2.312 Cc1ccc(c(c1)O)Sc2ccccn2 62a_100011216584_100012002257 [0,2,0,0,0,0|1,1,0]=4 5731 B16R2.312 Cc1ccc(c(c1)O)Sc2ccccn2 62a_100012002257_100011216584 [0,2,0,0,0,0|1,1,0]=4 5732 B16R2.312 Cc1ccc(c(c1)O)Sc2cccnc2 62a_100000210063_100012002257 [0,2,0,0,0,0|1,1,0]=4 5733 B16R2.312 Cc1ccc(c(c1)O)Sc2cccnc2 62a_100012002257_100000210063 [0,2,0,0,0,0|1,1,0]=4 5734 B16R2.312 Cc1ccc(c(c1)O)Sc2ccncc2 62a_100000728582_100012002257 [0,2,0,0,0,0|1,1,0]=4 5735 B16R2.312 Cc1ccc(c(c1)O)Sc2ccncc2 62a_100012002257_100000728582 [0,2,0,0,0,0|1,1,0]=4 5736 B16R2.312 Cc1ccc(c(n1)C)Sc2ccccc2 62a_100000719477_100009813853 [0,2,0,0,0,0|1,1,0]=4 5737 B16R2.312 Cc1ccc(c(n1)C)Sc2ccccc2 62a_100009813853_100000041952 [0,2,0,0,0,0|1,1,0]=4 5738 B16R2.312 Cc1ccc(c(n1)F)Sc2ccccc2 62a_100000719477_100010006597 [0,2,0,0,0,0|1,1,0]=4 5739 B16R2.312 Cc1ccc(c(n1)F)Sc2ccccc2 62a_100010006597_100000041952 [0,2,0,0,0,0|1,1,0]=4 5740 B16R2.312 Cc1ccc(c(n1)N)Sc2ccccc2 62a_100000719477_100009816662 [0,2,0,0,0,0|1,1,0]=4 5741 B16R2.312 Cc1ccc(c(n1)N)Sc2ccccc2 62a_100009816662_100000041952 [0,2,0,0,0,0|1,1,0]=4 5742 B16R2.312 Cc1ccc(c(n1)O)Sc2ccccc2 62a_100000719477_100009817604 [0,2,0,0,0,0|1,1,0]=4 5743 B16R2.312 Cc1ccc(c(n1)O)Sc2ccccc2 62a_100009817604_100000041952 [0,2,0,0,0,0|1,1,0]=4 5744 B16R2.312 Cc1cnc(c(c1)C)Sc2ccccc2 62a_100000719477_100009864548 [0,2,0,0,0,0|1,1,0]=4 5745 B16R2.312 Cc1cnc(c(c1)C)Sc2ccccc2 62a_100009864548_100000041952 [0,2,0,0,0,0|1,1,0]=4 5746 B16R2.312 Cc1cnc(c(c1)F)Sc2ccccc2 62a_100000719477_100009819633 [0,2,0,0,0,0|1,1,0]=4 5747 B16R2.312 Cc1cnc(c(c1)F)Sc2ccccc2 62a_100009819633_100000041952 [0,2,0,0,0,0|1,1,0]=4 5748 B16R2.312 Cc1cnc(c(c1)N)Sc2ccccc2 62a_100000719477_100000733613 [0,2,0,0,0,0|1,1,0]=4 5749 B16R2.312 Cc1cnc(c(c1)N)Sc2ccccc2 62a_100000733613_100000041952 [0,2,0,0,0,0|1,1,0]=4 5750 B16R2.312 Cc1cnc(c(c1)O)Sc2ccccc2 62a_100000719477_100012000487 [0,2,0,0,0,0|1,1,0]=4 5751 B16R2.312 Cc1nc(ccc1Sc2ccccc2)Cl 62a_100000062408_100000041952 [0,2,0,0,0,0|1,1,0]=4 5752 B16R2.312 Cc1nc(ccc1Sc2ccccc2)Cl 62a_100000719477_100000062408 [0,2,0,0,0,0|1,1,0]=4 5753 B16R2.312 Cc1nc(ccc1Sc2ccccc2)F 62a_100000688911_100000041952 [0,2,0,0,0,0|1,1,0]=4 5754 B16R2.312 Cc1nc(ccc1Sc2ccccc2)F 62a_100000719477_100000688911 [0,2,0,0,0,0|1,1,0]=4 5755 B16R2.312 Cc1nc(ccc1Sc2ccccc2)N 62a_100000187202_100000041952 [0,2,0,0,0,0|1,1,0]=4 5756 B16R2.312 Cc1nc(ccc1Sc2ccccc2)N 62a_100000719477_100000187202 [0,2,0,0,0,0|1,1,0]=4 5757 B16R2.312 Cc1nc(ccc1Sc2ccccc2)O 62a_100000691680_100000041952 [0,2,0,0,0,0|1,1,0]=4 5758 B16R2.312 Cc1nc(ccc1Sc2ccccc2)O 62a_100000719477_100000691680 [0,2,0,0,0,0|1,1,0]=4 5759 B16R2.312 Clc1cc(c(cn1)Sc2ccccc2)Cl 62a_100000719477_100010200927 [0,2,0,0,0,0|1,1,0]=4 5760 B16R2.312 Clc1cc(c(cn1)Sc2ccccc2)Cl 62a_100010200927_100000041952 [0,2,0,0,0,0|1,1,0]=4 5761 B16R2.312 Clc1cc(ccc1Sc2ccccc2)Br 62a_100000719477_100011216062 [0,2,0,0,0,0|0,1,0]=3 5762 B16R2.312 Clc1cc(ccc1Sc2ccccc2)Br 62a_100011216062_100000041952 [0,2,0,0,0,0|0,1,0]=3 5763 B16R2.312 Clc1cc(ccc1Sc2ccccn2)Br 62a_100011216062_100011216584 [0,2,0,0,0,0|1,1,0]=4 5764 B16R2.312 Clc1cc(ccc1Sc2ccccn2)Br 62a_100011216584_100011216062 [0,2,0,0,0,0|1,1,0]=4 5765 B16R2.312 Clc1cc(ccc1Sc2cccnc2)Br 62a_100000210063_100011216062 [0,2,0,0,0,0|1,1,0]=4 5766 B16R2.312 Clc1cc(ccc1Sc2cccnc2)Br 62a_100011216062_100000210063 [0,2,0,0,0,0|1,1,0]=4 5767 B16R2.312 Clc1cc(ccc1Sc2ccncc2)Br 62a_100000728582_100011216062 [0,2,0,0,0,0|1,1,0]=4 5768 B16R2.312 Clc1cc(ccc1Sc2ccncc2)Br 62a_100011216062_100000728582 [0,2,0,0,0,0|1,1,0]=4 5769 B16R2.312 Clc1cc(ncc1Sc2ccccc2)Br 62a_100000719477_100010381092 [0,2,0,0,0,0|1,1,0]=4 5770 B16R2.312 Clc1cc(ncc1Sc2ccccc2)Br 62a_100010381092_100000041952 [0,2,0,0,0,0|1,1,0]=4 5771 B16R2.312 Clc1ccc(c(c1)Br)Sc2ccccc2 62a_100000719477_100011219703 [0,2,0,0,0,0|0,1,0]=3 5772 B16R2.312 Clc1ccc(c(c1)Br)Sc2ccccc2 62a_100011219703_100000041952 [0,2,0,0,0,0|0,1,0]=3 5773 B16R2.312 Clc1ccc(c(c1)Br)Sc2ccccn2 62a_100011216584_100011219703 [0,2,0,0,0,0|1,1,0]=4 5774 B16R2.312 Clc1ccc(c(c1)Br)Sc2ccccn2 62a_100011219703_100011216584 [0,2,0,0,0,0|1,1,0]=4 5775 B16R2.312 Clc1ccc(c(c1)Br)Sc2cccnc2 62a_100000210063_100011219703 [0,2,0,0,0,0|1,1,0]=4 5776 B16R2.312 Clc1ccc(c(c1)Br)Sc2cccnc2 62a_100011219703_100000210063 [0,2,0,0,0,0|1,1,0]=4 5777 B16R2.312 Clc1ccc(c(c1)Br)Sc2ccncc2 62a_100000728582_100011219703 [0,2,0,0,0,0|1,1,0]=4 5778 B16R2.312 Clc1ccc(c(c1)Br)Sc2ccncc2 62a_100011219703_100000728582 [0,2,0,0,0,0|1,1,0]=4 5779 B16R2.312 Clc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000699841_100000041952 [0,2,0,0,0,0|0,1,0]=3 5780 B16R2.312 Clc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000719477_100000699841 [0,2,0,0,0,0|0,1,0]=3 5781 B16R2.312 Clc1ccc(c(c1)Cl)Sc2ccccn2 62a_100000699841_100011216584 [0,2,0,0,0,0|1,1,0]=4 5782 B16R2.312 Clc1ccc(c(c1)Cl)Sc2ccccn2 62a_100011216584_100000699841 [0,2,0,0,0,0|1,1,0]=4 5783 B16R2.312 Clc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000210063_100000699841 [0,2,0,0,0,0|1,1,0]=4 5784 B16R2.312 Clc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000699841_100000210063 [0,2,0,0,0,0|1,1,0]=4 5785 B16R2.312 Clc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000699841_100000728582 [0,2,0,0,0,0|1,1,0]=4 5786 B16R2.312 Clc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000728582_100000699841 [0,2,0,0,0,0|1,1,0]=4 5787 B16R2.312 Clc1ccc(c(n1)Cl)Sc2ccccc2 62a_100000719477_100000043682 [0,2,0,0,0,0|1,1,0]=4 5788 B16R2.312 Clc1cnc(c(c1)Br)Sc2ccccc2 62a_100000719477_100012154958 [0,2,0,0,0,0|1,1,0]=4 5789 B16R2.312 Clc1cnc(c(c1)Br)Sc2ccccc2 62a_100012154958_100000041952 [0,2,0,0,0,0|1,1,0]=4 5790 B16R2.312 Clc1nc(ccc1Sc2ccccc2)Br 62a_100000719477_100010246183 [0,2,0,0,0,0|1,1,0]=4 5791 B16R2.312 Clc1nc(ccc1Sc2ccccc2)Br 62a_100010246183_100000041952 [0,2,0,0,0,0|1,1,0]=4 5792 B16R2.312 Fc1cc(c(cn1)Sc2ccccc2)Br 62a_100000719477_100015451857 [0,2,0,0,0,0|1,1,0]=4 5793 B16R2.312 Fc1cc(c(cn1)Sc2ccccc2)Br 62a_100015451857_100000041952 [0,2,0,0,0,0|1,1,0]=4 5794 B16R2.312 Fc1cc(ccc1Sc2ccccc2)Br 62a_100000719477_100009814013 [0,2,0,0,0,0|0,1,0]=3 5795 B16R2.312 Fc1cc(ccc1Sc2ccccc2)Br 62a_100009814013_100000041952 [0,2,0,0,0,0|0,1,0]=3 5796 B16R2.312 Fc1cc(ccc1Sc2ccccc2)Cl 62a_100000719477_100011216042 [0,2,0,0,0,0|0,1,0]=3 5797 B16R2.312 Fc1cc(ccc1Sc2ccccc2)Cl 62a_100011216042_100000041952 [0,2,0,0,0,0|0,1,0]=3 5798 B16R2.312 Fc1cc(ccc1Sc2ccccn2)Br 62a_100009814013_100011216584 [0,2,0,0,0,0|1,1,0]=4 5799 B16R2.312 Fc1cc(ccc1Sc2ccccn2)Br 62a_100011216584_100009814013 [0,2,0,0,0,0|1,1,0]=4 5800 B16R2.312 Fc1cc(ccc1Sc2ccccn2)Cl 62a_100011216042_100011216584 [0,2,0,0,0,0|1,1,0]=4 5801 B16R2.312 Fc1cc(ccc1Sc2ccccn2)Cl 62a_100011216584_100011216042 [0,2,0,0,0,0|1,1,0]=4 5802 B16R2.312 Fc1cc(ccc1Sc2cccnc2)Br 62a_100000210063_100009814013 [0,2,0,0,0,0|1,1,0]=4 5803 B16R2.312 Fc1cc(ccc1Sc2cccnc2)Br 62a_100009814013_100000210063 [0,2,0,0,0,0|1,1,0]=4 5804 B16R2.312 Fc1cc(ccc1Sc2cccnc2)Cl 62a_100000210063_100011216042 [0,2,0,0,0,0|1,1,0]=4 5805 B16R2.312 Fc1cc(ccc1Sc2cccnc2)Cl 62a_100011216042_100000210063 [0,2,0,0,0,0|1,1,0]=4 5806 B16R2.312 Fc1cc(ccc1Sc2ccncc2)Br 62a_100000728582_100009814013 [0,2,0,0,0,0|1,1,0]=4 5807 B16R2.312 Fc1cc(ccc1Sc2ccncc2)Br 62a_100009814013_100000728582 [0,2,0,0,0,0|1,1,0]=4 5808 B16R2.312 Fc1cc(ccc1Sc2ccncc2)Cl 62a_100000728582_100011216042 [0,2,0,0,0,0|1,1,0]=4 5809 B16R2.312 Fc1cc(ccc1Sc2ccncc2)Cl 62a_100011216042_100000728582 [0,2,0,0,0,0|1,1,0]=4 5810 B16R2.312 Fc1cc(cnc1Sc2ccccc2)Br 62a_100000719477_100012348576 [0,2,0,0,0,0|1,1,0]=4 5811 B16R2.312 Fc1cc(cnc1Sc2ccccc2)Br 62a_100012348576_100000041952 [0,2,0,0,0,0|1,1,0]=4 5812 B16R2.312 Fc1cc(cnc1Sc2ccccc2)Cl 62a_100000719477_100012348686 [0,2,0,0,0,0|1,1,0]=4 5813 B16R2.312 Fc1cc(cnc1Sc2ccccc2)Cl 62a_100012348686_100000041952 [0,2,0,0,0,0|1,1,0]=4 5814 B16R2.312 Fc1cc(ncc1Sc2ccccc2)Cl 62a_100000719477_100010128100 [0,2,0,0,0,0|1,1,0]=4 5815 B16R2.312 Fc1cc(ncc1Sc2ccccc2)Cl 62a_100010128100_100000041952 [0,2,0,0,0,0|1,1,0]=4 5816 B16R2.312 Fc1ccc(c(c1)Br)Sc2ccccc2 62a_100000719477_100011217111 [0,2,0,0,0,0|0,1,0]=3 5817 B16R2.312 Fc1ccc(c(c1)Br)Sc2ccccc2 62a_100011217111_100000041952 [0,2,0,0,0,0|0,1,0]=3 5818 B16R2.312 Fc1ccc(c(c1)Br)Sc2ccccn2 62a_100011216584_100011217111 [0,2,0,0,0,0|1,1,0]=4 5819 B16R2.312 Fc1ccc(c(c1)Br)Sc2ccccn2 62a_100011217111_100011216584 [0,2,0,0,0,0|1,1,0]=4 5820 B16R2.312 Fc1ccc(c(c1)Br)Sc2cccnc2 62a_100000210063_100011217111 [0,2,0,0,0,0|1,1,0]=4 5821 B16R2.312 Fc1ccc(c(c1)Br)Sc2cccnc2 62a_100011217111_100000210063 [0,2,0,0,0,0|1,1,0]=4 5822 B16R2.312 Fc1ccc(c(c1)Br)Sc2ccncc2 62a_100000728582_100011217111 [0,2,0,0,0,0|1,1,0]=4 5823 B16R2.312 Fc1ccc(c(c1)Br)Sc2ccncc2 62a_100011217111_100000728582 [0,2,0,0,0,0|1,1,0]=4 5824 B16R2.312 Fc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000719477_100000733362 [0,2,0,0,0,0|0,1,0]=3 5825 B16R2.312 Fc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000733362_100000041952 [0,2,0,0,0,0|0,1,0]=3 5826 B16R2.312 Fc1ccc(c(c1)Cl)Sc2ccccn2 62a_100000733362_100011216584 [0,2,0,0,0,0|1,1,0]=4 5827 B16R2.312 Fc1ccc(c(c1)Cl)Sc2ccccn2 62a_100011216584_100000733362 [0,2,0,0,0,0|1,1,0]=4 5828 B16R2.312 Fc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000210063_100000733362 [0,2,0,0,0,0|1,1,0]=4 5829 B16R2.312 Fc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000733362_100000210063 [0,2,0,0,0,0|1,1,0]=4 5830 B16R2.312 Fc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000728582_100000733362 [0,2,0,0,0,0|1,1,0]=4 5831 B16R2.312 Fc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000733362_100000728582 [0,2,0,0,0,0|1,1,0]=4 5832 B16R2.312 Fc1ccc(c(c1)F)Sc2ccccc2 62a_100000719477_100000750030 [0,2,0,0,0,0|0,1,0]=3 5833 B16R2.312 Fc1ccc(c(c1)F)Sc2ccccc2 62a_100000750030_100000041952 [0,2,0,0,0,0|0,1,0]=3 5834 B16R2.312 Fc1ccc(c(c1)F)Sc2ccccn2 62a_100000750030_100011216584 [0,2,0,0,0,0|1,1,0]=4 5835 B16R2.312 Fc1ccc(c(c1)F)Sc2ccccn2 62a_100011216584_100000750030 [0,2,0,0,0,0|1,1,0]=4 5836 B16R2.312 Fc1ccc(c(c1)F)Sc2cccnc2 62a_100000210063_100000750030 [0,2,0,0,0,0|1,1,0]=4 5837 B16R2.312 Fc1ccc(c(c1)F)Sc2cccnc2 62a_100000750030_100000210063 [0,2,0,0,0,0|1,1,0]=4 5838 B16R2.312 Fc1ccc(c(c1)F)Sc2ccncc2 62a_100000728582_100000750030 [0,2,0,0,0,0|1,1,0]=4 5839 B16R2.312 Fc1ccc(c(c1)F)Sc2ccncc2 62a_100000750030_100000728582 [0,2,0,0,0,0|1,1,0]=4 5840 B16R2.312 Fc1ccc(c(n1)F)Sc2ccccc2 62a_100000070099_100000041952 [0,2,0,0,0,0|1,1,0]=4 5841 B16R2.312 Fc1ccc(c(n1)F)Sc2ccccc2 62a_100000719477_100000070099 [0,2,0,0,0,0|1,1,0]=4 5842 B16R2.312 Fc1cnc(c(c1)F)Sc2ccccc2 62a_100000719477_100011219543 [0,2,0,0,0,0|1,1,0]=4 5843 B16R2.312 Fc1cnc(c(c1)F)Sc2ccccc2 62a_100011219543_100000041952 [0,2,0,0,0,0|1,1,0]=4 5844 B16R2.312 Fc1nc(ccc1Sc2ccccc2)Cl 62a_100000719477_100010168078 [0,2,0,0,0,0|1,1,0]=4 5845 B16R2.312 Fc1nc(ccc1Sc2ccccc2)Cl 62a_100010168078_100000041952 [0,2,0,0,0,0|1,1,0]=4 5846 B16R2.312 Nc1[nH]c(=O)ccc1Sc2ccccc2 62a_100009884077_100000041952 [0,2,0,0,0,0|1,1,0]=4 5847 B16R2.312 Nc1cc(c(cn1)Sc2ccccc2)Br 62a_100000719477_100010074611 [0,2,0,0,0,0|1,1,0]=4 5848 B16R2.312 Nc1cc(c(cn1)Sc2ccccc2)Br 62a_100010074611_100000041952 [0,2,0,0,0,0|1,1,0]=4 5849 B16R2.312 Nc1cc(c(cn1)Sc2ccccc2)Cl 62a_100000694920_100000041952 [0,2,0,0,0,0|1,1,0]=4 5850 B16R2.312 Nc1cc(c(cn1)Sc2ccccc2)Cl 62a_100000719477_100000694920 [0,2,0,0,0,0|1,1,0]=4 5851 B16R2.312 Nc1cc(c(cn1)Sc2ccccc2)F 62a_100000719477_100009844730 [0,2,0,0,0,0|1,1,0]=4 5852 B16R2.312 Nc1cc(c(cn1)Sc2ccccc2)F 62a_100009844730_100000041952 [0,2,0,0,0,0|1,1,0]=4 5853 B16R2.312 Nc1cc(c(cn1)Sc2ccccc2)N 62a_100000719477_200009857908 [0,2,0,0,0,0|1,1,0]=4 5854 B16R2.312 Nc1cc(c(cn1)Sc2ccccc2)N 62a_200009857908_100000041952 [0,2,0,0,0,0|1,1,0]=4 5855 B16R2.312 Nc1cc(ccc1Sc2ccccc2)Br 62a_100000719477_100000743836 [0,2,0,0,0,0|0,1,0]=3 5856 B16R2.312 Nc1cc(ccc1Sc2ccccc2)Br 62a_100000743836_100000041952 [0,2,0,0,0,0|0,1,0]=3 5857 B16R2.312 Nc1cc(ccc1Sc2ccccc2)Cl 62a_100000719477_100000761886 [0,2,0,0,0,0|0,1,0]=3 5858 B16R2.312 Nc1cc(ccc1Sc2ccccc2)Cl 62a_100000761886_100000041952 [0,2,0,0,0,0|0,1,0]=3 5859 B16R2.312 Nc1cc(ccc1Sc2ccccc2)F 62a_100000687223_100000041952 [0,2,0,0,0,0|0,1,0]=3 5860 B16R2.312 Nc1cc(ccc1Sc2ccccc2)F 62a_100000719477_100000687223 [0,2,0,0,0,0|0,1,0]=3 5861 B16R2.312 Nc1cc(ccc1Sc2ccccc2)O 62a_100000719477_100011999798 [0,2,0,0,0,0|0,1,0]=3 5862 B16R2.312 Nc1cc(ccc1Sc2ccccc2)O 62a_100011999798_100000041952 [0,2,0,0,0,0|0,1,0]=3 5863 B16R2.312 Nc1cc(ccc1Sc2ccccn2)Br 62a_100000743836_100011216584 [0,2,0,0,0,0|1,1,0]=4 5864 B16R2.312 Nc1cc(ccc1Sc2ccccn2)Br 62a_100011216584_100000743836 [0,2,0,0,0,0|1,1,0]=4 5865 B16R2.312 Nc1cc(ccc1Sc2ccccn2)Cl 62a_100000761886_100011216584 [0,2,0,0,0,0|1,1,0]=4 5866 B16R2.312 Nc1cc(ccc1Sc2ccccn2)Cl 62a_100011216584_100000761886 [0,2,0,0,0,0|1,1,0]=4 5867 B16R2.312 Nc1cc(ccc1Sc2ccccn2)F 62a_100000687223_100011216584 [0,2,0,0,0,0|1,1,0]=4 5868 B16R2.312 Nc1cc(ccc1Sc2ccccn2)F 62a_100011216584_100000687223 [0,2,0,0,0,0|1,1,0]=4 5869 B16R2.312 Nc1cc(ccc1Sc2ccccn2)O 62a_100011216584_100011999798 [0,2,0,0,0,0|1,1,0]=4 5870 B16R2.312 Nc1cc(ccc1Sc2ccccn2)O 62a_100011999798_100011216584 [0,2,0,0,0,0|1,1,0]=4 5871 B16R2.312 Nc1cc(ccc1Sc2cccnc2)Br 62a_100000210063_100000743836 [0,2,0,0,0,0|1,1,0]=4 5872 B16R2.312 Nc1cc(ccc1Sc2cccnc2)Br 62a_100000743836_100000210063 [0,2,0,0,0,0|1,1,0]=4 5873 B16R2.312 Nc1cc(ccc1Sc2cccnc2)Cl 62a_100000210063_100000761886 [0,2,0,0,0,0|1,1,0]=4 5874 B16R2.312 Nc1cc(ccc1Sc2cccnc2)Cl 62a_100000761886_100000210063 [0,2,0,0,0,0|1,1,0]=4 5875 B16R2.312 Nc1cc(ccc1Sc2cccnc2)F 62a_100000210063_100000687223 [0,2,0,0,0,0|1,1,0]=4 5876 B16R2.312 Nc1cc(ccc1Sc2cccnc2)F 62a_100000687223_100000210063 [0,2,0,0,0,0|1,1,0]=4 5877 B16R2.312 Nc1cc(ccc1Sc2cccnc2)O 62a_100000210063_100011999798 [0,2,0,0,0,0|1,1,0]=4 5878 B16R2.312 Nc1cc(ccc1Sc2cccnc2)O 62a_100011999798_100000210063 [0,2,0,0,0,0|1,1,0]=4 5879 B16R2.312 Nc1cc(ccc1Sc2ccncc2)Br 62a_100000728582_100000743836 [0,2,0,0,0,0|1,1,0]=4 5880 B16R2.312 Nc1cc(ccc1Sc2ccncc2)Br 62a_100000743836_100000728582 [0,2,0,0,0,0|1,1,0]=4 5881 B16R2.312 Nc1cc(ccc1Sc2ccncc2)Cl 62a_100000728582_100000761886 [0,2,0,0,0,0|1,1,0]=4 5882 B16R2.312 Nc1cc(ccc1Sc2ccncc2)Cl 62a_100000761886_100000728582 [0,2,0,0,0,0|1,1,0]=4 5883 B16R2.312 Nc1cc(ccc1Sc2ccncc2)F 62a_100000687223_100000728582 [0,2,0,0,0,0|1,1,0]=4 5884 B16R2.312 Nc1cc(ccc1Sc2ccncc2)F 62a_100000728582_100000687223 [0,2,0,0,0,0|1,1,0]=4 5885 B16R2.312 Nc1cc(ccc1Sc2ccncc2)O 62a_100000728582_100011999798 [0,2,0,0,0,0|1,1,0]=4 5886 B16R2.312 Nc1cc(ccc1Sc2ccncc2)O 62a_100011999798_100000728582 [0,2,0,0,0,0|1,1,0]=4 5887 B16R2.312 Nc1cc(cnc1Sc2ccccc2)Br 62a_100000719477_100010090555 [0,2,0,0,0,0|1,1,0]=4 5888 B16R2.312 Nc1cc(cnc1Sc2ccccc2)Br 62a_100010090555_100000041952 [0,2,0,0,0,0|1,1,0]=4 5889 B16R2.312 Nc1cc(cnc1Sc2ccccc2)F 62a_100000719477_100009817643 [0,2,0,0,0,0|1,1,0]=4 5890 B16R2.312 Nc1cc(cnc1Sc2ccccc2)F 62a_100009817643_100000041952 [0,2,0,0,0,0|1,1,0]=4 5891 B16R2.312 Nc1cc(ncc1Sc2ccccc2)Cl 62a_100000719477_100010209552 [0,2,0,0,0,0|1,1,0]=4 5892 B16R2.312 Nc1cc(ncc1Sc2ccccc2)Cl 62a_100010209552_100000041952 [0,2,0,0,0,0|1,1,0]=4 5893 B16R2.312 Nc1ccc(c(c1)Br)Sc2ccccc2 62a_100000719477_100000750458 [0,2,0,0,0,0|0,1,0]=3 5894 B16R2.312 Nc1ccc(c(c1)Br)Sc2ccccc2 62a_100000750458_100000041952 [0,2,0,0,0,0|0,1,0]=3 5895 B16R2.312 Nc1ccc(c(c1)Br)Sc2ccccn2 62a_100000750458_100011216584 [0,2,0,0,0,0|1,1,0]=4 5896 B16R2.312 Nc1ccc(c(c1)Br)Sc2ccccn2 62a_100011216584_100000750458 [0,2,0,0,0,0|1,1,0]=4 5897 B16R2.312 Nc1ccc(c(c1)Br)Sc2cccnc2 62a_100000210063_100000750458 [0,2,0,0,0,0|1,1,0]=4 5898 B16R2.312 Nc1ccc(c(c1)Br)Sc2cccnc2 62a_100000750458_100000210063 [0,2,0,0,0,0|1,1,0]=4 5899 B16R2.312 Nc1ccc(c(c1)Br)Sc2ccncc2 62a_100000728582_100000750458 [0,2,0,0,0,0|1,1,0]=4 5900 B16R2.312 Nc1ccc(c(c1)Br)Sc2ccncc2 62a_100000750458_100000728582 [0,2,0,0,0,0|1,1,0]=4 5901 B16R2.312 Nc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000719477_100000761885 [0,2,0,0,0,0|0,1,0]=3 5902 B16R2.312 Nc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000761885_100000041952 [0,2,0,0,0,0|0,1,0]=3 5903 B16R2.312 Nc1ccc(c(c1)Cl)Sc2ccccn2 62a_100000761885_100011216584 [0,2,0,0,0,0|1,1,0]=4 5904 B16R2.312 Nc1ccc(c(c1)Cl)Sc2ccccn2 62a_100011216584_100000761885 [0,2,0,0,0,0|1,1,0]=4 5905 B16R2.312 Nc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000210063_100000761885 [0,2,0,0,0,0|1,1,0]=4 5906 B16R2.312 Nc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000761885_100000210063 [0,2,0,0,0,0|1,1,0]=4 5907 B16R2.312 Nc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000728582_100000761885 [0,2,0,0,0,0|1,1,0]=4 5908 B16R2.312 Nc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000761885_100000728582 [0,2,0,0,0,0|1,1,0]=4 5909 B16R2.312 Nc1ccc(c(c1)F)Sc2ccccc2 62a_100000719477_100011356925 [0,2,0,0,0,0|0,1,0]=3 5910 B16R2.312 Nc1ccc(c(c1)F)Sc2ccccc2 62a_100011356925_100000041952 [0,2,0,0,0,0|0,1,0]=3 5911 B16R2.312 Nc1ccc(c(c1)F)Sc2ccccn2 62a_100011216584_100011356925 [0,2,0,0,0,0|1,1,0]=4 5912 B16R2.312 Nc1ccc(c(c1)F)Sc2ccccn2 62a_100011356925_100011216584 [0,2,0,0,0,0|1,1,0]=4 5913 B16R2.312 Nc1ccc(c(c1)F)Sc2cccnc2 62a_100000210063_100011356925 [0,2,0,0,0,0|1,1,0]=4 5914 B16R2.312 Nc1ccc(c(c1)F)Sc2cccnc2 62a_100011356925_100000210063 [0,2,0,0,0,0|1,1,0]=4 5915 B16R2.312 Nc1ccc(c(c1)F)Sc2ccncc2 62a_100000728582_100011356925 [0,2,0,0,0,0|1,1,0]=4 5916 B16R2.312 Nc1ccc(c(c1)F)Sc2ccncc2 62a_100011356925_100000728582 [0,2,0,0,0,0|1,1,0]=4 5917 B16R2.312 Nc1ccc(c(c1)N)Sc2ccccc2 62a_100000719477_200012175722 [0,2,0,0,0,0|0,1,0]=3 5918 B16R2.312 Nc1ccc(c(c1)N)Sc2ccccc2 62a_200012175722_100000041952 [0,2,0,0,0,0|0,1,0]=3 5919 B16R2.312 Nc1ccc(c(c1)N)Sc2ccccn2 62a_100011216584_200012175722 [0,2,0,0,0,0|1,1,0]=4 5920 B16R2.312 Nc1ccc(c(c1)N)Sc2ccccn2 62a_200012175722_100011216584 [0,2,0,0,0,0|1,1,0]=4 5921 B16R2.312 Nc1ccc(c(c1)N)Sc2cccnc2 62a_100000210063_200012175722 [0,2,0,0,0,0|1,1,0]=4 5922 B16R2.312 Nc1ccc(c(c1)N)Sc2cccnc2 62a_200012175722_100000210063 [0,2,0,0,0,0|1,1,0]=4 5923 B16R2.312 Nc1ccc(c(c1)N)Sc2ccncc2 62a_100000728582_200012175722 [0,2,0,0,0,0|1,1,0]=4 5924 B16R2.312 Nc1ccc(c(c1)N)Sc2ccncc2 62a_200012175722_100000728582 [0,2,0,0,0,0|1,1,0]=4 5925 B16R2.312 Nc1ccc(c(n1)Br)Sc2ccccc2 62a_100000719477_100010734177 [0,2,0,0,0,0|1,1,0]=4 5926 B16R2.312 Nc1ccc(c(n1)Br)Sc2ccccc2 62a_100010734177_100000041952 [0,2,0,0,0,0|1,1,0]=4 5927 B16R2.312 Nc1ccc(c(n1)Cl)Sc2ccccc2 62a_100000719477_100010270343 [0,2,0,0,0,0|1,1,0]=4 5928 B16R2.312 Nc1ccc(c(n1)Cl)Sc2ccccc2 62a_100010270343_100000041952 [0,2,0,0,0,0|1,1,0]=4 5929 B16R2.312 Nc1ccc(c(n1)F)Sc2ccccc2 62a_100000719477_100009882772 [0,2,0,0,0,0|1,1,0]=4 5930 B16R2.312 Nc1ccc(c(n1)F)Sc2ccccc2 62a_100009882772_100000041952 [0,2,0,0,0,0|1,1,0]=4 5931 B16R2.312 Nc1ccc(c(n1)N)Sc2ccccc2 62a_100011356871_100000041952 [0,2,0,0,0,0|1,1,0]=4 5932 B16R2.312 Nc1cnc(c(c1)F)Sc2ccccc2 62a_100000719477_100010280766 [0,2,0,0,0,0|1,1,0]=4 5933 B16R2.312 Nc1cnc(c(c1)F)Sc2ccccc2 62a_100010280766_100000041952 [0,2,0,0,0,0|1,1,0]=4 5934 B16R2.312 Nc1cnc(c(c1)N)Sc2ccccc2 62a_100000719477_200000093520 [0,2,0,0,0,0|1,1,0]=4 5935 B16R2.312 Nc1cnc(c(c1)N)Sc2ccccc2 62a_200000093520_100000041952 [0,2,0,0,0,0|1,1,0]=4 5936 B16R2.312 Nc1nc(ccc1Sc2ccccc2)Cl 62a_100000719477_100010171640 [0,2,0,0,0,0|1,1,0]=4 5937 B16R2.312 Nc1nc(ccc1Sc2ccccc2)Cl 62a_100010171640_100000041952 [0,2,0,0,0,0|1,1,0]=4 5938 B16R2.312 Nc1nc(ccc1Sc2ccccc2)F 62a_100000719477_100009854977 [0,2,0,0,0,0|1,1,0]=4 5939 B16R2.312 Nc1nc(ccc1Sc2ccccc2)F 62a_100009854977_100000041952 [0,2,0,0,0,0|1,1,0]=4 5940 B16R2.312 O=c1cc(c(c[nH]1)Sc2ccccc2)F 62a_100000719477_100015631685 [0,2,0,0,0,0|1,1,0]=4 5941 B16R2.312 O=c1cc(c(c[nH]1)Sc2ccccc2)F 62a_100015631685_100000041952 [0,2,0,0,0,0|1,1,0]=4 5942 B16R2.312 Oc1cc(ccc1Sc2ccccc2)Br 62a_100000719477_100012344904 [0,2,0,0,0,0|0,1,0]=3 5943 B16R2.312 Oc1cc(ccc1Sc2ccccc2)Br 62a_100012344904_100000041952 [0,2,0,0,0,0|0,1,0]=3 5944 B16R2.312 Oc1cc(ccc1Sc2ccccc2)Cl 62a_100000050036_100000041952 [0,2,0,0,0,0|0,1,0]=3 5945 B16R2.312 Oc1cc(ccc1Sc2ccccc2)Cl 62a_100000719477_100000050036 [0,2,0,0,0,0|0,1,0]=3 5946 B16R2.312 Oc1cc(ccc1Sc2ccccc2)F 62a_100000690578_100000041952 [0,2,0,0,0,0|0,1,0]=3 5947 B16R2.312 Oc1cc(ccc1Sc2ccccc2)F 62a_100000719477_100000690578 [0,2,0,0,0,0|0,1,0]=3 5948 B16R2.312 Oc1cc(ccc1Sc2ccccn2)Br 62a_100011216584_100012344904 [0,2,0,0,0,0|1,1,0]=4 5949 B16R2.312 Oc1cc(ccc1Sc2ccccn2)Br 62a_100012344904_100011216584 [0,2,0,0,0,0|1,1,0]=4 5950 B16R2.312 Oc1cc(ccc1Sc2ccccn2)Cl 62a_100000050036_100011216584 [0,2,0,0,0,0|1,1,0]=4 5951 B16R2.312 Oc1cc(ccc1Sc2ccccn2)Cl 62a_100011216584_100000050036 [0,2,0,0,0,0|1,1,0]=4 5952 B16R2.312 Oc1cc(ccc1Sc2ccccn2)F 62a_100000690578_100011216584 [0,2,0,0,0,0|1,1,0]=4 5953 B16R2.312 Oc1cc(ccc1Sc2ccccn2)F 62a_100011216584_100000690578 [0,2,0,0,0,0|1,1,0]=4 5954 B16R2.312 Oc1cc(ccc1Sc2cccnc2)Br 62a_100000210063_100012344904 [0,2,0,0,0,0|1,1,0]=4 5955 B16R2.312 Oc1cc(ccc1Sc2cccnc2)Br 62a_100012344904_100000210063 [0,2,0,0,0,0|1,1,0]=4 5956 B16R2.312 Oc1cc(ccc1Sc2cccnc2)Cl 62a_100000050036_100000210063 [0,2,0,0,0,0|1,1,0]=4 5957 B16R2.312 Oc1cc(ccc1Sc2cccnc2)Cl 62a_100000210063_100000050036 [0,2,0,0,0,0|1,1,0]=4 5958 B16R2.312 Oc1cc(ccc1Sc2cccnc2)F 62a_100000210063_100000690578 [0,2,0,0,0,0|1,1,0]=4 5959 B16R2.312 Oc1cc(ccc1Sc2cccnc2)F 62a_100000690578_100000210063 [0,2,0,0,0,0|1,1,0]=4 5960 B16R2.312 Oc1cc(ccc1Sc2ccncc2)Br 62a_100000728582_100012344904 [0,2,0,0,0,0|1,1,0]=4 5961 B16R2.312 Oc1cc(ccc1Sc2ccncc2)Br 62a_100012344904_100000728582 [0,2,0,0,0,0|1,1,0]=4 5962 B16R2.312 Oc1cc(ccc1Sc2ccncc2)Cl 62a_100000050036_100000728582 [0,2,0,0,0,0|1,1,0]=4 5963 B16R2.312 Oc1cc(ccc1Sc2ccncc2)Cl 62a_100000728582_100000050036 [0,2,0,0,0,0|1,1,0]=4 5964 B16R2.312 Oc1cc(ccc1Sc2ccncc2)F 62a_100000690578_100000728582 [0,2,0,0,0,0|1,1,0]=4 5965 B16R2.312 Oc1cc(ccc1Sc2ccncc2)F 62a_100000728582_100000690578 [0,2,0,0,0,0|1,1,0]=4 5966 B16R2.312 Oc1cc(cnc1Sc2ccccc2)Br 62a_100000719477_100010210634 [0,2,0,0,0,0|1,1,0]=4 5967 B16R2.312 Oc1cc(cnc1Sc2ccccc2)Br 62a_100010210634_100000041952 [0,2,0,0,0,0|1,1,0]=4 5968 B16R2.312 Oc1cc(cnc1Sc2ccccc2)Cl 62a_100000719477_100010233512 [0,2,0,0,0,0|1,1,0]=4 5969 B16R2.312 Oc1cc(cnc1Sc2ccccc2)Cl 62a_100010233512_100000041952 [0,2,0,0,0,0|1,1,0]=4 5970 B16R2.312 Oc1cc(cnc1Sc2ccccc2)F 62a_100000719477_100000079967 [0,2,0,0,0,0|1,1,0]=4 5971 B16R2.312 Oc1cc(cnc1Sc2ccccc2)F 62a_100009820119_100000041952 [0,2,0,0,0,0|1,1,0]=4 5972 B16R2.312 Oc1ccc(c(c1)Br)Sc2ccccc2 62a_100000701344_100000041952 [0,2,0,0,0,0|0,1,0]=3 5973 B16R2.312 Oc1ccc(c(c1)Br)Sc2ccccc2 62a_100000719477_100000701344 [0,2,0,0,0,0|0,1,0]=3 5974 B16R2.312 Oc1ccc(c(c1)Br)Sc2ccccn2 62a_100000701344_100011216584 [0,2,0,0,0,0|1,1,0]=4 5975 B16R2.312 Oc1ccc(c(c1)Br)Sc2ccccn2 62a_100011216584_100000701344 [0,2,0,0,0,0|1,1,0]=4 5976 B16R2.312 Oc1ccc(c(c1)Br)Sc2cccnc2 62a_100000210063_100000701344 [0,2,0,0,0,0|1,1,0]=4 5977 B16R2.312 Oc1ccc(c(c1)Br)Sc2cccnc2 62a_100000701344_100000210063 [0,2,0,0,0,0|1,1,0]=4 5978 B16R2.312 Oc1ccc(c(c1)Br)Sc2ccncc2 62a_100000701344_100000728582 [0,2,0,0,0,0|1,1,0]=4 5979 B16R2.312 Oc1ccc(c(c1)Br)Sc2ccncc2 62a_100000728582_100000701344 [0,2,0,0,0,0|1,1,0]=4 5980 B16R2.312 Oc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000047559_100000041952 [0,2,0,0,0,0|0,1,0]=3 5981 B16R2.312 Oc1ccc(c(c1)Cl)Sc2ccccc2 62a_100000719477_100000047559 [0,2,0,0,0,0|0,1,0]=3 5982 B16R2.312 Oc1ccc(c(c1)Cl)Sc2ccccn2 62a_100000047559_100011216584 [0,2,0,0,0,0|1,1,0]=4 5983 B16R2.312 Oc1ccc(c(c1)Cl)Sc2ccccn2 62a_100011216584_100000047559 [0,2,0,0,0,0|1,1,0]=4 5984 B16R2.312 Oc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000047559_100000210063 [0,2,0,0,0,0|1,1,0]=4 5985 B16R2.312 Oc1ccc(c(c1)Cl)Sc2cccnc2 62a_100000210063_100000047559 [0,2,0,0,0,0|1,1,0]=4 5986 B16R2.312 Oc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000047559_100000728582 [0,2,0,0,0,0|1,1,0]=4 5987 B16R2.312 Oc1ccc(c(c1)Cl)Sc2ccncc2 62a_100000728582_100000047559 [0,2,0,0,0,0|1,1,0]=4 5988 B16R2.312 Oc1ccc(c(c1)F)Sc2ccccc2 62a_100000719477_100000755031 [0,2,0,0,0,0|0,1,0]=3 5989 B16R2.312 Oc1ccc(c(c1)F)Sc2ccccc2 62a_100000755031_100000041952 [0,2,0,0,0,0|0,1,0]=3 5990 B16R2.312 Oc1ccc(c(c1)F)Sc2ccccn2 62a_100000755031_100011216584 [0,2,0,0,0,0|1,1,0]=4 5991 B16R2.312 Oc1ccc(c(c1)F)Sc2ccccn2 62a_100011216584_100000755031 [0,2,0,0,0,0|1,1,0]=4 5992 B16R2.312 Oc1ccc(c(c1)F)Sc2cccnc2 62a_100000210063_100000755031 [0,2,0,0,0,0|1,1,0]=4 5993 B16R2.312 Oc1ccc(c(c1)F)Sc2cccnc2 62a_100000755031_100000210063 [0,2,0,0,0,0|1,1,0]=4 5994 B16R2.312 Oc1ccc(c(c1)F)Sc2ccncc2 62a_100000728582_100000755031 [0,2,0,0,0,0|1,1,0]=4 5995 B16R2.312 Oc1ccc(c(c1)F)Sc2ccncc2 62a_100000755031_100000728582 [0,2,0,0,0,0|1,1,0]=4 5996 B16R2.312 Oc1ccc(c(c1)O)Sc2ccccc2 62a_100000719477_100009813921 [0,2,0,0,0,0|0,1,0]=3 5997 B16R2.312 Oc1ccc(c(c1)O)Sc2ccccn2 62a_100011216584_100009813921 [0,2,0,0,0,0|1,1,0]=4 5998 B16R2.312 Oc1ccc(c(c1)O)Sc2cccnc2 62a_100000210063_100009813921 [0,2,0,0,0,0|1,1,0]=4 5999 B16R2.312 Oc1ccc(c(c1)O)Sc2ccncc2 62a_100000728582_100009813921 [0,2,0,0,0,0|1,1,0]=4 6000 B16R2.312 Oc1ccc(c(n1)F)Sc2ccccc2 62a_100000719477_100009879308 [0,2,0,0,0,0|1,1,0]=4 6001 B16R2.312 Oc1ccc(c(n1)F)Sc2ccccc2 62a_100009879308_100000041952 [0,2,0,0,0,0|1,1,0]=4 6002 B16R2.312 Oc1cnc(c(c1)F)Sc2ccccc2 62a_100000719477_100000063512 [0,2,0,0,0,0|1,1,0]=4 6003 B16R2.312 [O-][n+]1cc(ccc1Sc2ccccc2)F 62a_100000719477_100009817261 [0,2,0,0,0,0|1,1,0]=4 6004 B16R2.312 [O-][n+]1cc(ccc1Sc2ccccc2)F 62a_100009817261_100000041952 [0,2,0,0,0,0|1,1,0]=4 6005 B16R2.1129 Brc1ccc(cc1)Nc2ccncc2Br 27a_100000210018_100000726257 [0,2,0,0,0,0|2,0,0]=4 6006 B16R2.1129 Brc1ccc(cc1)Nc2ncccc2Br 27a_100000210018_100000696092 [0,2,0,0,0,0|2,0,0]=4 6007 B16R2.1129 Brc1ccc(cc1)Sc2ccccc2Br 62a_100000695589_100000752885 [0,2,0,0,0,0|0,1,0]=3 6008 B16R2.1129 Brc1ccc(cc1)Sc2ccccc2Br 62a_100000752885_100000695589 [0,2,0,0,0,0|0,1,0]=3 6009 B16R2.1129 Brc1ccc(cc1)Sc2cccnc2Br 62a_100000752885_100010202626 [0,2,0,0,0,0|1,1,0]=4 6010 B16R2.1129 Brc1ccc(cc1)Sc2cccnc2Br 62a_100010202626_100000752885 [0,2,0,0,0,0|1,1,0]=4 6011 B16R2.1129 Brc1ccc(cc1)Sc2ccncc2Br 62a_100000726257_100000752885 [0,2,0,0,0,0|1,1,0]=4 6012 B16R2.1129 Brc1ccc(cc1)Sc2ccncc2Br 62a_100000752885_100000726257 [0,2,0,0,0,0|1,1,0]=4 6013 B16R2.1129 Brc1ccc(cc1)Sc2cnccc2Br 62a_100000752885_100010138639 [0,2,0,0,0,0|1,1,0]=4 6014 B16R2.1129 Brc1ccc(cc1)Sc2cnccc2Br 62a_100010138639_100000752885 [0,2,0,0,0,0|1,1,0]=4 6015 B16R2.1129 Brc1ccc(cc1)Sc2ncccc2Br 62a_100000696092_100000752885 [0,2,0,0,0,0|1,1,0]=4 6016 B16R2.1129 Brc1ccc(cc1)Sc2ncccc2Br 62a_100000752885_100000696092 [0,2,0,0,0,0|1,1,0]=4 6017 B16R2.1129 Brc1ccc(cn1)Sc2ccccc2Br 62a_100000695589_100009814638 [0,2,0,0,0,0|1,1,0]=4 6018 B16R2.1129 Brc1ccc(cn1)Sc2ccccc2Br 62a_100009814638_100000695589 [0,2,0,0,0,0|1,1,0]=4 6019 B16R2.1129 Brc1ccc(nc1)Nc2ccccc2I 27a_100000210053_100000686858 [0,2,0,0,0,0|2,0,0]=4 6020 B16R2.1129 Brc1ccc(nc1)Sc2ccccc2Br 62a_100000686858_100000695589 [0,2,0,0,0,0|1,1,0]=4 6021 B16R2.1129 Brc1ccc(nc1)Sc2ccccc2Br 62a_100000695589_100000686858 [0,2,0,0,0,0|1,1,0]=4 6022 B16R2.1129 Brc1cccnc1Nc2ccc(cc2)I 27a_100000185761_100000696092 [0,2,0,0,0,0|2,0,0]=4 6023 B16R2.1129 Brc1cnccc1Nc2ccc(cc2)I 27a_100000185761_100000726257 [0,2,0,0,0,0|2,0,0]=4 6024 B16R2.1129 C[n+]1ccccc1Sc2ccc(cc2)Br 62a_100000752885_100000212160 [0,2,0,0,0,0|1,1,0]=4 6025 B16R2.1129 C[n+]1ccccc1Sc2ccc(cc2)Cl 62a_100000755918_100000212160 [0,2,0,0,0,0|1,1,0]=4 6026 B16R2.1129 C[n+]1ccccc1Sc2ccc(cc2)F 62a_100000211213_100000212160 [0,2,0,0,0,0|1,1,0]=4 6027 B16R2.1129 C[n+]1ccccc1Sc2ccc(cc2)N 62a_100000185761_100000212160 [0,2,0,0,0,0|1,1,0]=4 6028 B16R2.1129 Cc1ccc(cc1)Nc2ccncc2Br 27a_100000124888_100000726257 [0,2,0,0,0,0|2,0,0]=4 6029 B16R2.1129 Cc1ccc(cc1)Nc2ccncc2C 27a_100000124888_100000765111 [0,2,0,0,0,0|2,0,0]=4 6030 B16R2.1129 Cc1ccc(cc1)Nc2ccncc2F 27a_100000124888_100000035921 [0,2,0,0,0,0|2,0,0]=4 6031 B16R2.1129 Cc1ccc(cc1)Nc2ncccc2Br 27a_100000124888_100000696092 [0,2,0,0,0,0|2,0,0]=4 6032 B16R2.1129 Cc1ccc(cc1)Sc2c[nH]ccc2=O 62a_100000186775_100009998708 [0,2,0,0,0,0|1,1,0]=4 6033 B16R2.1129 Cc1ccc(cc1)Sc2c[nH]ccc2=O 62a_100009998708_100000186775 [0,2,0,0,0,0|1,1,0]=4 6034 B16R2.1129 Cc1ccc(cc1)Sc2c[nH]ccc2=S 62a_100000186775_200012280681 [0,2,0,0,0,0|1,1,0]=4 6035 B16R2.1129 Cc1ccc(cc1)Sc2c[nH]ccc2=S 62a_200012280681_100000186775 [0,2,0,0,0,0|1,1,0]=4 6036 B16R2.1129 Cc1ccc(cc1)Sc2cccc[n+]2C 62a_100000186775_100000212160 [0,2,0,0,0,0|1,1,0]=4 6037 B16R2.1129 Cc1ccc(cc1)Sc2cccc[n+]2[O-] 62a_100000186775_200000042595 [0,2,0,0,0,0|1,1,0]=4 6038 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2Br 62a_100000186775_100000695589 [0,2,0,0,0,0|0,1,0]=3 6039 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2Br 62a_100000695589_100000186775 [0,2,0,0,0,0|0,1,0]=3 6040 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2C 62a_100000186775_100000210755 [0,2,0,0,0,0|0,1,0]=3 6041 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2C 62a_100000210755_100000186775 [0,2,0,0,0,0|0,1,0]=3 6042 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2Cl 62a_100000186775_100000764095 [0,2,0,0,0,0|0,1,0]=3 6043 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2Cl 62a_100000764095_100000186775 [0,2,0,0,0,0|0,1,0]=3 6044 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2F 62a_100000186775_100011215700 [0,2,0,0,0,0|0,1,0]=3 6045 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2F 62a_100011215700_100000186775 [0,2,0,0,0,0|0,1,0]=3 6046 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2N 62a_100000186775_100000210017 [0,2,0,0,0,0|0,1,0]=3 6047 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2N 62a_100000210017_100000186775 [0,2,0,0,0,0|0,1,0]=3 6048 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2O 62a_100000186775_100000739446 [0,2,0,0,0,0|0,1,0]=3 6049 B16R2.1129 Cc1ccc(cc1)Sc2ccccc2O 62a_100000739446_100000186775 [0,2,0,0,0,0|0,1,0]=3 6050 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2Br 62a_100000186775_100010202626 [0,2,0,0,0,0|1,1,0]=4 6051 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2Br 62a_100010202626_100000186775 [0,2,0,0,0,0|1,1,0]=4 6052 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2C 62a_100000186775_100000751574 [0,2,0,0,0,0|1,1,0]=4 6053 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2C 62a_100000751574_100000186775 [0,2,0,0,0,0|1,1,0]=4 6054 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2Cl 62a_100000036424_100000186775 [0,2,0,0,0,0|1,1,0]=4 6055 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2Cl 62a_100000186775_100000036424 [0,2,0,0,0,0|1,1,0]=4 6056 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2F 62a_100000186775_100009816115 [0,2,0,0,0,0|1,1,0]=4 6057 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2F 62a_100009816115_100000186775 [0,2,0,0,0,0|1,1,0]=4 6058 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2N 62a_100000045569_100000186775 [0,2,0,0,0,0|1,1,0]=4 6059 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2N 62a_100000186775_100000045569 [0,2,0,0,0,0|1,1,0]=4 6060 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2O 62a_100000186775_100000760158 [0,2,0,0,0,0|1,1,0]=4 6061 B16R2.1129 Cc1ccc(cc1)Sc2cccnc2O 62a_100000760158_100000186775 [0,2,0,0,0,0|1,1,0]=4 6062 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2Br 62a_100000186775_100000726257 [0,2,0,0,0,0|1,1,0]=4 6063 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2Br 62a_100000726257_100000186775 [0,2,0,0,0,0|1,1,0]=4 6064 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2C 62a_100000186775_100000765111 [0,2,0,0,0,0|1,1,0]=4 6065 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2C 62a_100000765111_100000186775 [0,2,0,0,0,0|1,1,0]=4 6066 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2Cl 62a_100000186775_100000708259 [0,2,0,0,0,0|1,1,0]=4 6067 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2Cl 62a_100000708259_100000186775 [0,2,0,0,0,0|1,1,0]=4 6068 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2F 62a_100000047030_100000186775 [0,2,0,0,0,0|1,1,0]=4 6069 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2F 62a_100000186775_100000047030 [0,2,0,0,0,0|1,1,0]=4 6070 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2N 62a_100000186775_100000756074 [0,2,0,0,0,0|1,1,0]=4 6071 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2N 62a_100000756074_100000186775 [0,2,0,0,0,0|1,1,0]=4 6072 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2O 62a_100000186775_100009817591 [0,2,0,0,0,0|1,1,0]=4 6073 B16R2.1129 Cc1ccc(cc1)Sc2ccncc2O 62a_100009817591_100000186775 [0,2,0,0,0,0|1,1,0]=4 6074 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2Br 62a_100000186775_100010138639 [0,2,0,0,0,0|1,1,0]=4 6075 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2Br 62a_100010138639_100000186775 [0,2,0,0,0,0|1,1,0]=4 6076 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2C 62a_100000186775_100000761580 [0,2,0,0,0,0|1,1,0]=4 6077 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2C 62a_100000761580_100000186775 [0,2,0,0,0,0|1,1,0]=4 6078 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2Cl 62a_100000186775_100009995489 [0,2,0,0,0,0|1,1,0]=4 6079 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2Cl 62a_100009995489_100000186775 [0,2,0,0,0,0|1,1,0]=4 6080 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2F 62a_100000186775_100009820683 [0,2,0,0,0,0|1,1,0]=4 6081 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2F 62a_100009820683_100000186775 [0,2,0,0,0,0|1,1,0]=4 6082 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2N 62a_100000047001_100000186775 [0,2,0,0,0,0|1,1,0]=4 6083 B16R2.1129 Cc1ccc(cc1)Sc2cnccc2N 62a_100000186775_100000047001 [0,2,0,0,0,0|1,1,0]=4 6084 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2Br 62a_100000186775_100000696092 [0,2,0,0,0,0|1,1,0]=4 6085 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2Br 62a_100000696092_100000186775 [0,2,0,0,0,0|1,1,0]=4 6086 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2C 62a_100000186775_100000751373 [0,2,0,0,0,0|1,1,0]=4 6087 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2C 62a_100000751373_100000186775 [0,2,0,0,0,0|1,1,0]=4 6088 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2Cl 62a_100000186775_100011356963 [0,2,0,0,0,0|1,1,0]=4 6089 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2Cl 62a_100011356963_100000186775 [0,2,0,0,0,0|1,1,0]=4 6090 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2F 62a_100000186775_100000685392 [0,2,0,0,0,0|1,1,0]=4 6091 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2F 62a_100000685392_100000186775 [0,2,0,0,0,0|1,1,0]=4 6092 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2N 62a_100000186775_100000688686 [0,2,0,0,0,0|1,1,0]=4 6093 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2N 62a_100000688686_100000186775 [0,2,0,0,0,0|1,1,0]=4 6094 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2O 62a_100000034122_100000186775 [0,2,0,0,0,0|1,1,0]=4 6095 B16R2.1129 Cc1ccc(cc1)Sc2ncccc2O 62a_100000186775_100000034122 [0,2,0,0,0,0|1,1,0]=4 6096 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2Br 62a_100000695589_100000751577 [0,2,0,0,0,0|1,1,0]=4 6097 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2Br 62a_100000751577_100000695589 [0,2,0,0,0,0|1,1,0]=4 6098 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2C 62a_100000210755_100000751577 [0,2,0,0,0,0|1,1,0]=4 6099 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2C 62a_100000751577_100000210755 [0,2,0,0,0,0|1,1,0]=4 6100 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2Cl 62a_100000751577_100000764095 [0,2,0,0,0,0|1,1,0]=4 6101 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2Cl 62a_100000764095_100000751577 [0,2,0,0,0,0|1,1,0]=4 6102 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2F 62a_100000751577_100011215700 [0,2,0,0,0,0|1,1,0]=4 6103 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2F 62a_100011215700_100000751577 [0,2,0,0,0,0|1,1,0]=4 6104 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2N 62a_100000210017_100000751577 [0,2,0,0,0,0|1,1,0]=4 6105 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2N 62a_100000751577_100000210017 [0,2,0,0,0,0|1,1,0]=4 6106 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2O 62a_100000739446_100000751577 [0,2,0,0,0,0|1,1,0]=4 6107 B16R2.1129 Cc1ccc(cn1)Sc2ccccc2O 62a_100000751577_100000739446 [0,2,0,0,0,0|1,1,0]=4 6108 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2Br 62a_100000695589_100000754016 [0,2,0,0,0,0|1,1,0]=4 6109 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2Br 62a_100011192072_100000695589 [0,2,0,0,0,0|1,1,0]=4 6110 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2C 62a_100000210755_100000754016 [0,2,0,0,0,0|1,1,0]=4 6111 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2C 62a_100011192072_100000210755 [0,2,0,0,0,0|1,1,0]=4 6112 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2Cl 62a_100000764095_100000754016 [0,2,0,0,0,0|1,1,0]=4 6113 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2Cl 62a_100011192072_100000764095 [0,2,0,0,0,0|1,1,0]=4 6114 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2F 62a_100011192072_100011215700 [0,2,0,0,0,0|1,1,0]=4 6115 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2F 62a_100011215700_100000754016 [0,2,0,0,0,0|1,1,0]=4 6116 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2N 62a_100000210017_100000754016 [0,2,0,0,0,0|1,1,0]=4 6117 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2N 62a_100011192072_100000210017 [0,2,0,0,0,0|1,1,0]=4 6118 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2O 62a_100000739446_100000754016 [0,2,0,0,0,0|1,1,0]=4 6119 B16R2.1129 Cc1ccc(nc1)Sc2ccccc2O 62a_100011192072_100000739446 [0,2,0,0,0,0|1,1,0]=4 6120 B16R2.1129 Cc1ccccc1Nc2ccc(cn2)Br 27a_100015192222_100000686858 [0,2,0,0,0,0|2,0,0]=4 6121 B16R2.1129 Cc1ccccc1Oc2ncc(cn2)O 271570a_203496583355_200011939430 [0,2,0,0,0,0|2,0,0]=4 6122 B16R2.1129 Cc1ccccc1Sc2cc[n+](cc2)[O-] 62a_100000210755_100000039755 [0,2,0,0,0,0|1,1,0]=4 6123 B16R2.1129 Cc1ccccc1Sc2ccc(=O)[nH]c2 62a_100000210755_100000212171 [0,2,0,0,0,0|1,1,0]=4 6124 B16R2.1129 Cc1ccccc1Sc2ccc(=O)[nH]c2 62a_100000212171_100000210755 [0,2,0,0,0,0|1,1,0]=4 6125 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)Br 62a_100000210755_100000752885 [0,2,0,0,0,0|0,1,0]=3 6126 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)Br 62a_100000752885_100000210755 [0,2,0,0,0,0|0,1,0]=3 6127 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)Cl 62a_100000210755_100000755918 [0,2,0,0,0,0|0,1,0]=3 6128 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)Cl 62a_100000755918_100000210755 [0,2,0,0,0,0|0,1,0]=3 6129 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)F 62a_100000210755_100000211213 [0,2,0,0,0,0|0,1,0]=3 6130 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)F 62a_100000211213_100000210755 [0,2,0,0,0,0|0,1,0]=3 6131 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)N 62a_100000185761_100000210755 [0,2,0,0,0,0|0,1,0]=3 6132 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)N 62a_100000210755_100000185761 [0,2,0,0,0,0|0,1,0]=3 6133 B16R2.1129 Cc1ccccc1Sc2ccc(cc2)O 62a_100000210755_100000185759 [0,2,0,0,0,0|0,1,0]=3 6134 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)Br 62a_100000210755_100000686858 [0,2,0,0,0,0|1,1,0]=4 6135 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)Br 62a_100000686858_100000210755 [0,2,0,0,0,0|1,1,0]=4 6136 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)Cl 62a_100000210755_100011356976 [0,2,0,0,0,0|1,1,0]=4 6137 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)Cl 62a_100011356976_100000210755 [0,2,0,0,0,0|1,1,0]=4 6138 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)F 62a_100000210755_100000744514 [0,2,0,0,0,0|1,1,0]=4 6139 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)F 62a_100000744514_100000210755 [0,2,0,0,0,0|1,1,0]=4 6140 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)N 62a_100000210755_100000737798 [0,2,0,0,0,0|1,1,0]=4 6141 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)N 62a_100000737798_100000210755 [0,2,0,0,0,0|1,1,0]=4 6142 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)O 62a_100000210755_100000744096 [0,2,0,0,0,0|1,1,0]=4 6143 B16R2.1129 Cc1ccccc1Sc2ccc(cn2)O 62a_100000685995_100000210755 [0,2,0,0,0,0|1,1,0]=4 6144 B16R2.1129 Cc1ccccc1Sc2ccc(nc2)Br 62a_100000210755_100009814638 [0,2,0,0,0,0|1,1,0]=4 6145 B16R2.1129 Cc1ccccc1Sc2ccc(nc2)Br 62a_100009814638_100000210755 [0,2,0,0,0,0|1,1,0]=4 6146 B16R2.1129 Cc1ccccc1Sc2ccc(nc2)Cl 62a_100000034144_100000210755 [0,2,0,0,0,0|1,1,0]=4 6147 B16R2.1129 Cc1ccccc1Sc2ccc(nc2)Cl 62a_100000210755_100000034144 [0,2,0,0,0,0|1,1,0]=4 6148 B16R2.1129 Cc1ccccc1Sc2ccc(nc2)F 62a_100000042367_100000210755 [0,2,0,0,0,0|1,1,0]=4 6149 B16R2.1129 Cc1ccccc1Sc2ccc(nc2)F 62a_100000210755_100000042367 [0,2,0,0,0,0|1,1,0]=4 6150 B16R2.1129 Cc1ccccc1Sc2ccc(nc2)N 62a_100000187370_100000210755 [0,2,0,0,0,0|1,1,0]=4 6151 B16R2.1129 Cc1ccccc1Sc2ccc(nc2)N 62a_100000210755_100000187370 [0,2,0,0,0,0|1,1,0]=4 6152 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)Br 62a_100000751373_100000752885 [0,2,0,0,0,0|1,1,0]=4 6153 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)Br 62a_100000752885_100000751373 [0,2,0,0,0,0|1,1,0]=4 6154 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)Cl 62a_100000751373_100000755918 [0,2,0,0,0,0|1,1,0]=4 6155 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)Cl 62a_100000755918_100000751373 [0,2,0,0,0,0|1,1,0]=4 6156 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)F 62a_100000211213_100000751373 [0,2,0,0,0,0|1,1,0]=4 6157 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)F 62a_100000751373_100000211213 [0,2,0,0,0,0|1,1,0]=4 6158 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)N 62a_100000185761_100000751373 [0,2,0,0,0,0|1,1,0]=4 6159 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)N 62a_100000751373_100000185761 [0,2,0,0,0,0|1,1,0]=4 6160 B16R2.1129 Cc1cccnc1Sc2ccc(cc2)O 62a_100000751373_100000185759 [0,2,0,0,0,0|1,1,0]=4 6161 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)Br 62a_100000752885_100000761580 [0,2,0,0,0,0|1,1,0]=4 6162 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)Br 62a_100000761580_100000752885 [0,2,0,0,0,0|1,1,0]=4 6163 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)Cl 62a_100000755918_100000761580 [0,2,0,0,0,0|1,1,0]=4 6164 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)Cl 62a_100000761580_100000755918 [0,2,0,0,0,0|1,1,0]=4 6165 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)F 62a_100000211213_100000761580 [0,2,0,0,0,0|1,1,0]=4 6166 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)F 62a_100000761580_100000211213 [0,2,0,0,0,0|1,1,0]=4 6167 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)N 62a_100000185761_100000761580 [0,2,0,0,0,0|1,1,0]=4 6168 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)N 62a_100000761580_100000185761 [0,2,0,0,0,0|1,1,0]=4 6169 B16R2.1129 Cc1ccncc1Sc2ccc(cc2)O 62a_100000761580_100000185759 [0,2,0,0,0,0|1,1,0]=4 6170 B16R2.1129 Cc1cnccc1Nc2ccc(cc2)Br 27a_100000210018_100000765111 [0,2,0,0,0,0|2,0,0]=4 6171 B16R2.1129 Cc1cnccc1Nc2ccc(cc2)Cl 27a_100000210052_100000765111 [0,2,0,0,0,0|2,0,0]=4 6172 B16R2.1129 Cc1cnccc1Nc2ccc(cc2)F 27a_100000185862_100000765111 [0,2,0,0,0,0|2,0,0]=4 6173 B16R2.1129 Cc1cnccc1Nc2ccc(cc2)I 27a_100000185761_100000765111 [0,2,0,0,0,0|2,0,0]=4 6174 B16R2.1129 Cc1cnccc1Nc2ccc(cc2)O 27a_100000185829_100000765111 [0,2,0,0,0,0|2,0,0]=4 6175 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)Br 62a_100000752885_100000765111 [0,2,0,0,0,0|1,1,0]=4 6176 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)Br 62a_100000765111_100000752885 [0,2,0,0,0,0|1,1,0]=4 6177 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)Cl 62a_100000755918_100000765111 [0,2,0,0,0,0|1,1,0]=4 6178 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)Cl 62a_100000765111_100000755918 [0,2,0,0,0,0|1,1,0]=4 6179 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)F 62a_100000211213_100000765111 [0,2,0,0,0,0|1,1,0]=4 6180 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)F 62a_100000765111_100000211213 [0,2,0,0,0,0|1,1,0]=4 6181 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)N 62a_100000185761_100000765111 [0,2,0,0,0,0|1,1,0]=4 6182 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)N 62a_100000765111_100000185761 [0,2,0,0,0,0|1,1,0]=4 6183 B16R2.1129 Cc1cnccc1Sc2ccc(cc2)O 62a_100000765111_100000185759 [0,2,0,0,0,0|1,1,0]=4 6184 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)Br 62a_100000751574_100000752885 [0,2,0,0,0,0|1,1,0]=4 6185 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)Br 62a_100000752885_100000751574 [0,2,0,0,0,0|1,1,0]=4 6186 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)Cl 62a_100000751574_100000755918 [0,2,0,0,0,0|1,1,0]=4 6187 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)Cl 62a_100000755918_100000751574 [0,2,0,0,0,0|1,1,0]=4 6188 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)F 62a_100000211213_100000751574 [0,2,0,0,0,0|1,1,0]=4 6189 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)F 62a_100000751574_100000211213 [0,2,0,0,0,0|1,1,0]=4 6190 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)N 62a_100000185761_100000751574 [0,2,0,0,0,0|1,1,0]=4 6191 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)N 62a_100000751574_100000185761 [0,2,0,0,0,0|1,1,0]=4 6192 B16R2.1129 Cc1ncccc1Sc2ccc(cc2)O 62a_100000751574_100000185759 [0,2,0,0,0,0|1,1,0]=4 6193 B16R2.1129 Clc1ccc(cc1)Nc2ccncc2Br 27a_100000210052_100000726257 [0,2,0,0,0,0|2,0,0]=4 6194 B16R2.1129 Clc1ccc(cc1)Nc2ncccc2Br 27a_100000210052_100000696092 [0,2,0,0,0,0|2,0,0]=4 6195 B16R2.1129 Clc1ccc(cc1)Sc2ccccc2Br 62a_100000695589_100000755918 [0,2,0,0,0,0|0,1,0]=3 6196 B16R2.1129 Clc1ccc(cc1)Sc2ccccc2Br 62a_100000755918_100000695589 [0,2,0,0,0,0|0,1,0]=3 6197 B16R2.1129 Clc1ccc(cc1)Sc2ccccc2Cl 62a_100000755918_100000764095 [0,2,0,0,0,0|0,1,0]=3 6198 B16R2.1129 Clc1ccc(cc1)Sc2ccccc2Cl 62a_100000764095_100000755918 [0,2,0,0,0,0|0,1,0]=3 6199 B16R2.1129 Clc1ccc(cc1)Sc2cccnc2Br 62a_100000755918_100010202626 [0,2,0,0,0,0|1,1,0]=4 6200 B16R2.1129 Clc1ccc(cc1)Sc2cccnc2Br 62a_100010202626_100000755918 [0,2,0,0,0,0|1,1,0]=4 6201 B16R2.1129 Clc1ccc(cc1)Sc2cccnc2Cl 62a_100000036424_100000755918 [0,2,0,0,0,0|1,1,0]=4 6202 B16R2.1129 Clc1ccc(cc1)Sc2cccnc2Cl 62a_100000755918_100000036424 [0,2,0,0,0,0|1,1,0]=4 6203 B16R2.1129 Clc1ccc(cc1)Sc2ccncc2Br 62a_100000726257_100000755918 [0,2,0,0,0,0|1,1,0]=4 6204 B16R2.1129 Clc1ccc(cc1)Sc2ccncc2Br 62a_100000755918_100000726257 [0,2,0,0,0,0|1,1,0]=4 6205 B16R2.1129 Clc1ccc(cc1)Sc2ccncc2Cl 62a_100000708259_100000755918 [0,2,0,0,0,0|1,1,0]=4 6206 B16R2.1129 Clc1ccc(cc1)Sc2ccncc2Cl 62a_100000755918_100000708259 [0,2,0,0,0,0|1,1,0]=4 6207 B16R2.1129 Clc1ccc(cc1)Sc2cnccc2Br 62a_100000755918_100010138639 [0,2,0,0,0,0|1,1,0]=4 6208 B16R2.1129 Clc1ccc(cc1)Sc2cnccc2Br 62a_100010138639_100000755918 [0,2,0,0,0,0|1,1,0]=4 6209 B16R2.1129 Clc1ccc(cc1)Sc2cnccc2Cl 62a_100000755918_100009995489 [0,2,0,0,0,0|1,1,0]=4 6210 B16R2.1129 Clc1ccc(cc1)Sc2cnccc2Cl 62a_100009995489_100000755918 [0,2,0,0,0,0|1,1,0]=4 6211 B16R2.1129 Clc1ccc(cc1)Sc2ncccc2Br 62a_100000696092_100000755918 [0,2,0,0,0,0|1,1,0]=4 6212 B16R2.1129 Clc1ccc(cc1)Sc2ncccc2Br 62a_100000755918_100000696092 [0,2,0,0,0,0|1,1,0]=4 6213 B16R2.1129 Clc1ccc(cc1)Sc2ncccc2Cl 62a_100000755918_100011356963 [0,2,0,0,0,0|1,1,0]=4 6214 B16R2.1129 Clc1ccc(cc1)Sc2ncccc2Cl 62a_100011356963_100000755918 [0,2,0,0,0,0|1,1,0]=4 6215 B16R2.1129 Clc1ccc(cn1)Sc2ccccc2Br 62a_100000034144_100000695589 [0,2,0,0,0,0|1,1,0]=4 6216 B16R2.1129 Clc1ccc(cn1)Sc2ccccc2Br 62a_100000695589_100000034144 [0,2,0,0,0,0|1,1,0]=4 6217 B16R2.1129 Clc1ccc(cn1)Sc2ccccc2Cl 62a_100000034144_100000764095 [0,2,0,0,0,0|1,1,0]=4 6218 B16R2.1129 Clc1ccc(cn1)Sc2ccccc2Cl 62a_100000764095_100000034144 [0,2,0,0,0,0|1,1,0]=4 6219 B16R2.1129 Clc1ccc(nc1)Sc2ccccc2Br 62a_100000695589_100011356976 [0,2,0,0,0,0|1,1,0]=4 6220 B16R2.1129 Clc1ccc(nc1)Sc2ccccc2Br 62a_100011356976_100000695589 [0,2,0,0,0,0|1,1,0]=4 6221 B16R2.1129 Clc1ccc(nc1)Sc2ccccc2Cl 62a_100000764095_100011356976 [0,2,0,0,0,0|1,1,0]=4 6222 B16R2.1129 Clc1ccc(nc1)Sc2ccccc2Cl 62a_100011356976_100000764095 [0,2,0,0,0,0|1,1,0]=4 6223 B16R2.1129 Clc1ccccc1Nc2ccc(cn2)Br 27a_100000185783_100000686858 [0,2,0,0,0,0|2,0,0]=4 6224 B16R2.1129 Clc1ccccc1Sc2ccc(cc2)Br 62a_100000752885_100000764095 [0,2,0,0,0,0|0,1,0]=3 6225 B16R2.1129 Clc1ccccc1Sc2ccc(cc2)Br 62a_100000764095_100000752885 [0,2,0,0,0,0|0,1,0]=3 6226 B16R2.1129 Clc1ccccc1Sc2ccc(cn2)Br 62a_100000686858_100000764095 [0,2,0,0,0,0|1,1,0]=4 6227 B16R2.1129 Clc1ccccc1Sc2ccc(cn2)Br 62a_100000764095_100000686858 [0,2,0,0,0,0|1,1,0]=4 6228 B16R2.1129 Clc1ccccc1Sc2ccc(nc2)Br 62a_100000764095_100009814638 [0,2,0,0,0,0|1,1,0]=4 6229 B16R2.1129 Clc1ccccc1Sc2ccc(nc2)Br 62a_100009814638_100000764095 [0,2,0,0,0,0|1,1,0]=4 6230 B16R2.1129 Clc1cccnc1Sc2ccc(cc2)Br 62a_100000752885_100011356963 [0,2,0,0,0,0|1,1,0]=4 6231 B16R2.1129 Clc1cccnc1Sc2ccc(cc2)Br 62a_100011356963_100000752885 [0,2,0,0,0,0|1,1,0]=4 6232 B16R2.1129 Clc1ccncc1Sc2ccc(cc2)Br 62a_100000752885_100009995489 [0,2,0,0,0,0|1,1,0]=4 6233 B16R2.1129 Clc1ccncc1Sc2ccc(cc2)Br 62a_100009995489_100000752885 [0,2,0,0,0,0|1,1,0]=4 6234 B16R2.1129 Clc1cnccc1Sc2ccc(cc2)Br 62a_100000708259_100000752885 [0,2,0,0,0,0|1,1,0]=4 6235 B16R2.1129 Clc1cnccc1Sc2ccc(cc2)Br 62a_100000752885_100000708259 [0,2,0,0,0,0|1,1,0]=4 6236 B16R2.1129 Clc1ncccc1Sc2ccc(cc2)Br 62a_100000036424_100000752885 [0,2,0,0,0,0|1,1,0]=4 6237 B16R2.1129 Clc1ncccc1Sc2ccc(cc2)Br 62a_100000752885_100000036424 [0,2,0,0,0,0|1,1,0]=4 6238 B16R2.1129 Fc1ccc(cc1)Nc2ccncc2Br 27a_100000185862_100000726257 [0,2,0,0,0,0|2,0,0]=4 6239 B16R2.1129 Fc1ccc(cc1)Nc2ccncc2F 27a_100000185862_100000035921 [0,2,0,0,0,0|2,0,0]=4 6240 B16R2.1129 Fc1ccc(cc1)Nc2ncccc2Br 27a_100000185862_100000696092 [0,2,0,0,0,0|2,0,0]=4 6241 B16R2.1129 Fc1ccc(cc1)Sc2c[nH]ccc2=S 62a_100000211213_200012280681 [0,2,0,0,0,0|1,1,0]=4 6242 B16R2.1129 Fc1ccc(cc1)Sc2c[nH]ccc2=S 62a_200012280681_100000211213 [0,2,0,0,0,0|1,1,0]=4 6243 B16R2.1129 Fc1ccc(cc1)Sc2ccccc2Br 62a_100000211213_100000695589 [0,2,0,0,0,0|0,1,0]=3 6244 B16R2.1129 Fc1ccc(cc1)Sc2ccccc2Br 62a_100000695589_100000211213 [0,2,0,0,0,0|0,1,0]=3 6245 B16R2.1129 Fc1ccc(cc1)Sc2ccccc2Cl 62a_100000211213_100000764095 [0,2,0,0,0,0|0,1,0]=3 6246 B16R2.1129 Fc1ccc(cc1)Sc2ccccc2Cl 62a_100000764095_100000211213 [0,2,0,0,0,0|0,1,0]=3 6247 B16R2.1129 Fc1ccc(cc1)Sc2ccccc2F 62a_100000211213_100011215700 [0,2,0,0,0,0|0,1,0]=3 6248 B16R2.1129 Fc1ccc(cc1)Sc2ccccc2F 62a_100011215700_100000211213 [0,2,0,0,0,0|0,1,0]=3 6249 B16R2.1129 Fc1ccc(cc1)Sc2cccnc2Br 62a_100000211213_100010202626 [0,2,0,0,0,0|1,1,0]=4 6250 B16R2.1129 Fc1ccc(cc1)Sc2cccnc2Br 62a_100010202626_100000211213 [0,2,0,0,0,0|1,1,0]=4 6251 B16R2.1129 Fc1ccc(cc1)Sc2cccnc2Cl 62a_100000036424_100000211213 [0,2,0,0,0,0|1,1,0]=4 6252 B16R2.1129 Fc1ccc(cc1)Sc2cccnc2Cl 62a_100000211213_100000036424 [0,2,0,0,0,0|1,1,0]=4 6253 B16R2.1129 Fc1ccc(cc1)Sc2cccnc2F 62a_100000211213_100009816115 [0,2,0,0,0,0|1,1,0]=4 6254 B16R2.1129 Fc1ccc(cc1)Sc2cccnc2F 62a_100009816115_100000211213 [0,2,0,0,0,0|1,1,0]=4 6255 B16R2.1129 Fc1ccc(cc1)Sc2ccncc2Br 62a_100000211213_100000726257 [0,2,0,0,0,0|1,1,0]=4 6256 B16R2.1129 Fc1ccc(cc1)Sc2ccncc2Br 62a_100000726257_100000211213 [0,2,0,0,0,0|1,1,0]=4 6257 B16R2.1129 Fc1ccc(cc1)Sc2ccncc2Cl 62a_100000211213_100000708259 [0,2,0,0,0,0|1,1,0]=4 6258 B16R2.1129 Fc1ccc(cc1)Sc2ccncc2Cl 62a_100000708259_100000211213 [0,2,0,0,0,0|1,1,0]=4 6259 B16R2.1129 Fc1ccc(cc1)Sc2ccncc2F 62a_100000047030_100000211213 [0,2,0,0,0,0|1,1,0]=4 6260 B16R2.1129 Fc1ccc(cc1)Sc2ccncc2F 62a_100000211213_100000047030 [0,2,0,0,0,0|1,1,0]=4 6261 B16R2.1129 Fc1ccc(cc1)Sc2cnccc2Br 62a_100000211213_100010138639 [0,2,0,0,0,0|1,1,0]=4 6262 B16R2.1129 Fc1ccc(cc1)Sc2cnccc2Br 62a_100010138639_100000211213 [0,2,0,0,0,0|1,1,0]=4 6263 B16R2.1129 Fc1ccc(cc1)Sc2cnccc2Cl 62a_100000211213_100009995489 [0,2,0,0,0,0|1,1,0]=4 6264 B16R2.1129 Fc1ccc(cc1)Sc2cnccc2Cl 62a_100009995489_100000211213 [0,2,0,0,0,0|1,1,0]=4 6265 B16R2.1129 Fc1ccc(cc1)Sc2cnccc2F 62a_100000211213_100009820683 [0,2,0,0,0,0|1,1,0]=4 6266 B16R2.1129 Fc1ccc(cc1)Sc2cnccc2F 62a_100009820683_100000211213 [0,2,0,0,0,0|1,1,0]=4 6267 B16R2.1129 Fc1ccc(cc1)Sc2ncccc2Br 62a_100000211213_100000696092 [0,2,0,0,0,0|1,1,0]=4 6268 B16R2.1129 Fc1ccc(cc1)Sc2ncccc2Br 62a_100000696092_100000211213 [0,2,0,0,0,0|1,1,0]=4 6269 B16R2.1129 Fc1ccc(cc1)Sc2ncccc2Cl 62a_100000211213_100011356963 [0,2,0,0,0,0|1,1,0]=4 6270 B16R2.1129 Fc1ccc(cc1)Sc2ncccc2Cl 62a_100011356963_100000211213 [0,2,0,0,0,0|1,1,0]=4 6271 B16R2.1129 Fc1ccc(cc1)Sc2ncccc2F 62a_100000211213_100000685392 [0,2,0,0,0,0|1,1,0]=4 6272 B16R2.1129 Fc1ccc(cc1)Sc2ncccc2F 62a_100000685392_100000211213 [0,2,0,0,0,0|1,1,0]=4 6273 B16R2.1129 Fc1ccc(cn1)Sc2ccccc2Br 62a_100000042367_100000695589 [0,2,0,0,0,0|1,1,0]=4 6274 B16R2.1129 Fc1ccc(cn1)Sc2ccccc2Br 62a_100000695589_100000042367 [0,2,0,0,0,0|1,1,0]=4 6275 B16R2.1129 Fc1ccc(cn1)Sc2ccccc2Cl 62a_100000042367_100000764095 [0,2,0,0,0,0|1,1,0]=4 6276 B16R2.1129 Fc1ccc(cn1)Sc2ccccc2Cl 62a_100000764095_100000042367 [0,2,0,0,0,0|1,1,0]=4 6277 B16R2.1129 Fc1ccc(cn1)Sc2ccccc2F 62a_100000042367_100011215700 [0,2,0,0,0,0|1,1,0]=4 6278 B16R2.1129 Fc1ccc(cn1)Sc2ccccc2F 62a_100011215700_100000042367 [0,2,0,0,0,0|1,1,0]=4 6279 B16R2.1129 Fc1ccc(nc1)Sc2ccccc2Br 62a_100000695589_100000744514 [0,2,0,0,0,0|1,1,0]=4 6280 B16R2.1129 Fc1ccc(nc1)Sc2ccccc2Br 62a_100000744514_100000695589 [0,2,0,0,0,0|1,1,0]=4 6281 B16R2.1129 Fc1ccc(nc1)Sc2ccccc2Cl 62a_100000744514_100000764095 [0,2,0,0,0,0|1,1,0]=4 6282 B16R2.1129 Fc1ccc(nc1)Sc2ccccc2Cl 62a_100000764095_100000744514 [0,2,0,0,0,0|1,1,0]=4 6283 B16R2.1129 Fc1ccc(nc1)Sc2ccccc2F 62a_100000744514_100011215700 [0,2,0,0,0,0|1,1,0]=4 6284 B16R2.1129 Fc1ccc(nc1)Sc2ccccc2F 62a_100011215700_100000744514 [0,2,0,0,0,0|1,1,0]=4 6285 B16R2.1129 Fc1ccccc1Nc2ccc(cn2)Br 27a_100000210422_100000686858 [0,2,0,0,0,0|2,0,0]=4 6286 B16R2.1129 Fc1ccccc1Sc2ccc(cc2)Br 62a_100000752885_100011215700 [0,2,0,0,0,0|0,1,0]=3 6287 B16R2.1129 Fc1ccccc1Sc2ccc(cc2)Br 62a_100011215700_100000752885 [0,2,0,0,0,0|0,1,0]=3 6288 B16R2.1129 Fc1ccccc1Sc2ccc(cc2)Cl 62a_100000755918_100011215700 [0,2,0,0,0,0|0,1,0]=3 6289 B16R2.1129 Fc1ccccc1Sc2ccc(cc2)Cl 62a_100011215700_100000755918 [0,2,0,0,0,0|0,1,0]=3 6290 B16R2.1129 Fc1ccccc1Sc2ccc(cn2)Br 62a_100000686858_100011215700 [0,2,0,0,0,0|1,1,0]=4 6291 B16R2.1129 Fc1ccccc1Sc2ccc(cn2)Br 62a_100011215700_100000686858 [0,2,0,0,0,0|1,1,0]=4 6292 B16R2.1129 Fc1ccccc1Sc2ccc(cn2)Cl 62a_100011215700_100011356976 [0,2,0,0,0,0|1,1,0]=4 6293 B16R2.1129 Fc1ccccc1Sc2ccc(cn2)Cl 62a_100011356976_100011215700 [0,2,0,0,0,0|1,1,0]=4 6294 B16R2.1129 Fc1ccccc1Sc2ccc(nc2)Br 62a_100009814638_100011215700 [0,2,0,0,0,0|1,1,0]=4 6295 B16R2.1129 Fc1ccccc1Sc2ccc(nc2)Br 62a_100011215700_100009814638 [0,2,0,0,0,0|1,1,0]=4 6296 B16R2.1129 Fc1ccccc1Sc2ccc(nc2)Cl 62a_100000034144_100011215700 [0,2,0,0,0,0|1,1,0]=4 6297 B16R2.1129 Fc1ccccc1Sc2ccc(nc2)Cl 62a_100011215700_100000034144 [0,2,0,0,0,0|1,1,0]=4 6298 B16R2.1129 Fc1cccnc1Sc2ccc(cc2)Br 62a_100000685392_100000752885 [0,2,0,0,0,0|1,1,0]=4 6299 B16R2.1129 Fc1cccnc1Sc2ccc(cc2)Br 62a_100000752885_100000685392 [0,2,0,0,0,0|1,1,0]=4 6300 B16R2.1129 Fc1cccnc1Sc2ccc(cc2)Cl 62a_100000685392_100000755918 [0,2,0,0,0,0|1,1,0]=4 6301 B16R2.1129 Fc1cccnc1Sc2ccc(cc2)Cl 62a_100000755918_100000685392 [0,2,0,0,0,0|1,1,0]=4 6302 B16R2.1129 Fc1ccncc1Sc2ccc(cc2)Br 62a_100000752885_100009820683 [0,2,0,0,0,0|1,1,0]=4 6303 B16R2.1129 Fc1ccncc1Sc2ccc(cc2)Br 62a_100009820683_100000752885 [0,2,0,0,0,0|1,1,0]=4 6304 B16R2.1129 Fc1ccncc1Sc2ccc(cc2)Cl 62a_100000755918_100009820683 [0,2,0,0,0,0|1,1,0]=4 6305 B16R2.1129 Fc1ccncc1Sc2ccc(cc2)Cl 62a_100009820683_100000755918 [0,2,0,0,0,0|1,1,0]=4 6306 B16R2.1129 Fc1cnccc1Nc2ccc(cc2)Br 27a_100000210018_100000035921 [0,2,0,0,0,0|2,0,0]=4 6307 B16R2.1129 Fc1cnccc1Nc2ccc(cc2)Cl 27a_100000210052_100000035921 [0,2,0,0,0,0|2,0,0]=4 6308 B16R2.1129 Fc1cnccc1Nc2ccc(cc2)I 27a_100000185761_100000035921 [0,2,0,0,0,0|2,0,0]=4 6309 B16R2.1129 Fc1cnccc1Sc2ccc(cc2)Br 62a_100000047030_100000752885 [0,2,0,0,0,0|1,1,0]=4 6310 B16R2.1129 Fc1cnccc1Sc2ccc(cc2)Br 62a_100000752885_100000047030 [0,2,0,0,0,0|1,1,0]=4 6311 B16R2.1129 Fc1cnccc1Sc2ccc(cc2)Cl 62a_100000047030_100000755918 [0,2,0,0,0,0|1,1,0]=4 6312 B16R2.1129 Fc1cnccc1Sc2ccc(cc2)Cl 62a_100000755918_100000047030 [0,2,0,0,0,0|1,1,0]=4 6313 B16R2.1129 Fc1ncccc1Sc2ccc(cc2)Br 62a_100000752885_100009816115 [0,2,0,0,0,0|1,1,0]=4 6314 B16R2.1129 Fc1ncccc1Sc2ccc(cc2)Br 62a_100009816115_100000752885 [0,2,0,0,0,0|1,1,0]=4 6315 B16R2.1129 Fc1ncccc1Sc2ccc(cc2)Cl 62a_100000755918_100009816115 [0,2,0,0,0,0|1,1,0]=4 6316 B16R2.1129 Fc1ncccc1Sc2ccc(cc2)Cl 62a_100009816115_100000755918 [0,2,0,0,0,0|1,1,0]=4 6317 B16R2.1129 Nc1ccc(cc1)Sc2c[nH]ccc2=O 62a_100000185761_100009998708 [0,2,0,0,0,0|1,1,0]=4 6318 B16R2.1129 Nc1ccc(cc1)Sc2c[nH]ccc2=O 62a_100009998708_100000185761 [0,2,0,0,0,0|1,1,0]=4 6319 B16R2.1129 Nc1ccc(cc1)Sc2c[nH]ccc2=S 62a_100000185761_200012280681 [0,2,0,0,0,0|1,1,0]=4 6320 B16R2.1129 Nc1ccc(cc1)Sc2c[nH]ccc2=S 62a_200012280681_100000185761 [0,2,0,0,0,0|1,1,0]=4 6321 B16R2.1129 Nc1ccc(cc1)Sc2cccc[n+]2[O-] 62a_100000185761_200000042595 [0,2,0,0,0,0|1,1,0]=4 6322 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2Br 62a_100000185761_100000695589 [0,2,0,0,0,0|0,1,0]=3 6323 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2Br 62a_100000695589_100000185761 [0,2,0,0,0,0|0,1,0]=3 6324 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2Cl 62a_100000185761_100000764095 [0,2,0,0,0,0|0,1,0]=3 6325 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2Cl 62a_100000764095_100000185761 [0,2,0,0,0,0|0,1,0]=3 6326 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2F 62a_100000185761_100011215700 [0,2,0,0,0,0|0,1,0]=3 6327 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2F 62a_100011215700_100000185761 [0,2,0,0,0,0|0,1,0]=3 6328 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2N 62a_100000185761_100000210017 [0,2,0,0,0,0|0,1,0]=3 6329 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2N 62a_100000210017_100000185761 [0,2,0,0,0,0|0,1,0]=3 6330 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2O 62a_100000185761_100000739446 [0,2,0,0,0,0|0,1,0]=3 6331 B16R2.1129 Nc1ccc(cc1)Sc2ccccc2O 62a_100000739446_100000185761 [0,2,0,0,0,0|0,1,0]=3 6332 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2Br 62a_100000185761_100010202626 [0,2,0,0,0,0|1,1,0]=4 6333 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2Br 62a_100010202626_100000185761 [0,2,0,0,0,0|1,1,0]=4 6334 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2Cl 62a_100000036424_100000185761 [0,2,0,0,0,0|1,1,0]=4 6335 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2Cl 62a_100000185761_100000036424 [0,2,0,0,0,0|1,1,0]=4 6336 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2F 62a_100000185761_100009816115 [0,2,0,0,0,0|1,1,0]=4 6337 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2F 62a_100009816115_100000185761 [0,2,0,0,0,0|1,1,0]=4 6338 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2N 62a_100000045569_100000185761 [0,2,0,0,0,0|1,1,0]=4 6339 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2N 62a_100000185761_100000045569 [0,2,0,0,0,0|1,1,0]=4 6340 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2O 62a_100000185761_100000760158 [0,2,0,0,0,0|1,1,0]=4 6341 B16R2.1129 Nc1ccc(cc1)Sc2cccnc2O 62a_100000760158_100000185761 [0,2,0,0,0,0|1,1,0]=4 6342 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2Br 62a_100000185761_100000726257 [0,2,0,0,0,0|1,1,0]=4 6343 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2Br 62a_100000726257_100000185761 [0,2,0,0,0,0|1,1,0]=4 6344 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2Cl 62a_100000185761_100000708259 [0,2,0,0,0,0|1,1,0]=4 6345 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2Cl 62a_100000708259_100000185761 [0,2,0,0,0,0|1,1,0]=4 6346 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2F 62a_100000047030_100000185761 [0,2,0,0,0,0|1,1,0]=4 6347 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2F 62a_100000185761_100000047030 [0,2,0,0,0,0|1,1,0]=4 6348 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2N 62a_100000185761_100000756074 [0,2,0,0,0,0|1,1,0]=4 6349 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2N 62a_100000756074_100000185761 [0,2,0,0,0,0|1,1,0]=4 6350 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2O 62a_100000185761_100009817591 [0,2,0,0,0,0|1,1,0]=4 6351 B16R2.1129 Nc1ccc(cc1)Sc2ccncc2O 62a_100009817591_100000185761 [0,2,0,0,0,0|1,1,0]=4 6352 B16R2.1129 Nc1ccc(cc1)Sc2cnccc2Br 62a_100000185761_100010138639 [0,2,0,0,0,0|1,1,0]=4 6353 B16R2.1129 Nc1ccc(cc1)Sc2cnccc2Br 62a_100010138639_100000185761 [0,2,0,0,0,0|1,1,0]=4 6354 B16R2.1129 Nc1ccc(cc1)Sc2cnccc2Cl 62a_100000185761_100009995489 [0,2,0,0,0,0|1,1,0]=4 6355 B16R2.1129 Nc1ccc(cc1)Sc2cnccc2Cl 62a_100009995489_100000185761 [0,2,0,0,0,0|1,1,0]=4 6356 B16R2.1129 Nc1ccc(cc1)Sc2cnccc2F 62a_100000185761_100009820683 [0,2,0,0,0,0|1,1,0]=4 6357 B16R2.1129 Nc1ccc(cc1)Sc2cnccc2F 62a_100009820683_100000185761 [0,2,0,0,0,0|1,1,0]=4 6358 B16R2.1129 Nc1ccc(cc1)Sc2cnccc2N 62a_100000047001_100000185761 [0,2,0,0,0,0|1,1,0]=4 6359 B16R2.1129 Nc1ccc(cc1)Sc2cnccc2N 62a_100000185761_100000047001 [0,2,0,0,0,0|1,1,0]=4 6360 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2Br 62a_100000185761_100000696092 [0,2,0,0,0,0|1,1,0]=4 6361 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2Br 62a_100000696092_100000185761 [0,2,0,0,0,0|1,1,0]=4 6362 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2Cl 62a_100000185761_100011356963 [0,2,0,0,0,0|1,1,0]=4 6363 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2Cl 62a_100011356963_100000185761 [0,2,0,0,0,0|1,1,0]=4 6364 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2F 62a_100000185761_100000685392 [0,2,0,0,0,0|1,1,0]=4 6365 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2F 62a_100000685392_100000185761 [0,2,0,0,0,0|1,1,0]=4 6366 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2N 62a_100000185761_100000688686 [0,2,0,0,0,0|1,1,0]=4 6367 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2N 62a_100000688686_100000185761 [0,2,0,0,0,0|1,1,0]=4 6368 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2O 62a_100000034122_100000185761 [0,2,0,0,0,0|1,1,0]=4 6369 B16R2.1129 Nc1ccc(cc1)Sc2ncccc2O 62a_100000185761_100000034122 [0,2,0,0,0,0|1,1,0]=4 6370 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2Br 62a_100000187370_100000695589 [0,2,0,0,0,0|1,1,0]=4 6371 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2Br 62a_100000695589_100000187370 [0,2,0,0,0,0|1,1,0]=4 6372 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2Cl 62a_100000187370_100000764095 [0,2,0,0,0,0|1,1,0]=4 6373 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2Cl 62a_100000764095_100000187370 [0,2,0,0,0,0|1,1,0]=4 6374 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2F 62a_100000187370_100011215700 [0,2,0,0,0,0|1,1,0]=4 6375 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2F 62a_100011215700_100000187370 [0,2,0,0,0,0|1,1,0]=4 6376 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2N 62a_100000187370_100000210017 [0,2,0,0,0,0|1,1,0]=4 6377 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2N 62a_100000210017_100000187370 [0,2,0,0,0,0|1,1,0]=4 6378 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2O 62a_100000187370_100000739446 [0,2,0,0,0,0|1,1,0]=4 6379 B16R2.1129 Nc1ccc(cn1)Sc2ccccc2O 62a_100000739446_100000187370 [0,2,0,0,0,0|1,1,0]=4 6380 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2Br 62a_100000695589_100000737798 [0,2,0,0,0,0|1,1,0]=4 6381 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2Br 62a_100000737798_100000695589 [0,2,0,0,0,0|1,1,0]=4 6382 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2Cl 62a_100000737798_100000764095 [0,2,0,0,0,0|1,1,0]=4 6383 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2Cl 62a_100000764095_100000737798 [0,2,0,0,0,0|1,1,0]=4 6384 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2F 62a_100000737798_100011215700 [0,2,0,0,0,0|1,1,0]=4 6385 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2F 62a_100011215700_100000737798 [0,2,0,0,0,0|1,1,0]=4 6386 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2N 62a_100000210017_100000737798 [0,2,0,0,0,0|1,1,0]=4 6387 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2N 62a_100000737798_100000210017 [0,2,0,0,0,0|1,1,0]=4 6388 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2O 62a_100000737798_100000739446 [0,2,0,0,0,0|1,1,0]=4 6389 B16R2.1129 Nc1ccc(nc1)Sc2ccccc2O 62a_100000739446_100000737798 [0,2,0,0,0,0|1,1,0]=4 6390 B16R2.1129 Nc1ccccc1Nc2ccc(cc2)O 271570a_203496583355_100011254256 [0,2,0,0,0,0|1,0,0]=3 6391 B16R2.1129 Nc1ccccc1Sc2cc[n+](cc2)[O-] 62a_100000210017_100000039755 [0,2,0,0,0,0|1,1,0]=4 6392 B16R2.1129 Nc1ccccc1Sc2ccc(=O)[nH]c2 62a_100000210017_100000212171 [0,2,0,0,0,0|1,1,0]=4 6393 B16R2.1129 Nc1ccccc1Sc2ccc(=O)[nH]c2 62a_100000212171_100000210017 [0,2,0,0,0,0|1,1,0]=4 6394 B16R2.1129 Nc1ccccc1Sc2ccc(cc2)Br 62a_100000210017_100000752885 [0,2,0,0,0,0|0,1,0]=3 6395 B16R2.1129 Nc1ccccc1Sc2ccc(cc2)Br 62a_100000752885_100000210017 [0,2,0,0,0,0|0,1,0]=3 6396 B16R2.1129 Nc1ccccc1Sc2ccc(cc2)Cl 62a_100000210017_100000755918 [0,2,0,0,0,0|0,1,0]=3 6397 B16R2.1129 Nc1ccccc1Sc2ccc(cc2)Cl 62a_100000755918_100000210017 [0,2,0,0,0,0|0,1,0]=3 6398 B16R2.1129 Nc1ccccc1Sc2ccc(cc2)F 62a_100000210017_100000211213 [0,2,0,0,0,0|0,1,0]=3 6399 B16R2.1129 Nc1ccccc1Sc2ccc(cc2)F 62a_100000211213_100000210017 [0,2,0,0,0,0|0,1,0]=3 6400 B16R2.1129 Nc1ccccc1Sc2ccc(cc2)O 62a_100000210017_100000185759 [0,2,0,0,0,0|0,1,0]=3 6401 B16R2.1129 Nc1ccccc1Sc2ccc(cn2)Br 62a_100000210017_100000686858 [0,2,0,0,0,0|1,1,0]=4 6402 B16R2.1129 Nc1ccccc1Sc2ccc(cn2)Br 62a_100000686858_100000210017 [0,2,0,0,0,0|1,1,0]=4 6403 B16R2.1129 Nc1ccccc1Sc2ccc(cn2)Cl 62a_100000210017_100011356976 [0,2,0,0,0,0|1,1,0]=4 6404 B16R2.1129 Nc1ccccc1Sc2ccc(cn2)Cl 62a_100011356976_100000210017 [0,2,0,0,0,0|1,1,0]=4 6405 B16R2.1129 Nc1ccccc1Sc2ccc(cn2)F 62a_100000210017_100000744514 [0,2,0,0,0,0|1,1,0]=4 6406 B16R2.1129 Nc1ccccc1Sc2ccc(cn2)F 62a_100000744514_100000210017 [0,2,0,0,0,0|1,1,0]=4 6407 B16R2.1129 Nc1ccccc1Sc2ccc(cn2)O 62a_100000210017_100000744096 [0,2,0,0,0,0|1,1,0]=4 6408 B16R2.1129 Nc1ccccc1Sc2ccc(cn2)O 62a_100000685995_100000210017 [0,2,0,0,0,0|1,1,0]=4 6409 B16R2.1129 Nc1ccccc1Sc2ccc(nc2)Br 62a_100000210017_100009814638 [0,2,0,0,0,0|1,1,0]=4 6410 B16R2.1129 Nc1ccccc1Sc2ccc(nc2)Br 62a_100009814638_100000210017 [0,2,0,0,0,0|1,1,0]=4 6411 B16R2.1129 Nc1ccccc1Sc2ccc(nc2)Cl 62a_100000034144_100000210017 [0,2,0,0,0,0|1,1,0]=4 6412 B16R2.1129 Nc1ccccc1Sc2ccc(nc2)Cl 62a_100000210017_100000034144 [0,2,0,0,0,0|1,1,0]=4 6413 B16R2.1129 Nc1ccccc1Sc2ccc(nc2)F 62a_100000042367_100000210017 [0,2,0,0,0,0|1,1,0]=4 6414 B16R2.1129 Nc1ccccc1Sc2ccc(nc2)F 62a_100000210017_100000042367 [0,2,0,0,0,0|1,1,0]=4 6415 B16R2.1129 Nc1cccnc1Sc2ccc(cc2)Br 62a_100000688686_100000752885 [0,2,0,0,0,0|1,1,0]=4 6416 B16R2.1129 Nc1cccnc1Sc2ccc(cc2)Br 62a_100000752885_100000688686 [0,2,0,0,0,0|1,1,0]=4 6417 B16R2.1129 Nc1cccnc1Sc2ccc(cc2)Cl 62a_100000688686_100000755918 [0,2,0,0,0,0|1,1,0]=4 6418 B16R2.1129 Nc1cccnc1Sc2ccc(cc2)Cl 62a_100000755918_100000688686 [0,2,0,0,0,0|1,1,0]=4 6419 B16R2.1129 Nc1cccnc1Sc2ccc(cc2)F 62a_100000211213_100000688686 [0,2,0,0,0,0|1,1,0]=4 6420 B16R2.1129 Nc1cccnc1Sc2ccc(cc2)F 62a_100000688686_100000211213 [0,2,0,0,0,0|1,1,0]=4 6421 B16R2.1129 Nc1cccnc1Sc2ccc(cc2)O 62a_100000688686_100000185759 [0,2,0,0,0,0|1,1,0]=4 6422 B16R2.1129 Nc1ccncc1Sc2ccc(cc2)Br 62a_100000047001_100000752885 [0,2,0,0,0,0|1,1,0]=4 6423 B16R2.1129 Nc1ccncc1Sc2ccc(cc2)Br 62a_100000752885_100000047001 [0,2,0,0,0,0|1,1,0]=4 6424 B16R2.1129 Nc1ccncc1Sc2ccc(cc2)Cl 62a_100000047001_100000755918 [0,2,0,0,0,0|1,1,0]=4 6425 B16R2.1129 Nc1ccncc1Sc2ccc(cc2)Cl 62a_100000755918_100000047001 [0,2,0,0,0,0|1,1,0]=4 6426 B16R2.1129 Nc1ccncc1Sc2ccc(cc2)F 62a_100000047001_100000211213 [0,2,0,0,0,0|1,1,0]=4 6427 B16R2.1129 Nc1ccncc1Sc2ccc(cc2)F 62a_100000211213_100000047001 [0,2,0,0,0,0|1,1,0]=4 6428 B16R2.1129 Nc1ccncc1Sc2ccc(cc2)O 62a_100000047001_100000185759 [0,2,0,0,0,0|1,1,0]=4 6429 B16R2.1129 Nc1cnccc1Sc2ccc(cc2)Br 62a_100000752885_100000756074 [0,2,0,0,0,0|1,1,0]=4 6430 B16R2.1129 Nc1cnccc1Sc2ccc(cc2)Br 62a_100000756074_100000752885 [0,2,0,0,0,0|1,1,0]=4 6431 B16R2.1129 Nc1cnccc1Sc2ccc(cc2)Cl 62a_100000755918_100000756074 [0,2,0,0,0,0|1,1,0]=4 6432 B16R2.1129 Nc1cnccc1Sc2ccc(cc2)Cl 62a_100000756074_100000755918 [0,2,0,0,0,0|1,1,0]=4 6433 B16R2.1129 Nc1cnccc1Sc2ccc(cc2)F 62a_100000211213_100000756074 [0,2,0,0,0,0|1,1,0]=4 6434 B16R2.1129 Nc1cnccc1Sc2ccc(cc2)F 62a_100000756074_100000211213 [0,2,0,0,0,0|1,1,0]=4 6435 B16R2.1129 Nc1cnccc1Sc2ccc(cc2)O 62a_100000756074_100000185759 [0,2,0,0,0,0|1,1,0]=4 6436 B16R2.1129 Nc1ncccc1Sc2ccc(cc2)Br 62a_100000045569_100000752885 [0,2,0,0,0,0|1,1,0]=4 6437 B16R2.1129 Nc1ncccc1Sc2ccc(cc2)Br 62a_100000752885_100000045569 [0,2,0,0,0,0|1,1,0]=4 6438 B16R2.1129 Nc1ncccc1Sc2ccc(cc2)Cl 62a_100000045569_100000755918 [0,2,0,0,0,0|1,1,0]=4 6439 B16R2.1129 Nc1ncccc1Sc2ccc(cc2)Cl 62a_100000755918_100000045569 [0,2,0,0,0,0|1,1,0]=4 6440 B16R2.1129 Nc1ncccc1Sc2ccc(cc2)F 62a_100000045569_100000211213 [0,2,0,0,0,0|1,1,0]=4 6441 B16R2.1129 Nc1ncccc1Sc2ccc(cc2)F 62a_100000211213_100000045569 [0,2,0,0,0,0|1,1,0]=4 6442 B16R2.1129 Nc1ncccc1Sc2ccc(cc2)O 62a_100000045569_100000185759 [0,2,0,0,0,0|1,1,0]=4 6443 B16R2.1129 O=c1cc[nH]cc1Sc2ccc(cc2)Br 62a_100000752885_100009998708 [0,2,0,0,0,0|1,1,0]=4 6444 B16R2.1129 O=c1cc[nH]cc1Sc2ccc(cc2)Br 62a_100009998708_100000752885 [0,2,0,0,0,0|1,1,0]=4 6445 B16R2.1129 O=c1cc[nH]cc1Sc2ccc(cc2)Cl 62a_100000755918_100009998708 [0,2,0,0,0,0|1,1,0]=4 6446 B16R2.1129 O=c1cc[nH]cc1Sc2ccc(cc2)Cl 62a_100009998708_100000755918 [0,2,0,0,0,0|1,1,0]=4 6447 B16R2.1129 O=c1cc[nH]cc1Sc2ccc(cc2)F 62a_100000211213_100009998708 [0,2,0,0,0,0|1,1,0]=4 6448 B16R2.1129 O=c1cc[nH]cc1Sc2ccc(cc2)F 62a_100009998708_100000211213 [0,2,0,0,0,0|1,1,0]=4 6449 B16R2.1129 O=c1cc[nH]cc1Sc2ccc(cc2)O 62a_100009998708_100000185759 [0,2,0,0,0,0|1,1,0]=4 6450 B16R2.1129 O=c1ccc(c[nH]1)Sc2ccccc2Br 62a_100000212171_100000695589 [0,2,0,0,0,0|1,1,0]=4 6451 B16R2.1129 O=c1ccc(c[nH]1)Sc2ccccc2Br 62a_100000695589_100000212171 [0,2,0,0,0,0|1,1,0]=4 6452 B16R2.1129 O=c1ccc(c[nH]1)Sc2ccccc2Cl 62a_100000212171_100000764095 [0,2,0,0,0,0|1,1,0]=4 6453 B16R2.1129 O=c1ccc(c[nH]1)Sc2ccccc2Cl 62a_100000764095_100000212171 [0,2,0,0,0,0|1,1,0]=4 6454 B16R2.1129 O=c1ccc(c[nH]1)Sc2ccccc2F 62a_100000212171_100011215700 [0,2,0,0,0,0|1,1,0]=4 6455 B16R2.1129 O=c1ccc(c[nH]1)Sc2ccccc2F 62a_100011215700_100000212171 [0,2,0,0,0,0|1,1,0]=4 6456 B16R2.1129 O=c1ccc(c[nH]1)Sc2ccccc2O 62a_100000212171_100000739446 [0,2,0,0,0,0|1,1,0]=4 6457 B16R2.1129 O=c1ccc(c[nH]1)Sc2ccccc2O 62a_100000739446_100000212171 [0,2,0,0,0,0|1,1,0]=4 6458 B16R2.1129 Oc1ccc(cc1)Nc2ccncc2Br 27a_100000185829_100000726257 [0,2,0,0,0,0|2,0,0]=4 6459 B16R2.1129 Oc1ccc(cc1)Nc2ccncc2F 27a_100000185829_100000035921 [0,2,0,0,0,0|2,0,0]=4 6460 B16R2.1129 Oc1ccc(cc1)Nc2ncccc2Br 27a_100000185829_100000696092 [0,2,0,0,0,0|2,0,0]=4 6461 B16R2.1129 Oc1ccc(cc1)Sc2c[nH]ccc2=S 62a_200012280681_100000185759 [0,2,0,0,0,0|1,1,0]=4 6462 B16R2.1129 Oc1ccc(cc1)Sc2ccccc2Br 62a_100000695589_100000185759 [0,2,0,0,0,0|0,1,0]=3 6463 B16R2.1129 Oc1ccc(cc1)Sc2ccccc2Cl 62a_100000764095_100000185759 [0,2,0,0,0,0|0,1,0]=3 6464 B16R2.1129 Oc1ccc(cc1)Sc2ccccc2F 62a_100011215700_100000185759 [0,2,0,0,0,0|0,1,0]=3 6465 B16R2.1129 Oc1ccc(cc1)Sc2ccccc2O 62a_100000739446_100000185759 [0,2,0,0,0,0|0,1,0]=3 6466 B16R2.1129 Oc1ccc(cc1)Sc2cccnc2Br 62a_100010202626_100000185759 [0,2,0,0,0,0|1,1,0]=4 6467 B16R2.1129 Oc1ccc(cc1)Sc2cccnc2Cl 62a_100000036424_100000185759 [0,2,0,0,0,0|1,1,0]=4 6468 B16R2.1129 Oc1ccc(cc1)Sc2cccnc2F 62a_100009816115_100000185759 [0,2,0,0,0,0|1,1,0]=4 6469 B16R2.1129 Oc1ccc(cc1)Sc2cccnc2O 62a_100000760158_100000185759 [0,2,0,0,0,0|1,1,0]=4 6470 B16R2.1129 Oc1ccc(cc1)Sc2ccncc2Br 62a_100000726257_100000185759 [0,2,0,0,0,0|1,1,0]=4 6471 B16R2.1129 Oc1ccc(cc1)Sc2ccncc2Cl 62a_100000708259_100000185759 [0,2,0,0,0,0|1,1,0]=4 6472 B16R2.1129 Oc1ccc(cc1)Sc2ccncc2F 62a_100000047030_100000185759 [0,2,0,0,0,0|1,1,0]=4 6473 B16R2.1129 Oc1ccc(cc1)Sc2ccncc2O 62a_100009817591_100000185759 [0,2,0,0,0,0|1,1,0]=4 6474 B16R2.1129 Oc1ccc(cc1)Sc2cnccc2Br 62a_100010138639_100000185759 [0,2,0,0,0,0|1,1,0]=4 6475 B16R2.1129 Oc1ccc(cc1)Sc2cnccc2Cl 62a_100009995489_100000185759 [0,2,0,0,0,0|1,1,0]=4 6476 B16R2.1129 Oc1ccc(cc1)Sc2cnccc2F 62a_100009820683_100000185759 [0,2,0,0,0,0|1,1,0]=4 6477 B16R2.1129 Oc1ccc(cc1)Sc2ncccc2Br 62a_100000696092_100000185759 [0,2,0,0,0,0|1,1,0]=4 6478 B16R2.1129 Oc1ccc(cc1)Sc2ncccc2Cl 62a_100011356963_100000185759 [0,2,0,0,0,0|1,1,0]=4 6479 B16R2.1129 Oc1ccc(cc1)Sc2ncccc2F 62a_100000685392_100000185759 [0,2,0,0,0,0|1,1,0]=4 6480 B16R2.1129 Oc1ccc(cc1)Sc2ncccc2O 62a_100000034122_100000185759 [0,2,0,0,0,0|1,1,0]=4 6481 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2Br 62a_100000685995_100000695589 [0,2,0,0,0,0|1,1,0]=4 6482 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2Br 62a_100000695589_100000744096 [0,2,0,0,0,0|1,1,0]=4 6483 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2Cl 62a_100000685995_100000764095 [0,2,0,0,0,0|1,1,0]=4 6484 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2Cl 62a_100000764095_100000744096 [0,2,0,0,0,0|1,1,0]=4 6485 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2F 271570a_203496583355_100011465541 [0,2,0,0,0,0|1,1,0]=4 6486 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2F 62a_100000685995_100011215700 [0,2,0,0,0,0|1,1,0]=4 6487 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2F 62a_100011215700_100000744096 [0,2,0,0,0,0|1,1,0]=4 6488 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2O 62a_100000685995_100000739446 [0,2,0,0,0,0|1,1,0]=4 6489 B16R2.1129 Oc1ccc(nc1)Sc2ccccc2O 62a_100000739446_100000744096 [0,2,0,0,0,0|1,1,0]=4 6490 B16R2.1129 Oc1ccccc1Nc2ccc(cn2)Br 27a_100000185747_100000686858 [0,2,0,0,0,0|2,0,0]=4 6491 B16R2.1129 Oc1ccccc1Oc2ccc(cc2)F 271570a_203496583355_200010782033 [0,2,0,0,0,0|0,0,0]=2 6492 B16R2.1129 Oc1ccccc1Sc2ccc(cc2)Br 62a_100000739446_100000752885 [0,2,0,0,0,0|0,1,0]=3 6493 B16R2.1129 Oc1ccccc1Sc2ccc(cc2)Br 62a_100000752885_100000739446 [0,2,0,0,0,0|0,1,0]=3 6494 B16R2.1129 Oc1ccccc1Sc2ccc(cc2)Cl 62a_100000739446_100000755918 [0,2,0,0,0,0|0,1,0]=3 6495 B16R2.1129 Oc1ccccc1Sc2ccc(cc2)Cl 62a_100000755918_100000739446 [0,2,0,0,0,0|0,1,0]=3 6496 B16R2.1129 Oc1ccccc1Sc2ccc(cc2)F 62a_100000211213_100000739446 [0,2,0,0,0,0|0,1,0]=3 6497 B16R2.1129 Oc1ccccc1Sc2ccc(cc2)F 62a_100000739446_100000211213 [0,2,0,0,0,0|0,1,0]=3 6498 B16R2.1129 Oc1ccccc1Sc2ccc(cn2)Br 62a_100000686858_100000739446 [0,2,0,0,0,0|1,1,0]=4 6499 B16R2.1129 Oc1ccccc1Sc2ccc(cn2)Br 62a_100000739446_100000686858 [0,2,0,0,0,0|1,1,0]=4 6500 B16R2.1129 Oc1ccccc1Sc2ccc(cn2)Cl 62a_100000739446_100011356976 [0,2,0,0,0,0|1,1,0]=4 6501 B16R2.1129 Oc1ccccc1Sc2ccc(cn2)Cl 62a_100011356976_100000739446 [0,2,0,0,0,0|1,1,0]=4 6502 B16R2.1129 Oc1ccccc1Sc2ccc(cn2)F 62a_100000739446_100000744514 [0,2,0,0,0,0|1,1,0]=4 6503 B16R2.1129 Oc1ccccc1Sc2ccc(cn2)F 62a_100000744514_100000739446 [0,2,0,0,0,0|1,1,0]=4 6504 B16R2.1129 Oc1ccccc1Sc2ccc(nc2)Br 62a_100000739446_100009814638 [0,2,0,0,0,0|1,1,0]=4 6505 B16R2.1129 Oc1ccccc1Sc2ccc(nc2)Br 62a_100009814638_100000739446 [0,2,0,0,0,0|1,1,0]=4 6506 B16R2.1129 Oc1ccccc1Sc2ccc(nc2)Cl 62a_100000034144_100000739446 [0,2,0,0,0,0|1,1,0]=4 6507 B16R2.1129 Oc1ccccc1Sc2ccc(nc2)Cl 62a_100000739446_100000034144 [0,2,0,0,0,0|1,1,0]=4 6508 B16R2.1129 Oc1ccccc1Sc2ccc(nc2)F 62a_100000042367_100000739446 [0,2,0,0,0,0|1,1,0]=4 6509 B16R2.1129 Oc1ccccc1Sc2ccc(nc2)F 62a_100000739446_100000042367 [0,2,0,0,0,0|1,1,0]=4 6510 B16R2.1129 Oc1cccnc1Sc2ccc(cc2)Br 62a_100000034122_100000752885 [0,2,0,0,0,0|1,1,0]=4 6511 B16R2.1129 Oc1cccnc1Sc2ccc(cc2)Br 62a_100000752885_100000034122 [0,2,0,0,0,0|1,1,0]=4 6512 B16R2.1129 Oc1cccnc1Sc2ccc(cc2)Cl 62a_100000034122_100000755918 [0,2,0,0,0,0|1,1,0]=4 6513 B16R2.1129 Oc1cccnc1Sc2ccc(cc2)Cl 62a_100000755918_100000034122 [0,2,0,0,0,0|1,1,0]=4 6514 B16R2.1129 Oc1cccnc1Sc2ccc(cc2)F 62a_100000034122_100000211213 [0,2,0,0,0,0|1,1,0]=4 6515 B16R2.1129 Oc1cccnc1Sc2ccc(cc2)F 62a_100000211213_100000034122 [0,2,0,0,0,0|1,1,0]=4 6516 B16R2.1129 Oc1cnccc1Sc2ccc(cc2)Br 62a_100000752885_100009817591 [0,2,0,0,0,0|1,1,0]=4 6517 B16R2.1129 Oc1cnccc1Sc2ccc(cc2)Br 62a_100009817591_100000752885 [0,2,0,0,0,0|1,1,0]=4 6518 B16R2.1129 Oc1cnccc1Sc2ccc(cc2)Cl 62a_100000755918_100009817591 [0,2,0,0,0,0|1,1,0]=4 6519 B16R2.1129 Oc1cnccc1Sc2ccc(cc2)Cl 62a_100009817591_100000755918 [0,2,0,0,0,0|1,1,0]=4 6520 B16R2.1129 Oc1cnccc1Sc2ccc(cc2)F 62a_100000211213_100009817591 [0,2,0,0,0,0|1,1,0]=4 6521 B16R2.1129 Oc1cnccc1Sc2ccc(cc2)F 62a_100009817591_100000211213 [0,2,0,0,0,0|1,1,0]=4 6522 B16R2.1129 Oc1ncccc1Sc2ccc(cc2)Br 62a_100000752885_100000760158 [0,2,0,0,0,0|1,1,0]=4 6523 B16R2.1129 Oc1ncccc1Sc2ccc(cc2)Br 62a_100000760158_100000752885 [0,2,0,0,0,0|1,1,0]=4 6524 B16R2.1129 Oc1ncccc1Sc2ccc(cc2)Cl 62a_100000755918_100000760158 [0,2,0,0,0,0|1,1,0]=4 6525 B16R2.1129 Oc1ncccc1Sc2ccc(cc2)Cl 62a_100000760158_100000755918 [0,2,0,0,0,0|1,1,0]=4 6526 B16R2.1129 Oc1ncccc1Sc2ccc(cc2)F 62a_100000211213_100000760158 [0,2,0,0,0,0|1,1,0]=4 6527 B16R2.1129 Oc1ncccc1Sc2ccc(cc2)F 62a_100000760158_100000211213 [0,2,0,0,0,0|1,1,0]=4 6528 B16R2.1129 S=c1cc[nH]cc1Sc2ccc(cc2)Br 62a_100000752885_200012280681 [0,2,0,0,0,0|1,1,0]=4 6529 B16R2.1129 S=c1cc[nH]cc1Sc2ccc(cc2)Br 62a_200012280681_100000752885 [0,2,0,0,0,0|1,1,0]=4 6530 B16R2.1129 S=c1cc[nH]cc1Sc2ccc(cc2)Cl 62a_100000755918_200012280681 [0,2,0,0,0,0|1,1,0]=4 6531 B16R2.1129 S=c1cc[nH]cc1Sc2ccc(cc2)Cl 62a_200012280681_100000755918 [0,2,0,0,0,0|1,1,0]=4 6532 B16R2.1129 [O-][n+]1ccc(cc1)Sc2ccccc2Br 62a_100000695589_100000039755 [0,2,0,0,0,0|1,1,0]=4 6533 B16R2.1129 [O-][n+]1ccc(cc1)Sc2ccccc2Cl 62a_100000764095_100000039755 [0,2,0,0,0,0|1,1,0]=4 6534 B16R2.1129 [O-][n+]1ccc(cc1)Sc2ccccc2F 62a_100011215700_100000039755 [0,2,0,0,0,0|1,1,0]=4 6535 B16R2.1129 [O-][n+]1ccc(cc1)Sc2ccccc2O 62a_100000739446_100000039755 [0,2,0,0,0,0|1,1,0]=4 6536 B16R2.1129 [O-][n+]1ccccc1Sc2ccc(cc2)Br 62a_100000752885_200000042595 [0,2,0,0,0,0|1,1,0]=4 6537 B16R2.1129 [O-][n+]1ccccc1Sc2ccc(cc2)Cl 62a_100000755918_200000042595 [0,2,0,0,0,0|1,1,0]=4 6538 B16R2.1129 [O-][n+]1ccccc1Sc2ccc(cc2)F 62a_100000211213_200000042595 [0,2,0,0,0,0|1,1,0]=4 6539 B16R2.23 C=Cc1cc(ccn1)Sc2ccccc2 62a_100000719477_100009845566 [0,2,0,0,0,0|1,1,0]=4 6540 B16R2.23 C=Cc1cc(ccn1)Sc2ccccc2 62a_100009845566_100000041952 [0,2,0,0,0,0|1,1,0]=4 6541 B16R2.23 C=Cc1cc(ncn1)Oc2ccccc2 271570a_100011290941_100000242500 [0,2,0,0,0,0|2,0,0]=4 6542 B16R2.23 C=Cc1ccc[n+](c1)Cc2ccccc2 271570a_100011290941_200009812568 [0,2,0,0,0,0|2,0,0]=4 6543 B16R2.23 C=Cc1cccc(c1)Nc2ccccc2 271570a_100011290941_100000701362 [0,2,0,0,0,0|1,0,0]=3 6544 B16R2.23 C=Cc1cccc(c1)Oc2ccccc2 271570a_100011290941_100009814285 [0,2,0,0,0,0|0,0,0]=2 6545 B16R2.23 C=Cc1cccc(c1)Oc2ccccn2 271570a_100011290941_200000173466 [0,2,0,0,0,0|1,0,0]=3 6546 B16R2.23 C=Cc1cccc(c1)Sc2ccccc2 62a_100000719477_100011215241 [0,2,0,0,0,0|0,1,0]=3 6547 B16R2.23 C=Cc1cccc(c1)Sc2ccccc2 62a_100011215241_100000041952 [0,2,0,0,0,0|0,1,0]=3 6548 B16R2.23 C=Cc1cccc(c1)Sc2ccccn2 62a_100011215241_100011216584 [0,2,0,0,0,0|1,1,0]=4 6549 B16R2.23 C=Cc1cccc(c1)Sc2ccccn2 62a_100011216584_100011215241 [0,2,0,0,0,0|1,1,0]=4 6550 B16R2.23 C=Cc1cccc(c1)Sc2cccnc2 62a_100000210063_100011215241 [0,2,0,0,0,0|1,1,0]=4 6551 B16R2.23 C=Cc1cccc(c1)Sc2cccnc2 62a_100011215241_100000210063 [0,2,0,0,0,0|1,1,0]=4 6552 B16R2.23 C=Cc1cccc(c1)Sc2ccncc2 62a_100000728582_100011215241 [0,2,0,0,0,0|1,1,0]=4 6553 B16R2.23 C=Cc1cccc(c1)Sc2ccncc2 62a_100011215241_100000728582 [0,2,0,0,0,0|1,1,0]=4 6554 B16R2.23 C=Cc1cccc(n1)Oc2ccccc2 271570a_100011290941_100011960278 [0,2,0,0,0,0|1,0,0]=3 6555 B16R2.23 C=Cc1cncc(c1)Cc2ccccc2 271570a_100011290941_200010295753 [0,2,0,0,0,0|2,0,0]=4 6556 B16R2.23 C=Cc1cncc(c1)Oc2ccccc2 271570a_100011290941_100012359384 [0,2,0,0,0,0|1,0,0]=3 6557 B16R2.23 C=Cc1cncc(c1)Sc2ccccc2 62a_100000719477_200012180632 [0,2,0,0,0,0|1,1,0]=4 6558 B16R2.23 C=Cc1cncc(c1)Sc2ccccc2 62a_200012180632_100000041952 [0,2,0,0,0,0|1,1,0]=4 6559 B16R2.23 C=Cc1cncc(n1)Oc2ccccc2 271570a_100011290941_200011210009 [0,2,0,0,0,0|2,0,0]=4 6560 B16R2.23 C=Cc1nccc(n1)Oc2ccccc2 271570a_100011290941_100000722766 [0,2,0,0,0,0|2,0,0]=4 6561 B16R2.23 CCc1cc(ccn1)Nc2ccccc2 27a_100000106764_100009820011 [0,2,0,0,0,0|2,0,0]=4 6562 B16R2.23 CCc1cc(ccn1)Sc2ccccc2 62a_100000719477_100009820011 [0,2,0,0,0,0|1,1,0]=4 6563 B16R2.23 CCc1cc(ccn1)Sc2ccccc2 62a_100009820011_100000041952 [0,2,0,0,0,0|1,1,0]=4 6564 B16R2.23 CCc1cccc(c1)Sc2ccccc2 62a_100000719477_100011263222 [0,2,0,0,0,0|0,1,0]=3 6565 B16R2.23 CCc1cccc(c1)Sc2ccccc2 62a_100011263222_100000041952 [0,2,0,0,0,0|0,1,0]=3 6566 B16R2.23 CCc1cccc(c1)Sc2ccccn2 62a_100011216584_100011263222 [0,2,0,0,0,0|1,1,0]=4 6567 B16R2.23 CCc1cccc(c1)Sc2ccccn2 62a_100011263222_100011216584 [0,2,0,0,0,0|1,1,0]=4 6568 B16R2.23 CCc1cccc(c1)Sc2cccnc2 62a_100000210063_100011263222 [0,2,0,0,0,0|1,1,0]=4 6569 B16R2.23 CCc1cccc(c1)Sc2cccnc2 62a_100011263222_100000210063 [0,2,0,0,0,0|1,1,0]=4 6570 B16R2.23 CCc1cccc(c1)Sc2ccncc2 62a_100000728582_100011263222 [0,2,0,0,0,0|1,1,0]=4 6571 B16R2.23 CCc1cccc(c1)Sc2ccncc2 62a_100011263222_100000728582 [0,2,0,0,0,0|1,1,0]=4 6572 B16R2.23 CCc1cccc(n1)Sc2ccccc2 62a_100000719477_100009856026 [0,2,0,0,0,0|1,1,0]=4 6573 B16R2.23 CCc1cccc(n1)Sc2ccccc2 62a_100009856026_100000041952 [0,2,0,0,0,0|1,1,0]=4 6574 B16R2.23 CCc1ccnc(c1)Nc2ccccc2 27a_100000106764_100009817561 [0,2,0,0,0,0|2,0,0]=4 6575 B16R2.23 CCc1ccnc(c1)Sc2ccccc2 62a_100000719477_100009817561 [0,2,0,0,0,0|1,1,0]=4 6576 B16R2.23 CCc1ccnc(c1)Sc2ccccc2 62a_100009817561_100000041952 [0,2,0,0,0,0|1,1,0]=4 6577 B16R2.23 CCc1cncc(c1)Sc2ccccc2 62a_100000719477_200009819073 [0,2,0,0,0,0|1,1,0]=4 6578 B16R2.23 CCc1cncc(c1)Sc2ccccc2 62a_200009819073_100000041952 [0,2,0,0,0,0|1,1,0]=4 6579 B16R2.23 CNc1cc(ccn1)Sc2ccccc2 62a_100000719477_100009819592 [0,2,0,0,0,0|1,1,0]=4 6580 B16R2.23 CNc1cc(ccn1)Sc2ccccc2 62a_100009819592_100000041952 [0,2,0,0,0,0|1,1,0]=4 6581 B16R2.23 CNc1cc(ncn1)Oc2ccccc2 27a_100102657272_100000242500 [0,2,0,0,0,0|2,0,0]=4 6582 B16R2.23 CNc1cccc(c1)Cc2ccccc2 2230a_200000043086_200000210301 [0,2,0,0,0,0|1,0,0]=3 6583 B16R2.23 CNc1cccc(c1)Cc2ccccc2 34a_200000043086_200000210301 [0,2,0,0,0,0|1,0,0]=3 6584 B16R2.23 CNc1cccc(c1)Cc2ccccc2 7a_200000043086_200000210301 [0,2,0,0,0,0|1,0,0]=3 6585 B16R2.23 CNc1cccc(c1)Oc2ccccc2 2230a_100000210861_200000210301 [0,2,0,0,0,0|0,0,0]=2 6586 B16R2.23 CNc1cccc(c1)Oc2ccccc2 34a_100000210861_200000210301 [0,2,0,0,0,0|0,0,0]=2 6587 B16R2.23 CNc1cccc(c1)Oc2ccccc2 7a_100000210861_200000210301 [0,2,0,0,0,0|0,0,0]=2 6588 B16R2.23 CNc1cccc(c1)Oc2ccccn2 2230a_100000765317_200000210301 [0,2,0,0,0,0|1,0,0]=3 6589 B16R2.23 CNc1cccc(c1)Oc2ccccn2 34a_100000765317_200000210301 [0,2,0,0,0,0|1,0,0]=3 6590 B16R2.23 CNc1cccc(c1)Oc2cccnc2 2230a_200012179206_200000210301 [0,2,0,0,0,0|1,0,0]=3 6591 B16R2.23 CNc1cccc(c1)Oc2cccnc2 34a_200012179206_200000210301 [0,2,0,0,0,0|1,0,0]=3 6592 B16R2.23 CNc1cccc(c1)Sc2ccccc2 62a_100000219648_100000041952 [0,2,0,0,0,0|0,1,0]=3 6593 B16R2.23 CNc1cccc(c1)Sc2ccccc2 62a_100000719477_100000219648 [0,2,0,0,0,0|0,1,0]=3 6594 B16R2.23 CNc1cccc(c1)Sc2ccccn2 62a_100000219648_100011216584 [0,2,0,0,0,0|1,1,0]=4 6595 B16R2.23 CNc1cccc(c1)Sc2ccccn2 62a_100011216584_100000219648 [0,2,0,0,0,0|1,1,0]=4 6596 B16R2.23 CNc1cccc(c1)Sc2cccnc2 62a_100000210063_100000219648 [0,2,0,0,0,0|1,1,0]=4 6597 B16R2.23 CNc1cccc(c1)Sc2cccnc2 62a_100000219648_100000210063 [0,2,0,0,0,0|1,1,0]=4 6598 B16R2.23 CNc1cccc(c1)Sc2ccncc2 62a_100000219648_100000728582 [0,2,0,0,0,0|1,1,0]=4 6599 B16R2.23 CNc1cccc(c1)Sc2ccncc2 62a_100000728582_100000219648 [0,2,0,0,0,0|1,1,0]=4 6600 B16R2.23 CNc1cccc(n1)Sc2ccccc2 62a_100000703281_100000041952 [0,2,0,0,0,0|1,1,0]=4 6601 B16R2.23 CNc1cccc(n1)Sc2ccccc2 62a_100000719477_100000703281 [0,2,0,0,0,0|1,1,0]=4 6602 B16R2.23 CNc1ccnc(c1)Sc2ccccc2 62a_100000719477_100009869472 [0,2,0,0,0,0|1,1,0]=4 6603 B16R2.23 CNc1ccnc(c1)Sc2ccccc2 62a_100009869472_100000041952 [0,2,0,0,0,0|1,1,0]=4 6604 B16R2.23 CNc1cncc(c1)Sc2ccccc2 62a_100000719477_100012184536 [0,2,0,0,0,0|1,1,0]=4 6605 B16R2.23 CNc1cncc(c1)Sc2ccccc2 62a_100012184536_100000041952 [0,2,0,0,0,0|1,1,0]=4 6606 B16R2.23 CNc1cncc(n1)Oc2ccccc2 27a_100102657272_200011210009 [0,2,0,0,0,0|2,0,0]=4 6607 B16R2.23 CNc1nccc(n1)Oc2ccccc2 27a_100102657272_100000722766 [0,2,0,0,0,0|2,0,0]=4 6608 B16R2.23 COc1cc(ccn1)Sc2ccccc2 62a_100000117307_100000041952 [0,2,0,0,0,0|1,1,0]=4 6609 B16R2.23 COc1cc(ccn1)Sc2ccccc2 62a_100000719477_100000117307 [0,2,0,0,0,0|1,1,0]=4 6610 B16R2.23 COc1cccc(c1)Cc2ccccc2 34a_100000073777_200000210301 [0,2,0,0,0,0|1,0,0]=3 6611 B16R2.23 COc1cccc(c1)Cc2ccccc2 7a_100000073777_200000210301 [0,2,0,0,0,0|1,0,0]=3 6612 B16R2.23 COc1cccc(c1)Nc2ccccc2 34a_100000031534_200000210301 [0,2,0,0,0,0|1,0,0]=3 6613 B16R2.23 COc1cccc(c1)Nc2ccccc2 7a_100000031534_200000210301 [0,2,0,0,0,0|1,0,0]=3 6614 B16R2.23 COc1cccc(c1)Oc2ccccc2 7a_100000199087_200000210301 [0,2,0,0,0,0|0,0,0]=2 6615 B16R2.23 COc1cccc(c1)Sc2ccccc2 62a_100000719477_100000170001 [0,2,0,0,0,0|0,1,0]=3 6616 B16R2.23 COc1cccc(c1)Sc2ccccn2 62a_100011216584_100000170001 [0,2,0,0,0,0|1,1,0]=4 6617 B16R2.23 COc1cccc(c1)Sc2cccnc2 62a_100000210063_100000170001 [0,2,0,0,0,0|1,1,0]=4 6618 B16R2.23 COc1cccc(c1)Sc2ccncc2 62a_100000728582_100000170001 [0,2,0,0,0,0|1,1,0]=4 6619 B16R2.23 COc1cccc(n1)Sc2ccccc2 62a_100000719477_100000760917 [0,2,0,0,0,0|1,1,0]=4 6620 B16R2.23 COc1cccc(n1)Sc2ccccc2 62a_100000760917_100000041952 [0,2,0,0,0,0|1,1,0]=4 6621 B16R2.23 COc1ccnc(c1)Sc2ccccc2 62a_100000719477_100011216251 [0,2,0,0,0,0|1,1,0]=4 6622 B16R2.23 COc1ccnc(c1)Sc2ccccc2 62a_100009817693_100000041952 [0,2,0,0,0,0|1,1,0]=4 6623 B16R2.23 COc1cncc(c1)Sc2ccccc2 62a_100000050176_100000041952 [0,2,0,0,0,0|1,1,0]=4 6624 B16R2.23 COc1cncc(c1)Sc2ccccc2 62a_100000719477_100000050176 [0,2,0,0,0,0|1,1,0]=4 6625 B16R2.23 CSc1cc(ncn1)Oc2ccccc2 62a_200000210301_100000242500 [0,2,0,0,0,0|2,0,0]=4 6626 B16R2.23 CSc1ccc[n+](c1)Cc2ccccc2 62a_200000210301_200009812568 [0,2,0,0,0,0|2,0,0]=4 6627 B16R2.23 CSc1ccc[n+](c1)Cc2ccccc2 62a_200009812568_200000210301 [0,2,0,0,0,0|2,0,0]=4 6628 B16R2.23 CSc1cccc(c1)Nc2ccccc2 62a_200000210301_100000701362 [0,2,0,0,0,0|1,0,0]=3 6629 B16R2.23 CSc1cccc(c1)Oc2ccccc2 62a_200000210301_100009814285 [0,2,0,0,0,0|0,0,0]=2 6630 B16R2.23 CSc1cccc(c1)Oc2ccccn2 62a_200000173466_200000210301 [0,2,0,0,0,0|1,0,0]=3 6631 B16R2.23 CSc1cccc(c1)Oc2ccccn2 62a_200000210301_200000173466 [0,2,0,0,0,0|1,0,0]=3 6632 B16R2.23 CSc1cccc(c1)Sc2ccccc2 62a_100000719477_100011215954 [0,2,0,0,0,0|0,1,0]=3 6633 B16R2.23 CSc1cccc(c1)Sc2ccccc2 62a_100011215954_100000041952 [0,2,0,0,0,0|0,1,0]=3 6634 B16R2.23 CSc1cccc(c1)Sc2ccccn2 62a_100011215954_100011216584 [0,2,0,0,0,0|1,1,0]=4 6635 B16R2.23 CSc1cccc(c1)Sc2ccccn2 62a_100011216584_100011215954 [0,2,0,0,0,0|1,1,0]=4 6636 B16R2.23 CSc1cccc(c1)Sc2cccnc2 62a_100000210063_100011215954 [0,2,0,0,0,0|1,1,0]=4 6637 B16R2.23 CSc1cccc(c1)Sc2cccnc2 62a_100011215954_100000210063 [0,2,0,0,0,0|1,1,0]=4 6638 B16R2.23 CSc1cccc(c1)Sc2ccncc2 62a_100000728582_100011215954 [0,2,0,0,0,0|1,1,0]=4 6639 B16R2.23 CSc1cccc(c1)Sc2ccncc2 62a_100011215954_100000728582 [0,2,0,0,0,0|1,1,0]=4 6640 B16R2.23 CSc1cccc(n1)Oc2ccccc2 62a_100011960278_200000210301 [0,2,0,0,0,0|1,0,0]=3 6641 B16R2.23 CSc1cccc(n1)Oc2ccccc2 62a_200000210301_100011960278 [0,2,0,0,0,0|1,0,0]=3 6642 B16R2.23 CSc1cccc(n1)Sc2ccccc2 62a_100000719477_100011960944 [0,2,0,0,0,0|1,1,0]=4 6643 B16R2.23 CSc1cccc(n1)Sc2ccccc2 62a_100011960944_100000041952 [0,2,0,0,0,0|1,1,0]=4 6644 B16R2.23 CSc1ccnc(c1)Sc2ccccc2 62a_100000719477_100010883326 [0,2,0,0,0,0|1,1,0]=4 6645 B16R2.23 CSc1ccnc(c1)Sc2ccccc2 62a_100010883326_100000041952 [0,2,0,0,0,0|1,1,0]=4 6646 B16R2.23 CSc1cncc(c1)Cc2ccccc2 62a_200000210301_200010295753 [0,2,0,0,0,0|2,0,0]=4 6647 B16R2.23 CSc1cncc(c1)Cc2ccccc2 62a_200010295753_200000210301 [0,2,0,0,0,0|2,0,0]=4 6648 B16R2.23 CSc1cncc(c1)Oc2ccccc2 62a_200000210301_100012359384 [0,2,0,0,0,0|1,0,0]=3 6649 B16R2.23 CSc1cncc(c1)Sc2ccccc2 62a_100000719477_100009816972 [0,2,0,0,0,0|1,1,0]=4 6650 B16R2.23 CSc1cncc(c1)Sc2ccccc2 62a_100009816972_100000041952 [0,2,0,0,0,0|1,1,0]=4 6651 B16R2.23 CSc1cncc(n1)Oc2ccccc2 62a_200000210301_200011210009 [0,2,0,0,0,0|2,0,0]=4 6652 B16R2.23 CSc1nccc(n1)Oc2ccccc2 62a_200000210301_100000722766 [0,2,0,0,0,0|2,0,0]=4 6653 B16R2.23 FCc1cccc(c1)Sc2ccccc2 62a_100000719477_100010878472 [0,2,0,0,0,0|0,1,0]=3 6654 B16R2.23 FCc1cccc(c1)Sc2ccccc2 62a_100010878472_100000041952 [0,2,0,0,0,0|0,1,0]=3 6655 B16R2.23 FCc1cccc(c1)Sc2ccccn2 62a_100010878472_100011216584 [0,2,0,0,0,0|1,1,0]=4 6656 B16R2.23 FCc1cccc(c1)Sc2ccccn2 62a_100011216584_100010878472 [0,2,0,0,0,0|1,1,0]=4 6657 B16R2.23 FCc1cccc(c1)Sc2cccnc2 62a_100000210063_100010878472 [0,2,0,0,0,0|1,1,0]=4 6658 B16R2.23 FCc1cccc(c1)Sc2cccnc2 62a_100010878472_100000210063 [0,2,0,0,0,0|1,1,0]=4 6659 B16R2.23 FCc1cccc(c1)Sc2ccncc2 62a_100000728582_100010878472 [0,2,0,0,0,0|1,1,0]=4 6660 B16R2.23 FCc1cccc(c1)Sc2ccncc2 62a_100010878472_100000728582 [0,2,0,0,0,0|1,1,0]=4 6661 B16R2.23 N#Cc1cc(ccn1)Nc2ccccc2 27a_100000106764_100000685610 [0,2,0,0,0,0|2,0,0]=4 6662 B16R2.23 N#Cc1cc(ccn1)Sc2ccccc2 62a_100000719477_100000685610 [0,2,0,0,0,0|1,1,0]=4 6663 B16R2.23 N#Cc1cccc(c1)Sc2ccccc2 62a_100000719477_100000189340 [0,2,0,0,0,0|0,1,0]=3 6664 B16R2.23 N#Cc1cccc(c1)Sc2ccccn2 62a_100011216584_100000189340 [0,2,0,0,0,0|1,1,0]=4 6665 B16R2.23 N#Cc1cccc(c1)Sc2cccnc2 62a_100000210063_100000189340 [0,2,0,0,0,0|1,1,0]=4 6666 B16R2.23 N#Cc1cccc(c1)Sc2ccncc2 62a_100000728582_100000189340 [0,2,0,0,0,0|1,1,0]=4 6667 B16R2.23 N#Cc1cccc(n1)Nc2ccccc2 27a_100000106764_100011934037 [0,2,0,0,0,0|2,0,0]=4 6668 B16R2.23 N#Cc1cccc(n1)Sc2ccccc2 62a_100000719477_100011934037 [0,2,0,0,0,0|1,1,0]=4 6669 B16R2.23 N#Cc1ccnc(c1)Nc2ccccc2 27a_100000106764_100011291639 [0,2,0,0,0,0|2,0,0]=4 6670 B16R2.23 N#Cc1ccnc(c1)Sc2ccccc2 62a_100000719477_100011291639 [0,2,0,0,0,0|1,1,0]=4 6671 B16R2.23 N#Cc1cncc(c1)Sc2ccccc2 62a_100000719477_100000686085 [0,2,0,0,0,0|1,1,0]=4 6672 B16R2.23 NCc1cc(ccn1)Sc2ccccc2 62a_100000085674_100000041952 [0,2,0,0,0,0|1,1,0]=4 6673 B16R2.23 NCc1cc(ccn1)Sc2ccccc2 62a_100000719477_100000085674 [0,2,0,0,0,0|1,1,0]=4 6674 B16R2.23 NCc1cccc(c1)Sc2ccccc2 62a_100000106179_100000041952 [0,2,0,0,0,0|0,1,0]=3 6675 B16R2.23 NCc1cccc(c1)Sc2ccccc2 62a_100000719477_100000106179 [0,2,0,0,0,0|0,1,0]=3 6676 B16R2.23 NCc1cccc(c1)Sc2ccccn2 62a_100000106179_100011216584 [0,2,0,0,0,0|1,1,0]=4 6677 B16R2.23 NCc1cccc(c1)Sc2ccccn2 62a_100011216584_100000106179 [0,2,0,0,0,0|1,1,0]=4 6678 B16R2.23 NCc1cccc(c1)Sc2cccnc2 62a_100000106179_100000210063 [0,2,0,0,0,0|1,1,0]=4 6679 B16R2.23 NCc1cccc(c1)Sc2cccnc2 62a_100000210063_100000106179 [0,2,0,0,0,0|1,1,0]=4 6680 B16R2.23 NCc1cccc(c1)Sc2ccncc2 62a_100000106179_100000728582 [0,2,0,0,0,0|1,1,0]=4 6681 B16R2.23 NCc1cccc(c1)Sc2ccncc2 62a_100000728582_100000106179 [0,2,0,0,0,0|1,1,0]=4 6682 B16R2.23 NCc1cccc(n1)Sc2ccccc2 62a_100000719477_100016990191 [0,2,0,0,0,0|1,1,0]=4 6683 B16R2.23 NCc1cccc(n1)Sc2ccccc2 62a_100016990191_100000041952 [0,2,0,0,0,0|1,1,0]=4 6684 B16R2.23 NCc1ccnc(c1)Sc2ccccc2 62a_100000719477_100025757509 [0,2,0,0,0,0|1,1,0]=4 6685 B16R2.23 NCc1ccnc(c1)Sc2ccccc2 62a_100025757509_100000041952 [0,2,0,0,0,0|1,1,0]=4 6686 B16R2.23 NCc1cncc(c1)Sc2ccccc2 62a_100000719477_100011249555 [0,2,0,0,0,0|1,1,0]=4 6687 B16R2.23 NCc1cncc(c1)Sc2ccccc2 62a_100011249555_100000041952 [0,2,0,0,0,0|1,1,0]=4 6688 B16R2.23 NNc1cc(ccn1)Sc2ccccc2 62a_100000719477_100000764631 [0,2,0,0,0,0|1,1,0]=4 6689 B16R2.23 NNc1cc(ccn1)Sc2ccccc2 62a_100000764631_100000041952 [0,2,0,0,0,0|1,1,0]=4 6690 B16R2.23 NNc1cccc(c1)Sc2ccccc2 62a_100000217339_100000041952 [0,2,0,0,0,0|0,1,0]=3 6691 B16R2.23 NNc1cccc(c1)Sc2ccccc2 62a_100000719477_100000217339 [0,2,0,0,0,0|0,1,0]=3 6692 B16R2.23 NNc1cccc(c1)Sc2ccccn2 62a_100000217339_100011216584 [0,2,0,0,0,0|1,1,0]=4 6693 B16R2.23 NNc1cccc(c1)Sc2ccccn2 62a_100011216584_100000217339 [0,2,0,0,0,0|1,1,0]=4 6694 B16R2.23 NNc1cccc(c1)Sc2cccnc2 62a_100000210063_100000217339 [0,2,0,0,0,0|1,1,0]=4 6695 B16R2.23 NNc1cccc(c1)Sc2cccnc2 62a_100000217339_100000210063 [0,2,0,0,0,0|1,1,0]=4 6696 B16R2.23 NNc1cccc(c1)Sc2ccncc2 62a_100000217339_100000728582 [0,2,0,0,0,0|1,1,0]=4 6697 B16R2.23 NNc1cccc(c1)Sc2ccncc2 62a_100000728582_100000217339 [0,2,0,0,0,0|1,1,0]=4 6698 B16R2.23 NNc1cccc(n1)Sc2ccccc2 62a_100000719477_100009817029 [0,2,0,0,0,0|1,1,0]=4 6699 B16R2.23 NNc1cccc(n1)Sc2ccccc2 62a_100009817029_100000041952 [0,2,0,0,0,0|1,1,0]=4 6700 B16R2.23 NNc1ccnc(c1)Sc2ccccc2 62a_100000089018_100000041952 [0,2,0,0,0,0|1,1,0]=4 6701 B16R2.23 NNc1ccnc(c1)Sc2ccccc2 62a_100000719477_100000089018 [0,2,0,0,0,0|1,1,0]=4 6702 B16R2.23 NNc1cncc(c1)Sc2ccccc2 62a_100000719477_100000727789 [0,2,0,0,0,0|1,1,0]=4 6703 B16R2.23 NNc1cncc(c1)Sc2ccccc2 62a_100000727789_100000041952 [0,2,0,0,0,0|1,1,0]=4 6704 B16R2.23 O=Cc1cc(ccn1)Sc2ccccc2 62a_100000719477_100011998288 [0,2,0,0,0,0|1,1,0]=4 6705 B16R2.23 O=Cc1cc(ccn1)Sc2ccccc2 62a_100011998288_100000041952 [0,2,0,0,0,0|1,1,0]=4 6706 B16R2.23 O=Cc1cccc(c1)Sc2ccccc2 62a_100000014684_100000041952 [0,2,0,0,0,0|0,1,0]=3 6707 B16R2.23 O=Cc1cccc(c1)Sc2ccccc2 62a_100000719477_100000014684 [0,2,0,0,0,0|0,1,0]=3 6708 B16R2.23 O=Cc1cccc(c1)Sc2ccccn2 62a_100000014684_100011216584 [0,2,0,0,0,0|1,1,0]=4 6709 B16R2.23 O=Cc1cccc(c1)Sc2ccccn2 62a_100011216584_100000014684 [0,2,0,0,0,0|1,1,0]=4 6710 B16R2.23 O=Cc1cccc(c1)Sc2cccnc2 62a_100000014684_100000210063 [0,2,0,0,0,0|1,1,0]=4 6711 B16R2.23 O=Cc1cccc(c1)Sc2cccnc2 62a_100000210063_100000014684 [0,2,0,0,0,0|1,1,0]=4 6712 B16R2.23 O=Cc1cccc(c1)Sc2ccncc2 62a_100000014684_100000728582 [0,2,0,0,0,0|1,1,0]=4 6713 B16R2.23 O=Cc1cccc(c1)Sc2ccncc2 62a_100000728582_100000014684 [0,2,0,0,0,0|1,1,0]=4 6714 B16R2.23 O=Cc1cccc(n1)Sc2ccccc2 62a_100000688028_100000041952 [0,2,0,0,0,0|1,1,0]=4 6715 B16R2.23 O=Cc1cccc(n1)Sc2ccccc2 62a_100000719477_100000688028 [0,2,0,0,0,0|1,1,0]=4 6716 B16R2.23 O=Cc1ccnc(c1)Sc2ccccc2 62a_100000719477_100011290808 [0,2,0,0,0,0|1,1,0]=4 6717 B16R2.23 O=Cc1ccnc(c1)Sc2ccccc2 62a_100011290808_100000041952 [0,2,0,0,0,0|1,1,0]=4 6718 B16R2.23 O=Cc1cncc(c1)Sc2ccccc2 62a_100000687066_100000041952 [0,2,0,0,0,0|1,1,0]=4 6719 B16R2.23 O=Cc1cncc(c1)Sc2ccccc2 62a_100000719477_100000687066 [0,2,0,0,0,0|1,1,0]=4 6720 B16R2.23 OCc1cc(ccn1)Nc2ccccc2 27a_100000106764_100000748867 [0,2,0,0,0,0|2,0,0]=4 6721 B16R2.23 OCc1cc(ccn1)Sc2ccccc2 62a_100000719477_100000748867 [0,2,0,0,0,0|1,1,0]=4 6722 B16R2.23 OCc1cc(ccn1)Sc2ccccc2 62a_100000748867_100000041952 [0,2,0,0,0,0|1,1,0]=4 6723 B16R2.23 OCc1cccc(c1)Sc2ccccc2 62a_100000687537_100000041952 [0,2,0,0,0,0|0,1,0]=3 6724 B16R2.23 OCc1cccc(c1)Sc2ccccc2 62a_100000719477_100000687537 [0,2,0,0,0,0|0,1,0]=3 6725 B16R2.23 OCc1cccc(c1)Sc2ccccn2 62a_100000687537_100011216584 [0,2,0,0,0,0|1,1,0]=4 6726 B16R2.23 OCc1cccc(c1)Sc2ccccn2 62a_100011216584_100000687537 [0,2,0,0,0,0|1,1,0]=4 6727 B16R2.23 OCc1cccc(c1)Sc2cccnc2 62a_100000210063_100000687537 [0,2,0,0,0,0|1,1,0]=4 6728 B16R2.23 OCc1cccc(c1)Sc2cccnc2 62a_100000687537_100000210063 [0,2,0,0,0,0|1,1,0]=4 6729 B16R2.23 OCc1cccc(c1)Sc2ccncc2 62a_100000687537_100000728582 [0,2,0,0,0,0|1,1,0]=4 6730 B16R2.23 OCc1cccc(c1)Sc2ccncc2 62a_100000728582_100000687537 [0,2,0,0,0,0|1,1,0]=4 6731 B16R2.23 OCc1cccc(n1)Sc2ccccc2 62a_100000694195_100000041952 [0,2,0,0,0,0|1,1,0]=4 6732 B16R2.23 OCc1cccc(n1)Sc2ccccc2 62a_100000719477_100000694195 [0,2,0,0,0,0|1,1,0]=4 6733 B16R2.23 OCc1ccnc(c1)Sc2ccccc2 62a_100000719477_100009814636 [0,2,0,0,0,0|1,1,0]=4 6734 B16R2.23 OCc1ccnc(c1)Sc2ccccc2 62a_100009814636_100000041952 [0,2,0,0,0,0|1,1,0]=4 6735 B16R2.23 OCc1cncc(c1)Sc2ccccc2 62a_100000719477_100011259137 [0,2,0,0,0,0|1,1,0]=4 6736 B16R2.23 OCc1cncc(c1)Sc2ccccc2 62a_100011259137_100000041952 [0,2,0,0,0,0|1,1,0]=4 6737 B16R2.23 [13CH3]Nc1cccc(c1)Cc2ccccc2 2230a_200000043086_200025704644 [0,2,0,0,0,0|1,0,0]=3 6738 B16R2.23 [13CH3]Nc1cccc(c1)Cc2ccccc2 34a_200000043086_200025704644 [0,2,0,0,0,0|1,0,0]=3 6739 B16R2.23 [13CH3]Nc1cccc(c1)Cc2ccccc2 7a_200000043086_200025704644 [0,2,0,0,0,0|1,0,0]=3 6740 B16R2.23 [13CH3]Nc1cccc(c1)Oc2ccccc2 2230a_100000210861_200025704644 [0,2,0,0,0,0|0,0,0]=2 6741 B16R2.23 [13CH3]Nc1cccc(c1)Oc2ccccc2 34a_100000210861_200025704644 [0,2,0,0,0,0|0,0,0]=2 6742 B16R2.23 [13CH3]Nc1cccc(c1)Oc2ccccc2 7a_100000210861_200025704644 [0,2,0,0,0,0|0,0,0]=2 6743 B16R2.23 [13CH3]Nc1cccc(c1)Oc2ccccn2 2230a_100000765317_200025704644 [0,2,0,0,0,0|1,0,0]=3 6744 B16R2.23 [13CH3]Nc1cccc(c1)Oc2ccccn2 34a_100000765317_200025704644 [0,2,0,0,0,0|1,0,0]=3 6745 B16R2.23 [13CH3]Nc1cccc(c1)Oc2cccnc2 2230a_200012179206_200025704644 [0,2,0,0,0,0|1,0,0]=3 6746 B16R2.23 [13CH3]Nc1cccc(c1)Oc2cccnc2 34a_200012179206_200025704644 [0,2,0,0,0,0|1,0,0]=3 6747 B16R2.23 [13CH3]Oc1cccc(c1)Cc2ccccc2 34a_100000073777_200025704644 [0,2,0,0,0,0|1,0,0]=3 6748 B16R2.23 [13CH3]Oc1cccc(c1)Cc2ccccc2 7a_100000073777_200025704644 [0,2,0,0,0,0|1,0,0]=3 6749 B16R2.23 [13CH3]Oc1cccc(c1)Nc2ccccc2 34a_100000031534_200025704644 [0,2,0,0,0,0|1,0,0]=3 6750 B16R2.23 [13CH3]Oc1cccc(c1)Nc2ccccc2 7a_100000031534_200025704644 [0,2,0,0,0,0|1,0,0]=3 6751 B16R2.23 [13CH3]Oc1cccc(c1)Oc2ccccc2 7a_100000199087_200025704644 [0,2,0,0,0,0|0,0,0]=2 6752 B16R2.23 [13CH3]Sc1cc(ncn1)Oc2ccccc2 62a_200025704644_100000242500 [0,2,0,0,0,0|2,0,0]=4 6753 B16R2.23 [13CH3]Sc1ccc[n+](c1)Cc2ccccc2 62a_200009812568_200025704644 [0,2,0,0,0,0|2,0,0]=4 6754 B16R2.23 [13CH3]Sc1ccc[n+](c1)Cc2ccccc2 62a_200025704644_200009812568 [0,2,0,0,0,0|2,0,0]=4 6755 B16R2.23 [13CH3]Sc1cccc(c1)Nc2ccccc2 62a_200025704644_100000701362 [0,2,0,0,0,0|1,0,0]=3 6756 B16R2.23 [13CH3]Sc1cccc(c1)Oc2ccccc2 62a_200025704644_100009814285 [0,2,0,0,0,0|0,0,0]=2 6757 B16R2.23 [13CH3]Sc1cccc(c1)Oc2ccccn2 62a_200000173466_200025704644 [0,2,0,0,0,0|1,0,0]=3 6758 B16R2.23 [13CH3]Sc1cccc(c1)Oc2ccccn2 62a_200025704644_200000173466 [0,2,0,0,0,0|1,0,0]=3 6759 B16R2.23 [13CH3]Sc1cccc(n1)Oc2ccccc2 62a_100011960278_200025704644 [0,2,0,0,0,0|1,0,0]=3 6760 B16R2.23 [13CH3]Sc1cccc(n1)Oc2ccccc2 62a_200025704644_100011960278 [0,2,0,0,0,0|1,0,0]=3 6761 B16R2.23 [13CH3]Sc1cncc(c1)Cc2ccccc2 62a_200010295753_200025704644 [0,2,0,0,0,0|2,0,0]=4 6762 B16R2.23 [13CH3]Sc1cncc(c1)Cc2ccccc2 62a_200025704644_200010295753 [0,2,0,0,0,0|2,0,0]=4 6763 B16R2.23 [13CH3]Sc1cncc(c1)Oc2ccccc2 62a_200025704644_100012359384 [0,2,0,0,0,0|1,0,0]=3 6764 B16R2.23 [13CH3]Sc1cncc(n1)Oc2ccccc2 62a_200025704644_200011210009 [0,2,0,0,0,0|2,0,0]=4 6765 B16R2.23 [13CH3]Sc1nccc(n1)Oc2ccccc2 62a_200025704644_100000722766 [0,2,0,0,0,0|2,0,0]=4 6766 B16R2.35 Brc1cccc(c1Br)Sc2ccccc2 62a_100000719477_100010175083 [0,2,0,0,0,0|0,1,0]=3 6767 B16R2.35 Brc1cccc(c1Br)Sc2ccccc2 62a_100010175083_100000041952 [0,2,0,0,0,0|0,1,0]=3 6768 B16R2.35 Brc1cccc(c1Br)Sc2ccccn2 62a_100010175083_100011216584 [0,2,0,0,0,0|1,1,0]=4 6769 B16R2.35 Brc1cccc(c1Br)Sc2ccccn2 62a_100011216584_100010175083 [0,2,0,0,0,0|1,1,0]=4 6770 B16R2.35 Brc1cccc(c1Br)Sc2cccnc2 62a_100000210063_100010175083 [0,2,0,0,0,0|1,1,0]=4 6771 B16R2.35 Brc1cccc(c1Br)Sc2cccnc2 62a_100010175083_100000210063 [0,2,0,0,0,0|1,1,0]=4 6772 B16R2.35 Brc1cccc(c1Br)Sc2ccncc2 62a_100000728582_100010175083 [0,2,0,0,0,0|1,1,0]=4 6773 B16R2.35 Brc1cccc(c1Br)Sc2ccncc2 62a_100010175083_100000728582 [0,2,0,0,0,0|1,1,0]=4 6774 B16R2.35 Cc1c(cccc1Sc2ccccc2)Br 62a_100000719477_100012353703 [0,2,0,0,0,0|0,1,0]=3 6775 B16R2.35 Cc1c(cccc1Sc2ccccc2)Br 62a_100012353703_100000041952 [0,2,0,0,0,0|0,1,0]=3 6776 B16R2.35 Cc1c(cccc1Sc2ccccc2)Cl 62a_100000719477_100000726075 [0,2,0,0,0,0|0,1,0]=3 6777 B16R2.35 Cc1c(cccc1Sc2ccccc2)Cl 62a_100000726075_100000041952 [0,2,0,0,0,0|0,1,0]=3 6778 B16R2.35 Cc1c(cccc1Sc2ccccc2)F 62a_100000719477_100011216893 [0,2,0,0,0,0|0,1,0]=3 6779 B16R2.35 Cc1c(cccc1Sc2ccccc2)F 62a_100011216893_100000041952 [0,2,0,0,0,0|0,1,0]=3 6780 B16R2.35 Cc1c(cccc1Sc2ccccc2)N 62a_100000719477_100000761887 [0,2,0,0,0,0|0,1,0]=3 6781 B16R2.35 Cc1c(cccc1Sc2ccccc2)N 62a_100000761887_100000041952 [0,2,0,0,0,0|0,1,0]=3 6782 B16R2.35 Cc1c(cccc1Sc2ccccc2)O 62a_100000719477_100012002258 [0,2,0,0,0,0|0,1,0]=3 6783 B16R2.35 Cc1c(cccc1Sc2ccccc2)O 62a_100012002258_100000041952 [0,2,0,0,0,0|0,1,0]=3 6784 B16R2.35 Cc1c(cccc1Sc2ccccn2)Br 62a_100011216584_100012353703 [0,2,0,0,0,0|1,1,0]=4 6785 B16R2.35 Cc1c(cccc1Sc2ccccn2)Br 62a_100012353703_100011216584 [0,2,0,0,0,0|1,1,0]=4 6786 B16R2.35 Cc1c(cccc1Sc2ccccn2)Cl 62a_100000726075_100011216584 [0,2,0,0,0,0|1,1,0]=4 6787 B16R2.35 Cc1c(cccc1Sc2ccccn2)Cl 62a_100011216584_100000726075 [0,2,0,0,0,0|1,1,0]=4 6788 B16R2.35 Cc1c(cccc1Sc2ccccn2)F 62a_100011216584_100011216893 [0,2,0,0,0,0|1,1,0]=4 6789 B16R2.35 Cc1c(cccc1Sc2ccccn2)F 62a_100011216893_100011216584 [0,2,0,0,0,0|1,1,0]=4 6790 B16R2.35 Cc1c(cccc1Sc2ccccn2)N 62a_100000761887_100011216584 [0,2,0,0,0,0|1,1,0]=4 6791 B16R2.35 Cc1c(cccc1Sc2ccccn2)N 62a_100011216584_100000761887 [0,2,0,0,0,0|1,1,0]=4 6792 B16R2.35 Cc1c(cccc1Sc2ccccn2)O 62a_100011216584_100012002258 [0,2,0,0,0,0|1,1,0]=4 6793 B16R2.35 Cc1c(cccc1Sc2ccccn2)O 62a_100012002258_100011216584 [0,2,0,0,0,0|1,1,0]=4 6794 B16R2.35 Cc1c(cccc1Sc2cccnc2)Br 62a_100000210063_100012353703 [0,2,0,0,0,0|1,1,0]=4 6795 B16R2.35 Cc1c(cccc1Sc2cccnc2)Br 62a_100012353703_100000210063 [0,2,0,0,0,0|1,1,0]=4 6796 B16R2.35 Cc1c(cccc1Sc2cccnc2)Cl 62a_100000210063_100000726075 [0,2,0,0,0,0|1,1,0]=4 6797 B16R2.35 Cc1c(cccc1Sc2cccnc2)Cl 62a_100000726075_100000210063 [0,2,0,0,0,0|1,1,0]=4 6798 B16R2.35 Cc1c(cccc1Sc2cccnc2)F 62a_100000210063_100011216893 [0,2,0,0,0,0|1,1,0]=4 6799 B16R2.35 Cc1c(cccc1Sc2cccnc2)F 62a_100011216893_100000210063 [0,2,0,0,0,0|1,1,0]=4 6800 B16R2.35 Cc1c(cccc1Sc2cccnc2)N 62a_100000210063_100000761887 [0,2,0,0,0,0|1,1,0]=4 6801 B16R2.35 Cc1c(cccc1Sc2cccnc2)N 62a_100000761887_100000210063 [0,2,0,0,0,0|1,1,0]=4 6802 B16R2.35 Cc1c(cccc1Sc2cccnc2)O 62a_100000210063_100012002258 [0,2,0,0,0,0|1,1,0]=4 6803 B16R2.35 Cc1c(cccc1Sc2cccnc2)O 62a_100012002258_100000210063 [0,2,0,0,0,0|1,1,0]=4 6804 B16R2.35 Cc1c(cccc1Sc2ccncc2)Br 62a_100000728582_100012353703 [0,2,0,0,0,0|1,1,0]=4 6805 B16R2.35 Cc1c(cccc1Sc2ccncc2)Br 62a_100012353703_100000728582 [0,2,0,0,0,0|1,1,0]=4 6806 B16R2.35 Cc1c(cccc1Sc2ccncc2)Cl 62a_100000726075_100000728582 [0,2,0,0,0,0|1,1,0]=4 6807 B16R2.35 Cc1c(cccc1Sc2ccncc2)Cl 62a_100000728582_100000726075 [0,2,0,0,0,0|1,1,0]=4 6808 B16R2.35 Cc1c(cccc1Sc2ccncc2)F 62a_100000728582_100011216893 [0,2,0,0,0,0|1,1,0]=4 6809 B16R2.35 Cc1c(cccc1Sc2ccncc2)F 62a_100011216893_100000728582 [0,2,0,0,0,0|1,1,0]=4 6810 B16R2.35 Cc1c(cccc1Sc2ccncc2)N 62a_100000728582_100000761887 [0,2,0,0,0,0|1,1,0]=4 6811 B16R2.35 Cc1c(cccc1Sc2ccncc2)N 62a_100000761887_100000728582 [0,2,0,0,0,0|1,1,0]=4 6812 B16R2.35 Cc1c(cccc1Sc2ccncc2)O 62a_100000728582_100012002258 [0,2,0,0,0,0|1,1,0]=4 6813 B16R2.35 Cc1c(cccc1Sc2ccncc2)O 62a_100012002258_100000728582 [0,2,0,0,0,0|1,1,0]=4 6814 B16R2.35 Cc1c(ccnc1Cl)Sc2ccccc2 62a_100000047055_100000041952 [0,2,0,0,0,0|1,1,0]=4 6815 B16R2.35 Cc1c(ccnc1Cl)Sc2ccccc2 62a_100000719477_100000047055 [0,2,0,0,0,0|1,1,0]=4 6816 B16R2.35 Cc1c(ccnc1F)Nc2ccccc2 27a_100000106764_100010006593 [0,2,0,0,0,0|2,0,0]=4 6817 B16R2.35 Cc1c(ccnc1F)Sc2ccccc2 62a_100000719477_100010006593 [0,2,0,0,0,0|1,1,0]=4 6818 B16R2.35 Cc1c(ccnc1F)Sc2ccccc2 62a_100010006593_100000041952 [0,2,0,0,0,0|1,1,0]=4 6819 B16R2.35 Cc1c(ccnc1N)Sc2ccccc2 62a_100000719477_100009865460 [0,2,0,0,0,0|1,1,0]=4 6820 B16R2.35 Cc1c(ccnc1N)Sc2ccccc2 62a_100009865460_100000041952 [0,2,0,0,0,0|1,1,0]=4 6821 B16R2.35 Cc1c(ccnc1Nc2ccccc2)F 27a_100000106764_100009846374 [0,2,0,0,0,0|2,0,0]=4 6822 B16R2.35 Cc1c(ccnc1O)Sc2ccccc2 62a_100000719477_100009858498 [0,2,0,0,0,0|1,1,0]=4 6823 B16R2.35 Cc1c(ccnc1O)Sc2ccccc2 62a_100009858498_100000041952 [0,2,0,0,0,0|1,1,0]=4 6824 B16R2.35 Cc1c(ccnc1Sc2ccccc2)F 62a_100000719477_100009846374 [0,2,0,0,0,0|1,1,0]=4 6825 B16R2.35 Cc1c(ccnc1Sc2ccccc2)F 62a_100009846374_100000041952 [0,2,0,0,0,0|1,1,0]=4 6826 B16R2.35 Cc1c(ccnc1Sc2ccccc2)N 62a_100000690622_100000041952 [0,2,0,0,0,0|1,1,0]=4 6827 B16R2.35 Cc1c(ccnc1Sc2ccccc2)N 62a_100000719477_100000690622 [0,2,0,0,0,0|1,1,0]=4 6828 B16R2.35 Cc1c(cncc1Sc2ccccc2)Br 62a_100000719477_100010109657 [0,2,0,0,0,0|1,1,0]=4 6829 B16R2.35 Cc1c(cncc1Sc2ccccc2)Br 62a_100010109657_100000041952 [0,2,0,0,0,0|1,1,0]=4 6830 B16R2.35 Cc1c(cncc1Sc2ccccc2)F 62a_100000719477_100009881546 [0,2,0,0,0,0|1,1,0]=4 6831 B16R2.35 Cc1c(cncc1Sc2ccccc2)F 62a_100009881546_100000041952 [0,2,0,0,0,0|1,1,0]=4 6832 B16R2.35 Cc1c(cncc1Sc2ccccc2)N 62a_100000719477_100011998293 [0,2,0,0,0,0|1,1,0]=4 6833 B16R2.35 Cc1c(cncc1Sc2ccccc2)N 62a_100011998293_100000041952 [0,2,0,0,0,0|1,1,0]=4 6834 B16R2.35 Cc1cccc(c1Br)Sc2ccccc2 62a_100000719477_100012362457 [0,2,0,0,0,0|0,1,0]=3 6835 B16R2.35 Cc1cccc(c1Br)Sc2ccccc2 62a_100012362457_100000041952 [0,2,0,0,0,0|0,1,0]=3 6836 B16R2.35 Cc1cccc(c1Br)Sc2ccccn2 62a_100011216584_100012362457 [0,2,0,0,0,0|1,1,0]=4 6837 B16R2.35 Cc1cccc(c1Br)Sc2ccccn2 62a_100012362457_100011216584 [0,2,0,0,0,0|1,1,0]=4 6838 B16R2.35 Cc1cccc(c1Br)Sc2cccnc2 62a_100000210063_100012362457 [0,2,0,0,0,0|1,1,0]=4 6839 B16R2.35 Cc1cccc(c1Br)Sc2cccnc2 62a_100012362457_100000210063 [0,2,0,0,0,0|1,1,0]=4 6840 B16R2.35 Cc1cccc(c1Br)Sc2ccncc2 62a_100000728582_100012362457 [0,2,0,0,0,0|1,1,0]=4 6841 B16R2.35 Cc1cccc(c1Br)Sc2ccncc2 62a_100012362457_100000728582 [0,2,0,0,0,0|1,1,0]=4 6842 B16R2.35 Cc1cccc(c1C)Sc2ccccc2 62a_100000719477_100011214922 [0,2,0,0,0,0|0,1,0]=3 6843 B16R2.35 Cc1cccc(c1C)Sc2ccccc2 62a_100011214922_100000041952 [0,2,0,0,0,0|0,1,0]=3 6844 B16R2.35 Cc1cccc(c1C)Sc2ccccn2 62a_100011214922_100011216584 [0,2,0,0,0,0|1,1,0]=4 6845 B16R2.35 Cc1cccc(c1C)Sc2ccccn2 62a_100011216584_100011214922 [0,2,0,0,0,0|1,1,0]=4 6846 B16R2.35 Cc1cccc(c1C)Sc2cccnc2 62a_100000210063_100011214922 [0,2,0,0,0,0|1,1,0]=4 6847 B16R2.35 Cc1cccc(c1C)Sc2cccnc2 62a_100011214922_100000210063 [0,2,0,0,0,0|1,1,0]=4 6848 B16R2.35 Cc1cccc(c1C)Sc2ccncc2 62a_100000728582_100011214922 [0,2,0,0,0,0|1,1,0]=4 6849 B16R2.35 Cc1cccc(c1C)Sc2ccncc2 62a_100011214922_100000728582 [0,2,0,0,0,0|1,1,0]=4 6850 B16R2.35 Cc1cccc(c1Cl)Sc2ccccc2 62a_100000719477_200012352035 [0,2,0,0,0,0|0,1,0]=3 6851 B16R2.35 Cc1cccc(c1Cl)Sc2ccccc2 62a_200012352035_100000041952 [0,2,0,0,0,0|0,1,0]=3 6852 B16R2.35 Cc1cccc(c1Cl)Sc2ccccn2 62a_100011216584_200012352035 [0,2,0,0,0,0|1,1,0]=4 6853 B16R2.35 Cc1cccc(c1Cl)Sc2ccccn2 62a_200012352035_100011216584 [0,2,0,0,0,0|1,1,0]=4 6854 B16R2.35 Cc1cccc(c1Cl)Sc2cccnc2 62a_100000210063_200012352035 [0,2,0,0,0,0|1,1,0]=4 6855 B16R2.35 Cc1cccc(c1Cl)Sc2cccnc2 62a_200012352035_100000210063 [0,2,0,0,0,0|1,1,0]=4 6856 B16R2.35 Cc1cccc(c1Cl)Sc2ccncc2 62a_100000728582_200012352035 [0,2,0,0,0,0|1,1,0]=4 6857 B16R2.35 Cc1cccc(c1Cl)Sc2ccncc2 62a_200012352035_100000728582 [0,2,0,0,0,0|1,1,0]=4 6858 B16R2.35 Cc1cccc(c1F)Sc2ccccc2 62a_100000717567_100000041952 [0,2,0,0,0,0|0,1,0]=3 6859 B16R2.35 Cc1cccc(c1F)Sc2ccccc2 62a_100000719477_100000717567 [0,2,0,0,0,0|0,1,0]=3 6860 B16R2.35 Cc1cccc(c1F)Sc2ccccn2 62a_100000717567_100011216584 [0,2,0,0,0,0|1,1,0]=4 6861 B16R2.35 Cc1cccc(c1F)Sc2ccccn2 62a_100011216584_100000717567 [0,2,0,0,0,0|1,1,0]=4 6862 B16R2.35 Cc1cccc(c1F)Sc2cccnc2 62a_100000210063_100000717567 [0,2,0,0,0,0|1,1,0]=4 6863 B16R2.35 Cc1cccc(c1F)Sc2cccnc2 62a_100000717567_100000210063 [0,2,0,0,0,0|1,1,0]=4 6864 B16R2.35 Cc1cccc(c1F)Sc2ccncc2 62a_100000717567_100000728582 [0,2,0,0,0,0|1,1,0]=4 6865 B16R2.35 Cc1cccc(c1F)Sc2ccncc2 62a_100000728582_100000717567 [0,2,0,0,0,0|1,1,0]=4 6866 B16R2.35 Cc1cccc(c1N)Sc2ccccc2 62a_100000719477_100011834072 [0,2,0,0,0,0|0,1,0]=3 6867 B16R2.35 Cc1cccc(c1N)Sc2ccccc2 62a_100011834072_100000041952 [0,2,0,0,0,0|0,1,0]=3 6868 B16R2.35 Cc1cccc(c1N)Sc2ccccn2 62a_100011216584_100011834072 [0,2,0,0,0,0|1,1,0]=4 6869 B16R2.35 Cc1cccc(c1N)Sc2ccccn2 62a_100011834072_100011216584 [0,2,0,0,0,0|1,1,0]=4 6870 B16R2.35 Cc1cccc(c1N)Sc2cccnc2 62a_100000210063_100011834072 [0,2,0,0,0,0|1,1,0]=4 6871 B16R2.35 Cc1cccc(c1N)Sc2cccnc2 62a_100011834072_100000210063 [0,2,0,0,0,0|1,1,0]=4 6872 B16R2.35 Cc1cccc(c1N)Sc2ccncc2 62a_100000728582_100011834072 [0,2,0,0,0,0|1,1,0]=4 6873 B16R2.35 Cc1cccc(c1N)Sc2ccncc2 62a_100011834072_100000728582 [0,2,0,0,0,0|1,1,0]=4 6874 B16R2.35 Cc1cccc(c1O)Sc2ccccc2 62a_100000719477_100009817157 [0,2,0,0,0,0|0,1,0]=3 6875 B16R2.35 Cc1cccc(c1O)Sc2ccccc2 62a_100009817157_100000041952 [0,2,0,0,0,0|0,1,0]=3 6876 B16R2.35 Cc1cccc(c1O)Sc2ccccn2 62a_100009817157_100011216584 [0,2,0,0,0,0|1,1,0]=4 6877 B16R2.35 Cc1cccc(c1O)Sc2ccccn2 62a_100011216584_100009817157 [0,2,0,0,0,0|1,1,0]=4 6878 B16R2.35 Cc1cccc(c1O)Sc2cccnc2 62a_100000210063_100009817157 [0,2,0,0,0,0|1,1,0]=4 6879 B16R2.35 Cc1cccc(c1O)Sc2cccnc2 62a_100009817157_100000210063 [0,2,0,0,0,0|1,1,0]=4 6880 B16R2.35 Cc1cccc(c1O)Sc2ccncc2 62a_100000728582_100009817157 [0,2,0,0,0,0|1,1,0]=4 6881 B16R2.35 Cc1cccc(c1O)Sc2ccncc2 62a_100009817157_100000728582 [0,2,0,0,0,0|1,1,0]=4 6882 B16R2.35 Cc1ccnc(c1C)Sc2ccccc2 62a_100000719477_100009847204 [0,2,0,0,0,0|1,1,0]=4 6883 B16R2.35 Cc1ccnc(c1C)Sc2ccccc2 62a_100009847204_100000041952 [0,2,0,0,0,0|1,1,0]=4 6884 B16R2.35 Cc1ccnc(c1F)Sc2ccccc2 62a_100000719477_100009817629 [0,2,0,0,0,0|1,1,0]=4 6885 B16R2.35 Cc1ccnc(c1F)Sc2ccccc2 62a_100009817629_100000041952 [0,2,0,0,0,0|1,1,0]=4 6886 B16R2.35 Cc1ccnc(c1N)Sc2ccccc2 62a_100000719477_100000763560 [0,2,0,0,0,0|1,1,0]=4 6887 B16R2.35 Cc1ccnc(c1N)Sc2ccccc2 62a_100000763560_100000041952 [0,2,0,0,0,0|1,1,0]=4 6888 B16R2.35 Cc1ccnc(c1O)Sc2ccccc2 62a_100000719477_100000696282 [0,2,0,0,0,0|1,1,0]=4 6889 B16R2.35 Cc1cncc(c1C)Sc2ccccc2 62a_100000719477_100009864703 [0,2,0,0,0,0|1,1,0]=4 6890 B16R2.35 Cc1cncc(c1C)Sc2ccccc2 62a_100009864703_100000041952 [0,2,0,0,0,0|1,1,0]=4 6891 B16R2.35 Cc1cncc(c1N)Sc2ccccc2 62a_100000719477_100009818025 [0,2,0,0,0,0|1,1,0]=4 6892 B16R2.35 Cc1cncc(c1N)Sc2ccccc2 62a_100009818025_100000041952 [0,2,0,0,0,0|1,1,0]=4 6893 B16R2.35 Cc1nccc(c1C)Sc2ccccc2 62a_100000719477_100009846815 [0,2,0,0,0,0|1,1,0]=4 6894 B16R2.35 Cc1nccc(c1C)Sc2ccccc2 62a_100009846815_100000041952 [0,2,0,0,0,0|1,1,0]=4 6895 B16R2.35 Cc1nccc(c1Cl)Nc2ccccc2 27a_100000106764_100000698670 [0,2,0,0,0,0|2,0,0]=4 6896 B16R2.35 Cc1nccc(c1Cl)Sc2ccccc2 62a_100000698670_100000041952 [0,2,0,0,0,0|1,1,0]=4 6897 B16R2.35 Cc1nccc(c1Cl)Sc2ccccc2 62a_100000719477_100000698670 [0,2,0,0,0,0|1,1,0]=4 6898 B16R2.35 Cc1nccc(c1F)Nc2ccccc2 27a_100000106764_100009849794 [0,2,0,0,0,0|2,0,0]=4 6899 B16R2.35 Cc1nccc(c1F)Sc2ccccc2 62a_100000719477_100009849794 [0,2,0,0,0,0|1,1,0]=4 6900 B16R2.35 Cc1nccc(c1F)Sc2ccccc2 62a_100009849794_100000041952 [0,2,0,0,0,0|1,1,0]=4 6901 B16R2.35 Cc1nccc(c1N)Sc2ccccc2 62a_100000719477_100009885578 [0,2,0,0,0,0|1,1,0]=4 6902 B16R2.35 Cc1nccc(c1N)Sc2ccccc2 62a_100009885578_100000041952 [0,2,0,0,0,0|1,1,0]=4 6903 B16R2.35 Clc1c(cccc1Sc2ccccc2)Br 62a_100000719477_100010142854 [0,2,0,0,0,0|0,1,0]=3 6904 B16R2.35 Clc1c(cccc1Sc2ccccc2)Br 62a_100010142854_100000041952 [0,2,0,0,0,0|0,1,0]=3 6905 B16R2.35 Clc1c(cccc1Sc2ccccn2)Br 62a_100010142854_100011216584 [0,2,0,0,0,0|1,1,0]=4 6906 B16R2.35 Clc1c(cccc1Sc2ccccn2)Br 62a_100011216584_100010142854 [0,2,0,0,0,0|1,1,0]=4 6907 B16R2.35 Clc1c(cccc1Sc2cccnc2)Br 62a_100000210063_100010142854 [0,2,0,0,0,0|1,1,0]=4 6908 B16R2.35 Clc1c(cccc1Sc2cccnc2)Br 62a_100010142854_100000210063 [0,2,0,0,0,0|1,1,0]=4 6909 B16R2.35 Clc1c(cccc1Sc2ccncc2)Br 62a_100000728582_100010142854 [0,2,0,0,0,0|1,1,0]=4 6910 B16R2.35 Clc1c(cccc1Sc2ccncc2)Br 62a_100010142854_100000728582 [0,2,0,0,0,0|1,1,0]=4 6911 B16R2.35 Clc1cccc(c1Br)Sc2ccccc2 62a_100000719477_100014021842 [0,2,0,0,0,0|0,1,0]=3 6912 B16R2.35 Clc1cccc(c1Br)Sc2ccccc2 62a_100014021842_100000041952 [0,2,0,0,0,0|0,1,0]=3 6913 B16R2.35 Clc1cccc(c1Br)Sc2ccccn2 62a_100011216584_100014021842 [0,2,0,0,0,0|1,1,0]=4 6914 B16R2.35 Clc1cccc(c1Br)Sc2ccccn2 62a_100014021842_100011216584 [0,2,0,0,0,0|1,1,0]=4 6915 B16R2.35 Clc1cccc(c1Br)Sc2cccnc2 62a_100000210063_100014021842 [0,2,0,0,0,0|1,1,0]=4 6916 B16R2.35 Clc1cccc(c1Br)Sc2cccnc2 62a_100014021842_100000210063 [0,2,0,0,0,0|1,1,0]=4 6917 B16R2.35 Clc1cccc(c1Br)Sc2ccncc2 62a_100000728582_100014021842 [0,2,0,0,0,0|1,1,0]=4 6918 B16R2.35 Clc1cccc(c1Br)Sc2ccncc2 62a_100014021842_100000728582 [0,2,0,0,0,0|1,1,0]=4 6919 B16R2.35 Clc1cccc(c1Cl)Sc2ccccc2 62a_100000719477_100011215384 [0,2,0,0,0,0|0,1,0]=3 6920 B16R2.35 Clc1cccc(c1Cl)Sc2ccccc2 62a_100011215384_100000041952 [0,2,0,0,0,0|0,1,0]=3 6921 B16R2.35 Clc1cccc(c1Cl)Sc2ccccn2 62a_100011215384_100011216584 [0,2,0,0,0,0|1,1,0]=4 6922 B16R2.35 Clc1cccc(c1Cl)Sc2ccccn2 62a_100011216584_100011215384 [0,2,0,0,0,0|1,1,0]=4 6923 B16R2.35 Clc1cccc(c1Cl)Sc2cccnc2 62a_100000210063_100011215384 [0,2,0,0,0,0|1,1,0]=4 6924 B16R2.35 Clc1cccc(c1Cl)Sc2cccnc2 62a_100011215384_100000210063 [0,2,0,0,0,0|1,1,0]=4 6925 B16R2.35 Clc1cccc(c1Cl)Sc2ccncc2 62a_100000728582_100011215384 [0,2,0,0,0,0|1,1,0]=4 6926 B16R2.35 Clc1cccc(c1Cl)Sc2ccncc2 62a_100011215384_100000728582 [0,2,0,0,0,0|1,1,0]=4 6927 B16R2.35 Clc1nccc(c1Cl)Sc2ccccc2 62a_100000719477_100010246212 [0,2,0,0,0,0|1,1,0]=4 6928 B16R2.35 Clc1nccc(c1Cl)Sc2ccccc2 62a_100010246212_100000041952 [0,2,0,0,0,0|1,1,0]=4 6929 B16R2.35 Cn1c(cccc1=O)Sc2ccccc2 62a_100000719477_100000726605 [0,2,0,0,0,0|1,1,0]=4 6930 B16R2.35 Cn1c(cccc1=O)Sc2ccccc2 62a_100000726605_100000041952 [0,2,0,0,0,0|1,1,0]=4 6931 B16R2.35 Cn1cccc(c1=O)Sc2ccccc2 62a_100000687173_100000041952 [0,2,0,0,0,0|1,1,0]=4 6932 B16R2.35 Cn1cccc(c1=O)Sc2ccccc2 62a_100000719477_100000687173 [0,2,0,0,0,0|1,1,0]=4 6933 B16R2.35 Fc1c(cccc1Sc2ccccc2)Br 62a_100000702267_100000041952 [0,2,0,0,0,0|0,1,0]=3 6934 B16R2.35 Fc1c(cccc1Sc2ccccc2)Br 62a_100000719477_100000702267 [0,2,0,0,0,0|0,1,0]=3 6935 B16R2.35 Fc1c(cccc1Sc2ccccc2)Cl 62a_100000719477_100011217346 [0,2,0,0,0,0|0,1,0]=3 6936 B16R2.35 Fc1c(cccc1Sc2ccccc2)Cl 62a_100011217346_100000041952 [0,2,0,0,0,0|0,1,0]=3 6937 B16R2.35 Fc1c(cccc1Sc2ccccn2)Br 62a_100000702267_100011216584 [0,2,0,0,0,0|1,1,0]=4 6938 B16R2.35 Fc1c(cccc1Sc2ccccn2)Br 62a_100011216584_100000702267 [0,2,0,0,0,0|1,1,0]=4 6939 B16R2.35 Fc1c(cccc1Sc2ccccn2)Cl 62a_100011216584_100011217346 [0,2,0,0,0,0|1,1,0]=4 6940 B16R2.35 Fc1c(cccc1Sc2ccccn2)Cl 62a_100011217346_100011216584 [0,2,0,0,0,0|1,1,0]=4 6941 B16R2.35 Fc1c(cccc1Sc2cccnc2)Br 62a_100000210063_100000702267 [0,2,0,0,0,0|1,1,0]=4 6942 B16R2.35 Fc1c(cccc1Sc2cccnc2)Br 62a_100000702267_100000210063 [0,2,0,0,0,0|1,1,0]=4 6943 B16R2.35 Fc1c(cccc1Sc2cccnc2)Cl 62a_100000210063_100011217346 [0,2,0,0,0,0|1,1,0]=4 6944 B16R2.35 Fc1c(cccc1Sc2cccnc2)Cl 62a_100011217346_100000210063 [0,2,0,0,0,0|1,1,0]=4 6945 B16R2.35 Fc1c(cccc1Sc2ccncc2)Br 62a_100000702267_100000728582 [0,2,0,0,0,0|1,1,0]=4 6946 B16R2.35 Fc1c(cccc1Sc2ccncc2)Br 62a_100000728582_100000702267 [0,2,0,0,0,0|1,1,0]=4 6947 B16R2.35 Fc1c(cccc1Sc2ccncc2)Cl 62a_100000728582_100011217346 [0,2,0,0,0,0|1,1,0]=4 6948 B16R2.35 Fc1c(cccc1Sc2ccncc2)Cl 62a_100011217346_100000728582 [0,2,0,0,0,0|1,1,0]=4 6949 B16R2.35 Fc1c(ccnc1Br)Sc2ccccc2 62a_100000719477_200015269031 [0,2,0,0,0,0|1,1,0]=4 6950 B16R2.35 Fc1c(ccnc1Br)Sc2ccccc2 62a_200015269031_100000041952 [0,2,0,0,0,0|1,1,0]=4 6951 B16R2.35 Fc1c(ccnc1Cl)Sc2ccccc2 62a_100000719477_100010150473 [0,2,0,0,0,0|1,1,0]=4 6952 B16R2.35 Fc1c(ccnc1Cl)Sc2ccccc2 62a_100010150473_100000041952 [0,2,0,0,0,0|1,1,0]=4 6953 B16R2.35 Fc1cccc(c1Br)Sc2ccccc2 62a_100000719477_100010202630 [0,2,0,0,0,0|0,1,0]=3 6954 B16R2.35 Fc1cccc(c1Br)Sc2ccccc2 62a_100010202630_100000041952 [0,2,0,0,0,0|0,1,0]=3 6955 B16R2.35 Fc1cccc(c1Br)Sc2ccccn2 62a_100010202630_100011216584 [0,2,0,0,0,0|1,1,0]=4 6956 B16R2.35 Fc1cccc(c1Br)Sc2ccccn2 62a_100011216584_100010202630 [0,2,0,0,0,0|1,1,0]=4 6957 B16R2.35 Fc1cccc(c1Br)Sc2cccnc2 62a_100000210063_100010202630 [0,2,0,0,0,0|1,1,0]=4 6958 B16R2.35 Fc1cccc(c1Br)Sc2cccnc2 62a_100010202630_100000210063 [0,2,0,0,0,0|1,1,0]=4 6959 B16R2.35 Fc1cccc(c1Br)Sc2ccncc2 62a_100000728582_100010202630 [0,2,0,0,0,0|1,1,0]=4 6960 B16R2.35 Fc1cccc(c1Br)Sc2ccncc2 62a_100010202630_100000728582 [0,2,0,0,0,0|1,1,0]=4 6961 B16R2.35 Fc1cccc(c1Cl)Sc2ccccc2 62a_100000719477_200010234923 [0,2,0,0,0,0|0,1,0]=3 6962 B16R2.35 Fc1cccc(c1Cl)Sc2ccccc2 62a_200010234923_100000041952 [0,2,0,0,0,0|0,1,0]=3 6963 B16R2.35 Fc1cccc(c1Cl)Sc2ccccn2 62a_100011216584_200010234923 [0,2,0,0,0,0|1,1,0]=4 6964 B16R2.35 Fc1cccc(c1Cl)Sc2ccccn2 62a_200010234923_100011216584 [0,2,0,0,0,0|1,1,0]=4 6965 B16R2.35 Fc1cccc(c1Cl)Sc2cccnc2 62a_100000210063_200010234923 [0,2,0,0,0,0|1,1,0]=4 6966 B16R2.35 Fc1cccc(c1Cl)Sc2cccnc2 62a_200010234923_100000210063 [0,2,0,0,0,0|1,1,0]=4 6967 B16R2.35 Fc1cccc(c1Cl)Sc2ccncc2 62a_100000728582_200010234923 [0,2,0,0,0,0|1,1,0]=4 6968 B16R2.35 Fc1cccc(c1Cl)Sc2ccncc2 62a_200010234923_100000728582 [0,2,0,0,0,0|1,1,0]=4 6969 B16R2.35 Fc1cccc(c1F)Sc2ccccc2 62a_100000694657_100000041952 [0,2,0,0,0,0|0,1,0]=3 6970 B16R2.35 Fc1cccc(c1F)Sc2ccccc2 62a_100000719477_100000694657 [0,2,0,0,0,0|0,1,0]=3 6971 B16R2.35 Fc1cccc(c1F)Sc2ccccn2 62a_100000694657_100011216584 [0,2,0,0,0,0|1,1,0]=4 6972 B16R2.35 Fc1cccc(c1F)Sc2ccccn2 62a_100011216584_100000694657 [0,2,0,0,0,0|1,1,0]=4 6973 B16R2.35 Fc1cccc(c1F)Sc2cccnc2 62a_100000210063_100000694657 [0,2,0,0,0,0|1,1,0]=4 6974 B16R2.35 Fc1cccc(c1F)Sc2cccnc2 62a_100000694657_100000210063 [0,2,0,0,0,0|1,1,0]=4 6975 B16R2.35 Fc1cccc(c1F)Sc2ccncc2 62a_100000694657_100000728582 [0,2,0,0,0,0|1,1,0]=4 6976 B16R2.35 Fc1cccc(c1F)Sc2ccncc2 62a_100000728582_100000694657 [0,2,0,0,0,0|1,1,0]=4 6977 B16R2.35 Fc1nccc(c1Br)Nc2ccccc2 27a_100000106764_100010006599 [0,2,0,0,0,0|2,0,0]=4 6978 B16R2.35 Fc1nccc(c1Br)Sc2ccccc2 62a_100000719477_100010006599 [0,2,0,0,0,0|1,1,0]=4 6979 B16R2.35 Fc1nccc(c1Br)Sc2ccccc2 62a_100010006599_100000041952 [0,2,0,0,0,0|1,1,0]=4 6980 B16R2.35 Fc1nccc(c1Cl)Nc2ccccc2 27a_100000106764_100010067886 [0,2,0,0,0,0|2,0,0]=4 6981 B16R2.35 Fc1nccc(c1Cl)Sc2ccccc2 62a_100000719477_100010067886 [0,2,0,0,0,0|1,1,0]=4 6982 B16R2.35 Fc1nccc(c1Cl)Sc2ccccc2 62a_100010067886_100000041952 [0,2,0,0,0,0|1,1,0]=4 6983 B16R2.35 Fc1nccc(c1F)Nc2ccccc2 27a_100000106764_100010214882 [0,2,0,0,0,0|2,0,0]=4 6984 B16R2.35 Fc1nccc(c1F)Sc2ccccc2 62a_100000719477_100010214882 [0,2,0,0,0,0|1,1,0]=4 6985 B16R2.35 Fc1nccc(c1F)Sc2ccccc2 62a_100010214882_100000041952 [0,2,0,0,0,0|1,1,0]=4 6986 B16R2.35 Nc1c(cccc1Sc2ccccc2)Br 62a_100000719477_100010146558 [0,2,0,0,0,0|0,1,0]=3 6987 B16R2.35 Nc1c(cccc1Sc2ccccc2)Br 62a_100010146558_100000041952 [0,2,0,0,0,0|0,1,0]=3 6988 B16R2.35 Nc1c(cccc1Sc2ccccc2)Cl 62a_100000719477_100010190421 [0,2,0,0,0,0|0,1,0]=3 6989 B16R2.35 Nc1c(cccc1Sc2ccccc2)Cl 62a_100010190421_100000041952 [0,2,0,0,0,0|0,1,0]=3 6990 B16R2.35 Nc1c(cccc1Sc2ccccc2)F 62a_100000042321_100000041952 [0,2,0,0,0,0|0,1,0]=3 6991 B16R2.35 Nc1c(cccc1Sc2ccccc2)F 62a_100000719477_100000042321 [0,2,0,0,0,0|0,1,0]=3 6992 B16R2.35 Nc1c(cccc1Sc2ccccc2)O 62a_100000719477_100011934926 [0,2,0,0,0,0|0,1,0]=3 6993 B16R2.35 Nc1c(cccc1Sc2ccccn2)Br 62a_100010146558_100011216584 [0,2,0,0,0,0|1,1,0]=4 6994 B16R2.35 Nc1c(cccc1Sc2ccccn2)Br 62a_100011216584_100010146558 [0,2,0,0,0,0|1,1,0]=4 6995 B16R2.35 Nc1c(cccc1Sc2ccccn2)Cl 62a_100010190421_100011216584 [0,2,0,0,0,0|1,1,0]=4 6996 B16R2.35 Nc1c(cccc1Sc2ccccn2)Cl 62a_100011216584_100010190421 [0,2,0,0,0,0|1,1,0]=4 6997 B16R2.35 Nc1c(cccc1Sc2ccccn2)F 62a_100000042321_100011216584 [0,2,0,0,0,0|1,1,0]=4 6998 B16R2.35 Nc1c(cccc1Sc2ccccn2)F 62a_100011216584_100000042321 [0,2,0,0,0,0|1,1,0]=4 6999 B16R2.35 Nc1c(cccc1Sc2ccccn2)O 62a_100011216584_100011934926 [0,2,0,0,0,0|1,1,0]=4 7000 B16R2.35 Nc1c(cccc1Sc2cccnc2)Br 62a_100000210063_100010146558 [0,2,0,0,0,0|1,1,0]=4 7001 B16R2.35 Nc1c(cccc1Sc2cccnc2)Br 62a_100010146558_100000210063 [0,2,0,0,0,0|1,1,0]=4 7002 B16R2.35 Nc1c(cccc1Sc2cccnc2)Cl 62a_100000210063_100010190421 [0,2,0,0,0,0|1,1,0]=4 7003 B16R2.35 Nc1c(cccc1Sc2cccnc2)Cl 62a_100010190421_100000210063 [0,2,0,0,0,0|1,1,0]=4 7004 B16R2.35 Nc1c(cccc1Sc2cccnc2)F 62a_100000042321_100000210063 [0,2,0,0,0,0|1,1,0]=4 7005 B16R2.35 Nc1c(cccc1Sc2cccnc2)F 62a_100000210063_100000042321 [0,2,0,0,0,0|1,1,0]=4 7006 B16R2.35 Nc1c(cccc1Sc2cccnc2)O 62a_100000210063_100011934926 [0,2,0,0,0,0|1,1,0]=4 7007 B16R2.35 Nc1c(cccc1Sc2ccncc2)Br 62a_100000728582_100010146558 [0,2,0,0,0,0|1,1,0]=4 7008 B16R2.35 Nc1c(cccc1Sc2ccncc2)Br 62a_100010146558_100000728582 [0,2,0,0,0,0|1,1,0]=4 7009 B16R2.35 Nc1c(cccc1Sc2ccncc2)Cl 62a_100000728582_100010190421 [0,2,0,0,0,0|1,1,0]=4 7010 B16R2.35 Nc1c(cccc1Sc2ccncc2)Cl 62a_100010190421_100000728582 [0,2,0,0,0,0|1,1,0]=4 7011 B16R2.35 Nc1c(cccc1Sc2ccncc2)F 62a_100000042321_100000728582 [0,2,0,0,0,0|1,1,0]=4 7012 B16R2.35 Nc1c(cccc1Sc2ccncc2)F 62a_100000728582_100000042321 [0,2,0,0,0,0|1,1,0]=4 7013 B16R2.35 Nc1c(cccc1Sc2ccncc2)O 62a_100000728582_100011934926 [0,2,0,0,0,0|1,1,0]=4 7014 B16R2.35 Nc1c(cncc1Sc2ccccc2)Br 62a_100000719477_100011290786 [0,2,0,0,0,0|1,1,0]=4 7015 B16R2.35 Nc1c(cncc1Sc2ccccc2)Br 62a_100011290786_100000041952 [0,2,0,0,0,0|1,1,0]=4 7016 B16R2.35 Nc1c(cncc1Sc2ccccc2)Cl 62a_100000684942_100000041952 [0,2,0,0,0,0|1,1,0]=4 7017 B16R2.35 Nc1c(cncc1Sc2ccccc2)Cl 62a_100000719477_100000684942 [0,2,0,0,0,0|1,1,0]=4 7018 B16R2.35 Nc1c(cncc1Sc2ccccc2)F 62a_100000719477_100009880649 [0,2,0,0,0,0|1,1,0]=4 7019 B16R2.35 Nc1c(cncc1Sc2ccccc2)F 62a_100009880649_100000041952 [0,2,0,0,0,0|1,1,0]=4 7020 B16R2.35 Nc1cccc(c1F)Sc2ccccc2 62a_100000719477_100011935091 [0,2,0,0,0,0|0,1,0]=3 7021 B16R2.35 Nc1cccc(c1F)Sc2ccccc2 62a_100011935091_100000041952 [0,2,0,0,0,0|0,1,0]=3 7022 B16R2.35 Nc1cccc(c1F)Sc2ccccn2 62a_100011216584_100011935091 [0,2,0,0,0,0|1,1,0]=4 7023 B16R2.35 Nc1cccc(c1F)Sc2ccccn2 62a_100011935091_100011216584 [0,2,0,0,0,0|1,1,0]=4 7024 B16R2.35 Nc1cccc(c1F)Sc2cccnc2 62a_100000210063_100011935091 [0,2,0,0,0,0|1,1,0]=4 7025 B16R2.35 Nc1cccc(c1F)Sc2cccnc2 62a_100011935091_100000210063 [0,2,0,0,0,0|1,1,0]=4 7026 B16R2.35 Nc1cccc(c1F)Sc2ccncc2 62a_100000728582_100011935091 [0,2,0,0,0,0|1,1,0]=4 7027 B16R2.35 Nc1cccc(c1F)Sc2ccncc2 62a_100011935091_100000728582 [0,2,0,0,0,0|1,1,0]=4 7028 B16R2.35 Nc1cccc(c1N)Sc2ccccc2 62a_100015191791_100000041952 [0,2,0,0,0,0|0,1,0]=3 7029 B16R2.35 Nc1cccc(c1N)Sc2ccccn2 62a_100015191791_100011216584 [0,2,0,0,0,0|1,1,0]=4 7030 B16R2.35 Nc1cccc(c1N)Sc2cccnc2 62a_100015191791_100000210063 [0,2,0,0,0,0|1,1,0]=4 7031 B16R2.35 Nc1cccc(c1N)Sc2ccncc2 62a_100015191791_100000728582 [0,2,0,0,0,0|1,1,0]=4 7032 B16R2.35 Nc1cccc(c1O)Sc2ccccc2 62a_100000719477_100010084371 [0,2,0,0,0,0|0,1,0]=3 7033 B16R2.35 Nc1cccc(c1O)Sc2ccccc2 62a_100011934915_100000041952 [0,2,0,0,0,0|0,1,0]=3 7034 B16R2.35 Nc1cccc(c1O)Sc2ccccn2 62a_100011216584_100010084371 [0,2,0,0,0,0|1,1,0]=4 7035 B16R2.35 Nc1cccc(c1O)Sc2ccccn2 62a_100011934915_100011216584 [0,2,0,0,0,0|1,1,0]=4 7036 B16R2.35 Nc1cccc(c1O)Sc2cccnc2 62a_100000210063_100010084371 [0,2,0,0,0,0|1,1,0]=4 7037 B16R2.35 Nc1cccc(c1O)Sc2cccnc2 62a_100011934915_100000210063 [0,2,0,0,0,0|1,1,0]=4 7038 B16R2.35 Nc1cccc(c1O)Sc2ccncc2 62a_100000728582_100010084371 [0,2,0,0,0,0|1,1,0]=4 7039 B16R2.35 Nc1cccc(c1O)Sc2ccncc2 62a_100011934915_100000728582 [0,2,0,0,0,0|1,1,0]=4 7040 B16R2.35 Nc1ccnc(c1F)Sc2ccccc2 62a_100000719477_100015205195 [0,2,0,0,0,0|1,1,0]=4 7041 B16R2.35 Nc1ccnc(c1F)Sc2ccccc2 62a_100015205195_100000041952 [0,2,0,0,0,0|1,1,0]=4 7042 B16R2.35 Nc1ccnc(c1N)Sc2ccccc2 62a_100000085203_100000041952 [0,2,0,0,0,0|1,1,0]=4 7043 B16R2.35 Nc1ccnc(c1N)Sc2ccccc2 62a_100000719477_100000085203 [0,2,0,0,0,0|1,1,0]=4 7044 B16R2.35 Nc1ccnc(c1O)Sc2ccccc2 62a_100000719477_100009844647 [0,2,0,0,0,0|1,1,0]=4 7045 B16R2.35 Nc1cncc(c1N)Sc2ccccc2 62a_100000694774_100000041952 [0,2,0,0,0,0|1,1,0]=4 7046 B16R2.35 Nc1cncc(c1N)Sc2ccccc2 62a_100000719477_100000694774 [0,2,0,0,0,0|1,1,0]=4 7047 B16R2.35 Nc1cncc(c1O)Sc2ccccc2 62a_100000694263_100000041952 [0,2,0,0,0,0|1,1,0]=4 7048 B16R2.35 Nc1cncc(c1O)Sc2ccccc2 62a_100000719477_100000694263 [0,2,0,0,0,0|1,1,0]=4 7049 B16R2.35 Nc1nccc(c1Cl)Sc2ccccc2 62a_100000719477_100010735111 [0,2,0,0,0,0|1,1,0]=4 7050 B16R2.35 Nc1nccc(c1Cl)Sc2ccccc2 62a_100010735111_100000041952 [0,2,0,0,0,0|1,1,0]=4 7051 B16R2.35 Nc1nccc(c1F)Sc2ccccc2 62a_100000719477_100010077785 [0,2,0,0,0,0|1,1,0]=4 7052 B16R2.35 Nc1nccc(c1F)Sc2ccccc2 62a_100010077785_100000041952 [0,2,0,0,0,0|1,1,0]=4 7053 B16R2.35 Nc1nccc(c1N)Sc2ccccc2 62a_100000124095_100000041952 [0,2,0,0,0,0|1,1,0]=4 7054 B16R2.35 Oc1c(cccc1Sc2ccccc2)Br 62a_100000719477_100010084509 [0,2,0,0,0,0|0,1,0]=3 7055 B16R2.35 Oc1c(cccc1Sc2ccccc2)Br 62a_100010084509_100000041952 [0,2,0,0,0,0|0,1,0]=3 7056 B16R2.35 Oc1c(cccc1Sc2ccccc2)Cl 62a_100000719477_100010202889 [0,2,0,0,0,0|0,1,0]=3 7057 B16R2.35 Oc1c(cccc1Sc2ccccc2)Cl 62a_100010202889_100000041952 [0,2,0,0,0,0|0,1,0]=3 7058 B16R2.35 Oc1c(cccc1Sc2ccccc2)F 62a_100000719477_100009813666 [0,2,0,0,0,0|0,1,0]=3 7059 B16R2.35 Oc1c(cccc1Sc2ccccc2)F 62a_100009813666_100000041952 [0,2,0,0,0,0|0,1,0]=3 7060 B16R2.35 Oc1c(cccc1Sc2ccccn2)Br 62a_100010084509_100011216584 [0,2,0,0,0,0|1,1,0]=4 7061 B16R2.35 Oc1c(cccc1Sc2ccccn2)Br 62a_100011216584_100010084509 [0,2,0,0,0,0|1,1,0]=4 7062 B16R2.35 Oc1c(cccc1Sc2ccccn2)Cl 62a_100010202889_100011216584 [0,2,0,0,0,0|1,1,0]=4 7063 B16R2.35 Oc1c(cccc1Sc2ccccn2)Cl 62a_100011216584_100010202889 [0,2,0,0,0,0|1,1,0]=4 7064 B16R2.35 Oc1c(cccc1Sc2ccccn2)F 62a_100009813666_100011216584 [0,2,0,0,0,0|1,1,0]=4 7065 B16R2.35 Oc1c(cccc1Sc2ccccn2)F 62a_100011216584_100009813666 [0,2,0,0,0,0|1,1,0]=4 7066 B16R2.35 Oc1c(cccc1Sc2cccnc2)Br 62a_100000210063_100010084509 [0,2,0,0,0,0|1,1,0]=4 7067 B16R2.35 Oc1c(cccc1Sc2cccnc2)Br 62a_100010084509_100000210063 [0,2,0,0,0,0|1,1,0]=4 7068 B16R2.35 Oc1c(cccc1Sc2cccnc2)Cl 62a_100000210063_100010202889 [0,2,0,0,0,0|1,1,0]=4 7069 B16R2.35 Oc1c(cccc1Sc2cccnc2)Cl 62a_100010202889_100000210063 [0,2,0,0,0,0|1,1,0]=4 7070 B16R2.35 Oc1c(cccc1Sc2cccnc2)F 62a_100000210063_100009813666 [0,2,0,0,0,0|1,1,0]=4 7071 B16R2.35 Oc1c(cccc1Sc2cccnc2)F 62a_100009813666_100000210063 [0,2,0,0,0,0|1,1,0]=4 7072 B16R2.35 Oc1c(cccc1Sc2ccncc2)Br 62a_100000728582_100010084509 [0,2,0,0,0,0|1,1,0]=4 7073 B16R2.35 Oc1c(cccc1Sc2ccncc2)Br 62a_100010084509_100000728582 [0,2,0,0,0,0|1,1,0]=4 7074 B16R2.35 Oc1c(cccc1Sc2ccncc2)Cl 62a_100000728582_100010202889 [0,2,0,0,0,0|1,1,0]=4 7075 B16R2.35 Oc1c(cccc1Sc2ccncc2)Cl 62a_100010202889_100000728582 [0,2,0,0,0,0|1,1,0]=4 7076 B16R2.35 Oc1c(cccc1Sc2ccncc2)F 62a_100000728582_100009813666 [0,2,0,0,0,0|1,1,0]=4 7077 B16R2.35 Oc1c(cccc1Sc2ccncc2)F 62a_100009813666_100000728582 [0,2,0,0,0,0|1,1,0]=4 7078 B16R2.35 Oc1c(ccnc1Cl)Sc2ccccc2 62a_100000719477_100010067911 [0,2,0,0,0,0|1,1,0]=4 7079 B16R2.35 Oc1c(ccnc1Sc2ccccc2)F 62a_100000719477_100009867227 [0,2,0,0,0,0|1,1,0]=4 7080 B16R2.35 Oc1cccc(c1Br)Sc2ccccc2 62a_100000719477_100010187914 [0,2,0,0,0,0|0,1,0]=3 7081 B16R2.35 Oc1cccc(c1Br)Sc2ccccc2 62a_100010187914_100000041952 [0,2,0,0,0,0|0,1,0]=3 7082 B16R2.35 Oc1cccc(c1Br)Sc2ccccn2 62a_100010187914_100011216584 [0,2,0,0,0,0|1,1,0]=4 7083 B16R2.35 Oc1cccc(c1Br)Sc2ccccn2 62a_100011216584_100010187914 [0,2,0,0,0,0|1,1,0]=4 7084 B16R2.35 Oc1cccc(c1Br)Sc2cccnc2 62a_100000210063_100010187914 [0,2,0,0,0,0|1,1,0]=4 7085 B16R2.35 Oc1cccc(c1Br)Sc2cccnc2 62a_100010187914_100000210063 [0,2,0,0,0,0|1,1,0]=4 7086 B16R2.35 Oc1cccc(c1Br)Sc2ccncc2 62a_100000728582_100010187914 [0,2,0,0,0,0|1,1,0]=4 7087 B16R2.35 Oc1cccc(c1Br)Sc2ccncc2 62a_100010187914_100000728582 [0,2,0,0,0,0|1,1,0]=4 7088 B16R2.35 Oc1cccc(c1Cl)Sc2ccccc2 62a_100000719477_100000049636 [0,2,0,0,0,0|0,1,0]=3 7089 B16R2.35 Oc1cccc(c1Cl)Sc2ccccn2 62a_100011216584_100000049636 [0,2,0,0,0,0|1,1,0]=4 7090 B16R2.35 Oc1cccc(c1Cl)Sc2cccnc2 62a_100000210063_100000049636 [0,2,0,0,0,0|1,1,0]=4 7091 B16R2.35 Oc1cccc(c1Cl)Sc2ccncc2 62a_100000728582_100000049636 [0,2,0,0,0,0|1,1,0]=4 7092 B16R2.35 Oc1cccc(c1F)Sc2ccccc2 62a_100000719477_100009817021 [0,2,0,0,0,0|0,1,0]=3 7093 B16R2.35 Oc1cccc(c1F)Sc2ccccc2 62a_100009817021_100000041952 [0,2,0,0,0,0|0,1,0]=3 7094 B16R2.35 Oc1cccc(c1F)Sc2ccccn2 62a_100009817021_100011216584 [0,2,0,0,0,0|1,1,0]=4 7095 B16R2.35 Oc1cccc(c1F)Sc2ccccn2 62a_100011216584_100009817021 [0,2,0,0,0,0|1,1,0]=4 7096 B16R2.35 Oc1cccc(c1F)Sc2cccnc2 62a_100000210063_100009817021 [0,2,0,0,0,0|1,1,0]=4 7097 B16R2.35 Oc1cccc(c1F)Sc2cccnc2 62a_100009817021_100000210063 [0,2,0,0,0,0|1,1,0]=4 7098 B16R2.35 Oc1cccc(c1F)Sc2ccncc2 62a_100000728582_100009817021 [0,2,0,0,0,0|1,1,0]=4 7099 B16R2.35 Oc1cccc(c1F)Sc2ccncc2 62a_100009817021_100000728582 [0,2,0,0,0,0|1,1,0]=4 7100 B16R2.35 Oc1cccc(c1O)Sc2ccccc2 62a_100000719477_100009815950 [0,2,0,0,0,0|0,1,0]=3 7101 B16R2.35 Oc1cccc(c1O)Sc2ccccn2 62a_100011216584_100009815950 [0,2,0,0,0,0|1,1,0]=4 7102 B16R2.35 Oc1cccc(c1O)Sc2cccnc2 62a_100000210063_100009815950 [0,2,0,0,0,0|1,1,0]=4 7103 B16R2.35 Oc1cccc(c1O)Sc2ccncc2 62a_100000728582_100009815950 [0,2,0,0,0,0|1,1,0]=4 7104 B16R2.35 Oc1ccnc(c1F)Sc2ccccc2 62a_100000719477_100009876375 [0,2,0,0,0,0|1,1,0]=4 7105 B16R2.35 Oc1ccnc(c1F)Sc2ccccc2 62a_100009876375_100000041952 [0,2,0,0,0,0|1,1,0]=4 7106 B16R2.236 C=C(c1ccccc1)c2cc(ccn2)C 271570a_100000068269_100000750283 [0,2,0,0,0,0|2,0,0]=4 7107 B16R2.236 C=C(c1ccccc1)c2cc(ccn2)Cl 271570a_100000068269_100010167805 [0,2,0,0,0,0|2,0,0]=4 7108 B16R2.236 C=C(c1ccccc1)c2cc(ccn2)F 271570a_100000068269_100009817058 [0,2,0,0,0,0|2,0,0]=4 7109 B16R2.236 C=C(c1ccccc1)c2cc(ccn2)N 271570a_100000068269_100009814236 [0,2,0,0,0,0|2,0,0]=4 7110 B16R2.236 C=C(c1ccccc1)c2cc(ccn2)O 271570a_100000068269_100000762945 [0,2,0,0,0,0|2,0,0]=4 7111 B16R2.236 C=C(c1ccccc1)c2cc[nH]c(=O)c2 271570a_100000068269_100009816521 [0,2,0,0,0,0|2,0,0]=4 7112 B16R2.236 C=C(c1ccccc1)c2ccc[n+](c2)C 271570a_100000068269_100009996589 [0,2,0,0,0,0|2,0,0]=4 7113 B16R2.236 C=C(c1ccccc1)c2ccc[n+](c2)[O-] 271570a_100000068269_100009815978 [0,2,0,0,0,0|2,0,0]=4 7114 B16R2.236 C=C(c1ccccc1)c2cccc(=O)[nH]2 271570a_100000068269_100000761760 [0,2,0,0,0,0|2,0,0]=4 7115 B16R2.236 C=C(c1ccccc1)c2cccc(c2)Br 271570a_100000068269_100000691529 [0,2,0,0,0,0|1,0,0]=3 7116 B16R2.236 C=C(c1ccccc1)c2cccc(c2)C 271570a_100000068269_100011215228 [0,2,0,0,0,0|1,0,0]=3 7117 B16R2.236 C=C(c1ccccc1)c2cccc(c2)Cl 271570a_100000068269_100000699651 [0,2,0,0,0,0|1,0,0]=3 7118 B16R2.236 C=C(c1ccccc1)c2cccc(c2)F 271570a_100000068269_100000685547 [0,2,0,0,0,0|1,0,0]=3 7119 B16R2.236 C=C(c1ccccc1)c2cccc(c2)N 271570a_100000068269_100000210019 [0,2,0,0,0,0|1,0,0]=3 7120 B16R2.236 C=C(c1ccccc1)c2cccc(c2)O 271570a_100000068269_100000211634 [0,2,0,0,0,0|1,0,0]=3 7121 B16R2.236 C=C(c1ccccc1)c2cccc(c2)[S] 271570a_100000068269_114929384022 [0,2,0,0,0,0|1,0,0]=3 7122 B16R2.236 C=C(c1ccccc1)c2cccc(n2)Br 271570a_100000068269_100000684672 [0,2,0,0,0,0|2,0,0]=4 7123 B16R2.236 C=C(c1ccccc1)c2cccc(n2)C 271570a_100000068269_100000742759 [0,2,0,0,0,0|2,0,0]=4 7124 B16R2.236 C=C(c1ccccc1)c2cccc(n2)F 271570a_100000068269_100009815982 [0,2,0,0,0,0|2,0,0]=4 7125 B16R2.236 C=C(c1ccccc1)c2cccc(n2)N 271570a_100000068269_100000740741 [0,2,0,0,0,0|2,0,0]=4 7126 B16R2.236 C=C(c1ccccc1)c2ccnc(c2)Br 271570a_100000068269_100009814637 [0,2,0,0,0,0|2,0,0]=4 7127 B16R2.236 C=C(c1ccccc1)c2ccnc(c2)C 271570a_100000068269_100000758586 [0,2,0,0,0,0|2,0,0]=4 7128 B16R2.236 C=C(c1ccccc1)c2ccnc(c2)Cl 271570a_100000068269_100000035001 [0,2,0,0,0,0|2,0,0]=4 7129 B16R2.236 C=C(c1ccccc1)c2ccnc(c2)F 271570a_100000068269_100009816116 [0,2,0,0,0,0|2,0,0]=4 7130 B16R2.236 C=C(c1ccccc1)c2ccnc(c2)N 271570a_100000068269_100000744379 [0,2,0,0,0,0|2,0,0]=4 7131 B16R2.236 C=C(c1ccccc1)c2cncc(c2)Br 271570a_100000068269_100000728054 [0,2,0,0,0,0|2,0,0]=4 7132 B16R2.236 C=C(c1ccccc1)c2cncc(c2)C 271570a_100000068269_100000760492 [0,2,0,0,0,0|2,0,0]=4 7133 B16R2.236 C=C(c1ccccc1)c2cncc(c2)Cl 271570a_100000068269_100000049639 [0,2,0,0,0,0|2,0,0]=4 7134 B16R2.236 C=C(c1ccccc1)c2cncc(c2)F 271570a_100000068269_100000744099 [0,2,0,0,0,0|2,0,0]=4 7135 B16R2.236 C=C(c1ccccc1)c2cncc(c2)N 271570a_100000068269_100000687067 [0,2,0,0,0,0|2,0,0]=4 7136 B16R2.236 C=C(c1ccccc1)c2cncc(c2)O 271570a_100000068269_100000754920 [0,2,0,0,0,0|2,0,0]=4 7137 B16R2.236 NC(c1ccccc1)c2cccc(c2)O 271570a_203496583355_100011212009 [0,2,0,0,0,0|1,0,0]=3 7138 B16R2.236 O=C(c1ccccc1)c2cccc(c2)O 271570a_203496583355_100011267660 [0,2,0,0,0,0|1,0,0]=3 7139 B16R2.236 O=C(c1ccccc1)c2cncc(c2)O 271570a_203496583355_100011267668 [0,2,0,0,0,0|2,0,0]=4 7140 B16R2.251 Brc1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_100000691529 [0,2,0,0,0,0|0,1,0]=3 7141 B16R2.251 Brc1cccc(c1)Sc2cccc(n2)Br 62a_100000684672_100000691529 [0,2,0,0,0,0|1,1,0]=4 7142 B16R2.251 Brc1cccc(c1)Sc2cccc(n2)Br 62a_100000691529_100000684672 [0,2,0,0,0,0|1,1,0]=4 7143 B16R2.251 Brc1cccc(c1)Sc2ccnc(c2)Br 62a_100000691529_100009814637 [0,2,0,0,0,0|1,1,0]=4 7144 B16R2.251 Brc1cccc(c1)Sc2ccnc(c2)Br 62a_100009814637_100000691529 [0,2,0,0,0,0|1,1,0]=4 7145 B16R2.251 Brc1cccc(c1)Sc2cncc(c2)Br 62a_100000691529_100000728054 [0,2,0,0,0,0|1,1,0]=4 7146 B16R2.251 Brc1cccc(c1)Sc2cncc(c2)Br 62a_100000728054_100000691529 [0,2,0,0,0,0|1,1,0]=4 7147 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_100009996589 [0,2,0,0,0,0|1,1,0]=4 7148 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)Br 62a_100009996589_100000691529 [0,2,0,0,0,0|1,1,0]=4 7149 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)Cl 62a_100000699651_100009996589 [0,2,0,0,0,0|1,1,0]=4 7150 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)Cl 62a_100009996589_100000699651 [0,2,0,0,0,0|1,1,0]=4 7151 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)F 62a_100000685547_100009996589 [0,2,0,0,0,0|1,1,0]=4 7152 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)F 62a_100009996589_100000685547 [0,2,0,0,0,0|1,1,0]=4 7153 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)N 62a_100000210019_100009996589 [0,2,0,0,0,0|1,1,0]=4 7154 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)N 62a_100009996589_100000210019 [0,2,0,0,0,0|1,1,0]=4 7155 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)O 62a_100009996589_100000211634 [0,2,0,0,0,0|1,1,0]=4 7156 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)[S] 62a_100009996589_114929384022 [0,2,0,0,0,0|1,1,0]=4 7157 B16R2.251 C[n+]1cccc(c1)Sc2cccc(c2)[S] 62a_114929384022_100009996589 [0,2,0,0,0,0|1,1,0]=4 7158 B16R2.251 Cc1cc(ccn1)Nc2cccc(c2)Br 27a_100000210019_100000758586 [0,2,0,0,0,0|2,0,0]=4 7159 B16R2.251 Cc1cc(ccn1)Nc2cccc(c2)Cl 27a_100000185859_100000758586 [0,2,0,0,0,0|2,0,0]=4 7160 B16R2.251 Cc1cc(ccn1)Nc2cccc(c2)F 27a_100000210047_100000758586 [0,2,0,0,0,0|2,0,0]=4 7161 B16R2.251 Cc1cc(ccn1)Nc2cccc(c2)I 27a_100000211102_100000758586 [0,2,0,0,0,0|2,0,0]=4 7162 B16R2.251 Cc1cc(ccn1)Nc2cccc(c2)O 27a_100000210217_100000758586 [0,2,0,0,0,0|2,0,0]=4 7163 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)Br 62a_100000691529_100000758586 [0,2,0,0,0,0|1,1,0]=4 7164 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)Br 62a_100000758586_100000691529 [0,2,0,0,0,0|1,1,0]=4 7165 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)Cl 62a_100000699651_100000758586 [0,2,0,0,0,0|1,1,0]=4 7166 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)Cl 62a_100000758586_100000699651 [0,2,0,0,0,0|1,1,0]=4 7167 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)F 62a_100000685547_100000758586 [0,2,0,0,0,0|1,1,0]=4 7168 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)F 62a_100000758586_100000685547 [0,2,0,0,0,0|1,1,0]=4 7169 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)N 62a_100000210019_100000758586 [0,2,0,0,0,0|1,1,0]=4 7170 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)N 62a_100000758586_100000210019 [0,2,0,0,0,0|1,1,0]=4 7171 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)O 62a_100000758586_100000211634 [0,2,0,0,0,0|1,1,0]=4 7172 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)[S] 62a_100000758586_114929384022 [0,2,0,0,0,0|1,1,0]=4 7173 B16R2.251 Cc1cc(ccn1)Sc2cccc(c2)[S] 62a_114929384022_100000758586 [0,2,0,0,0,0|1,1,0]=4 7174 B16R2.251 Cc1cccc(c1)Nc2cc(ccn2)F 27a_100000188690_100000764206 [0,2,0,0,0,0|2,0,0]=4 7175 B16R2.251 Cc1cccc(c1)Nc2cc[nH]c(=O)c2 27a_100000188690_100000061649 [0,2,0,0,0,0|2,0,0]=4 7176 B16R2.251 Cc1cccc(c1)Nc2cccc(n2)F 27a_100000188690_100009815982 [0,2,0,0,0,0|2,0,0]=4 7177 B16R2.251 Cc1cccc(c1)Nc2ccnc(c2)C 27a_100000188690_100000758586 [0,2,0,0,0,0|2,0,0]=4 7178 B16R2.251 Cc1cccc(c1)Nc2ccnc(c2)F 27a_100000188690_100009816116 [0,2,0,0,0,0|2,0,0]=4 7179 B16R2.251 Cc1cccc(c1)Sc2cc(=O)cc[nH]2 62a_100009817434_100011215228 [0,2,0,0,0,0|1,1,0]=4 7180 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)C 62a_100000750283_100011215228 [0,2,0,0,0,0|1,1,0]=4 7181 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)C 62a_100011215228_100000750283 [0,2,0,0,0,0|1,1,0]=4 7182 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)Cl 62a_100010167805_100011215228 [0,2,0,0,0,0|1,1,0]=4 7183 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)Cl 62a_100011215228_100010167805 [0,2,0,0,0,0|1,1,0]=4 7184 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)F 62a_100000764206_100011215228 [0,2,0,0,0,0|1,1,0]=4 7185 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)F 62a_100011215228_100000764206 [0,2,0,0,0,0|1,1,0]=4 7186 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)N 62a_100009814236_100011215228 [0,2,0,0,0,0|1,1,0]=4 7187 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)N 62a_100011215228_100009814236 [0,2,0,0,0,0|1,1,0]=4 7188 B16R2.251 Cc1cccc(c1)Sc2cc(ccn2)O 62a_100011215228_100000762945 [0,2,0,0,0,0|1,1,0]=4 7189 B16R2.251 Cc1cccc(c1)Sc2cc[nH]c(=O)c2 62a_100009816521_100011215228 [0,2,0,0,0,0|1,1,0]=4 7190 B16R2.251 Cc1cccc(c1)Sc2cc[nH]c(=O)c2 62a_100011215228_100009816521 [0,2,0,0,0,0|1,1,0]=4 7191 B16R2.251 Cc1cccc(c1)Sc2ccc[n+](c2)C 62a_100009996589_100011215228 [0,2,0,0,0,0|1,1,0]=4 7192 B16R2.251 Cc1cccc(c1)Sc2ccc[n+](c2)C 62a_100011215228_100009996589 [0,2,0,0,0,0|1,1,0]=4 7193 B16R2.251 Cc1cccc(c1)Sc2ccc[n+](c2)[O-] 62a_100011215228_100009815978 [0,2,0,0,0,0|1,1,0]=4 7194 B16R2.251 Cc1cccc(c1)Sc2cccc(=O)[nH]2 62a_100011215228_100000752884 [0,2,0,0,0,0|1,1,0]=4 7195 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_100011215228 [0,2,0,0,0,0|0,1,0]=3 7196 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)Br 62a_100011215228_100000691529 [0,2,0,0,0,0|0,1,0]=3 7197 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)C 62a_100011215228_100011215228 [0,2,0,0,0,0|0,1,0]=3 7198 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)Cl 62a_100000699651_100011215228 [0,2,0,0,0,0|0,1,0]=3 7199 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)Cl 62a_100011215228_100000699651 [0,2,0,0,0,0|0,1,0]=3 7200 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)F 62a_100000685547_100011215228 [0,2,0,0,0,0|0,1,0]=3 7201 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)F 62a_100011215228_100000685547 [0,2,0,0,0,0|0,1,0]=3 7202 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)N 62a_100000210019_100011215228 [0,2,0,0,0,0|0,1,0]=3 7203 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)N 62a_100011215228_100000210019 [0,2,0,0,0,0|0,1,0]=3 7204 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)O 62a_100011215228_100000211634 [0,2,0,0,0,0|0,1,0]=3 7205 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)[S] 62a_100011215228_114929384022 [0,2,0,0,0,0|0,1,0]=3 7206 B16R2.251 Cc1cccc(c1)Sc2cccc(c2)[S] 62a_114929384022_100011215228 [0,2,0,0,0,0|0,1,0]=3 7207 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)Br 62a_100000684672_100011215228 [0,2,0,0,0,0|1,1,0]=4 7208 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)Br 62a_100011215228_100000684672 [0,2,0,0,0,0|1,1,0]=4 7209 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)C 62a_100000742759_100011215228 [0,2,0,0,0,0|1,1,0]=4 7210 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)C 62a_100011215228_100000742759 [0,2,0,0,0,0|1,1,0]=4 7211 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)Cl 62a_100000051397_100011215228 [0,2,0,0,0,0|1,1,0]=4 7212 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)Cl 62a_100011215228_100000051397 [0,2,0,0,0,0|1,1,0]=4 7213 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)F 62a_100009815982_100011215228 [0,2,0,0,0,0|1,1,0]=4 7214 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)F 62a_100011215228_100009815982 [0,2,0,0,0,0|1,1,0]=4 7215 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)N 62a_100000740741_100011215228 [0,2,0,0,0,0|1,1,0]=4 7216 B16R2.251 Cc1cccc(c1)Sc2cccc(n2)N 62a_100011215228_100000740741 [0,2,0,0,0,0|1,1,0]=4 7217 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)Br 62a_100009814637_100011215228 [0,2,0,0,0,0|1,1,0]=4 7218 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)Br 62a_100011215228_100009814637 [0,2,0,0,0,0|1,1,0]=4 7219 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)C 62a_100000758586_100011215228 [0,2,0,0,0,0|1,1,0]=4 7220 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)C 62a_100011215228_100000758586 [0,2,0,0,0,0|1,1,0]=4 7221 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)Cl 62a_100000035001_100011215228 [0,2,0,0,0,0|1,1,0]=4 7222 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)Cl 62a_100011215228_100000035001 [0,2,0,0,0,0|1,1,0]=4 7223 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)F 62a_100009816116_100011215228 [0,2,0,0,0,0|1,1,0]=4 7224 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)F 62a_100011215228_100009816116 [0,2,0,0,0,0|1,1,0]=4 7225 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)N 62a_100000049665_100011215228 [0,2,0,0,0,0|1,1,0]=4 7226 B16R2.251 Cc1cccc(c1)Sc2ccnc(c2)N 62a_100011215228_100000049665 [0,2,0,0,0,0|1,1,0]=4 7227 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)Br 62a_100000728054_100011215228 [0,2,0,0,0,0|1,1,0]=4 7228 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)Br 62a_100011215228_100000728054 [0,2,0,0,0,0|1,1,0]=4 7229 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)C 62a_100000760492_100011215228 [0,2,0,0,0,0|1,1,0]=4 7230 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)C 62a_100011215228_100000760492 [0,2,0,0,0,0|1,1,0]=4 7231 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)Cl 62a_100000049639_100011215228 [0,2,0,0,0,0|1,1,0]=4 7232 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)Cl 62a_100011215228_100000049639 [0,2,0,0,0,0|1,1,0]=4 7233 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)F 62a_100000744099_100011215228 [0,2,0,0,0,0|1,1,0]=4 7234 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)F 62a_100011215228_100000744099 [0,2,0,0,0,0|1,1,0]=4 7235 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)N 62a_100000687067_100011215228 [0,2,0,0,0,0|1,1,0]=4 7236 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)N 62a_100011215228_100000687067 [0,2,0,0,0,0|1,1,0]=4 7237 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)O 62a_100000754920_100011215228 [0,2,0,0,0,0|1,1,0]=4 7238 B16R2.251 Cc1cccc(c1)Sc2cncc(c2)O 62a_100011215228_100000754920 [0,2,0,0,0,0|1,1,0]=4 7239 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)Br 62a_100000691529_100000742759 [0,2,0,0,0,0|1,1,0]=4 7240 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)Br 62a_100000742759_100000691529 [0,2,0,0,0,0|1,1,0]=4 7241 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)Cl 62a_100000699651_100000742759 [0,2,0,0,0,0|1,1,0]=4 7242 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)Cl 62a_100000742759_100000699651 [0,2,0,0,0,0|1,1,0]=4 7243 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)F 62a_100000685547_100000742759 [0,2,0,0,0,0|1,1,0]=4 7244 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)F 62a_100000742759_100000685547 [0,2,0,0,0,0|1,1,0]=4 7245 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)N 62a_100000210019_100000742759 [0,2,0,0,0,0|1,1,0]=4 7246 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)N 62a_100000742759_100000210019 [0,2,0,0,0,0|1,1,0]=4 7247 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)O 62a_100000742759_100000211634 [0,2,0,0,0,0|1,1,0]=4 7248 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)[S] 62a_100000742759_114929384022 [0,2,0,0,0,0|1,1,0]=4 7249 B16R2.251 Cc1cccc(n1)Sc2cccc(c2)[S] 62a_114929384022_100000742759 [0,2,0,0,0,0|1,1,0]=4 7250 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)Br 62a_100000691529_100000750283 [0,2,0,0,0,0|1,1,0]=4 7251 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)Br 62a_100000750283_100000691529 [0,2,0,0,0,0|1,1,0]=4 7252 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000750283 [0,2,0,0,0,0|1,1,0]=4 7253 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)Cl 62a_100000750283_100000699651 [0,2,0,0,0,0|1,1,0]=4 7254 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)F 62a_100000685547_100000750283 [0,2,0,0,0,0|1,1,0]=4 7255 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)F 62a_100000750283_100000685547 [0,2,0,0,0,0|1,1,0]=4 7256 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)N 62a_100000210019_100000750283 [0,2,0,0,0,0|1,1,0]=4 7257 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)N 62a_100000750283_100000210019 [0,2,0,0,0,0|1,1,0]=4 7258 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)O 62a_100000750283_100000211634 [0,2,0,0,0,0|1,1,0]=4 7259 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)[S] 62a_100000750283_114929384022 [0,2,0,0,0,0|1,1,0]=4 7260 B16R2.251 Cc1ccnc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000750283 [0,2,0,0,0,0|1,1,0]=4 7261 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)Br 62a_100000691529_100000760492 [0,2,0,0,0,0|1,1,0]=4 7262 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)Br 62a_100000760492_100000691529 [0,2,0,0,0,0|1,1,0]=4 7263 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000760492 [0,2,0,0,0,0|1,1,0]=4 7264 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)Cl 62a_100000760492_100000699651 [0,2,0,0,0,0|1,1,0]=4 7265 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)F 62a_100000685547_100000760492 [0,2,0,0,0,0|1,1,0]=4 7266 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)F 62a_100000760492_100000685547 [0,2,0,0,0,0|1,1,0]=4 7267 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)N 62a_100000210019_100000760492 [0,2,0,0,0,0|1,1,0]=4 7268 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)N 62a_100000760492_100000210019 [0,2,0,0,0,0|1,1,0]=4 7269 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)O 62a_100000760492_100000211634 [0,2,0,0,0,0|1,1,0]=4 7270 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)[S] 62a_100000760492_114929384022 [0,2,0,0,0,0|1,1,0]=4 7271 B16R2.251 Cc1cncc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000760492 [0,2,0,0,0,0|1,1,0]=4 7272 B16R2.251 Clc1cc(ccn1)Sc2cccc(c2)Br 62a_100000035001_100000691529 [0,2,0,0,0,0|1,1,0]=4 7273 B16R2.251 Clc1cc(ccn1)Sc2cccc(c2)Br 62a_100000691529_100000035001 [0,2,0,0,0,0|1,1,0]=4 7274 B16R2.251 Clc1cccc(c1)Sc2cc(ccn2)Cl 62a_100000699651_100010167805 [0,2,0,0,0,0|1,1,0]=4 7275 B16R2.251 Clc1cccc(c1)Sc2cc(ccn2)Cl 62a_100010167805_100000699651 [0,2,0,0,0,0|1,1,0]=4 7276 B16R2.251 Clc1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_100000699651 [0,2,0,0,0,0|0,1,0]=3 7277 B16R2.251 Clc1cccc(c1)Sc2cccc(c2)Br 62a_100000699651_100000691529 [0,2,0,0,0,0|0,1,0]=3 7278 B16R2.251 Clc1cccc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000699651 [0,2,0,0,0,0|0,1,0]=3 7279 B16R2.251 Clc1cccc(c1)Sc2cccc(n2)Br 62a_100000684672_100000699651 [0,2,0,0,0,0|1,1,0]=4 7280 B16R2.251 Clc1cccc(c1)Sc2cccc(n2)Br 62a_100000699651_100000684672 [0,2,0,0,0,0|1,1,0]=4 7281 B16R2.251 Clc1cccc(c1)Sc2cccc(n2)Cl 62a_100000051397_100000699651 [0,2,0,0,0,0|1,1,0]=4 7282 B16R2.251 Clc1cccc(c1)Sc2cccc(n2)Cl 62a_100000699651_100000051397 [0,2,0,0,0,0|1,1,0]=4 7283 B16R2.251 Clc1cccc(c1)Sc2ccnc(c2)Br 62a_100000699651_100009814637 [0,2,0,0,0,0|1,1,0]=4 7284 B16R2.251 Clc1cccc(c1)Sc2ccnc(c2)Br 62a_100009814637_100000699651 [0,2,0,0,0,0|1,1,0]=4 7285 B16R2.251 Clc1cccc(c1)Sc2ccnc(c2)Cl 62a_100000035001_100000699651 [0,2,0,0,0,0|1,1,0]=4 7286 B16R2.251 Clc1cccc(c1)Sc2ccnc(c2)Cl 62a_100000699651_100000035001 [0,2,0,0,0,0|1,1,0]=4 7287 B16R2.251 Clc1cccc(c1)Sc2cncc(c2)Br 62a_100000699651_100000728054 [0,2,0,0,0,0|1,1,0]=4 7288 B16R2.251 Clc1cccc(c1)Sc2cncc(c2)Br 62a_100000728054_100000699651 [0,2,0,0,0,0|1,1,0]=4 7289 B16R2.251 Clc1cccc(c1)Sc2cncc(c2)Cl 62a_100000049639_100000699651 [0,2,0,0,0,0|1,1,0]=4 7290 B16R2.251 Clc1cccc(c1)Sc2cncc(c2)Cl 62a_100000699651_100000049639 [0,2,0,0,0,0|1,1,0]=4 7291 B16R2.251 Clc1cccc(n1)Sc2cccc(c2)Br 62a_100000051397_100000691529 [0,2,0,0,0,0|1,1,0]=4 7292 B16R2.251 Clc1cccc(n1)Sc2cccc(c2)Br 62a_100000691529_100000051397 [0,2,0,0,0,0|1,1,0]=4 7293 B16R2.251 Clc1ccnc(c1)Sc2cccc(c2)Br 62a_100000691529_100010167805 [0,2,0,0,0,0|1,1,0]=4 7294 B16R2.251 Clc1ccnc(c1)Sc2cccc(c2)Br 62a_100010167805_100000691529 [0,2,0,0,0,0|1,1,0]=4 7295 B16R2.251 Clc1cncc(c1)Sc2cccc(c2)Br 62a_100000049639_100000691529 [0,2,0,0,0,0|1,1,0]=4 7296 B16R2.251 Clc1cncc(c1)Sc2cccc(c2)Br 62a_100000691529_100000049639 [0,2,0,0,0,0|1,1,0]=4 7297 B16R2.251 Fc1cc(ccn1)Nc2cccc(c2)Br 27a_100000210019_100009816116 [0,2,0,0,0,0|2,0,0]=4 7298 B16R2.251 Fc1cc(ccn1)Nc2cccc(c2)Cl 27a_100000185859_100009816116 [0,2,0,0,0,0|2,0,0]=4 7299 B16R2.251 Fc1cc(ccn1)Nc2cccc(c2)I 27a_100000211102_100009816116 [0,2,0,0,0,0|2,0,0]=4 7300 B16R2.251 Fc1cc(ccn1)Sc2cccc(c2)Br 62a_100000691529_100009816116 [0,2,0,0,0,0|1,1,0]=4 7301 B16R2.251 Fc1cc(ccn1)Sc2cccc(c2)Br 62a_100009816116_100000691529 [0,2,0,0,0,0|1,1,0]=4 7302 B16R2.251 Fc1cc(ccn1)Sc2cccc(c2)Cl 62a_100000699651_100009816116 [0,2,0,0,0,0|1,1,0]=4 7303 B16R2.251 Fc1cc(ccn1)Sc2cccc(c2)Cl 62a_100009816116_100000699651 [0,2,0,0,0,0|1,1,0]=4 7304 B16R2.251 Fc1cc(ccn1)Sc2cccc(c2)[S] 62a_100009816116_114929384022 [0,2,0,0,0,0|1,1,0]=4 7305 B16R2.251 Fc1cc(ccn1)Sc2cccc(c2)[S] 62a_114929384022_100009816116 [0,2,0,0,0,0|1,1,0]=4 7306 B16R2.251 Fc1cccc(c1)Nc2cc(ccn2)F 27a_100000210047_100000764206 [0,2,0,0,0,0|2,0,0]=4 7307 B16R2.251 Fc1cccc(c1)Nc2cccc(n2)F 27a_100000210047_100009815982 [0,2,0,0,0,0|2,0,0]=4 7308 B16R2.251 Fc1cccc(c1)Nc2ccnc(c2)F 27a_100000210047_100009816116 [0,2,0,0,0,0|2,0,0]=4 7309 B16R2.251 Fc1cccc(c1)Sc2cc(ccn2)Cl 62a_100000685547_100010167805 [0,2,0,0,0,0|1,1,0]=4 7310 B16R2.251 Fc1cccc(c1)Sc2cc(ccn2)Cl 62a_100010167805_100000685547 [0,2,0,0,0,0|1,1,0]=4 7311 B16R2.251 Fc1cccc(c1)Sc2cc(ccn2)F 62a_100000685547_100000764206 [0,2,0,0,0,0|1,1,0]=4 7312 B16R2.251 Fc1cccc(c1)Sc2cc(ccn2)F 62a_100000764206_100000685547 [0,2,0,0,0,0|1,1,0]=4 7313 B16R2.251 Fc1cccc(c1)Sc2cccc(c2)Br 62a_100000685547_100000691529 [0,2,0,0,0,0|0,1,0]=3 7314 B16R2.251 Fc1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_100000685547 [0,2,0,0,0,0|0,1,0]=3 7315 B16R2.251 Fc1cccc(c1)Sc2cccc(c2)Cl 62a_100000685547_100000699651 [0,2,0,0,0,0|0,1,0]=3 7316 B16R2.251 Fc1cccc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000685547 [0,2,0,0,0,0|0,1,0]=3 7317 B16R2.251 Fc1cccc(c1)Sc2cccc(c2)F 62a_100000685547_100000685547 [0,2,0,0,0,0|0,1,0]=3 7318 B16R2.251 Fc1cccc(c1)Sc2cccc(c2)[S] 62a_100000685547_114929384022 [0,2,0,0,0,0|0,1,0]=3 7319 B16R2.251 Fc1cccc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000685547 [0,2,0,0,0,0|0,1,0]=3 7320 B16R2.251 Fc1cccc(c1)Sc2cccc(n2)Br 62a_100000684672_100000685547 [0,2,0,0,0,0|1,1,0]=4 7321 B16R2.251 Fc1cccc(c1)Sc2cccc(n2)Br 62a_100000685547_100000684672 [0,2,0,0,0,0|1,1,0]=4 7322 B16R2.251 Fc1cccc(c1)Sc2cccc(n2)Cl 62a_100000051397_100000685547 [0,2,0,0,0,0|1,1,0]=4 7323 B16R2.251 Fc1cccc(c1)Sc2cccc(n2)Cl 62a_100000685547_100000051397 [0,2,0,0,0,0|1,1,0]=4 7324 B16R2.251 Fc1cccc(c1)Sc2cccc(n2)F 62a_100000685547_100009815982 [0,2,0,0,0,0|1,1,0]=4 7325 B16R2.251 Fc1cccc(c1)Sc2cccc(n2)F 62a_100009815982_100000685547 [0,2,0,0,0,0|1,1,0]=4 7326 B16R2.251 Fc1cccc(c1)Sc2ccnc(c2)Br 62a_100000685547_100009814637 [0,2,0,0,0,0|1,1,0]=4 7327 B16R2.251 Fc1cccc(c1)Sc2ccnc(c2)Br 62a_100009814637_100000685547 [0,2,0,0,0,0|1,1,0]=4 7328 B16R2.251 Fc1cccc(c1)Sc2ccnc(c2)Cl 62a_100000035001_100000685547 [0,2,0,0,0,0|1,1,0]=4 7329 B16R2.251 Fc1cccc(c1)Sc2ccnc(c2)Cl 62a_100000685547_100000035001 [0,2,0,0,0,0|1,1,0]=4 7330 B16R2.251 Fc1cccc(c1)Sc2ccnc(c2)F 62a_100000685547_100009816116 [0,2,0,0,0,0|1,1,0]=4 7331 B16R2.251 Fc1cccc(c1)Sc2ccnc(c2)F 62a_100009816116_100000685547 [0,2,0,0,0,0|1,1,0]=4 7332 B16R2.251 Fc1cccc(c1)Sc2cncc(c2)Br 62a_100000685547_100000728054 [0,2,0,0,0,0|1,1,0]=4 7333 B16R2.251 Fc1cccc(c1)Sc2cncc(c2)Br 62a_100000728054_100000685547 [0,2,0,0,0,0|1,1,0]=4 7334 B16R2.251 Fc1cccc(c1)Sc2cncc(c2)Cl 62a_100000049639_100000685547 [0,2,0,0,0,0|1,1,0]=4 7335 B16R2.251 Fc1cccc(c1)Sc2cncc(c2)Cl 62a_100000685547_100000049639 [0,2,0,0,0,0|1,1,0]=4 7336 B16R2.251 Fc1cccc(c1)Sc2cncc(c2)F 62a_100000685547_100000744099 [0,2,0,0,0,0|1,1,0]=4 7337 B16R2.251 Fc1cccc(c1)Sc2cncc(c2)F 62a_100000744099_100000685547 [0,2,0,0,0,0|1,1,0]=4 7338 B16R2.251 Fc1cccc(n1)Nc2cccc(c2)Br 27a_100000210019_100009815982 [0,2,0,0,0,0|2,0,0]=4 7339 B16R2.251 Fc1cccc(n1)Nc2cccc(c2)Cl 27a_100000185859_100009815982 [0,2,0,0,0,0|2,0,0]=4 7340 B16R2.251 Fc1cccc(n1)Nc2cccc(c2)I 27a_100000211102_100009815982 [0,2,0,0,0,0|2,0,0]=4 7341 B16R2.251 Fc1cccc(n1)Sc2cccc(c2)Br 62a_100000691529_100009815982 [0,2,0,0,0,0|1,1,0]=4 7342 B16R2.251 Fc1cccc(n1)Sc2cccc(c2)Br 62a_100009815982_100000691529 [0,2,0,0,0,0|1,1,0]=4 7343 B16R2.251 Fc1cccc(n1)Sc2cccc(c2)Cl 62a_100000699651_100009815982 [0,2,0,0,0,0|1,1,0]=4 7344 B16R2.251 Fc1cccc(n1)Sc2cccc(c2)Cl 62a_100009815982_100000699651 [0,2,0,0,0,0|1,1,0]=4 7345 B16R2.251 Fc1cccc(n1)Sc2cccc(c2)[S] 62a_100009815982_114929384022 [0,2,0,0,0,0|1,1,0]=4 7346 B16R2.251 Fc1cccc(n1)Sc2cccc(c2)[S] 62a_114929384022_100009815982 [0,2,0,0,0,0|1,1,0]=4 7347 B16R2.251 Fc1ccnc(c1)Nc2cccc(c2)Br 27a_100000210019_100000764206 [0,2,0,0,0,0|2,0,0]=4 7348 B16R2.251 Fc1ccnc(c1)Nc2cccc(c2)Cl 27a_100000185859_100000764206 [0,2,0,0,0,0|2,0,0]=4 7349 B16R2.251 Fc1ccnc(c1)Nc2cccc(c2)I 27a_100000211102_100000764206 [0,2,0,0,0,0|2,0,0]=4 7350 B16R2.251 Fc1ccnc(c1)Sc2cccc(c2)Br 62a_100000691529_100000764206 [0,2,0,0,0,0|1,1,0]=4 7351 B16R2.251 Fc1ccnc(c1)Sc2cccc(c2)Br 62a_100000764206_100000691529 [0,2,0,0,0,0|1,1,0]=4 7352 B16R2.251 Fc1ccnc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000764206 [0,2,0,0,0,0|1,1,0]=4 7353 B16R2.251 Fc1ccnc(c1)Sc2cccc(c2)Cl 62a_100000764206_100000699651 [0,2,0,0,0,0|1,1,0]=4 7354 B16R2.251 Fc1ccnc(c1)Sc2cccc(c2)[S] 62a_100000764206_114929384022 [0,2,0,0,0,0|1,1,0]=4 7355 B16R2.251 Fc1ccnc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000764206 [0,2,0,0,0,0|1,1,0]=4 7356 B16R2.251 Fc1cncc(c1)Sc2cccc(c2)Br 62a_100000691529_100000744099 [0,2,0,0,0,0|1,1,0]=4 7357 B16R2.251 Fc1cncc(c1)Sc2cccc(c2)Br 62a_100000744099_100000691529 [0,2,0,0,0,0|1,1,0]=4 7358 B16R2.251 Fc1cncc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000744099 [0,2,0,0,0,0|1,1,0]=4 7359 B16R2.251 Fc1cncc(c1)Sc2cccc(c2)Cl 62a_100000744099_100000699651 [0,2,0,0,0,0|1,1,0]=4 7360 B16R2.251 Fc1cncc(c1)Sc2cccc(c2)[S] 62a_100000744099_114929384022 [0,2,0,0,0,0|1,1,0]=4 7361 B16R2.251 Fc1cncc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000744099 [0,2,0,0,0,0|1,1,0]=4 7362 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)Br 62a_100000049665_100000691529 [0,2,0,0,0,0|1,1,0]=4 7363 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)Br 62a_100000691529_100000049665 [0,2,0,0,0,0|1,1,0]=4 7364 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)Cl 62a_100000049665_100000699651 [0,2,0,0,0,0|1,1,0]=4 7365 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)Cl 62a_100000699651_100000049665 [0,2,0,0,0,0|1,1,0]=4 7366 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)F 62a_100000049665_100000685547 [0,2,0,0,0,0|1,1,0]=4 7367 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)F 62a_100000685547_100000049665 [0,2,0,0,0,0|1,1,0]=4 7368 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)O 62a_100000049665_100000211634 [0,2,0,0,0,0|1,1,0]=4 7369 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)[S] 62a_100000049665_114929384022 [0,2,0,0,0,0|1,1,0]=4 7370 B16R2.251 Nc1cc(ccn1)Sc2cccc(c2)[S] 62a_114929384022_100000049665 [0,2,0,0,0,0|1,1,0]=4 7371 B16R2.251 Nc1cccc(c1)Oc2ccnc(n2)O 271570a_203496583355_200010211407 [0,2,0,0,0,0|2,0,0]=4 7372 B16R2.251 Nc1cccc(c1)Sc2cc(=O)cc[nH]2 62a_100009817434_100000210019 [0,2,0,0,0,0|1,1,0]=4 7373 B16R2.251 Nc1cccc(c1)Sc2cc(ccn2)Cl 62a_100000210019_100010167805 [0,2,0,0,0,0|1,1,0]=4 7374 B16R2.251 Nc1cccc(c1)Sc2cc(ccn2)Cl 62a_100010167805_100000210019 [0,2,0,0,0,0|1,1,0]=4 7375 B16R2.251 Nc1cccc(c1)Sc2cc(ccn2)F 62a_100000210019_100000764206 [0,2,0,0,0,0|1,1,0]=4 7376 B16R2.251 Nc1cccc(c1)Sc2cc(ccn2)F 62a_100000764206_100000210019 [0,2,0,0,0,0|1,1,0]=4 7377 B16R2.251 Nc1cccc(c1)Sc2cc(ccn2)N 62a_100000210019_100009814236 [0,2,0,0,0,0|1,1,0]=4 7378 B16R2.251 Nc1cccc(c1)Sc2cc(ccn2)N 62a_100009814236_100000210019 [0,2,0,0,0,0|1,1,0]=4 7379 B16R2.251 Nc1cccc(c1)Sc2cc(ccn2)O 62a_100000210019_100000762945 [0,2,0,0,0,0|1,1,0]=4 7380 B16R2.251 Nc1cccc(c1)Sc2cc[nH]c(=O)c2 62a_100000210019_100009816521 [0,2,0,0,0,0|1,1,0]=4 7381 B16R2.251 Nc1cccc(c1)Sc2cc[nH]c(=O)c2 62a_100009816521_100000210019 [0,2,0,0,0,0|1,1,0]=4 7382 B16R2.251 Nc1cccc(c1)Sc2ccc[n+](c2)[O-] 62a_100000210019_100009815978 [0,2,0,0,0,0|1,1,0]=4 7383 B16R2.251 Nc1cccc(c1)Sc2cccc(=O)[nH]2 62a_100000210019_100000752884 [0,2,0,0,0,0|1,1,0]=4 7384 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)Br 62a_100000210019_100000691529 [0,2,0,0,0,0|0,1,0]=3 7385 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_100000210019 [0,2,0,0,0,0|0,1,0]=3 7386 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)Cl 62a_100000210019_100000699651 [0,2,0,0,0,0|0,1,0]=3 7387 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000210019 [0,2,0,0,0,0|0,1,0]=3 7388 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)F 62a_100000210019_100000685547 [0,2,0,0,0,0|0,1,0]=3 7389 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)F 62a_100000685547_100000210019 [0,2,0,0,0,0|0,1,0]=3 7390 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)N 62a_100000210019_100000210019 [0,2,0,0,0,0|0,1,0]=3 7391 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)O 62a_100000210019_100000211634 [0,2,0,0,0,0|0,1,0]=3 7392 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)[S] 62a_100000210019_114929384022 [0,2,0,0,0,0|0,1,0]=3 7393 B16R2.251 Nc1cccc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000210019 [0,2,0,0,0,0|0,1,0]=3 7394 B16R2.251 Nc1cccc(c1)Sc2cccc(n2)Br 62a_100000210019_100000684672 [0,2,0,0,0,0|1,1,0]=4 7395 B16R2.251 Nc1cccc(c1)Sc2cccc(n2)Br 62a_100000684672_100000210019 [0,2,0,0,0,0|1,1,0]=4 7396 B16R2.251 Nc1cccc(c1)Sc2cccc(n2)Cl 62a_100000051397_100000210019 [0,2,0,0,0,0|1,1,0]=4 7397 B16R2.251 Nc1cccc(c1)Sc2cccc(n2)Cl 62a_100000210019_100000051397 [0,2,0,0,0,0|1,1,0]=4 7398 B16R2.251 Nc1cccc(c1)Sc2cccc(n2)F 62a_100000210019_100009815982 [0,2,0,0,0,0|1,1,0]=4 7399 B16R2.251 Nc1cccc(c1)Sc2cccc(n2)F 62a_100009815982_100000210019 [0,2,0,0,0,0|1,1,0]=4 7400 B16R2.251 Nc1cccc(c1)Sc2cccc(n2)N 62a_100000210019_100000740741 [0,2,0,0,0,0|1,1,0]=4 7401 B16R2.251 Nc1cccc(c1)Sc2cccc(n2)N 62a_100000740741_100000210019 [0,2,0,0,0,0|1,1,0]=4 7402 B16R2.251 Nc1cccc(c1)Sc2ccnc(c2)Br 62a_100000210019_100009814637 [0,2,0,0,0,0|1,1,0]=4 7403 B16R2.251 Nc1cccc(c1)Sc2ccnc(c2)Br 62a_100009814637_100000210019 [0,2,0,0,0,0|1,1,0]=4 7404 B16R2.251 Nc1cccc(c1)Sc2ccnc(c2)Cl 62a_100000035001_100000210019 [0,2,0,0,0,0|1,1,0]=4 7405 B16R2.251 Nc1cccc(c1)Sc2ccnc(c2)Cl 62a_100000210019_100000035001 [0,2,0,0,0,0|1,1,0]=4 7406 B16R2.251 Nc1cccc(c1)Sc2ccnc(c2)F 62a_100000210019_100009816116 [0,2,0,0,0,0|1,1,0]=4 7407 B16R2.251 Nc1cccc(c1)Sc2ccnc(c2)F 62a_100009816116_100000210019 [0,2,0,0,0,0|1,1,0]=4 7408 B16R2.251 Nc1cccc(c1)Sc2ccnc(c2)N 62a_100000049665_100000210019 [0,2,0,0,0,0|1,1,0]=4 7409 B16R2.251 Nc1cccc(c1)Sc2ccnc(c2)N 62a_100000210019_100000049665 [0,2,0,0,0,0|1,1,0]=4 7410 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)Br 62a_100000210019_100000728054 [0,2,0,0,0,0|1,1,0]=4 7411 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)Br 62a_100000728054_100000210019 [0,2,0,0,0,0|1,1,0]=4 7412 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)Cl 62a_100000049639_100000210019 [0,2,0,0,0,0|1,1,0]=4 7413 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)Cl 62a_100000210019_100000049639 [0,2,0,0,0,0|1,1,0]=4 7414 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)F 62a_100000210019_100000744099 [0,2,0,0,0,0|1,1,0]=4 7415 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)F 62a_100000744099_100000210019 [0,2,0,0,0,0|1,1,0]=4 7416 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)N 62a_100000210019_100000687067 [0,2,0,0,0,0|1,1,0]=4 7417 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)N 62a_100000687067_100000210019 [0,2,0,0,0,0|1,1,0]=4 7418 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)O 62a_100000210019_100000754920 [0,2,0,0,0,0|1,1,0]=4 7419 B16R2.251 Nc1cccc(c1)Sc2cncc(c2)O 62a_100000754920_100000210019 [0,2,0,0,0,0|1,1,0]=4 7420 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)Br 62a_100000691529_100000740741 [0,2,0,0,0,0|1,1,0]=4 7421 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)Br 62a_100000740741_100000691529 [0,2,0,0,0,0|1,1,0]=4 7422 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)Cl 62a_100000699651_100000740741 [0,2,0,0,0,0|1,1,0]=4 7423 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)Cl 62a_100000740741_100000699651 [0,2,0,0,0,0|1,1,0]=4 7424 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)F 62a_100000685547_100000740741 [0,2,0,0,0,0|1,1,0]=4 7425 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)F 62a_100000740741_100000685547 [0,2,0,0,0,0|1,1,0]=4 7426 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)O 62a_100000740741_100000211634 [0,2,0,0,0,0|1,1,0]=4 7427 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)[S] 62a_100000740741_114929384022 [0,2,0,0,0,0|1,1,0]=4 7428 B16R2.251 Nc1cccc(n1)Sc2cccc(c2)[S] 62a_114929384022_100000740741 [0,2,0,0,0,0|1,1,0]=4 7429 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)Br 62a_100000691529_100009814236 [0,2,0,0,0,0|1,1,0]=4 7430 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)Br 62a_100009814236_100000691529 [0,2,0,0,0,0|1,1,0]=4 7431 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)Cl 62a_100000699651_100009814236 [0,2,0,0,0,0|1,1,0]=4 7432 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)Cl 62a_100009814236_100000699651 [0,2,0,0,0,0|1,1,0]=4 7433 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)F 62a_100000685547_100009814236 [0,2,0,0,0,0|1,1,0]=4 7434 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)F 62a_100009814236_100000685547 [0,2,0,0,0,0|1,1,0]=4 7435 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)O 62a_100009814236_100000211634 [0,2,0,0,0,0|1,1,0]=4 7436 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)[S] 62a_100009814236_114929384022 [0,2,0,0,0,0|1,1,0]=4 7437 B16R2.251 Nc1ccnc(c1)Sc2cccc(c2)[S] 62a_114929384022_100009814236 [0,2,0,0,0,0|1,1,0]=4 7438 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)Br 62a_100000687067_100000691529 [0,2,0,0,0,0|1,1,0]=4 7439 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)Br 62a_100000691529_100000687067 [0,2,0,0,0,0|1,1,0]=4 7440 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)Cl 62a_100000687067_100000699651 [0,2,0,0,0,0|1,1,0]=4 7441 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000687067 [0,2,0,0,0,0|1,1,0]=4 7442 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)F 62a_100000685547_100000687067 [0,2,0,0,0,0|1,1,0]=4 7443 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)F 62a_100000687067_100000685547 [0,2,0,0,0,0|1,1,0]=4 7444 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)O 62a_100000687067_100000211634 [0,2,0,0,0,0|1,1,0]=4 7445 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)[S] 62a_100000687067_114929384022 [0,2,0,0,0,0|1,1,0]=4 7446 B16R2.251 Nc1cncc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000687067 [0,2,0,0,0,0|1,1,0]=4 7447 B16R2.251 O=c1cc(cc[nH]1)Nc2cccc(c2)Br 27a_100000210019_100000061649 [0,2,0,0,0,0|2,0,0]=4 7448 B16R2.251 O=c1cc(cc[nH]1)Nc2cccc(c2)Cl 27a_100000185859_100000061649 [0,2,0,0,0,0|2,0,0]=4 7449 B16R2.251 O=c1cc(cc[nH]1)Nc2cccc(c2)F 27a_100000210047_100000061649 [0,2,0,0,0,0|2,0,0]=4 7450 B16R2.251 O=c1cc(cc[nH]1)Nc2cccc(c2)I 27a_100000211102_100000061649 [0,2,0,0,0,0|2,0,0]=4 7451 B16R2.251 O=c1cc(cc[nH]1)Nc2cccc(c2)O 27a_100000210217_100000061649 [0,2,0,0,0,0|2,0,0]=4 7452 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)Br 62a_100000691529_100009816521 [0,2,0,0,0,0|1,1,0]=4 7453 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)Br 62a_100009816521_100000691529 [0,2,0,0,0,0|1,1,0]=4 7454 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)Cl 62a_100000699651_100009816521 [0,2,0,0,0,0|1,1,0]=4 7455 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)Cl 62a_100009816521_100000699651 [0,2,0,0,0,0|1,1,0]=4 7456 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)F 62a_100000685547_100009816521 [0,2,0,0,0,0|1,1,0]=4 7457 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)F 62a_100009816521_100000685547 [0,2,0,0,0,0|1,1,0]=4 7458 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)O 62a_100009816521_100000211634 [0,2,0,0,0,0|1,1,0]=4 7459 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)[S] 62a_100009816521_114929384022 [0,2,0,0,0,0|1,1,0]=4 7460 B16R2.251 O=c1cc(cc[nH]1)Sc2cccc(c2)[S] 62a_114929384022_100009816521 [0,2,0,0,0,0|1,1,0]=4 7461 B16R2.251 O=c1cc[nH]c(c1)Sc2cccc(c2)Br 62a_100009817434_100000691529 [0,2,0,0,0,0|1,1,0]=4 7462 B16R2.251 O=c1cc[nH]c(c1)Sc2cccc(c2)Cl 62a_100009817434_100000699651 [0,2,0,0,0,0|1,1,0]=4 7463 B16R2.251 O=c1cc[nH]c(c1)Sc2cccc(c2)F 62a_100009817434_100000685547 [0,2,0,0,0,0|1,1,0]=4 7464 B16R2.251 O=c1cc[nH]c(c1)Sc2cccc(c2)O 62a_100009817434_100000211634 [0,2,0,0,0,0|1,1,0]=4 7465 B16R2.251 O=c1cc[nH]c(c1)Sc2cccc(c2)[S] 62a_100009817434_114929384022 [0,2,0,0,0,0|1,1,0]=4 7466 B16R2.251 O=c1cccc([nH]1)Sc2cccc(c2)Br 62a_100000691529_100000752884 [0,2,0,0,0,0|1,1,0]=4 7467 B16R2.251 O=c1cccc([nH]1)Sc2cccc(c2)Cl 62a_100000699651_100000752884 [0,2,0,0,0,0|1,1,0]=4 7468 B16R2.251 O=c1cccc([nH]1)Sc2cccc(c2)F 62a_100000685547_100000752884 [0,2,0,0,0,0|1,1,0]=4 7469 B16R2.251 O=c1cccc([nH]1)Sc2cccc(c2)[S] 62a_114929384022_100000752884 [0,2,0,0,0,0|1,1,0]=4 7470 B16R2.251 Oc1cccc(c1)Nc2cc(ccn2)F 27a_100000210217_100000764206 [0,2,0,0,0,0|2,0,0]=4 7471 B16R2.251 Oc1cccc(c1)Nc2cccc(n2)F 27a_100000210217_100009815982 [0,2,0,0,0,0|2,0,0]=4 7472 B16R2.251 Oc1cccc(c1)Nc2ccnc(c2)F 27a_100000210217_100009816116 [0,2,0,0,0,0|2,0,0]=4 7473 B16R2.251 Oc1cccc(c1)Sc2cc(ccn2)Cl 62a_100010167805_100000211634 [0,2,0,0,0,0|1,1,0]=4 7474 B16R2.251 Oc1cccc(c1)Sc2cc(ccn2)F 62a_100000764206_100000211634 [0,2,0,0,0,0|1,1,0]=4 7475 B16R2.251 Oc1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_100000211634 [0,2,0,0,0,0|0,1,0]=3 7476 B16R2.251 Oc1cccc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000211634 [0,2,0,0,0,0|0,1,0]=3 7477 B16R2.251 Oc1cccc(c1)Sc2cccc(c2)F 62a_100000685547_100000211634 [0,2,0,0,0,0|0,1,0]=3 7478 B16R2.251 Oc1cccc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000211634 [0,2,0,0,0,0|0,1,0]=3 7479 B16R2.251 Oc1cccc(c1)Sc2cccc(n2)Br 62a_100000684672_100000211634 [0,2,0,0,0,0|1,1,0]=4 7480 B16R2.251 Oc1cccc(c1)Sc2cccc(n2)Cl 62a_100000051397_100000211634 [0,2,0,0,0,0|1,1,0]=4 7481 B16R2.251 Oc1cccc(c1)Sc2cccc(n2)F 62a_100009815982_100000211634 [0,2,0,0,0,0|1,1,0]=4 7482 B16R2.251 Oc1cccc(c1)Sc2ccnc(c2)Br 62a_100009814637_100000211634 [0,2,0,0,0,0|1,1,0]=4 7483 B16R2.251 Oc1cccc(c1)Sc2ccnc(c2)Cl 62a_100000035001_100000211634 [0,2,0,0,0,0|1,1,0]=4 7484 B16R2.251 Oc1cccc(c1)Sc2ccnc(c2)F 62a_100009816116_100000211634 [0,2,0,0,0,0|1,1,0]=4 7485 B16R2.251 Oc1cccc(c1)Sc2cncc(c2)Br 62a_100000728054_100000211634 [0,2,0,0,0,0|1,1,0]=4 7486 B16R2.251 Oc1cccc(c1)Sc2cncc(c2)Cl 62a_100000049639_100000211634 [0,2,0,0,0,0|1,1,0]=4 7487 B16R2.251 Oc1cccc(c1)Sc2cncc(c2)F 62a_100000744099_100000211634 [0,2,0,0,0,0|1,1,0]=4 7488 B16R2.251 Oc1cccc(c1)Sc2cncc(c2)O 62a_100000754920_100000211634 [0,2,0,0,0,0|1,1,0]=4 7489 B16R2.251 Oc1ccnc(c1)Sc2cccc(c2)Br 62a_100000691529_100000762945 [0,2,0,0,0,0|1,1,0]=4 7490 B16R2.251 Oc1ccnc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000762945 [0,2,0,0,0,0|1,1,0]=4 7491 B16R2.251 Oc1ccnc(c1)Sc2cccc(c2)F 62a_100000685547_100000762945 [0,2,0,0,0,0|1,1,0]=4 7492 B16R2.251 Oc1ccnc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000762945 [0,2,0,0,0,0|1,1,0]=4 7493 B16R2.251 Oc1cncc(c1)Sc2cccc(c2)Br 62a_100000691529_100000754920 [0,2,0,0,0,0|1,1,0]=4 7494 B16R2.251 Oc1cncc(c1)Sc2cccc(c2)Br 62a_100000754920_100000691529 [0,2,0,0,0,0|1,1,0]=4 7495 B16R2.251 Oc1cncc(c1)Sc2cccc(c2)Cl 62a_100000699651_100000754920 [0,2,0,0,0,0|1,1,0]=4 7496 B16R2.251 Oc1cncc(c1)Sc2cccc(c2)Cl 62a_100000754920_100000699651 [0,2,0,0,0,0|1,1,0]=4 7497 B16R2.251 Oc1cncc(c1)Sc2cccc(c2)F 62a_100000685547_100000754920 [0,2,0,0,0,0|1,1,0]=4 7498 B16R2.251 Oc1cncc(c1)Sc2cccc(c2)F 62a_100000754920_100000685547 [0,2,0,0,0,0|1,1,0]=4 7499 B16R2.251 Oc1cncc(c1)Sc2cccc(c2)[S] 62a_100000754920_114929384022 [0,2,0,0,0,0|1,1,0]=4 7500 B16R2.251 Oc1cncc(c1)Sc2cccc(c2)[S] 62a_114929384022_100000754920 [0,2,0,0,0,0|1,1,0]=4 7501 B16R2.251 [O-][n+]1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_100009815978 [0,2,0,0,0,0|1,1,0]=4 7502 B16R2.251 [O-][n+]1cccc(c1)Sc2cccc(c2)Cl 62a_100000699651_100009815978 [0,2,0,0,0,0|1,1,0]=4 7503 B16R2.251 [O-][n+]1cccc(c1)Sc2cccc(c2)F 62a_100000685547_100009815978 [0,2,0,0,0,0|1,1,0]=4 7504 B16R2.251 [O-][n+]1cccc(c1)Sc2cccc(c2)[S] 62a_114929384022_100009815978 [0,2,0,0,0,0|1,1,0]=4 7505 B16R2.251 [S]c1cccc(c1)Sc2cc(ccn2)Cl 62a_100010167805_114929384022 [0,2,0,0,0,0|1,1,0]=4 7506 B16R2.251 [S]c1cccc(c1)Sc2cc(ccn2)Cl 62a_114929384022_100010167805 [0,2,0,0,0,0|1,1,0]=4 7507 B16R2.251 [S]c1cccc(c1)Sc2cccc(c2)Br 62a_100000691529_114929384022 [0,2,0,0,0,0|0,1,0]=3 7508 B16R2.251 [S]c1cccc(c1)Sc2cccc(c2)Br 62a_114929384022_100000691529 [0,2,0,0,0,0|0,1,0]=3 7509 B16R2.251 [S]c1cccc(c1)Sc2cccc(c2)Cl 62a_100000699651_114929384022 [0,2,0,0,0,0|0,1,0]=3 7510 B16R2.251 [S]c1cccc(c1)Sc2cccc(c2)Cl 62a_114929384022_100000699651 [0,2,0,0,0,0|0,1,0]=3 7511 B16R2.251 [S]c1cccc(c1)Sc2cccc(c2)[S] 62a_114929384022_114929384022 [0,2,0,0,0,0|0,1,0]=3 7512 B16R2.251 [S]c1cccc(c1)Sc2cccc(n2)Br 62a_100000684672_114929384022 [0,2,0,0,0,0|1,1,0]=4 7513 B16R2.251 [S]c1cccc(c1)Sc2cccc(n2)Br 62a_114929384022_100000684672 [0,2,0,0,0,0|1,1,0]=4 7514 B16R2.251 [S]c1cccc(c1)Sc2cccc(n2)Cl 62a_100000051397_114929384022 [0,2,0,0,0,0|1,1,0]=4 7515 B16R2.251 [S]c1cccc(c1)Sc2cccc(n2)Cl 62a_114929384022_100000051397 [0,2,0,0,0,0|1,1,0]=4 7516 B16R2.251 [S]c1cccc(c1)Sc2ccnc(c2)Br 62a_100009814637_114929384022 [0,2,0,0,0,0|1,1,0]=4 7517 B16R2.251 [S]c1cccc(c1)Sc2ccnc(c2)Br 62a_114929384022_100009814637 [0,2,0,0,0,0|1,1,0]=4 7518 B16R2.251 [S]c1cccc(c1)Sc2ccnc(c2)Cl 62a_100000035001_114929384022 [0,2,0,0,0,0|1,1,0]=4 7519 B16R2.251 [S]c1cccc(c1)Sc2ccnc(c2)Cl 62a_114929384022_100000035001 [0,2,0,0,0,0|1,1,0]=4 7520 B16R2.251 [S]c1cccc(c1)Sc2cncc(c2)Br 62a_100000728054_114929384022 [0,2,0,0,0,0|1,1,0]=4 7521 B16R2.251 [S]c1cccc(c1)Sc2cncc(c2)Br 62a_114929384022_100000728054 [0,2,0,0,0,0|1,1,0]=4 7522 B16R2.251 [S]c1cccc(c1)Sc2cncc(c2)Cl 62a_100000049639_114929384022 [0,2,0,0,0,0|1,1,0]=4 7523 B16R2.251 [S]c1cccc(c1)Sc2cncc(c2)Cl 62a_114929384022_100000049639 [0,2,0,0,0,0|1,1,0]=4 7524 B16R2.317 Brc1cc(c(cn1)Br)Nc2ccccc2 27a_100000106764_100010171693 [0,2,0,0,0,0|2,0,0]=4 7525 B16R2.317 Brc1cc(c(cn1)Br)Sc2ccccc2 62a_100000719477_100010171693 [0,2,0,0,0,0|1,1,0]=4 7526 B16R2.317 Brc1cc(c(cn1)Br)Sc2ccccc2 62a_100010171693_100000041952 [0,2,0,0,0,0|1,1,0]=4 7527 B16R2.317 Brc1ccc(c(c1)Sc2ccccc2)Br 62a_100000719477_100011483371 [0,2,0,0,0,0|0,1,0]=3 7528 B16R2.317 Brc1ccc(c(c1)Sc2ccccc2)Br 62a_100011483371_100000041952 [0,2,0,0,0,0|0,1,0]=3 7529 B16R2.317 Brc1ccc(c(c1)Sc2ccccn2)Br 62a_100011216584_100011483371 [0,2,0,0,0,0|1,1,0]=4 7530 B16R2.317 Brc1ccc(c(c1)Sc2ccccn2)Br 62a_100011483371_100011216584 [0,2,0,0,0,0|1,1,0]=4 7531 B16R2.317 Brc1ccc(c(c1)Sc2cccnc2)Br 62a_100000210063_100011483371 [0,2,0,0,0,0|1,1,0]=4 7532 B16R2.317 Brc1ccc(c(c1)Sc2cccnc2)Br 62a_100011483371_100000210063 [0,2,0,0,0,0|1,1,0]=4 7533 B16R2.317 Brc1ccc(c(c1)Sc2ccncc2)Br 62a_100000728582_100011483371 [0,2,0,0,0,0|1,1,0]=4 7534 B16R2.317 Brc1ccc(c(c1)Sc2ccncc2)Br 62a_100011483371_100000728582 [0,2,0,0,0,0|1,1,0]=4 7535 B16R2.317 Cc1cc(c(cn1)C)Sc2ccccc2 62a_100000719477_100009862788 [0,2,0,0,0,0|1,1,0]=4 7536 B16R2.317 Cc1cc(c(cn1)C)Sc2ccccc2 62a_100009862788_100000041952 [0,2,0,0,0,0|1,1,0]=4 7537 B16R2.317 Cc1cc(c(cn1)F)Nc2ccccc2 27a_100000106764_100009867690 [0,2,0,0,0,0|2,0,0]=4 7538 B16R2.317 Cc1cc(c(cn1)F)Sc2ccccc2 62a_100000719477_100009867690 [0,2,0,0,0,0|1,1,0]=4 7539 B16R2.317 Cc1cc(c(cn1)F)Sc2ccccc2 62a_100009867690_100000041952 [0,2,0,0,0,0|1,1,0]=4 7540 B16R2.317 Cc1cc(c(cn1)O)Sc2ccccc2 62a_100000719477_100009843476 [0,2,0,0,0,0|1,1,0]=4 7541 B16R2.317 Cc1cc(c(cn1)O)Sc2ccccc2 62a_100009843476_100000041952 [0,2,0,0,0,0|1,1,0]=4 7542 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)Br 62a_100000719477_100012353751 [0,2,0,0,0,0|0,1,0]=3 7543 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)Br 62a_100012353751_100000041952 [0,2,0,0,0,0|0,1,0]=3 7544 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)C 62a_100000210833_100000041952 [0,2,0,0,0,0|0,1,0]=3 7545 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)C 62a_100000719477_100000210833 [0,2,0,0,0,0|0,1,0]=3 7546 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)Cl 62a_100000719477_100012356289 [0,2,0,0,0,0|0,1,0]=3 7547 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)Cl 62a_100012356289_100000041952 [0,2,0,0,0,0|0,1,0]=3 7548 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)F 62a_100000719477_100000736223 [0,2,0,0,0,0|0,1,0]=3 7549 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)F 62a_100000736223_100000041952 [0,2,0,0,0,0|0,1,0]=3 7550 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)N 62a_100000719477_100011356834 [0,2,0,0,0,0|0,1,0]=3 7551 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)N 62a_100011356834_100000041952 [0,2,0,0,0,0|0,1,0]=3 7552 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)O 62a_100000719477_100000765521 [0,2,0,0,0,0|0,1,0]=3 7553 B16R2.317 Cc1ccc(c(c1)Sc2ccccc2)O 62a_100000765521_100000041952 [0,2,0,0,0,0|0,1,0]=3 7554 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)Br 62a_100011216584_100012353751 [0,2,0,0,0,0|1,1,0]=4 7555 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)Br 62a_100012353751_100011216584 [0,2,0,0,0,0|1,1,0]=4 7556 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)C 62a_100000210833_100011216584 [0,2,0,0,0,0|1,1,0]=4 7557 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)C 62a_100011216584_100000210833 [0,2,0,0,0,0|1,1,0]=4 7558 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)Cl 62a_100011216584_100012356289 [0,2,0,0,0,0|1,1,0]=4 7559 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)Cl 62a_100012356289_100011216584 [0,2,0,0,0,0|1,1,0]=4 7560 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)F 62a_100000736223_100011216584 [0,2,0,0,0,0|1,1,0]=4 7561 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)F 62a_100011216584_100000736223 [0,2,0,0,0,0|1,1,0]=4 7562 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)N 62a_100011216584_100011356834 [0,2,0,0,0,0|1,1,0]=4 7563 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)N 62a_100011356834_100011216584 [0,2,0,0,0,0|1,1,0]=4 7564 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)O 62a_100000765521_100011216584 [0,2,0,0,0,0|1,1,0]=4 7565 B16R2.317 Cc1ccc(c(c1)Sc2ccccn2)O 62a_100011216584_100000765521 [0,2,0,0,0,0|1,1,0]=4 7566 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)Br 62a_100000210063_100012353751 [0,2,0,0,0,0|1,1,0]=4 7567 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)Br 62a_100012353751_100000210063 [0,2,0,0,0,0|1,1,0]=4 7568 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)C 62a_100000210063_100000210833 [0,2,0,0,0,0|1,1,0]=4 7569 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)C 62a_100000210833_100000210063 [0,2,0,0,0,0|1,1,0]=4 7570 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)Cl 62a_100000210063_100012356289 [0,2,0,0,0,0|1,1,0]=4 7571 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)Cl 62a_100012356289_100000210063 [0,2,0,0,0,0|1,1,0]=4 7572 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)F 62a_100000210063_100000736223 [0,2,0,0,0,0|1,1,0]=4 7573 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)F 62a_100000736223_100000210063 [0,2,0,0,0,0|1,1,0]=4 7574 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)N 62a_100000210063_100011356834 [0,2,0,0,0,0|1,1,0]=4 7575 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)N 62a_100011356834_100000210063 [0,2,0,0,0,0|1,1,0]=4 7576 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)O 62a_100000210063_100000765521 [0,2,0,0,0,0|1,1,0]=4 7577 B16R2.317 Cc1ccc(c(c1)Sc2cccnc2)O 62a_100000765521_100000210063 [0,2,0,0,0,0|1,1,0]=4 7578 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)Br 62a_100000728582_100012353751 [0,2,0,0,0,0|1,1,0]=4 7579 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)Br 62a_100012353751_100000728582 [0,2,0,0,0,0|1,1,0]=4 7580 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)C 62a_100000210833_100000728582 [0,2,0,0,0,0|1,1,0]=4 7581 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)C 62a_100000728582_100000210833 [0,2,0,0,0,0|1,1,0]=4 7582 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)Cl 62a_100000728582_100012356289 [0,2,0,0,0,0|1,1,0]=4 7583 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)Cl 62a_100012356289_100000728582 [0,2,0,0,0,0|1,1,0]=4 7584 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)F 62a_100000728582_100000736223 [0,2,0,0,0,0|1,1,0]=4 7585 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)F 62a_100000736223_100000728582 [0,2,0,0,0,0|1,1,0]=4 7586 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)N 62a_100000728582_100011356834 [0,2,0,0,0,0|1,1,0]=4 7587 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)N 62a_100011356834_100000728582 [0,2,0,0,0,0|1,1,0]=4 7588 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)O 62a_100000728582_100000765521 [0,2,0,0,0,0|1,1,0]=4 7589 B16R2.317 Cc1ccc(c(c1)Sc2ccncc2)O 62a_100000765521_100000728582 [0,2,0,0,0,0|1,1,0]=4 7590 B16R2.317 Cc1ccc(c(n1)Sc2ccccc2)C 62a_100000719477_100009854376 [0,2,0,0,0,0|1,1,0]=4 7591 B16R2.317 Cc1ccc(c(n1)Sc2ccccc2)C 62a_100009854376_100000041952 [0,2,0,0,0,0|1,1,0]=4 7592 B16R2.317 Cc1ccc(c(n1)Sc2ccccc2)F 62a_100000719477_100009817602 [0,2,0,0,0,0|1,1,0]=4 7593 B16R2.317 Cc1ccc(c(n1)Sc2ccccc2)F 62a_100009817602_100000041952 [0,2,0,0,0,0|1,1,0]=4 7594 B16R2.317 Cc1ccc(c(n1)Sc2ccccc2)N 62a_100000685570_100000041952 [0,2,0,0,0,0|1,1,0]=4 7595 B16R2.317 Cc1ccc(c(n1)Sc2ccccc2)N 62a_100000719477_100000685570 [0,2,0,0,0,0|1,1,0]=4 7596 B16R2.317 Cc1ccc(c(n1)Sc2ccccc2)O 62a_100000702858_100000041952 [0,2,0,0,0,0|1,1,0]=4 7597 B16R2.317 Cc1ccc(c(n1)Sc2ccccc2)O 62a_100000719477_100000702858 [0,2,0,0,0,0|1,1,0]=4 7598 B16R2.317 Cc1ccc(cc1Sc2ccccc2)Br 62a_100000719477_100011344865 [0,2,0,0,0,0|0,1,0]=3 7599 B16R2.317 Cc1ccc(cc1Sc2ccccc2)Br 62a_100011344865_100000041952 [0,2,0,0,0,0|0,1,0]=3 7600 B16R2.317 Cc1ccc(cc1Sc2ccccc2)Cl 62a_100000719477_100011263213 [0,2,0,0,0,0|0,1,0]=3 7601 B16R2.317 Cc1ccc(cc1Sc2ccccc2)Cl 62a_100011263213_100000041952 [0,2,0,0,0,0|0,1,0]=3 7602 B16R2.317 Cc1ccc(cc1Sc2ccccc2)F 62a_100000719477_100011218078 [0,2,0,0,0,0|0,1,0]=3 7603 B16R2.317 Cc1ccc(cc1Sc2ccccc2)F 62a_100011218078_100000041952 [0,2,0,0,0,0|0,1,0]=3 7604 B16R2.317 Cc1ccc(cc1Sc2ccccc2)N 62a_100000719477_100000736455 [0,2,0,0,0,0|0,1,0]=3 7605 B16R2.317 Cc1ccc(cc1Sc2ccccc2)N 62a_100000736455_100000041952 [0,2,0,0,0,0|0,1,0]=3 7606 B16R2.317 Cc1ccc(cc1Sc2ccccc2)O 62a_100000719477_100011380479 [0,2,0,0,0,0|0,1,0]=3 7607 B16R2.317 Cc1ccc(cc1Sc2ccccc2)O 62a_100011380479_100000041952 [0,2,0,0,0,0|0,1,0]=3 7608 B16R2.317 Cc1ccc(cc1Sc2ccccn2)Br 62a_100011216584_100011344865 [0,2,0,0,0,0|1,1,0]=4 7609 B16R2.317 Cc1ccc(cc1Sc2ccccn2)Br 62a_100011344865_100011216584 [0,2,0,0,0,0|1,1,0]=4 7610 B16R2.317 Cc1ccc(cc1Sc2ccccn2)Cl 62a_100011216584_100011263213 [0,2,0,0,0,0|1,1,0]=4 7611 B16R2.317 Cc1ccc(cc1Sc2ccccn2)Cl 62a_100011263213_100011216584 [0,2,0,0,0,0|1,1,0]=4 7612 B16R2.317 Cc1ccc(cc1Sc2ccccn2)F 62a_100011216584_100011218078 [0,2,0,0,0,0|1,1,0]=4 7613 B16R2.317 Cc1ccc(cc1Sc2ccccn2)F 62a_100011218078_100011216584 [0,2,0,0,0,0|1,1,0]=4 7614 B16R2.317 Cc1ccc(cc1Sc2ccccn2)N 62a_100000736455_100011216584 [0,2,0,0,0,0|1,1,0]=4 7615 B16R2.317 Cc1ccc(cc1Sc2ccccn2)N 62a_100011216584_100000736455 [0,2,0,0,0,0|1,1,0]=4 7616 B16R2.317 Cc1ccc(cc1Sc2ccccn2)O 62a_100011216584_100011380479 [0,2,0,0,0,0|1,1,0]=4 7617 B16R2.317 Cc1ccc(cc1Sc2ccccn2)O 62a_100011380479_100011216584 [0,2,0,0,0,0|1,1,0]=4 7618 B16R2.317 Cc1ccc(cc1Sc2cccnc2)Br 62a_100000210063_100011344865 [0,2,0,0,0,0|1,1,0]=4 7619 B16R2.317 Cc1ccc(cc1Sc2cccnc2)Br 62a_100011344865_100000210063 [0,2,0,0,0,0|1,1,0]=4 7620 B16R2.317 Cc1ccc(cc1Sc2cccnc2)Cl 62a_100000210063_100011263213 [0,2,0,0,0,0|1,1,0]=4 7621 B16R2.317 Cc1ccc(cc1Sc2cccnc2)Cl 62a_100011263213_100000210063 [0,2,0,0,0,0|1,1,0]=4 7622 B16R2.317 Cc1ccc(cc1Sc2cccnc2)F 62a_100000210063_100011218078 [0,2,0,0,0,0|1,1,0]=4 7623 B16R2.317 Cc1ccc(cc1Sc2cccnc2)F 62a_100011218078_100000210063 [0,2,0,0,0,0|1,1,0]=4 7624 B16R2.317 Cc1ccc(cc1Sc2cccnc2)N 62a_100000210063_100000736455 [0,2,0,0,0,0|1,1,0]=4 7625 B16R2.317 Cc1ccc(cc1Sc2cccnc2)N 62a_100000736455_100000210063 [0,2,0,0,0,0|1,1,0]=4 7626 B16R2.317 Cc1ccc(cc1Sc2cccnc2)O 62a_100000210063_100011380479 [0,2,0,0,0,0|1,1,0]=4 7627 B16R2.317 Cc1ccc(cc1Sc2cccnc2)O 62a_100011380479_100000210063 [0,2,0,0,0,0|1,1,0]=4 7628 B16R2.317 Cc1ccc(cc1Sc2ccncc2)Br 62a_100000728582_100011344865 [0,2,0,0,0,0|1,1,0]=4 7629 B16R2.317 Cc1ccc(cc1Sc2ccncc2)Br 62a_100011344865_100000728582 [0,2,0,0,0,0|1,1,0]=4 7630 B16R2.317 Cc1ccc(cc1Sc2ccncc2)Cl 62a_100000728582_100011263213 [0,2,0,0,0,0|1,1,0]=4 7631 B16R2.317 Cc1ccc(cc1Sc2ccncc2)Cl 62a_100011263213_100000728582 [0,2,0,0,0,0|1,1,0]=4 7632 B16R2.317 Cc1ccc(cc1Sc2ccncc2)F 62a_100000728582_100011218078 [0,2,0,0,0,0|1,1,0]=4 7633 B16R2.317 Cc1ccc(cc1Sc2ccncc2)F 62a_100011218078_100000728582 [0,2,0,0,0,0|1,1,0]=4 7634 B16R2.317 Cc1ccc(cc1Sc2ccncc2)N 62a_100000728582_100000736455 [0,2,0,0,0,0|1,1,0]=4 7635 B16R2.317 Cc1ccc(cc1Sc2ccncc2)N 62a_100000736455_100000728582 [0,2,0,0,0,0|1,1,0]=4 7636 B16R2.317 Cc1ccc(cc1Sc2ccncc2)O 62a_100000728582_100011380479 [0,2,0,0,0,0|1,1,0]=4 7637 B16R2.317 Cc1ccc(cc1Sc2ccncc2)O 62a_100011380479_100000728582 [0,2,0,0,0,0|1,1,0]=4 7638 B16R2.317 Cc1ccc(nc1Sc2ccccc2)N 62a_100000126722_100000041952 [0,2,0,0,0,0|1,1,0]=4 7639 B16R2.317 Cc1ccc(nc1Sc2ccccc2)N 62a_100000719477_100000126722 [0,2,0,0,0,0|1,1,0]=4 7640 B16R2.317 Cc1cnc(c(c1)Nc2ccccc2)F 27a_100000106764_100009820679 [0,2,0,0,0,0|2,0,0]=4 7641 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)C 62a_100000719477_100009817436 [0,2,0,0,0,0|1,1,0]=4 7642 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)C 62a_100009817436_100000041952 [0,2,0,0,0,0|1,1,0]=4 7643 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)Cl 62a_100000719477_100010210167 [0,2,0,0,0,0|1,1,0]=4 7644 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)Cl 62a_100010210167_100000041952 [0,2,0,0,0,0|1,1,0]=4 7645 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)F 62a_100000049784_100000041952 [0,2,0,0,0,0|1,1,0]=4 7646 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)F 62a_100000719477_100000049784 [0,2,0,0,0,0|1,1,0]=4 7647 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)N 62a_100000049664_100000041952 [0,2,0,0,0,0|1,1,0]=4 7648 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)N 62a_100000719477_100000049664 [0,2,0,0,0,0|1,1,0]=4 7649 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)O 62a_100000719477_100000719714 [0,2,0,0,0,0|1,1,0]=4 7650 B16R2.317 Cc1cnc(c(c1)Sc2ccccc2)O 62a_100000719714_100000041952 [0,2,0,0,0,0|1,1,0]=4 7651 B16R2.317 Cc1cnc(cc1Nc2ccccc2)F 27a_100000106764_100000049870 [0,2,0,0,0,0|2,0,0]=4 7652 B16R2.317 Cc1cnc(cc1Sc2ccccc2)Br 62a_100000719477_100010067628 [0,2,0,0,0,0|1,1,0]=4 7653 B16R2.317 Cc1cnc(cc1Sc2ccccc2)Br 62a_100010067628_100000041952 [0,2,0,0,0,0|1,1,0]=4 7654 B16R2.317 Cc1cnc(cc1Sc2ccccc2)Cl 62a_100000719477_100010068021 [0,2,0,0,0,0|1,1,0]=4 7655 B16R2.317 Cc1cnc(cc1Sc2ccccc2)Cl 62a_100010068021_100000041952 [0,2,0,0,0,0|1,1,0]=4 7656 B16R2.317 Cc1cnc(cc1Sc2ccccc2)F 62a_100000049870_100000041952 [0,2,0,0,0,0|1,1,0]=4 7657 B16R2.317 Cc1cnc(cc1Sc2ccccc2)F 62a_100000719477_100000049870 [0,2,0,0,0,0|1,1,0]=4 7658 B16R2.317 Cc1cnc(cc1Sc2ccccc2)N 62a_100000719477_100009819938 [0,2,0,0,0,0|1,1,0]=4 7659 B16R2.317 Cc1cnc(cc1Sc2ccccc2)N 62a_100009819938_100000041952 [0,2,0,0,0,0|1,1,0]=4 7660 B16R2.317 Cc1cnc(cc1Sc2ccccc2)O 62a_100000719477_100009831917 [0,2,0,0,0,0|1,1,0]=4 7661 B16R2.317 Cc1cnc(cc1Sc2ccccc2)O 62a_100009831917_100000041952 [0,2,0,0,0,0|1,1,0]=4 7662 B16R2.317 Cc1ncc(cc1Sc2ccccc2)Br 62a_100000719477_200010090566 [0,2,0,0,0,0|1,1,0]=4 7663 B16R2.317 Cc1ncc(cc1Sc2ccccc2)Br 62a_200010090566_100000041952 [0,2,0,0,0,0|1,1,0]=4 7664 B16R2.317 Cc1ncc(cc1Sc2ccccc2)F 62a_100000719477_100009860710 [0,2,0,0,0,0|1,1,0]=4 7665 B16R2.317 Cc1ncc(cc1Sc2ccccc2)F 62a_100009860710_100000041952 [0,2,0,0,0,0|1,1,0]=4 7666 B16R2.317 Cc1ncc(cc1Sc2ccccc2)N 62a_100000719477_100011998591 [0,2,0,0,0,0|1,1,0]=4 7667 B16R2.317 Cc1ncc(cc1Sc2ccccc2)N 62a_100011998591_100000041952 [0,2,0,0,0,0|1,1,0]=4 7668 B16R2.317 Cc1ncc(cc1Sc2ccccc2)O 62a_100000719477_100009819603 [0,2,0,0,0,0|1,1,0]=4 7669 B16R2.317 Cc1ncc(cc1Sc2ccccc2)O 62a_100009819603_100000041952 [0,2,0,0,0,0|1,1,0]=4 7670 B16R2.317 Clc1cc(c(cn1)Br)Sc2ccccc2 62a_100000719477_100009815598 [0,2,0,0,0,0|1,1,0]=4 7671 B16R2.317 Clc1cc(c(cn1)Br)Sc2ccccc2 62a_100009815598_100000041952 [0,2,0,0,0,0|1,1,0]=4 7672 B16R2.317 Clc1cc(c(cn1)Cl)Sc2ccccc2 62a_100000719477_100010172835 [0,2,0,0,0,0|1,1,0]=4 7673 B16R2.317 Clc1cc(c(cn1)Cl)Sc2ccccc2 62a_100010172835_100000041952 [0,2,0,0,0,0|1,1,0]=4 7674 B16R2.317 Clc1ccc(c(c1)Sc2ccccc2)Br 62a_100000719477_100012339723 [0,2,0,0,0,0|0,1,0]=3 7675 B16R2.317 Clc1ccc(c(c1)Sc2ccccc2)Br 62a_100012339723_100000041952 [0,2,0,0,0,0|0,1,0]=3 7676 B16R2.317 Clc1ccc(c(c1)Sc2ccccc2)Cl 62a_100000707729_100000041952 [0,2,0,0,0,0|0,1,0]=3 7677 B16R2.317 Clc1ccc(c(c1)Sc2ccccc2)Cl 62a_100000719477_100000707729 [0,2,0,0,0,0|0,1,0]=3 7678 B16R2.317 Clc1ccc(c(c1)Sc2ccccn2)Br 62a_100011216584_100012339723 [0,2,0,0,0,0|1,1,0]=4 7679 B16R2.317 Clc1ccc(c(c1)Sc2ccccn2)Br 62a_100012339723_100011216584 [0,2,0,0,0,0|1,1,0]=4 7680 B16R2.317 Clc1ccc(c(c1)Sc2ccccn2)Cl 62a_100000707729_100011216584 [0,2,0,0,0,0|1,1,0]=4 7681 B16R2.317 Clc1ccc(c(c1)Sc2ccccn2)Cl 62a_100011216584_100000707729 [0,2,0,0,0,0|1,1,0]=4 7682 B16R2.317 Clc1ccc(c(c1)Sc2cccnc2)Br 62a_100000210063_100012339723 [0,2,0,0,0,0|1,1,0]=4 7683 B16R2.317 Clc1ccc(c(c1)Sc2cccnc2)Br 62a_100012339723_100000210063 [0,2,0,0,0,0|1,1,0]=4 7684 B16R2.317 Clc1ccc(c(c1)Sc2cccnc2)Cl 62a_100000210063_100000707729 [0,2,0,0,0,0|1,1,0]=4 7685 B16R2.317 Clc1ccc(c(c1)Sc2cccnc2)Cl 62a_100000707729_100000210063 [0,2,0,0,0,0|1,1,0]=4 7686 B16R2.317 Clc1ccc(c(c1)Sc2ccncc2)Br 62a_100000728582_100012339723 [0,2,0,0,0,0|1,1,0]=4 7687 B16R2.317 Clc1ccc(c(c1)Sc2ccncc2)Br 62a_100012339723_100000728582 [0,2,0,0,0,0|1,1,0]=4 7688 B16R2.317 Clc1ccc(c(c1)Sc2ccncc2)Cl 62a_100000707729_100000728582 [0,2,0,0,0,0|1,1,0]=4 7689 B16R2.317 Clc1ccc(c(c1)Sc2ccncc2)Cl 62a_100000728582_100000707729 [0,2,0,0,0,0|1,1,0]=4 7690 B16R2.317 Clc1ccc(cc1Sc2ccccc2)Br 62a_100000719477_100011772130 [0,2,0,0,0,0|0,1,0]=3 7691 B16R2.317 Clc1ccc(cc1Sc2ccccc2)Br 62a_100011772130_100000041952 [0,2,0,0,0,0|0,1,0]=3 7692 B16R2.317 Clc1ccc(cc1Sc2ccccn2)Br 62a_100011216584_100011772130 [0,2,0,0,0,0|1,1,0]=4 7693 B16R2.317 Clc1ccc(cc1Sc2ccccn2)Br 62a_100011772130_100011216584 [0,2,0,0,0,0|1,1,0]=4 7694 B16R2.317 Clc1ccc(cc1Sc2cccnc2)Br 62a_100000210063_100011772130 [0,2,0,0,0,0|1,1,0]=4 7695 B16R2.317 Clc1ccc(cc1Sc2cccnc2)Br 62a_100011772130_100000210063 [0,2,0,0,0,0|1,1,0]=4 7696 B16R2.317 Clc1ccc(cc1Sc2ccncc2)Br 62a_100000728582_100011772130 [0,2,0,0,0,0|1,1,0]=4 7697 B16R2.317 Clc1ccc(cc1Sc2ccncc2)Br 62a_100011772130_100000728582 [0,2,0,0,0,0|1,1,0]=4 7698 B16R2.317 Clc1cnc(c(c1)Sc2ccccc2)Cl 62a_100000719477_200000062399 [0,2,0,0,0,0|1,1,0]=4 7699 B16R2.317 Clc1cnc(c(c1)Sc2ccccc2)Cl 62a_200000062399_100000041952 [0,2,0,0,0,0|1,1,0]=4 7700 B16R2.317 Clc1cnc(cc1Sc2ccccc2)Br 62a_100000719477_100010223331 [0,2,0,0,0,0|1,1,0]=4 7701 B16R2.317 Clc1cnc(cc1Sc2ccccc2)Br 62a_100010223331_100000041952 [0,2,0,0,0,0|1,1,0]=4 7702 B16R2.317 Clc1ncc(cc1Sc2ccccc2)Br 62a_100000719477_100009814771 [0,2,0,0,0,0|1,1,0]=4 7703 B16R2.317 Clc1ncc(cc1Sc2ccccc2)Br 62a_100009814771_100000041952 [0,2,0,0,0,0|1,1,0]=4 7704 B16R2.317 Cn1ccc(=O)c(c1)Sc2ccccc2 62a_100000719477_100010750718 [0,2,0,0,0,0|1,1,0]=4 7705 B16R2.317 Cn1ccc(=O)c(c1)Sc2ccccc2 62a_100010750718_100000041952 [0,2,0,0,0,0|1,1,0]=4 7706 B16R2.317 Fc1cc(c(cn1)Cl)Nc2ccccc2 27a_100000106764_100009892587 [0,2,0,0,0,0|2,0,0]=4 7707 B16R2.317 Fc1cc(c(cn1)Cl)Sc2ccccc2 62a_100000719477_100009892587 [0,2,0,0,0,0|1,1,0]=4 7708 B16R2.317 Fc1cc(c(cn1)Cl)Sc2ccccc2 62a_100009892587_100000041952 [0,2,0,0,0,0|1,1,0]=4 7709 B16R2.317 Fc1cc(c(cn1)F)Nc2ccccc2 27a_100000106764_100010233071 [0,2,0,0,0,0|2,0,0]=4 7710 B16R2.317 Fc1cc(c(cn1)F)Sc2ccccc2 62a_100000719477_100010233071 [0,2,0,0,0,0|1,1,0]=4 7711 B16R2.317 Fc1cc(c(cn1)F)Sc2ccccc2 62a_100010233071_100000041952 [0,2,0,0,0,0|1,1,0]=4 7712 B16R2.317 Fc1ccc(c(c1)Sc2ccccc2)Br 62a_100000719477_100011217576 [0,2,0,0,0,0|0,1,0]=3 7713 B16R2.317 Fc1ccc(c(c1)Sc2ccccc2)Br 62a_100011217576_100000041952 [0,2,0,0,0,0|0,1,0]=3 7714 B16R2.317 Fc1ccc(c(c1)Sc2ccccc2)Cl 62a_100000719477_100011217299 [0,2,0,0,0,0|0,1,0]=3 7715 B16R2.317 Fc1ccc(c(c1)Sc2ccccc2)Cl 62a_100011217299_100000041952 [0,2,0,0,0,0|0,1,0]=3 7716 B16R2.317 Fc1ccc(c(c1)Sc2ccccc2)F 62a_100000719477_100011219198 [0,2,0,0,0,0|0,1,0]=3 7717 B16R2.317 Fc1ccc(c(c1)Sc2ccccc2)F 62a_100011219198_100000041952 [0,2,0,0,0,0|0,1,0]=3 7718 B16R2.317 Fc1ccc(c(c1)Sc2ccccn2)Br 62a_100011216584_100011217576 [0,2,0,0,0,0|1,1,0]=4 7719 B16R2.317 Fc1ccc(c(c1)Sc2ccccn2)Br 62a_100011217576_100011216584 [0,2,0,0,0,0|1,1,0]=4 7720 B16R2.317 Fc1ccc(c(c1)Sc2ccccn2)Cl 62a_100011216584_100011217299 [0,2,0,0,0,0|1,1,0]=4 7721 B16R2.317 Fc1ccc(c(c1)Sc2ccccn2)Cl 62a_100011217299_100011216584 [0,2,0,0,0,0|1,1,0]=4 7722 B16R2.317 Fc1ccc(c(c1)Sc2ccccn2)F 62a_100011216584_100011219198 [0,2,0,0,0,0|1,1,0]=4 7723 B16R2.317 Fc1ccc(c(c1)Sc2ccccn2)F 62a_100011219198_100011216584 [0,2,0,0,0,0|1,1,0]=4 7724 B16R2.317 Fc1ccc(c(c1)Sc2cccnc2)Br 62a_100000210063_100011217576 [0,2,0,0,0,0|1,1,0]=4 7725 B16R2.317 Fc1ccc(c(c1)Sc2cccnc2)Br 62a_100011217576_100000210063 [0,2,0,0,0,0|1,1,0]=4 7726 B16R2.317 Fc1ccc(c(c1)Sc2cccnc2)Cl 62a_100000210063_100011217299 [0,2,0,0,0,0|1,1,0]=4 7727 B16R2.317 Fc1ccc(c(c1)Sc2cccnc2)Cl 62a_100011217299_100000210063 [0,2,0,0,0,0|1,1,0]=4 7728 B16R2.317 Fc1ccc(c(c1)Sc2cccnc2)F 62a_100000210063_100011219198 [0,2,0,0,0,0|1,1,0]=4 7729 B16R2.317 Fc1ccc(c(c1)Sc2cccnc2)F 62a_100011219198_100000210063 [0,2,0,0,0,0|1,1,0]=4 7730 B16R2.317 Fc1ccc(c(c1)Sc2ccncc2)Br 62a_100000728582_100011217576 [0,2,0,0,0,0|1,1,0]=4 7731 B16R2.317 Fc1ccc(c(c1)Sc2ccncc2)Br 62a_100011217576_100000728582 [0,2,0,0,0,0|1,1,0]=4 7732 B16R2.317 Fc1ccc(c(c1)Sc2ccncc2)Cl 62a_100000728582_100011217299 [0,2,0,0,0,0|1,1,0]=4 7733 B16R2.317 Fc1ccc(c(c1)Sc2ccncc2)Cl 62a_100011217299_100000728582 [0,2,0,0,0,0|1,1,0]=4 7734 B16R2.317 Fc1ccc(c(c1)Sc2ccncc2)F 62a_100000728582_100011219198 [0,2,0,0,0,0|1,1,0]=4 7735 B16R2.317 Fc1ccc(c(c1)Sc2ccncc2)F 62a_100011219198_100000728582 [0,2,0,0,0,0|1,1,0]=4 7736 B16R2.317 Fc1ccc(c(n1)Nc2ccccc2)F 27a_100000106764_100010997973 [0,2,0,0,0,0|2,0,0]=4 7737 B16R2.317 Fc1ccc(c(n1)Sc2ccccc2)F 62a_100000719477_100010997973 [0,2,0,0,0,0|1,1,0]=4 7738 B16R2.317 Fc1ccc(c(n1)Sc2ccccc2)F 62a_100010997973_100000041952 [0,2,0,0,0,0|1,1,0]=4 7739 B16R2.317 Fc1ccc(cc1Sc2ccccc2)Br 62a_100000719477_100011217312 [0,2,0,0,0,0|0,1,0]=3 7740 B16R2.317 Fc1ccc(cc1Sc2ccccc2)Br 62a_100011217312_100000041952 [0,2,0,0,0,0|0,1,0]=3 7741 B16R2.317 Fc1ccc(cc1Sc2ccccc2)Cl 62a_100000719477_100011218116 [0,2,0,0,0,0|0,1,0]=3 7742 B16R2.317 Fc1ccc(cc1Sc2ccccc2)Cl 62a_100011218116_100000041952 [0,2,0,0,0,0|0,1,0]=3 7743 B16R2.317 Fc1ccc(cc1Sc2ccccn2)Br 62a_100011216584_100011217312 [0,2,0,0,0,0|1,1,0]=4 7744 B16R2.317 Fc1ccc(cc1Sc2ccccn2)Br 62a_100011217312_100011216584 [0,2,0,0,0,0|1,1,0]=4 7745 B16R2.317 Fc1ccc(cc1Sc2ccccn2)Cl 62a_100011216584_100011218116 [0,2,0,0,0,0|1,1,0]=4 7746 B16R2.317 Fc1ccc(cc1Sc2ccccn2)Cl 62a_100011218116_100011216584 [0,2,0,0,0,0|1,1,0]=4 7747 B16R2.317 Fc1ccc(cc1Sc2cccnc2)Br 62a_100000210063_100011217312 [0,2,0,0,0,0|1,1,0]=4 7748 B16R2.317 Fc1ccc(cc1Sc2cccnc2)Br 62a_100011217312_100000210063 [0,2,0,0,0,0|1,1,0]=4 7749 B16R2.317 Fc1ccc(cc1Sc2cccnc2)Cl 62a_100000210063_100011218116 [0,2,0,0,0,0|1,1,0]=4 7750 B16R2.317 Fc1ccc(cc1Sc2cccnc2)Cl 62a_100011218116_100000210063 [0,2,0,0,0,0|1,1,0]=4 7751 B16R2.317 Fc1ccc(cc1Sc2ccncc2)Br 62a_100000728582_100011217312 [0,2,0,0,0,0|1,1,0]=4 7752 B16R2.317 Fc1ccc(cc1Sc2ccncc2)Br 62a_100011217312_100000728582 [0,2,0,0,0,0|1,1,0]=4 7753 B16R2.317 Fc1ccc(cc1Sc2ccncc2)Cl 62a_100000728582_100011218116 [0,2,0,0,0,0|1,1,0]=4 7754 B16R2.317 Fc1ccc(cc1Sc2ccncc2)Cl 62a_100011218116_100000728582 [0,2,0,0,0,0|1,1,0]=4 7755 B16R2.317 Fc1ccc(nc1Sc2ccccc2)Cl 62a_100000719477_100010136221 [0,2,0,0,0,0|1,1,0]=4 7756 B16R2.317 Fc1ccc(nc1Sc2ccccc2)Cl 62a_100010136221_100000041952 [0,2,0,0,0,0|1,1,0]=4 7757 B16R2.317 Fc1cnc(c(c1)Sc2ccccc2)F 62a_100000719477_100009820768 [0,2,0,0,0,0|1,1,0]=4 7758 B16R2.317 Fc1cnc(c(c1)Sc2ccccc2)F 62a_100009820768_100000041952 [0,2,0,0,0,0|1,1,0]=4 7759 B16R2.317 Fc1cnc(cc1Sc2ccccc2)Br 62a_100000719477_100010193852 [0,2,0,0,0,0|1,1,0]=4 7760 B16R2.317 Fc1cnc(cc1Sc2ccccc2)Br 62a_100010193852_100000041952 [0,2,0,0,0,0|1,1,0]=4 7761 B16R2.317 Fc1cnc(cc1Sc2ccccc2)Cl 62a_100000708277_100000041952 [0,2,0,0,0,0|1,1,0]=4 7762 B16R2.317 Fc1cnc(cc1Sc2ccccc2)Cl 62a_100000719477_100000708277 [0,2,0,0,0,0|1,1,0]=4 7763 B16R2.317 Fc1ncc(cc1Nc2ccccc2)Br 27a_100000106764_100010172738 [0,2,0,0,0,0|2,0,0]=4 7764 B16R2.317 Fc1ncc(cc1Nc2ccccc2)Cl 27a_100000106764_100010188783 [0,2,0,0,0,0|2,0,0]=4 7765 B16R2.317 Fc1ncc(cc1Sc2ccccc2)Br 62a_100000719477_100010172738 [0,2,0,0,0,0|1,1,0]=4 7766 B16R2.317 Fc1ncc(cc1Sc2ccccc2)Br 62a_100010172738_100000041952 [0,2,0,0,0,0|1,1,0]=4 7767 B16R2.317 Fc1ncc(cc1Sc2ccccc2)Cl 62a_100000719477_100010188783 [0,2,0,0,0,0|1,1,0]=4 7768 B16R2.317 Fc1ncc(cc1Sc2ccccc2)Cl 62a_100010188783_100000041952 [0,2,0,0,0,0|1,1,0]=4 7769 B16R2.317 Nc1cc(c(cn1)Cl)Sc2ccccc2 62a_100000719477_100010134119 [0,2,0,0,0,0|1,1,0]=4 7770 B16R2.317 Nc1cc(c(cn1)Cl)Sc2ccccc2 62a_100010134119_100000041952 [0,2,0,0,0,0|1,1,0]=4 7771 B16R2.317 Nc1cc(c(cn1)F)Sc2ccccc2 62a_100000719477_100015713587 [0,2,0,0,0,0|1,1,0]=4 7772 B16R2.317 Nc1cc(c(cn1)F)Sc2ccccc2 62a_100015713587_100000041952 [0,2,0,0,0,0|1,1,0]=4 7773 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)Br 62a_100000719477_100000750459 [0,2,0,0,0,0|0,1,0]=3 7774 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)Br 62a_100000750459_100000041952 [0,2,0,0,0,0|0,1,0]=3 7775 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)Cl 62a_100000719477_100012360549 [0,2,0,0,0,0|0,1,0]=3 7776 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)Cl 62a_100012360549_100000041952 [0,2,0,0,0,0|0,1,0]=3 7777 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)F 62a_100000719477_100000760356 [0,2,0,0,0,0|0,1,0]=3 7778 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)F 62a_100000760356_100000041952 [0,2,0,0,0,0|0,1,0]=3 7779 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)N 62a_100000719477_100011534242 [0,2,0,0,0,0|0,1,0]=3 7780 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)N 62a_100011534242_100000041952 [0,2,0,0,0,0|0,1,0]=3 7781 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)O 62a_100000719477_100011534360 [0,2,0,0,0,0|0,1,0]=3 7782 B16R2.317 Nc1ccc(c(c1)Sc2ccccc2)O 62a_100011534360_100000041952 [0,2,0,0,0,0|0,1,0]=3 7783 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)Br 62a_100000750459_100011216584 [0,2,0,0,0,0|1,1,0]=4 7784 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)Br 62a_100011216584_100000750459 [0,2,0,0,0,0|1,1,0]=4 7785 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)Cl 62a_100011216584_100012360549 [0,2,0,0,0,0|1,1,0]=4 7786 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)Cl 62a_100012360549_100011216584 [0,2,0,0,0,0|1,1,0]=4 7787 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)F 62a_100000760356_100011216584 [0,2,0,0,0,0|1,1,0]=4 7788 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)F 62a_100011216584_100000760356 [0,2,0,0,0,0|1,1,0]=4 7789 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)N 62a_100011216584_100011534242 [0,2,0,0,0,0|1,1,0]=4 7790 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)N 62a_100011534242_100011216584 [0,2,0,0,0,0|1,1,0]=4 7791 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)O 62a_100011216584_100011534360 [0,2,0,0,0,0|1,1,0]=4 7792 B16R2.317 Nc1ccc(c(c1)Sc2ccccn2)O 62a_100011534360_100011216584 [0,2,0,0,0,0|1,1,0]=4 7793 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)Br 62a_100000210063_100000750459 [0,2,0,0,0,0|1,1,0]=4 7794 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)Br 62a_100000750459_100000210063 [0,2,0,0,0,0|1,1,0]=4 7795 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)Cl 62a_100000210063_100012360549 [0,2,0,0,0,0|1,1,0]=4 7796 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)Cl 62a_100012360549_100000210063 [0,2,0,0,0,0|1,1,0]=4 7797 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)F 62a_100000210063_100000760356 [0,2,0,0,0,0|1,1,0]=4 7798 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)F 62a_100000760356_100000210063 [0,2,0,0,0,0|1,1,0]=4 7799 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)N 62a_100000210063_100011534242 [0,2,0,0,0,0|1,1,0]=4 7800 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)N 62a_100011534242_100000210063 [0,2,0,0,0,0|1,1,0]=4 7801 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)O 62a_100000210063_100011534360 [0,2,0,0,0,0|1,1,0]=4 7802 B16R2.317 Nc1ccc(c(c1)Sc2cccnc2)O 62a_100011534360_100000210063 [0,2,0,0,0,0|1,1,0]=4 7803 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)Br 62a_100000728582_100000750459 [0,2,0,0,0,0|1,1,0]=4 7804 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)Br 62a_100000750459_100000728582 [0,2,0,0,0,0|1,1,0]=4 7805 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)Cl 62a_100000728582_100012360549 [0,2,0,0,0,0|1,1,0]=4 7806 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)Cl 62a_100012360549_100000728582 [0,2,0,0,0,0|1,1,0]=4 7807 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)F 62a_100000728582_100000760356 [0,2,0,0,0,0|1,1,0]=4 7808 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)F 62a_100000760356_100000728582 [0,2,0,0,0,0|1,1,0]=4 7809 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)N 62a_100000728582_100011534242 [0,2,0,0,0,0|1,1,0]=4 7810 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)N 62a_100011534242_100000728582 [0,2,0,0,0,0|1,1,0]=4 7811 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)O 62a_100000728582_100011534360 [0,2,0,0,0,0|1,1,0]=4 7812 B16R2.317 Nc1ccc(c(c1)Sc2ccncc2)O 62a_100011534360_100000728582 [0,2,0,0,0,0|1,1,0]=4 7813 B16R2.317 Nc1ccc(c(n1)Sc2ccccc2)Br 62a_100000719477_100010192275 [0,2,0,0,0,0|1,1,0]=4 7814 B16R2.317 Nc1ccc(c(n1)Sc2ccccc2)Br 62a_100010192275_100000041952 [0,2,0,0,0,0|1,1,0]=4 7815 B16R2.317 Nc1ccc(c(n1)Sc2ccccc2)F 62a_100000719477_100010892222 [0,2,0,0,0,0|1,1,0]=4 7816 B16R2.317 Nc1ccc(c(n1)Sc2ccccc2)F 62a_100010892222_100000041952 [0,2,0,0,0,0|1,1,0]=4 7817 B16R2.317 Nc1ccc(c(n1)Sc2ccccc2)N 62a_100000719477_200009884323 [0,2,0,0,0,0|1,1,0]=4 7818 B16R2.317 Nc1ccc(c(n1)Sc2ccccc2)N 62a_200009884323_100000041952 [0,2,0,0,0,0|1,1,0]=4 7819 B16R2.317 Nc1ccc(cc1Sc2ccccc2)Br 62a_100000187925_100000041952 [0,2,0,0,0,0|0,1,0]=3 7820 B16R2.317 Nc1ccc(cc1Sc2ccccc2)Br 62a_100000719477_100000187925 [0,2,0,0,0,0|0,1,0]=3 7821 B16R2.317 Nc1ccc(cc1Sc2ccccc2)Cl 62a_100000719477_100000761889 [0,2,0,0,0,0|0,1,0]=3 7822 B16R2.317 Nc1ccc(cc1Sc2ccccc2)Cl 62a_100000761889_100000041952 [0,2,0,0,0,0|0,1,0]=3 7823 B16R2.317 Nc1ccc(cc1Sc2ccccc2)F 62a_100000719477_100000760547 [0,2,0,0,0,0|0,1,0]=3 7824 B16R2.317 Nc1ccc(cc1Sc2ccccc2)F 62a_100000760547_100000041952 [0,2,0,0,0,0|0,1,0]=3 7825 B16R2.317 Nc1ccc(cc1Sc2ccccc2)O 62a_100000719477_100012001276 [0,2,0,0,0,0|0,1,0]=3 7826 B16R2.317 Nc1ccc(cc1Sc2ccccc2)O 62a_100012001276_100000041952 [0,2,0,0,0,0|0,1,0]=3 7827 B16R2.317 Nc1ccc(cc1Sc2ccccn2)Br 62a_100000187925_100011216584 [0,2,0,0,0,0|1,1,0]=4 7828 B16R2.317 Nc1ccc(cc1Sc2ccccn2)Br 62a_100011216584_100000187925 [0,2,0,0,0,0|1,1,0]=4 7829 B16R2.317 Nc1ccc(cc1Sc2ccccn2)Cl 62a_100000761889_100011216584 [0,2,0,0,0,0|1,1,0]=4 7830 B16R2.317 Nc1ccc(cc1Sc2ccccn2)Cl 62a_100011216584_100000761889 [0,2,0,0,0,0|1,1,0]=4 7831 B16R2.317 Nc1ccc(cc1Sc2ccccn2)F 62a_100000760547_100011216584 [0,2,0,0,0,0|1,1,0]=4 7832 B16R2.317 Nc1ccc(cc1Sc2ccccn2)F 62a_100011216584_100000760547 [0,2,0,0,0,0|1,1,0]=4 7833 B16R2.317 Nc1ccc(cc1Sc2ccccn2)O 62a_100011216584_100012001276 [0,2,0,0,0,0|1,1,0]=4 7834 B16R2.317 Nc1ccc(cc1Sc2ccccn2)O 62a_100012001276_100011216584 [0,2,0,0,0,0|1,1,0]=4 7835 B16R2.317 Nc1ccc(cc1Sc2cccnc2)Br 62a_100000187925_100000210063 [0,2,0,0,0,0|1,1,0]=4 7836 B16R2.317 Nc1ccc(cc1Sc2cccnc2)Br 62a_100000210063_100000187925 [0,2,0,0,0,0|1,1,0]=4 7837 B16R2.317 Nc1ccc(cc1Sc2cccnc2)Cl 62a_100000210063_100000761889 [0,2,0,0,0,0|1,1,0]=4 7838 B16R2.317 Nc1ccc(cc1Sc2cccnc2)Cl 62a_100000761889_100000210063 [0,2,0,0,0,0|1,1,0]=4 7839 B16R2.317 Nc1ccc(cc1Sc2cccnc2)F 62a_100000210063_100000760547 [0,2,0,0,0,0|1,1,0]=4 7840 B16R2.317 Nc1ccc(cc1Sc2cccnc2)F 62a_100000760547_100000210063 [0,2,0,0,0,0|1,1,0]=4 7841 B16R2.317 Nc1ccc(cc1Sc2cccnc2)O 62a_100000210063_100012001276 [0,2,0,0,0,0|1,1,0]=4 7842 B16R2.317 Nc1ccc(cc1Sc2cccnc2)O 62a_100012001276_100000210063 [0,2,0,0,0,0|1,1,0]=4 7843 B16R2.317 Nc1ccc(cc1Sc2ccncc2)Br 62a_100000187925_100000728582 [0,2,0,0,0,0|1,1,0]=4 7844 B16R2.317 Nc1ccc(cc1Sc2ccncc2)Br 62a_100000728582_100000187925 [0,2,0,0,0,0|1,1,0]=4 7845 B16R2.317 Nc1ccc(cc1Sc2ccncc2)Cl 62a_100000728582_100000761889 [0,2,0,0,0,0|1,1,0]=4 7846 B16R2.317 Nc1ccc(cc1Sc2ccncc2)Cl 62a_100000761889_100000728582 [0,2,0,0,0,0|1,1,0]=4 7847 B16R2.317 Nc1ccc(cc1Sc2ccncc2)F 62a_100000728582_100000760547 [0,2,0,0,0,0|1,1,0]=4 7848 B16R2.317 Nc1ccc(cc1Sc2ccncc2)F 62a_100000760547_100000728582 [0,2,0,0,0,0|1,1,0]=4 7849 B16R2.317 Nc1ccc(cc1Sc2ccncc2)O 62a_100000728582_100012001276 [0,2,0,0,0,0|1,1,0]=4 7850 B16R2.317 Nc1ccc(cc1Sc2ccncc2)O 62a_100012001276_100000728582 [0,2,0,0,0,0|1,1,0]=4 7851 B16R2.317 Nc1ccc(nc1Nc2ccccc2)F 27a_100000106764_100009879877 [0,2,0,0,0,0|2,0,0]=4 7852 B16R2.317 Nc1ccc(nc1Sc2ccccc2)Br 62a_100000719477_100010168765 [0,2,0,0,0,0|1,1,0]=4 7853 B16R2.317 Nc1ccc(nc1Sc2ccccc2)Br 62a_100010168765_100000041952 [0,2,0,0,0,0|1,1,0]=4 7854 B16R2.317 Nc1ccc(nc1Sc2ccccc2)Cl 62a_100000719477_100010233647 [0,2,0,0,0,0|1,1,0]=4 7855 B16R2.317 Nc1ccc(nc1Sc2ccccc2)Cl 62a_100010233647_100000041952 [0,2,0,0,0,0|1,1,0]=4 7856 B16R2.317 Nc1ccc(nc1Sc2ccccc2)F 62a_100000719477_100009879877 [0,2,0,0,0,0|1,1,0]=4 7857 B16R2.317 Nc1ccc(nc1Sc2ccccc2)F 62a_100009879877_100000041952 [0,2,0,0,0,0|1,1,0]=4 7858 B16R2.317 Nc1cnc(c(c1)Sc2ccccc2)Br 62a_100000719477_100010201102 [0,2,0,0,0,0|1,1,0]=4 7859 B16R2.317 Nc1cnc(c(c1)Sc2ccccc2)Br 62a_100010201102_100000041952 [0,2,0,0,0,0|1,1,0]=4 7860 B16R2.317 Nc1cnc(c(c1)Sc2ccccc2)Cl 62a_100000719477_100010253917 [0,2,0,0,0,0|1,1,0]=4 7861 B16R2.317 Nc1cnc(c(c1)Sc2ccccc2)Cl 62a_100010253917_100000041952 [0,2,0,0,0,0|1,1,0]=4 7862 B16R2.317 Nc1cnc(c(c1)Sc2ccccc2)F 62a_100000719477_100009840397 [0,2,0,0,0,0|1,1,0]=4 7863 B16R2.317 Nc1cnc(c(c1)Sc2ccccc2)F 62a_100009840397_100000041952 [0,2,0,0,0,0|1,1,0]=4 7864 B16R2.317 Nc1cnc(c(c1)Sc2ccccc2)N 62a_100000719477_200011934315 [0,2,0,0,0,0|1,1,0]=4 7865 B16R2.317 Nc1cnc(c(c1)Sc2ccccc2)N 62a_200011934315_100000041952 [0,2,0,0,0,0|1,1,0]=4 7866 B16R2.317 Nc1cnc(cc1Sc2ccccc2)Cl 62a_100000050123_100000041952 [0,2,0,0,0,0|1,1,0]=4 7867 B16R2.317 Nc1cnc(cc1Sc2ccccc2)Cl 62a_100000719477_100000050123 [0,2,0,0,0,0|1,1,0]=4 7868 B16R2.317 Nc1ncc(cc1Sc2ccccc2)Br 62a_100000719477_100000760472 [0,2,0,0,0,0|1,1,0]=4 7869 B16R2.317 Nc1ncc(cc1Sc2ccccc2)Br 62a_100000760472_100000041952 [0,2,0,0,0,0|1,1,0]=4 7870 B16R2.317 Nc1ncc(cc1Sc2ccccc2)Cl 62a_100000050159_100000041952 [0,2,0,0,0,0|1,1,0]=4 7871 B16R2.317 Nc1ncc(cc1Sc2ccccc2)Cl 62a_100000719477_100000050159 [0,2,0,0,0,0|1,1,0]=4 7872 B16R2.317 Nc1ncc(cc1Sc2ccccc2)F 62a_100000719477_100009814671 [0,2,0,0,0,0|1,1,0]=4 7873 B16R2.317 Nc1ncc(cc1Sc2ccccc2)F 62a_100009814671_100000041952 [0,2,0,0,0,0|1,1,0]=4 7874 B16R2.317 O=c1[nH]cc(cc1Sc2ccccc2)F 62a_100000719477_100009817720 [0,2,0,0,0,0|1,1,0]=4 7875 B16R2.317 O=c1[nH]cc(cc1Sc2ccccc2)F 62a_100009817720_100000041952 [0,2,0,0,0,0|1,1,0]=4 7876 B16R2.317 O=c1cc(c(c[nH]1)F)Sc2ccccc2 62a_100000719477_100009817642 [0,2,0,0,0,0|1,1,0]=4 7877 B16R2.317 O=c1cc(c(c[nH]1)F)Sc2ccccc2 62a_100009817642_100000041952 [0,2,0,0,0,0|1,1,0]=4 7878 B16R2.317 O=c1ccc(cn1Cc2ccccc2)O 271570a_203496583355_200000151737 [0,2,0,0,0,0|2,0,0]=4 7879 B16R2.317 Oc1ccc(c(c1)Sc2ccccc2)Br 62a_100000719477_100012339312 [0,2,0,0,0,0|0,1,0]=3 7880 B16R2.317 Oc1ccc(c(c1)Sc2ccccc2)Br 62a_100012339312_100000041952 [0,2,0,0,0,0|0,1,0]=3 7881 B16R2.317 Oc1ccc(c(c1)Sc2ccccc2)Cl 62a_100000049588_100000041952 [0,2,0,0,0,0|0,1,0]=3 7882 B16R2.317 Oc1ccc(c(c1)Sc2ccccc2)Cl 62a_100000719477_100000049588 [0,2,0,0,0,0|0,1,0]=3 7883 B16R2.317 Oc1ccc(c(c1)Sc2ccccc2)F 62a_100000693481_100000041952 [0,2,0,0,0,0|0,1,0]=3 7884 B16R2.317 Oc1ccc(c(c1)Sc2ccccc2)F 62a_100000719477_100000693481 [0,2,0,0,0,0|0,1,0]=3 7885 B16R2.317 Oc1ccc(c(c1)Sc2ccccc2)O 62a_100000719477_100009813629 [0,2,0,0,0,0|0,1,0]=3 7886 B16R2.317 Oc1ccc(c(c1)Sc2ccccn2)Br 62a_100011216584_100012339312 [0,2,0,0,0,0|1,1,0]=4 7887 B16R2.317 Oc1ccc(c(c1)Sc2ccccn2)Br 62a_100012339312_100011216584 [0,2,0,0,0,0|1,1,0]=4 7888 B16R2.317 Oc1ccc(c(c1)Sc2ccccn2)Cl 62a_100000049588_100011216584 [0,2,0,0,0,0|1,1,0]=4 7889 B16R2.317 Oc1ccc(c(c1)Sc2ccccn2)Cl 62a_100011216584_100000049588 [0,2,0,0,0,0|1,1,0]=4 7890 B16R2.317 Oc1ccc(c(c1)Sc2ccccn2)F 62a_100000693481_100011216584 [0,2,0,0,0,0|1,1,0]=4 7891 B16R2.317 Oc1ccc(c(c1)Sc2ccccn2)F 62a_100011216584_100000693481 [0,2,0,0,0,0|1,1,0]=4 7892 B16R2.317 Oc1ccc(c(c1)Sc2ccccn2)O 62a_100011216584_100009813629 [0,2,0,0,0,0|1,1,0]=4 7893 B16R2.317 Oc1ccc(c(c1)Sc2cccnc2)Br 62a_100000210063_100012339312 [0,2,0,0,0,0|1,1,0]=4 7894 B16R2.317 Oc1ccc(c(c1)Sc2cccnc2)Br 62a_100012339312_100000210063 [0,2,0,0,0,0|1,1,0]=4 7895 B16R2.317 Oc1ccc(c(c1)Sc2cccnc2)Cl 62a_100000049588_100000210063 [0,2,0,0,0,0|1,1,0]=4 7896 B16R2.317 Oc1ccc(c(c1)Sc2cccnc2)Cl 62a_100000210063_100000049588 [0,2,0,0,0,0|1,1,0]=4 7897 B16R2.317 Oc1ccc(c(c1)Sc2cccnc2)F 62a_100000210063_100000693481 [0,2,0,0,0,0|1,1,0]=4 7898 B16R2.317 Oc1ccc(c(c1)Sc2cccnc2)F 62a_100000693481_100000210063 [0,2,0,0,0,0|1,1,0]=4 7899 B16R2.317 Oc1ccc(c(c1)Sc2cccnc2)O 62a_100000210063_100009813629 [0,2,0,0,0,0|1,1,0]=4 7900 B16R2.317 Oc1ccc(c(c1)Sc2ccncc2)Br 62a_100000728582_100012339312 [0,2,0,0,0,0|1,1,0]=4 7901 B16R2.317 Oc1ccc(c(c1)Sc2ccncc2)Br 62a_100012339312_100000728582 [0,2,0,0,0,0|1,1,0]=4 7902 B16R2.317 Oc1ccc(c(c1)Sc2ccncc2)Cl 62a_100000049588_100000728582 [0,2,0,0,0,0|1,1,0]=4 7903 B16R2.317 Oc1ccc(c(c1)Sc2ccncc2)Cl 62a_100000728582_100000049588 [0,2,0,0,0,0|1,1,0]=4 7904 B16R2.317 Oc1ccc(c(c1)Sc2ccncc2)F 62a_100000693481_100000728582 [0,2,0,0,0,0|1,1,0]=4 7905 B16R2.317 Oc1ccc(c(c1)Sc2ccncc2)F 62a_100000728582_100000693481 [0,2,0,0,0,0|1,1,0]=4 7906 B16R2.317 Oc1ccc(c(c1)Sc2ccncc2)O 62a_100000728582_100009813629 [0,2,0,0,0,0|1,1,0]=4 7907 B16R2.317 Oc1ccc(cc1Sc2ccccc2)Br 62a_100000719477_100012355227 [0,2,0,0,0,0|0,1,0]=3 7908 B16R2.317 Oc1ccc(cc1Sc2ccccc2)Br 62a_100012355227_100000041952 [0,2,0,0,0,0|0,1,0]=3 7909 B16R2.317 Oc1ccc(cc1Sc2ccccc2)Cl 62a_100000719477_100011356953 [0,2,0,0,0,0|0,1,0]=3 7910 B16R2.317 Oc1ccc(cc1Sc2ccccc2)Cl 62a_100011356953_100000041952 [0,2,0,0,0,0|0,1,0]=3 7911 B16R2.317 Oc1ccc(cc1Sc2ccccc2)F 62a_100000211999_100000041952 [0,2,0,0,0,0|0,1,0]=3 7912 B16R2.317 Oc1ccc(cc1Sc2ccccc2)F 62a_100000719477_100000211999 [0,2,0,0,0,0|0,1,0]=3 7913 B16R2.317 Oc1ccc(cc1Sc2ccccn2)Br 62a_100011216584_100012355227 [0,2,0,0,0,0|1,1,0]=4 7914 B16R2.317 Oc1ccc(cc1Sc2ccccn2)Br 62a_100012355227_100011216584 [0,2,0,0,0,0|1,1,0]=4 7915 B16R2.317 Oc1ccc(cc1Sc2ccccn2)Cl 62a_100011216584_100011356953 [0,2,0,0,0,0|1,1,0]=4 7916 B16R2.317 Oc1ccc(cc1Sc2ccccn2)Cl 62a_100011356953_100011216584 [0,2,0,0,0,0|1,1,0]=4 7917 B16R2.317 Oc1ccc(cc1Sc2ccccn2)F 62a_100000211999_100011216584 [0,2,0,0,0,0|1,1,0]=4 7918 B16R2.317 Oc1ccc(cc1Sc2ccccn2)F 62a_100011216584_100000211999 [0,2,0,0,0,0|1,1,0]=4 7919 B16R2.317 Oc1ccc(cc1Sc2cccnc2)Br 62a_100000210063_100012355227 [0,2,0,0,0,0|1,1,0]=4 7920 B16R2.317 Oc1ccc(cc1Sc2cccnc2)Br 62a_100012355227_100000210063 [0,2,0,0,0,0|1,1,0]=4 7921 B16R2.317 Oc1ccc(cc1Sc2cccnc2)Cl 62a_100000210063_100011356953 [0,2,0,0,0,0|1,1,0]=4 7922 B16R2.317 Oc1ccc(cc1Sc2cccnc2)Cl 62a_100011356953_100000210063 [0,2,0,0,0,0|1,1,0]=4 7923 B16R2.317 Oc1ccc(cc1Sc2cccnc2)F 62a_100000210063_100000211999 [0,2,0,0,0,0|1,1,0]=4 7924 B16R2.317 Oc1ccc(cc1Sc2cccnc2)F 62a_100000211999_100000210063 [0,2,0,0,0,0|1,1,0]=4 7925 B16R2.317 Oc1ccc(cc1Sc2ccncc2)Br 62a_100000728582_100012355227 [0,2,0,0,0,0|1,1,0]=4 7926 B16R2.317 Oc1ccc(cc1Sc2ccncc2)Br 62a_100012355227_100000728582 [0,2,0,0,0,0|1,1,0]=4 7927 B16R2.317 Oc1ccc(cc1Sc2ccncc2)Cl 62a_100000728582_100011356953 [0,2,0,0,0,0|1,1,0]=4 7928 B16R2.317 Oc1ccc(cc1Sc2ccncc2)Cl 62a_100011356953_100000728582 [0,2,0,0,0,0|1,1,0]=4 7929 B16R2.317 Oc1ccc(cc1Sc2ccncc2)F 62a_100000211999_100000728582 [0,2,0,0,0,0|1,1,0]=4 7930 B16R2.317 Oc1ccc(cc1Sc2ccncc2)F 62a_100000728582_100000211999 [0,2,0,0,0,0|1,1,0]=4 7931 B16R2.317 Oc1ccc(nc1Sc2ccccc2)Br 62a_100000719477_100010253912 [0,2,0,0,0,0|1,1,0]=4 7932 B16R2.317 Oc1ccc(nc1Sc2ccccc2)Br 62a_100010253912_100000041952 [0,2,0,0,0,0|1,1,0]=4 7933 B16R2.317 Oc1ccc(nc1Sc2ccccc2)Cl 62a_100000719477_100000696390 [0,2,0,0,0,0|1,1,0]=4 7934 B16R2.317 Oc1ccc(nc1Sc2ccccc2)F 62a_100000719477_100010382442 [0,2,0,0,0,0|1,1,0]=4 7935 B16R2.317 Oc1ccc(nc1Sc2ccccc2)F 62a_100010382442_100000041952 [0,2,0,0,0,0|1,1,0]=4 7936 B16R2.317 Oc1cnc(c(c1)Sc2ccccc2)F 62a_100000719477_100009817267 [0,2,0,0,0,0|1,1,0]=4 7937 B16R2.317 Oc1cnc(c(c1)Sc2ccccc2)F 62a_100009817267_100000041952 [0,2,0,0,0,0|1,1,0]=4 7938 B16R2.317 Oc1cnc(cc1Sc2ccccc2)Cl 62a_100000698892_100000041952 [0,2,0,0,0,0|1,1,0]=4 7939 B16R2.317 Oc1cnc(cc1Sc2ccccc2)Cl 62a_100000719477_100000698892 [0,2,0,0,0,0|1,1,0]=4 7940 B16R2.317 Oc1ncc(cc1Sc2ccccc2)Br 62a_100000719477_100010197142 [0,2,0,0,0,0|1,1,0]=4 7941 B16R2.317 Oc1ncc(cc1Sc2ccccc2)Br 62a_100010197142_100000041952 [0,2,0,0,0,0|1,1,0]=4 7942 B16R2.317 Oc1ncc(cc1Sc2ccccc2)Cl 62a_100000719477_100010188700 [0,2,0,0,0,0|1,1,0]=4 7943 B16R2.317 Oc1ncc(cc1Sc2ccccc2)Cl 62a_100010188700_100000041952 [0,2,0,0,0,0|1,1,0]=4 7944 B16R2.2822 Brc1cc(cc(c1)Nc2ccccc2)Br 27a_100000106764_100009814770 [0,2,0,0,0,0|1,0,0]=3 7945 B16R2.2822 Brc1cc(cc(c1)Sc2ccccc2)Br 62a_100000719477_100009814770 [0,2,0,0,0,0|0,1,0]=3 7946 B16R2.2822 Brc1cc(cc(c1)Sc2ccccc2)Br 62a_100009814770_100000041952 [0,2,0,0,0,0|0,1,0]=3 7947 B16R2.2822 Brc1cc(cc(c1)Sc2ccccn2)Br 62a_100009814770_100011216584 [0,2,0,0,0,0|1,1,0]=4 7948 B16R2.2822 Brc1cc(cc(c1)Sc2ccccn2)Br 62a_100011216584_100009814770 [0,2,0,0,0,0|1,1,0]=4 7949 B16R2.2822 Brc1cc(cc(c1)Sc2cccnc2)Br 62a_100000210063_100009814770 [0,2,0,0,0,0|1,1,0]=4 7950 B16R2.2822 Brc1cc(cc(c1)Sc2cccnc2)Br 62a_100009814770_100000210063 [0,2,0,0,0,0|1,1,0]=4 7951 B16R2.2822 Brc1cc(cc(c1)Sc2ccncc2)Br 62a_100000728582_100009814770 [0,2,0,0,0,0|1,1,0]=4 7952 B16R2.2822 Brc1cc(cc(c1)Sc2ccncc2)Br 62a_100009814770_100000728582 [0,2,0,0,0,0|1,1,0]=4 7953 B16R2.2822 Cc1cc(cc(=O)[nH]1)Nc2ccccc2 27a_100000106764_100009861981 [0,2,0,0,0,0|2,0,0]=4 7954 B16R2.2822 Cc1cc(cc(=O)[nH]1)Sc2ccccc2 62a_100000719477_100009861981 [0,2,0,0,0,0|1,1,0]=4 7955 B16R2.2822 Cc1cc(cc(=O)[nH]1)Sc2ccccc2 62a_100009861981_100000041952 [0,2,0,0,0,0|1,1,0]=4 7956 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)C 62a_100000719477_100011215608 [0,2,0,0,0,0|0,1,0]=3 7957 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)C 62a_100011215608_100000041952 [0,2,0,0,0,0|0,1,0]=3 7958 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)Cl 62a_100000719477_100010172791 [0,2,0,0,0,0|0,1,0]=3 7959 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)Cl 62a_100010172791_100000041952 [0,2,0,0,0,0|0,1,0]=3 7960 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)F 62a_100000719477_100011356977 [0,2,0,0,0,0|0,1,0]=3 7961 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)F 62a_100011356977_100000041952 [0,2,0,0,0,0|0,1,0]=3 7962 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)N 62a_100000695972_100000041952 [0,2,0,0,0,0|0,1,0]=3 7963 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)N 62a_100000719477_100000695972 [0,2,0,0,0,0|0,1,0]=3 7964 B16R2.2822 Cc1cc(cc(c1)Sc2ccccc2)O 62a_100000719477_100011999630 [0,2,0,0,0,0|0,1,0]=3 7965 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)C 62a_100011215608_100011216584 [0,2,0,0,0,0|1,1,0]=4 7966 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)C 62a_100011216584_100011215608 [0,2,0,0,0,0|1,1,0]=4 7967 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)Cl 62a_100010172791_100011216584 [0,2,0,0,0,0|1,1,0]=4 7968 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)Cl 62a_100011216584_100010172791 [0,2,0,0,0,0|1,1,0]=4 7969 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)F 62a_100011216584_100011356977 [0,2,0,0,0,0|1,1,0]=4 7970 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)F 62a_100011356977_100011216584 [0,2,0,0,0,0|1,1,0]=4 7971 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)N 62a_100000695972_100011216584 [0,2,0,0,0,0|1,1,0]=4 7972 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)N 62a_100011216584_100000695972 [0,2,0,0,0,0|1,1,0]=4 7973 B16R2.2822 Cc1cc(cc(c1)Sc2ccccn2)O 62a_100011216584_100011999630 [0,2,0,0,0,0|1,1,0]=4 7974 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)C 62a_100000210063_100011215608 [0,2,0,0,0,0|1,1,0]=4 7975 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)C 62a_100011215608_100000210063 [0,2,0,0,0,0|1,1,0]=4 7976 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)Cl 62a_100000210063_100010172791 [0,2,0,0,0,0|1,1,0]=4 7977 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)Cl 62a_100010172791_100000210063 [0,2,0,0,0,0|1,1,0]=4 7978 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)F 62a_100000210063_100011356977 [0,2,0,0,0,0|1,1,0]=4 7979 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)F 62a_100011356977_100000210063 [0,2,0,0,0,0|1,1,0]=4 7980 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)N 62a_100000210063_100000695972 [0,2,0,0,0,0|1,1,0]=4 7981 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)N 62a_100000695972_100000210063 [0,2,0,0,0,0|1,1,0]=4 7982 B16R2.2822 Cc1cc(cc(c1)Sc2cccnc2)O 62a_100000210063_100011999630 [0,2,0,0,0,0|1,1,0]=4 7983 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)C 62a_100000728582_100011215608 [0,2,0,0,0,0|1,1,0]=4 7984 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)C 62a_100011215608_100000728582 [0,2,0,0,0,0|1,1,0]=4 7985 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)Cl 62a_100000728582_100010172791 [0,2,0,0,0,0|1,1,0]=4 7986 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)Cl 62a_100010172791_100000728582 [0,2,0,0,0,0|1,1,0]=4 7987 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)F 62a_100000728582_100011356977 [0,2,0,0,0,0|1,1,0]=4 7988 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)F 62a_100011356977_100000728582 [0,2,0,0,0,0|1,1,0]=4 7989 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)N 62a_100000695972_100000728582 [0,2,0,0,0,0|1,1,0]=4 7990 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)N 62a_100000728582_100000695972 [0,2,0,0,0,0|1,1,0]=4 7991 B16R2.2822 Cc1cc(cc(c1)Sc2ccncc2)O 62a_100000728582_100011999630 [0,2,0,0,0,0|1,1,0]=4 7992 B16R2.2822 Cc1cc(cc(n1)C)Nc2ccccc2 27a_100000106764_100000066820 [0,2,0,0,0,0|2,0,0]=4 7993 B16R2.2822 Cc1cc(cc(n1)C)Sc2ccccc2 62a_100000066820_100000041952 [0,2,0,0,0,0|1,1,0]=4 7994 B16R2.2822 Cc1cc(cc(n1)C)Sc2ccccc2 62a_100000719477_100000066820 [0,2,0,0,0,0|1,1,0]=4 7995 B16R2.2822 Cc1cc(cc(n1)Cl)Nc2ccccc2 27a_100000106764_100010068023 [0,2,0,0,0,0|2,0,0]=4 7996 B16R2.2822 Cc1cc(cc(n1)Cl)Sc2ccccc2 62a_100000719477_100010068023 [0,2,0,0,0,0|1,1,0]=4 7997 B16R2.2822 Cc1cc(cc(n1)Cl)Sc2ccccc2 62a_100010068023_100000041952 [0,2,0,0,0,0|1,1,0]=4 7998 B16R2.2822 Cc1cc(cc(n1)F)Nc2ccccc2 27a_100000106764_100010006595 [0,2,0,0,0,0|2,0,0]=4 7999 B16R2.2822 Cc1cc(cc(n1)F)Sc2ccccc2 62a_100000719477_100010006595 [0,2,0,0,0,0|1,1,0]=4 8000 B16R2.2822 Cc1cc(cc(n1)F)Sc2ccccc2 62a_100010006595_100000041952 [0,2,0,0,0,0|1,1,0]=4 8001 B16R2.2822 Cc1cc(cc(n1)N)Sc2ccccc2 62a_100000076705_100000041952 [0,2,0,0,0,0|1,1,0]=4 8002 B16R2.2822 Cc1cc(cc(n1)N)Sc2ccccc2 62a_100000719477_100000076705 [0,2,0,0,0,0|1,1,0]=4 8003 B16R2.2822 Cc1cc(cc(n1)Sc2ccccc2)N 62a_100000071261_100000041952 [0,2,0,0,0,0|1,1,0]=4 8004 B16R2.2822 Cc1cc(cc(n1)Sc2ccccc2)N 62a_100000719477_100000071261 [0,2,0,0,0,0|1,1,0]=4 8005 B16R2.2822 Cc1cc(nc(c1)Nc2ccccc2)C 27a_100000106764_100000069240 [0,2,0,0,0,0|2,0,0]=4 8006 B16R2.2822 Cc1cc(nc(c1)Nc2ccccc2)F 27a_100000106764_100009819601 [0,2,0,0,0,0|2,0,0]=4 8007 B16R2.2822 Cc1cc(nc(c1)Sc2ccccc2)C 62a_100000069240_100000041952 [0,2,0,0,0,0|1,1,0]=4 8008 B16R2.2822 Cc1cc(nc(c1)Sc2ccccc2)C 62a_100000719477_100000069240 [0,2,0,0,0,0|1,1,0]=4 8009 B16R2.2822 Cc1cc(nc(c1)Sc2ccccc2)F 62a_100000719477_100009819601 [0,2,0,0,0,0|1,1,0]=4 8010 B16R2.2822 Cc1cc(nc(c1)Sc2ccccc2)F 62a_100009819601_100000041952 [0,2,0,0,0,0|1,1,0]=4 8011 B16R2.2822 Cc1cc(nc(c1)Sc2ccccc2)N 62a_100000719477_100009819863 [0,2,0,0,0,0|1,1,0]=4 8012 B16R2.2822 Cc1cc(nc(c1)Sc2ccccc2)N 62a_100009819863_100000041952 [0,2,0,0,0,0|1,1,0]=4 8013 B16R2.2822 Clc1cc(cc(c1)Sc2ccccc2)Br 62a_100000719477_100009814755 [0,2,0,0,0,0|0,1,0]=3 8014 B16R2.2822 Clc1cc(cc(c1)Sc2ccccc2)Br 62a_100009814755_100000041952 [0,2,0,0,0,0|0,1,0]=3 8015 B16R2.2822 Clc1cc(cc(c1)Sc2ccccc2)Cl 62a_100000719477_100000747138 [0,2,0,0,0,0|0,1,0]=3 8016 B16R2.2822 Clc1cc(cc(c1)Sc2ccccc2)Cl 62a_100000747138_100000041952 [0,2,0,0,0,0|0,1,0]=3 8017 B16R2.2822 Clc1cc(cc(c1)Sc2ccccn2)Br 62a_100009814755_100011216584 [0,2,0,0,0,0|1,1,0]=4 8018 B16R2.2822 Clc1cc(cc(c1)Sc2ccccn2)Br 62a_100011216584_100009814755 [0,2,0,0,0,0|1,1,0]=4 8019 B16R2.2822 Clc1cc(cc(c1)Sc2ccccn2)Cl 62a_100000747138_100011216584 [0,2,0,0,0,0|1,1,0]=4 8020 B16R2.2822 Clc1cc(cc(c1)Sc2ccccn2)Cl 62a_100011216584_100000747138 [0,2,0,0,0,0|1,1,0]=4 8021 B16R2.2822 Clc1cc(cc(c1)Sc2cccnc2)Br 62a_100000210063_100009814755 [0,2,0,0,0,0|1,1,0]=4 8022 B16R2.2822 Clc1cc(cc(c1)Sc2cccnc2)Br 62a_100009814755_100000210063 [0,2,0,0,0,0|1,1,0]=4 8023 B16R2.2822 Clc1cc(cc(c1)Sc2cccnc2)Cl 62a_100000210063_100000747138 [0,2,0,0,0,0|1,1,0]=4 8024 B16R2.2822 Clc1cc(cc(c1)Sc2cccnc2)Cl 62a_100000747138_100000210063 [0,2,0,0,0,0|1,1,0]=4 8025 B16R2.2822 Clc1cc(cc(c1)Sc2ccncc2)Br 62a_100000728582_100009814755 [0,2,0,0,0,0|1,1,0]=4 8026 B16R2.2822 Clc1cc(cc(c1)Sc2ccncc2)Br 62a_100009814755_100000728582 [0,2,0,0,0,0|1,1,0]=4 8027 B16R2.2822 Clc1cc(cc(c1)Sc2ccncc2)Cl 62a_100000728582_100000747138 [0,2,0,0,0,0|1,1,0]=4 8028 B16R2.2822 Clc1cc(cc(c1)Sc2ccncc2)Cl 62a_100000747138_100000728582 [0,2,0,0,0,0|1,1,0]=4 8029 B16R2.2822 Clc1cc(cc(n1)Cl)Sc2ccccc2 62a_100000062418_100000041952 [0,2,0,0,0,0|1,1,0]=4 8030 B16R2.2822 Clc1cc(cc(n1)Cl)Sc2ccccc2 62a_100000719477_100000062418 [0,2,0,0,0,0|1,1,0]=4 8031 B16R2.2822 Fc1cc(cc(c1)Sc2ccccc2)Br 62a_100000719477_100009814764 [0,2,0,0,0,0|0,1,0]=3 8032 B16R2.2822 Fc1cc(cc(c1)Sc2ccccc2)Br 62a_100009814764_100000041952 [0,2,0,0,0,0|0,1,0]=3 8033 B16R2.2822 Fc1cc(cc(c1)Sc2ccccc2)Cl 62a_100000719477_100013859453 [0,2,0,0,0,0|0,1,0]=3 8034 B16R2.2822 Fc1cc(cc(c1)Sc2ccccc2)Cl 62a_100013859453_100000041952 [0,2,0,0,0,0|0,1,0]=3 8035 B16R2.2822 Fc1cc(cc(c1)Sc2ccccc2)F 62a_100000233788_100000041952 [0,2,0,0,0,0|0,1,0]=3 8036 B16R2.2822 Fc1cc(cc(c1)Sc2ccccc2)F 62a_100000719477_100000233788 [0,2,0,0,0,0|0,1,0]=3 8037 B16R2.2822 Fc1cc(cc(c1)Sc2ccccn2)Br 62a_100009814764_100011216584 [0,2,0,0,0,0|1,1,0]=4 8038 B16R2.2822 Fc1cc(cc(c1)Sc2ccccn2)Br 62a_100011216584_100009814764 [0,2,0,0,0,0|1,1,0]=4 8039 B16R2.2822 Fc1cc(cc(c1)Sc2ccccn2)Cl 62a_100011216584_100013859453 [0,2,0,0,0,0|1,1,0]=4 8040 B16R2.2822 Fc1cc(cc(c1)Sc2ccccn2)Cl 62a_100013859453_100011216584 [0,2,0,0,0,0|1,1,0]=4 8041 B16R2.2822 Fc1cc(cc(c1)Sc2ccccn2)F 62a_100000233788_100011216584 [0,2,0,0,0,0|1,1,0]=4 8042 B16R2.2822 Fc1cc(cc(c1)Sc2ccccn2)F 62a_100011216584_100000233788 [0,2,0,0,0,0|1,1,0]=4 8043 B16R2.2822 Fc1cc(cc(c1)Sc2cccnc2)Br 62a_100000210063_100009814764 [0,2,0,0,0,0|1,1,0]=4 8044 B16R2.2822 Fc1cc(cc(c1)Sc2cccnc2)Br 62a_100009814764_100000210063 [0,2,0,0,0,0|1,1,0]=4 8045 B16R2.2822 Fc1cc(cc(c1)Sc2cccnc2)Cl 62a_100000210063_100013859453 [0,2,0,0,0,0|1,1,0]=4 8046 B16R2.2822 Fc1cc(cc(c1)Sc2cccnc2)Cl 62a_100013859453_100000210063 [0,2,0,0,0,0|1,1,0]=4 8047 B16R2.2822 Fc1cc(cc(c1)Sc2cccnc2)F 62a_100000210063_100000233788 [0,2,0,0,0,0|1,1,0]=4 8048 B16R2.2822 Fc1cc(cc(c1)Sc2cccnc2)F 62a_100000233788_100000210063 [0,2,0,0,0,0|1,1,0]=4 8049 B16R2.2822 Fc1cc(cc(c1)Sc2ccncc2)Br 62a_100000728582_100009814764 [0,2,0,0,0,0|1,1,0]=4 8050 B16R2.2822 Fc1cc(cc(c1)Sc2ccncc2)Br 62a_100009814764_100000728582 [0,2,0,0,0,0|1,1,0]=4 8051 B16R2.2822 Fc1cc(cc(c1)Sc2ccncc2)Cl 62a_100000728582_100013859453 [0,2,0,0,0,0|1,1,0]=4 8052 B16R2.2822 Fc1cc(cc(c1)Sc2ccncc2)Cl 62a_100013859453_100000728582 [0,2,0,0,0,0|1,1,0]=4 8053 B16R2.2822 Fc1cc(cc(c1)Sc2ccncc2)F 62a_100000233788_100000728582 [0,2,0,0,0,0|1,1,0]=4 8054 B16R2.2822 Fc1cc(cc(c1)Sc2ccncc2)F 62a_100000728582_100000233788 [0,2,0,0,0,0|1,1,0]=4 8055 B16R2.2822 Fc1cc(cc(n1)Cl)Nc2ccccc2 27a_100000106764_100011069727 [0,2,0,0,0,0|2,0,0]=4 8056 B16R2.2822 Fc1cc(cc(n1)Cl)Sc2ccccc2 62a_100000719477_100011069727 [0,2,0,0,0,0|1,1,0]=4 8057 B16R2.2822 Fc1cc(cc(n1)Cl)Sc2ccccc2 62a_100011069727_100000041952 [0,2,0,0,0,0|1,1,0]=4 8058 B16R2.2822 Fc1cc(cc(n1)F)Nc2ccccc2 27a_100000106764_100000049587 [0,2,0,0,0,0|2,0,0]=4 8059 B16R2.2822 Fc1cc(cc(n1)F)Sc2ccccc2 62a_100000049587_100000041952 [0,2,0,0,0,0|1,1,0]=4 8060 B16R2.2822 Fc1cc(cc(n1)F)Sc2ccccc2 62a_100000719477_100000049587 [0,2,0,0,0,0|1,1,0]=4 8061 B16R2.2822 Nc1cc(cc(c1)Sc2ccccc2)Br 62a_100000719477_100009814763 [0,2,0,0,0,0|0,1,0]=3 8062 B16R2.2822 Nc1cc(cc(c1)Sc2ccccc2)Br 62a_100009814763_100000041952 [0,2,0,0,0,0|0,1,0]=3 8063 B16R2.2822 Nc1cc(cc(c1)Sc2ccccc2)Cl 62a_100000719477_100010147676 [0,2,0,0,0,0|0,1,0]=3 8064 B16R2.2822 Nc1cc(cc(c1)Sc2ccccc2)Cl 62a_100010147676_100000041952 [0,2,0,0,0,0|0,1,0]=3 8065 B16R2.2822 Nc1cc(cc(c1)Sc2ccccc2)F 62a_100000719477_100011356972 [0,2,0,0,0,0|0,1,0]=3 8066 B16R2.2822 Nc1cc(cc(c1)Sc2ccccc2)F 62a_100011356972_100000041952 [0,2,0,0,0,0|0,1,0]=3 8067 B16R2.2822 Nc1cc(cc(c1)Sc2ccccc2)N 62a_100000719477_100011999608 [0,2,0,0,0,0|0,1,0]=3 8068 B16R2.2822 Nc1cc(cc(c1)Sc2ccccc2)N 62a_100011999608_100000041952 [0,2,0,0,0,0|0,1,0]=3 8069 B16R2.2822 Nc1cc(cc(c1)Sc2ccccn2)Br 62a_100009814763_100011216584 [0,2,0,0,0,0|1,1,0]=4 8070 B16R2.2822 Nc1cc(cc(c1)Sc2ccccn2)Br 62a_100011216584_100009814763 [0,2,0,0,0,0|1,1,0]=4 8071 B16R2.2822 Nc1cc(cc(c1)Sc2ccccn2)Cl 62a_100010147676_100011216584 [0,2,0,0,0,0|1,1,0]=4 8072 B16R2.2822 Nc1cc(cc(c1)Sc2ccccn2)Cl 62a_100011216584_100010147676 [0,2,0,0,0,0|1,1,0]=4 8073 B16R2.2822 Nc1cc(cc(c1)Sc2ccccn2)F 62a_100011216584_100011356972 [0,2,0,0,0,0|1,1,0]=4 8074 B16R2.2822 Nc1cc(cc(c1)Sc2ccccn2)F 62a_100011356972_100011216584 [0,2,0,0,0,0|1,1,0]=4 8075 B16R2.2822 Nc1cc(cc(c1)Sc2ccccn2)N 62a_100011216584_100011999608 [0,2,0,0,0,0|1,1,0]=4 8076 B16R2.2822 Nc1cc(cc(c1)Sc2ccccn2)N 62a_100011999608_100011216584 [0,2,0,0,0,0|1,1,0]=4 8077 B16R2.2822 Nc1cc(cc(c1)Sc2cccnc2)Br 62a_100000210063_100009814763 [0,2,0,0,0,0|1,1,0]=4 8078 B16R2.2822 Nc1cc(cc(c1)Sc2cccnc2)Br 62a_100009814763_100000210063 [0,2,0,0,0,0|1,1,0]=4 8079 B16R2.2822 Nc1cc(cc(c1)Sc2cccnc2)Cl 62a_100000210063_100010147676 [0,2,0,0,0,0|1,1,0]=4 8080 B16R2.2822 Nc1cc(cc(c1)Sc2cccnc2)Cl 62a_100010147676_100000210063 [0,2,0,0,0,0|1,1,0]=4 8081 B16R2.2822 Nc1cc(cc(c1)Sc2cccnc2)F 62a_100000210063_100011356972 [0,2,0,0,0,0|1,1,0]=4 8082 B16R2.2822 Nc1cc(cc(c1)Sc2cccnc2)F 62a_100011356972_100000210063 [0,2,0,0,0,0|1,1,0]=4 8083 B16R2.2822 Nc1cc(cc(c1)Sc2cccnc2)N 62a_100000210063_100011999608 [0,2,0,0,0,0|1,1,0]=4 8084 B16R2.2822 Nc1cc(cc(c1)Sc2cccnc2)N 62a_100011999608_100000210063 [0,2,0,0,0,0|1,1,0]=4 8085 B16R2.2822 Nc1cc(cc(c1)Sc2ccncc2)Br 62a_100000728582_100009814763 [0,2,0,0,0,0|1,1,0]=4 8086 B16R2.2822 Nc1cc(cc(c1)Sc2ccncc2)Br 62a_100009814763_100000728582 [0,2,0,0,0,0|1,1,0]=4 8087 B16R2.2822 Nc1cc(cc(c1)Sc2ccncc2)Cl 62a_100000728582_100010147676 [0,2,0,0,0,0|1,1,0]=4 8088 B16R2.2822 Nc1cc(cc(c1)Sc2ccncc2)Cl 62a_100010147676_100000728582 [0,2,0,0,0,0|1,1,0]=4 8089 B16R2.2822 Nc1cc(cc(c1)Sc2ccncc2)F 62a_100000728582_100011356972 [0,2,0,0,0,0|1,1,0]=4 8090 B16R2.2822 Nc1cc(cc(c1)Sc2ccncc2)F 62a_100011356972_100000728582 [0,2,0,0,0,0|1,1,0]=4 8091 B16R2.2822 Nc1cc(cc(c1)Sc2ccncc2)N 62a_100000728582_100011999608 [0,2,0,0,0,0|1,1,0]=4 8092 B16R2.2822 Nc1cc(cc(c1)Sc2ccncc2)N 62a_100011999608_100000728582 [0,2,0,0,0,0|1,1,0]=4 8093 B16R2.2822 Nc1cc(cc(n1)Cl)Sc2ccccc2 62a_100000719477_200011084131 [0,2,0,0,0,0|1,1,0]=4 8094 B16R2.2822 Nc1cc(cc(n1)Cl)Sc2ccccc2 62a_200011084131_100000041952 [0,2,0,0,0,0|1,1,0]=4 8095 B16R2.2822 Nc1cc(cc(n1)N)Sc2ccccc2 62a_100009816676_100000041952 [0,2,0,0,0,0|1,1,0]=4 8096 B16R2.2822 Nc1cc(nc(c1)Sc2ccccc2)O 62a_100000719477_200012179554 [0,2,0,0,0,0|1,1,0]=4 8097 B16R2.2822 Oc1cc(cc(c1)Sc2ccccc2)Br 62a_100000719477_100010068917 [0,2,0,0,0,0|0,1,0]=3 8098 B16R2.2822 Oc1cc(cc(c1)Sc2ccccc2)Br 62a_100010068917_100000041952 [0,2,0,0,0,0|0,1,0]=3 8099 B16R2.2822 Oc1cc(cc(c1)Sc2ccccc2)Cl 62a_100000719477_100010068924 [0,2,0,0,0,0|0,1,0]=3 8100 B16R2.2822 Oc1cc(cc(c1)Sc2ccccc2)Cl 62a_100010068924_100000041952 [0,2,0,0,0,0|0,1,0]=3 8101 B16R2.2822 Oc1cc(cc(c1)Sc2ccccc2)F 62a_100000688818_100000041952 [0,2,0,0,0,0|0,1,0]=3 8102 B16R2.2822 Oc1cc(cc(c1)Sc2ccccc2)F 62a_100000719477_100000688818 [0,2,0,0,0,0|0,1,0]=3 8103 B16R2.2822 Oc1cc(cc(c1)Sc2ccccc2)O 62a_100000719477_100009868816 [0,2,0,0,0,0|0,1,0]=3 8104 B16R2.2822 Oc1cc(cc(c1)Sc2ccccn2)Br 62a_100010068917_100011216584 [0,2,0,0,0,0|1,1,0]=4 8105 B16R2.2822 Oc1cc(cc(c1)Sc2ccccn2)Br 62a_100011216584_100010068917 [0,2,0,0,0,0|1,1,0]=4 8106 B16R2.2822 Oc1cc(cc(c1)Sc2ccccn2)Cl 62a_100010068924_100011216584 [0,2,0,0,0,0|1,1,0]=4 8107 B16R2.2822 Oc1cc(cc(c1)Sc2ccccn2)Cl 62a_100011216584_100010068924 [0,2,0,0,0,0|1,1,0]=4 8108 B16R2.2822 Oc1cc(cc(c1)Sc2ccccn2)F 62a_100000688818_100011216584 [0,2,0,0,0,0|1,1,0]=4 8109 B16R2.2822 Oc1cc(cc(c1)Sc2ccccn2)F 62a_100011216584_100000688818 [0,2,0,0,0,0|1,1,0]=4 8110 B16R2.2822 Oc1cc(cc(c1)Sc2ccccn2)O 62a_100011216584_100009868816 [0,2,0,0,0,0|1,1,0]=4 8111 B16R2.2822 Oc1cc(cc(c1)Sc2cccnc2)Br 62a_100000210063_100010068917 [0,2,0,0,0,0|1,1,0]=4 8112 B16R2.2822 Oc1cc(cc(c1)Sc2cccnc2)Br 62a_100010068917_100000210063 [0,2,0,0,0,0|1,1,0]=4 8113 B16R2.2822 Oc1cc(cc(c1)Sc2cccnc2)Cl 62a_100000210063_100010068924 [0,2,0,0,0,0|1,1,0]=4 8114 B16R2.2822 Oc1cc(cc(c1)Sc2cccnc2)Cl 62a_100010068924_100000210063 [0,2,0,0,0,0|1,1,0]=4 8115 B16R2.2822 Oc1cc(cc(c1)Sc2cccnc2)F 62a_100000210063_100000688818 [0,2,0,0,0,0|1,1,0]=4 8116 B16R2.2822 Oc1cc(cc(c1)Sc2cccnc2)F 62a_100000688818_100000210063 [0,2,0,0,0,0|1,1,0]=4 8117 B16R2.2822 Oc1cc(cc(c1)Sc2cccnc2)O 62a_100000210063_100009868816 [0,2,0,0,0,0|1,1,0]=4 8118 B16R2.2822 Oc1cc(cc(c1)Sc2ccncc2)Br 62a_100000728582_100010068917 [0,2,0,0,0,0|1,1,0]=4 8119 B16R2.2822 Oc1cc(cc(c1)Sc2ccncc2)Br 62a_100010068917_100000728582 [0,2,0,0,0,0|1,1,0]=4 8120 B16R2.2822 Oc1cc(cc(c1)Sc2ccncc2)Cl 62a_100000728582_100010068924 [0,2,0,0,0,0|1,1,0]=4 8121 B16R2.2822 Oc1cc(cc(c1)Sc2ccncc2)Cl 62a_100010068924_100000728582 [0,2,0,0,0,0|1,1,0]=4 8122 B16R2.2822 Oc1cc(cc(c1)Sc2ccncc2)F 62a_100000688818_100000728582 [0,2,0,0,0,0|1,1,0]=4 8123 B16R2.2822 Oc1cc(cc(c1)Sc2ccncc2)F 62a_100000728582_100000688818 [0,2,0,0,0,0|1,1,0]=4 8124 B16R2.2822 Oc1cc(cc(c1)Sc2ccncc2)O 62a_100000728582_100009868816 [0,2,0,0,0,0|1,1,0]=4 8125 B16R2.2923 Brc1cc(ccn1)Sc2ccccc2Br 62a_100000695589_100009814637 [0,2,0,0,0,0|1,1,0]=4 8126 B16R2.2923 Brc1cc(ccn1)Sc2ccccc2Br 62a_100009814637_100000695589 [0,2,0,0,0,0|1,1,0]=4 8127 B16R2.2923 Brc1cccc(c1)Nc2ccncc2Br 27a_100000210019_100000726257 [0,2,0,0,0,0|2,0,0]=4 8128 B16R2.2923 Brc1cccc(c1)Nc2ncccc2Br 27a_100000210019_100000696092 [0,2,0,0,0,0|2,0,0]=4 8129 B16R2.2923 Brc1cccc(c1)Sc2ccccc2Br 62a_100000691529_100000695589 [0,2,0,0,0,0|0,1,0]=3 8130 B16R2.2923 Brc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100000691529 [0,2,0,0,0,0|0,1,0]=3 8131 B16R2.2923 Brc1cccc(c1)Sc2cccnc2Br 62a_100000691529_100010202626 [0,2,0,0,0,0|1,1,0]=4 8132 B16R2.2923 Brc1cccc(c1)Sc2cccnc2Br 62a_100010202626_100000691529 [0,2,0,0,0,0|1,1,0]=4 8133 B16R2.2923 Brc1cccc(c1)Sc2ccncc2Br 62a_100000691529_100000726257 [0,2,0,0,0,0|1,1,0]=4 8134 B16R2.2923 Brc1cccc(c1)Sc2ccncc2Br 62a_100000726257_100000691529 [0,2,0,0,0,0|1,1,0]=4 8135 B16R2.2923 Brc1cccc(c1)Sc2cnccc2Br 62a_100000691529_100010138639 [0,2,0,0,0,0|1,1,0]=4 8136 B16R2.2923 Brc1cccc(c1)Sc2cnccc2Br 62a_100010138639_100000691529 [0,2,0,0,0,0|1,1,0]=4 8137 B16R2.2923 Brc1cccc(c1)Sc2ncccc2Br 62a_100000691529_100000696092 [0,2,0,0,0,0|1,1,0]=4 8138 B16R2.2923 Brc1cccc(c1)Sc2ncccc2Br 62a_100000696092_100000691529 [0,2,0,0,0,0|1,1,0]=4 8139 B16R2.2923 Brc1cccc(n1)Sc2ccccc2Br 62a_100000684672_100000695589 [0,2,0,0,0,0|1,1,0]=4 8140 B16R2.2923 Brc1cccc(n1)Sc2ccccc2Br 62a_100000695589_100000684672 [0,2,0,0,0,0|1,1,0]=4 8141 B16R2.2923 Brc1cccnc1Nc2cccc(c2)I 27a_100000211102_100000696092 [0,2,0,0,0,0|2,0,0]=4 8142 B16R2.2923 Brc1cncc(c1)Sc2ccccc2Br 62a_100000695589_100000728054 [0,2,0,0,0,0|1,1,0]=4 8143 B16R2.2923 Brc1cncc(c1)Sc2ccccc2Br 62a_100000728054_100000695589 [0,2,0,0,0,0|1,1,0]=4 8144 B16R2.2923 Brc1cnccc1Nc2cccc(c2)I 27a_100000211102_100000726257 [0,2,0,0,0,0|2,0,0]=4 8145 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2Br 62a_100000695589_100009996589 [0,2,0,0,0,0|1,1,0]=4 8146 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2Br 62a_100009996589_100000695589 [0,2,0,0,0,0|1,1,0]=4 8147 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100009996589 [0,2,0,0,0,0|1,1,0]=4 8148 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2Cl 62a_100009996589_100000764095 [0,2,0,0,0,0|1,1,0]=4 8149 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2F 62a_100009996589_100011215700 [0,2,0,0,0,0|1,1,0]=4 8150 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2F 62a_100011215700_100009996589 [0,2,0,0,0,0|1,1,0]=4 8151 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2N 62a_100000210017_100009996589 [0,2,0,0,0,0|1,1,0]=4 8152 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2N 62a_100009996589_100000210017 [0,2,0,0,0,0|1,1,0]=4 8153 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2O 62a_100000739446_100009996589 [0,2,0,0,0,0|1,1,0]=4 8154 B16R2.2923 C[n+]1cccc(c1)Sc2ccccc2O 62a_100009996589_100000739446 [0,2,0,0,0,0|1,1,0]=4 8155 B16R2.2923 C[n+]1ccccc1Sc2cccc(c2)Br 62a_100000691529_100000212160 [0,2,0,0,0,0|1,1,0]=4 8156 B16R2.2923 C[n+]1ccccc1Sc2cccc(c2)Cl 62a_100000699651_100000212160 [0,2,0,0,0,0|1,1,0]=4 8157 B16R2.2923 C[n+]1ccccc1Sc2cccc(c2)F 62a_100000685547_100000212160 [0,2,0,0,0,0|1,1,0]=4 8158 B16R2.2923 C[n+]1ccccc1Sc2cccc(c2)N 62a_100000210019_100000212160 [0,2,0,0,0,0|1,1,0]=4 8159 B16R2.2923 C[n+]1ccccc1Sc2cccc(c2)[S] 62a_114929384022_100000212160 [0,2,0,0,0,0|1,1,0]=4 8160 B16R2.2923 Cc1cc(ccn1)Nc2ccccc2C 27a_100015192222_100000758586 [0,2,0,0,0,0|2,0,0]=4 8161 B16R2.2923 Cc1cc(ccn1)Nc2ccccc2Cl 27a_100000185783_100000758586 [0,2,0,0,0,0|2,0,0]=4 8162 B16R2.2923 Cc1cc(ccn1)Nc2ccccc2F 27a_100000210422_100000758586 [0,2,0,0,0,0|2,0,0]=4 8163 B16R2.2923 Cc1cc(ccn1)Nc2ccccc2I 27a_100000210053_100000758586 [0,2,0,0,0,0|2,0,0]=4 8164 B16R2.2923 Cc1cc(ccn1)Nc2ccccc2O 27a_100000185747_100000758586 [0,2,0,0,0,0|2,0,0]=4 8165 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2Br 62a_100000695589_100000758586 [0,2,0,0,0,0|1,1,0]=4 8166 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2Br 62a_100000758586_100000695589 [0,2,0,0,0,0|1,1,0]=4 8167 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2C 62a_100000210755_100000758586 [0,2,0,0,0,0|1,1,0]=4 8168 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2C 62a_100000758586_100000210755 [0,2,0,0,0,0|1,1,0]=4 8169 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2Cl 62a_100000758586_100000764095 [0,2,0,0,0,0|1,1,0]=4 8170 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2Cl 62a_100000764095_100000758586 [0,2,0,0,0,0|1,1,0]=4 8171 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2F 62a_100000758586_100011215700 [0,2,0,0,0,0|1,1,0]=4 8172 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2F 62a_100011215700_100000758586 [0,2,0,0,0,0|1,1,0]=4 8173 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2N 62a_100000210017_100000758586 [0,2,0,0,0,0|1,1,0]=4 8174 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2N 62a_100000758586_100000210017 [0,2,0,0,0,0|1,1,0]=4 8175 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2O 62a_100000739446_100000758586 [0,2,0,0,0,0|1,1,0]=4 8176 B16R2.2923 Cc1cc(ccn1)Sc2ccccc2O 62a_100000758586_100000739446 [0,2,0,0,0,0|1,1,0]=4 8177 B16R2.2923 Cc1cccc(c1)Nc2ccncc2Br 27a_100000188690_100000726257 [0,2,0,0,0,0|2,0,0]=4 8178 B16R2.2923 Cc1cccc(c1)Nc2ccncc2C 27a_100000188690_100000765111 [0,2,0,0,0,0|2,0,0]=4 8179 B16R2.2923 Cc1cccc(c1)Nc2ccncc2F 27a_100000188690_100000035921 [0,2,0,0,0,0|2,0,0]=4 8180 B16R2.2923 Cc1cccc(c1)Nc2ncccc2Br 27a_100000188690_100000696092 [0,2,0,0,0,0|2,0,0]=4 8181 B16R2.2923 Cc1cccc(c1)Sc2c[nH]ccc2=O 62a_100009998708_100011215228 [0,2,0,0,0,0|1,1,0]=4 8182 B16R2.2923 Cc1cccc(c1)Sc2c[nH]ccc2=O 62a_100011215228_100009998708 [0,2,0,0,0,0|1,1,0]=4 8183 B16R2.2923 Cc1cccc(c1)Sc2c[nH]ccc2=S 62a_100011215228_200012280681 [0,2,0,0,0,0|1,1,0]=4 8184 B16R2.2923 Cc1cccc(c1)Sc2c[nH]ccc2=S 62a_200012280681_100011215228 [0,2,0,0,0,0|1,1,0]=4 8185 B16R2.2923 Cc1cccc(c1)Sc2cccc[n+]2C 62a_100011215228_100000212160 [0,2,0,0,0,0|1,1,0]=4 8186 B16R2.2923 Cc1cccc(c1)Sc2cccc[n+]2[O-] 62a_100011215228_200000042595 [0,2,0,0,0,0|1,1,0]=4 8187 B16R2.2923 Cc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100011215228 [0,2,0,0,0,0|0,1,0]=3 8188 B16R2.2923 Cc1cccc(c1)Sc2ccccc2Br 62a_100011215228_100000695589 [0,2,0,0,0,0|0,1,0]=3 8189 B16R2.2923 Cc1cccc(c1)Sc2ccccc2C 62a_100000210755_100011215228 [0,2,0,0,0,0|0,1,0]=3 8190 B16R2.2923 Cc1cccc(c1)Sc2ccccc2C 62a_100011215228_100000210755 [0,2,0,0,0,0|0,1,0]=3 8191 B16R2.2923 Cc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100011215228 [0,2,0,0,0,0|0,1,0]=3 8192 B16R2.2923 Cc1cccc(c1)Sc2ccccc2Cl 62a_100011215228_100000764095 [0,2,0,0,0,0|0,1,0]=3 8193 B16R2.2923 Cc1cccc(c1)Sc2ccccc2F 62a_100011215228_100011215700 [0,2,0,0,0,0|0,1,0]=3 8194 B16R2.2923 Cc1cccc(c1)Sc2ccccc2F 62a_100011215700_100011215228 [0,2,0,0,0,0|0,1,0]=3 8195 B16R2.2923 Cc1cccc(c1)Sc2ccccc2N 62a_100000210017_100011215228 [0,2,0,0,0,0|0,1,0]=3 8196 B16R2.2923 Cc1cccc(c1)Sc2ccccc2N 62a_100011215228_100000210017 [0,2,0,0,0,0|0,1,0]=3 8197 B16R2.2923 Cc1cccc(c1)Sc2ccccc2O 62a_100000739446_100011215228 [0,2,0,0,0,0|0,1,0]=3 8198 B16R2.2923 Cc1cccc(c1)Sc2ccccc2O 62a_100011215228_100000739446 [0,2,0,0,0,0|0,1,0]=3 8199 B16R2.2923 Cc1cccc(c1)Sc2cccnc2Br 62a_100010202626_100011215228 [0,2,0,0,0,0|1,1,0]=4 8200 B16R2.2923 Cc1cccc(c1)Sc2cccnc2Br 62a_100011215228_100010202626 [0,2,0,0,0,0|1,1,0]=4 8201 B16R2.2923 Cc1cccc(c1)Sc2cccnc2C 62a_100000751574_100011215228 [0,2,0,0,0,0|1,1,0]=4 8202 B16R2.2923 Cc1cccc(c1)Sc2cccnc2C 62a_100011215228_100000751574 [0,2,0,0,0,0|1,1,0]=4 8203 B16R2.2923 Cc1cccc(c1)Sc2cccnc2Cl 62a_100000036424_100011215228 [0,2,0,0,0,0|1,1,0]=4 8204 B16R2.2923 Cc1cccc(c1)Sc2cccnc2Cl 62a_100011215228_100000036424 [0,2,0,0,0,0|1,1,0]=4 8205 B16R2.2923 Cc1cccc(c1)Sc2cccnc2F 62a_100009816115_100011215228 [0,2,0,0,0,0|1,1,0]=4 8206 B16R2.2923 Cc1cccc(c1)Sc2cccnc2F 62a_100011215228_100009816115 [0,2,0,0,0,0|1,1,0]=4 8207 B16R2.2923 Cc1cccc(c1)Sc2cccnc2N 62a_100000045569_100011215228 [0,2,0,0,0,0|1,1,0]=4 8208 B16R2.2923 Cc1cccc(c1)Sc2cccnc2N 62a_100011215228_100000045569 [0,2,0,0,0,0|1,1,0]=4 8209 B16R2.2923 Cc1cccc(c1)Sc2cccnc2O 62a_100000760158_100011215228 [0,2,0,0,0,0|1,1,0]=4 8210 B16R2.2923 Cc1cccc(c1)Sc2cccnc2O 62a_100011215228_100000760158 [0,2,0,0,0,0|1,1,0]=4 8211 B16R2.2923 Cc1cccc(c1)Sc2ccncc2Br 62a_100000726257_100011215228 [0,2,0,0,0,0|1,1,0]=4 8212 B16R2.2923 Cc1cccc(c1)Sc2ccncc2Br 62a_100011215228_100000726257 [0,2,0,0,0,0|1,1,0]=4 8213 B16R2.2923 Cc1cccc(c1)Sc2ccncc2C 62a_100000765111_100011215228 [0,2,0,0,0,0|1,1,0]=4 8214 B16R2.2923 Cc1cccc(c1)Sc2ccncc2C 62a_100011215228_100000765111 [0,2,0,0,0,0|1,1,0]=4 8215 B16R2.2923 Cc1cccc(c1)Sc2ccncc2Cl 62a_100000708259_100011215228 [0,2,0,0,0,0|1,1,0]=4 8216 B16R2.2923 Cc1cccc(c1)Sc2ccncc2Cl 62a_100011215228_100000708259 [0,2,0,0,0,0|1,1,0]=4 8217 B16R2.2923 Cc1cccc(c1)Sc2ccncc2F 62a_100000047030_100011215228 [0,2,0,0,0,0|1,1,0]=4 8218 B16R2.2923 Cc1cccc(c1)Sc2ccncc2F 62a_100011215228_100000047030 [0,2,0,0,0,0|1,1,0]=4 8219 B16R2.2923 Cc1cccc(c1)Sc2ccncc2N 62a_100000756074_100011215228 [0,2,0,0,0,0|1,1,0]=4 8220 B16R2.2923 Cc1cccc(c1)Sc2ccncc2N 62a_100011215228_100000756074 [0,2,0,0,0,0|1,1,0]=4 8221 B16R2.2923 Cc1cccc(c1)Sc2ccncc2O 62a_100009817591_100011215228 [0,2,0,0,0,0|1,1,0]=4 8222 B16R2.2923 Cc1cccc(c1)Sc2ccncc2O 62a_100011215228_100009817591 [0,2,0,0,0,0|1,1,0]=4 8223 B16R2.2923 Cc1cccc(c1)Sc2cnccc2Br 62a_100010138639_100011215228 [0,2,0,0,0,0|1,1,0]=4 8224 B16R2.2923 Cc1cccc(c1)Sc2cnccc2Br 62a_100011215228_100010138639 [0,2,0,0,0,0|1,1,0]=4 8225 B16R2.2923 Cc1cccc(c1)Sc2cnccc2C 62a_100000761580_100011215228 [0,2,0,0,0,0|1,1,0]=4 8226 B16R2.2923 Cc1cccc(c1)Sc2cnccc2C 62a_100011215228_100000761580 [0,2,0,0,0,0|1,1,0]=4 8227 B16R2.2923 Cc1cccc(c1)Sc2cnccc2Cl 62a_100009995489_100011215228 [0,2,0,0,0,0|1,1,0]=4 8228 B16R2.2923 Cc1cccc(c1)Sc2cnccc2Cl 62a_100011215228_100009995489 [0,2,0,0,0,0|1,1,0]=4 8229 B16R2.2923 Cc1cccc(c1)Sc2cnccc2F 62a_100009820683_100011215228 [0,2,0,0,0,0|1,1,0]=4 8230 B16R2.2923 Cc1cccc(c1)Sc2cnccc2F 62a_100011215228_100009820683 [0,2,0,0,0,0|1,1,0]=4 8231 B16R2.2923 Cc1cccc(c1)Sc2cnccc2N 62a_100000047001_100011215228 [0,2,0,0,0,0|1,1,0]=4 8232 B16R2.2923 Cc1cccc(c1)Sc2cnccc2N 62a_100011215228_100000047001 [0,2,0,0,0,0|1,1,0]=4 8233 B16R2.2923 Cc1cccc(c1)Sc2ncccc2Br 62a_100000696092_100011215228 [0,2,0,0,0,0|1,1,0]=4 8234 B16R2.2923 Cc1cccc(c1)Sc2ncccc2Br 62a_100011215228_100000696092 [0,2,0,0,0,0|1,1,0]=4 8235 B16R2.2923 Cc1cccc(c1)Sc2ncccc2C 62a_100000751373_100011215228 [0,2,0,0,0,0|1,1,0]=4 8236 B16R2.2923 Cc1cccc(c1)Sc2ncccc2C 62a_100011215228_100000751373 [0,2,0,0,0,0|1,1,0]=4 8237 B16R2.2923 Cc1cccc(c1)Sc2ncccc2Cl 62a_100011215228_100011356963 [0,2,0,0,0,0|1,1,0]=4 8238 B16R2.2923 Cc1cccc(c1)Sc2ncccc2Cl 62a_100011356963_100011215228 [0,2,0,0,0,0|1,1,0]=4 8239 B16R2.2923 Cc1cccc(c1)Sc2ncccc2F 62a_100000685392_100011215228 [0,2,0,0,0,0|1,1,0]=4 8240 B16R2.2923 Cc1cccc(c1)Sc2ncccc2F 62a_100011215228_100000685392 [0,2,0,0,0,0|1,1,0]=4 8241 B16R2.2923 Cc1cccc(c1)Sc2ncccc2N 62a_100000688686_100011215228 [0,2,0,0,0,0|1,1,0]=4 8242 B16R2.2923 Cc1cccc(c1)Sc2ncccc2N 62a_100011215228_100000688686 [0,2,0,0,0,0|1,1,0]=4 8243 B16R2.2923 Cc1cccc(c1)Sc2ncccc2O 62a_100000034122_100011215228 [0,2,0,0,0,0|1,1,0]=4 8244 B16R2.2923 Cc1cccc(c1)Sc2ncccc2O 62a_100011215228_100000034122 [0,2,0,0,0,0|1,1,0]=4 8245 B16R2.2923 Cc1cccc(n1)Sc2ccccc2Br 62a_100000695589_100000742759 [0,2,0,0,0,0|1,1,0]=4 8246 B16R2.2923 Cc1cccc(n1)Sc2ccccc2Br 62a_100000742759_100000695589 [0,2,0,0,0,0|1,1,0]=4 8247 B16R2.2923 Cc1cccc(n1)Sc2ccccc2C 62a_100000210755_100000742759 [0,2,0,0,0,0|1,1,0]=4 8248 B16R2.2923 Cc1cccc(n1)Sc2ccccc2C 62a_100000742759_100000210755 [0,2,0,0,0,0|1,1,0]=4 8249 B16R2.2923 Cc1cccc(n1)Sc2ccccc2Cl 62a_100000742759_100000764095 [0,2,0,0,0,0|1,1,0]=4 8250 B16R2.2923 Cc1cccc(n1)Sc2ccccc2Cl 62a_100000764095_100000742759 [0,2,0,0,0,0|1,1,0]=4 8251 B16R2.2923 Cc1cccc(n1)Sc2ccccc2F 62a_100000742759_100011215700 [0,2,0,0,0,0|1,1,0]=4 8252 B16R2.2923 Cc1cccc(n1)Sc2ccccc2F 62a_100011215700_100000742759 [0,2,0,0,0,0|1,1,0]=4 8253 B16R2.2923 Cc1cccc(n1)Sc2ccccc2N 62a_100000210017_100000742759 [0,2,0,0,0,0|1,1,0]=4 8254 B16R2.2923 Cc1cccc(n1)Sc2ccccc2N 62a_100000742759_100000210017 [0,2,0,0,0,0|1,1,0]=4 8255 B16R2.2923 Cc1cccc(n1)Sc2ccccc2O 62a_100000739446_100000742759 [0,2,0,0,0,0|1,1,0]=4 8256 B16R2.2923 Cc1cccc(n1)Sc2ccccc2O 62a_100000742759_100000739446 [0,2,0,0,0,0|1,1,0]=4 8257 B16R2.2923 Cc1ccccc1Nc2cc(ccn2)F 27a_100015192222_100000764206 [0,2,0,0,0,0|2,0,0]=4 8258 B16R2.2923 Cc1ccccc1Nc2cc[nH]c(=O)c2 27a_100015192222_100000061649 [0,2,0,0,0,0|2,0,0]=4 8259 B16R2.2923 Cc1ccccc1Nc2cccc(n2)F 27a_100015192222_100009815982 [0,2,0,0,0,0|2,0,0]=4 8260 B16R2.2923 Cc1ccccc1Nc2ccnc(c2)F 27a_100015192222_100009816116 [0,2,0,0,0,0|2,0,0]=4 8261 B16R2.2923 Cc1ccccc1Sc2cc(=O)cc[nH]2 62a_100009817434_100000210755 [0,2,0,0,0,0|1,1,0]=4 8262 B16R2.2923 Cc1ccccc1Sc2cc(ccn2)Cl 62a_100000210755_100010167805 [0,2,0,0,0,0|1,1,0]=4 8263 B16R2.2923 Cc1ccccc1Sc2cc(ccn2)Cl 62a_100010167805_100000210755 [0,2,0,0,0,0|1,1,0]=4 8264 B16R2.2923 Cc1ccccc1Sc2cc(ccn2)F 62a_100000210755_100000764206 [0,2,0,0,0,0|1,1,0]=4 8265 B16R2.2923 Cc1ccccc1Sc2cc(ccn2)F 62a_100000764206_100000210755 [0,2,0,0,0,0|1,1,0]=4 8266 B16R2.2923 Cc1ccccc1Sc2cc(ccn2)N 62a_100000210755_100009814236 [0,2,0,0,0,0|1,1,0]=4 8267 B16R2.2923 Cc1ccccc1Sc2cc(ccn2)N 62a_100009814236_100000210755 [0,2,0,0,0,0|1,1,0]=4 8268 B16R2.2923 Cc1ccccc1Sc2cc(ccn2)O 62a_100000210755_100000762945 [0,2,0,0,0,0|1,1,0]=4 8269 B16R2.2923 Cc1ccccc1Sc2cc[nH]c(=O)c2 62a_100000210755_100009816521 [0,2,0,0,0,0|1,1,0]=4 8270 B16R2.2923 Cc1ccccc1Sc2cc[nH]c(=O)c2 62a_100009816521_100000210755 [0,2,0,0,0,0|1,1,0]=4 8271 B16R2.2923 Cc1ccccc1Sc2ccc[n+](c2)C 62a_100000210755_100009996589 [0,2,0,0,0,0|1,1,0]=4 8272 B16R2.2923 Cc1ccccc1Sc2ccc[n+](c2)C 62a_100009996589_100000210755 [0,2,0,0,0,0|1,1,0]=4 8273 B16R2.2923 Cc1ccccc1Sc2ccc[n+](c2)[O-] 62a_100000210755_100009815978 [0,2,0,0,0,0|1,1,0]=4 8274 B16R2.2923 Cc1ccccc1Sc2cccc(=O)[nH]2 62a_100000210755_100000752884 [0,2,0,0,0,0|1,1,0]=4 8275 B16R2.2923 Cc1ccccc1Sc2cccc(c2)Br 62a_100000210755_100000691529 [0,2,0,0,0,0|0,1,0]=3 8276 B16R2.2923 Cc1ccccc1Sc2cccc(c2)Br 62a_100000691529_100000210755 [0,2,0,0,0,0|0,1,0]=3 8277 B16R2.2923 Cc1ccccc1Sc2cccc(c2)Cl 62a_100000210755_100000699651 [0,2,0,0,0,0|0,1,0]=3 8278 B16R2.2923 Cc1ccccc1Sc2cccc(c2)Cl 62a_100000699651_100000210755 [0,2,0,0,0,0|0,1,0]=3 8279 B16R2.2923 Cc1ccccc1Sc2cccc(c2)F 62a_100000210755_100000685547 [0,2,0,0,0,0|0,1,0]=3 8280 B16R2.2923 Cc1ccccc1Sc2cccc(c2)F 62a_100000685547_100000210755 [0,2,0,0,0,0|0,1,0]=3 8281 B16R2.2923 Cc1ccccc1Sc2cccc(c2)N 62a_100000210019_100000210755 [0,2,0,0,0,0|0,1,0]=3 8282 B16R2.2923 Cc1ccccc1Sc2cccc(c2)N 62a_100000210755_100000210019 [0,2,0,0,0,0|0,1,0]=3 8283 B16R2.2923 Cc1ccccc1Sc2cccc(c2)O 62a_100000210755_100000211634 [0,2,0,0,0,0|0,1,0]=3 8284 B16R2.2923 Cc1ccccc1Sc2cccc(c2)[S] 62a_100000210755_114929384022 [0,2,0,0,0,0|0,1,0]=3 8285 B16R2.2923 Cc1ccccc1Sc2cccc(c2)[S] 62a_114929384022_100000210755 [0,2,0,0,0,0|0,1,0]=3 8286 B16R2.2923 Cc1ccccc1Sc2cccc(n2)Br 62a_100000210755_100000684672 [0,2,0,0,0,0|1,1,0]=4 8287 B16R2.2923 Cc1ccccc1Sc2cccc(n2)Br 62a_100000684672_100000210755 [0,2,0,0,0,0|1,1,0]=4 8288 B16R2.2923 Cc1ccccc1Sc2cccc(n2)Cl 62a_100000051397_100000210755 [0,2,0,0,0,0|1,1,0]=4 8289 B16R2.2923 Cc1ccccc1Sc2cccc(n2)Cl 62a_100000210755_100000051397 [0,2,0,0,0,0|1,1,0]=4 8290 B16R2.2923 Cc1ccccc1Sc2cccc(n2)F 62a_100000210755_100009815982 [0,2,0,0,0,0|1,1,0]=4 8291 B16R2.2923 Cc1ccccc1Sc2cccc(n2)F 62a_100009815982_100000210755 [0,2,0,0,0,0|1,1,0]=4 8292 B16R2.2923 Cc1ccccc1Sc2cccc(n2)N 62a_100000210755_100000740741 [0,2,0,0,0,0|1,1,0]=4 8293 B16R2.2923 Cc1ccccc1Sc2cccc(n2)N 62a_100000740741_100000210755 [0,2,0,0,0,0|1,1,0]=4 8294 B16R2.2923 Cc1ccccc1Sc2ccnc(c2)Br 62a_100000210755_100009814637 [0,2,0,0,0,0|1,1,0]=4 8295 B16R2.2923 Cc1ccccc1Sc2ccnc(c2)Br 62a_100009814637_100000210755 [0,2,0,0,0,0|1,1,0]=4 8296 B16R2.2923 Cc1ccccc1Sc2ccnc(c2)Cl 62a_100000035001_100000210755 [0,2,0,0,0,0|1,1,0]=4 8297 B16R2.2923 Cc1ccccc1Sc2ccnc(c2)Cl 62a_100000210755_100000035001 [0,2,0,0,0,0|1,1,0]=4 8298 B16R2.2923 Cc1ccccc1Sc2ccnc(c2)F 62a_100000210755_100009816116 [0,2,0,0,0,0|1,1,0]=4 8299 B16R2.2923 Cc1ccccc1Sc2ccnc(c2)F 62a_100009816116_100000210755 [0,2,0,0,0,0|1,1,0]=4 8300 B16R2.2923 Cc1ccccc1Sc2ccnc(c2)N 62a_100000049665_100000210755 [0,2,0,0,0,0|1,1,0]=4 8301 B16R2.2923 Cc1ccccc1Sc2ccnc(c2)N 62a_100000210755_100000049665 [0,2,0,0,0,0|1,1,0]=4 8302 B16R2.2923 Cc1ccccc1Sc2cncc(c2)Br 62a_100000210755_100000728054 [0,2,0,0,0,0|1,1,0]=4 8303 B16R2.2923 Cc1ccccc1Sc2cncc(c2)Br 62a_100000728054_100000210755 [0,2,0,0,0,0|1,1,0]=4 8304 B16R2.2923 Cc1ccccc1Sc2cncc(c2)Cl 62a_100000049639_100000210755 [0,2,0,0,0,0|1,1,0]=4 8305 B16R2.2923 Cc1ccccc1Sc2cncc(c2)Cl 62a_100000210755_100000049639 [0,2,0,0,0,0|1,1,0]=4 8306 B16R2.2923 Cc1ccccc1Sc2cncc(c2)F 62a_100000210755_100000744099 [0,2,0,0,0,0|1,1,0]=4 8307 B16R2.2923 Cc1ccccc1Sc2cncc(c2)F 62a_100000744099_100000210755 [0,2,0,0,0,0|1,1,0]=4 8308 B16R2.2923 Cc1ccccc1Sc2cncc(c2)N 62a_100000210755_100000687067 [0,2,0,0,0,0|1,1,0]=4 8309 B16R2.2923 Cc1ccccc1Sc2cncc(c2)N 62a_100000687067_100000210755 [0,2,0,0,0,0|1,1,0]=4 8310 B16R2.2923 Cc1ccccc1Sc2cncc(c2)O 62a_100000210755_100000754920 [0,2,0,0,0,0|1,1,0]=4 8311 B16R2.2923 Cc1ccccc1Sc2cncc(c2)O 62a_100000754920_100000210755 [0,2,0,0,0,0|1,1,0]=4 8312 B16R2.2923 Cc1cccnc1Sc2cccc(c2)Br 62a_100000691529_100000751373 [0,2,0,0,0,0|1,1,0]=4 8313 B16R2.2923 Cc1cccnc1Sc2cccc(c2)Br 62a_100000751373_100000691529 [0,2,0,0,0,0|1,1,0]=4 8314 B16R2.2923 Cc1cccnc1Sc2cccc(c2)Cl 62a_100000699651_100000751373 [0,2,0,0,0,0|1,1,0]=4 8315 B16R2.2923 Cc1cccnc1Sc2cccc(c2)Cl 62a_100000751373_100000699651 [0,2,0,0,0,0|1,1,0]=4 8316 B16R2.2923 Cc1cccnc1Sc2cccc(c2)F 62a_100000685547_100000751373 [0,2,0,0,0,0|1,1,0]=4 8317 B16R2.2923 Cc1cccnc1Sc2cccc(c2)F 62a_100000751373_100000685547 [0,2,0,0,0,0|1,1,0]=4 8318 B16R2.2923 Cc1cccnc1Sc2cccc(c2)N 62a_100000210019_100000751373 [0,2,0,0,0,0|1,1,0]=4 8319 B16R2.2923 Cc1cccnc1Sc2cccc(c2)N 62a_100000751373_100000210019 [0,2,0,0,0,0|1,1,0]=4 8320 B16R2.2923 Cc1cccnc1Sc2cccc(c2)O 62a_100000751373_100000211634 [0,2,0,0,0,0|1,1,0]=4 8321 B16R2.2923 Cc1cccnc1Sc2cccc(c2)[S] 62a_100000751373_114929384022 [0,2,0,0,0,0|1,1,0]=4 8322 B16R2.2923 Cc1cccnc1Sc2cccc(c2)[S] 62a_114929384022_100000751373 [0,2,0,0,0,0|1,1,0]=4 8323 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2Br 62a_100000695589_100000750283 [0,2,0,0,0,0|1,1,0]=4 8324 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2Br 62a_100000750283_100000695589 [0,2,0,0,0,0|1,1,0]=4 8325 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2C 62a_100000210755_100000750283 [0,2,0,0,0,0|1,1,0]=4 8326 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2C 62a_100000750283_100000210755 [0,2,0,0,0,0|1,1,0]=4 8327 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2Cl 62a_100000750283_100000764095 [0,2,0,0,0,0|1,1,0]=4 8328 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2Cl 62a_100000764095_100000750283 [0,2,0,0,0,0|1,1,0]=4 8329 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2F 62a_100000750283_100011215700 [0,2,0,0,0,0|1,1,0]=4 8330 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2F 62a_100011215700_100000750283 [0,2,0,0,0,0|1,1,0]=4 8331 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2N 62a_100000210017_100000750283 [0,2,0,0,0,0|1,1,0]=4 8332 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2N 62a_100000750283_100000210017 [0,2,0,0,0,0|1,1,0]=4 8333 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2O 62a_100000739446_100000750283 [0,2,0,0,0,0|1,1,0]=4 8334 B16R2.2923 Cc1ccnc(c1)Sc2ccccc2O 62a_100000750283_100000739446 [0,2,0,0,0,0|1,1,0]=4 8335 B16R2.2923 Cc1ccncc1Sc2cccc(c2)Br 62a_100000691529_100000761580 [0,2,0,0,0,0|1,1,0]=4 8336 B16R2.2923 Cc1ccncc1Sc2cccc(c2)Br 62a_100000761580_100000691529 [0,2,0,0,0,0|1,1,0]=4 8337 B16R2.2923 Cc1ccncc1Sc2cccc(c2)Cl 62a_100000699651_100000761580 [0,2,0,0,0,0|1,1,0]=4 8338 B16R2.2923 Cc1ccncc1Sc2cccc(c2)Cl 62a_100000761580_100000699651 [0,2,0,0,0,0|1,1,0]=4 8339 B16R2.2923 Cc1ccncc1Sc2cccc(c2)F 62a_100000685547_100000761580 [0,2,0,0,0,0|1,1,0]=4 8340 B16R2.2923 Cc1ccncc1Sc2cccc(c2)F 62a_100000761580_100000685547 [0,2,0,0,0,0|1,1,0]=4 8341 B16R2.2923 Cc1ccncc1Sc2cccc(c2)N 62a_100000210019_100000761580 [0,2,0,0,0,0|1,1,0]=4 8342 B16R2.2923 Cc1ccncc1Sc2cccc(c2)N 62a_100000761580_100000210019 [0,2,0,0,0,0|1,1,0]=4 8343 B16R2.2923 Cc1ccncc1Sc2cccc(c2)O 62a_100000761580_100000211634 [0,2,0,0,0,0|1,1,0]=4 8344 B16R2.2923 Cc1ccncc1Sc2cccc(c2)[S] 62a_100000761580_114929384022 [0,2,0,0,0,0|1,1,0]=4 8345 B16R2.2923 Cc1ccncc1Sc2cccc(c2)[S] 62a_114929384022_100000761580 [0,2,0,0,0,0|1,1,0]=4 8346 B16R2.2923 Cc1cncc(c1)Sc2ccccc2Br 62a_100000695589_100000760492 [0,2,0,0,0,0|1,1,0]=4 8347 B16R2.2923 Cc1cncc(c1)Sc2ccccc2Br 62a_100000760492_100000695589 [0,2,0,0,0,0|1,1,0]=4 8348 B16R2.2923 Cc1cncc(c1)Sc2ccccc2C 62a_100000210755_100000760492 [0,2,0,0,0,0|1,1,0]=4 8349 B16R2.2923 Cc1cncc(c1)Sc2ccccc2C 62a_100000760492_100000210755 [0,2,0,0,0,0|1,1,0]=4 8350 B16R2.2923 Cc1cncc(c1)Sc2ccccc2Cl 62a_100000760492_100000764095 [0,2,0,0,0,0|1,1,0]=4 8351 B16R2.2923 Cc1cncc(c1)Sc2ccccc2Cl 62a_100000764095_100000760492 [0,2,0,0,0,0|1,1,0]=4 8352 B16R2.2923 Cc1cncc(c1)Sc2ccccc2F 62a_100000760492_100011215700 [0,2,0,0,0,0|1,1,0]=4 8353 B16R2.2923 Cc1cncc(c1)Sc2ccccc2F 62a_100011215700_100000760492 [0,2,0,0,0,0|1,1,0]=4 8354 B16R2.2923 Cc1cncc(c1)Sc2ccccc2N 62a_100000210017_100000760492 [0,2,0,0,0,0|1,1,0]=4 8355 B16R2.2923 Cc1cncc(c1)Sc2ccccc2N 62a_100000760492_100000210017 [0,2,0,0,0,0|1,1,0]=4 8356 B16R2.2923 Cc1cncc(c1)Sc2ccccc2O 62a_100000739446_100000760492 [0,2,0,0,0,0|1,1,0]=4 8357 B16R2.2923 Cc1cncc(c1)Sc2ccccc2O 62a_100000760492_100000739446 [0,2,0,0,0,0|1,1,0]=4 8358 B16R2.2923 Cc1cnccc1Nc2cccc(c2)Br 27a_100000210019_100000765111 [0,2,0,0,0,0|2,0,0]=4 8359 B16R2.2923 Cc1cnccc1Nc2cccc(c2)Cl 27a_100000185859_100000765111 [0,2,0,0,0,0|2,0,0]=4 8360 B16R2.2923 Cc1cnccc1Nc2cccc(c2)F 27a_100000210047_100000765111 [0,2,0,0,0,0|2,0,0]=4 8361 B16R2.2923 Cc1cnccc1Nc2cccc(c2)I 27a_100000211102_100000765111 [0,2,0,0,0,0|2,0,0]=4 8362 B16R2.2923 Cc1cnccc1Nc2cccc(c2)O 27a_100000210217_100000765111 [0,2,0,0,0,0|2,0,0]=4 8363 B16R2.2923 Cc1cnccc1Sc2cccc(c2)Br 62a_100000691529_100000765111 [0,2,0,0,0,0|1,1,0]=4 8364 B16R2.2923 Cc1cnccc1Sc2cccc(c2)Br 62a_100000765111_100000691529 [0,2,0,0,0,0|1,1,0]=4 8365 B16R2.2923 Cc1cnccc1Sc2cccc(c2)Cl 62a_100000699651_100000765111 [0,2,0,0,0,0|1,1,0]=4 8366 B16R2.2923 Cc1cnccc1Sc2cccc(c2)Cl 62a_100000765111_100000699651 [0,2,0,0,0,0|1,1,0]=4 8367 B16R2.2923 Cc1cnccc1Sc2cccc(c2)F 62a_100000685547_100000765111 [0,2,0,0,0,0|1,1,0]=4 8368 B16R2.2923 Cc1cnccc1Sc2cccc(c2)F 62a_100000765111_100000685547 [0,2,0,0,0,0|1,1,0]=4 8369 B16R2.2923 Cc1cnccc1Sc2cccc(c2)N 62a_100000210019_100000765111 [0,2,0,0,0,0|1,1,0]=4 8370 B16R2.2923 Cc1cnccc1Sc2cccc(c2)N 62a_100000765111_100000210019 [0,2,0,0,0,0|1,1,0]=4 8371 B16R2.2923 Cc1cnccc1Sc2cccc(c2)O 62a_100000765111_100000211634 [0,2,0,0,0,0|1,1,0]=4 8372 B16R2.2923 Cc1cnccc1Sc2cccc(c2)[S] 62a_100000765111_114929384022 [0,2,0,0,0,0|1,1,0]=4 8373 B16R2.2923 Cc1cnccc1Sc2cccc(c2)[S] 62a_114929384022_100000765111 [0,2,0,0,0,0|1,1,0]=4 8374 B16R2.2923 Cc1ncccc1Sc2cccc(c2)Br 62a_100000691529_100000751574 [0,2,0,0,0,0|1,1,0]=4 8375 B16R2.2923 Cc1ncccc1Sc2cccc(c2)Br 62a_100000751574_100000691529 [0,2,0,0,0,0|1,1,0]=4 8376 B16R2.2923 Cc1ncccc1Sc2cccc(c2)Cl 62a_100000699651_100000751574 [0,2,0,0,0,0|1,1,0]=4 8377 B16R2.2923 Cc1ncccc1Sc2cccc(c2)Cl 62a_100000751574_100000699651 [0,2,0,0,0,0|1,1,0]=4 8378 B16R2.2923 Cc1ncccc1Sc2cccc(c2)F 62a_100000685547_100000751574 [0,2,0,0,0,0|1,1,0]=4 8379 B16R2.2923 Cc1ncccc1Sc2cccc(c2)F 62a_100000751574_100000685547 [0,2,0,0,0,0|1,1,0]=4 8380 B16R2.2923 Cc1ncccc1Sc2cccc(c2)N 62a_100000210019_100000751574 [0,2,0,0,0,0|1,1,0]=4 8381 B16R2.2923 Cc1ncccc1Sc2cccc(c2)N 62a_100000751574_100000210019 [0,2,0,0,0,0|1,1,0]=4 8382 B16R2.2923 Cc1ncccc1Sc2cccc(c2)O 62a_100000751574_100000211634 [0,2,0,0,0,0|1,1,0]=4 8383 B16R2.2923 Cc1ncccc1Sc2cccc(c2)[S] 62a_100000751574_114929384022 [0,2,0,0,0,0|1,1,0]=4 8384 B16R2.2923 Cc1ncccc1Sc2cccc(c2)[S] 62a_114929384022_100000751574 [0,2,0,0,0,0|1,1,0]=4 8385 B16R2.2923 Clc1cc(ccn1)Sc2ccccc2Br 62a_100000035001_100000695589 [0,2,0,0,0,0|1,1,0]=4 8386 B16R2.2923 Clc1cc(ccn1)Sc2ccccc2Br 62a_100000695589_100000035001 [0,2,0,0,0,0|1,1,0]=4 8387 B16R2.2923 Clc1cc(ccn1)Sc2ccccc2Cl 62a_100000035001_100000764095 [0,2,0,0,0,0|1,1,0]=4 8388 B16R2.2923 Clc1cc(ccn1)Sc2ccccc2Cl 62a_100000764095_100000035001 [0,2,0,0,0,0|1,1,0]=4 8389 B16R2.2923 Clc1cccc(c1)Nc2ccncc2Br 27a_100000185859_100000726257 [0,2,0,0,0,0|2,0,0]=4 8390 B16R2.2923 Clc1cccc(c1)Nc2ncccc2Br 27a_100000185859_100000696092 [0,2,0,0,0,0|2,0,0]=4 8391 B16R2.2923 Clc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100000699651 [0,2,0,0,0,0|0,1,0]=3 8392 B16R2.2923 Clc1cccc(c1)Sc2ccccc2Br 62a_100000699651_100000695589 [0,2,0,0,0,0|0,1,0]=3 8393 B16R2.2923 Clc1cccc(c1)Sc2ccccc2Cl 62a_100000699651_100000764095 [0,2,0,0,0,0|0,1,0]=3 8394 B16R2.2923 Clc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100000699651 [0,2,0,0,0,0|0,1,0]=3 8395 B16R2.2923 Clc1cccc(c1)Sc2cccnc2Br 62a_100000699651_100010202626 [0,2,0,0,0,0|1,1,0]=4 8396 B16R2.2923 Clc1cccc(c1)Sc2cccnc2Br 62a_100010202626_100000699651 [0,2,0,0,0,0|1,1,0]=4 8397 B16R2.2923 Clc1cccc(c1)Sc2cccnc2Cl 62a_100000036424_100000699651 [0,2,0,0,0,0|1,1,0]=4 8398 B16R2.2923 Clc1cccc(c1)Sc2cccnc2Cl 62a_100000699651_100000036424 [0,2,0,0,0,0|1,1,0]=4 8399 B16R2.2923 Clc1cccc(c1)Sc2ccncc2Br 62a_100000699651_100000726257 [0,2,0,0,0,0|1,1,0]=4 8400 B16R2.2923 Clc1cccc(c1)Sc2ccncc2Br 62a_100000726257_100000699651 [0,2,0,0,0,0|1,1,0]=4 8401 B16R2.2923 Clc1cccc(c1)Sc2ccncc2Cl 62a_100000699651_100000708259 [0,2,0,0,0,0|1,1,0]=4 8402 B16R2.2923 Clc1cccc(c1)Sc2ccncc2Cl 62a_100000708259_100000699651 [0,2,0,0,0,0|1,1,0]=4 8403 B16R2.2923 Clc1cccc(c1)Sc2cnccc2Br 62a_100000699651_100010138639 [0,2,0,0,0,0|1,1,0]=4 8404 B16R2.2923 Clc1cccc(c1)Sc2cnccc2Br 62a_100010138639_100000699651 [0,2,0,0,0,0|1,1,0]=4 8405 B16R2.2923 Clc1cccc(c1)Sc2cnccc2Cl 62a_100000699651_100009995489 [0,2,0,0,0,0|1,1,0]=4 8406 B16R2.2923 Clc1cccc(c1)Sc2cnccc2Cl 62a_100009995489_100000699651 [0,2,0,0,0,0|1,1,0]=4 8407 B16R2.2923 Clc1cccc(c1)Sc2ncccc2Br 62a_100000696092_100000699651 [0,2,0,0,0,0|1,1,0]=4 8408 B16R2.2923 Clc1cccc(c1)Sc2ncccc2Br 62a_100000699651_100000696092 [0,2,0,0,0,0|1,1,0]=4 8409 B16R2.2923 Clc1cccc(c1)Sc2ncccc2Cl 62a_100000699651_100011356963 [0,2,0,0,0,0|1,1,0]=4 8410 B16R2.2923 Clc1cccc(c1)Sc2ncccc2Cl 62a_100011356963_100000699651 [0,2,0,0,0,0|1,1,0]=4 8411 B16R2.2923 Clc1cccc(n1)Sc2ccccc2Br 62a_100000051397_100000695589 [0,2,0,0,0,0|1,1,0]=4 8412 B16R2.2923 Clc1cccc(n1)Sc2ccccc2Br 62a_100000695589_100000051397 [0,2,0,0,0,0|1,1,0]=4 8413 B16R2.2923 Clc1cccc(n1)Sc2ccccc2Cl 62a_100000051397_100000764095 [0,2,0,0,0,0|1,1,0]=4 8414 B16R2.2923 Clc1cccc(n1)Sc2ccccc2Cl 62a_100000764095_100000051397 [0,2,0,0,0,0|1,1,0]=4 8415 B16R2.2923 Clc1ccccc1Sc2cccc(c2)Br 62a_100000691529_100000764095 [0,2,0,0,0,0|0,1,0]=3 8416 B16R2.2923 Clc1ccccc1Sc2cccc(c2)Br 62a_100000764095_100000691529 [0,2,0,0,0,0|0,1,0]=3 8417 B16R2.2923 Clc1ccccc1Sc2cccc(n2)Br 62a_100000684672_100000764095 [0,2,0,0,0,0|1,1,0]=4 8418 B16R2.2923 Clc1ccccc1Sc2cccc(n2)Br 62a_100000764095_100000684672 [0,2,0,0,0,0|1,1,0]=4 8419 B16R2.2923 Clc1ccccc1Sc2ccnc(c2)Br 62a_100000764095_100009814637 [0,2,0,0,0,0|1,1,0]=4 8420 B16R2.2923 Clc1ccccc1Sc2ccnc(c2)Br 62a_100009814637_100000764095 [0,2,0,0,0,0|1,1,0]=4 8421 B16R2.2923 Clc1ccccc1Sc2cncc(c2)Br 62a_100000728054_100000764095 [0,2,0,0,0,0|1,1,0]=4 8422 B16R2.2923 Clc1ccccc1Sc2cncc(c2)Br 62a_100000764095_100000728054 [0,2,0,0,0,0|1,1,0]=4 8423 B16R2.2923 Clc1cccnc1Sc2cccc(c2)Br 62a_100000691529_100011356963 [0,2,0,0,0,0|1,1,0]=4 8424 B16R2.2923 Clc1cccnc1Sc2cccc(c2)Br 62a_100011356963_100000691529 [0,2,0,0,0,0|1,1,0]=4 8425 B16R2.2923 Clc1ccnc(c1)Sc2ccccc2Br 62a_100000695589_100010167805 [0,2,0,0,0,0|1,1,0]=4 8426 B16R2.2923 Clc1ccnc(c1)Sc2ccccc2Br 62a_100010167805_100000695589 [0,2,0,0,0,0|1,1,0]=4 8427 B16R2.2923 Clc1ccnc(c1)Sc2ccccc2Cl 62a_100000764095_100010167805 [0,2,0,0,0,0|1,1,0]=4 8428 B16R2.2923 Clc1ccnc(c1)Sc2ccccc2Cl 62a_100010167805_100000764095 [0,2,0,0,0,0|1,1,0]=4 8429 B16R2.2923 Clc1ccncc1Sc2cccc(c2)Br 62a_100000691529_100009995489 [0,2,0,0,0,0|1,1,0]=4 8430 B16R2.2923 Clc1ccncc1Sc2cccc(c2)Br 62a_100009995489_100000691529 [0,2,0,0,0,0|1,1,0]=4 8431 B16R2.2923 Clc1cncc(c1)Sc2ccccc2Br 62a_100000049639_100000695589 [0,2,0,0,0,0|1,1,0]=4 8432 B16R2.2923 Clc1cncc(c1)Sc2ccccc2Br 62a_100000695589_100000049639 [0,2,0,0,0,0|1,1,0]=4 8433 B16R2.2923 Clc1cncc(c1)Sc2ccccc2Cl 62a_100000049639_100000764095 [0,2,0,0,0,0|1,1,0]=4 8434 B16R2.2923 Clc1cncc(c1)Sc2ccccc2Cl 62a_100000764095_100000049639 [0,2,0,0,0,0|1,1,0]=4 8435 B16R2.2923 Clc1cnccc1Sc2cccc(c2)Br 62a_100000691529_100000708259 [0,2,0,0,0,0|1,1,0]=4 8436 B16R2.2923 Clc1cnccc1Sc2cccc(c2)Br 62a_100000708259_100000691529 [0,2,0,0,0,0|1,1,0]=4 8437 B16R2.2923 Clc1ncccc1Sc2cccc(c2)Br 62a_100000036424_100000691529 [0,2,0,0,0,0|1,1,0]=4 8438 B16R2.2923 Clc1ncccc1Sc2cccc(c2)Br 62a_100000691529_100000036424 [0,2,0,0,0,0|1,1,0]=4 8439 B16R2.2923 Fc1cc(ccn1)Nc2ccccc2Cl 27a_100000185783_100009816116 [0,2,0,0,0,0|2,0,0]=4 8440 B16R2.2923 Fc1cc(ccn1)Nc2ccccc2F 27a_100000210422_100009816116 [0,2,0,0,0,0|2,0,0]=4 8441 B16R2.2923 Fc1cc(ccn1)Nc2ccccc2I 27a_100000210053_100009816116 [0,2,0,0,0,0|2,0,0]=4 8442 B16R2.2923 Fc1cc(ccn1)Sc2ccccc2Br 62a_100000695589_100009816116 [0,2,0,0,0,0|1,1,0]=4 8443 B16R2.2923 Fc1cc(ccn1)Sc2ccccc2Br 62a_100009816116_100000695589 [0,2,0,0,0,0|1,1,0]=4 8444 B16R2.2923 Fc1cc(ccn1)Sc2ccccc2Cl 62a_100000764095_100009816116 [0,2,0,0,0,0|1,1,0]=4 8445 B16R2.2923 Fc1cc(ccn1)Sc2ccccc2Cl 62a_100009816116_100000764095 [0,2,0,0,0,0|1,1,0]=4 8446 B16R2.2923 Fc1cc(ccn1)Sc2ccccc2F 62a_100009816116_100011215700 [0,2,0,0,0,0|1,1,0]=4 8447 B16R2.2923 Fc1cc(ccn1)Sc2ccccc2F 62a_100011215700_100009816116 [0,2,0,0,0,0|1,1,0]=4 8448 B16R2.2923 Fc1cccc(c1)Nc2ccncc2Br 27a_100000210047_100000726257 [0,2,0,0,0,0|2,0,0]=4 8449 B16R2.2923 Fc1cccc(c1)Nc2ccncc2F 27a_100000210047_100000035921 [0,2,0,0,0,0|2,0,0]=4 8450 B16R2.2923 Fc1cccc(c1)Nc2ncccc2Br 27a_100000210047_100000696092 [0,2,0,0,0,0|2,0,0]=4 8451 B16R2.2923 Fc1cccc(c1)Sc2c[nH]ccc2=S 62a_100000685547_200012280681 [0,2,0,0,0,0|1,1,0]=4 8452 B16R2.2923 Fc1cccc(c1)Sc2c[nH]ccc2=S 62a_200012280681_100000685547 [0,2,0,0,0,0|1,1,0]=4 8453 B16R2.2923 Fc1cccc(c1)Sc2ccccc2Br 62a_100000685547_100000695589 [0,2,0,0,0,0|0,1,0]=3 8454 B16R2.2923 Fc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100000685547 [0,2,0,0,0,0|0,1,0]=3 8455 B16R2.2923 Fc1cccc(c1)Sc2ccccc2Cl 62a_100000685547_100000764095 [0,2,0,0,0,0|0,1,0]=3 8456 B16R2.2923 Fc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100000685547 [0,2,0,0,0,0|0,1,0]=3 8457 B16R2.2923 Fc1cccc(c1)Sc2ccccc2F 62a_100000685547_100011215700 [0,2,0,0,0,0|0,1,0]=3 8458 B16R2.2923 Fc1cccc(c1)Sc2ccccc2F 62a_100011215700_100000685547 [0,2,0,0,0,0|0,1,0]=3 8459 B16R2.2923 Fc1cccc(c1)Sc2cccnc2Br 62a_100000685547_100010202626 [0,2,0,0,0,0|1,1,0]=4 8460 B16R2.2923 Fc1cccc(c1)Sc2cccnc2Br 62a_100010202626_100000685547 [0,2,0,0,0,0|1,1,0]=4 8461 B16R2.2923 Fc1cccc(c1)Sc2cccnc2Cl 62a_100000036424_100000685547 [0,2,0,0,0,0|1,1,0]=4 8462 B16R2.2923 Fc1cccc(c1)Sc2cccnc2Cl 62a_100000685547_100000036424 [0,2,0,0,0,0|1,1,0]=4 8463 B16R2.2923 Fc1cccc(c1)Sc2cccnc2F 62a_100000685547_100009816115 [0,2,0,0,0,0|1,1,0]=4 8464 B16R2.2923 Fc1cccc(c1)Sc2cccnc2F 62a_100009816115_100000685547 [0,2,0,0,0,0|1,1,0]=4 8465 B16R2.2923 Fc1cccc(c1)Sc2ccncc2Br 62a_100000685547_100000726257 [0,2,0,0,0,0|1,1,0]=4 8466 B16R2.2923 Fc1cccc(c1)Sc2ccncc2Br 62a_100000726257_100000685547 [0,2,0,0,0,0|1,1,0]=4 8467 B16R2.2923 Fc1cccc(c1)Sc2ccncc2Cl 62a_100000685547_100000708259 [0,2,0,0,0,0|1,1,0]=4 8468 B16R2.2923 Fc1cccc(c1)Sc2ccncc2Cl 62a_100000708259_100000685547 [0,2,0,0,0,0|1,1,0]=4 8469 B16R2.2923 Fc1cccc(c1)Sc2ccncc2F 62a_100000047030_100000685547 [0,2,0,0,0,0|1,1,0]=4 8470 B16R2.2923 Fc1cccc(c1)Sc2ccncc2F 62a_100000685547_100000047030 [0,2,0,0,0,0|1,1,0]=4 8471 B16R2.2923 Fc1cccc(c1)Sc2cnccc2Br 62a_100000685547_100010138639 [0,2,0,0,0,0|1,1,0]=4 8472 B16R2.2923 Fc1cccc(c1)Sc2cnccc2Br 62a_100010138639_100000685547 [0,2,0,0,0,0|1,1,0]=4 8473 B16R2.2923 Fc1cccc(c1)Sc2cnccc2Cl 62a_100000685547_100009995489 [0,2,0,0,0,0|1,1,0]=4 8474 B16R2.2923 Fc1cccc(c1)Sc2cnccc2Cl 62a_100009995489_100000685547 [0,2,0,0,0,0|1,1,0]=4 8475 B16R2.2923 Fc1cccc(c1)Sc2cnccc2F 62a_100000685547_100009820683 [0,2,0,0,0,0|1,1,0]=4 8476 B16R2.2923 Fc1cccc(c1)Sc2cnccc2F 62a_100009820683_100000685547 [0,2,0,0,0,0|1,1,0]=4 8477 B16R2.2923 Fc1cccc(c1)Sc2ncccc2Br 62a_100000685547_100000696092 [0,2,0,0,0,0|1,1,0]=4 8478 B16R2.2923 Fc1cccc(c1)Sc2ncccc2Br 62a_100000696092_100000685547 [0,2,0,0,0,0|1,1,0]=4 8479 B16R2.2923 Fc1cccc(c1)Sc2ncccc2Cl 62a_100000685547_100011356963 [0,2,0,0,0,0|1,1,0]=4 8480 B16R2.2923 Fc1cccc(c1)Sc2ncccc2Cl 62a_100011356963_100000685547 [0,2,0,0,0,0|1,1,0]=4 8481 B16R2.2923 Fc1cccc(c1)Sc2ncccc2F 62a_100000685392_100000685547 [0,2,0,0,0,0|1,1,0]=4 8482 B16R2.2923 Fc1cccc(c1)Sc2ncccc2F 62a_100000685547_100000685392 [0,2,0,0,0,0|1,1,0]=4 8483 B16R2.2923 Fc1cccc(n1)Nc2ccccc2Cl 27a_100000185783_100009815982 [0,2,0,0,0,0|2,0,0]=4 8484 B16R2.2923 Fc1cccc(n1)Nc2ccccc2F 27a_100000210422_100009815982 [0,2,0,0,0,0|2,0,0]=4 8485 B16R2.2923 Fc1cccc(n1)Nc2ccccc2I 27a_100000210053_100009815982 [0,2,0,0,0,0|2,0,0]=4 8486 B16R2.2923 Fc1cccc(n1)Sc2ccccc2Br 62a_100000695589_100009815982 [0,2,0,0,0,0|1,1,0]=4 8487 B16R2.2923 Fc1cccc(n1)Sc2ccccc2Br 62a_100009815982_100000695589 [0,2,0,0,0,0|1,1,0]=4 8488 B16R2.2923 Fc1cccc(n1)Sc2ccccc2Cl 62a_100000764095_100009815982 [0,2,0,0,0,0|1,1,0]=4 8489 B16R2.2923 Fc1cccc(n1)Sc2ccccc2Cl 62a_100009815982_100000764095 [0,2,0,0,0,0|1,1,0]=4 8490 B16R2.2923 Fc1cccc(n1)Sc2ccccc2F 62a_100009815982_100011215700 [0,2,0,0,0,0|1,1,0]=4 8491 B16R2.2923 Fc1cccc(n1)Sc2ccccc2F 62a_100011215700_100009815982 [0,2,0,0,0,0|1,1,0]=4 8492 B16R2.2923 Fc1ccccc1Sc2cc(ccn2)Cl 62a_100010167805_100011215700 [0,2,0,0,0,0|1,1,0]=4 8493 B16R2.2923 Fc1ccccc1Sc2cc(ccn2)Cl 62a_100011215700_100010167805 [0,2,0,0,0,0|1,1,0]=4 8494 B16R2.2923 Fc1ccccc1Sc2cccc(c2)Br 62a_100000691529_100011215700 [0,2,0,0,0,0|0,1,0]=3 8495 B16R2.2923 Fc1ccccc1Sc2cccc(c2)Br 62a_100011215700_100000691529 [0,2,0,0,0,0|0,1,0]=3 8496 B16R2.2923 Fc1ccccc1Sc2cccc(c2)Cl 62a_100000699651_100011215700 [0,2,0,0,0,0|0,1,0]=3 8497 B16R2.2923 Fc1ccccc1Sc2cccc(c2)Cl 62a_100011215700_100000699651 [0,2,0,0,0,0|0,1,0]=3 8498 B16R2.2923 Fc1ccccc1Sc2cccc(c2)[S] 62a_100011215700_114929384022 [0,2,0,0,0,0|0,1,0]=3 8499 B16R2.2923 Fc1ccccc1Sc2cccc(c2)[S] 62a_114929384022_100011215700 [0,2,0,0,0,0|0,1,0]=3 8500 B16R2.2923 Fc1ccccc1Sc2cccc(n2)Br 62a_100000684672_100011215700 [0,2,0,0,0,0|1,1,0]=4 8501 B16R2.2923 Fc1ccccc1Sc2cccc(n2)Br 62a_100011215700_100000684672 [0,2,0,0,0,0|1,1,0]=4 8502 B16R2.2923 Fc1ccccc1Sc2cccc(n2)Cl 62a_100000051397_100011215700 [0,2,0,0,0,0|1,1,0]=4 8503 B16R2.2923 Fc1ccccc1Sc2cccc(n2)Cl 62a_100011215700_100000051397 [0,2,0,0,0,0|1,1,0]=4 8504 B16R2.2923 Fc1ccccc1Sc2ccnc(c2)Br 62a_100009814637_100011215700 [0,2,0,0,0,0|1,1,0]=4 8505 B16R2.2923 Fc1ccccc1Sc2ccnc(c2)Br 62a_100011215700_100009814637 [0,2,0,0,0,0|1,1,0]=4 8506 B16R2.2923 Fc1ccccc1Sc2ccnc(c2)Cl 62a_100000035001_100011215700 [0,2,0,0,0,0|1,1,0]=4 8507 B16R2.2923 Fc1ccccc1Sc2ccnc(c2)Cl 62a_100011215700_100000035001 [0,2,0,0,0,0|1,1,0]=4 8508 B16R2.2923 Fc1ccccc1Sc2cncc(c2)Br 62a_100000728054_100011215700 [0,2,0,0,0,0|1,1,0]=4 8509 B16R2.2923 Fc1ccccc1Sc2cncc(c2)Br 62a_100011215700_100000728054 [0,2,0,0,0,0|1,1,0]=4 8510 B16R2.2923 Fc1ccccc1Sc2cncc(c2)Cl 62a_100000049639_100011215700 [0,2,0,0,0,0|1,1,0]=4 8511 B16R2.2923 Fc1ccccc1Sc2cncc(c2)Cl 62a_100011215700_100000049639 [0,2,0,0,0,0|1,1,0]=4 8512 B16R2.2923 Fc1cccnc1Sc2cccc(c2)Br 62a_100000685392_100000691529 [0,2,0,0,0,0|1,1,0]=4 8513 B16R2.2923 Fc1cccnc1Sc2cccc(c2)Br 62a_100000691529_100000685392 [0,2,0,0,0,0|1,1,0]=4 8514 B16R2.2923 Fc1cccnc1Sc2cccc(c2)Cl 62a_100000685392_100000699651 [0,2,0,0,0,0|1,1,0]=4 8515 B16R2.2923 Fc1cccnc1Sc2cccc(c2)Cl 62a_100000699651_100000685392 [0,2,0,0,0,0|1,1,0]=4 8516 B16R2.2923 Fc1cccnc1Sc2cccc(c2)[S] 62a_100000685392_114929384022 [0,2,0,0,0,0|1,1,0]=4 8517 B16R2.2923 Fc1cccnc1Sc2cccc(c2)[S] 62a_114929384022_100000685392 [0,2,0,0,0,0|1,1,0]=4 8518 B16R2.2923 Fc1ccnc(c1)Nc2ccccc2Cl 27a_100000185783_100000764206 [0,2,0,0,0,0|2,0,0]=4 8519 B16R2.2923 Fc1ccnc(c1)Nc2ccccc2F 27a_100000210422_100000764206 [0,2,0,0,0,0|2,0,0]=4 8520 B16R2.2923 Fc1ccnc(c1)Nc2ccccc2I 27a_100000210053_100000764206 [0,2,0,0,0,0|2,0,0]=4 8521 B16R2.2923 Fc1ccnc(c1)Sc2ccccc2Br 62a_100000695589_100000764206 [0,2,0,0,0,0|1,1,0]=4 8522 B16R2.2923 Fc1ccnc(c1)Sc2ccccc2Br 62a_100000764206_100000695589 [0,2,0,0,0,0|1,1,0]=4 8523 B16R2.2923 Fc1ccnc(c1)Sc2ccccc2Cl 62a_100000764095_100000764206 [0,2,0,0,0,0|1,1,0]=4 8524 B16R2.2923 Fc1ccnc(c1)Sc2ccccc2Cl 62a_100000764206_100000764095 [0,2,0,0,0,0|1,1,0]=4 8525 B16R2.2923 Fc1ccnc(c1)Sc2ccccc2F 62a_100000764206_100011215700 [0,2,0,0,0,0|1,1,0]=4 8526 B16R2.2923 Fc1ccnc(c1)Sc2ccccc2F 62a_100011215700_100000764206 [0,2,0,0,0,0|1,1,0]=4 8527 B16R2.2923 Fc1ccncc1Sc2cccc(c2)Br 62a_100000691529_100009820683 [0,2,0,0,0,0|1,1,0]=4 8528 B16R2.2923 Fc1ccncc1Sc2cccc(c2)Br 62a_100009820683_100000691529 [0,2,0,0,0,0|1,1,0]=4 8529 B16R2.2923 Fc1ccncc1Sc2cccc(c2)Cl 62a_100000699651_100009820683 [0,2,0,0,0,0|1,1,0]=4 8530 B16R2.2923 Fc1ccncc1Sc2cccc(c2)Cl 62a_100009820683_100000699651 [0,2,0,0,0,0|1,1,0]=4 8531 B16R2.2923 Fc1ccncc1Sc2cccc(c2)[S] 62a_100009820683_114929384022 [0,2,0,0,0,0|1,1,0]=4 8532 B16R2.2923 Fc1ccncc1Sc2cccc(c2)[S] 62a_114929384022_100009820683 [0,2,0,0,0,0|1,1,0]=4 8533 B16R2.2923 Fc1cncc(c1)Sc2ccccc2Br 62a_100000695589_100000744099 [0,2,0,0,0,0|1,1,0]=4 8534 B16R2.2923 Fc1cncc(c1)Sc2ccccc2Br 62a_100000744099_100000695589 [0,2,0,0,0,0|1,1,0]=4 8535 B16R2.2923 Fc1cncc(c1)Sc2ccccc2Cl 62a_100000744099_100000764095 [0,2,0,0,0,0|1,1,0]=4 8536 B16R2.2923 Fc1cncc(c1)Sc2ccccc2Cl 62a_100000764095_100000744099 [0,2,0,0,0,0|1,1,0]=4 8537 B16R2.2923 Fc1cncc(c1)Sc2ccccc2F 62a_100000744099_100011215700 [0,2,0,0,0,0|1,1,0]=4 8538 B16R2.2923 Fc1cncc(c1)Sc2ccccc2F 62a_100011215700_100000744099 [0,2,0,0,0,0|1,1,0]=4 8539 B16R2.2923 Fc1cnccc1Nc2cccc(c2)Br 27a_100000210019_100000035921 [0,2,0,0,0,0|2,0,0]=4 8540 B16R2.2923 Fc1cnccc1Nc2cccc(c2)Cl 27a_100000185859_100000035921 [0,2,0,0,0,0|2,0,0]=4 8541 B16R2.2923 Fc1cnccc1Nc2cccc(c2)I 27a_100000211102_100000035921 [0,2,0,0,0,0|2,0,0]=4 8542 B16R2.2923 Fc1cnccc1Sc2cccc(c2)Br 62a_100000047030_100000691529 [0,2,0,0,0,0|1,1,0]=4 8543 B16R2.2923 Fc1cnccc1Sc2cccc(c2)Br 62a_100000691529_100000047030 [0,2,0,0,0,0|1,1,0]=4 8544 B16R2.2923 Fc1cnccc1Sc2cccc(c2)Cl 62a_100000047030_100000699651 [0,2,0,0,0,0|1,1,0]=4 8545 B16R2.2923 Fc1cnccc1Sc2cccc(c2)Cl 62a_100000699651_100000047030 [0,2,0,0,0,0|1,1,0]=4 8546 B16R2.2923 Fc1cnccc1Sc2cccc(c2)[S] 62a_100000047030_114929384022 [0,2,0,0,0,0|1,1,0]=4 8547 B16R2.2923 Fc1cnccc1Sc2cccc(c2)[S] 62a_114929384022_100000047030 [0,2,0,0,0,0|1,1,0]=4 8548 B16R2.2923 Fc1ncccc1Sc2cccc(c2)Br 62a_100000691529_100009816115 [0,2,0,0,0,0|1,1,0]=4 8549 B16R2.2923 Fc1ncccc1Sc2cccc(c2)Br 62a_100009816115_100000691529 [0,2,0,0,0,0|1,1,0]=4 8550 B16R2.2923 Fc1ncccc1Sc2cccc(c2)Cl 62a_100000699651_100009816115 [0,2,0,0,0,0|1,1,0]=4 8551 B16R2.2923 Fc1ncccc1Sc2cccc(c2)Cl 62a_100009816115_100000699651 [0,2,0,0,0,0|1,1,0]=4 8552 B16R2.2923 Fc1ncccc1Sc2cccc(c2)[S] 62a_100009816115_114929384022 [0,2,0,0,0,0|1,1,0]=4 8553 B16R2.2923 Fc1ncccc1Sc2cccc(c2)[S] 62a_114929384022_100009816115 [0,2,0,0,0,0|1,1,0]=4 8554 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2Br 62a_100000049665_100000695589 [0,2,0,0,0,0|1,1,0]=4 8555 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2Br 62a_100000695589_100000049665 [0,2,0,0,0,0|1,1,0]=4 8556 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2Cl 62a_100000049665_100000764095 [0,2,0,0,0,0|1,1,0]=4 8557 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2Cl 62a_100000764095_100000049665 [0,2,0,0,0,0|1,1,0]=4 8558 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2F 62a_100000049665_100011215700 [0,2,0,0,0,0|1,1,0]=4 8559 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2F 62a_100011215700_100000049665 [0,2,0,0,0,0|1,1,0]=4 8560 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2N 62a_100000049665_100000210017 [0,2,0,0,0,0|1,1,0]=4 8561 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2N 62a_100000210017_100000049665 [0,2,0,0,0,0|1,1,0]=4 8562 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2O 62a_100000049665_100000739446 [0,2,0,0,0,0|1,1,0]=4 8563 B16R2.2923 Nc1cc(ccn1)Sc2ccccc2O 62a_100000739446_100000049665 [0,2,0,0,0,0|1,1,0]=4 8564 B16R2.2923 Nc1cccc(c1)Sc2c[nH]ccc2=O 62a_100000210019_100009998708 [0,2,0,0,0,0|1,1,0]=4 8565 B16R2.2923 Nc1cccc(c1)Sc2c[nH]ccc2=O 62a_100009998708_100000210019 [0,2,0,0,0,0|1,1,0]=4 8566 B16R2.2923 Nc1cccc(c1)Sc2c[nH]ccc2=S 62a_100000210019_200012280681 [0,2,0,0,0,0|1,1,0]=4 8567 B16R2.2923 Nc1cccc(c1)Sc2c[nH]ccc2=S 62a_200012280681_100000210019 [0,2,0,0,0,0|1,1,0]=4 8568 B16R2.2923 Nc1cccc(c1)Sc2cccc[n+]2[O-] 62a_100000210019_200000042595 [0,2,0,0,0,0|1,1,0]=4 8569 B16R2.2923 Nc1cccc(c1)Sc2ccccc2Br 62a_100000210019_100000695589 [0,2,0,0,0,0|0,1,0]=3 8570 B16R2.2923 Nc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100000210019 [0,2,0,0,0,0|0,1,0]=3 8571 B16R2.2923 Nc1cccc(c1)Sc2ccccc2Cl 62a_100000210019_100000764095 [0,2,0,0,0,0|0,1,0]=3 8572 B16R2.2923 Nc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100000210019 [0,2,0,0,0,0|0,1,0]=3 8573 B16R2.2923 Nc1cccc(c1)Sc2ccccc2F 62a_100000210019_100011215700 [0,2,0,0,0,0|0,1,0]=3 8574 B16R2.2923 Nc1cccc(c1)Sc2ccccc2F 62a_100011215700_100000210019 [0,2,0,0,0,0|0,1,0]=3 8575 B16R2.2923 Nc1cccc(c1)Sc2ccccc2N 62a_100000210017_100000210019 [0,2,0,0,0,0|0,1,0]=3 8576 B16R2.2923 Nc1cccc(c1)Sc2ccccc2N 62a_100000210019_100000210017 [0,2,0,0,0,0|0,1,0]=3 8577 B16R2.2923 Nc1cccc(c1)Sc2ccccc2O 62a_100000210019_100000739446 [0,2,0,0,0,0|0,1,0]=3 8578 B16R2.2923 Nc1cccc(c1)Sc2ccccc2O 62a_100000739446_100000210019 [0,2,0,0,0,0|0,1,0]=3 8579 B16R2.2923 Nc1cccc(c1)Sc2cccnc2Br 62a_100000210019_100010202626 [0,2,0,0,0,0|1,1,0]=4 8580 B16R2.2923 Nc1cccc(c1)Sc2cccnc2Br 62a_100010202626_100000210019 [0,2,0,0,0,0|1,1,0]=4 8581 B16R2.2923 Nc1cccc(c1)Sc2cccnc2Cl 62a_100000036424_100000210019 [0,2,0,0,0,0|1,1,0]=4 8582 B16R2.2923 Nc1cccc(c1)Sc2cccnc2Cl 62a_100000210019_100000036424 [0,2,0,0,0,0|1,1,0]=4 8583 B16R2.2923 Nc1cccc(c1)Sc2cccnc2F 62a_100000210019_100009816115 [0,2,0,0,0,0|1,1,0]=4 8584 B16R2.2923 Nc1cccc(c1)Sc2cccnc2F 62a_100009816115_100000210019 [0,2,0,0,0,0|1,1,0]=4 8585 B16R2.2923 Nc1cccc(c1)Sc2cccnc2N 62a_100000045569_100000210019 [0,2,0,0,0,0|1,1,0]=4 8586 B16R2.2923 Nc1cccc(c1)Sc2cccnc2N 62a_100000210019_100000045569 [0,2,0,0,0,0|1,1,0]=4 8587 B16R2.2923 Nc1cccc(c1)Sc2cccnc2O 62a_100000210019_100000760158 [0,2,0,0,0,0|1,1,0]=4 8588 B16R2.2923 Nc1cccc(c1)Sc2cccnc2O 62a_100000760158_100000210019 [0,2,0,0,0,0|1,1,0]=4 8589 B16R2.2923 Nc1cccc(c1)Sc2ccncc2Br 62a_100000210019_100000726257 [0,2,0,0,0,0|1,1,0]=4 8590 B16R2.2923 Nc1cccc(c1)Sc2ccncc2Br 62a_100000726257_100000210019 [0,2,0,0,0,0|1,1,0]=4 8591 B16R2.2923 Nc1cccc(c1)Sc2ccncc2Cl 62a_100000210019_100000708259 [0,2,0,0,0,0|1,1,0]=4 8592 B16R2.2923 Nc1cccc(c1)Sc2ccncc2Cl 62a_100000708259_100000210019 [0,2,0,0,0,0|1,1,0]=4 8593 B16R2.2923 Nc1cccc(c1)Sc2ccncc2F 62a_100000047030_100000210019 [0,2,0,0,0,0|1,1,0]=4 8594 B16R2.2923 Nc1cccc(c1)Sc2ccncc2F 62a_100000210019_100000047030 [0,2,0,0,0,0|1,1,0]=4 8595 B16R2.2923 Nc1cccc(c1)Sc2ccncc2N 62a_100000210019_100000756074 [0,2,0,0,0,0|1,1,0]=4 8596 B16R2.2923 Nc1cccc(c1)Sc2ccncc2N 62a_100000756074_100000210019 [0,2,0,0,0,0|1,1,0]=4 8597 B16R2.2923 Nc1cccc(c1)Sc2ccncc2O 62a_100000210019_100009817591 [0,2,0,0,0,0|1,1,0]=4 8598 B16R2.2923 Nc1cccc(c1)Sc2ccncc2O 62a_100009817591_100000210019 [0,2,0,0,0,0|1,1,0]=4 8599 B16R2.2923 Nc1cccc(c1)Sc2cnccc2Br 62a_100000210019_100010138639 [0,2,0,0,0,0|1,1,0]=4 8600 B16R2.2923 Nc1cccc(c1)Sc2cnccc2Br 62a_100010138639_100000210019 [0,2,0,0,0,0|1,1,0]=4 8601 B16R2.2923 Nc1cccc(c1)Sc2cnccc2Cl 62a_100000210019_100009995489 [0,2,0,0,0,0|1,1,0]=4 8602 B16R2.2923 Nc1cccc(c1)Sc2cnccc2Cl 62a_100009995489_100000210019 [0,2,0,0,0,0|1,1,0]=4 8603 B16R2.2923 Nc1cccc(c1)Sc2cnccc2F 62a_100000210019_100009820683 [0,2,0,0,0,0|1,1,0]=4 8604 B16R2.2923 Nc1cccc(c1)Sc2cnccc2F 62a_100009820683_100000210019 [0,2,0,0,0,0|1,1,0]=4 8605 B16R2.2923 Nc1cccc(c1)Sc2cnccc2N 62a_100000047001_100000210019 [0,2,0,0,0,0|1,1,0]=4 8606 B16R2.2923 Nc1cccc(c1)Sc2cnccc2N 62a_100000210019_100000047001 [0,2,0,0,0,0|1,1,0]=4 8607 B16R2.2923 Nc1cccc(c1)Sc2ncccc2Br 62a_100000210019_100000696092 [0,2,0,0,0,0|1,1,0]=4 8608 B16R2.2923 Nc1cccc(c1)Sc2ncccc2Br 62a_100000696092_100000210019 [0,2,0,0,0,0|1,1,0]=4 8609 B16R2.2923 Nc1cccc(c1)Sc2ncccc2Cl 62a_100000210019_100011356963 [0,2,0,0,0,0|1,1,0]=4 8610 B16R2.2923 Nc1cccc(c1)Sc2ncccc2Cl 62a_100011356963_100000210019 [0,2,0,0,0,0|1,1,0]=4 8611 B16R2.2923 Nc1cccc(c1)Sc2ncccc2F 62a_100000210019_100000685392 [0,2,0,0,0,0|1,1,0]=4 8612 B16R2.2923 Nc1cccc(c1)Sc2ncccc2F 62a_100000685392_100000210019 [0,2,0,0,0,0|1,1,0]=4 8613 B16R2.2923 Nc1cccc(c1)Sc2ncccc2N 62a_100000210019_100000688686 [0,2,0,0,0,0|1,1,0]=4 8614 B16R2.2923 Nc1cccc(c1)Sc2ncccc2N 62a_100000688686_100000210019 [0,2,0,0,0,0|1,1,0]=4 8615 B16R2.2923 Nc1cccc(c1)Sc2ncccc2O 62a_100000034122_100000210019 [0,2,0,0,0,0|1,1,0]=4 8616 B16R2.2923 Nc1cccc(c1)Sc2ncccc2O 62a_100000210019_100000034122 [0,2,0,0,0,0|1,1,0]=4 8617 B16R2.2923 Nc1cccc(n1)Sc2ccccc2Br 62a_100000695589_100000740741 [0,2,0,0,0,0|1,1,0]=4 8618 B16R2.2923 Nc1cccc(n1)Sc2ccccc2Br 62a_100000740741_100000695589 [0,2,0,0,0,0|1,1,0]=4 8619 B16R2.2923 Nc1cccc(n1)Sc2ccccc2Cl 62a_100000740741_100000764095 [0,2,0,0,0,0|1,1,0]=4 8620 B16R2.2923 Nc1cccc(n1)Sc2ccccc2Cl 62a_100000764095_100000740741 [0,2,0,0,0,0|1,1,0]=4 8621 B16R2.2923 Nc1cccc(n1)Sc2ccccc2F 62a_100000740741_100011215700 [0,2,0,0,0,0|1,1,0]=4 8622 B16R2.2923 Nc1cccc(n1)Sc2ccccc2F 62a_100011215700_100000740741 [0,2,0,0,0,0|1,1,0]=4 8623 B16R2.2923 Nc1cccc(n1)Sc2ccccc2N 62a_100000210017_100000740741 [0,2,0,0,0,0|1,1,0]=4 8624 B16R2.2923 Nc1cccc(n1)Sc2ccccc2N 62a_100000740741_100000210017 [0,2,0,0,0,0|1,1,0]=4 8625 B16R2.2923 Nc1cccc(n1)Sc2ccccc2O 62a_100000739446_100000740741 [0,2,0,0,0,0|1,1,0]=4 8626 B16R2.2923 Nc1cccc(n1)Sc2ccccc2O 62a_100000740741_100000739446 [0,2,0,0,0,0|1,1,0]=4 8627 B16R2.2923 Nc1ccccc1Sc2cc(=O)cc[nH]2 62a_100009817434_100000210017 [0,2,0,0,0,0|1,1,0]=4 8628 B16R2.2923 Nc1ccccc1Sc2cc(ccn2)Cl 62a_100000210017_100010167805 [0,2,0,0,0,0|1,1,0]=4 8629 B16R2.2923 Nc1ccccc1Sc2cc(ccn2)Cl 62a_100010167805_100000210017 [0,2,0,0,0,0|1,1,0]=4 8630 B16R2.2923 Nc1ccccc1Sc2cc(ccn2)F 62a_100000210017_100000764206 [0,2,0,0,0,0|1,1,0]=4 8631 B16R2.2923 Nc1ccccc1Sc2cc(ccn2)F 62a_100000764206_100000210017 [0,2,0,0,0,0|1,1,0]=4 8632 B16R2.2923 Nc1ccccc1Sc2cc(ccn2)O 62a_100000210017_100000762945 [0,2,0,0,0,0|1,1,0]=4 8633 B16R2.2923 Nc1ccccc1Sc2cc[nH]c(=O)c2 62a_100000210017_100009816521 [0,2,0,0,0,0|1,1,0]=4 8634 B16R2.2923 Nc1ccccc1Sc2cc[nH]c(=O)c2 62a_100009816521_100000210017 [0,2,0,0,0,0|1,1,0]=4 8635 B16R2.2923 Nc1ccccc1Sc2ccc[n+](c2)[O-] 62a_100000210017_100009815978 [0,2,0,0,0,0|1,1,0]=4 8636 B16R2.2923 Nc1ccccc1Sc2cccc(=O)[nH]2 62a_100000210017_100000752884 [0,2,0,0,0,0|1,1,0]=4 8637 B16R2.2923 Nc1ccccc1Sc2cccc(c2)Br 62a_100000210017_100000691529 [0,2,0,0,0,0|0,1,0]=3 8638 B16R2.2923 Nc1ccccc1Sc2cccc(c2)Br 62a_100000691529_100000210017 [0,2,0,0,0,0|0,1,0]=3 8639 B16R2.2923 Nc1ccccc1Sc2cccc(c2)Cl 62a_100000210017_100000699651 [0,2,0,0,0,0|0,1,0]=3 8640 B16R2.2923 Nc1ccccc1Sc2cccc(c2)Cl 62a_100000699651_100000210017 [0,2,0,0,0,0|0,1,0]=3 8641 B16R2.2923 Nc1ccccc1Sc2cccc(c2)F 62a_100000210017_100000685547 [0,2,0,0,0,0|0,1,0]=3 8642 B16R2.2923 Nc1ccccc1Sc2cccc(c2)F 62a_100000685547_100000210017 [0,2,0,0,0,0|0,1,0]=3 8643 B16R2.2923 Nc1ccccc1Sc2cccc(c2)O 62a_100000210017_100000211634 [0,2,0,0,0,0|0,1,0]=3 8644 B16R2.2923 Nc1ccccc1Sc2cccc(c2)[S] 62a_100000210017_114929384022 [0,2,0,0,0,0|0,1,0]=3 8645 B16R2.2923 Nc1ccccc1Sc2cccc(c2)[S] 62a_114929384022_100000210017 [0,2,0,0,0,0|0,1,0]=3 8646 B16R2.2923 Nc1ccccc1Sc2cccc(n2)Br 62a_100000210017_100000684672 [0,2,0,0,0,0|1,1,0]=4 8647 B16R2.2923 Nc1ccccc1Sc2cccc(n2)Br 62a_100000684672_100000210017 [0,2,0,0,0,0|1,1,0]=4 8648 B16R2.2923 Nc1ccccc1Sc2cccc(n2)Cl 62a_100000051397_100000210017 [0,2,0,0,0,0|1,1,0]=4 8649 B16R2.2923 Nc1ccccc1Sc2cccc(n2)Cl 62a_100000210017_100000051397 [0,2,0,0,0,0|1,1,0]=4 8650 B16R2.2923 Nc1ccccc1Sc2cccc(n2)F 62a_100000210017_100009815982 [0,2,0,0,0,0|1,1,0]=4 8651 B16R2.2923 Nc1ccccc1Sc2cccc(n2)F 62a_100009815982_100000210017 [0,2,0,0,0,0|1,1,0]=4 8652 B16R2.2923 Nc1ccccc1Sc2ccnc(c2)Br 62a_100000210017_100009814637 [0,2,0,0,0,0|1,1,0]=4 8653 B16R2.2923 Nc1ccccc1Sc2ccnc(c2)Br 62a_100009814637_100000210017 [0,2,0,0,0,0|1,1,0]=4 8654 B16R2.2923 Nc1ccccc1Sc2ccnc(c2)Cl 62a_100000035001_100000210017 [0,2,0,0,0,0|1,1,0]=4 8655 B16R2.2923 Nc1ccccc1Sc2ccnc(c2)Cl 62a_100000210017_100000035001 [0,2,0,0,0,0|1,1,0]=4 8656 B16R2.2923 Nc1ccccc1Sc2ccnc(c2)F 62a_100000210017_100009816116 [0,2,0,0,0,0|1,1,0]=4 8657 B16R2.2923 Nc1ccccc1Sc2ccnc(c2)F 62a_100009816116_100000210017 [0,2,0,0,0,0|1,1,0]=4 8658 B16R2.2923 Nc1ccccc1Sc2cncc(c2)Br 62a_100000210017_100000728054 [0,2,0,0,0,0|1,1,0]=4 8659 B16R2.2923 Nc1ccccc1Sc2cncc(c2)Br 62a_100000728054_100000210017 [0,2,0,0,0,0|1,1,0]=4 8660 B16R2.2923 Nc1ccccc1Sc2cncc(c2)Cl 62a_100000049639_100000210017 [0,2,0,0,0,0|1,1,0]=4 8661 B16R2.2923 Nc1ccccc1Sc2cncc(c2)Cl 62a_100000210017_100000049639 [0,2,0,0,0,0|1,1,0]=4 8662 B16R2.2923 Nc1ccccc1Sc2cncc(c2)F 62a_100000210017_100000744099 [0,2,0,0,0,0|1,1,0]=4 8663 B16R2.2923 Nc1ccccc1Sc2cncc(c2)F 62a_100000744099_100000210017 [0,2,0,0,0,0|1,1,0]=4 8664 B16R2.2923 Nc1ccccc1Sc2cncc(c2)O 62a_100000210017_100000754920 [0,2,0,0,0,0|1,1,0]=4 8665 B16R2.2923 Nc1ccccc1Sc2cncc(c2)O 62a_100000754920_100000210017 [0,2,0,0,0,0|1,1,0]=4 8666 B16R2.2923 Nc1cccnc1Sc2cccc(c2)Br 62a_100000688686_100000691529 [0,2,0,0,0,0|1,1,0]=4 8667 B16R2.2923 Nc1cccnc1Sc2cccc(c2)Br 62a_100000691529_100000688686 [0,2,0,0,0,0|1,1,0]=4 8668 B16R2.2923 Nc1cccnc1Sc2cccc(c2)Cl 62a_100000688686_100000699651 [0,2,0,0,0,0|1,1,0]=4 8669 B16R2.2923 Nc1cccnc1Sc2cccc(c2)Cl 62a_100000699651_100000688686 [0,2,0,0,0,0|1,1,0]=4 8670 B16R2.2923 Nc1cccnc1Sc2cccc(c2)F 62a_100000685547_100000688686 [0,2,0,0,0,0|1,1,0]=4 8671 B16R2.2923 Nc1cccnc1Sc2cccc(c2)F 62a_100000688686_100000685547 [0,2,0,0,0,0|1,1,0]=4 8672 B16R2.2923 Nc1cccnc1Sc2cccc(c2)O 62a_100000688686_100000211634 [0,2,0,0,0,0|1,1,0]=4 8673 B16R2.2923 Nc1cccnc1Sc2cccc(c2)[S] 62a_100000688686_114929384022 [0,2,0,0,0,0|1,1,0]=4 8674 B16R2.2923 Nc1cccnc1Sc2cccc(c2)[S] 62a_114929384022_100000688686 [0,2,0,0,0,0|1,1,0]=4 8675 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2Br 62a_100000695589_100009814236 [0,2,0,0,0,0|1,1,0]=4 8676 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2Br 62a_100009814236_100000695589 [0,2,0,0,0,0|1,1,0]=4 8677 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2Cl 62a_100000764095_100009814236 [0,2,0,0,0,0|1,1,0]=4 8678 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2Cl 62a_100009814236_100000764095 [0,2,0,0,0,0|1,1,0]=4 8679 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2F 62a_100009814236_100011215700 [0,2,0,0,0,0|1,1,0]=4 8680 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2F 62a_100011215700_100009814236 [0,2,0,0,0,0|1,1,0]=4 8681 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2N 62a_100000210017_100009814236 [0,2,0,0,0,0|1,1,0]=4 8682 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2N 62a_100009814236_100000210017 [0,2,0,0,0,0|1,1,0]=4 8683 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2O 62a_100000739446_100009814236 [0,2,0,0,0,0|1,1,0]=4 8684 B16R2.2923 Nc1ccnc(c1)Sc2ccccc2O 62a_100009814236_100000739446 [0,2,0,0,0,0|1,1,0]=4 8685 B16R2.2923 Nc1ccncc1Sc2cccc(c2)Br 62a_100000047001_100000691529 [0,2,0,0,0,0|1,1,0]=4 8686 B16R2.2923 Nc1ccncc1Sc2cccc(c2)Br 62a_100000691529_100000047001 [0,2,0,0,0,0|1,1,0]=4 8687 B16R2.2923 Nc1ccncc1Sc2cccc(c2)Cl 62a_100000047001_100000699651 [0,2,0,0,0,0|1,1,0]=4 8688 B16R2.2923 Nc1ccncc1Sc2cccc(c2)Cl 62a_100000699651_100000047001 [0,2,0,0,0,0|1,1,0]=4 8689 B16R2.2923 Nc1ccncc1Sc2cccc(c2)F 62a_100000047001_100000685547 [0,2,0,0,0,0|1,1,0]=4 8690 B16R2.2923 Nc1ccncc1Sc2cccc(c2)F 62a_100000685547_100000047001 [0,2,0,0,0,0|1,1,0]=4 8691 B16R2.2923 Nc1ccncc1Sc2cccc(c2)O 62a_100000047001_100000211634 [0,2,0,0,0,0|1,1,0]=4 8692 B16R2.2923 Nc1ccncc1Sc2cccc(c2)[S] 62a_100000047001_114929384022 [0,2,0,0,0,0|1,1,0]=4 8693 B16R2.2923 Nc1ccncc1Sc2cccc(c2)[S] 62a_114929384022_100000047001 [0,2,0,0,0,0|1,1,0]=4 8694 B16R2.2923 Nc1cncc(c1)Sc2ccccc2Br 62a_100000687067_100000695589 [0,2,0,0,0,0|1,1,0]=4 8695 B16R2.2923 Nc1cncc(c1)Sc2ccccc2Br 62a_100000695589_100000687067 [0,2,0,0,0,0|1,1,0]=4 8696 B16R2.2923 Nc1cncc(c1)Sc2ccccc2Cl 62a_100000687067_100000764095 [0,2,0,0,0,0|1,1,0]=4 8697 B16R2.2923 Nc1cncc(c1)Sc2ccccc2Cl 62a_100000764095_100000687067 [0,2,0,0,0,0|1,1,0]=4 8698 B16R2.2923 Nc1cncc(c1)Sc2ccccc2F 62a_100000687067_100011215700 [0,2,0,0,0,0|1,1,0]=4 8699 B16R2.2923 Nc1cncc(c1)Sc2ccccc2F 62a_100011215700_100000687067 [0,2,0,0,0,0|1,1,0]=4 8700 B16R2.2923 Nc1cncc(c1)Sc2ccccc2N 62a_100000210017_100000687067 [0,2,0,0,0,0|1,1,0]=4 8701 B16R2.2923 Nc1cncc(c1)Sc2ccccc2N 62a_100000687067_100000210017 [0,2,0,0,0,0|1,1,0]=4 8702 B16R2.2923 Nc1cncc(c1)Sc2ccccc2O 62a_100000687067_100000739446 [0,2,0,0,0,0|1,1,0]=4 8703 B16R2.2923 Nc1cncc(c1)Sc2ccccc2O 62a_100000739446_100000687067 [0,2,0,0,0,0|1,1,0]=4 8704 B16R2.2923 Nc1cnccc1Sc2cccc(c2)Br 62a_100000691529_100000756074 [0,2,0,0,0,0|1,1,0]=4 8705 B16R2.2923 Nc1cnccc1Sc2cccc(c2)Br 62a_100000756074_100000691529 [0,2,0,0,0,0|1,1,0]=4 8706 B16R2.2923 Nc1cnccc1Sc2cccc(c2)Cl 62a_100000699651_100000756074 [0,2,0,0,0,0|1,1,0]=4 8707 B16R2.2923 Nc1cnccc1Sc2cccc(c2)Cl 62a_100000756074_100000699651 [0,2,0,0,0,0|1,1,0]=4 8708 B16R2.2923 Nc1cnccc1Sc2cccc(c2)F 62a_100000685547_100000756074 [0,2,0,0,0,0|1,1,0]=4 8709 B16R2.2923 Nc1cnccc1Sc2cccc(c2)F 62a_100000756074_100000685547 [0,2,0,0,0,0|1,1,0]=4 8710 B16R2.2923 Nc1cnccc1Sc2cccc(c2)O 62a_100000756074_100000211634 [0,2,0,0,0,0|1,1,0]=4 8711 B16R2.2923 Nc1cnccc1Sc2cccc(c2)[S] 62a_100000756074_114929384022 [0,2,0,0,0,0|1,1,0]=4 8712 B16R2.2923 Nc1cnccc1Sc2cccc(c2)[S] 62a_114929384022_100000756074 [0,2,0,0,0,0|1,1,0]=4 8713 B16R2.2923 Nc1ncccc1Sc2cccc(c2)Br 62a_100000045569_100000691529 [0,2,0,0,0,0|1,1,0]=4 8714 B16R2.2923 Nc1ncccc1Sc2cccc(c2)Br 62a_100000691529_100000045569 [0,2,0,0,0,0|1,1,0]=4 8715 B16R2.2923 Nc1ncccc1Sc2cccc(c2)Cl 62a_100000045569_100000699651 [0,2,0,0,0,0|1,1,0]=4 8716 B16R2.2923 Nc1ncccc1Sc2cccc(c2)Cl 62a_100000699651_100000045569 [0,2,0,0,0,0|1,1,0]=4 8717 B16R2.2923 Nc1ncccc1Sc2cccc(c2)F 62a_100000045569_100000685547 [0,2,0,0,0,0|1,1,0]=4 8718 B16R2.2923 Nc1ncccc1Sc2cccc(c2)F 62a_100000685547_100000045569 [0,2,0,0,0,0|1,1,0]=4 8719 B16R2.2923 Nc1ncccc1Sc2cccc(c2)O 62a_100000045569_100000211634 [0,2,0,0,0,0|1,1,0]=4 8720 B16R2.2923 Nc1ncccc1Sc2cccc(c2)[S] 62a_100000045569_114929384022 [0,2,0,0,0,0|1,1,0]=4 8721 B16R2.2923 Nc1ncccc1Sc2cccc(c2)[S] 62a_114929384022_100000045569 [0,2,0,0,0,0|1,1,0]=4 8722 B16R2.2923 O=c1cc(cc[nH]1)Nc2ccccc2Cl 27a_100000185783_100000061649 [0,2,0,0,0,0|2,0,0]=4 8723 B16R2.2923 O=c1cc(cc[nH]1)Nc2ccccc2F 27a_100000210422_100000061649 [0,2,0,0,0,0|2,0,0]=4 8724 B16R2.2923 O=c1cc(cc[nH]1)Nc2ccccc2I 27a_100000210053_100000061649 [0,2,0,0,0,0|2,0,0]=4 8725 B16R2.2923 O=c1cc(cc[nH]1)Nc2ccccc2O 27a_100000185747_100000061649 [0,2,0,0,0,0|2,0,0]=4 8726 B16R2.2923 O=c1cc(cc[nH]1)Sc2ccccc2Br 62a_100000695589_100009816521 [0,2,0,0,0,0|1,1,0]=4 8727 B16R2.2923 O=c1cc(cc[nH]1)Sc2ccccc2Br 62a_100009816521_100000695589 [0,2,0,0,0,0|1,1,0]=4 8728 B16R2.2923 O=c1cc(cc[nH]1)Sc2ccccc2Cl 62a_100000764095_100009816521 [0,2,0,0,0,0|1,1,0]=4 8729 B16R2.2923 O=c1cc(cc[nH]1)Sc2ccccc2Cl 62a_100009816521_100000764095 [0,2,0,0,0,0|1,1,0]=4 8730 B16R2.2923 O=c1cc(cc[nH]1)Sc2ccccc2F 62a_100009816521_100011215700 [0,2,0,0,0,0|1,1,0]=4 8731 B16R2.2923 O=c1cc(cc[nH]1)Sc2ccccc2F 62a_100011215700_100009816521 [0,2,0,0,0,0|1,1,0]=4 8732 B16R2.2923 O=c1cc(cc[nH]1)Sc2ccccc2O 62a_100000739446_100009816521 [0,2,0,0,0,0|1,1,0]=4 8733 B16R2.2923 O=c1cc(cc[nH]1)Sc2ccccc2O 62a_100009816521_100000739446 [0,2,0,0,0,0|1,1,0]=4 8734 B16R2.2923 O=c1cc[nH]c(c1)Sc2ccccc2Br 62a_100009817434_100000695589 [0,2,0,0,0,0|1,1,0]=4 8735 B16R2.2923 O=c1cc[nH]c(c1)Sc2ccccc2Cl 62a_100009817434_100000764095 [0,2,0,0,0,0|1,1,0]=4 8736 B16R2.2923 O=c1cc[nH]c(c1)Sc2ccccc2F 62a_100009817434_100011215700 [0,2,0,0,0,0|1,1,0]=4 8737 B16R2.2923 O=c1cc[nH]c(c1)Sc2ccccc2O 62a_100009817434_100000739446 [0,2,0,0,0,0|1,1,0]=4 8738 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)Br 62a_100000691529_100009998708 [0,2,0,0,0,0|1,1,0]=4 8739 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)Br 62a_100009998708_100000691529 [0,2,0,0,0,0|1,1,0]=4 8740 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)Cl 62a_100000699651_100009998708 [0,2,0,0,0,0|1,1,0]=4 8741 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)Cl 62a_100009998708_100000699651 [0,2,0,0,0,0|1,1,0]=4 8742 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)F 62a_100000685547_100009998708 [0,2,0,0,0,0|1,1,0]=4 8743 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)F 62a_100009998708_100000685547 [0,2,0,0,0,0|1,1,0]=4 8744 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)O 62a_100009998708_100000211634 [0,2,0,0,0,0|1,1,0]=4 8745 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)[S] 62a_100009998708_114929384022 [0,2,0,0,0,0|1,1,0]=4 8746 B16R2.2923 O=c1cc[nH]cc1Sc2cccc(c2)[S] 62a_114929384022_100009998708 [0,2,0,0,0,0|1,1,0]=4 8747 B16R2.2923 O=c1cccc([nH]1)Sc2ccccc2Br 62a_100000695589_100000752884 [0,2,0,0,0,0|1,1,0]=4 8748 B16R2.2923 O=c1cccc([nH]1)Sc2ccccc2Cl 62a_100000764095_100000752884 [0,2,0,0,0,0|1,1,0]=4 8749 B16R2.2923 O=c1cccc([nH]1)Sc2ccccc2F 62a_100011215700_100000752884 [0,2,0,0,0,0|1,1,0]=4 8750 B16R2.2923 O=c1cccc([nH]1)Sc2ccccc2O 62a_100000739446_100000752884 [0,2,0,0,0,0|1,1,0]=4 8751 B16R2.2923 Oc1cccc(c1)Nc2ccncc2Br 27a_100000210217_100000726257 [0,2,0,0,0,0|2,0,0]=4 8752 B16R2.2923 Oc1cccc(c1)Nc2ccncc2F 27a_100000210217_100000035921 [0,2,0,0,0,0|2,0,0]=4 8753 B16R2.2923 Oc1cccc(c1)Nc2ncccc2Br 27a_100000210217_100000696092 [0,2,0,0,0,0|2,0,0]=4 8754 B16R2.2923 Oc1cccc(c1)Sc2c[nH]ccc2=S 62a_200012280681_100000211634 [0,2,0,0,0,0|1,1,0]=4 8755 B16R2.2923 Oc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100000211634 [0,2,0,0,0,0|0,1,0]=3 8756 B16R2.2923 Oc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100000211634 [0,2,0,0,0,0|0,1,0]=3 8757 B16R2.2923 Oc1cccc(c1)Sc2ccccc2F 62a_100011215700_100000211634 [0,2,0,0,0,0|0,1,0]=3 8758 B16R2.2923 Oc1cccc(c1)Sc2ccccc2O 62a_100000739446_100000211634 [0,2,0,0,0,0|0,1,0]=3 8759 B16R2.2923 Oc1cccc(c1)Sc2cccnc2Br 62a_100010202626_100000211634 [0,2,0,0,0,0|1,1,0]=4 8760 B16R2.2923 Oc1cccc(c1)Sc2cccnc2Cl 62a_100000036424_100000211634 [0,2,0,0,0,0|1,1,0]=4 8761 B16R2.2923 Oc1cccc(c1)Sc2cccnc2F 62a_100009816115_100000211634 [0,2,0,0,0,0|1,1,0]=4 8762 B16R2.2923 Oc1cccc(c1)Sc2cccnc2O 62a_100000760158_100000211634 [0,2,0,0,0,0|1,1,0]=4 8763 B16R2.2923 Oc1cccc(c1)Sc2ccncc2Br 62a_100000726257_100000211634 [0,2,0,0,0,0|1,1,0]=4 8764 B16R2.2923 Oc1cccc(c1)Sc2ccncc2Cl 62a_100000708259_100000211634 [0,2,0,0,0,0|1,1,0]=4 8765 B16R2.2923 Oc1cccc(c1)Sc2ccncc2F 62a_100000047030_100000211634 [0,2,0,0,0,0|1,1,0]=4 8766 B16R2.2923 Oc1cccc(c1)Sc2ccncc2O 62a_100009817591_100000211634 [0,2,0,0,0,0|1,1,0]=4 8767 B16R2.2923 Oc1cccc(c1)Sc2cnccc2Br 62a_100010138639_100000211634 [0,2,0,0,0,0|1,1,0]=4 8768 B16R2.2923 Oc1cccc(c1)Sc2cnccc2Cl 62a_100009995489_100000211634 [0,2,0,0,0,0|1,1,0]=4 8769 B16R2.2923 Oc1cccc(c1)Sc2cnccc2F 62a_100009820683_100000211634 [0,2,0,0,0,0|1,1,0]=4 8770 B16R2.2923 Oc1cccc(c1)Sc2ncccc2Br 62a_100000696092_100000211634 [0,2,0,0,0,0|1,1,0]=4 8771 B16R2.2923 Oc1cccc(c1)Sc2ncccc2Cl 62a_100011356963_100000211634 [0,2,0,0,0,0|1,1,0]=4 8772 B16R2.2923 Oc1cccc(c1)Sc2ncccc2F 62a_100000685392_100000211634 [0,2,0,0,0,0|1,1,0]=4 8773 B16R2.2923 Oc1cccc(c1)Sc2ncccc2O 62a_100000034122_100000211634 [0,2,0,0,0,0|1,1,0]=4 8774 B16R2.2923 Oc1ccccc1Nc2cc(ccn2)F 27a_100000185747_100000764206 [0,2,0,0,0,0|2,0,0]=4 8775 B16R2.2923 Oc1ccccc1Nc2cccc(n2)F 27a_100000185747_100009815982 [0,2,0,0,0,0|2,0,0]=4 8776 B16R2.2923 Oc1ccccc1Nc2ccnc(c2)F 27a_100000185747_100009816116 [0,2,0,0,0,0|2,0,0]=4 8777 B16R2.2923 Oc1ccccc1Sc2cc(ccn2)Cl 62a_100000739446_100010167805 [0,2,0,0,0,0|1,1,0]=4 8778 B16R2.2923 Oc1ccccc1Sc2cc(ccn2)Cl 62a_100010167805_100000739446 [0,2,0,0,0,0|1,1,0]=4 8779 B16R2.2923 Oc1ccccc1Sc2cc(ccn2)F 62a_100000739446_100000764206 [0,2,0,0,0,0|1,1,0]=4 8780 B16R2.2923 Oc1ccccc1Sc2cc(ccn2)F 62a_100000764206_100000739446 [0,2,0,0,0,0|1,1,0]=4 8781 B16R2.2923 Oc1ccccc1Sc2cccc(c2)Br 62a_100000691529_100000739446 [0,2,0,0,0,0|0,1,0]=3 8782 B16R2.2923 Oc1ccccc1Sc2cccc(c2)Br 62a_100000739446_100000691529 [0,2,0,0,0,0|0,1,0]=3 8783 B16R2.2923 Oc1ccccc1Sc2cccc(c2)Cl 62a_100000699651_100000739446 [0,2,0,0,0,0|0,1,0]=3 8784 B16R2.2923 Oc1ccccc1Sc2cccc(c2)Cl 62a_100000739446_100000699651 [0,2,0,0,0,0|0,1,0]=3 8785 B16R2.2923 Oc1ccccc1Sc2cccc(c2)F 62a_100000685547_100000739446 [0,2,0,0,0,0|0,1,0]=3 8786 B16R2.2923 Oc1ccccc1Sc2cccc(c2)F 62a_100000739446_100000685547 [0,2,0,0,0,0|0,1,0]=3 8787 B16R2.2923 Oc1ccccc1Sc2cccc(c2)[S] 62a_100000739446_114929384022 [0,2,0,0,0,0|0,1,0]=3 8788 B16R2.2923 Oc1ccccc1Sc2cccc(c2)[S] 62a_114929384022_100000739446 [0,2,0,0,0,0|0,1,0]=3 8789 B16R2.2923 Oc1ccccc1Sc2cccc(n2)Br 62a_100000684672_100000739446 [0,2,0,0,0,0|1,1,0]=4 8790 B16R2.2923 Oc1ccccc1Sc2cccc(n2)Br 62a_100000739446_100000684672 [0,2,0,0,0,0|1,1,0]=4 8791 B16R2.2923 Oc1ccccc1Sc2cccc(n2)Cl 62a_100000051397_100000739446 [0,2,0,0,0,0|1,1,0]=4 8792 B16R2.2923 Oc1ccccc1Sc2cccc(n2)Cl 62a_100000739446_100000051397 [0,2,0,0,0,0|1,1,0]=4 8793 B16R2.2923 Oc1ccccc1Sc2cccc(n2)F 62a_100000739446_100009815982 [0,2,0,0,0,0|1,1,0]=4 8794 B16R2.2923 Oc1ccccc1Sc2cccc(n2)F 62a_100009815982_100000739446 [0,2,0,0,0,0|1,1,0]=4 8795 B16R2.2923 Oc1ccccc1Sc2ccnc(c2)Br 62a_100000739446_100009814637 [0,2,0,0,0,0|1,1,0]=4 8796 B16R2.2923 Oc1ccccc1Sc2ccnc(c2)Br 62a_100009814637_100000739446 [0,2,0,0,0,0|1,1,0]=4 8797 B16R2.2923 Oc1ccccc1Sc2ccnc(c2)Cl 62a_100000035001_100000739446 [0,2,0,0,0,0|1,1,0]=4 8798 B16R2.2923 Oc1ccccc1Sc2ccnc(c2)Cl 62a_100000739446_100000035001 [0,2,0,0,0,0|1,1,0]=4 8799 B16R2.2923 Oc1ccccc1Sc2ccnc(c2)F 62a_100000739446_100009816116 [0,2,0,0,0,0|1,1,0]=4 8800 B16R2.2923 Oc1ccccc1Sc2ccnc(c2)F 62a_100009816116_100000739446 [0,2,0,0,0,0|1,1,0]=4 8801 B16R2.2923 Oc1ccccc1Sc2cncc(c2)Br 62a_100000728054_100000739446 [0,2,0,0,0,0|1,1,0]=4 8802 B16R2.2923 Oc1ccccc1Sc2cncc(c2)Br 62a_100000739446_100000728054 [0,2,0,0,0,0|1,1,0]=4 8803 B16R2.2923 Oc1ccccc1Sc2cncc(c2)Cl 62a_100000049639_100000739446 [0,2,0,0,0,0|1,1,0]=4 8804 B16R2.2923 Oc1ccccc1Sc2cncc(c2)Cl 62a_100000739446_100000049639 [0,2,0,0,0,0|1,1,0]=4 8805 B16R2.2923 Oc1ccccc1Sc2cncc(c2)F 62a_100000739446_100000744099 [0,2,0,0,0,0|1,1,0]=4 8806 B16R2.2923 Oc1ccccc1Sc2cncc(c2)F 62a_100000744099_100000739446 [0,2,0,0,0,0|1,1,0]=4 8807 B16R2.2923 Oc1cccnc1Sc2cccc(c2)Br 62a_100000034122_100000691529 [0,2,0,0,0,0|1,1,0]=4 8808 B16R2.2923 Oc1cccnc1Sc2cccc(c2)Br 62a_100000691529_100000034122 [0,2,0,0,0,0|1,1,0]=4 8809 B16R2.2923 Oc1cccnc1Sc2cccc(c2)Cl 62a_100000034122_100000699651 [0,2,0,0,0,0|1,1,0]=4 8810 B16R2.2923 Oc1cccnc1Sc2cccc(c2)Cl 62a_100000699651_100000034122 [0,2,0,0,0,0|1,1,0]=4 8811 B16R2.2923 Oc1cccnc1Sc2cccc(c2)F 62a_100000034122_100000685547 [0,2,0,0,0,0|1,1,0]=4 8812 B16R2.2923 Oc1cccnc1Sc2cccc(c2)F 62a_100000685547_100000034122 [0,2,0,0,0,0|1,1,0]=4 8813 B16R2.2923 Oc1cccnc1Sc2cccc(c2)[S] 62a_100000034122_114929384022 [0,2,0,0,0,0|1,1,0]=4 8814 B16R2.2923 Oc1cccnc1Sc2cccc(c2)[S] 62a_114929384022_100000034122 [0,2,0,0,0,0|1,1,0]=4 8815 B16R2.2923 Oc1ccnc(c1)Sc2ccccc2Br 62a_100000695589_100000762945 [0,2,0,0,0,0|1,1,0]=4 8816 B16R2.2923 Oc1ccnc(c1)Sc2ccccc2Cl 62a_100000764095_100000762945 [0,2,0,0,0,0|1,1,0]=4 8817 B16R2.2923 Oc1ccnc(c1)Sc2ccccc2F 62a_100011215700_100000762945 [0,2,0,0,0,0|1,1,0]=4 8818 B16R2.2923 Oc1ccnc(c1)Sc2ccccc2O 62a_100000739446_100000762945 [0,2,0,0,0,0|1,1,0]=4 8819 B16R2.2923 Oc1cncc(c1)Sc2ccccc2Br 62a_100000695589_100000754920 [0,2,0,0,0,0|1,1,0]=4 8820 B16R2.2923 Oc1cncc(c1)Sc2ccccc2Br 62a_100000754920_100000695589 [0,2,0,0,0,0|1,1,0]=4 8821 B16R2.2923 Oc1cncc(c1)Sc2ccccc2Cl 62a_100000754920_100000764095 [0,2,0,0,0,0|1,1,0]=4 8822 B16R2.2923 Oc1cncc(c1)Sc2ccccc2Cl 62a_100000764095_100000754920 [0,2,0,0,0,0|1,1,0]=4 8823 B16R2.2923 Oc1cncc(c1)Sc2ccccc2F 62a_100000754920_100011215700 [0,2,0,0,0,0|1,1,0]=4 8824 B16R2.2923 Oc1cncc(c1)Sc2ccccc2F 62a_100011215700_100000754920 [0,2,0,0,0,0|1,1,0]=4 8825 B16R2.2923 Oc1cncc(c1)Sc2ccccc2O 62a_100000739446_100000754920 [0,2,0,0,0,0|1,1,0]=4 8826 B16R2.2923 Oc1cncc(c1)Sc2ccccc2O 62a_100000754920_100000739446 [0,2,0,0,0,0|1,1,0]=4 8827 B16R2.2923 Oc1cnccc1Sc2cccc(c2)Br 62a_100000691529_100009817591 [0,2,0,0,0,0|1,1,0]=4 8828 B16R2.2923 Oc1cnccc1Sc2cccc(c2)Br 62a_100009817591_100000691529 [0,2,0,0,0,0|1,1,0]=4 8829 B16R2.2923 Oc1cnccc1Sc2cccc(c2)Cl 62a_100000699651_100009817591 [0,2,0,0,0,0|1,1,0]=4 8830 B16R2.2923 Oc1cnccc1Sc2cccc(c2)Cl 62a_100009817591_100000699651 [0,2,0,0,0,0|1,1,0]=4 8831 B16R2.2923 Oc1cnccc1Sc2cccc(c2)F 62a_100000685547_100009817591 [0,2,0,0,0,0|1,1,0]=4 8832 B16R2.2923 Oc1cnccc1Sc2cccc(c2)F 62a_100009817591_100000685547 [0,2,0,0,0,0|1,1,0]=4 8833 B16R2.2923 Oc1cnccc1Sc2cccc(c2)[S] 62a_100009817591_114929384022 [0,2,0,0,0,0|1,1,0]=4 8834 B16R2.2923 Oc1cnccc1Sc2cccc(c2)[S] 62a_114929384022_100009817591 [0,2,0,0,0,0|1,1,0]=4 8835 B16R2.2923 Oc1ncccc1Sc2cccc(c2)Br 62a_100000691529_100000760158 [0,2,0,0,0,0|1,1,0]=4 8836 B16R2.2923 Oc1ncccc1Sc2cccc(c2)Br 62a_100000760158_100000691529 [0,2,0,0,0,0|1,1,0]=4 8837 B16R2.2923 Oc1ncccc1Sc2cccc(c2)Cl 62a_100000699651_100000760158 [0,2,0,0,0,0|1,1,0]=4 8838 B16R2.2923 Oc1ncccc1Sc2cccc(c2)Cl 62a_100000760158_100000699651 [0,2,0,0,0,0|1,1,0]=4 8839 B16R2.2923 Oc1ncccc1Sc2cccc(c2)F 62a_100000685547_100000760158 [0,2,0,0,0,0|1,1,0]=4 8840 B16R2.2923 Oc1ncccc1Sc2cccc(c2)F 62a_100000760158_100000685547 [0,2,0,0,0,0|1,1,0]=4 8841 B16R2.2923 Oc1ncccc1Sc2cccc(c2)[S] 62a_100000760158_114929384022 [0,2,0,0,0,0|1,1,0]=4 8842 B16R2.2923 Oc1ncccc1Sc2cccc(c2)[S] 62a_114929384022_100000760158 [0,2,0,0,0,0|1,1,0]=4 8843 B16R2.2923 S=c1cc[nH]cc1Sc2cccc(c2)Br 62a_100000691529_200012280681 [0,2,0,0,0,0|1,1,0]=4 8844 B16R2.2923 S=c1cc[nH]cc1Sc2cccc(c2)Br 62a_200012280681_100000691529 [0,2,0,0,0,0|1,1,0]=4 8845 B16R2.2923 S=c1cc[nH]cc1Sc2cccc(c2)Cl 62a_100000699651_200012280681 [0,2,0,0,0,0|1,1,0]=4 8846 B16R2.2923 S=c1cc[nH]cc1Sc2cccc(c2)Cl 62a_200012280681_100000699651 [0,2,0,0,0,0|1,1,0]=4 8847 B16R2.2923 [O-][n+]1cccc(c1)Sc2ccccc2Br 62a_100000695589_100009815978 [0,2,0,0,0,0|1,1,0]=4 8848 B16R2.2923 [O-][n+]1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100009815978 [0,2,0,0,0,0|1,1,0]=4 8849 B16R2.2923 [O-][n+]1cccc(c1)Sc2ccccc2F 62a_100011215700_100009815978 [0,2,0,0,0,0|1,1,0]=4 8850 B16R2.2923 [O-][n+]1cccc(c1)Sc2ccccc2O 62a_100000739446_100009815978 [0,2,0,0,0,0|1,1,0]=4 8851 B16R2.2923 [O-][n+]1ccccc1Sc2cccc(c2)Br 62a_100000691529_200000042595 [0,2,0,0,0,0|1,1,0]=4 8852 B16R2.2923 [O-][n+]1ccccc1Sc2cccc(c2)Cl 62a_100000699651_200000042595 [0,2,0,0,0,0|1,1,0]=4 8853 B16R2.2923 [O-][n+]1ccccc1Sc2cccc(c2)F 62a_100000685547_200000042595 [0,2,0,0,0,0|1,1,0]=4 8854 B16R2.2923 [O-][n+]1ccccc1Sc2cccc(c2)[S] 62a_114929384022_200000042595 [0,2,0,0,0,0|1,1,0]=4 8855 B16R2.2923 [S]c1cccc(c1)Sc2c[nH]ccc2=S 62a_114929384022_200012280681 [0,2,0,0,0,0|1,1,0]=4 8856 B16R2.2923 [S]c1cccc(c1)Sc2c[nH]ccc2=S 62a_200012280681_114929384022 [0,2,0,0,0,0|1,1,0]=4 8857 B16R2.2923 [S]c1cccc(c1)Sc2ccccc2Br 62a_100000695589_114929384022 [0,2,0,0,0,0|0,1,0]=3 8858 B16R2.2923 [S]c1cccc(c1)Sc2ccccc2Br 62a_114929384022_100000695589 [0,2,0,0,0,0|0,1,0]=3 8859 B16R2.2923 [S]c1cccc(c1)Sc2ccccc2Cl 62a_100000764095_114929384022 [0,2,0,0,0,0|0,1,0]=3 8860 B16R2.2923 [S]c1cccc(c1)Sc2ccccc2Cl 62a_114929384022_100000764095 [0,2,0,0,0,0|0,1,0]=3 8861 B16R2.2923 [S]c1cccc(c1)Sc2cccnc2Br 62a_100010202626_114929384022 [0,2,0,0,0,0|1,1,0]=4 8862 B16R2.2923 [S]c1cccc(c1)Sc2cccnc2Br 62a_114929384022_100010202626 [0,2,0,0,0,0|1,1,0]=4 8863 B16R2.2923 [S]c1cccc(c1)Sc2cccnc2Cl 62a_100000036424_114929384022 [0,2,0,0,0,0|1,1,0]=4 8864 B16R2.2923 [S]c1cccc(c1)Sc2cccnc2Cl 62a_114929384022_100000036424 [0,2,0,0,0,0|1,1,0]=4 8865 B16R2.2923 [S]c1cccc(c1)Sc2ccncc2Br 62a_100000726257_114929384022 [0,2,0,0,0,0|1,1,0]=4 8866 B16R2.2923 [S]c1cccc(c1)Sc2ccncc2Br 62a_114929384022_100000726257 [0,2,0,0,0,0|1,1,0]=4 8867 B16R2.2923 [S]c1cccc(c1)Sc2ccncc2Cl 62a_100000708259_114929384022 [0,2,0,0,0,0|1,1,0]=4 8868 B16R2.2923 [S]c1cccc(c1)Sc2ccncc2Cl 62a_114929384022_100000708259 [0,2,0,0,0,0|1,1,0]=4 8869 B16R2.2923 [S]c1cccc(c1)Sc2cnccc2Br 62a_100010138639_114929384022 [0,2,0,0,0,0|1,1,0]=4 8870 B16R2.2923 [S]c1cccc(c1)Sc2cnccc2Br 62a_114929384022_100010138639 [0,2,0,0,0,0|1,1,0]=4 8871 B16R2.2923 [S]c1cccc(c1)Sc2cnccc2Cl 62a_100009995489_114929384022 [0,2,0,0,0,0|1,1,0]=4 8872 B16R2.2923 [S]c1cccc(c1)Sc2cnccc2Cl 62a_114929384022_100009995489 [0,2,0,0,0,0|1,1,0]=4 8873 B16R2.2923 [S]c1cccc(c1)Sc2ncccc2Br 62a_100000696092_114929384022 [0,2,0,0,0,0|1,1,0]=4 8874 B16R2.2923 [S]c1cccc(c1)Sc2ncccc2Br 62a_114929384022_100000696092 [0,2,0,0,0,0|1,1,0]=4 8875 B16R2.2923 [S]c1cccc(c1)Sc2ncccc2Cl 62a_100011356963_114929384022 [0,2,0,0,0,0|1,1,0]=4 8876 B16R2.2923 [S]c1cccc(c1)Sc2ncccc2Cl 62a_114929384022_100011356963 [0,2,0,0,0,0|1,1,0]=4 8877 B16R2.172 C=Cc1ccccc1Cc2ccccc2 271570a_100011290941_200011216382 [0,2,0,0,0,0|1,0,0]=3 8878 B16R2.172 C=Cc1ccccc1Oc2ccccc2 271570a_100011290941_100000049502 [0,2,0,0,0,0|0,0,0]=2 8879 B16R2.172 C=Cc1ccccc1Sc2ccccc2 62a_100000719477_100011218376 [0,2,0,0,0,0|0,1,0]=3 8880 B16R2.172 C=Cc1ccccc1Sc2ccccc2 62a_100011218376_100000041952 [0,2,0,0,0,0|0,1,0]=3 8881 B16R2.172 C=Cc1ccccc1Sc2ccccn2 62a_100011216584_100011218376 [0,2,0,0,0,0|1,1,0]=4 8882 B16R2.172 C=Cc1ccccc1Sc2ccccn2 62a_100011218376_100011216584 [0,2,0,0,0,0|1,1,0]=4 8883 B16R2.172 C=Cc1ccccc1Sc2cccnc2 62a_100000210063_100011218376 [0,2,0,0,0,0|1,1,0]=4 8884 B16R2.172 C=Cc1ccccc1Sc2cccnc2 62a_100011218376_100000210063 [0,2,0,0,0,0|1,1,0]=4 8885 B16R2.172 C=Cc1ccccc1Sc2ccncc2 62a_100000728582_100011218376 [0,2,0,0,0,0|1,1,0]=4 8886 B16R2.172 C=Cc1ccccc1Sc2ccncc2 62a_100011218376_100000728582 [0,2,0,0,0,0|1,1,0]=4 8887 B16R2.172 CCc1ccccc1Sc2ccccc2 62a_100000719477_100011215823 [0,2,0,0,0,0|0,1,0]=3 8888 B16R2.172 CCc1ccccc1Sc2ccccc2 62a_100011215823_100000041952 [0,2,0,0,0,0|0,1,0]=3 8889 B16R2.172 CCc1ccccc1Sc2ccccn2 62a_100011215823_100011216584 [0,2,0,0,0,0|1,1,0]=4 8890 B16R2.172 CCc1ccccc1Sc2ccccn2 62a_100011216584_100011215823 [0,2,0,0,0,0|1,1,0]=4 8891 B16R2.172 CCc1ccccc1Sc2cccnc2 62a_100000210063_100011215823 [0,2,0,0,0,0|1,1,0]=4 8892 B16R2.172 CCc1ccccc1Sc2cccnc2 62a_100011215823_100000210063 [0,2,0,0,0,0|1,1,0]=4 8893 B16R2.172 CCc1ccccc1Sc2ccncc2 62a_100000728582_100011215823 [0,2,0,0,0,0|1,1,0]=4 8894 B16R2.172 CCc1ccccc1Sc2ccncc2 62a_100011215823_100000728582 [0,2,0,0,0,0|1,1,0]=4 8895 B16R2.172 CCc1ccncc1Sc2ccccc2 62a_100000719477_100009819861 [0,2,0,0,0,0|1,1,0]=4 8896 B16R2.172 CCc1ccncc1Sc2ccccc2 62a_100009819861_100000041952 [0,2,0,0,0,0|1,1,0]=4 8897 B16R2.172 CCc1cnccc1Sc2ccccc2 62a_100000719477_100025704421 [0,2,0,0,0,0|1,1,0]=4 8898 B16R2.172 CCc1cnccc1Sc2ccccc2 62a_100025704421_100000041952 [0,2,0,0,0,0|1,1,0]=4 8899 B16R2.172 CCc1ncccc1Sc2ccccc2 62a_100000719477_100009877225 [0,2,0,0,0,0|1,1,0]=4 8900 B16R2.172 CCc1ncccc1Sc2ccccc2 62a_100009877225_100000041952 [0,2,0,0,0,0|1,1,0]=4 8901 B16R2.172 CNc1ccccc1Cc2ccccc2 2230a_100000211252_200000210301 [0,2,0,0,0,0|1,0,0]=3 8902 B16R2.172 CNc1ccccc1Cc2ccccc2 34a_100000211252_200000210301 [0,2,0,0,0,0|1,0,0]=3 8903 B16R2.172 CNc1ccccc1Cc2ccccc2 7a_100000211252_200000210301 [0,2,0,0,0,0|1,0,0]=3 8904 B16R2.172 CNc1ccccc1Oc2ccccc2 2230a_100000182328_200000210301 [0,2,0,0,0,0|0,0,0]=2 8905 B16R2.172 CNc1ccccc1Oc2ccccc2 34a_100000182328_200000210301 [0,2,0,0,0,0|0,0,0]=2 8906 B16R2.172 CNc1ccccc1Sc2ccccc2 2230a_100000210917_200000210301 [0,2,0,0,0,0|0,1,0]=3 8907 B16R2.172 CNc1ccccc1Sc2ccccc2 62a_100000719477_100020606079 [0,2,0,0,0,0|0,1,0]=3 8908 B16R2.172 CNc1ccccc1Sc2ccccc2 62a_100020606079_100000041952 [0,2,0,0,0,0|0,1,0]=3 8909 B16R2.172 CNc1ccccc1Sc2ccccn2 62a_100011216584_100020606079 [0,2,0,0,0,0|1,1,0]=4 8910 B16R2.172 CNc1ccccc1Sc2ccccn2 62a_100020606079_100011216584 [0,2,0,0,0,0|1,1,0]=4 8911 B16R2.172 CNc1ccccc1Sc2cccnc2 62a_100000210063_100020606079 [0,2,0,0,0,0|1,1,0]=4 8912 B16R2.172 CNc1ccccc1Sc2cccnc2 62a_100020606079_100000210063 [0,2,0,0,0,0|1,1,0]=4 8913 B16R2.172 CNc1ccccc1Sc2ccncc2 62a_100000728582_100020606079 [0,2,0,0,0,0|1,1,0]=4 8914 B16R2.172 CNc1ccccc1Sc2ccncc2 62a_100020606079_100000728582 [0,2,0,0,0,0|1,1,0]=4 8915 B16R2.172 CNc1cccnc1Sc2ccccc2 62a_100000719477_200011806188 [0,2,0,0,0,0|1,1,0]=4 8916 B16R2.172 CNc1ccncc1Sc2ccccc2 62a_100000719477_100010069531 [0,2,0,0,0,0|1,1,0]=4 8917 B16R2.172 CNc1ccncc1Sc2ccccc2 62a_100010069531_100000041952 [0,2,0,0,0,0|1,1,0]=4 8918 B16R2.172 CNc1ncccc1Sc2ccccc2 62a_100000700899_100000041952 [0,2,0,0,0,0|1,1,0]=4 8919 B16R2.172 CNc1ncccc1Sc2ccccc2 62a_100000719477_100000700899 [0,2,0,0,0,0|1,1,0]=4 8920 B16R2.172 COc1ccccc1Cc2ccccc2 34a_100000211249_200000210301 [0,2,0,0,0,0|1,0,0]=3 8921 B16R2.172 COc1ccccc1Cc2ccccc2 7a_100000211249_200000210301 [0,2,0,0,0,0|1,0,0]=3 8922 B16R2.172 COc1ccccc1Oc2ccccc2 34a_100000074787_200000210301 [0,2,0,0,0,0|0,0,0]=2 8923 B16R2.172 COc1ccccc1Oc2ccccc2 7a_100000074787_200000210301 [0,2,0,0,0,0|0,0,0]=2 8924 B16R2.172 COc1ccccc1Oc2ccccn2 34a_100000748224_200000210301 [0,2,0,0,0,0|1,0,0]=3 8925 B16R2.172 COc1ccccc1Sc2ccccc2 62a_100000210334_100000041952 [0,2,0,0,0,0|0,1,0]=3 8926 B16R2.172 COc1ccccc1Sc2ccccc2 62a_100000719477_100000210334 [0,2,0,0,0,0|0,1,0]=3 8927 B16R2.172 COc1ccccc1Sc2ccccn2 62a_100000210334_100011216584 [0,2,0,0,0,0|1,1,0]=4 8928 B16R2.172 COc1ccccc1Sc2ccccn2 62a_100011216584_100000210334 [0,2,0,0,0,0|1,1,0]=4 8929 B16R2.172 COc1ccccc1Sc2cccnc2 62a_100000210063_100000210334 [0,2,0,0,0,0|1,1,0]=4 8930 B16R2.172 COc1ccccc1Sc2cccnc2 62a_100000210334_100000210063 [0,2,0,0,0,0|1,1,0]=4 8931 B16R2.172 COc1ccccc1Sc2ccncc2 62a_100000210334_100000728582 [0,2,0,0,0,0|1,1,0]=4 8932 B16R2.172 COc1ccccc1Sc2ccncc2 62a_100000728582_100000210334 [0,2,0,0,0,0|1,1,0]=4 8933 B16R2.172 COc1cccnc1Sc2ccccc2 62a_100000719477_100000690851 [0,2,0,0,0,0|1,1,0]=4 8934 B16R2.172 COc1cccnc1Sc2ccccc2 62a_100000767102_100000041952 [0,2,0,0,0,0|1,1,0]=4 8935 B16R2.172 COc1ccncc1Sc2ccccc2 62a_100000719477_100011997281 [0,2,0,0,0,0|1,1,0]=4 8936 B16R2.172 COc1ccncc1Sc2ccccc2 62a_100011997281_100000041952 [0,2,0,0,0,0|1,1,0]=4 8937 B16R2.172 COc1cnccc1Sc2ccccc2 62a_100000719477_100016988167 [0,2,0,0,0,0|1,1,0]=4 8938 B16R2.172 COc1cnccc1Sc2ccccc2 62a_100016988167_100000041952 [0,2,0,0,0,0|1,1,0]=4 8939 B16R2.172 COc1ncccc1Sc2ccccc2 62a_100000047025_100000041952 [0,2,0,0,0,0|1,1,0]=4 8940 B16R2.172 COc1ncccc1Sc2ccccc2 62a_100000719477_100000047025 [0,2,0,0,0,0|1,1,0]=4 8941 B16R2.172 CSc1ccccc1Cc2ccccc2 62a_200000210301_200011216382 [0,2,0,0,0,0|1,0,0]=3 8942 B16R2.172 CSc1ccccc1Cc2ccccc2 62a_200011216382_200000210301 [0,2,0,0,0,0|1,0,0]=3 8943 B16R2.172 CSc1ccccc1Nc2ccccc2 62a_200000210301_100009815782 [0,2,0,0,0,0|1,0,0]=3 8944 B16R2.172 CSc1ccccc1Oc2ccccc2 62a_200000210301_100000049502 [0,2,0,0,0,0|0,0,0]=2 8945 B16R2.172 CSc1ccccc1Sc2ccccc2 62a_100000719477_100011217816 [0,2,0,0,0,0|0,1,0]=3 8946 B16R2.172 CSc1ccccc1Sc2ccccc2 62a_100011217816_100000041952 [0,2,0,0,0,0|0,1,0]=3 8947 B16R2.172 CSc1ccccc1Sc2ccccn2 62a_100011216584_100011217816 [0,2,0,0,0,0|1,1,0]=4 8948 B16R2.172 CSc1ccccc1Sc2ccccn2 62a_100011217816_100011216584 [0,2,0,0,0,0|1,1,0]=4 8949 B16R2.172 CSc1ccccc1Sc2cccnc2 62a_100000210063_100011217816 [0,2,0,0,0,0|1,1,0]=4 8950 B16R2.172 CSc1ccccc1Sc2cccnc2 62a_100011217816_100000210063 [0,2,0,0,0,0|1,1,0]=4 8951 B16R2.172 CSc1ccccc1Sc2ccncc2 62a_100000728582_100011217816 [0,2,0,0,0,0|1,1,0]=4 8952 B16R2.172 CSc1ccccc1Sc2ccncc2 62a_100011217816_100000728582 [0,2,0,0,0,0|1,1,0]=4 8953 B16R2.172 CSc1ncccc1Sc2ccccc2 62a_100000719477_100011465278 [0,2,0,0,0,0|1,1,0]=4 8954 B16R2.172 CSc1ncccc1Sc2ccccc2 62a_100011465278_100000041952 [0,2,0,0,0,0|1,1,0]=4 8955 B16R2.172 N#Cc1ccccc1Sc2ccccc2 62a_100000719477_100000188569 [0,2,0,0,0,0|0,1,0]=3 8956 B16R2.172 N#Cc1ccccc1Sc2ccccn2 62a_100011216584_100000188569 [0,2,0,0,0,0|1,1,0]=4 8957 B16R2.172 N#Cc1ccccc1Sc2cccnc2 62a_100000210063_100000188569 [0,2,0,0,0,0|1,1,0]=4 8958 B16R2.172 N#Cc1ccccc1Sc2ccncc2 62a_100000728582_100000188569 [0,2,0,0,0,0|1,1,0]=4 8959 B16R2.172 N#Cc1cccnc1Nc2ccccc2 27a_100000106764_100000211984 [0,2,0,0,0,0|2,0,0]=4 8960 B16R2.172 N#Cc1cccnc1Sc2ccccc2 62a_100000719477_100000211984 [0,2,0,0,0,0|1,1,0]=4 8961 B16R2.172 N#Cc1ccncc1Nc2ccccc2 27a_100000106764_100000684818 [0,2,0,0,0,0|2,0,0]=4 8962 B16R2.172 N#Cc1ccncc1Sc2ccccc2 62a_100000719477_100000684818 [0,2,0,0,0,0|1,1,0]=4 8963 B16R2.172 N#Cc1cnccc1Nc2ccccc2 27a_100000106764_100000687039 [0,2,0,0,0,0|2,0,0]=4 8964 B16R2.172 N#Cc1cnccc1Sc2ccccc2 62a_100000719477_100000687039 [0,2,0,0,0,0|1,1,0]=4 8965 B16R2.172 N#Cc1ncccc1Sc2ccccc2 62a_100000719477_100000685805 [0,2,0,0,0,0|1,1,0]=4 8966 B16R2.172 NCc1ccccc1Sc2ccccc2 62a_100000689332_100000041952 [0,2,0,0,0,0|0,1,0]=3 8967 B16R2.172 NCc1ccccc1Sc2ccccc2 62a_100000719477_100000689332 [0,2,0,0,0,0|0,1,0]=3 8968 B16R2.172 NCc1ccccc1Sc2ccccn2 62a_100000689332_100011216584 [0,2,0,0,0,0|1,1,0]=4 8969 B16R2.172 NCc1ccccc1Sc2ccccn2 62a_100011216584_100000689332 [0,2,0,0,0,0|1,1,0]=4 8970 B16R2.172 NCc1ccccc1Sc2cccnc2 62a_100000210063_100000689332 [0,2,0,0,0,0|1,1,0]=4 8971 B16R2.172 NCc1ccccc1Sc2cccnc2 62a_100000689332_100000210063 [0,2,0,0,0,0|1,1,0]=4 8972 B16R2.172 NCc1ccccc1Sc2ccncc2 62a_100000689332_100000728582 [0,2,0,0,0,0|1,1,0]=4 8973 B16R2.172 NCc1ccccc1Sc2ccncc2 62a_100000728582_100000689332 [0,2,0,0,0,0|1,1,0]=4 8974 B16R2.172 NCc1cccnc1Sc2ccccc2 62a_100000719477_100015189234 [0,2,0,0,0,0|1,1,0]=4 8975 B16R2.172 NCc1cccnc1Sc2ccccc2 62a_100015189234_100000041952 [0,2,0,0,0,0|1,1,0]=4 8976 B16R2.172 NCc1ccncc1Sc2ccccc2 62a_100000719477_100020640021 [0,2,0,0,0,0|1,1,0]=4 8977 B16R2.172 NCc1ccncc1Sc2ccccc2 62a_100020640021_100000041952 [0,2,0,0,0,0|1,1,0]=4 8978 B16R2.172 NCc1ncccc1Sc2ccccc2 62a_100000719477_100020591323 [0,2,0,0,0,0|1,1,0]=4 8979 B16R2.172 NCc1ncccc1Sc2ccccc2 62a_100020591323_100000041952 [0,2,0,0,0,0|1,1,0]=4 8980 B16R2.172 NNc1ccccc1Sc2ccccc2 62a_100000241748_100000041952 [0,2,0,0,0,0|0,1,0]=3 8981 B16R2.172 NNc1ccccc1Sc2ccccc2 62a_100000719477_100000241748 [0,2,0,0,0,0|0,1,0]=3 8982 B16R2.172 NNc1ccccc1Sc2ccccn2 62a_100000241748_100011216584 [0,2,0,0,0,0|1,1,0]=4 8983 B16R2.172 NNc1ccccc1Sc2ccccn2 62a_100011216584_100000241748 [0,2,0,0,0,0|1,1,0]=4 8984 B16R2.172 NNc1ccccc1Sc2cccnc2 62a_100000210063_100000241748 [0,2,0,0,0,0|1,1,0]=4 8985 B16R2.172 NNc1ccccc1Sc2cccnc2 62a_100000241748_100000210063 [0,2,0,0,0,0|1,1,0]=4 8986 B16R2.172 NNc1ccccc1Sc2ccncc2 62a_100000241748_100000728582 [0,2,0,0,0,0|1,1,0]=4 8987 B16R2.172 NNc1ccccc1Sc2ccncc2 62a_100000728582_100000241748 [0,2,0,0,0,0|1,1,0]=4 8988 B16R2.172 NNc1ccncc1Sc2ccccc2 62a_100000719477_100013404636 [0,2,0,0,0,0|1,1,0]=4 8989 B16R2.172 NNc1ccncc1Sc2ccccc2 62a_100013404636_100000041952 [0,2,0,0,0,0|1,1,0]=4 8990 B16R2.172 NNc1ncccc1Sc2ccccc2 62a_100000719477_100011464834 [0,2,0,0,0,0|1,1,0]=4 8991 B16R2.172 NNc1ncccc1Sc2ccccc2 62a_100011464834_100000041952 [0,2,0,0,0,0|1,1,0]=4 8992 B16R2.172 O=Cc1ccccc1Sc2ccccc2 62a_100000210073_100000041952 [0,2,0,0,0,0|0,1,0]=3 8993 B16R2.172 O=Cc1ccccc1Sc2ccccc2 62a_100000719477_100000210073 [0,2,0,0,0,0|0,1,0]=3 8994 B16R2.172 O=Cc1ccccc1Sc2ccccn2 62a_100000210073_100011216584 [0,2,0,0,0,0|1,1,0]=4 8995 B16R2.172 O=Cc1ccccc1Sc2ccccn2 62a_100011216584_100000210073 [0,2,0,0,0,0|1,1,0]=4 8996 B16R2.172 O=Cc1ccccc1Sc2cccnc2 62a_100000210063_100000210073 [0,2,0,0,0,0|1,1,0]=4 8997 B16R2.172 O=Cc1ccccc1Sc2cccnc2 62a_100000210073_100000210063 [0,2,0,0,0,0|1,1,0]=4 8998 B16R2.172 O=Cc1ccccc1Sc2ccncc2 62a_100000210073_100000728582 [0,2,0,0,0,0|1,1,0]=4 8999 B16R2.172 O=Cc1ccccc1Sc2ccncc2 62a_100000728582_100000210073 [0,2,0,0,0,0|1,1,0]=4 9000 B16R2.172 O=Cc1cccnc1Sc2ccccc2 62a_100000719477_100009816751 [0,2,0,0,0,0|1,1,0]=4 9001 B16R2.172 O=Cc1cccnc1Sc2ccccc2 62a_100009816751_100000041952 [0,2,0,0,0,0|1,1,0]=4 9002 B16R2.172 O=Cc1ccncc1Sc2ccccc2 62a_100000719477_100011934409 [0,2,0,0,0,0|1,1,0]=4 9003 B16R2.172 O=Cc1ccncc1Sc2ccccc2 62a_100011934409_100000041952 [0,2,0,0,0,0|1,1,0]=4 9004 B16R2.172 O=Cc1cnccc1Sc2ccccc2 62a_100000050567_100000041952 [0,2,0,0,0,0|1,1,0]=4 9005 B16R2.172 O=Cc1cnccc1Sc2ccccc2 62a_100000719477_100000050567 [0,2,0,0,0,0|1,1,0]=4 9006 B16R2.172 O=Cc1ncccc1Sc2ccccc2 62a_100000719477_100011934733 [0,2,0,0,0,0|1,1,0]=4 9007 B16R2.172 O=Cc1ncccc1Sc2ccccc2 62a_100011934733_100000041952 [0,2,0,0,0,0|1,1,0]=4 9008 B16R2.172 OCc1ccccc1Sc2ccccc2 62a_100000187465_100000041952 [0,2,0,0,0,0|0,1,0]=3 9009 B16R2.172 OCc1ccccc1Sc2ccccc2 62a_100000719477_100000187465 [0,2,0,0,0,0|0,1,0]=3 9010 B16R2.172 OCc1ccccc1Sc2ccccn2 62a_100000187465_100011216584 [0,2,0,0,0,0|1,1,0]=4 9011 B16R2.172 OCc1ccccc1Sc2ccccn2 62a_100011216584_100000187465 [0,2,0,0,0,0|1,1,0]=4 9012 B16R2.172 OCc1ccccc1Sc2cccnc2 62a_100000187465_100000210063 [0,2,0,0,0,0|1,1,0]=4 9013 B16R2.172 OCc1ccccc1Sc2cccnc2 62a_100000210063_100000187465 [0,2,0,0,0,0|1,1,0]=4 9014 B16R2.172 OCc1ccccc1Sc2ccncc2 62a_100000187465_100000728582 [0,2,0,0,0,0|1,1,0]=4 9015 B16R2.172 OCc1ccccc1Sc2ccncc2 62a_100000728582_100000187465 [0,2,0,0,0,0|1,1,0]=4 9016 B16R2.172 OCc1cccnc1Sc2ccccc2 62a_100000719477_100000748726 [0,2,0,0,0,0|1,1,0]=4 9017 B16R2.172 OCc1cccnc1Sc2ccccc2 62a_100000748726_100000041952 [0,2,0,0,0,0|1,1,0]=4 9018 B16R2.172 OCc1ccncc1Sc2ccccc2 62a_100000719477_100009873359 [0,2,0,0,0,0|1,1,0]=4 9019 B16R2.172 OCc1ccncc1Sc2ccccc2 62a_100009873359_100000041952 [0,2,0,0,0,0|1,1,0]=4 9020 B16R2.172 OCc1cnccc1Nc2ccccc2 27a_100000106764_100000117392 [0,2,0,0,0,0|2,0,0]=4 9021 B16R2.172 OCc1cnccc1Sc2ccccc2 62a_100000117392_100000041952 [0,2,0,0,0,0|1,1,0]=4 9022 B16R2.172 OCc1cnccc1Sc2ccccc2 62a_100000719477_100000117392 [0,2,0,0,0,0|1,1,0]=4 9023 B16R2.172 OCc1ncccc1Sc2ccccc2 62a_100000719477_100011996772 [0,2,0,0,0,0|1,1,0]=4 9024 B16R2.172 OCc1ncccc1Sc2ccccc2 62a_100011996772_100000041952 [0,2,0,0,0,0|1,1,0]=4 9025 B16R2.172 [13CH3]Nc1ccccc1Cc2ccccc2 2230a_100000211252_200025704644 [0,2,0,0,0,0|1,0,0]=3 9026 B16R2.172 [13CH3]Nc1ccccc1Cc2ccccc2 34a_100000211252_200025704644 [0,2,0,0,0,0|1,0,0]=3 9027 B16R2.172 [13CH3]Nc1ccccc1Cc2ccccc2 7a_100000211252_200025704644 [0,2,0,0,0,0|1,0,0]=3 9028 B16R2.172 [13CH3]Nc1ccccc1Oc2ccccc2 2230a_100000182328_200025704644 [0,2,0,0,0,0|0,0,0]=2 9029 B16R2.172 [13CH3]Nc1ccccc1Oc2ccccc2 34a_100000182328_200025704644 [0,2,0,0,0,0|0,0,0]=2 9030 B16R2.172 [13CH3]Nc1ccccc1Sc2ccccc2 2230a_100000210917_200025704644 [0,2,0,0,0,0|0,1,0]=3 9031 B16R2.172 [13CH3]Oc1ccccc1Cc2ccccc2 34a_100000211249_200025704644 [0,2,0,0,0,0|1,0,0]=3 9032 B16R2.172 [13CH3]Oc1ccccc1Cc2ccccc2 7a_100000211249_200025704644 [0,2,0,0,0,0|1,0,0]=3 9033 B16R2.172 [13CH3]Oc1ccccc1Oc2ccccc2 34a_100000074787_200025704644 [0,2,0,0,0,0|0,0,0]=2 9034 B16R2.172 [13CH3]Oc1ccccc1Oc2ccccc2 7a_100000074787_200025704644 [0,2,0,0,0,0|0,0,0]=2 9035 B16R2.172 [13CH3]Oc1ccccc1Oc2ccccn2 34a_100000748224_200025704644 [0,2,0,0,0,0|1,0,0]=3 9036 B16R2.172 [13CH3]Sc1ccccc1Cc2ccccc2 62a_200011216382_200025704644 [0,2,0,0,0,0|1,0,0]=3 9037 B16R2.172 [13CH3]Sc1ccccc1Cc2ccccc2 62a_200025704644_200011216382 [0,2,0,0,0,0|1,0,0]=3 9038 B16R2.172 [13CH3]Sc1ccccc1Nc2ccccc2 62a_200025704644_100009815782 [0,2,0,0,0,0|1,0,0]=3 9039 B16R2.172 [13CH3]Sc1ccccc1Oc2ccccc2 62a_200025704644_100000049502 [0,2,0,0,0,0|0,0,0]=2 9040 B16R2.3259 Brc1cccc(c1Sc2ccccc2)Br 62a_100000719477_100009994525 [0,2,0,0,0,0|0,1,0]=3 9041 B16R2.3259 Brc1cccc(c1Sc2ccccc2)Br 62a_100009994525_100000041952 [0,2,0,0,0,0|0,1,0]=3 9042 B16R2.3259 Brc1cccc(c1Sc2ccccn2)Br 62a_100009994525_100011216584 [0,2,0,0,0,0|1,1,0]=4 9043 B16R2.3259 Brc1cccc(c1Sc2ccccn2)Br 62a_100011216584_100009994525 [0,2,0,0,0,0|1,1,0]=4 9044 B16R2.3259 Brc1cccc(c1Sc2cccnc2)Br 62a_100000210063_100009994525 [0,2,0,0,0,0|1,1,0]=4 9045 B16R2.3259 Brc1cccc(c1Sc2cccnc2)Br 62a_100009994525_100000210063 [0,2,0,0,0,0|1,1,0]=4 9046 B16R2.3259 Brc1cccc(c1Sc2ccncc2)Br 62a_100000728582_100009994525 [0,2,0,0,0,0|1,1,0]=4 9047 B16R2.3259 Brc1cccc(c1Sc2ccncc2)Br 62a_100009994525_100000728582 [0,2,0,0,0,0|1,1,0]=4 9048 B16R2.3259 Brc1cncc(c1Sc2ccccc2)Br 62a_100000719477_100010172828 [0,2,0,0,0,0|1,1,0]=4 9049 B16R2.3259 Brc1cncc(c1Sc2ccccc2)Br 62a_100010172828_100000041952 [0,2,0,0,0,0|1,1,0]=4 9050 B16R2.3259 Cc1ccc[n+](c1Sc2ccccc2)[O-] 62a_100000719477_100116209805 [0,2,0,0,0,0|1,1,0]=4 9051 B16R2.3259 Cc1cccc(c1Sc2ccccc2)Br 62a_100000719477_100010141302 [0,2,0,0,0,0|0,1,0]=3 9052 B16R2.3259 Cc1cccc(c1Sc2ccccc2)Br 62a_100010141302_100000041952 [0,2,0,0,0,0|0,1,0]=3 9053 B16R2.3259 Cc1cccc(c1Sc2ccccc2)C 62a_100000033847_100000041952 [0,2,0,0,0,0|0,1,0]=3 9054 B16R2.3259 Cc1cccc(c1Sc2ccccc2)C 62a_100000719477_100000033847 [0,2,0,0,0,0|0,1,0]=3 9055 B16R2.3259 Cc1cccc(c1Sc2ccccc2)Cl 62a_100000043165_100000041952 [0,2,0,0,0,0|0,1,0]=3 9056 B16R2.3259 Cc1cccc(c1Sc2ccccc2)Cl 62a_100000719477_100000043165 [0,2,0,0,0,0|0,1,0]=3 9057 B16R2.3259 Cc1cccc(c1Sc2ccccc2)F 62a_100000719477_100011218421 [0,2,0,0,0,0|0,1,0]=3 9058 B16R2.3259 Cc1cccc(c1Sc2ccccc2)F 62a_100011218421_100000041952 [0,2,0,0,0,0|0,1,0]=3 9059 B16R2.3259 Cc1cccc(c1Sc2ccccc2)N 62a_100000684715_100000041952 [0,2,0,0,0,0|0,1,0]=3 9060 B16R2.3259 Cc1cccc(c1Sc2ccccc2)N 62a_100000719477_100000684715 [0,2,0,0,0,0|0,1,0]=3 9061 B16R2.3259 Cc1cccc(c1Sc2ccccc2)O 62a_100000686692_100000041952 [0,2,0,0,0,0|0,1,0]=3 9062 B16R2.3259 Cc1cccc(c1Sc2ccccc2)O 62a_100000719477_100000686692 [0,2,0,0,0,0|0,1,0]=3 9063 B16R2.3259 Cc1cccc(c1Sc2ccccn2)Br 62a_100010141302_100011216584 [0,2,0,0,0,0|1,1,0]=4 9064 B16R2.3259 Cc1cccc(c1Sc2ccccn2)Br 62a_100011216584_100010141302 [0,2,0,0,0,0|1,1,0]=4 9065 B16R2.3259 Cc1cccc(c1Sc2ccccn2)C 62a_100000033847_100011216584 [0,2,0,0,0,0|1,1,0]=4 9066 B16R2.3259 Cc1cccc(c1Sc2ccccn2)C 62a_100011216584_100000033847 [0,2,0,0,0,0|1,1,0]=4 9067 B16R2.3259 Cc1cccc(c1Sc2ccccn2)Cl 62a_100000043165_100011216584 [0,2,0,0,0,0|1,1,0]=4 9068 B16R2.3259 Cc1cccc(c1Sc2ccccn2)Cl 62a_100011216584_100000043165 [0,2,0,0,0,0|1,1,0]=4 9069 B16R2.3259 Cc1cccc(c1Sc2ccccn2)F 62a_100011216584_100011218421 [0,2,0,0,0,0|1,1,0]=4 9070 B16R2.3259 Cc1cccc(c1Sc2ccccn2)F 62a_100011218421_100011216584 [0,2,0,0,0,0|1,1,0]=4 9071 B16R2.3259 Cc1cccc(c1Sc2ccccn2)N 62a_100000684715_100011216584 [0,2,0,0,0,0|1,1,0]=4 9072 B16R2.3259 Cc1cccc(c1Sc2ccccn2)N 62a_100011216584_100000684715 [0,2,0,0,0,0|1,1,0]=4 9073 B16R2.3259 Cc1cccc(c1Sc2ccccn2)O 62a_100000686692_100011216584 [0,2,0,0,0,0|1,1,0]=4 9074 B16R2.3259 Cc1cccc(c1Sc2ccccn2)O 62a_100011216584_100000686692 [0,2,0,0,0,0|1,1,0]=4 9075 B16R2.3259 Cc1cccc(c1Sc2cccnc2)Br 62a_100000210063_100010141302 [0,2,0,0,0,0|1,1,0]=4 9076 B16R2.3259 Cc1cccc(c1Sc2cccnc2)Br 62a_100010141302_100000210063 [0,2,0,0,0,0|1,1,0]=4 9077 B16R2.3259 Cc1cccc(c1Sc2cccnc2)C 62a_100000033847_100000210063 [0,2,0,0,0,0|1,1,0]=4 9078 B16R2.3259 Cc1cccc(c1Sc2cccnc2)C 62a_100000210063_100000033847 [0,2,0,0,0,0|1,1,0]=4 9079 B16R2.3259 Cc1cccc(c1Sc2cccnc2)Cl 62a_100000043165_100000210063 [0,2,0,0,0,0|1,1,0]=4 9080 B16R2.3259 Cc1cccc(c1Sc2cccnc2)Cl 62a_100000210063_100000043165 [0,2,0,0,0,0|1,1,0]=4 9081 B16R2.3259 Cc1cccc(c1Sc2cccnc2)F 62a_100000210063_100011218421 [0,2,0,0,0,0|1,1,0]=4 9082 B16R2.3259 Cc1cccc(c1Sc2cccnc2)F 62a_100011218421_100000210063 [0,2,0,0,0,0|1,1,0]=4 9083 B16R2.3259 Cc1cccc(c1Sc2cccnc2)N 62a_100000210063_100000684715 [0,2,0,0,0,0|1,1,0]=4 9084 B16R2.3259 Cc1cccc(c1Sc2cccnc2)N 62a_100000684715_100000210063 [0,2,0,0,0,0|1,1,0]=4 9085 B16R2.3259 Cc1cccc(c1Sc2cccnc2)O 62a_100000210063_100000686692 [0,2,0,0,0,0|1,1,0]=4 9086 B16R2.3259 Cc1cccc(c1Sc2cccnc2)O 62a_100000686692_100000210063 [0,2,0,0,0,0|1,1,0]=4 9087 B16R2.3259 Cc1cccc(c1Sc2ccncc2)Br 62a_100000728582_100010141302 [0,2,0,0,0,0|1,1,0]=4 9088 B16R2.3259 Cc1cccc(c1Sc2ccncc2)Br 62a_100010141302_100000728582 [0,2,0,0,0,0|1,1,0]=4 9089 B16R2.3259 Cc1cccc(c1Sc2ccncc2)C 62a_100000033847_100000728582 [0,2,0,0,0,0|1,1,0]=4 9090 B16R2.3259 Cc1cccc(c1Sc2ccncc2)C 62a_100000728582_100000033847 [0,2,0,0,0,0|1,1,0]=4 9091 B16R2.3259 Cc1cccc(c1Sc2ccncc2)Cl 62a_100000043165_100000728582 [0,2,0,0,0,0|1,1,0]=4 9092 B16R2.3259 Cc1cccc(c1Sc2ccncc2)Cl 62a_100000728582_100000043165 [0,2,0,0,0,0|1,1,0]=4 9093 B16R2.3259 Cc1cccc(c1Sc2ccncc2)F 62a_100000728582_100011218421 [0,2,0,0,0,0|1,1,0]=4 9094 B16R2.3259 Cc1cccc(c1Sc2ccncc2)F 62a_100011218421_100000728582 [0,2,0,0,0,0|1,1,0]=4 9095 B16R2.3259 Cc1cccc(c1Sc2ccncc2)N 62a_100000684715_100000728582 [0,2,0,0,0,0|1,1,0]=4 9096 B16R2.3259 Cc1cccc(c1Sc2ccncc2)N 62a_100000728582_100000684715 [0,2,0,0,0,0|1,1,0]=4 9097 B16R2.3259 Cc1cccc(c1Sc2ccncc2)O 62a_100000686692_100000728582 [0,2,0,0,0,0|1,1,0]=4 9098 B16R2.3259 Cc1cccc(c1Sc2ccncc2)O 62a_100000728582_100000686692 [0,2,0,0,0,0|1,1,0]=4 9099 B16R2.3259 Cc1ccnc(c1Nc2ccccc2)F 27a_100000106764_100009818256 [0,2,0,0,0,0|2,0,0]=4 9100 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)C 62a_100000719477_100012000501 [0,2,0,0,0,0|1,1,0]=4 9101 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)C 62a_100012000501_100000041952 [0,2,0,0,0,0|1,1,0]=4 9102 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)Cl 62a_100000719477_100010248874 [0,2,0,0,0,0|1,1,0]=4 9103 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)Cl 62a_100010248874_100000041952 [0,2,0,0,0,0|1,1,0]=4 9104 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)F 62a_100000719477_100009818256 [0,2,0,0,0,0|1,1,0]=4 9105 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)F 62a_100009818256_100000041952 [0,2,0,0,0,0|1,1,0]=4 9106 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)N 62a_100000719477_100011998619 [0,2,0,0,0,0|1,1,0]=4 9107 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)N 62a_100011998619_100000041952 [0,2,0,0,0,0|1,1,0]=4 9108 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)O 62a_100000719477_100012000493 [0,2,0,0,0,0|1,1,0]=4 9109 B16R2.3259 Cc1ccnc(c1Sc2ccccc2)O 62a_100012000493_100000041952 [0,2,0,0,0,0|1,1,0]=4 9110 B16R2.3259 Cc1cncc(c1Sc2ccccc2)C 62a_100000719477_100009817138 [0,2,0,0,0,0|1,1,0]=4 9111 B16R2.3259 Cc1cncc(c1Sc2ccccc2)C 62a_100009817138_100000041952 [0,2,0,0,0,0|1,1,0]=4 9112 B16R2.3259 Cc1nccc(c1Sc2ccccc2)N 62a_100000719477_100010243816 [0,2,0,0,0,0|1,1,0]=4 9113 B16R2.3259 Cc1nccc(c1Sc2ccccc2)N 62a_100010243816_100000041952 [0,2,0,0,0,0|1,1,0]=4 9114 B16R2.3259 Clc1cccc(c1Sc2ccccc2)Br 62a_100000719477_100010214488 [0,2,0,0,0,0|0,1,0]=3 9115 B16R2.3259 Clc1cccc(c1Sc2ccccc2)Br 62a_100010214488_100000041952 [0,2,0,0,0,0|0,1,0]=3 9116 B16R2.3259 Clc1cccc(c1Sc2ccccc2)Cl 62a_100000034237_100000041952 [0,2,0,0,0,0|0,1,0]=3 9117 B16R2.3259 Clc1cccc(c1Sc2ccccc2)Cl 62a_100000719477_100000034237 [0,2,0,0,0,0|0,1,0]=3 9118 B16R2.3259 Clc1cccc(c1Sc2ccccn2)Br 62a_100010214488_100011216584 [0,2,0,0,0,0|1,1,0]=4 9119 B16R2.3259 Clc1cccc(c1Sc2ccccn2)Br 62a_100011216584_100010214488 [0,2,0,0,0,0|1,1,0]=4 9120 B16R2.3259 Clc1cccc(c1Sc2ccccn2)Cl 62a_100000034237_100011216584 [0,2,0,0,0,0|1,1,0]=4 9121 B16R2.3259 Clc1cccc(c1Sc2ccccn2)Cl 62a_100011216584_100000034237 [0,2,0,0,0,0|1,1,0]=4 9122 B16R2.3259 Clc1cccc(c1Sc2cccnc2)Br 62a_100000210063_100010214488 [0,2,0,0,0,0|1,1,0]=4 9123 B16R2.3259 Clc1cccc(c1Sc2cccnc2)Br 62a_100010214488_100000210063 [0,2,0,0,0,0|1,1,0]=4 9124 B16R2.3259 Clc1cccc(c1Sc2cccnc2)Cl 62a_100000034237_100000210063 [0,2,0,0,0,0|1,1,0]=4 9125 B16R2.3259 Clc1cccc(c1Sc2cccnc2)Cl 62a_100000210063_100000034237 [0,2,0,0,0,0|1,1,0]=4 9126 B16R2.3259 Clc1cccc(c1Sc2ccncc2)Br 62a_100000728582_100010214488 [0,2,0,0,0,0|1,1,0]=4 9127 B16R2.3259 Clc1cccc(c1Sc2ccncc2)Br 62a_100010214488_100000728582 [0,2,0,0,0,0|1,1,0]=4 9128 B16R2.3259 Clc1cccc(c1Sc2ccncc2)Cl 62a_100000034237_100000728582 [0,2,0,0,0,0|1,1,0]=4 9129 B16R2.3259 Clc1cccc(c1Sc2ccncc2)Cl 62a_100000728582_100000034237 [0,2,0,0,0,0|1,1,0]=4 9130 B16R2.3259 Clc1ccnc(c1Sc2ccccc2)Cl 62a_100000050019_100000041952 [0,2,0,0,0,0|1,1,0]=4 9131 B16R2.3259 Clc1ccnc(c1Sc2ccccc2)Cl 62a_100000719477_100000050019 [0,2,0,0,0,0|1,1,0]=4 9132 B16R2.3259 Clc1cncc(c1Sc2ccccc2)Cl 62a_100000036193_100000041952 [0,2,0,0,0,0|1,1,0]=4 9133 B16R2.3259 Clc1cncc(c1Sc2ccccc2)Cl 62a_100000719477_100000036193 [0,2,0,0,0,0|1,1,0]=4 9134 B16R2.3259 Clc1nccc(c1Sc2ccccc2)Br 62a_100000719477_100009814607 [0,2,0,0,0,0|1,1,0]=4 9135 B16R2.3259 Clc1nccc(c1Sc2ccccc2)Br 62a_100009814607_100000041952 [0,2,0,0,0,0|1,1,0]=4 9136 B16R2.3259 Fc1cccc(c1Sc2ccccc2)Br 62a_100000719477_100011219512 [0,2,0,0,0,0|0,1,0]=3 9137 B16R2.3259 Fc1cccc(c1Sc2ccccc2)Br 62a_100011219512_100000041952 [0,2,0,0,0,0|0,1,0]=3 9138 B16R2.3259 Fc1cccc(c1Sc2ccccc2)Cl 62a_100000050007_100000041952 [0,2,0,0,0,0|0,1,0]=3 9139 B16R2.3259 Fc1cccc(c1Sc2ccccc2)Cl 62a_100000719477_100000050007 [0,2,0,0,0,0|0,1,0]=3 9140 B16R2.3259 Fc1cccc(c1Sc2ccccc2)F 62a_100000693133_100000041952 [0,2,0,0,0,0|0,1,0]=3 9141 B16R2.3259 Fc1cccc(c1Sc2ccccc2)F 62a_100000719477_100000693133 [0,2,0,0,0,0|0,1,0]=3 9142 B16R2.3259 Fc1cccc(c1Sc2ccccn2)Br 62a_100011216584_100011219512 [0,2,0,0,0,0|1,1,0]=4 9143 B16R2.3259 Fc1cccc(c1Sc2ccccn2)Br 62a_100011219512_100011216584 [0,2,0,0,0,0|1,1,0]=4 9144 B16R2.3259 Fc1cccc(c1Sc2ccccn2)Cl 62a_100000050007_100011216584 [0,2,0,0,0,0|1,1,0]=4 9145 B16R2.3259 Fc1cccc(c1Sc2ccccn2)Cl 62a_100011216584_100000050007 [0,2,0,0,0,0|1,1,0]=4 9146 B16R2.3259 Fc1cccc(c1Sc2ccccn2)F 62a_100000693133_100011216584 [0,2,0,0,0,0|1,1,0]=4 9147 B16R2.3259 Fc1cccc(c1Sc2ccccn2)F 62a_100011216584_100000693133 [0,2,0,0,0,0|1,1,0]=4 9148 B16R2.3259 Fc1cccc(c1Sc2cccnc2)Br 62a_100000210063_100011219512 [0,2,0,0,0,0|1,1,0]=4 9149 B16R2.3259 Fc1cccc(c1Sc2cccnc2)Br 62a_100011219512_100000210063 [0,2,0,0,0,0|1,1,0]=4 9150 B16R2.3259 Fc1cccc(c1Sc2cccnc2)Cl 62a_100000050007_100000210063 [0,2,0,0,0,0|1,1,0]=4 9151 B16R2.3259 Fc1cccc(c1Sc2cccnc2)Cl 62a_100000210063_100000050007 [0,2,0,0,0,0|1,1,0]=4 9152 B16R2.3259 Fc1cccc(c1Sc2cccnc2)F 62a_100000210063_100000693133 [0,2,0,0,0,0|1,1,0]=4 9153 B16R2.3259 Fc1cccc(c1Sc2cccnc2)F 62a_100000693133_100000210063 [0,2,0,0,0,0|1,1,0]=4 9154 B16R2.3259 Fc1cccc(c1Sc2ccncc2)Br 62a_100000728582_100011219512 [0,2,0,0,0,0|1,1,0]=4 9155 B16R2.3259 Fc1cccc(c1Sc2ccncc2)Br 62a_100011219512_100000728582 [0,2,0,0,0,0|1,1,0]=4 9156 B16R2.3259 Fc1cccc(c1Sc2ccncc2)Cl 62a_100000050007_100000728582 [0,2,0,0,0,0|1,1,0]=4 9157 B16R2.3259 Fc1cccc(c1Sc2ccncc2)Cl 62a_100000728582_100000050007 [0,2,0,0,0,0|1,1,0]=4 9158 B16R2.3259 Fc1cccc(c1Sc2ccncc2)F 62a_100000693133_100000728582 [0,2,0,0,0,0|1,1,0]=4 9159 B16R2.3259 Fc1cccc(c1Sc2ccncc2)F 62a_100000728582_100000693133 [0,2,0,0,0,0|1,1,0]=4 9160 B16R2.3259 Fc1ccnc(c1Nc2ccccc2)F 27a_100000106764_100009874084 [0,2,0,0,0,0|2,0,0]=4 9161 B16R2.3259 Fc1ccnc(c1Sc2ccccc2)Cl 62a_100000716511_100000041952 [0,2,0,0,0,0|1,1,0]=4 9162 B16R2.3259 Fc1ccnc(c1Sc2ccccc2)Cl 62a_100000719477_100000716511 [0,2,0,0,0,0|1,1,0]=4 9163 B16R2.3259 Fc1ccnc(c1Sc2ccccc2)F 62a_100000719477_100009874084 [0,2,0,0,0,0|1,1,0]=4 9164 B16R2.3259 Fc1ccnc(c1Sc2ccccc2)F 62a_100009874084_100000041952 [0,2,0,0,0,0|1,1,0]=4 9165 B16R2.3259 Fc1cncc(c1Sc2ccccc2)F 62a_100000719477_100000760538 [0,2,0,0,0,0|1,1,0]=4 9166 B16R2.3259 Fc1cncc(c1Sc2ccccc2)F 62a_100000760538_100000041952 [0,2,0,0,0,0|1,1,0]=4 9167 B16R2.3259 Nc1cccc(c1Sc2ccccc2)Br 62a_100000719477_100020590159 [0,2,0,0,0,0|0,1,0]=3 9168 B16R2.3259 Nc1cccc(c1Sc2ccccc2)Br 62a_100020590159_100000041952 [0,2,0,0,0,0|0,1,0]=3 9169 B16R2.3259 Nc1cccc(c1Sc2ccccc2)Cl 62a_100000049713_100000041952 [0,2,0,0,0,0|0,1,0]=3 9170 B16R2.3259 Nc1cccc(c1Sc2ccccc2)Cl 62a_100000719477_100000049713 [0,2,0,0,0,0|0,1,0]=3 9171 B16R2.3259 Nc1cccc(c1Sc2ccccc2)F 62a_100000690935_100000041952 [0,2,0,0,0,0|0,1,0]=3 9172 B16R2.3259 Nc1cccc(c1Sc2ccccc2)F 62a_100000719477_100000690935 [0,2,0,0,0,0|0,1,0]=3 9173 B16R2.3259 Nc1cccc(c1Sc2ccccc2)O 62a_100000719477_100012183704 [0,2,0,0,0,0|0,1,0]=3 9174 B16R2.3259 Nc1cccc(c1Sc2ccccc2)O 62a_100012183704_100000041952 [0,2,0,0,0,0|0,1,0]=3 9175 B16R2.3259 Nc1cccc(c1Sc2ccccn2)Br 62a_100011216584_100020590159 [0,2,0,0,0,0|1,1,0]=4 9176 B16R2.3259 Nc1cccc(c1Sc2ccccn2)Br 62a_100020590159_100011216584 [0,2,0,0,0,0|1,1,0]=4 9177 B16R2.3259 Nc1cccc(c1Sc2ccccn2)Cl 62a_100000049713_100011216584 [0,2,0,0,0,0|1,1,0]=4 9178 B16R2.3259 Nc1cccc(c1Sc2ccccn2)Cl 62a_100011216584_100000049713 [0,2,0,0,0,0|1,1,0]=4 9179 B16R2.3259 Nc1cccc(c1Sc2ccccn2)F 62a_100000690935_100011216584 [0,2,0,0,0,0|1,1,0]=4 9180 B16R2.3259 Nc1cccc(c1Sc2ccccn2)F 62a_100011216584_100000690935 [0,2,0,0,0,0|1,1,0]=4 9181 B16R2.3259 Nc1cccc(c1Sc2ccccn2)O 62a_100011216584_100012183704 [0,2,0,0,0,0|1,1,0]=4 9182 B16R2.3259 Nc1cccc(c1Sc2ccccn2)O 62a_100012183704_100011216584 [0,2,0,0,0,0|1,1,0]=4 9183 B16R2.3259 Nc1cccc(c1Sc2cccnc2)Br 62a_100000210063_100020590159 [0,2,0,0,0,0|1,1,0]=4 9184 B16R2.3259 Nc1cccc(c1Sc2cccnc2)Br 62a_100020590159_100000210063 [0,2,0,0,0,0|1,1,0]=4 9185 B16R2.3259 Nc1cccc(c1Sc2cccnc2)Cl 62a_100000049713_100000210063 [0,2,0,0,0,0|1,1,0]=4 9186 B16R2.3259 Nc1cccc(c1Sc2cccnc2)Cl 62a_100000210063_100000049713 [0,2,0,0,0,0|1,1,0]=4 9187 B16R2.3259 Nc1cccc(c1Sc2cccnc2)F 62a_100000210063_100000690935 [0,2,0,0,0,0|1,1,0]=4 9188 B16R2.3259 Nc1cccc(c1Sc2cccnc2)F 62a_100000690935_100000210063 [0,2,0,0,0,0|1,1,0]=4 9189 B16R2.3259 Nc1cccc(c1Sc2cccnc2)O 62a_100000210063_100012183704 [0,2,0,0,0,0|1,1,0]=4 9190 B16R2.3259 Nc1cccc(c1Sc2cccnc2)O 62a_100012183704_100000210063 [0,2,0,0,0,0|1,1,0]=4 9191 B16R2.3259 Nc1cccc(c1Sc2ccncc2)Br 62a_100000728582_100020590159 [0,2,0,0,0,0|1,1,0]=4 9192 B16R2.3259 Nc1cccc(c1Sc2ccncc2)Br 62a_100020590159_100000728582 [0,2,0,0,0,0|1,1,0]=4 9193 B16R2.3259 Nc1cccc(c1Sc2ccncc2)Cl 62a_100000049713_100000728582 [0,2,0,0,0,0|1,1,0]=4 9194 B16R2.3259 Nc1cccc(c1Sc2ccncc2)Cl 62a_100000728582_100000049713 [0,2,0,0,0,0|1,1,0]=4 9195 B16R2.3259 Nc1cccc(c1Sc2ccncc2)F 62a_100000690935_100000728582 [0,2,0,0,0,0|1,1,0]=4 9196 B16R2.3259 Nc1cccc(c1Sc2ccncc2)F 62a_100000728582_100000690935 [0,2,0,0,0,0|1,1,0]=4 9197 B16R2.3259 Nc1cccc(c1Sc2ccncc2)O 62a_100000728582_100012183704 [0,2,0,0,0,0|1,1,0]=4 9198 B16R2.3259 Nc1cccc(c1Sc2ccncc2)O 62a_100012183704_100000728582 [0,2,0,0,0,0|1,1,0]=4 9199 B16R2.3259 Nc1ccnc(c1Sc2ccccc2)Cl 62a_100000719477_100010208016 [0,2,0,0,0,0|1,1,0]=4 9200 B16R2.3259 Nc1ccnc(c1Sc2ccccc2)Cl 62a_100010208016_100000041952 [0,2,0,0,0,0|1,1,0]=4 9201 B16R2.3259 Nc1ccnc(c1Sc2ccccc2)F 62a_100000719477_100010381272 [0,2,0,0,0,0|1,1,0]=4 9202 B16R2.3259 Nc1ccnc(c1Sc2ccccc2)F 62a_100010381272_100000041952 [0,2,0,0,0,0|1,1,0]=4 9203 B16R2.3259 Nc1nccc(c1Sc2ccccc2)Cl 62a_100000719477_100010199028 [0,2,0,0,0,0|1,1,0]=4 9204 B16R2.3259 Nc1nccc(c1Sc2ccccc2)Cl 62a_100010199028_100000041952 [0,2,0,0,0,0|1,1,0]=4 9205 B16R2.3259 Oc1cccc(c1Sc2ccccc2)Br 62a_100000719477_100010187912 [0,2,0,0,0,0|0,1,0]=3 9206 B16R2.3259 Oc1cccc(c1Sc2ccccc2)Br 62a_100010187912_100000041952 [0,2,0,0,0,0|0,1,0]=3 9207 B16R2.3259 Oc1cccc(c1Sc2ccccc2)Cl 62a_100000719477_100000050174 [0,2,0,0,0,0|0,1,0]=3 9208 B16R2.3259 Oc1cccc(c1Sc2ccccc2)F 62a_100000719477_100009820682 [0,2,0,0,0,0|0,1,0]=3 9209 B16R2.3259 Oc1cccc(c1Sc2ccccc2)F 62a_100009820682_100000041952 [0,2,0,0,0,0|0,1,0]=3 9210 B16R2.3259 Oc1cccc(c1Sc2ccccc2)O 62a_100000719477_100010205330 [0,2,0,0,0,0|0,1,0]=3 9211 B16R2.3259 Oc1cccc(c1Sc2ccccn2)Br 62a_100010187912_100011216584 [0,2,0,0,0,0|1,1,0]=4 9212 B16R2.3259 Oc1cccc(c1Sc2ccccn2)Br 62a_100011216584_100010187912 [0,2,0,0,0,0|1,1,0]=4 9213 B16R2.3259 Oc1cccc(c1Sc2ccccn2)Cl 62a_100011216584_100000050174 [0,2,0,0,0,0|1,1,0]=4 9214 B16R2.3259 Oc1cccc(c1Sc2ccccn2)F 62a_100009820682_100011216584 [0,2,0,0,0,0|1,1,0]=4 9215 B16R2.3259 Oc1cccc(c1Sc2ccccn2)F 62a_100011216584_100009820682 [0,2,0,0,0,0|1,1,0]=4 9216 B16R2.3259 Oc1cccc(c1Sc2ccccn2)O 62a_100011216584_100010205330 [0,2,0,0,0,0|1,1,0]=4 9217 B16R2.3259 Oc1cccc(c1Sc2cccnc2)Br 62a_100000210063_100010187912 [0,2,0,0,0,0|1,1,0]=4 9218 B16R2.3259 Oc1cccc(c1Sc2cccnc2)Br 62a_100010187912_100000210063 [0,2,0,0,0,0|1,1,0]=4 9219 B16R2.3259 Oc1cccc(c1Sc2cccnc2)Cl 62a_100000210063_100000050174 [0,2,0,0,0,0|1,1,0]=4 9220 B16R2.3259 Oc1cccc(c1Sc2cccnc2)F 62a_100000210063_100009820682 [0,2,0,0,0,0|1,1,0]=4 9221 B16R2.3259 Oc1cccc(c1Sc2cccnc2)F 62a_100009820682_100000210063 [0,2,0,0,0,0|1,1,0]=4 9222 B16R2.3259 Oc1cccc(c1Sc2cccnc2)O 62a_100000210063_100010205330 [0,2,0,0,0,0|1,1,0]=4 9223 B16R2.3259 Oc1cccc(c1Sc2ccncc2)Br 62a_100000728582_100010187912 [0,2,0,0,0,0|1,1,0]=4 9224 B16R2.3259 Oc1cccc(c1Sc2ccncc2)Br 62a_100010187912_100000728582 [0,2,0,0,0,0|1,1,0]=4 9225 B16R2.3259 Oc1cccc(c1Sc2ccncc2)Cl 62a_100000728582_100000050174 [0,2,0,0,0,0|1,1,0]=4 9226 B16R2.3259 Oc1cccc(c1Sc2ccncc2)F 62a_100000728582_100009820682 [0,2,0,0,0,0|1,1,0]=4 9227 B16R2.3259 Oc1cccc(c1Sc2ccncc2)F 62a_100009820682_100000728582 [0,2,0,0,0,0|1,1,0]=4 9228 B16R2.3259 Oc1cccc(c1Sc2ccncc2)O 62a_100000728582_100010205330 [0,2,0,0,0,0|1,1,0]=4 9229 B16R2.3259 Oc1ccnc(c1Sc2ccccc2)O 62a_100000719477_200009817435 [0,2,0,0,0,0|1,1,0]=4 9230 B16R2.3896 C=C(c1ccccc1)c2c[nH]ccc2=O 271570a_100000068269_100009998708 [0,2,0,0,0,0|2,0,0]=4 9231 B16R2.3896 C=C(c1ccccc1)c2c[nH]ccc2=S 271570a_100000068269_200012280681 [0,2,0,0,0,0|2,0,0]=4 9232 B16R2.3896 C=C(c1ccccc1)c2ccc[nH]c2=O 271570a_100000068269_100000050042 [0,2,0,0,0,0|2,0,0]=4 9233 B16R2.3896 C=C(c1ccccc1)c2cccc[n+]2C 271570a_100000068269_100000212160 [0,2,0,0,0,0|2,0,0]=4 9234 B16R2.3896 C=C(c1ccccc1)c2cccc[n+]2[O-] 271570a_100000068269_200000042595 [0,2,0,0,0,0|2,0,0]=4 9235 B16R2.3896 C=C(c1ccccc1)c2ccccc2Br 271570a_100000068269_100000695589 [0,2,0,0,0,0|1,0,0]=3 9236 B16R2.3896 C=C(c1ccccc1)c2ccccc2C 271570a_100000068269_100000210755 [0,2,0,0,0,0|1,0,0]=3 9237 B16R2.3896 C=C(c1ccccc1)c2ccccc2Cl 271570a_100000068269_100000764095 [0,2,0,0,0,0|1,0,0]=3 9238 B16R2.3896 C=C(c1ccccc1)c2ccccc2F 271570a_100000068269_100011215700 [0,2,0,0,0,0|1,0,0]=3 9239 B16R2.3896 C=C(c1ccccc1)c2ccccc2N 271570a_100000068269_100000210017 [0,2,0,0,0,0|1,0,0]=3 9240 B16R2.3896 C=C(c1ccccc1)c2ccccc2O 271570a_100000068269_100000739446 [0,2,0,0,0,0|1,0,0]=3 9241 B16R2.3896 C=C(c1ccccc1)c2cccnc2Br 271570a_100000068269_100010202626 [0,2,0,0,0,0|2,0,0]=4 9242 B16R2.3896 C=C(c1ccccc1)c2cccnc2C 271570a_100000068269_100000751574 [0,2,0,0,0,0|2,0,0]=4 9243 B16R2.3896 C=C(c1ccccc1)c2cccnc2Cl 271570a_100000068269_100000036424 [0,2,0,0,0,0|2,0,0]=4 9244 B16R2.3896 C=C(c1ccccc1)c2cccnc2F 271570a_100000068269_100009816115 [0,2,0,0,0,0|2,0,0]=4 9245 B16R2.3896 C=C(c1ccccc1)c2cccnc2N 271570a_100000068269_100000045569 [0,2,0,0,0,0|2,0,0]=4 9246 B16R2.3896 C=C(c1ccccc1)c2ccncc2Br 271570a_100000068269_100000726257 [0,2,0,0,0,0|2,0,0]=4 9247 B16R2.3896 C=C(c1ccccc1)c2ccncc2C 271570a_100000068269_100015191297 [0,2,0,0,0,0|2,0,0]=4 9248 B16R2.3896 C=C(c1ccccc1)c2ccncc2Cl 271570a_100000068269_100000708259 [0,2,0,0,0,0|2,0,0]=4 9249 B16R2.3896 C=C(c1ccccc1)c2ccncc2F 271570a_100000068269_100000047030 [0,2,0,0,0,0|2,0,0]=4 9250 B16R2.3896 C=C(c1ccccc1)c2ccncc2N 271570a_100000068269_100009815883 [0,2,0,0,0,0|2,0,0]=4 9251 B16R2.3896 C=C(c1ccccc1)c2ccncc2O 271570a_100000068269_100009817591 [0,2,0,0,0,0|2,0,0]=4 9252 B16R2.3896 C=C(c1ccccc1)c2cnccc2Br 271570a_100000068269_100010138639 [0,2,0,0,0,0|2,0,0]=4 9253 B16R2.3896 C=C(c1ccccc1)c2cnccc2C 271570a_100000068269_100000761580 [0,2,0,0,0,0|2,0,0]=4 9254 B16R2.3896 C=C(c1ccccc1)c2cnccc2Cl 271570a_100000068269_100009995489 [0,2,0,0,0,0|2,0,0]=4 9255 B16R2.3896 C=C(c1ccccc1)c2cnccc2F 271570a_100000068269_100009820683 [0,2,0,0,0,0|2,0,0]=4 9256 B16R2.3896 C=C(c1ccccc1)c2cnccc2N 271570a_100000068269_100000047001 [0,2,0,0,0,0|2,0,0]=4 9257 B16R2.3896 C=C(c1ccccc1)c2ncccc2Br 271570a_100000068269_100000696092 [0,2,0,0,0,0|2,0,0]=4 9258 B16R2.3896 C=C(c1ccccc1)c2ncccc2C 271570a_100000068269_100000751373 [0,2,0,0,0,0|2,0,0]=4 9259 B16R2.3896 C=C(c1ccccc1)c2ncccc2Cl 271570a_100000068269_100011356963 [0,2,0,0,0,0|2,0,0]=4 9260 B16R2.3896 C=C(c1ccccc1)c2ncccc2F 271570a_100000068269_100000685392 [0,2,0,0,0,0|2,0,0]=4 9261 B16R2.3896 C=C(c1ccccc1)c2ncccc2N 271570a_100000068269_100000688686 [0,2,0,0,0,0|2,0,0]=4 9262 B16R2.3896 C=C(c1ccccc1)c2ncccc2O 271570a_100000068269_100000034122 [0,2,0,0,0,0|2,0,0]=4 9263 B16R2.3896 NC(c1ccccc1)c2ccccc2O 271570a_203496583355_100011211563 [0,2,0,0,0,0|1,0,0]=3 9264 B16R2.3896 O=C(c1ccccc1)c2ccccc2O 271570a_203496583355_100000198044 [0,2,0,0,0,0|1,0,0]=3 9265 B16R2.3896 O=C(c1cccnc1)c2ccccc2O 271570a_203496583355_100011532686 [0,2,0,0,0,0|2,0,0]=4 9266 B16R2.4062 Brc1ccccc1Sc2ccccc2Br 62a_100000695589_100000695589 [0,2,0,0,0,0|0,1,0]=3 9267 B16R2.4062 Brc1ccccc1Sc2cccnc2Br 62a_100000695589_100010202626 [0,2,0,0,0,0|1,1,0]=4 9268 B16R2.4062 Brc1ccccc1Sc2cccnc2Br 62a_100010202626_100000695589 [0,2,0,0,0,0|1,1,0]=4 9269 B16R2.4062 Brc1ccccc1Sc2ccncc2Br 62a_100000695589_100000726257 [0,2,0,0,0,0|1,1,0]=4 9270 B16R2.4062 Brc1ccccc1Sc2ccncc2Br 62a_100000726257_100000695589 [0,2,0,0,0,0|1,1,0]=4 9271 B16R2.4062 Brc1ccccc1Sc2cnccc2Br 62a_100000695589_100010138639 [0,2,0,0,0,0|1,1,0]=4 9272 B16R2.4062 Brc1ccccc1Sc2cnccc2Br 62a_100010138639_100000695589 [0,2,0,0,0,0|1,1,0]=4 9273 B16R2.4062 Brc1ccccc1Sc2ncccc2Br 62a_100000695589_100000696092 [0,2,0,0,0,0|1,1,0]=4 9274 B16R2.4062 Brc1ccccc1Sc2ncccc2Br 62a_100000696092_100000695589 [0,2,0,0,0,0|1,1,0]=4 9275 B16R2.4062 Brc1cccnc1Nc2ccccc2I 27a_100000210053_100000696092 [0,2,0,0,0,0|2,0,0]=4 9276 B16R2.4062 Brc1cnccc1Nc2ccccc2I 27a_100000210053_100000726257 [0,2,0,0,0,0|2,0,0]=4 9277 B16R2.4062 C[n+]1ccccc1Sc2ccccc2Br 62a_100000695589_100000212160 [0,2,0,0,0,0|1,1,0]=4 9278 B16R2.4062 C[n+]1ccccc1Sc2ccccc2Cl 62a_100000764095_100000212160 [0,2,0,0,0,0|1,1,0]=4 9279 B16R2.4062 C[n+]1ccccc1Sc2ccccc2F 62a_100011215700_100000212160 [0,2,0,0,0,0|1,1,0]=4 9280 B16R2.4062 C[n+]1ccccc1Sc2ccccc2N 62a_100000210017_100000212160 [0,2,0,0,0,0|1,1,0]=4 9281 B16R2.4062 C[n+]1ccccc1Sc2ccccc2O 62a_100000739446_100000212160 [0,2,0,0,0,0|1,1,0]=4 9282 B16R2.4062 Cc1ccccc1Nc2ccncc2Br 27a_100015192222_100000726257 [0,2,0,0,0,0|2,0,0]=4 9283 B16R2.4062 Cc1ccccc1Nc2ccncc2C 27a_100015192222_100000765111 [0,2,0,0,0,0|2,0,0]=4 9284 B16R2.4062 Cc1ccccc1Nc2ccncc2F 27a_100015192222_100000035921 [0,2,0,0,0,0|2,0,0]=4 9285 B16R2.4062 Cc1ccccc1Nc2ncccc2Br 27a_100015192222_100000696092 [0,2,0,0,0,0|2,0,0]=4 9286 B16R2.4062 Cc1ccccc1Sc2c[nH]ccc2=O 62a_100000210755_100009998708 [0,2,0,0,0,0|1,1,0]=4 9287 B16R2.4062 Cc1ccccc1Sc2c[nH]ccc2=O 62a_100009998708_100000210755 [0,2,0,0,0,0|1,1,0]=4 9288 B16R2.4062 Cc1ccccc1Sc2c[nH]ccc2=S 62a_100000210755_200012280681 [0,2,0,0,0,0|1,1,0]=4 9289 B16R2.4062 Cc1ccccc1Sc2c[nH]ccc2=S 62a_200012280681_100000210755 [0,2,0,0,0,0|1,1,0]=4 9290 B16R2.4062 Cc1ccccc1Sc2cccc[n+]2C 62a_100000210755_100000212160 [0,2,0,0,0,0|1,1,0]=4 9291 B16R2.4062 Cc1ccccc1Sc2cccc[n+]2[O-] 62a_100000210755_200000042595 [0,2,0,0,0,0|1,1,0]=4 9292 B16R2.4062 Cc1ccccc1Sc2ccccc2Br 62a_100000210755_100000695589 [0,2,0,0,0,0|0,1,0]=3 9293 B16R2.4062 Cc1ccccc1Sc2ccccc2Br 62a_100000695589_100000210755 [0,2,0,0,0,0|0,1,0]=3 9294 B16R2.4062 Cc1ccccc1Sc2ccccc2C 62a_100000210755_100000210755 [0,2,0,0,0,0|0,1,0]=3 9295 B16R2.4062 Cc1ccccc1Sc2ccccc2Cl 62a_100000210755_100000764095 [0,2,0,0,0,0|0,1,0]=3 9296 B16R2.4062 Cc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000210755 [0,2,0,0,0,0|0,1,0]=3 9297 B16R2.4062 Cc1ccccc1Sc2ccccc2F 62a_100000210755_100011215700 [0,2,0,0,0,0|0,1,0]=3 9298 B16R2.4062 Cc1ccccc1Sc2ccccc2F 62a_100011215700_100000210755 [0,2,0,0,0,0|0,1,0]=3 9299 B16R2.4062 Cc1ccccc1Sc2ccccc2N 62a_100000210017_100000210755 [0,2,0,0,0,0|0,1,0]=3 9300 B16R2.4062 Cc1ccccc1Sc2ccccc2N 62a_100000210755_100000210017 [0,2,0,0,0,0|0,1,0]=3 9301 B16R2.4062 Cc1ccccc1Sc2ccccc2O 62a_100000210755_100000739446 [0,2,0,0,0,0|0,1,0]=3 9302 B16R2.4062 Cc1ccccc1Sc2ccccc2O 62a_100000739446_100000210755 [0,2,0,0,0,0|0,1,0]=3 9303 B16R2.4062 Cc1ccccc1Sc2cccnc2Br 62a_100000210755_100010202626 [0,2,0,0,0,0|1,1,0]=4 9304 B16R2.4062 Cc1ccccc1Sc2cccnc2Br 62a_100010202626_100000210755 [0,2,0,0,0,0|1,1,0]=4 9305 B16R2.4062 Cc1ccccc1Sc2cccnc2C 62a_100000210755_100000751574 [0,2,0,0,0,0|1,1,0]=4 9306 B16R2.4062 Cc1ccccc1Sc2cccnc2C 62a_100000751574_100000210755 [0,2,0,0,0,0|1,1,0]=4 9307 B16R2.4062 Cc1ccccc1Sc2cccnc2Cl 62a_100000036424_100000210755 [0,2,0,0,0,0|1,1,0]=4 9308 B16R2.4062 Cc1ccccc1Sc2cccnc2Cl 62a_100000210755_100000036424 [0,2,0,0,0,0|1,1,0]=4 9309 B16R2.4062 Cc1ccccc1Sc2cccnc2F 62a_100000210755_100009816115 [0,2,0,0,0,0|1,1,0]=4 9310 B16R2.4062 Cc1ccccc1Sc2cccnc2F 62a_100009816115_100000210755 [0,2,0,0,0,0|1,1,0]=4 9311 B16R2.4062 Cc1ccccc1Sc2cccnc2N 62a_100000045569_100000210755 [0,2,0,0,0,0|1,1,0]=4 9312 B16R2.4062 Cc1ccccc1Sc2cccnc2N 62a_100000210755_100000045569 [0,2,0,0,0,0|1,1,0]=4 9313 B16R2.4062 Cc1ccccc1Sc2cccnc2O 62a_100000210755_100000760158 [0,2,0,0,0,0|1,1,0]=4 9314 B16R2.4062 Cc1ccccc1Sc2cccnc2O 62a_100000760158_100000210755 [0,2,0,0,0,0|1,1,0]=4 9315 B16R2.4062 Cc1ccccc1Sc2ccncc2Br 62a_100000210755_100000726257 [0,2,0,0,0,0|1,1,0]=4 9316 B16R2.4062 Cc1ccccc1Sc2ccncc2Br 62a_100000726257_100000210755 [0,2,0,0,0,0|1,1,0]=4 9317 B16R2.4062 Cc1ccccc1Sc2ccncc2C 62a_100000210755_100000765111 [0,2,0,0,0,0|1,1,0]=4 9318 B16R2.4062 Cc1ccccc1Sc2ccncc2C 62a_100000765111_100000210755 [0,2,0,0,0,0|1,1,0]=4 9319 B16R2.4062 Cc1ccccc1Sc2ccncc2Cl 62a_100000210755_100000708259 [0,2,0,0,0,0|1,1,0]=4 9320 B16R2.4062 Cc1ccccc1Sc2ccncc2Cl 62a_100000708259_100000210755 [0,2,0,0,0,0|1,1,0]=4 9321 B16R2.4062 Cc1ccccc1Sc2ccncc2F 62a_100000047030_100000210755 [0,2,0,0,0,0|1,1,0]=4 9322 B16R2.4062 Cc1ccccc1Sc2ccncc2F 62a_100000210755_100000047030 [0,2,0,0,0,0|1,1,0]=4 9323 B16R2.4062 Cc1ccccc1Sc2ccncc2N 62a_100000210755_100000756074 [0,2,0,0,0,0|1,1,0]=4 9324 B16R2.4062 Cc1ccccc1Sc2ccncc2N 62a_100000756074_100000210755 [0,2,0,0,0,0|1,1,0]=4 9325 B16R2.4062 Cc1ccccc1Sc2ccncc2O 62a_100000210755_100009817591 [0,2,0,0,0,0|1,1,0]=4 9326 B16R2.4062 Cc1ccccc1Sc2ccncc2O 62a_100009817591_100000210755 [0,2,0,0,0,0|1,1,0]=4 9327 B16R2.4062 Cc1ccccc1Sc2cnccc2Br 62a_100000210755_100010138639 [0,2,0,0,0,0|1,1,0]=4 9328 B16R2.4062 Cc1ccccc1Sc2cnccc2Br 62a_100010138639_100000210755 [0,2,0,0,0,0|1,1,0]=4 9329 B16R2.4062 Cc1ccccc1Sc2cnccc2C 62a_100000210755_100000761580 [0,2,0,0,0,0|1,1,0]=4 9330 B16R2.4062 Cc1ccccc1Sc2cnccc2C 62a_100000761580_100000210755 [0,2,0,0,0,0|1,1,0]=4 9331 B16R2.4062 Cc1ccccc1Sc2cnccc2Cl 62a_100000210755_100009995489 [0,2,0,0,0,0|1,1,0]=4 9332 B16R2.4062 Cc1ccccc1Sc2cnccc2Cl 62a_100009995489_100000210755 [0,2,0,0,0,0|1,1,0]=4 9333 B16R2.4062 Cc1ccccc1Sc2cnccc2F 62a_100000210755_100009820683 [0,2,0,0,0,0|1,1,0]=4 9334 B16R2.4062 Cc1ccccc1Sc2cnccc2F 62a_100009820683_100000210755 [0,2,0,0,0,0|1,1,0]=4 9335 B16R2.4062 Cc1ccccc1Sc2cnccc2N 62a_100000047001_100000210755 [0,2,0,0,0,0|1,1,0]=4 9336 B16R2.4062 Cc1ccccc1Sc2cnccc2N 62a_100000210755_100000047001 [0,2,0,0,0,0|1,1,0]=4 9337 B16R2.4062 Cc1ccccc1Sc2ncccc2Br 62a_100000210755_100000696092 [0,2,0,0,0,0|1,1,0]=4 9338 B16R2.4062 Cc1ccccc1Sc2ncccc2Br 62a_100000696092_100000210755 [0,2,0,0,0,0|1,1,0]=4 9339 B16R2.4062 Cc1ccccc1Sc2ncccc2C 62a_100000210755_100000751373 [0,2,0,0,0,0|1,1,0]=4 9340 B16R2.4062 Cc1ccccc1Sc2ncccc2C 62a_100000751373_100000210755 [0,2,0,0,0,0|1,1,0]=4 9341 B16R2.4062 Cc1ccccc1Sc2ncccc2Cl 62a_100000210755_100011356963 [0,2,0,0,0,0|1,1,0]=4 9342 B16R2.4062 Cc1ccccc1Sc2ncccc2Cl 62a_100011356963_100000210755 [0,2,0,0,0,0|1,1,0]=4 9343 B16R2.4062 Cc1ccccc1Sc2ncccc2F 62a_100000210755_100000685392 [0,2,0,0,0,0|1,1,0]=4 9344 B16R2.4062 Cc1ccccc1Sc2ncccc2F 62a_100000685392_100000210755 [0,2,0,0,0,0|1,1,0]=4 9345 B16R2.4062 Cc1ccccc1Sc2ncccc2N 62a_100000210755_100000688686 [0,2,0,0,0,0|1,1,0]=4 9346 B16R2.4062 Cc1ccccc1Sc2ncccc2N 62a_100000688686_100000210755 [0,2,0,0,0,0|1,1,0]=4 9347 B16R2.4062 Cc1ccccc1Sc2ncccc2O 62a_100000034122_100000210755 [0,2,0,0,0,0|1,1,0]=4 9348 B16R2.4062 Cc1ccccc1Sc2ncccc2O 62a_100000210755_100000034122 [0,2,0,0,0,0|1,1,0]=4 9349 B16R2.4062 Cc1cccnc1Sc2ccccc2Br 62a_100000695589_100000751373 [0,2,0,0,0,0|1,1,0]=4 9350 B16R2.4062 Cc1cccnc1Sc2ccccc2Br 62a_100000751373_100000695589 [0,2,0,0,0,0|1,1,0]=4 9351 B16R2.4062 Cc1cccnc1Sc2ccccc2Cl 62a_100000751373_100000764095 [0,2,0,0,0,0|1,1,0]=4 9352 B16R2.4062 Cc1cccnc1Sc2ccccc2Cl 62a_100000764095_100000751373 [0,2,0,0,0,0|1,1,0]=4 9353 B16R2.4062 Cc1cccnc1Sc2ccccc2F 62a_100000751373_100011215700 [0,2,0,0,0,0|1,1,0]=4 9354 B16R2.4062 Cc1cccnc1Sc2ccccc2F 62a_100011215700_100000751373 [0,2,0,0,0,0|1,1,0]=4 9355 B16R2.4062 Cc1cccnc1Sc2ccccc2N 62a_100000210017_100000751373 [0,2,0,0,0,0|1,1,0]=4 9356 B16R2.4062 Cc1cccnc1Sc2ccccc2N 62a_100000751373_100000210017 [0,2,0,0,0,0|1,1,0]=4 9357 B16R2.4062 Cc1cccnc1Sc2ccccc2O 62a_100000739446_100000751373 [0,2,0,0,0,0|1,1,0]=4 9358 B16R2.4062 Cc1cccnc1Sc2ccccc2O 62a_100000751373_100000739446 [0,2,0,0,0,0|1,1,0]=4 9359 B16R2.4062 Cc1ccncc1Sc2ccccc2Br 62a_100000695589_100000761580 [0,2,0,0,0,0|1,1,0]=4 9360 B16R2.4062 Cc1ccncc1Sc2ccccc2Br 62a_100000761580_100000695589 [0,2,0,0,0,0|1,1,0]=4 9361 B16R2.4062 Cc1ccncc1Sc2ccccc2Cl 62a_100000761580_100000764095 [0,2,0,0,0,0|1,1,0]=4 9362 B16R2.4062 Cc1ccncc1Sc2ccccc2Cl 62a_100000764095_100000761580 [0,2,0,0,0,0|1,1,0]=4 9363 B16R2.4062 Cc1ccncc1Sc2ccccc2F 62a_100000761580_100011215700 [0,2,0,0,0,0|1,1,0]=4 9364 B16R2.4062 Cc1ccncc1Sc2ccccc2F 62a_100011215700_100000761580 [0,2,0,0,0,0|1,1,0]=4 9365 B16R2.4062 Cc1ccncc1Sc2ccccc2N 62a_100000210017_100000761580 [0,2,0,0,0,0|1,1,0]=4 9366 B16R2.4062 Cc1ccncc1Sc2ccccc2N 62a_100000761580_100000210017 [0,2,0,0,0,0|1,1,0]=4 9367 B16R2.4062 Cc1ccncc1Sc2ccccc2O 62a_100000739446_100000761580 [0,2,0,0,0,0|1,1,0]=4 9368 B16R2.4062 Cc1ccncc1Sc2ccccc2O 62a_100000761580_100000739446 [0,2,0,0,0,0|1,1,0]=4 9369 B16R2.4062 Cc1cnccc1Nc2ccccc2Cl 27a_100000185783_100000765111 [0,2,0,0,0,0|2,0,0]=4 9370 B16R2.4062 Cc1cnccc1Nc2ccccc2F 27a_100000210422_100000765111 [0,2,0,0,0,0|2,0,0]=4 9371 B16R2.4062 Cc1cnccc1Nc2ccccc2I 27a_100000210053_100000765111 [0,2,0,0,0,0|2,0,0]=4 9372 B16R2.4062 Cc1cnccc1Nc2ccccc2O 27a_100000185747_100000765111 [0,2,0,0,0,0|2,0,0]=4 9373 B16R2.4062 Cc1cnccc1Sc2ccccc2Br 62a_100000695589_100000765111 [0,2,0,0,0,0|1,1,0]=4 9374 B16R2.4062 Cc1cnccc1Sc2ccccc2Br 62a_100000765111_100000695589 [0,2,0,0,0,0|1,1,0]=4 9375 B16R2.4062 Cc1cnccc1Sc2ccccc2Cl 62a_100000764095_100000765111 [0,2,0,0,0,0|1,1,0]=4 9376 B16R2.4062 Cc1cnccc1Sc2ccccc2Cl 62a_100000765111_100000764095 [0,2,0,0,0,0|1,1,0]=4 9377 B16R2.4062 Cc1cnccc1Sc2ccccc2F 62a_100000765111_100011215700 [0,2,0,0,0,0|1,1,0]=4 9378 B16R2.4062 Cc1cnccc1Sc2ccccc2F 62a_100011215700_100000765111 [0,2,0,0,0,0|1,1,0]=4 9379 B16R2.4062 Cc1cnccc1Sc2ccccc2N 62a_100000210017_100000765111 [0,2,0,0,0,0|1,1,0]=4 9380 B16R2.4062 Cc1cnccc1Sc2ccccc2N 62a_100000765111_100000210017 [0,2,0,0,0,0|1,1,0]=4 9381 B16R2.4062 Cc1cnccc1Sc2ccccc2O 62a_100000739446_100000765111 [0,2,0,0,0,0|1,1,0]=4 9382 B16R2.4062 Cc1cnccc1Sc2ccccc2O 62a_100000765111_100000739446 [0,2,0,0,0,0|1,1,0]=4 9383 B16R2.4062 Cc1ncccc1Sc2ccccc2Br 62a_100000695589_100000751574 [0,2,0,0,0,0|1,1,0]=4 9384 B16R2.4062 Cc1ncccc1Sc2ccccc2Br 62a_100000751574_100000695589 [0,2,0,0,0,0|1,1,0]=4 9385 B16R2.4062 Cc1ncccc1Sc2ccccc2Cl 62a_100000751574_100000764095 [0,2,0,0,0,0|1,1,0]=4 9386 B16R2.4062 Cc1ncccc1Sc2ccccc2Cl 62a_100000764095_100000751574 [0,2,0,0,0,0|1,1,0]=4 9387 B16R2.4062 Cc1ncccc1Sc2ccccc2F 62a_100000751574_100011215700 [0,2,0,0,0,0|1,1,0]=4 9388 B16R2.4062 Cc1ncccc1Sc2ccccc2F 62a_100011215700_100000751574 [0,2,0,0,0,0|1,1,0]=4 9389 B16R2.4062 Cc1ncccc1Sc2ccccc2N 62a_100000210017_100000751574 [0,2,0,0,0,0|1,1,0]=4 9390 B16R2.4062 Cc1ncccc1Sc2ccccc2N 62a_100000751574_100000210017 [0,2,0,0,0,0|1,1,0]=4 9391 B16R2.4062 Cc1ncccc1Sc2ccccc2O 62a_100000739446_100000751574 [0,2,0,0,0,0|1,1,0]=4 9392 B16R2.4062 Cc1ncccc1Sc2ccccc2O 62a_100000751574_100000739446 [0,2,0,0,0,0|1,1,0]=4 9393 B16R2.4062 Clc1ccccc1Nc2ccncc2Br 27a_100000185783_100000726257 [0,2,0,0,0,0|2,0,0]=4 9394 B16R2.4062 Clc1ccccc1Nc2ncccc2Br 27a_100000185783_100000696092 [0,2,0,0,0,0|2,0,0]=4 9395 B16R2.4062 Clc1ccccc1Sc2ccccc2Br 62a_100000695589_100000764095 [0,2,0,0,0,0|0,1,0]=3 9396 B16R2.4062 Clc1ccccc1Sc2ccccc2Br 62a_100000764095_100000695589 [0,2,0,0,0,0|0,1,0]=3 9397 B16R2.4062 Clc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000764095 [0,2,0,0,0,0|0,1,0]=3 9398 B16R2.4062 Clc1ccccc1Sc2cccnc2Br 62a_100000764095_100010202626 [0,2,0,0,0,0|1,1,0]=4 9399 B16R2.4062 Clc1ccccc1Sc2cccnc2Br 62a_100010202626_100000764095 [0,2,0,0,0,0|1,1,0]=4 9400 B16R2.4062 Clc1ccccc1Sc2cccnc2Cl 62a_100000036424_100000764095 [0,2,0,0,0,0|1,1,0]=4 9401 B16R2.4062 Clc1ccccc1Sc2cccnc2Cl 62a_100000764095_100000036424 [0,2,0,0,0,0|1,1,0]=4 9402 B16R2.4062 Clc1ccccc1Sc2ccncc2Br 62a_100000726257_100000764095 [0,2,0,0,0,0|1,1,0]=4 9403 B16R2.4062 Clc1ccccc1Sc2ccncc2Br 62a_100000764095_100000726257 [0,2,0,0,0,0|1,1,0]=4 9404 B16R2.4062 Clc1ccccc1Sc2ccncc2Cl 62a_100000708259_100000764095 [0,2,0,0,0,0|1,1,0]=4 9405 B16R2.4062 Clc1ccccc1Sc2ccncc2Cl 62a_100000764095_100000708259 [0,2,0,0,0,0|1,1,0]=4 9406 B16R2.4062 Clc1ccccc1Sc2cnccc2Br 62a_100000764095_100010138639 [0,2,0,0,0,0|1,1,0]=4 9407 B16R2.4062 Clc1ccccc1Sc2cnccc2Br 62a_100010138639_100000764095 [0,2,0,0,0,0|1,1,0]=4 9408 B16R2.4062 Clc1ccccc1Sc2cnccc2Cl 62a_100000764095_100009995489 [0,2,0,0,0,0|1,1,0]=4 9409 B16R2.4062 Clc1ccccc1Sc2cnccc2Cl 62a_100009995489_100000764095 [0,2,0,0,0,0|1,1,0]=4 9410 B16R2.4062 Clc1ccccc1Sc2ncccc2Br 62a_100000696092_100000764095 [0,2,0,0,0,0|1,1,0]=4 9411 B16R2.4062 Clc1ccccc1Sc2ncccc2Br 62a_100000764095_100000696092 [0,2,0,0,0,0|1,1,0]=4 9412 B16R2.4062 Clc1ccccc1Sc2ncccc2Cl 62a_100000764095_100011356963 [0,2,0,0,0,0|1,1,0]=4 9413 B16R2.4062 Clc1ccccc1Sc2ncccc2Cl 62a_100011356963_100000764095 [0,2,0,0,0,0|1,1,0]=4 9414 B16R2.4062 Clc1cccnc1Sc2ccccc2Br 62a_100000695589_100011356963 [0,2,0,0,0,0|1,1,0]=4 9415 B16R2.4062 Clc1cccnc1Sc2ccccc2Br 62a_100011356963_100000695589 [0,2,0,0,0,0|1,1,0]=4 9416 B16R2.4062 Clc1ccncc1Sc2ccccc2Br 62a_100000695589_100009995489 [0,2,0,0,0,0|1,1,0]=4 9417 B16R2.4062 Clc1ccncc1Sc2ccccc2Br 62a_100009995489_100000695589 [0,2,0,0,0,0|1,1,0]=4 9418 B16R2.4062 Clc1cnccc1Sc2ccccc2Br 62a_100000695589_100000708259 [0,2,0,0,0,0|1,1,0]=4 9419 B16R2.4062 Clc1cnccc1Sc2ccccc2Br 62a_100000708259_100000695589 [0,2,0,0,0,0|1,1,0]=4 9420 B16R2.4062 Clc1ncccc1Sc2ccccc2Br 62a_100000036424_100000695589 [0,2,0,0,0,0|1,1,0]=4 9421 B16R2.4062 Clc1ncccc1Sc2ccccc2Br 62a_100000695589_100000036424 [0,2,0,0,0,0|1,1,0]=4 9422 B16R2.4062 Fc1ccccc1Nc2ccncc2Br 27a_100000210422_100000726257 [0,2,0,0,0,0|2,0,0]=4 9423 B16R2.4062 Fc1ccccc1Nc2ccncc2F 27a_100000210422_100000035921 [0,2,0,0,0,0|2,0,0]=4 9424 B16R2.4062 Fc1ccccc1Nc2ncccc2Br 27a_100000210422_100000696092 [0,2,0,0,0,0|2,0,0]=4 9425 B16R2.4062 Fc1ccccc1Sc2c[nH]ccc2=S 62a_100011215700_200012280681 [0,2,0,0,0,0|1,1,0]=4 9426 B16R2.4062 Fc1ccccc1Sc2c[nH]ccc2=S 62a_200012280681_100011215700 [0,2,0,0,0,0|1,1,0]=4 9427 B16R2.4062 Fc1ccccc1Sc2ccccc2Br 62a_100000695589_100011215700 [0,2,0,0,0,0|0,1,0]=3 9428 B16R2.4062 Fc1ccccc1Sc2ccccc2Br 62a_100011215700_100000695589 [0,2,0,0,0,0|0,1,0]=3 9429 B16R2.4062 Fc1ccccc1Sc2ccccc2Cl 62a_100000764095_100011215700 [0,2,0,0,0,0|0,1,0]=3 9430 B16R2.4062 Fc1ccccc1Sc2ccccc2Cl 62a_100011215700_100000764095 [0,2,0,0,0,0|0,1,0]=3 9431 B16R2.4062 Fc1ccccc1Sc2ccccc2F 62a_100011215700_100011215700 [0,2,0,0,0,0|0,1,0]=3 9432 B16R2.4062 Fc1ccccc1Sc2cccnc2Br 62a_100010202626_100011215700 [0,2,0,0,0,0|1,1,0]=4 9433 B16R2.4062 Fc1ccccc1Sc2cccnc2Br 62a_100011215700_100010202626 [0,2,0,0,0,0|1,1,0]=4 9434 B16R2.4062 Fc1ccccc1Sc2cccnc2Cl 62a_100000036424_100011215700 [0,2,0,0,0,0|1,1,0]=4 9435 B16R2.4062 Fc1ccccc1Sc2cccnc2Cl 62a_100011215700_100000036424 [0,2,0,0,0,0|1,1,0]=4 9436 B16R2.4062 Fc1ccccc1Sc2cccnc2F 62a_100009816115_100011215700 [0,2,0,0,0,0|1,1,0]=4 9437 B16R2.4062 Fc1ccccc1Sc2cccnc2F 62a_100011215700_100009816115 [0,2,0,0,0,0|1,1,0]=4 9438 B16R2.4062 Fc1ccccc1Sc2ccncc2Br 62a_100000726257_100011215700 [0,2,0,0,0,0|1,1,0]=4 9439 B16R2.4062 Fc1ccccc1Sc2ccncc2Br 62a_100011215700_100000726257 [0,2,0,0,0,0|1,1,0]=4 9440 B16R2.4062 Fc1ccccc1Sc2ccncc2Cl 62a_100000708259_100011215700 [0,2,0,0,0,0|1,1,0]=4 9441 B16R2.4062 Fc1ccccc1Sc2ccncc2Cl 62a_100011215700_100000708259 [0,2,0,0,0,0|1,1,0]=4 9442 B16R2.4062 Fc1ccccc1Sc2ccncc2F 62a_100000047030_100011215700 [0,2,0,0,0,0|1,1,0]=4 9443 B16R2.4062 Fc1ccccc1Sc2ccncc2F 62a_100011215700_100000047030 [0,2,0,0,0,0|1,1,0]=4 9444 B16R2.4062 Fc1ccccc1Sc2cnccc2Br 62a_100010138639_100011215700 [0,2,0,0,0,0|1,1,0]=4 9445 B16R2.4062 Fc1ccccc1Sc2cnccc2Br 62a_100011215700_100010138639 [0,2,0,0,0,0|1,1,0]=4 9446 B16R2.4062 Fc1ccccc1Sc2cnccc2Cl 62a_100009995489_100011215700 [0,2,0,0,0,0|1,1,0]=4 9447 B16R2.4062 Fc1ccccc1Sc2cnccc2Cl 62a_100011215700_100009995489 [0,2,0,0,0,0|1,1,0]=4 9448 B16R2.4062 Fc1ccccc1Sc2cnccc2F 62a_100009820683_100011215700 [0,2,0,0,0,0|1,1,0]=4 9449 B16R2.4062 Fc1ccccc1Sc2cnccc2F 62a_100011215700_100009820683 [0,2,0,0,0,0|1,1,0]=4 9450 B16R2.4062 Fc1ccccc1Sc2ncccc2Br 62a_100000696092_100011215700 [0,2,0,0,0,0|1,1,0]=4 9451 B16R2.4062 Fc1ccccc1Sc2ncccc2Br 62a_100011215700_100000696092 [0,2,0,0,0,0|1,1,0]=4 9452 B16R2.4062 Fc1ccccc1Sc2ncccc2Cl 62a_100011215700_100011356963 [0,2,0,0,0,0|1,1,0]=4 9453 B16R2.4062 Fc1ccccc1Sc2ncccc2Cl 62a_100011356963_100011215700 [0,2,0,0,0,0|1,1,0]=4 9454 B16R2.4062 Fc1ccccc1Sc2ncccc2F 62a_100000685392_100011215700 [0,2,0,0,0,0|1,1,0]=4 9455 B16R2.4062 Fc1ccccc1Sc2ncccc2F 62a_100011215700_100000685392 [0,2,0,0,0,0|1,1,0]=4 9456 B16R2.4062 Fc1cccnc1Sc2ccccc2Br 62a_100000685392_100000695589 [0,2,0,0,0,0|1,1,0]=4 9457 B16R2.4062 Fc1cccnc1Sc2ccccc2Br 62a_100000695589_100000685392 [0,2,0,0,0,0|1,1,0]=4 9458 B16R2.4062 Fc1cccnc1Sc2ccccc2Cl 62a_100000685392_100000764095 [0,2,0,0,0,0|1,1,0]=4 9459 B16R2.4062 Fc1cccnc1Sc2ccccc2Cl 62a_100000764095_100000685392 [0,2,0,0,0,0|1,1,0]=4 9460 B16R2.4062 Fc1ccncc1Sc2ccccc2Br 62a_100000695589_100009820683 [0,2,0,0,0,0|1,1,0]=4 9461 B16R2.4062 Fc1ccncc1Sc2ccccc2Br 62a_100009820683_100000695589 [0,2,0,0,0,0|1,1,0]=4 9462 B16R2.4062 Fc1ccncc1Sc2ccccc2Cl 62a_100000764095_100009820683 [0,2,0,0,0,0|1,1,0]=4 9463 B16R2.4062 Fc1ccncc1Sc2ccccc2Cl 62a_100009820683_100000764095 [0,2,0,0,0,0|1,1,0]=4 9464 B16R2.4062 Fc1cnccc1Nc2ccccc2Cl 27a_100000185783_100000035921 [0,2,0,0,0,0|2,0,0]=4 9465 B16R2.4062 Fc1cnccc1Nc2ccccc2I 27a_100000210053_100000035921 [0,2,0,0,0,0|2,0,0]=4 9466 B16R2.4062 Fc1cnccc1Sc2ccccc2Br 62a_100000047030_100000695589 [0,2,0,0,0,0|1,1,0]=4 9467 B16R2.4062 Fc1cnccc1Sc2ccccc2Br 62a_100000695589_100000047030 [0,2,0,0,0,0|1,1,0]=4 9468 B16R2.4062 Fc1cnccc1Sc2ccccc2Cl 62a_100000047030_100000764095 [0,2,0,0,0,0|1,1,0]=4 9469 B16R2.4062 Fc1cnccc1Sc2ccccc2Cl 62a_100000764095_100000047030 [0,2,0,0,0,0|1,1,0]=4 9470 B16R2.4062 Fc1ncccc1Sc2ccccc2Br 62a_100000695589_100009816115 [0,2,0,0,0,0|1,1,0]=4 9471 B16R2.4062 Fc1ncccc1Sc2ccccc2Br 62a_100009816115_100000695589 [0,2,0,0,0,0|1,1,0]=4 9472 B16R2.4062 Fc1ncccc1Sc2ccccc2Cl 62a_100000764095_100009816115 [0,2,0,0,0,0|1,1,0]=4 9473 B16R2.4062 Fc1ncccc1Sc2ccccc2Cl 62a_100009816115_100000764095 [0,2,0,0,0,0|1,1,0]=4 9474 B16R2.4062 Nc1ccccc1Sc2c[nH]ccc2=O 62a_100000210017_100009998708 [0,2,0,0,0,0|1,1,0]=4 9475 B16R2.4062 Nc1ccccc1Sc2c[nH]ccc2=O 62a_100009998708_100000210017 [0,2,0,0,0,0|1,1,0]=4 9476 B16R2.4062 Nc1ccccc1Sc2c[nH]ccc2=S 62a_100000210017_200012280681 [0,2,0,0,0,0|1,1,0]=4 9477 B16R2.4062 Nc1ccccc1Sc2c[nH]ccc2=S 62a_200012280681_100000210017 [0,2,0,0,0,0|1,1,0]=4 9478 B16R2.4062 Nc1ccccc1Sc2cccc[n+]2[O-] 62a_100000210017_200000042595 [0,2,0,0,0,0|1,1,0]=4 9479 B16R2.4062 Nc1ccccc1Sc2ccccc2Br 62a_100000210017_100000695589 [0,2,0,0,0,0|0,1,0]=3 9480 B16R2.4062 Nc1ccccc1Sc2ccccc2Br 62a_100000695589_100000210017 [0,2,0,0,0,0|0,1,0]=3 9481 B16R2.4062 Nc1ccccc1Sc2ccccc2Cl 62a_100000210017_100000764095 [0,2,0,0,0,0|0,1,0]=3 9482 B16R2.4062 Nc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000210017 [0,2,0,0,0,0|0,1,0]=3 9483 B16R2.4062 Nc1ccccc1Sc2ccccc2F 62a_100000210017_100011215700 [0,2,0,0,0,0|0,1,0]=3 9484 B16R2.4062 Nc1ccccc1Sc2ccccc2F 62a_100011215700_100000210017 [0,2,0,0,0,0|0,1,0]=3 9485 B16R2.4062 Nc1ccccc1Sc2ccccc2N 62a_100000210017_100000210017 [0,2,0,0,0,0|0,1,0]=3 9486 B16R2.4062 Nc1ccccc1Sc2ccccc2O 62a_100000210017_100000739446 [0,2,0,0,0,0|0,1,0]=3 9487 B16R2.4062 Nc1ccccc1Sc2ccccc2O 62a_100000739446_100000210017 [0,2,0,0,0,0|0,1,0]=3 9488 B16R2.4062 Nc1ccccc1Sc2cccnc2Br 62a_100000210017_100010202626 [0,2,0,0,0,0|1,1,0]=4 9489 B16R2.4062 Nc1ccccc1Sc2cccnc2Br 62a_100010202626_100000210017 [0,2,0,0,0,0|1,1,0]=4 9490 B16R2.4062 Nc1ccccc1Sc2cccnc2Cl 62a_100000036424_100000210017 [0,2,0,0,0,0|1,1,0]=4 9491 B16R2.4062 Nc1ccccc1Sc2cccnc2Cl 62a_100000210017_100000036424 [0,2,0,0,0,0|1,1,0]=4 9492 B16R2.4062 Nc1ccccc1Sc2cccnc2F 62a_100000210017_100009816115 [0,2,0,0,0,0|1,1,0]=4 9493 B16R2.4062 Nc1ccccc1Sc2cccnc2F 62a_100009816115_100000210017 [0,2,0,0,0,0|1,1,0]=4 9494 B16R2.4062 Nc1ccccc1Sc2cccnc2N 62a_100000045569_100000210017 [0,2,0,0,0,0|1,1,0]=4 9495 B16R2.4062 Nc1ccccc1Sc2cccnc2N 62a_100000210017_100000045569 [0,2,0,0,0,0|1,1,0]=4 9496 B16R2.4062 Nc1ccccc1Sc2cccnc2O 62a_100000210017_100000760158 [0,2,0,0,0,0|1,1,0]=4 9497 B16R2.4062 Nc1ccccc1Sc2cccnc2O 62a_100000760158_100000210017 [0,2,0,0,0,0|1,1,0]=4 9498 B16R2.4062 Nc1ccccc1Sc2ccncc2Br 62a_100000210017_100000726257 [0,2,0,0,0,0|1,1,0]=4 9499 B16R2.4062 Nc1ccccc1Sc2ccncc2Br 62a_100000726257_100000210017 [0,2,0,0,0,0|1,1,0]=4 9500 B16R2.4062 Nc1ccccc1Sc2ccncc2Cl 62a_100000210017_100000708259 [0,2,0,0,0,0|1,1,0]=4 9501 B16R2.4062 Nc1ccccc1Sc2ccncc2Cl 62a_100000708259_100000210017 [0,2,0,0,0,0|1,1,0]=4 9502 B16R2.4062 Nc1ccccc1Sc2ccncc2F 62a_100000047030_100000210017 [0,2,0,0,0,0|1,1,0]=4 9503 B16R2.4062 Nc1ccccc1Sc2ccncc2F 62a_100000210017_100000047030 [0,2,0,0,0,0|1,1,0]=4 9504 B16R2.4062 Nc1ccccc1Sc2ccncc2N 62a_100000210017_100000756074 [0,2,0,0,0,0|1,1,0]=4 9505 B16R2.4062 Nc1ccccc1Sc2ccncc2N 62a_100000756074_100000210017 [0,2,0,0,0,0|1,1,0]=4 9506 B16R2.4062 Nc1ccccc1Sc2ccncc2O 62a_100000210017_100009817591 [0,2,0,0,0,0|1,1,0]=4 9507 B16R2.4062 Nc1ccccc1Sc2ccncc2O 62a_100009817591_100000210017 [0,2,0,0,0,0|1,1,0]=4 9508 B16R2.4062 Nc1ccccc1Sc2cnccc2Br 62a_100000210017_100010138639 [0,2,0,0,0,0|1,1,0]=4 9509 B16R2.4062 Nc1ccccc1Sc2cnccc2Br 62a_100010138639_100000210017 [0,2,0,0,0,0|1,1,0]=4 9510 B16R2.4062 Nc1ccccc1Sc2cnccc2Cl 62a_100000210017_100009995489 [0,2,0,0,0,0|1,1,0]=4 9511 B16R2.4062 Nc1ccccc1Sc2cnccc2Cl 62a_100009995489_100000210017 [0,2,0,0,0,0|1,1,0]=4 9512 B16R2.4062 Nc1ccccc1Sc2cnccc2F 62a_100000210017_100009820683 [0,2,0,0,0,0|1,1,0]=4 9513 B16R2.4062 Nc1ccccc1Sc2cnccc2F 62a_100009820683_100000210017 [0,2,0,0,0,0|1,1,0]=4 9514 B16R2.4062 Nc1ccccc1Sc2cnccc2N 62a_100000047001_100000210017 [0,2,0,0,0,0|1,1,0]=4 9515 B16R2.4062 Nc1ccccc1Sc2cnccc2N 62a_100000210017_100000047001 [0,2,0,0,0,0|1,1,0]=4 9516 B16R2.4062 Nc1ccccc1Sc2ncccc2Br 62a_100000210017_100000696092 [0,2,0,0,0,0|1,1,0]=4 9517 B16R2.4062 Nc1ccccc1Sc2ncccc2Br 62a_100000696092_100000210017 [0,2,0,0,0,0|1,1,0]=4 9518 B16R2.4062 Nc1ccccc1Sc2ncccc2Cl 62a_100000210017_100011356963 [0,2,0,0,0,0|1,1,0]=4 9519 B16R2.4062 Nc1ccccc1Sc2ncccc2Cl 62a_100011356963_100000210017 [0,2,0,0,0,0|1,1,0]=4 9520 B16R2.4062 Nc1ccccc1Sc2ncccc2F 62a_100000210017_100000685392 [0,2,0,0,0,0|1,1,0]=4 9521 B16R2.4062 Nc1ccccc1Sc2ncccc2F 62a_100000685392_100000210017 [0,2,0,0,0,0|1,1,0]=4 9522 B16R2.4062 Nc1ccccc1Sc2ncccc2N 62a_100000210017_100000688686 [0,2,0,0,0,0|1,1,0]=4 9523 B16R2.4062 Nc1ccccc1Sc2ncccc2N 62a_100000688686_100000210017 [0,2,0,0,0,0|1,1,0]=4 9524 B16R2.4062 Nc1ccccc1Sc2ncccc2O 62a_100000034122_100000210017 [0,2,0,0,0,0|1,1,0]=4 9525 B16R2.4062 Nc1ccccc1Sc2ncccc2O 62a_100000210017_100000034122 [0,2,0,0,0,0|1,1,0]=4 9526 B16R2.4062 Nc1cccnc1Sc2ccccc2Br 62a_100000688686_100000695589 [0,2,0,0,0,0|1,1,0]=4 9527 B16R2.4062 Nc1cccnc1Sc2ccccc2Br 62a_100000695589_100000688686 [0,2,0,0,0,0|1,1,0]=4 9528 B16R2.4062 Nc1cccnc1Sc2ccccc2Cl 62a_100000688686_100000764095 [0,2,0,0,0,0|1,1,0]=4 9529 B16R2.4062 Nc1cccnc1Sc2ccccc2Cl 62a_100000764095_100000688686 [0,2,0,0,0,0|1,1,0]=4 9530 B16R2.4062 Nc1cccnc1Sc2ccccc2F 62a_100000688686_100011215700 [0,2,0,0,0,0|1,1,0]=4 9531 B16R2.4062 Nc1cccnc1Sc2ccccc2F 62a_100011215700_100000688686 [0,2,0,0,0,0|1,1,0]=4 9532 B16R2.4062 Nc1cccnc1Sc2ccccc2O 62a_100000688686_100000739446 [0,2,0,0,0,0|1,1,0]=4 9533 B16R2.4062 Nc1cccnc1Sc2ccccc2O 62a_100000739446_100000688686 [0,2,0,0,0,0|1,1,0]=4 9534 B16R2.4062 Nc1ccncc1Sc2ccccc2Br 62a_100000047001_100000695589 [0,2,0,0,0,0|1,1,0]=4 9535 B16R2.4062 Nc1ccncc1Sc2ccccc2Br 62a_100000695589_100000047001 [0,2,0,0,0,0|1,1,0]=4 9536 B16R2.4062 Nc1ccncc1Sc2ccccc2Cl 62a_100000047001_100000764095 [0,2,0,0,0,0|1,1,0]=4 9537 B16R2.4062 Nc1ccncc1Sc2ccccc2Cl 62a_100000764095_100000047001 [0,2,0,0,0,0|1,1,0]=4 9538 B16R2.4062 Nc1ccncc1Sc2ccccc2F 62a_100000047001_100011215700 [0,2,0,0,0,0|1,1,0]=4 9539 B16R2.4062 Nc1ccncc1Sc2ccccc2F 62a_100011215700_100000047001 [0,2,0,0,0,0|1,1,0]=4 9540 B16R2.4062 Nc1ccncc1Sc2ccccc2O 62a_100000047001_100000739446 [0,2,0,0,0,0|1,1,0]=4 9541 B16R2.4062 Nc1ccncc1Sc2ccccc2O 62a_100000739446_100000047001 [0,2,0,0,0,0|1,1,0]=4 9542 B16R2.4062 Nc1cnccc1Sc2ccccc2Br 62a_100000695589_100000756074 [0,2,0,0,0,0|1,1,0]=4 9543 B16R2.4062 Nc1cnccc1Sc2ccccc2Br 62a_100000756074_100000695589 [0,2,0,0,0,0|1,1,0]=4 9544 B16R2.4062 Nc1cnccc1Sc2ccccc2Cl 62a_100000756074_100000764095 [0,2,0,0,0,0|1,1,0]=4 9545 B16R2.4062 Nc1cnccc1Sc2ccccc2Cl 62a_100000764095_100000756074 [0,2,0,0,0,0|1,1,0]=4 9546 B16R2.4062 Nc1cnccc1Sc2ccccc2F 62a_100000756074_100011215700 [0,2,0,0,0,0|1,1,0]=4 9547 B16R2.4062 Nc1cnccc1Sc2ccccc2F 62a_100011215700_100000756074 [0,2,0,0,0,0|1,1,0]=4 9548 B16R2.4062 Nc1cnccc1Sc2ccccc2O 62a_100000739446_100000756074 [0,2,0,0,0,0|1,1,0]=4 9549 B16R2.4062 Nc1cnccc1Sc2ccccc2O 62a_100000756074_100000739446 [0,2,0,0,0,0|1,1,0]=4 9550 B16R2.4062 Nc1ncccc1Sc2ccccc2Br 62a_100000045569_100000695589 [0,2,0,0,0,0|1,1,0]=4 9551 B16R2.4062 Nc1ncccc1Sc2ccccc2Br 62a_100000695589_100000045569 [0,2,0,0,0,0|1,1,0]=4 9552 B16R2.4062 Nc1ncccc1Sc2ccccc2Cl 62a_100000045569_100000764095 [0,2,0,0,0,0|1,1,0]=4 9553 B16R2.4062 Nc1ncccc1Sc2ccccc2Cl 62a_100000764095_100000045569 [0,2,0,0,0,0|1,1,0]=4 9554 B16R2.4062 Nc1ncccc1Sc2ccccc2F 62a_100000045569_100011215700 [0,2,0,0,0,0|1,1,0]=4 9555 B16R2.4062 Nc1ncccc1Sc2ccccc2F 62a_100011215700_100000045569 [0,2,0,0,0,0|1,1,0]=4 9556 B16R2.4062 Nc1ncccc1Sc2ccccc2O 62a_100000045569_100000739446 [0,2,0,0,0,0|1,1,0]=4 9557 B16R2.4062 Nc1ncccc1Sc2ccccc2O 62a_100000739446_100000045569 [0,2,0,0,0,0|1,1,0]=4 9558 B16R2.4062 O=c1cc[nH]cc1Sc2ccccc2Br 62a_100000695589_100009998708 [0,2,0,0,0,0|1,1,0]=4 9559 B16R2.4062 O=c1cc[nH]cc1Sc2ccccc2Br 62a_100009998708_100000695589 [0,2,0,0,0,0|1,1,0]=4 9560 B16R2.4062 O=c1cc[nH]cc1Sc2ccccc2Cl 62a_100000764095_100009998708 [0,2,0,0,0,0|1,1,0]=4 9561 B16R2.4062 O=c1cc[nH]cc1Sc2ccccc2Cl 62a_100009998708_100000764095 [0,2,0,0,0,0|1,1,0]=4 9562 B16R2.4062 O=c1cc[nH]cc1Sc2ccccc2F 62a_100009998708_100011215700 [0,2,0,0,0,0|1,1,0]=4 9563 B16R2.4062 O=c1cc[nH]cc1Sc2ccccc2F 62a_100011215700_100009998708 [0,2,0,0,0,0|1,1,0]=4 9564 B16R2.4062 O=c1cc[nH]cc1Sc2ccccc2O 62a_100000739446_100009998708 [0,2,0,0,0,0|1,1,0]=4 9565 B16R2.4062 O=c1cc[nH]cc1Sc2ccccc2O 62a_100009998708_100000739446 [0,2,0,0,0,0|1,1,0]=4 9566 B16R2.4062 Oc1ccccc1Nc2ccncc2Br 27a_100000185747_100000726257 [0,2,0,0,0,0|2,0,0]=4 9567 B16R2.4062 Oc1ccccc1Nc2ccncc2F 27a_100000185747_100000035921 [0,2,0,0,0,0|2,0,0]=4 9568 B16R2.4062 Oc1ccccc1Nc2ncccc2Br 27a_100000185747_100000696092 [0,2,0,0,0,0|2,0,0]=4 9569 B16R2.4062 Oc1ccccc1Sc2c[nH]ccc2=S 62a_100000739446_200012280681 [0,2,0,0,0,0|1,1,0]=4 9570 B16R2.4062 Oc1ccccc1Sc2c[nH]ccc2=S 62a_200012280681_100000739446 [0,2,0,0,0,0|1,1,0]=4 9571 B16R2.4062 Oc1ccccc1Sc2ccccc2Br 62a_100000695589_100000739446 [0,2,0,0,0,0|0,1,0]=3 9572 B16R2.4062 Oc1ccccc1Sc2ccccc2Br 62a_100000739446_100000695589 [0,2,0,0,0,0|0,1,0]=3 9573 B16R2.4062 Oc1ccccc1Sc2ccccc2Cl 62a_100000739446_100000764095 [0,2,0,0,0,0|0,1,0]=3 9574 B16R2.4062 Oc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000739446 [0,2,0,0,0,0|0,1,0]=3 9575 B16R2.4062 Oc1ccccc1Sc2ccccc2F 62a_100000739446_100011215700 [0,2,0,0,0,0|0,1,0]=3 9576 B16R2.4062 Oc1ccccc1Sc2ccccc2F 62a_100011215700_100000739446 [0,2,0,0,0,0|0,1,0]=3 9577 B16R2.4062 Oc1ccccc1Sc2ccccc2O 62a_100000739446_100000739446 [0,2,0,0,0,0|0,1,0]=3 9578 B16R2.4062 Oc1ccccc1Sc2cccnc2Br 62a_100000739446_100010202626 [0,2,0,0,0,0|1,1,0]=4 9579 B16R2.4062 Oc1ccccc1Sc2cccnc2Br 62a_100010202626_100000739446 [0,2,0,0,0,0|1,1,0]=4 9580 B16R2.4062 Oc1ccccc1Sc2cccnc2Cl 62a_100000036424_100000739446 [0,2,0,0,0,0|1,1,0]=4 9581 B16R2.4062 Oc1ccccc1Sc2cccnc2Cl 62a_100000739446_100000036424 [0,2,0,0,0,0|1,1,0]=4 9582 B16R2.4062 Oc1ccccc1Sc2cccnc2F 62a_100000739446_100009816115 [0,2,0,0,0,0|1,1,0]=4 9583 B16R2.4062 Oc1ccccc1Sc2cccnc2F 62a_100009816115_100000739446 [0,2,0,0,0,0|1,1,0]=4 9584 B16R2.4062 Oc1ccccc1Sc2cccnc2O 62a_100000739446_100000760158 [0,2,0,0,0,0|1,1,0]=4 9585 B16R2.4062 Oc1ccccc1Sc2cccnc2O 62a_100000760158_100000739446 [0,2,0,0,0,0|1,1,0]=4 9586 B16R2.4062 Oc1ccccc1Sc2ccncc2Br 62a_100000726257_100000739446 [0,2,0,0,0,0|1,1,0]=4 9587 B16R2.4062 Oc1ccccc1Sc2ccncc2Br 62a_100000739446_100000726257 [0,2,0,0,0,0|1,1,0]=4 9588 B16R2.4062 Oc1ccccc1Sc2ccncc2Cl 62a_100000708259_100000739446 [0,2,0,0,0,0|1,1,0]=4 9589 B16R2.4062 Oc1ccccc1Sc2ccncc2Cl 62a_100000739446_100000708259 [0,2,0,0,0,0|1,1,0]=4 9590 B16R2.4062 Oc1ccccc1Sc2ccncc2F 62a_100000047030_100000739446 [0,2,0,0,0,0|1,1,0]=4 9591 B16R2.4062 Oc1ccccc1Sc2ccncc2F 62a_100000739446_100000047030 [0,2,0,0,0,0|1,1,0]=4 9592 B16R2.4062 Oc1ccccc1Sc2ccncc2O 62a_100000739446_100009817591 [0,2,0,0,0,0|1,1,0]=4 9593 B16R2.4062 Oc1ccccc1Sc2ccncc2O 62a_100009817591_100000739446 [0,2,0,0,0,0|1,1,0]=4 9594 B16R2.4062 Oc1ccccc1Sc2cnccc2Br 62a_100000739446_100010138639 [0,2,0,0,0,0|1,1,0]=4 9595 B16R2.4062 Oc1ccccc1Sc2cnccc2Br 62a_100010138639_100000739446 [0,2,0,0,0,0|1,1,0]=4 9596 B16R2.4062 Oc1ccccc1Sc2cnccc2Cl 62a_100000739446_100009995489 [0,2,0,0,0,0|1,1,0]=4 9597 B16R2.4062 Oc1ccccc1Sc2cnccc2Cl 62a_100009995489_100000739446 [0,2,0,0,0,0|1,1,0]=4 9598 B16R2.4062 Oc1ccccc1Sc2cnccc2F 62a_100000739446_100009820683 [0,2,0,0,0,0|1,1,0]=4 9599 B16R2.4062 Oc1ccccc1Sc2cnccc2F 62a_100009820683_100000739446 [0,2,0,0,0,0|1,1,0]=4 9600 B16R2.4062 Oc1ccccc1Sc2ncccc2Br 62a_100000696092_100000739446 [0,2,0,0,0,0|1,1,0]=4 9601 B16R2.4062 Oc1ccccc1Sc2ncccc2Br 62a_100000739446_100000696092 [0,2,0,0,0,0|1,1,0]=4 9602 B16R2.4062 Oc1ccccc1Sc2ncccc2Cl 62a_100000739446_100011356963 [0,2,0,0,0,0|1,1,0]=4 9603 B16R2.4062 Oc1ccccc1Sc2ncccc2Cl 62a_100011356963_100000739446 [0,2,0,0,0,0|1,1,0]=4 9604 B16R2.4062 Oc1ccccc1Sc2ncccc2F 62a_100000685392_100000739446 [0,2,0,0,0,0|1,1,0]=4 9605 B16R2.4062 Oc1ccccc1Sc2ncccc2F 62a_100000739446_100000685392 [0,2,0,0,0,0|1,1,0]=4 9606 B16R2.4062 Oc1ccccc1Sc2ncccc2O 62a_100000034122_100000739446 [0,2,0,0,0,0|1,1,0]=4 9607 B16R2.4062 Oc1ccccc1Sc2ncccc2O 62a_100000739446_100000034122 [0,2,0,0,0,0|1,1,0]=4 9608 B16R2.4062 Oc1cccnc1Sc2ccccc2Br 62a_100000034122_100000695589 [0,2,0,0,0,0|1,1,0]=4 9609 B16R2.4062 Oc1cccnc1Sc2ccccc2Br 62a_100000695589_100000034122 [0,2,0,0,0,0|1,1,0]=4 9610 B16R2.4062 Oc1cccnc1Sc2ccccc2Cl 62a_100000034122_100000764095 [0,2,0,0,0,0|1,1,0]=4 9611 B16R2.4062 Oc1cccnc1Sc2ccccc2Cl 62a_100000764095_100000034122 [0,2,0,0,0,0|1,1,0]=4 9612 B16R2.4062 Oc1cccnc1Sc2ccccc2F 62a_100000034122_100011215700 [0,2,0,0,0,0|1,1,0]=4 9613 B16R2.4062 Oc1cccnc1Sc2ccccc2F 62a_100011215700_100000034122 [0,2,0,0,0,0|1,1,0]=4 9614 B16R2.4062 Oc1cnccc1Sc2ccccc2Br 62a_100000695589_100009817591 [0,2,0,0,0,0|1,1,0]=4 9615 B16R2.4062 Oc1cnccc1Sc2ccccc2Br 62a_100009817591_100000695589 [0,2,0,0,0,0|1,1,0]=4 9616 B16R2.4062 Oc1cnccc1Sc2ccccc2Cl 62a_100000764095_100009817591 [0,2,0,0,0,0|1,1,0]=4 9617 B16R2.4062 Oc1cnccc1Sc2ccccc2Cl 62a_100009817591_100000764095 [0,2,0,0,0,0|1,1,0]=4 9618 B16R2.4062 Oc1cnccc1Sc2ccccc2F 62a_100009817591_100011215700 [0,2,0,0,0,0|1,1,0]=4 9619 B16R2.4062 Oc1cnccc1Sc2ccccc2F 62a_100011215700_100009817591 [0,2,0,0,0,0|1,1,0]=4 9620 B16R2.4062 Oc1ncccc1Sc2ccccc2Br 62a_100000695589_100000760158 [0,2,0,0,0,0|1,1,0]=4 9621 B16R2.4062 Oc1ncccc1Sc2ccccc2Br 62a_100000760158_100000695589 [0,2,0,0,0,0|1,1,0]=4 9622 B16R2.4062 Oc1ncccc1Sc2ccccc2Cl 62a_100000760158_100000764095 [0,2,0,0,0,0|1,1,0]=4 9623 B16R2.4062 Oc1ncccc1Sc2ccccc2Cl 62a_100000764095_100000760158 [0,2,0,0,0,0|1,1,0]=4 9624 B16R2.4062 Oc1ncccc1Sc2ccccc2F 62a_100000760158_100011215700 [0,2,0,0,0,0|1,1,0]=4 9625 B16R2.4062 Oc1ncccc1Sc2ccccc2F 62a_100011215700_100000760158 [0,2,0,0,0,0|1,1,0]=4 9626 B16R2.4062 S=c1cc[nH]cc1Sc2ccccc2Br 62a_100000695589_200012280681 [0,2,0,0,0,0|1,1,0]=4 9627 B16R2.4062 S=c1cc[nH]cc1Sc2ccccc2Br 62a_200012280681_100000695589 [0,2,0,0,0,0|1,1,0]=4 9628 B16R2.4062 S=c1cc[nH]cc1Sc2ccccc2Cl 62a_100000764095_200012280681 [0,2,0,0,0,0|1,1,0]=4 9629 B16R2.4062 S=c1cc[nH]cc1Sc2ccccc2Cl 62a_200012280681_100000764095 [0,2,0,0,0,0|1,1,0]=4 9630 B16R2.4062 [O-][n+]1ccccc1Sc2ccccc2Br 62a_100000695589_200000042595 [0,2,0,0,0,0|1,1,0]=4 9631 B16R2.4062 [O-][n+]1ccccc1Sc2ccccc2Cl 62a_100000764095_200000042595 [0,2,0,0,0,0|1,1,0]=4 9632 B16R2.4062 [O-][n+]1ccccc1Sc2ccccc2F 62a_100011215700_200000042595 [0,2,0,0,0,0|1,1,0]=4 9633 B16R2.4062 [O-][n+]1ccccc1Sc2ccccc2O 62a_100000739446_200000042595 [0,2,0,0,0,0|1,1,0]=4 9634 B16R2.187 CNC(c1ccccc1)c2ccccc2 2230a_100000162943_200000210301 [0,2,0,0,0,0|1,0,0]=3 9635 B16R2.187 CNC(c1ccccc1)c2ccccc2 2230a_106832991635_100000211591 [0,2,0,0,0,0|1,0,0]=3 9636 B16R2.187 CNC(c1ccccc1)c2ccccc2 270004a_106832991635_100000210122 [0,2,0,0,0,0|1,0,0]=3 9637 B16R2.187 CNC(c1ccccc1)c2ccccc2 34a_100000162943_200000210301 [0,2,0,0,0,0|1,0,0]=3 9638 B16R2.187 CNC(c1ccccc1)c2ccccc2 7a_106832991635_100011216954 [0,2,0,0,0,0|1,0,0]=3 9639 B16R2.187 CNC(c1ccccc1)c2ccccn2 2230a_100000689936_200000210301 [0,2,0,0,0,0|2,0,0]=4 9640 B16R2.187 CNC(c1ccccc1)c2ccccn2 270004a_106832991635_100000210380 [0,2,0,0,0,0|2,0,0]=4 9641 B16R2.187 CNC(c1ccccc1)c2cccnc2 2230a_100011232609_200000210301 [0,2,0,0,0,0|2,0,0]=4 9642 B16R2.187 CNC(c1ccccc1)c2cccnc2 270004a_106832991635_100000735413 [0,2,0,0,0,0|2,0,0]=4 9643 B16R2.187 CNC(c1ccccc1)c2ccncc2 2230a_100025760769_200000210301 [0,2,0,0,0,0|2,0,0]=4 9644 B16R2.187 COC(c1ccccc1)c2ccccc2 34a_100000211180_200000210301 [0,2,0,0,0,0|1,0,0]=3 9645 B16R2.187 COC(c1ccccc1)c2ccccc2 7a_100000211180_200000210301 [0,2,0,0,0,0|1,0,0]=3 9646 B16R2.187 COC(c1ccccc1)c2ccccn2 7a_100000180852_200000210301 [0,2,0,0,0,0|2,0,0]=4 9647 B16R2.187 CSC(c1ccccc1)c2ccccc2 62a_100000211591_200000210301 [0,2,0,0,0,0|1,0,0]=3 9648 B16R2.187 CSC(c1ccccc1)c2ccccc2 62a_200000210301_100011216954 [0,2,0,0,0,0|1,0,0]=3 9649 B16R2.187 [13CH3]NC(c1ccccc1)c2ccccc2 2230a_100000162943_200025704644 [0,2,0,0,0,0|1,0,0]=3 9650 B16R2.187 [13CH3]NC(c1ccccc1)c2ccccc2 34a_100000162943_200025704644 [0,2,0,0,0,0|1,0,0]=3 9651 B16R2.187 [13CH3]NC(c1ccccc1)c2ccccn2 2230a_100000689936_200025704644 [0,2,0,0,0,0|2,0,0]=4 9652 B16R2.187 [13CH3]NC(c1ccccc1)c2cccnc2 2230a_100011232609_200025704644 [0,2,0,0,0,0|2,0,0]=4 9653 B16R2.187 [13CH3]NC(c1ccccc1)c2ccncc2 2230a_100025760769_200025704644 [0,2,0,0,0,0|2,0,0]=4 9654 B16R2.187 [13CH3]OC(c1ccccc1)c2ccccc2 34a_100000211180_200025704644 [0,2,0,0,0,0|1,0,0]=3 9655 B16R2.187 [13CH3]OC(c1ccccc1)c2ccccc2 7a_100000211180_200025704644 [0,2,0,0,0,0|1,0,0]=3 9656 B16R2.187 [13CH3]OC(c1ccccc1)c2ccccn2 7a_100000180852_200025704644 [0,2,0,0,0,0|2,0,0]=4 9657 B16R2.187 [13CH3]SC(c1ccccc1)c2ccccc2 62a_100000211591_200025704644 [0,2,0,0,0,0|1,0,0]=3 9658 B16R2.187 [13CH3]SC(c1ccccc1)c2ccccc2 62a_200025704644_100011216954 [0,2,0,0,0,0|1,0,0]=3 9659 B14R2.3 C=CCSc1coc2c1cccc2 62a_100000210623_100009812202 [0,0,1,1,0,0|1,0,1]=4 9660 B14R2.14 C=Cc1ccnn1c2ccccc2 271570a_100011290941_100011001034 [0,0,1,1,0,0|2,0,0]=4 9661 B14R2.101 C(=Cc1ccco1)c2ccccc2 271570a_100102527694_100009814098 [0,0,1,1,0,0|2,0,0]=4 9662 B14R2.101 C(=Cc1cccs1)c2ccccc2 271570a_100102527694_100011215356 [0,0,1,1,0,0|2,0,0]=4 9663 B14R2.101 C(=Cc1ccoc1)c2ccccc2 271570a_100102527694_100011215275 [0,0,1,1,0,0|2,0,0]=4 9664 B14R2.101 C(=Cc1ccsc1)c2ccccc2 271570a_100102527694_100000738268 [0,0,1,1,0,0|2,0,0]=4 9665 B14R2.101 c1ccc(cc1)OCc2ccsc2 34a_100000210340_100011261437 [0,0,1,1,0,0|1,0,1]=4 9666 B14R2.101 c1ccc(cc1)OCc2ccsc2 7a_100000210340_100011261437 [0,0,1,1,0,0|1,0,1]=4 9667 B14R2.7150 C=C=Cc1cccc2c1cccc2 271570a_100015277604_100000210605 [0,0,1,1,0,0|1,0,1]=4 9668 B14R2.7150 C=C=Cc1ccnc2c1cccc2 271570a_100015277604_100011215880 [0,0,1,1,0,0|1,0,1]=4 9669 B14R2.7150 CC=Cc1cccc2c1cccc2 271570a_100016259895_100000210605 [0,0,1,1,0,0|1,0,1]=4 9670 B14R2.7150 CC=Cc1ccnc2c1cccc2 271570a_100016259895_100011215880 [0,0,1,1,0,0|1,0,1]=4 9671 B14R2.67 C=CCSc1cc2ccccc2o1 62a_100000210623_100010159458 [0,0,1,1,0,0|1,0,1]=4 9672 B14R2.517 C=C=Cc1c(oc2c1cccc2)C 271570a_100015277604_200010236113 [0,0,1,1,0,0|0,0,2]=4 9673 B14R2.517 CC=Cc1c(oc2c1cccc2)C 271570a_100016259895_200010236113 [0,0,1,1,0,0|0,0,2]=4 9674 B14R2.1146 C=Cc1cc(=O)[nH]c2c1cccc2 271570a_100011290941_100000075698 [0,0,1,1,0,0|2,0,0]=4 9675 B14R2.1146 C=Cc1cc(cc2c1cccc2)N 271570a_100011290941_100010089974 [0,0,1,1,0,0|2,0,0]=4 9676 B14R2.1146 C=Cc1cc(cc2c1cccc2)O 271570a_100011290941_100010001680 [0,0,1,1,0,0|2,0,0]=4 9677 B14R2.1146 C=Cc1cc(nc2c1cccc2)C 271570a_100011290941_100000764982 [0,0,1,1,0,0|1,0,1]=4 9678 B14R2.112 C=C=Cc1ccc2ccccc2c1 271570a_100015277604_100000233703 [0,0,1,1,0,0|1,0,1]=4 9679 B14R2.112 C=C=Cc1ccc2ccccc2n1 271570a_100015277604_100011291633 [0,0,1,1,0,0|1,0,1]=4 9680 B14R2.112 CC=Cc1ccc2ccccc2c1 271570a_100016259895_100000233703 [0,0,1,1,0,0|1,0,1]=4 9681 B14R2.112 CC=Cc1ccc2ccccc2n1 271570a_100016259895_100011291633 [0,0,1,1,0,0|1,0,1]=4 9682 B14R2.1019 C=Cc1cc(=O)c2ccccc2[nH]1 271570a_100011290941_100000090176 [0,0,1,1,0,0|2,0,0]=4 9683 B14R2.1019 C=Cc1cc(c2ccccc2c1)N 271570a_100011290941_100010171453 [0,0,1,1,0,0|2,0,0]=4 9684 B14R2.1019 C=Cc1cc(c2ccccc2c1)O 271570a_100011290941_100010089979 [0,0,1,1,0,0|2,0,0]=4 9685 B14R2.1019 C=Cc1cc(c2ccccc2n1)C 271570a_100011290941_100012354972 [0,0,1,1,0,0|1,0,1]=4 9686 B14R2.1019 C=Cc1cc(c2ccccc2n1)N 271570a_100011290941_100010197925 [0,0,1,1,0,0|2,0,0]=4 9687 B14R2.1129 C=Cc1c(sc2c1cccc2)C=O 271570a_100011290941_100009816528 [0,0,1,1,0,0|1,1,0]=4 9688 B16R3.2583 Oc1ccc2[nH]c3ccccc3c2c1 271570a_203496583355_100011220005 [0,1,0,1,0,0|1,0,0]=3 9689 B16R3.2583 Oc1ccc2[nH]c3ncccc3c2c1 271570a_203496583355_200103153866 [0,1,0,1,0,0|2,0,0]=4 9690 B16R3.2583 Oc1ccc2oc3ccccc3c2c1 271570a_203496583355_100000731244 [0,1,0,1,0,0|0,0,0]=2 9691 B16R3.2583 Oc1ccc2sc3ccccc3c2c1 271570a_203496583355_100009827798 [0,1,0,1,0,0|0,1,0]=3 9692 B16R3.2583 Oc1cnc2[nH]c3ccccc3c2c1 271570a_203496583355_100160480879 [0,1,0,1,0,0|2,0,0]=4 9693 B16R3.2637 Oc1ccc-2c(c1)Cc3c2cccc3 271570a_203496583355_100009813320 [0,1,0,1,0,0|1,0,0]=3 9694 B16R3.2637 Oc1ccc2c(c1)[nH]c3c2cccc3 271570a_203496583355_100010206880 [0,1,0,1,0,0|1,0,0]=3 9695 B16R3.2637 Oc1ccc2c(c1)[nH]c3c2cncc3 271570a_203496583355_100102525256 [0,1,0,1,0,0|2,0,0]=4 9696 B16R3.2637 Oc1ccc2c(c1)oc3c2cccc3 271570a_203496583355_100012357422 [0,1,0,1,0,0|0,0,0]=2 9697 B16R3.2637 Oc1ccc2c(c1)sc3c2cccc3 271570a_203496583355_100010234584 [0,1,0,1,0,0|0,1,0]=3 9698 B16R3.27838 Oc1cccc2c1c3c([nH]2)cccc3 271570a_203496583355_100010159384 [0,1,0,1,0,0|1,0,0]=3 9699 B16R3.27838 Oc1cccc2c1c3c([nH]2)ccnc3 271570a_203496583355_200037665351 [0,1,0,1,0,0|2,0,0]=4 9700 B16R3.27838 Oc1cccc2c1c3c(o2)cccc3 271570a_203496583355_100010743613 [0,1,0,1,0,0|0,0,0]=2 9701 B16R3.27838 Oc1cccc2c1c3c(s2)cccc3 271570a_203496583355_100010159529 [0,1,0,1,0,0|0,1,0]=3 9702 B16R3.3329 Oc1cccc2c1[nH]c3c2cccc3 271570a_203496583355_100010159381 [0,1,0,1,0,0|1,0,0]=3 9703 B16R3.3329 Oc1cccc2c1oc3c2cccc3 271570a_203496583355_100009831572 [0,1,0,1,0,0|0,0,0]=2 9704 B16R3.3329 Oc1cccc2c1sc3c2cccc3 271570a_203496583355_100009993974 [0,1,0,1,0,0|0,1,0]=3 9705 B16R3.3329 Oc1nccc2c1[nH]c3c2cccc3 271570a_203496583355_100010159298 [0,1,0,1,0,0|2,0,0]=4 9706 B16R3.3329 Oc1ncnc2c1oc3c2cccc3 271570a_203496583355_100000010260 [0,1,0,1,0,0|2,0,0]=4 9707 B12R2.2 c1cc(ccn1)c2cc[nH]c2 271570a_100000102155_100000035832 [0,0,0,0,2,0|2,0,0]=4 9708 B12R2.2 c1cc(ccn1)c2ccoc2 271570a_100000752145_100011215275 [0,0,0,0,2,0|2,0,0]=4 9709 B12R2.2 c1cc(ccn1)c2ccoc2 271570a_100011218838_100000035832 [0,0,0,0,2,0|2,0,0]=4 9710 B12R2.2 c1cc(ccn1)c2ccsc2 271570a_100000752145_100000738268 [0,0,0,0,2,0|2,0,0]=4 9711 B12R2.2 c1cc(ccn1)c2ccsc2 271570a_100011934443_100000035832 [0,0,0,0,2,0|2,0,0]=4 9712 B12R2.2 c1ccc(cc1)c2c[nH]cn2 271570a_100011218836_100000756875 [0,0,0,0,2,0|2,0,0]=4 9713 B12R2.2 c1ccc(cc1)c2cc[nH]c2 271570a_100000102155_100000210277 [0,0,0,0,2,0|1,0,0]=3 9714 B12R2.2 c1ccc(cc1)c2cc[nH]n2 271570a_100000062414_100000210277 [0,0,0,0,2,0|2,0,0]=4 9715 B12R2.2 c1ccc(cc1)c2cc[nH]n2 271570a_100011218836_100000062575 [0,0,0,0,2,0|2,0,0]=4 9716 B12R2.2 c1ccc(cc1)c2ccco2 271570a_100000750936_100000210277 [0,0,0,0,2,0|1,0,0]=3 9717 B12R2.2 c1ccc(cc1)c2ccco2 271570a_100011218836_100009814098 [0,0,0,0,2,0|1,0,0]=3 9718 B12R2.2 c1ccc(cc1)c2cccs2 271570a_100000742291_100000210277 [0,0,0,0,2,0|1,0,0]=3 9719 B12R2.2 c1ccc(cc1)c2cccs2 271570a_100011218836_100011215356 [0,0,0,0,2,0|1,0,0]=3 9720 B12R2.2 c1ccc(cc1)c2ccoc2 271570a_100011218836_100011215275 [0,0,0,0,2,0|1,0,0]=3 9721 B12R2.2 c1ccc(cc1)c2ccoc2 271570a_100011218838_100000210277 [0,0,0,0,2,0|1,0,0]=3 9722 B12R2.2 c1ccc(cc1)c2ccsc2 271570a_100011218836_100000738268 [0,0,0,0,2,0|1,0,0]=3 9723 B12R2.2 c1ccc(cc1)c2ccsc2 271570a_100011934443_100000210277 [0,0,0,0,2,0|1,0,0]=3 9724 B12R2.2 c1ccc(cc1)c2ccsn2 271570a_100011218836_100009818082 [0,0,0,0,2,0|2,0,0]=4 9725 B12R2.2 c1ccc(cc1)c2cn[nH]c2 271570a_100000041997_100000210277 [0,0,0,0,2,0|2,0,0]=4 9726 B12R2.2 c1ccc(cc1)c2cn[nH]c2 271570a_100011218836_100000238712 [0,0,0,0,2,0|2,0,0]=4 9727 B12R2.2 c1ccc(cc1)c2cnco2 271570a_100011218836_100020591547 [0,0,0,0,2,0|2,0,0]=4 9728 B12R2.2 c1ccc(cc1)c2cncs2 271570a_100010231675_100000210277 [0,0,0,0,2,0|2,0,0]=4 9729 B12R2.2 c1ccc(cc1)c2cncs2 271570a_100011218836_100011934649 [0,0,0,0,2,0|2,0,0]=4 9730 B12R2.2 c1ccc(cc1)c2cnoc2 271570a_100011218836_100009815712 [0,0,0,0,2,0|2,0,0]=4 9731 B12R2.2 c1ccc(cc1)c2cnsc2 271570a_100011218836_100009815736 [0,0,0,0,2,0|2,0,0]=4 9732 B12R2.2 c1ccc(cc1)c2cscn2 271570a_100011218836_100000751502 [0,0,0,0,2,0|2,0,0]=4 9733 B12R2.2 c1ccc(cc1)c2ncc[nH]2 271570a_100011218836_100025796157 [0,0,0,0,2,0|2,0,0]=4 9734 B12R2.2 c1ccc(cc1)c2ncc[nH]2 271570a_100016988920_100000210277 [0,0,0,0,2,0|2,0,0]=4 9735 B12R2.2 c1ccc(cc1)c2ncco2 271570a_100011218836_100011787736 [0,0,0,0,2,0|2,0,0]=4 9736 B12R2.2 c1ccc(cc1)c2nccs2 271570a_100011218836_100000211983 [0,0,0,0,2,0|2,0,0]=4 9737 B12R2.2 c1ccc(nc1)c2cc[nH]c2 271570a_100000102155_100011216584 [0,0,0,0,2,0|2,0,0]=4 9738 B12R2.2 c1ccc(nc1)c2ccco2 271570a_100000750936_100011216584 [0,0,0,0,2,0|2,0,0]=4 9739 B12R2.2 c1ccc(nc1)c2ccco2 271570a_100011264011_100009814098 [0,0,0,0,2,0|2,0,0]=4 9740 B12R2.2 c1ccc(nc1)c2cccs2 271570a_100000742291_100011216584 [0,0,0,0,2,0|2,0,0]=4 9741 B12R2.2 c1ccc(nc1)c2cccs2 271570a_100011264011_100011215356 [0,0,0,0,2,0|2,0,0]=4 9742 B12R2.2 c1ccc(nc1)c2ccoc2 271570a_100011218838_100011216584 [0,0,0,0,2,0|2,0,0]=4 9743 B12R2.2 c1ccc(nc1)c2ccoc2 271570a_100011264011_100011215275 [0,0,0,0,2,0|2,0,0]=4 9744 B12R2.2 c1ccc(nc1)c2ccsc2 271570a_100011264011_100000738268 [0,0,0,0,2,0|2,0,0]=4 9745 B12R2.2 c1ccc(nc1)c2ccsc2 271570a_100011934443_100011216584 [0,0,0,0,2,0|2,0,0]=4 9746 B12R2.2 c1cncc(c1)c2cc[nH]c2 271570a_100000102155_100000752921 [0,0,0,0,2,0|2,0,0]=4 9747 B12R2.2 c1cncc(c1)c2ccco2 271570a_100000750936_100000752921 [0,0,0,0,2,0|2,0,0]=4 9748 B12R2.2 c1cncc(c1)c2ccco2 271570a_100000757648_100009814098 [0,0,0,0,2,0|2,0,0]=4 9749 B12R2.2 c1cncc(c1)c2cccs2 271570a_100000742291_100000752921 [0,0,0,0,2,0|2,0,0]=4 9750 B12R2.2 c1cncc(c1)c2cccs2 271570a_100000757648_100011215356 [0,0,0,0,2,0|2,0,0]=4 9751 B12R2.2 c1cncc(c1)c2ccoc2 271570a_100000757648_100011215275 [0,0,0,0,2,0|2,0,0]=4 9752 B12R2.2 c1cncc(c1)c2ccoc2 271570a_100011218838_100000752921 [0,0,0,0,2,0|2,0,0]=4 9753 B12R2.2 c1cncc(c1)c2ccsc2 271570a_100000757648_100000738268 [0,0,0,0,2,0|2,0,0]=4 9754 B12R2.2 c1cncc(c1)c2ccsc2 271570a_100011934443_100000752921 [0,0,0,0,2,0|2,0,0]=4 9755 B12R2.2 c1coc(c1)c2ccncc2 271570a_100000750936_100000035832 [0,0,0,0,2,0|2,0,0]=4 9756 B12R2.2 c1coc(c1)c2ccncc2 271570a_100000752145_100009814098 [0,0,0,0,2,0|2,0,0]=4 9757 B12R2.2 c1csc(c1)c2ccncc2 271570a_100000742291_100000035832 [0,0,0,0,2,0|2,0,0]=4 9758 B12R2.2 c1csc(c1)c2ccncc2 271570a_100000752145_100011215356 [0,0,0,0,2,0|2,0,0]=4 9759 B14R1.979 C=CCC(C=C)OCc1ccccc1 34a_100000038011_100015291786 [0,0,1,0,0,1|0,0,2]=4 9760 B14R1.979 C=CCC(C=C)OCc1ccccc1 7a_100000038011_100000211182 [0,0,1,0,0,1|0,0,2]=4 9761 B16R2.2256 C(=Cc1ccccc1)Cc2ccccc2 271570a_200016263579_100000210277 [0,0,0,0,0,2|1,0,0]=3 9762 B16R2.2256 C(=Cc1ccccn1)Cc2ccccc2 271570a_200016263579_100011216584 [0,0,0,0,0,2|2,0,0]=4 9763 B16R2.2256 C(=Cc1cccnc1)Cc2ccccc2 271570a_200016263579_100000752921 [0,0,0,0,0,2|2,0,0]=4 9764 B16R2.2256 C(=Cc1ccncc1)Cc2ccccc2 271570a_200016263579_100000035832 [0,0,0,0,0,2|2,0,0]=4 9765 B16R2.2256 C(=NNc1ccccc1)c2ccccc2 4a_100015195140_100015611070 [0,0,0,0,0,2|1,0,0]=3 9766 B16R2.2256 C(=NNc1ccccc1)c2ccccn2 4a_100015195140_100000209966 [0,0,0,0,0,2|2,0,0]=4 9767 B16R2.2256 C(=NNc1ccccc1)c2cccnc2 4a_100015195140_100000209961 [0,0,0,0,0,2|2,0,0]=4 9768 B16R2.2256 C(=NNc1ccccc1)c2ccncc2 4a_100015195140_100000186114 [0,0,0,0,0,2|2,0,0]=4 9769 B16R2.2256 C(=NNc1ccccn1)c2ccccc2 4a_100000183288_100015611070 [0,0,0,0,0,2|2,0,0]=4 9770 B16R2.2256 C(=NNc1cccnc1)c2ccccc2 4a_100000728903_100015611070 [0,0,0,0,0,2|2,0,0]=4 9771 B16R2.2256 C(=NNc1ccncc1)c2ccccc2 4a_100000698918_100015611070 [0,0,0,0,0,2|2,0,0]=4 9772 B16R2.2256 c1ccc(cc1)CCNc2ccccc2 34a_100000106764_100000765856 [0,0,0,0,0,2|1,0,0]=3 9773 B16R2.2256 c1ccc(cc1)CCOc2ccccc2 34a_100000210340_100000765856 [0,0,0,0,0,2|0,0,0]=2 9774 B16R2.2256 c1ccc(cc1)CCOc2ccccc2 7a_100000210340_100000765856 [0,0,0,0,0,2|0,0,0]=2 9775 B16R2.2256 c1ccc(cc1)CCOc2cccnc2 34a_100000210849_100000765856 [0,0,0,0,0,2|1,0,0]=3 9776 B16R2.2256 c1ccc(cc1)CCOc2cccnc2 7a_100000210849_100000765856 [0,0,0,0,0,2|1,0,0]=3 9777 B16R2.2256 c1ccc(cc1)CCOc2ccncc2 34a_100000212176_100000765856 [0,0,0,0,0,2|1,0,0]=3 9778 B16R2.2256 c1ccc(cc1)CCOc2ccnnc2 34a_100015204005_100000765856 [0,0,0,0,0,2|2,0,0]=4 9779 B16R2.2256 c1ccc(cc1)CCOc2cncnc2 7a_100000754086_100000765856 [0,0,0,0,0,2|2,0,0]=4 9780 B16R2.2256 c1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011218657 [0,0,0,0,0,2|0,1,0]=3 9781 B16R2.2256 c1ccc(cc1)CCSc2ccccc2 62a_100000765856_100000041952 [0,0,0,0,0,2|0,1,0]=3 9782 B16R2.2256 c1ccc(cc1)CCSc2ccccn2 62a_100000765856_100011216584 [0,0,0,0,0,2|1,1,0]=4 9783 B16R2.2256 c1ccc(cc1)CCSc2ccccn2 62a_100011216584_100011218657 [0,0,0,0,0,2|1,1,0]=4 9784 B16R2.2256 c1ccc(cc1)CCSc2cccnc2 62a_100000210063_100011218657 [0,0,0,0,0,2|1,1,0]=4 9785 B16R2.2256 c1ccc(cc1)CCSc2cccnc2 62a_100000765856_100000210063 [0,0,0,0,0,2|1,1,0]=4 9786 B16R2.2256 c1ccc(cc1)CCSc2ccncc2 62a_100000728582_100011218657 [0,0,0,0,0,2|1,1,0]=4 9787 B16R2.2256 c1ccc(cc1)CCSc2ccncc2 62a_100000765856_100000728582 [0,0,0,0,0,2|1,1,0]=4 9788 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 207a_100015324214_100015611070 [0,0,0,0,0,2|1,0,0]=3 9789 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100015291786 [0,0,0,0,0,2|1,0,0]=3 9790 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100015611070 [0,0,0,0,0,2|1,0,0]=3 9791 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 34a_100015324214_100015291786 [0,0,0,0,0,2|1,0,0]=3 9792 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 207a_100015324214_100000209966 [0,0,0,0,0,2|2,0,0]=4 9793 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 2230a_100015324214_100000721315 [0,0,0,0,0,2|2,0,0]=4 9794 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100015611070 [0,0,0,0,0,2|2,0,0]=4 9795 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 270004a_100015324214_100000209966 [0,0,0,0,0,2|2,0,0]=4 9796 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 34a_100015324214_100000721315 [0,0,0,0,0,2|2,0,0]=4 9797 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 207a_100000210453_100015611070 [0,0,0,0,0,2|2,0,0]=4 9798 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 207a_100015324214_100000209961 [0,0,0,0,0,2|2,0,0]=4 9799 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 2230a_100015324214_100000741622 [0,0,0,0,0,2|2,0,0]=4 9800 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100015611070 [0,0,0,0,0,2|2,0,0]=4 9801 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 270004a_100015324214_100000209961 [0,0,0,0,0,2|2,0,0]=4 9802 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 34a_100015324214_100000733263 [0,0,0,0,0,2|2,0,0]=4 9803 B16R2.2256 c1ccc(cc1)CNCc2ccncc2 207a_100015324214_100000186114 [0,0,0,0,0,2|2,0,0]=4 9804 B16R2.2256 c1ccc(cc1)CNCc2ccncc2 2230a_100015324214_100015193705 [0,0,0,0,0,2|2,0,0]=4 9805 B16R2.2256 c1ccc(cc1)COCc2ccccc2 34a_100000210790_100015291786 [0,0,0,0,0,2|0,0,0]=2 9806 B16R2.2256 c1ccc(cc1)COCc2ccccc2 7a_100000210790_100000211182 [0,0,0,0,0,2|0,0,0]=2 9807 B16R2.2256 c1ccc(cc1)COCc2ccccn2 34a_100000210790_100000721315 [0,0,0,0,0,2|1,0,0]=3 9808 B16R2.2256 c1ccc(cc1)COCc2ccccn2 7a_100000210790_100000721315 [0,0,0,0,0,2|1,0,0]=3 9809 B16R2.2256 c1ccc(cc1)COCc2cccnc2 34a_100000210790_100000733263 [0,0,0,0,0,2|1,0,0]=3 9810 B16R2.2256 c1ccc(cc1)COCc2cccnc2 7a_100000210790_100000741622 [0,0,0,0,0,2|1,0,0]=3 9811 B16R2.2256 c1ccc(cc1)COCc2cccnn2 34a_100000210790_100016990269 [0,0,0,0,0,2|2,0,0]=4 9812 B16R2.2256 c1ccc(cc1)COCc2cccnn2 7a_100000210790_100016990269 [0,0,0,0,0,2|2,0,0]=4 9813 B16R2.2256 c1ccc(cc1)COCc2ccncc2 7a_100000210790_100015193705 [0,0,0,0,0,2|1,0,0]=3 9814 B16R2.2256 c1ccc(cc1)COCc2cnccn2 34a_100000210790_100016995436 [0,0,0,0,0,2|2,0,0]=4 9815 B16R2.2256 c1ccc(cc1)COCc2cnccn2 7a_100000210790_100016995436 [0,0,0,0,0,2|2,0,0]=4 9816 B16R2.2256 c1ccc(cc1)COCc2cncnc2 34a_100000210790_100015196519 [0,0,0,0,0,2|2,0,0]=4 9817 B16R2.2256 c1ccc(cc1)COCc2cncnc2 7a_100000210790_100015196519 [0,0,0,0,0,2|2,0,0]=4 9818 B16R2.2256 c1ccc(cc1)COCc2ncccn2 34a_100000210790_100000703007 [0,0,0,0,0,2|2,0,0]=4 9819 B16R2.2256 c1ccc(cc1)COCc2ncccn2 7a_100000210790_100000703007 [0,0,0,0,0,2|2,0,0]=4 9820 B16R2.2256 c1ccc(cc1)CSCc2ccccc2 62a_100000211182_100015291786 [0,0,0,0,0,2|0,1,0]=3 9821 B16R2.2256 c1ccc(cc1)CSCc2ccccn2 62a_100000211182_100000721315 [0,0,0,0,0,2|1,1,0]=4 9822 B16R2.2256 c1ccc(cc1)CSCc2ccccn2 62a_100000721315_100015291786 [0,0,0,0,0,2|1,1,0]=4 9823 B16R2.2256 c1ccc(cc1)CSCc2cccnc2 62a_100000211182_100000741622 [0,0,0,0,0,2|1,1,0]=4 9824 B16R2.2256 c1ccc(cc1)CSCc2cccnc2 62a_100000741622_100015291786 [0,0,0,0,0,2|1,1,0]=4 9825 B16R2.2256 c1ccc(cc1)CSCc2ccncc2 62a_100000211182_100015193705 [0,0,0,0,0,2|1,1,0]=4 9826 B16R2.2256 c1ccc(cc1)CSCc2ccncc2 62a_100015193705_100015291786 [0,0,0,0,0,2|1,1,0]=4 9827 B16R2.2256 c1ccc(cc1)OCCc2ccccn2 7a_100000210340_100015183660 [0,0,0,0,0,2|1,0,0]=3 9828 B16R2.2256 c1ccc(cc1)OCCc2cccnc2 7a_100000210340_200011713674 [0,0,0,0,0,2|1,0,0]=3 9829 B16R2.2256 c1ccc(cc1)OCCc2ccncc2 7a_100000210340_100000723409 [0,0,0,0,0,2|1,0,0]=3 9830 B16R2.2256 c1ccc(cc1)SCCc2ccccn2 62a_100000719477_100015183660 [0,0,0,0,0,2|1,1,0]=4 9831 B16R2.2256 c1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000041952 [0,0,0,0,0,2|1,1,0]=4 9832 B16R2.2256 c1ccc(cc1)SCCc2cccnc2 62a_100000719477_200011713674 [0,0,0,0,0,2|1,1,0]=4 9833 B16R2.2256 c1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000041952 [0,0,0,0,0,2|1,1,0]=4 9834 B16R2.2256 c1ccc(cc1)SCCc2ccncc2 62a_100000719477_100000723409 [0,0,0,0,0,2|1,1,0]=4 9835 B16R2.2256 c1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000041952 [0,0,0,0,0,2|1,1,0]=4 9836 B16R2.2256 c1ccc(cc1)SCSc2ccccc2 62a_100000719477_100011218342 [0,0,0,0,0,2|0,1,0]=3 9837 B16R2.2256 c1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000041952 [0,0,0,0,0,2|0,1,0]=3 9838 B16R2.2256 c1ccc(cc1)SCSc2ccccn2 62a_100011216584_100011218342 [0,0,0,0,0,2|1,1,0]=4 9839 B16R2.2256 c1ccc(cc1)SCSc2ccccn2 62a_100011218342_100011216584 [0,0,0,0,0,2|1,1,0]=4 9840 B16R2.2256 c1ccc(cc1)SCSc2cccnc2 62a_100000210063_100011218342 [0,0,0,0,0,2|1,1,0]=4 9841 B16R2.2256 c1ccc(cc1)SCSc2cccnc2 62a_100011218342_100000210063 [0,0,0,0,0,2|1,1,0]=4 9842 B16R2.2256 c1ccc(cc1)SCSc2ccncc2 62a_100000728582_100011218342 [0,0,0,0,0,2|1,1,0]=4 9843 B16R2.2256 c1ccc(cc1)SCSc2ccncc2 62a_100011218342_100000728582 [0,0,0,0,0,2|1,1,0]=4 9844 B16R2.2256 c1ccc(nc1)CCOc2cccnc2 7a_100000210849_100015183660 [0,0,0,0,0,2|2,0,0]=4 9845 B16R2.2256 c1cncc(c1)CCOc2cccnc2 7a_100000210849_200011713674 [0,0,0,0,0,2|2,0,0]=4 9846 B16R2.2256 c1cncc(c1)OCCc2ccncc2 7a_100000210849_100000723409 [0,0,0,0,0,2|2,0,0]=4