0 B19R2.16162 CC(=NNc1ccccc1)C=Cc2ccccc2 4a_100015195140_100000204604 [0,0,0,0,0,0|3,0,0]=3 1 B19R2.16162 CC(=NNc1ccccc1)C=Cc2ccccn2 4a_100015195140_100102710650 [0,0,0,0,0,0|4,0,0]=4 2 B19R2.16162 CC(=NNc1ccccc1)CCc2ccccc2 4a_100015195140_100000210092 [0,0,0,0,0,0|4,0,0]=4 3 B19R2.16162 CC(=NNc1ccccn1)C=Cc2ccccc2 4a_100000183288_100000204604 [0,0,0,0,0,0|4,0,0]=4 4 B19R2.16162 CC(=NNc1cccnc1)C=Cc2ccccc2 4a_100000728903_100000204604 [0,0,0,0,0,0|4,0,0]=4 5 B19R2.16162 CC(=NNc1ccncc1)C=Cc2ccccc2 4a_100000698918_100000204604 [0,0,0,0,0,0|4,0,0]=4 6 B19R2.16162 CC(C#Cc1ccccc1)OCc2ccccc2 34a_200000065209_100015291786 [0,0,0,0,0,0|1,0,3]=4 7 B19R2.16162 CC(C#Cc1ccccc1)OCc2ccccc2 7a_200000065209_100000211182 [0,0,0,0,0,0|1,0,3]=4 8 B19R2.16162 CC(COc1ccccc1)OCc2ccccc2 34a_100000210911_100015291786 [0,0,0,0,0,0|2,0,2]=4 9 B19R2.16162 CC(COc1ccccc1)OCc2ccccc2 7a_100000210911_100000211182 [0,0,0,0,0,0|2,0,2]=4 10 B19R2.16162 C[C@@H](CCc1ccccc1)OCc2ccccc2 34a_100009815974_100015291786 [0,0,0,0,0,0|1,0,3]=4 11 B19R2.16162 C[C@@H](CCc1ccccc1)OCc2ccccc2 7a_100009815974_100000211182 [0,0,0,0,0,0|1,0,3]=4 12 B19R2.16162 O=C(C#Cc1ccccc1)CCc2ccccc2 1458a_100000736102_100000765856 [0,0,0,0,0,0|1,0,2]=3 13 B19R2.16162 O=C(C#Cc1ccccc1)CCc2ccccn2 1458a_100000736102_100015183660 [0,0,0,0,0,0|2,0,2]=4 14 B19R2.16162 O=C(C#Cc1ccccc1)CCc2cccnc2 1458a_100000736102_200011713674 [0,0,0,0,0,0|2,0,2]=4 15 B19R2.16162 O=C(C#Cc1ccccc1)CCc2ccncc2 1458a_100000736102_100000723409 [0,0,0,0,0,0|2,0,2]=4 16 B19R2.16162 O=C(C#Cc1ccccc1)NCc2ccccc2 240690a_100015324214_100000736102 [0,0,0,0,0,0|1,0,2]=3 17 B19R2.16162 O=C(C#Cc1ccccc1)NCc2ccccn2 240690a_100000210449_100000736102 [0,0,0,0,0,0|2,0,2]=4 18 B19R2.16162 O=C(C#Cc1ccccc1)NCc2cccnc2 240690a_100000210453_100000736102 [0,0,0,0,0,0|2,0,2]=4 19 B19R2.16162 O=C(C#Cc1ccccc1)NCc2ccncc2 240690a_100000210450_100000736102 [0,0,0,0,0,0|2,0,2]=4 20 B19R2.16162 O=C(C#Cc1ccccc1)NNc2ccccc2 22a_100015195140_100000736102 [0,0,0,0,0,0|2,0,2]=4 21 B19R2.16162 O=C(C#Cc1ccccn1)CCc2ccccc2 1458a_102125277312_100000765856 [0,0,0,0,0,0|2,0,2]=4 22 B19R2.16162 O=C(C=Cc1ccccc1)CCc2ccccc2 1458a_100000210462_100000765856 [0,0,0,0,0,0|1,0,0]=1 23 B19R2.16162 O=C(C=Cc1ccccc1)CCc2ccccn2 1458a_100000210462_100015183660 [0,0,0,0,0,0|2,0,0]=2 24 B19R2.16162 O=C(C=Cc1ccccc1)CCc2cccnc2 1458a_100000210462_200011713674 [0,0,0,0,0,0|2,0,0]=2 25 B19R2.16162 O=C(C=Cc1ccccc1)CCc2ccncc2 1458a_100000210462_100000723409 [0,0,0,0,0,0|2,0,0]=2 26 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccccc2 11a_100015324214_100000210462 [0,0,0,0,0,0|1,0,0]=1 27 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccccc2 1626a_100015324214_100000210462 [0,0,0,0,0,0|1,0,0]=1 28 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccccn2 11a_100000210449_100000210462 [0,0,0,0,0,0|2,0,0]=2 29 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccccn2 1626a_100000210449_100000210462 [0,0,0,0,0,0|2,0,0]=2 30 B19R2.16162 O=C(C=Cc1ccccc1)NCc2cccnc2 11a_100000210453_100000210462 [0,0,0,0,0,0|2,0,0]=2 31 B19R2.16162 O=C(C=Cc1ccccc1)NCc2cccnn2 11a_100159270163_100000210462 [0,0,0,0,0,0|3,0,0]=3 32 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccncc2 11a_100000210450_100000210462 [0,0,0,0,0,0|2,0,0]=2 33 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccncc2 1626a_100000210450_100000210462 [0,0,0,0,0,0|2,0,0]=2 34 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccncn2 11a_100000736019_100000210462 [0,0,0,0,0,0|3,0,0]=3 35 B19R2.16162 O=C(C=Cc1ccccc1)NCc2cnccn2 11a_100000737960_100000210462 [0,0,0,0,0,0|3,0,0]=3 36 B19R2.16162 O=C(C=Cc1ccccc1)NCc2cncnc2 11a_100011243677_100000210462 [0,0,0,0,0,0|3,0,0]=3 37 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ncccn2 11a_100015189908_100000210462 [0,0,0,0,0,0|3,0,0]=3 38 B19R2.16162 O=C(C=Cc1ccccc1)NNc2ccccc2 22a_100015195140_100000210462 [0,0,0,0,0,0|2,0,0]=2 39 B19R2.16162 O=C(C=Cc1ccccc1)NNc2ccccn2 22a_100000183288_100000210462 [0,0,0,0,0,0|3,0,0]=3 40 B19R2.16162 O=C(C=Cc1ccccc1)NNc2cccnc2 22a_100000728903_100000210462 [0,0,0,0,0,0|3,0,0]=3 41 B19R2.16162 O=C(C=Cc1ccccc1)NNc2cccnn2 22a_100000757824_100000210462 [0,0,0,0,0,0|4,0,0]=4 42 B19R2.16162 O=C(C=Cc1ccccc1)NNc2ccncc2 22a_100000698918_100000210462 [0,0,0,0,0,0|3,0,0]=3 43 B19R2.16162 O=C(C=Cc1ccccc1)NNc2ccncn2 22a_100011438088_100000210462 [0,0,0,0,0,0|4,0,0]=4 44 B19R2.16162 O=C(C=Cc1ccccc1)NNc2cnccn2 22a_100000736894_100000210462 [0,0,0,0,0,0|4,0,0]=4 45 B19R2.16162 O=C(C=Cc1ccccc1)NNc2ncccn2 22a_100000736892_100000210462 [0,0,0,0,0,0|4,0,0]=4 46 B19R2.16162 O=C(C=Cc1ccccn1)CCc2ccccc2 1458a_100000740811_100000765856 [0,0,0,0,0,0|2,0,0]=2 47 B19R2.16162 O=C(C=Cc1ccccn1)CCc2ccccn2 1458a_100000740811_100015183660 [0,0,0,0,0,0|3,0,0]=3 48 B19R2.16162 O=C(C=Cc1ccccn1)CCc2cccnc2 1458a_100000740811_200011713674 [0,0,0,0,0,0|3,0,0]=3 49 B19R2.16162 O=C(C=Cc1ccccn1)CCc2ccncc2 1458a_100000740811_100000723409 [0,0,0,0,0,0|3,0,0]=3 50 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccccc2 11a_100015324214_100000740811 [0,0,0,0,0,0|2,0,0]=2 51 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccccc2 240690a_100015324214_100000740811 [0,0,0,0,0,0|2,0,0]=2 52 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccccn2 11a_100000210449_100000740811 [0,0,0,0,0,0|3,0,0]=3 53 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccccn2 240690a_100000210449_100000740811 [0,0,0,0,0,0|3,0,0]=3 54 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cccnc2 11a_100000210453_100000740811 [0,0,0,0,0,0|3,0,0]=3 55 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cccnc2 240690a_100000210453_100000740811 [0,0,0,0,0,0|3,0,0]=3 56 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cccnn2 11a_100159270163_100000740811 [0,0,0,0,0,0|4,0,0]=4 57 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cccnn2 240690a_100159270163_100000740811 [0,0,0,0,0,0|4,0,0]=4 58 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccncc2 11a_100000210450_100000740811 [0,0,0,0,0,0|3,0,0]=3 59 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccncc2 240690a_100000210450_100000740811 [0,0,0,0,0,0|3,0,0]=3 60 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccncn2 11a_100000736019_100000740811 [0,0,0,0,0,0|4,0,0]=4 61 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccncn2 240690a_100000736019_100000740811 [0,0,0,0,0,0|4,0,0]=4 62 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cnccn2 11a_100000737960_100000740811 [0,0,0,0,0,0|4,0,0]=4 63 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cnccn2 240690a_100000737960_100000740811 [0,0,0,0,0,0|4,0,0]=4 64 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cncnc2 11a_100011243677_100000740811 [0,0,0,0,0,0|4,0,0]=4 65 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cncnc2 240690a_100011243677_100000740811 [0,0,0,0,0,0|4,0,0]=4 66 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ncccn2 11a_100015189908_100000740811 [0,0,0,0,0,0|4,0,0]=4 67 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ncccn2 240690a_100015189908_100000740811 [0,0,0,0,0,0|4,0,0]=4 68 B19R2.16162 O=C(C=Cc1ccccn1)NNc2ccccc2 22a_100015195140_100000740811 [0,0,0,0,0,0|3,0,0]=3 69 B19R2.16162 O=C(C=Cc1ccccn1)NNc2ccccn2 22a_100000183288_100000740811 [0,0,0,0,0,0|4,0,0]=4 70 B19R2.16162 O=C(C=Cc1ccccn1)NNc2cccnc2 22a_100000728903_100000740811 [0,0,0,0,0,0|4,0,0]=4 71 B19R2.16162 O=C(C=Cc1ccccn1)NNc2ccncc2 22a_100000698918_100000740811 [0,0,0,0,0,0|4,0,0]=4 72 B19R2.16162 O=C(C=Cc1cccnc1)CCc2ccccc2 1458a_100000735890_100000765856 [0,0,0,0,0,0|2,0,0]=2 73 B19R2.16162 O=C(C=Cc1cccnc1)CCc2ccccn2 1458a_100000735890_100015183660 [0,0,0,0,0,0|3,0,0]=3 74 B19R2.16162 O=C(C=Cc1cccnc1)CCc2cccnc2 1458a_100000735890_200011713674 [0,0,0,0,0,0|3,0,0]=3 75 B19R2.16162 O=C(C=Cc1cccnc1)CCc2ccncc2 1458a_100000735890_100000723409 [0,0,0,0,0,0|3,0,0]=3 76 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccccc2 11a_100015324214_100000735890 [0,0,0,0,0,0|2,0,0]=2 77 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccccc2 240690a_100015324214_100000735890 [0,0,0,0,0,0|2,0,0]=2 78 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccccn2 11a_100000210449_100000735890 [0,0,0,0,0,0|3,0,0]=3 79 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccccn2 240690a_100000210449_100000735890 [0,0,0,0,0,0|3,0,0]=3 80 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cccnc2 11a_100000210453_100000735890 [0,0,0,0,0,0|3,0,0]=3 81 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cccnc2 240690a_100000210453_100000735890 [0,0,0,0,0,0|3,0,0]=3 82 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cccnn2 11a_100159270163_100000735890 [0,0,0,0,0,0|4,0,0]=4 83 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cccnn2 240690a_100159270163_100000735890 [0,0,0,0,0,0|4,0,0]=4 84 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccncc2 11a_100000210450_100000735890 [0,0,0,0,0,0|3,0,0]=3 85 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccncc2 240690a_100000210450_100000735890 [0,0,0,0,0,0|3,0,0]=3 86 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccncn2 11a_100000736019_100000735890 [0,0,0,0,0,0|4,0,0]=4 87 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccncn2 240690a_100000736019_100000735890 [0,0,0,0,0,0|4,0,0]=4 88 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cnccn2 11a_100000737960_100000735890 [0,0,0,0,0,0|4,0,0]=4 89 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cnccn2 240690a_100000737960_100000735890 [0,0,0,0,0,0|4,0,0]=4 90 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cncnc2 11a_100011243677_100000735890 [0,0,0,0,0,0|4,0,0]=4 91 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cncnc2 240690a_100011243677_100000735890 [0,0,0,0,0,0|4,0,0]=4 92 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ncccn2 11a_100015189908_100000735890 [0,0,0,0,0,0|4,0,0]=4 93 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ncccn2 240690a_100015189908_100000735890 [0,0,0,0,0,0|4,0,0]=4 94 B19R2.16162 O=C(C=Cc1cccnc1)NNc2ccccc2 22a_100015195140_100000735890 [0,0,0,0,0,0|3,0,0]=3 95 B19R2.16162 O=C(C=Cc1cccnc1)NNc2ccccn2 22a_100000183288_100000735890 [0,0,0,0,0,0|4,0,0]=4 96 B19R2.16162 O=C(C=Cc1cccnc1)NNc2cccnc2 22a_100000728903_100000735890 [0,0,0,0,0,0|4,0,0]=4 97 B19R2.16162 O=C(C=Cc1cccnc1)NNc2ccncc2 22a_100000698918_100000735890 [0,0,0,0,0,0|4,0,0]=4 98 B19R2.16162 O=C(C=Cc1ccncc1)CCc2ccccc2 1458a_100000682801_100000765856 [0,0,0,0,0,0|2,0,0]=2 99 B19R2.16162 O=C(C=Cc1ccncc1)CCc2ccccn2 1458a_100000682801_100015183660 [0,0,0,0,0,0|3,0,0]=3 100 B19R2.16162 O=C(C=Cc1ccncc1)CCc2cccnc2 1458a_100000682801_200011713674 [0,0,0,0,0,0|3,0,0]=3 101 B19R2.16162 O=C(C=Cc1ccncc1)CCc2ccncc2 1458a_100000682801_100000723409 [0,0,0,0,0,0|3,0,0]=3 102 B19R2.16162 O=C(C=Cc1ccncc1)NCc2ccccc2 240690a_100015324214_100000682801 [0,0,0,0,0,0|2,0,0]=2 103 B19R2.16162 O=C(C=Cc1ccncc1)NCc2ccccn2 240690a_100000210449_100000682801 [0,0,0,0,0,0|3,0,0]=3 104 B19R2.16162 O=C(C=Cc1ccncc1)NCc2cccnc2 240690a_100000210453_100000682801 [0,0,0,0,0,0|3,0,0]=3 105 B19R2.16162 O=C(C=Cc1ccncc1)NCc2cccnn2 240690a_100159270163_100000682801 [0,0,0,0,0,0|4,0,0]=4 106 B19R2.16162 O=C(C=Cc1ccncc1)NCc2ccncc2 240690a_100000210450_100000682801 [0,0,0,0,0,0|3,0,0]=3 107 B19R2.16162 O=C(C=Cc1ccncc1)NCc2ccncn2 240690a_100000736019_100000682801 [0,0,0,0,0,0|4,0,0]=4 108 B19R2.16162 O=C(C=Cc1ccncc1)NCc2cnccn2 240690a_100000737960_100000682801 [0,0,0,0,0,0|4,0,0]=4 109 B19R2.16162 O=C(C=Cc1ccncc1)NCc2cncnc2 240690a_100011243677_100000682801 [0,0,0,0,0,0|4,0,0]=4 110 B19R2.16162 O=C(C=Cc1ccncc1)NCc2ncccn2 240690a_100015189908_100000682801 [0,0,0,0,0,0|4,0,0]=4 111 B19R2.16162 O=C(C=Cc1ccncc1)NNc2ccccc2 22a_100015195140_100000682801 [0,0,0,0,0,0|3,0,0]=3 112 B19R2.16162 O=C(C=Cc1ccncc1)NNc2ccccn2 22a_100000183288_100000682801 [0,0,0,0,0,0|4,0,0]=4 113 B19R2.16162 O=C(C=Cc1ccncc1)NNc2cccnc2 22a_100000728903_100000682801 [0,0,0,0,0,0|4,0,0]=4 114 B19R2.16162 O=C(C=Cc1ccncc1)NNc2ccncc2 22a_100000698918_100000682801 [0,0,0,0,0,0|4,0,0]=4 115 B19R2.16162 O=C(C=Cc1cncnc1)CCc2ccccc2 6a_100000749868_100000210092 [0,0,0,0,0,0|3,0,0]=3 116 B19R2.16162 O=C(C=Cc1cncnc1)COc2ccccc2 6a_100000749868_100000150576 [0,0,0,0,0,0|4,0,0]=4 117 B19R2.16162 O=C(C=Cc1cncnc1)CSc2ccccc2 6a_100000749868_100000150717 [0,0,0,0,0,0|4,0,0]=4 118 B19R2.16162 O=C(CCc1ccccc1)CCc2ccccc2 1458a_100000185753_100000765856 [0,0,0,0,0,0|1,0,2]=3 119 B19R2.16162 O=C(CCc1ccccc1)CCc2ccccn2 1458a_100000185753_100015183660 [0,0,0,0,0,0|2,0,2]=4 120 B19R2.16162 O=C(CCc1ccccc1)CCc2ccccn2 1458a_100015195070_100000765856 [0,0,0,0,0,0|2,0,2]=4 121 B19R2.16162 O=C(CCc1ccccc1)CCc2cccnc2 1458a_100000185753_200011713674 [0,0,0,0,0,0|2,0,2]=4 122 B19R2.16162 O=C(CCc1ccccc1)CCc2cccnc2 1458a_100000198484_100000765856 [0,0,0,0,0,0|2,0,2]=4 123 B19R2.16162 O=C(CCc1ccccc1)CCc2ccncc2 1458a_100000185753_100000723409 [0,0,0,0,0,0|2,0,2]=4 124 B19R2.16162 O=C(CCc1ccccc1)CCc2ccncc2 1458a_100011225043_100000765856 [0,0,0,0,0,0|2,0,2]=4 125 B19R2.16162 O=C(CCc1ccccc1)CNc2ccccc2 34a_100000106764_100012361361 [0,0,0,0,0,0|2,0,1]=3 126 B19R2.16162 O=C(CCc1ccccc1)COc2ccccc2 1458a_100000186222_100000765856 [0,0,0,0,0,0|2,0,1]=3 127 B19R2.16162 O=C(CCc1ccccc1)COc2ccccc2 34a_100000210340_100012361361 [0,0,0,0,0,0|2,0,1]=3 128 B19R2.16162 O=C(CCc1ccccc1)COc2ccccc2 7a_100000210340_100012361361 [0,0,0,0,0,0|2,0,1]=3 129 B19R2.16162 O=C(CCc1ccccc1)COc2ccccn2 1458a_100102699861_100000765856 [0,0,0,0,0,0|3,0,1]=4 130 B19R2.16162 O=C(CCc1ccccc1)COc2cccnc2 1458a_100015207166_100000765856 [0,0,0,0,0,0|3,0,1]=4 131 B19R2.16162 O=C(CCc1ccccc1)COc2cccnc2 34a_100000210849_100012361361 [0,0,0,0,0,0|3,0,1]=4 132 B19R2.16162 O=C(CCc1ccccc1)COc2cccnc2 7a_100000210849_100012361361 [0,0,0,0,0,0|3,0,1]=4 133 B19R2.16162 O=C(CCc1ccccc1)COc2ccncc2 34a_100000212176_100012361361 [0,0,0,0,0,0|3,0,1]=4 134 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccc2 1458a_100000211596_100000765856 [0,0,0,0,0,0|2,0,1]=3 135 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccc2 62a_100000719477_100012361361 [0,0,0,0,0,0|2,0,1]=3 136 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccc2 62a_100012361361_100000041952 [0,0,0,0,0,0|2,0,1]=3 137 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccn2 1458a_100000156281_100000765856 [0,0,0,0,0,0|3,0,1]=4 138 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccn2 62a_100011216584_100012361361 [0,0,0,0,0,0|3,0,1]=4 139 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccn2 62a_100012361361_100011216584 [0,0,0,0,0,0|3,0,1]=4 140 B19R2.16162 O=C(CCc1ccccc1)CSc2cccnc2 62a_100000210063_100012361361 [0,0,0,0,0,0|3,0,1]=4 141 B19R2.16162 O=C(CCc1ccccc1)CSc2cccnc2 62a_100012361361_100000210063 [0,0,0,0,0,0|3,0,1]=4 142 B19R2.16162 O=C(CCc1ccccc1)CSc2ccncc2 1458a_100000211328_100000765856 [0,0,0,0,0,0|3,0,1]=4 143 B19R2.16162 O=C(CCc1ccccc1)CSc2ccncc2 62a_100000728582_100012361361 [0,0,0,0,0,0|3,0,1]=4 144 B19R2.16162 O=C(CCc1ccccc1)CSc2ccncc2 62a_100012361361_100000728582 [0,0,0,0,0,0|3,0,1]=4 145 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 11a_100015324214_100000185753 [0,0,0,0,0,0|1,0,2]=3 146 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000185753 [0,0,0,0,0,0|1,0,2]=3 147 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000185753 [0,0,0,0,0,0|1,0,2]=3 148 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 527a_100015324214_100000185753 [0,0,0,0,0,0|1,0,2]=3 149 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccn2 11a_100000210449_100000185753 [0,0,0,0,0,0|2,0,2]=4 150 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccn2 1626a_100000210449_100000185753 [0,0,0,0,0,0|2,0,2]=4 151 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccn2 240690a_100000210449_100000185753 [0,0,0,0,0,0|2,0,2]=4 152 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccn2 527a_100000210449_100000185753 [0,0,0,0,0,0|2,0,2]=4 153 B19R2.16162 O=C(CCc1ccccc1)NCc2cccnc2 11a_100000210453_100000185753 [0,0,0,0,0,0|2,0,2]=4 154 B19R2.16162 O=C(CCc1ccccc1)NCc2cccnc2 240690a_100000210453_100000185753 [0,0,0,0,0,0|2,0,2]=4 155 B19R2.16162 O=C(CCc1ccccc1)NCc2cccnc2 527a_100000210453_100000185753 [0,0,0,0,0,0|2,0,2]=4 156 B19R2.16162 O=C(CCc1ccccc1)NCc2ccncc2 11a_100000210450_100000185753 [0,0,0,0,0,0|2,0,2]=4 157 B19R2.16162 O=C(CCc1ccccc1)NCc2ccncc2 1626a_100000210450_100000185753 [0,0,0,0,0,0|2,0,2]=4 158 B19R2.16162 O=C(CCc1ccccc1)NCc2ccncc2 240690a_100000210450_100000185753 [0,0,0,0,0,0|2,0,2]=4 159 B19R2.16162 O=C(CCc1ccccc1)NCc2ccncc2 527a_100000210450_100000185753 [0,0,0,0,0,0|2,0,2]=4 160 B19R2.16162 O=C(CCc1ccccc1)NNc2ccccc2 22a_100015195140_100000185753 [0,0,0,0,0,0|3,0,0]=3 161 B19R2.16162 O=C(CCc1ccccc1)NNc2ccccn2 22a_100000183288_100000185753 [0,0,0,0,0,0|4,0,0]=4 162 B19R2.16162 O=C(CCc1ccccc1)NNc2cccnc2 22a_100000728903_100000185753 [0,0,0,0,0,0|4,0,0]=4 163 B19R2.16162 O=C(CCc1ccccc1)NNc2ccncc2 22a_100000698918_100000185753 [0,0,0,0,0,0|4,0,0]=4 164 B19R2.16162 O=C(CCc1ccccn1)COc2ccccc2 1458a_100000186222_100015183660 [0,0,0,0,0,0|3,0,1]=4 165 B19R2.16162 O=C(CCc1ccccn1)CSc2ccccc2 1458a_100000211596_100015183660 [0,0,0,0,0,0|3,0,1]=4 166 B19R2.16162 O=C(CCc1ccccn1)NCc2ccccc2 11a_100015324214_100015195070 [0,0,0,0,0,0|2,0,2]=4 167 B19R2.16162 O=C(CCc1ccccn1)NCc2ccccc2 240690a_100015324214_100015195070 [0,0,0,0,0,0|2,0,2]=4 168 B19R2.16162 O=C(CCc1ccccn1)NCc2ccccc2 527a_100015324214_100015195070 [0,0,0,0,0,0|2,0,2]=4 169 B19R2.16162 O=C(CCc1ccccn1)NNc2ccccc2 22a_100015195140_100015195070 [0,0,0,0,0,0|4,0,0]=4 170 B19R2.16162 O=C(CCc1cccnc1)COc2ccccc2 1458a_100000186222_200011713674 [0,0,0,0,0,0|3,0,1]=4 171 B19R2.16162 O=C(CCc1cccnc1)CSc2ccccc2 1458a_100000211596_200011713674 [0,0,0,0,0,0|3,0,1]=4 172 B19R2.16162 O=C(CCc1cccnc1)NCc2ccccc2 11a_100015324214_100000198484 [0,0,0,0,0,0|2,0,2]=4 173 B19R2.16162 O=C(CCc1cccnc1)NCc2ccccc2 1626a_100015324214_100000198484 [0,0,0,0,0,0|2,0,2]=4 174 B19R2.16162 O=C(CCc1cccnc1)NCc2ccccc2 240690a_100015324214_100000198484 [0,0,0,0,0,0|2,0,2]=4 175 B19R2.16162 O=C(CCc1cccnc1)NCc2ccccc2 527a_100015324214_100000198484 [0,0,0,0,0,0|2,0,2]=4 176 B19R2.16162 O=C(CCc1cccnc1)NNc2ccccc2 22a_100015195140_100000198484 [0,0,0,0,0,0|4,0,0]=4 177 B19R2.16162 O=C(CCc1ccncc1)COc2ccccc2 1458a_100000186222_100000723409 [0,0,0,0,0,0|3,0,1]=4 178 B19R2.16162 O=C(CCc1ccncc1)CSc2ccccc2 1458a_100000211596_100000723409 [0,0,0,0,0,0|3,0,1]=4 179 B19R2.16162 O=C(CCc1ccncc1)NCc2ccccc2 11a_100015324214_100011225043 [0,0,0,0,0,0|2,0,2]=4 180 B19R2.16162 O=C(CCc1ccncc1)NCc2ccccc2 240690a_100015324214_100011225043 [0,0,0,0,0,0|2,0,2]=4 181 B19R2.16162 O=C(CCc1ccncc1)NCc2ccccc2 527a_100015324214_100011225043 [0,0,0,0,0,0|2,0,2]=4 182 B19R2.16162 O=C(CCc1ccncc1)NNc2ccccc2 22a_100015195140_100011225043 [0,0,0,0,0,0|4,0,0]=4 183 B19R2.16162 O=C(CNc1ccccc1)NCc2ccccc2 34a_100000106764_100000183539 [0,0,0,0,0,0|2,0,1]=3 184 B19R2.16162 O=C(CNc1ccccc1)NCc2ccccn2 34a_100000106764_100000684169 [0,0,0,0,0,0|3,0,1]=4 185 B19R2.16162 O=C(CNc1ccccc1)OCc2ccccc2 34a_100000106764_100000753625 [0,0,0,0,0,0|1,0,1]=2 186 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 11a_100015324214_100000186222 [0,0,0,0,0,0|2,0,1]=3 187 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 1626a_100015324214_100000186222 [0,0,0,0,0,0|2,0,1]=3 188 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 240690a_100015324214_100000186222 [0,0,0,0,0,0|2,0,1]=3 189 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 34a_100000210340_100000183539 [0,0,0,0,0,0|2,0,1]=3 190 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 527a_100015324214_100000186222 [0,0,0,0,0,0|2,0,1]=3 191 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 7a_100000210340_100000183539 [0,0,0,0,0,0|2,0,1]=3 192 B19R2.16162 O=C(COc1ccccc1)NCc2ccccn2 11a_100000210449_100000186222 [0,0,0,0,0,0|3,0,1]=4 193 B19R2.16162 O=C(COc1ccccc1)NCc2ccccn2 1626a_100000210449_100000186222 [0,0,0,0,0,0|3,0,1]=4 194 B19R2.16162 O=C(COc1ccccc1)NCc2ccccn2 240690a_100000210449_100000186222 [0,0,0,0,0,0|3,0,1]=4 195 B19R2.16162 O=C(COc1ccccc1)NCc2ccccn2 34a_100000210340_100000684169 [0,0,0,0,0,0|3,0,1]=4 196 B19R2.16162 O=C(COc1ccccc1)NCc2ccccn2 527a_100000210449_100000186222 [0,0,0,0,0,0|3,0,1]=4 197 B19R2.16162 O=C(COc1ccccc1)NCc2ccccn2 7a_100000210340_100000684169 [0,0,0,0,0,0|3,0,1]=4 198 B19R2.16162 O=C(COc1ccccc1)NCc2cccnc2 11a_100000210453_100000186222 [0,0,0,0,0,0|3,0,1]=4 199 B19R2.16162 O=C(COc1ccccc1)NCc2cccnc2 240690a_100000210453_100000186222 [0,0,0,0,0,0|3,0,1]=4 200 B19R2.16162 O=C(COc1ccccc1)NCc2cccnc2 527a_100000210453_100000186222 [0,0,0,0,0,0|3,0,1]=4 201 B19R2.16162 O=C(COc1ccccc1)NCc2cccnc2 7a_100000210340_100000752408 [0,0,0,0,0,0|3,0,1]=4 202 B19R2.16162 O=C(COc1ccccc1)NCc2ccncc2 11a_100000210450_100000186222 [0,0,0,0,0,0|3,0,1]=4 203 B19R2.16162 O=C(COc1ccccc1)NCc2ccncc2 1626a_100000210450_100000186222 [0,0,0,0,0,0|3,0,1]=4 204 B19R2.16162 O=C(COc1ccccc1)NCc2ccncc2 240690a_100000210450_100000186222 [0,0,0,0,0,0|3,0,1]=4 205 B19R2.16162 O=C(COc1ccccc1)NCc2ccncc2 527a_100000210450_100000186222 [0,0,0,0,0,0|3,0,1]=4 206 B19R2.16162 O=C(COc1ccccc1)NCc2ccncc2 7a_100000210340_100011243468 [0,0,0,0,0,0|3,0,1]=4 207 B19R2.16162 O=C(COc1ccccc1)NNc2ccccc2 22a_100015195140_100000186222 [0,0,0,0,0,0|3,0,1]=4 208 B19R2.16162 O=C(COc1ccccc1)OCc2ccccc2 34a_100000210340_100000753625 [0,0,0,0,0,0|1,0,1]=2 209 B19R2.16162 O=C(COc1ccccc1)OCc2ccccc2 7a_100000210340_100000753625 [0,0,0,0,0,0|1,0,1]=2 210 B19R2.16162 O=C(COc1ccccn1)NCc2ccccc2 1626a_100015324214_100102699861 [0,0,0,0,0,0|3,0,1]=4 211 B19R2.16162 O=C(COc1ccccn1)NCc2ccccc2 240690a_100015324214_100102699861 [0,0,0,0,0,0|3,0,1]=4 212 B19R2.16162 O=C(COc1ccccn1)NCc2ccccc2 527a_100015324214_100102699861 [0,0,0,0,0,0|3,0,1]=4 213 B19R2.16162 O=C(COc1cccnc1)NCc2ccccc2 11a_100015324214_100015207166 [0,0,0,0,0,0|3,0,1]=4 214 B19R2.16162 O=C(COc1cccnc1)NCc2ccccc2 1626a_100015324214_100015207166 [0,0,0,0,0,0|3,0,1]=4 215 B19R2.16162 O=C(COc1cccnc1)NCc2ccccc2 240690a_100015324214_100015207166 [0,0,0,0,0,0|3,0,1]=4 216 B19R2.16162 O=C(COc1cccnc1)NCc2ccccc2 34a_100000210849_100000183539 [0,0,0,0,0,0|3,0,1]=4 217 B19R2.16162 O=C(COc1cccnc1)NCc2ccccc2 527a_100015324214_100015207166 [0,0,0,0,0,0|3,0,1]=4 218 B19R2.16162 O=C(COc1cccnc1)NCc2ccccc2 7a_100000210849_100000183539 [0,0,0,0,0,0|3,0,1]=4 219 B19R2.16162 O=C(COc1cccnc1)OCc2ccccc2 34a_100000210849_100000753625 [0,0,0,0,0,0|2,0,1]=3 220 B19R2.16162 O=C(COc1cccnc1)OCc2ccccc2 7a_100000210849_100000753625 [0,0,0,0,0,0|2,0,1]=3 221 B19R2.16162 O=C(COc1ccncc1)NCc2ccccc2 34a_100000212176_100000183539 [0,0,0,0,0,0|3,0,1]=4 222 B19R2.16162 O=C(COc1ccncc1)OCc2ccccc2 34a_100000212176_100000753625 [0,0,0,0,0,0|2,0,1]=3 223 B19R2.16162 O=C(COc1ccnnc1)OCc2ccccc2 34a_100015204005_100000753625 [0,0,0,0,0,0|3,0,1]=4 224 B19R2.16162 O=C(COc1cncnc1)OCc2ccccc2 7a_100000754086_100000753625 [0,0,0,0,0,0|3,0,1]=4 225 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 11a_100015324214_100000211596 [0,0,0,0,0,0|2,0,1]=3 226 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 1626a_100015324214_100000211596 [0,0,0,0,0,0|2,0,1]=3 227 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 240690a_100015324214_100000211596 [0,0,0,0,0,0|2,0,1]=3 228 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 527a_100015324214_100000211596 [0,0,0,0,0,0|2,0,1]=3 229 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 62a_100000183539_100000041952 [0,0,0,0,0,0|2,0,1]=3 230 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 62a_100000719477_100000183539 [0,0,0,0,0,0|2,0,1]=3 231 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccn2 11a_100000210449_100000211596 [0,0,0,0,0,0|3,0,1]=4 232 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccn2 1626a_100000210449_100000211596 [0,0,0,0,0,0|3,0,1]=4 233 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccn2 240690a_100000210449_100000211596 [0,0,0,0,0,0|3,0,1]=4 234 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccn2 527a_100000210449_100000211596 [0,0,0,0,0,0|3,0,1]=4 235 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccn2 62a_100000684169_100000041952 [0,0,0,0,0,0|3,0,1]=4 236 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccn2 62a_100000719477_100000684169 [0,0,0,0,0,0|3,0,1]=4 237 B19R2.16162 O=C(CSc1ccccc1)NCc2cccnc2 11a_100000210453_100000211596 [0,0,0,0,0,0|3,0,1]=4 238 B19R2.16162 O=C(CSc1ccccc1)NCc2cccnc2 240690a_100000210453_100000211596 [0,0,0,0,0,0|3,0,1]=4 239 B19R2.16162 O=C(CSc1ccccc1)NCc2cccnc2 527a_100000210453_100000211596 [0,0,0,0,0,0|3,0,1]=4 240 B19R2.16162 O=C(CSc1ccccc1)NCc2cccnc2 62a_100000719477_100000752408 [0,0,0,0,0,0|3,0,1]=4 241 B19R2.16162 O=C(CSc1ccccc1)NCc2cccnc2 62a_100000752408_100000041952 [0,0,0,0,0,0|3,0,1]=4 242 B19R2.16162 O=C(CSc1ccccc1)NCc2ccncc2 11a_100000210450_100000211596 [0,0,0,0,0,0|3,0,1]=4 243 B19R2.16162 O=C(CSc1ccccc1)NCc2ccncc2 1626a_100000210450_100000211596 [0,0,0,0,0,0|3,0,1]=4 244 B19R2.16162 O=C(CSc1ccccc1)NCc2ccncc2 240690a_100000210450_100000211596 [0,0,0,0,0,0|3,0,1]=4 245 B19R2.16162 O=C(CSc1ccccc1)NCc2ccncc2 527a_100000210450_100000211596 [0,0,0,0,0,0|3,0,1]=4 246 B19R2.16162 O=C(CSc1ccccc1)NCc2ccncc2 62a_100000719477_100011243468 [0,0,0,0,0,0|3,0,1]=4 247 B19R2.16162 O=C(CSc1ccccc1)NCc2ccncc2 62a_100011243468_100000041952 [0,0,0,0,0,0|3,0,1]=4 248 B19R2.16162 O=C(CSc1ccccc1)NNc2ccccc2 22a_100015195140_100000211596 [0,0,0,0,0,0|3,0,1]=4 249 B19R2.16162 O=C(CSc1ccccc1)OCc2ccccc2 62a_100000719477_100000753625 [0,0,0,0,0,0|1,0,1]=2 250 B19R2.16162 O=C(CSc1ccccc1)OCc2ccccc2 62a_100000753625_100000041952 [0,0,0,0,0,0|1,0,1]=2 251 B19R2.16162 O=C(CSc1ccccn1)NCc2ccccc2 11a_100015324214_100000156281 [0,0,0,0,0,0|3,0,1]=4 252 B19R2.16162 O=C(CSc1ccccn1)NCc2ccccc2 240690a_100015324214_100000156281 [0,0,0,0,0,0|3,0,1]=4 253 B19R2.16162 O=C(CSc1ccccn1)NCc2ccccc2 527a_100015324214_100000156281 [0,0,0,0,0,0|3,0,1]=4 254 B19R2.16162 O=C(CSc1ccccn1)NCc2ccccc2 62a_100000183539_100011216584 [0,0,0,0,0,0|3,0,1]=4 255 B19R2.16162 O=C(CSc1ccccn1)NCc2ccccc2 62a_100011216584_100000183539 [0,0,0,0,0,0|3,0,1]=4 256 B19R2.16162 O=C(CSc1ccccn1)OCc2ccccc2 62a_100000753625_100011216584 [0,0,0,0,0,0|2,0,1]=3 257 B19R2.16162 O=C(CSc1ccccn1)OCc2ccccc2 62a_100011216584_100000753625 [0,0,0,0,0,0|2,0,1]=3 258 B19R2.16162 O=C(CSc1cccnc1)NCc2ccccc2 62a_100000183539_100000210063 [0,0,0,0,0,0|3,0,1]=4 259 B19R2.16162 O=C(CSc1cccnc1)NCc2ccccc2 62a_100000210063_100000183539 [0,0,0,0,0,0|3,0,1]=4 260 B19R2.16162 O=C(CSc1cccnc1)OCc2ccccc2 62a_100000210063_100000753625 [0,0,0,0,0,0|2,0,1]=3 261 B19R2.16162 O=C(CSc1cccnc1)OCc2ccccc2 62a_100000753625_100000210063 [0,0,0,0,0,0|2,0,1]=3 262 B19R2.16162 O=C(CSc1cccnn1)OCc2ccccc2 62a_100000753625_100016991348 [0,0,0,0,0,0|3,0,1]=4 263 B19R2.16162 O=C(CSc1cccnn1)OCc2ccccc2 62a_100016991348_100000753625 [0,0,0,0,0,0|3,0,1]=4 264 B19R2.16162 O=C(CSc1ccncc1)NCc2ccccc2 11a_100015324214_100000211328 [0,0,0,0,0,0|3,0,1]=4 265 B19R2.16162 O=C(CSc1ccncc1)NCc2ccccc2 1626a_100015324214_100000211328 [0,0,0,0,0,0|3,0,1]=4 266 B19R2.16162 O=C(CSc1ccncc1)NCc2ccccc2 240690a_100015324214_100000211328 [0,0,0,0,0,0|3,0,1]=4 267 B19R2.16162 O=C(CSc1ccncc1)NCc2ccccc2 527a_100015324214_100000211328 [0,0,0,0,0,0|3,0,1]=4 268 B19R2.16162 O=C(CSc1ccncc1)NCc2ccccc2 62a_100000183539_100000728582 [0,0,0,0,0,0|3,0,1]=4 269 B19R2.16162 O=C(CSc1ccncc1)NCc2ccccc2 62a_100000728582_100000183539 [0,0,0,0,0,0|3,0,1]=4 270 B19R2.16162 O=C(CSc1ccncc1)OCc2ccccc2 62a_100000728582_100000753625 [0,0,0,0,0,0|2,0,1]=3 271 B19R2.16162 O=C(CSc1ccncc1)OCc2ccccc2 62a_100000753625_100000728582 [0,0,0,0,0,0|2,0,1]=3 272 B19R2.16162 O=C(CSc1ccncn1)OCc2ccccc2 62a_100000703185_100000753625 [0,0,0,0,0,0|3,0,1]=4 273 B19R2.16162 O=C(CSc1ccncn1)OCc2ccccc2 62a_100000753625_100000703185 [0,0,0,0,0,0|3,0,1]=4 274 B19R2.16162 O=C(CSc1ccnnc1)OCc2ccccc2 62a_100000732662_100000753625 [0,0,0,0,0,0|3,0,1]=4 275 B19R2.16162 O=C(CSc1ccnnc1)OCc2ccccc2 62a_100000753625_100000732662 [0,0,0,0,0,0|3,0,1]=4 276 B19R2.16162 O=C(CSc1cnccn1)OCc2ccccc2 62a_100000211759_100000753625 [0,0,0,0,0,0|3,0,1]=4 277 B19R2.16162 O=C(CSc1cnccn1)OCc2ccccc2 62a_100000753625_100000211759 [0,0,0,0,0,0|3,0,1]=4 278 B19R2.16162 O=C(CSc1cncnc1)OCc2ccccc2 62a_100000753625_100011206942 [0,0,0,0,0,0|3,0,1]=4 279 B19R2.16162 O=C(CSc1cncnc1)OCc2ccccc2 62a_100011206942_100000753625 [0,0,0,0,0,0|3,0,1]=4 280 B19R2.16162 O=C(CSc1ncccn1)OCc2ccccc2 62a_100000211032_100000753625 [0,0,0,0,0,0|3,0,1]=4 281 B19R2.16162 O=C(CSc1ncccn1)OCc2ccccc2 62a_100000753625_100000211032 [0,0,0,0,0,0|3,0,1]=4 282 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccc2 2708a_100015324214_100015324214 [0,0,0,0,0,0|2,0,1]=3 283 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccc2 273464a_100015324214_100015324214 [0,0,0,0,0,0|2,0,1]=3 284 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccc2 512a_100015324214_100015324214 [0,0,0,0,0,0|2,0,1]=3 285 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccn2 2708a_100000210449_100015324214 [0,0,0,0,0,0|3,0,1]=4 286 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccn2 2708a_100015324214_100000210449 [0,0,0,0,0,0|3,0,1]=4 287 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccn2 273464a_100000210449_100015324214 [0,0,0,0,0,0|3,0,1]=4 288 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccn2 273464a_100015324214_100000210449 [0,0,0,0,0,0|3,0,1]=4 289 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccn2 512a_100015324214_100000210449 [0,0,0,0,0,0|3,0,1]=4 290 B19R2.16162 O=C(NCc1ccccc1)NCc2cccnc2 2708a_100000210453_100015324214 [0,0,0,0,0,0|3,0,1]=4 291 B19R2.16162 O=C(NCc1ccccc1)NCc2cccnc2 2708a_100015324214_100000210453 [0,0,0,0,0,0|3,0,1]=4 292 B19R2.16162 O=C(NCc1ccccc1)NCc2cccnc2 273464a_100000210453_100015324214 [0,0,0,0,0,0|3,0,1]=4 293 B19R2.16162 O=C(NCc1ccccc1)NCc2cccnc2 273464a_100015324214_100000210453 [0,0,0,0,0,0|3,0,1]=4 294 B19R2.16162 O=C(NCc1ccccc1)NCc2cccnc2 512a_100000210453_100015324214 [0,0,0,0,0,0|3,0,1]=4 295 B19R2.16162 O=C(NCc1ccccc1)NCc2cccnc2 512a_100015324214_100000210453 [0,0,0,0,0,0|3,0,1]=4 296 B19R2.16162 O=C(NCc1ccccc1)NCc2ccncc2 2708a_100000210450_100015324214 [0,0,0,0,0,0|3,0,1]=4 297 B19R2.16162 O=C(NCc1ccccc1)NCc2ccncc2 2708a_100015324214_100000210450 [0,0,0,0,0,0|3,0,1]=4 298 B19R2.16162 O=C(NCc1ccccc1)NCc2ccncc2 273464a_100000210450_100015324214 [0,0,0,0,0,0|3,0,1]=4 299 B19R2.16162 O=C(NCc1ccccc1)NCc2ccncc2 273464a_100015324214_100000210450 [0,0,0,0,0,0|3,0,1]=4 300 B19R2.16162 O=C(NCc1ccccc1)NCc2ccncc2 512a_100015324214_100000210450 [0,0,0,0,0,0|3,0,1]=4 301 B19R2.16162 O=C(NCc1ccccc1)NNc2ccccc2 273464a_100015324214_100015195140 [0,0,0,0,0,0|3,0,0]=3 302 B19R2.16162 O=C(NCc1ccccc1)NNc2ccccc2 512a_100015324214_100015195140 [0,0,0,0,0,0|3,0,0]=3 303 B19R2.16162 O=C(NCc1ccccc1)NNc2ccccn2 273464a_100015324214_100000183288 [0,0,0,0,0,0|4,0,0]=4 304 B19R2.16162 O=C(NCc1ccccc1)NNc2ccccn2 512a_100015324214_100000183288 [0,0,0,0,0,0|4,0,0]=4 305 B19R2.16162 O=C(NCc1ccccc1)NNc2cccnc2 273464a_100015324214_100000728903 [0,0,0,0,0,0|4,0,0]=4 306 B19R2.16162 O=C(NCc1ccccc1)NNc2cccnc2 512a_100015324214_100000728903 [0,0,0,0,0,0|4,0,0]=4 307 B19R2.16162 O=C(NCc1ccccc1)NNc2ccncc2 273464a_100015324214_100000698918 [0,0,0,0,0,0|4,0,0]=4 308 B19R2.16162 O=C(NCc1ccccc1)NNc2ccncc2 512a_100015324214_100000698918 [0,0,0,0,0,0|4,0,0]=4 309 B19R2.16162 O=C(NCc1ccccn1)NNc2ccccc2 273464a_100000210449_100015195140 [0,0,0,0,0,0|4,0,0]=4 310 B19R2.16162 O=C(NCc1cccnc1)NNc2ccccc2 273464a_100000210453_100015195140 [0,0,0,0,0,0|4,0,0]=4 311 B19R2.16162 O=C(NCc1cccnc1)NNc2ccccc2 512a_100000210453_100015195140 [0,0,0,0,0,0|4,0,0]=4 312 B19R2.16162 O=C(NCc1ccncc1)NNc2ccccc2 273464a_100000210450_100015195140 [0,0,0,0,0,0|4,0,0]=4 313 B18R2.2525 C(#Cc1ccccc1)COCc2ccccc2 34a_100000210790_100011352542 [1,0,0,0,0,0|0,0,3]=4 314 B18R2.2525 C(#Cc1ccccc1)COCc2ccccc2 34a_100011217464_100015291786 [1,0,0,0,0,0|0,0,3]=4 315 B18R2.2525 C(#Cc1ccccc1)COCc2ccccc2 7a_100000210790_100011352542 [1,0,0,0,0,0|0,0,3]=4 316 B18R2.2525 C(#Cc1ccccc1)COCc2ccccc2 7a_100011217464_100000211182 [1,0,0,0,0,0|0,0,3]=4 317 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 2230a_100015324214_100016265936 [1,0,0,0,0,0|1,0,1]=3 318 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 2230a_100020603302_100015291786 [1,0,0,0,0,0|1,0,1]=3 319 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 270004a_100020603302_100015611070 [1,0,0,0,0,0|1,0,1]=3 320 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 34a_100015324214_100016265936 [1,0,0,0,0,0|1,0,1]=3 321 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 34a_100020603302_100015291786 [1,0,0,0,0,0|1,0,1]=3 322 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccn2 2230a_100020603302_100000721315 [1,0,0,0,0,0|2,0,1]=4 323 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccn2 270004a_100020603302_100000209966 [1,0,0,0,0,0|2,0,1]=4 324 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccn2 34a_100020603302_100000721315 [1,0,0,0,0,0|2,0,1]=4 325 B18R2.2525 C(=C/c1ccccc1)\CNCc2cccnc2 2230a_100020603302_100000741622 [1,0,0,0,0,0|2,0,1]=4 326 B18R2.2525 C(=C/c1ccccc1)\CNCc2cccnc2 270004a_100020603302_100000209961 [1,0,0,0,0,0|2,0,1]=4 327 B18R2.2525 C(=C/c1ccccc1)\CNCc2cccnc2 34a_100020603302_100000733263 [1,0,0,0,0,0|2,0,1]=4 328 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccncc2 2230a_100020603302_100015193705 [1,0,0,0,0,0|2,0,1]=4 329 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 34a_100000210256_100015291786 [1,0,0,0,0,0|0,0,1]=2 330 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 34a_100000210790_100016265936 [1,0,0,0,0,0|0,0,1]=2 331 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 7a_100000210790_100016265936 [1,0,0,0,0,0|0,0,1]=2 332 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccn2 34a_100000210256_100000721315 [1,0,0,0,0,0|1,0,1]=3 333 B18R2.2525 C(=C/c1ccccc1)\COCc2cccnc2 34a_100000210256_100000733263 [1,0,0,0,0,0|1,0,1]=3 334 B18R2.2525 C(=C/c1ccccc1)\COCc2cccnn2 34a_100000210256_100016990269 [1,0,0,0,0,0|2,0,1]=4 335 B18R2.2525 C(=C/c1ccccc1)\COCc2cnccn2 34a_100000210256_100016995436 [1,0,0,0,0,0|2,0,1]=4 336 B18R2.2525 C(=C/c1ccccc1)\COCc2cncnc2 34a_100000210256_100015196519 [1,0,0,0,0,0|2,0,1]=4 337 B18R2.2525 C(=C/c1ccccc1)\COCc2ncccn2 34a_100000210256_100000703007 [1,0,0,0,0,0|2,0,1]=4 338 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccc2 62a_100000211182_100016265936 [1,0,0,0,0,0|0,1,1]=3 339 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccc2 62a_100016265936_100015291786 [1,0,0,0,0,0|0,1,1]=3 340 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccn2 62a_100000721315_100016265936 [1,0,0,0,0,0|1,1,1]=4 341 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccn2 62a_100016265936_100000721315 [1,0,0,0,0,0|1,1,1]=4 342 B18R2.2525 C(=C/c1ccccc1)\CSCc2cccnc2 62a_100000741622_100016265936 [1,0,0,0,0,0|1,1,1]=4 343 B18R2.2525 C(=C/c1ccccc1)\CSCc2cccnc2 62a_100016265936_100000741622 [1,0,0,0,0,0|1,1,1]=4 344 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccncc2 62a_100015193705_100016265936 [1,0,0,0,0,0|1,1,1]=4 345 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccncc2 62a_100016265936_100015193705 [1,0,0,0,0,0|1,1,1]=4 346 B18R2.2525 C(=C/c1cccnc1)\COCc2ccccc2 34a_200102594124_100015291786 [1,0,0,0,0,0|1,0,1]=3 347 B18R2.2525 C(=C/c1cccnc1)\COCc2ccccn2 34a_200102594124_100000721315 [1,0,0,0,0,0|2,0,1]=4 348 B18R2.2525 C(=C/c1cccnc1)\COCc2cccnc2 34a_200102594124_100000733263 [1,0,0,0,0,0|2,0,1]=4 349 B18R2.2525 C(=Cc1ccccc1)C=NNc2ccccc2 4a_100015195140_100000210105 [1,0,0,0,0,0|2,0,0]=3 350 B18R2.2525 C(=Cc1ccccc1)C=NNc2ccccn2 4a_100000183288_100000210105 [1,0,0,0,0,0|3,0,0]=4 351 B18R2.2525 C(=Cc1ccccc1)C=NNc2cccnc2 4a_100000728903_100000210105 [1,0,0,0,0,0|3,0,0]=4 352 B18R2.2525 C(=Cc1ccccc1)C=NNc2ccncc2 4a_100000698918_100000210105 [1,0,0,0,0,0|3,0,0]=4 353 B18R2.2525 C(=Cc1ccccc1)CNCc2ccccc2 270004a_100015324214_100000210105 [1,0,0,0,0,0|1,0,1]=3 354 B18R2.2525 C(=Cc1ccccc1)CNCc2ccccn2 270004a_100000210449_100000210105 [1,0,0,0,0,0|2,0,1]=4 355 B18R2.2525 C(=Cc1ccccc1)CNCc2cccnc2 270004a_100000210453_100000210105 [1,0,0,0,0,0|2,0,1]=4 356 B18R2.2525 C(=Cc1ccccc1)COCc2ccccc2 271570a_200011106559_100000210277 [1,0,0,0,0,0|0,0,1]=2 357 B18R2.2525 C(=Cc1ccccn1)COCc2ccccc2 271570a_200011106559_100011216584 [1,0,0,0,0,0|1,0,1]=3 358 B18R2.2525 C(=Cc1cccnc1)COCc2ccccc2 271570a_200011106559_100000752921 [1,0,0,0,0,0|1,0,1]=3 359 B18R2.2525 C(=Cc1cccnn1)COCc2ccccc2 271570a_200011106559_100016991348 [1,0,0,0,0,0|2,0,1]=4 360 B18R2.2525 C(=Cc1ccncc1)C=NNc2ccccc2 4a_100015195140_100000703957 [1,0,0,0,0,0|3,0,0]=4 361 B18R2.2525 C(=Cc1ccncc1)COCc2ccccc2 271570a_200011106559_100000035832 [1,0,0,0,0,0|1,0,1]=3 362 B18R2.2525 C(=Cc1ccncn1)COCc2ccccc2 271570a_200011106559_100000703185 [1,0,0,0,0,0|2,0,1]=4 363 B18R2.2525 C(=Cc1ccnnc1)COCc2ccccc2 271570a_200011106559_100000732662 [1,0,0,0,0,0|2,0,1]=4 364 B18R2.2525 C(=Cc1cnccn1)COCc2ccccc2 271570a_200011106559_100000758340 [1,0,0,0,0,0|2,0,1]=4 365 B18R2.2525 C(=Cc1cncnc1)COCc2ccccc2 271570a_200011106559_100011206942 [1,0,0,0,0,0|2,0,1]=4 366 B18R2.2525 C(=Cc1ncccn1)COCc2ccccc2 271570a_200011106559_100000211032 [1,0,0,0,0,0|2,0,1]=4 367 B18R2.2525 C(=NNCCc1ccccc1)c2ccccc2 4a_100000740470_100015611070 [1,0,0,0,0,0|3,0,0]=4 368 B18R2.2525 C(=NNCc1ccccc1)Cc2ccccc2 4a_100000007032_100000209964 [1,0,0,0,0,0|2,0,1]=4 369 B18R2.2525 C(=NNc1ccccc1)CCc2ccccc2 4a_100015195140_100000198083 [1,0,0,0,0,0|3,0,0]=4 370 B18R2.2525 c1ccc(cc1)CCCOCc2ccccc2 34a_100000210790_100000211621 [1,0,0,0,0,0|0,0,3]=4 371 B18R2.2525 c1ccc(cc1)CCCOCc2ccccc2 34a_100000210828_100015291786 [1,0,0,0,0,0|0,0,3]=4 372 B18R2.2525 c1ccc(cc1)CCCOCc2ccccc2 7a_100000210790_100000211621 [1,0,0,0,0,0|0,0,3]=4 373 B18R2.2525 c1ccc(cc1)CCCOCc2ccccc2 7a_100000210828_100000211182 [1,0,0,0,0,0|0,0,3]=4 374 B18R2.2525 c1ccc(cc1)CNCOCc2ccccc2 2230a_100015324214_100000763385 [1,0,0,0,0,0|1,0,2]=4 375 B18R2.2525 c1ccc(cc1)CNCOCc2ccccc2 34a_100015324214_100000763385 [1,0,0,0,0,0|1,0,2]=4 376 B18R2.2525 c1ccc(cc1)COCCNc2ccccc2 34a_100000106764_100000234347 [1,0,0,0,0,0|1,0,2]=4 377 B18R2.2525 c1ccc(cc1)COCCNc2ccccc2 34a_100000211345_100015291786 [1,0,0,0,0,0|1,0,2]=4 378 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 34a_100000210260_100015291786 [1,0,0,0,0,0|1,0,2]=4 379 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 34a_100000210340_100000234347 [1,0,0,0,0,0|1,0,2]=4 380 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 34a_100000210790_100000184471 [1,0,0,0,0,0|1,0,2]=4 381 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 7a_100000210260_100000211182 [1,0,0,0,0,0|1,0,2]=4 382 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 7a_100000210340_100000234347 [1,0,0,0,0,0|1,0,2]=4 383 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 7a_100000210790_100000184471 [1,0,0,0,0,0|1,0,2]=4 384 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 34a_100000210790_100000246102 [1,0,0,0,0,0|1,0,2]=4 385 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 62a_100000234347_100000041952 [1,0,0,0,0,0|1,0,2]=4 386 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 62a_100000719477_100000234347 [1,0,0,0,0,0|1,0,2]=4 387 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 7a_100000210790_100000246102 [1,0,0,0,0,0|1,0,2]=4 388 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 7a_100000230494_100000211182 [1,0,0,0,0,0|1,0,2]=4 389 B18R2.2525 c1ccc(cc1)COCOCc2ccccc2 34a_100000210790_100000763385 [1,0,0,0,0,0|1,0,2]=4 390 B18R2.2525 c1ccc(cc1)COCSCc2ccccc2 34a_100000210790_200011217039 [1,0,0,0,0,0|1,0,2]=4 391 B18R2.2525 c1ccc(cc1)COCSCc2ccccc2 62a_100000211182_100000763385 [1,0,0,0,0,0|1,0,2]=4 392 B18R2.2525 c1ccc(cc1)COCSCc2ccccc2 62a_100000763385_100015291786 [1,0,0,0,0,0|1,0,2]=4 393 B20R2.4449 CC(=NNc1ccc(cc1)Br)C=Cc2ccccc2 4a_100000735608_100000204604 [0,1,0,0,0,0|3,0,0]=4 394 B20R2.4449 CC(=NNc1ccc(cc1)C)C=Cc2ccccc2 4a_100000683527_100000204604 [0,1,0,0,0,0|3,0,0]=4 395 B20R2.4449 CC(=NNc1ccc(cc1)Cl)C=Cc2ccccc2 4a_100000683521_100000204604 [0,1,0,0,0,0|3,0,0]=4 396 B20R2.4449 CC(=NNc1ccc(cc1)F)C=Cc2ccccc2 4a_100000728448_100000204604 [0,1,0,0,0,0|3,0,0]=4 397 B20R2.4449 CC(=NNc1ccc(cc1)I)C=Cc2ccccc2 4a_100016988836_100000204604 [0,1,0,0,0,0|3,0,0]=4 398 B20R2.4449 CC(=NNc1ccccc1)C=Cc2ccc(cc2)Br 4a_100015195140_200016259395 [0,1,0,0,0,0|3,0,0]=4 399 B20R2.4449 CC(=NNc1ccccc1)C=Cc2ccc(cc2)Cl 4a_100015195140_100016256711 [0,1,0,0,0,0|3,0,0]=4 400 B20R2.4449 CC(=NNc1ccccc1)C=Cc2ccc(cc2)O 4a_100015195140_100000189429 [0,1,0,0,0,0|3,0,0]=4 401 B20R2.4449 Cc1ccc(cc1)C=CC(=O)CCc2ccccc2 1458a_100000716854_100000765856 [0,1,0,0,0,0|1,0,0]=2 402 B20R2.4449 Cc1ccc(cc1)C=CC(=O)CCc2ccccn2 1458a_100000716854_100015183660 [0,1,0,0,0,0|2,0,0]=3 403 B20R2.4449 Cc1ccc(cc1)C=CC(=O)CCc2cccnc2 1458a_100000716854_200011713674 [0,1,0,0,0,0|2,0,0]=3 404 B20R2.4449 Cc1ccc(cc1)C=CC(=O)CCc2ccncc2 1458a_100000716854_100000723409 [0,1,0,0,0,0|2,0,0]=3 405 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000716854 [0,1,0,0,0,0|1,0,0]=2 406 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000716854 [0,1,0,0,0,0|1,0,0]=2 407 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100000716854 [0,1,0,0,0,0|1,0,0]=2 408 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 11a_100000210449_100000716854 [0,1,0,0,0,0|2,0,0]=3 409 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000716854 [0,1,0,0,0,0|2,0,0]=3 410 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 240690a_100000210449_100000716854 [0,1,0,0,0,0|2,0,0]=3 411 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2 11a_100000210453_100000716854 [0,1,0,0,0,0|2,0,0]=3 412 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2 240690a_100000210453_100000716854 [0,1,0,0,0,0|2,0,0]=3 413 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cccnn2 11a_100159270163_100000716854 [0,1,0,0,0,0|3,0,0]=4 414 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cccnn2 240690a_100159270163_100000716854 [0,1,0,0,0,0|3,0,0]=4 415 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 11a_100000210450_100000716854 [0,1,0,0,0,0|2,0,0]=3 416 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000716854 [0,1,0,0,0,0|2,0,0]=3 417 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 240690a_100000210450_100000716854 [0,1,0,0,0,0|2,0,0]=3 418 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccncn2 11a_100000736019_100000716854 [0,1,0,0,0,0|3,0,0]=4 419 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccncn2 240690a_100000736019_100000716854 [0,1,0,0,0,0|3,0,0]=4 420 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cnccn2 11a_100000737960_100000716854 [0,1,0,0,0,0|3,0,0]=4 421 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cnccn2 240690a_100000737960_100000716854 [0,1,0,0,0,0|3,0,0]=4 422 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cncnc2 11a_100011243677_100000716854 [0,1,0,0,0,0|3,0,0]=4 423 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cncnc2 240690a_100011243677_100000716854 [0,1,0,0,0,0|3,0,0]=4 424 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ncccn2 11a_100015189908_100000716854 [0,1,0,0,0,0|3,0,0]=4 425 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ncccn2 240690a_100015189908_100000716854 [0,1,0,0,0,0|3,0,0]=4 426 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000716854 [0,1,0,0,0,0|2,0,0]=3 427 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NNc2ccccn2 22a_100000183288_100000716854 [0,1,0,0,0,0|3,0,0]=4 428 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NNc2cccnc2 22a_100000728903_100000716854 [0,1,0,0,0,0|3,0,0]=4 429 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NNc2ccncc2 22a_100000698918_100000716854 [0,1,0,0,0,0|3,0,0]=4 430 B20R2.4449 Cc1ccc(cc1)CCC(=O)C#Cc2ccccc2 1458a_100000736102_100011713686 [0,1,0,0,0,0|1,0,2]=4 431 B20R2.4449 Cc1ccc(cc1)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100011713686 [0,1,0,0,0,0|1,0,0]=2 432 B20R2.4449 Cc1ccc(cc1)CCC(=O)C=Cc2ccccn2 1458a_100000740811_100011713686 [0,1,0,0,0,0|2,0,0]=3 433 B20R2.4449 Cc1ccc(cc1)CCC(=O)C=Cc2cccnc2 1458a_100000735890_100011713686 [0,1,0,0,0,0|2,0,0]=3 434 B20R2.4449 Cc1ccc(cc1)CCC(=O)C=Cc2ccncc2 1458a_100000682801_100011713686 [0,1,0,0,0,0|2,0,0]=3 435 B20R2.4449 Cc1ccc(cc1)CCC(=O)CCc2ccccc2 1458a_100000185753_100011713686 [0,1,0,0,0,0|1,0,2]=4 436 B20R2.4449 Cc1ccc(cc1)CCC(=O)CCc2ccccc2 1458a_100000234883_100000765856 [0,1,0,0,0,0|1,0,2]=4 437 B20R2.4449 Cc1ccc(cc1)CCC(=O)COc2ccccc2 1458a_100000186222_100011713686 [0,1,0,0,0,0|2,0,1]=4 438 B20R2.4449 Cc1ccc(cc1)CCC(=O)CSc2ccccc2 1458a_100000211596_100011713686 [0,1,0,0,0,0|2,0,1]=4 439 B20R2.4449 Cc1ccc(cc1)CCC(=O)NCc2ccccc2 11a_100015324214_100000234883 [0,1,0,0,0,0|1,0,2]=4 440 B20R2.4449 Cc1ccc(cc1)CCC(=O)NCc2ccccc2 1626a_100015324214_100000234883 [0,1,0,0,0,0|1,0,2]=4 441 B20R2.4449 Cc1ccc(cc1)CCC(=O)NCc2ccccc2 240690a_100015324214_100000234883 [0,1,0,0,0,0|1,0,2]=4 442 B20R2.4449 Cc1ccc(cc1)CCC(=O)NCc2ccccc2 527a_100015324214_100000234883 [0,1,0,0,0,0|1,0,2]=4 443 B20R2.4449 Cc1ccc(cc1)CCC(=O)NNc2ccccc2 22a_100015195140_100000234883 [0,1,0,0,0,0|3,0,0]=4 444 B20R2.4449 Cc1ccc(cc1)CNC(=O)C#Cc2ccccc2 240690a_100000174908_100000736102 [0,1,0,0,0,0|1,0,2]=4 445 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 11a_100000174908_100000210462 [0,1,0,0,0,0|1,0,0]=2 446 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 1626a_100000174908_100000210462 [0,1,0,0,0,0|1,0,0]=2 447 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 11a_100000174908_100000740811 [0,1,0,0,0,0|2,0,0]=3 448 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 240690a_100000174908_100000740811 [0,1,0,0,0,0|2,0,0]=3 449 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 11a_100000174908_100000735890 [0,1,0,0,0,0|2,0,0]=3 450 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 240690a_100000174908_100000735890 [0,1,0,0,0,0|2,0,0]=3 451 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccncc2 240690a_100000174908_100000682801 [0,1,0,0,0,0|2,0,0]=3 452 B20R2.4449 Cc1ccc(cc1)CNC(=O)CCc2ccccc2 11a_100000174908_100000185753 [0,1,0,0,0,0|1,0,2]=4 453 B20R2.4449 Cc1ccc(cc1)CNC(=O)CCc2ccccc2 1626a_100000174908_100000185753 [0,1,0,0,0,0|1,0,2]=4 454 B20R2.4449 Cc1ccc(cc1)CNC(=O)CCc2ccccc2 240690a_100000174908_100000185753 [0,1,0,0,0,0|1,0,2]=4 455 B20R2.4449 Cc1ccc(cc1)CNC(=O)CCc2ccccc2 527a_100000174908_100000185753 [0,1,0,0,0,0|1,0,2]=4 456 B20R2.4449 Cc1ccc(cc1)CNC(=O)CNc2ccccc2 34a_100000106764_100000183211 [0,1,0,0,0,0|2,0,1]=4 457 B20R2.4449 Cc1ccc(cc1)CNC(=O)COc2ccccc2 11a_100000174908_100000186222 [0,1,0,0,0,0|2,0,1]=4 458 B20R2.4449 Cc1ccc(cc1)CNC(=O)COc2ccccc2 1626a_100000174908_100000186222 [0,1,0,0,0,0|2,0,1]=4 459 B20R2.4449 Cc1ccc(cc1)CNC(=O)COc2ccccc2 240690a_100000174908_100000186222 [0,1,0,0,0,0|2,0,1]=4 460 B20R2.4449 Cc1ccc(cc1)CNC(=O)COc2ccccc2 34a_100000210340_100000183211 [0,1,0,0,0,0|2,0,1]=4 461 B20R2.4449 Cc1ccc(cc1)CNC(=O)COc2ccccc2 527a_100000174908_100000186222 [0,1,0,0,0,0|2,0,1]=4 462 B20R2.4449 Cc1ccc(cc1)CNC(=O)COc2ccccc2 7a_100000210340_100000183211 [0,1,0,0,0,0|2,0,1]=4 463 B20R2.4449 Cc1ccc(cc1)CNC(=O)CSc2ccccc2 11a_100000174908_100000211596 [0,1,0,0,0,0|2,0,1]=4 464 B20R2.4449 Cc1ccc(cc1)CNC(=O)CSc2ccccc2 1626a_100000174908_100000211596 [0,1,0,0,0,0|2,0,1]=4 465 B20R2.4449 Cc1ccc(cc1)CNC(=O)CSc2ccccc2 240690a_100000174908_100000211596 [0,1,0,0,0,0|2,0,1]=4 466 B20R2.4449 Cc1ccc(cc1)CNC(=O)CSc2ccccc2 527a_100000174908_100000211596 [0,1,0,0,0,0|2,0,1]=4 467 B20R2.4449 Cc1ccc(cc1)CNC(=O)CSc2ccccc2 62a_100000183211_100000041952 [0,1,0,0,0,0|2,0,1]=4 468 B20R2.4449 Cc1ccc(cc1)CNC(=O)CSc2ccccc2 62a_100000719477_100000183211 [0,1,0,0,0,0|2,0,1]=4 469 B20R2.4449 Cc1ccc(cc1)CNC(=O)NCc2ccccc2 2708a_100000174908_100015324214 [0,1,0,0,0,0|2,0,1]=4 470 B20R2.4449 Cc1ccc(cc1)CNC(=O)NCc2ccccc2 2708a_100015324214_100000174908 [0,1,0,0,0,0|2,0,1]=4 471 B20R2.4449 Cc1ccc(cc1)CNC(=O)NCc2ccccc2 273464a_100000174908_100015324214 [0,1,0,0,0,0|2,0,1]=4 472 B20R2.4449 Cc1ccc(cc1)CNC(=O)NCc2ccccc2 273464a_100015324214_100000174908 [0,1,0,0,0,0|2,0,1]=4 473 B20R2.4449 Cc1ccc(cc1)CNC(=O)NCc2ccccc2 512a_100000174908_100015324214 [0,1,0,0,0,0|2,0,1]=4 474 B20R2.4449 Cc1ccc(cc1)CNC(=O)NCc2ccccc2 512a_100015324214_100000174908 [0,1,0,0,0,0|2,0,1]=4 475 B20R2.4449 Cc1ccc(cc1)CNC(=O)NNc2ccccc2 273464a_100000174908_100015195140 [0,1,0,0,0,0|3,0,0]=4 476 B20R2.4449 Cc1ccc(cc1)CNC(=O)NNc2ccccc2 512a_100000174908_100015195140 [0,1,0,0,0,0|3,0,0]=4 477 B20R2.4449 Cc1ccc(cc1)NCC(=O)CCc2ccccc2 34a_100000124888_100012361361 [0,1,0,0,0,0|2,0,1]=4 478 B20R2.4449 Cc1ccc(cc1)NCC(=O)NCc2ccccc2 34a_100000124888_100000183539 [0,1,0,0,0,0|2,0,1]=4 479 B20R2.4449 Cc1ccc(cc1)NCC(=O)OCc2ccccc2 34a_100000124888_100000753625 [0,1,0,0,0,0|1,0,1]=3 480 B20R2.4449 Cc1ccc(cc1)NNC(=O)C=Cc2ccccc2 22a_100000683527_100000210462 [0,1,0,0,0,0|2,0,0]=3 481 B20R2.4449 Cc1ccc(cc1)NNC(=O)C=Cc2ccccn2 22a_100000683527_100000740811 [0,1,0,0,0,0|3,0,0]=4 482 B20R2.4449 Cc1ccc(cc1)NNC(=O)C=Cc2cccnc2 22a_100000683527_100000735890 [0,1,0,0,0,0|3,0,0]=4 483 B20R2.4449 Cc1ccc(cc1)NNC(=O)C=Cc2ccncc2 22a_100000683527_100000682801 [0,1,0,0,0,0|3,0,0]=4 484 B20R2.4449 Cc1ccc(cc1)NNC(=O)CCc2ccccc2 22a_100000683527_100000185753 [0,1,0,0,0,0|3,0,0]=4 485 B20R2.4449 Cc1ccc(cc1)NNC(=O)NCc2ccccc2 273464a_100015324214_100000683527 [0,1,0,0,0,0|3,0,0]=4 486 B20R2.4449 Cc1ccc(cc1)NNC(=O)NCc2ccccc2 512a_100015324214_100000683527 [0,1,0,0,0,0|3,0,0]=4 487 B20R2.4449 Cc1ccc(cc1)OCC(=O)CCc2ccccc2 1458a_100000182360_100000765856 [0,1,0,0,0,0|2,0,1]=4 488 B20R2.4449 Cc1ccc(cc1)OCC(=O)CCc2ccccc2 34a_100000210336_100012361361 [0,1,0,0,0,0|2,0,1]=4 489 B20R2.4449 Cc1ccc(cc1)OCC(=O)CCc2ccccc2 7a_100000210336_100012361361 [0,1,0,0,0,0|2,0,1]=4 490 B20R2.4449 Cc1ccc(cc1)OCC(=O)NCc2ccccc2 11a_100015324214_100000182360 [0,1,0,0,0,0|2,0,1]=4 491 B20R2.4449 Cc1ccc(cc1)OCC(=O)NCc2ccccc2 1626a_100015324214_100000182360 [0,1,0,0,0,0|2,0,1]=4 492 B20R2.4449 Cc1ccc(cc1)OCC(=O)NCc2ccccc2 240690a_100015324214_100000182360 [0,1,0,0,0,0|2,0,1]=4 493 B20R2.4449 Cc1ccc(cc1)OCC(=O)NCc2ccccc2 34a_100000210336_100000183539 [0,1,0,0,0,0|2,0,1]=4 494 B20R2.4449 Cc1ccc(cc1)OCC(=O)NCc2ccccc2 527a_100015324214_100000182360 [0,1,0,0,0,0|2,0,1]=4 495 B20R2.4449 Cc1ccc(cc1)OCC(=O)NCc2ccccc2 7a_100000210336_100000183539 [0,1,0,0,0,0|2,0,1]=4 496 B20R2.4449 Cc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000210336_100000753625 [0,1,0,0,0,0|1,0,1]=3 497 B20R2.4449 Cc1ccc(cc1)OCC(=O)OCc2ccccc2 7a_100000210336_100000753625 [0,1,0,0,0,0|1,0,1]=3 498 B20R2.4449 Cc1ccc(cc1)SCC(=O)CCc2ccccc2 1458a_100000179497_100000765856 [0,1,0,0,0,0|2,0,1]=4 499 B20R2.4449 Cc1ccc(cc1)SCC(=O)CCc2ccccc2 62a_100000186775_100012361361 [0,1,0,0,0,0|2,0,1]=4 500 B20R2.4449 Cc1ccc(cc1)SCC(=O)CCc2ccccc2 62a_100012361361_100000186775 [0,1,0,0,0,0|2,0,1]=4 501 B20R2.4449 Cc1ccc(cc1)SCC(=O)NCc2ccccc2 11a_100015324214_100000179497 [0,1,0,0,0,0|2,0,1]=4 502 B20R2.4449 Cc1ccc(cc1)SCC(=O)NCc2ccccc2 1626a_100015324214_100000179497 [0,1,0,0,0,0|2,0,1]=4 503 B20R2.4449 Cc1ccc(cc1)SCC(=O)NCc2ccccc2 240690a_100015324214_100000179497 [0,1,0,0,0,0|2,0,1]=4 504 B20R2.4449 Cc1ccc(cc1)SCC(=O)NCc2ccccc2 527a_100015324214_100000179497 [0,1,0,0,0,0|2,0,1]=4 505 B20R2.4449 Cc1ccc(cc1)SCC(=O)NCc2ccccc2 62a_100000183539_100000186775 [0,1,0,0,0,0|2,0,1]=4 506 B20R2.4449 Cc1ccc(cc1)SCC(=O)NCc2ccccc2 62a_100000186775_100000183539 [0,1,0,0,0,0|2,0,1]=4 507 B20R2.4449 Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000186775_100000753625 [0,1,0,0,0,0|1,0,1]=3 508 B20R2.4449 Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000186775 [0,1,0,0,0,0|1,0,1]=3 509 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2 11a_100000740942_100000210462 [0,1,0,0,0,0|2,0,0]=3 510 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2 1626a_100000740942_100000210462 [0,1,0,0,0,0|2,0,0]=3 511 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2ccccn2 11a_100000740942_100000740811 [0,1,0,0,0,0|3,0,0]=4 512 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2ccccn2 240690a_100000740942_100000740811 [0,1,0,0,0,0|3,0,0]=4 513 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2cccnc2 11a_100000740942_100000735890 [0,1,0,0,0,0|3,0,0]=4 514 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2cccnc2 240690a_100000740942_100000735890 [0,1,0,0,0,0|3,0,0]=4 515 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2ccncc2 240690a_100000740942_100000682801 [0,1,0,0,0,0|3,0,0]=4 516 B20R2.4449 Cc1ccc(cn1)NNC(=O)C=Cc2ccccc2 22a_100020639869_100000210462 [0,1,0,0,0,0|3,0,0]=4 517 B20R2.4449 Cc1ccc(cn1)OCC(=O)OCc2ccccc2 34a_100000745506_100000753625 [0,1,0,0,0,0|2,0,1]=4 518 B20R2.4449 Cc1ccc(cn1)OCC(=O)OCc2ccccc2 7a_100000745506_100000753625 [0,1,0,0,0,0|2,0,1]=4 519 B20R2.4449 Cc1ccc(cn1)SCC(=O)OCc2ccccc2 62a_100000751577_100000753625 [0,1,0,0,0,0|2,0,1]=4 520 B20R2.4449 Cc1ccc(cn1)SCC(=O)OCc2ccccc2 62a_100000753625_100000751577 [0,1,0,0,0,0|2,0,1]=4 521 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2 11a_100015187455_100000210462 [0,1,0,0,0,0|2,0,0]=3 522 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2 1626a_100015187455_100000210462 [0,1,0,0,0,0|2,0,0]=3 523 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2ccccn2 11a_100015187455_100000740811 [0,1,0,0,0,0|3,0,0]=4 524 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2ccccn2 240690a_100015187455_100000740811 [0,1,0,0,0,0|3,0,0]=4 525 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2cccnc2 11a_100015187455_100000735890 [0,1,0,0,0,0|3,0,0]=4 526 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2cccnc2 240690a_100015187455_100000735890 [0,1,0,0,0,0|3,0,0]=4 527 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2ccncc2 240690a_100015187455_100000682801 [0,1,0,0,0,0|3,0,0]=4 528 B20R2.4449 Cc1ccc(nc1)NNC(=O)C=Cc2ccccc2 22a_100000746693_100000210462 [0,1,0,0,0,0|3,0,0]=4 529 B20R2.4449 Cc1ccc(nc1)OCC(=O)OCc2ccccc2 34a_100000759353_100000753625 [0,1,0,0,0,0|2,0,1]=4 530 B20R2.4449 Cc1ccc(nc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000754016 [0,1,0,0,0,0|2,0,1]=4 531 B20R2.4449 Cc1ccc(nc1)SCC(=O)OCc2ccccc2 62a_100011192072_100000753625 [0,1,0,0,0,0|2,0,1]=4 532 B20R2.4449 Cc1cnc(cn1)C=CC(=O)CCc2ccccc2 6a_100000685221_100000210092 [0,1,0,0,0,0|3,0,0]=4 533 B20R2.4449 Cc1cnc(cn1)CNC(=O)C=Cc2ccccc2 11a_100132314150_100000210462 [0,1,0,0,0,0|3,0,0]=4 534 B20R2.4449 Cc1ncc(cn1)C=CC(=O)CCc2ccccc2 6a_100011202771_100000210092 [0,1,0,0,0,0|3,0,0]=4 535 B20R2.4449 Nc1ccc(cc1)OCC(=O)CCc2ccccc2 34a_100000185829_100012361361 [0,1,0,0,0,0|2,0,1]=4 536 B20R2.4449 Nc1ccc(cc1)OCC(=O)NCc2ccccc2 34a_100000185829_100000183539 [0,1,0,0,0,0|2,0,1]=4 537 B20R2.4449 Nc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000185829_100000753625 [0,1,0,0,0,0|1,0,1]=3 538 B20R2.4449 Nc1ccc(cc1)SCC(=O)CCc2ccccc2 62a_100000185761_100012361361 [0,1,0,0,0,0|2,0,1]=4 539 B20R2.4449 Nc1ccc(cc1)SCC(=O)CCc2ccccc2 62a_100012361361_100000185761 [0,1,0,0,0,0|2,0,1]=4 540 B20R2.4449 Nc1ccc(cc1)SCC(=O)NCc2ccccc2 62a_100000183539_100000185761 [0,1,0,0,0,0|2,0,1]=4 541 B20R2.4449 Nc1ccc(cc1)SCC(=O)NCc2ccccc2 62a_100000185761_100000183539 [0,1,0,0,0,0|2,0,1]=4 542 B20R2.4449 Nc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000185761_100000753625 [0,1,0,0,0,0|1,0,1]=3 543 B20R2.4449 Nc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000185761 [0,1,0,0,0,0|1,0,1]=3 544 B20R2.4449 Nc1ccc(cn1)OCC(=O)OCc2ccccc2 34a_100015188713_100000753625 [0,1,0,0,0,0|2,0,1]=4 545 B20R2.4449 Nc1ccc(cn1)OCC(=O)OCc2ccccc2 7a_100015188713_100000753625 [0,1,0,0,0,0|2,0,1]=4 546 B20R2.4449 Nc1ccc(cn1)SCC(=O)OCc2ccccc2 62a_100000187370_100000753625 [0,1,0,0,0,0|2,0,1]=4 547 B20R2.4449 Nc1ccc(cn1)SCC(=O)OCc2ccccc2 62a_100000753625_100000187370 [0,1,0,0,0,0|2,0,1]=4 548 B20R2.4449 Nc1ccc(nc1)OCC(=O)OCc2ccccc2 34a_100000729260_100000753625 [0,1,0,0,0,0|2,0,1]=4 549 B20R2.4449 Nc1ccc(nc1)SCC(=O)OCc2ccccc2 62a_100000737798_100000753625 [0,1,0,0,0,0|2,0,1]=4 550 B20R2.4449 Nc1ccc(nc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000737798 [0,1,0,0,0,0|2,0,1]=4 551 B20R2.4449 O=C(C#Cc1ccc(cc1)Br)CCc2ccccc2 1458a_100012100275_100000765856 [0,1,0,0,0,0|1,0,2]=4 552 B20R2.4449 O=C(C#Cc1ccc(cc1)Cl)CCc2ccccc2 1458a_100011892723_100000765856 [0,1,0,0,0,0|1,0,2]=4 553 B20R2.4449 O=C(C#Cc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100011892723 [0,1,0,0,0,0|1,0,2]=4 554 B20R2.4449 O=C(C#Cc1ccc(cc1)F)CCc2ccccc2 1458a_100000238512_100000765856 [0,1,0,0,0,0|1,0,2]=4 555 B20R2.4449 O=C(C#Cc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100000238512 [0,1,0,0,0,0|1,0,2]=4 556 B20R2.4449 O=C(C#Cc1ccccc1)CCc2ccc(cc2)Br 1458a_100000736102_100011740612 [0,1,0,0,0,0|1,0,2]=4 557 B20R2.4449 O=C(C#Cc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000736102_100011713675 [0,1,0,0,0,0|1,0,2]=4 558 B20R2.4449 O=C(C#Cc1ccccc1)CCc2ccc(cc2)F 1458a_100000736102_100011217392 [0,1,0,0,0,0|1,0,2]=4 559 B20R2.4449 O=C(C#Cc1ccccc1)CCc2ccc(cc2)O 1458a_100000736102_100009816426 [0,1,0,0,0,0|1,0,2]=4 560 B20R2.4449 O=C(C#Cc1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100000736102 [0,1,0,0,0,0|1,0,2]=4 561 B20R2.4449 O=C(C#Cc1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000736102 [0,1,0,0,0,0|1,0,2]=4 562 B20R2.4449 O=C(C#Cc1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100000736102 [0,1,0,0,0,0|1,0,2]=4 563 B20R2.4449 O=C(C#Cc1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100000736102 [0,1,0,0,0,0|1,0,2]=4 564 B20R2.4449 O=C(C#Cc1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100000736102 [0,1,0,0,0,0|1,0,2]=4 565 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2ccccc2 1458a_100016267368_100000765856 [0,1,0,0,0,0|1,0,0]=2 566 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2ccccc2 6a_100000186029_100000210092 [0,1,0,0,0,0|1,0,0]=2 567 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2ccccn2 1458a_100016267368_100015183660 [0,1,0,0,0,0|2,0,0]=3 568 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2cccnc2 1458a_100016267368_200011713674 [0,1,0,0,0,0|2,0,0]=3 569 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2ccncc2 1458a_100016267368_100000723409 [0,1,0,0,0,0|2,0,0]=3 570 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)COc2ccccc2 6a_100000186029_100000150576 [0,1,0,0,0,0|2,0,0]=3 571 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CSc2ccccc2 6a_100000186029_100000150717 [0,1,0,0,0,0|2,0,0]=3 572 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_100016267368 [0,1,0,0,0,0|1,0,0]=2 573 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2 1626a_100015324214_100016267368 [0,1,0,0,0,0|1,0,0]=2 574 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccccn2 11a_100000210449_100016267368 [0,1,0,0,0,0|2,0,0]=3 575 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccccn2 1626a_100000210449_100016267368 [0,1,0,0,0,0|2,0,0]=3 576 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2cccnc2 11a_100000210453_100016267368 [0,1,0,0,0,0|2,0,0]=3 577 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2cccnn2 11a_100159270163_100016267368 [0,1,0,0,0,0|3,0,0]=4 578 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccncc2 11a_100000210450_100016267368 [0,1,0,0,0,0|2,0,0]=3 579 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccncc2 1626a_100000210450_100016267368 [0,1,0,0,0,0|2,0,0]=3 580 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccncn2 11a_100000736019_100016267368 [0,1,0,0,0,0|3,0,0]=4 581 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2cnccn2 11a_100000737960_100016267368 [0,1,0,0,0,0|3,0,0]=4 582 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2cncnc2 11a_100011243677_100016267368 [0,1,0,0,0,0|3,0,0]=4 583 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ncccn2 11a_100015189908_100016267368 [0,1,0,0,0,0|3,0,0]=4 584 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NNc2ccccc2 22a_100015195140_100016267368 [0,1,0,0,0,0|2,0,0]=3 585 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NNc2ccccn2 22a_100000183288_100016267368 [0,1,0,0,0,0|3,0,0]=4 586 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NNc2cccnc2 22a_100000728903_100016267368 [0,1,0,0,0,0|3,0,0]=4 587 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NNc2ccncc2 22a_100000698918_100016267368 [0,1,0,0,0,0|3,0,0]=4 588 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)CCc2ccccc2 1458a_100000184863_100000765856 [0,1,0,0,0,0|1,0,0]=2 589 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)CCc2ccccn2 1458a_100000184863_100015183660 [0,1,0,0,0,0|2,0,0]=3 590 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)CCc2cccnc2 1458a_100000184863_200011713674 [0,1,0,0,0,0|2,0,0]=3 591 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)CCc2ccncc2 1458a_100000184863_100000723409 [0,1,0,0,0,0|2,0,0]=3 592 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2 11a_100015324214_100000184863 [0,1,0,0,0,0|1,0,0]=2 593 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2 1626a_100015324214_100000184863 [0,1,0,0,0,0|1,0,0]=2 594 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100000184863 [0,1,0,0,0,0|1,0,0]=2 595 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccn2 11a_100000210449_100000184863 [0,1,0,0,0,0|2,0,0]=3 596 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccn2 1626a_100000210449_100000184863 [0,1,0,0,0,0|2,0,0]=3 597 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccn2 240690a_100000210449_100000184863 [0,1,0,0,0,0|2,0,0]=3 598 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2 11a_100000210453_100000184863 [0,1,0,0,0,0|2,0,0]=3 599 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2 240690a_100000210453_100000184863 [0,1,0,0,0,0|2,0,0]=3 600 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnn2 11a_100159270163_100000184863 [0,1,0,0,0,0|3,0,0]=4 601 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnn2 240690a_100159270163_100000184863 [0,1,0,0,0,0|3,0,0]=4 602 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2 11a_100000210450_100000184863 [0,1,0,0,0,0|2,0,0]=3 603 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2 1626a_100000210450_100000184863 [0,1,0,0,0,0|2,0,0]=3 604 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2 240690a_100000210450_100000184863 [0,1,0,0,0,0|2,0,0]=3 605 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncn2 11a_100000736019_100000184863 [0,1,0,0,0,0|3,0,0]=4 606 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncn2 240690a_100000736019_100000184863 [0,1,0,0,0,0|3,0,0]=4 607 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cnccn2 11a_100000737960_100000184863 [0,1,0,0,0,0|3,0,0]=4 608 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cnccn2 240690a_100000737960_100000184863 [0,1,0,0,0,0|3,0,0]=4 609 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cncnc2 11a_100011243677_100000184863 [0,1,0,0,0,0|3,0,0]=4 610 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cncnc2 240690a_100011243677_100000184863 [0,1,0,0,0,0|3,0,0]=4 611 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccn2 11a_100015189908_100000184863 [0,1,0,0,0,0|3,0,0]=4 612 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccn2 240690a_100015189908_100000184863 [0,1,0,0,0,0|3,0,0]=4 613 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NNc2ccccc2 22a_100015195140_100000184863 [0,1,0,0,0,0|2,0,0]=3 614 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NNc2ccccn2 22a_100000183288_100000184863 [0,1,0,0,0,0|3,0,0]=4 615 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NNc2cccnc2 22a_100000728903_100000184863 [0,1,0,0,0,0|3,0,0]=4 616 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NNc2ccncc2 22a_100000698918_100000184863 [0,1,0,0,0,0|3,0,0]=4 617 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2ccccc2 1458a_100000182136_100000765856 [0,1,0,0,0,0|1,0,0]=2 618 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2ccccc2 6a_100000210084_100000210092 [0,1,0,0,0,0|1,0,0]=2 619 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2ccccn2 1458a_100000182136_100015183660 [0,1,0,0,0,0|2,0,0]=3 620 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2cccnc2 1458a_100000182136_200011713674 [0,1,0,0,0,0|2,0,0]=3 621 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2ccncc2 1458a_100000182136_100000723409 [0,1,0,0,0,0|2,0,0]=3 622 B20R2.4449 O=C(C=Cc1ccc(cc1)F)COc2ccccc2 6a_100000210084_100000150576 [0,1,0,0,0,0|2,0,0]=3 623 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CSc2ccccc2 6a_100000210084_100000150717 [0,1,0,0,0,0|2,0,0]=3 624 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2 11a_100015324214_100000182136 [0,1,0,0,0,0|1,0,0]=2 625 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2 1626a_100015324214_100000182136 [0,1,0,0,0,0|1,0,0]=2 626 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100000182136 [0,1,0,0,0,0|1,0,0]=2 627 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccn2 11a_100000210449_100000182136 [0,1,0,0,0,0|2,0,0]=3 628 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccn2 1626a_100000210449_100000182136 [0,1,0,0,0,0|2,0,0]=3 629 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccn2 240690a_100000210449_100000182136 [0,1,0,0,0,0|2,0,0]=3 630 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2 11a_100000210453_100000182136 [0,1,0,0,0,0|2,0,0]=3 631 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2 240690a_100000210453_100000182136 [0,1,0,0,0,0|2,0,0]=3 632 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cccnn2 11a_100159270163_100000182136 [0,1,0,0,0,0|3,0,0]=4 633 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cccnn2 240690a_100159270163_100000182136 [0,1,0,0,0,0|3,0,0]=4 634 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2 11a_100000210450_100000182136 [0,1,0,0,0,0|2,0,0]=3 635 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2 1626a_100000210450_100000182136 [0,1,0,0,0,0|2,0,0]=3 636 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2 240690a_100000210450_100000182136 [0,1,0,0,0,0|2,0,0]=3 637 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccncn2 11a_100000736019_100000182136 [0,1,0,0,0,0|3,0,0]=4 638 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccncn2 240690a_100000736019_100000182136 [0,1,0,0,0,0|3,0,0]=4 639 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cnccn2 11a_100000737960_100000182136 [0,1,0,0,0,0|3,0,0]=4 640 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cnccn2 240690a_100000737960_100000182136 [0,1,0,0,0,0|3,0,0]=4 641 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cncnc2 11a_100011243677_100000182136 [0,1,0,0,0,0|3,0,0]=4 642 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cncnc2 240690a_100011243677_100000182136 [0,1,0,0,0,0|3,0,0]=4 643 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ncccn2 11a_100015189908_100000182136 [0,1,0,0,0,0|3,0,0]=4 644 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ncccn2 240690a_100015189908_100000182136 [0,1,0,0,0,0|3,0,0]=4 645 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NNc2ccccc2 22a_100015195140_100000182136 [0,1,0,0,0,0|2,0,0]=3 646 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NNc2ccccn2 22a_100000183288_100000182136 [0,1,0,0,0,0|3,0,0]=4 647 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NNc2cccnc2 22a_100000728903_100000182136 [0,1,0,0,0,0|3,0,0]=4 648 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NNc2ccncc2 22a_100000698918_100000182136 [0,1,0,0,0,0|3,0,0]=4 649 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2ccccc2 1458a_100102526154_100000765856 [0,1,0,0,0,0|1,0,0]=2 650 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2ccccc2 6a_100000188517_100000210092 [0,1,0,0,0,0|1,0,0]=2 651 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2ccccn2 1458a_100102526154_100015183660 [0,1,0,0,0,0|2,0,0]=3 652 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2cccnc2 1458a_100102526154_200011713674 [0,1,0,0,0,0|2,0,0]=3 653 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2ccncc2 1458a_100102526154_100000723409 [0,1,0,0,0,0|2,0,0]=3 654 B20R2.4449 O=C(C=Cc1ccc(cc1)I)COc2ccccc2 6a_100000188517_100000150576 [0,1,0,0,0,0|2,0,0]=3 655 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CSc2ccccc2 6a_100000188517_100000150717 [0,1,0,0,0,0|2,0,0]=3 656 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2 11a_100015324214_100102526154 [0,1,0,0,0,0|1,0,0]=2 657 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2 1626a_100015324214_100102526154 [0,1,0,0,0,0|1,0,0]=2 658 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2 240690a_100015324214_100102526154 [0,1,0,0,0,0|1,0,0]=2 659 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccn2 11a_100000210449_100102526154 [0,1,0,0,0,0|2,0,0]=3 660 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccn2 1626a_100000210449_100102526154 [0,1,0,0,0,0|2,0,0]=3 661 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccn2 240690a_100000210449_100102526154 [0,1,0,0,0,0|2,0,0]=3 662 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2 11a_100000210453_100102526154 [0,1,0,0,0,0|2,0,0]=3 663 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2 240690a_100000210453_100102526154 [0,1,0,0,0,0|2,0,0]=3 664 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cccnn2 11a_100159270163_100102526154 [0,1,0,0,0,0|3,0,0]=4 665 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cccnn2 240690a_100159270163_100102526154 [0,1,0,0,0,0|3,0,0]=4 666 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2 11a_100000210450_100102526154 [0,1,0,0,0,0|2,0,0]=3 667 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2 1626a_100000210450_100102526154 [0,1,0,0,0,0|2,0,0]=3 668 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2 240690a_100000210450_100102526154 [0,1,0,0,0,0|2,0,0]=3 669 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccncn2 11a_100000736019_100102526154 [0,1,0,0,0,0|3,0,0]=4 670 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccncn2 240690a_100000736019_100102526154 [0,1,0,0,0,0|3,0,0]=4 671 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cnccn2 11a_100000737960_100102526154 [0,1,0,0,0,0|3,0,0]=4 672 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cnccn2 240690a_100000737960_100102526154 [0,1,0,0,0,0|3,0,0]=4 673 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cncnc2 11a_100011243677_100102526154 [0,1,0,0,0,0|3,0,0]=4 674 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cncnc2 240690a_100011243677_100102526154 [0,1,0,0,0,0|3,0,0]=4 675 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ncccn2 11a_100015189908_100102526154 [0,1,0,0,0,0|3,0,0]=4 676 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ncccn2 240690a_100015189908_100102526154 [0,1,0,0,0,0|3,0,0]=4 677 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NNc2ccccc2 22a_100015195140_100102526154 [0,1,0,0,0,0|2,0,0]=3 678 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NNc2ccccn2 22a_100000183288_100102526154 [0,1,0,0,0,0|3,0,0]=4 679 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NNc2cccnc2 22a_100000728903_100102526154 [0,1,0,0,0,0|3,0,0]=4 680 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NNc2ccncc2 22a_100000698918_100102526154 [0,1,0,0,0,0|3,0,0]=4 681 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2ccccc2 240690a_100015324214_100016269017 [0,1,0,0,0,0|1,0,0]=2 682 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2ccccn2 240690a_100000210449_100016269017 [0,1,0,0,0,0|2,0,0]=3 683 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2cccnc2 240690a_100000210453_100016269017 [0,1,0,0,0,0|2,0,0]=3 684 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2cccnn2 240690a_100159270163_100016269017 [0,1,0,0,0,0|3,0,0]=4 685 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2ccncc2 240690a_100000210450_100016269017 [0,1,0,0,0,0|2,0,0]=3 686 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2ccncn2 240690a_100000736019_100016269017 [0,1,0,0,0,0|3,0,0]=4 687 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2cnccn2 240690a_100000737960_100016269017 [0,1,0,0,0,0|3,0,0]=4 688 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2cncnc2 240690a_100011243677_100016269017 [0,1,0,0,0,0|3,0,0]=4 689 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2ncccn2 240690a_100015189908_100016269017 [0,1,0,0,0,0|3,0,0]=4 690 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NNc2ccccc2 22a_100015195140_100016269017 [0,1,0,0,0,0|2,0,0]=3 691 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NNc2ccccn2 22a_100000183288_100016269017 [0,1,0,0,0,0|3,0,0]=4 692 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NNc2cccnc2 22a_100000728903_100016269017 [0,1,0,0,0,0|3,0,0]=4 693 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NNc2ccncc2 22a_100000698918_100016269017 [0,1,0,0,0,0|3,0,0]=4 694 B20R2.4449 O=C(C=Cc1ccc(cn1)Br)CCc2ccccc2 6a_100000754260_100000210092 [0,1,0,0,0,0|2,0,0]=3 695 B20R2.4449 O=C(C=Cc1ccc(cn1)Br)COc2ccccc2 6a_100000754260_100000150576 [0,1,0,0,0,0|3,0,0]=4 696 B20R2.4449 O=C(C=Cc1ccc(cn1)Br)CSc2ccccc2 6a_100000754260_100000150717 [0,1,0,0,0,0|3,0,0]=4 697 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2ccccc2 1458a_100020630499_100000765856 [0,1,0,0,0,0|2,0,0]=3 698 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2ccccc2 6a_100011934744_100000210092 [0,1,0,0,0,0|2,0,0]=3 699 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2ccccn2 1458a_100020630499_100015183660 [0,1,0,0,0,0|3,0,0]=4 700 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2cccnc2 1458a_100020630499_200011713674 [0,1,0,0,0,0|3,0,0]=4 701 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2ccncc2 1458a_100020630499_100000723409 [0,1,0,0,0,0|3,0,0]=4 702 B20R2.4449 O=C(C=Cc1ccc(cn1)F)COc2ccccc2 6a_100011934744_100000150576 [0,1,0,0,0,0|3,0,0]=4 703 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CSc2ccccc2 6a_100011934744_100000150717 [0,1,0,0,0,0|3,0,0]=4 704 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2 11a_100015324214_100020630499 [0,1,0,0,0,0|2,0,0]=3 705 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2 1626a_100015324214_100020630499 [0,1,0,0,0,0|2,0,0]=3 706 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2 240690a_100015324214_100020630499 [0,1,0,0,0,0|2,0,0]=3 707 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccn2 11a_100000210449_100020630499 [0,1,0,0,0,0|3,0,0]=4 708 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccn2 1626a_100000210449_100020630499 [0,1,0,0,0,0|3,0,0]=4 709 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccn2 240690a_100000210449_100020630499 [0,1,0,0,0,0|3,0,0]=4 710 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2cccnc2 11a_100000210453_100020630499 [0,1,0,0,0,0|3,0,0]=4 711 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2cccnc2 240690a_100000210453_100020630499 [0,1,0,0,0,0|3,0,0]=4 712 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccncc2 11a_100000210450_100020630499 [0,1,0,0,0,0|3,0,0]=4 713 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccncc2 1626a_100000210450_100020630499 [0,1,0,0,0,0|3,0,0]=4 714 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccncc2 240690a_100000210450_100020630499 [0,1,0,0,0,0|3,0,0]=4 715 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NNc2ccccc2 22a_100015195140_100020630499 [0,1,0,0,0,0|3,0,0]=4 716 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)CCc2ccccc2 1458a_100020588214_100000765856 [0,1,0,0,0,0|2,0,0]=3 717 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)CCc2ccccn2 1458a_100020588214_100015183660 [0,1,0,0,0,0|3,0,0]=4 718 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)CCc2cccnc2 1458a_100020588214_200011713674 [0,1,0,0,0,0|3,0,0]=4 719 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)CCc2ccncc2 1458a_100020588214_100000723409 [0,1,0,0,0,0|3,0,0]=4 720 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2 11a_100015324214_100020588214 [0,1,0,0,0,0|2,0,0]=3 721 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2 1626a_100015324214_100020588214 [0,1,0,0,0,0|2,0,0]=3 722 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2 240690a_100015324214_100020588214 [0,1,0,0,0,0|2,0,0]=3 723 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccn2 11a_100000210449_100020588214 [0,1,0,0,0,0|3,0,0]=4 724 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccn2 1626a_100000210449_100020588214 [0,1,0,0,0,0|3,0,0]=4 725 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccn2 240690a_100000210449_100020588214 [0,1,0,0,0,0|3,0,0]=4 726 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2cccnc2 11a_100000210453_100020588214 [0,1,0,0,0,0|3,0,0]=4 727 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2cccnc2 240690a_100000210453_100020588214 [0,1,0,0,0,0|3,0,0]=4 728 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccncc2 11a_100000210450_100020588214 [0,1,0,0,0,0|3,0,0]=4 729 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccncc2 1626a_100000210450_100020588214 [0,1,0,0,0,0|3,0,0]=4 730 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccncc2 240690a_100000210450_100020588214 [0,1,0,0,0,0|3,0,0]=4 731 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NNc2ccccc2 22a_100015195140_100020588214 [0,1,0,0,0,0|3,0,0]=4 732 B20R2.4449 O=C(C=Cc1ccccc1)CCc2ccc(cc2)Br 1458a_100000210462_100011740612 [0,1,0,0,0,0|1,0,0]=2 733 B20R2.4449 O=C(C=Cc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000210462_100011713675 [0,1,0,0,0,0|1,0,0]=2 734 B20R2.4449 O=C(C=Cc1ccccc1)CCc2ccc(cc2)F 1458a_100000210462_100011217392 [0,1,0,0,0,0|1,0,0]=2 735 B20R2.4449 O=C(C=Cc1ccccc1)CCc2ccc(cc2)O 1458a_100000210462_100009816426 [0,1,0,0,0,0|1,0,0]=2 736 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100000210462 [0,1,0,0,0,0|1,0,0]=2 737 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100000210462 [0,1,0,0,0,0|1,0,0]=2 738 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100000210462 [0,1,0,0,0,0|1,0,0]=2 739 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000210462 [0,1,0,0,0,0|1,0,0]=2 740 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100000210462 [0,1,0,0,0,0|1,0,0]=2 741 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100000210462 [0,1,0,0,0,0|1,0,0]=2 742 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100000210462 [0,1,0,0,0,0|1,0,0]=2 743 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100000210462 [0,1,0,0,0,0|1,0,0]=2 744 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)Br 11a_100015188789_100000210462 [0,1,0,0,0,0|2,0,0]=3 745 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)Br 1626a_100015188789_100000210462 [0,1,0,0,0,0|2,0,0]=3 746 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)Cl 11a_100000697193_100000210462 [0,1,0,0,0,0|2,0,0]=3 747 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)Cl 1626a_100000697193_100000210462 [0,1,0,0,0,0|2,0,0]=3 748 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)F 11a_100020620131_100000210462 [0,1,0,0,0,0|2,0,0]=3 749 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)F 1626a_100020620131_100000210462 [0,1,0,0,0,0|2,0,0]=3 750 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)Br 11a_100009817727_100000210462 [0,1,0,0,0,0|2,0,0]=3 751 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)Cl 11a_100000735879_100000210462 [0,1,0,0,0,0|2,0,0]=3 752 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)Cl 1626a_100000735879_100000210462 [0,1,0,0,0,0|2,0,0]=3 753 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)F 11a_100000101913_100000210462 [0,1,0,0,0,0|2,0,0]=3 754 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)F 1626a_100000101913_100000210462 [0,1,0,0,0,0|2,0,0]=3 755 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)O 11a_100000757128_100000210462 [0,1,0,0,0,0|2,0,0]=3 756 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ncc(cn2)Br 11a_200016993442_100000210462 [0,1,0,0,0,0|3,0,0]=4 757 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ncc(cn2)Cl 11a_200015186297_100000210462 [0,1,0,0,0,0|3,0,0]=4 758 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ncc(cn2)Cl 1626a_200015186297_100000210462 [0,1,0,0,0,0|3,0,0]=4 759 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cc2)Br 22a_100000735608_100000210462 [0,1,0,0,0,0|2,0,0]=3 760 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cc2)Cl 22a_100000683521_100000210462 [0,1,0,0,0,0|2,0,0]=3 761 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cc2)F 22a_100000728448_100000210462 [0,1,0,0,0,0|2,0,0]=3 762 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cc2)I 22a_100016988836_100000210462 [0,1,0,0,0,0|2,0,0]=3 763 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cn2)Br 22a_100000750576_100000210462 [0,1,0,0,0,0|3,0,0]=4 764 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cn2)Cl 22a_100011206499_100000210462 [0,1,0,0,0,0|3,0,0]=4 765 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cn2)F 22a_100000753838_100000210462 [0,1,0,0,0,0|3,0,0]=4 766 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cn2)I 22a_100010221006_100000210462 [0,1,0,0,0,0|3,0,0]=4 767 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(nc2)Br 22a_100000755011_100000210462 [0,1,0,0,0,0|3,0,0]=4 768 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(nc2)Cl 22a_100000119030_100000210462 [0,1,0,0,0,0|3,0,0]=4 769 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(nc2)F 22a_100000120849_100000210462 [0,1,0,0,0,0|3,0,0]=4 770 B20R2.4449 O=C(C=Cc1ccccn1)CCc2ccc(cc2)Br 1458a_100000740811_100011740612 [0,1,0,0,0,0|2,0,0]=3 771 B20R2.4449 O=C(C=Cc1ccccn1)CCc2ccc(cc2)Cl 1458a_100000740811_100011713675 [0,1,0,0,0,0|2,0,0]=3 772 B20R2.4449 O=C(C=Cc1ccccn1)CCc2ccc(cc2)F 1458a_100000740811_100011217392 [0,1,0,0,0,0|2,0,0]=3 773 B20R2.4449 O=C(C=Cc1ccccn1)CCc2ccc(cc2)O 1458a_100000740811_100009816426 [0,1,0,0,0,0|2,0,0]=3 774 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)Br 11a_100000174875_100000740811 [0,1,0,0,0,0|2,0,0]=3 775 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)Br 240690a_100000174875_100000740811 [0,1,0,0,0,0|2,0,0]=3 776 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)Cl 11a_100000174871_100000740811 [0,1,0,0,0,0|2,0,0]=3 777 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)Cl 240690a_100000174871_100000740811 [0,1,0,0,0,0|2,0,0]=3 778 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)F 11a_100000174882_100000740811 [0,1,0,0,0,0|2,0,0]=3 779 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)F 240690a_100000174882_100000740811 [0,1,0,0,0,0|2,0,0]=3 780 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)I 11a_100016989417_100000740811 [0,1,0,0,0,0|2,0,0]=3 781 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)I 240690a_100016989417_100000740811 [0,1,0,0,0,0|2,0,0]=3 782 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)O 240690a_100000185549_100000740811 [0,1,0,0,0,0|2,0,0]=3 783 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cn2)Br 11a_100015188789_100000740811 [0,1,0,0,0,0|3,0,0]=4 784 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cn2)Br 240690a_100015188789_100000740811 [0,1,0,0,0,0|3,0,0]=4 785 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cn2)Cl 11a_100000697193_100000740811 [0,1,0,0,0,0|3,0,0]=4 786 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cn2)Cl 240690a_100000697193_100000740811 [0,1,0,0,0,0|3,0,0]=4 787 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cn2)F 11a_100020620131_100000740811 [0,1,0,0,0,0|3,0,0]=4 788 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cn2)F 240690a_100020620131_100000740811 [0,1,0,0,0,0|3,0,0]=4 789 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cn2)O 240690a_100020605196_100000740811 [0,1,0,0,0,0|3,0,0]=4 790 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(nc2)Br 11a_100009817727_100000740811 [0,1,0,0,0,0|3,0,0]=4 791 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(nc2)Br 240690a_100009817727_100000740811 [0,1,0,0,0,0|3,0,0]=4 792 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(nc2)Cl 11a_100000735879_100000740811 [0,1,0,0,0,0|3,0,0]=4 793 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(nc2)Cl 240690a_100000735879_100000740811 [0,1,0,0,0,0|3,0,0]=4 794 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(nc2)F 11a_100000101913_100000740811 [0,1,0,0,0,0|3,0,0]=4 795 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(nc2)F 240690a_100000101913_100000740811 [0,1,0,0,0,0|3,0,0]=4 796 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(nc2)O 11a_100000757128_100000740811 [0,1,0,0,0,0|3,0,0]=4 797 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(nc2)O 240690a_100000757128_100000740811 [0,1,0,0,0,0|3,0,0]=4 798 B20R2.4449 O=C(C=Cc1ccccn1)NNc2ccc(cc2)Br 22a_100000735608_100000740811 [0,1,0,0,0,0|3,0,0]=4 799 B20R2.4449 O=C(C=Cc1ccccn1)NNc2ccc(cc2)Cl 22a_100000683521_100000740811 [0,1,0,0,0,0|3,0,0]=4 800 B20R2.4449 O=C(C=Cc1ccccn1)NNc2ccc(cc2)F 22a_100000728448_100000740811 [0,1,0,0,0,0|3,0,0]=4 801 B20R2.4449 O=C(C=Cc1ccccn1)NNc2ccc(cc2)I 22a_100016988836_100000740811 [0,1,0,0,0,0|3,0,0]=4 802 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)Br 1458a_100000735890_100011740612 [0,1,0,0,0,0|2,0,0]=3 803 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)Cl 1458a_100000735890_100011713675 [0,1,0,0,0,0|2,0,0]=3 804 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)F 1458a_100000735890_100011217392 [0,1,0,0,0,0|2,0,0]=3 805 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)O 1458a_100000735890_100009816426 [0,1,0,0,0,0|2,0,0]=3 806 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Br 11a_100000174875_100000735890 [0,1,0,0,0,0|2,0,0]=3 807 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Br 240690a_100000174875_100000735890 [0,1,0,0,0,0|2,0,0]=3 808 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Cl 11a_100000174871_100000735890 [0,1,0,0,0,0|2,0,0]=3 809 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000735890 [0,1,0,0,0,0|2,0,0]=3 810 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)F 11a_100000174882_100000735890 [0,1,0,0,0,0|2,0,0]=3 811 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)F 240690a_100000174882_100000735890 [0,1,0,0,0,0|2,0,0]=3 812 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)I 11a_100016989417_100000735890 [0,1,0,0,0,0|2,0,0]=3 813 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)I 240690a_100016989417_100000735890 [0,1,0,0,0,0|2,0,0]=3 814 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)O 240690a_100000185549_100000735890 [0,1,0,0,0,0|2,0,0]=3 815 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cn2)Br 11a_100015188789_100000735890 [0,1,0,0,0,0|3,0,0]=4 816 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cn2)Br 240690a_100015188789_100000735890 [0,1,0,0,0,0|3,0,0]=4 817 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cn2)Cl 11a_100000697193_100000735890 [0,1,0,0,0,0|3,0,0]=4 818 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cn2)Cl 240690a_100000697193_100000735890 [0,1,0,0,0,0|3,0,0]=4 819 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cn2)F 11a_100020620131_100000735890 [0,1,0,0,0,0|3,0,0]=4 820 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cn2)F 240690a_100020620131_100000735890 [0,1,0,0,0,0|3,0,0]=4 821 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cn2)O 240690a_100020605196_100000735890 [0,1,0,0,0,0|3,0,0]=4 822 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(nc2)Br 11a_100009817727_100000735890 [0,1,0,0,0,0|3,0,0]=4 823 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(nc2)Br 240690a_100009817727_100000735890 [0,1,0,0,0,0|3,0,0]=4 824 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(nc2)Cl 11a_100000735879_100000735890 [0,1,0,0,0,0|3,0,0]=4 825 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(nc2)Cl 240690a_100000735879_100000735890 [0,1,0,0,0,0|3,0,0]=4 826 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(nc2)F 11a_100000101913_100000735890 [0,1,0,0,0,0|3,0,0]=4 827 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(nc2)F 240690a_100000101913_100000735890 [0,1,0,0,0,0|3,0,0]=4 828 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(nc2)O 11a_100000757128_100000735890 [0,1,0,0,0,0|3,0,0]=4 829 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(nc2)O 240690a_100000757128_100000735890 [0,1,0,0,0,0|3,0,0]=4 830 B20R2.4449 O=C(C=Cc1cccnc1)NNc2ccc(cc2)Br 22a_100000735608_100000735890 [0,1,0,0,0,0|3,0,0]=4 831 B20R2.4449 O=C(C=Cc1cccnc1)NNc2ccc(cc2)Cl 22a_100000683521_100000735890 [0,1,0,0,0,0|3,0,0]=4 832 B20R2.4449 O=C(C=Cc1cccnc1)NNc2ccc(cc2)F 22a_100000728448_100000735890 [0,1,0,0,0,0|3,0,0]=4 833 B20R2.4449 O=C(C=Cc1cccnc1)NNc2ccc(cc2)I 22a_100016988836_100000735890 [0,1,0,0,0,0|3,0,0]=4 834 B20R2.4449 O=C(C=Cc1ccncc1)CCc2ccc(cc2)Br 1458a_100000682801_100011740612 [0,1,0,0,0,0|2,0,0]=3 835 B20R2.4449 O=C(C=Cc1ccncc1)CCc2ccc(cc2)Cl 1458a_100000682801_100011713675 [0,1,0,0,0,0|2,0,0]=3 836 B20R2.4449 O=C(C=Cc1ccncc1)CCc2ccc(cc2)F 1458a_100000682801_100011217392 [0,1,0,0,0,0|2,0,0]=3 837 B20R2.4449 O=C(C=Cc1ccncc1)CCc2ccc(cc2)O 1458a_100000682801_100009816426 [0,1,0,0,0,0|2,0,0]=3 838 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)Br 240690a_100000174875_100000682801 [0,1,0,0,0,0|2,0,0]=3 839 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000682801 [0,1,0,0,0,0|2,0,0]=3 840 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)F 240690a_100000174882_100000682801 [0,1,0,0,0,0|2,0,0]=3 841 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)I 240690a_100016989417_100000682801 [0,1,0,0,0,0|2,0,0]=3 842 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)O 240690a_100000185549_100000682801 [0,1,0,0,0,0|2,0,0]=3 843 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cn2)Br 240690a_100015188789_100000682801 [0,1,0,0,0,0|3,0,0]=4 844 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cn2)Cl 240690a_100000697193_100000682801 [0,1,0,0,0,0|3,0,0]=4 845 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cn2)F 240690a_100020620131_100000682801 [0,1,0,0,0,0|3,0,0]=4 846 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cn2)O 240690a_100020605196_100000682801 [0,1,0,0,0,0|3,0,0]=4 847 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(nc2)Br 240690a_100009817727_100000682801 [0,1,0,0,0,0|3,0,0]=4 848 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(nc2)Cl 240690a_100000735879_100000682801 [0,1,0,0,0,0|3,0,0]=4 849 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(nc2)F 240690a_100000101913_100000682801 [0,1,0,0,0,0|3,0,0]=4 850 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(nc2)O 240690a_100000757128_100000682801 [0,1,0,0,0,0|3,0,0]=4 851 B20R2.4449 O=C(C=Cc1ccncc1)NNc2ccc(cc2)Br 22a_100000735608_100000682801 [0,1,0,0,0,0|3,0,0]=4 852 B20R2.4449 O=C(C=Cc1ccncc1)NNc2ccc(cc2)Cl 22a_100000683521_100000682801 [0,1,0,0,0,0|3,0,0]=4 853 B20R2.4449 O=C(C=Cc1ccncc1)NNc2ccc(cc2)F 22a_100000728448_100000682801 [0,1,0,0,0,0|3,0,0]=4 854 B20R2.4449 O=C(C=Cc1ccncc1)NNc2ccc(cc2)I 22a_100016988836_100000682801 [0,1,0,0,0,0|3,0,0]=4 855 B20R2.4449 O=C(C=Cc1cnc(cn1)Cl)CCc2ccccc2 6a_100012001714_100000210092 [0,1,0,0,0,0|3,0,0]=4 856 B20R2.4449 O=C(C=Cc1cncnc1)CCc2ccc(cc2)Cl 6a_100000749868_100011279170 [0,1,0,0,0,0|3,0,0]=4 857 B20R2.4449 O=C(C=Cc1cncnc1)CCc2ccc(cc2)F 6a_100000749868_100000743244 [0,1,0,0,0,0|3,0,0]=4 858 B20R2.4449 O=C(C=Cc1cncnc1)CCc2ccc(cc2)I 6a_100000749868_100000723691 [0,1,0,0,0,0|3,0,0]=4 859 B20R2.4449 O=C(C=Cc1cncnc1)CCc2ccc(cc2)O 6a_100000749868_100000198047 [0,1,0,0,0,0|3,0,0]=4 860 B20R2.4449 O=C(CCc1ccc(cc1)Br)COc2ccccc2 1458a_100000186222_100011740612 [0,1,0,0,0,0|2,0,1]=4 861 B20R2.4449 O=C(CCc1ccc(cc1)Br)CSc2ccccc2 1458a_100000211596_100011740612 [0,1,0,0,0,0|2,0,1]=4 862 B20R2.4449 O=C(CCc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_100000217147 [0,1,0,0,0,0|1,0,2]=4 863 B20R2.4449 O=C(CCc1ccc(cc1)Br)NCc2ccccc2 1626a_100015324214_100000217147 [0,1,0,0,0,0|1,0,2]=4 864 B20R2.4449 O=C(CCc1ccc(cc1)Br)NCc2ccccc2 240690a_100015324214_100000217147 [0,1,0,0,0,0|1,0,2]=4 865 B20R2.4449 O=C(CCc1ccc(cc1)Br)NCc2ccccc2 527a_100015324214_100000217147 [0,1,0,0,0,0|1,0,2]=4 866 B20R2.4449 O=C(CCc1ccc(cc1)Br)NNc2ccccc2 22a_100015195140_100000217147 [0,1,0,0,0,0|3,0,0]=4 867 B20R2.4449 O=C(CCc1ccc(cc1)Cl)COc2ccccc2 1458a_100000186222_100011713675 [0,1,0,0,0,0|2,0,1]=4 868 B20R2.4449 O=C(CCc1ccc(cc1)Cl)CSc2ccccc2 1458a_100000211596_100011713675 [0,1,0,0,0,0|2,0,1]=4 869 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NCc2ccccc2 11a_100015324214_100000235379 [0,1,0,0,0,0|1,0,2]=4 870 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NCc2ccccc2 1626a_100015324214_100000235379 [0,1,0,0,0,0|1,0,2]=4 871 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100000235379 [0,1,0,0,0,0|1,0,2]=4 872 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NCc2ccccc2 527a_100015324214_100000235379 [0,1,0,0,0,0|1,0,2]=4 873 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NNc2ccccc2 22a_100015195140_100000235379 [0,1,0,0,0,0|3,0,0]=4 874 B20R2.4449 O=C(CCc1ccc(cc1)F)COc2ccccc2 1458a_100000186222_100011217392 [0,1,0,0,0,0|2,0,1]=4 875 B20R2.4449 O=C(CCc1ccc(cc1)F)CSc2ccccc2 1458a_100000211596_100011217392 [0,1,0,0,0,0|2,0,1]=4 876 B20R2.4449 O=C(CCc1ccc(cc1)F)NCc2ccccc2 11a_100015324214_100000198493 [0,1,0,0,0,0|1,0,2]=4 877 B20R2.4449 O=C(CCc1ccc(cc1)F)NCc2ccccc2 1626a_100015324214_100000198493 [0,1,0,0,0,0|1,0,2]=4 878 B20R2.4449 O=C(CCc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100000198493 [0,1,0,0,0,0|1,0,2]=4 879 B20R2.4449 O=C(CCc1ccc(cc1)F)NCc2ccccc2 527a_100015324214_100000198493 [0,1,0,0,0,0|1,0,2]=4 880 B20R2.4449 O=C(CCc1ccc(cc1)F)NNc2ccccc2 22a_100015195140_100000198493 [0,1,0,0,0,0|3,0,0]=4 881 B20R2.4449 O=C(CCc1ccc(cc1)I)NCc2ccccc2 11a_100015324214_100011217499 [0,1,0,0,0,0|1,0,2]=4 882 B20R2.4449 O=C(CCc1ccc(cc1)I)NCc2ccccc2 1626a_100015324214_100011217499 [0,1,0,0,0,0|1,0,2]=4 883 B20R2.4449 O=C(CCc1ccc(cc1)I)NCc2ccccc2 240690a_100015324214_100011217499 [0,1,0,0,0,0|1,0,2]=4 884 B20R2.4449 O=C(CCc1ccc(cc1)I)NCc2ccccc2 527a_100015324214_100011217499 [0,1,0,0,0,0|1,0,2]=4 885 B20R2.4449 O=C(CCc1ccc(cc1)I)NNc2ccccc2 22a_100015195140_100011217499 [0,1,0,0,0,0|3,0,0]=4 886 B20R2.4449 O=C(CCc1ccc(cc1)O)COc2ccccc2 1458a_100000186222_100009816426 [0,1,0,0,0,0|2,0,1]=4 887 B20R2.4449 O=C(CCc1ccc(cc1)O)CSc2ccccc2 1458a_100000211596_100009816426 [0,1,0,0,0,0|2,0,1]=4 888 B20R2.4449 O=C(CCc1ccc(cc1)O)NCc2ccccc2 240690a_100015324214_100000742835 [0,1,0,0,0,0|1,0,2]=4 889 B20R2.4449 O=C(CCc1ccc(cc1)O)NNc2ccccc2 22a_100015195140_100000742835 [0,1,0,0,0,0|3,0,0]=4 890 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)Br 1458a_100000185753_100011740612 [0,1,0,0,0,0|1,0,2]=4 891 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)Br 1458a_100000217147_100000765856 [0,1,0,0,0,0|1,0,2]=4 892 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000185753_100011713675 [0,1,0,0,0,0|1,0,2]=4 893 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000235379_100000765856 [0,1,0,0,0,0|1,0,2]=4 894 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)F 1458a_100000185753_100011217392 [0,1,0,0,0,0|1,0,2]=4 895 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)F 1458a_100000198493_100000765856 [0,1,0,0,0,0|1,0,2]=4 896 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)I 1458a_100011217499_100000765856 [0,1,0,0,0,0|1,0,2]=4 897 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)O 1458a_100000185753_100009816426 [0,1,0,0,0,0|1,0,2]=4 898 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)O 1458a_100000742835_100000765856 [0,1,0,0,0,0|1,0,2]=4 899 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)Br 2230a_100000210018_100012361361 [0,1,0,0,0,0|2,0,1]=4 900 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)Br 34a_100000210018_100012361361 [0,1,0,0,0,0|2,0,1]=4 901 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)Cl 2230a_100000210052_100012361361 [0,1,0,0,0,0|2,0,1]=4 902 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)Cl 34a_100000210052_100012361361 [0,1,0,0,0,0|2,0,1]=4 903 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)F 34a_100000185862_100012361361 [0,1,0,0,0,0|2,0,1]=4 904 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)I 34a_100000185761_100012361361 [0,1,0,0,0,0|2,0,1]=4 905 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)O 34a_100000185829_100012361361 [0,1,0,0,0,0|2,0,1]=4 906 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Br 1458a_100000182358_100000765856 [0,1,0,0,0,0|2,0,1]=4 907 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Br 34a_100000185759_100012361361 [0,1,0,0,0,0|2,0,1]=4 908 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Br 7a_100000185759_100012361361 [0,1,0,0,0,0|2,0,1]=4 909 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Cl 1458a_100016990877_100000765856 [0,1,0,0,0,0|2,0,1]=4 910 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Cl 34a_100000210216_100012361361 [0,1,0,0,0,0|2,0,1]=4 911 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Cl 7a_100000210216_100012361361 [0,1,0,0,0,0|2,0,1]=4 912 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)F 1458a_100000184765_100000765856 [0,1,0,0,0,0|2,0,1]=4 913 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)F 34a_100000210339_100012361361 [0,1,0,0,0,0|2,0,1]=4 914 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)I 1458a_100000184369_100000765856 [0,1,0,0,0,0|2,0,1]=4 915 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)I 34a_100000212066_100012361361 [0,1,0,0,0,0|2,0,1]=4 916 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)I 7a_100000212066_100012361361 [0,1,0,0,0,0|2,0,1]=4 917 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)O 1458a_100000031633_100000765856 [0,1,0,0,0,0|2,0,1]=4 918 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Br 1458a_100000179496_100000765856 [0,1,0,0,0,0|2,0,1]=4 919 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Br 62a_100000752885_100012361361 [0,1,0,0,0,0|2,0,1]=4 920 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Br 62a_100012361361_100000752885 [0,1,0,0,0,0|2,0,1]=4 921 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Cl 1458a_100000178402_100000765856 [0,1,0,0,0,0|2,0,1]=4 922 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Cl 62a_100000755918_100012361361 [0,1,0,0,0,0|2,0,1]=4 923 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Cl 62a_100012361361_100000755918 [0,1,0,0,0,0|2,0,1]=4 924 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)F 1458a_100000691584_100000765856 [0,1,0,0,0,0|2,0,1]=4 925 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)F 62a_100000211213_100012361361 [0,1,0,0,0,0|2,0,1]=4 926 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)F 62a_100012361361_100000211213 [0,1,0,0,0,0|2,0,1]=4 927 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)O 62a_100012361361_100000185759 [0,1,0,0,0,0|2,0,1]=4 928 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100000185753 [0,1,0,0,0,0|1,0,2]=4 929 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100000185753 [0,1,0,0,0,0|1,0,2]=4 930 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100000185753 [0,1,0,0,0,0|1,0,2]=4 931 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Br 527a_100000174875_100000185753 [0,1,0,0,0,0|1,0,2]=4 932 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100000185753 [0,1,0,0,0,0|1,0,2]=4 933 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000185753 [0,1,0,0,0,0|1,0,2]=4 934 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000185753 [0,1,0,0,0,0|1,0,2]=4 935 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Cl 527a_100000174871_100000185753 [0,1,0,0,0,0|1,0,2]=4 936 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100000185753 [0,1,0,0,0,0|1,0,2]=4 937 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100000185753 [0,1,0,0,0,0|1,0,2]=4 938 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100000185753 [0,1,0,0,0,0|1,0,2]=4 939 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)F 527a_100000174882_100000185753 [0,1,0,0,0,0|1,0,2]=4 940 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100000185753 [0,1,0,0,0,0|1,0,2]=4 941 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100000185753 [0,1,0,0,0,0|1,0,2]=4 942 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100000185753 [0,1,0,0,0,0|1,0,2]=4 943 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)I 527a_100016989417_100000185753 [0,1,0,0,0,0|1,0,2]=4 944 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100000185753 [0,1,0,0,0,0|1,0,2]=4 945 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)O 527a_100000185549_100000185753 [0,1,0,0,0,0|1,0,2]=4 946 B20R2.4449 O=C(CCc1ccccc1)NNc2ccc(cc2)Br 22a_100000735608_100000185753 [0,1,0,0,0,0|3,0,0]=4 947 B20R2.4449 O=C(CCc1ccccc1)NNc2ccc(cc2)Cl 22a_100000683521_100000185753 [0,1,0,0,0,0|3,0,0]=4 948 B20R2.4449 O=C(CCc1ccccc1)NNc2ccc(cc2)F 22a_100000728448_100000185753 [0,1,0,0,0,0|3,0,0]=4 949 B20R2.4449 O=C(CCc1ccccc1)NNc2ccc(cc2)I 22a_100016988836_100000185753 [0,1,0,0,0,0|3,0,0]=4 950 B20R2.4449 O=C(CNc1ccc(cc1)Br)NCc2ccccc2 2230a_100000210018_100000183539 [0,1,0,0,0,0|2,0,1]=4 951 B20R2.4449 O=C(CNc1ccc(cc1)Br)NCc2ccccc2 34a_100000210018_100000183539 [0,1,0,0,0,0|2,0,1]=4 952 B20R2.4449 O=C(CNc1ccc(cc1)Br)OCc2ccccc2 2230a_100000210018_100000753625 [0,1,0,0,0,0|1,0,1]=3 953 B20R2.4449 O=C(CNc1ccc(cc1)Br)OCc2ccccc2 34a_100000210018_100000753625 [0,1,0,0,0,0|1,0,1]=3 954 B20R2.4449 O=C(CNc1ccc(cc1)Cl)NCc2ccccc2 2230a_100000210052_100000183539 [0,1,0,0,0,0|2,0,1]=4 955 B20R2.4449 O=C(CNc1ccc(cc1)Cl)NCc2ccccc2 34a_100000210052_100000183539 [0,1,0,0,0,0|2,0,1]=4 956 B20R2.4449 O=C(CNc1ccc(cc1)Cl)OCc2ccccc2 2230a_100000210052_100000753625 [0,1,0,0,0,0|1,0,1]=3 957 B20R2.4449 O=C(CNc1ccc(cc1)Cl)OCc2ccccc2 34a_100000210052_100000753625 [0,1,0,0,0,0|1,0,1]=3 958 B20R2.4449 O=C(CNc1ccc(cc1)F)NCc2ccccc2 34a_100000185862_100000183539 [0,1,0,0,0,0|2,0,1]=4 959 B20R2.4449 O=C(CNc1ccc(cc1)F)OCc2ccccc2 34a_100000185862_100000753625 [0,1,0,0,0,0|1,0,1]=3 960 B20R2.4449 O=C(CNc1ccc(cc1)I)NCc2ccccc2 34a_100000185761_100000183539 [0,1,0,0,0,0|2,0,1]=4 961 B20R2.4449 O=C(CNc1ccc(cc1)I)OCc2ccccc2 34a_100000185761_100000753625 [0,1,0,0,0,0|1,0,1]=3 962 B20R2.4449 O=C(CNc1ccc(cc1)O)NCc2ccccc2 34a_100000185829_100000183539 [0,1,0,0,0,0|2,0,1]=4 963 B20R2.4449 O=C(CNc1ccc(cc1)O)OCc2ccccc2 34a_100000185829_100000753625 [0,1,0,0,0,0|1,0,1]=3 964 B20R2.4449 O=C(CNc1ccccc1)NCc2ccc(cc2)Cl 34a_100000106764_100000183476 [0,1,0,0,0,0|2,0,1]=4 965 B20R2.4449 O=C(CNc1ccccc1)NCc2ccc(cc2)F 34a_100000106764_100000182461 [0,1,0,0,0,0|2,0,1]=4 966 B20R2.4449 O=C(COc1ccc(=O)[nH]c1)OCc2ccccc2 34a_100000075641_100000753625 [0,1,0,0,0,0|2,0,1]=4 967 B20R2.4449 O=C(COc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_100000182358 [0,1,0,0,0,0|2,0,1]=4 968 B20R2.4449 O=C(COc1ccc(cc1)Br)NCc2ccccc2 1626a_100015324214_100000182358 [0,1,0,0,0,0|2,0,1]=4 969 B20R2.4449 O=C(COc1ccc(cc1)Br)NCc2ccccc2 240690a_100015324214_100000182358 [0,1,0,0,0,0|2,0,1]=4 970 B20R2.4449 O=C(COc1ccc(cc1)Br)NCc2ccccc2 34a_100000185759_100000183539 [0,1,0,0,0,0|2,0,1]=4 971 B20R2.4449 O=C(COc1ccc(cc1)Br)NCc2ccccc2 527a_100015324214_100000182358 [0,1,0,0,0,0|2,0,1]=4 972 B20R2.4449 O=C(COc1ccc(cc1)Br)NCc2ccccc2 7a_100000185759_100000183539 [0,1,0,0,0,0|2,0,1]=4 973 B20R2.4449 O=C(COc1ccc(cc1)Br)OCc2ccccc2 34a_100000185759_100000753625 [0,1,0,0,0,0|1,0,1]=3 974 B20R2.4449 O=C(COc1ccc(cc1)Br)OCc2ccccc2 7a_100000185759_100000753625 [0,1,0,0,0,0|1,0,1]=3 975 B20R2.4449 O=C(COc1ccc(cc1)Cl)NCc2ccccc2 11a_100015324214_100016990877 [0,1,0,0,0,0|2,0,1]=4 976 B20R2.4449 O=C(COc1ccc(cc1)Cl)NCc2ccccc2 1626a_100015324214_100016990877 [0,1,0,0,0,0|2,0,1]=4 977 B20R2.4449 O=C(COc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100016990877 [0,1,0,0,0,0|2,0,1]=4 978 B20R2.4449 O=C(COc1ccc(cc1)Cl)NCc2ccccc2 34a_100000210216_100000183539 [0,1,0,0,0,0|2,0,1]=4 979 B20R2.4449 O=C(COc1ccc(cc1)Cl)NCc2ccccc2 527a_100015324214_100016990877 [0,1,0,0,0,0|2,0,1]=4 980 B20R2.4449 O=C(COc1ccc(cc1)Cl)NCc2ccccc2 7a_100000210216_100000183539 [0,1,0,0,0,0|2,0,1]=4 981 B20R2.4449 O=C(COc1ccc(cc1)Cl)OCc2ccccc2 34a_100000210216_100000753625 [0,1,0,0,0,0|1,0,1]=3 982 B20R2.4449 O=C(COc1ccc(cc1)Cl)OCc2ccccc2 7a_100000210216_100000753625 [0,1,0,0,0,0|1,0,1]=3 983 B20R2.4449 O=C(COc1ccc(cc1)F)NCc2ccccc2 11a_100015324214_100000184765 [0,1,0,0,0,0|2,0,1]=4 984 B20R2.4449 O=C(COc1ccc(cc1)F)NCc2ccccc2 1626a_100015324214_100000184765 [0,1,0,0,0,0|2,0,1]=4 985 B20R2.4449 O=C(COc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100000184765 [0,1,0,0,0,0|2,0,1]=4 986 B20R2.4449 O=C(COc1ccc(cc1)F)NCc2ccccc2 34a_100000210339_100000183539 [0,1,0,0,0,0|2,0,1]=4 987 B20R2.4449 O=C(COc1ccc(cc1)F)NCc2ccccc2 527a_100015324214_100000184765 [0,1,0,0,0,0|2,0,1]=4 988 B20R2.4449 O=C(COc1ccc(cc1)F)OCc2ccccc2 34a_100000210339_100000753625 [0,1,0,0,0,0|1,0,1]=3 989 B20R2.4449 O=C(COc1ccc(cc1)I)NCc2ccccc2 11a_100015324214_100000184369 [0,1,0,0,0,0|2,0,1]=4 990 B20R2.4449 O=C(COc1ccc(cc1)I)NCc2ccccc2 1626a_100015324214_100000184369 [0,1,0,0,0,0|2,0,1]=4 991 B20R2.4449 O=C(COc1ccc(cc1)I)NCc2ccccc2 240690a_100015324214_100000184369 [0,1,0,0,0,0|2,0,1]=4 992 B20R2.4449 O=C(COc1ccc(cc1)I)NCc2ccccc2 34a_100000212066_100000183539 [0,1,0,0,0,0|2,0,1]=4 993 B20R2.4449 O=C(COc1ccc(cc1)I)NCc2ccccc2 527a_100015324214_100000184369 [0,1,0,0,0,0|2,0,1]=4 994 B20R2.4449 O=C(COc1ccc(cc1)I)NCc2ccccc2 7a_100000212066_100000183539 [0,1,0,0,0,0|2,0,1]=4 995 B20R2.4449 O=C(COc1ccc(cc1)I)OCc2ccccc2 34a_100000212066_100000753625 [0,1,0,0,0,0|1,0,1]=3 996 B20R2.4449 O=C(COc1ccc(cc1)I)OCc2ccccc2 7a_100000212066_100000753625 [0,1,0,0,0,0|1,0,1]=3 997 B20R2.4449 O=C(COc1ccc(cc1)O)NCc2ccccc2 240690a_100015324214_100000031633 [0,1,0,0,0,0|2,0,1]=4 998 B20R2.4449 O=C(COc1ccc(cc1)O)NCc2ccccc2 527a_100015324214_100000031633 [0,1,0,0,0,0|2,0,1]=4 999 B20R2.4449 O=C(COc1ccc(cn1)Cl)OCc2ccccc2 34a_100011215309_100000753625 [0,1,0,0,0,0|2,0,1]=4 1000 B20R2.4449 O=C(COc1ccc(cn1)F)OCc2ccccc2 34a_100000742473_100000753625 [0,1,0,0,0,0|2,0,1]=4 1001 B20R2.4449 O=C(COc1ccc(nc1)Br)OCc2ccccc2 34a_100000685995_100000753625 [0,1,0,0,0,0|2,0,1]=4 1002 B20R2.4449 O=C(COc1ccc(nc1)Br)OCc2ccccc2 7a_100000685995_100000753625 [0,1,0,0,0,0|2,0,1]=4 1003 B20R2.4449 O=C(COc1ccc(nc1)Cl)OCc2ccccc2 34a_100000744096_100000753625 [0,1,0,0,0,0|2,0,1]=4 1004 B20R2.4449 O=C(COc1ccc(nc1)Cl)OCc2ccccc2 7a_100000744096_100000753625 [0,1,0,0,0,0|2,0,1]=4 1005 B20R2.4449 O=C(COc1ccc(nc1)F)OCc2ccccc2 34a_100000688820_100000753625 [0,1,0,0,0,0|2,0,1]=4 1006 B20R2.4449 O=C(COc1ccc(nc1)F)OCc2ccccc2 7a_100000688820_100000753625 [0,1,0,0,0,0|2,0,1]=4 1007 B20R2.4449 O=C(COc1ccc(nc1)I)OCc2ccccc2 34a_100000687607_100000753625 [0,1,0,0,0,0|2,0,1]=4 1008 B20R2.4449 O=C(COc1ccc(nc1)I)OCc2ccccc2 7a_100000687607_100000753625 [0,1,0,0,0,0|2,0,1]=4 1009 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100000186222 [0,1,0,0,0,0|2,0,1]=4 1010 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100000186222 [0,1,0,0,0,0|2,0,1]=4 1011 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100000186222 [0,1,0,0,0,0|2,0,1]=4 1012 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Br 527a_100000174875_100000186222 [0,1,0,0,0,0|2,0,1]=4 1013 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100000186222 [0,1,0,0,0,0|2,0,1]=4 1014 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000186222 [0,1,0,0,0,0|2,0,1]=4 1015 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000186222 [0,1,0,0,0,0|2,0,1]=4 1016 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Cl 34a_100000210340_100000183476 [0,1,0,0,0,0|2,0,1]=4 1017 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Cl 527a_100000174871_100000186222 [0,1,0,0,0,0|2,0,1]=4 1018 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)Cl 7a_100000210340_100000183476 [0,1,0,0,0,0|2,0,1]=4 1019 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100000186222 [0,1,0,0,0,0|2,0,1]=4 1020 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100000186222 [0,1,0,0,0,0|2,0,1]=4 1021 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100000186222 [0,1,0,0,0,0|2,0,1]=4 1022 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)F 34a_100000210340_100000182461 [0,1,0,0,0,0|2,0,1]=4 1023 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)F 527a_100000174882_100000186222 [0,1,0,0,0,0|2,0,1]=4 1024 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)F 7a_100000210340_100000182461 [0,1,0,0,0,0|2,0,1]=4 1025 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100000186222 [0,1,0,0,0,0|2,0,1]=4 1026 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100000186222 [0,1,0,0,0,0|2,0,1]=4 1027 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100000186222 [0,1,0,0,0,0|2,0,1]=4 1028 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)I 527a_100016989417_100000186222 [0,1,0,0,0,0|2,0,1]=4 1029 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100000186222 [0,1,0,0,0,0|2,0,1]=4 1030 B20R2.4449 O=C(COc1ccccc1)NCc2ccc(cc2)O 527a_100000185549_100000186222 [0,1,0,0,0,0|2,0,1]=4 1031 B20R2.4449 O=C(CSc1cc[n+](cc1)[O-])OCc2ccccc2 62a_100000753625_100000039755 [0,1,0,0,0,0|2,0,1]=4 1032 B20R2.4449 O=C(CSc1ccc(=O)[nH]c1)OCc2ccccc2 62a_100000212171_100000753625 [0,1,0,0,0,0|2,0,1]=4 1033 B20R2.4449 O=C(CSc1ccc(=O)[nH]c1)OCc2ccccc2 62a_100000753625_100000212171 [0,1,0,0,0,0|2,0,1]=4 1034 B20R2.4449 O=C(CSc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_100000179496 [0,1,0,0,0,0|2,0,1]=4 1035 B20R2.4449 O=C(CSc1ccc(cc1)Br)NCc2ccccc2 1626a_100015324214_100000179496 [0,1,0,0,0,0|2,0,1]=4 1036 B20R2.4449 O=C(CSc1ccc(cc1)Br)NCc2ccccc2 240690a_100015324214_100000179496 [0,1,0,0,0,0|2,0,1]=4 1037 B20R2.4449 O=C(CSc1ccc(cc1)Br)NCc2ccccc2 527a_100015324214_100000179496 [0,1,0,0,0,0|2,0,1]=4 1038 B20R2.4449 O=C(CSc1ccc(cc1)Br)NCc2ccccc2 62a_100000183539_100000752885 [0,1,0,0,0,0|2,0,1]=4 1039 B20R2.4449 O=C(CSc1ccc(cc1)Br)NCc2ccccc2 62a_100000752885_100000183539 [0,1,0,0,0,0|2,0,1]=4 1040 B20R2.4449 O=C(CSc1ccc(cc1)Br)OCc2ccccc2 62a_100000752885_100000753625 [0,1,0,0,0,0|1,0,1]=3 1041 B20R2.4449 O=C(CSc1ccc(cc1)Br)OCc2ccccc2 62a_100000753625_100000752885 [0,1,0,0,0,0|1,0,1]=3 1042 B20R2.4449 O=C(CSc1ccc(cc1)Cl)NCc2ccccc2 11a_100015324214_100000178402 [0,1,0,0,0,0|2,0,1]=4 1043 B20R2.4449 O=C(CSc1ccc(cc1)Cl)NCc2ccccc2 1626a_100015324214_100000178402 [0,1,0,0,0,0|2,0,1]=4 1044 B20R2.4449 O=C(CSc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100000178402 [0,1,0,0,0,0|2,0,1]=4 1045 B20R2.4449 O=C(CSc1ccc(cc1)Cl)NCc2ccccc2 527a_100015324214_100000178402 [0,1,0,0,0,0|2,0,1]=4 1046 B20R2.4449 O=C(CSc1ccc(cc1)Cl)NCc2ccccc2 62a_100000183539_100000755918 [0,1,0,0,0,0|2,0,1]=4 1047 B20R2.4449 O=C(CSc1ccc(cc1)Cl)NCc2ccccc2 62a_100000755918_100000183539 [0,1,0,0,0,0|2,0,1]=4 1048 B20R2.4449 O=C(CSc1ccc(cc1)Cl)OCc2ccccc2 62a_100000753625_100000755918 [0,1,0,0,0,0|1,0,1]=3 1049 B20R2.4449 O=C(CSc1ccc(cc1)Cl)OCc2ccccc2 62a_100000755918_100000753625 [0,1,0,0,0,0|1,0,1]=3 1050 B20R2.4449 O=C(CSc1ccc(cc1)F)NCc2ccccc2 11a_100015324214_100000691584 [0,1,0,0,0,0|2,0,1]=4 1051 B20R2.4449 O=C(CSc1ccc(cc1)F)NCc2ccccc2 1626a_100015324214_100000691584 [0,1,0,0,0,0|2,0,1]=4 1052 B20R2.4449 O=C(CSc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100000691584 [0,1,0,0,0,0|2,0,1]=4 1053 B20R2.4449 O=C(CSc1ccc(cc1)F)NCc2ccccc2 527a_100015324214_100000691584 [0,1,0,0,0,0|2,0,1]=4 1054 B20R2.4449 O=C(CSc1ccc(cc1)F)NCc2ccccc2 62a_100000183539_100000211213 [0,1,0,0,0,0|2,0,1]=4 1055 B20R2.4449 O=C(CSc1ccc(cc1)F)NCc2ccccc2 62a_100000211213_100000183539 [0,1,0,0,0,0|2,0,1]=4 1056 B20R2.4449 O=C(CSc1ccc(cc1)F)OCc2ccccc2 62a_100000211213_100000753625 [0,1,0,0,0,0|1,0,1]=3 1057 B20R2.4449 O=C(CSc1ccc(cc1)F)OCc2ccccc2 62a_100000753625_100000211213 [0,1,0,0,0,0|1,0,1]=3 1058 B20R2.4449 O=C(CSc1ccc(cc1)O)NCc2ccccc2 62a_100000183539_100000185759 [0,1,0,0,0,0|2,0,1]=4 1059 B20R2.4449 O=C(CSc1ccc(cc1)O)OCc2ccccc2 62a_100000753625_100000185759 [0,1,0,0,0,0|1,0,1]=3 1060 B20R2.4449 O=C(CSc1ccc(cn1)Br)OCc2ccccc2 62a_100000686858_100000753625 [0,1,0,0,0,0|2,0,1]=4 1061 B20R2.4449 O=C(CSc1ccc(cn1)Br)OCc2ccccc2 62a_100000753625_100000686858 [0,1,0,0,0,0|2,0,1]=4 1062 B20R2.4449 O=C(CSc1ccc(cn1)Cl)OCc2ccccc2 62a_100000753625_100011356976 [0,1,0,0,0,0|2,0,1]=4 1063 B20R2.4449 O=C(CSc1ccc(cn1)Cl)OCc2ccccc2 62a_100011356976_100000753625 [0,1,0,0,0,0|2,0,1]=4 1064 B20R2.4449 O=C(CSc1ccc(cn1)F)OCc2ccccc2 62a_100000744514_100000753625 [0,1,0,0,0,0|2,0,1]=4 1065 B20R2.4449 O=C(CSc1ccc(cn1)F)OCc2ccccc2 62a_100000753625_100000744514 [0,1,0,0,0,0|2,0,1]=4 1066 B20R2.4449 O=C(CSc1ccc(cn1)O)OCc2ccccc2 62a_100000685995_100000753625 [0,1,0,0,0,0|2,0,1]=4 1067 B20R2.4449 O=C(CSc1ccc(cn1)O)OCc2ccccc2 62a_100000753625_100000744096 [0,1,0,0,0,0|2,0,1]=4 1068 B20R2.4449 O=C(CSc1ccc(nc1)Br)OCc2ccccc2 62a_100000753625_100009814638 [0,1,0,0,0,0|2,0,1]=4 1069 B20R2.4449 O=C(CSc1ccc(nc1)Br)OCc2ccccc2 62a_100009814638_100000753625 [0,1,0,0,0,0|2,0,1]=4 1070 B20R2.4449 O=C(CSc1ccc(nc1)Cl)OCc2ccccc2 62a_100000034144_100000753625 [0,1,0,0,0,0|2,0,1]=4 1071 B20R2.4449 O=C(CSc1ccc(nc1)Cl)OCc2ccccc2 62a_100000753625_100000034144 [0,1,0,0,0,0|2,0,1]=4 1072 B20R2.4449 O=C(CSc1ccc(nc1)F)OCc2ccccc2 62a_100000042367_100000753625 [0,1,0,0,0,0|2,0,1]=4 1073 B20R2.4449 O=C(CSc1ccc(nc1)F)OCc2ccccc2 62a_100000753625_100000042367 [0,1,0,0,0,0|2,0,1]=4 1074 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100000211596 [0,1,0,0,0,0|2,0,1]=4 1075 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100000211596 [0,1,0,0,0,0|2,0,1]=4 1076 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100000211596 [0,1,0,0,0,0|2,0,1]=4 1077 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Br 527a_100000174875_100000211596 [0,1,0,0,0,0|2,0,1]=4 1078 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100000211596 [0,1,0,0,0,0|2,0,1]=4 1079 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000211596 [0,1,0,0,0,0|2,0,1]=4 1080 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000211596 [0,1,0,0,0,0|2,0,1]=4 1081 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Cl 527a_100000174871_100000211596 [0,1,0,0,0,0|2,0,1]=4 1082 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Cl 62a_100000183476_100000041952 [0,1,0,0,0,0|2,0,1]=4 1083 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)Cl 62a_100000719477_100000183476 [0,1,0,0,0,0|2,0,1]=4 1084 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100000211596 [0,1,0,0,0,0|2,0,1]=4 1085 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100000211596 [0,1,0,0,0,0|2,0,1]=4 1086 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100000211596 [0,1,0,0,0,0|2,0,1]=4 1087 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)F 527a_100000174882_100000211596 [0,1,0,0,0,0|2,0,1]=4 1088 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)F 62a_100000182461_100000041952 [0,1,0,0,0,0|2,0,1]=4 1089 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)F 62a_100000719477_100000182461 [0,1,0,0,0,0|2,0,1]=4 1090 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100000211596 [0,1,0,0,0,0|2,0,1]=4 1091 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100000211596 [0,1,0,0,0,0|2,0,1]=4 1092 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100000211596 [0,1,0,0,0,0|2,0,1]=4 1093 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)I 527a_100016989417_100000211596 [0,1,0,0,0,0|2,0,1]=4 1094 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100000211596 [0,1,0,0,0,0|2,0,1]=4 1095 B20R2.4449 O=C(CSc1ccccc1)NCc2ccc(cc2)O 527a_100000185549_100000211596 [0,1,0,0,0,0|2,0,1]=4 1096 B20R2.4449 O=C(NCc1ccc(cc1)Br)NNc2ccccc2 273464a_100000174875_100015195140 [0,1,0,0,0,0|3,0,0]=4 1097 B20R2.4449 O=C(NCc1ccc(cc1)Br)NNc2ccccc2 512a_100000174875_100015195140 [0,1,0,0,0,0|3,0,0]=4 1098 B20R2.4449 O=C(NCc1ccc(cc1)Cl)NNc2ccccc2 273464a_100000174871_100015195140 [0,1,0,0,0,0|3,0,0]=4 1099 B20R2.4449 O=C(NCc1ccc(cc1)F)NNc2ccccc2 273464a_100000174882_100015195140 [0,1,0,0,0,0|3,0,0]=4 1100 B20R2.4449 O=C(NCc1ccc(cc1)F)NNc2ccccc2 512a_100000174882_100015195140 [0,1,0,0,0,0|3,0,0]=4 1101 B20R2.4449 O=C(NCc1ccc(cc1)I)NNc2ccccc2 273464a_100016989417_100015195140 [0,1,0,0,0,0|3,0,0]=4 1102 B20R2.4449 O=C(NCc1ccc(cc1)I)NNc2ccccc2 512a_100016989417_100015195140 [0,1,0,0,0,0|3,0,0]=4 1103 B20R2.4449 O=C(NCc1ccc(cc1)O)NNc2ccccc2 273464a_100000185549_100015195140 [0,1,0,0,0,0|3,0,0]=4 1104 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Br 2708a_100000174875_100015324214 [0,1,0,0,0,0|2,0,1]=4 1105 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Br 2708a_100015324214_100000174875 [0,1,0,0,0,0|2,0,1]=4 1106 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Br 273464a_100000174875_100015324214 [0,1,0,0,0,0|2,0,1]=4 1107 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Br 273464a_100015324214_100000174875 [0,1,0,0,0,0|2,0,1]=4 1108 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Br 512a_100000174875_100015324214 [0,1,0,0,0,0|2,0,1]=4 1109 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Br 512a_100015324214_100000174875 [0,1,0,0,0,0|2,0,1]=4 1110 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Cl 2708a_100000174871_100015324214 [0,1,0,0,0,0|2,0,1]=4 1111 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Cl 2708a_100015324214_100000174871 [0,1,0,0,0,0|2,0,1]=4 1112 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Cl 273464a_100000174871_100015324214 [0,1,0,0,0,0|2,0,1]=4 1113 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Cl 273464a_100015324214_100000174871 [0,1,0,0,0,0|2,0,1]=4 1114 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)Cl 512a_100015324214_100000174871 [0,1,0,0,0,0|2,0,1]=4 1115 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)F 2708a_100000174882_100015324214 [0,1,0,0,0,0|2,0,1]=4 1116 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)F 2708a_100015324214_100000174882 [0,1,0,0,0,0|2,0,1]=4 1117 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)F 273464a_100000174882_100015324214 [0,1,0,0,0,0|2,0,1]=4 1118 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)F 273464a_100015324214_100000174882 [0,1,0,0,0,0|2,0,1]=4 1119 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)F 512a_100000174882_100015324214 [0,1,0,0,0,0|2,0,1]=4 1120 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)F 512a_100015324214_100000174882 [0,1,0,0,0,0|2,0,1]=4 1121 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)I 2708a_100015324214_100016989417 [0,1,0,0,0,0|2,0,1]=4 1122 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)I 2708a_100016989417_100015324214 [0,1,0,0,0,0|2,0,1]=4 1123 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)I 273464a_100015324214_100016989417 [0,1,0,0,0,0|2,0,1]=4 1124 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)I 273464a_100016989417_100015324214 [0,1,0,0,0,0|2,0,1]=4 1125 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)I 512a_100015324214_100016989417 [0,1,0,0,0,0|2,0,1]=4 1126 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)I 512a_100016989417_100015324214 [0,1,0,0,0,0|2,0,1]=4 1127 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)O 2708a_100000185549_100015324214 [0,1,0,0,0,0|2,0,1]=4 1128 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)O 2708a_100015324214_100000185549 [0,1,0,0,0,0|2,0,1]=4 1129 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)O 273464a_100000185549_100015324214 [0,1,0,0,0,0|2,0,1]=4 1130 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)O 273464a_100015324214_100000185549 [0,1,0,0,0,0|2,0,1]=4 1131 B20R2.4449 O=C(NCc1ccccc1)NCc2ccc(cc2)O 512a_100015324214_100000185549 [0,1,0,0,0,0|2,0,1]=4 1132 B20R2.4449 O=C(NCc1ccccc1)NNc2ccc(cc2)Br 273464a_100015324214_100000735608 [0,1,0,0,0,0|3,0,0]=4 1133 B20R2.4449 O=C(NCc1ccccc1)NNc2ccc(cc2)Br 512a_100015324214_100000735608 [0,1,0,0,0,0|3,0,0]=4 1134 B20R2.4449 O=C(NCc1ccccc1)NNc2ccc(cc2)Cl 273464a_100015324214_100000683521 [0,1,0,0,0,0|3,0,0]=4 1135 B20R2.4449 O=C(NCc1ccccc1)NNc2ccc(cc2)Cl 512a_100015324214_100000683521 [0,1,0,0,0,0|3,0,0]=4 1136 B20R2.4449 O=C(NCc1ccccc1)NNc2ccc(cc2)F 273464a_100015324214_100000728448 [0,1,0,0,0,0|3,0,0]=4 1137 B20R2.4449 O=C(NCc1ccccc1)NNc2ccc(cc2)F 512a_100015324214_100000728448 [0,1,0,0,0,0|3,0,0]=4 1138 B20R2.4449 O=C(NCc1ccccc1)NNc2ccc(cc2)I 273464a_100015324214_100016988836 [0,1,0,0,0,0|3,0,0]=4 1139 B20R2.4449 O=C(NCc1ccccc1)NNc2ccc(cc2)I 512a_100015324214_100016988836 [0,1,0,0,0,0|3,0,0]=4 1140 B20R2.4658 CC(=NNc1cccc(c1)Br)C=Cc2ccccc2 4a_100000217339_100000204604 [0,1,0,0,0,0|3,0,0]=4 1141 B20R2.4658 CC(=NNc1cccc(c1)C)C=Cc2ccccc2 4a_100000681630_100000204604 [0,1,0,0,0,0|3,0,0]=4 1142 B20R2.4658 CC(=NNc1cccc(c1)Cl)C=Cc2ccccc2 4a_100000184277_100000204604 [0,1,0,0,0,0|3,0,0]=4 1143 B20R2.4658 CC(=NNc1cccc(c1)F)C=Cc2ccccc2 4a_100000745080_100000204604 [0,1,0,0,0,0|3,0,0]=4 1144 B20R2.4658 CC(=NNc1cccc(c1)I)C=Cc2ccccc2 4a_100020605690_100000204604 [0,1,0,0,0,0|3,0,0]=4 1145 B20R2.4658 CC(=NNc1ccccc1)C=Cc2cccc(c2)Br 4a_100015195140_200016266566 [0,1,0,0,0,0|3,0,0]=4 1146 B20R2.4658 CC(=NNc1ccccc1)C=Cc2cccc(c2)Cl 4a_100015195140_200016280735 [0,1,0,0,0,0|3,0,0]=4 1147 B20R2.4658 C[n+]1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100009996589 [0,1,0,0,0,0|2,0,1]=4 1148 B20R2.4658 C[n+]1cccc(c1)SCC(=O)OCc2ccccc2 62a_100009996589_100000753625 [0,1,0,0,0,0|2,0,1]=4 1149 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2 11a_100011934566_100000210462 [0,1,0,0,0,0|2,0,0]=3 1150 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2 1626a_100011934566_100000210462 [0,1,0,0,0,0|2,0,0]=3 1151 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2ccccn2 11a_100011934566_100000740811 [0,1,0,0,0,0|3,0,0]=4 1152 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2ccccn2 240690a_100011934566_100000740811 [0,1,0,0,0,0|3,0,0]=4 1153 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2cccnc2 11a_100011934566_100000735890 [0,1,0,0,0,0|3,0,0]=4 1154 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2cccnc2 240690a_100011934566_100000735890 [0,1,0,0,0,0|3,0,0]=4 1155 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2ccncc2 240690a_100011934566_100000682801 [0,1,0,0,0,0|3,0,0]=4 1156 B20R2.4658 Cc1cc(ccn1)OCC(=O)OCc2ccccc2 34a_100000688365_100000753625 [0,1,0,0,0,0|2,0,1]=4 1157 B20R2.4658 Cc1cc(ccn1)SCC(=O)OCc2ccccc2 62a_100000753625_100000758586 [0,1,0,0,0,0|2,0,1]=4 1158 B20R2.4658 Cc1cc(ccn1)SCC(=O)OCc2ccccc2 62a_100000758586_100000753625 [0,1,0,0,0,0|2,0,1]=4 1159 B20R2.4658 Cc1cccc(c1)C#CC(=O)CCc2ccccc2 1458a_100011892726_100000765856 [0,1,0,0,0,0|1,0,2]=4 1160 B20R2.4658 Cc1cccc(c1)C#CC(=O)NCc2ccccc2 240690a_100015324214_100011892726 [0,1,0,0,0,0|1,0,2]=4 1161 B20R2.4658 Cc1cccc(c1)C=CC(=O)CCc2ccccc2 1458a_100000690095_100000765856 [0,1,0,0,0,0|1,0,0]=2 1162 B20R2.4658 Cc1cccc(c1)C=CC(=O)CCc2ccccn2 1458a_100000690095_100015183660 [0,1,0,0,0,0|2,0,0]=3 1163 B20R2.4658 Cc1cccc(c1)C=CC(=O)CCc2cccnc2 1458a_100000690095_200011713674 [0,1,0,0,0,0|2,0,0]=3 1164 B20R2.4658 Cc1cccc(c1)C=CC(=O)CCc2ccncc2 1458a_100000690095_100000723409 [0,1,0,0,0,0|2,0,0]=3 1165 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000690095 [0,1,0,0,0,0|1,0,0]=2 1166 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000690095 [0,1,0,0,0,0|1,0,0]=2 1167 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100000690095 [0,1,0,0,0,0|1,0,0]=2 1168 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccn2 11a_100000210449_100000690095 [0,1,0,0,0,0|2,0,0]=3 1169 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000690095 [0,1,0,0,0,0|2,0,0]=3 1170 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccn2 240690a_100000210449_100000690095 [0,1,0,0,0,0|2,0,0]=3 1171 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cccnc2 11a_100000210453_100000690095 [0,1,0,0,0,0|2,0,0]=3 1172 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cccnc2 240690a_100000210453_100000690095 [0,1,0,0,0,0|2,0,0]=3 1173 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cccnn2 11a_100159270163_100000690095 [0,1,0,0,0,0|3,0,0]=4 1174 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cccnn2 240690a_100159270163_100000690095 [0,1,0,0,0,0|3,0,0]=4 1175 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccncc2 11a_100000210450_100000690095 [0,1,0,0,0,0|2,0,0]=3 1176 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000690095 [0,1,0,0,0,0|2,0,0]=3 1177 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccncc2 240690a_100000210450_100000690095 [0,1,0,0,0,0|2,0,0]=3 1178 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccncn2 11a_100000736019_100000690095 [0,1,0,0,0,0|3,0,0]=4 1179 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccncn2 240690a_100000736019_100000690095 [0,1,0,0,0,0|3,0,0]=4 1180 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cnccn2 11a_100000737960_100000690095 [0,1,0,0,0,0|3,0,0]=4 1181 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cnccn2 240690a_100000737960_100000690095 [0,1,0,0,0,0|3,0,0]=4 1182 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cncnc2 11a_100011243677_100000690095 [0,1,0,0,0,0|3,0,0]=4 1183 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cncnc2 240690a_100011243677_100000690095 [0,1,0,0,0,0|3,0,0]=4 1184 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ncccn2 11a_100015189908_100000690095 [0,1,0,0,0,0|3,0,0]=4 1185 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ncccn2 240690a_100015189908_100000690095 [0,1,0,0,0,0|3,0,0]=4 1186 B20R2.4658 Cc1cccc(c1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000690095 [0,1,0,0,0,0|2,0,0]=3 1187 B20R2.4658 Cc1cccc(c1)C=CC(=O)NNc2ccccn2 22a_100000183288_100000690095 [0,1,0,0,0,0|3,0,0]=4 1188 B20R2.4658 Cc1cccc(c1)C=CC(=O)NNc2cccnc2 22a_100000728903_100000690095 [0,1,0,0,0,0|3,0,0]=4 1189 B20R2.4658 Cc1cccc(c1)C=CC(=O)NNc2ccncc2 22a_100000698918_100000690095 [0,1,0,0,0,0|3,0,0]=4 1190 B20R2.4658 Cc1cccc(c1)CCC(=O)C#Cc2ccccc2 1458a_100000736102_100011713685 [0,1,0,0,0,0|1,0,2]=4 1191 B20R2.4658 Cc1cccc(c1)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100011713685 [0,1,0,0,0,0|1,0,0]=2 1192 B20R2.4658 Cc1cccc(c1)CCC(=O)C=Cc2ccccn2 1458a_100000740811_100011713685 [0,1,0,0,0,0|2,0,0]=3 1193 B20R2.4658 Cc1cccc(c1)CCC(=O)C=Cc2cccnc2 1458a_100000735890_100011713685 [0,1,0,0,0,0|2,0,0]=3 1194 B20R2.4658 Cc1cccc(c1)CCC(=O)C=Cc2ccncc2 1458a_100000682801_100011713685 [0,1,0,0,0,0|2,0,0]=3 1195 B20R2.4658 Cc1cccc(c1)CCC(=O)CCc2ccccc2 1458a_100000185753_100011713685 [0,1,0,0,0,0|1,0,2]=4 1196 B20R2.4658 Cc1cccc(c1)CCC(=O)CCc2ccccc2 1458a_100000234952_100000765856 [0,1,0,0,0,0|1,0,2]=4 1197 B20R2.4658 Cc1cccc(c1)CCC(=O)COc2ccccc2 1458a_100000186222_100011713685 [0,1,0,0,0,0|2,0,1]=4 1198 B20R2.4658 Cc1cccc(c1)CCC(=O)CSc2ccccc2 1458a_100000211596_100011713685 [0,1,0,0,0,0|2,0,1]=4 1199 B20R2.4658 Cc1cccc(c1)CCC(=O)NCc2ccccc2 11a_100015324214_100000234952 [0,1,0,0,0,0|1,0,2]=4 1200 B20R2.4658 Cc1cccc(c1)CCC(=O)NCc2ccccc2 1626a_100015324214_100000234952 [0,1,0,0,0,0|1,0,2]=4 1201 B20R2.4658 Cc1cccc(c1)CCC(=O)NCc2ccccc2 240690a_100015324214_100000234952 [0,1,0,0,0,0|1,0,2]=4 1202 B20R2.4658 Cc1cccc(c1)CCC(=O)NCc2ccccc2 527a_100015324214_100000234952 [0,1,0,0,0,0|1,0,2]=4 1203 B20R2.4658 Cc1cccc(c1)CCC(=O)NNc2ccccc2 22a_100015195140_100000234952 [0,1,0,0,0,0|3,0,0]=4 1204 B20R2.4658 Cc1cccc(c1)CNC(=O)C#Cc2ccccc2 240690a_100000185548_100000736102 [0,1,0,0,0,0|1,0,2]=4 1205 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2 11a_100000185548_100000210462 [0,1,0,0,0,0|1,0,0]=2 1206 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2 1626a_100000185548_100000210462 [0,1,0,0,0,0|1,0,0]=2 1207 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccccn2 11a_100000185548_100000740811 [0,1,0,0,0,0|2,0,0]=3 1208 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccccn2 240690a_100000185548_100000740811 [0,1,0,0,0,0|2,0,0]=3 1209 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2cccnc2 11a_100000185548_100000735890 [0,1,0,0,0,0|2,0,0]=3 1210 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2cccnc2 240690a_100000185548_100000735890 [0,1,0,0,0,0|2,0,0]=3 1211 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccncc2 240690a_100000185548_100000682801 [0,1,0,0,0,0|2,0,0]=3 1212 B20R2.4658 Cc1cccc(c1)CNC(=O)CCc2ccccc2 11a_100000185548_100000185753 [0,1,0,0,0,0|1,0,2]=4 1213 B20R2.4658 Cc1cccc(c1)CNC(=O)CCc2ccccc2 1626a_100000185548_100000185753 [0,1,0,0,0,0|1,0,2]=4 1214 B20R2.4658 Cc1cccc(c1)CNC(=O)CCc2ccccc2 240690a_100000185548_100000185753 [0,1,0,0,0,0|1,0,2]=4 1215 B20R2.4658 Cc1cccc(c1)CNC(=O)CCc2ccccc2 527a_100000185548_100000185753 [0,1,0,0,0,0|1,0,2]=4 1216 B20R2.4658 Cc1cccc(c1)CNC(=O)CNc2ccccc2 34a_100000106764_100000754571 [0,1,0,0,0,0|2,0,1]=4 1217 B20R2.4658 Cc1cccc(c1)CNC(=O)COc2ccccc2 11a_100000185548_100000186222 [0,1,0,0,0,0|2,0,1]=4 1218 B20R2.4658 Cc1cccc(c1)CNC(=O)COc2ccccc2 1626a_100000185548_100000186222 [0,1,0,0,0,0|2,0,1]=4 1219 B20R2.4658 Cc1cccc(c1)CNC(=O)COc2ccccc2 240690a_100000185548_100000186222 [0,1,0,0,0,0|2,0,1]=4 1220 B20R2.4658 Cc1cccc(c1)CNC(=O)COc2ccccc2 34a_100000210340_100000754571 [0,1,0,0,0,0|2,0,1]=4 1221 B20R2.4658 Cc1cccc(c1)CNC(=O)COc2ccccc2 527a_100000185548_100000186222 [0,1,0,0,0,0|2,0,1]=4 1222 B20R2.4658 Cc1cccc(c1)CNC(=O)COc2ccccc2 7a_100000210340_100000754571 [0,1,0,0,0,0|2,0,1]=4 1223 B20R2.4658 Cc1cccc(c1)CNC(=O)CSc2ccccc2 11a_100000185548_100000211596 [0,1,0,0,0,0|2,0,1]=4 1224 B20R2.4658 Cc1cccc(c1)CNC(=O)CSc2ccccc2 1626a_100000185548_100000211596 [0,1,0,0,0,0|2,0,1]=4 1225 B20R2.4658 Cc1cccc(c1)CNC(=O)CSc2ccccc2 240690a_100000185548_100000211596 [0,1,0,0,0,0|2,0,1]=4 1226 B20R2.4658 Cc1cccc(c1)CNC(=O)CSc2ccccc2 527a_100000185548_100000211596 [0,1,0,0,0,0|2,0,1]=4 1227 B20R2.4658 Cc1cccc(c1)CNC(=O)CSc2ccccc2 62a_100000719477_100000754571 [0,1,0,0,0,0|2,0,1]=4 1228 B20R2.4658 Cc1cccc(c1)CNC(=O)CSc2ccccc2 62a_100000754571_100000041952 [0,1,0,0,0,0|2,0,1]=4 1229 B20R2.4658 Cc1cccc(c1)CNC(=O)NCc2ccccc2 2708a_100000185548_100015324214 [0,1,0,0,0,0|2,0,1]=4 1230 B20R2.4658 Cc1cccc(c1)CNC(=O)NCc2ccccc2 2708a_100015324214_100000185548 [0,1,0,0,0,0|2,0,1]=4 1231 B20R2.4658 Cc1cccc(c1)CNC(=O)NCc2ccccc2 273464a_100000185548_100015324214 [0,1,0,0,0,0|2,0,1]=4 1232 B20R2.4658 Cc1cccc(c1)CNC(=O)NCc2ccccc2 273464a_100015324214_100000185548 [0,1,0,0,0,0|2,0,1]=4 1233 B20R2.4658 Cc1cccc(c1)CNC(=O)NCc2ccccc2 512a_100000185548_100015324214 [0,1,0,0,0,0|2,0,1]=4 1234 B20R2.4658 Cc1cccc(c1)CNC(=O)NCc2ccccc2 512a_100015324214_100000185548 [0,1,0,0,0,0|2,0,1]=4 1235 B20R2.4658 Cc1cccc(c1)CNC(=O)NNc2ccccc2 273464a_100000185548_100015195140 [0,1,0,0,0,0|3,0,0]=4 1236 B20R2.4658 Cc1cccc(c1)CNC(=O)NNc2ccccc2 512a_100000185548_100015195140 [0,1,0,0,0,0|3,0,0]=4 1237 B20R2.4658 Cc1cccc(c1)NCC(=O)CCc2ccccc2 2230a_100000188690_100012361361 [0,1,0,0,0,0|2,0,1]=4 1238 B20R2.4658 Cc1cccc(c1)NCC(=O)CCc2ccccc2 34a_100000188690_100012361361 [0,1,0,0,0,0|2,0,1]=4 1239 B20R2.4658 Cc1cccc(c1)NCC(=O)NCc2ccccc2 2230a_100000188690_100000183539 [0,1,0,0,0,0|2,0,1]=4 1240 B20R2.4658 Cc1cccc(c1)NCC(=O)NCc2ccccc2 34a_100000188690_100000183539 [0,1,0,0,0,0|2,0,1]=4 1241 B20R2.4658 Cc1cccc(c1)NCC(=O)OCc2ccccc2 2230a_100000188690_100000753625 [0,1,0,0,0,0|1,0,1]=3 1242 B20R2.4658 Cc1cccc(c1)NCC(=O)OCc2ccccc2 34a_100000188690_100000753625 [0,1,0,0,0,0|1,0,1]=3 1243 B20R2.4658 Cc1cccc(c1)NNC(=O)C=Cc2ccccc2 22a_100000681630_100000210462 [0,1,0,0,0,0|2,0,0]=3 1244 B20R2.4658 Cc1cccc(c1)NNC(=O)C=Cc2ccccn2 22a_100000681630_100000740811 [0,1,0,0,0,0|3,0,0]=4 1245 B20R2.4658 Cc1cccc(c1)NNC(=O)C=Cc2cccnc2 22a_100000681630_100000735890 [0,1,0,0,0,0|3,0,0]=4 1246 B20R2.4658 Cc1cccc(c1)NNC(=O)C=Cc2ccncc2 22a_100000681630_100000682801 [0,1,0,0,0,0|3,0,0]=4 1247 B20R2.4658 Cc1cccc(c1)NNC(=O)CCc2ccccc2 22a_100000681630_100000185753 [0,1,0,0,0,0|3,0,0]=4 1248 B20R2.4658 Cc1cccc(c1)NNC(=O)NCc2ccccc2 273464a_100015324214_100000681630 [0,1,0,0,0,0|3,0,0]=4 1249 B20R2.4658 Cc1cccc(c1)NNC(=O)NCc2ccccc2 512a_100000681630_100015324214 [0,1,0,0,0,0|3,0,0]=4 1250 B20R2.4658 Cc1cccc(c1)NNC(=O)NCc2ccccc2 512a_100015324214_100000681630 [0,1,0,0,0,0|3,0,0]=4 1251 B20R2.4658 Cc1cccc(c1)OCC(=O)CCc2ccccc2 1458a_100000183606_100000765856 [0,1,0,0,0,0|2,0,1]=4 1252 B20R2.4658 Cc1cccc(c1)OCC(=O)CCc2ccccc2 34a_100000210337_100012361361 [0,1,0,0,0,0|2,0,1]=4 1253 B20R2.4658 Cc1cccc(c1)OCC(=O)CCc2ccccc2 7a_100000210337_100012361361 [0,1,0,0,0,0|2,0,1]=4 1254 B20R2.4658 Cc1cccc(c1)OCC(=O)NCc2ccccc2 11a_100015324214_100000183606 [0,1,0,0,0,0|2,0,1]=4 1255 B20R2.4658 Cc1cccc(c1)OCC(=O)NCc2ccccc2 1626a_100015324214_100000183606 [0,1,0,0,0,0|2,0,1]=4 1256 B20R2.4658 Cc1cccc(c1)OCC(=O)NCc2ccccc2 240690a_100015324214_100000183606 [0,1,0,0,0,0|2,0,1]=4 1257 B20R2.4658 Cc1cccc(c1)OCC(=O)NCc2ccccc2 34a_100000210337_100000183539 [0,1,0,0,0,0|2,0,1]=4 1258 B20R2.4658 Cc1cccc(c1)OCC(=O)NCc2ccccc2 527a_100015324214_100000183606 [0,1,0,0,0,0|2,0,1]=4 1259 B20R2.4658 Cc1cccc(c1)OCC(=O)NCc2ccccc2 7a_100000210337_100000183539 [0,1,0,0,0,0|2,0,1]=4 1260 B20R2.4658 Cc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000210337_100000753625 [0,1,0,0,0,0|1,0,1]=3 1261 B20R2.4658 Cc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100000210337_100000753625 [0,1,0,0,0,0|1,0,1]=3 1262 B20R2.4658 Cc1cccc(c1)SCC(=O)CCc2ccccc2 62a_100011215228_100012361361 [0,1,0,0,0,0|2,0,1]=4 1263 B20R2.4658 Cc1cccc(c1)SCC(=O)CCc2ccccc2 62a_100012361361_100011215228 [0,1,0,0,0,0|2,0,1]=4 1264 B20R2.4658 Cc1cccc(c1)SCC(=O)NCc2ccccc2 62a_100000183539_100011215228 [0,1,0,0,0,0|2,0,1]=4 1265 B20R2.4658 Cc1cccc(c1)SCC(=O)NCc2ccccc2 62a_100011215228_100000183539 [0,1,0,0,0,0|2,0,1]=4 1266 B20R2.4658 Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100011215228 [0,1,0,0,0,0|1,0,1]=3 1267 B20R2.4658 Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100011215228_100000753625 [0,1,0,0,0,0|1,0,1]=3 1268 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2 11a_100000701342_100000210462 [0,1,0,0,0,0|2,0,0]=3 1269 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2 1626a_100000701342_100000210462 [0,1,0,0,0,0|2,0,0]=3 1270 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2ccccn2 11a_100000701342_100000740811 [0,1,0,0,0,0|3,0,0]=4 1271 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2ccccn2 240690a_100000701342_100000740811 [0,1,0,0,0,0|3,0,0]=4 1272 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2cccnc2 11a_100000701342_100000735890 [0,1,0,0,0,0|3,0,0]=4 1273 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2cccnc2 240690a_100000701342_100000735890 [0,1,0,0,0,0|3,0,0]=4 1274 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2ccncc2 240690a_100000701342_100000682801 [0,1,0,0,0,0|3,0,0]=4 1275 B20R2.4658 Cc1cccc(n1)NNC(=O)C=Cc2ccccc2 22a_100011363444_100000210462 [0,1,0,0,0,0|3,0,0]=4 1276 B20R2.4658 Cc1cccc(n1)SCC(=O)OCc2ccccc2 62a_100000742759_100000753625 [0,1,0,0,0,0|2,0,1]=4 1277 B20R2.4658 Cc1cccc(n1)SCC(=O)OCc2ccccc2 62a_100000753625_100000742759 [0,1,0,0,0,0|2,0,1]=4 1278 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2 11a_100011934573_100000210462 [0,1,0,0,0,0|2,0,0]=3 1279 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2 1626a_100011934573_100000210462 [0,1,0,0,0,0|2,0,0]=3 1280 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2ccccn2 11a_100011934573_100000740811 [0,1,0,0,0,0|3,0,0]=4 1281 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2ccccn2 240690a_100011934573_100000740811 [0,1,0,0,0,0|3,0,0]=4 1282 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2cccnc2 11a_100011934573_100000735890 [0,1,0,0,0,0|3,0,0]=4 1283 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2cccnc2 240690a_100011934573_100000735890 [0,1,0,0,0,0|3,0,0]=4 1284 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2ccncc2 240690a_100011934573_100000682801 [0,1,0,0,0,0|3,0,0]=4 1285 B20R2.4658 Cc1ccnc(c1)NNC(=O)C=Cc2ccccc2 22a_100000746014_100000210462 [0,1,0,0,0,0|3,0,0]=4 1286 B20R2.4658 Cc1ccnc(c1)SCC(=O)OCc2ccccc2 62a_100000750283_100000753625 [0,1,0,0,0,0|2,0,1]=4 1287 B20R2.4658 Cc1ccnc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000750283 [0,1,0,0,0,0|2,0,1]=4 1288 B20R2.4658 Cc1ccnc(n1)CNC(=O)C=Cc2ccccc2 11a_100015186494_100000210462 [0,1,0,0,0,0|3,0,0]=4 1289 B20R2.4658 Cc1ccnc(n1)CNC(=O)C=Cc2ccccc2 1626a_100015186494_100000210462 [0,1,0,0,0,0|3,0,0]=4 1290 B20R2.4658 Cc1cncc(c1)C=CC(=O)CCc2ccccc2 6a_100011998712_100000210092 [0,1,0,0,0,0|2,0,0]=3 1291 B20R2.4658 Cc1cncc(c1)C=CC(=O)COc2ccccc2 6a_100011998712_100000150576 [0,1,0,0,0,0|3,0,0]=4 1292 B20R2.4658 Cc1cncc(c1)C=CC(=O)CSc2ccccc2 6a_100011998712_100000150717 [0,1,0,0,0,0|3,0,0]=4 1293 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2 11a_100000692839_100000210462 [0,1,0,0,0,0|2,0,0]=3 1294 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2 1626a_100000692839_100000210462 [0,1,0,0,0,0|2,0,0]=3 1295 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2ccccn2 11a_100000692839_100000740811 [0,1,0,0,0,0|3,0,0]=4 1296 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2ccccn2 240690a_100000692839_100000740811 [0,1,0,0,0,0|3,0,0]=4 1297 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2cccnc2 11a_100000692839_100000735890 [0,1,0,0,0,0|3,0,0]=4 1298 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2cccnc2 240690a_100000692839_100000735890 [0,1,0,0,0,0|3,0,0]=4 1299 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2ccncc2 240690a_100000692839_100000682801 [0,1,0,0,0,0|3,0,0]=4 1300 B20R2.4658 Cc1cncc(c1)OCC(=O)OCc2ccccc2 34a_100011830280_100000753625 [0,1,0,0,0,0|2,0,1]=4 1301 B20R2.4658 Cc1cncc(c1)OCC(=O)OCc2ccccc2 7a_100011830280_100000753625 [0,1,0,0,0,0|2,0,1]=4 1302 B20R2.4658 Cc1cncc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000760492 [0,1,0,0,0,0|2,0,1]=4 1303 B20R2.4658 Cc1cncc(c1)SCC(=O)OCc2ccccc2 62a_100000760492_100000753625 [0,1,0,0,0,0|2,0,1]=4 1304 B20R2.4658 Cc1cncc(n1)C=CC(=O)CCc2ccccc2 6a_100000100294_100000210092 [0,1,0,0,0,0|3,0,0]=4 1305 B20R2.4658 Nc1cc(ccn1)OCC(=O)OCc2ccccc2 34a_100011834064_100000753625 [0,1,0,0,0,0|2,0,1]=4 1306 B20R2.4658 Nc1cc(ccn1)SCC(=O)OCc2ccccc2 62a_100000049665_100000753625 [0,1,0,0,0,0|2,0,1]=4 1307 B20R2.4658 Nc1cc(ccn1)SCC(=O)OCc2ccccc2 62a_100000753625_100000049665 [0,1,0,0,0,0|2,0,1]=4 1308 B20R2.4658 Nc1cccc(c1)OCC(=O)CCc2ccccc2 34a_100000210217_100012361361 [0,1,0,0,0,0|2,0,1]=4 1309 B20R2.4658 Nc1cccc(c1)OCC(=O)NCc2ccccc2 34a_100000210217_100000183539 [0,1,0,0,0,0|2,0,1]=4 1310 B20R2.4658 Nc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000210217_100000753625 [0,1,0,0,0,0|1,0,1]=3 1311 B20R2.4658 Nc1cccc(c1)SCC(=O)CCc2ccccc2 62a_100000210019_100012361361 [0,1,0,0,0,0|2,0,1]=4 1312 B20R2.4658 Nc1cccc(c1)SCC(=O)CCc2ccccc2 62a_100012361361_100000210019 [0,1,0,0,0,0|2,0,1]=4 1313 B20R2.4658 Nc1cccc(c1)SCC(=O)NCc2ccccc2 62a_100000183539_100000210019 [0,1,0,0,0,0|2,0,1]=4 1314 B20R2.4658 Nc1cccc(c1)SCC(=O)NCc2ccccc2 62a_100000210019_100000183539 [0,1,0,0,0,0|2,0,1]=4 1315 B20R2.4658 Nc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000210019_100000753625 [0,1,0,0,0,0|1,0,1]=3 1316 B20R2.4658 Nc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000210019 [0,1,0,0,0,0|1,0,1]=3 1317 B20R2.4658 Nc1cccc(n1)SCC(=O)OCc2ccccc2 62a_100000740741_100000753625 [0,1,0,0,0,0|2,0,1]=4 1318 B20R2.4658 Nc1cccc(n1)SCC(=O)OCc2ccccc2 62a_100000753625_100000740741 [0,1,0,0,0,0|2,0,1]=4 1319 B20R2.4658 Nc1ccnc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100009814236 [0,1,0,0,0,0|2,0,1]=4 1320 B20R2.4658 Nc1ccnc(c1)SCC(=O)OCc2ccccc2 62a_100009814236_100000753625 [0,1,0,0,0,0|2,0,1]=4 1321 B20R2.4658 Nc1cncc(c1)OCC(=O)OCc2ccccc2 34a_100011997051_100000753625 [0,1,0,0,0,0|2,0,1]=4 1322 B20R2.4658 Nc1cncc(c1)SCC(=O)OCc2ccccc2 62a_100000687067_100000753625 [0,1,0,0,0,0|2,0,1]=4 1323 B20R2.4658 Nc1cncc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000687067 [0,1,0,0,0,0|2,0,1]=4 1324 B20R2.4658 O=C(C#Cc1cccc(c1)Br)CCc2ccccc2 1458a_100012100324_100000765856 [0,1,0,0,0,0|1,0,2]=4 1325 B20R2.4658 O=C(C#Cc1cccc(c1)Cl)CCc2ccccc2 1458a_100011892777_100000765856 [0,1,0,0,0,0|1,0,2]=4 1326 B20R2.4658 O=C(C#Cc1cccc(c1)Cl)NCc2ccccc2 240690a_100015324214_100011892777 [0,1,0,0,0,0|1,0,2]=4 1327 B20R2.4658 O=C(C#Cc1cccc(c1)F)CCc2ccccc2 1458a_100011892744_100000765856 [0,1,0,0,0,0|1,0,2]=4 1328 B20R2.4658 O=C(C#Cc1cccc(c1)F)NCc2ccccc2 240690a_100015324214_100011892744 [0,1,0,0,0,0|1,0,2]=4 1329 B20R2.4658 O=C(C#Cc1cccc(c1)O)CCc2ccccc2 1458a_200009909484_100000765856 [0,1,0,0,0,0|1,0,2]=4 1330 B20R2.4658 O=C(C#Cc1ccccc1)CCc2cccc(c2)Br 1458a_100000736102_100011740638 [0,1,0,0,0,0|1,0,2]=4 1331 B20R2.4658 O=C(C#Cc1ccccc1)CCc2cccc(c2)Cl 1458a_100000736102_100011713710 [0,1,0,0,0,0|1,0,2]=4 1332 B20R2.4658 O=C(C#Cc1ccccc1)CCc2cccc(c2)F 1458a_100000736102_100011217235 [0,1,0,0,0,0|1,0,2]=4 1333 B20R2.4658 O=C(C#Cc1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100000736102 [0,1,0,0,0,0|1,0,2]=4 1334 B20R2.4658 O=C(C#Cc1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100000736102 [0,1,0,0,0,0|1,0,2]=4 1335 B20R2.4658 O=C(C#Cc1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100000736102 [0,1,0,0,0,0|1,0,2]=4 1336 B20R2.4658 O=C(C#Cc1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100000736102 [0,1,0,0,0,0|1,0,2]=4 1337 B20R2.4658 O=C(C#Cc1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100000736102 [0,1,0,0,0,0|1,0,2]=4 1338 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2ccccc2 1458a_100016258244_100000765856 [0,1,0,0,0,0|1,0,0]=2 1339 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2ccccc2 6a_100000210085_100000210092 [0,1,0,0,0,0|1,0,0]=2 1340 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2ccccn2 1458a_100016258244_100015183660 [0,1,0,0,0,0|2,0,0]=3 1341 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2cccnc2 1458a_100016258244_200011713674 [0,1,0,0,0,0|2,0,0]=3 1342 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2ccncc2 1458a_100016258244_100000723409 [0,1,0,0,0,0|2,0,0]=3 1343 B20R2.4658 O=C(C=Cc1cccc(c1)Br)COc2ccccc2 6a_100000210085_100000150576 [0,1,0,0,0,0|2,0,0]=3 1344 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CSc2ccccc2 6a_100000210085_100000150717 [0,1,0,0,0,0|2,0,0]=3 1345 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2 11a_100015324214_100016258244 [0,1,0,0,0,0|1,0,0]=2 1346 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2 1626a_100015324214_100016258244 [0,1,0,0,0,0|1,0,0]=2 1347 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2 240690a_100015324214_100016258244 [0,1,0,0,0,0|1,0,0]=2 1348 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccn2 11a_100000210449_100016258244 [0,1,0,0,0,0|2,0,0]=3 1349 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccn2 1626a_100000210449_100016258244 [0,1,0,0,0,0|2,0,0]=3 1350 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccn2 240690a_100000210449_100016258244 [0,1,0,0,0,0|2,0,0]=3 1351 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2 11a_100000210453_100016258244 [0,1,0,0,0,0|2,0,0]=3 1352 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2 240690a_100000210453_100016258244 [0,1,0,0,0,0|2,0,0]=3 1353 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cccnn2 11a_100159270163_100016258244 [0,1,0,0,0,0|3,0,0]=4 1354 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cccnn2 240690a_100159270163_100016258244 [0,1,0,0,0,0|3,0,0]=4 1355 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2 11a_100000210450_100016258244 [0,1,0,0,0,0|2,0,0]=3 1356 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2 1626a_100000210450_100016258244 [0,1,0,0,0,0|2,0,0]=3 1357 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2 240690a_100000210450_100016258244 [0,1,0,0,0,0|2,0,0]=3 1358 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccncn2 11a_100000736019_100016258244 [0,1,0,0,0,0|3,0,0]=4 1359 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccncn2 240690a_100000736019_100016258244 [0,1,0,0,0,0|3,0,0]=4 1360 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cnccn2 11a_100000737960_100016258244 [0,1,0,0,0,0|3,0,0]=4 1361 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cnccn2 240690a_100000737960_100016258244 [0,1,0,0,0,0|3,0,0]=4 1362 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cncnc2 11a_100011243677_100016258244 [0,1,0,0,0,0|3,0,0]=4 1363 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cncnc2 240690a_100011243677_100016258244 [0,1,0,0,0,0|3,0,0]=4 1364 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ncccn2 11a_100015189908_100016258244 [0,1,0,0,0,0|3,0,0]=4 1365 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ncccn2 240690a_100015189908_100016258244 [0,1,0,0,0,0|3,0,0]=4 1366 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NNc2ccccc2 22a_100015195140_100016258244 [0,1,0,0,0,0|2,0,0]=3 1367 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NNc2ccccn2 22a_100000183288_100016258244 [0,1,0,0,0,0|3,0,0]=4 1368 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NNc2cccnc2 22a_100000728903_100016258244 [0,1,0,0,0,0|3,0,0]=4 1369 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NNc2ccncc2 22a_100000698918_100016258244 [0,1,0,0,0,0|3,0,0]=4 1370 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)CCc2ccccc2 1458a_100000184502_100000765856 [0,1,0,0,0,0|1,0,0]=2 1371 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)CCc2ccccn2 1458a_100000184502_100015183660 [0,1,0,0,0,0|2,0,0]=3 1372 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)CCc2cccnc2 1458a_100000184502_200011713674 [0,1,0,0,0,0|2,0,0]=3 1373 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)CCc2ccncc2 1458a_100000184502_100000723409 [0,1,0,0,0,0|2,0,0]=3 1374 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2 11a_100015324214_100000184502 [0,1,0,0,0,0|1,0,0]=2 1375 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2 1626a_100015324214_100000184502 [0,1,0,0,0,0|1,0,0]=2 1376 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2 240690a_100015324214_100000184502 [0,1,0,0,0,0|1,0,0]=2 1377 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccn2 11a_100000210449_100000184502 [0,1,0,0,0,0|2,0,0]=3 1378 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccn2 1626a_100000210449_100000184502 [0,1,0,0,0,0|2,0,0]=3 1379 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccn2 240690a_100000210449_100000184502 [0,1,0,0,0,0|2,0,0]=3 1380 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2 11a_100000210453_100000184502 [0,1,0,0,0,0|2,0,0]=3 1381 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2 240690a_100000210453_100000184502 [0,1,0,0,0,0|2,0,0]=3 1382 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cccnn2 11a_100159270163_100000184502 [0,1,0,0,0,0|3,0,0]=4 1383 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cccnn2 240690a_100159270163_100000184502 [0,1,0,0,0,0|3,0,0]=4 1384 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2 11a_100000210450_100000184502 [0,1,0,0,0,0|2,0,0]=3 1385 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2 1626a_100000210450_100000184502 [0,1,0,0,0,0|2,0,0]=3 1386 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2 240690a_100000210450_100000184502 [0,1,0,0,0,0|2,0,0]=3 1387 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccncn2 11a_100000736019_100000184502 [0,1,0,0,0,0|3,0,0]=4 1388 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccncn2 240690a_100000736019_100000184502 [0,1,0,0,0,0|3,0,0]=4 1389 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cnccn2 11a_100000737960_100000184502 [0,1,0,0,0,0|3,0,0]=4 1390 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cnccn2 240690a_100000737960_100000184502 [0,1,0,0,0,0|3,0,0]=4 1391 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cncnc2 11a_100011243677_100000184502 [0,1,0,0,0,0|3,0,0]=4 1392 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cncnc2 240690a_100011243677_100000184502 [0,1,0,0,0,0|3,0,0]=4 1393 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ncccn2 11a_100015189908_100000184502 [0,1,0,0,0,0|3,0,0]=4 1394 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ncccn2 240690a_100015189908_100000184502 [0,1,0,0,0,0|3,0,0]=4 1395 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NNc2ccccc2 22a_100015195140_100000184502 [0,1,0,0,0,0|2,0,0]=3 1396 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NNc2ccccn2 22a_100000183288_100000184502 [0,1,0,0,0,0|3,0,0]=4 1397 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NNc2cccnc2 22a_100000728903_100000184502 [0,1,0,0,0,0|3,0,0]=4 1398 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NNc2ccncc2 22a_100000698918_100000184502 [0,1,0,0,0,0|3,0,0]=4 1399 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2ccccc2 1458a_100000718793_100000765856 [0,1,0,0,0,0|1,0,0]=2 1400 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2ccccc2 6a_100000210812_100000210092 [0,1,0,0,0,0|1,0,0]=2 1401 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2ccccn2 1458a_100000718793_100015183660 [0,1,0,0,0,0|2,0,0]=3 1402 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2cccnc2 1458a_100000718793_200011713674 [0,1,0,0,0,0|2,0,0]=3 1403 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2ccncc2 1458a_100000718793_100000723409 [0,1,0,0,0,0|2,0,0]=3 1404 B20R2.4658 O=C(C=Cc1cccc(c1)F)COc2ccccc2 6a_100000210812_100000150576 [0,1,0,0,0,0|2,0,0]=3 1405 B20R2.4658 O=C(C=Cc1cccc(c1)F)CSc2ccccc2 6a_100000210812_100000150717 [0,1,0,0,0,0|2,0,0]=3 1406 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccc2 11a_100015324214_100000718793 [0,1,0,0,0,0|1,0,0]=2 1407 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccc2 1626a_100015324214_100000718793 [0,1,0,0,0,0|1,0,0]=2 1408 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccc2 240690a_100015324214_100000718793 [0,1,0,0,0,0|1,0,0]=2 1409 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccn2 11a_100000210449_100000718793 [0,1,0,0,0,0|2,0,0]=3 1410 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccn2 1626a_100000210449_100000718793 [0,1,0,0,0,0|2,0,0]=3 1411 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccn2 240690a_100000210449_100000718793 [0,1,0,0,0,0|2,0,0]=3 1412 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cccnc2 11a_100000210453_100000718793 [0,1,0,0,0,0|2,0,0]=3 1413 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cccnc2 240690a_100000210453_100000718793 [0,1,0,0,0,0|2,0,0]=3 1414 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cccnn2 11a_100159270163_100000718793 [0,1,0,0,0,0|3,0,0]=4 1415 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cccnn2 240690a_100159270163_100000718793 [0,1,0,0,0,0|3,0,0]=4 1416 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccncc2 11a_100000210450_100000718793 [0,1,0,0,0,0|2,0,0]=3 1417 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccncc2 1626a_100000210450_100000718793 [0,1,0,0,0,0|2,0,0]=3 1418 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccncc2 240690a_100000210450_100000718793 [0,1,0,0,0,0|2,0,0]=3 1419 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccncn2 11a_100000736019_100000718793 [0,1,0,0,0,0|3,0,0]=4 1420 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccncn2 240690a_100000736019_100000718793 [0,1,0,0,0,0|3,0,0]=4 1421 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cnccn2 11a_100000737960_100000718793 [0,1,0,0,0,0|3,0,0]=4 1422 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cnccn2 240690a_100000737960_100000718793 [0,1,0,0,0,0|3,0,0]=4 1423 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cncnc2 11a_100011243677_100000718793 [0,1,0,0,0,0|3,0,0]=4 1424 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cncnc2 240690a_100011243677_100000718793 [0,1,0,0,0,0|3,0,0]=4 1425 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ncccn2 11a_100015189908_100000718793 [0,1,0,0,0,0|3,0,0]=4 1426 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ncccn2 240690a_100015189908_100000718793 [0,1,0,0,0,0|3,0,0]=4 1427 B20R2.4658 O=C(C=Cc1cccc(c1)F)NNc2ccccc2 22a_100015195140_100000718793 [0,1,0,0,0,0|2,0,0]=3 1428 B20R2.4658 O=C(C=Cc1cccc(c1)F)NNc2ccccn2 22a_100000183288_100000718793 [0,1,0,0,0,0|3,0,0]=4 1429 B20R2.4658 O=C(C=Cc1cccc(c1)F)NNc2cccnc2 22a_100000728903_100000718793 [0,1,0,0,0,0|3,0,0]=4 1430 B20R2.4658 O=C(C=Cc1cccc(c1)F)NNc2ccncc2 22a_100000698918_100000718793 [0,1,0,0,0,0|3,0,0]=4 1431 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2ccccc2 1458a_100020647043_100000765856 [0,1,0,0,0,0|1,0,0]=2 1432 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2ccccc2 6a_100000014684_100000210092 [0,1,0,0,0,0|1,0,0]=2 1433 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2ccccn2 1458a_100020647043_100015183660 [0,1,0,0,0,0|2,0,0]=3 1434 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2cccnc2 1458a_100020647043_200011713674 [0,1,0,0,0,0|2,0,0]=3 1435 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2ccncc2 1458a_100020647043_100000723409 [0,1,0,0,0,0|2,0,0]=3 1436 B20R2.4658 O=C(C=Cc1cccc(c1)I)COc2ccccc2 6a_100000014684_100000150576 [0,1,0,0,0,0|2,0,0]=3 1437 B20R2.4658 O=C(C=Cc1cccc(c1)I)CSc2ccccc2 6a_100000014684_100000150717 [0,1,0,0,0,0|2,0,0]=3 1438 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccc2 11a_100015324214_100020647043 [0,1,0,0,0,0|1,0,0]=2 1439 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccc2 1626a_100015324214_100020647043 [0,1,0,0,0,0|1,0,0]=2 1440 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccc2 240690a_100015324214_100020647043 [0,1,0,0,0,0|1,0,0]=2 1441 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccn2 11a_100000210449_100020647043 [0,1,0,0,0,0|2,0,0]=3 1442 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccn2 1626a_100000210449_100020647043 [0,1,0,0,0,0|2,0,0]=3 1443 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccn2 240690a_100000210449_100020647043 [0,1,0,0,0,0|2,0,0]=3 1444 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cccnc2 11a_100000210453_100020647043 [0,1,0,0,0,0|2,0,0]=3 1445 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cccnc2 240690a_100000210453_100020647043 [0,1,0,0,0,0|2,0,0]=3 1446 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cccnn2 11a_100159270163_100020647043 [0,1,0,0,0,0|3,0,0]=4 1447 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cccnn2 240690a_100159270163_100020647043 [0,1,0,0,0,0|3,0,0]=4 1448 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccncc2 11a_100000210450_100020647043 [0,1,0,0,0,0|2,0,0]=3 1449 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccncc2 1626a_100000210450_100020647043 [0,1,0,0,0,0|2,0,0]=3 1450 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccncc2 240690a_100000210450_100020647043 [0,1,0,0,0,0|2,0,0]=3 1451 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccncn2 11a_100000736019_100020647043 [0,1,0,0,0,0|3,0,0]=4 1452 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccncn2 240690a_100000736019_100020647043 [0,1,0,0,0,0|3,0,0]=4 1453 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cnccn2 11a_100000737960_100020647043 [0,1,0,0,0,0|3,0,0]=4 1454 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cnccn2 240690a_100000737960_100020647043 [0,1,0,0,0,0|3,0,0]=4 1455 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cncnc2 11a_100011243677_100020647043 [0,1,0,0,0,0|3,0,0]=4 1456 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cncnc2 240690a_100011243677_100020647043 [0,1,0,0,0,0|3,0,0]=4 1457 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ncccn2 11a_100015189908_100020647043 [0,1,0,0,0,0|3,0,0]=4 1458 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ncccn2 240690a_100015189908_100020647043 [0,1,0,0,0,0|3,0,0]=4 1459 B20R2.4658 O=C(C=Cc1cccc(c1)I)NNc2ccccc2 22a_100015195140_100020647043 [0,1,0,0,0,0|2,0,0]=3 1460 B20R2.4658 O=C(C=Cc1cccc(c1)I)NNc2ccccn2 22a_100000183288_100020647043 [0,1,0,0,0,0|3,0,0]=4 1461 B20R2.4658 O=C(C=Cc1cccc(c1)I)NNc2cccnc2 22a_100000728903_100020647043 [0,1,0,0,0,0|3,0,0]=4 1462 B20R2.4658 O=C(C=Cc1cccc(c1)I)NNc2ccncc2 22a_100000698918_100020647043 [0,1,0,0,0,0|3,0,0]=4 1463 B20R2.4658 O=C(C=Cc1cccc(c1)O)NNc2ccccc2 22a_100015195140_100102525460 [0,1,0,0,0,0|2,0,0]=3 1464 B20R2.4658 O=C(C=Cc1cccc(c1)O)NNc2ccccn2 22a_100000183288_100102525460 [0,1,0,0,0,0|3,0,0]=4 1465 B20R2.4658 O=C(C=Cc1cccc(c1)O)NNc2cccnc2 22a_100000728903_100102525460 [0,1,0,0,0,0|3,0,0]=4 1466 B20R2.4658 O=C(C=Cc1cccc(c1)O)NNc2ccncc2 22a_100000698918_100102525460 [0,1,0,0,0,0|3,0,0]=4 1467 B20R2.4658 O=C(C=Cc1ccccc1)CCc2cccc(c2)Br 1458a_100000210462_100011740638 [0,1,0,0,0,0|1,0,0]=2 1468 B20R2.4658 O=C(C=Cc1ccccc1)CCc2cccc(c2)Cl 1458a_100000210462_100011713710 [0,1,0,0,0,0|1,0,0]=2 1469 B20R2.4658 O=C(C=Cc1ccccc1)CCc2cccc(c2)F 1458a_100000210462_100011217235 [0,1,0,0,0,0|1,0,0]=2 1470 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cc(ccn2)Br 11a_100009818019_100000210462 [0,1,0,0,0,0|2,0,0]=3 1471 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cc(ccn2)Br 1626a_100009818019_100000210462 [0,1,0,0,0,0|2,0,0]=3 1472 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cc(ccn2)Cl 11a_100000085674_100000210462 [0,1,0,0,0,0|2,0,0]=3 1473 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cc(ccn2)Cl 1626a_100000085674_100000210462 [0,1,0,0,0,0|2,0,0]=3 1474 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(=O)[nH]2 11a_100000696482_100000210462 [0,1,0,0,0,0|2,0,0]=3 1475 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(=O)[nH]2 1626a_100000696482_100000210462 [0,1,0,0,0,0|2,0,0]=3 1476 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100000210462 [0,1,0,0,0,0|1,0,0]=2 1477 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100000210462 [0,1,0,0,0,0|1,0,0]=2 1478 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100000210462 [0,1,0,0,0,0|1,0,0]=2 1479 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100000210462 [0,1,0,0,0,0|1,0,0]=2 1480 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100000210462 [0,1,0,0,0,0|1,0,0]=2 1481 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100000210462 [0,1,0,0,0,0|1,0,0]=2 1482 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100000210462 [0,1,0,0,0,0|1,0,0]=2 1483 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100000210462 [0,1,0,0,0,0|1,0,0]=2 1484 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)Br 11a_100016987751_100000210462 [0,1,0,0,0,0|2,0,0]=3 1485 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)Br 1626a_100016987751_100000210462 [0,1,0,0,0,0|2,0,0]=3 1486 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)Cl 11a_100016990191_100000210462 [0,1,0,0,0,0|2,0,0]=3 1487 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)Cl 1626a_100016990191_100000210462 [0,1,0,0,0,0|2,0,0]=3 1488 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)F 11a_100015188798_100000210462 [0,1,0,0,0,0|2,0,0]=3 1489 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)F 1626a_100015188798_100000210462 [0,1,0,0,0,0|2,0,0]=3 1490 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)Br 11a_100025757509_100000210462 [0,1,0,0,0,0|2,0,0]=3 1491 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)Cl 11a_100015205668_100000210462 [0,1,0,0,0,0|2,0,0]=3 1492 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)Cl 1626a_100015205668_100000210462 [0,1,0,0,0,0|2,0,0]=3 1493 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)F 11a_100015188774_100000210462 [0,1,0,0,0,0|2,0,0]=3 1494 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)F 1626a_100015188774_100000210462 [0,1,0,0,0,0|2,0,0]=3 1495 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)O 11a_100000748557_100000210462 [0,1,0,0,0,0|2,0,0]=3 1496 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)Br 11a_100011249555_100000210462 [0,1,0,0,0,0|2,0,0]=3 1497 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)Cl 11a_200020614424_100000210462 [0,1,0,0,0,0|2,0,0]=3 1498 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)Cl 1626a_200020614424_100000210462 [0,1,0,0,0,0|2,0,0]=3 1499 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)F 11a_100011962886_100000210462 [0,1,0,0,0,0|2,0,0]=3 1500 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)F 1626a_100011962886_100000210462 [0,1,0,0,0,0|2,0,0]=3 1501 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cc(ccn2)Br 22a_100000764631_100000210462 [0,1,0,0,0,0|3,0,0]=4 1502 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cc(ccn2)Cl 22a_100102524961_100000210462 [0,1,0,0,0,0|3,0,0]=4 1503 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cc(ccn2)I 22a_100010221011_100000210462 [0,1,0,0,0,0|3,0,0]=4 1504 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cc[nH]c(=O)c2 22a_100000120847_100000210462 [0,1,0,0,0,0|3,0,0]=4 1505 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(c2)Br 22a_100000217339_100000210462 [0,1,0,0,0,0|2,0,0]=3 1506 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(c2)Cl 22a_100000184277_100000210462 [0,1,0,0,0,0|2,0,0]=3 1507 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(c2)F 22a_100000745080_100000210462 [0,1,0,0,0,0|2,0,0]=3 1508 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(c2)I 22a_100020605690_100000210462 [0,1,0,0,0,0|2,0,0]=3 1509 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(n2)Br 22a_100009817029_100000210462 [0,1,0,0,0,0|3,0,0]=4 1510 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(n2)Cl 22a_100102524919_100000210462 [0,1,0,0,0,0|3,0,0]=4 1511 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(n2)F 22a_100000075452_100000210462 [0,1,0,0,0,0|3,0,0]=4 1512 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cncc(c2)Br 22a_100000727789_100000210462 [0,1,0,0,0,0|3,0,0]=4 1513 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cncc(c2)F 22a_200011955905_100000210462 [0,1,0,0,0,0|3,0,0]=4 1514 B20R2.4658 O=C(C=Cc1ccccn1)CCc2cccc(c2)Br 1458a_100000740811_100011740638 [0,1,0,0,0,0|2,0,0]=3 1515 B20R2.4658 O=C(C=Cc1ccccn1)CCc2cccc(c2)Cl 1458a_100000740811_100011713710 [0,1,0,0,0,0|2,0,0]=3 1516 B20R2.4658 O=C(C=Cc1ccccn1)CCc2cccc(c2)F 1458a_100000740811_100011217235 [0,1,0,0,0,0|2,0,0]=3 1517 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cc(ccn2)Br 11a_100009818019_100000740811 [0,1,0,0,0,0|3,0,0]=4 1518 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cc(ccn2)Br 240690a_100009818019_100000740811 [0,1,0,0,0,0|3,0,0]=4 1519 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cc(ccn2)Cl 11a_100000085674_100000740811 [0,1,0,0,0,0|3,0,0]=4 1520 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cc(ccn2)Cl 240690a_100000085674_100000740811 [0,1,0,0,0,0|3,0,0]=4 1521 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(=O)[nH]2 11a_100000696482_100000740811 [0,1,0,0,0,0|3,0,0]=4 1522 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(=O)[nH]2 240690a_100000696482_100000740811 [0,1,0,0,0,0|3,0,0]=4 1523 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)Br 11a_100000174977_100000740811 [0,1,0,0,0,0|2,0,0]=3 1524 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)Br 240690a_100000174977_100000740811 [0,1,0,0,0,0|2,0,0]=3 1525 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)Cl 11a_100000174878_100000740811 [0,1,0,0,0,0|2,0,0]=3 1526 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)Cl 240690a_100000174878_100000740811 [0,1,0,0,0,0|2,0,0]=3 1527 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)F 11a_100000174948_100000740811 [0,1,0,0,0,0|2,0,0]=3 1528 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)F 240690a_100000174948_100000740811 [0,1,0,0,0,0|2,0,0]=3 1529 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)I 11a_100000106179_100000740811 [0,1,0,0,0,0|2,0,0]=3 1530 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)I 240690a_100000106179_100000740811 [0,1,0,0,0,0|2,0,0]=3 1531 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)O 240690a_100000743036_100000740811 [0,1,0,0,0,0|2,0,0]=3 1532 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(n2)Br 11a_100016987751_100000740811 [0,1,0,0,0,0|3,0,0]=4 1533 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(n2)Br 240690a_100016987751_100000740811 [0,1,0,0,0,0|3,0,0]=4 1534 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(n2)Cl 11a_100016990191_100000740811 [0,1,0,0,0,0|3,0,0]=4 1535 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(n2)Cl 240690a_100016990191_100000740811 [0,1,0,0,0,0|3,0,0]=4 1536 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(n2)F 11a_100015188798_100000740811 [0,1,0,0,0,0|3,0,0]=4 1537 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(n2)F 240690a_100015188798_100000740811 [0,1,0,0,0,0|3,0,0]=4 1538 B20R2.4658 O=C(C=Cc1ccccn1)NCc2ccnc(c2)Br 11a_100025757509_100000740811 [0,1,0,0,0,0|3,0,0]=4 1539 B20R2.4658 O=C(C=Cc1ccccn1)NCc2ccnc(c2)Br 240690a_100025757509_100000740811 [0,1,0,0,0,0|3,0,0]=4 1540 B20R2.4658 O=C(C=Cc1ccccn1)NCc2ccnc(c2)Cl 11a_100015205668_100000740811 [0,1,0,0,0,0|3,0,0]=4 1541 B20R2.4658 O=C(C=Cc1ccccn1)NCc2ccnc(c2)Cl 240690a_100015205668_100000740811 [0,1,0,0,0,0|3,0,0]=4 1542 B20R2.4658 O=C(C=Cc1ccccn1)NCc2ccnc(c2)F 11a_100015188774_100000740811 [0,1,0,0,0,0|3,0,0]=4 1543 B20R2.4658 O=C(C=Cc1ccccn1)NCc2ccnc(c2)F 240690a_100015188774_100000740811 [0,1,0,0,0,0|3,0,0]=4 1544 B20R2.4658 O=C(C=Cc1ccccn1)NCc2ccnc(c2)O 11a_100000748557_100000740811 [0,1,0,0,0,0|3,0,0]=4 1545 B20R2.4658 O=C(C=Cc1ccccn1)NCc2ccnc(c2)O 240690a_100000748557_100000740811 [0,1,0,0,0,0|3,0,0]=4 1546 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cncc(c2)Br 11a_100011249555_100000740811 [0,1,0,0,0,0|3,0,0]=4 1547 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cncc(c2)Br 240690a_100011249555_100000740811 [0,1,0,0,0,0|3,0,0]=4 1548 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cncc(c2)Cl 11a_200020614424_100000740811 [0,1,0,0,0,0|3,0,0]=4 1549 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cncc(c2)Cl 240690a_200020614424_100000740811 [0,1,0,0,0,0|3,0,0]=4 1550 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cncc(c2)F 11a_100011962886_100000740811 [0,1,0,0,0,0|3,0,0]=4 1551 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cncc(c2)F 240690a_100011962886_100000740811 [0,1,0,0,0,0|3,0,0]=4 1552 B20R2.4658 O=C(C=Cc1ccccn1)NNc2cccc(c2)Br 22a_100000217339_100000740811 [0,1,0,0,0,0|3,0,0]=4 1553 B20R2.4658 O=C(C=Cc1ccccn1)NNc2cccc(c2)Cl 22a_100000184277_100000740811 [0,1,0,0,0,0|3,0,0]=4 1554 B20R2.4658 O=C(C=Cc1ccccn1)NNc2cccc(c2)F 22a_100000745080_100000740811 [0,1,0,0,0,0|3,0,0]=4 1555 B20R2.4658 O=C(C=Cc1ccccn1)NNc2cccc(c2)I 22a_100020605690_100000740811 [0,1,0,0,0,0|3,0,0]=4 1556 B20R2.4658 O=C(C=Cc1cccnc1)CCc2cccc(c2)Br 1458a_100000735890_100011740638 [0,1,0,0,0,0|2,0,0]=3 1557 B20R2.4658 O=C(C=Cc1cccnc1)CCc2cccc(c2)Cl 1458a_100000735890_100011713710 [0,1,0,0,0,0|2,0,0]=3 1558 B20R2.4658 O=C(C=Cc1cccnc1)CCc2cccc(c2)F 1458a_100000735890_100011217235 [0,1,0,0,0,0|2,0,0]=3 1559 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cc(ccn2)Br 11a_100009818019_100000735890 [0,1,0,0,0,0|3,0,0]=4 1560 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cc(ccn2)Br 240690a_100009818019_100000735890 [0,1,0,0,0,0|3,0,0]=4 1561 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cc(ccn2)Cl 11a_100000085674_100000735890 [0,1,0,0,0,0|3,0,0]=4 1562 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cc(ccn2)Cl 240690a_100000085674_100000735890 [0,1,0,0,0,0|3,0,0]=4 1563 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(=O)[nH]2 11a_100000696482_100000735890 [0,1,0,0,0,0|3,0,0]=4 1564 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(=O)[nH]2 240690a_100000696482_100000735890 [0,1,0,0,0,0|3,0,0]=4 1565 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Br 11a_100000174977_100000735890 [0,1,0,0,0,0|2,0,0]=3 1566 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Br 240690a_100000174977_100000735890 [0,1,0,0,0,0|2,0,0]=3 1567 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Cl 11a_100000174878_100000735890 [0,1,0,0,0,0|2,0,0]=3 1568 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Cl 240690a_100000174878_100000735890 [0,1,0,0,0,0|2,0,0]=3 1569 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)F 11a_100000174948_100000735890 [0,1,0,0,0,0|2,0,0]=3 1570 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)F 240690a_100000174948_100000735890 [0,1,0,0,0,0|2,0,0]=3 1571 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)I 11a_100000106179_100000735890 [0,1,0,0,0,0|2,0,0]=3 1572 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)I 240690a_100000106179_100000735890 [0,1,0,0,0,0|2,0,0]=3 1573 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)O 240690a_100000743036_100000735890 [0,1,0,0,0,0|2,0,0]=3 1574 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(n2)Br 11a_100016987751_100000735890 [0,1,0,0,0,0|3,0,0]=4 1575 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(n2)Br 240690a_100016987751_100000735890 [0,1,0,0,0,0|3,0,0]=4 1576 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(n2)Cl 11a_100016990191_100000735890 [0,1,0,0,0,0|3,0,0]=4 1577 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(n2)Cl 240690a_100016990191_100000735890 [0,1,0,0,0,0|3,0,0]=4 1578 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(n2)F 11a_100015188798_100000735890 [0,1,0,0,0,0|3,0,0]=4 1579 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(n2)F 240690a_100015188798_100000735890 [0,1,0,0,0,0|3,0,0]=4 1580 B20R2.4658 O=C(C=Cc1cccnc1)NCc2ccnc(c2)Br 11a_100025757509_100000735890 [0,1,0,0,0,0|3,0,0]=4 1581 B20R2.4658 O=C(C=Cc1cccnc1)NCc2ccnc(c2)Br 240690a_100025757509_100000735890 [0,1,0,0,0,0|3,0,0]=4 1582 B20R2.4658 O=C(C=Cc1cccnc1)NCc2ccnc(c2)Cl 11a_100015205668_100000735890 [0,1,0,0,0,0|3,0,0]=4 1583 B20R2.4658 O=C(C=Cc1cccnc1)NCc2ccnc(c2)Cl 240690a_100015205668_100000735890 [0,1,0,0,0,0|3,0,0]=4 1584 B20R2.4658 O=C(C=Cc1cccnc1)NCc2ccnc(c2)F 11a_100015188774_100000735890 [0,1,0,0,0,0|3,0,0]=4 1585 B20R2.4658 O=C(C=Cc1cccnc1)NCc2ccnc(c2)F 240690a_100015188774_100000735890 [0,1,0,0,0,0|3,0,0]=4 1586 B20R2.4658 O=C(C=Cc1cccnc1)NCc2ccnc(c2)O 11a_100000748557_100000735890 [0,1,0,0,0,0|3,0,0]=4 1587 B20R2.4658 O=C(C=Cc1cccnc1)NCc2ccnc(c2)O 240690a_100000748557_100000735890 [0,1,0,0,0,0|3,0,0]=4 1588 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cncc(c2)Br 11a_100011249555_100000735890 [0,1,0,0,0,0|3,0,0]=4 1589 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cncc(c2)Br 240690a_100011249555_100000735890 [0,1,0,0,0,0|3,0,0]=4 1590 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cncc(c2)Cl 11a_200020614424_100000735890 [0,1,0,0,0,0|3,0,0]=4 1591 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cncc(c2)Cl 240690a_200020614424_100000735890 [0,1,0,0,0,0|3,0,0]=4 1592 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cncc(c2)F 11a_100011962886_100000735890 [0,1,0,0,0,0|3,0,0]=4 1593 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cncc(c2)F 240690a_100011962886_100000735890 [0,1,0,0,0,0|3,0,0]=4 1594 B20R2.4658 O=C(C=Cc1cccnc1)NNc2cccc(c2)Br 22a_100000217339_100000735890 [0,1,0,0,0,0|3,0,0]=4 1595 B20R2.4658 O=C(C=Cc1cccnc1)NNc2cccc(c2)Cl 22a_100000184277_100000735890 [0,1,0,0,0,0|3,0,0]=4 1596 B20R2.4658 O=C(C=Cc1cccnc1)NNc2cccc(c2)F 22a_100000745080_100000735890 [0,1,0,0,0,0|3,0,0]=4 1597 B20R2.4658 O=C(C=Cc1cccnc1)NNc2cccc(c2)I 22a_100020605690_100000735890 [0,1,0,0,0,0|3,0,0]=4 1598 B20R2.4658 O=C(C=Cc1ccncc1)CCc2cccc(c2)Br 1458a_100000682801_100011740638 [0,1,0,0,0,0|2,0,0]=3 1599 B20R2.4658 O=C(C=Cc1ccncc1)CCc2cccc(c2)Cl 1458a_100000682801_100011713710 [0,1,0,0,0,0|2,0,0]=3 1600 B20R2.4658 O=C(C=Cc1ccncc1)CCc2cccc(c2)F 1458a_100000682801_100011217235 [0,1,0,0,0,0|2,0,0]=3 1601 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cc(ccn2)Br 240690a_100009818019_100000682801 [0,1,0,0,0,0|3,0,0]=4 1602 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cc(ccn2)Cl 240690a_100000085674_100000682801 [0,1,0,0,0,0|3,0,0]=4 1603 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(=O)[nH]2 240690a_100000696482_100000682801 [0,1,0,0,0,0|3,0,0]=4 1604 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)Br 240690a_100000174977_100000682801 [0,1,0,0,0,0|2,0,0]=3 1605 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)Cl 240690a_100000174878_100000682801 [0,1,0,0,0,0|2,0,0]=3 1606 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)F 240690a_100000174948_100000682801 [0,1,0,0,0,0|2,0,0]=3 1607 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)I 240690a_100000106179_100000682801 [0,1,0,0,0,0|2,0,0]=3 1608 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)O 240690a_100000743036_100000682801 [0,1,0,0,0,0|2,0,0]=3 1609 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(n2)Br 240690a_100016987751_100000682801 [0,1,0,0,0,0|3,0,0]=4 1610 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(n2)Cl 240690a_100016990191_100000682801 [0,1,0,0,0,0|3,0,0]=4 1611 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(n2)F 240690a_100015188798_100000682801 [0,1,0,0,0,0|3,0,0]=4 1612 B20R2.4658 O=C(C=Cc1ccncc1)NCc2ccnc(c2)Br 240690a_100025757509_100000682801 [0,1,0,0,0,0|3,0,0]=4 1613 B20R2.4658 O=C(C=Cc1ccncc1)NCc2ccnc(c2)Cl 240690a_100015205668_100000682801 [0,1,0,0,0,0|3,0,0]=4 1614 B20R2.4658 O=C(C=Cc1ccncc1)NCc2ccnc(c2)F 240690a_100015188774_100000682801 [0,1,0,0,0,0|3,0,0]=4 1615 B20R2.4658 O=C(C=Cc1ccncc1)NCc2ccnc(c2)O 240690a_100000748557_100000682801 [0,1,0,0,0,0|3,0,0]=4 1616 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cncc(c2)Br 240690a_100011249555_100000682801 [0,1,0,0,0,0|3,0,0]=4 1617 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cncc(c2)Cl 240690a_200020614424_100000682801 [0,1,0,0,0,0|3,0,0]=4 1618 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cncc(c2)F 240690a_100011962886_100000682801 [0,1,0,0,0,0|3,0,0]=4 1619 B20R2.4658 O=C(C=Cc1ccncc1)NNc2cccc(c2)Br 22a_100000217339_100000682801 [0,1,0,0,0,0|3,0,0]=4 1620 B20R2.4658 O=C(C=Cc1ccncc1)NNc2cccc(c2)Cl 22a_100000184277_100000682801 [0,1,0,0,0,0|3,0,0]=4 1621 B20R2.4658 O=C(C=Cc1ccncc1)NNc2cccc(c2)F 22a_100000745080_100000682801 [0,1,0,0,0,0|3,0,0]=4 1622 B20R2.4658 O=C(C=Cc1ccncc1)NNc2cccc(c2)I 22a_100020605690_100000682801 [0,1,0,0,0,0|3,0,0]=4 1623 B20R2.4658 O=C(C=Cc1cncc(c1)Br)CCc2ccccc2 6a_100000687066_100000210092 [0,1,0,0,0,0|2,0,0]=3 1624 B20R2.4658 O=C(C=Cc1cncc(c1)Br)COc2ccccc2 6a_100000687066_100000150576 [0,1,0,0,0,0|3,0,0]=4 1625 B20R2.4658 O=C(C=Cc1cncc(c1)Br)CSc2ccccc2 6a_100000687066_100000150717 [0,1,0,0,0,0|3,0,0]=4 1626 B20R2.4658 O=C(C=Cc1cncc(c1)Cl)CCc2ccccc2 6a_100000088910_100000210092 [0,1,0,0,0,0|2,0,0]=3 1627 B20R2.4658 O=C(C=Cc1cncc(c1)Cl)COc2ccccc2 6a_100000088910_100000150576 [0,1,0,0,0,0|3,0,0]=4 1628 B20R2.4658 O=C(C=Cc1cncc(c1)Cl)CSc2ccccc2 6a_100000088910_100000150717 [0,1,0,0,0,0|3,0,0]=4 1629 B20R2.4658 O=C(C=Cc1cncc(c1)F)CCc2ccccc2 6a_100011361476_100000210092 [0,1,0,0,0,0|2,0,0]=3 1630 B20R2.4658 O=C(C=Cc1cncc(c1)F)COc2ccccc2 6a_100011361476_100000150576 [0,1,0,0,0,0|3,0,0]=4 1631 B20R2.4658 O=C(C=Cc1cncc(c1)F)CSc2ccccc2 6a_100011361476_100000150717 [0,1,0,0,0,0|3,0,0]=4 1632 B20R2.4658 O=C(C=Cc1cncnc1)CCc2cccc(c2)Br 6a_100000749868_100011279149 [0,1,0,0,0,0|3,0,0]=4 1633 B20R2.4658 O=C(C=Cc1cncnc1)CCc2cccc(c2)F 6a_100000749868_100000743863 [0,1,0,0,0,0|3,0,0]=4 1634 B20R2.4658 O=C(CCc1cccc(c1)Br)COc2ccccc2 1458a_100000186222_100011740638 [0,1,0,0,0,0|2,0,1]=4 1635 B20R2.4658 O=C(CCc1cccc(c1)Br)CSc2ccccc2 1458a_100000211596_100011740638 [0,1,0,0,0,0|2,0,1]=4 1636 B20R2.4658 O=C(CCc1cccc(c1)Br)NCc2ccccc2 11a_100015324214_100000184314 [0,1,0,0,0,0|1,0,2]=4 1637 B20R2.4658 O=C(CCc1cccc(c1)Br)NCc2ccccc2 1626a_100015324214_100000184314 [0,1,0,0,0,0|1,0,2]=4 1638 B20R2.4658 O=C(CCc1cccc(c1)Br)NCc2ccccc2 240690a_100015324214_100000184314 [0,1,0,0,0,0|1,0,2]=4 1639 B20R2.4658 O=C(CCc1cccc(c1)Br)NCc2ccccc2 527a_100015324214_100000184314 [0,1,0,0,0,0|1,0,2]=4 1640 B20R2.4658 O=C(CCc1cccc(c1)Br)NNc2ccccc2 22a_100015195140_100000184314 [0,1,0,0,0,0|3,0,0]=4 1641 B20R2.4658 O=C(CCc1cccc(c1)Cl)COc2ccccc2 1458a_100000186222_100011713710 [0,1,0,0,0,0|2,0,1]=4 1642 B20R2.4658 O=C(CCc1cccc(c1)Cl)CSc2ccccc2 1458a_100000211596_100011713710 [0,1,0,0,0,0|2,0,1]=4 1643 B20R2.4658 O=C(CCc1cccc(c1)Cl)NCc2ccccc2 11a_100015324214_100000235675 [0,1,0,0,0,0|1,0,2]=4 1644 B20R2.4658 O=C(CCc1cccc(c1)Cl)NCc2ccccc2 1626a_100015324214_100000235675 [0,1,0,0,0,0|1,0,2]=4 1645 B20R2.4658 O=C(CCc1cccc(c1)Cl)NCc2ccccc2 240690a_100015324214_100000235675 [0,1,0,0,0,0|1,0,2]=4 1646 B20R2.4658 O=C(CCc1cccc(c1)Cl)NCc2ccccc2 527a_100015324214_100000235675 [0,1,0,0,0,0|1,0,2]=4 1647 B20R2.4658 O=C(CCc1cccc(c1)Cl)NNc2ccccc2 22a_100015195140_100000235675 [0,1,0,0,0,0|3,0,0]=4 1648 B20R2.4658 O=C(CCc1cccc(c1)F)COc2ccccc2 1458a_100000186222_100011217235 [0,1,0,0,0,0|2,0,1]=4 1649 B20R2.4658 O=C(CCc1cccc(c1)F)CSc2ccccc2 1458a_100000211596_100011217235 [0,1,0,0,0,0|2,0,1]=4 1650 B20R2.4658 O=C(CCc1cccc(c1)F)NCc2ccccc2 11a_100015324214_100000235673 [0,1,0,0,0,0|1,0,2]=4 1651 B20R2.4658 O=C(CCc1cccc(c1)F)NCc2ccccc2 1626a_100015324214_100000235673 [0,1,0,0,0,0|1,0,2]=4 1652 B20R2.4658 O=C(CCc1cccc(c1)F)NCc2ccccc2 240690a_100015324214_100000235673 [0,1,0,0,0,0|1,0,2]=4 1653 B20R2.4658 O=C(CCc1cccc(c1)F)NCc2ccccc2 527a_100015324214_100000235673 [0,1,0,0,0,0|1,0,2]=4 1654 B20R2.4658 O=C(CCc1cccc(c1)F)NNc2ccccc2 22a_100015195140_100000235673 [0,1,0,0,0,0|3,0,0]=4 1655 B20R2.4658 O=C(CCc1cccc(c1)I)NCc2ccccc2 11a_100015324214_100010007846 [0,1,0,0,0,0|1,0,2]=4 1656 B20R2.4658 O=C(CCc1cccc(c1)I)NCc2ccccc2 1626a_100015324214_100010007846 [0,1,0,0,0,0|1,0,2]=4 1657 B20R2.4658 O=C(CCc1cccc(c1)I)NCc2ccccc2 240690a_100015324214_100010007846 [0,1,0,0,0,0|1,0,2]=4 1658 B20R2.4658 O=C(CCc1cccc(c1)I)NCc2ccccc2 527a_100015324214_100010007846 [0,1,0,0,0,0|1,0,2]=4 1659 B20R2.4658 O=C(CCc1cccc(c1)I)NNc2ccccc2 22a_100015195140_100010007846 [0,1,0,0,0,0|3,0,0]=4 1660 B20R2.4658 O=C(CCc1cccc(c1)O)NCc2ccccc2 240690a_100015324214_100011216126 [0,1,0,0,0,0|1,0,2]=4 1661 B20R2.4658 O=C(CCc1cccc(c1)O)NCc2ccccc2 527a_100015324214_100011216126 [0,1,0,0,0,0|1,0,2]=4 1662 B20R2.4658 O=C(CCc1cccc(c1)O)NNc2ccccc2 22a_100015195140_100011216126 [0,1,0,0,0,0|3,0,0]=4 1663 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)Br 1458a_100000184314_100000765856 [0,1,0,0,0,0|1,0,2]=4 1664 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)Br 1458a_100000185753_100011740638 [0,1,0,0,0,0|1,0,2]=4 1665 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)Cl 1458a_100000185753_100011713710 [0,1,0,0,0,0|1,0,2]=4 1666 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)Cl 1458a_100000235675_100000765856 [0,1,0,0,0,0|1,0,2]=4 1667 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)F 1458a_100000185753_100011217235 [0,1,0,0,0,0|1,0,2]=4 1668 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)F 1458a_100000235673_100000765856 [0,1,0,0,0,0|1,0,2]=4 1669 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)I 1458a_100010007846_100000765856 [0,1,0,0,0,0|1,0,2]=4 1670 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)O 1458a_100011216126_100000765856 [0,1,0,0,0,0|1,0,2]=4 1671 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)Br 34a_100000210019_100012361361 [0,1,0,0,0,0|2,0,1]=4 1672 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)Cl 34a_100000185859_100012361361 [0,1,0,0,0,0|2,0,1]=4 1673 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)F 34a_100000210047_100012361361 [0,1,0,0,0,0|2,0,1]=4 1674 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)I 34a_100000211102_100012361361 [0,1,0,0,0,0|2,0,1]=4 1675 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)O 34a_100000210217_100012361361 [0,1,0,0,0,0|2,0,1]=4 1676 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Br 1458a_100000182359_100000765856 [0,1,0,0,0,0|2,0,1]=4 1677 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Br 34a_100000210342_100012361361 [0,1,0,0,0,0|2,0,1]=4 1678 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Br 7a_100000210342_100012361361 [0,1,0,0,0,0|2,0,1]=4 1679 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Cl 1458a_100000184978_100000765856 [0,1,0,0,0,0|2,0,1]=4 1680 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Cl 34a_100000210295_100012361361 [0,1,0,0,0,0|2,0,1]=4 1681 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Cl 7a_100000210295_100012361361 [0,1,0,0,0,0|2,0,1]=4 1682 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)F 1458a_100000182781_100000765856 [0,1,0,0,0,0|2,0,1]=4 1683 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)F 34a_100000210426_100012361361 [0,1,0,0,0,0|2,0,1]=4 1684 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)F 7a_100000210426_100012361361 [0,1,0,0,0,0|2,0,1]=4 1685 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)I 34a_100000211634_100012361361 [0,1,0,0,0,0|2,0,1]=4 1686 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)I 7a_100000211634_100012361361 [0,1,0,0,0,0|2,0,1]=4 1687 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Br 1458a_100000760868_100000765856 [0,1,0,0,0,0|2,0,1]=4 1688 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Br 62a_100000691529_100012361361 [0,1,0,0,0,0|2,0,1]=4 1689 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Br 62a_100012361361_100000691529 [0,1,0,0,0,0|2,0,1]=4 1690 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Cl 62a_100000699651_100012361361 [0,1,0,0,0,0|2,0,1]=4 1691 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Cl 62a_100012361361_100000699651 [0,1,0,0,0,0|2,0,1]=4 1692 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)F 62a_100000685547_100012361361 [0,1,0,0,0,0|2,0,1]=4 1693 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)F 62a_100012361361_100000685547 [0,1,0,0,0,0|2,0,1]=4 1694 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)O 62a_100012361361_100000211634 [0,1,0,0,0,0|2,0,1]=4 1695 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)[S] 62a_100012361361_114929384022 [0,1,0,0,0,0|2,0,1]=4 1696 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)[S] 62a_114929384022_100012361361 [0,1,0,0,0,0|2,0,1]=4 1697 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100000185753 [0,1,0,0,0,0|1,0,2]=4 1698 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100000185753 [0,1,0,0,0,0|1,0,2]=4 1699 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100000185753 [0,1,0,0,0,0|1,0,2]=4 1700 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Br 527a_100000174977_100000185753 [0,1,0,0,0,0|1,0,2]=4 1701 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100000185753 [0,1,0,0,0,0|1,0,2]=4 1702 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100000185753 [0,1,0,0,0,0|1,0,2]=4 1703 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100000185753 [0,1,0,0,0,0|1,0,2]=4 1704 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Cl 527a_100000174878_100000185753 [0,1,0,0,0,0|1,0,2]=4 1705 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100000185753 [0,1,0,0,0,0|1,0,2]=4 1706 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100000185753 [0,1,0,0,0,0|1,0,2]=4 1707 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100000185753 [0,1,0,0,0,0|1,0,2]=4 1708 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)F 527a_100000174948_100000185753 [0,1,0,0,0,0|1,0,2]=4 1709 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100000185753 [0,1,0,0,0,0|1,0,2]=4 1710 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100000185753 [0,1,0,0,0,0|1,0,2]=4 1711 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100000185753 [0,1,0,0,0,0|1,0,2]=4 1712 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)I 527a_100000106179_100000185753 [0,1,0,0,0,0|1,0,2]=4 1713 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100000185753 [0,1,0,0,0,0|1,0,2]=4 1714 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)O 527a_100000743036_100000185753 [0,1,0,0,0,0|1,0,2]=4 1715 B20R2.4658 O=C(CCc1ccccc1)NNc2cccc(c2)Br 22a_100000217339_100000185753 [0,1,0,0,0,0|3,0,0]=4 1716 B20R2.4658 O=C(CCc1ccccc1)NNc2cccc(c2)Cl 22a_100000184277_100000185753 [0,1,0,0,0,0|3,0,0]=4 1717 B20R2.4658 O=C(CCc1ccccc1)NNc2cccc(c2)F 22a_100000745080_100000185753 [0,1,0,0,0,0|3,0,0]=4 1718 B20R2.4658 O=C(CCc1ccccc1)NNc2cccc(c2)I 22a_100020605690_100000185753 [0,1,0,0,0,0|3,0,0]=4 1719 B20R2.4658 O=C(CNc1cccc(c1)Br)NCc2ccccc2 34a_100000210019_100000183539 [0,1,0,0,0,0|2,0,1]=4 1720 B20R2.4658 O=C(CNc1cccc(c1)Br)OCc2ccccc2 34a_100000210019_100000753625 [0,1,0,0,0,0|1,0,1]=3 1721 B20R2.4658 O=C(CNc1cccc(c1)Cl)NCc2ccccc2 34a_100000185859_100000183539 [0,1,0,0,0,0|2,0,1]=4 1722 B20R2.4658 O=C(CNc1cccc(c1)Cl)OCc2ccccc2 34a_100000185859_100000753625 [0,1,0,0,0,0|1,0,1]=3 1723 B20R2.4658 O=C(CNc1cccc(c1)F)NCc2ccccc2 34a_100000210047_100000183539 [0,1,0,0,0,0|2,0,1]=4 1724 B20R2.4658 O=C(CNc1cccc(c1)F)OCc2ccccc2 34a_100000210047_100000753625 [0,1,0,0,0,0|1,0,1]=3 1725 B20R2.4658 O=C(CNc1cccc(c1)I)NCc2ccccc2 34a_100000211102_100000183539 [0,1,0,0,0,0|2,0,1]=4 1726 B20R2.4658 O=C(CNc1cccc(c1)I)OCc2ccccc2 34a_100000211102_100000753625 [0,1,0,0,0,0|1,0,1]=3 1727 B20R2.4658 O=C(CNc1cccc(c1)O)NCc2ccccc2 34a_100000210217_100000183539 [0,1,0,0,0,0|2,0,1]=4 1728 B20R2.4658 O=C(CNc1cccc(c1)O)OCc2ccccc2 34a_100000210217_100000753625 [0,1,0,0,0,0|1,0,1]=3 1729 B20R2.4658 O=C(CNc1ccccc1)NCc2cccc(c2)Br 34a_100000106764_100011263252 [0,1,0,0,0,0|2,0,1]=4 1730 B20R2.4658 O=C(CNc1ccccc1)NCc2cccc(c2)Cl 34a_100000106764_100000181154 [0,1,0,0,0,0|2,0,1]=4 1731 B20R2.4658 O=C(CNc1ccccc1)NCc2cccc(c2)F 34a_100000106764_100000738998 [0,1,0,0,0,0|2,0,1]=4 1732 B20R2.4658 O=C(COc1cc[nH]c(=O)c1)OCc2ccccc2 34a_100000032262_100000753625 [0,1,0,0,0,0|2,0,1]=4 1733 B20R2.4658 O=C(COc1ccc[n+](c1)[O-])OCc2ccccc2 34a_100000039713_100000753625 [0,1,0,0,0,0|2,0,1]=4 1734 B20R2.4658 O=C(COc1ccc[n+](c1)[O-])OCc2ccccc2 7a_100000039713_100000753625 [0,1,0,0,0,0|2,0,1]=4 1735 B20R2.4658 O=C(COc1cccc(=O)[nH]1)OCc2ccccc2 34a_100000033347_100000753625 [0,1,0,0,0,0|2,0,1]=4 1736 B20R2.4658 O=C(COc1cccc(c1)Br)NCc2ccccc2 11a_100015324214_100000182359 [0,1,0,0,0,0|2,0,1]=4 1737 B20R2.4658 O=C(COc1cccc(c1)Br)NCc2ccccc2 1626a_100015324214_100000182359 [0,1,0,0,0,0|2,0,1]=4 1738 B20R2.4658 O=C(COc1cccc(c1)Br)NCc2ccccc2 240690a_100015324214_100000182359 [0,1,0,0,0,0|2,0,1]=4 1739 B20R2.4658 O=C(COc1cccc(c1)Br)NCc2ccccc2 34a_100000210342_100000183539 [0,1,0,0,0,0|2,0,1]=4 1740 B20R2.4658 O=C(COc1cccc(c1)Br)NCc2ccccc2 527a_100015324214_100000182359 [0,1,0,0,0,0|2,0,1]=4 1741 B20R2.4658 O=C(COc1cccc(c1)Br)NCc2ccccc2 7a_100000210342_100000183539 [0,1,0,0,0,0|2,0,1]=4 1742 B20R2.4658 O=C(COc1cccc(c1)Br)OCc2ccccc2 34a_100000210342_100000753625 [0,1,0,0,0,0|1,0,1]=3 1743 B20R2.4658 O=C(COc1cccc(c1)Br)OCc2ccccc2 7a_100000210342_100000753625 [0,1,0,0,0,0|1,0,1]=3 1744 B20R2.4658 O=C(COc1cccc(c1)Cl)NCc2ccccc2 11a_100015324214_100000184978 [0,1,0,0,0,0|2,0,1]=4 1745 B20R2.4658 O=C(COc1cccc(c1)Cl)NCc2ccccc2 1626a_100015324214_100000184978 [0,1,0,0,0,0|2,0,1]=4 1746 B20R2.4658 O=C(COc1cccc(c1)Cl)NCc2ccccc2 240690a_100015324214_100000184978 [0,1,0,0,0,0|2,0,1]=4 1747 B20R2.4658 O=C(COc1cccc(c1)Cl)NCc2ccccc2 34a_100000210295_100000183539 [0,1,0,0,0,0|2,0,1]=4 1748 B20R2.4658 O=C(COc1cccc(c1)Cl)NCc2ccccc2 527a_100015324214_100000184978 [0,1,0,0,0,0|2,0,1]=4 1749 B20R2.4658 O=C(COc1cccc(c1)Cl)NCc2ccccc2 7a_100000210295_100000183539 [0,1,0,0,0,0|2,0,1]=4 1750 B20R2.4658 O=C(COc1cccc(c1)Cl)OCc2ccccc2 34a_100000210295_100000753625 [0,1,0,0,0,0|1,0,1]=3 1751 B20R2.4658 O=C(COc1cccc(c1)Cl)OCc2ccccc2 7a_100000210295_100000753625 [0,1,0,0,0,0|1,0,1]=3 1752 B20R2.4658 O=C(COc1cccc(c1)F)NCc2ccccc2 11a_100015324214_100000182781 [0,1,0,0,0,0|2,0,1]=4 1753 B20R2.4658 O=C(COc1cccc(c1)F)NCc2ccccc2 1626a_100015324214_100000182781 [0,1,0,0,0,0|2,0,1]=4 1754 B20R2.4658 O=C(COc1cccc(c1)F)NCc2ccccc2 240690a_100015324214_100000182781 [0,1,0,0,0,0|2,0,1]=4 1755 B20R2.4658 O=C(COc1cccc(c1)F)NCc2ccccc2 34a_100000210426_100000183539 [0,1,0,0,0,0|2,0,1]=4 1756 B20R2.4658 O=C(COc1cccc(c1)F)NCc2ccccc2 527a_100015324214_100000182781 [0,1,0,0,0,0|2,0,1]=4 1757 B20R2.4658 O=C(COc1cccc(c1)F)NCc2ccccc2 7a_100000210426_100000183539 [0,1,0,0,0,0|2,0,1]=4 1758 B20R2.4658 O=C(COc1cccc(c1)F)OCc2ccccc2 34a_100000210426_100000753625 [0,1,0,0,0,0|1,0,1]=3 1759 B20R2.4658 O=C(COc1cccc(c1)F)OCc2ccccc2 7a_100000210426_100000753625 [0,1,0,0,0,0|1,0,1]=3 1760 B20R2.4658 O=C(COc1cccc(c1)I)NCc2ccccc2 34a_100000211634_100000183539 [0,1,0,0,0,0|2,0,1]=4 1761 B20R2.4658 O=C(COc1cccc(c1)I)NCc2ccccc2 7a_100000211634_100000183539 [0,1,0,0,0,0|2,0,1]=4 1762 B20R2.4658 O=C(COc1cccc(c1)I)OCc2ccccc2 34a_100000211634_100000753625 [0,1,0,0,0,0|1,0,1]=3 1763 B20R2.4658 O=C(COc1cccc(c1)I)OCc2ccccc2 7a_100000211634_100000753625 [0,1,0,0,0,0|1,0,1]=3 1764 B20R2.4658 O=C(COc1cccc(n1)F)OCc2ccccc2 34a_100011432558_100000753625 [0,1,0,0,0,0|2,0,1]=4 1765 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100000186222 [0,1,0,0,0,0|2,0,1]=4 1766 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100000186222 [0,1,0,0,0,0|2,0,1]=4 1767 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100000186222 [0,1,0,0,0,0|2,0,1]=4 1768 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Br 34a_100000210340_100011263252 [0,1,0,0,0,0|2,0,1]=4 1769 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Br 527a_100000174977_100000186222 [0,1,0,0,0,0|2,0,1]=4 1770 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Br 7a_100000210340_100011263252 [0,1,0,0,0,0|2,0,1]=4 1771 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100000186222 [0,1,0,0,0,0|2,0,1]=4 1772 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100000186222 [0,1,0,0,0,0|2,0,1]=4 1773 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100000186222 [0,1,0,0,0,0|2,0,1]=4 1774 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Cl 34a_100000210340_100000181154 [0,1,0,0,0,0|2,0,1]=4 1775 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Cl 527a_100000174878_100000186222 [0,1,0,0,0,0|2,0,1]=4 1776 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)Cl 7a_100000210340_100000181154 [0,1,0,0,0,0|2,0,1]=4 1777 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100000186222 [0,1,0,0,0,0|2,0,1]=4 1778 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100000186222 [0,1,0,0,0,0|2,0,1]=4 1779 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100000186222 [0,1,0,0,0,0|2,0,1]=4 1780 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)F 34a_100000210340_100000738998 [0,1,0,0,0,0|2,0,1]=4 1781 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)F 527a_100000174948_100000186222 [0,1,0,0,0,0|2,0,1]=4 1782 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)F 7a_100000210340_100000738998 [0,1,0,0,0,0|2,0,1]=4 1783 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100000186222 [0,1,0,0,0,0|2,0,1]=4 1784 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100000186222 [0,1,0,0,0,0|2,0,1]=4 1785 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100000186222 [0,1,0,0,0,0|2,0,1]=4 1786 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)I 527a_100000106179_100000186222 [0,1,0,0,0,0|2,0,1]=4 1787 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100000186222 [0,1,0,0,0,0|2,0,1]=4 1788 B20R2.4658 O=C(COc1ccccc1)NCc2cccc(c2)O 527a_100000743036_100000186222 [0,1,0,0,0,0|2,0,1]=4 1789 B20R2.4658 O=C(COc1ccnc(c1)Cl)OCc2ccccc2 34a_100000762945_100000753625 [0,1,0,0,0,0|2,0,1]=4 1790 B20R2.4658 O=C(COc1ccnc(c1)F)OCc2ccccc2 34a_100000732698_100000753625 [0,1,0,0,0,0|2,0,1]=4 1791 B20R2.4658 O=C(COc1cncc(c1)Br)OCc2ccccc2 34a_100000754920_100000753625 [0,1,0,0,0,0|2,0,1]=4 1792 B20R2.4658 O=C(COc1cncc(c1)Br)OCc2ccccc2 7a_100000754920_100000753625 [0,1,0,0,0,0|2,0,1]=4 1793 B20R2.4658 O=C(COc1cncc(c1)Cl)OCc2ccccc2 7a_100000032511_100000753625 [0,1,0,0,0,0|2,0,1]=4 1794 B20R2.4658 O=C(COc1cncc(c1)F)OCc2ccccc2 34a_100011830296_100000753625 [0,1,0,0,0,0|2,0,1]=4 1795 B20R2.4658 O=C(COc1cncc(c1)F)OCc2ccccc2 7a_100011830296_100000753625 [0,1,0,0,0,0|2,0,1]=4 1796 B20R2.4658 O=C(CSc1cc(=O)cc[nH]1)OCc2ccccc2 62a_100009817434_100000753625 [0,1,0,0,0,0|2,0,1]=4 1797 B20R2.4658 O=C(CSc1cc(ccn1)Cl)OCc2ccccc2 62a_100000753625_100010167805 [0,1,0,0,0,0|2,0,1]=4 1798 B20R2.4658 O=C(CSc1cc(ccn1)Cl)OCc2ccccc2 62a_100010167805_100000753625 [0,1,0,0,0,0|2,0,1]=4 1799 B20R2.4658 O=C(CSc1cc(ccn1)F)OCc2ccccc2 62a_100000753625_100000764206 [0,1,0,0,0,0|2,0,1]=4 1800 B20R2.4658 O=C(CSc1cc(ccn1)F)OCc2ccccc2 62a_100000764206_100000753625 [0,1,0,0,0,0|2,0,1]=4 1801 B20R2.4658 O=C(CSc1cc(ccn1)O)OCc2ccccc2 62a_100000753625_100000762945 [0,1,0,0,0,0|2,0,1]=4 1802 B20R2.4658 O=C(CSc1cc[nH]c(=O)c1)OCc2ccccc2 62a_100000753625_100009816521 [0,1,0,0,0,0|2,0,1]=4 1803 B20R2.4658 O=C(CSc1cc[nH]c(=O)c1)OCc2ccccc2 62a_100009816521_100000753625 [0,1,0,0,0,0|2,0,1]=4 1804 B20R2.4658 O=C(CSc1ccc[n+](c1)[O-])OCc2ccccc2 62a_100000753625_100009815978 [0,1,0,0,0,0|2,0,1]=4 1805 B20R2.4658 O=C(CSc1cccc(=O)[nH]1)OCc2ccccc2 62a_100000753625_100000752884 [0,1,0,0,0,0|2,0,1]=4 1806 B20R2.4658 O=C(CSc1cccc(c1)Br)NCc2ccccc2 11a_100015324214_100000760868 [0,1,0,0,0,0|2,0,1]=4 1807 B20R2.4658 O=C(CSc1cccc(c1)Br)NCc2ccccc2 1626a_100015324214_100000760868 [0,1,0,0,0,0|2,0,1]=4 1808 B20R2.4658 O=C(CSc1cccc(c1)Br)NCc2ccccc2 240690a_100015324214_100000760868 [0,1,0,0,0,0|2,0,1]=4 1809 B20R2.4658 O=C(CSc1cccc(c1)Br)NCc2ccccc2 527a_100015324214_100000760868 [0,1,0,0,0,0|2,0,1]=4 1810 B20R2.4658 O=C(CSc1cccc(c1)Br)NCc2ccccc2 62a_100000183539_100000691529 [0,1,0,0,0,0|2,0,1]=4 1811 B20R2.4658 O=C(CSc1cccc(c1)Br)NCc2ccccc2 62a_100000691529_100000183539 [0,1,0,0,0,0|2,0,1]=4 1812 B20R2.4658 O=C(CSc1cccc(c1)Br)OCc2ccccc2 62a_100000691529_100000753625 [0,1,0,0,0,0|1,0,1]=3 1813 B20R2.4658 O=C(CSc1cccc(c1)Br)OCc2ccccc2 62a_100000753625_100000691529 [0,1,0,0,0,0|1,0,1]=3 1814 B20R2.4658 O=C(CSc1cccc(c1)Cl)NCc2ccccc2 62a_100000183539_100000699651 [0,1,0,0,0,0|2,0,1]=4 1815 B20R2.4658 O=C(CSc1cccc(c1)Cl)NCc2ccccc2 62a_100000699651_100000183539 [0,1,0,0,0,0|2,0,1]=4 1816 B20R2.4658 O=C(CSc1cccc(c1)Cl)OCc2ccccc2 62a_100000699651_100000753625 [0,1,0,0,0,0|1,0,1]=3 1817 B20R2.4658 O=C(CSc1cccc(c1)Cl)OCc2ccccc2 62a_100000753625_100000699651 [0,1,0,0,0,0|1,0,1]=3 1818 B20R2.4658 O=C(CSc1cccc(c1)F)NCc2ccccc2 62a_100000183539_100000685547 [0,1,0,0,0,0|2,0,1]=4 1819 B20R2.4658 O=C(CSc1cccc(c1)F)NCc2ccccc2 62a_100000685547_100000183539 [0,1,0,0,0,0|2,0,1]=4 1820 B20R2.4658 O=C(CSc1cccc(c1)F)OCc2ccccc2 62a_100000685547_100000753625 [0,1,0,0,0,0|1,0,1]=3 1821 B20R2.4658 O=C(CSc1cccc(c1)F)OCc2ccccc2 62a_100000753625_100000685547 [0,1,0,0,0,0|1,0,1]=3 1822 B20R2.4658 O=C(CSc1cccc(c1)O)NCc2ccccc2 62a_100000183539_100000211634 [0,1,0,0,0,0|2,0,1]=4 1823 B20R2.4658 O=C(CSc1cccc(c1)O)OCc2ccccc2 62a_100000753625_100000211634 [0,1,0,0,0,0|1,0,1]=3 1824 B20R2.4658 O=C(CSc1cccc(c1)[S])NCc2ccccc2 62a_100000183539_114929384022 [0,1,0,0,0,0|2,0,1]=4 1825 B20R2.4658 O=C(CSc1cccc(c1)[S])NCc2ccccc2 62a_114929384022_100000183539 [0,1,0,0,0,0|2,0,1]=4 1826 B20R2.4658 O=C(CSc1cccc(c1)[S])OCc2ccccc2 62a_100000753625_114929384022 [0,1,0,0,0,0|1,0,1]=3 1827 B20R2.4658 O=C(CSc1cccc(c1)[S])OCc2ccccc2 62a_114929384022_100000753625 [0,1,0,0,0,0|1,0,1]=3 1828 B20R2.4658 O=C(CSc1cccc(n1)Br)OCc2ccccc2 62a_100000684672_100000753625 [0,1,0,0,0,0|2,0,1]=4 1829 B20R2.4658 O=C(CSc1cccc(n1)Br)OCc2ccccc2 62a_100000753625_100000684672 [0,1,0,0,0,0|2,0,1]=4 1830 B20R2.4658 O=C(CSc1cccc(n1)Cl)OCc2ccccc2 62a_100000051397_100000753625 [0,1,0,0,0,0|2,0,1]=4 1831 B20R2.4658 O=C(CSc1cccc(n1)Cl)OCc2ccccc2 62a_100000753625_100000051397 [0,1,0,0,0,0|2,0,1]=4 1832 B20R2.4658 O=C(CSc1cccc(n1)F)OCc2ccccc2 62a_100000753625_100009815982 [0,1,0,0,0,0|2,0,1]=4 1833 B20R2.4658 O=C(CSc1cccc(n1)F)OCc2ccccc2 62a_100009815982_100000753625 [0,1,0,0,0,0|2,0,1]=4 1834 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100000211596 [0,1,0,0,0,0|2,0,1]=4 1835 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100000211596 [0,1,0,0,0,0|2,0,1]=4 1836 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100000211596 [0,1,0,0,0,0|2,0,1]=4 1837 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Br 527a_100000174977_100000211596 [0,1,0,0,0,0|2,0,1]=4 1838 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Br 62a_100000719477_100011263252 [0,1,0,0,0,0|2,0,1]=4 1839 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Br 62a_100011263252_100000041952 [0,1,0,0,0,0|2,0,1]=4 1840 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100000211596 [0,1,0,0,0,0|2,0,1]=4 1841 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100000211596 [0,1,0,0,0,0|2,0,1]=4 1842 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100000211596 [0,1,0,0,0,0|2,0,1]=4 1843 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Cl 527a_100000174878_100000211596 [0,1,0,0,0,0|2,0,1]=4 1844 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Cl 62a_100000181154_100000041952 [0,1,0,0,0,0|2,0,1]=4 1845 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)Cl 62a_100000719477_100000181154 [0,1,0,0,0,0|2,0,1]=4 1846 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100000211596 [0,1,0,0,0,0|2,0,1]=4 1847 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100000211596 [0,1,0,0,0,0|2,0,1]=4 1848 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100000211596 [0,1,0,0,0,0|2,0,1]=4 1849 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)F 527a_100000174948_100000211596 [0,1,0,0,0,0|2,0,1]=4 1850 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)F 62a_100000719477_100000738998 [0,1,0,0,0,0|2,0,1]=4 1851 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)F 62a_100000738998_100000041952 [0,1,0,0,0,0|2,0,1]=4 1852 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100000211596 [0,1,0,0,0,0|2,0,1]=4 1853 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100000211596 [0,1,0,0,0,0|2,0,1]=4 1854 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100000211596 [0,1,0,0,0,0|2,0,1]=4 1855 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)I 527a_100000106179_100000211596 [0,1,0,0,0,0|2,0,1]=4 1856 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100000211596 [0,1,0,0,0,0|2,0,1]=4 1857 B20R2.4658 O=C(CSc1ccccc1)NCc2cccc(c2)O 527a_100000743036_100000211596 [0,1,0,0,0,0|2,0,1]=4 1858 B20R2.4658 O=C(CSc1ccnc(c1)Br)OCc2ccccc2 62a_100000753625_100009814637 [0,1,0,0,0,0|2,0,1]=4 1859 B20R2.4658 O=C(CSc1ccnc(c1)Br)OCc2ccccc2 62a_100009814637_100000753625 [0,1,0,0,0,0|2,0,1]=4 1860 B20R2.4658 O=C(CSc1ccnc(c1)Cl)OCc2ccccc2 62a_100000035001_100000753625 [0,1,0,0,0,0|2,0,1]=4 1861 B20R2.4658 O=C(CSc1ccnc(c1)Cl)OCc2ccccc2 62a_100000753625_100000035001 [0,1,0,0,0,0|2,0,1]=4 1862 B20R2.4658 O=C(CSc1ccnc(c1)F)OCc2ccccc2 62a_100000753625_100009816116 [0,1,0,0,0,0|2,0,1]=4 1863 B20R2.4658 O=C(CSc1ccnc(c1)F)OCc2ccccc2 62a_100009816116_100000753625 [0,1,0,0,0,0|2,0,1]=4 1864 B20R2.4658 O=C(CSc1cncc(c1)Br)OCc2ccccc2 62a_100000728054_100000753625 [0,1,0,0,0,0|2,0,1]=4 1865 B20R2.4658 O=C(CSc1cncc(c1)Br)OCc2ccccc2 62a_100000753625_100000728054 [0,1,0,0,0,0|2,0,1]=4 1866 B20R2.4658 O=C(CSc1cncc(c1)Cl)OCc2ccccc2 62a_100000049639_100000753625 [0,1,0,0,0,0|2,0,1]=4 1867 B20R2.4658 O=C(CSc1cncc(c1)Cl)OCc2ccccc2 62a_100000753625_100000049639 [0,1,0,0,0,0|2,0,1]=4 1868 B20R2.4658 O=C(CSc1cncc(c1)F)OCc2ccccc2 62a_100000744099_100000753625 [0,1,0,0,0,0|2,0,1]=4 1869 B20R2.4658 O=C(CSc1cncc(c1)F)OCc2ccccc2 62a_100000753625_100000744099 [0,1,0,0,0,0|2,0,1]=4 1870 B20R2.4658 O=C(CSc1cncc(c1)O)OCc2ccccc2 62a_100000753625_100000754920 [0,1,0,0,0,0|2,0,1]=4 1871 B20R2.4658 O=C(CSc1cncc(c1)O)OCc2ccccc2 62a_100000754920_100000753625 [0,1,0,0,0,0|2,0,1]=4 1872 B20R2.4658 O=C(NCc1cccc(c1)Br)NNc2ccccc2 273464a_100000174977_100015195140 [0,1,0,0,0,0|3,0,0]=4 1873 B20R2.4658 O=C(NCc1cccc(c1)Br)NNc2ccccc2 512a_100000174977_100015195140 [0,1,0,0,0,0|3,0,0]=4 1874 B20R2.4658 O=C(NCc1cccc(c1)Cl)NNc2ccccc2 273464a_100000174878_100015195140 [0,1,0,0,0,0|3,0,0]=4 1875 B20R2.4658 O=C(NCc1cccc(c1)Cl)NNc2ccccc2 512a_100000174878_100015195140 [0,1,0,0,0,0|3,0,0]=4 1876 B20R2.4658 O=C(NCc1cccc(c1)F)NNc2ccccc2 273464a_100000174948_100015195140 [0,1,0,0,0,0|3,0,0]=4 1877 B20R2.4658 O=C(NCc1cccc(c1)F)NNc2ccccc2 512a_100000174948_100015195140 [0,1,0,0,0,0|3,0,0]=4 1878 B20R2.4658 O=C(NCc1cccc(c1)I)NNc2ccccc2 273464a_100000106179_100015195140 [0,1,0,0,0,0|3,0,0]=4 1879 B20R2.4658 O=C(NCc1cccc(c1)I)NNc2ccccc2 512a_100000106179_100015195140 [0,1,0,0,0,0|3,0,0]=4 1880 B20R2.4658 O=C(NCc1cccc(c1)O)NNc2ccccc2 273464a_100000743036_100015195140 [0,1,0,0,0,0|3,0,0]=4 1881 B20R2.4658 O=C(NCc1cccc(c1)O)NNc2ccccc2 512a_100000743036_100015195140 [0,1,0,0,0,0|3,0,0]=4 1882 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Br 2708a_100000174977_100015324214 [0,1,0,0,0,0|2,0,1]=4 1883 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Br 2708a_100015324214_100000174977 [0,1,0,0,0,0|2,0,1]=4 1884 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Br 273464a_100000174977_100015324214 [0,1,0,0,0,0|2,0,1]=4 1885 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Br 273464a_100015324214_100000174977 [0,1,0,0,0,0|2,0,1]=4 1886 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Br 512a_100000174977_100015324214 [0,1,0,0,0,0|2,0,1]=4 1887 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Br 512a_100015324214_100000174977 [0,1,0,0,0,0|2,0,1]=4 1888 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Cl 2708a_100000174878_100015324214 [0,1,0,0,0,0|2,0,1]=4 1889 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Cl 2708a_100015324214_100000174878 [0,1,0,0,0,0|2,0,1]=4 1890 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Cl 273464a_100000174878_100015324214 [0,1,0,0,0,0|2,0,1]=4 1891 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Cl 273464a_100015324214_100000174878 [0,1,0,0,0,0|2,0,1]=4 1892 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Cl 512a_100000174878_100015324214 [0,1,0,0,0,0|2,0,1]=4 1893 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)Cl 512a_100015324214_100000174878 [0,1,0,0,0,0|2,0,1]=4 1894 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)F 2708a_100000174948_100015324214 [0,1,0,0,0,0|2,0,1]=4 1895 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)F 2708a_100015324214_100000174948 [0,1,0,0,0,0|2,0,1]=4 1896 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)F 273464a_100000174948_100015324214 [0,1,0,0,0,0|2,0,1]=4 1897 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)F 273464a_100015324214_100000174948 [0,1,0,0,0,0|2,0,1]=4 1898 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)F 512a_100000174948_100015324214 [0,1,0,0,0,0|2,0,1]=4 1899 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)F 512a_100015324214_100000174948 [0,1,0,0,0,0|2,0,1]=4 1900 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)I 2708a_100000106179_100015324214 [0,1,0,0,0,0|2,0,1]=4 1901 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)I 2708a_100015324214_100000106179 [0,1,0,0,0,0|2,0,1]=4 1902 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)I 273464a_100000106179_100015324214 [0,1,0,0,0,0|2,0,1]=4 1903 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)I 273464a_100015324214_100000106179 [0,1,0,0,0,0|2,0,1]=4 1904 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)I 512a_100000106179_100015324214 [0,1,0,0,0,0|2,0,1]=4 1905 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)I 512a_100015324214_100000106179 [0,1,0,0,0,0|2,0,1]=4 1906 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)O 2708a_100000743036_100015324214 [0,1,0,0,0,0|2,0,1]=4 1907 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)O 2708a_100015324214_100000743036 [0,1,0,0,0,0|2,0,1]=4 1908 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)O 273464a_100000743036_100015324214 [0,1,0,0,0,0|2,0,1]=4 1909 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)O 273464a_100015324214_100000743036 [0,1,0,0,0,0|2,0,1]=4 1910 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)O 512a_100000743036_100015324214 [0,1,0,0,0,0|2,0,1]=4 1911 B20R2.4658 O=C(NCc1ccccc1)NCc2cccc(c2)O 512a_100015324214_100000743036 [0,1,0,0,0,0|2,0,1]=4 1912 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)Br 273464a_100015324214_100000217339 [0,1,0,0,0,0|3,0,0]=4 1913 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)Br 512a_100000217339_100015324214 [0,1,0,0,0,0|3,0,0]=4 1914 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)Br 512a_100015324214_100000217339 [0,1,0,0,0,0|3,0,0]=4 1915 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)Cl 273464a_100015324214_100000184277 [0,1,0,0,0,0|3,0,0]=4 1916 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)Cl 512a_100015324214_100000184277 [0,1,0,0,0,0|3,0,0]=4 1917 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)F 273464a_100015324214_100000745080 [0,1,0,0,0,0|3,0,0]=4 1918 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)F 512a_100000745080_100015324214 [0,1,0,0,0,0|3,0,0]=4 1919 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)F 512a_100015324214_100000745080 [0,1,0,0,0,0|3,0,0]=4 1920 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)I 273464a_100015324214_100020605690 [0,1,0,0,0,0|3,0,0]=4 1921 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)I 512a_100015324214_100020605690 [0,1,0,0,0,0|3,0,0]=4 1922 B20R2.4658 O=C(NCc1ccccc1)NNc2cccc(c2)I 512a_100020605690_100015324214 [0,1,0,0,0,0|3,0,0]=4 1923 B20R2.6651 CC(=NNc1ccccc1)C=Cc2ccccc2Cl 4a_100015195140_200016284137 [0,1,0,0,0,0|3,0,0]=4 1924 B20R2.6651 CC(=NNc1ccccc1Br)C=Cc2ccccc2 4a_100000241748_100000204604 [0,1,0,0,0,0|3,0,0]=4 1925 B20R2.6651 CC(=NNc1ccccc1C)C=Cc2ccccc2 4a_100000184220_100000204604 [0,1,0,0,0,0|3,0,0]=4 1926 B20R2.6651 CC(=NNc1ccccc1Cl)C=Cc2ccccc2 4a_100000683529_100000204604 [0,1,0,0,0,0|3,0,0]=4 1927 B20R2.6651 CC(=NNc1ccccc1F)C=Cc2ccccc2 4a_100000239246_100000204604 [0,1,0,0,0,0|3,0,0]=4 1928 B20R2.6651 CC(=NNc1ccccc1I)C=Cc2ccccc2 4a_100011218156_100000204604 [0,1,0,0,0,0|3,0,0]=4 1929 B20R2.6651 C[n+]1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000212160 [0,1,0,0,0,0|2,0,1]=4 1930 B20R2.6651 Cc1ccccc1C=CC(=O)NCc2ccccc2 1626a_100015324214_100016266485 [0,1,0,0,0,0|1,0,0]=2 1931 B20R2.6651 Cc1ccccc1C=CC(=O)NCc2ccccn2 1626a_100000210449_100016266485 [0,1,0,0,0,0|2,0,0]=3 1932 B20R2.6651 Cc1ccccc1C=CC(=O)NCc2ccncc2 1626a_100000210450_100016266485 [0,1,0,0,0,0|2,0,0]=3 1933 B20R2.6651 Cc1ccccc1C=CC(=O)NNc2ccccc2 22a_100015195140_100016266485 [0,1,0,0,0,0|2,0,0]=3 1934 B20R2.6651 Cc1ccccc1C=CC(=O)NNc2ccccn2 22a_100000183288_100016266485 [0,1,0,0,0,0|3,0,0]=4 1935 B20R2.6651 Cc1ccccc1C=CC(=O)NNc2cccnc2 22a_100000728903_100016266485 [0,1,0,0,0,0|3,0,0]=4 1936 B20R2.6651 Cc1ccccc1C=CC(=O)NNc2ccncc2 22a_100000698918_100016266485 [0,1,0,0,0,0|3,0,0]=4 1937 B20R2.6651 Cc1ccccc1CCC(=O)C#Cc2ccccc2 1458a_100000736102_100011713688 [0,1,0,0,0,0|1,0,2]=4 1938 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2ccccc2 1458a_100000210462_100011713688 [0,1,0,0,0,0|1,0,0]=2 1939 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2ccccn2 1458a_100000740811_100011713688 [0,1,0,0,0,0|2,0,0]=3 1940 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2cccnc2 1458a_100000735890_100011713688 [0,1,0,0,0,0|2,0,0]=3 1941 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2ccncc2 1458a_100000682801_100011713688 [0,1,0,0,0,0|2,0,0]=3 1942 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2cncnc2 6a_100000749868_100012183946 [0,1,0,0,0,0|3,0,0]=4 1943 B20R2.6651 Cc1ccccc1CCC(=O)CCc2ccccc2 1458a_100000185753_100011713688 [0,1,0,0,0,0|1,0,2]=4 1944 B20R2.6651 Cc1ccccc1CCC(=O)CCc2ccccc2 1458a_100000748742_100000765856 [0,1,0,0,0,0|1,0,2]=4 1945 B20R2.6651 Cc1ccccc1CCC(=O)COc2ccccc2 1458a_100000186222_100011713688 [0,1,0,0,0,0|2,0,1]=4 1946 B20R2.6651 Cc1ccccc1CCC(=O)CSc2ccccc2 1458a_100000211596_100011713688 [0,1,0,0,0,0|2,0,1]=4 1947 B20R2.6651 Cc1ccccc1CCC(=O)NCc2ccccc2 11a_100015324214_100000748742 [0,1,0,0,0,0|1,0,2]=4 1948 B20R2.6651 Cc1ccccc1CCC(=O)NCc2ccccc2 1626a_100015324214_100000748742 [0,1,0,0,0,0|1,0,2]=4 1949 B20R2.6651 Cc1ccccc1CCC(=O)NCc2ccccc2 240690a_100015324214_100000748742 [0,1,0,0,0,0|1,0,2]=4 1950 B20R2.6651 Cc1ccccc1CCC(=O)NCc2ccccc2 527a_100015324214_100000748742 [0,1,0,0,0,0|1,0,2]=4 1951 B20R2.6651 Cc1ccccc1CCC(=O)NNc2ccccc2 22a_100015195140_100000748742 [0,1,0,0,0,0|3,0,0]=4 1952 B20R2.6651 Cc1ccccc1CNC(=O)C#Cc2ccccc2 240690a_100000174972_100000736102 [0,1,0,0,0,0|1,0,2]=4 1953 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccccc2 11a_100000174972_100000210462 [0,1,0,0,0,0|1,0,0]=2 1954 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccccc2 1626a_100000174972_100000210462 [0,1,0,0,0,0|1,0,0]=2 1955 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccccn2 11a_100000174972_100000740811 [0,1,0,0,0,0|2,0,0]=3 1956 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccccn2 240690a_100000174972_100000740811 [0,1,0,0,0,0|2,0,0]=3 1957 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2cccnc2 11a_100000174972_100000735890 [0,1,0,0,0,0|2,0,0]=3 1958 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2cccnc2 240690a_100000174972_100000735890 [0,1,0,0,0,0|2,0,0]=3 1959 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccncc2 240690a_100000174972_100000682801 [0,1,0,0,0,0|2,0,0]=3 1960 B20R2.6651 Cc1ccccc1CNC(=O)CCc2ccccc2 11a_100000174972_100000185753 [0,1,0,0,0,0|1,0,2]=4 1961 B20R2.6651 Cc1ccccc1CNC(=O)CCc2ccccc2 1626a_100000174972_100000185753 [0,1,0,0,0,0|1,0,2]=4 1962 B20R2.6651 Cc1ccccc1CNC(=O)CCc2ccccc2 240690a_100000174972_100000185753 [0,1,0,0,0,0|1,0,2]=4 1963 B20R2.6651 Cc1ccccc1CNC(=O)CCc2ccccc2 527a_100000174972_100000185753 [0,1,0,0,0,0|1,0,2]=4 1964 B20R2.6651 Cc1ccccc1CNC(=O)CNc2ccccc2 34a_100000106764_100000230231 [0,1,0,0,0,0|2,0,1]=4 1965 B20R2.6651 Cc1ccccc1CNC(=O)COc2ccccc2 11a_100000174972_100000186222 [0,1,0,0,0,0|2,0,1]=4 1966 B20R2.6651 Cc1ccccc1CNC(=O)COc2ccccc2 1626a_100000174972_100000186222 [0,1,0,0,0,0|2,0,1]=4 1967 B20R2.6651 Cc1ccccc1CNC(=O)COc2ccccc2 240690a_100000174972_100000186222 [0,1,0,0,0,0|2,0,1]=4 1968 B20R2.6651 Cc1ccccc1CNC(=O)COc2ccccc2 34a_100000210340_100000230231 [0,1,0,0,0,0|2,0,1]=4 1969 B20R2.6651 Cc1ccccc1CNC(=O)COc2ccccc2 527a_100000174972_100000186222 [0,1,0,0,0,0|2,0,1]=4 1970 B20R2.6651 Cc1ccccc1CNC(=O)COc2ccccc2 7a_100000210340_100000230231 [0,1,0,0,0,0|2,0,1]=4 1971 B20R2.6651 Cc1ccccc1CNC(=O)CSc2ccccc2 11a_100000174972_100000211596 [0,1,0,0,0,0|2,0,1]=4 1972 B20R2.6651 Cc1ccccc1CNC(=O)CSc2ccccc2 1626a_100000174972_100000211596 [0,1,0,0,0,0|2,0,1]=4 1973 B20R2.6651 Cc1ccccc1CNC(=O)CSc2ccccc2 240690a_100000174972_100000211596 [0,1,0,0,0,0|2,0,1]=4 1974 B20R2.6651 Cc1ccccc1CNC(=O)CSc2ccccc2 527a_100000174972_100000211596 [0,1,0,0,0,0|2,0,1]=4 1975 B20R2.6651 Cc1ccccc1CNC(=O)CSc2ccccc2 62a_100000230231_100000041952 [0,1,0,0,0,0|2,0,1]=4 1976 B20R2.6651 Cc1ccccc1CNC(=O)CSc2ccccc2 62a_100000719477_100000230231 [0,1,0,0,0,0|2,0,1]=4 1977 B20R2.6651 Cc1ccccc1CNC(=O)NCc2ccccc2 2708a_100000174972_100015324214 [0,1,0,0,0,0|2,0,1]=4 1978 B20R2.6651 Cc1ccccc1CNC(=O)NCc2ccccc2 2708a_100015324214_100000174972 [0,1,0,0,0,0|2,0,1]=4 1979 B20R2.6651 Cc1ccccc1CNC(=O)NCc2ccccc2 273464a_100000174972_100015324214 [0,1,0,0,0,0|2,0,1]=4 1980 B20R2.6651 Cc1ccccc1CNC(=O)NCc2ccccc2 273464a_100015324214_100000174972 [0,1,0,0,0,0|2,0,1]=4 1981 B20R2.6651 Cc1ccccc1CNC(=O)NCc2ccccc2 512a_100000174972_100015324214 [0,1,0,0,0,0|2,0,1]=4 1982 B20R2.6651 Cc1ccccc1CNC(=O)NCc2ccccc2 512a_100015324214_100000174972 [0,1,0,0,0,0|2,0,1]=4 1983 B20R2.6651 Cc1ccccc1CNC(=O)NNc2ccccc2 273464a_100000174972_100015195140 [0,1,0,0,0,0|3,0,0]=4 1984 B20R2.6651 Cc1ccccc1CNC(=O)NNc2ccccc2 512a_100000174972_100015195140 [0,1,0,0,0,0|3,0,0]=4 1985 B20R2.6651 Cc1ccccc1NCC(=O)CCc2ccccc2 34a_100015192222_100012361361 [0,1,0,0,0,0|2,0,1]=4 1986 B20R2.6651 Cc1ccccc1NCC(=O)NCc2ccccc2 34a_100015192222_100000183539 [0,1,0,0,0,0|2,0,1]=4 1987 B20R2.6651 Cc1ccccc1NCC(=O)OCc2ccccc2 34a_100015192222_100000753625 [0,1,0,0,0,0|1,0,1]=3 1988 B20R2.6651 Cc1ccccc1NNC(=O)C=Cc2ccccc2 22a_100000184220_100000210462 [0,1,0,0,0,0|2,0,0]=3 1989 B20R2.6651 Cc1ccccc1NNC(=O)C=Cc2ccccn2 22a_100000184220_100000740811 [0,1,0,0,0,0|3,0,0]=4 1990 B20R2.6651 Cc1ccccc1NNC(=O)C=Cc2cccnc2 22a_100000184220_100000735890 [0,1,0,0,0,0|3,0,0]=4 1991 B20R2.6651 Cc1ccccc1NNC(=O)C=Cc2ccncc2 22a_100000184220_100000682801 [0,1,0,0,0,0|3,0,0]=4 1992 B20R2.6651 Cc1ccccc1NNC(=O)CCc2ccccc2 22a_100000184220_100000185753 [0,1,0,0,0,0|3,0,0]=4 1993 B20R2.6651 Cc1ccccc1NNC(=O)NCc2ccccc2 273464a_100015324214_100000184220 [0,1,0,0,0,0|3,0,0]=4 1994 B20R2.6651 Cc1ccccc1NNC(=O)NCc2ccccc2 512a_100015324214_100000184220 [0,1,0,0,0,0|3,0,0]=4 1995 B20R2.6651 Cc1ccccc1OCC(=O)CCc2ccccc2 1458a_100000182418_100000765856 [0,1,0,0,0,0|2,0,1]=4 1996 B20R2.6651 Cc1ccccc1OCC(=O)CCc2ccccc2 34a_100000210338_100012361361 [0,1,0,0,0,0|2,0,1]=4 1997 B20R2.6651 Cc1ccccc1OCC(=O)CCc2ccccc2 7a_100000210338_100012361361 [0,1,0,0,0,0|2,0,1]=4 1998 B20R2.6651 Cc1ccccc1OCC(=O)NCc2ccccc2 11a_100015324214_100000182418 [0,1,0,0,0,0|2,0,1]=4 1999 B20R2.6651 Cc1ccccc1OCC(=O)NCc2ccccc2 1626a_100015324214_100000182418 [0,1,0,0,0,0|2,0,1]=4 2000 B20R2.6651 Cc1ccccc1OCC(=O)NCc2ccccc2 240690a_100015324214_100000182418 [0,1,0,0,0,0|2,0,1]=4 2001 B20R2.6651 Cc1ccccc1OCC(=O)NCc2ccccc2 34a_100000210338_100000183539 [0,1,0,0,0,0|2,0,1]=4 2002 B20R2.6651 Cc1ccccc1OCC(=O)NCc2ccccc2 527a_100015324214_100000182418 [0,1,0,0,0,0|2,0,1]=4 2003 B20R2.6651 Cc1ccccc1OCC(=O)NCc2ccccc2 7a_100000210338_100000183539 [0,1,0,0,0,0|2,0,1]=4 2004 B20R2.6651 Cc1ccccc1OCC(=O)OCc2ccccc2 34a_100000210338_100000753625 [0,1,0,0,0,0|1,0,1]=3 2005 B20R2.6651 Cc1ccccc1OCC(=O)OCc2ccccc2 7a_100000210338_100000753625 [0,1,0,0,0,0|1,0,1]=3 2006 B20R2.6651 Cc1ccccc1SCC(=O)CCc2ccccc2 1458a_100000183026_100000765856 [0,1,0,0,0,0|2,0,1]=4 2007 B20R2.6651 Cc1ccccc1SCC(=O)CCc2ccccc2 62a_100000210755_100012361361 [0,1,0,0,0,0|2,0,1]=4 2008 B20R2.6651 Cc1ccccc1SCC(=O)CCc2ccccc2 62a_100012361361_100000210755 [0,1,0,0,0,0|2,0,1]=4 2009 B20R2.6651 Cc1ccccc1SCC(=O)NCc2ccccc2 11a_100015324214_100000183026 [0,1,0,0,0,0|2,0,1]=4 2010 B20R2.6651 Cc1ccccc1SCC(=O)NCc2ccccc2 1626a_100015324214_100000183026 [0,1,0,0,0,0|2,0,1]=4 2011 B20R2.6651 Cc1ccccc1SCC(=O)NCc2ccccc2 240690a_100015324214_100000183026 [0,1,0,0,0,0|2,0,1]=4 2012 B20R2.6651 Cc1ccccc1SCC(=O)NCc2ccccc2 527a_100015324214_100000183026 [0,1,0,0,0,0|2,0,1]=4 2013 B20R2.6651 Cc1ccccc1SCC(=O)NCc2ccccc2 62a_100000183539_100000210755 [0,1,0,0,0,0|2,0,1]=4 2014 B20R2.6651 Cc1ccccc1SCC(=O)NCc2ccccc2 62a_100000210755_100000183539 [0,1,0,0,0,0|2,0,1]=4 2015 B20R2.6651 Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100000210755_100000753625 [0,1,0,0,0,0|1,0,1]=3 2016 B20R2.6651 Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000210755 [0,1,0,0,0,0|1,0,1]=3 2017 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2ccccc2 11a_100011223789_100000210462 [0,1,0,0,0,0|2,0,0]=3 2018 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2ccccc2 1626a_100011223789_100000210462 [0,1,0,0,0,0|2,0,0]=3 2019 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2ccccn2 11a_100011223789_100000740811 [0,1,0,0,0,0|3,0,0]=4 2020 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2ccccn2 240690a_100011223789_100000740811 [0,1,0,0,0,0|3,0,0]=4 2021 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2cccnc2 11a_100011223789_100000735890 [0,1,0,0,0,0|3,0,0]=4 2022 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2cccnc2 240690a_100011223789_100000735890 [0,1,0,0,0,0|3,0,0]=4 2023 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2ccncc2 240690a_100011223789_100000682801 [0,1,0,0,0,0|3,0,0]=4 2024 B20R2.6651 Cc1cccnc1NNC(=O)C=Cc2ccccc2 22a_100000708268_100000210462 [0,1,0,0,0,0|3,0,0]=4 2025 B20R2.6651 Cc1cccnc1SCC(=O)OCc2ccccc2 62a_100000751373_100000753625 [0,1,0,0,0,0|2,0,1]=4 2026 B20R2.6651 Cc1cccnc1SCC(=O)OCc2ccccc2 62a_100000753625_100000751373 [0,1,0,0,0,0|2,0,1]=4 2027 B20R2.6651 Cc1ccncc1CNC(=O)C=Cc2ccccc2 11a_100011997553_100000210462 [0,1,0,0,0,0|2,0,0]=3 2028 B20R2.6651 Cc1ccncc1CNC(=O)C=Cc2ccccn2 11a_100011997553_100000740811 [0,1,0,0,0,0|3,0,0]=4 2029 B20R2.6651 Cc1ccncc1CNC(=O)C=Cc2ccccn2 240690a_100011997553_100000740811 [0,1,0,0,0,0|3,0,0]=4 2030 B20R2.6651 Cc1ccncc1CNC(=O)C=Cc2cccnc2 11a_100011997553_100000735890 [0,1,0,0,0,0|3,0,0]=4 2031 B20R2.6651 Cc1ccncc1CNC(=O)C=Cc2cccnc2 240690a_100011997553_100000735890 [0,1,0,0,0,0|3,0,0]=4 2032 B20R2.6651 Cc1ccncc1CNC(=O)C=Cc2ccncc2 240690a_100011997553_100000682801 [0,1,0,0,0,0|3,0,0]=4 2033 B20R2.6651 Cc1ccncc1OCC(=O)OCc2ccccc2 34a_100011997053_100000753625 [0,1,0,0,0,0|2,0,1]=4 2034 B20R2.6651 Cc1ccncc1OCC(=O)OCc2ccccc2 7a_100011997053_100000753625 [0,1,0,0,0,0|2,0,1]=4 2035 B20R2.6651 Cc1ccncc1SCC(=O)OCc2ccccc2 62a_100000753625_100000761580 [0,1,0,0,0,0|2,0,1]=4 2036 B20R2.6651 Cc1ccncc1SCC(=O)OCc2ccccc2 62a_100000761580_100000753625 [0,1,0,0,0,0|2,0,1]=4 2037 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2ccccc2 11a_100000708811_100000210462 [0,1,0,0,0,0|2,0,0]=3 2038 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2ccccc2 1626a_100000708811_100000210462 [0,1,0,0,0,0|2,0,0]=3 2039 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2ccccn2 11a_100000708811_100000740811 [0,1,0,0,0,0|3,0,0]=4 2040 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2ccccn2 240690a_100000708811_100000740811 [0,1,0,0,0,0|3,0,0]=4 2041 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2cccnc2 11a_100000708811_100000735890 [0,1,0,0,0,0|3,0,0]=4 2042 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2cccnc2 240690a_100000708811_100000735890 [0,1,0,0,0,0|3,0,0]=4 2043 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2ccncc2 240690a_100000708811_100000682801 [0,1,0,0,0,0|3,0,0]=4 2044 B20R2.6651 Cc1cnccc1NNC(=O)C=Cc2ccccc2 22a_100011935204_100000210462 [0,1,0,0,0,0|3,0,0]=4 2045 B20R2.6651 Cc1cnccc1OCC(=O)OCc2ccccc2 34a_100000694293_100000753625 [0,1,0,0,0,0|2,0,1]=4 2046 B20R2.6651 Cc1cnccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000765111 [0,1,0,0,0,0|2,0,1]=4 2047 B20R2.6651 Cc1cnccc1SCC(=O)OCc2ccccc2 62a_100000765111_100000753625 [0,1,0,0,0,0|2,0,1]=4 2048 B20R2.6651 Cc1ncccc1NNC(=O)C=Cc2ccccc2 22a_100000730703_100000210462 [0,1,0,0,0,0|3,0,0]=4 2049 B20R2.6651 Cc1ncccc1OCC(=O)OCc2ccccc2 34a_100000745507_100000753625 [0,1,0,0,0,0|2,0,1]=4 2050 B20R2.6651 Cc1ncccc1OCC(=O)OCc2ccccc2 7a_100000745507_100000753625 [0,1,0,0,0,0|2,0,1]=4 2051 B20R2.6651 Cc1ncccc1SCC(=O)OCc2ccccc2 62a_100000751574_100000753625 [0,1,0,0,0,0|2,0,1]=4 2052 B20R2.6651 Cc1ncccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000751574 [0,1,0,0,0,0|2,0,1]=4 2053 B20R2.6651 Cc1nccnc1CNC(=O)C=Cc2ccccc2 11a_100020641712_100000210462 [0,1,0,0,0,0|3,0,0]=4 2054 B20R2.6651 Nc1ccccc1OCC(=O)CCc2ccccc2 34a_100000185747_100012361361 [0,1,0,0,0,0|2,0,1]=4 2055 B20R2.6651 Nc1ccccc1OCC(=O)CCc2ccccc2 7a_100000185747_100012361361 [0,1,0,0,0,0|2,0,1]=4 2056 B20R2.6651 Nc1ccccc1OCC(=O)NCc2ccccc2 34a_100000185747_100000183539 [0,1,0,0,0,0|2,0,1]=4 2057 B20R2.6651 Nc1ccccc1OCC(=O)NCc2ccccc2 7a_100000185747_100000183539 [0,1,0,0,0,0|2,0,1]=4 2058 B20R2.6651 Nc1ccccc1OCC(=O)OCc2ccccc2 34a_100000185747_100000753625 [0,1,0,0,0,0|1,0,1]=3 2059 B20R2.6651 Nc1ccccc1OCC(=O)OCc2ccccc2 7a_100000185747_100000753625 [0,1,0,0,0,0|1,0,1]=3 2060 B20R2.6651 Nc1ccccc1SCC(=O)CCc2ccccc2 62a_100000210017_100012361361 [0,1,0,0,0,0|2,0,1]=4 2061 B20R2.6651 Nc1ccccc1SCC(=O)CCc2ccccc2 62a_100012361361_100000210017 [0,1,0,0,0,0|2,0,1]=4 2062 B20R2.6651 Nc1ccccc1SCC(=O)NCc2ccccc2 62a_100000183539_100000210017 [0,1,0,0,0,0|2,0,1]=4 2063 B20R2.6651 Nc1ccccc1SCC(=O)NCc2ccccc2 62a_100000210017_100000183539 [0,1,0,0,0,0|2,0,1]=4 2064 B20R2.6651 Nc1ccccc1SCC(=O)OCc2ccccc2 62a_100000210017_100000753625 [0,1,0,0,0,0|1,0,1]=3 2065 B20R2.6651 Nc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000210017 [0,1,0,0,0,0|1,0,1]=3 2066 B20R2.6651 Nc1cccnc1OCC(=O)OCc2ccccc2 34a_100000746358_100000753625 [0,1,0,0,0,0|2,0,1]=4 2067 B20R2.6651 Nc1cccnc1SCC(=O)OCc2ccccc2 62a_100000688686_100000753625 [0,1,0,0,0,0|2,0,1]=4 2068 B20R2.6651 Nc1cccnc1SCC(=O)OCc2ccccc2 62a_100000753625_100000688686 [0,1,0,0,0,0|2,0,1]=4 2069 B20R2.6651 Nc1ccncc1OCC(=O)OCc2ccccc2 34a_100000753702_100000753625 [0,1,0,0,0,0|2,0,1]=4 2070 B20R2.6651 Nc1ccncc1SCC(=O)OCc2ccccc2 62a_100000047001_100000753625 [0,1,0,0,0,0|2,0,1]=4 2071 B20R2.6651 Nc1ccncc1SCC(=O)OCc2ccccc2 62a_100000753625_100000047001 [0,1,0,0,0,0|2,0,1]=4 2072 B20R2.6651 Nc1cnccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000756074 [0,1,0,0,0,0|2,0,1]=4 2073 B20R2.6651 Nc1cnccc1SCC(=O)OCc2ccccc2 62a_100000756074_100000753625 [0,1,0,0,0,0|2,0,1]=4 2074 B20R2.6651 Nc1ncccc1OCC(=O)OCc2ccccc2 34a_100000211975_100000753625 [0,1,0,0,0,0|2,0,1]=4 2075 B20R2.6651 Nc1ncccc1OCC(=O)OCc2ccccc2 7a_100000211975_100000753625 [0,1,0,0,0,0|2,0,1]=4 2076 B20R2.6651 Nc1ncccc1SCC(=O)OCc2ccccc2 62a_100000045569_100000753625 [0,1,0,0,0,0|2,0,1]=4 2077 B20R2.6651 Nc1ncccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000045569 [0,1,0,0,0,0|2,0,1]=4 2078 B20R2.6651 O=C(C#Cc1ccccc1)CCc2ccccc2Br 1458a_100000736102_100012161201 [0,1,0,0,0,0|1,0,2]=4 2079 B20R2.6651 O=C(C#Cc1ccccc1)CCc2ccccc2Cl 1458a_100000736102_100011713703 [0,1,0,0,0,0|1,0,2]=4 2080 B20R2.6651 O=C(C#Cc1ccccc1)CCc2ccccc2F 1458a_100000736102_100000720011 [0,1,0,0,0,0|1,0,2]=4 2081 B20R2.6651 O=C(C#Cc1ccccc1)CCc2ccccc2O 1458a_100000736102_100000722297 [0,1,0,0,0,0|1,0,2]=4 2082 B20R2.6651 O=C(C#Cc1ccccc1)NCc2ccccc2Br 240690a_100000689332_100000736102 [0,1,0,0,0,0|1,0,2]=4 2083 B20R2.6651 O=C(C#Cc1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100000736102 [0,1,0,0,0,0|1,0,2]=4 2084 B20R2.6651 O=C(C#Cc1ccccc1)NCc2ccccc2F 240690a_100000174869_100000736102 [0,1,0,0,0,0|1,0,2]=4 2085 B20R2.6651 O=C(C#Cc1ccccc1)NCc2ccccc2I 240690a_100015347259_100000736102 [0,1,0,0,0,0|1,0,2]=4 2086 B20R2.6651 O=C(C#Cc1ccccc1)NCc2ccccc2O 240690a_100000185550_100000736102 [0,1,0,0,0,0|1,0,2]=4 2087 B20R2.6651 O=C(C#Cc1ccccc1F)CCc2ccccc2 1458a_100011892747_100000765856 [0,1,0,0,0,0|1,0,2]=4 2088 B20R2.6651 O=C(C=Cc1ccccc1)CCc2ccccc2Br 1458a_100000210462_100012161201 [0,1,0,0,0,0|1,0,0]=2 2089 B20R2.6651 O=C(C=Cc1ccccc1)CCc2ccccc2Cl 1458a_100000210462_100011713703 [0,1,0,0,0,0|1,0,0]=2 2090 B20R2.6651 O=C(C=Cc1ccccc1)CCc2ccccc2F 1458a_100000210462_100000720011 [0,1,0,0,0,0|1,0,0]=2 2091 B20R2.6651 O=C(C=Cc1ccccc1)CCc2ccccc2O 1458a_100000210462_100000722297 [0,1,0,0,0,0|1,0,0]=2 2092 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2Br 11a_100000689332_100000210462 [0,1,0,0,0,0|1,0,0]=2 2093 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100000210462 [0,1,0,0,0,0|1,0,0]=2 2094 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100000210462 [0,1,0,0,0,0|1,0,0]=2 2095 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100000210462 [0,1,0,0,0,0|1,0,0]=2 2096 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2F 11a_100000174869_100000210462 [0,1,0,0,0,0|1,0,0]=2 2097 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2F 1626a_100000174869_100000210462 [0,1,0,0,0,0|1,0,0]=2 2098 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2I 11a_100015347259_100000210462 [0,1,0,0,0,0|1,0,0]=2 2099 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2I 1626a_100015347259_100000210462 [0,1,0,0,0,0|1,0,0]=2 2100 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2Br 11a_100009818023_100000210462 [0,1,0,0,0,0|2,0,0]=3 2101 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2Cl 11a_100015189234_100000210462 [0,1,0,0,0,0|2,0,0]=3 2102 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2Cl 1626a_100015189234_100000210462 [0,1,0,0,0,0|2,0,0]=3 2103 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2F 11a_100000724633_100000210462 [0,1,0,0,0,0|2,0,0]=3 2104 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2F 1626a_100000724633_100000210462 [0,1,0,0,0,0|2,0,0]=3 2105 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccncc2Br 11a_100020640021_100000210462 [0,1,0,0,0,0|2,0,0]=3 2106 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccncc2F 11a_100011935246_100000210462 [0,1,0,0,0,0|2,0,0]=3 2107 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccncc2F 1626a_100011935246_100000210462 [0,1,0,0,0,0|2,0,0]=3 2108 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2Br 11a_100020591323_100000210462 [0,1,0,0,0,0|2,0,0]=3 2109 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2Cl 11a_100015189233_100000210462 [0,1,0,0,0,0|2,0,0]=3 2110 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2Cl 1626a_100015189233_100000210462 [0,1,0,0,0,0|2,0,0]=3 2111 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2F 11a_100000690088_100000210462 [0,1,0,0,0,0|2,0,0]=3 2112 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2F 1626a_100000690088_100000210462 [0,1,0,0,0,0|2,0,0]=3 2113 B20R2.6651 O=C(C=Cc1ccccc1)NCc2nccnc2Cl 11a_100000729963_100000210462 [0,1,0,0,0,0|3,0,0]=4 2114 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccccc2Br 22a_100000241748_100000210462 [0,1,0,0,0,0|2,0,0]=3 2115 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccccc2Cl 22a_100000683529_100000210462 [0,1,0,0,0,0|2,0,0]=3 2116 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccccc2F 22a_100000239246_100000210462 [0,1,0,0,0,0|2,0,0]=3 2117 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccccc2I 22a_100011218156_100000210462 [0,1,0,0,0,0|2,0,0]=3 2118 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccncc2Br 22a_100013404636_100000210462 [0,1,0,0,0,0|3,0,0]=4 2119 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ncccc2Br 22a_100011464834_100000210462 [0,1,0,0,0,0|3,0,0]=4 2120 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ncccc2Cl 22a_100000741667_100000210462 [0,1,0,0,0,0|3,0,0]=4 2121 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ncccc2F 22a_100000717775_100000210462 [0,1,0,0,0,0|3,0,0]=4 2122 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ncccc2I 22a_100010221029_100000210462 [0,1,0,0,0,0|3,0,0]=4 2123 B20R2.6651 O=C(C=Cc1ccccc1Br)CCc2ccccc2 1458a_100000719032_100000765856 [0,1,0,0,0,0|1,0,0]=2 2124 B20R2.6651 O=C(C=Cc1ccccc1Br)CCc2ccccn2 1458a_100000719032_100015183660 [0,1,0,0,0,0|2,0,0]=3 2125 B20R2.6651 O=C(C=Cc1ccccc1Br)CCc2cccnc2 1458a_100000719032_200011713674 [0,1,0,0,0,0|2,0,0]=3 2126 B20R2.6651 O=C(C=Cc1ccccc1Br)CCc2ccncc2 1458a_100000719032_100000723409 [0,1,0,0,0,0|2,0,0]=3 2127 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccc2 11a_100015324214_100000719032 [0,1,0,0,0,0|1,0,0]=2 2128 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccc2 1626a_100015324214_100000719032 [0,1,0,0,0,0|1,0,0]=2 2129 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccc2 240690a_100015324214_100000719032 [0,1,0,0,0,0|1,0,0]=2 2130 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccn2 11a_100000210449_100000719032 [0,1,0,0,0,0|2,0,0]=3 2131 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccn2 1626a_100000210449_100000719032 [0,1,0,0,0,0|2,0,0]=3 2132 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccn2 240690a_100000210449_100000719032 [0,1,0,0,0,0|2,0,0]=3 2133 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cccnc2 11a_100000210453_100000719032 [0,1,0,0,0,0|2,0,0]=3 2134 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cccnc2 240690a_100000210453_100000719032 [0,1,0,0,0,0|2,0,0]=3 2135 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cccnn2 11a_100159270163_100000719032 [0,1,0,0,0,0|3,0,0]=4 2136 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cccnn2 240690a_100159270163_100000719032 [0,1,0,0,0,0|3,0,0]=4 2137 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccncc2 11a_100000210450_100000719032 [0,1,0,0,0,0|2,0,0]=3 2138 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccncc2 1626a_100000210450_100000719032 [0,1,0,0,0,0|2,0,0]=3 2139 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccncc2 240690a_100000210450_100000719032 [0,1,0,0,0,0|2,0,0]=3 2140 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccncn2 11a_100000736019_100000719032 [0,1,0,0,0,0|3,0,0]=4 2141 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccncn2 240690a_100000736019_100000719032 [0,1,0,0,0,0|3,0,0]=4 2142 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cnccn2 11a_100000737960_100000719032 [0,1,0,0,0,0|3,0,0]=4 2143 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cnccn2 240690a_100000737960_100000719032 [0,1,0,0,0,0|3,0,0]=4 2144 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cncnc2 11a_100011243677_100000719032 [0,1,0,0,0,0|3,0,0]=4 2145 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cncnc2 240690a_100011243677_100000719032 [0,1,0,0,0,0|3,0,0]=4 2146 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ncccn2 11a_100015189908_100000719032 [0,1,0,0,0,0|3,0,0]=4 2147 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ncccn2 240690a_100015189908_100000719032 [0,1,0,0,0,0|3,0,0]=4 2148 B20R2.6651 O=C(C=Cc1ccccc1Br)NNc2ccccc2 22a_100015195140_100000719032 [0,1,0,0,0,0|2,0,0]=3 2149 B20R2.6651 O=C(C=Cc1ccccc1Br)NNc2ccccn2 22a_100000183288_100000719032 [0,1,0,0,0,0|3,0,0]=4 2150 B20R2.6651 O=C(C=Cc1ccccc1Br)NNc2cccnc2 22a_100000728903_100000719032 [0,1,0,0,0,0|3,0,0]=4 2151 B20R2.6651 O=C(C=Cc1ccccc1Br)NNc2ccncc2 22a_100000698918_100000719032 [0,1,0,0,0,0|3,0,0]=4 2152 B20R2.6651 O=C(C=Cc1ccccc1Cl)CCc2ccccc2 1458a_100000720304_100000765856 [0,1,0,0,0,0|1,0,0]=2 2153 B20R2.6651 O=C(C=Cc1ccccc1Cl)CCc2ccccn2 1458a_100000720304_100015183660 [0,1,0,0,0,0|2,0,0]=3 2154 B20R2.6651 O=C(C=Cc1ccccc1Cl)CCc2cccnc2 1458a_100000720304_200011713674 [0,1,0,0,0,0|2,0,0]=3 2155 B20R2.6651 O=C(C=Cc1ccccc1Cl)CCc2ccncc2 1458a_100000720304_100000723409 [0,1,0,0,0,0|2,0,0]=3 2156 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccc2 11a_100015324214_100000720304 [0,1,0,0,0,0|1,0,0]=2 2157 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccc2 1626a_100015324214_100000720304 [0,1,0,0,0,0|1,0,0]=2 2158 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccc2 240690a_100015324214_100000720304 [0,1,0,0,0,0|1,0,0]=2 2159 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccn2 11a_100000210449_100000720304 [0,1,0,0,0,0|2,0,0]=3 2160 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccn2 1626a_100000210449_100000720304 [0,1,0,0,0,0|2,0,0]=3 2161 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccn2 240690a_100000210449_100000720304 [0,1,0,0,0,0|2,0,0]=3 2162 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cccnc2 11a_100000210453_100000720304 [0,1,0,0,0,0|2,0,0]=3 2163 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cccnc2 240690a_100000210453_100000720304 [0,1,0,0,0,0|2,0,0]=3 2164 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cccnn2 11a_100159270163_100000720304 [0,1,0,0,0,0|3,0,0]=4 2165 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cccnn2 240690a_100159270163_100000720304 [0,1,0,0,0,0|3,0,0]=4 2166 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccncc2 11a_100000210450_100000720304 [0,1,0,0,0,0|2,0,0]=3 2167 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccncc2 1626a_100000210450_100000720304 [0,1,0,0,0,0|2,0,0]=3 2168 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccncc2 240690a_100000210450_100000720304 [0,1,0,0,0,0|2,0,0]=3 2169 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccncn2 11a_100000736019_100000720304 [0,1,0,0,0,0|3,0,0]=4 2170 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccncn2 240690a_100000736019_100000720304 [0,1,0,0,0,0|3,0,0]=4 2171 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cnccn2 11a_100000737960_100000720304 [0,1,0,0,0,0|3,0,0]=4 2172 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cnccn2 240690a_100000737960_100000720304 [0,1,0,0,0,0|3,0,0]=4 2173 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cncnc2 11a_100011243677_100000720304 [0,1,0,0,0,0|3,0,0]=4 2174 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cncnc2 240690a_100011243677_100000720304 [0,1,0,0,0,0|3,0,0]=4 2175 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ncccn2 11a_100015189908_100000720304 [0,1,0,0,0,0|3,0,0]=4 2176 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ncccn2 240690a_100015189908_100000720304 [0,1,0,0,0,0|3,0,0]=4 2177 B20R2.6651 O=C(C=Cc1ccccc1Cl)NNc2ccccc2 22a_100015195140_100000720304 [0,1,0,0,0,0|2,0,0]=3 2178 B20R2.6651 O=C(C=Cc1ccccc1Cl)NNc2ccccn2 22a_100000183288_100000720304 [0,1,0,0,0,0|3,0,0]=4 2179 B20R2.6651 O=C(C=Cc1ccccc1Cl)NNc2cccnc2 22a_100000728903_100000720304 [0,1,0,0,0,0|3,0,0]=4 2180 B20R2.6651 O=C(C=Cc1ccccc1Cl)NNc2ccncc2 22a_100000698918_100000720304 [0,1,0,0,0,0|3,0,0]=4 2181 B20R2.6651 O=C(C=Cc1ccccc1F)CCc2ccccc2 1458a_100016256065_100000765856 [0,1,0,0,0,0|1,0,0]=2 2182 B20R2.6651 O=C(C=Cc1ccccc1F)CCc2ccccn2 1458a_100016256065_100015183660 [0,1,0,0,0,0|2,0,0]=3 2183 B20R2.6651 O=C(C=Cc1ccccc1F)CCc2cccnc2 1458a_100016256065_200011713674 [0,1,0,0,0,0|2,0,0]=3 2184 B20R2.6651 O=C(C=Cc1ccccc1F)CCc2ccncc2 1458a_100016256065_100000723409 [0,1,0,0,0,0|2,0,0]=3 2185 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccc2 11a_100015324214_100016256065 [0,1,0,0,0,0|1,0,0]=2 2186 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccc2 1626a_100015324214_100016256065 [0,1,0,0,0,0|1,0,0]=2 2187 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccc2 240690a_100015324214_100016256065 [0,1,0,0,0,0|1,0,0]=2 2188 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccn2 11a_100000210449_100016256065 [0,1,0,0,0,0|2,0,0]=3 2189 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccn2 1626a_100000210449_100016256065 [0,1,0,0,0,0|2,0,0]=3 2190 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccn2 240690a_100000210449_100016256065 [0,1,0,0,0,0|2,0,0]=3 2191 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cccnc2 11a_100000210453_100016256065 [0,1,0,0,0,0|2,0,0]=3 2192 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cccnc2 240690a_100000210453_100016256065 [0,1,0,0,0,0|2,0,0]=3 2193 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cccnn2 11a_100159270163_100016256065 [0,1,0,0,0,0|3,0,0]=4 2194 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cccnn2 240690a_100159270163_100016256065 [0,1,0,0,0,0|3,0,0]=4 2195 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccncc2 11a_100000210450_100016256065 [0,1,0,0,0,0|2,0,0]=3 2196 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccncc2 1626a_100000210450_100016256065 [0,1,0,0,0,0|2,0,0]=3 2197 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccncc2 240690a_100000210450_100016256065 [0,1,0,0,0,0|2,0,0]=3 2198 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccncn2 11a_100000736019_100016256065 [0,1,0,0,0,0|3,0,0]=4 2199 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccncn2 240690a_100000736019_100016256065 [0,1,0,0,0,0|3,0,0]=4 2200 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cnccn2 11a_100000737960_100016256065 [0,1,0,0,0,0|3,0,0]=4 2201 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cnccn2 240690a_100000737960_100016256065 [0,1,0,0,0,0|3,0,0]=4 2202 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cncnc2 11a_100011243677_100016256065 [0,1,0,0,0,0|3,0,0]=4 2203 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cncnc2 240690a_100011243677_100016256065 [0,1,0,0,0,0|3,0,0]=4 2204 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ncccn2 11a_100015189908_100016256065 [0,1,0,0,0,0|3,0,0]=4 2205 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ncccn2 240690a_100015189908_100016256065 [0,1,0,0,0,0|3,0,0]=4 2206 B20R2.6651 O=C(C=Cc1ccccc1F)NNc2ccccc2 22a_100015195140_100016256065 [0,1,0,0,0,0|2,0,0]=3 2207 B20R2.6651 O=C(C=Cc1ccccc1F)NNc2ccccn2 22a_100000183288_100016256065 [0,1,0,0,0,0|3,0,0]=4 2208 B20R2.6651 O=C(C=Cc1ccccc1F)NNc2cccnc2 22a_100000728903_100016256065 [0,1,0,0,0,0|3,0,0]=4 2209 B20R2.6651 O=C(C=Cc1ccccc1F)NNc2ccncc2 22a_100000698918_100016256065 [0,1,0,0,0,0|3,0,0]=4 2210 B20R2.6651 O=C(C=Cc1ccccc1O)CCc2ccccc2 1458a_100016263591_100000765856 [0,1,0,0,0,0|1,0,0]=2 2211 B20R2.6651 O=C(C=Cc1ccccc1O)CCc2ccccn2 1458a_100016263591_100015183660 [0,1,0,0,0,0|2,0,0]=3 2212 B20R2.6651 O=C(C=Cc1ccccc1O)CCc2cccnc2 1458a_100016263591_200011713674 [0,1,0,0,0,0|2,0,0]=3 2213 B20R2.6651 O=C(C=Cc1ccccc1O)CCc2ccncc2 1458a_100016263591_100000723409 [0,1,0,0,0,0|2,0,0]=3 2214 B20R2.6651 O=C(C=Cc1ccccc1O)NNc2ccccc2 22a_100015195140_100016263591 [0,1,0,0,0,0|2,0,0]=3 2215 B20R2.6651 O=C(C=Cc1ccccc1O)NNc2ccccn2 22a_100000183288_100016263591 [0,1,0,0,0,0|3,0,0]=4 2216 B20R2.6651 O=C(C=Cc1ccccc1O)NNc2cccnc2 22a_100000728903_100016263591 [0,1,0,0,0,0|3,0,0]=4 2217 B20R2.6651 O=C(C=Cc1ccccc1O)NNc2ccncc2 22a_100000698918_100016263591 [0,1,0,0,0,0|3,0,0]=4 2218 B20R2.6651 O=C(C=Cc1ccccn1)CCc2ccccc2Br 1458a_100000740811_100012161201 [0,1,0,0,0,0|2,0,0]=3 2219 B20R2.6651 O=C(C=Cc1ccccn1)CCc2ccccc2Cl 1458a_100000740811_100011713703 [0,1,0,0,0,0|2,0,0]=3 2220 B20R2.6651 O=C(C=Cc1ccccn1)CCc2ccccc2F 1458a_100000740811_100000720011 [0,1,0,0,0,0|2,0,0]=3 2221 B20R2.6651 O=C(C=Cc1ccccn1)CCc2ccccc2O 1458a_100000740811_100000722297 [0,1,0,0,0,0|2,0,0]=3 2222 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2Br 11a_100000689332_100000740811 [0,1,0,0,0,0|2,0,0]=3 2223 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2Br 240690a_100000689332_100000740811 [0,1,0,0,0,0|2,0,0]=3 2224 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2Cl 11a_100000174879_100000740811 [0,1,0,0,0,0|2,0,0]=3 2225 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2Cl 240690a_100000174879_100000740811 [0,1,0,0,0,0|2,0,0]=3 2226 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2F 11a_100000174869_100000740811 [0,1,0,0,0,0|2,0,0]=3 2227 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2F 240690a_100000174869_100000740811 [0,1,0,0,0,0|2,0,0]=3 2228 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2I 11a_100015347259_100000740811 [0,1,0,0,0,0|2,0,0]=3 2229 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2I 240690a_100015347259_100000740811 [0,1,0,0,0,0|2,0,0]=3 2230 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2O 240690a_100000185550_100000740811 [0,1,0,0,0,0|2,0,0]=3 2231 B20R2.6651 O=C(C=Cc1ccccn1)NCc2cccnc2Br 11a_100009818023_100000740811 [0,1,0,0,0,0|3,0,0]=4 2232 B20R2.6651 O=C(C=Cc1ccccn1)NCc2cccnc2Br 240690a_100009818023_100000740811 [0,1,0,0,0,0|3,0,0]=4 2233 B20R2.6651 O=C(C=Cc1ccccn1)NCc2cccnc2Cl 11a_100015189234_100000740811 [0,1,0,0,0,0|3,0,0]=4 2234 B20R2.6651 O=C(C=Cc1ccccn1)NCc2cccnc2Cl 240690a_100015189234_100000740811 [0,1,0,0,0,0|3,0,0]=4 2235 B20R2.6651 O=C(C=Cc1ccccn1)NCc2cccnc2F 11a_100000724633_100000740811 [0,1,0,0,0,0|3,0,0]=4 2236 B20R2.6651 O=C(C=Cc1ccccn1)NCc2cccnc2F 240690a_100000724633_100000740811 [0,1,0,0,0,0|3,0,0]=4 2237 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccncc2Br 11a_100020640021_100000740811 [0,1,0,0,0,0|3,0,0]=4 2238 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccncc2Br 240690a_100020640021_100000740811 [0,1,0,0,0,0|3,0,0]=4 2239 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccncc2F 11a_100011935246_100000740811 [0,1,0,0,0,0|3,0,0]=4 2240 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccncc2F 240690a_100011935246_100000740811 [0,1,0,0,0,0|3,0,0]=4 2241 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ncccc2Br 11a_100020591323_100000740811 [0,1,0,0,0,0|3,0,0]=4 2242 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ncccc2Br 240690a_100020591323_100000740811 [0,1,0,0,0,0|3,0,0]=4 2243 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ncccc2Cl 11a_100015189233_100000740811 [0,1,0,0,0,0|3,0,0]=4 2244 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ncccc2Cl 240690a_100015189233_100000740811 [0,1,0,0,0,0|3,0,0]=4 2245 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ncccc2F 11a_100000690088_100000740811 [0,1,0,0,0,0|3,0,0]=4 2246 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ncccc2F 240690a_100000690088_100000740811 [0,1,0,0,0,0|3,0,0]=4 2247 B20R2.6651 O=C(C=Cc1ccccn1)NNc2ccccc2Br 22a_100000241748_100000740811 [0,1,0,0,0,0|3,0,0]=4 2248 B20R2.6651 O=C(C=Cc1ccccn1)NNc2ccccc2Cl 22a_100000683529_100000740811 [0,1,0,0,0,0|3,0,0]=4 2249 B20R2.6651 O=C(C=Cc1ccccn1)NNc2ccccc2F 22a_100000239246_100000740811 [0,1,0,0,0,0|3,0,0]=4 2250 B20R2.6651 O=C(C=Cc1ccccn1)NNc2ccccc2I 22a_100011218156_100000740811 [0,1,0,0,0,0|3,0,0]=4 2251 B20R2.6651 O=C(C=Cc1cccnc1)CCc2ccccc2Br 1458a_100000735890_100012161201 [0,1,0,0,0,0|2,0,0]=3 2252 B20R2.6651 O=C(C=Cc1cccnc1)CCc2ccccc2Cl 1458a_100000735890_100011713703 [0,1,0,0,0,0|2,0,0]=3 2253 B20R2.6651 O=C(C=Cc1cccnc1)CCc2ccccc2F 1458a_100000735890_100000720011 [0,1,0,0,0,0|2,0,0]=3 2254 B20R2.6651 O=C(C=Cc1cccnc1)CCc2ccccc2O 1458a_100000735890_100000722297 [0,1,0,0,0,0|2,0,0]=3 2255 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2Br 11a_100000689332_100000735890 [0,1,0,0,0,0|2,0,0]=3 2256 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2Br 240690a_100000689332_100000735890 [0,1,0,0,0,0|2,0,0]=3 2257 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2Cl 11a_100000174879_100000735890 [0,1,0,0,0,0|2,0,0]=3 2258 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2Cl 240690a_100000174879_100000735890 [0,1,0,0,0,0|2,0,0]=3 2259 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2F 11a_100000174869_100000735890 [0,1,0,0,0,0|2,0,0]=3 2260 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2F 240690a_100000174869_100000735890 [0,1,0,0,0,0|2,0,0]=3 2261 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2I 11a_100015347259_100000735890 [0,1,0,0,0,0|2,0,0]=3 2262 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2I 240690a_100015347259_100000735890 [0,1,0,0,0,0|2,0,0]=3 2263 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2O 240690a_100000185550_100000735890 [0,1,0,0,0,0|2,0,0]=3 2264 B20R2.6651 O=C(C=Cc1cccnc1)NCc2cccnc2Br 11a_100009818023_100000735890 [0,1,0,0,0,0|3,0,0]=4 2265 B20R2.6651 O=C(C=Cc1cccnc1)NCc2cccnc2Br 240690a_100009818023_100000735890 [0,1,0,0,0,0|3,0,0]=4 2266 B20R2.6651 O=C(C=Cc1cccnc1)NCc2cccnc2Cl 11a_100015189234_100000735890 [0,1,0,0,0,0|3,0,0]=4 2267 B20R2.6651 O=C(C=Cc1cccnc1)NCc2cccnc2Cl 240690a_100015189234_100000735890 [0,1,0,0,0,0|3,0,0]=4 2268 B20R2.6651 O=C(C=Cc1cccnc1)NCc2cccnc2F 11a_100000724633_100000735890 [0,1,0,0,0,0|3,0,0]=4 2269 B20R2.6651 O=C(C=Cc1cccnc1)NCc2cccnc2F 240690a_100000724633_100000735890 [0,1,0,0,0,0|3,0,0]=4 2270 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccncc2Br 11a_100020640021_100000735890 [0,1,0,0,0,0|3,0,0]=4 2271 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccncc2Br 240690a_100020640021_100000735890 [0,1,0,0,0,0|3,0,0]=4 2272 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccncc2F 11a_100011935246_100000735890 [0,1,0,0,0,0|3,0,0]=4 2273 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccncc2F 240690a_100011935246_100000735890 [0,1,0,0,0,0|3,0,0]=4 2274 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ncccc2Br 11a_100020591323_100000735890 [0,1,0,0,0,0|3,0,0]=4 2275 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ncccc2Br 240690a_100020591323_100000735890 [0,1,0,0,0,0|3,0,0]=4 2276 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ncccc2Cl 11a_100015189233_100000735890 [0,1,0,0,0,0|3,0,0]=4 2277 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ncccc2Cl 240690a_100015189233_100000735890 [0,1,0,0,0,0|3,0,0]=4 2278 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ncccc2F 11a_100000690088_100000735890 [0,1,0,0,0,0|3,0,0]=4 2279 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ncccc2F 240690a_100000690088_100000735890 [0,1,0,0,0,0|3,0,0]=4 2280 B20R2.6651 O=C(C=Cc1cccnc1)NNc2ccccc2Br 22a_100000241748_100000735890 [0,1,0,0,0,0|3,0,0]=4 2281 B20R2.6651 O=C(C=Cc1cccnc1)NNc2ccccc2Cl 22a_100000683529_100000735890 [0,1,0,0,0,0|3,0,0]=4 2282 B20R2.6651 O=C(C=Cc1cccnc1)NNc2ccccc2F 22a_100000239246_100000735890 [0,1,0,0,0,0|3,0,0]=4 2283 B20R2.6651 O=C(C=Cc1cccnc1)NNc2ccccc2I 22a_100011218156_100000735890 [0,1,0,0,0,0|3,0,0]=4 2284 B20R2.6651 O=C(C=Cc1ccncc1)CCc2ccccc2Br 1458a_100000682801_100012161201 [0,1,0,0,0,0|2,0,0]=3 2285 B20R2.6651 O=C(C=Cc1ccncc1)CCc2ccccc2Cl 1458a_100000682801_100011713703 [0,1,0,0,0,0|2,0,0]=3 2286 B20R2.6651 O=C(C=Cc1ccncc1)CCc2ccccc2F 1458a_100000682801_100000720011 [0,1,0,0,0,0|2,0,0]=3 2287 B20R2.6651 O=C(C=Cc1ccncc1)CCc2ccccc2O 1458a_100000682801_100000722297 [0,1,0,0,0,0|2,0,0]=3 2288 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2Br 240690a_100000689332_100000682801 [0,1,0,0,0,0|2,0,0]=3 2289 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2Cl 240690a_100000174879_100000682801 [0,1,0,0,0,0|2,0,0]=3 2290 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2F 240690a_100000174869_100000682801 [0,1,0,0,0,0|2,0,0]=3 2291 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2I 240690a_100015347259_100000682801 [0,1,0,0,0,0|2,0,0]=3 2292 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2O 240690a_100000185550_100000682801 [0,1,0,0,0,0|2,0,0]=3 2293 B20R2.6651 O=C(C=Cc1ccncc1)NCc2cccnc2Br 240690a_100009818023_100000682801 [0,1,0,0,0,0|3,0,0]=4 2294 B20R2.6651 O=C(C=Cc1ccncc1)NCc2cccnc2Cl 240690a_100015189234_100000682801 [0,1,0,0,0,0|3,0,0]=4 2295 B20R2.6651 O=C(C=Cc1ccncc1)NCc2cccnc2F 240690a_100000724633_100000682801 [0,1,0,0,0,0|3,0,0]=4 2296 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccncc2Br 240690a_100020640021_100000682801 [0,1,0,0,0,0|3,0,0]=4 2297 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccncc2F 240690a_100011935246_100000682801 [0,1,0,0,0,0|3,0,0]=4 2298 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ncccc2Br 240690a_100020591323_100000682801 [0,1,0,0,0,0|3,0,0]=4 2299 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ncccc2Cl 240690a_100015189233_100000682801 [0,1,0,0,0,0|3,0,0]=4 2300 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ncccc2F 240690a_100000690088_100000682801 [0,1,0,0,0,0|3,0,0]=4 2301 B20R2.6651 O=C(C=Cc1ccncc1)NNc2ccccc2Br 22a_100000241748_100000682801 [0,1,0,0,0,0|3,0,0]=4 2302 B20R2.6651 O=C(C=Cc1ccncc1)NNc2ccccc2Cl 22a_100000683529_100000682801 [0,1,0,0,0,0|3,0,0]=4 2303 B20R2.6651 O=C(C=Cc1ccncc1)NNc2ccccc2F 22a_100000239246_100000682801 [0,1,0,0,0,0|3,0,0]=4 2304 B20R2.6651 O=C(C=Cc1ccncc1)NNc2ccccc2I 22a_100011218156_100000682801 [0,1,0,0,0,0|3,0,0]=4 2305 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2Br 1458a_100000185753_100012161201 [0,1,0,0,0,0|1,0,2]=4 2306 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2Br 1458a_100000740810_100000765856 [0,1,0,0,0,0|1,0,2]=4 2307 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2Cl 1458a_100000184300_100000765856 [0,1,0,0,0,0|1,0,2]=4 2308 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2Cl 1458a_100000185753_100011713703 [0,1,0,0,0,0|1,0,2]=4 2309 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2F 1458a_100000185753_100000720011 [0,1,0,0,0,0|1,0,2]=4 2310 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2F 1458a_100000189703_100000765856 [0,1,0,0,0,0|1,0,2]=4 2311 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2I 1458a_100000037306_100000765856 [0,1,0,0,0,0|1,0,2]=4 2312 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2O 1458a_100000181328_100000765856 [0,1,0,0,0,0|1,0,2]=4 2313 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2O 1458a_100000185753_100000722297 [0,1,0,0,0,0|1,0,2]=4 2314 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2Br 34a_100000210017_100012361361 [0,1,0,0,0,0|2,0,1]=4 2315 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2Cl 34a_100000185783_100012361361 [0,1,0,0,0,0|2,0,1]=4 2316 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2F 34a_100000210422_100012361361 [0,1,0,0,0,0|2,0,1]=4 2317 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2I 34a_100000210053_100012361361 [0,1,0,0,0,0|2,0,1]=4 2318 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2O 34a_100000185747_100012361361 [0,1,0,0,0,0|2,0,1]=4 2319 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Br 1458a_100000216496_100000765856 [0,1,0,0,0,0|2,0,1]=4 2320 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Br 34a_100000181306_100012361361 [0,1,0,0,0,0|2,0,1]=4 2321 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Br 7a_100000181306_100012361361 [0,1,0,0,0,0|2,0,1]=4 2322 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Cl 1458a_100000185159_100000765856 [0,1,0,0,0,0|2,0,1]=4 2323 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Cl 34a_100000210172_100012361361 [0,1,0,0,0,0|2,0,1]=4 2324 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Cl 7a_100000210172_100012361361 [0,1,0,0,0,0|2,0,1]=4 2325 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2F 1458a_100000182486_100000765856 [0,1,0,0,0,0|2,0,1]=4 2326 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2F 34a_100000210171_100012361361 [0,1,0,0,0,0|2,0,1]=4 2327 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2F 7a_100000210171_100012361361 [0,1,0,0,0,0|2,0,1]=4 2328 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2I 34a_100000739446_100012361361 [0,1,0,0,0,0|2,0,1]=4 2329 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2I 7a_100000739446_100012361361 [0,1,0,0,0,0|2,0,1]=4 2330 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2O 1458a_100000183020_100000765856 [0,1,0,0,0,0|2,0,1]=4 2331 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2Br 62a_100000695589_100012361361 [0,1,0,0,0,0|2,0,1]=4 2332 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2Br 62a_100012361361_100000695589 [0,1,0,0,0,0|2,0,1]=4 2333 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2Cl 62a_100000764095_100012361361 [0,1,0,0,0,0|2,0,1]=4 2334 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2Cl 62a_100012361361_100000764095 [0,1,0,0,0,0|2,0,1]=4 2335 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2F 1458a_100000179528_100000765856 [0,1,0,0,0,0|2,0,1]=4 2336 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2F 62a_100011215700_100012361361 [0,1,0,0,0,0|2,0,1]=4 2337 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2F 62a_100012361361_100011215700 [0,1,0,0,0,0|2,0,1]=4 2338 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2O 1458a_100000695322_100000765856 [0,1,0,0,0,0|2,0,1]=4 2339 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2O 62a_100000739446_100012361361 [0,1,0,0,0,0|2,0,1]=4 2340 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2O 62a_100012361361_100000739446 [0,1,0,0,0,0|2,0,1]=4 2341 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Br 11a_100000689332_100000185753 [0,1,0,0,0,0|1,0,2]=4 2342 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100000185753 [0,1,0,0,0,0|1,0,2]=4 2343 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Br 240690a_100000689332_100000185753 [0,1,0,0,0,0|1,0,2]=4 2344 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Br 527a_100000689332_100000185753 [0,1,0,0,0,0|1,0,2]=4 2345 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100000185753 [0,1,0,0,0,0|1,0,2]=4 2346 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100000185753 [0,1,0,0,0,0|1,0,2]=4 2347 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100000185753 [0,1,0,0,0,0|1,0,2]=4 2348 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Cl 527a_100000174879_100000185753 [0,1,0,0,0,0|1,0,2]=4 2349 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2F 11a_100000174869_100000185753 [0,1,0,0,0,0|1,0,2]=4 2350 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2F 1626a_100000174869_100000185753 [0,1,0,0,0,0|1,0,2]=4 2351 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2F 240690a_100000174869_100000185753 [0,1,0,0,0,0|1,0,2]=4 2352 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2F 527a_100000174869_100000185753 [0,1,0,0,0,0|1,0,2]=4 2353 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2I 11a_100015347259_100000185753 [0,1,0,0,0,0|1,0,2]=4 2354 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2I 1626a_100015347259_100000185753 [0,1,0,0,0,0|1,0,2]=4 2355 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2I 240690a_100015347259_100000185753 [0,1,0,0,0,0|1,0,2]=4 2356 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2I 527a_100015347259_100000185753 [0,1,0,0,0,0|1,0,2]=4 2357 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2O 240690a_100000185550_100000185753 [0,1,0,0,0,0|1,0,2]=4 2358 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2O 527a_100000185550_100000185753 [0,1,0,0,0,0|1,0,2]=4 2359 B20R2.6651 O=C(CCc1ccccc1)NNc2ccccc2Br 22a_100000241748_100000185753 [0,1,0,0,0,0|3,0,0]=4 2360 B20R2.6651 O=C(CCc1ccccc1)NNc2ccccc2Cl 22a_100000683529_100000185753 [0,1,0,0,0,0|3,0,0]=4 2361 B20R2.6651 O=C(CCc1ccccc1)NNc2ccccc2F 22a_100000239246_100000185753 [0,1,0,0,0,0|3,0,0]=4 2362 B20R2.6651 O=C(CCc1ccccc1)NNc2ccccc2I 22a_100011218156_100000185753 [0,1,0,0,0,0|3,0,0]=4 2363 B20R2.6651 O=C(CCc1ccccc1Br)COc2ccccc2 1458a_100000186222_100012161201 [0,1,0,0,0,0|2,0,1]=4 2364 B20R2.6651 O=C(CCc1ccccc1Br)CSc2ccccc2 1458a_100000211596_100012161201 [0,1,0,0,0,0|2,0,1]=4 2365 B20R2.6651 O=C(CCc1ccccc1Br)NCc2ccccc2 11a_100015324214_100000740810 [0,1,0,0,0,0|1,0,2]=4 2366 B20R2.6651 O=C(CCc1ccccc1Br)NCc2ccccc2 1626a_100015324214_100000740810 [0,1,0,0,0,0|1,0,2]=4 2367 B20R2.6651 O=C(CCc1ccccc1Br)NCc2ccccc2 240690a_100015324214_100000740810 [0,1,0,0,0,0|1,0,2]=4 2368 B20R2.6651 O=C(CCc1ccccc1Br)NCc2ccccc2 527a_100015324214_100000740810 [0,1,0,0,0,0|1,0,2]=4 2369 B20R2.6651 O=C(CCc1ccccc1Br)NNc2ccccc2 22a_100015195140_100000740810 [0,1,0,0,0,0|3,0,0]=4 2370 B20R2.6651 O=C(CCc1ccccc1Cl)COc2ccccc2 1458a_100000186222_100011713703 [0,1,0,0,0,0|2,0,1]=4 2371 B20R2.6651 O=C(CCc1ccccc1Cl)CSc2ccccc2 1458a_100000211596_100011713703 [0,1,0,0,0,0|2,0,1]=4 2372 B20R2.6651 O=C(CCc1ccccc1Cl)NCc2ccccc2 11a_100015324214_100000184300 [0,1,0,0,0,0|1,0,2]=4 2373 B20R2.6651 O=C(CCc1ccccc1Cl)NCc2ccccc2 1626a_100015324214_100000184300 [0,1,0,0,0,0|1,0,2]=4 2374 B20R2.6651 O=C(CCc1ccccc1Cl)NCc2ccccc2 240690a_100015324214_100000184300 [0,1,0,0,0,0|1,0,2]=4 2375 B20R2.6651 O=C(CCc1ccccc1Cl)NCc2ccccc2 527a_100015324214_100000184300 [0,1,0,0,0,0|1,0,2]=4 2376 B20R2.6651 O=C(CCc1ccccc1Cl)NNc2ccccc2 22a_100015195140_100000184300 [0,1,0,0,0,0|3,0,0]=4 2377 B20R2.6651 O=C(CCc1ccccc1F)COc2ccccc2 1458a_100000186222_100000720011 [0,1,0,0,0,0|2,0,1]=4 2378 B20R2.6651 O=C(CCc1ccccc1F)CSc2ccccc2 1458a_100000211596_100000720011 [0,1,0,0,0,0|2,0,1]=4 2379 B20R2.6651 O=C(CCc1ccccc1F)NCc2ccccc2 11a_100015324214_100000189703 [0,1,0,0,0,0|1,0,2]=4 2380 B20R2.6651 O=C(CCc1ccccc1F)NCc2ccccc2 1626a_100015324214_100000189703 [0,1,0,0,0,0|1,0,2]=4 2381 B20R2.6651 O=C(CCc1ccccc1F)NCc2ccccc2 240690a_100015324214_100000189703 [0,1,0,0,0,0|1,0,2]=4 2382 B20R2.6651 O=C(CCc1ccccc1F)NCc2ccccc2 527a_100015324214_100000189703 [0,1,0,0,0,0|1,0,2]=4 2383 B20R2.6651 O=C(CCc1ccccc1F)NNc2ccccc2 22a_100015195140_100000189703 [0,1,0,0,0,0|3,0,0]=4 2384 B20R2.6651 O=C(CCc1ccccc1I)NCc2ccccc2 11a_100015324214_100000037306 [0,1,0,0,0,0|1,0,2]=4 2385 B20R2.6651 O=C(CCc1ccccc1I)NCc2ccccc2 1626a_100015324214_100000037306 [0,1,0,0,0,0|1,0,2]=4 2386 B20R2.6651 O=C(CCc1ccccc1I)NCc2ccccc2 240690a_100015324214_100000037306 [0,1,0,0,0,0|1,0,2]=4 2387 B20R2.6651 O=C(CCc1ccccc1I)NCc2ccccc2 527a_100015324214_100000037306 [0,1,0,0,0,0|1,0,2]=4 2388 B20R2.6651 O=C(CCc1ccccc1I)NNc2ccccc2 22a_100015195140_100000037306 [0,1,0,0,0,0|3,0,0]=4 2389 B20R2.6651 O=C(CCc1ccccc1O)COc2ccccc2 1458a_100000186222_100000722297 [0,1,0,0,0,0|2,0,1]=4 2390 B20R2.6651 O=C(CCc1ccccc1O)CSc2ccccc2 1458a_100000211596_100000722297 [0,1,0,0,0,0|2,0,1]=4 2391 B20R2.6651 O=C(CCc1ccccc1O)NCc2ccccc2 11a_100015324214_100000181328 [0,1,0,0,0,0|1,0,2]=4 2392 B20R2.6651 O=C(CCc1ccccc1O)NCc2ccccc2 240690a_100015324214_100000181328 [0,1,0,0,0,0|1,0,2]=4 2393 B20R2.6651 O=C(CCc1ccccc1O)NCc2ccccc2 527a_100015324214_100000181328 [0,1,0,0,0,0|1,0,2]=4 2394 B20R2.6651 O=C(CCc1ccccc1O)NNc2ccccc2 22a_100015195140_100000181328 [0,1,0,0,0,0|3,0,0]=4 2395 B20R2.6651 O=C(CNc1ccccc1)NCc2ccccc2F 34a_100000106764_100000190583 [0,1,0,0,0,0|2,0,1]=4 2396 B20R2.6651 O=C(CNc1ccccc1Br)NCc2ccccc2 34a_100000210017_100000183539 [0,1,0,0,0,0|2,0,1]=4 2397 B20R2.6651 O=C(CNc1ccccc1Br)OCc2ccccc2 34a_100000210017_100000753625 [0,1,0,0,0,0|1,0,1]=3 2398 B20R2.6651 O=C(CNc1ccccc1Cl)NCc2ccccc2 34a_100000185783_100000183539 [0,1,0,0,0,0|2,0,1]=4 2399 B20R2.6651 O=C(CNc1ccccc1Cl)OCc2ccccc2 34a_100000185783_100000753625 [0,1,0,0,0,0|1,0,1]=3 2400 B20R2.6651 O=C(CNc1ccccc1F)NCc2ccccc2 34a_100000210422_100000183539 [0,1,0,0,0,0|2,0,1]=4 2401 B20R2.6651 O=C(CNc1ccccc1F)OCc2ccccc2 34a_100000210422_100000753625 [0,1,0,0,0,0|1,0,1]=3 2402 B20R2.6651 O=C(CNc1ccccc1I)NCc2ccccc2 34a_100000210053_100000183539 [0,1,0,0,0,0|2,0,1]=4 2403 B20R2.6651 O=C(CNc1ccccc1I)OCc2ccccc2 34a_100000210053_100000753625 [0,1,0,0,0,0|1,0,1]=3 2404 B20R2.6651 O=C(CNc1ccccc1O)NCc2ccccc2 34a_100000185747_100000183539 [0,1,0,0,0,0|2,0,1]=4 2405 B20R2.6651 O=C(CNc1ccccc1O)OCc2ccccc2 34a_100000185747_100000753625 [0,1,0,0,0,0|1,0,1]=3 2406 B20R2.6651 O=C(COc1cccc[n+]1[O-])OCc2ccccc2 7a_100000211761_100000753625 [0,1,0,0,0,0|2,0,1]=4 2407 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2Br 11a_100000689332_100000186222 [0,1,0,0,0,0|2,0,1]=4 2408 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100000186222 [0,1,0,0,0,0|2,0,1]=4 2409 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2Br 240690a_100000689332_100000186222 [0,1,0,0,0,0|2,0,1]=4 2410 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2Br 527a_100000689332_100000186222 [0,1,0,0,0,0|2,0,1]=4 2411 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100000186222 [0,1,0,0,0,0|2,0,1]=4 2412 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100000186222 [0,1,0,0,0,0|2,0,1]=4 2413 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100000186222 [0,1,0,0,0,0|2,0,1]=4 2414 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2Cl 527a_100000174879_100000186222 [0,1,0,0,0,0|2,0,1]=4 2415 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2F 11a_100000174869_100000186222 [0,1,0,0,0,0|2,0,1]=4 2416 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2F 1626a_100000174869_100000186222 [0,1,0,0,0,0|2,0,1]=4 2417 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2F 240690a_100000174869_100000186222 [0,1,0,0,0,0|2,0,1]=4 2418 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2F 34a_100000210340_100000190583 [0,1,0,0,0,0|2,0,1]=4 2419 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2F 527a_100000174869_100000186222 [0,1,0,0,0,0|2,0,1]=4 2420 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2F 7a_100000210340_100000190583 [0,1,0,0,0,0|2,0,1]=4 2421 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2I 11a_100015347259_100000186222 [0,1,0,0,0,0|2,0,1]=4 2422 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2I 1626a_100015347259_100000186222 [0,1,0,0,0,0|2,0,1]=4 2423 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2I 240690a_100015347259_100000186222 [0,1,0,0,0,0|2,0,1]=4 2424 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2I 527a_100015347259_100000186222 [0,1,0,0,0,0|2,0,1]=4 2425 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2O 240690a_100000185550_100000186222 [0,1,0,0,0,0|2,0,1]=4 2426 B20R2.6651 O=C(COc1ccccc1)NCc2ccccc2O 527a_100000185550_100000186222 [0,1,0,0,0,0|2,0,1]=4 2427 B20R2.6651 O=C(COc1ccccc1Br)NCc2ccccc2 11a_100015324214_100000216496 [0,1,0,0,0,0|2,0,1]=4 2428 B20R2.6651 O=C(COc1ccccc1Br)NCc2ccccc2 1626a_100015324214_100000216496 [0,1,0,0,0,0|2,0,1]=4 2429 B20R2.6651 O=C(COc1ccccc1Br)NCc2ccccc2 240690a_100015324214_100000216496 [0,1,0,0,0,0|2,0,1]=4 2430 B20R2.6651 O=C(COc1ccccc1Br)NCc2ccccc2 34a_100000181306_100000183539 [0,1,0,0,0,0|2,0,1]=4 2431 B20R2.6651 O=C(COc1ccccc1Br)NCc2ccccc2 527a_100015324214_100000216496 [0,1,0,0,0,0|2,0,1]=4 2432 B20R2.6651 O=C(COc1ccccc1Br)NCc2ccccc2 7a_100000181306_100000183539 [0,1,0,0,0,0|2,0,1]=4 2433 B20R2.6651 O=C(COc1ccccc1Br)OCc2ccccc2 34a_100000181306_100000753625 [0,1,0,0,0,0|1,0,1]=3 2434 B20R2.6651 O=C(COc1ccccc1Br)OCc2ccccc2 7a_100000181306_100000753625 [0,1,0,0,0,0|1,0,1]=3 2435 B20R2.6651 O=C(COc1ccccc1Cl)NCc2ccccc2 11a_100015324214_100000185159 [0,1,0,0,0,0|2,0,1]=4 2436 B20R2.6651 O=C(COc1ccccc1Cl)NCc2ccccc2 1626a_100015324214_100000185159 [0,1,0,0,0,0|2,0,1]=4 2437 B20R2.6651 O=C(COc1ccccc1Cl)NCc2ccccc2 240690a_100015324214_100000185159 [0,1,0,0,0,0|2,0,1]=4 2438 B20R2.6651 O=C(COc1ccccc1Cl)NCc2ccccc2 34a_100000210172_100000183539 [0,1,0,0,0,0|2,0,1]=4 2439 B20R2.6651 O=C(COc1ccccc1Cl)NCc2ccccc2 527a_100015324214_100000185159 [0,1,0,0,0,0|2,0,1]=4 2440 B20R2.6651 O=C(COc1ccccc1Cl)NCc2ccccc2 7a_100000210172_100000183539 [0,1,0,0,0,0|2,0,1]=4 2441 B20R2.6651 O=C(COc1ccccc1Cl)OCc2ccccc2 34a_100000210172_100000753625 [0,1,0,0,0,0|1,0,1]=3 2442 B20R2.6651 O=C(COc1ccccc1Cl)OCc2ccccc2 7a_100000210172_100000753625 [0,1,0,0,0,0|1,0,1]=3 2443 B20R2.6651 O=C(COc1ccccc1F)NCc2ccccc2 11a_100015324214_100000182486 [0,1,0,0,0,0|2,0,1]=4 2444 B20R2.6651 O=C(COc1ccccc1F)NCc2ccccc2 1626a_100015324214_100000182486 [0,1,0,0,0,0|2,0,1]=4 2445 B20R2.6651 O=C(COc1ccccc1F)NCc2ccccc2 240690a_100015324214_100000182486 [0,1,0,0,0,0|2,0,1]=4 2446 B20R2.6651 O=C(COc1ccccc1F)NCc2ccccc2 34a_100000210171_100000183539 [0,1,0,0,0,0|2,0,1]=4 2447 B20R2.6651 O=C(COc1ccccc1F)NCc2ccccc2 527a_100015324214_100000182486 [0,1,0,0,0,0|2,0,1]=4 2448 B20R2.6651 O=C(COc1ccccc1F)NCc2ccccc2 7a_100000210171_100000183539 [0,1,0,0,0,0|2,0,1]=4 2449 B20R2.6651 O=C(COc1ccccc1F)OCc2ccccc2 34a_100000210171_100000753625 [0,1,0,0,0,0|1,0,1]=3 2450 B20R2.6651 O=C(COc1ccccc1F)OCc2ccccc2 7a_100000210171_100000753625 [0,1,0,0,0,0|1,0,1]=3 2451 B20R2.6651 O=C(COc1ccccc1I)NCc2ccccc2 34a_100000739446_100000183539 [0,1,0,0,0,0|2,0,1]=4 2452 B20R2.6651 O=C(COc1ccccc1I)NCc2ccccc2 7a_100000739446_100000183539 [0,1,0,0,0,0|2,0,1]=4 2453 B20R2.6651 O=C(COc1ccccc1I)OCc2ccccc2 34a_100000739446_100000753625 [0,1,0,0,0,0|1,0,1]=3 2454 B20R2.6651 O=C(COc1ccccc1I)OCc2ccccc2 7a_100000739446_100000753625 [0,1,0,0,0,0|1,0,1]=3 2455 B20R2.6651 O=C(COc1ccccc1O)NCc2ccccc2 240690a_100015324214_100000183020 [0,1,0,0,0,0|2,0,1]=4 2456 B20R2.6651 O=C(COc1ccccc1O)NCc2ccccc2 527a_100015324214_100000183020 [0,1,0,0,0,0|2,0,1]=4 2457 B20R2.6651 O=C(COc1cccnc1Br)OCc2ccccc2 34a_100000744436_100000753625 [0,1,0,0,0,0|2,0,1]=4 2458 B20R2.6651 O=C(COc1cccnc1Br)OCc2ccccc2 7a_100000744436_100000753625 [0,1,0,0,0,0|2,0,1]=4 2459 B20R2.6651 O=C(COc1cccnc1Cl)OCc2ccccc2 34a_100000757616_100000753625 [0,1,0,0,0,0|2,0,1]=4 2460 B20R2.6651 O=C(COc1cccnc1Cl)OCc2ccccc2 7a_100000757616_100000753625 [0,1,0,0,0,0|2,0,1]=4 2461 B20R2.6651 O=C(COc1cccnc1F)OCc2ccccc2 34a_100000061740_100000753625 [0,1,0,0,0,0|2,0,1]=4 2462 B20R2.6651 O=C(COc1cccnc1F)OCc2ccccc2 7a_100000061740_100000753625 [0,1,0,0,0,0|2,0,1]=4 2463 B20R2.6651 O=C(COc1cccnc1I)OCc2ccccc2 34a_100000034122_100000753625 [0,1,0,0,0,0|2,0,1]=4 2464 B20R2.6651 O=C(COc1cccnc1I)OCc2ccccc2 7a_100000034122_100000753625 [0,1,0,0,0,0|2,0,1]=4 2465 B20R2.6651 O=C(COc1cccoc1=O)OCc2ccccc2 34a_100000077404_100000753625 [0,1,0,0,0,0|2,0,1]=4 2466 B20R2.6651 O=C(COc1cccoc1=O)OCc2ccccc2 7a_100000077404_100000753625 [0,1,0,0,0,0|2,0,1]=4 2467 B20R2.6651 O=C(COc1ccncc1Br)OCc2ccccc2 34a_100011996408_100000753625 [0,1,0,0,0,0|2,0,1]=4 2468 B20R2.6651 O=C(COc1ccncc1Cl)OCc2ccccc2 34a_100011997054_100000753625 [0,1,0,0,0,0|2,0,1]=4 2469 B20R2.6651 O=C(COc1ccncc1F)OCc2ccccc2 34a_200000081243_100000753625 [0,1,0,0,0,0|2,0,1]=4 2470 B20R2.6651 O=C(COc1cnccc1Cl)OCc2ccccc2 34a_100011996695_100000753625 [0,1,0,0,0,0|2,0,1]=4 2471 B20R2.6651 O=C(COc1cnccc1I)OCc2ccccc2 34a_100000050107_100000753625 [0,1,0,0,0,0|2,0,1]=4 2472 B20R2.6651 O=C(COc1coccc1=O)OCc2ccccc2 34a_100000060831_100000753625 [0,1,0,0,0,0|2,0,1]=4 2473 B20R2.6651 O=C(COc1ncccc1Cl)OCc2ccccc2 34a_100011290957_100000753625 [0,1,0,0,0,0|2,0,1]=4 2474 B20R2.6651 O=C(COc1ncccc1F)OCc2ccccc2 34a_100011219419_100000753625 [0,1,0,0,0,0|2,0,1]=4 2475 B20R2.6651 O=C(CSc1c[nH]ccc1=O)OCc2ccccc2 62a_100000753625_100009998708 [0,1,0,0,0,0|2,0,1]=4 2476 B20R2.6651 O=C(CSc1c[nH]ccc1=O)OCc2ccccc2 62a_100009998708_100000753625 [0,1,0,0,0,0|2,0,1]=4 2477 B20R2.6651 O=C(CSc1c[nH]ccc1=S)OCc2ccccc2 62a_100000753625_200012280681 [0,1,0,0,0,0|2,0,1]=4 2478 B20R2.6651 O=C(CSc1c[nH]ccc1=S)OCc2ccccc2 62a_200012280681_100000753625 [0,1,0,0,0,0|2,0,1]=4 2479 B20R2.6651 O=C(CSc1cccc[n+]1[O-])OCc2ccccc2 62a_100000753625_200000042595 [0,1,0,0,0,0|2,0,1]=4 2480 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2Br 11a_100000689332_100000211596 [0,1,0,0,0,0|2,0,1]=4 2481 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100000211596 [0,1,0,0,0,0|2,0,1]=4 2482 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2Br 240690a_100000689332_100000211596 [0,1,0,0,0,0|2,0,1]=4 2483 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2Br 527a_100000689332_100000211596 [0,1,0,0,0,0|2,0,1]=4 2484 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100000211596 [0,1,0,0,0,0|2,0,1]=4 2485 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100000211596 [0,1,0,0,0,0|2,0,1]=4 2486 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100000211596 [0,1,0,0,0,0|2,0,1]=4 2487 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2Cl 527a_100000174879_100000211596 [0,1,0,0,0,0|2,0,1]=4 2488 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2F 11a_100000174869_100000211596 [0,1,0,0,0,0|2,0,1]=4 2489 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2F 1626a_100000174869_100000211596 [0,1,0,0,0,0|2,0,1]=4 2490 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2F 240690a_100000174869_100000211596 [0,1,0,0,0,0|2,0,1]=4 2491 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2F 527a_100000174869_100000211596 [0,1,0,0,0,0|2,0,1]=4 2492 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2F 62a_100000190583_100000041952 [0,1,0,0,0,0|2,0,1]=4 2493 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2F 62a_100000719477_100000190583 [0,1,0,0,0,0|2,0,1]=4 2494 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2I 11a_100015347259_100000211596 [0,1,0,0,0,0|2,0,1]=4 2495 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2I 1626a_100015347259_100000211596 [0,1,0,0,0,0|2,0,1]=4 2496 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2I 240690a_100015347259_100000211596 [0,1,0,0,0,0|2,0,1]=4 2497 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2I 527a_100015347259_100000211596 [0,1,0,0,0,0|2,0,1]=4 2498 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2O 240690a_100000185550_100000211596 [0,1,0,0,0,0|2,0,1]=4 2499 B20R2.6651 O=C(CSc1ccccc1)NCc2ccccc2O 527a_100000185550_100000211596 [0,1,0,0,0,0|2,0,1]=4 2500 B20R2.6651 O=C(CSc1ccccc1Br)NCc2ccccc2 62a_100000183539_100000695589 [0,1,0,0,0,0|2,0,1]=4 2501 B20R2.6651 O=C(CSc1ccccc1Br)NCc2ccccc2 62a_100000695589_100000183539 [0,1,0,0,0,0|2,0,1]=4 2502 B20R2.6651 O=C(CSc1ccccc1Br)OCc2ccccc2 62a_100000695589_100000753625 [0,1,0,0,0,0|1,0,1]=3 2503 B20R2.6651 O=C(CSc1ccccc1Br)OCc2ccccc2 62a_100000753625_100000695589 [0,1,0,0,0,0|1,0,1]=3 2504 B20R2.6651 O=C(CSc1ccccc1Cl)NCc2ccccc2 62a_100000183539_100000764095 [0,1,0,0,0,0|2,0,1]=4 2505 B20R2.6651 O=C(CSc1ccccc1Cl)NCc2ccccc2 62a_100000764095_100000183539 [0,1,0,0,0,0|2,0,1]=4 2506 B20R2.6651 O=C(CSc1ccccc1Cl)OCc2ccccc2 62a_100000753625_100000764095 [0,1,0,0,0,0|1,0,1]=3 2507 B20R2.6651 O=C(CSc1ccccc1Cl)OCc2ccccc2 62a_100000764095_100000753625 [0,1,0,0,0,0|1,0,1]=3 2508 B20R2.6651 O=C(CSc1ccccc1F)NCc2ccccc2 11a_100015324214_100000179528 [0,1,0,0,0,0|2,0,1]=4 2509 B20R2.6651 O=C(CSc1ccccc1F)NCc2ccccc2 1626a_100015324214_100000179528 [0,1,0,0,0,0|2,0,1]=4 2510 B20R2.6651 O=C(CSc1ccccc1F)NCc2ccccc2 240690a_100015324214_100000179528 [0,1,0,0,0,0|2,0,1]=4 2511 B20R2.6651 O=C(CSc1ccccc1F)NCc2ccccc2 62a_100000183539_100011215700 [0,1,0,0,0,0|2,0,1]=4 2512 B20R2.6651 O=C(CSc1ccccc1F)NCc2ccccc2 62a_100011215700_100000183539 [0,1,0,0,0,0|2,0,1]=4 2513 B20R2.6651 O=C(CSc1ccccc1F)OCc2ccccc2 62a_100000753625_100011215700 [0,1,0,0,0,0|1,0,1]=3 2514 B20R2.6651 O=C(CSc1ccccc1F)OCc2ccccc2 62a_100011215700_100000753625 [0,1,0,0,0,0|1,0,1]=3 2515 B20R2.6651 O=C(CSc1ccccc1O)NCc2ccccc2 240690a_100015324214_100000695322 [0,1,0,0,0,0|2,0,1]=4 2516 B20R2.6651 O=C(CSc1ccccc1O)NCc2ccccc2 527a_100015324214_100000695322 [0,1,0,0,0,0|2,0,1]=4 2517 B20R2.6651 O=C(CSc1ccccc1O)NCc2ccccc2 62a_100000183539_100000739446 [0,1,0,0,0,0|2,0,1]=4 2518 B20R2.6651 O=C(CSc1ccccc1O)NCc2ccccc2 62a_100000739446_100000183539 [0,1,0,0,0,0|2,0,1]=4 2519 B20R2.6651 O=C(CSc1ccccc1O)OCc2ccccc2 62a_100000739446_100000753625 [0,1,0,0,0,0|1,0,1]=3 2520 B20R2.6651 O=C(CSc1ccccc1O)OCc2ccccc2 62a_100000753625_100000739446 [0,1,0,0,0,0|1,0,1]=3 2521 B20R2.6651 O=C(CSc1cccnc1Br)OCc2ccccc2 62a_100000753625_100010202626 [0,1,0,0,0,0|2,0,1]=4 2522 B20R2.6651 O=C(CSc1cccnc1Br)OCc2ccccc2 62a_100010202626_100000753625 [0,1,0,0,0,0|2,0,1]=4 2523 B20R2.6651 O=C(CSc1cccnc1Cl)OCc2ccccc2 62a_100000036424_100000753625 [0,1,0,0,0,0|2,0,1]=4 2524 B20R2.6651 O=C(CSc1cccnc1Cl)OCc2ccccc2 62a_100000753625_100000036424 [0,1,0,0,0,0|2,0,1]=4 2525 B20R2.6651 O=C(CSc1cccnc1F)OCc2ccccc2 62a_100000753625_100009816115 [0,1,0,0,0,0|2,0,1]=4 2526 B20R2.6651 O=C(CSc1cccnc1F)OCc2ccccc2 62a_100009816115_100000753625 [0,1,0,0,0,0|2,0,1]=4 2527 B20R2.6651 O=C(CSc1cccnc1O)OCc2ccccc2 62a_100000753625_100000760158 [0,1,0,0,0,0|2,0,1]=4 2528 B20R2.6651 O=C(CSc1cccnc1O)OCc2ccccc2 62a_100000760158_100000753625 [0,1,0,0,0,0|2,0,1]=4 2529 B20R2.6651 O=C(CSc1ccncc1Br)OCc2ccccc2 62a_100000726257_100000753625 [0,1,0,0,0,0|2,0,1]=4 2530 B20R2.6651 O=C(CSc1ccncc1Br)OCc2ccccc2 62a_100000753625_100000726257 [0,1,0,0,0,0|2,0,1]=4 2531 B20R2.6651 O=C(CSc1ccncc1Cl)OCc2ccccc2 62a_100000708259_100000753625 [0,1,0,0,0,0|2,0,1]=4 2532 B20R2.6651 O=C(CSc1ccncc1Cl)OCc2ccccc2 62a_100000753625_100000708259 [0,1,0,0,0,0|2,0,1]=4 2533 B20R2.6651 O=C(CSc1ccncc1F)OCc2ccccc2 62a_100000047030_100000753625 [0,1,0,0,0,0|2,0,1]=4 2534 B20R2.6651 O=C(CSc1ccncc1F)OCc2ccccc2 62a_100000753625_100000047030 [0,1,0,0,0,0|2,0,1]=4 2535 B20R2.6651 O=C(CSc1ccncc1O)OCc2ccccc2 62a_100000753625_100009817591 [0,1,0,0,0,0|2,0,1]=4 2536 B20R2.6651 O=C(CSc1ccncc1O)OCc2ccccc2 62a_100009817591_100000753625 [0,1,0,0,0,0|2,0,1]=4 2537 B20R2.6651 O=C(CSc1cnccc1Br)OCc2ccccc2 62a_100000753625_100010138639 [0,1,0,0,0,0|2,0,1]=4 2538 B20R2.6651 O=C(CSc1cnccc1Br)OCc2ccccc2 62a_100010138639_100000753625 [0,1,0,0,0,0|2,0,1]=4 2539 B20R2.6651 O=C(CSc1cnccc1Cl)OCc2ccccc2 62a_100000753625_100009995489 [0,1,0,0,0,0|2,0,1]=4 2540 B20R2.6651 O=C(CSc1cnccc1Cl)OCc2ccccc2 62a_100009995489_100000753625 [0,1,0,0,0,0|2,0,1]=4 2541 B20R2.6651 O=C(CSc1cnccc1F)OCc2ccccc2 62a_100000753625_100009820683 [0,1,0,0,0,0|2,0,1]=4 2542 B20R2.6651 O=C(CSc1cnccc1F)OCc2ccccc2 62a_100009820683_100000753625 [0,1,0,0,0,0|2,0,1]=4 2543 B20R2.6651 O=C(CSc1ncccc1Br)OCc2ccccc2 62a_100000696092_100000753625 [0,1,0,0,0,0|2,0,1]=4 2544 B20R2.6651 O=C(CSc1ncccc1Br)OCc2ccccc2 62a_100000753625_100000696092 [0,1,0,0,0,0|2,0,1]=4 2545 B20R2.6651 O=C(CSc1ncccc1Cl)OCc2ccccc2 62a_100000753625_100011356963 [0,1,0,0,0,0|2,0,1]=4 2546 B20R2.6651 O=C(CSc1ncccc1Cl)OCc2ccccc2 62a_100011356963_100000753625 [0,1,0,0,0,0|2,0,1]=4 2547 B20R2.6651 O=C(CSc1ncccc1F)OCc2ccccc2 62a_100000685392_100000753625 [0,1,0,0,0,0|2,0,1]=4 2548 B20R2.6651 O=C(CSc1ncccc1F)OCc2ccccc2 62a_100000753625_100000685392 [0,1,0,0,0,0|2,0,1]=4 2549 B20R2.6651 O=C(CSc1ncccc1O)OCc2ccccc2 62a_100000034122_100000753625 [0,1,0,0,0,0|2,0,1]=4 2550 B20R2.6651 O=C(CSc1ncccc1O)OCc2ccccc2 62a_100000753625_100000034122 [0,1,0,0,0,0|2,0,1]=4 2551 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Br 2708a_100000689332_100015324214 [0,1,0,0,0,0|2,0,1]=4 2552 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Br 2708a_100015324214_100000689332 [0,1,0,0,0,0|2,0,1]=4 2553 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Br 273464a_100000689332_100015324214 [0,1,0,0,0,0|2,0,1]=4 2554 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Br 273464a_100015324214_100000689332 [0,1,0,0,0,0|2,0,1]=4 2555 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Br 512a_100000689332_100015324214 [0,1,0,0,0,0|2,0,1]=4 2556 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Br 512a_100015324214_100000689332 [0,1,0,0,0,0|2,0,1]=4 2557 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Cl 2708a_100000174879_100015324214 [0,1,0,0,0,0|2,0,1]=4 2558 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Cl 2708a_100015324214_100000174879 [0,1,0,0,0,0|2,0,1]=4 2559 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Cl 273464a_100000174879_100015324214 [0,1,0,0,0,0|2,0,1]=4 2560 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Cl 273464a_100015324214_100000174879 [0,1,0,0,0,0|2,0,1]=4 2561 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2Cl 512a_100015324214_100000174879 [0,1,0,0,0,0|2,0,1]=4 2562 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2F 2708a_100000174869_100015324214 [0,1,0,0,0,0|2,0,1]=4 2563 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2F 2708a_100015324214_100000174869 [0,1,0,0,0,0|2,0,1]=4 2564 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2F 273464a_100000174869_100015324214 [0,1,0,0,0,0|2,0,1]=4 2565 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2F 273464a_100015324214_100000174869 [0,1,0,0,0,0|2,0,1]=4 2566 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2F 512a_100000174869_100015324214 [0,1,0,0,0,0|2,0,1]=4 2567 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2F 512a_100015324214_100000174869 [0,1,0,0,0,0|2,0,1]=4 2568 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2I 2708a_100015324214_100015347259 [0,1,0,0,0,0|2,0,1]=4 2569 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2I 2708a_100015347259_100015324214 [0,1,0,0,0,0|2,0,1]=4 2570 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2I 273464a_100015324214_100015347259 [0,1,0,0,0,0|2,0,1]=4 2571 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2I 273464a_100015347259_100015324214 [0,1,0,0,0,0|2,0,1]=4 2572 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2I 512a_100015324214_100015347259 [0,1,0,0,0,0|2,0,1]=4 2573 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2I 512a_100015347259_100015324214 [0,1,0,0,0,0|2,0,1]=4 2574 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2O 2708a_100000185550_100015324214 [0,1,0,0,0,0|2,0,1]=4 2575 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2O 2708a_100015324214_100000185550 [0,1,0,0,0,0|2,0,1]=4 2576 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2O 273464a_100000185550_100015324214 [0,1,0,0,0,0|2,0,1]=4 2577 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2O 273464a_100015324214_100000185550 [0,1,0,0,0,0|2,0,1]=4 2578 B20R2.6651 O=C(NCc1ccccc1)NCc2ccccc2O 512a_100000185550_100015324214 [0,1,0,0,0,0|2,0,1]=4 2579 B20R2.6651 O=C(NCc1ccccc1)NNc2ccccc2Br 273464a_100015324214_100000241748 [0,1,0,0,0,0|3,0,0]=4 2580 B20R2.6651 O=C(NCc1ccccc1)NNc2ccccc2Br 512a_100015324214_100000241748 [0,1,0,0,0,0|3,0,0]=4 2581 B20R2.6651 O=C(NCc1ccccc1)NNc2ccccc2Cl 273464a_100015324214_100000683529 [0,1,0,0,0,0|3,0,0]=4 2582 B20R2.6651 O=C(NCc1ccccc1)NNc2ccccc2Cl 512a_100015324214_100000683529 [0,1,0,0,0,0|3,0,0]=4 2583 B20R2.6651 O=C(NCc1ccccc1)NNc2ccccc2F 273464a_100015324214_100000239246 [0,1,0,0,0,0|3,0,0]=4 2584 B20R2.6651 O=C(NCc1ccccc1)NNc2ccccc2F 512a_100015324214_100000239246 [0,1,0,0,0,0|3,0,0]=4 2585 B20R2.6651 O=C(NCc1ccccc1)NNc2ccccc2I 273464a_100015324214_100011218156 [0,1,0,0,0,0|3,0,0]=4 2586 B20R2.6651 O=C(NCc1ccccc1)NNc2ccccc2I 512a_100015324214_100011218156 [0,1,0,0,0,0|3,0,0]=4 2587 B20R2.6651 O=C(NCc1ccccc1Br)NNc2ccccc2 273464a_100000689332_100015195140 [0,1,0,0,0,0|3,0,0]=4 2588 B20R2.6651 O=C(NCc1ccccc1Br)NNc2ccccc2 512a_100000689332_100015195140 [0,1,0,0,0,0|3,0,0]=4 2589 B20R2.6651 O=C(NCc1ccccc1Cl)NNc2ccccc2 273464a_100000174879_100015195140 [0,1,0,0,0,0|3,0,0]=4 2590 B20R2.6651 O=C(NCc1ccccc1F)NNc2ccccc2 273464a_100000174869_100015195140 [0,1,0,0,0,0|3,0,0]=4 2591 B20R2.6651 O=C(NCc1ccccc1F)NNc2ccccc2 512a_100000174869_100015195140 [0,1,0,0,0,0|3,0,0]=4 2592 B20R2.6651 O=C(NCc1ccccc1I)NNc2ccccc2 273464a_100015347259_100015195140 [0,1,0,0,0,0|3,0,0]=4 2593 B20R2.6651 O=C(NCc1ccccc1I)NNc2ccccc2 512a_100015347259_100015195140 [0,1,0,0,0,0|3,0,0]=4 2594 B20R2.6651 O=C(NCc1ccccc1O)NNc2ccccc2 273464a_100000185550_100015195140 [0,1,0,0,0,0|3,0,0]=4 2595 B20R2.6651 O=C(NCc1ccccc1O)NNc2ccccc2 512a_100000185550_100015195140 [0,1,0,0,0,0|3,0,0]=4 2596 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)CCc2ccccc2 1458a_100016990649_100000765856 [0,1,0,0,0,0|1,0,0]=2 2597 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)CCc2ccccn2 1458a_100016990649_100015183660 [0,1,0,0,0,0|2,0,0]=3 2598 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)CCc2cccnc2 1458a_100016990649_200011713674 [0,1,0,0,0,0|2,0,0]=3 2599 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)CCc2ccncc2 1458a_100016990649_100000723409 [0,1,0,0,0,0|2,0,0]=3 2600 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2 11a_100015324214_100016990649 [0,1,0,0,0,0|1,0,0]=2 2601 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2 1626a_100015324214_100016990649 [0,1,0,0,0,0|1,0,0]=2 2602 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2 527a_100015324214_100016990649 [0,1,0,0,0,0|1,0,0]=2 2603 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccccn2 11a_100000210449_100016990649 [0,1,0,0,0,0|2,0,0]=3 2604 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccccn2 1626a_100000210449_100016990649 [0,1,0,0,0,0|2,0,0]=3 2605 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccccn2 527a_100000210449_100016990649 [0,1,0,0,0,0|2,0,0]=3 2606 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2 11a_100000210453_100016990649 [0,1,0,0,0,0|2,0,0]=3 2607 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2 527a_100000210453_100016990649 [0,1,0,0,0,0|2,0,0]=3 2608 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2cccnn2 11a_100159270163_100016990649 [0,1,0,0,0,0|3,0,0]=4 2609 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2cccnn2 527a_100159270163_100016990649 [0,1,0,0,0,0|3,0,0]=4 2610 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2 11a_100000210450_100016990649 [0,1,0,0,0,0|2,0,0]=3 2611 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2 1626a_100000210450_100016990649 [0,1,0,0,0,0|2,0,0]=3 2612 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2 527a_100000210450_100016990649 [0,1,0,0,0,0|2,0,0]=3 2613 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccncn2 11a_100000736019_100016990649 [0,1,0,0,0,0|3,0,0]=4 2614 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ccncn2 527a_100000736019_100016990649 [0,1,0,0,0,0|3,0,0]=4 2615 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2cnccn2 11a_100000737960_100016990649 [0,1,0,0,0,0|3,0,0]=4 2616 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2cnccn2 527a_100000737960_100016990649 [0,1,0,0,0,0|3,0,0]=4 2617 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2cncnc2 11a_100011243677_100016990649 [0,1,0,0,0,0|3,0,0]=4 2618 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2cncnc2 527a_100011243677_100016990649 [0,1,0,0,0,0|3,0,0]=4 2619 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ncccn2 11a_100015189908_100016990649 [0,1,0,0,0,0|3,0,0]=4 2620 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NCc2ncccn2 527a_100015189908_100016990649 [0,1,0,0,0,0|3,0,0]=4 2621 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NNc2ccccc2 22a_100015195140_100016990649 [0,1,0,0,0,0|2,0,0]=3 2622 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NNc2ccccn2 22a_100000183288_100016990649 [0,1,0,0,0,0|3,0,0]=4 2623 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NNc2cccnc2 22a_100000728903_100016990649 [0,1,0,0,0,0|3,0,0]=4 2624 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)NNc2ccncc2 22a_100000698918_100016990649 [0,1,0,0,0,0|3,0,0]=4 2625 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)CCc2ccccc2 1458a_100025712827_100000765856 [0,1,0,0,0,0|2,0,0]=3 2626 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)CCc2ccccn2 1458a_100025712827_100015183660 [0,1,0,0,0,0|3,0,0]=4 2627 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)CCc2cccnc2 1458a_100025712827_200011713674 [0,1,0,0,0,0|3,0,0]=4 2628 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)CCc2ccncc2 1458a_100025712827_100000723409 [0,1,0,0,0,0|3,0,0]=4 2629 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2 11a_100015324214_100025712827 [0,1,0,0,0,0|2,0,0]=3 2630 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2 1626a_100015324214_100025712827 [0,1,0,0,0,0|2,0,0]=3 2631 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2 527a_100015324214_100025712827 [0,1,0,0,0,0|2,0,0]=3 2632 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccccn2 11a_100000210449_100025712827 [0,1,0,0,0,0|3,0,0]=4 2633 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccccn2 1626a_100000210449_100025712827 [0,1,0,0,0,0|3,0,0]=4 2634 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccccn2 527a_100000210449_100025712827 [0,1,0,0,0,0|3,0,0]=4 2635 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2cccnc2 11a_100000210453_100025712827 [0,1,0,0,0,0|3,0,0]=4 2636 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2cccnc2 527a_100000210453_100025712827 [0,1,0,0,0,0|3,0,0]=4 2637 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccncc2 11a_100000210450_100025712827 [0,1,0,0,0,0|3,0,0]=4 2638 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccncc2 1626a_100000210450_100025712827 [0,1,0,0,0,0|3,0,0]=4 2639 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NCc2ccncc2 527a_100000210450_100025712827 [0,1,0,0,0,0|3,0,0]=4 2640 B20R2.21590 C/C(=C\c1ccccn1)/C(=O)NNc2ccccc2 22a_100015195140_100025712827 [0,1,0,0,0,0|3,0,0]=4 2641 B20R2.21590 C=C(Cc1ccccc1)C(=O)NCc2ccccc2 11a_100015324214_100000066491 [0,1,0,0,0,0|1,0,1]=3 2642 B20R2.21590 C=C(Cc1ccccc1)C(=O)NCc2ccccc2 1626a_100015324214_100000066491 [0,1,0,0,0,0|1,0,1]=3 2643 B20R2.21590 C=C(Cc1ccccc1)C(=O)NCc2ccccn2 11a_100000210449_100000066491 [0,1,0,0,0,0|2,0,1]=4 2644 B20R2.21590 C=C(Cc1ccccc1)C(=O)NCc2ccccn2 1626a_100000210449_100000066491 [0,1,0,0,0,0|2,0,1]=4 2645 B20R2.21590 C=C(Cc1ccccc1)C(=O)NCc2cccnc2 11a_100000210453_100000066491 [0,1,0,0,0,0|2,0,1]=4 2646 B20R2.21590 C=C(Cc1ccccc1)C(=O)NCc2ccncc2 11a_100000210450_100000066491 [0,1,0,0,0,0|2,0,1]=4 2647 B20R2.21590 C=C(Cc1ccccc1)C(=O)NCc2ccncc2 1626a_100000210450_100000066491 [0,1,0,0,0,0|2,0,1]=4 2648 B20R2.21590 C=C(Cc1ccccc1)C(=O)NNc2ccccc2 22a_100015195140_100000066491 [0,1,0,0,0,0|2,0,1]=4 2649 B20R2.21590 CC(Cc1ccccc1)C(=O)C#Cc2ccccc2 1458a_100000736102_200011218536 [0,1,0,0,0,0|1,0,2]=4 2650 B20R2.21590 CC(Cc1ccccc1)C(=O)C=Cc2ccccc2 1458a_100000210462_200011218536 [0,1,0,0,0,0|1,0,0]=2 2651 B20R2.21590 CC(Cc1ccccc1)C(=O)C=Cc2ccccn2 1458a_100000740811_200011218536 [0,1,0,0,0,0|2,0,0]=3 2652 B20R2.21590 CC(Cc1ccccc1)C(=O)C=Cc2cccnc2 1458a_100000735890_200011218536 [0,1,0,0,0,0|2,0,0]=3 2653 B20R2.21590 CC(Cc1ccccc1)C(=O)C=Cc2ccncc2 1458a_100000682801_200011218536 [0,1,0,0,0,0|2,0,0]=3 2654 B20R2.21590 CC(Cc1ccccc1)C(=O)CCc2ccccc2 1458a_100000185753_200011218536 [0,1,0,0,0,0|1,0,2]=4 2655 B20R2.21590 CC(Cc1ccccc1)C(=O)CCc2ccccc2 1458a_100000754839_100000765856 [0,1,0,0,0,0|1,0,2]=4 2656 B20R2.21590 CC(Cc1ccccc1)C(=O)COc2ccccc2 1458a_100000186222_200011218536 [0,1,0,0,0,0|2,0,1]=4 2657 B20R2.21590 CC(Cc1ccccc1)C(=O)CSc2ccccc2 1458a_100000211596_200011218536 [0,1,0,0,0,0|2,0,1]=4 2658 B20R2.21590 CC(Cc1ccccc1)C(=O)NCc2ccccc2 11a_100015324214_100000754839 [0,1,0,0,0,0|1,0,2]=4 2659 B20R2.21590 CC(Cc1ccccc1)C(=O)NCc2ccccc2 1626a_100015324214_100000754839 [0,1,0,0,0,0|1,0,2]=4 2660 B20R2.21590 CC(Cc1ccccc1)C(=O)NCc2ccccc2 240690a_100015324214_100000754839 [0,1,0,0,0,0|1,0,2]=4 2661 B20R2.21590 CC(Cc1ccccc1)C(=O)NCc2ccccc2 527a_100015324214_100000754839 [0,1,0,0,0,0|1,0,2]=4 2662 B20R2.21590 CC(Cc1ccccc1)C(=O)NNc2ccccc2 22a_100015195140_100000754839 [0,1,0,0,0,0|3,0,0]=4 2663 B20R2.21590 CC(Nc1ccccc1)C(=O)NCc2ccccc2 34a_100000106764_200011934207 [0,1,0,0,0,0|2,0,1]=4 2664 B20R2.21590 CC(OCc1ccccc1)C(=O)Nc2ccccc2 34a_100000210790_100000183986 [0,1,0,0,0,0|2,0,1]=4 2665 B20R2.21590 CC(OCc1ccccc1)C(=O)Nc2ccccc2 7a_100000210790_100000183986 [0,1,0,0,0,0|2,0,1]=4 2666 B20R2.21590 CC(Oc1ccccc1)C(=O)CCc2ccccc2 1458a_100000188414_100000765856 [0,1,0,0,0,0|2,0,1]=4 2667 B20R2.21590 CC(Oc1ccccc1)C(=O)NCc2ccccc2 11a_100015324214_100000188414 [0,1,0,0,0,0|2,0,1]=4 2668 B20R2.21590 CC(Oc1ccccc1)C(=O)NCc2ccccc2 1626a_100015324214_100000188414 [0,1,0,0,0,0|2,0,1]=4 2669 B20R2.21590 CC(Oc1ccccc1)C(=O)NCc2ccccc2 240690a_100015324214_100000188414 [0,1,0,0,0,0|2,0,1]=4 2670 B20R2.21590 CC(Oc1ccccc1)C(=O)NCc2ccccc2 34a_100000210340_200011934207 [0,1,0,0,0,0|2,0,1]=4 2671 B20R2.21590 CC(Oc1ccccc1)C(=O)NCc2ccccc2 527a_100015324214_100000188414 [0,1,0,0,0,0|2,0,1]=4 2672 B20R2.21590 CC(Oc1ccccc1)C(=O)NCc2ccccc2 7a_100000210340_100000183842 [0,1,0,0,0,0|2,0,1]=4 2673 B20R2.21590 CC(Sc1ccccc1)C(=O)CCc2ccccc2 1458a_100000199063_100000765856 [0,1,0,0,0,0|2,0,1]=4 2674 B20R2.21590 CC(Sc1ccccc1)C(=O)NCc2ccccc2 11a_100015324214_100000199063 [0,1,0,0,0,0|2,0,1]=4 2675 B20R2.21590 CC(Sc1ccccc1)C(=O)NCc2ccccc2 1626a_100015324214_100000199063 [0,1,0,0,0,0|2,0,1]=4 2676 B20R2.21590 CC(Sc1ccccc1)C(=O)NCc2ccccc2 240690a_100015324214_100000199063 [0,1,0,0,0,0|2,0,1]=4 2677 B20R2.21590 CC(Sc1ccccc1)C(=O)NCc2ccccc2 527a_100015324214_100000199063 [0,1,0,0,0,0|2,0,1]=4 2678 B20R2.21590 CC(Sc1ccccc1)C(=O)NCc2ccccc2 62a_100000183842_100000041952 [0,1,0,0,0,0|2,0,1]=4 2679 B20R2.21590 CC(Sc1ccccc1)C(=O)NCc2ccccc2 62a_100000719477_100000183842 [0,1,0,0,0,0|2,0,1]=4 2680 B20R2.21590 CN(Cc1ccccc1)C(=O)C#Cc2ccccc2 240690a_100000186898_100000736102 [0,1,0,0,0,0|1,0,2]=4 2681 B20R2.21590 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2 11a_100000186898_100000210462 [0,1,0,0,0,0|1,0,0]=2 2682 B20R2.21590 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2 1626a_100000186898_100000210462 [0,1,0,0,0,0|1,0,0]=2 2683 B20R2.21590 CN(Cc1ccccc1)C(=O)C=Cc2ccccn2 11a_100000186898_100000740811 [0,1,0,0,0,0|2,0,0]=3 2684 B20R2.21590 CN(Cc1ccccc1)C(=O)C=Cc2ccccn2 240690a_100000186898_100000740811 [0,1,0,0,0,0|2,0,0]=3 2685 B20R2.21590 CN(Cc1ccccc1)C(=O)C=Cc2cccnc2 11a_100000186898_100000735890 [0,1,0,0,0,0|2,0,0]=3 2686 B20R2.21590 CN(Cc1ccccc1)C(=O)C=Cc2cccnc2 240690a_100000186898_100000735890 [0,1,0,0,0,0|2,0,0]=3 2687 B20R2.21590 CN(Cc1ccccc1)C(=O)C=Cc2ccncc2 240690a_100000186898_100000682801 [0,1,0,0,0,0|2,0,0]=3 2688 B20R2.21590 CN(Cc1ccccc1)C(=O)CCc2ccccc2 11a_100000186898_100000185753 [0,1,0,0,0,0|1,0,2]=4 2689 B20R2.21590 CN(Cc1ccccc1)C(=O)CCc2ccccc2 1626a_100000186898_100000185753 [0,1,0,0,0,0|1,0,2]=4 2690 B20R2.21590 CN(Cc1ccccc1)C(=O)CCc2ccccc2 240690a_100000186898_100000185753 [0,1,0,0,0,0|1,0,2]=4 2691 B20R2.21590 CN(Cc1ccccc1)C(=O)CCc2ccccc2 527a_100000186898_100000185753 [0,1,0,0,0,0|1,0,2]=4 2692 B20R2.21590 CN(Cc1ccccc1)C(=O)CNc2ccccc2 34a_100000106764_100000182870 [0,1,0,0,0,0|2,0,1]=4 2693 B20R2.21590 CN(Cc1ccccc1)C(=O)COc2ccccc2 11a_100000186898_100000186222 [0,1,0,0,0,0|2,0,1]=4 2694 B20R2.21590 CN(Cc1ccccc1)C(=O)COc2ccccc2 1626a_100000186898_100000186222 [0,1,0,0,0,0|2,0,1]=4 2695 B20R2.21590 CN(Cc1ccccc1)C(=O)COc2ccccc2 240690a_100000186898_100000186222 [0,1,0,0,0,0|2,0,1]=4 2696 B20R2.21590 CN(Cc1ccccc1)C(=O)COc2ccccc2 34a_100000210340_100000182870 [0,1,0,0,0,0|2,0,1]=4 2697 B20R2.21590 CN(Cc1ccccc1)C(=O)COc2ccccc2 527a_100000186898_100000186222 [0,1,0,0,0,0|2,0,1]=4 2698 B20R2.21590 CN(Cc1ccccc1)C(=O)COc2ccccc2 7a_100000210340_100000182870 [0,1,0,0,0,0|2,0,1]=4 2699 B20R2.21590 CN(Cc1ccccc1)C(=O)CSc2ccccc2 11a_100000186898_100000211596 [0,1,0,0,0,0|2,0,1]=4 2700 B20R2.21590 CN(Cc1ccccc1)C(=O)CSc2ccccc2 1626a_100000186898_100000211596 [0,1,0,0,0,0|2,0,1]=4 2701 B20R2.21590 CN(Cc1ccccc1)C(=O)CSc2ccccc2 240690a_100000186898_100000211596 [0,1,0,0,0,0|2,0,1]=4 2702 B20R2.21590 CN(Cc1ccccc1)C(=O)CSc2ccccc2 527a_100000186898_100000211596 [0,1,0,0,0,0|2,0,1]=4 2703 B20R2.21590 CN(Cc1ccccc1)C(=O)CSc2ccccc2 62a_100000182870_100000041952 [0,1,0,0,0,0|2,0,1]=4 2704 B20R2.21590 CN(Cc1ccccc1)C(=O)CSc2ccccc2 62a_100000719477_100000182870 [0,1,0,0,0,0|2,0,1]=4 2705 B20R2.21590 CN(Cc1ccccc1)C(=O)NCc2ccccc2 2708a_100015324214_100000186898 [0,1,0,0,0,0|2,0,1]=4 2706 B20R2.21590 CN(Cc1ccccc1)C(=O)NCc2ccccc2 273464a_100015324214_100000186898 [0,1,0,0,0,0|2,0,1]=4 2707 B20R2.21590 CN(Cc1ccccn1)C(=O)C=Cc2ccccc2 11a_100000207498_100000210462 [0,1,0,0,0,0|2,0,0]=3 2708 B20R2.21590 CN(Cc1ccccn1)C(=O)C=Cc2ccccn2 11a_100000207498_100000740811 [0,1,0,0,0,0|3,0,0]=4 2709 B20R2.21590 CN(Cc1ccccn1)C(=O)C=Cc2ccccn2 240690a_100000207498_100000740811 [0,1,0,0,0,0|3,0,0]=4 2710 B20R2.21590 CN(Cc1ccccn1)C(=O)C=Cc2cccnc2 11a_100000207498_100000735890 [0,1,0,0,0,0|3,0,0]=4 2711 B20R2.21590 CN(Cc1ccccn1)C(=O)C=Cc2cccnc2 240690a_100000207498_100000735890 [0,1,0,0,0,0|3,0,0]=4 2712 B20R2.21590 CN(Cc1ccccn1)C(=O)C=Cc2ccncc2 240690a_100000207498_100000682801 [0,1,0,0,0,0|3,0,0]=4 2713 B20R2.21590 CN(Cc1cccnc1)C(=O)C=Cc2ccccc2 11a_100000184577_100000210462 [0,1,0,0,0,0|2,0,0]=3 2714 B20R2.21590 CN(Cc1cccnc1)C(=O)C=Cc2ccccn2 11a_100000184577_100000740811 [0,1,0,0,0,0|3,0,0]=4 2715 B20R2.21590 CN(Cc1cccnc1)C(=O)C=Cc2ccccn2 240690a_100000184577_100000740811 [0,1,0,0,0,0|3,0,0]=4 2716 B20R2.21590 CN(Cc1cccnc1)C(=O)C=Cc2cccnc2 11a_100000184577_100000735890 [0,1,0,0,0,0|3,0,0]=4 2717 B20R2.21590 CN(Cc1cccnc1)C(=O)C=Cc2cccnc2 240690a_100000184577_100000735890 [0,1,0,0,0,0|3,0,0]=4 2718 B20R2.21590 CN(Cc1cccnc1)C(=O)C=Cc2ccncc2 240690a_100000184577_100000682801 [0,1,0,0,0,0|3,0,0]=4 2719 B20R2.21590 CN(Cc1ccncc1)C(=O)C=Cc2ccccc2 11a_100000187231_100000210462 [0,1,0,0,0,0|2,0,0]=3 2720 B20R2.21590 CN(Cc1ccncc1)C(=O)C=Cc2ccccn2 11a_100000187231_100000740811 [0,1,0,0,0,0|3,0,0]=4 2721 B20R2.21590 CN(Cc1ccncc1)C(=O)C=Cc2ccccn2 240690a_100000187231_100000740811 [0,1,0,0,0,0|3,0,0]=4 2722 B20R2.21590 CN(Cc1ccncc1)C(=O)C=Cc2cccnc2 11a_100000187231_100000735890 [0,1,0,0,0,0|3,0,0]=4 2723 B20R2.21590 CN(Cc1ccncc1)C(=O)C=Cc2cccnc2 240690a_100000187231_100000735890 [0,1,0,0,0,0|3,0,0]=4 2724 B20R2.21590 CN(Cc1ccncc1)C(=O)C=Cc2ccncc2 240690a_100000187231_100000682801 [0,1,0,0,0,0|3,0,0]=4 2725 B20R2.21590 CN(Cc1cnccn1)C(=O)C=Cc2ccccc2 11a_100011269079_100000210462 [0,1,0,0,0,0|3,0,0]=4 2726 B20R2.21590 CN(Cc1ncccn1)C(=O)C=Cc2ccccc2 11a_100025716638_100000210462 [0,1,0,0,0,0|3,0,0]=4 2727 B20R2.21590 C[C@H](OCc1ccccc1)C(=O)Cc2ccccc2 1458a_100000703211_100015291786 [0,1,0,0,0,0|1,0,2]=4 2728 B20R2.21590 C[C@H](OCc1ccccc1)C(=O)Nc2ccccc2 11a_100000106764_100000703211 [0,1,0,0,0,0|2,0,1]=4 2729 B20R2.21590 C[C@H](OCc1ccccc1)C(=O)Nc2ccccc2 1626a_100000106764_100000703211 [0,1,0,0,0,0|2,0,1]=4 2730 B20R2.21590 C[C@H](OCc1ccccc1)C(=O)Nc2ccccc2 22a_100000106764_100000703211 [0,1,0,0,0,0|2,0,1]=4 2731 B20R2.21590 C[C@H](OCc1ccccc1)C(=O)Nc2ccccc2 527a_100000106764_100000703211 [0,1,0,0,0,0|2,0,1]=4 2732 B20R2.21590 O=C(CCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000765856 [0,1,0,0,0,0|1,0,0]=2 2733 B20R2.21590 O=C(CCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000765856 [0,1,0,0,0,0|1,0,0]=2 2734 B20R2.21590 O=C(CCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000765856 [0,1,0,0,0,0|2,0,0]=3 2735 B20R2.21590 O=C(CCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000765856 [0,1,0,0,0,0|2,0,0]=3 2736 B20R2.21590 O=C(CCc1ccccc1)[C@H](O)Cc2ccccc2 1458a_100009816399_100000765856 [0,1,0,0,0,0|1,0,2]=4 2737 B20R2.21590 O=C(CCc1ccccn1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100015183660 [0,1,0,0,0,0|2,0,0]=3 2738 B20R2.21590 O=C(CCc1ccccn1)/C(=C\c2ccccc2)/F 1458a_100020889036_100015183660 [0,1,0,0,0,0|2,0,0]=3 2739 B20R2.21590 O=C(CCc1ccccn1)C(=Cc2cccnc2)F 1458a_100000731744_100015183660 [0,1,0,0,0,0|3,0,0]=4 2740 B20R2.21590 O=C(CCc1ccccn1)C(=O)Nc2ccccc2 1458a_100000738435_100015183660 [0,1,0,0,0,0|3,0,0]=4 2741 B20R2.21590 O=C(CCc1cccnc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200011713674 [0,1,0,0,0,0|2,0,0]=3 2742 B20R2.21590 O=C(CCc1cccnc1)/C(=C\c2ccccc2)/F 1458a_100020889036_200011713674 [0,1,0,0,0,0|2,0,0]=3 2743 B20R2.21590 O=C(CCc1cccnc1)C(=Cc2cccnc2)F 1458a_100000731744_200011713674 [0,1,0,0,0,0|3,0,0]=4 2744 B20R2.21590 O=C(CCc1cccnc1)C(=O)Nc2ccccc2 1458a_100000738435_200011713674 [0,1,0,0,0,0|3,0,0]=4 2745 B20R2.21590 O=C(CCc1ccncc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000723409 [0,1,0,0,0,0|2,0,0]=3 2746 B20R2.21590 O=C(CCc1ccncc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000723409 [0,1,0,0,0,0|2,0,0]=3 2747 B20R2.21590 O=C(CCc1ccncc1)C(=Cc2cccnc2)F 1458a_100000731744_100000723409 [0,1,0,0,0,0|3,0,0]=4 2748 B20R2.21590 O=C(CCc1ccncc1)C(=O)Nc2ccccc2 1458a_100000738435_100000723409 [0,1,0,0,0,0|3,0,0]=4 2749 B20R2.21590 O=C(NCc1ccccc1)/C(=C/c2ccccc2)/Cl 11a_100015324214_200020598536 [0,1,0,0,0,0|1,0,0]=2 2750 B20R2.21590 O=C(NCc1ccccc1)/C(=C/c2ccccc2)/Cl 1626a_100015324214_200020598536 [0,1,0,0,0,0|1,0,0]=2 2751 B20R2.21590 O=C(NCc1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100015324214_200020598536 [0,1,0,0,0,0|1,0,0]=2 2752 B20R2.21590 O=C(NCc1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100015324214_200020598536 [0,1,0,0,0,0|1,0,0]=2 2753 B20R2.21590 O=C(NCc1ccccc1)/C(=C\c2ccccc2)/F 11a_100015324214_100020889036 [0,1,0,0,0,0|1,0,0]=2 2754 B20R2.21590 O=C(NCc1ccccc1)/C(=C\c2ccccc2)/F 527a_100015324214_100020889036 [0,1,0,0,0,0|1,0,0]=2 2755 B20R2.21590 O=C(NCc1ccccc1)C(=Cc2cccnc2)F 11a_100015324214_100000731744 [0,1,0,0,0,0|2,0,0]=3 2756 B20R2.21590 O=C(NCc1ccccc1)C(=Cc2cccnc2)F 240690a_100015324214_100000731744 [0,1,0,0,0,0|2,0,0]=3 2757 B20R2.21590 O=C(NCc1ccccc1)C(=Cc2cccnc2)F 527a_100015324214_100000731744 [0,1,0,0,0,0|2,0,0]=3 2758 B20R2.21590 O=C(NCc1ccccc1)C(=O)Nc2ccccc2 240690a_100015324214_100000738435 [0,1,0,0,0,0|2,0,0]=3 2759 B20R2.21590 O=C(NCc1ccccc1)[C@H](O)Cc2ccccc2 240690a_100015324214_100009816399 [0,1,0,0,0,0|1,0,2]=4 2760 B20R2.21590 O=C(NCc1ccccn1)/C(=C/c2ccccc2)/Cl 11a_100000210449_200020598536 [0,1,0,0,0,0|2,0,0]=3 2761 B20R2.21590 O=C(NCc1ccccn1)/C(=C/c2ccccc2)/Cl 1626a_100000210449_200020598536 [0,1,0,0,0,0|2,0,0]=3 2762 B20R2.21590 O=C(NCc1ccccn1)/C(=C/c2ccccc2)/Cl 240690a_100000210449_200020598536 [0,1,0,0,0,0|2,0,0]=3 2763 B20R2.21590 O=C(NCc1ccccn1)/C(=C/c2ccccc2)/Cl 527a_100000210449_200020598536 [0,1,0,0,0,0|2,0,0]=3 2764 B20R2.21590 O=C(NCc1ccccn1)/C(=C\c2ccccc2)/F 11a_100000210449_100020889036 [0,1,0,0,0,0|2,0,0]=3 2765 B20R2.21590 O=C(NCc1ccccn1)/C(=C\c2ccccc2)/F 527a_100000210449_100020889036 [0,1,0,0,0,0|2,0,0]=3 2766 B20R2.21590 O=C(NCc1ccccn1)C(=Cc2cccnc2)F 11a_100000210449_100000731744 [0,1,0,0,0,0|3,0,0]=4 2767 B20R2.21590 O=C(NCc1ccccn1)C(=Cc2cccnc2)F 240690a_100000210449_100000731744 [0,1,0,0,0,0|3,0,0]=4 2768 B20R2.21590 O=C(NCc1ccccn1)C(=Cc2cccnc2)F 527a_100000210449_100000731744 [0,1,0,0,0,0|3,0,0]=4 2769 B20R2.21590 O=C(NCc1ccccn1)C(=O)Nc2ccccc2 240690a_100000210449_100000738435 [0,1,0,0,0,0|3,0,0]=4 2770 B20R2.21590 O=C(NCc1cccnc1)/C(=C/c2ccccc2)/Cl 11a_100000210453_200020598536 [0,1,0,0,0,0|2,0,0]=3 2771 B20R2.21590 O=C(NCc1cccnc1)/C(=C/c2ccccc2)/Cl 240690a_100000210453_200020598536 [0,1,0,0,0,0|2,0,0]=3 2772 B20R2.21590 O=C(NCc1cccnc1)/C(=C/c2ccccc2)/Cl 527a_100000210453_200020598536 [0,1,0,0,0,0|2,0,0]=3 2773 B20R2.21590 O=C(NCc1cccnc1)/C(=C\c2ccccc2)/F 11a_100000210453_100020889036 [0,1,0,0,0,0|2,0,0]=3 2774 B20R2.21590 O=C(NCc1cccnc1)/C(=C\c2ccccc2)/F 527a_100000210453_100020889036 [0,1,0,0,0,0|2,0,0]=3 2775 B20R2.21590 O=C(NCc1cccnc1)C(=Cc2cccnc2)F 11a_100000210453_100000731744 [0,1,0,0,0,0|3,0,0]=4 2776 B20R2.21590 O=C(NCc1cccnc1)C(=Cc2cccnc2)F 240690a_100000210453_100000731744 [0,1,0,0,0,0|3,0,0]=4 2777 B20R2.21590 O=C(NCc1cccnc1)C(=Cc2cccnc2)F 527a_100000210453_100000731744 [0,1,0,0,0,0|3,0,0]=4 2778 B20R2.21590 O=C(NCc1cccnc1)C(=O)Nc2ccccc2 240690a_100000210453_100000738435 [0,1,0,0,0,0|3,0,0]=4 2779 B20R2.21590 O=C(NCc1cccnn1)/C(=C/c2ccccc2)/Cl 11a_100159270163_200020598536 [0,1,0,0,0,0|3,0,0]=4 2780 B20R2.21590 O=C(NCc1cccnn1)/C(=C/c2ccccc2)/Cl 240690a_100159270163_200020598536 [0,1,0,0,0,0|3,0,0]=4 2781 B20R2.21590 O=C(NCc1cccnn1)/C(=C/c2ccccc2)/Cl 527a_100159270163_200020598536 [0,1,0,0,0,0|3,0,0]=4 2782 B20R2.21590 O=C(NCc1cccnn1)/C(=C\c2ccccc2)/F 11a_100159270163_100020889036 [0,1,0,0,0,0|3,0,0]=4 2783 B20R2.21590 O=C(NCc1cccnn1)/C(=C\c2ccccc2)/F 527a_100159270163_100020889036 [0,1,0,0,0,0|3,0,0]=4 2784 B20R2.21590 O=C(NCc1ccncc1)/C(=C/c2ccccc2)/Cl 11a_100000210450_200020598536 [0,1,0,0,0,0|2,0,0]=3 2785 B20R2.21590 O=C(NCc1ccncc1)/C(=C/c2ccccc2)/Cl 1626a_100000210450_200020598536 [0,1,0,0,0,0|2,0,0]=3 2786 B20R2.21590 O=C(NCc1ccncc1)/C(=C/c2ccccc2)/Cl 240690a_100000210450_200020598536 [0,1,0,0,0,0|2,0,0]=3 2787 B20R2.21590 O=C(NCc1ccncc1)/C(=C/c2ccccc2)/Cl 527a_100000210450_200020598536 [0,1,0,0,0,0|2,0,0]=3 2788 B20R2.21590 O=C(NCc1ccncc1)/C(=C\c2ccccc2)/F 11a_100000210450_100020889036 [0,1,0,0,0,0|2,0,0]=3 2789 B20R2.21590 O=C(NCc1ccncc1)/C(=C\c2ccccc2)/F 527a_100000210450_100020889036 [0,1,0,0,0,0|2,0,0]=3 2790 B20R2.21590 O=C(NCc1ccncc1)C(=Cc2cccnc2)F 11a_100000210450_100000731744 [0,1,0,0,0,0|3,0,0]=4 2791 B20R2.21590 O=C(NCc1ccncc1)C(=Cc2cccnc2)F 240690a_100000210450_100000731744 [0,1,0,0,0,0|3,0,0]=4 2792 B20R2.21590 O=C(NCc1ccncc1)C(=Cc2cccnc2)F 527a_100000210450_100000731744 [0,1,0,0,0,0|3,0,0]=4 2793 B20R2.21590 O=C(NCc1ccncc1)C(=O)Nc2ccccc2 240690a_100000210450_100000738435 [0,1,0,0,0,0|3,0,0]=4 2794 B20R2.21590 O=C(NCc1ccncn1)/C(=C/c2ccccc2)/Cl 11a_100000736019_200020598536 [0,1,0,0,0,0|3,0,0]=4 2795 B20R2.21590 O=C(NCc1ccncn1)/C(=C/c2ccccc2)/Cl 240690a_100000736019_200020598536 [0,1,0,0,0,0|3,0,0]=4 2796 B20R2.21590 O=C(NCc1ccncn1)/C(=C/c2ccccc2)/Cl 527a_100000736019_200020598536 [0,1,0,0,0,0|3,0,0]=4 2797 B20R2.21590 O=C(NCc1ccncn1)/C(=C\c2ccccc2)/F 11a_100000736019_100020889036 [0,1,0,0,0,0|3,0,0]=4 2798 B20R2.21590 O=C(NCc1ccncn1)/C(=C\c2ccccc2)/F 527a_100000736019_100020889036 [0,1,0,0,0,0|3,0,0]=4 2799 B20R2.21590 O=C(NCc1cnccn1)/C(=C/c2ccccc2)/Cl 11a_100000737960_200020598536 [0,1,0,0,0,0|3,0,0]=4 2800 B20R2.21590 O=C(NCc1cnccn1)/C(=C/c2ccccc2)/Cl 240690a_100000737960_200020598536 [0,1,0,0,0,0|3,0,0]=4 2801 B20R2.21590 O=C(NCc1cnccn1)/C(=C/c2ccccc2)/Cl 527a_100000737960_200020598536 [0,1,0,0,0,0|3,0,0]=4 2802 B20R2.21590 O=C(NCc1cnccn1)/C(=C\c2ccccc2)/F 11a_100000737960_100020889036 [0,1,0,0,0,0|3,0,0]=4 2803 B20R2.21590 O=C(NCc1cnccn1)/C(=C\c2ccccc2)/F 527a_100000737960_100020889036 [0,1,0,0,0,0|3,0,0]=4 2804 B20R2.21590 O=C(NCc1cncnc1)/C(=C/c2ccccc2)/Cl 11a_100011243677_200020598536 [0,1,0,0,0,0|3,0,0]=4 2805 B20R2.21590 O=C(NCc1cncnc1)/C(=C/c2ccccc2)/Cl 240690a_100011243677_200020598536 [0,1,0,0,0,0|3,0,0]=4 2806 B20R2.21590 O=C(NCc1cncnc1)/C(=C/c2ccccc2)/Cl 527a_100011243677_200020598536 [0,1,0,0,0,0|3,0,0]=4 2807 B20R2.21590 O=C(NCc1cncnc1)/C(=C\c2ccccc2)/F 11a_100011243677_100020889036 [0,1,0,0,0,0|3,0,0]=4 2808 B20R2.21590 O=C(NCc1cncnc1)/C(=C\c2ccccc2)/F 527a_100011243677_100020889036 [0,1,0,0,0,0|3,0,0]=4 2809 B20R2.21590 O=C(NCc1ncccn1)/C(=C/c2ccccc2)/Cl 11a_100015189908_200020598536 [0,1,0,0,0,0|3,0,0]=4 2810 B20R2.21590 O=C(NCc1ncccn1)/C(=C/c2ccccc2)/Cl 240690a_100015189908_200020598536 [0,1,0,0,0,0|3,0,0]=4 2811 B20R2.21590 O=C(NCc1ncccn1)/C(=C/c2ccccc2)/Cl 527a_100015189908_200020598536 [0,1,0,0,0,0|3,0,0]=4 2812 B20R2.21590 O=C(NCc1ncccn1)/C(=C\c2ccccc2)/F 11a_100015189908_100020889036 [0,1,0,0,0,0|3,0,0]=4 2813 B20R2.21590 O=C(NCc1ncccn1)/C(=C\c2ccccc2)/F 527a_100015189908_100020889036 [0,1,0,0,0,0|3,0,0]=4 2814 B20R2.21590 O=C(NNc1ccccc1)/C(=C/c2ccccc2)/Cl 22a_100015195140_200020598536 [0,1,0,0,0,0|2,0,0]=3 2815 B20R2.21590 O=C(NNc1ccccc1)/C(=C\c2ccccc2)/F 22a_100015195140_100020889036 [0,1,0,0,0,0|2,0,0]=3 2816 B20R2.21590 O=C(NNc1ccccc1)C(=Cc2cccnc2)F 22a_100015195140_100000731744 [0,1,0,0,0,0|3,0,0]=4 2817 B20R2.21590 O=C(NNc1ccccc1)C(=O)Nc2ccccc2 22a_100015195140_100000738435 [0,1,0,0,0,0|3,0,0]=4 2818 B20R2.21590 O=C(NNc1ccccc1)[C@H](O)Cc2ccccc2 22a_100015195140_100009816399 [0,1,0,0,0,0|3,0,0]=4 2819 B20R2.21590 O=C(NNc1ccccn1)/C(=C/c2ccccc2)/Cl 22a_100000183288_200020598536 [0,1,0,0,0,0|3,0,0]=4 2820 B20R2.21590 O=C(NNc1ccccn1)/C(=C\c2ccccc2)/F 22a_100000183288_100020889036 [0,1,0,0,0,0|3,0,0]=4 2821 B20R2.21590 O=C(NNc1cccnc1)/C(=C/c2ccccc2)/Cl 22a_100000728903_200020598536 [0,1,0,0,0,0|3,0,0]=4 2822 B20R2.21590 O=C(NNc1cccnc1)/C(=C\c2ccccc2)/F 22a_100000728903_100020889036 [0,1,0,0,0,0|3,0,0]=4 2823 B20R2.21590 O=C(NNc1ccncc1)/C(=C/c2ccccc2)/Cl 22a_100000698918_200020598536 [0,1,0,0,0,0|3,0,0]=4 2824 B20R2.21590 O=C(NNc1ccncc1)/C(=C\c2ccccc2)/F 22a_100000698918_100020889036 [0,1,0,0,0,0|3,0,0]=4 2825 B20R2.21590 O=C(OCc1ccccc1)C(F)Nc2ccccc2 34a_100000106764_100000036447 [0,1,0,0,0,0|1,0,1]=3 2826 B20R2.21590 O=C(OCc1ccccc1)C(F)Oc2ccccc2 34a_100000210340_100000036447 [0,1,0,0,0,0|1,0,1]=3 2827 B20R2.21590 O=C(OCc1ccccc1)C(F)Oc2ccccc2 7a_100000210340_100000036447 [0,1,0,0,0,0|1,0,1]=3 2828 B20R2.21590 O=C(OCc1ccccc1)C(F)Oc2cccnc2 34a_100000210849_100000036447 [0,1,0,0,0,0|2,0,1]=4 2829 B20R2.21590 O=C(OCc1ccccc1)C(F)Oc2cccnc2 7a_100000210849_100000036447 [0,1,0,0,0,0|2,0,1]=4 2830 B20R2.21590 O=C(OCc1ccccc1)C(F)Oc2ccncc2 34a_100000212176_100000036447 [0,1,0,0,0,0|2,0,1]=4 2831 B20R2.21590 O=C(OCc1ccccc1)C(F)Sc2ccccc2 62a_100000036447_100000041952 [0,1,0,0,0,0|1,0,1]=3 2832 B20R2.21590 O=C(OCc1ccccc1)C(F)Sc2ccccc2 62a_100000719477_100000036447 [0,1,0,0,0,0|1,0,1]=3 2833 B20R2.21590 O=C(OCc1ccccc1)C(F)Sc2ccccn2 62a_100000036447_100011216584 [0,1,0,0,0,0|2,0,1]=4 2834 B20R2.21590 O=C(OCc1ccccc1)C(F)Sc2ccccn2 62a_100011216584_100000036447 [0,1,0,0,0,0|2,0,1]=4 2835 B20R2.21590 O=C(OCc1ccccc1)C(F)Sc2cccnc2 62a_100000036447_100000210063 [0,1,0,0,0,0|2,0,1]=4 2836 B20R2.21590 O=C(OCc1ccccc1)C(F)Sc2cccnc2 62a_100000210063_100000036447 [0,1,0,0,0,0|2,0,1]=4 2837 B20R2.21590 O=C(OCc1ccccc1)C(F)Sc2ccncc2 62a_100000036447_100000728582 [0,1,0,0,0,0|2,0,1]=4 2838 B20R2.21590 O=C(OCc1ccccc1)C(F)Sc2ccncc2 62a_100000728582_100000036447 [0,1,0,0,0,0|2,0,1]=4 2839 B20R2.21596 CC(=CC(=O)CCc1ccccc1)c2ccccc2 1458a_100000743005_100000765856 [0,1,0,0,0,0|1,0,0]=2 2840 B20R2.21596 CC(=CC(=O)CCc1ccccn1)c2ccccc2 1458a_100000743005_100015183660 [0,1,0,0,0,0|2,0,0]=3 2841 B20R2.21596 CC(=CC(=O)CCc1cccnc1)c2ccccc2 1458a_100000743005_200011713674 [0,1,0,0,0,0|2,0,0]=3 2842 B20R2.21596 CC(=CC(=O)CCc1ccncc1)c2ccccc2 1458a_100000743005_100000723409 [0,1,0,0,0,0|2,0,0]=3 2843 B20R2.21596 CC(=CC(=O)NCc1ccccc1)c2ccccc2 11a_100015324214_100000743005 [0,1,0,0,0,0|1,0,0]=2 2844 B20R2.21596 CC(=CC(=O)NCc1ccccc1)c2ccccc2 1626a_100015324214_100000743005 [0,1,0,0,0,0|1,0,0]=2 2845 B20R2.21596 CC(=CC(=O)NCc1ccccc1)c2ccccc2 240690a_100015324214_100000743005 [0,1,0,0,0,0|1,0,0]=2 2846 B20R2.21596 CC(=CC(=O)NCc1ccccc1)c2ccccc2 527a_100015324214_100000743005 [0,1,0,0,0,0|1,0,0]=2 2847 B20R2.21596 CC(=CC(=O)NCc1ccccn1)c2ccccc2 11a_100000210449_100000743005 [0,1,0,0,0,0|2,0,0]=3 2848 B20R2.21596 CC(=CC(=O)NCc1ccccn1)c2ccccc2 1626a_100000210449_100000743005 [0,1,0,0,0,0|2,0,0]=3 2849 B20R2.21596 CC(=CC(=O)NCc1ccccn1)c2ccccc2 240690a_100000210449_100000743005 [0,1,0,0,0,0|2,0,0]=3 2850 B20R2.21596 CC(=CC(=O)NCc1ccccn1)c2ccccc2 527a_100000210449_100000743005 [0,1,0,0,0,0|2,0,0]=3 2851 B20R2.21596 CC(=CC(=O)NCc1cccnc1)c2ccccc2 11a_100000210453_100000743005 [0,1,0,0,0,0|2,0,0]=3 2852 B20R2.21596 CC(=CC(=O)NCc1cccnc1)c2ccccc2 240690a_100000210453_100000743005 [0,1,0,0,0,0|2,0,0]=3 2853 B20R2.21596 CC(=CC(=O)NCc1cccnc1)c2ccccc2 527a_100000210453_100000743005 [0,1,0,0,0,0|2,0,0]=3 2854 B20R2.21596 CC(=CC(=O)NCc1cccnn1)c2ccccc2 11a_100159270163_100000743005 [0,1,0,0,0,0|3,0,0]=4 2855 B20R2.21596 CC(=CC(=O)NCc1cccnn1)c2ccccc2 240690a_100159270163_100000743005 [0,1,0,0,0,0|3,0,0]=4 2856 B20R2.21596 CC(=CC(=O)NCc1cccnn1)c2ccccc2 527a_100159270163_100000743005 [0,1,0,0,0,0|3,0,0]=4 2857 B20R2.21596 CC(=CC(=O)NCc1ccncc1)c2ccccc2 11a_100000210450_100000743005 [0,1,0,0,0,0|2,0,0]=3 2858 B20R2.21596 CC(=CC(=O)NCc1ccncc1)c2ccccc2 1626a_100000210450_100000743005 [0,1,0,0,0,0|2,0,0]=3 2859 B20R2.21596 CC(=CC(=O)NCc1ccncc1)c2ccccc2 240690a_100000210450_100000743005 [0,1,0,0,0,0|2,0,0]=3 2860 B20R2.21596 CC(=CC(=O)NCc1ccncc1)c2ccccc2 527a_100000210450_100000743005 [0,1,0,0,0,0|2,0,0]=3 2861 B20R2.21596 CC(=CC(=O)NCc1ccncn1)c2ccccc2 11a_100000736019_100000743005 [0,1,0,0,0,0|3,0,0]=4 2862 B20R2.21596 CC(=CC(=O)NCc1ccncn1)c2ccccc2 240690a_100000736019_100000743005 [0,1,0,0,0,0|3,0,0]=4 2863 B20R2.21596 CC(=CC(=O)NCc1ccncn1)c2ccccc2 527a_100000736019_100000743005 [0,1,0,0,0,0|3,0,0]=4 2864 B20R2.21596 CC(=CC(=O)NCc1cnccn1)c2ccccc2 11a_100000737960_100000743005 [0,1,0,0,0,0|3,0,0]=4 2865 B20R2.21596 CC(=CC(=O)NCc1cnccn1)c2ccccc2 240690a_100000737960_100000743005 [0,1,0,0,0,0|3,0,0]=4 2866 B20R2.21596 CC(=CC(=O)NCc1cnccn1)c2ccccc2 527a_100000737960_100000743005 [0,1,0,0,0,0|3,0,0]=4 2867 B20R2.21596 CC(=CC(=O)NCc1cncnc1)c2ccccc2 11a_100011243677_100000743005 [0,1,0,0,0,0|3,0,0]=4 2868 B20R2.21596 CC(=CC(=O)NCc1cncnc1)c2ccccc2 240690a_100011243677_100000743005 [0,1,0,0,0,0|3,0,0]=4 2869 B20R2.21596 CC(=CC(=O)NCc1cncnc1)c2ccccc2 527a_100011243677_100000743005 [0,1,0,0,0,0|3,0,0]=4 2870 B20R2.21596 CC(=CC(=O)NCc1ncccn1)c2ccccc2 11a_100015189908_100000743005 [0,1,0,0,0,0|3,0,0]=4 2871 B20R2.21596 CC(=CC(=O)NCc1ncccn1)c2ccccc2 240690a_100015189908_100000743005 [0,1,0,0,0,0|3,0,0]=4 2872 B20R2.21596 CC(=CC(=O)NCc1ncccn1)c2ccccc2 527a_100015189908_100000743005 [0,1,0,0,0,0|3,0,0]=4 2873 B20R2.21596 CC(=CC(=O)NNc1ccccc1)c2ccccc2 22a_100015195140_100000743005 [0,1,0,0,0,0|2,0,0]=3 2874 B20R2.21596 CC(=CC(=O)NNc1ccccn1)c2ccccc2 22a_100000183288_100000743005 [0,1,0,0,0,0|3,0,0]=4 2875 B20R2.21596 CC(=CC(=O)NNc1cccnc1)c2ccccc2 22a_100000728903_100000743005 [0,1,0,0,0,0|3,0,0]=4 2876 B20R2.21596 CC(=CC(=O)NNc1ccncc1)c2ccccc2 22a_100000698918_100000743005 [0,1,0,0,0,0|3,0,0]=4 2877 B20R2.21596 CC(CC(=O)C#Cc1ccccc1)c2ccccc2 1458a_100000736102_100000756946 [0,1,0,0,0,0|1,0,2]=4 2878 B20R2.21596 CC(CC(=O)C=Cc1ccccc1)c2ccccc2 1458a_100000210462_100000756946 [0,1,0,0,0,0|1,0,0]=2 2879 B20R2.21596 CC(CC(=O)C=Cc1ccccn1)c2ccccc2 1458a_100000740811_100000756946 [0,1,0,0,0,0|2,0,0]=3 2880 B20R2.21596 CC(CC(=O)C=Cc1cccnc1)c2ccccc2 1458a_100000735890_100000756946 [0,1,0,0,0,0|2,0,0]=3 2881 B20R2.21596 CC(CC(=O)C=Cc1ccncc1)c2ccccc2 1458a_100000682801_100000756946 [0,1,0,0,0,0|2,0,0]=3 2882 B20R2.21596 CC(CC(=O)CCc1ccccc1)c2ccccc2 1458a_100000183687_100000765856 [0,1,0,0,0,0|1,0,2]=4 2883 B20R2.21596 CC(CC(=O)CCc1ccccc1)c2ccccc2 1458a_100000185753_100000756946 [0,1,0,0,0,0|1,0,2]=4 2884 B20R2.21596 CC(CC(=O)COc1ccccc1)c2ccccc2 1458a_100000186222_100000756946 [0,1,0,0,0,0|2,0,1]=4 2885 B20R2.21596 CC(CC(=O)CSc1ccccc1)c2ccccc2 1458a_100000211596_100000756946 [0,1,0,0,0,0|2,0,1]=4 2886 B20R2.21596 CC(CC(=O)NCc1ccccc1)c2ccccc2 11a_100015324214_100000183687 [0,1,0,0,0,0|1,0,2]=4 2887 B20R2.21596 CC(CC(=O)NCc1ccccc1)c2ccccc2 1626a_100015324214_100000183687 [0,1,0,0,0,0|1,0,2]=4 2888 B20R2.21596 CC(CC(=O)NCc1ccccc1)c2ccccc2 240690a_100015324214_100000183687 [0,1,0,0,0,0|1,0,2]=4 2889 B20R2.21596 CC(CC(=O)NCc1ccccc1)c2ccccc2 527a_100015324214_100000183687 [0,1,0,0,0,0|1,0,2]=4 2890 B20R2.21596 CC(CC(=O)NNc1ccccc1)c2ccccc2 22a_100015195140_100000183687 [0,1,0,0,0,0|3,0,0]=4 2891 B20R2.21596 CC(NC(=O)C=Cc1ccccc1)c2ccccn2 11a_100000181244_100000210462 [0,1,0,0,0,0|2,0,0]=3 2892 B20R2.21596 CC(NC(=O)C=Cc1ccccc1)c2ccccn2 1626a_100000181244_100000210462 [0,1,0,0,0,0|2,0,0]=3 2893 B20R2.21596 CC(NC(=O)C=Cc1ccccc1)c2cccnc2 11a_100000195435_100000210462 [0,1,0,0,0,0|2,0,0]=3 2894 B20R2.21596 CC(NC(=O)C=Cc1ccccc1)c2ncccn2 11a_100020641698_100000210462 [0,1,0,0,0,0|3,0,0]=4 2895 B20R2.21596 CC(NC(=O)C=Cc1ccccc1)c2ncccn2 1626a_100020641698_100000210462 [0,1,0,0,0,0|3,0,0]=4 2896 B20R2.21596 CC(NC(=O)C=Cc1ccccn1)c2ccccn2 11a_100000181244_100000740811 [0,1,0,0,0,0|3,0,0]=4 2897 B20R2.21596 CC(NC(=O)C=Cc1ccccn1)c2ccccn2 240690a_100000181244_100000740811 [0,1,0,0,0,0|3,0,0]=4 2898 B20R2.21596 CC(NC(=O)C=Cc1ccccn1)c2cccnc2 11a_100000195435_100000740811 [0,1,0,0,0,0|3,0,0]=4 2899 B20R2.21596 CC(NC(=O)C=Cc1ccccn1)c2cccnc2 240690a_100000195435_100000740811 [0,1,0,0,0,0|3,0,0]=4 2900 B20R2.21596 CC(NC(=O)C=Cc1ccccn1)c2ccncc2 240690a_100000181269_100000740811 [0,1,0,0,0,0|3,0,0]=4 2901 B20R2.21596 CC(NC(=O)C=Cc1cccnc1)c2ccccn2 11a_100000181244_100000735890 [0,1,0,0,0,0|3,0,0]=4 2902 B20R2.21596 CC(NC(=O)C=Cc1cccnc1)c2ccccn2 240690a_100000181244_100000735890 [0,1,0,0,0,0|3,0,0]=4 2903 B20R2.21596 CC(NC(=O)C=Cc1cccnc1)c2cccnc2 11a_100000195435_100000735890 [0,1,0,0,0,0|3,0,0]=4 2904 B20R2.21596 CC(NC(=O)C=Cc1cccnc1)c2cccnc2 240690a_100000195435_100000735890 [0,1,0,0,0,0|3,0,0]=4 2905 B20R2.21596 CC(NC(=O)C=Cc1cccnc1)c2ccncc2 240690a_100000181269_100000735890 [0,1,0,0,0,0|3,0,0]=4 2906 B20R2.21596 CC(NC(=O)C=Cc1ccncc1)c2ccccn2 240690a_100000181244_100000682801 [0,1,0,0,0,0|3,0,0]=4 2907 B20R2.21596 CC(NC(=O)C=Cc1ccncc1)c2cccnc2 240690a_100000195435_100000682801 [0,1,0,0,0,0|3,0,0]=4 2908 B20R2.21596 CC(NC(=O)C=Cc1ccncc1)c2ccncc2 240690a_100000181269_100000682801 [0,1,0,0,0,0|3,0,0]=4 2909 B20R2.21596 CC(NC(=O)CNc1ccccc1)c2ccccc2 34a_100000106764_200000243715 [0,1,0,0,0,0|2,0,1]=4 2910 B20R2.21596 CC(NC(=O)COc1ccccc1)c2ccccc2 34a_100000210340_200000243715 [0,1,0,0,0,0|2,0,1]=4 2911 B20R2.21596 CC(NC(=O)COc1ccccc1)c2ccccc2 7a_100000210340_200000243715 [0,1,0,0,0,0|2,0,1]=4 2912 B20R2.21596 CC(NC(=O)CSc1ccccc1)c2ccccc2 62a_100000719477_200000243715 [0,1,0,0,0,0|2,0,1]=4 2913 B20R2.21596 CC(NC(=O)CSc1ccccc1)c2ccccc2 62a_200000243715_100000041952 [0,1,0,0,0,0|2,0,1]=4 2914 B20R2.21596 CN(CC(=O)CCc1ccccc1)c2ccccc2 1458a_100000745425_100000765856 [0,1,0,0,0,0|2,0,1]=4 2915 B20R2.21596 CN(CC(=O)CCc1ccccc1)c2ccccc2 2230a_100000210012_100012361361 [0,1,0,0,0,0|2,0,1]=4 2916 B20R2.21596 CN(CC(=O)CCc1ccccc1)c2ccccc2 269982a_100000210012_100012361361 [0,1,0,0,0,0|2,0,1]=4 2917 B20R2.21596 CN(CC(=O)CCc1ccccc1)c2ccccc2 34a_100000210012_100012361361 [0,1,0,0,0,0|2,0,1]=4 2918 B20R2.21596 CN(CC(=O)NCc1ccccc1)c2ccccc2 2230a_100000210012_100000183539 [0,1,0,0,0,0|2,0,1]=4 2919 B20R2.21596 CN(CC(=O)NCc1ccccc1)c2ccccc2 240690a_100015324214_100000745425 [0,1,0,0,0,0|2,0,1]=4 2920 B20R2.21596 CN(CC(=O)NCc1ccccc1)c2ccccc2 269982a_100000210012_100000183539 [0,1,0,0,0,0|2,0,1]=4 2921 B20R2.21596 CN(CC(=O)NCc1ccccc1)c2ccccc2 34a_100000210012_100000183539 [0,1,0,0,0,0|2,0,1]=4 2922 B20R2.21596 CN(CC(=O)NCc1ccccc1)c2ccccc2 527a_100015324214_100000745425 [0,1,0,0,0,0|2,0,1]=4 2923 B20R2.21596 CN(CC(=O)OCc1ccccc1)c2ccccc2 2230a_100000210012_100000753625 [0,1,0,0,0,0|1,0,1]=3 2924 B20R2.21596 CN(CC(=O)OCc1ccccc1)c2ccccc2 269982a_100000210012_100000753625 [0,1,0,0,0,0|1,0,1]=3 2925 B20R2.21596 CN(CC(=O)OCc1ccccc1)c2ccccc2 34a_100000210012_100000753625 [0,1,0,0,0,0|1,0,1]=3 2926 B20R2.21596 C[C@@H](NC(=O)C#Cc1ccccc1)c2ccccc2 240690a_100000751104_100000736102 [0,1,0,0,0,0|1,0,2]=4 2927 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccccc2 11a_100000751104_100000210462 [0,1,0,0,0,0|1,0,0]=2 2928 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccccc2 1626a_100000751104_100000210462 [0,1,0,0,0,0|1,0,0]=2 2929 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccc1)c2cnccn2 11a_100020589798_100000210462 [0,1,0,0,0,0|3,0,0]=4 2930 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccccc2 11a_100000751104_100000740811 [0,1,0,0,0,0|2,0,0]=3 2931 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100000751104_100000740811 [0,1,0,0,0,0|2,0,0]=3 2932 B20R2.21596 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccccc2 11a_100000751104_100000735890 [0,1,0,0,0,0|2,0,0]=3 2933 B20R2.21596 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100000751104_100000735890 [0,1,0,0,0,0|2,0,0]=3 2934 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100000751104_100000682801 [0,1,0,0,0,0|2,0,0]=3 2935 B20R2.21596 C[C@@H](NC(=O)CCc1ccccc1)c2ccccc2 11a_100000751104_100000185753 [0,1,0,0,0,0|1,0,2]=4 2936 B20R2.21596 C[C@@H](NC(=O)CCc1ccccc1)c2ccccc2 1626a_100000751104_100000185753 [0,1,0,0,0,0|1,0,2]=4 2937 B20R2.21596 C[C@@H](NC(=O)CCc1ccccc1)c2ccccc2 240690a_100000751104_100000185753 [0,1,0,0,0,0|1,0,2]=4 2938 B20R2.21596 C[C@@H](NC(=O)CCc1ccccc1)c2ccccc2 527a_100000751104_100000185753 [0,1,0,0,0,0|1,0,2]=4 2939 B20R2.21596 C[C@@H](NC(=O)COc1ccccc1)c2ccccc2 11a_100000751104_100000186222 [0,1,0,0,0,0|2,0,1]=4 2940 B20R2.21596 C[C@@H](NC(=O)COc1ccccc1)c2ccccc2 1626a_100000751104_100000186222 [0,1,0,0,0,0|2,0,1]=4 2941 B20R2.21596 C[C@@H](NC(=O)COc1ccccc1)c2ccccc2 240690a_100000751104_100000186222 [0,1,0,0,0,0|2,0,1]=4 2942 B20R2.21596 C[C@@H](NC(=O)COc1ccccc1)c2ccccc2 527a_100000751104_100000186222 [0,1,0,0,0,0|2,0,1]=4 2943 B20R2.21596 C[C@@H](NC(=O)CSc1ccccc1)c2ccccc2 11a_100000751104_100000211596 [0,1,0,0,0,0|2,0,1]=4 2944 B20R2.21596 C[C@@H](NC(=O)CSc1ccccc1)c2ccccc2 1626a_100000751104_100000211596 [0,1,0,0,0,0|2,0,1]=4 2945 B20R2.21596 C[C@@H](NC(=O)CSc1ccccc1)c2ccccc2 240690a_100000751104_100000211596 [0,1,0,0,0,0|2,0,1]=4 2946 B20R2.21596 C[C@@H](NC(=O)CSc1ccccc1)c2ccccc2 527a_100000751104_100000211596 [0,1,0,0,0,0|2,0,1]=4 2947 B20R2.21596 C[C@@H](NC(=O)NCc1ccccc1)c2ccccc2 2708a_100000751104_100015324214 [0,1,0,0,0,0|2,0,1]=4 2948 B20R2.21596 C[C@@H](NC(=O)NCc1ccccc1)c2ccccc2 2708a_100015324214_100000751104 [0,1,0,0,0,0|2,0,1]=4 2949 B20R2.21596 C[C@@H](NC(=O)NCc1ccccc1)c2ccccc2 273464a_100000751104_100015324214 [0,1,0,0,0,0|2,0,1]=4 2950 B20R2.21596 C[C@@H](NC(=O)NCc1ccccc1)c2ccccc2 273464a_100015324214_100000751104 [0,1,0,0,0,0|2,0,1]=4 2951 B20R2.21596 C[C@@H](NC(=O)NCc1ccccc1)c2ccccc2 512a_100000751104_100015324214 [0,1,0,0,0,0|2,0,1]=4 2952 B20R2.21596 C[C@@H](NC(=O)NCc1ccccc1)c2ccccc2 512a_100015324214_100000751104 [0,1,0,0,0,0|2,0,1]=4 2953 B20R2.21596 C[C@@H](NC(=O)NNc1ccccc1)c2ccccc2 273464a_100000751104_100015195140 [0,1,0,0,0,0|3,0,0]=4 2954 B20R2.21596 C[C@@H](NC(=O)NNc1ccccc1)c2ccccc2 512a_100000751104_100015195140 [0,1,0,0,0,0|3,0,0]=4 2955 B20R2.21596 C[C@H](NC(=O)CNc1ccccc1)c2ccccc2 34a_100000106764_100011939912 [0,1,0,0,0,0|2,0,1]=4 2956 B20R2.21596 C[C@H](NC(=O)COc1ccccc1)c2ccccc2 34a_100000210340_100011939912 [0,1,0,0,0,0|2,0,1]=4 2957 B20R2.21596 C[C@H](NC(=O)COc1ccccc1)c2ccccc2 7a_100000210340_100011939912 [0,1,0,0,0,0|2,0,1]=4 2958 B20R2.21596 C[C@H](NC(=O)CSc1ccccc1)c2ccccc2 62a_100000719477_100011939912 [0,1,0,0,0,0|2,0,1]=4 2959 B20R2.21596 C[C@H](NC(=O)CSc1ccccc1)c2ccccc2 62a_100011939912_100000041952 [0,1,0,0,0,0|2,0,1]=4 2960 B20R2.21596 O=C(C#Cc1ccccc1)CC(=O)c2ccccc2 1458a_100000736102_100000211460 [0,1,0,0,0,0|1,0,2]=4 2961 B20R2.21596 O=C(C#Cc1ccccc1)CC(O)c2ccccc2 1458a_100000736102_100000185958 [0,1,0,0,0,0|1,0,2]=4 2962 B20R2.21596 O=C(C#Cc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000736102_100011933945 [0,1,0,0,0,0|1,0,2]=4 2963 B20R2.21596 O=C(C=Cc1ccccc1)CC(=O)c2ccccc2 1458a_100000210462_100000211460 [0,1,0,0,0,0|1,0,1]=3 2964 B20R2.21596 O=C(C=Cc1ccccc1)CC(=O)c2ccccn2 1458a_100000210462_100000027445 [0,1,0,0,0,0|2,0,1]=4 2965 B20R2.21596 O=C(C=Cc1ccccc1)CC(=O)c2cccnc2 1458a_100000210462_100015188593 [0,1,0,0,0,0|2,0,1]=4 2966 B20R2.21596 O=C(C=Cc1ccccc1)CC(=O)c2ccncc2 1458a_100000210462_100000027454 [0,1,0,0,0,0|2,0,1]=4 2967 B20R2.21596 O=C(C=Cc1ccccc1)CC(O)c2ccccc2 1458a_100000210462_100000185958 [0,1,0,0,0,0|1,0,0]=2 2968 B20R2.21596 O=C(C=Cc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000210462_100011933945 [0,1,0,0,0,0|1,0,0]=2 2969 B20R2.21596 O=C(C=Cc1ccccn1)CC(=O)c2ccccc2 1458a_100000740811_100000211460 [0,1,0,0,0,0|2,0,1]=4 2970 B20R2.21596 O=C(C=Cc1ccccn1)CC(O)c2ccccc2 1458a_100000740811_100000185958 [0,1,0,0,0,0|2,0,0]=3 2971 B20R2.21596 O=C(C=Cc1ccccn1)C[C@@H](O)c2ccccc2 1458a_100000740811_100011933945 [0,1,0,0,0,0|2,0,0]=3 2972 B20R2.21596 O=C(C=Cc1cccnc1)CC(=O)c2ccccc2 1458a_100000735890_100000211460 [0,1,0,0,0,0|2,0,1]=4 2973 B20R2.21596 O=C(C=Cc1cccnc1)CC(O)c2ccccc2 1458a_100000735890_100000185958 [0,1,0,0,0,0|2,0,0]=3 2974 B20R2.21596 O=C(C=Cc1cccnc1)C[C@@H](O)c2ccccc2 1458a_100000735890_100011933945 [0,1,0,0,0,0|2,0,0]=3 2975 B20R2.21596 O=C(C=Cc1ccncc1)CC(=O)c2ccccc2 1458a_100000682801_100000211460 [0,1,0,0,0,0|2,0,1]=4 2976 B20R2.21596 O=C(C=Cc1ccncc1)CC(O)c2ccccc2 1458a_100000682801_100000185958 [0,1,0,0,0,0|2,0,0]=3 2977 B20R2.21596 O=C(C=Cc1ccncc1)C[C@@H](O)c2ccccc2 1458a_100000682801_100011933945 [0,1,0,0,0,0|2,0,0]=3 2978 B20R2.21596 O=C(CC(=O)c1ccccc1)NCc2ccccc2 1458a_100000185807_100000183539 [0,1,0,0,0,0|1,0,1]=3 2979 B20R2.21596 O=C(CC(=O)c1ccccc1)NCc2ccccn2 1458a_100000185807_100000684169 [0,1,0,0,0,0|2,0,1]=4 2980 B20R2.21596 O=C(CC(=O)c1ccccc1)NCc2ccncc2 1458a_100000185807_100011243468 [0,1,0,0,0,0|2,0,1]=4 2981 B20R2.21596 O=C(CC(=O)c1ccccc1)OCc2ccccc2 1458a_100000185807_100000753625 [0,1,0,0,0,0|0,0,1]=2 2982 B20R2.21596 O=C(CC(O)c1ccccc1)NCc2ccccc2 240690a_100015324214_100000690199 [0,1,0,0,0,0|1,0,2]=4 2983 B20R2.21596 O=C(CC(O)c1ccccc1)NNc2ccccc2 22a_100015195140_100000690199 [0,1,0,0,0,0|3,0,0]=4 2984 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2ccccc2 1458a_100000185753_100000211460 [0,1,0,0,0,0|1,0,1]=3 2985 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2ccccc2 1458a_100000185807_100012361361 [0,1,0,0,0,0|1,0,1]=3 2986 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2ccccn2 1458a_100000185753_100000027445 [0,1,0,0,0,0|2,0,1]=4 2987 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2cccnc2 1458a_100000185753_100015188593 [0,1,0,0,0,0|2,0,1]=4 2988 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2ccncc2 1458a_100000185753_100000027454 [0,1,0,0,0,0|2,0,1]=4 2989 B20R2.21596 O=C(CCc1ccccc1)CC(O)c2ccccc2 1458a_100000185753_100000185958 [0,1,0,0,0,0|1,0,2]=4 2990 B20R2.21596 O=C(CCc1ccccc1)CC(O)c2ccccc2 1458a_100000690199_100000765856 [0,1,0,0,0,0|1,0,2]=4 2991 B20R2.21596 O=C(CCc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000185753_100011933945 [0,1,0,0,0,0|1,0,2]=4 2992 B20R2.21596 O=C(CCc1ccccn1)CC(=O)c2ccccc2 1458a_100015195070_100000211460 [0,1,0,0,0,0|2,0,1]=4 2993 B20R2.21596 O=C(CCc1cccnc1)CC(=O)c2ccccc2 1458a_100000198484_100000211460 [0,1,0,0,0,0|2,0,1]=4 2994 B20R2.21596 O=C(CCc1ccncc1)CC(=O)c2ccccc2 1458a_100011225043_100000211460 [0,1,0,0,0,0|2,0,1]=4 2995 B20R2.21596 O=C(COc1ccccc1)CC(=O)c2ccccc2 1458a_100000186222_100000211460 [0,1,0,0,0,0|2,0,1]=4 2996 B20R2.21596 O=C(COc1ccccc1)CC(O)c2ccccc2 1458a_100000186222_100000185958 [0,1,0,0,0,0|2,0,1]=4 2997 B20R2.21596 O=C(COc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000186222_100011933945 [0,1,0,0,0,0|2,0,1]=4 2998 B20R2.21596 O=C(COc1ccccc1)NC(=O)c2ccccc2 7a_100000210340_100000010347 [0,1,0,0,0,0|3,0,0]=4 2999 B20R2.21596 O=C(CSc1ccccc1)CC(=O)c2ccccc2 1458a_100000211596_100000211460 [0,1,0,0,0,0|2,0,1]=4 3000 B20R2.21596 O=C(CSc1ccccc1)CC(O)c2ccccc2 1458a_100000211596_100000185958 [0,1,0,0,0,0|2,0,1]=4 3001 B20R2.21596 O=C(CSc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000211596_100011933945 [0,1,0,0,0,0|2,0,1]=4 3002 B20R2.21596 O=C(CSc1ccccc1)NC(=O)c2ccccc2 62a_100000719477_100000010347 [0,1,0,0,0,0|3,0,0]=4 3003 B20R2.2714576 O=S(=O)(C=Cc1ccccc1)NCc2ccccc2 40a_100015324214_100011098038 [0,1,0,0,0,0|2,0,0]=3 3004 B20R2.2714576 O=S(=O)(C=Cc1ccccc1)NCc2ccccn2 40a_100000210449_100011098038 [0,1,0,0,0,0|3,0,0]=4 3005 B20R2.2714576 O=S(=O)(C=Cc1ccccc1)NCc2cccnc2 40a_100000210453_100011098038 [0,1,0,0,0,0|3,0,0]=4 3006 B20R2.2714576 O=S(=O)(C=Cc1ccccc1)NCc2ccncc2 40a_100000210450_100011098038 [0,1,0,0,0,0|3,0,0]=4 3007 B20R2.2714576 O=S(=O)(C=Cc1ccccc1)NNc2ccccc2 40a_100015195140_100011098038 [0,1,0,0,0,0|3,0,0]=4 3008 B18R1.10651 C=CC=CC(=O)CCC(=O)OCc1ccccc1 1458a_100016291481_100009813219 [0,0,1,0,0,0|1,0,2]=4 3009 B20R3.451 Brc1ccc2ccccc2c1Sc3ccccc3 62a_100000719477_100010090040 [0,0,0,1,0,0|3,0,0]=4 3010 B20R3.451 Brc1ccc2ccccc2c1Sc3ccccc3 62a_100010090040_100000041952 [0,0,0,1,0,0|3,0,0]=4 3011 B20R3.451 Cc1ccc2ccccc2c1Sc3ccccc3 62a_100000719477_100000759710 [0,0,0,1,0,0|3,0,0]=4 3012 B20R3.451 Cc1ccc2ccccc2c1Sc3ccccc3 62a_100000759710_100000041952 [0,0,0,1,0,0|3,0,0]=4 3013 B20R3.451 Nc1ccc2ccccc2c1Sc3ccccc3 62a_100000705303_100000041952 [0,0,0,1,0,0|3,0,0]=4 3014 B20R3.451 Nc1ccc2ccccc2c1Sc3ccccc3 62a_100000719477_100000705303 [0,0,0,1,0,0|3,0,0]=4 3015 B20R3.451 Oc1ccc2ccccc2c1Sc3ccccc3 62a_100000719477_100000183829 [0,0,0,1,0,0|2,0,1]=4 3016 B20R3.26404 O=C(CCc1ccccc1)C2Cc3c2cccc3 1458a_200000238571_100000765856 [0,0,0,1,0,0|1,0,2]=4 3017 B20R3.26404 O=C(NCc1ccccc1)C2Cc3c2cccc3 11a_100015324214_200000238571 [0,0,0,1,0,0|1,0,2]=4 3018 B20R3.26404 O=C(NCc1ccccc1)C2Cc3c2cccc3 1626a_100015324214_200000238571 [0,0,0,1,0,0|1,0,2]=4 3019 B20R3.26404 O=C(NCc1ccccc1)C2Cc3c2cccc3 240690a_100015324214_200000238571 [0,0,0,1,0,0|1,0,2]=4 3020 B20R3.26404 O=C(NCc1ccccc1)C2Cc3c2cccc3 527a_100015324214_200000238571 [0,0,0,1,0,0|1,0,2]=4 3021 B20R3.26404 O=C(NNc1ccccc1)C2Cc3c2cccc3 22a_100015195140_200000238571 [0,0,0,1,0,0|3,0,0]=4 3022 B20R3.30190 C(#Cc1ccc2ccccc2c1)c3ccccc3 271570a_100000069678_100000233703 [0,0,0,1,0,0|2,0,1]=4 3023 B20R3.30190 C(#Cc1ccc2ccccc2n1)c3ccccc3 271570a_100000069678_100011291633 [0,0,0,1,0,0|2,0,1]=4 3024 B20R3.30190 C(=Cc1cc2ccccc2cn1)c3ccccc3 271570a_100102527694_100000047361 [0,0,0,1,0,0|2,0,1]=4 3025 B20R3.30190 C(=Cc1ccc2ccccc2c1)c3ccccc3 271570a_100102527694_100000233703 [0,0,0,1,0,0|2,0,1]=4 3026 B20R3.30190 C(=Cc1ccc2ccccc2n1)c3ccccc3 271570a_100102527694_100011291633 [0,0,0,1,0,0|2,0,1]=4 3027 B20R3.30190 C(=Cc1cnc2ccccc2c1)c3ccccc3 271570a_100102527694_100000737414 [0,0,0,1,0,0|3,0,0]=4 3028 B20R3.30190 C(=Cc1cnc2ccccc2n1)c3ccccc3 271570a_100102527694_100000756483 [0,0,0,1,0,0|3,0,0]=4 3029 B20R3.30190 C(=Cc1ncc2ccccc2n1)c3ccccc3 271570a_100102527694_100000097389 [0,0,0,1,0,0|2,0,1]=4 3030 B20R3.30190 c1cc(ccn1)COc2ccc3ccncc3c2 7a_100000752006_100015193705 [0,0,0,1,0,0|3,0,0]=4 3031 B20R3.30190 c1cc(ccn1)COc2ccc3cnccc3c2 7a_100000046372_100015193705 [0,0,0,1,0,0|3,0,0]=4 3032 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3c2 207a_100000211940_100015611070 [0,0,0,1,0,0|2,0,0]=3 3033 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3c2 270302a_100000211940_100015611070 [0,0,0,1,0,0|2,0,0]=3 3034 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3c2 34a_100000211940_100015291786 [0,0,0,1,0,0|2,0,0]=3 3035 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3c2 7a_100000211940_100000211182 [0,0,0,1,0,0|2,0,0]=3 3036 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3n2 27a_100015324214_100011291633 [0,0,0,1,0,0|2,0,0]=3 3037 B20R3.30190 c1ccc(cc1)CNc2ccc3cccnc3c2 207a_100102887122_100015611070 [0,0,0,1,0,0|3,0,0]=4 3038 B20R3.30190 c1ccc(cc1)CNc2ccc3cccnc3c2 270302a_100102887122_100015611070 [0,0,0,1,0,0|3,0,0]=4 3039 B20R3.30190 c1ccc(cc1)CNc2ccc3cccnc3c2 34a_100102887122_100015291786 [0,0,0,1,0,0|3,0,0]=4 3040 B20R3.30190 c1ccc(cc1)CNc2ccc3cccnc3n2 27a_100015324214_100000075685 [0,0,0,1,0,0|3,0,0]=4 3041 B20R3.30190 c1ccc(cc1)CNc2ccc3ccncc3c2 207a_100000069342_100015611070 [0,0,0,1,0,0|3,0,0]=4 3042 B20R3.30190 c1ccc(cc1)CNc2ccc3ccncc3c2 270302a_100000069342_100015611070 [0,0,0,1,0,0|3,0,0]=4 3043 B20R3.30190 c1ccc(cc1)CNc2ccc3ccncc3n2 27a_100015324214_100000020162 [0,0,0,1,0,0|3,0,0]=4 3044 B20R3.30190 c1ccc(cc1)CNc2ccc3cnccc3c2 207a_100000039641_100015611070 [0,0,0,1,0,0|3,0,0]=4 3045 B20R3.30190 c1ccc(cc1)CNc2ccc3cnccc3c2 270302a_100000039641_100015611070 [0,0,0,1,0,0|3,0,0]=4 3046 B20R3.30190 c1ccc(cc1)CNc2ccc3cnccc3c2 34a_100000039641_100015291786 [0,0,0,1,0,0|3,0,0]=4 3047 B20R3.30190 c1ccc(cc1)CNc2ccc3ncccc3c2 207a_100011198106_100015611070 [0,0,0,1,0,0|3,0,0]=4 3048 B20R3.30190 c1ccc(cc1)CNc2ccc3ncccc3c2 270302a_100011198106_100015611070 [0,0,0,1,0,0|3,0,0]=4 3049 B20R3.30190 c1ccc(cc1)CNc2ccc3ncccc3c2 34a_100011198106_100015291786 [0,0,0,1,0,0|3,0,0]=4 3050 B20R3.30190 c1ccc(cc1)CNc2ccc3ncccc3n2 27a_100015324214_100000073381 [0,0,0,1,0,0|3,0,0]=4 3051 B20R3.30190 c1ccc(cc1)CNc2cnc3ccccc3n2 27a_100015324214_100000756483 [0,0,0,1,0,0|3,0,0]=4 3052 B20R3.30190 c1ccc(cc1)CNc2ncc3ccccc3n2 27a_100015324214_100000097389 [0,0,0,1,0,0|3,0,0]=4 3053 B20R3.30190 c1ccc(cc1)COc2ccc3ccccc3c2 34a_100000185828_100015291786 [0,0,0,1,0,0|1,0,0]=2 3054 B20R3.30190 c1ccc(cc1)COc2ccc3ccccc3c2 7a_100000185828_100000211182 [0,0,0,1,0,0|1,0,0]=2 3055 B20R3.30190 c1ccc(cc1)COc2ccc3cccnc3c2 34a_100011216045_100015291786 [0,0,0,1,0,0|2,0,0]=3 3056 B20R3.30190 c1ccc(cc1)COc2ccc3ccncc3c2 7a_100000752006_100000211182 [0,0,0,1,0,0|2,0,0]=3 3057 B20R3.30190 c1ccc(cc1)COc2ccc3cnccc3c2 34a_100000046372_100015291786 [0,0,0,1,0,0|2,0,0]=3 3058 B20R3.30190 c1ccc(cc1)COc2ccc3cnccc3c2 7a_100000046372_100000211182 [0,0,0,1,0,0|2,0,0]=3 3059 B20R3.30190 c1ccc(cc1)COc2ccc3ncccc3c2 34a_100011215586_100015291786 [0,0,0,1,0,0|2,0,0]=3 3060 B20R3.30190 c1ccc(cc1)COc2ccc3ncccc3c2 7a_100011215586_100000211182 [0,0,0,1,0,0|2,0,0]=3 3061 B20R3.30190 c1ccc(cc1)COc2ccc3nccnc3c2 34a_100000694412_100015291786 [0,0,0,1,0,0|3,0,0]=4 3062 B20R3.30190 c1ccc(cc1)COc2cnc3ccccc3c2 34a_100011934006_100015291786 [0,0,0,1,0,0|2,0,0]=3 3063 B20R3.30190 c1ccc(cc1)COc2cnc3ccccc3c2 7a_100011934006_100000211182 [0,0,0,1,0,0|2,0,0]=3 3064 B20R3.30190 c1ccc(cc1)CSc2cc3ccccc3cn2 62a_100000211182_100000047361 [0,0,0,1,0,0|2,1,0]=4 3065 B20R3.30190 c1ccc(cc1)CSc2cc3ccccc3cn2 62a_100009816522_100015291786 [0,0,0,1,0,0|2,1,0]=4 3066 B20R3.30190 c1ccc(cc1)CSc2ccc3ccccc3c2 62a_100000211182_100000233703 [0,0,0,1,0,0|1,1,0]=3 3067 B20R3.30190 c1ccc(cc1)CSc2ccc3ccccc3n2 62a_100000211182_100011291633 [0,0,0,1,0,0|1,1,0]=3 3068 B20R3.30190 c1ccc(cc1)CSc2ccc3ccccc3n2 62a_100011291633_100015291786 [0,0,0,1,0,0|1,1,0]=3 3069 B20R3.30190 c1ccc(cc1)CSc2ccc3cccnc3c2 62a_100000211182_100009816655 [0,0,0,1,0,0|2,1,0]=4 3070 B20R3.30190 c1ccc(cc1)CSc2ccc3cccnc3n2 62a_100000075685_100015291786 [0,0,0,1,0,0|2,1,0]=4 3071 B20R3.30190 c1ccc(cc1)CSc2ccc3cccnc3n2 62a_100000211182_100000075685 [0,0,0,1,0,0|2,1,0]=4 3072 B20R3.30190 c1ccc(cc1)CSc2ccc3ccncc3c2 62a_100000211182_100000686496 [0,0,0,1,0,0|2,1,0]=4 3073 B20R3.30190 c1ccc(cc1)CSc2ccc3ccncc3c2 62a_100000686496_100015291786 [0,0,0,1,0,0|2,1,0]=4 3074 B20R3.30190 c1ccc(cc1)CSc2ccc3ccncc3n2 62a_100000211182_100000020162 [0,0,0,1,0,0|2,1,0]=4 3075 B20R3.30190 c1ccc(cc1)CSc2ccc3cnccc3c2 62a_100000211182_100009816743 [0,0,0,1,0,0|2,1,0]=4 3076 B20R3.30190 c1ccc(cc1)CSc2ccc3cnccc3c2 62a_100009816743_100015291786 [0,0,0,1,0,0|2,1,0]=4 3077 B20R3.30190 c1ccc(cc1)CSc2ccc3ncccc3c2 62a_100000211182_100011215947 [0,0,0,1,0,0|2,1,0]=4 3078 B20R3.30190 c1ccc(cc1)CSc2ccc3ncccc3c2 62a_100011215947_100015291786 [0,0,0,1,0,0|2,1,0]=4 3079 B20R3.30190 c1ccc(cc1)CSc2ccc3ncccc3n2 62a_100000211182_100000073381 [0,0,0,1,0,0|2,1,0]=4 3080 B20R3.30190 c1ccc(cc1)CSc2cnc3ccccc3c2 62a_100000211182_100000737414 [0,0,0,1,0,0|2,1,0]=4 3081 B20R3.30190 c1ccc(cc1)CSc2cnc3ccccc3n2 62a_100000211182_100000756483 [0,0,0,1,0,0|2,1,0]=4 3082 B20R3.30190 c1ccc(cc1)CSc2cnc3ccccc3n2 62a_100000756483_100015291786 [0,0,0,1,0,0|2,1,0]=4 3083 B20R3.30190 c1ccc(cc1)CSc2ncc3ccccc3n2 62a_100000211182_100000097389 [0,0,0,1,0,0|2,1,0]=4 3084 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3c2 207a_100000106764_100000211584 [0,0,0,1,0,0|3,0,0]=4 3085 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3c2 270302a_100000106764_100000211584 [0,0,0,1,0,0|3,0,0]=4 3086 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3c2 34a_100000106764_100011216711 [0,0,0,1,0,0|3,0,0]=4 3087 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3n2 207a_100000106764_100000759686 [0,0,0,1,0,0|3,0,0]=4 3088 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3n2 34a_100000106764_100000737579 [0,0,0,1,0,0|3,0,0]=4 3089 B20R3.30190 c1ccc(cc1)OCc2ccc3ccccc3c2 34a_100000210340_100011216711 [0,0,0,1,0,0|3,0,0]=4 3090 B20R3.30190 c1ccc(cc1)OCc2ccc3ccccc3c2 7a_100000210340_100011216711 [0,0,0,1,0,0|3,0,0]=4 3091 B20R3.30190 c1ccc(cc1)OCc2ccc3ccccc3n2 34a_100000210340_100000737579 [0,0,0,1,0,0|3,0,0]=4 3092 B20R3.30190 c1ccc(cc1)OCc2ccc3ccccc3n2 7a_100000210340_100000737579 [0,0,0,1,0,0|3,0,0]=4 3093 B20R3.30190 c1ccc(cc1)SCc2ccc3ccccc3c2 62a_100000719477_100011216711 [0,0,0,1,0,0|3,0,0]=4 3094 B20R3.30190 c1ccc(cc1)SCc2ccc3ccccc3c2 62a_100011216711_100000041952 [0,0,0,1,0,0|3,0,0]=4 3095 B20R3.30190 c1ccc(cc1)SCc2ccc3ccccc3n2 62a_100000719477_100000737579 [0,0,0,1,0,0|3,0,0]=4 3096 B20R3.30190 c1ccc(cc1)SCc2ccc3ccccc3n2 62a_100000737579_100000041952 [0,0,0,1,0,0|3,0,0]=4 3097 B20R3.30190 c1ccc(nc1)CNc2ccc3ccccc3c2 207a_100000211940_100000209966 [0,0,0,1,0,0|3,0,0]=4 3098 B20R3.30190 c1ccc(nc1)CNc2ccc3ccccc3c2 270302a_100000211940_100000209966 [0,0,0,1,0,0|3,0,0]=4 3099 B20R3.30190 c1ccc(nc1)CNc2ccc3ccccc3c2 34a_100000211940_100000721315 [0,0,0,1,0,0|3,0,0]=4 3100 B20R3.30190 c1ccc(nc1)CNc2ccc3ccccc3c2 7a_100000211940_100000721315 [0,0,0,1,0,0|3,0,0]=4 3101 B20R3.30190 c1ccc(nc1)CNc2ccc3ccccc3n2 27a_100000210449_100011291633 [0,0,0,1,0,0|3,0,0]=4 3102 B20R3.30190 c1ccc(nc1)COc2ccc3ccccc3c2 34a_100000185828_100000721315 [0,0,0,1,0,0|2,0,0]=3 3103 B20R3.30190 c1ccc(nc1)COc2ccc3ccccc3c2 7a_100000185828_100000721315 [0,0,0,1,0,0|2,0,0]=3 3104 B20R3.30190 c1ccc(nc1)COc2ccc3cccnc3c2 34a_100011216045_100000721315 [0,0,0,1,0,0|3,0,0]=4 3105 B20R3.30190 c1ccc(nc1)COc2ccc3ccncc3c2 7a_100000752006_100000721315 [0,0,0,1,0,0|3,0,0]=4 3106 B20R3.30190 c1ccc(nc1)COc2ccc3cnccc3c2 34a_100000046372_100000721315 [0,0,0,1,0,0|3,0,0]=4 3107 B20R3.30190 c1ccc(nc1)COc2ccc3cnccc3c2 7a_100000046372_100000721315 [0,0,0,1,0,0|3,0,0]=4 3108 B20R3.30190 c1ccc(nc1)COc2ccc3ncccc3c2 34a_100011215586_100000721315 [0,0,0,1,0,0|3,0,0]=4 3109 B20R3.30190 c1ccc(nc1)COc2ccc3ncccc3c2 7a_100011215586_100000721315 [0,0,0,1,0,0|3,0,0]=4 3110 B20R3.30190 c1ccc(nc1)COc2cnc3ccccc3c2 34a_100011934006_100000721315 [0,0,0,1,0,0|3,0,0]=4 3111 B20R3.30190 c1ccc(nc1)COc2cnc3ccccc3c2 7a_100011934006_100000721315 [0,0,0,1,0,0|3,0,0]=4 3112 B20R3.30190 c1ccc(nc1)CSc2ccc3ccccc3c2 62a_100000721315_100000233703 [0,0,0,1,0,0|2,1,0]=4 3113 B20R3.30190 c1ccc(nc1)CSc2ccc3ccccc3n2 62a_100000721315_100011291633 [0,0,0,1,0,0|2,1,0]=4 3114 B20R3.30190 c1ccc(nc1)CSc2ccc3ccccc3n2 62a_100011291633_100000721315 [0,0,0,1,0,0|2,1,0]=4 3115 B20R3.30190 c1ccc2cc(ccc2c1)NCc3ccncc3 207a_100000211940_100000186114 [0,0,0,1,0,0|3,0,0]=4 3116 B20R3.30190 c1ccc2cc(ccc2c1)NCc3ccncc3 7a_100000211940_100015193705 [0,0,0,1,0,0|3,0,0]=4 3117 B20R3.30190 c1ccc2cc(ccc2c1)OCc3ccncc3 7a_100000185828_100015193705 [0,0,0,1,0,0|2,0,0]=3 3118 B20R3.30190 c1ccc2cc(ccc2c1)OCc3cnccn3 34a_100000185828_100016995436 [0,0,0,1,0,0|3,0,0]=4 3119 B20R3.30190 c1ccc2cc(ccc2c1)OCc3cnccn3 7a_100000185828_100016995436 [0,0,0,1,0,0|3,0,0]=4 3120 B20R3.30190 c1ccc2cc(ccc2c1)OCc3cncnc3 34a_100000185828_100015196519 [0,0,0,1,0,0|3,0,0]=4 3121 B20R3.30190 c1ccc2cc(ccc2c1)OCc3cncnc3 7a_100000185828_100015196519 [0,0,0,1,0,0|3,0,0]=4 3122 B20R3.30190 c1ccc2cc(ccc2c1)SCc3ccncc3 62a_100015193705_100000233703 [0,0,0,1,0,0|2,1,0]=4 3123 B20R3.30190 c1ccc2nc(ccc2c1)NCc3ccncc3 27a_100000210450_100011291633 [0,0,0,1,0,0|3,0,0]=4 3124 B20R3.30190 c1ccc2nc(ccc2c1)SCc3ccncc3 62a_100011291633_100015193705 [0,0,0,1,0,0|2,1,0]=4 3125 B20R3.30190 c1ccc2nc(ccc2c1)SCc3ccncc3 62a_100015193705_100011291633 [0,0,0,1,0,0|2,1,0]=4 3126 B20R3.30190 c1ccc2ncc(cc2c1)OCc3ccncc3 7a_100011934006_100015193705 [0,0,0,1,0,0|3,0,0]=4 3127 B20R3.30190 c1cnc(nc1)COc2ccc3ccccc3c2 34a_100000185828_100000703007 [0,0,0,1,0,0|3,0,0]=4 3128 B20R3.30190 c1cnc(nc1)COc2ccc3ccccc3c2 7a_100000185828_100000703007 [0,0,0,1,0,0|3,0,0]=4 3129 B20R3.30190 c1cnc2ccc(cc2c1)OCc3ccncc3 7a_100011215586_100015193705 [0,0,0,1,0,0|3,0,0]=4 3130 B20R3.30190 c1cncc(c1)CNc2ccc3ccccc3c2 207a_100000211940_100000209961 [0,0,0,1,0,0|3,0,0]=4 3131 B20R3.30190 c1cncc(c1)CNc2ccc3ccccc3c2 270302a_100000211940_100000209961 [0,0,0,1,0,0|3,0,0]=4 3132 B20R3.30190 c1cncc(c1)CNc2ccc3ccccc3c2 34a_100000211940_100000733263 [0,0,0,1,0,0|3,0,0]=4 3133 B20R3.30190 c1cncc(c1)CNc2ccc3ccccc3c2 7a_100000211940_100000741622 [0,0,0,1,0,0|3,0,0]=4 3134 B20R3.30190 c1cncc(c1)CNc2ccc3ccccc3n2 27a_100000210453_100011291633 [0,0,0,1,0,0|3,0,0]=4 3135 B20R3.30190 c1cncc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000733263 [0,0,0,1,0,0|2,0,0]=3 3136 B20R3.30190 c1cncc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000741622 [0,0,0,1,0,0|2,0,0]=3 3137 B20R3.30190 c1cncc(c1)COc2ccc3cccnc3c2 34a_100011216045_100000733263 [0,0,0,1,0,0|3,0,0]=4 3138 B20R3.30190 c1cncc(c1)COc2ccc3ccncc3c2 7a_100000752006_100000741622 [0,0,0,1,0,0|3,0,0]=4 3139 B20R3.30190 c1cncc(c1)COc2ccc3cnccc3c2 34a_100000046372_100000733263 [0,0,0,1,0,0|3,0,0]=4 3140 B20R3.30190 c1cncc(c1)COc2ccc3cnccc3c2 7a_100000046372_100000741622 [0,0,0,1,0,0|3,0,0]=4 3141 B20R3.30190 c1cncc(c1)COc2ccc3ncccc3c2 34a_100011215586_100000733263 [0,0,0,1,0,0|3,0,0]=4 3142 B20R3.30190 c1cncc(c1)COc2ccc3ncccc3c2 7a_100011215586_100000741622 [0,0,0,1,0,0|3,0,0]=4 3143 B20R3.30190 c1cncc(c1)COc2cnc3ccccc3c2 34a_100011934006_100000733263 [0,0,0,1,0,0|3,0,0]=4 3144 B20R3.30190 c1cncc(c1)COc2cnc3ccccc3c2 7a_100011934006_100000741622 [0,0,0,1,0,0|3,0,0]=4 3145 B20R3.30190 c1cncc(c1)CSc2ccc3ccccc3c2 62a_100000741622_100000233703 [0,0,0,1,0,0|2,1,0]=4 3146 B20R3.30190 c1cncc(c1)CSc2ccc3ccccc3n2 62a_100000741622_100011291633 [0,0,0,1,0,0|2,1,0]=4 3147 B20R3.30190 c1cncc(c1)CSc2ccc3ccccc3n2 62a_100011291633_100000741622 [0,0,0,1,0,0|2,1,0]=4 3148 B20R3.30190 c1cnnc(c1)COc2ccc3ccccc3c2 34a_100000185828_100016990269 [0,0,0,1,0,0|3,0,0]=4 3149 B20R3.30190 c1cnnc(c1)COc2ccc3ccccc3c2 7a_100000185828_100016990269 [0,0,0,1,0,0|3,0,0]=4 3150 B18R2.2429 CC(Cc1ccccc1)OCc2ccccc2 34a_100000210790_200011218536 [0,0,0,0,1,0|1,0,2]=4 3151 B18R2.2429 CC(Cc1ccccc1)OCc2ccccc2 34a_100000748627_100015291786 [0,0,0,0,1,0|1,0,2]=4 3152 B18R2.2429 CC(Cc1ccccc1)OCc2ccccc2 7a_100000210790_200011218536 [0,0,0,0,1,0|1,0,2]=4 3153 B18R2.2429 CC(Cc1ccccc1)OCc2ccccc2 7a_100000748627_100000211182 [0,0,0,0,1,0|1,0,2]=4 3154 B18R2.2429 O=C(C#Cc1ccccc1)Cc2ccccc2 1458a_100000736102_100015291786 [0,0,0,0,1,0|0,0,2]=3 3155 B18R2.2429 O=C(C#Cc1ccccc1)Cc2ccccn2 1458a_100000736102_100000721315 [0,0,0,0,1,0|1,0,2]=4 3156 B18R2.2429 O=C(C#Cc1ccccc1)Cc2cccnc2 1458a_100000736102_100000733263 [0,0,0,0,1,0|1,0,2]=4 3157 B18R2.2429 O=C(C#Cc1ccccc1)Cc2ccncc2 1458a_100000736102_100000705612 [0,0,0,0,1,0|1,0,2]=4 3158 B18R2.2429 O=C(C#Cc1ccccc1)Nc2ccccc2 22a_100000106764_100000736102 [0,0,0,0,1,0|1,0,2]=4 3159 B18R2.2429 O=C(C#Cc1ccccn1)Cc2ccccc2 1458a_102125277312_100015291786 [0,0,0,0,1,0|1,0,2]=4 3160 B18R2.2429 O=C(C=Cc1ccccc1)Cc2ccccc2 1458a_100000210462_100015291786 [0,0,0,0,1,0|0,0,0]=1 3161 B18R2.2429 O=C(C=Cc1ccccc1)Cc2ccccn2 1458a_100000210462_100000721315 [0,0,0,0,1,0|1,0,0]=2 3162 B18R2.2429 O=C(C=Cc1ccccc1)Cc2cccnc2 1458a_100000210462_100000733263 [0,0,0,0,1,0|1,0,0]=2 3163 B18R2.2429 O=C(C=Cc1ccccc1)Cc2cccnn2 1458a_100000210462_100016990269 [0,0,0,0,1,0|2,0,0]=3 3164 B18R2.2429 O=C(C=Cc1ccccc1)Cc2ccncc2 1458a_100000210462_100000705612 [0,0,0,0,1,0|1,0,0]=2 3165 B18R2.2429 O=C(C=Cc1ccccc1)Cc2cnccn2 1458a_100000210462_100016995436 [0,0,0,0,1,0|2,0,0]=3 3166 B18R2.2429 O=C(C=Cc1ccccc1)Cc2cncnc2 1458a_100000210462_100015196519 [0,0,0,0,1,0|2,0,0]=3 3167 B18R2.2429 O=C(C=Cc1ccccc1)Cc2ncccn2 1458a_100000210462_100000703007 [0,0,0,0,1,0|2,0,0]=3 3168 B18R2.2429 O=C(C=Cc1ccccc1)Nc2ccccc2 11a_100000106764_100000210462 [0,0,0,0,1,0|1,0,0]=2 3169 B18R2.2429 O=C(C=Cc1ccccc1)Nc2ccccc2 1626a_100000106764_100000210462 [0,0,0,0,1,0|1,0,0]=2 3170 B18R2.2429 O=C(C=Cc1ccccc1)Nc2ccccc2 22a_100000106764_100000210462 [0,0,0,0,1,0|1,0,0]=2 3171 B18R2.2429 O=C(C=Cc1ccccn1)Cc2ccccc2 1458a_100000740811_100015291786 [0,0,0,0,1,0|1,0,0]=2 3172 B18R2.2429 O=C(C=Cc1ccccn1)Cc2ccccn2 1458a_100000740811_100000721315 [0,0,0,0,1,0|2,0,0]=3 3173 B18R2.2429 O=C(C=Cc1ccccn1)Cc2cccnc2 1458a_100000740811_100000733263 [0,0,0,0,1,0|2,0,0]=3 3174 B18R2.2429 O=C(C=Cc1ccccn1)Cc2cccnn2 1458a_100000740811_100016990269 [0,0,0,0,1,0|3,0,0]=4 3175 B18R2.2429 O=C(C=Cc1ccccn1)Cc2ccncc2 1458a_100000740811_100000705612 [0,0,0,0,1,0|2,0,0]=3 3176 B18R2.2429 O=C(C=Cc1ccccn1)Cc2cnccn2 1458a_100000740811_100016995436 [0,0,0,0,1,0|3,0,0]=4 3177 B18R2.2429 O=C(C=Cc1ccccn1)Cc2cncnc2 1458a_100000740811_100015196519 [0,0,0,0,1,0|3,0,0]=4 3178 B18R2.2429 O=C(C=Cc1ccccn1)Cc2ncccn2 1458a_100000740811_100000703007 [0,0,0,0,1,0|3,0,0]=4 3179 B18R2.2429 O=C(C=Cc1ccccn1)Nc2ccccc2 11a_100000106764_100000740811 [0,0,0,0,1,0|2,0,0]=3 3180 B18R2.2429 O=C(C=Cc1ccccn1)Nc2ccccc2 22a_100000106764_100000740811 [0,0,0,0,1,0|2,0,0]=3 3181 B18R2.2429 O=C(C=Cc1cccnc1)Cc2ccccc2 1458a_100000735890_100015291786 [0,0,0,0,1,0|1,0,0]=2 3182 B18R2.2429 O=C(C=Cc1cccnc1)Cc2ccccn2 1458a_100000735890_100000721315 [0,0,0,0,1,0|2,0,0]=3 3183 B18R2.2429 O=C(C=Cc1cccnc1)Cc2cccnc2 1458a_100000735890_100000733263 [0,0,0,0,1,0|2,0,0]=3 3184 B18R2.2429 O=C(C=Cc1cccnc1)Cc2cccnn2 1458a_100000735890_100016990269 [0,0,0,0,1,0|3,0,0]=4 3185 B18R2.2429 O=C(C=Cc1cccnc1)Cc2ccncc2 1458a_100000735890_100000705612 [0,0,0,0,1,0|2,0,0]=3 3186 B18R2.2429 O=C(C=Cc1cccnc1)Cc2cnccn2 1458a_100000735890_100016995436 [0,0,0,0,1,0|3,0,0]=4 3187 B18R2.2429 O=C(C=Cc1cccnc1)Cc2cncnc2 1458a_100000735890_100015196519 [0,0,0,0,1,0|3,0,0]=4 3188 B18R2.2429 O=C(C=Cc1cccnc1)Cc2ncccn2 1458a_100000735890_100000703007 [0,0,0,0,1,0|3,0,0]=4 3189 B18R2.2429 O=C(C=Cc1cccnc1)Nc2ccccc2 11a_100000106764_100000735890 [0,0,0,0,1,0|2,0,0]=3 3190 B18R2.2429 O=C(C=Cc1cccnc1)Nc2ccccc2 22a_100000106764_100000735890 [0,0,0,0,1,0|2,0,0]=3 3191 B18R2.2429 O=C(C=Cc1ccncc1)Cc2ccccc2 1458a_100000682801_100015291786 [0,0,0,0,1,0|1,0,0]=2 3192 B18R2.2429 O=C(C=Cc1ccncc1)Cc2ccccn2 1458a_100000682801_100000721315 [0,0,0,0,1,0|2,0,0]=3 3193 B18R2.2429 O=C(C=Cc1ccncc1)Cc2cccnc2 1458a_100000682801_100000733263 [0,0,0,0,1,0|2,0,0]=3 3194 B18R2.2429 O=C(C=Cc1ccncc1)Cc2cccnn2 1458a_100000682801_100016990269 [0,0,0,0,1,0|3,0,0]=4 3195 B18R2.2429 O=C(C=Cc1ccncc1)Cc2ccncc2 1458a_100000682801_100000705612 [0,0,0,0,1,0|2,0,0]=3 3196 B18R2.2429 O=C(C=Cc1ccncc1)Cc2cnccn2 1458a_100000682801_100016995436 [0,0,0,0,1,0|3,0,0]=4 3197 B18R2.2429 O=C(C=Cc1ccncc1)Cc2cncnc2 1458a_100000682801_100015196519 [0,0,0,0,1,0|3,0,0]=4 3198 B18R2.2429 O=C(C=Cc1ccncc1)Cc2ncccn2 1458a_100000682801_100000703007 [0,0,0,0,1,0|3,0,0]=4 3199 B18R2.2429 O=C(C=Cc1ccncc1)Nc2ccccc2 22a_100000106764_100000682801 [0,0,0,0,1,0|2,0,0]=3 3200 B18R2.2429 O=C(C=Cc1cncnc1)Cc2ccccc2 6a_100000749868_100000766558 [0,0,0,0,1,0|2,0,0]=3 3201 B18R2.2429 O=C(C=Cc1cncnc1)Cc2cccnc2 6a_100000749868_100015187140 [0,0,0,0,1,0|3,0,0]=4 3202 B18R2.2429 O=C(CCc1ccccc1)C[n+]2ccccc2 1458a_200000086051_100000765856 [0,0,0,0,1,0|1,0,2]=4 3203 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccc2 1458a_100000185753_100015291786 [0,0,0,0,1,0|0,0,2]=3 3204 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccn2 1458a_100000185753_100000721315 [0,0,0,0,1,0|1,0,2]=4 3205 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccn2 1458a_100000233486_100000765856 [0,0,0,0,1,0|1,0,2]=4 3206 B18R2.2429 O=C(CCc1ccccc1)Cc2cccnc2 1458a_100000185753_100000733263 [0,0,0,0,1,0|1,0,2]=4 3207 B18R2.2429 O=C(CCc1ccccc1)Cc2cccnc2 1458a_100000737805_100000765856 [0,0,0,0,1,0|1,0,2]=4 3208 B18R2.2429 O=C(CCc1ccccc1)Cc2ccncc2 1458a_100000185753_100000705612 [0,0,0,0,1,0|1,0,2]=4 3209 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 11a_100000106764_100000185753 [0,0,0,0,1,0|2,0,0]=3 3210 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 1626a_100000106764_100000185753 [0,0,0,0,1,0|2,0,0]=3 3211 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 22a_100000106764_100000185753 [0,0,0,0,1,0|2,0,0]=3 3212 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 527a_100000106764_100000185753 [0,0,0,0,1,0|2,0,0]=3 3213 B18R2.2429 O=C(CCc1ccccn1)Cc2ccccc2 1458a_100015195070_100015291786 [0,0,0,0,1,0|1,0,2]=4 3214 B18R2.2429 O=C(CCc1ccccn1)Nc2ccccc2 11a_100000106764_100015195070 [0,0,0,0,1,0|3,0,0]=4 3215 B18R2.2429 O=C(CCc1ccccn1)Nc2ccccc2 22a_100000106764_100015195070 [0,0,0,0,1,0|3,0,0]=4 3216 B18R2.2429 O=C(CCc1ccccn1)Nc2ccccc2 527a_100000106764_100015195070 [0,0,0,0,1,0|3,0,0]=4 3217 B18R2.2429 O=C(CCc1cccnc1)Cc2ccccc2 1458a_100000198484_100015291786 [0,0,0,0,1,0|1,0,2]=4 3218 B18R2.2429 O=C(CCc1cccnc1)Nc2ccccc2 11a_100000106764_100000198484 [0,0,0,0,1,0|3,0,0]=4 3219 B18R2.2429 O=C(CCc1cccnc1)Nc2ccccc2 1626a_100000106764_100000198484 [0,0,0,0,1,0|3,0,0]=4 3220 B18R2.2429 O=C(CCc1cccnc1)Nc2ccccc2 22a_100000106764_100000198484 [0,0,0,0,1,0|3,0,0]=4 3221 B18R2.2429 O=C(CCc1cccnc1)Nc2ccccc2 527a_100000106764_100000198484 [0,0,0,0,1,0|3,0,0]=4 3222 B18R2.2429 O=C(CCc1ccncc1)Cc2ccccc2 1458a_100011225043_100015291786 [0,0,0,0,1,0|1,0,2]=4 3223 B18R2.2429 O=C(CCc1ccncc1)Nc2ccccc2 11a_100000106764_100011225043 [0,0,0,0,1,0|3,0,0]=4 3224 B18R2.2429 O=C(CCc1ccncc1)Nc2ccccc2 22a_100000106764_100011225043 [0,0,0,0,1,0|3,0,0]=4 3225 B18R2.2429 O=C(CCc1ccncc1)Nc2ccccc2 527a_100000106764_100011225043 [0,0,0,0,1,0|3,0,0]=4 3226 B18R2.2429 O=C(CNc1ccccc1)Nc2ccccc2 34a_100000106764_100000182850 [0,0,0,0,1,0|2,0,1]=4 3227 B18R2.2429 O=C(CNc1ccccc1)Oc2ccccc2 34a_100000106764_100009813826 [0,0,0,0,1,0|1,0,1]=3 3228 B18R2.2429 O=C(COc1ccccc1)Cc2ccccc2 1458a_100000186222_100015291786 [0,0,0,0,1,0|1,0,1]=3 3229 B18R2.2429 O=C(COc1ccccc1)Cc2ccccc2 7a_100000210340_100000233483 [0,0,0,0,1,0|1,0,1]=3 3230 B18R2.2429 O=C(COc1ccccc1)Cc2ccccn2 1458a_100000186222_100000721315 [0,0,0,0,1,0|2,0,1]=4 3231 B18R2.2429 O=C(COc1ccccc1)Cc2cccnc2 1458a_100000186222_100000733263 [0,0,0,0,1,0|2,0,1]=4 3232 B18R2.2429 O=C(COc1ccccc1)Cc2ccncc2 1458a_100000186222_100000705612 [0,0,0,0,1,0|2,0,1]=4 3233 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 11a_100000106764_100000186222 [0,0,0,0,1,0|2,0,1]=4 3234 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 1626a_100000106764_100000186222 [0,0,0,0,1,0|2,0,1]=4 3235 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 22a_100000106764_100000186222 [0,0,0,0,1,0|2,0,1]=4 3236 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 34a_100000210340_100000182850 [0,0,0,0,1,0|2,0,1]=4 3237 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 527a_100000106764_100000186222 [0,0,0,0,1,0|2,0,1]=4 3238 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 7a_100000210340_100000182850 [0,0,0,0,1,0|2,0,1]=4 3239 B18R2.2429 O=C(COc1ccccc1)Oc2ccccc2 34a_100000210340_100009813826 [0,0,0,0,1,0|1,0,1]=3 3240 B18R2.2429 O=C(COc1ccccc1)Oc2ccccc2 7a_100000210340_100009813826 [0,0,0,0,1,0|1,0,1]=3 3241 B18R2.2429 O=C(COc1ccccn1)Cc2ccccc2 1458a_100102699861_100015291786 [0,0,0,0,1,0|2,0,1]=4 3242 B18R2.2429 O=C(COc1cccnc1)Cc2ccccc2 1458a_100015207166_100015291786 [0,0,0,0,1,0|2,0,1]=4 3243 B18R2.2429 O=C(COc1cccnc1)Cc2ccccc2 7a_100000210849_100000233483 [0,0,0,0,1,0|2,0,1]=4 3244 B18R2.2429 O=C(COc1cccnc1)Oc2ccccc2 34a_100000210849_100009813826 [0,0,0,0,1,0|2,0,1]=4 3245 B18R2.2429 O=C(COc1cccnc1)Oc2ccccc2 7a_100000210849_100009813826 [0,0,0,0,1,0|2,0,1]=4 3246 B18R2.2429 O=C(COc1ccncc1)Oc2ccccc2 34a_100000212176_100009813826 [0,0,0,0,1,0|2,0,1]=4 3247 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 1458a_100000211596_100015291786 [0,0,0,0,1,0|1,0,1]=3 3248 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 62a_100000233483_100000041952 [0,0,0,0,1,0|1,0,1]=3 3249 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 62a_100000719477_100000233483 [0,0,0,0,1,0|1,0,1]=3 3250 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccn2 1458a_100000211596_100000721315 [0,0,0,0,1,0|2,0,1]=4 3251 B18R2.2429 O=C(CSc1ccccc1)Cc2cccnc2 1458a_100000211596_100000733263 [0,0,0,0,1,0|2,0,1]=4 3252 B18R2.2429 O=C(CSc1ccccc1)Cc2ccncc2 1458a_100000211596_100000705612 [0,0,0,0,1,0|2,0,1]=4 3253 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 11a_100000106764_100000211596 [0,0,0,0,1,0|2,0,1]=4 3254 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 1626a_100000106764_100000211596 [0,0,0,0,1,0|2,0,1]=4 3255 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 22a_100000106764_100000211596 [0,0,0,0,1,0|2,0,1]=4 3256 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 527a_100000106764_100000211596 [0,0,0,0,1,0|2,0,1]=4 3257 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 62a_100000719477_100000182850 [0,0,0,0,1,0|2,0,1]=4 3258 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 62a_100012148978_100000041952 [0,0,0,0,1,0|2,0,1]=4 3259 B18R2.2429 O=C(CSc1ccccc1)Oc2ccccc2 62a_100000719477_100009813826 [0,0,0,0,1,0|1,0,1]=3 3260 B18R2.2429 O=C(CSc1ccccc1)Oc2ccccc2 62a_100009813826_100000041952 [0,0,0,0,1,0|1,0,1]=3 3261 B18R2.2429 O=C(CSc1ccccn1)Cc2ccccc2 1458a_100000156281_100015291786 [0,0,0,0,1,0|2,0,1]=4 3262 B18R2.2429 O=C(CSc1ccccn1)Cc2ccccc2 62a_100000233483_100011216584 [0,0,0,0,1,0|2,0,1]=4 3263 B18R2.2429 O=C(CSc1ccccn1)Cc2ccccc2 62a_100011216584_100000233483 [0,0,0,0,1,0|2,0,1]=4 3264 B18R2.2429 O=C(CSc1ccccn1)Oc2ccccc2 62a_100009813826_100011216584 [0,0,0,0,1,0|2,0,1]=4 3265 B18R2.2429 O=C(CSc1ccccn1)Oc2ccccc2 62a_100011216584_100009813826 [0,0,0,0,1,0|2,0,1]=4 3266 B18R2.2429 O=C(CSc1cccnc1)Cc2ccccc2 62a_100000210063_100000233483 [0,0,0,0,1,0|2,0,1]=4 3267 B18R2.2429 O=C(CSc1cccnc1)Cc2ccccc2 62a_100000233483_100000210063 [0,0,0,0,1,0|2,0,1]=4 3268 B18R2.2429 O=C(CSc1cccnc1)Oc2ccccc2 62a_100000210063_100009813826 [0,0,0,0,1,0|2,0,1]=4 3269 B18R2.2429 O=C(CSc1cccnc1)Oc2ccccc2 62a_100009813826_100000210063 [0,0,0,0,1,0|2,0,1]=4 3270 B18R2.2429 O=C(CSc1ccncc1)Cc2ccccc2 1458a_100000211328_100015291786 [0,0,0,0,1,0|2,0,1]=4 3271 B18R2.2429 O=C(CSc1ccncc1)Cc2ccccc2 62a_100000233483_100000728582 [0,0,0,0,1,0|2,0,1]=4 3272 B18R2.2429 O=C(CSc1ccncc1)Cc2ccccc2 62a_100000728582_100000233483 [0,0,0,0,1,0|2,0,1]=4 3273 B18R2.2429 O=C(CSc1ccncc1)Oc2ccccc2 62a_100000728582_100009813826 [0,0,0,0,1,0|2,0,1]=4 3274 B18R2.2429 O=C(CSc1ccncc1)Oc2ccccc2 62a_100009813826_100000728582 [0,0,0,0,1,0|2,0,1]=4 3275 B18R2.2429 O=C(C[n+]1ccccc1)NCc2ccccc2 11a_100015324214_200000086051 [0,0,0,0,1,0|2,0,1]=4 3276 B18R2.2429 O=C(C[n+]1ccccc1)NCc2ccccc2 240690a_100015324214_200000086051 [0,0,0,0,1,0|2,0,1]=4 3277 B18R2.2429 O=C(C[n+]1ccccc1)NCc2ccccc2 527a_100015324214_200000086051 [0,0,0,0,1,0|2,0,1]=4 3278 B18R2.2429 O=C(C[n+]1ccccc1)NNc2ccccc2 22a_100015195140_200000086051 [0,0,0,0,1,0|3,0,0]=4 3279 B18R2.2429 O=C(Cc1ccccn1)NCc2ccccc2 11a_100015324214_100000233486 [0,0,0,0,1,0|2,0,1]=4 3280 B18R2.2429 O=C(Cc1ccccn1)NNc2ccccc2 22a_100015195140_100000233486 [0,0,0,0,1,0|3,0,0]=4 3281 B18R2.2429 O=C(Cc1cccnc1)NCc2ccccc2 11a_100015324214_100000737805 [0,0,0,0,1,0|2,0,1]=4 3282 B18R2.2429 O=C(Cc1cccnc1)NCc2ccccc2 240690a_100015324214_100000737805 [0,0,0,0,1,0|2,0,1]=4 3283 B18R2.2429 O=C(Cc1cccnc1)NCc2ccccc2 527a_100015324214_100000737805 [0,0,0,0,1,0|2,0,1]=4 3284 B18R2.2429 O=C(Cc1cccnc1)NNc2ccccc2 22a_100015195140_100000737805 [0,0,0,0,1,0|3,0,0]=4 3285 B18R2.2429 O=C(Cc1ccncc1)NCc2ccccc2 11a_100015324214_100011201483 [0,0,0,0,1,0|2,0,1]=4 3286 B18R2.2429 O=C(Cc1ccncc1)NCc2ccccc2 240690a_100015324214_100011201483 [0,0,0,0,1,0|2,0,1]=4 3287 B18R2.2429 O=C(Cc1ccncc1)NNc2ccccc2 22a_100015195140_100011201483 [0,0,0,0,1,0|3,0,0]=4 3288 B18R2.2429 O=C(NCc1ccccc1)Nc2ccccc2 2430a_100000106764_100015324214 [0,0,0,0,1,0|2,0,0]=3 3289 B18R2.2429 O=C(NCc1ccccn1)Nc2ccccc2 2430a_100000106764_100000210449 [0,0,0,0,1,0|3,0,0]=4 3290 B18R2.2429 O=C(NCc1cccnc1)Nc2ccccc2 2430a_100000106764_100000210453 [0,0,0,0,1,0|3,0,0]=4 3291 B18R2.2429 O=C(NCc1ccncc1)Nc2ccccc2 2430a_100000106764_100000210450 [0,0,0,0,1,0|3,0,0]=4 3292 B18R2.11744 O=C(C=Cc1c[nH]cn1)CCc2ccccc2 1458a_100102678534_100000765856 [0,0,0,0,1,0|3,0,0]=4 3293 B18R2.11744 O=C(C=Cc1c[nH]cn1)NCc2ccccc2 240690a_100015324214_100102678534 [0,0,0,0,1,0|3,0,0]=4 3294 B18R2.11744 O=C(C=Cc1ccccc1)CCc2c[nH]cn2 1458a_100000210462_100020628418 [0,0,0,0,1,0|3,0,0]=4 3295 B18R2.11744 O=C(C=Cc1ccccc1)CCc2cccs2 1458a_100000210462_100000748579 [0,0,0,0,1,0|2,0,0]=3 3296 B18R2.11744 O=C(C=Cc1ccccc1)CCc2cn[nH]c2 1458a_100000210462_100000743252 [0,0,0,0,1,0|3,0,0]=4 3297 B18R2.11744 O=C(C=Cc1ccccc1)CCn2cccc2 1458a_100000210462_200000035178 [0,0,0,0,1,0|2,0,0]=3 3298 B18R2.11744 O=C(C=Cc1ccccc1)CCn2cccn2 1458a_100000210462_100000685285 [0,0,0,0,1,0|3,0,0]=4 3299 B18R2.11744 O=C(C=Cc1ccccc1)CCn2ccnc2 1458a_100000210462_100000702546 [0,0,0,0,1,0|3,0,0]=4 3300 B18R2.11744 O=C(C=Cc1ccccc1)NCc2c[nH]cn2 11a_100000758547_100000210462 [0,0,0,0,1,0|3,0,0]=4 3301 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cc[nH]n2 11a_100000739516_100000210462 [0,0,0,0,1,0|3,0,0]=4 3302 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccc[nH]2 11a_100000764082_100000210462 [0,0,0,0,1,0|2,0,0]=3 3303 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccco2 11a_100000185738_100000210462 [0,0,0,0,1,0|2,0,0]=3 3304 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccco2 1626a_100000185738_100000210462 [0,0,0,0,1,0|2,0,0]=3 3305 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cccs2 11a_100000211653_100000210462 [0,0,0,0,1,0|2,0,0]=3 3306 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cccs2 1626a_100000211653_100000210462 [0,0,0,0,1,0|2,0,0]=3 3307 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccoc2 11a_100015206860_100000210462 [0,0,0,0,1,0|2,0,0]=3 3308 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccoc2 1626a_100015206860_100000210462 [0,0,0,0,1,0|2,0,0]=3 3309 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccon2 11a_100000688301_100000210462 [0,0,0,0,1,0|3,0,0]=4 3310 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccsc2 11a_100000186416_100000210462 [0,0,0,0,1,0|2,0,0]=3 3311 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccsc2 1626a_100000186416_100000210462 [0,0,0,0,1,0|2,0,0]=3 3312 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cn[nH]c2 11a_100000737208_100000210462 [0,0,0,0,1,0|3,0,0]=4 3313 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cnco2 11a_100020634212_100000210462 [0,0,0,0,1,0|3,0,0]=4 3314 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cncs2 11a_100016987365_100000210462 [0,0,0,0,1,0|3,0,0]=4 3315 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cnoc2 11a_100016995009_100000210462 [0,0,0,0,1,0|3,0,0]=4 3316 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cocn2 11a_100015188801_100000210462 [0,0,0,0,1,0|3,0,0]=4 3317 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cscn2 11a_100015185402_100000210462 [0,0,0,0,1,0|3,0,0]=4 3318 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cscn2 1626a_100015185402_100000210462 [0,0,0,0,1,0|3,0,0]=4 3319 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ncc[nH]2 11a_100000754540_100000210462 [0,0,0,0,1,0|3,0,0]=4 3320 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ncco2 11a_100016994969_100000210462 [0,0,0,0,1,0|3,0,0]=4 3321 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ncco2 1626a_100016994969_100000210462 [0,0,0,0,1,0|3,0,0]=4 3322 B18R2.11744 O=C(C=Cc1ccccc1)NCc2nccs2 11a_100000740555_100000210462 [0,0,0,0,1,0|3,0,0]=4 3323 B18R2.11744 O=C(C=Cc1ccccc1)NCc2nccs2 1626a_100000740555_100000210462 [0,0,0,0,1,0|3,0,0]=4 3324 B18R2.11744 O=C(C=Cc1ccccn1)CCc2cccs2 1458a_100000740811_100000748579 [0,0,0,0,1,0|3,0,0]=4 3325 B18R2.11744 O=C(C=Cc1ccccn1)CCn2cccc2 1458a_100000740811_200000035178 [0,0,0,0,1,0|3,0,0]=4 3326 B18R2.11744 O=C(C=Cc1ccccn1)NCc2ccc[nH]2 11a_100000764082_100000740811 [0,0,0,0,1,0|3,0,0]=4 3327 B18R2.11744 O=C(C=Cc1ccccn1)NCc2ccc[nH]2 240690a_100000764082_100000740811 [0,0,0,0,1,0|3,0,0]=4 3328 B18R2.11744 O=C(C=Cc1ccccn1)NCc2ccco2 11a_100000185738_100000740811 [0,0,0,0,1,0|3,0,0]=4 3329 B18R2.11744 O=C(C=Cc1ccccn1)NCc2ccco2 240690a_100000185738_100000740811 [0,0,0,0,1,0|3,0,0]=4 3330 B18R2.11744 O=C(C=Cc1ccccn1)NCc2cccs2 11a_100000211653_100000740811 [0,0,0,0,1,0|3,0,0]=4 3331 B18R2.11744 O=C(C=Cc1ccccn1)NCc2cccs2 240690a_100000211653_100000740811 [0,0,0,0,1,0|3,0,0]=4 3332 B18R2.11744 O=C(C=Cc1ccccn1)NCc2ccoc2 11a_100015206860_100000740811 [0,0,0,0,1,0|3,0,0]=4 3333 B18R2.11744 O=C(C=Cc1ccccn1)NCc2ccoc2 240690a_100015206860_100000740811 [0,0,0,0,1,0|3,0,0]=4 3334 B18R2.11744 O=C(C=Cc1ccccn1)NCc2ccsc2 11a_100000186416_100000740811 [0,0,0,0,1,0|3,0,0]=4 3335 B18R2.11744 O=C(C=Cc1ccccn1)NCc2ccsc2 240690a_100000186416_100000740811 [0,0,0,0,1,0|3,0,0]=4 3336 B18R2.11744 O=C(C=Cc1cccnc1)CCc2cccs2 1458a_100000735890_100000748579 [0,0,0,0,1,0|3,0,0]=4 3337 B18R2.11744 O=C(C=Cc1cccnc1)CCn2cccc2 1458a_100000735890_200000035178 [0,0,0,0,1,0|3,0,0]=4 3338 B18R2.11744 O=C(C=Cc1cccnc1)NCc2ccc[nH]2 11a_100000764082_100000735890 [0,0,0,0,1,0|3,0,0]=4 3339 B18R2.11744 O=C(C=Cc1cccnc1)NCc2ccc[nH]2 240690a_100000764082_100000735890 [0,0,0,0,1,0|3,0,0]=4 3340 B18R2.11744 O=C(C=Cc1cccnc1)NCc2ccco2 11a_100000185738_100000735890 [0,0,0,0,1,0|3,0,0]=4 3341 B18R2.11744 O=C(C=Cc1cccnc1)NCc2ccco2 240690a_100000185738_100000735890 [0,0,0,0,1,0|3,0,0]=4 3342 B18R2.11744 O=C(C=Cc1cccnc1)NCc2cccs2 11a_100000211653_100000735890 [0,0,0,0,1,0|3,0,0]=4 3343 B18R2.11744 O=C(C=Cc1cccnc1)NCc2cccs2 240690a_100000211653_100000735890 [0,0,0,0,1,0|3,0,0]=4 3344 B18R2.11744 O=C(C=Cc1cccnc1)NCc2ccoc2 11a_100015206860_100000735890 [0,0,0,0,1,0|3,0,0]=4 3345 B18R2.11744 O=C(C=Cc1cccnc1)NCc2ccoc2 240690a_100015206860_100000735890 [0,0,0,0,1,0|3,0,0]=4 3346 B18R2.11744 O=C(C=Cc1cccnc1)NCc2ccsc2 11a_100000186416_100000735890 [0,0,0,0,1,0|3,0,0]=4 3347 B18R2.11744 O=C(C=Cc1cccnc1)NCc2ccsc2 240690a_100000186416_100000735890 [0,0,0,0,1,0|3,0,0]=4 3348 B18R2.11744 O=C(C=Cc1ccco1)NNc2ccccc2 22a_100015195140_100000720202 [0,0,0,0,1,0|3,0,0]=4 3349 B18R2.11744 O=C(C=Cc1cccs1)CCc2ccccc2 1458a_100000182767_100000765856 [0,0,0,0,1,0|2,0,0]=3 3350 B18R2.11744 O=C(C=Cc1cccs1)CCc2ccccn2 1458a_100000182767_100015183660 [0,0,0,0,1,0|3,0,0]=4 3351 B18R2.11744 O=C(C=Cc1cccs1)CCc2cccnc2 1458a_100000182767_200011713674 [0,0,0,0,1,0|3,0,0]=4 3352 B18R2.11744 O=C(C=Cc1cccs1)CCc2ccncc2 1458a_100000182767_100000723409 [0,0,0,0,1,0|3,0,0]=4 3353 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccc2 11a_100015324214_100000182767 [0,0,0,0,1,0|2,0,0]=3 3354 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccc2 1626a_100015324214_100000182767 [0,0,0,0,1,0|2,0,0]=3 3355 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccc2 240690a_100015324214_100000182767 [0,0,0,0,1,0|2,0,0]=3 3356 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccn2 11a_100000210449_100000182767 [0,0,0,0,1,0|3,0,0]=4 3357 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccn2 1626a_100000210449_100000182767 [0,0,0,0,1,0|3,0,0]=4 3358 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccn2 240690a_100000210449_100000182767 [0,0,0,0,1,0|3,0,0]=4 3359 B18R2.11744 O=C(C=Cc1cccs1)NCc2cccnc2 11a_100000210453_100000182767 [0,0,0,0,1,0|3,0,0]=4 3360 B18R2.11744 O=C(C=Cc1cccs1)NCc2cccnc2 240690a_100000210453_100000182767 [0,0,0,0,1,0|3,0,0]=4 3361 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccncc2 11a_100000210450_100000182767 [0,0,0,0,1,0|3,0,0]=4 3362 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccncc2 1626a_100000210450_100000182767 [0,0,0,0,1,0|3,0,0]=4 3363 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccncc2 240690a_100000210450_100000182767 [0,0,0,0,1,0|3,0,0]=4 3364 B18R2.11744 O=C(C=Cc1cccs1)NNc2ccccc2 22a_100015195140_100000182767 [0,0,0,0,1,0|3,0,0]=4 3365 B18R2.11744 O=C(C=Cc1ccncc1)CCc2cccs2 1458a_100000682801_100000748579 [0,0,0,0,1,0|3,0,0]=4 3366 B18R2.11744 O=C(C=Cc1ccncc1)CCn2cccc2 1458a_100000682801_200000035178 [0,0,0,0,1,0|3,0,0]=4 3367 B18R2.11744 O=C(C=Cc1ccncc1)NCc2ccc[nH]2 240690a_100000764082_100000682801 [0,0,0,0,1,0|3,0,0]=4 3368 B18R2.11744 O=C(C=Cc1ccncc1)NCc2ccco2 240690a_100000185738_100000682801 [0,0,0,0,1,0|3,0,0]=4 3369 B18R2.11744 O=C(C=Cc1ccncc1)NCc2cccs2 240690a_100000211653_100000682801 [0,0,0,0,1,0|3,0,0]=4 3370 B18R2.11744 O=C(C=Cc1ccncc1)NCc2ccoc2 240690a_100015206860_100000682801 [0,0,0,0,1,0|3,0,0]=4 3371 B18R2.11744 O=C(C=Cc1ccncc1)NCc2ccsc2 240690a_100000186416_100000682801 [0,0,0,0,1,0|3,0,0]=4 3372 B18R2.11744 O=C(C=Cc1ccoc1)CCc2ccccc2 1458a_100000238621_100000765856 [0,0,0,0,1,0|2,0,0]=3 3373 B18R2.11744 O=C(C=Cc1ccoc1)CCc2ccccn2 1458a_100000238621_100015183660 [0,0,0,0,1,0|3,0,0]=4 3374 B18R2.11744 O=C(C=Cc1ccoc1)CCc2cccnc2 1458a_100000238621_200011713674 [0,0,0,0,1,0|3,0,0]=4 3375 B18R2.11744 O=C(C=Cc1ccoc1)CCc2ccncc2 1458a_100000238621_100000723409 [0,0,0,0,1,0|3,0,0]=4 3376 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccc2 11a_100015324214_100000238621 [0,0,0,0,1,0|2,0,0]=3 3377 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccc2 1626a_100015324214_100000238621 [0,0,0,0,1,0|2,0,0]=3 3378 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccc2 240690a_100015324214_100000238621 [0,0,0,0,1,0|2,0,0]=3 3379 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccn2 11a_100000210449_100000238621 [0,0,0,0,1,0|3,0,0]=4 3380 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccn2 1626a_100000210449_100000238621 [0,0,0,0,1,0|3,0,0]=4 3381 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccn2 240690a_100000210449_100000238621 [0,0,0,0,1,0|3,0,0]=4 3382 B18R2.11744 O=C(C=Cc1ccoc1)NCc2cccnc2 11a_100000210453_100000238621 [0,0,0,0,1,0|3,0,0]=4 3383 B18R2.11744 O=C(C=Cc1ccoc1)NCc2cccnc2 240690a_100000210453_100000238621 [0,0,0,0,1,0|3,0,0]=4 3384 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccncc2 11a_100000210450_100000238621 [0,0,0,0,1,0|3,0,0]=4 3385 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccncc2 1626a_100000210450_100000238621 [0,0,0,0,1,0|3,0,0]=4 3386 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccncc2 240690a_100000210450_100000238621 [0,0,0,0,1,0|3,0,0]=4 3387 B18R2.11744 O=C(C=Cc1ccoc1)NNc2ccccc2 22a_100015195140_100000238621 [0,0,0,0,1,0|3,0,0]=4 3388 B18R2.11744 O=C(C=Cc1ccsc1)CCc2ccccc2 1458a_100000698588_100000765856 [0,0,0,0,1,0|2,0,0]=3 3389 B18R2.11744 O=C(C=Cc1ccsc1)CCc2ccccn2 1458a_100000698588_100015183660 [0,0,0,0,1,0|3,0,0]=4 3390 B18R2.11744 O=C(C=Cc1ccsc1)CCc2cccnc2 1458a_100000698588_200011713674 [0,0,0,0,1,0|3,0,0]=4 3391 B18R2.11744 O=C(C=Cc1ccsc1)CCc2ccncc2 1458a_100000698588_100000723409 [0,0,0,0,1,0|3,0,0]=4 3392 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccc2 11a_100015324214_100000698588 [0,0,0,0,1,0|2,0,0]=3 3393 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccc2 1626a_100015324214_100000698588 [0,0,0,0,1,0|2,0,0]=3 3394 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccc2 240690a_100015324214_100000698588 [0,0,0,0,1,0|2,0,0]=3 3395 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccc2 527a_100015324214_100000698588 [0,0,0,0,1,0|2,0,0]=3 3396 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccn2 11a_100000210449_100000698588 [0,0,0,0,1,0|3,0,0]=4 3397 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccn2 1626a_100000210449_100000698588 [0,0,0,0,1,0|3,0,0]=4 3398 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccn2 240690a_100000210449_100000698588 [0,0,0,0,1,0|3,0,0]=4 3399 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccn2 527a_100000210449_100000698588 [0,0,0,0,1,0|3,0,0]=4 3400 B18R2.11744 O=C(C=Cc1ccsc1)NCc2cccnc2 11a_100000210453_100000698588 [0,0,0,0,1,0|3,0,0]=4 3401 B18R2.11744 O=C(C=Cc1ccsc1)NCc2cccnc2 240690a_100000210453_100000698588 [0,0,0,0,1,0|3,0,0]=4 3402 B18R2.11744 O=C(C=Cc1ccsc1)NCc2cccnc2 527a_100000210453_100000698588 [0,0,0,0,1,0|3,0,0]=4 3403 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccncc2 11a_100000210450_100000698588 [0,0,0,0,1,0|3,0,0]=4 3404 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccncc2 1626a_100000210450_100000698588 [0,0,0,0,1,0|3,0,0]=4 3405 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccncc2 240690a_100000210450_100000698588 [0,0,0,0,1,0|3,0,0]=4 3406 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccncc2 527a_100000210450_100000698588 [0,0,0,0,1,0|3,0,0]=4 3407 B18R2.11744 O=C(C=Cc1ccsc1)NNc2ccccc2 22a_100015195140_100000698588 [0,0,0,0,1,0|3,0,0]=4 3408 B18R2.11744 O=C(C=Cc1cscn1)CCc2ccccc2 1458a_200000747928_100000765856 [0,0,0,0,1,0|3,0,0]=4 3409 B18R2.11744 O=C(C=Cc1cscn1)NCc2ccccc2 11a_100015324214_200000747928 [0,0,0,0,1,0|3,0,0]=4 3410 B18R2.11744 O=C(C=Cc1cscn1)NCc2ccccc2 1626a_100015324214_200000747928 [0,0,0,0,1,0|3,0,0]=4 3411 B18R2.11744 O=C(C=Cc1cscn1)NCc2ccccc2 240690a_100015324214_200000747928 [0,0,0,0,1,0|3,0,0]=4 3412 B18R2.11744 O=C(C=Cc1nccs1)CCc2ccccc2 1458a_100102558208_100000765856 [0,0,0,0,1,0|3,0,0]=4 3413 B18R2.11744 O=C(C=Cc1nccs1)CCc2ccccc2 6a_100000750902_100000210092 [0,0,0,0,1,0|3,0,0]=4 3414 B18R2.11744 O=C(C=Cc1nccs1)NCc2ccccc2 11a_100015324214_100102558208 [0,0,0,0,1,0|3,0,0]=4 3415 B18R2.11744 O=C(C=Cc1nccs1)NCc2ccccc2 240690a_100015324214_100102558208 [0,0,0,0,1,0|3,0,0]=4 3416 B18R2.11744 O=C(COc1ccsc1)OCc2ccccc2 34a_100000106738_100000753625 [0,0,0,0,1,0|2,0,1]=4 3417 B18R2.11744 O=C(COc1ccsc1)OCc2ccccc2 7a_100000106738_100000753625 [0,0,0,0,1,0|2,0,1]=4 3418 B18R2.11744 O=C(CSc1ccco1)OCc2ccccc2 62a_100000753625_100009814098 [0,0,0,0,1,0|2,0,1]=4 3419 B18R2.11744 O=C(CSc1ccco1)OCc2ccccc2 62a_100009814098_100000753625 [0,0,0,0,1,0|2,0,1]=4 3420 B18R2.11744 O=C(CSc1cccs1)OCc2ccccc2 62a_100000753625_100011215356 [0,0,0,0,1,0|2,0,1]=4 3421 B18R2.11744 O=C(CSc1cccs1)OCc2ccccc2 62a_100011215356_100000753625 [0,0,0,0,1,0|2,0,1]=4 3422 B18R2.11744 O=C(CSc1ccoc1)OCc2ccccc2 62a_100000753625_100011215275 [0,0,0,0,1,0|2,0,1]=4 3423 B18R2.11744 O=C(CSc1ccoc1)OCc2ccccc2 62a_100011215275_100000753625 [0,0,0,0,1,0|2,0,1]=4 3424 B18R2.11744 O=C(CSc1ccsc1)OCc2ccccc2 62a_100000738268_100000753625 [0,0,0,0,1,0|2,0,1]=4 3425 B18R2.11744 O=C(CSc1ccsc1)OCc2ccccc2 62a_100000753625_100000738268 [0,0,0,0,1,0|2,0,1]=4 3426 B20R2.174735 CC(=NNCc1ccccc1)C=Cc2ccccc2 4a_100000007032_100000204604 [0,0,0,0,0,1|2,0,0]=3 3427 B20R2.174735 CC(=NNCc1ccccc1)C=Cc2ccccn2 4a_100000007032_100102710650 [0,0,0,0,0,1|3,0,0]=4 3428 B20R2.174735 CC(=NNCc1ccccn1)C=Cc2ccccc2 4a_100000736832_100000204604 [0,0,0,0,0,1|3,0,0]=4 3429 B20R2.174735 CC(=NNCc1cccnc1)C=Cc2ccccc2 4a_100000738295_100000204604 [0,0,0,0,0,1|3,0,0]=4 3430 B20R2.174735 CC(=NNCc1ccncc1)C=Cc2ccccc2 4a_100000736929_100000204604 [0,0,0,0,0,1|3,0,0]=4 3431 B20R2.174735 CC(=NNc1ccccc1)COCc2ccccc2 4a_100015195140_100011215004 [0,0,0,0,0,1|3,0,0]=4 3432 B20R2.174735 CN(C/C=C/c1ccccc1)CCc2ccccc2 2230a_100000207497_100016265936 [0,0,0,0,0,1|3,0,0]=4 3433 B20R2.174735 CN(C/C=C/c1ccccc1)CCc2ccccc2 269982a_100000207497_100016265936 [0,0,0,0,0,1|3,0,0]=4 3434 B20R2.174735 CN(CC=Cc1ccccc1)CCc2ccccc2 270004a_100000207497_100000210105 [0,0,0,0,0,1|3,0,0]=4 3435 B20R2.174735 O=C(C#Cc1ccccc1)C/C=C/c2ccccc2 1458a_100000736102_100016265936 [0,0,0,0,0,1|1,0,1]=3 3436 B20R2.174735 O=C(C#Cc1ccccc1)CCCc2ccccc2 1458a_100000736102_100000211621 [0,0,0,0,0,1|1,0,2]=4 3437 B20R2.174735 O=C(C#Cc1ccccc1)CCOc2ccccc2 1458a_100000736102_100000184471 [0,0,0,0,0,1|1,0,2]=4 3438 B20R2.174735 O=C(C#Cc1ccccc1)CCSc2ccccc2 1458a_100000736102_100000246102 [0,0,0,0,0,1|1,0,2]=4 3439 B20R2.174735 O=C(C#Cc1ccccc1)CSCc2ccccc2 1458a_100000736102_200011217039 [0,0,0,0,0,1|0,1,2]=4 3440 B20R2.174735 O=C(C#Cc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000736102 [0,0,0,0,0,1|1,0,2]=4 3441 B20R2.174735 O=C(C#Cc1ccccc1)NNCc2ccccc2 22a_100000007032_100000736102 [0,0,0,0,0,1|1,0,2]=4 3442 B20R2.174735 O=C(C#Cc1ccccn1)C/C=C/c2ccccc2 1458a_102125277312_100016265936 [0,0,0,0,0,1|2,0,1]=4 3443 B20R2.174735 O=C(C/C=C/c1ccccc1)CCc2ccccc2 1458a_100000185753_100016265936 [0,0,0,0,0,1|1,0,0]=2 3444 B20R2.174735 O=C(C/C=C/c1ccccc1)CCc2ccccc2 1458a_100011219626_100000765856 [0,0,0,0,0,1|1,0,0]=2 3445 B20R2.174735 O=C(C/C=C/c1ccccc1)CCc2ccccn2 1458a_100011219626_100015183660 [0,0,0,0,0,1|2,0,0]=3 3446 B20R2.174735 O=C(C/C=C/c1ccccc1)CCc2ccccn2 1458a_100015195070_100016265936 [0,0,0,0,0,1|2,0,0]=3 3447 B20R2.174735 O=C(C/C=C/c1ccccc1)CCc2cccnc2 1458a_100000198484_100016265936 [0,0,0,0,0,1|2,0,0]=3 3448 B20R2.174735 O=C(C/C=C/c1ccccc1)CCc2cccnc2 1458a_100011219626_200011713674 [0,0,0,0,0,1|2,0,0]=3 3449 B20R2.174735 O=C(C/C=C/c1ccccc1)CCc2ccncc2 1458a_100011219626_100000723409 [0,0,0,0,0,1|2,0,0]=3 3450 B20R2.174735 O=C(C/C=C/c1ccccc1)CCc2ccncc2 1458a_100011225043_100016265936 [0,0,0,0,0,1|2,0,0]=3 3451 B20R2.174735 O=C(C/C=C/c1ccccc1)COc2ccccc2 1458a_100000186222_100016265936 [0,0,0,0,0,1|2,0,0]=3 3452 B20R2.174735 O=C(C/C=C/c1ccccc1)COc2ccccn2 1458a_100102699861_100016265936 [0,0,0,0,0,1|3,0,0]=4 3453 B20R2.174735 O=C(C/C=C/c1ccccc1)COc2cccnc2 1458a_100015207166_100016265936 [0,0,0,0,0,1|3,0,0]=4 3454 B20R2.174735 O=C(C/C=C/c1ccccc1)CSc2ccccc2 1458a_100000211596_100016265936 [0,0,0,0,0,1|2,0,0]=3 3455 B20R2.174735 O=C(C/C=C/c1ccccc1)CSc2ccccn2 1458a_100000156281_100016265936 [0,0,0,0,0,1|3,0,0]=4 3456 B20R2.174735 O=C(C/C=C/c1ccccc1)CSc2ccncc2 1458a_100000211328_100016265936 [0,0,0,0,0,1|3,0,0]=4 3457 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccccc2 11a_100015324214_100011219626 [0,0,0,0,0,1|1,0,0]=2 3458 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccccc2 1626a_100015324214_100011219626 [0,0,0,0,0,1|1,0,0]=2 3459 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccccc2 240690a_100015324214_100011219626 [0,0,0,0,0,1|1,0,0]=2 3460 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccccn2 11a_100000210449_100011219626 [0,0,0,0,0,1|2,0,0]=3 3461 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccccn2 1626a_100000210449_100011219626 [0,0,0,0,0,1|2,0,0]=3 3462 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccccn2 240690a_100000210449_100011219626 [0,0,0,0,0,1|2,0,0]=3 3463 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2cccnc2 11a_100000210453_100011219626 [0,0,0,0,0,1|2,0,0]=3 3464 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2cccnc2 240690a_100000210453_100011219626 [0,0,0,0,0,1|2,0,0]=3 3465 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2cccnn2 11a_100159270163_100011219626 [0,0,0,0,0,1|3,0,0]=4 3466 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2cccnn2 240690a_100159270163_100011219626 [0,0,0,0,0,1|3,0,0]=4 3467 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccncc2 11a_100000210450_100011219626 [0,0,0,0,0,1|2,0,0]=3 3468 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccncc2 1626a_100000210450_100011219626 [0,0,0,0,0,1|2,0,0]=3 3469 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccncc2 240690a_100000210450_100011219626 [0,0,0,0,0,1|2,0,0]=3 3470 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccncn2 11a_100000736019_100011219626 [0,0,0,0,0,1|3,0,0]=4 3471 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ccncn2 240690a_100000736019_100011219626 [0,0,0,0,0,1|3,0,0]=4 3472 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2cnccn2 11a_100000737960_100011219626 [0,0,0,0,0,1|3,0,0]=4 3473 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2cnccn2 240690a_100000737960_100011219626 [0,0,0,0,0,1|3,0,0]=4 3474 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2cncnc2 11a_100011243677_100011219626 [0,0,0,0,0,1|3,0,0]=4 3475 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2cncnc2 240690a_100011243677_100011219626 [0,0,0,0,0,1|3,0,0]=4 3476 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ncccn2 11a_100015189908_100011219626 [0,0,0,0,0,1|3,0,0]=4 3477 B20R2.174735 O=C(C/C=C/c1ccccc1)NCc2ncccn2 240690a_100015189908_100011219626 [0,0,0,0,0,1|3,0,0]=4 3478 B20R2.174735 O=C(C/C=C/c1ccccc1)NNc2ccccc2 22a_100015195140_100011219626 [0,0,0,0,0,1|2,0,0]=3 3479 B20R2.174735 O=C(C/C=C/c1ccccc1)NNc2ccccn2 22a_100000183288_100011219626 [0,0,0,0,0,1|3,0,0]=4 3480 B20R2.174735 O=C(C/C=C/c1ccccc1)NNc2cccnc2 22a_100000728903_100011219626 [0,0,0,0,0,1|3,0,0]=4 3481 B20R2.174735 O=C(C/C=C/c1ccccc1)NNc2ccncc2 22a_100000698918_100011219626 [0,0,0,0,0,1|3,0,0]=4 3482 B20R2.174735 O=C(C=CSc1ccccc1)CCc2ccccc2 1458a_100016262050_100000765856 [0,0,0,0,0,1|1,0,0]=2 3483 B20R2.174735 O=C(C=CSc1ccccc1)CCc2ccccn2 1458a_100016262050_100015183660 [0,0,0,0,0,1|2,0,0]=3 3484 B20R2.174735 O=C(C=CSc1ccccc1)CCc2cccnc2 1458a_100016262050_200011713674 [0,0,0,0,0,1|2,0,0]=3 3485 B20R2.174735 O=C(C=CSc1ccccc1)CCc2ccncc2 1458a_100016262050_100000723409 [0,0,0,0,0,1|2,0,0]=3 3486 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccccc2 11a_100015324214_100016262050 [0,0,0,0,0,1|1,0,0]=2 3487 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccccc2 1626a_100015324214_100016262050 [0,0,0,0,0,1|1,0,0]=2 3488 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccccc2 240690a_100015324214_100016262050 [0,0,0,0,0,1|1,0,0]=2 3489 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccccn2 11a_100000210449_100016262050 [0,0,0,0,0,1|2,0,0]=3 3490 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccccn2 1626a_100000210449_100016262050 [0,0,0,0,0,1|2,0,0]=3 3491 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccccn2 240690a_100000210449_100016262050 [0,0,0,0,0,1|2,0,0]=3 3492 B20R2.174735 O=C(C=CSc1ccccc1)NCc2cccnc2 11a_100000210453_100016262050 [0,0,0,0,0,1|2,0,0]=3 3493 B20R2.174735 O=C(C=CSc1ccccc1)NCc2cccnc2 240690a_100000210453_100016262050 [0,0,0,0,0,1|2,0,0]=3 3494 B20R2.174735 O=C(C=CSc1ccccc1)NCc2cccnn2 11a_100159270163_100016262050 [0,0,0,0,0,1|3,0,0]=4 3495 B20R2.174735 O=C(C=CSc1ccccc1)NCc2cccnn2 240690a_100159270163_100016262050 [0,0,0,0,0,1|3,0,0]=4 3496 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccncc2 11a_100000210450_100016262050 [0,0,0,0,0,1|2,0,0]=3 3497 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccncc2 1626a_100000210450_100016262050 [0,0,0,0,0,1|2,0,0]=3 3498 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccncc2 240690a_100000210450_100016262050 [0,0,0,0,0,1|2,0,0]=3 3499 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccncn2 11a_100000736019_100016262050 [0,0,0,0,0,1|3,0,0]=4 3500 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ccncn2 240690a_100000736019_100016262050 [0,0,0,0,0,1|3,0,0]=4 3501 B20R2.174735 O=C(C=CSc1ccccc1)NCc2cnccn2 11a_100000737960_100016262050 [0,0,0,0,0,1|3,0,0]=4 3502 B20R2.174735 O=C(C=CSc1ccccc1)NCc2cnccn2 240690a_100000737960_100016262050 [0,0,0,0,0,1|3,0,0]=4 3503 B20R2.174735 O=C(C=CSc1ccccc1)NCc2cncnc2 11a_100011243677_100016262050 [0,0,0,0,0,1|3,0,0]=4 3504 B20R2.174735 O=C(C=CSc1ccccc1)NCc2cncnc2 240690a_100011243677_100016262050 [0,0,0,0,0,1|3,0,0]=4 3505 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ncccn2 11a_100015189908_100016262050 [0,0,0,0,0,1|3,0,0]=4 3506 B20R2.174735 O=C(C=CSc1ccccc1)NCc2ncccn2 240690a_100015189908_100016262050 [0,0,0,0,0,1|3,0,0]=4 3507 B20R2.174735 O=C(C=CSc1ccccc1)NNc2ccccc2 22a_100015195140_100016262050 [0,0,0,0,0,1|2,0,0]=3 3508 B20R2.174735 O=C(C=CSc1ccccc1)NNc2ccccn2 22a_100000183288_100016262050 [0,0,0,0,0,1|3,0,0]=4 3509 B20R2.174735 O=C(C=CSc1ccccc1)NNc2cccnc2 22a_100000728903_100016262050 [0,0,0,0,0,1|3,0,0]=4 3510 B20R2.174735 O=C(C=CSc1ccccc1)NNc2ccncc2 22a_100000698918_100016262050 [0,0,0,0,0,1|3,0,0]=4 3511 B20R2.174735 O=C(C=Cc1ccccc1)C/C=C/c2ccccc2 1458a_100000210462_100016265936 [0,0,0,0,0,1|1,0,1]=3 3512 B20R2.174735 O=C(C=Cc1ccccc1)CC#Cc2ccccc2 1458a_100000210462_100011352542 [0,0,0,0,0,1|1,0,1]=3 3513 B20R2.174735 O=C(C=Cc1ccccc1)CCCc2ccccc2 1458a_100000210462_100000211621 [0,0,0,0,0,1|1,0,0]=2 3514 B20R2.174735 O=C(C=Cc1ccccc1)CCOc2ccccc2 1458a_100000210462_100000184471 [0,0,0,0,0,1|1,0,0]=2 3515 B20R2.174735 O=C(C=Cc1ccccc1)CCSc2ccccc2 1458a_100000210462_100000246102 [0,0,0,0,0,1|1,0,0]=2 3516 B20R2.174735 O=C(C=Cc1ccccc1)CSCc2ccccc2 1458a_100000210462_200011217039 [0,0,0,0,0,1|0,1,0]=2 3517 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccccc2 11a_100000106460_100000210462 [0,0,0,0,0,1|1,0,0]=2 3518 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000210462 [0,0,0,0,0,1|1,0,0]=2 3519 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccccn2 11a_100000211156_100000210462 [0,0,0,0,0,1|2,0,0]=3 3520 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccccn2 1626a_100000211156_100000210462 [0,0,0,0,0,1|2,0,0]=3 3521 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2cccnc2 11a_100000736294_100000210462 [0,0,0,0,0,1|2,0,0]=3 3522 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2cccnc2 1626a_100000736294_100000210462 [0,0,0,0,0,1|2,0,0]=3 3523 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccncc2 11a_100000742849_100000210462 [0,0,0,0,0,1|2,0,0]=3 3524 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccncc2 1626a_100000742849_100000210462 [0,0,0,0,0,1|2,0,0]=3 3525 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2cnccn2 11a_100000723456_100000210462 [0,0,0,0,0,1|3,0,0]=4 3526 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2cnccn2 1626a_100000723456_100000210462 [0,0,0,0,0,1|3,0,0]=4 3527 B20R2.174735 O=C(C=Cc1ccccc1)NNCc2ccccc2 22a_100000007032_100000210462 [0,0,0,0,0,1|1,0,0]=2 3528 B20R2.174735 O=C(C=Cc1ccccc1)NNCc2ccccn2 22a_100000736832_100000210462 [0,0,0,0,0,1|2,0,0]=3 3529 B20R2.174735 O=C(C=Cc1ccccc1)NNCc2cccnc2 22a_100000738295_100000210462 [0,0,0,0,0,1|2,0,0]=3 3530 B20R2.174735 O=C(C=Cc1ccccc1)NNCc2ccncc2 22a_100000736929_100000210462 [0,0,0,0,0,1|2,0,0]=3 3531 B20R2.174735 O=C(C=Cc1ccccn1)C/C=C/c2ccccc2 1458a_100000740811_100016265936 [0,0,0,0,0,1|2,0,1]=4 3532 B20R2.174735 O=C(C=Cc1ccccn1)CC#Cc2ccccc2 1458a_100000740811_100011352542 [0,0,0,0,0,1|2,0,1]=4 3533 B20R2.174735 O=C(C=Cc1ccccn1)CCCc2ccccc2 1458a_100000740811_100000211621 [0,0,0,0,0,1|2,0,0]=3 3534 B20R2.174735 O=C(C=Cc1ccccn1)CCOc2ccccc2 1458a_100000740811_100000184471 [0,0,0,0,0,1|2,0,0]=3 3535 B20R2.174735 O=C(C=Cc1ccccn1)CCSc2ccccc2 1458a_100000740811_100000246102 [0,0,0,0,0,1|2,0,0]=3 3536 B20R2.174735 O=C(C=Cc1ccccn1)CSCc2ccccc2 1458a_100000740811_200011217039 [0,0,0,0,0,1|1,1,0]=3 3537 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccccc2 11a_100000106460_100000740811 [0,0,0,0,0,1|2,0,0]=3 3538 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccccc2 240690a_100000106460_100000740811 [0,0,0,0,0,1|2,0,0]=3 3539 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccccn2 11a_100000211156_100000740811 [0,0,0,0,0,1|3,0,0]=4 3540 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccccn2 240690a_100000211156_100000740811 [0,0,0,0,0,1|3,0,0]=4 3541 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2cccnc2 11a_100000736294_100000740811 [0,0,0,0,0,1|3,0,0]=4 3542 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2cccnc2 240690a_100000736294_100000740811 [0,0,0,0,0,1|3,0,0]=4 3543 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccncc2 11a_100000742849_100000740811 [0,0,0,0,0,1|3,0,0]=4 3544 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccncc2 240690a_100000742849_100000740811 [0,0,0,0,0,1|3,0,0]=4 3545 B20R2.174735 O=C(C=Cc1ccccn1)NNCc2ccccc2 22a_100000007032_100000740811 [0,0,0,0,0,1|2,0,0]=3 3546 B20R2.174735 O=C(C=Cc1ccccn1)NNCc2ccccn2 22a_100000736832_100000740811 [0,0,0,0,0,1|3,0,0]=4 3547 B20R2.174735 O=C(C=Cc1ccccn1)NNCc2cccnc2 22a_100000738295_100000740811 [0,0,0,0,0,1|3,0,0]=4 3548 B20R2.174735 O=C(C=Cc1ccccn1)NNCc2ccncc2 22a_100000736929_100000740811 [0,0,0,0,0,1|3,0,0]=4 3549 B20R2.174735 O=C(C=Cc1cccnc1)C/C=C/c2ccccc2 1458a_100000735890_100016265936 [0,0,0,0,0,1|2,0,1]=4 3550 B20R2.174735 O=C(C=Cc1cccnc1)CC#Cc2ccccc2 1458a_100000735890_100011352542 [0,0,0,0,0,1|2,0,1]=4 3551 B20R2.174735 O=C(C=Cc1cccnc1)CCCc2ccccc2 1458a_100000735890_100000211621 [0,0,0,0,0,1|2,0,0]=3 3552 B20R2.174735 O=C(C=Cc1cccnc1)CCOc2ccccc2 1458a_100000735890_100000184471 [0,0,0,0,0,1|2,0,0]=3 3553 B20R2.174735 O=C(C=Cc1cccnc1)CCSc2ccccc2 1458a_100000735890_100000246102 [0,0,0,0,0,1|2,0,0]=3 3554 B20R2.174735 O=C(C=Cc1cccnc1)CSCc2ccccc2 1458a_100000735890_200011217039 [0,0,0,0,0,1|1,1,0]=3 3555 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccccc2 11a_100000106460_100000735890 [0,0,0,0,0,1|2,0,0]=3 3556 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccccc2 240690a_100000106460_100000735890 [0,0,0,0,0,1|2,0,0]=3 3557 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccccn2 11a_100000211156_100000735890 [0,0,0,0,0,1|3,0,0]=4 3558 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccccn2 240690a_100000211156_100000735890 [0,0,0,0,0,1|3,0,0]=4 3559 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2cccnc2 11a_100000736294_100000735890 [0,0,0,0,0,1|3,0,0]=4 3560 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2cccnc2 240690a_100000736294_100000735890 [0,0,0,0,0,1|3,0,0]=4 3561 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccncc2 11a_100000742849_100000735890 [0,0,0,0,0,1|3,0,0]=4 3562 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccncc2 240690a_100000742849_100000735890 [0,0,0,0,0,1|3,0,0]=4 3563 B20R2.174735 O=C(C=Cc1cccnc1)NNCc2ccccc2 22a_100000007032_100000735890 [0,0,0,0,0,1|2,0,0]=3 3564 B20R2.174735 O=C(C=Cc1cccnc1)NNCc2ccccn2 22a_100000736832_100000735890 [0,0,0,0,0,1|3,0,0]=4 3565 B20R2.174735 O=C(C=Cc1cccnc1)NNCc2cccnc2 22a_100000738295_100000735890 [0,0,0,0,0,1|3,0,0]=4 3566 B20R2.174735 O=C(C=Cc1cccnc1)NNCc2ccncc2 22a_100000736929_100000735890 [0,0,0,0,0,1|3,0,0]=4 3567 B20R2.174735 O=C(C=Cc1ccncc1)C/C=C/c2ccccc2 1458a_100000682801_100016265936 [0,0,0,0,0,1|2,0,1]=4 3568 B20R2.174735 O=C(C=Cc1ccncc1)CC#Cc2ccccc2 1458a_100000682801_100011352542 [0,0,0,0,0,1|2,0,1]=4 3569 B20R2.174735 O=C(C=Cc1ccncc1)CCCc2ccccc2 1458a_100000682801_100000211621 [0,0,0,0,0,1|2,0,0]=3 3570 B20R2.174735 O=C(C=Cc1ccncc1)CCOc2ccccc2 1458a_100000682801_100000184471 [0,0,0,0,0,1|2,0,0]=3 3571 B20R2.174735 O=C(C=Cc1ccncc1)CCSc2ccccc2 1458a_100000682801_100000246102 [0,0,0,0,0,1|2,0,0]=3 3572 B20R2.174735 O=C(C=Cc1ccncc1)CSCc2ccccc2 1458a_100000682801_200011217039 [0,0,0,0,0,1|1,1,0]=3 3573 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2ccccc2 240690a_100000106460_100000682801 [0,0,0,0,0,1|2,0,0]=3 3574 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2ccccn2 240690a_100000211156_100000682801 [0,0,0,0,0,1|3,0,0]=4 3575 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2cccnc2 240690a_100000736294_100000682801 [0,0,0,0,0,1|3,0,0]=4 3576 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2ccncc2 240690a_100000742849_100000682801 [0,0,0,0,0,1|3,0,0]=4 3577 B20R2.174735 O=C(C=Cc1ccncc1)NNCc2ccccc2 22a_100000007032_100000682801 [0,0,0,0,0,1|2,0,0]=3 3578 B20R2.174735 O=C(C=Cc1ccncc1)NNCc2ccccn2 22a_100000736832_100000682801 [0,0,0,0,0,1|3,0,0]=4 3579 B20R2.174735 O=C(C=Cc1ccncc1)NNCc2cccnc2 22a_100000738295_100000682801 [0,0,0,0,0,1|3,0,0]=4 3580 B20R2.174735 O=C(C=Cc1ccncc1)NNCc2ccncc2 22a_100000736929_100000682801 [0,0,0,0,0,1|3,0,0]=4 3581 B20R2.174735 O=C(C=Cc1cncnc1)COCc2ccccc2 6a_100000749868_100011215004 [0,0,0,0,0,1|2,0,0]=3 3582 B20R2.174735 O=C(C=Cc1cncnc1)CSCc2ccccc2 6a_100000749868_100000172147 [0,0,0,0,0,1|2,1,0]=4 3583 B20R2.174735 O=C(CC#Cc1ccccc1)CCc2ccccc2 1458a_100000185753_100011352542 [0,0,0,0,0,1|1,0,2]=4 3584 B20R2.174735 O=C(CCCc1ccccc1)CCc2ccccc2 1458a_100000185753_100000211621 [0,0,0,0,0,1|1,0,2]=4 3585 B20R2.174735 O=C(CCCc1ccccc1)CCc2ccccc2 1458a_100011207963_100000765856 [0,0,0,0,0,1|1,0,2]=4 3586 B20R2.174735 O=C(CCCc1ccccc1)COc2ccccc2 1458a_100000186222_100000211621 [0,0,0,0,0,1|2,0,1]=4 3587 B20R2.174735 O=C(CCCc1ccccc1)CSc2ccccc2 1458a_100000211596_100000211621 [0,0,0,0,0,1|2,0,1]=4 3588 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 11a_100015324214_100011207963 [0,0,0,0,0,1|1,0,2]=4 3589 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 1626a_100015324214_100011207963 [0,0,0,0,0,1|1,0,2]=4 3590 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 240690a_100015324214_100011207963 [0,0,0,0,0,1|1,0,2]=4 3591 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 527a_100015324214_100011207963 [0,0,0,0,0,1|1,0,2]=4 3592 B20R2.174735 O=C(CCCc1ccccc1)NNc2ccccc2 22a_100015195140_100011207963 [0,0,0,0,0,1|3,0,0]=4 3593 B20R2.174735 O=C(CCOc1ccccc1)CCc2ccccc2 1458a_100000182761_100000765856 [0,0,0,0,0,1|1,0,2]=4 3594 B20R2.174735 O=C(CCOc1ccccc1)CCc2ccccc2 1458a_100000185753_100000184471 [0,0,0,0,0,1|1,0,2]=4 3595 B20R2.174735 O=C(CCOc1ccccc1)COc2ccccc2 1458a_100000186222_100000184471 [0,0,0,0,0,1|2,0,1]=4 3596 B20R2.174735 O=C(CCOc1ccccc1)CSc2ccccc2 1458a_100000211596_100000184471 [0,0,0,0,0,1|2,0,1]=4 3597 B20R2.174735 O=C(CCOc1ccccc1)NCc2ccccc2 11a_100015324214_100000182761 [0,0,0,0,0,1|1,0,2]=4 3598 B20R2.174735 O=C(CCOc1ccccc1)NCc2ccccc2 1626a_100015324214_100000182761 [0,0,0,0,0,1|1,0,2]=4 3599 B20R2.174735 O=C(CCOc1ccccc1)NCc2ccccc2 240690a_100015324214_100000182761 [0,0,0,0,0,1|1,0,2]=4 3600 B20R2.174735 O=C(CCOc1ccccc1)NNc2ccccc2 22a_100015195140_100000182761 [0,0,0,0,0,1|3,0,0]=4 3601 B20R2.174735 O=C(CCOc1ccccc1)OCc2ccccc2 7a_100000210340_100009813219 [0,0,0,0,0,1|0,0,2]=3 3602 B20R2.174735 O=C(CCOc1cccnc1)OCc2ccccc2 7a_100000210849_100009813219 [0,0,0,0,0,1|1,0,2]=4 3603 B20R2.174735 O=C(CCSc1ccccc1)CCc2ccccc2 1458a_100000182436_100000765856 [0,0,0,0,0,1|1,0,2]=4 3604 B20R2.174735 O=C(CCSc1ccccc1)CCc2ccccc2 1458a_100000185753_100000246102 [0,0,0,0,0,1|1,0,2]=4 3605 B20R2.174735 O=C(CCSc1ccccc1)COc2ccccc2 1458a_100000186222_100000246102 [0,0,0,0,0,1|2,0,1]=4 3606 B20R2.174735 O=C(CCSc1ccccc1)CSc2ccccc2 1458a_100000211596_100000246102 [0,0,0,0,0,1|2,0,1]=4 3607 B20R2.174735 O=C(CCSc1ccccc1)NCc2ccccc2 11a_100015324214_100000182436 [0,0,0,0,0,1|1,0,2]=4 3608 B20R2.174735 O=C(CCSc1ccccc1)NCc2ccccc2 1626a_100015324214_100000182436 [0,0,0,0,0,1|1,0,2]=4 3609 B20R2.174735 O=C(CCSc1ccccc1)NCc2ccccc2 240690a_100015324214_100000182436 [0,0,0,0,0,1|1,0,2]=4 3610 B20R2.174735 O=C(CCSc1ccccc1)NNc2ccccc2 22a_100015195140_100000182436 [0,0,0,0,0,1|3,0,0]=4 3611 B20R2.174735 O=C(CCSc1ccccc1)OCc2ccccc2 62a_100000719477_100009813219 [0,0,0,0,0,1|0,0,2]=3 3612 B20R2.174735 O=C(CCSc1ccccc1)OCc2ccccc2 62a_100009813219_100000041952 [0,0,0,0,0,1|0,0,2]=3 3613 B20R2.174735 O=C(CCSc1ccccn1)OCc2ccccc2 62a_100009813219_100011216584 [0,0,0,0,0,1|1,0,2]=4 3614 B20R2.174735 O=C(CCSc1ccccn1)OCc2ccccc2 62a_100011216584_100009813219 [0,0,0,0,0,1|1,0,2]=4 3615 B20R2.174735 O=C(CCSc1cccnc1)OCc2ccccc2 62a_100000210063_100009813219 [0,0,0,0,0,1|1,0,2]=4 3616 B20R2.174735 O=C(CCSc1cccnc1)OCc2ccccc2 62a_100009813219_100000210063 [0,0,0,0,0,1|1,0,2]=4 3617 B20R2.174735 O=C(CCSc1ccncc1)OCc2ccccc2 62a_100000728582_100009813219 [0,0,0,0,0,1|1,0,2]=4 3618 B20R2.174735 O=C(CCSc1ccncc1)OCc2ccccc2 62a_100009813219_100000728582 [0,0,0,0,0,1|1,0,2]=4 3619 B20R2.174735 O=C(CCc1ccccc1)CNCc2ccccc2 2230a_100015324214_100012361361 [0,0,0,0,0,1|1,0,2]=4 3620 B20R2.174735 O=C(CCc1ccccc1)CNCc2ccccc2 34a_100015324214_100012361361 [0,0,0,0,0,1|1,0,2]=4 3621 B20R2.174735 O=C(CCc1ccccc1)COCc2ccccc2 1458a_100000230186_100000765856 [0,0,0,0,0,1|0,0,2]=3 3622 B20R2.174735 O=C(CCc1ccccc1)COCc2ccccc2 34a_100000210790_100012361361 [0,0,0,0,0,1|0,0,2]=3 3623 B20R2.174735 O=C(CCc1ccccc1)COCc2ccccc2 7a_100000210790_100012361361 [0,0,0,0,0,1|0,0,2]=3 3624 B20R2.174735 O=C(CCc1ccccc1)CSCc2ccccc2 1458a_100000150264_100000765856 [0,0,0,0,0,1|0,1,2]=4 3625 B20R2.174735 O=C(CCc1ccccc1)CSCc2ccccc2 1458a_100000185753_200011217039 [0,0,0,0,0,1|0,1,2]=4 3626 B20R2.174735 O=C(CCc1ccccc1)CSCc2ccccc2 62a_100000211182_100012361361 [0,0,0,0,0,1|0,1,2]=4 3627 B20R2.174735 O=C(CCc1ccccc1)CSCc2ccccc2 62a_100012361361_100015291786 [0,0,0,0,0,1|0,1,2]=4 3628 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccc2 11a_100000106460_100000185753 [0,0,0,0,0,1|1,0,2]=4 3629 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000185753 [0,0,0,0,0,1|1,0,2]=4 3630 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000185753 [0,0,0,0,0,1|1,0,2]=4 3631 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccc2 527a_100000106460_100000185753 [0,0,0,0,0,1|1,0,2]=4 3632 B20R2.174735 O=C(CCc1ccccc1)NN=Cc2ccccc2 4a_100000189782_100015611070 [0,0,0,0,0,1|2,0,0]=3 3633 B20R2.174735 O=C(CCc1ccccc1)NN=Cc2ccccn2 4a_100000189782_100000209966 [0,0,0,0,0,1|3,0,0]=4 3634 B20R2.174735 O=C(CCc1ccccc1)NN=Cc2cccnc2 4a_100000189782_100000209961 [0,0,0,0,0,1|3,0,0]=4 3635 B20R2.174735 O=C(CCc1ccccc1)NN=Cc2ccncc2 4a_100000189782_100000186114 [0,0,0,0,0,1|3,0,0]=4 3636 B20R2.174735 O=C(CCc1ccccc1)NNCc2ccccc2 22a_100000007032_100000185753 [0,0,0,0,0,1|1,0,2]=4 3637 B20R2.174735 O=C(CCc1ccccn1)COCc2ccccc2 1458a_100000230186_100015183660 [0,0,0,0,0,1|1,0,2]=4 3638 B20R2.174735 O=C(CCc1cccnc1)COCc2ccccc2 1458a_100000230186_200011713674 [0,0,0,0,0,1|1,0,2]=4 3639 B20R2.174735 O=C(CCc1ccncc1)COCc2ccccc2 1458a_100000230186_100000723409 [0,0,0,0,0,1|1,0,2]=4 3640 B20R2.174735 O=C(CNCc1ccccc1)NCc2ccccc2 2230a_100000739245_100015291786 [0,0,0,0,0,1|1,0,2]=4 3641 B20R2.174735 O=C(CNCc1ccccc1)NCc2ccccc2 2230a_100015324214_100000183539 [0,0,0,0,0,1|1,0,2]=4 3642 B20R2.174735 O=C(CNCc1ccccc1)NCc2ccccc2 270004a_100000739245_100015611070 [0,0,0,0,0,1|1,0,2]=4 3643 B20R2.174735 O=C(CNCc1ccccc1)NCc2ccccc2 34a_100015324214_100000183539 [0,0,0,0,0,1|1,0,2]=4 3644 B20R2.174735 O=C(CNCc1ccccc1)OCc2ccccc2 2230a_100015324214_100000753625 [0,0,0,0,0,1|0,0,2]=3 3645 B20R2.174735 O=C(CNCc1ccccc1)OCc2ccccc2 34a_100015324214_100000753625 [0,0,0,0,0,1|0,0,2]=3 3646 B20R2.174735 O=C(CNc1ccccc1)NCCc2ccccc2 34a_100000106764_100000183012 [0,0,0,0,0,1|2,0,1]=4 3647 B20R2.174735 O=C(CNc1ccccc1)NOCc2ccccc2 34a_100000106764_100000230105 [0,0,0,0,0,1|1,0,1]=3 3648 B20R2.174735 O=C(CNc1ccccc1)OCCc2ccccc2 34a_100000106764_200000077782 [0,0,0,0,0,1|1,0,1]=3 3649 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 11a_100015324214_100000230186 [0,0,0,0,0,1|1,0,1]=3 3650 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000230186 [0,0,0,0,0,1|1,0,1]=3 3651 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000230186 [0,0,0,0,0,1|1,0,1]=3 3652 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 34a_100000210790_100000183539 [0,0,0,0,0,1|1,0,1]=3 3653 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 527a_100015324214_100000230186 [0,0,0,0,0,1|1,0,1]=3 3654 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 7a_100000210790_100000183539 [0,0,0,0,0,1|1,0,1]=3 3655 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccn2 11a_100000210449_100000230186 [0,0,0,0,0,1|2,0,1]=4 3656 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccn2 1626a_100000210449_100000230186 [0,0,0,0,0,1|2,0,1]=4 3657 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccn2 240690a_100000210449_100000230186 [0,0,0,0,0,1|2,0,1]=4 3658 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccn2 34a_100000210790_100000684169 [0,0,0,0,0,1|2,0,1]=4 3659 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccn2 527a_100000210449_100000230186 [0,0,0,0,0,1|2,0,1]=4 3660 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccn2 7a_100000210790_100000684169 [0,0,0,0,0,1|2,0,1]=4 3661 B20R2.174735 O=C(COCc1ccccc1)NCc2cccnc2 11a_100000210453_100000230186 [0,0,0,0,0,1|2,0,1]=4 3662 B20R2.174735 O=C(COCc1ccccc1)NCc2cccnc2 240690a_100000210453_100000230186 [0,0,0,0,0,1|2,0,1]=4 3663 B20R2.174735 O=C(COCc1ccccc1)NCc2cccnc2 527a_100000210453_100000230186 [0,0,0,0,0,1|2,0,1]=4 3664 B20R2.174735 O=C(COCc1ccccc1)NCc2cccnc2 7a_100000210790_100000752408 [0,0,0,0,0,1|2,0,1]=4 3665 B20R2.174735 O=C(COCc1ccccc1)NCc2ccncc2 11a_100000210450_100000230186 [0,0,0,0,0,1|2,0,1]=4 3666 B20R2.174735 O=C(COCc1ccccc1)NCc2ccncc2 1626a_100000210450_100000230186 [0,0,0,0,0,1|2,0,1]=4 3667 B20R2.174735 O=C(COCc1ccccc1)NCc2ccncc2 240690a_100000210450_100000230186 [0,0,0,0,0,1|2,0,1]=4 3668 B20R2.174735 O=C(COCc1ccccc1)NCc2ccncc2 527a_100000210450_100000230186 [0,0,0,0,0,1|2,0,1]=4 3669 B20R2.174735 O=C(COCc1ccccc1)NCc2ccncc2 7a_100000210790_100011243468 [0,0,0,0,0,1|2,0,1]=4 3670 B20R2.174735 O=C(COCc1ccccc1)NNc2ccccc2 22a_100015195140_100000230186 [0,0,0,0,0,1|2,0,0]=3 3671 B20R2.174735 O=C(COCc1ccccc1)NNc2ccccn2 22a_100000183288_100000230186 [0,0,0,0,0,1|3,0,0]=4 3672 B20R2.174735 O=C(COCc1ccccc1)NNc2cccnc2 22a_100000728903_100000230186 [0,0,0,0,0,1|3,0,0]=4 3673 B20R2.174735 O=C(COCc1ccccc1)NNc2ccncc2 22a_100000698918_100000230186 [0,0,0,0,0,1|3,0,0]=4 3674 B20R2.174735 O=C(COCc1ccccc1)OCc2ccccc2 34a_100000210790_100000753625 [0,0,0,0,0,1|0,0,2]=3 3675 B20R2.174735 O=C(COCc1ccccc1)OCc2ccccc2 7a_100000210790_100000753625 [0,0,0,0,0,1|0,0,2]=3 3676 B20R2.174735 O=C(COc1ccccc1)CSCc2ccccc2 1458a_100000186222_200011217039 [0,0,0,0,0,1|1,1,1]=4 3677 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 11a_100000106460_100000186222 [0,0,0,0,0,1|2,0,1]=4 3678 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000186222 [0,0,0,0,0,1|2,0,1]=4 3679 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000186222 [0,0,0,0,0,1|2,0,1]=4 3680 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 34a_100000210340_100000183012 [0,0,0,0,0,1|2,0,1]=4 3681 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 527a_100000106460_100000186222 [0,0,0,0,0,1|2,0,1]=4 3682 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 7a_100000210340_100000183012 [0,0,0,0,0,1|2,0,1]=4 3683 B20R2.174735 O=C(COc1ccccc1)NN=Cc2ccccc2 4a_100000186219_100015611070 [0,0,0,0,0,1|3,0,0]=4 3684 B20R2.174735 O=C(COc1ccccc1)NNCc2ccccc2 22a_100000007032_100000186222 [0,0,0,0,0,1|2,0,1]=4 3685 B20R2.174735 O=C(COc1ccccc1)NOCc2ccccc2 34a_100000210340_100000230105 [0,0,0,0,0,1|1,0,1]=3 3686 B20R2.174735 O=C(COc1ccccc1)NOCc2ccccc2 7a_100000210340_100000230105 [0,0,0,0,0,1|1,0,1]=3 3687 B20R2.174735 O=C(COc1ccccc1)OCCc2ccccc2 34a_100000210340_200000077782 [0,0,0,0,0,1|1,0,1]=3 3688 B20R2.174735 O=C(COc1ccccc1)OCCc2ccccc2 7a_100000210340_200000077782 [0,0,0,0,0,1|1,0,1]=3 3689 B20R2.174735 O=C(COc1cccnc1)NOCc2ccccc2 34a_100000210849_100000230105 [0,0,0,0,0,1|2,0,1]=4 3690 B20R2.174735 O=C(COc1cccnc1)NOCc2ccccc2 7a_100000210849_100000230105 [0,0,0,0,0,1|2,0,1]=4 3691 B20R2.174735 O=C(COc1cccnc1)OCCc2ccccc2 34a_100000210849_200000077782 [0,0,0,0,0,1|2,0,1]=4 3692 B20R2.174735 O=C(COc1cccnc1)OCCc2ccccc2 7a_100000210849_200000077782 [0,0,0,0,0,1|2,0,1]=4 3693 B20R2.174735 O=C(COc1ccncc1)NOCc2ccccc2 34a_100000212176_100000230105 [0,0,0,0,0,1|2,0,1]=4 3694 B20R2.174735 O=C(COc1ccncc1)OCCc2ccccc2 34a_100000212176_200000077782 [0,0,0,0,0,1|2,0,1]=4 3695 B20R2.174735 O=C(CSCc1ccccc1)CSc2ccccc2 1458a_100000211596_200011217039 [0,0,0,0,0,1|1,1,1]=4 3696 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 11a_100015324214_100000150264 [0,0,0,0,0,1|1,0,2]=4 3697 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000150264 [0,0,0,0,0,1|1,0,2]=4 3698 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000150264 [0,0,0,0,0,1|1,0,2]=4 3699 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 527a_100015324214_100000150264 [0,0,0,0,0,1|1,0,2]=4 3700 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 62a_100000183539_100015291786 [0,0,0,0,0,1|1,0,2]=4 3701 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 62a_100000211182_100000183539 [0,0,0,0,0,1|1,0,2]=4 3702 B20R2.174735 O=C(CSCc1ccccc1)NNc2ccccc2 22a_100015195140_100000150264 [0,0,0,0,0,1|2,1,0]=4 3703 B20R2.174735 O=C(CSCc1ccccc1)OCc2ccccc2 62a_100000211182_100000753625 [0,0,0,0,0,1|0,0,2]=3 3704 B20R2.174735 O=C(CSCc1ccccc1)OCc2ccccc2 62a_100000753625_100015291786 [0,0,0,0,0,1|0,0,2]=3 3705 B20R2.174735 O=C(CSCc1ccccn1)OCc2ccccc2 62a_100000721315_100000753625 [0,0,0,0,0,1|1,0,2]=4 3706 B20R2.174735 O=C(CSCc1ccccn1)OCc2ccccc2 62a_100000753625_100000721315 [0,0,0,0,0,1|1,0,2]=4 3707 B20R2.174735 O=C(CSCc1cccnc1)OCc2ccccc2 62a_100000741622_100000753625 [0,0,0,0,0,1|1,0,2]=4 3708 B20R2.174735 O=C(CSCc1cccnc1)OCc2ccccc2 62a_100000753625_100000741622 [0,0,0,0,0,1|1,0,2]=4 3709 B20R2.174735 O=C(CSCc1ccncc1)OCc2ccccc2 62a_100000753625_100015193705 [0,0,0,0,0,1|1,0,2]=4 3710 B20R2.174735 O=C(CSCc1ccncc1)OCc2ccccc2 62a_100015193705_100000753625 [0,0,0,0,0,1|1,0,2]=4 3711 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 11a_100000106460_100000211596 [0,0,0,0,0,1|2,0,1]=4 3712 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000211596 [0,0,0,0,0,1|2,0,1]=4 3713 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000211596 [0,0,0,0,0,1|2,0,1]=4 3714 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 527a_100000106460_100000211596 [0,0,0,0,0,1|2,0,1]=4 3715 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 62a_100000183012_100000041952 [0,0,0,0,0,1|2,0,1]=4 3716 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 62a_100000719477_100000183012 [0,0,0,0,0,1|2,0,1]=4 3717 B20R2.174735 O=C(CSc1ccccc1)NNCc2ccccc2 22a_100000007032_100000211596 [0,0,0,0,0,1|2,0,1]=4 3718 B20R2.174735 O=C(CSc1ccccc1)NOCc2ccccc2 62a_100000230105_100000041952 [0,0,0,0,0,1|1,0,1]=3 3719 B20R2.174735 O=C(CSc1ccccc1)NOCc2ccccc2 62a_100000719477_100000230105 [0,0,0,0,0,1|1,0,1]=3 3720 B20R2.174735 O=C(CSc1ccccc1)OCCc2ccccc2 62a_100000719477_200000077782 [0,0,0,0,0,1|1,0,1]=3 3721 B20R2.174735 O=C(CSc1ccccc1)OCCc2ccccc2 62a_200000077782_100000041952 [0,0,0,0,0,1|1,0,1]=3 3722 B20R2.174735 O=C(CSc1ccccn1)NOCc2ccccc2 62a_100000230105_100011216584 [0,0,0,0,0,1|2,0,1]=4 3723 B20R2.174735 O=C(CSc1ccccn1)NOCc2ccccc2 62a_100011216584_100000230105 [0,0,0,0,0,1|2,0,1]=4 3724 B20R2.174735 O=C(CSc1ccccn1)OCCc2ccccc2 62a_100011216584_200000077782 [0,0,0,0,0,1|2,0,1]=4 3725 B20R2.174735 O=C(CSc1ccccn1)OCCc2ccccc2 62a_200000077782_100011216584 [0,0,0,0,0,1|2,0,1]=4 3726 B20R2.174735 O=C(CSc1cccnc1)NOCc2ccccc2 62a_100000210063_100000230105 [0,0,0,0,0,1|2,0,1]=4 3727 B20R2.174735 O=C(CSc1cccnc1)NOCc2ccccc2 62a_100000230105_100000210063 [0,0,0,0,0,1|2,0,1]=4 3728 B20R2.174735 O=C(CSc1cccnc1)OCCc2ccccc2 62a_100000210063_200000077782 [0,0,0,0,0,1|2,0,1]=4 3729 B20R2.174735 O=C(CSc1cccnc1)OCCc2ccccc2 62a_200000077782_100000210063 [0,0,0,0,0,1|2,0,1]=4 3730 B20R2.174735 O=C(CSc1ccncc1)NOCc2ccccc2 62a_100000230105_100000728582 [0,0,0,0,0,1|2,0,1]=4 3731 B20R2.174735 O=C(CSc1ccncc1)NOCc2ccccc2 62a_100000728582_100000230105 [0,0,0,0,0,1|2,0,1]=4 3732 B20R2.174735 O=C(CSc1ccncc1)OCCc2ccccc2 62a_100000728582_200000077782 [0,0,0,0,0,1|2,0,1]=4 3733 B20R2.174735 O=C(CSc1ccncc1)OCCc2ccccc2 62a_200000077782_100000728582 [0,0,0,0,0,1|2,0,1]=4 3734 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 2708a_100000106460_100015324214 [0,0,0,0,0,1|1,0,2]=4 3735 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 2708a_100015324214_100000106460 [0,0,0,0,0,1|1,0,2]=4 3736 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 273464a_100000106460_100015324214 [0,0,0,0,0,1|1,0,2]=4 3737 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 273464a_100015324214_100000106460 [0,0,0,0,0,1|1,0,2]=4 3738 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 512a_100000106460_100015324214 [0,0,0,0,0,1|1,0,2]=4 3739 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 512a_100015324214_100000106460 [0,0,0,0,0,1|1,0,2]=4 3740 B20R2.174735 O=C(NCCc1ccccc1)NNc2ccccc2 273464a_100000106460_100015195140 [0,0,0,0,0,1|3,0,0]=4 3741 B20R2.174735 O=C(NCCc1ccccc1)NNc2ccccc2 512a_100000106460_100015195140 [0,0,0,0,0,1|3,0,0]=4 3742 B20R2.174735 O=C(NCCc1ccccc1)OCc2ccccc2 271570a_200010239705_100000210277 [0,0,0,0,0,1|0,0,2]=3 3743 B20R2.174735 O=C(NCCc1ccccn1)OCc2ccccc2 271570a_200010239705_100011216584 [0,0,0,0,0,1|1,0,2]=4 3744 B20R2.174735 O=C(NCCc1cccnc1)OCc2ccccc2 271570a_200010239705_100000752921 [0,0,0,0,0,1|1,0,2]=4 3745 B20R2.174735 O=C(NCCc1ccncc1)OCc2ccccc2 271570a_200010239705_100000035832 [0,0,0,0,0,1|1,0,2]=4 3746 B20R2.174735 O=C(NCc1ccccc1)NNCc2ccccc2 273464a_100015324214_100000007032 [0,0,0,0,0,1|2,0,1]=4 3747 B20R2.174735 O=C(NCc1ccccc1)NNCc2ccccc2 512a_100015324214_100000007032 [0,0,0,0,0,1|2,0,1]=4 3748 B19R2.4361 Brc1cc(ccn1)C=CCOCc2ccccc2 271570a_200011106559_100009814637 [1,1,0,0,0,0|1,0,1]=4 3749 B19R2.4361 Brc1cc(ccn1)COC/C=C/c2ccccc2 34a_100000210256_100010243470 [1,1,0,0,0,0|1,0,1]=4 3750 B19R2.4361 Brc1cc(ccn1)COC/C=C/c2ccccc2 34a_100009814636_100016265936 [1,1,0,0,0,0|1,0,1]=4 3751 B19R2.4361 Brc1cc(ccn1)COC/C=C/c2ccccc2 7a_100009814636_100016265936 [1,1,0,0,0,0|1,0,1]=4 3752 B19R2.4361 Brc1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000691529 [1,1,0,0,0,0|0,0,1]=3 3753 B19R2.4361 Brc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100000174977_100016265936 [1,1,0,0,0,0|1,0,1]=4 3754 B19R2.4361 Brc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100020603302_100000698116 [1,1,0,0,0,0|1,0,1]=4 3755 B19R2.4361 Brc1cccc(c1)CNC/C=C/c2ccccc2 270004a_100020603302_100000210085 [1,1,0,0,0,0|1,0,1]=4 3756 B19R2.4361 Brc1cccc(c1)CNC/C=C/c2ccccc2 34a_100000174977_100016265936 [1,1,0,0,0,0|1,0,1]=4 3757 B19R2.4361 Brc1cccc(c1)CNC/C=C/c2ccccc2 34a_100020603302_100000698116 [1,1,0,0,0,0|1,0,1]=4 3758 B19R2.4361 Brc1cccc(c1)CNCC=Cc2ccccc2 270004a_100000174977_100000210105 [1,1,0,0,0,0|1,0,1]=4 3759 B19R2.4361 Brc1cccc(c1)COC/C=C/c2ccccc2 34a_100000210256_100000698116 [1,1,0,0,0,0|0,0,1]=3 3760 B19R2.4361 Brc1cccc(c1)COC/C=C/c2ccccc2 34a_100000687537_100016265936 [1,1,0,0,0,0|0,0,1]=3 3761 B19R2.4361 Brc1cccc(c1)COC/C=C/c2ccccc2 7a_100000687537_100016265936 [1,1,0,0,0,0|0,0,1]=3 3762 B19R2.4361 Brc1cccc(c1)COC/C=C/c2cccnc2 34a_200102594124_100000698116 [1,1,0,0,0,0|1,0,1]=4 3763 B19R2.4361 Brc1cccc(c1)CSC/C=C/c2ccccc2 62a_100000211773_100016265936 [1,1,0,0,0,0|0,1,1]=4 3764 B19R2.4361 Brc1cccc(c1)CSC/C=C/c2ccccc2 62a_100016265936_100000211773 [1,1,0,0,0,0|0,1,1]=4 3765 B19R2.4361 Brc1cccc(c1)NN=CC=Cc2ccccc2 4a_100000217339_100000210105 [1,1,0,0,0,0|2,0,0]=4 3766 B19R2.4361 Brc1cccc(n1)C=CCOCc2ccccc2 271570a_200011106559_100000684672 [1,1,0,0,0,0|1,0,1]=4 3767 B19R2.4361 Brc1cccc(n1)COC/C=C/c2ccccc2 34a_100000210256_100009889011 [1,1,0,0,0,0|1,0,1]=4 3768 B19R2.4361 Brc1cccc(n1)COC/C=C/c2ccccc2 34a_100000694195_100016265936 [1,1,0,0,0,0|1,0,1]=4 3769 B19R2.4361 Brc1ccnc(c1)COC/C=C/c2ccccc2 34a_100000210256_100010173614 [1,1,0,0,0,0|1,0,1]=4 3770 B19R2.4361 Brc1cncc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000728054 [1,1,0,0,0,0|1,0,1]=4 3771 B19R2.4361 Brc1cncc(c1)COC/C=C/c2ccccc2 34a_100000210256_100000738771 [1,1,0,0,0,0|1,0,1]=4 3772 B19R2.4361 Brc1cncc(c1)COC/C=C/c2ccccc2 34a_100011259137_100016265936 [1,1,0,0,0,0|1,0,1]=4 3773 B19R2.4361 Brc1cncc(c1)COC/C=C/c2ccccc2 7a_100011259137_100016265936 [1,1,0,0,0,0|1,0,1]=4 3774 B19R2.4361 C[n+]1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_100009996589 [1,1,0,0,0,0|1,0,1]=4 3775 B19R2.4361 Cc1cc(ccn1)C=CCOCc2ccccc2 271570a_200011106559_100000758586 [1,1,0,0,0,0|1,0,1]=4 3776 B19R2.4361 Cc1cc(ccn1)COC/C=C/c2ccccc2 34a_100000210256_200020672517 [1,1,0,0,0,0|1,0,1]=4 3777 B19R2.4361 Cc1cc(ccn1)COC/C=C/c2ccccc2 34a_100011998630_100016265936 [1,1,0,0,0,0|1,0,1]=4 3778 B19R2.4361 Cc1cccc(c1)C=CC=NNc2ccccc2 4a_100015195140_100102525846 [1,1,0,0,0,0|2,0,0]=4 3779 B19R2.4361 Cc1cccc(c1)C=CCNCc2ccccc2 270004a_100015324214_100102525846 [1,1,0,0,0,0|1,0,1]=4 3780 B19R2.4361 Cc1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_100011215228 [1,1,0,0,0,0|0,0,1]=3 3781 B19R2.4361 Cc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100000185548_100016265936 [1,1,0,0,0,0|1,0,1]=4 3782 B19R2.4361 Cc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100020603302_100000211840 [1,1,0,0,0,0|1,0,1]=4 3783 B19R2.4361 Cc1cccc(c1)CNC/C=C/c2ccccc2 270004a_100020603302_100000211157 [1,1,0,0,0,0|1,0,1]=4 3784 B19R2.4361 Cc1cccc(c1)CNC/C=C/c2ccccc2 34a_100000185548_100016265936 [1,1,0,0,0,0|1,0,1]=4 3785 B19R2.4361 Cc1cccc(c1)CNC/C=C/c2ccccc2 34a_100020603302_100000211840 [1,1,0,0,0,0|1,0,1]=4 3786 B19R2.4361 Cc1cccc(c1)CNCC=Cc2ccccc2 270004a_100000185548_100000210105 [1,1,0,0,0,0|1,0,1]=4 3787 B19R2.4361 Cc1cccc(c1)COC/C=C/c2ccccc2 34a_100000210256_100000211840 [1,1,0,0,0,0|0,0,1]=3 3788 B19R2.4361 Cc1cccc(c1)COC/C=C/c2ccccc2 34a_100011217746_100016265936 [1,1,0,0,0,0|0,0,1]=3 3789 B19R2.4361 Cc1cccc(c1)COC/C=C/c2ccccc2 7a_100011217746_100016265936 [1,1,0,0,0,0|0,0,1]=3 3790 B19R2.4361 Cc1cccc(c1)COC/C=C/c2cccnc2 34a_200102594124_100000211840 [1,1,0,0,0,0|1,0,1]=4 3791 B19R2.4361 Cc1cccc(c1)CSC/C=C/c2ccccc2 62a_100000211840_100016265936 [1,1,0,0,0,0|0,1,1]=4 3792 B19R2.4361 Cc1cccc(c1)CSC/C=C/c2ccccc2 62a_100016265936_100000211840 [1,1,0,0,0,0|0,1,1]=4 3793 B19R2.4361 Cc1cccc(c1)NN=CC=Cc2ccccc2 4a_100000681630_100000210105 [1,1,0,0,0,0|2,0,0]=4 3794 B19R2.4361 Cc1cccc(n1)C=CCOCc2ccccc2 271570a_200011106559_100000742759 [1,1,0,0,0,0|1,0,1]=4 3795 B19R2.4361 Cc1cccc(n1)COC/C=C/c2ccccc2 34a_100000210256_100000757606 [1,1,0,0,0,0|1,0,1]=4 3796 B19R2.4361 Cc1cccc(n1)COC/C=C/c2ccccc2 34a_100000690600_100016265936 [1,1,0,0,0,0|1,0,1]=4 3797 B19R2.4361 Cc1ccnc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000750283 [1,1,0,0,0,0|1,0,1]=4 3798 B19R2.4361 Cc1ccnc(c1)COC/C=C/c2ccccc2 34a_100000210256_100000718516 [1,1,0,0,0,0|1,0,1]=4 3799 B19R2.4361 Cc1ccnc(c1)COC/C=C/c2ccccc2 34a_100011998357_100016265936 [1,1,0,0,0,0|1,0,1]=4 3800 B19R2.4361 Cc1cncc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000760492 [1,1,0,0,0,0|1,0,1]=4 3801 B19R2.4361 Cc1cncc(c1)COC/C=C/c2ccccc2 34a_100000210256_100000716715 [1,1,0,0,0,0|1,0,1]=4 3802 B19R2.4361 Cc1cncc(c1)COC/C=C/c2ccccc2 34a_100011998709_100016265936 [1,1,0,0,0,0|1,0,1]=4 3803 B19R2.4361 Cc1cncc(c1)COC/C=C/c2ccccc2 7a_100011998709_100016265936 [1,1,0,0,0,0|1,0,1]=4 3804 B19R2.4361 Clc1cc(ccn1)C=CCOCc2ccccc2 271570a_200011106559_100000035001 [1,1,0,0,0,0|1,0,1]=4 3805 B19R2.4361 Clc1cc(ccn1)COC/C=C/c2ccccc2 34a_100000210256_100000764220 [1,1,0,0,0,0|1,0,1]=4 3806 B19R2.4361 Clc1cc(ccn1)COC/C=C/c2ccccc2 34a_100000748751_100016265936 [1,1,0,0,0,0|1,0,1]=4 3807 B19R2.4361 Clc1cccc(c1)C=CC=NNc2ccccc2 4a_100015195140_100016268971 [1,1,0,0,0,0|2,0,0]=4 3808 B19R2.4361 Clc1cccc(c1)C=CCNCc2ccccc2 270004a_100015324214_100016268971 [1,1,0,0,0,0|1,0,1]=4 3809 B19R2.4361 Clc1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000699651 [1,1,0,0,0,0|0,0,1]=3 3810 B19R2.4361 Clc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100000174878_100016265936 [1,1,0,0,0,0|1,0,1]=4 3811 B19R2.4361 Clc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100020603302_100000181238 [1,1,0,0,0,0|1,0,1]=4 3812 B19R2.4361 Clc1cccc(c1)CNC/C=C/c2ccccc2 270004a_100020603302_100000210801 [1,1,0,0,0,0|1,0,1]=4 3813 B19R2.4361 Clc1cccc(c1)CNC/C=C/c2ccccc2 34a_100000174878_100016265936 [1,1,0,0,0,0|1,0,1]=4 3814 B19R2.4361 Clc1cccc(c1)CNC/C=C/c2ccccc2 34a_100020603302_100000187163 [1,1,0,0,0,0|1,0,1]=4 3815 B19R2.4361 Clc1cccc(c1)CNCC=Cc2ccccc2 270004a_100000174878_100000210105 [1,1,0,0,0,0|1,0,1]=4 3816 B19R2.4361 Clc1cccc(c1)COC/C=C/c2ccccc2 34a_100000210256_100000187163 [1,1,0,0,0,0|0,0,1]=3 3817 B19R2.4361 Clc1cccc(c1)COC/C=C/c2ccccc2 34a_100000241301_100016265936 [1,1,0,0,0,0|0,0,1]=3 3818 B19R2.4361 Clc1cccc(c1)COC/C=C/c2ccccc2 7a_100000241301_100016265936 [1,1,0,0,0,0|0,0,1]=3 3819 B19R2.4361 Clc1cccc(c1)COC/C=C/c2cccnc2 34a_200102594124_100000187163 [1,1,0,0,0,0|1,0,1]=4 3820 B19R2.4361 Clc1cccc(c1)CSC/C=C/c2ccccc2 62a_100000187163_100016265936 [1,1,0,0,0,0|0,1,1]=4 3821 B19R2.4361 Clc1cccc(c1)CSC/C=C/c2ccccc2 62a_100016265936_100000187163 [1,1,0,0,0,0|0,1,1]=4 3822 B19R2.4361 Clc1cccc(c1)NN=CC=Cc2ccccc2 4a_100000184277_100000210105 [1,1,0,0,0,0|2,0,0]=4 3823 B19R2.4361 Clc1cccc(n1)COC/C=C/c2ccccc2 34a_100000210256_100000086093 [1,1,0,0,0,0|1,0,1]=4 3824 B19R2.4361 Clc1cccc(n1)COC/C=C/c2ccccc2 34a_100011998359_100016265936 [1,1,0,0,0,0|1,0,1]=4 3825 B19R2.4361 Clc1ccnc(c1)C=CCOCc2ccccc2 271570a_200011106559_100010167805 [1,1,0,0,0,0|1,0,1]=4 3826 B19R2.4361 Clc1ccnc(c1)COC/C=C/c2ccccc2 34a_100000210256_100016988179 [1,1,0,0,0,0|1,0,1]=4 3827 B19R2.4361 Clc1ccnc(c1)COC/C=C/c2ccccc2 34a_100000748867_100016265936 [1,1,0,0,0,0|1,0,1]=4 3828 B19R2.4361 Clc1cncc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000049639 [1,1,0,0,0,0|1,0,1]=4 3829 B19R2.4361 Clc1cncc(c1)COC/C=C/c2ccccc2 34a_100000092867_100016265936 [1,1,0,0,0,0|1,0,1]=4 3830 B19R2.4361 Clc1cncc(c1)COC/C=C/c2ccccc2 34a_100000210256_100016992070 [1,1,0,0,0,0|1,0,1]=4 3831 B19R2.4361 Clc1cncc(c1)COC/C=C/c2ccccc2 7a_100000092867_100016265936 [1,1,0,0,0,0|1,0,1]=4 3832 B19R2.4361 Fc1cc(ccn1)C=CCOCc2ccccc2 271570a_200011106559_100009816116 [1,1,0,0,0,0|1,0,1]=4 3833 B19R2.4361 Fc1cc(ccn1)COC/C=C/c2ccccc2 34a_100000082451_100016265936 [1,1,0,0,0,0|1,0,1]=4 3834 B19R2.4361 Fc1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000685547 [1,1,0,0,0,0|0,0,1]=3 3835 B19R2.4361 Fc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100000174948_100016265936 [1,1,0,0,0,0|1,0,1]=4 3836 B19R2.4361 Fc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100020603302_100000230114 [1,1,0,0,0,0|1,0,1]=4 3837 B19R2.4361 Fc1cccc(c1)CNC/C=C/c2ccccc2 270004a_100020603302_100000210812 [1,1,0,0,0,0|1,0,1]=4 3838 B19R2.4361 Fc1cccc(c1)CNC/C=C/c2ccccc2 34a_100000174948_100016265936 [1,1,0,0,0,0|1,0,1]=4 3839 B19R2.4361 Fc1cccc(c1)CNC/C=C/c2ccccc2 34a_100020603302_100000187166 [1,1,0,0,0,0|1,0,1]=4 3840 B19R2.4361 Fc1cccc(c1)CNCC=Cc2ccccc2 270004a_100000174948_100000210105 [1,1,0,0,0,0|1,0,1]=4 3841 B19R2.4361 Fc1cccc(c1)COC/C=C/c2ccccc2 34a_100000210256_100000187166 [1,1,0,0,0,0|0,0,1]=3 3842 B19R2.4361 Fc1cccc(c1)COC/C=C/c2ccccc2 34a_100000210976_100016265936 [1,1,0,0,0,0|0,0,1]=3 3843 B19R2.4361 Fc1cccc(c1)COC/C=C/c2ccccc2 7a_100000210976_100016265936 [1,1,0,0,0,0|0,0,1]=3 3844 B19R2.4361 Fc1cccc(c1)COC/C=C/c2cccnc2 34a_200102594124_100000187166 [1,1,0,0,0,0|1,0,1]=4 3845 B19R2.4361 Fc1cccc(c1)CSC/C=C/c2ccccc2 62a_100000230114_100016265936 [1,1,0,0,0,0|0,1,1]=4 3846 B19R2.4361 Fc1cccc(c1)CSC/C=C/c2ccccc2 62a_100016265936_100000230114 [1,1,0,0,0,0|0,1,1]=4 3847 B19R2.4361 Fc1cccc(c1)NN=CC=Cc2ccccc2 4a_100000745080_100000210105 [1,1,0,0,0,0|2,0,0]=4 3848 B19R2.4361 Fc1cccc(n1)C=CCOCc2ccccc2 271570a_200011106559_100009815982 [1,1,0,0,0,0|1,0,1]=4 3849 B19R2.4361 Fc1cccc(n1)COC/C=C/c2ccccc2 34a_100000086748_100016265936 [1,1,0,0,0,0|1,0,1]=4 3850 B19R2.4361 Fc1cccc(n1)COC/C=C/c2ccccc2 34a_100000210256_100009819644 [1,1,0,0,0,0|1,0,1]=4 3851 B19R2.4361 Fc1ccnc(c1)C=CCOCc2ccccc2 271570a_200011106559_100009817058 [1,1,0,0,0,0|1,0,1]=4 3852 B19R2.4361 Fc1cncc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000744099 [1,1,0,0,0,0|1,0,1]=4 3853 B19R2.4361 Fc1cncc(c1)COC/C=C/c2ccccc2 34a_100000210256_100000725299 [1,1,0,0,0,0|1,0,1]=4 3854 B19R2.4361 Fc1cncc(c1)COC/C=C/c2ccccc2 34a_100011962875_100016265936 [1,1,0,0,0,0|1,0,1]=4 3855 B19R2.4361 Fc1cncc(c1)COC/C=C/c2ccccc2 7a_100011962875_100016265936 [1,1,0,0,0,0|1,0,1]=4 3856 B19R2.4361 Ic1cccc(c1)CNC/C=C/c2ccccc2 2230a_100000106179_100016265936 [1,1,0,0,0,0|1,0,1]=4 3857 B19R2.4361 Ic1cccc(c1)CNC/C=C/c2ccccc2 2230a_100020603302_100011218688 [1,1,0,0,0,0|1,0,1]=4 3858 B19R2.4361 Ic1cccc(c1)CNC/C=C/c2ccccc2 270004a_100020603302_100000014684 [1,1,0,0,0,0|1,0,1]=4 3859 B19R2.4361 Ic1cccc(c1)CNC/C=C/c2ccccc2 34a_100000106179_100016265936 [1,1,0,0,0,0|1,0,1]=4 3860 B19R2.4361 Ic1cccc(c1)CNC/C=C/c2ccccc2 34a_100020603302_100011218688 [1,1,0,0,0,0|1,0,1]=4 3861 B19R2.4361 Ic1cccc(c1)CNCC=Cc2ccccc2 270004a_100000106179_100000210105 [1,1,0,0,0,0|1,0,1]=4 3862 B19R2.4361 Ic1cccc(c1)COC/C=C/c2ccccc2 34a_100000210256_100011218688 [1,1,0,0,0,0|0,0,1]=3 3863 B19R2.4361 Ic1cccc(c1)COC/C=C/c2ccccc2 34a_100011215336_100016265936 [1,1,0,0,0,0|0,0,1]=3 3864 B19R2.4361 Ic1cccc(c1)COC/C=C/c2ccccc2 7a_100011215336_100016265936 [1,1,0,0,0,0|0,0,1]=3 3865 B19R2.4361 Ic1cccc(c1)COC/C=C/c2cccnc2 34a_200102594124_100011218688 [1,1,0,0,0,0|1,0,1]=4 3866 B19R2.4361 Ic1cccc(c1)CSC/C=C/c2ccccc2 62a_100011218688_100016265936 [1,1,0,0,0,0|0,1,1]=4 3867 B19R2.4361 Ic1cccc(c1)CSC/C=C/c2ccccc2 62a_100016265936_100011218688 [1,1,0,0,0,0|0,1,1]=4 3868 B19R2.4361 Ic1cccc(c1)NN=CC=Cc2ccccc2 4a_100020605690_100000210105 [1,1,0,0,0,0|2,0,0]=4 3869 B19R2.4361 Nc1cc(ccn1)C=CCOCc2ccccc2 271570a_200011106559_100000744379 [1,1,0,0,0,0|1,0,1]=4 3870 B19R2.4361 Nc1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000210019 [1,1,0,0,0,0|0,0,1]=3 3871 B19R2.4361 Nc1cccc(c1)COC/C=C/c2ccccc2 34a_100000211919_100016265936 [1,1,0,0,0,0|0,0,1]=3 3872 B19R2.4361 Nc1cccc(n1)C=CCOCc2ccccc2 271570a_200011106559_100000740741 [1,1,0,0,0,0|1,0,1]=4 3873 B19R2.4361 Nc1ccnc(c1)C=CCOCc2ccccc2 271570a_200011106559_100009814236 [1,1,0,0,0,0|1,0,1]=4 3874 B19R2.4361 Nc1ccnc(c1)COC/C=C/c2ccccc2 34a_100000692640_100016265936 [1,1,0,0,0,0|1,0,1]=4 3875 B19R2.4361 Nc1cncc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000687067 [1,1,0,0,0,0|1,0,1]=4 3876 B19R2.4361 Nc1cncc(c1)COC/C=C/c2ccccc2 34a_100000085308_100016265936 [1,1,0,0,0,0|1,0,1]=4 3877 B19R2.4361 O=c1cc(cc[nH]1)C=CCOCc2ccccc2 271570a_200011106559_100009816521 [1,1,0,0,0,0|1,0,1]=4 3878 B19R2.4361 O=c1cccc([nH]1)C=CCOCc2ccccc2 271570a_200011106559_100000761760 [1,1,0,0,0,0|1,0,1]=4 3879 B19R2.4361 Oc1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000211634 [1,1,0,0,0,0|0,0,1]=3 3880 B19R2.4361 Oc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100000743036_100016265936 [1,1,0,0,0,0|1,0,1]=4 3881 B19R2.4361 Oc1cccc(c1)CNC/C=C/c2ccccc2 2230a_100020603302_100011660834 [1,1,0,0,0,0|1,0,1]=4 3882 B19R2.4361 Oc1cccc(c1)CNC/C=C/c2ccccc2 270004a_100020603302_100000188321 [1,1,0,0,0,0|1,0,1]=4 3883 B19R2.4361 Oc1cccc(c1)CNC/C=C/c2ccccc2 34a_100000743036_100016265936 [1,1,0,0,0,0|1,0,1]=4 3884 B19R2.4361 Oc1cccc(c1)CNC/C=C/c2ccccc2 34a_100020603302_100011660834 [1,1,0,0,0,0|1,0,1]=4 3885 B19R2.4361 Oc1cccc(c1)CNCC=Cc2ccccc2 270004a_100000743036_100000210105 [1,1,0,0,0,0|1,0,1]=4 3886 B19R2.4361 Oc1cccc(c1)COC/C=C/c2ccccc2 34a_100000210256_100011660834 [1,1,0,0,0,0|0,0,1]=3 3887 B19R2.4361 Oc1cccc(c1)COC/C=C/c2cccnc2 34a_200102594124_100011660834 [1,1,0,0,0,0|1,0,1]=4 3888 B19R2.4361 Oc1cccc(c1)CSC/C=C/c2ccccc2 62a_100011660834_100016265936 [1,1,0,0,0,0|0,1,1]=4 3889 B19R2.4361 Oc1cccc(c1)CSC/C=C/c2ccccc2 62a_100016265936_100011660834 [1,1,0,0,0,0|0,1,1]=4 3890 B19R2.4361 Oc1ccnc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000762945 [1,1,0,0,0,0|1,0,1]=4 3891 B19R2.4361 Oc1cncc(c1)C=CCOCc2ccccc2 271570a_200011106559_100000754920 [1,1,0,0,0,0|1,0,1]=4 3892 B19R2.4361 [O-][n+]1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_100009815978 [1,1,0,0,0,0|1,0,1]=4 3893 B19R2.4361 [O-][n+]1cccc(c1)COC/C=C/c2ccccc2 34a_100000037817_100016265936 [1,1,0,0,0,0|1,0,1]=4 3894 B19R2.4361 [O-][n+]1cccc(c1)COC/C=C/c2ccccc2 7a_100000037817_100016265936 [1,1,0,0,0,0|1,0,1]=4 3895 B19R2.4361 [S]c1cccc(c1)C=CCOCc2ccccc2 271570a_200011106559_114929384022 [1,1,0,0,0,0|0,0,1]=3 3896 B19R2.4484 Brc1ccccc1C=CC=NNc2ccccc2 4a_100015195140_200016268969 [1,1,0,0,0,0|2,0,0]=4 3897 B19R2.4484 Brc1ccccc1C=CCNCc2ccccc2 270004a_100015324214_200016268969 [1,1,0,0,0,0|1,0,1]=4 3898 B19R2.4484 Brc1ccccc1C=CCOCc2ccccc2 271570a_200011106559_100000695589 [1,1,0,0,0,0|0,0,1]=3 3899 B19R2.4484 Brc1ccccc1CNC/C=C/c2ccccc2 2230a_100000689332_100016265936 [1,1,0,0,0,0|1,0,1]=4 3900 B19R2.4484 Brc1ccccc1CNC/C=C/c2ccccc2 2230a_100020603302_100000184730 [1,1,0,0,0,0|1,0,1]=4 3901 B19R2.4484 Brc1ccccc1CNC/C=C/c2ccccc2 270004a_100020603302_100000211189 [1,1,0,0,0,0|1,0,1]=4 3902 B19R2.4484 Brc1ccccc1CNC/C=C/c2ccccc2 34a_100000689332_100016265936 [1,1,0,0,0,0|1,0,1]=4 3903 B19R2.4484 Brc1ccccc1CNC/C=C/c2ccccc2 34a_100020603302_100000184730 [1,1,0,0,0,0|1,0,1]=4 3904 B19R2.4484 Brc1ccccc1CNCC=Cc2ccccc2 270004a_100000689332_100000210105 [1,1,0,0,0,0|1,0,1]=4 3905 B19R2.4484 Brc1ccccc1COC/C=C/c2ccccc2 34a_100000210256_100000184730 [1,1,0,0,0,0|0,0,1]=3 3906 B19R2.4484 Brc1ccccc1COC/C=C/c2ccccc2 34a_100000756307_100016265936 [1,1,0,0,0,0|0,0,1]=3 3907 B19R2.4484 Brc1ccccc1COC/C=C/c2ccccc2 7a_100000756307_100016265936 [1,1,0,0,0,0|0,0,1]=3 3908 B19R2.4484 Brc1ccccc1COC/C=C/c2cccnc2 34a_200102594124_100000184730 [1,1,0,0,0,0|1,0,1]=4 3909 B19R2.4484 Brc1ccccc1CSC/C=C/c2ccccc2 62a_100000184730_100016265936 [1,1,0,0,0,0|0,1,1]=4 3910 B19R2.4484 Brc1ccccc1CSC/C=C/c2ccccc2 62a_100016265936_100000184730 [1,1,0,0,0,0|0,1,1]=4 3911 B19R2.4484 Brc1ccccc1NN=CC=Cc2ccccc2 4a_100000241748_100000210105 [1,1,0,0,0,0|2,0,0]=4 3912 B19R2.4484 Brc1cccnc1C=CCOCc2ccccc2 271570a_200011106559_100000696092 [1,1,0,0,0,0|1,0,1]=4 3913 B19R2.4484 Brc1cccnc1COC/C=C/c2ccccc2 34a_100000210256_100025702911 [1,1,0,0,0,0|1,0,1]=4 3914 B19R2.4484 Brc1cccnc1COC/C=C/c2ccccc2 34a_100011996772_100016265936 [1,1,0,0,0,0|1,0,1]=4 3915 B19R2.4484 Brc1ccncc1C=CCOCc2ccccc2 271570a_200011106559_100010138639 [1,1,0,0,0,0|1,0,1]=4 3916 B19R2.4484 Brc1cnccc1C=CCOCc2ccccc2 271570a_200011106559_100000726257 [1,1,0,0,0,0|1,0,1]=4 3917 B19R2.4484 Brc1ncccc1C=CCOCc2ccccc2 271570a_200011106559_100010202626 [1,1,0,0,0,0|1,0,1]=4 3918 B19R2.4484 Brc1ncccc1COC/C=C/c2ccccc2 34a_100000210256_100010140945 [1,1,0,0,0,0|1,0,1]=4 3919 B19R2.4484 Brc1ncccc1COC/C=C/c2ccccc2 34a_100000719692_100016265936 [1,1,0,0,0,0|1,0,1]=4 3920 B19R2.4484 Brc1ncccc1COC/C=C/c2ccccc2 7a_100000719692_100016265936 [1,1,0,0,0,0|1,0,1]=4 3921 B19R2.4484 C[n+]1ccccc1C=CCOCc2ccccc2 271570a_200011106559_100000212160 [1,1,0,0,0,0|1,0,1]=4 3922 B19R2.4484 Cc1ccccc1C=CCOCc2ccccc2 271570a_200011106559_100000210755 [1,1,0,0,0,0|0,0,1]=3 3923 B19R2.4484 Cc1ccccc1CNC/C=C/c2ccccc2 2230a_100020603302_100000211839 [1,1,0,0,0,0|1,0,1]=4 3924 B19R2.4484 Cc1ccccc1CNC/C=C/c2ccccc2 270004a_100020603302_100000211143 [1,1,0,0,0,0|1,0,1]=4 3925 B19R2.4484 Cc1ccccc1CNC/C=C/c2ccccc2 34a_100000174972_100016265936 [1,1,0,0,0,0|1,0,1]=4 3926 B19R2.4484 Cc1ccccc1CNC/C=C/c2ccccc2 34a_100020603302_100000211839 [1,1,0,0,0,0|1,0,1]=4 3927 B19R2.4484 Cc1ccccc1CNCC=Cc2ccccc2 270004a_100000174972_100000210105 [1,1,0,0,0,0|1,0,1]=4 3928 B19R2.4484 Cc1ccccc1COC/C=C/c2ccccc2 34a_100000210256_100000211839 [1,1,0,0,0,0|0,0,1]=3 3929 B19R2.4484 Cc1ccccc1COC/C=C/c2ccccc2 34a_100000698903_100016265936 [1,1,0,0,0,0|0,0,1]=3 3930 B19R2.4484 Cc1ccccc1COC/C=C/c2ccccc2 7a_100000698903_100016265936 [1,1,0,0,0,0|0,0,1]=3 3931 B19R2.4484 Cc1ccccc1COC/C=C/c2cccnc2 34a_200102594124_100000211839 [1,1,0,0,0,0|1,0,1]=4 3932 B19R2.4484 Cc1ccccc1CSC/C=C/c2ccccc2 62a_100000211839_100016265936 [1,1,0,0,0,0|0,1,1]=4 3933 B19R2.4484 Cc1ccccc1CSC/C=C/c2ccccc2 62a_100016265936_100000211839 [1,1,0,0,0,0|0,1,1]=4 3934 B19R2.4484 Cc1ccccc1NN=CC=Cc2ccccc2 4a_100000184220_100000210105 [1,1,0,0,0,0|2,0,0]=4 3935 B19R2.4484 Cc1cccnc1C=CCOCc2ccccc2 271570a_200011106559_100000751373 [1,1,0,0,0,0|1,0,1]=4 3936 B19R2.4484 Cc1cccnc1COC/C=C/c2ccccc2 34a_100000210256_100000696600 [1,1,0,0,0,0|1,0,1]=4 3937 B19R2.4484 Cc1cccnc1COC/C=C/c2ccccc2 34a_100000698912_100016265936 [1,1,0,0,0,0|1,0,1]=4 3938 B19R2.4484 Cc1ccncc1C=CCOCc2ccccc2 271570a_200011106559_100000761580 [1,1,0,0,0,0|1,0,1]=4 3939 B19R2.4484 Cc1ccncc1COC/C=C/c2ccccc2 34a_100000210256_100000690890 [1,1,0,0,0,0|1,0,1]=4 3940 B19R2.4484 Cc1ccncc1COC/C=C/c2ccccc2 34a_100011996381_100016265936 [1,1,0,0,0,0|1,0,1]=4 3941 B19R2.4484 Cc1cnccc1C=CCOCc2ccccc2 271570a_200011106559_100015191297 [1,1,0,0,0,0|1,0,1]=4 3942 B19R2.4484 Cc1cnccc1COC/C=C/c2ccccc2 34a_100000210256_100020672809 [1,1,0,0,0,0|1,0,1]=4 3943 B19R2.4484 Cc1cnccc1COC/C=C/c2ccccc2 34a_100011997032_100016265936 [1,1,0,0,0,0|1,0,1]=4 3944 B19R2.4484 Cc1ncccc1C=CCOCc2ccccc2 271570a_200011106559_100000751574 [1,1,0,0,0,0|1,0,1]=4 3945 B19R2.4484 Cc1ncccc1COC/C=C/c2ccccc2 34a_100000210256_100000732876 [1,1,0,0,0,0|1,0,1]=4 3946 B19R2.4484 Cc1ncccc1COC/C=C/c2ccccc2 34a_100000729262_100016265936 [1,1,0,0,0,0|1,0,1]=4 3947 B19R2.4484 Cc1ncccc1COC/C=C/c2ccccc2 7a_100000729262_100016265936 [1,1,0,0,0,0|1,0,1]=4 3948 B19R2.4484 Clc1ccccc1C=CC=NNc2ccccc2 4a_100015195140_200102525841 [1,1,0,0,0,0|2,0,0]=4 3949 B19R2.4484 Clc1ccccc1C=CCNCc2ccccc2 270004a_100015324214_200102525841 [1,1,0,0,0,0|1,0,1]=4 3950 B19R2.4484 Clc1ccccc1C=CCOCc2ccccc2 271570a_200011106559_100000764095 [1,1,0,0,0,0|0,0,1]=3 3951 B19R2.4484 Clc1ccccc1CNC/C=C/c2ccccc2 2230a_100000174879_100016265936 [1,1,0,0,0,0|1,0,1]=4 3952 B19R2.4484 Clc1ccccc1CNC/C=C/c2ccccc2 2230a_100020603302_100000187162 [1,1,0,0,0,0|1,0,1]=4 3953 B19R2.4484 Clc1ccccc1CNC/C=C/c2ccccc2 270004a_100020603302_100000210073 [1,1,0,0,0,0|1,0,1]=4 3954 B19R2.4484 Clc1ccccc1CNC/C=C/c2ccccc2 34a_100000174879_100016265936 [1,1,0,0,0,0|1,0,1]=4 3955 B19R2.4484 Clc1ccccc1CNC/C=C/c2ccccc2 34a_100020603302_100000187162 [1,1,0,0,0,0|1,0,1]=4 3956 B19R2.4484 Clc1ccccc1CNCC=Cc2ccccc2 270004a_100000174879_100000210105 [1,1,0,0,0,0|1,0,1]=4 3957 B19R2.4484 Clc1ccccc1COC/C=C/c2ccccc2 34a_100000210256_100000187162 [1,1,0,0,0,0|0,0,1]=3 3958 B19R2.4484 Clc1ccccc1COC/C=C/c2ccccc2 34a_100000210847_100016265936 [1,1,0,0,0,0|0,0,1]=3 3959 B19R2.4484 Clc1ccccc1COC/C=C/c2ccccc2 7a_100000210847_100016265936 [1,1,0,0,0,0|0,0,1]=3 3960 B19R2.4484 Clc1ccccc1COC/C=C/c2cccnc2 34a_200102594124_100000187162 [1,1,0,0,0,0|1,0,1]=4 3961 B19R2.4484 Clc1ccccc1CSC/C=C/c2ccccc2 62a_100000187162_100016265936 [1,1,0,0,0,0|0,1,1]=4 3962 B19R2.4484 Clc1ccccc1CSC/C=C/c2ccccc2 62a_100016265936_100000187162 [1,1,0,0,0,0|0,1,1]=4 3963 B19R2.4484 Clc1ccccc1NN=CC=Cc2ccccc2 4a_100000683529_100000210105 [1,1,0,0,0,0|2,0,0]=4 3964 B19R2.4484 Clc1cccnc1C=CCOCc2ccccc2 271570a_200011106559_100011356963 [1,1,0,0,0,0|1,0,1]=4 3965 B19R2.4484 Clc1cccnc1COC/C=C/c2ccccc2 34a_100012002383_100016265936 [1,1,0,0,0,0|1,0,1]=4 3966 B19R2.4484 Clc1ccncc1C=CCOCc2ccccc2 271570a_200011106559_100009995489 [1,1,0,0,0,0|1,0,1]=4 3967 B19R2.4484 Clc1ccncc1COC/C=C/c2ccccc2 34a_100000117392_100016265936 [1,1,0,0,0,0|1,0,1]=4 3968 B19R2.4484 Clc1cnccc1C=CCOCc2ccccc2 271570a_200011106559_100000708259 [1,1,0,0,0,0|1,0,1]=4 3969 B19R2.4484 Clc1ncccc1C=CCOCc2ccccc2 271570a_200011106559_100000036424 [1,1,0,0,0,0|1,0,1]=4 3970 B19R2.4484 Clc1ncccc1COC/C=C/c2ccccc2 34a_100000210256_100000045678 [1,1,0,0,0,0|1,0,1]=4 3971 B19R2.4484 Clc1ncccc1COC/C=C/c2ccccc2 34a_100000748726_100016265936 [1,1,0,0,0,0|1,0,1]=4 3972 B19R2.4484 Clc1ncccc1COC/C=C/c2ccccc2 7a_100000748726_100016265936 [1,1,0,0,0,0|1,0,1]=4 3973 B19R2.4484 Fc1ccccc1C=CC=NNc2ccccc2 4a_100015195140_200102525844 [1,1,0,0,0,0|2,0,0]=4 3974 B19R2.4484 Fc1ccccc1C=CCNCc2ccccc2 270004a_100015324214_200102525844 [1,1,0,0,0,0|1,0,1]=4 3975 B19R2.4484 Fc1ccccc1C=CCOCc2ccccc2 271570a_200011106559_100011215700 [1,1,0,0,0,0|0,0,1]=3 3976 B19R2.4484 Fc1ccccc1CNC/C=C/c2ccccc2 2230a_100020603302_100000211605 [1,1,0,0,0,0|1,0,1]=4 3977 B19R2.4484 Fc1ccccc1CNC/C=C/c2ccccc2 270004a_100020603302_100000210811 [1,1,0,0,0,0|1,0,1]=4 3978 B19R2.4484 Fc1ccccc1CNC/C=C/c2ccccc2 34a_100000174869_100016265936 [1,1,0,0,0,0|1,0,1]=4 3979 B19R2.4484 Fc1ccccc1CNC/C=C/c2ccccc2 34a_100020603302_100000211605 [1,1,0,0,0,0|1,0,1]=4 3980 B19R2.4484 Fc1ccccc1CNCC=Cc2ccccc2 270004a_100000174869_100000210105 [1,1,0,0,0,0|1,0,1]=4 3981 B19R2.4484 Fc1ccccc1COC/C=C/c2ccccc2 34a_100000210256_100000211605 [1,1,0,0,0,0|0,0,1]=3 3982 B19R2.4484 Fc1ccccc1COC/C=C/c2ccccc2 34a_100000211962_100016265936 [1,1,0,0,0,0|0,0,1]=3 3983 B19R2.4484 Fc1ccccc1COC/C=C/c2ccccc2 7a_100000211962_100016265936 [1,1,0,0,0,0|0,0,1]=3 3984 B19R2.4484 Fc1ccccc1COC/C=C/c2cccnc2 34a_200102594124_100000211605 [1,1,0,0,0,0|1,0,1]=4 3985 B19R2.4484 Fc1ccccc1CSC/C=C/c2ccccc2 62a_100000211605_100016265936 [1,1,0,0,0,0|0,1,1]=4 3986 B19R2.4484 Fc1ccccc1CSC/C=C/c2ccccc2 62a_100016265936_100000211605 [1,1,0,0,0,0|0,1,1]=4 3987 B19R2.4484 Fc1ccccc1NN=CC=Cc2ccccc2 4a_100000239246_100000210105 [1,1,0,0,0,0|2,0,0]=4 3988 B19R2.4484 Fc1cccnc1C=CCOCc2ccccc2 271570a_200011106559_100000685392 [1,1,0,0,0,0|1,0,1]=4 3989 B19R2.4484 Fc1cccnc1COC/C=C/c2ccccc2 34a_100000210256_100000104219 [1,1,0,0,0,0|1,0,1]=4 3990 B19R2.4484 Fc1cccnc1COC/C=C/c2ccccc2 34a_100011934865_100016265936 [1,1,0,0,0,0|1,0,1]=4 3991 B19R2.4484 Fc1ccncc1C=CCOCc2ccccc2 271570a_200011106559_100009820683 [1,1,0,0,0,0|1,0,1]=4 3992 B19R2.4484 Fc1cnccc1C=CCOCc2ccccc2 271570a_200011106559_100000047030 [1,1,0,0,0,0|1,0,1]=4 3993 B19R2.4484 Fc1cnccc1COC/C=C/c2ccccc2 34a_100012172863_100016265936 [1,1,0,0,0,0|1,0,1]=4 3994 B19R2.4484 Fc1ncccc1C=CCOCc2ccccc2 271570a_200011106559_100009816115 [1,1,0,0,0,0|1,0,1]=4 3995 B19R2.4484 Fc1ncccc1COC/C=C/c2ccccc2 34a_100000079888_100016265936 [1,1,0,0,0,0|1,0,1]=4 3996 B19R2.4484 Fc1ncccc1COC/C=C/c2ccccc2 34a_100000210256_100000099810 [1,1,0,0,0,0|1,0,1]=4 3997 B19R2.4484 Fc1ncccc1COC/C=C/c2ccccc2 7a_100000079888_100016265936 [1,1,0,0,0,0|1,0,1]=4 3998 B19R2.4484 Ic1ccccc1CNC/C=C/c2ccccc2 2230a_100020603302_100011215278 [1,1,0,0,0,0|1,0,1]=4 3999 B19R2.4484 Ic1ccccc1CNC/C=C/c2ccccc2 270004a_100020603302_100000010305 [1,1,0,0,0,0|1,0,1]=4 4000 B19R2.4484 Ic1ccccc1CNC/C=C/c2ccccc2 34a_100020603302_100011215278 [1,1,0,0,0,0|1,0,1]=4 4001 B19R2.4484 Ic1ccccc1CNCC=Cc2ccccc2 270004a_100015347259_100000210105 [1,1,0,0,0,0|1,0,1]=4 4002 B19R2.4484 Ic1ccccc1COC/C=C/c2ccccc2 34a_100000187465_100016265936 [1,1,0,0,0,0|0,0,1]=3 4003 B19R2.4484 Ic1ccccc1COC/C=C/c2ccccc2 34a_100000210256_100011215278 [1,1,0,0,0,0|0,0,1]=3 4004 B19R2.4484 Ic1ccccc1COC/C=C/c2ccccc2 7a_100000187465_100016265936 [1,1,0,0,0,0|0,0,1]=3 4005 B19R2.4484 Ic1ccccc1COC/C=C/c2cccnc2 34a_200102594124_100011215278 [1,1,0,0,0,0|1,0,1]=4 4006 B19R2.4484 Ic1ccccc1CSC/C=C/c2ccccc2 62a_100011216222_100016265936 [1,1,0,0,0,0|0,1,1]=4 4007 B19R2.4484 Ic1ccccc1CSC/C=C/c2ccccc2 62a_100016265936_100011216222 [1,1,0,0,0,0|0,1,1]=4 4008 B19R2.4484 Ic1ccccc1NN=CC=Cc2ccccc2 4a_100011218156_100000210105 [1,1,0,0,0,0|2,0,0]=4 4009 B19R2.4484 Nc1ccccc1C=CCOCc2ccccc2 271570a_200011106559_100000210017 [1,1,0,0,0,0|0,0,1]=3 4010 B19R2.4484 Nc1ccccc1COC/C=C/c2ccccc2 34a_100000212039_100016265936 [1,1,0,0,0,0|0,0,1]=3 4011 B19R2.4484 Nc1cccnc1C=CCOCc2ccccc2 271570a_200011106559_100000688686 [1,1,0,0,0,0|1,0,1]=4 4012 B19R2.4484 Nc1cccnc1COC/C=C/c2ccccc2 34a_114873767017_100016265936 [1,1,0,0,0,0|1,0,1]=4 4013 B19R2.4484 Nc1ccncc1C=CCOCc2ccccc2 271570a_200011106559_100000047001 [1,1,0,0,0,0|1,0,1]=4 4014 B19R2.4484 Nc1cnccc1C=CCOCc2ccccc2 271570a_200011106559_100009815883 [1,1,0,0,0,0|1,0,1]=4 4015 B19R2.4484 Nc1ncccc1C=CCOCc2ccccc2 271570a_200011106559_100000045569 [1,1,0,0,0,0|1,0,1]=4 4016 B19R2.4484 O=c1[nH]cccc1C=CCOCc2ccccc2 271570a_200011106559_100000050042 [1,1,0,0,0,0|1,0,1]=4 4017 B19R2.4484 O=c1cc[nH]cc1C=CCOCc2ccccc2 271570a_200011106559_100009998708 [1,1,0,0,0,0|1,0,1]=4 4018 B19R2.4484 Oc1ccccc1C=CCOCc2ccccc2 271570a_200011106559_100000739446 [1,1,0,0,0,0|0,0,1]=3 4019 B19R2.4484 Oc1ccccc1CNC/C=C/c2ccccc2 34a_100000185550_100016265936 [1,1,0,0,0,0|1,0,1]=4 4020 B19R2.4484 Oc1ccccc1CNCC=Cc2ccccc2 270004a_100000185550_100000210105 [1,1,0,0,0,0|1,0,1]=4 4021 B19R2.4484 Oc1cccnc1C=CCOCc2ccccc2 271570a_200011106559_100000034122 [1,1,0,0,0,0|1,0,1]=4 4022 B19R2.4484 Oc1cccnc1COC/C=C/c2ccccc2 34a_100000210256_200020655725 [1,1,0,0,0,0|1,0,1]=4 4023 B19R2.4484 Oc1cnccc1C=CCOCc2ccccc2 271570a_200011106559_100009817591 [1,1,0,0,0,0|1,0,1]=4 4024 B19R2.4484 S=c1cc[nH]cc1C=CCOCc2ccccc2 271570a_200011106559_200012280681 [1,1,0,0,0,0|1,0,1]=4 4025 B19R2.4484 [O-][n+]1ccccc1C=CCOCc2ccccc2 271570a_200011106559_200000042595 [1,1,0,0,0,0|1,0,1]=4 4026 B19R2.8899 CC(=CC=NNc1ccccc1)c2ccccc2 4a_100015195140_200043867958 [1,1,0,0,0,0|2,0,0]=4 4027 B19R2.8899 CC(NC/C=C/c1ccccc1)c2ccccc2 2230a_100020603302_100000230085 [1,1,0,0,0,0|1,0,1]=4 4028 B19R2.8899 CC(NC/C=C/c1ccccc1)c2ccccc2 34a_100020603302_100000211855 [1,1,0,0,0,0|1,0,1]=4 4029 B19R2.8899 CC(OC/C=C/c1ccccc1)c2ccccc2 34a_100000210256_100000211855 [1,1,0,0,0,0|0,0,1]=3 4030 B19R2.8899 CC(OC/C=C/c1cccnc1)c2ccccc2 34a_200102594124_100000211855 [1,1,0,0,0,0|1,0,1]=4 4031 B19R2.8899 CC(SC/C=C/c1ccccc1)c2ccccc2 62a_100000230085_100016265936 [1,1,0,0,0,0|0,1,1]=4 4032 B19R2.8899 CC(SC/C=C/c1ccccc1)c2ccccc2 62a_100016265936_100000230085 [1,1,0,0,0,0|0,1,1]=4 4033 B19R2.8899 C[C@@H](NC/C=C/c1ccccc1)c2ccccc2 2230a_100000751104_100016265936 [1,1,0,0,0,0|1,0,1]=4 4034 B19R2.8899 C[C@@H](NCC=Cc1ccccc1)c2ccccc2 270004a_100000751104_100000210105 [1,1,0,0,0,0|1,0,1]=4 4035 B19R2.8899 C[C@@H](OC/C=C/c1ccccc1)c2ccccc2 34a_100000761318_100016265936 [1,1,0,0,0,0|0,0,1]=3 4036 B19R2.8899 C[C@@H](OC/C=C/c1ccccc1)c2ccccc2 7a_100000761318_100016265936 [1,1,0,0,0,0|0,0,1]=3 4037 B19R2.8899 O=C(CCOCc1ccccc1)c2ccccc2 1458a_100000185807_100000234347 [1,1,0,0,0,0|0,0,2]=4 4038 B19R2.8899 O=C(CCOCc1ccccc1)c2ccccc2 7a_100000210790_100000750707 [1,1,0,0,0,0|0,0,2]=4 4039 B19R2.8899 O=C(OCOCc1ccccc1)c2ccccc2 7a_100000210790_100000073877 [1,1,0,0,0,0|1,0,1]=4 4040 B19R2.8900 Br/C(=C\c1ccccc1)/C=NNc2ccccc2 4a_100015195140_100016988036 [1,1,0,0,0,0|2,0,0]=4 4041 B19R2.8900 C/C(=C\c1ccccc1)/C=NNc2ccccc2 4a_100015195140_100016997181 [1,1,0,0,0,0|2,0,0]=4 4042 B19R2.8900 C/C(=C\c1ccccc1)/COCc2ccccc2 34a_200025717232_100015291786 [1,1,0,0,0,0|0,0,1]=3 4043 B19R2.8900 C/C(=C\c1ccccc1)/COCc2ccccc2 7a_200025717232_100000211182 [1,1,0,0,0,0|0,0,1]=3 4044 B19R2.8900 C/C(=C\c1ccccc1)/COCc2ccccn2 34a_200025717232_100000721315 [1,1,0,0,0,0|1,0,1]=4 4045 B19R2.8900 C/C(=C\c1ccccc1)/COCc2ccccn2 7a_200025717232_100000721315 [1,1,0,0,0,0|1,0,1]=4 4046 B19R2.8900 C/C(=C\c1ccccc1)/COCc2cccnc2 34a_200025717232_100000733263 [1,1,0,0,0,0|1,0,1]=4 4047 B19R2.8900 C/C(=C\c1ccccc1)/COCc2cccnc2 7a_200025717232_100000741622 [1,1,0,0,0,0|1,0,1]=4 4048 B19R2.8900 C/C(=C\c1ccccc1)/COCc2ccncc2 7a_200025717232_100015193705 [1,1,0,0,0,0|1,0,1]=4 4049 B19R2.8900 CN(C/C=C/c1ccccc1)Cc2ccccc2 2230a_100000186898_100016265936 [1,1,0,0,0,0|1,0,1]=4 4050 B19R2.8900 CN(C/C=C/c1ccccc1)Cc2ccccc2 269982a_100000186898_100016265936 [1,1,0,0,0,0|1,0,1]=4 4051 B19R2.8900 CN(CC=Cc1ccccc1)Cc2ccccc2 270004a_100000186898_100000210105 [1,1,0,0,0,0|1,0,1]=4 4052 B19R2.8900 Cl/C(=C/c1ccccc1)/C=NNc2ccccc2 4a_100015195140_200014065628 [1,1,0,0,0,0|2,0,0]=4 4053 B19R2.8900 O=C(C/C=C/c1ccccc1)Cc2ccccc2 1458a_100011219626_100015291786 [1,1,0,0,0,0|1,0,1]=4 4054 B19R2.8900 O=C(C=CSc1ccccc1)Cc2ccccc2 1458a_100016262050_100015291786 [1,1,0,0,0,0|2,0,0]=4 4055 B19R2.8900 O=C(COCc1ccccc1)Cc2ccccc2 1458a_100000230186_100015291786 [1,1,0,0,0,0|0,0,2]=4 4056 B19R2.8900 O=C(COCc1ccccc1)Cc2ccccc2 7a_100000210790_100000233483 [1,1,0,0,0,0|0,0,2]=4 4057 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 11a_100000106764_100000230186 [1,1,0,0,0,0|1,0,1]=4 4058 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 1626a_100000106764_100000230186 [1,1,0,0,0,0|1,0,1]=4 4059 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 22a_100000106764_100000230186 [1,1,0,0,0,0|1,0,1]=4 4060 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 34a_100000210790_100000182850 [1,1,0,0,0,0|1,0,1]=4 4061 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 34a_100000246334_100015291786 [1,1,0,0,0,0|1,0,1]=4 4062 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 527a_100000106764_100000230186 [1,1,0,0,0,0|1,0,1]=4 4063 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 7a_100000210790_100000182850 [1,1,0,0,0,0|1,0,1]=4 4064 B19R2.8900 O=C(COCc1ccccc1)Oc2ccccc2 34a_100000210790_100009813826 [1,1,0,0,0,0|1,0,1]=4 4065 B19R2.8900 O=C(COCc1ccccc1)Oc2ccccc2 7a_100000210790_100009813826 [1,1,0,0,0,0|1,0,1]=4 4066 B19R2.11855 Brc1ccc(cc1)C=CC=NNc2ccccc2 4a_100015195140_100016291818 [1,1,0,0,0,0|2,0,0]=4 4067 B19R2.11855 Brc1ccc(cc1)C=CCNCc2ccccc2 270004a_100015324214_100016291818 [1,1,0,0,0,0|1,0,1]=4 4068 B19R2.11855 Brc1ccc(cc1)C=CCOCc2ccccc2 271570a_200011106559_100000752885 [1,1,0,0,0,0|0,0,1]=3 4069 B19R2.11855 Brc1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100000174875_100016265936 [1,1,0,0,0,0|1,0,1]=4 4070 B19R2.11855 Brc1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100020603302_100011217064 [1,1,0,0,0,0|1,0,1]=4 4071 B19R2.11855 Brc1ccc(cc1)CNC/C=C/c2ccccc2 270004a_100020603302_100000186029 [1,1,0,0,0,0|1,0,1]=4 4072 B19R2.11855 Brc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100000174875_100016265936 [1,1,0,0,0,0|1,0,1]=4 4073 B19R2.11855 Brc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100020603302_100000189115 [1,1,0,0,0,0|1,0,1]=4 4074 B19R2.11855 Brc1ccc(cc1)CNCC=Cc2ccccc2 270004a_100000174875_100000210105 [1,1,0,0,0,0|1,0,1]=4 4075 B19R2.11855 Brc1ccc(cc1)COC/C=C/c2ccccc2 34a_100000210256_100000189115 [1,1,0,0,0,0|0,0,1]=3 4076 B19R2.11855 Brc1ccc(cc1)COC/C=C/c2ccccc2 34a_100000695286_100016265936 [1,1,0,0,0,0|0,0,1]=3 4077 B19R2.11855 Brc1ccc(cc1)COC/C=C/c2cccnc2 34a_200102594124_100000189115 [1,1,0,0,0,0|1,0,1]=4 4078 B19R2.11855 Brc1ccc(cc1)CSC/C=C/c2ccccc2 62a_100000189115_100016265936 [1,1,0,0,0,0|0,1,1]=4 4079 B19R2.11855 Brc1ccc(cc1)CSC/C=C/c2ccccc2 62a_100016265936_100000189115 [1,1,0,0,0,0|0,1,1]=4 4080 B19R2.11855 Brc1ccc(cc1)NN=CC=Cc2ccccc2 4a_100000735608_100000210105 [1,1,0,0,0,0|2,0,0]=4 4081 B19R2.11855 Brc1ccc(cn1)C=CCOCc2ccccc2 271570a_200011106559_100009814638 [1,1,0,0,0,0|1,0,1]=4 4082 B19R2.11855 Brc1ccc(cn1)COC/C=C/c2ccccc2 34a_100000210256_100009831999 [1,1,0,0,0,0|1,0,1]=4 4083 B19R2.11855 Brc1ccc(cn1)COC/C=C/c2ccccc2 34a_100009816760_100016265936 [1,1,0,0,0,0|1,0,1]=4 4084 B19R2.11855 Brc1ccc(cn1)COC/C=C/c2ccccc2 7a_100009816760_100016265936 [1,1,0,0,0,0|1,0,1]=4 4085 B19R2.11855 Brc1ccc(nc1)C=CCOCc2ccccc2 271570a_200011106559_100000686858 [1,1,0,0,0,0|1,0,1]=4 4086 B19R2.11855 Brc1ccc(nc1)COC/C=C/c2ccccc2 34a_100000210256_100000702658 [1,1,0,0,0,0|1,0,1]=4 4087 B19R2.11855 Brc1ccc(nc1)COC/C=C/c2ccccc2 34a_100000754261_100016265936 [1,1,0,0,0,0|1,0,1]=4 4088 B19R2.11855 C[n+]1ccc(cc1)COC/C=C/c2ccccc2 34a_100009831711_100016265936 [1,1,0,0,0,0|1,0,1]=4 4089 B19R2.11855 Cc1ccc(cc1)C=CC=NNc2ccccc2 4a_100015195140_100016257026 [1,1,0,0,0,0|2,0,0]=4 4090 B19R2.11855 Cc1ccc(cc1)C=CCNCc2ccccc2 270004a_100015324214_100016257026 [1,1,0,0,0,0|1,0,1]=4 4091 B19R2.11855 Cc1ccc(cc1)C=CCOCc2ccccc2 271570a_200011106559_100000186775 [1,1,0,0,0,0|0,0,1]=3 4092 B19R2.11855 Cc1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100000174908_100016265936 [1,1,0,0,0,0|1,0,1]=4 4093 B19R2.11855 Cc1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100020603302_100000210814 [1,1,0,0,0,0|1,0,1]=4 4094 B19R2.11855 Cc1ccc(cc1)CNC/C=C/c2ccccc2 270004a_100020603302_100000211033 [1,1,0,0,0,0|1,0,1]=4 4095 B19R2.11855 Cc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100000174908_100016265936 [1,1,0,0,0,0|1,0,1]=4 4096 B19R2.11855 Cc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100020603302_100000210814 [1,1,0,0,0,0|1,0,1]=4 4097 B19R2.11855 Cc1ccc(cc1)CNCC=Cc2ccccc2 270004a_100000174908_100000210105 [1,1,0,0,0,0|1,0,1]=4 4098 B19R2.11855 Cc1ccc(cc1)COC/C=C/c2ccccc2 34a_100000210256_100000210814 [1,1,0,0,0,0|0,0,1]=3 4099 B19R2.11855 Cc1ccc(cc1)COC/C=C/c2ccccc2 34a_100011215236_100016265936 [1,1,0,0,0,0|0,0,1]=3 4100 B19R2.11855 Cc1ccc(cc1)COC/C=C/c2ccccc2 7a_100011215236_100016265936 [1,1,0,0,0,0|0,0,1]=3 4101 B19R2.11855 Cc1ccc(cc1)COC/C=C/c2cccnc2 34a_200102594124_100000210814 [1,1,0,0,0,0|1,0,1]=4 4102 B19R2.11855 Cc1ccc(cc1)CSC/C=C/c2ccccc2 62a_100000210814_100016265936 [1,1,0,0,0,0|0,1,1]=4 4103 B19R2.11855 Cc1ccc(cc1)CSC/C=C/c2ccccc2 62a_100016265936_100000210814 [1,1,0,0,0,0|0,1,1]=4 4104 B19R2.11855 Cc1ccc(cc1)NN=CC=Cc2ccccc2 4a_100000683527_100000210105 [1,1,0,0,0,0|2,0,0]=4 4105 B19R2.11855 Cc1ccc(cn1)C=CCOCc2ccccc2 271570a_200011106559_100000751577 [1,1,0,0,0,0|1,0,1]=4 4106 B19R2.11855 Cc1ccc(cn1)COC/C=C/c2ccccc2 34a_100000210256_100016987292 [1,1,0,0,0,0|1,0,1]=4 4107 B19R2.11855 Cc1ccc(cn1)COC/C=C/c2ccccc2 34a_100011248133_100016265936 [1,1,0,0,0,0|1,0,1]=4 4108 B19R2.11855 Cc1ccc(nc1)C=CCOCc2ccccc2 271570a_200011106559_100000754016 [1,1,0,0,0,0|1,0,1]=4 4109 B19R2.11855 Cc1ccc(nc1)COC/C=C/c2ccccc2 34a_100000210256_100000691093 [1,1,0,0,0,0|1,0,1]=4 4110 B19R2.11855 Cc1ccc(nc1)COC/C=C/c2ccccc2 34a_100012001401_100016265936 [1,1,0,0,0,0|1,0,1]=4 4111 B19R2.11855 Clc1ccc(cc1)C=CC=NNc2ccccc2 4a_100015195140_100102525842 [1,1,0,0,0,0|2,0,0]=4 4112 B19R2.11855 Clc1ccc(cc1)C=CCNCc2ccccc2 270004a_100015324214_100102525842 [1,1,0,0,0,0|1,0,1]=4 4113 B19R2.11855 Clc1ccc(cc1)C=CCOCc2ccccc2 271570a_200011106559_100000755918 [1,1,0,0,0,0|0,0,1]=3 4114 B19R2.11855 Clc1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100000174871_100016265936 [1,1,0,0,0,0|1,0,1]=4 4115 B19R2.11855 Clc1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100020603302_100000694040 [1,1,0,0,0,0|1,0,1]=4 4116 B19R2.11855 Clc1ccc(cc1)CNC/C=C/c2ccccc2 270004a_100020603302_100000189385 [1,1,0,0,0,0|1,0,1]=4 4117 B19R2.11855 Clc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100000174871_100016265936 [1,1,0,0,0,0|1,0,1]=4 4118 B19R2.11855 Clc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100020603302_100000694040 [1,1,0,0,0,0|1,0,1]=4 4119 B19R2.11855 Clc1ccc(cc1)CNCC=Cc2ccccc2 270004a_100000174871_100000210105 [1,1,0,0,0,0|1,0,1]=4 4120 B19R2.11855 Clc1ccc(cc1)COC/C=C/c2ccccc2 34a_100000210256_100000694040 [1,1,0,0,0,0|0,0,1]=3 4121 B19R2.11855 Clc1ccc(cc1)COC/C=C/c2ccccc2 34a_100000211118_100016265936 [1,1,0,0,0,0|0,0,1]=3 4122 B19R2.11855 Clc1ccc(cc1)COC/C=C/c2ccccc2 7a_100000211118_100016265936 [1,1,0,0,0,0|0,0,1]=3 4123 B19R2.11855 Clc1ccc(cc1)COC/C=C/c2cccnc2 34a_200102594124_100000694040 [1,1,0,0,0,0|1,0,1]=4 4124 B19R2.11855 Clc1ccc(cc1)CSC/C=C/c2ccccc2 62a_100000187161_100016265936 [1,1,0,0,0,0|0,1,1]=4 4125 B19R2.11855 Clc1ccc(cc1)CSC/C=C/c2ccccc2 62a_100016265936_100000187161 [1,1,0,0,0,0|0,1,1]=4 4126 B19R2.11855 Clc1ccc(cc1)NN=CC=Cc2ccccc2 4a_100000683521_100000210105 [1,1,0,0,0,0|2,0,0]=4 4127 B19R2.11855 Clc1ccc(cn1)C=CCOCc2ccccc2 271570a_200011106559_100000034144 [1,1,0,0,0,0|1,0,1]=4 4128 B19R2.11855 Clc1ccc(cn1)COC/C=C/c2ccccc2 34a_100000210256_100000735431 [1,1,0,0,0,0|1,0,1]=4 4129 B19R2.11855 Clc1ccc(cn1)COC/C=C/c2ccccc2 34a_100000755211_100016265936 [1,1,0,0,0,0|1,0,1]=4 4130 B19R2.11855 Clc1ccc(cn1)COC/C=C/c2ccccc2 7a_100000755211_100016265936 [1,1,0,0,0,0|1,0,1]=4 4131 B19R2.11855 Clc1ccc(nc1)C=CCOCc2ccccc2 271570a_200011106559_100011356976 [1,1,0,0,0,0|1,0,1]=4 4132 B19R2.11855 Clc1ccc(nc1)COC/C=C/c2ccccc2 34a_100000210256_100012066911 [1,1,0,0,0,0|1,0,1]=4 4133 B19R2.11855 Clc1ccc(nc1)COC/C=C/c2ccccc2 34a_100000703999_100016265936 [1,1,0,0,0,0|1,0,1]=4 4134 B19R2.11855 Fc1ccc(cc1)C=CC=NNc2ccccc2 4a_100015195140_100016272083 [1,1,0,0,0,0|2,0,0]=4 4135 B19R2.11855 Fc1ccc(cc1)C=CCNCc2ccccc2 270004a_100015324214_100016272083 [1,1,0,0,0,0|1,0,1]=4 4136 B19R2.11855 Fc1ccc(cc1)C=CCOCc2ccccc2 271570a_200011106559_100000211213 [1,1,0,0,0,0|0,0,1]=3 4137 B19R2.11855 Fc1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100000174882_100016265936 [1,1,0,0,0,0|1,0,1]=4 4138 B19R2.11855 Fc1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100020603302_100000198546 [1,1,0,0,0,0|1,0,1]=4 4139 B19R2.11855 Fc1ccc(cc1)CNC/C=C/c2ccccc2 270004a_100020603302_100000210084 [1,1,0,0,0,0|1,0,1]=4 4140 B19R2.11855 Fc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100000174882_100016265936 [1,1,0,0,0,0|1,0,1]=4 4141 B19R2.11855 Fc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100020603302_100000198546 [1,1,0,0,0,0|1,0,1]=4 4142 B19R2.11855 Fc1ccc(cc1)CNCC=Cc2ccccc2 270004a_100000174882_100000210105 [1,1,0,0,0,0|1,0,1]=4 4143 B19R2.11855 Fc1ccc(cc1)COC/C=C/c2ccccc2 34a_100000210256_100000198546 [1,1,0,0,0,0|0,0,1]=3 4144 B19R2.11855 Fc1ccc(cc1)COC/C=C/c2ccccc2 34a_100000210977_100016265936 [1,1,0,0,0,0|0,0,1]=3 4145 B19R2.11855 Fc1ccc(cc1)COC/C=C/c2ccccc2 7a_100000210977_100016265936 [1,1,0,0,0,0|0,0,1]=3 4146 B19R2.11855 Fc1ccc(cc1)COC/C=C/c2cccnc2 34a_200102594124_100000198546 [1,1,0,0,0,0|1,0,1]=4 4147 B19R2.11855 Fc1ccc(cc1)CSC/C=C/c2ccccc2 62a_100000198546_100016265936 [1,1,0,0,0,0|0,1,1]=4 4148 B19R2.11855 Fc1ccc(cc1)CSC/C=C/c2ccccc2 62a_100016265936_100000187164 [1,1,0,0,0,0|0,1,1]=4 4149 B19R2.11855 Fc1ccc(cc1)NN=CC=Cc2ccccc2 4a_100000728448_100000210105 [1,1,0,0,0,0|2,0,0]=4 4150 B19R2.11855 Fc1ccc(cn1)C=CCOCc2ccccc2 271570a_200011106559_100000748661 [1,1,0,0,0,0|1,0,1]=4 4151 B19R2.11855 Fc1ccc(cn1)COC/C=C/c2ccccc2 34a_100000079959_100016265936 [1,1,0,0,0,0|1,0,1]=4 4152 B19R2.11855 Fc1ccc(cn1)COC/C=C/c2ccccc2 34a_100000210256_100000099788 [1,1,0,0,0,0|1,0,1]=4 4153 B19R2.11855 Fc1ccc(nc1)C=CCOCc2ccccc2 271570a_200011106559_100000744514 [1,1,0,0,0,0|1,0,1]=4 4154 B19R2.11855 Fc1ccc(nc1)COC/C=C/c2ccccc2 34a_100000210256_100000703193 [1,1,0,0,0,0|1,0,1]=4 4155 B19R2.11855 Fc1ccc(nc1)COC/C=C/c2ccccc2 34a_100011999454_100016265936 [1,1,0,0,0,0|1,0,1]=4 4156 B19R2.11855 Ic1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100016989417_100016265936 [1,1,0,0,0,0|1,0,1]=4 4157 B19R2.11855 Ic1ccc(cc1)CNC/C=C/c2ccccc2 2230a_100020603302_100000189116 [1,1,0,0,0,0|1,0,1]=4 4158 B19R2.11855 Ic1ccc(cc1)CNC/C=C/c2ccccc2 34a_100016989417_100016265936 [1,1,0,0,0,0|1,0,1]=4 4159 B19R2.11855 Ic1ccc(cc1)CNC/C=C/c2ccccc2 34a_100020603302_100000189116 [1,1,0,0,0,0|1,0,1]=4 4160 B19R2.11855 Ic1ccc(cc1)CNCC=Cc2ccccc2 270004a_100016989417_100000210105 [1,1,0,0,0,0|1,0,1]=4 4161 B19R2.11855 Ic1ccc(cc1)COC/C=C/c2ccccc2 34a_100000210256_100000189116 [1,1,0,0,0,0|0,0,1]=3 4162 B19R2.11855 Ic1ccc(cc1)COC/C=C/c2ccccc2 34a_100000690907_100016265936 [1,1,0,0,0,0|0,0,1]=3 4163 B19R2.11855 Ic1ccc(cc1)COC/C=C/c2ccccc2 7a_100000690907_100016265936 [1,1,0,0,0,0|0,0,1]=3 4164 B19R2.11855 Ic1ccc(cc1)COC/C=C/c2cccnc2 34a_200102594124_100000189116 [1,1,0,0,0,0|1,0,1]=4 4165 B19R2.11855 Ic1ccc(cc1)CSC/C=C/c2ccccc2 62a_100000189116_100016265936 [1,1,0,0,0,0|0,1,1]=4 4166 B19R2.11855 Ic1ccc(cc1)CSC/C=C/c2ccccc2 62a_100016265936_100000189116 [1,1,0,0,0,0|0,1,1]=4 4167 B19R2.11855 Ic1ccc(cc1)NN=CC=Cc2ccccc2 4a_100016988836_100000210105 [1,1,0,0,0,0|2,0,0]=4 4168 B19R2.11855 Nc1ccc(cc1)C=CCOCc2ccccc2 271570a_200011106559_100000185761 [1,1,0,0,0,0|0,0,1]=3 4169 B19R2.11855 Nc1ccc(cc1)COC/C=C/c2ccccc2 34a_100011215238_100016265936 [1,1,0,0,0,0|0,0,1]=3 4170 B19R2.11855 Nc1ccc(cn1)C=CCOCc2ccccc2 271570a_200011106559_100000187370 [1,1,0,0,0,0|1,0,1]=4 4171 B19R2.11855 Nc1ccc(cn1)COC/C=C/c2ccccc2 34a_100000704267_100016265936 [1,1,0,0,0,0|1,0,1]=4 4172 B19R2.11855 Nc1ccc(nc1)C=CCOCc2ccccc2 271570a_200011106559_100000744251 [1,1,0,0,0,0|1,0,1]=4 4173 B19R2.11855 Nc1ccc(nc1)COC/C=C/c2ccccc2 34a_100011998161_100016265936 [1,1,0,0,0,0|1,0,1]=4 4174 B19R2.11855 O=c1ccc(c[nH]1)C=CCOCc2ccccc2 271570a_200011106559_100000212171 [1,1,0,0,0,0|1,0,1]=4 4175 B19R2.11855 O=c1ccc(c[nH]1)COC/C=C/c2ccccc2 34a_100011999846_100016265936 [1,1,0,0,0,0|1,0,1]=4 4176 B19R2.11855 Oc1ccc(cc1)C=CC=NNc2ccccc2 4a_100015195140_200011996185 [1,1,0,0,0,0|2,0,0]=4 4177 B19R2.11855 Oc1ccc(cc1)C=CCOCc2ccccc2 271570a_200011106559_100000185759 [1,1,0,0,0,0|0,0,1]=3 4178 B19R2.11855 Oc1ccc(cc1)CNC/C=C/c2ccccc2 34a_100000185549_100016265936 [1,1,0,0,0,0|1,0,1]=4 4179 B19R2.11855 Oc1ccc(nc1)C=CCOCc2ccccc2 271570a_200011106559_100000685995 [1,1,0,0,0,0|1,0,1]=4 4180 B19R2.11855 [O-][n+]1ccc(cc1)C=CCOCc2ccccc2 271570a_200011106559_100000039755 [1,1,0,0,0,0|1,0,1]=4 4181 B19R2.11855 [O-][n+]1ccc(cc1)COC/C=C/c2ccccc2 34a_100000031831_100016265936 [1,1,0,0,0,0|1,0,1]=4 4182 B19R2.11855 [O-][n+]1ccc(cc1)COC/C=C/c2ccccc2 7a_100000031831_100016265936 [1,1,0,0,0,0|1,0,1]=4 4183 B19R2.286 Cc1ccc(cc1)C=CC(=O)Cc2ccccc2 1458a_100000716854_100015291786 [0,1,0,0,1,0|0,0,0]=2 4184 B19R2.286 Cc1ccc(cc1)C=CC(=O)Cc2ccccn2 1458a_100000716854_100000721315 [0,1,0,0,1,0|1,0,0]=3 4185 B19R2.286 Cc1ccc(cc1)C=CC(=O)Cc2cccnc2 1458a_100000716854_100000733263 [0,1,0,0,1,0|1,0,0]=3 4186 B19R2.286 Cc1ccc(cc1)C=CC(=O)Cc2cccnn2 1458a_100000716854_100016990269 [0,1,0,0,1,0|2,0,0]=4 4187 B19R2.286 Cc1ccc(cc1)C=CC(=O)Cc2ccncc2 1458a_100000716854_100000705612 [0,1,0,0,1,0|1,0,0]=3 4188 B19R2.286 Cc1ccc(cc1)C=CC(=O)Cc2cnccn2 1458a_100000716854_100016995436 [0,1,0,0,1,0|2,0,0]=4 4189 B19R2.286 Cc1ccc(cc1)C=CC(=O)Cc2cncnc2 1458a_100000716854_100015196519 [0,1,0,0,1,0|2,0,0]=4 4190 B19R2.286 Cc1ccc(cc1)C=CC(=O)Cc2ncccn2 1458a_100000716854_100000703007 [0,1,0,0,1,0|2,0,0]=4 4191 B19R2.286 Cc1ccc(cc1)C=CC(=O)Nc2ccccc2 11a_100000106764_100000716854 [0,1,0,0,1,0|1,0,0]=3 4192 B19R2.286 Cc1ccc(cc1)C=CC(=O)Nc2ccccc2 1626a_100000106764_100000716854 [0,1,0,0,1,0|1,0,0]=3 4193 B19R2.286 Cc1ccc(cc1)C=CC(=O)Nc2ccccc2 22a_100000106764_100000716854 [0,1,0,0,1,0|1,0,0]=3 4194 B19R2.286 Cc1ccc(cc1)CCC(=O)Cc2ccccc2 1458a_100000234883_100015291786 [0,1,0,0,1,0|0,0,2]=4 4195 B19R2.286 Cc1ccc(cc1)CCC(=O)Nc2ccccc2 11a_100000106764_100000234883 [0,1,0,0,1,0|2,0,0]=4 4196 B19R2.286 Cc1ccc(cc1)CCC(=O)Nc2ccccc2 1626a_100000106764_100000234883 [0,1,0,0,1,0|2,0,0]=4 4197 B19R2.286 Cc1ccc(cc1)CCC(=O)Nc2ccccc2 22a_100000106764_100000234883 [0,1,0,0,1,0|2,0,0]=4 4198 B19R2.286 Cc1ccc(cc1)CCC(=O)Nc2ccccc2 527a_100000106764_100000234883 [0,1,0,0,1,0|2,0,0]=4 4199 B19R2.286 Cc1ccc(cc1)CNC(=O)Nc2ccccc2 2430a_100000106764_100000174908 [0,1,0,0,1,0|2,0,0]=4 4200 B19R2.286 Cc1ccc(cc1)NCC(=O)Oc2ccccc2 34a_100000124888_100009813826 [0,1,0,0,1,0|1,0,1]=4 4201 B19R2.286 Cc1ccc(cc1)OCC(=O)Cc2ccccc2 1458a_100000182360_100015291786 [0,1,0,0,1,0|1,0,1]=4 4202 B19R2.286 Cc1ccc(cc1)OCC(=O)Cc2ccccc2 7a_100000210336_100000233483 [0,1,0,0,1,0|1,0,1]=4 4203 B19R2.286 Cc1ccc(cc1)OCC(=O)Oc2ccccc2 34a_100000210336_100009813826 [0,1,0,0,1,0|1,0,1]=4 4204 B19R2.286 Cc1ccc(cc1)OCC(=O)Oc2ccccc2 7a_100000210336_100009813826 [0,1,0,0,1,0|1,0,1]=4 4205 B19R2.286 Cc1ccc(cc1)SCC(=O)Cc2ccccc2 1458a_100000179497_100015291786 [0,1,0,0,1,0|1,0,1]=4 4206 B19R2.286 Cc1ccc(cc1)SCC(=O)Cc2ccccc2 62a_100000186775_100000233483 [0,1,0,0,1,0|1,0,1]=4 4207 B19R2.286 Cc1ccc(cc1)SCC(=O)Cc2ccccc2 62a_100000233483_100000186775 [0,1,0,0,1,0|1,0,1]=4 4208 B19R2.286 Cc1ccc(cc1)SCC(=O)Oc2ccccc2 62a_100000186775_100009813826 [0,1,0,0,1,0|1,0,1]=4 4209 B19R2.286 Cc1ccc(cc1)SCC(=O)Oc2ccccc2 62a_100009813826_100000186775 [0,1,0,0,1,0|1,0,1]=4 4210 B19R2.286 Cc1cnc(cn1)C=CC(=O)Cc2ccccc2 6a_100000685221_100000766558 [0,1,0,0,1,0|2,0,0]=4 4211 B19R2.286 Cc1ncc(cn1)C=CC(=O)Cc2ccccc2 6a_100011202771_100000766558 [0,1,0,0,1,0|2,0,0]=4 4212 B19R2.286 Nc1ccc(cc1)OCC(=O)Oc2ccccc2 34a_100000185829_100009813826 [0,1,0,0,1,0|1,0,1]=4 4213 B19R2.286 Nc1ccc(cc1)SCC(=O)Cc2ccccc2 62a_100000185761_100000233483 [0,1,0,0,1,0|1,0,1]=4 4214 B19R2.286 Nc1ccc(cc1)SCC(=O)Cc2ccccc2 62a_100000233483_100000185761 [0,1,0,0,1,0|1,0,1]=4 4215 B19R2.286 Nc1ccc(cc1)SCC(=O)Oc2ccccc2 62a_100000185761_100009813826 [0,1,0,0,1,0|1,0,1]=4 4216 B19R2.286 Nc1ccc(cc1)SCC(=O)Oc2ccccc2 62a_100009813826_100000185761 [0,1,0,0,1,0|1,0,1]=4 4217 B19R2.286 O=C(C#Cc1ccc(cc1)Br)Cc2ccccc2 1458a_100012100275_100015291786 [0,1,0,0,1,0|0,0,2]=4 4218 B19R2.286 O=C(C#Cc1ccc(cc1)Cl)Cc2ccccc2 1458a_100011892723_100015291786 [0,1,0,0,1,0|0,0,2]=4 4219 B19R2.286 O=C(C#Cc1ccc(cc1)F)Cc2ccccc2 1458a_100000238512_100015291786 [0,1,0,0,1,0|0,0,2]=4 4220 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2ccccc2 1458a_100016267368_100015291786 [0,1,0,0,1,0|0,0,0]=2 4221 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2ccccc2 6a_100000186029_100000766558 [0,1,0,0,1,0|0,0,0]=2 4222 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2ccccn2 1458a_100016267368_100000721315 [0,1,0,0,1,0|1,0,0]=3 4223 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2cccnc2 1458a_100016267368_100000733263 [0,1,0,0,1,0|1,0,0]=3 4224 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2cccnc2 6a_100000186029_100015187140 [0,1,0,0,1,0|1,0,0]=3 4225 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2cccnn2 1458a_100016267368_100016990269 [0,1,0,0,1,0|2,0,0]=4 4226 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2ccncc2 1458a_100016267368_100000705612 [0,1,0,0,1,0|1,0,0]=3 4227 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2cnccn2 1458a_100016267368_100016995436 [0,1,0,0,1,0|2,0,0]=4 4228 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2cncnc2 1458a_100016267368_100015196519 [0,1,0,0,1,0|2,0,0]=4 4229 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Cc2ncccn2 1458a_100016267368_100000703007 [0,1,0,0,1,0|2,0,0]=4 4230 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Nc2ccccc2 11a_100000106764_100016267368 [0,1,0,0,1,0|1,0,0]=3 4231 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Nc2ccccc2 1626a_100000106764_100016267368 [0,1,0,0,1,0|1,0,0]=3 4232 B19R2.286 O=C(C=Cc1ccc(cc1)Br)Nc2ccccc2 22a_100000106764_100016267368 [0,1,0,0,1,0|1,0,0]=3 4233 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Cc2ccccc2 1458a_100000184863_100015291786 [0,1,0,0,1,0|0,0,0]=2 4234 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Cc2ccccn2 1458a_100000184863_100000721315 [0,1,0,0,1,0|1,0,0]=3 4235 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Cc2cccnc2 1458a_100000184863_100000733263 [0,1,0,0,1,0|1,0,0]=3 4236 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Cc2cccnn2 1458a_100000184863_100016990269 [0,1,0,0,1,0|2,0,0]=4 4237 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Cc2ccncc2 1458a_100000184863_100000705612 [0,1,0,0,1,0|1,0,0]=3 4238 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Cc2cnccn2 1458a_100000184863_100016995436 [0,1,0,0,1,0|2,0,0]=4 4239 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Cc2cncnc2 1458a_100000184863_100015196519 [0,1,0,0,1,0|2,0,0]=4 4240 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Cc2ncccn2 1458a_100000184863_100000703007 [0,1,0,0,1,0|2,0,0]=4 4241 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Nc2ccccc2 11a_100000106764_100000184863 [0,1,0,0,1,0|1,0,0]=3 4242 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Nc2ccccc2 1626a_100000106764_100000184863 [0,1,0,0,1,0|1,0,0]=3 4243 B19R2.286 O=C(C=Cc1ccc(cc1)Cl)Nc2ccccc2 22a_100000106764_100000184863 [0,1,0,0,1,0|1,0,0]=3 4244 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2ccccc2 1458a_100000182136_100015291786 [0,1,0,0,1,0|0,0,0]=2 4245 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2ccccc2 6a_100000210084_100000766558 [0,1,0,0,1,0|0,0,0]=2 4246 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2ccccn2 1458a_100000182136_100000721315 [0,1,0,0,1,0|1,0,0]=3 4247 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2cccnc2 1458a_100000182136_100000733263 [0,1,0,0,1,0|1,0,0]=3 4248 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2cccnc2 6a_100000210084_100015187140 [0,1,0,0,1,0|1,0,0]=3 4249 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2cccnn2 1458a_100000182136_100016990269 [0,1,0,0,1,0|2,0,0]=4 4250 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2ccncc2 1458a_100000182136_100000705612 [0,1,0,0,1,0|1,0,0]=3 4251 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2cnccn2 1458a_100000182136_100016995436 [0,1,0,0,1,0|2,0,0]=4 4252 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2cncnc2 1458a_100000182136_100015196519 [0,1,0,0,1,0|2,0,0]=4 4253 B19R2.286 O=C(C=Cc1ccc(cc1)F)Cc2ncccn2 1458a_100000182136_100000703007 [0,1,0,0,1,0|2,0,0]=4 4254 B19R2.286 O=C(C=Cc1ccc(cc1)F)Nc2ccccc2 11a_100000106764_100000182136 [0,1,0,0,1,0|1,0,0]=3 4255 B19R2.286 O=C(C=Cc1ccc(cc1)F)Nc2ccccc2 1626a_100000106764_100000182136 [0,1,0,0,1,0|1,0,0]=3 4256 B19R2.286 O=C(C=Cc1ccc(cc1)F)Nc2ccccc2 22a_100000106764_100000182136 [0,1,0,0,1,0|1,0,0]=3 4257 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2ccccc2 1458a_100102526154_100015291786 [0,1,0,0,1,0|0,0,0]=2 4258 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2ccccc2 6a_100000188517_100000766558 [0,1,0,0,1,0|0,0,0]=2 4259 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2ccccn2 1458a_100102526154_100000721315 [0,1,0,0,1,0|1,0,0]=3 4260 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2cccnc2 1458a_100102526154_100000733263 [0,1,0,0,1,0|1,0,0]=3 4261 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2cccnc2 6a_100000188517_100015187140 [0,1,0,0,1,0|1,0,0]=3 4262 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2cccnn2 1458a_100102526154_100016990269 [0,1,0,0,1,0|2,0,0]=4 4263 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2ccncc2 1458a_100102526154_100000705612 [0,1,0,0,1,0|1,0,0]=3 4264 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2cnccn2 1458a_100102526154_100016995436 [0,1,0,0,1,0|2,0,0]=4 4265 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2cncnc2 1458a_100102526154_100015196519 [0,1,0,0,1,0|2,0,0]=4 4266 B19R2.286 O=C(C=Cc1ccc(cc1)I)Cc2ncccn2 1458a_100102526154_100000703007 [0,1,0,0,1,0|2,0,0]=4 4267 B19R2.286 O=C(C=Cc1ccc(cc1)I)Nc2ccccc2 11a_100000106764_100102526154 [0,1,0,0,1,0|1,0,0]=3 4268 B19R2.286 O=C(C=Cc1ccc(cc1)I)Nc2ccccc2 1626a_100000106764_100102526154 [0,1,0,0,1,0|1,0,0]=3 4269 B19R2.286 O=C(C=Cc1ccc(cc1)I)Nc2ccccc2 22a_100000106764_100102526154 [0,1,0,0,1,0|1,0,0]=3 4270 B19R2.286 O=C(C=Cc1ccc(cc1)O)Nc2ccccc2 22a_100000106764_100016269017 [0,1,0,0,1,0|1,0,0]=3 4271 B19R2.286 O=C(C=Cc1ccc(cn1)Br)Cc2ccccc2 6a_100000754260_100000766558 [0,1,0,0,1,0|1,0,0]=3 4272 B19R2.286 O=C(C=Cc1ccc(cn1)Br)Cc2cccnc2 6a_100000754260_100015187140 [0,1,0,0,1,0|2,0,0]=4 4273 B19R2.286 O=C(C=Cc1ccc(cn1)F)Cc2ccccc2 1458a_100020630499_100015291786 [0,1,0,0,1,0|1,0,0]=3 4274 B19R2.286 O=C(C=Cc1ccc(cn1)F)Cc2ccccc2 6a_100011934744_100000766558 [0,1,0,0,1,0|1,0,0]=3 4275 B19R2.286 O=C(C=Cc1ccc(cn1)F)Cc2ccccn2 1458a_100020630499_100000721315 [0,1,0,0,1,0|2,0,0]=4 4276 B19R2.286 O=C(C=Cc1ccc(cn1)F)Cc2cccnc2 1458a_100020630499_100000733263 [0,1,0,0,1,0|2,0,0]=4 4277 B19R2.286 O=C(C=Cc1ccc(cn1)F)Cc2cccnc2 6a_100011934744_100015187140 [0,1,0,0,1,0|2,0,0]=4 4278 B19R2.286 O=C(C=Cc1ccc(cn1)F)Cc2ccncc2 1458a_100020630499_100000705612 [0,1,0,0,1,0|2,0,0]=4 4279 B19R2.286 O=C(C=Cc1ccc(cn1)F)Nc2ccccc2 11a_100000106764_100020630499 [0,1,0,0,1,0|2,0,0]=4 4280 B19R2.286 O=C(C=Cc1ccc(cn1)F)Nc2ccccc2 1626a_100000106764_100020630499 [0,1,0,0,1,0|2,0,0]=4 4281 B19R2.286 O=C(C=Cc1ccc(cn1)F)Nc2ccccc2 22a_100000106764_100020630499 [0,1,0,0,1,0|2,0,0]=4 4282 B19R2.286 O=C(C=Cc1ccc(nc1)Br)Cc2ccccc2 1458a_100020588214_100015291786 [0,1,0,0,1,0|1,0,0]=3 4283 B19R2.286 O=C(C=Cc1ccc(nc1)Br)Cc2ccccn2 1458a_100020588214_100000721315 [0,1,0,0,1,0|2,0,0]=4 4284 B19R2.286 O=C(C=Cc1ccc(nc1)Br)Cc2cccnc2 1458a_100020588214_100000733263 [0,1,0,0,1,0|2,0,0]=4 4285 B19R2.286 O=C(C=Cc1ccc(nc1)Br)Cc2ccncc2 1458a_100020588214_100000705612 [0,1,0,0,1,0|2,0,0]=4 4286 B19R2.286 O=C(C=Cc1ccc(nc1)Br)Nc2ccccc2 11a_100000106764_100020588214 [0,1,0,0,1,0|2,0,0]=4 4287 B19R2.286 O=C(C=Cc1ccc(nc1)Br)Nc2ccccc2 1626a_100000106764_100020588214 [0,1,0,0,1,0|2,0,0]=4 4288 B19R2.286 O=C(C=Cc1ccc(nc1)Br)Nc2ccccc2 22a_100000106764_100020588214 [0,1,0,0,1,0|2,0,0]=4 4289 B19R2.286 O=C(C=Cc1cnc(cn1)Cl)Cc2ccccc2 6a_100012001714_100000766558 [0,1,0,0,1,0|2,0,0]=4 4290 B19R2.286 O=C(CCc1ccc(cc1)Br)Cc2ccccc2 1458a_100000217147_100015291786 [0,1,0,0,1,0|0,0,2]=4 4291 B19R2.286 O=C(CCc1ccc(cc1)Br)Nc2ccccc2 11a_100000106764_100000217147 [0,1,0,0,1,0|2,0,0]=4 4292 B19R2.286 O=C(CCc1ccc(cc1)Br)Nc2ccccc2 1626a_100000106764_100000217147 [0,1,0,0,1,0|2,0,0]=4 4293 B19R2.286 O=C(CCc1ccc(cc1)Br)Nc2ccccc2 22a_100000106764_100000217147 [0,1,0,0,1,0|2,0,0]=4 4294 B19R2.286 O=C(CCc1ccc(cc1)Br)Nc2ccccc2 527a_100000106764_100000217147 [0,1,0,0,1,0|2,0,0]=4 4295 B19R2.286 O=C(CCc1ccc(cc1)Cl)Cc2ccccc2 1458a_100000235379_100015291786 [0,1,0,0,1,0|0,0,2]=4 4296 B19R2.286 O=C(CCc1ccc(cc1)Cl)Nc2ccccc2 11a_100000106764_100000235379 [0,1,0,0,1,0|2,0,0]=4 4297 B19R2.286 O=C(CCc1ccc(cc1)Cl)Nc2ccccc2 1626a_100000106764_100000235379 [0,1,0,0,1,0|2,0,0]=4 4298 B19R2.286 O=C(CCc1ccc(cc1)Cl)Nc2ccccc2 22a_100000106764_100000235379 [0,1,0,0,1,0|2,0,0]=4 4299 B19R2.286 O=C(CCc1ccc(cc1)Cl)Nc2ccccc2 527a_100000106764_100000235379 [0,1,0,0,1,0|2,0,0]=4 4300 B19R2.286 O=C(CCc1ccc(cc1)F)Cc2ccccc2 1458a_100000198493_100015291786 [0,1,0,0,1,0|0,0,2]=4 4301 B19R2.286 O=C(CCc1ccc(cc1)F)Nc2ccccc2 11a_100000106764_100000198493 [0,1,0,0,1,0|2,0,0]=4 4302 B19R2.286 O=C(CCc1ccc(cc1)F)Nc2ccccc2 1626a_100000106764_100000198493 [0,1,0,0,1,0|2,0,0]=4 4303 B19R2.286 O=C(CCc1ccc(cc1)F)Nc2ccccc2 22a_100000106764_100000198493 [0,1,0,0,1,0|2,0,0]=4 4304 B19R2.286 O=C(CCc1ccc(cc1)F)Nc2ccccc2 527a_100000106764_100000198493 [0,1,0,0,1,0|2,0,0]=4 4305 B19R2.286 O=C(CCc1ccc(cc1)I)Cc2ccccc2 1458a_100011217499_100015291786 [0,1,0,0,1,0|0,0,2]=4 4306 B19R2.286 O=C(CCc1ccc(cc1)I)Nc2ccccc2 11a_100000106764_100011217499 [0,1,0,0,1,0|2,0,0]=4 4307 B19R2.286 O=C(CCc1ccc(cc1)I)Nc2ccccc2 1626a_100000106764_100011217499 [0,1,0,0,1,0|2,0,0]=4 4308 B19R2.286 O=C(CCc1ccc(cc1)I)Nc2ccccc2 22a_100000106764_100011217499 [0,1,0,0,1,0|2,0,0]=4 4309 B19R2.286 O=C(CCc1ccc(cc1)I)Nc2ccccc2 527a_100000106764_100011217499 [0,1,0,0,1,0|2,0,0]=4 4310 B19R2.286 O=C(CCc1ccc(cc1)O)Cc2ccccc2 1458a_100000742835_100015291786 [0,1,0,0,1,0|0,0,2]=4 4311 B19R2.286 O=C(CCc1ccc(cc1)O)Nc2ccccc2 22a_100000106764_100000742835 [0,1,0,0,1,0|2,0,0]=4 4312 B19R2.286 O=C(CNc1ccc(cc1)Br)Cc2ccccc2 2230a_100000210018_100000233483 [0,1,0,0,1,0|1,0,1]=4 4313 B19R2.286 O=C(CNc1ccc(cc1)Br)Oc2ccccc2 2230a_100000210018_100009813826 [0,1,0,0,1,0|1,0,1]=4 4314 B19R2.286 O=C(CNc1ccc(cc1)Br)Oc2ccccc2 34a_100000210018_100009813826 [0,1,0,0,1,0|1,0,1]=4 4315 B19R2.286 O=C(CNc1ccc(cc1)Cl)Cc2ccccc2 2230a_100000210052_100000233483 [0,1,0,0,1,0|1,0,1]=4 4316 B19R2.286 O=C(CNc1ccc(cc1)Cl)Oc2ccccc2 2230a_100000210052_100009813826 [0,1,0,0,1,0|1,0,1]=4 4317 B19R2.286 O=C(CNc1ccc(cc1)Cl)Oc2ccccc2 34a_100000210052_100009813826 [0,1,0,0,1,0|1,0,1]=4 4318 B19R2.286 O=C(CNc1ccc(cc1)F)Oc2ccccc2 34a_100000185862_100009813826 [0,1,0,0,1,0|1,0,1]=4 4319 B19R2.286 O=C(CNc1ccc(cc1)I)Oc2ccccc2 34a_100000185761_100009813826 [0,1,0,0,1,0|1,0,1]=4 4320 B19R2.286 O=C(CNc1ccc(cc1)O)Oc2ccccc2 34a_100000185829_100009813826 [0,1,0,0,1,0|1,0,1]=4 4321 B19R2.286 O=C(COc1ccc(cc1)Br)Cc2ccccc2 1458a_100000182358_100015291786 [0,1,0,0,1,0|1,0,1]=4 4322 B19R2.286 O=C(COc1ccc(cc1)Br)Cc2ccccc2 7a_100000185759_100000233483 [0,1,0,0,1,0|1,0,1]=4 4323 B19R2.286 O=C(COc1ccc(cc1)Br)Oc2ccccc2 34a_100000185759_100009813826 [0,1,0,0,1,0|1,0,1]=4 4324 B19R2.286 O=C(COc1ccc(cc1)Br)Oc2ccccc2 7a_100000185759_100009813826 [0,1,0,0,1,0|1,0,1]=4 4325 B19R2.286 O=C(COc1ccc(cc1)Cl)Cc2ccccc2 1458a_100016990877_100015291786 [0,1,0,0,1,0|1,0,1]=4 4326 B19R2.286 O=C(COc1ccc(cc1)Cl)Cc2ccccc2 7a_100000210216_100000233483 [0,1,0,0,1,0|1,0,1]=4 4327 B19R2.286 O=C(COc1ccc(cc1)Cl)Oc2ccccc2 34a_100000210216_100009813826 [0,1,0,0,1,0|1,0,1]=4 4328 B19R2.286 O=C(COc1ccc(cc1)Cl)Oc2ccccc2 7a_100000210216_100009813826 [0,1,0,0,1,0|1,0,1]=4 4329 B19R2.286 O=C(COc1ccc(cc1)F)Cc2ccccc2 1458a_100000184765_100015291786 [0,1,0,0,1,0|1,0,1]=4 4330 B19R2.286 O=C(COc1ccc(cc1)F)Oc2ccccc2 34a_100000210339_100009813826 [0,1,0,0,1,0|1,0,1]=4 4331 B19R2.286 O=C(COc1ccc(cc1)I)Cc2ccccc2 1458a_100000184369_100015291786 [0,1,0,0,1,0|1,0,1]=4 4332 B19R2.286 O=C(COc1ccc(cc1)I)Cc2ccccc2 7a_100000212066_100000233483 [0,1,0,0,1,0|1,0,1]=4 4333 B19R2.286 O=C(COc1ccc(cc1)I)Oc2ccccc2 34a_100000212066_100009813826 [0,1,0,0,1,0|1,0,1]=4 4334 B19R2.286 O=C(COc1ccc(cc1)I)Oc2ccccc2 7a_100000212066_100009813826 [0,1,0,0,1,0|1,0,1]=4 4335 B19R2.286 O=C(COc1ccc(cc1)O)Cc2ccccc2 1458a_100000031633_100015291786 [0,1,0,0,1,0|1,0,1]=4 4336 B19R2.286 O=C(CSc1ccc(cc1)Br)Cc2ccccc2 1458a_100000179496_100015291786 [0,1,0,0,1,0|1,0,1]=4 4337 B19R2.286 O=C(CSc1ccc(cc1)Br)Cc2ccccc2 62a_100000233483_100000752885 [0,1,0,0,1,0|1,0,1]=4 4338 B19R2.286 O=C(CSc1ccc(cc1)Br)Cc2ccccc2 62a_100000752885_100000233483 [0,1,0,0,1,0|1,0,1]=4 4339 B19R2.286 O=C(CSc1ccc(cc1)Br)Oc2ccccc2 62a_100000752885_100009813826 [0,1,0,0,1,0|1,0,1]=4 4340 B19R2.286 O=C(CSc1ccc(cc1)Br)Oc2ccccc2 62a_100009813826_100000752885 [0,1,0,0,1,0|1,0,1]=4 4341 B19R2.286 O=C(CSc1ccc(cc1)Cl)Cc2ccccc2 1458a_100000178402_100015291786 [0,1,0,0,1,0|1,0,1]=4 4342 B19R2.286 O=C(CSc1ccc(cc1)Cl)Cc2ccccc2 62a_100000233483_100000755918 [0,1,0,0,1,0|1,0,1]=4 4343 B19R2.286 O=C(CSc1ccc(cc1)Cl)Cc2ccccc2 62a_100000755918_100000233483 [0,1,0,0,1,0|1,0,1]=4 4344 B19R2.286 O=C(CSc1ccc(cc1)Cl)Oc2ccccc2 62a_100000755918_100009813826 [0,1,0,0,1,0|1,0,1]=4 4345 B19R2.286 O=C(CSc1ccc(cc1)Cl)Oc2ccccc2 62a_100009813826_100000755918 [0,1,0,0,1,0|1,0,1]=4 4346 B19R2.286 O=C(CSc1ccc(cc1)F)Cc2ccccc2 1458a_100000691584_100015291786 [0,1,0,0,1,0|1,0,1]=4 4347 B19R2.286 O=C(CSc1ccc(cc1)F)Cc2ccccc2 62a_100000211213_100000233483 [0,1,0,0,1,0|1,0,1]=4 4348 B19R2.286 O=C(CSc1ccc(cc1)F)Cc2ccccc2 62a_100000233483_100000211213 [0,1,0,0,1,0|1,0,1]=4 4349 B19R2.286 O=C(CSc1ccc(cc1)F)Oc2ccccc2 62a_100000211213_100009813826 [0,1,0,0,1,0|1,0,1]=4 4350 B19R2.286 O=C(CSc1ccc(cc1)F)Oc2ccccc2 62a_100009813826_100000211213 [0,1,0,0,1,0|1,0,1]=4 4351 B19R2.286 O=C(CSc1ccc(cc1)O)Cc2ccccc2 62a_100000233483_100000185759 [0,1,0,0,1,0|1,0,1]=4 4352 B19R2.286 O=C(CSc1ccc(cc1)O)Oc2ccccc2 62a_100009813826_100000185759 [0,1,0,0,1,0|1,0,1]=4 4353 B19R2.286 O=C(NCc1ccc(cc1)Br)Nc2ccccc2 2430a_100000106764_100000174875 [0,1,0,0,1,0|2,0,0]=4 4354 B19R2.286 O=C(NCc1ccc(cc1)Cl)Nc2ccccc2 2430a_100000106764_100000174871 [0,1,0,0,1,0|2,0,0]=4 4355 B19R2.286 O=C(NCc1ccc(cc1)F)Nc2ccccc2 2430a_100000106764_100000174882 [0,1,0,0,1,0|2,0,0]=4 4356 B19R2.286 O=C(NCc1ccc(cc1)I)Nc2ccccc2 2430a_100000106764_100016989417 [0,1,0,0,1,0|2,0,0]=4 4357 B19R2.286 O=C(NCc1ccc(cc1)O)Nc2ccccc2 2430a_100000106764_100000185549 [0,1,0,0,1,0|2,0,0]=4 4358 B19R2.4385 Cc1cc(ccn1)CC(=O)C=Cc2ccccc2 1458a_100000210462_200020672517 [0,1,0,0,1,0|1,0,0]=3 4359 B19R2.4385 Cc1cc(ccn1)CC(=O)C=Cc2ccccn2 1458a_100000740811_200020672517 [0,1,0,0,1,0|2,0,0]=4 4360 B19R2.4385 Cc1cc(ccn1)CC(=O)C=Cc2cccnc2 1458a_100000735890_200020672517 [0,1,0,0,1,0|2,0,0]=4 4361 B19R2.4385 Cc1cc(ccn1)CC(=O)C=Cc2ccncc2 1458a_100000682801_200020672517 [0,1,0,0,1,0|2,0,0]=4 4362 B19R2.4385 Cc1cccc(c1)CC(=O)C#Cc2ccccc2 1458a_100000736102_100000211840 [0,1,0,0,1,0|0,0,2]=4 4363 B19R2.4385 Cc1cccc(c1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000211840 [0,1,0,0,1,0|0,0,0]=2 4364 B19R2.4385 Cc1cccc(c1)CC(=O)C=Cc2ccccn2 1458a_100000740811_100000211840 [0,1,0,0,1,0|1,0,0]=3 4365 B19R2.4385 Cc1cccc(c1)CC(=O)C=Cc2cccnc2 1458a_100000735890_100000211840 [0,1,0,0,1,0|1,0,0]=3 4366 B19R2.4385 Cc1cccc(c1)CC(=O)C=Cc2ccncc2 1458a_100000682801_100000211840 [0,1,0,0,1,0|1,0,0]=3 4367 B19R2.4385 Cc1cccc(c1)CC(=O)CCc2ccccc2 1458a_100000185753_100000211840 [0,1,0,0,1,0|0,0,2]=4 4368 B19R2.4385 Cc1cccc(c1)CC(=O)CCc2ccccc2 1458a_100011206899_100000765856 [0,1,0,0,1,0|0,0,2]=4 4369 B19R2.4385 Cc1cccc(c1)CC(=O)COc2ccccc2 1458a_100000186222_100000211840 [0,1,0,0,1,0|1,0,1]=4 4370 B19R2.4385 Cc1cccc(c1)CC(=O)CSc2ccccc2 1458a_100000211596_100000211840 [0,1,0,0,1,0|1,0,1]=4 4371 B19R2.4385 Cc1cccc(c1)CC(=O)NCc2ccccc2 11a_100015324214_100011206899 [0,1,0,0,1,0|1,0,1]=4 4372 B19R2.4385 Cc1cccc(c1)CC(=O)NCc2ccccc2 1626a_100015324214_100011206899 [0,1,0,0,1,0|1,0,1]=4 4373 B19R2.4385 Cc1cccc(c1)CC(=O)NCc2ccccc2 240690a_100015324214_100011206899 [0,1,0,0,1,0|1,0,1]=4 4374 B19R2.4385 Cc1cccc(c1)CC(=O)NCc2ccccc2 527a_100015324214_100011206899 [0,1,0,0,1,0|1,0,1]=4 4375 B19R2.4385 Cc1cccc(c1)CC(=O)NNc2ccccc2 22a_100015195140_100011206899 [0,1,0,0,1,0|2,0,0]=4 4376 B19R2.4385 Cc1cccc(c1)NC(=O)C=Cc2ccccc2 11a_100000188690_100000210462 [0,1,0,0,1,0|1,0,0]=3 4377 B19R2.4385 Cc1cccc(c1)NC(=O)C=Cc2ccccc2 1626a_100000188690_100000210462 [0,1,0,0,1,0|1,0,0]=3 4378 B19R2.4385 Cc1cccc(c1)NC(=O)C=Cc2ccccc2 22a_100000188690_100000210462 [0,1,0,0,1,0|1,0,0]=3 4379 B19R2.4385 Cc1cccc(c1)NC(=O)C=Cc2ccccn2 11a_100000188690_100000740811 [0,1,0,0,1,0|2,0,0]=4 4380 B19R2.4385 Cc1cccc(c1)NC(=O)C=Cc2ccccn2 22a_100000188690_100000740811 [0,1,0,0,1,0|2,0,0]=4 4381 B19R2.4385 Cc1cccc(c1)NC(=O)C=Cc2cccnc2 11a_100000188690_100000735890 [0,1,0,0,1,0|2,0,0]=4 4382 B19R2.4385 Cc1cccc(c1)NC(=O)C=Cc2cccnc2 22a_100000188690_100000735890 [0,1,0,0,1,0|2,0,0]=4 4383 B19R2.4385 Cc1cccc(c1)NC(=O)C=Cc2ccncc2 22a_100000188690_100000682801 [0,1,0,0,1,0|2,0,0]=4 4384 B19R2.4385 Cc1cccc(c1)NC(=O)CCc2ccccc2 11a_100000188690_100000185753 [0,1,0,0,1,0|2,0,0]=4 4385 B19R2.4385 Cc1cccc(c1)NC(=O)CCc2ccccc2 1626a_100000188690_100000185753 [0,1,0,0,1,0|2,0,0]=4 4386 B19R2.4385 Cc1cccc(c1)NC(=O)CCc2ccccc2 22a_100000188690_100000185753 [0,1,0,0,1,0|2,0,0]=4 4387 B19R2.4385 Cc1cccc(c1)NC(=O)CCc2ccccc2 527a_100000188690_100000185753 [0,1,0,0,1,0|2,0,0]=4 4388 B19R2.4385 Cc1cccc(c1)NC(=O)NCc2ccccc2 2430a_100000188690_100015324214 [0,1,0,0,1,0|2,0,0]=4 4389 B19R2.4385 Cc1cccc(c1)NC(=O)NCc2ccccc2 512a_100000188690_100015324214 [0,1,0,0,1,0|2,0,0]=4 4390 B19R2.4385 Cc1cccc(n1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000757606 [0,1,0,0,1,0|1,0,0]=3 4391 B19R2.4385 Cc1cccc(n1)CC(=O)C=Cc2ccccn2 1458a_100000740811_100000757606 [0,1,0,0,1,0|2,0,0]=4 4392 B19R2.4385 Cc1cccc(n1)CC(=O)C=Cc2cccnc2 1458a_100000735890_100000757606 [0,1,0,0,1,0|2,0,0]=4 4393 B19R2.4385 Cc1cccc(n1)CC(=O)C=Cc2ccncc2 1458a_100000682801_100000757606 [0,1,0,0,1,0|2,0,0]=4 4394 B19R2.4385 Cc1ccnc(c1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000718516 [0,1,0,0,1,0|1,0,0]=3 4395 B19R2.4385 Cc1ccnc(c1)CC(=O)C=Cc2ccccn2 1458a_100000740811_100000718516 [0,1,0,0,1,0|2,0,0]=4 4396 B19R2.4385 Cc1ccnc(c1)CC(=O)C=Cc2cccnc2 1458a_100000735890_100000718516 [0,1,0,0,1,0|2,0,0]=4 4397 B19R2.4385 Cc1ccnc(c1)CC(=O)C=Cc2ccncc2 1458a_100000682801_100000718516 [0,1,0,0,1,0|2,0,0]=4 4398 B19R2.4385 Cc1cncc(c1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000716715 [0,1,0,0,1,0|1,0,0]=3 4399 B19R2.4385 Cc1cncc(c1)CC(=O)C=Cc2ccccn2 1458a_100000740811_100000716715 [0,1,0,0,1,0|2,0,0]=4 4400 B19R2.4385 Cc1cncc(c1)CC(=O)C=Cc2cccnc2 1458a_100000735890_100000716715 [0,1,0,0,1,0|2,0,0]=4 4401 B19R2.4385 Cc1cncc(c1)CC(=O)C=Cc2ccncc2 1458a_100000682801_100000716715 [0,1,0,0,1,0|2,0,0]=4 4402 B19R2.4385 O=C(C#Cc1ccccc1)Cc2cccc(c2)Br 1458a_100000736102_100000211773 [0,1,0,0,1,0|0,0,2]=4 4403 B19R2.4385 O=C(C#Cc1ccccc1)Cc2cccc(c2)Cl 1458a_100000736102_100000181238 [0,1,0,0,1,0|0,0,2]=4 4404 B19R2.4385 O=C(C#Cc1ccccc1)Cc2cccc(c2)F 1458a_100000736102_100000230114 [0,1,0,0,1,0|0,0,2]=4 4405 B19R2.4385 O=C(C#Cc1ccccc1)Cc2cccc(c2)I 1458a_100000736102_100011218688 [0,1,0,0,1,0|0,0,2]=4 4406 B19R2.4385 O=C(C#Cc1ccccc1)Cc2cccc(c2)O 1458a_100000736102_100011660834 [0,1,0,0,1,0|0,0,2]=4 4407 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cc(ccn2)Br 1458a_100000210462_100010173614 [0,1,0,0,1,0|1,0,0]=3 4408 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cc(ccn2)Cl 1458a_100000210462_100016988179 [0,1,0,0,1,0|1,0,0]=3 4409 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cccc(c2)Br 1458a_100000210462_100000211773 [0,1,0,0,1,0|0,0,0]=2 4410 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cccc(c2)Cl 1458a_100000210462_100000181238 [0,1,0,0,1,0|0,0,0]=2 4411 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cccc(c2)F 1458a_100000210462_100000230114 [0,1,0,0,1,0|0,0,0]=2 4412 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cccc(c2)I 1458a_100000210462_100011218688 [0,1,0,0,1,0|0,0,0]=2 4413 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cccc(c2)O 1458a_100000210462_100011660834 [0,1,0,0,1,0|0,0,0]=2 4414 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cccc(n2)Br 1458a_100000210462_100009889011 [0,1,0,0,1,0|1,0,0]=3 4415 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cccc(n2)Cl 1458a_100000210462_100000086093 [0,1,0,0,1,0|1,0,0]=3 4416 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cccc(n2)F 1458a_100000210462_100009819644 [0,1,0,0,1,0|1,0,0]=3 4417 B19R2.4385 O=C(C=Cc1ccccc1)Cc2ccnc(c2)Br 1458a_100000210462_100010243470 [0,1,0,0,1,0|1,0,0]=3 4418 B19R2.4385 O=C(C=Cc1ccccc1)Cc2ccnc(c2)Cl 1458a_100000210462_100000764220 [0,1,0,0,1,0|1,0,0]=3 4419 B19R2.4385 O=C(C=Cc1ccccc1)Cc2ccnc(n2)Cl 1458a_100000210462_100000099655 [0,1,0,0,1,0|2,0,0]=4 4420 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cncc(c2)Br 1458a_100000210462_100011740620 [0,1,0,0,1,0|1,0,0]=3 4421 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cncc(c2)Cl 1458a_100000210462_100016992070 [0,1,0,0,1,0|1,0,0]=3 4422 B19R2.4385 O=C(C=Cc1ccccc1)Cc2cncc(c2)F 1458a_100000210462_100000725299 [0,1,0,0,1,0|1,0,0]=3 4423 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)Br 11a_100000210019_100000210462 [0,1,0,0,1,0|1,0,0]=3 4424 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)Br 1626a_100000210019_100000210462 [0,1,0,0,1,0|1,0,0]=3 4425 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)Br 22a_100000210019_100000210462 [0,1,0,0,1,0|1,0,0]=3 4426 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)Cl 11a_100000185859_100000210462 [0,1,0,0,1,0|1,0,0]=3 4427 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)Cl 1626a_100000185859_100000210462 [0,1,0,0,1,0|1,0,0]=3 4428 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)Cl 22a_100000185859_100000210462 [0,1,0,0,1,0|1,0,0]=3 4429 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)F 11a_100000210047_100000210462 [0,1,0,0,1,0|1,0,0]=3 4430 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)F 1626a_100000210047_100000210462 [0,1,0,0,1,0|1,0,0]=3 4431 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)F 22a_100000210047_100000210462 [0,1,0,0,1,0|1,0,0]=3 4432 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)I 11a_100000211102_100000210462 [0,1,0,0,1,0|1,0,0]=3 4433 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)I 1626a_100000211102_100000210462 [0,1,0,0,1,0|1,0,0]=3 4434 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)I 22a_100000211102_100000210462 [0,1,0,0,1,0|1,0,0]=3 4435 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)O 1626a_100000210217_100000210462 [0,1,0,0,1,0|1,0,0]=3 4436 B19R2.4385 O=C(C=Cc1ccccc1)Nc2cccc(c2)O 22a_100000210217_100000210462 [0,1,0,0,1,0|1,0,0]=3 4437 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cc(ccn2)Br 1458a_100000740811_100010173614 [0,1,0,0,1,0|2,0,0]=4 4438 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cc(ccn2)Cl 1458a_100000740811_100016988179 [0,1,0,0,1,0|2,0,0]=4 4439 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cccc(c2)Br 1458a_100000740811_100000211773 [0,1,0,0,1,0|1,0,0]=3 4440 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cccc(c2)Cl 1458a_100000740811_100000181238 [0,1,0,0,1,0|1,0,0]=3 4441 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cccc(c2)F 1458a_100000740811_100000230114 [0,1,0,0,1,0|1,0,0]=3 4442 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cccc(c2)I 1458a_100000740811_100011218688 [0,1,0,0,1,0|1,0,0]=3 4443 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cccc(c2)O 1458a_100000740811_100011660834 [0,1,0,0,1,0|1,0,0]=3 4444 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cccc(n2)Br 1458a_100000740811_100009889011 [0,1,0,0,1,0|2,0,0]=4 4445 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cccc(n2)Cl 1458a_100000740811_100000086093 [0,1,0,0,1,0|2,0,0]=4 4446 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cccc(n2)F 1458a_100000740811_100009819644 [0,1,0,0,1,0|2,0,0]=4 4447 B19R2.4385 O=C(C=Cc1ccccn1)Cc2ccnc(c2)Br 1458a_100000740811_100010243470 [0,1,0,0,1,0|2,0,0]=4 4448 B19R2.4385 O=C(C=Cc1ccccn1)Cc2ccnc(c2)Cl 1458a_100000740811_100000764220 [0,1,0,0,1,0|2,0,0]=4 4449 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cncc(c2)Br 1458a_100000740811_100011740620 [0,1,0,0,1,0|2,0,0]=4 4450 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cncc(c2)Cl 1458a_100000740811_100016992070 [0,1,0,0,1,0|2,0,0]=4 4451 B19R2.4385 O=C(C=Cc1ccccn1)Cc2cncc(c2)F 1458a_100000740811_100000725299 [0,1,0,0,1,0|2,0,0]=4 4452 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)Br 11a_100000210019_100000740811 [0,1,0,0,1,0|2,0,0]=4 4453 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)Br 22a_100000210019_100000740811 [0,1,0,0,1,0|2,0,0]=4 4454 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)Cl 11a_100000185859_100000740811 [0,1,0,0,1,0|2,0,0]=4 4455 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)Cl 22a_100000185859_100000740811 [0,1,0,0,1,0|2,0,0]=4 4456 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)F 11a_100000210047_100000740811 [0,1,0,0,1,0|2,0,0]=4 4457 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)F 22a_100000210047_100000740811 [0,1,0,0,1,0|2,0,0]=4 4458 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)I 11a_100000211102_100000740811 [0,1,0,0,1,0|2,0,0]=4 4459 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)I 22a_100000211102_100000740811 [0,1,0,0,1,0|2,0,0]=4 4460 B19R2.4385 O=C(C=Cc1ccccn1)Nc2cccc(c2)O 22a_100000210217_100000740811 [0,1,0,0,1,0|2,0,0]=4 4461 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cc(ccn2)Br 1458a_100000735890_100010173614 [0,1,0,0,1,0|2,0,0]=4 4462 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cc(ccn2)Cl 1458a_100000735890_100016988179 [0,1,0,0,1,0|2,0,0]=4 4463 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cccc(c2)Br 1458a_100000735890_100000211773 [0,1,0,0,1,0|1,0,0]=3 4464 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cccc(c2)Cl 1458a_100000735890_100000181238 [0,1,0,0,1,0|1,0,0]=3 4465 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cccc(c2)F 1458a_100000735890_100000230114 [0,1,0,0,1,0|1,0,0]=3 4466 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cccc(c2)I 1458a_100000735890_100011218688 [0,1,0,0,1,0|1,0,0]=3 4467 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cccc(c2)O 1458a_100000735890_100011660834 [0,1,0,0,1,0|1,0,0]=3 4468 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cccc(n2)Br 1458a_100000735890_100009889011 [0,1,0,0,1,0|2,0,0]=4 4469 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cccc(n2)Cl 1458a_100000735890_100000086093 [0,1,0,0,1,0|2,0,0]=4 4470 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cccc(n2)F 1458a_100000735890_100009819644 [0,1,0,0,1,0|2,0,0]=4 4471 B19R2.4385 O=C(C=Cc1cccnc1)Cc2ccnc(c2)Br 1458a_100000735890_100010243470 [0,1,0,0,1,0|2,0,0]=4 4472 B19R2.4385 O=C(C=Cc1cccnc1)Cc2ccnc(c2)Cl 1458a_100000735890_100000764220 [0,1,0,0,1,0|2,0,0]=4 4473 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cncc(c2)Br 1458a_100000735890_100011740620 [0,1,0,0,1,0|2,0,0]=4 4474 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cncc(c2)Cl 1458a_100000735890_100016992070 [0,1,0,0,1,0|2,0,0]=4 4475 B19R2.4385 O=C(C=Cc1cccnc1)Cc2cncc(c2)F 1458a_100000735890_100000725299 [0,1,0,0,1,0|2,0,0]=4 4476 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)Br 11a_100000210019_100000735890 [0,1,0,0,1,0|2,0,0]=4 4477 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)Br 22a_100000210019_100000735890 [0,1,0,0,1,0|2,0,0]=4 4478 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)Cl 11a_100000185859_100000735890 [0,1,0,0,1,0|2,0,0]=4 4479 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)Cl 22a_100000185859_100000735890 [0,1,0,0,1,0|2,0,0]=4 4480 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)F 11a_100000210047_100000735890 [0,1,0,0,1,0|2,0,0]=4 4481 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)F 22a_100000210047_100000735890 [0,1,0,0,1,0|2,0,0]=4 4482 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)I 11a_100000211102_100000735890 [0,1,0,0,1,0|2,0,0]=4 4483 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)I 22a_100000211102_100000735890 [0,1,0,0,1,0|2,0,0]=4 4484 B19R2.4385 O=C(C=Cc1cccnc1)Nc2cccc(c2)O 22a_100000210217_100000735890 [0,1,0,0,1,0|2,0,0]=4 4485 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cc(ccn2)Br 1458a_100000682801_100010173614 [0,1,0,0,1,0|2,0,0]=4 4486 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cc(ccn2)Cl 1458a_100000682801_100016988179 [0,1,0,0,1,0|2,0,0]=4 4487 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cccc(c2)Br 1458a_100000682801_100000211773 [0,1,0,0,1,0|1,0,0]=3 4488 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cccc(c2)Cl 1458a_100000682801_100000181238 [0,1,0,0,1,0|1,0,0]=3 4489 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cccc(c2)F 1458a_100000682801_100000230114 [0,1,0,0,1,0|1,0,0]=3 4490 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cccc(c2)I 1458a_100000682801_100011218688 [0,1,0,0,1,0|1,0,0]=3 4491 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cccc(c2)O 1458a_100000682801_100011660834 [0,1,0,0,1,0|1,0,0]=3 4492 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cccc(n2)Br 1458a_100000682801_100009889011 [0,1,0,0,1,0|2,0,0]=4 4493 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cccc(n2)Cl 1458a_100000682801_100000086093 [0,1,0,0,1,0|2,0,0]=4 4494 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cccc(n2)F 1458a_100000682801_100009819644 [0,1,0,0,1,0|2,0,0]=4 4495 B19R2.4385 O=C(C=Cc1ccncc1)Cc2ccnc(c2)Br 1458a_100000682801_100010243470 [0,1,0,0,1,0|2,0,0]=4 4496 B19R2.4385 O=C(C=Cc1ccncc1)Cc2ccnc(c2)Cl 1458a_100000682801_100000764220 [0,1,0,0,1,0|2,0,0]=4 4497 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cncc(c2)Br 1458a_100000682801_100011740620 [0,1,0,0,1,0|2,0,0]=4 4498 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cncc(c2)Cl 1458a_100000682801_100016992070 [0,1,0,0,1,0|2,0,0]=4 4499 B19R2.4385 O=C(C=Cc1ccncc1)Cc2cncc(c2)F 1458a_100000682801_100000725299 [0,1,0,0,1,0|2,0,0]=4 4500 B19R2.4385 O=C(C=Cc1ccncc1)Nc2cccc(c2)Br 22a_100000210019_100000682801 [0,1,0,0,1,0|2,0,0]=4 4501 B19R2.4385 O=C(C=Cc1ccncc1)Nc2cccc(c2)Cl 22a_100000185859_100000682801 [0,1,0,0,1,0|2,0,0]=4 4502 B19R2.4385 O=C(C=Cc1ccncc1)Nc2cccc(c2)F 22a_100000210047_100000682801 [0,1,0,0,1,0|2,0,0]=4 4503 B19R2.4385 O=C(C=Cc1ccncc1)Nc2cccc(c2)I 22a_100000211102_100000682801 [0,1,0,0,1,0|2,0,0]=4 4504 B19R2.4385 O=C(C=Cc1ccncc1)Nc2cccc(c2)O 22a_100000210217_100000682801 [0,1,0,0,1,0|2,0,0]=4 4505 B19R2.4385 O=C(C=Cc1cncnc1)Cc2cccc(c2)Br 6a_100000749868_100000689217 [0,1,0,0,1,0|2,0,0]=4 4506 B19R2.4385 O=C(C=Cc1cncnc1)Cc2cccc(c2)Cl 6a_100000749868_100000727212 [0,1,0,0,1,0|2,0,0]=4 4507 B19R2.4385 O=C(C=Cc1cncnc1)Cc2cccc(c2)F 6a_100000749868_100000687711 [0,1,0,0,1,0|2,0,0]=4 4508 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)Br 1458a_100000185753_100000211773 [0,1,0,0,1,0|0,0,2]=4 4509 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)Br 1458a_100000747190_100000765856 [0,1,0,0,1,0|0,0,2]=4 4510 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)Cl 1458a_100000185753_100000181238 [0,1,0,0,1,0|0,0,2]=4 4511 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)Cl 1458a_100000749307_100000765856 [0,1,0,0,1,0|0,0,2]=4 4512 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)F 1458a_100000185753_100000230114 [0,1,0,0,1,0|0,0,2]=4 4513 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)F 1458a_100000211661_100000765856 [0,1,0,0,1,0|0,0,2]=4 4514 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)I 1458a_100000185753_100011218688 [0,1,0,0,1,0|0,0,2]=4 4515 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)I 1458a_100000238430_100000765856 [0,1,0,0,1,0|0,0,2]=4 4516 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)O 1458a_100000185753_100011660834 [0,1,0,0,1,0|0,0,2]=4 4517 B19R2.4385 O=C(CCc1ccccc1)Cc2cccc(c2)O 1458a_100000745134_100000765856 [0,1,0,0,1,0|0,0,2]=4 4518 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)Br 11a_100000210019_100000185753 [0,1,0,0,1,0|2,0,0]=4 4519 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)Br 1626a_100000210019_100000185753 [0,1,0,0,1,0|2,0,0]=4 4520 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)Br 22a_100000210019_100000185753 [0,1,0,0,1,0|2,0,0]=4 4521 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)Br 527a_100000210019_100000185753 [0,1,0,0,1,0|2,0,0]=4 4522 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)Cl 11a_100000185859_100000185753 [0,1,0,0,1,0|2,0,0]=4 4523 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)Cl 1626a_100000185859_100000185753 [0,1,0,0,1,0|2,0,0]=4 4524 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)Cl 22a_100000185859_100000185753 [0,1,0,0,1,0|2,0,0]=4 4525 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)F 11a_100000210047_100000185753 [0,1,0,0,1,0|2,0,0]=4 4526 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)F 1626a_100000210047_100000185753 [0,1,0,0,1,0|2,0,0]=4 4527 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)F 22a_100000210047_100000185753 [0,1,0,0,1,0|2,0,0]=4 4528 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)F 527a_100000210047_100000185753 [0,1,0,0,1,0|2,0,0]=4 4529 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)I 11a_100000211102_100000185753 [0,1,0,0,1,0|2,0,0]=4 4530 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)I 1626a_100000211102_100000185753 [0,1,0,0,1,0|2,0,0]=4 4531 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)I 22a_100000211102_100000185753 [0,1,0,0,1,0|2,0,0]=4 4532 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)I 527a_100000211102_100000185753 [0,1,0,0,1,0|2,0,0]=4 4533 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)O 1626a_100000210217_100000185753 [0,1,0,0,1,0|2,0,0]=4 4534 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)O 22a_100000210217_100000185753 [0,1,0,0,1,0|2,0,0]=4 4535 B19R2.4385 O=C(CCc1ccccc1)Nc2cccc(c2)O 527a_100000210217_100000185753 [0,1,0,0,1,0|2,0,0]=4 4536 B19R2.4385 O=C(COc1ccccc1)Cc2cccc(c2)Br 1458a_100000186222_100000211773 [0,1,0,0,1,0|1,0,1]=4 4537 B19R2.4385 O=C(COc1ccccc1)Cc2cccc(c2)Cl 1458a_100000186222_100000181238 [0,1,0,0,1,0|1,0,1]=4 4538 B19R2.4385 O=C(COc1ccccc1)Cc2cccc(c2)F 1458a_100000186222_100000230114 [0,1,0,0,1,0|1,0,1]=4 4539 B19R2.4385 O=C(COc1ccccc1)Cc2cccc(c2)I 1458a_100000186222_100011218688 [0,1,0,0,1,0|1,0,1]=4 4540 B19R2.4385 O=C(COc1ccccc1)Cc2cccc(c2)O 1458a_100000186222_100011660834 [0,1,0,0,1,0|1,0,1]=4 4541 B19R2.4385 O=C(CSc1ccccc1)Cc2cccc(c2)Br 1458a_100000211596_100000211773 [0,1,0,0,1,0|1,0,1]=4 4542 B19R2.4385 O=C(CSc1ccccc1)Cc2cccc(c2)Cl 1458a_100000211596_100000181238 [0,1,0,0,1,0|1,0,1]=4 4543 B19R2.4385 O=C(CSc1ccccc1)Cc2cccc(c2)F 1458a_100000211596_100000230114 [0,1,0,0,1,0|1,0,1]=4 4544 B19R2.4385 O=C(CSc1ccccc1)Cc2cccc(c2)I 1458a_100000211596_100011218688 [0,1,0,0,1,0|1,0,1]=4 4545 B19R2.4385 O=C(CSc1ccccc1)Cc2cccc(c2)O 1458a_100000211596_100011660834 [0,1,0,0,1,0|1,0,1]=4 4546 B19R2.4385 O=C(Cc1cccc(c1)Br)NCc2ccccc2 11a_100015324214_100000747190 [0,1,0,0,1,0|1,0,1]=4 4547 B19R2.4385 O=C(Cc1cccc(c1)Br)NCc2ccccc2 240690a_100015324214_100000747190 [0,1,0,0,1,0|1,0,1]=4 4548 B19R2.4385 O=C(Cc1cccc(c1)Br)NCc2ccccc2 527a_100015324214_100000747190 [0,1,0,0,1,0|1,0,1]=4 4549 B19R2.4385 O=C(Cc1cccc(c1)Br)NNc2ccccc2 22a_100015195140_100000747190 [0,1,0,0,1,0|2,0,0]=4 4550 B19R2.4385 O=C(Cc1cccc(c1)Cl)NCc2ccccc2 11a_100015324214_100000749307 [0,1,0,0,1,0|1,0,1]=4 4551 B19R2.4385 O=C(Cc1cccc(c1)Cl)NCc2ccccc2 1626a_100015324214_100000749307 [0,1,0,0,1,0|1,0,1]=4 4552 B19R2.4385 O=C(Cc1cccc(c1)Cl)NCc2ccccc2 240690a_100015324214_100000749307 [0,1,0,0,1,0|1,0,1]=4 4553 B19R2.4385 O=C(Cc1cccc(c1)Cl)NCc2ccccc2 527a_100015324214_100000749307 [0,1,0,0,1,0|1,0,1]=4 4554 B19R2.4385 O=C(Cc1cccc(c1)Cl)NNc2ccccc2 22a_100015195140_100000749307 [0,1,0,0,1,0|2,0,0]=4 4555 B19R2.4385 O=C(Cc1cccc(c1)F)NCc2ccccc2 11a_100015324214_100000211661 [0,1,0,0,1,0|1,0,1]=4 4556 B19R2.4385 O=C(Cc1cccc(c1)F)NCc2ccccc2 1626a_100015324214_100000211661 [0,1,0,0,1,0|1,0,1]=4 4557 B19R2.4385 O=C(Cc1cccc(c1)F)NCc2ccccc2 240690a_100015324214_100000211661 [0,1,0,0,1,0|1,0,1]=4 4558 B19R2.4385 O=C(Cc1cccc(c1)F)NCc2ccccc2 527a_100015324214_100000211661 [0,1,0,0,1,0|1,0,1]=4 4559 B19R2.4385 O=C(Cc1cccc(c1)F)NNc2ccccc2 22a_100015195140_100000211661 [0,1,0,0,1,0|2,0,0]=4 4560 B19R2.4385 O=C(Cc1cccc(c1)I)NCc2ccccc2 11a_100015324214_100000238430 [0,1,0,0,1,0|1,0,1]=4 4561 B19R2.4385 O=C(Cc1cccc(c1)I)NCc2ccccc2 1626a_100015324214_100000238430 [0,1,0,0,1,0|1,0,1]=4 4562 B19R2.4385 O=C(Cc1cccc(c1)I)NCc2ccccc2 240690a_100015324214_100000238430 [0,1,0,0,1,0|1,0,1]=4 4563 B19R2.4385 O=C(Cc1cccc(c1)I)NCc2ccccc2 527a_100015324214_100000238430 [0,1,0,0,1,0|1,0,1]=4 4564 B19R2.4385 O=C(Cc1cccc(c1)I)NNc2ccccc2 22a_100015195140_100000238430 [0,1,0,0,1,0|2,0,0]=4 4565 B19R2.4385 O=C(Cc1cccc(c1)O)NCc2ccccc2 240690a_100015324214_100000745134 [0,1,0,0,1,0|1,0,1]=4 4566 B19R2.4385 O=C(Cc1cccc(c1)O)NCc2ccccc2 527a_100015324214_100000745134 [0,1,0,0,1,0|1,0,1]=4 4567 B19R2.4385 O=C(Cc1cccc(c1)O)NNc2ccccc2 22a_100015195140_100000745134 [0,1,0,0,1,0|2,0,0]=4 4568 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)Br 2430a_100000210019_100015324214 [0,1,0,0,1,0|2,0,0]=4 4569 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)Br 512a_100000210019_100015324214 [0,1,0,0,1,0|2,0,0]=4 4570 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)Cl 2430a_100000185859_100015324214 [0,1,0,0,1,0|2,0,0]=4 4571 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)F 2430a_100000210047_100015324214 [0,1,0,0,1,0|2,0,0]=4 4572 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)F 512a_100000210047_100015324214 [0,1,0,0,1,0|2,0,0]=4 4573 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)I 2430a_100000211102_100015324214 [0,1,0,0,1,0|2,0,0]=4 4574 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)I 512a_100000211102_100015324214 [0,1,0,0,1,0|2,0,0]=4 4575 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)O 2430a_100000210217_100015324214 [0,1,0,0,1,0|2,0,0]=4 4576 B19R2.4385 O=C(NCc1ccccc1)Nc2cccc(c2)O 512a_100000210217_100015324214 [0,1,0,0,1,0|2,0,0]=4 4577 B19R2.4385 O=C(Nc1cc(ccn1)O)OCc2ccccc2 271570a_203496583355_200012360432 [0,1,0,0,1,0|2,0,0]=4 4578 B19R2.4385 O=C(Nc1cccc(c1)O)OCc2ccccc2 271570a_203496583355_100000153647 [0,1,0,0,1,0|1,0,0]=3 4579 B19R2.4385 O=C(Nc1cncc(c1)O)OCc2ccccc2 271570a_203496583355_200012360433 [0,1,0,0,1,0|2,0,0]=4 4580 B19R2.4482 Cc1ccccc1C=CC(=O)Nc2ccccc2 1626a_100000106764_100016266485 [0,1,0,0,1,0|1,0,0]=3 4581 B19R2.4482 Cc1ccccc1C=CC(=O)Nc2ccccc2 22a_100000106764_100016266485 [0,1,0,0,1,0|1,0,0]=3 4582 B19R2.4482 Cc1ccccc1CCC(=O)Cc2ccccc2 1458a_100000748742_100015291786 [0,1,0,0,1,0|0,0,2]=4 4583 B19R2.4482 Cc1ccccc1CCC(=O)Nc2ccccc2 11a_100000106764_100000748742 [0,1,0,0,1,0|2,0,0]=4 4584 B19R2.4482 Cc1ccccc1CCC(=O)Nc2ccccc2 1626a_100000106764_100000748742 [0,1,0,0,1,0|2,0,0]=4 4585 B19R2.4482 Cc1ccccc1CCC(=O)Nc2ccccc2 22a_100000106764_100000748742 [0,1,0,0,1,0|2,0,0]=4 4586 B19R2.4482 Cc1ccccc1CCC(=O)Nc2ccccc2 527a_100000106764_100000748742 [0,1,0,0,1,0|2,0,0]=4 4587 B19R2.4482 Cc1ccccc1CNC(=O)Nc2ccccc2 2430a_100000106764_100000174972 [0,1,0,0,1,0|2,0,0]=4 4588 B19R2.4482 Cc1ccccc1NCC(=O)Oc2ccccc2 34a_100015192222_100009813826 [0,1,0,0,1,0|1,0,1]=4 4589 B19R2.4482 Cc1ccccc1OCC(=O)Cc2ccccc2 1458a_100000182418_100015291786 [0,1,0,0,1,0|1,0,1]=4 4590 B19R2.4482 Cc1ccccc1OCC(=O)Cc2ccccc2 7a_100000210338_100000233483 [0,1,0,0,1,0|1,0,1]=4 4591 B19R2.4482 Cc1ccccc1OCC(=O)Oc2ccccc2 34a_100000210338_100009813826 [0,1,0,0,1,0|1,0,1]=4 4592 B19R2.4482 Cc1ccccc1OCC(=O)Oc2ccccc2 7a_100000210338_100009813826 [0,1,0,0,1,0|1,0,1]=4 4593 B19R2.4482 Cc1ccccc1SCC(=O)Cc2ccccc2 1458a_100000183026_100015291786 [0,1,0,0,1,0|1,0,1]=4 4594 B19R2.4482 Cc1ccccc1SCC(=O)Cc2ccccc2 62a_100000210755_100000233483 [0,1,0,0,1,0|1,0,1]=4 4595 B19R2.4482 Cc1ccccc1SCC(=O)Cc2ccccc2 62a_100000233483_100000210755 [0,1,0,0,1,0|1,0,1]=4 4596 B19R2.4482 Cc1ccccc1SCC(=O)Oc2ccccc2 62a_100000210755_100009813826 [0,1,0,0,1,0|1,0,1]=4 4597 B19R2.4482 Cc1ccccc1SCC(=O)Oc2ccccc2 62a_100009813826_100000210755 [0,1,0,0,1,0|1,0,1]=4 4598 B19R2.4482 Nc1ccccc1OCC(=O)Cc2ccccc2 7a_100000185747_100000233483 [0,1,0,0,1,0|1,0,1]=4 4599 B19R2.4482 Nc1ccccc1OCC(=O)Oc2ccccc2 34a_100000185747_100009813826 [0,1,0,0,1,0|1,0,1]=4 4600 B19R2.4482 Nc1ccccc1OCC(=O)Oc2ccccc2 7a_100000185747_100009813826 [0,1,0,0,1,0|1,0,1]=4 4601 B19R2.4482 Nc1ccccc1SCC(=O)Cc2ccccc2 62a_100000210017_100000233483 [0,1,0,0,1,0|1,0,1]=4 4602 B19R2.4482 Nc1ccccc1SCC(=O)Cc2ccccc2 62a_100000233483_100000210017 [0,1,0,0,1,0|1,0,1]=4 4603 B19R2.4482 Nc1ccccc1SCC(=O)Oc2ccccc2 62a_100000210017_100009813826 [0,1,0,0,1,0|1,0,1]=4 4604 B19R2.4482 Nc1ccccc1SCC(=O)Oc2ccccc2 62a_100009813826_100000210017 [0,1,0,0,1,0|1,0,1]=4 4605 B19R2.4482 O=C(C#Cc1ccccc1F)Cc2ccccc2 1458a_100011892747_100015291786 [0,1,0,0,1,0|0,0,2]=4 4606 B19R2.4482 O=C(C=Cc1ccccc1Br)Cc2ccccc2 1458a_100000719032_100015291786 [0,1,0,0,1,0|0,0,0]=2 4607 B19R2.4482 O=C(C=Cc1ccccc1Br)Cc2ccccn2 1458a_100000719032_100000721315 [0,1,0,0,1,0|1,0,0]=3 4608 B19R2.4482 O=C(C=Cc1ccccc1Br)Cc2cccnc2 1458a_100000719032_100000733263 [0,1,0,0,1,0|1,0,0]=3 4609 B19R2.4482 O=C(C=Cc1ccccc1Br)Cc2cccnn2 1458a_100000719032_100016990269 [0,1,0,0,1,0|2,0,0]=4 4610 B19R2.4482 O=C(C=Cc1ccccc1Br)Cc2ccncc2 1458a_100000719032_100000705612 [0,1,0,0,1,0|1,0,0]=3 4611 B19R2.4482 O=C(C=Cc1ccccc1Br)Cc2cnccn2 1458a_100000719032_100016995436 [0,1,0,0,1,0|2,0,0]=4 4612 B19R2.4482 O=C(C=Cc1ccccc1Br)Cc2cncnc2 1458a_100000719032_100015196519 [0,1,0,0,1,0|2,0,0]=4 4613 B19R2.4482 O=C(C=Cc1ccccc1Br)Cc2ncccn2 1458a_100000719032_100000703007 [0,1,0,0,1,0|2,0,0]=4 4614 B19R2.4482 O=C(C=Cc1ccccc1Br)Nc2ccccc2 11a_100000106764_100000719032 [0,1,0,0,1,0|1,0,0]=3 4615 B19R2.4482 O=C(C=Cc1ccccc1Br)Nc2ccccc2 1626a_100000106764_100000719032 [0,1,0,0,1,0|1,0,0]=3 4616 B19R2.4482 O=C(C=Cc1ccccc1Br)Nc2ccccc2 22a_100000106764_100000719032 [0,1,0,0,1,0|1,0,0]=3 4617 B19R2.4482 O=C(C=Cc1ccccc1Cl)Cc2ccccc2 1458a_100000720304_100015291786 [0,1,0,0,1,0|0,0,0]=2 4618 B19R2.4482 O=C(C=Cc1ccccc1Cl)Cc2ccccn2 1458a_100000720304_100000721315 [0,1,0,0,1,0|1,0,0]=3 4619 B19R2.4482 O=C(C=Cc1ccccc1Cl)Cc2cccnc2 1458a_100000720304_100000733263 [0,1,0,0,1,0|1,0,0]=3 4620 B19R2.4482 O=C(C=Cc1ccccc1Cl)Cc2cccnn2 1458a_100000720304_100016990269 [0,1,0,0,1,0|2,0,0]=4 4621 B19R2.4482 O=C(C=Cc1ccccc1Cl)Cc2ccncc2 1458a_100000720304_100000705612 [0,1,0,0,1,0|1,0,0]=3 4622 B19R2.4482 O=C(C=Cc1ccccc1Cl)Cc2cnccn2 1458a_100000720304_100016995436 [0,1,0,0,1,0|2,0,0]=4 4623 B19R2.4482 O=C(C=Cc1ccccc1Cl)Cc2cncnc2 1458a_100000720304_100015196519 [0,1,0,0,1,0|2,0,0]=4 4624 B19R2.4482 O=C(C=Cc1ccccc1Cl)Cc2ncccn2 1458a_100000720304_100000703007 [0,1,0,0,1,0|2,0,0]=4 4625 B19R2.4482 O=C(C=Cc1ccccc1Cl)Nc2ccccc2 11a_100000106764_100000720304 [0,1,0,0,1,0|1,0,0]=3 4626 B19R2.4482 O=C(C=Cc1ccccc1Cl)Nc2ccccc2 1626a_100000106764_100000720304 [0,1,0,0,1,0|1,0,0]=3 4627 B19R2.4482 O=C(C=Cc1ccccc1Cl)Nc2ccccc2 22a_100000106764_100000720304 [0,1,0,0,1,0|1,0,0]=3 4628 B19R2.4482 O=C(C=Cc1ccccc1F)Cc2ccccc2 1458a_100016256065_100015291786 [0,1,0,0,1,0|0,0,0]=2 4629 B19R2.4482 O=C(C=Cc1ccccc1F)Cc2ccccn2 1458a_100016256065_100000721315 [0,1,0,0,1,0|1,0,0]=3 4630 B19R2.4482 O=C(C=Cc1ccccc1F)Cc2cccnc2 1458a_100016256065_100000733263 [0,1,0,0,1,0|1,0,0]=3 4631 B19R2.4482 O=C(C=Cc1ccccc1F)Cc2cccnn2 1458a_100016256065_100016990269 [0,1,0,0,1,0|2,0,0]=4 4632 B19R2.4482 O=C(C=Cc1ccccc1F)Cc2ccncc2 1458a_100016256065_100000705612 [0,1,0,0,1,0|1,0,0]=3 4633 B19R2.4482 O=C(C=Cc1ccccc1F)Cc2cnccn2 1458a_100016256065_100016995436 [0,1,0,0,1,0|2,0,0]=4 4634 B19R2.4482 O=C(C=Cc1ccccc1F)Cc2cncnc2 1458a_100016256065_100015196519 [0,1,0,0,1,0|2,0,0]=4 4635 B19R2.4482 O=C(C=Cc1ccccc1F)Cc2ncccn2 1458a_100016256065_100000703007 [0,1,0,0,1,0|2,0,0]=4 4636 B19R2.4482 O=C(C=Cc1ccccc1F)Nc2ccccc2 11a_100000106764_100016256065 [0,1,0,0,1,0|1,0,0]=3 4637 B19R2.4482 O=C(C=Cc1ccccc1F)Nc2ccccc2 1626a_100000106764_100016256065 [0,1,0,0,1,0|1,0,0]=3 4638 B19R2.4482 O=C(C=Cc1ccccc1F)Nc2ccccc2 22a_100000106764_100016256065 [0,1,0,0,1,0|1,0,0]=3 4639 B19R2.4482 O=C(C=Cc1ccccc1O)Cc2ccccc2 1458a_100016263591_100015291786 [0,1,0,0,1,0|0,0,0]=2 4640 B19R2.4482 O=C(C=Cc1ccccc1O)Cc2ccccn2 1458a_100016263591_100000721315 [0,1,0,0,1,0|1,0,0]=3 4641 B19R2.4482 O=C(C=Cc1ccccc1O)Cc2cccnc2 1458a_100016263591_100000733263 [0,1,0,0,1,0|1,0,0]=3 4642 B19R2.4482 O=C(C=Cc1ccccc1O)Cc2cccnn2 1458a_100016263591_100016990269 [0,1,0,0,1,0|2,0,0]=4 4643 B19R2.4482 O=C(C=Cc1ccccc1O)Cc2ccncc2 1458a_100016263591_100000705612 [0,1,0,0,1,0|1,0,0]=3 4644 B19R2.4482 O=C(C=Cc1ccccc1O)Cc2cnccn2 1458a_100016263591_100016995436 [0,1,0,0,1,0|2,0,0]=4 4645 B19R2.4482 O=C(C=Cc1ccccc1O)Cc2cncnc2 1458a_100016263591_100015196519 [0,1,0,0,1,0|2,0,0]=4 4646 B19R2.4482 O=C(C=Cc1ccccc1O)Cc2ncccn2 1458a_100016263591_100000703007 [0,1,0,0,1,0|2,0,0]=4 4647 B19R2.4482 O=C(C=Cc1ccccc1O)Nc2ccccc2 22a_100000106764_100016263591 [0,1,0,0,1,0|1,0,0]=3 4648 B19R2.4482 O=C(CCc1ccccc1Br)Cc2ccccc2 1458a_100000740810_100015291786 [0,1,0,0,1,0|0,0,2]=4 4649 B19R2.4482 O=C(CCc1ccccc1Br)Nc2ccccc2 11a_100000106764_100000740810 [0,1,0,0,1,0|2,0,0]=4 4650 B19R2.4482 O=C(CCc1ccccc1Br)Nc2ccccc2 1626a_100000106764_100000740810 [0,1,0,0,1,0|2,0,0]=4 4651 B19R2.4482 O=C(CCc1ccccc1Br)Nc2ccccc2 22a_100000106764_100000740810 [0,1,0,0,1,0|2,0,0]=4 4652 B19R2.4482 O=C(CCc1ccccc1Br)Nc2ccccc2 527a_100000106764_100000740810 [0,1,0,0,1,0|2,0,0]=4 4653 B19R2.4482 O=C(CCc1ccccc1Cl)Cc2ccccc2 1458a_100000184300_100015291786 [0,1,0,0,1,0|0,0,2]=4 4654 B19R2.4482 O=C(CCc1ccccc1Cl)Nc2ccccc2 11a_100000106764_100000184300 [0,1,0,0,1,0|2,0,0]=4 4655 B19R2.4482 O=C(CCc1ccccc1Cl)Nc2ccccc2 1626a_100000106764_100000184300 [0,1,0,0,1,0|2,0,0]=4 4656 B19R2.4482 O=C(CCc1ccccc1Cl)Nc2ccccc2 22a_100000106764_100000184300 [0,1,0,0,1,0|2,0,0]=4 4657 B19R2.4482 O=C(CCc1ccccc1Cl)Nc2ccccc2 527a_100000106764_100000184300 [0,1,0,0,1,0|2,0,0]=4 4658 B19R2.4482 O=C(CCc1ccccc1F)Cc2ccccc2 1458a_100000189703_100015291786 [0,1,0,0,1,0|0,0,2]=4 4659 B19R2.4482 O=C(CCc1ccccc1F)Nc2ccccc2 11a_100000106764_100000189703 [0,1,0,0,1,0|2,0,0]=4 4660 B19R2.4482 O=C(CCc1ccccc1F)Nc2ccccc2 1626a_100000106764_100000189703 [0,1,0,0,1,0|2,0,0]=4 4661 B19R2.4482 O=C(CCc1ccccc1F)Nc2ccccc2 22a_100000106764_100000189703 [0,1,0,0,1,0|2,0,0]=4 4662 B19R2.4482 O=C(CCc1ccccc1F)Nc2ccccc2 527a_100000106764_100000189703 [0,1,0,0,1,0|2,0,0]=4 4663 B19R2.4482 O=C(CCc1ccccc1I)Cc2ccccc2 1458a_100000037306_100015291786 [0,1,0,0,1,0|0,0,2]=4 4664 B19R2.4482 O=C(CCc1ccccc1I)Nc2ccccc2 11a_100000106764_100000037306 [0,1,0,0,1,0|2,0,0]=4 4665 B19R2.4482 O=C(CCc1ccccc1I)Nc2ccccc2 1626a_100000106764_100000037306 [0,1,0,0,1,0|2,0,0]=4 4666 B19R2.4482 O=C(CCc1ccccc1I)Nc2ccccc2 22a_100000106764_100000037306 [0,1,0,0,1,0|2,0,0]=4 4667 B19R2.4482 O=C(CCc1ccccc1I)Nc2ccccc2 527a_100000106764_100000037306 [0,1,0,0,1,0|2,0,0]=4 4668 B19R2.4482 O=C(CCc1ccccc1O)Cc2ccccc2 1458a_100000181328_100015291786 [0,1,0,0,1,0|0,0,2]=4 4669 B19R2.4482 O=C(CCc1ccccc1O)Nc2ccccc2 11a_100000106764_100000181328 [0,1,0,0,1,0|2,0,0]=4 4670 B19R2.4482 O=C(CCc1ccccc1O)Nc2ccccc2 22a_100000106764_100000181328 [0,1,0,0,1,0|2,0,0]=4 4671 B19R2.4482 O=C(CCc1ccccc1O)Nc2ccccc2 527a_100000106764_100000181328 [0,1,0,0,1,0|2,0,0]=4 4672 B19R2.4482 O=C(CNc1ccccc1Br)Oc2ccccc2 34a_100000210017_100009813826 [0,1,0,0,1,0|1,0,1]=4 4673 B19R2.4482 O=C(CNc1ccccc1Cl)Oc2ccccc2 34a_100000185783_100009813826 [0,1,0,0,1,0|1,0,1]=4 4674 B19R2.4482 O=C(CNc1ccccc1F)Oc2ccccc2 34a_100000210422_100009813826 [0,1,0,0,1,0|1,0,1]=4 4675 B19R2.4482 O=C(CNc1ccccc1I)Oc2ccccc2 34a_100000210053_100009813826 [0,1,0,0,1,0|1,0,1]=4 4676 B19R2.4482 O=C(CNc1ccccc1O)Oc2ccccc2 34a_100000185747_100009813826 [0,1,0,0,1,0|1,0,1]=4 4677 B19R2.4482 O=C(COc1ccccc1Br)Cc2ccccc2 1458a_100000216496_100015291786 [0,1,0,0,1,0|1,0,1]=4 4678 B19R2.4482 O=C(COc1ccccc1Br)Cc2ccccc2 7a_100000181306_100000233483 [0,1,0,0,1,0|1,0,1]=4 4679 B19R2.4482 O=C(COc1ccccc1Br)Oc2ccccc2 34a_100000181306_100009813826 [0,1,0,0,1,0|1,0,1]=4 4680 B19R2.4482 O=C(COc1ccccc1Br)Oc2ccccc2 7a_100000181306_100009813826 [0,1,0,0,1,0|1,0,1]=4 4681 B19R2.4482 O=C(COc1ccccc1Cl)Cc2ccccc2 1458a_100000185159_100015291786 [0,1,0,0,1,0|1,0,1]=4 4682 B19R2.4482 O=C(COc1ccccc1Cl)Cc2ccccc2 7a_100000210172_100000233483 [0,1,0,0,1,0|1,0,1]=4 4683 B19R2.4482 O=C(COc1ccccc1Cl)Oc2ccccc2 34a_100000210172_100009813826 [0,1,0,0,1,0|1,0,1]=4 4684 B19R2.4482 O=C(COc1ccccc1Cl)Oc2ccccc2 7a_100000210172_100009813826 [0,1,0,0,1,0|1,0,1]=4 4685 B19R2.4482 O=C(COc1ccccc1F)Cc2ccccc2 1458a_100000182486_100015291786 [0,1,0,0,1,0|1,0,1]=4 4686 B19R2.4482 O=C(COc1ccccc1F)Cc2ccccc2 7a_100000210171_100000233483 [0,1,0,0,1,0|1,0,1]=4 4687 B19R2.4482 O=C(COc1ccccc1F)Oc2ccccc2 34a_100000210171_100009813826 [0,1,0,0,1,0|1,0,1]=4 4688 B19R2.4482 O=C(COc1ccccc1F)Oc2ccccc2 7a_100000210171_100009813826 [0,1,0,0,1,0|1,0,1]=4 4689 B19R2.4482 O=C(COc1ccccc1I)Cc2ccccc2 7a_100000739446_100000233483 [0,1,0,0,1,0|1,0,1]=4 4690 B19R2.4482 O=C(COc1ccccc1I)Oc2ccccc2 34a_100000739446_100009813826 [0,1,0,0,1,0|1,0,1]=4 4691 B19R2.4482 O=C(COc1ccccc1I)Oc2ccccc2 7a_100000739446_100009813826 [0,1,0,0,1,0|1,0,1]=4 4692 B19R2.4482 O=C(COc1ccccc1O)Cc2ccccc2 1458a_100000183020_100015291786 [0,1,0,0,1,0|1,0,1]=4 4693 B19R2.4482 O=C(CSc1ccccc1Br)Cc2ccccc2 62a_100000233483_100000695589 [0,1,0,0,1,0|1,0,1]=4 4694 B19R2.4482 O=C(CSc1ccccc1Br)Cc2ccccc2 62a_100000695589_100000233483 [0,1,0,0,1,0|1,0,1]=4 4695 B19R2.4482 O=C(CSc1ccccc1Br)Oc2ccccc2 62a_100000695589_100009813826 [0,1,0,0,1,0|1,0,1]=4 4696 B19R2.4482 O=C(CSc1ccccc1Br)Oc2ccccc2 62a_100009813826_100000695589 [0,1,0,0,1,0|1,0,1]=4 4697 B19R2.4482 O=C(CSc1ccccc1Cl)Cc2ccccc2 62a_100000233483_100000764095 [0,1,0,0,1,0|1,0,1]=4 4698 B19R2.4482 O=C(CSc1ccccc1Cl)Cc2ccccc2 62a_100000764095_100000233483 [0,1,0,0,1,0|1,0,1]=4 4699 B19R2.4482 O=C(CSc1ccccc1Cl)Oc2ccccc2 62a_100000764095_100009813826 [0,1,0,0,1,0|1,0,1]=4 4700 B19R2.4482 O=C(CSc1ccccc1Cl)Oc2ccccc2 62a_100009813826_100000764095 [0,1,0,0,1,0|1,0,1]=4 4701 B19R2.4482 O=C(CSc1ccccc1F)Cc2ccccc2 1458a_100000179528_100015291786 [0,1,0,0,1,0|1,0,1]=4 4702 B19R2.4482 O=C(CSc1ccccc1F)Cc2ccccc2 62a_100000233483_100011215700 [0,1,0,0,1,0|1,0,1]=4 4703 B19R2.4482 O=C(CSc1ccccc1F)Cc2ccccc2 62a_100011215700_100000233483 [0,1,0,0,1,0|1,0,1]=4 4704 B19R2.4482 O=C(CSc1ccccc1F)Oc2ccccc2 62a_100009813826_100011215700 [0,1,0,0,1,0|1,0,1]=4 4705 B19R2.4482 O=C(CSc1ccccc1F)Oc2ccccc2 62a_100011215700_100009813826 [0,1,0,0,1,0|1,0,1]=4 4706 B19R2.4482 O=C(CSc1ccccc1O)Cc2ccccc2 1458a_100000695322_100015291786 [0,1,0,0,1,0|1,0,1]=4 4707 B19R2.4482 O=C(CSc1ccccc1O)Cc2ccccc2 62a_100000233483_100000739446 [0,1,0,0,1,0|1,0,1]=4 4708 B19R2.4482 O=C(CSc1ccccc1O)Cc2ccccc2 62a_100000739446_100000233483 [0,1,0,0,1,0|1,0,1]=4 4709 B19R2.4482 O=C(CSc1ccccc1O)Oc2ccccc2 62a_100000739446_100009813826 [0,1,0,0,1,0|1,0,1]=4 4710 B19R2.4482 O=C(CSc1ccccc1O)Oc2ccccc2 62a_100009813826_100000739446 [0,1,0,0,1,0|1,0,1]=4 4711 B19R2.4482 O=C(NCc1ccccc1Br)Nc2ccccc2 2430a_100000106764_100000689332 [0,1,0,0,1,0|2,0,0]=4 4712 B19R2.4482 O=C(NCc1ccccc1Cl)Nc2ccccc2 2430a_100000106764_100000174879 [0,1,0,0,1,0|2,0,0]=4 4713 B19R2.4482 O=C(NCc1ccccc1F)Nc2ccccc2 2430a_100000106764_100000174869 [0,1,0,0,1,0|2,0,0]=4 4714 B19R2.4482 O=C(NCc1ccccc1I)Nc2ccccc2 2430a_100000106764_100015347259 [0,1,0,0,1,0|2,0,0]=4 4715 B19R2.4482 O=C(NCc1ccccc1O)Nc2ccccc2 2430a_100000106764_100000185550 [0,1,0,0,1,0|2,0,0]=4 4716 B19R2.4485 Cc1ccccc1CC(=O)C#Cc2ccccc2 1458a_100000736102_100000211839 [0,1,0,0,1,0|0,0,2]=4 4717 B19R2.4485 Cc1ccccc1CC(=O)C=Cc2ccccc2 1458a_100000210462_100000211839 [0,1,0,0,1,0|0,0,0]=2 4718 B19R2.4485 Cc1ccccc1CC(=O)C=Cc2ccccn2 1458a_100000740811_100000211839 [0,1,0,0,1,0|1,0,0]=3 4719 B19R2.4485 Cc1ccccc1CC(=O)C=Cc2cccnc2 1458a_100000735890_100000211839 [0,1,0,0,1,0|1,0,0]=3 4720 B19R2.4485 Cc1ccccc1CC(=O)C=Cc2ccncc2 1458a_100000682801_100000211839 [0,1,0,0,1,0|1,0,0]=3 4721 B19R2.4485 Cc1ccccc1CC(=O)C=Cc2cncnc2 6a_100000749868_200000764500 [0,1,0,0,1,0|2,0,0]=4 4722 B19R2.4485 Cc1ccccc1CC(=O)CCc2ccccc2 1458a_100000185753_100000211839 [0,1,0,0,1,0|0,0,2]=4 4723 B19R2.4485 Cc1ccccc1CC(=O)CCc2ccccc2 1458a_100000212180_100000765856 [0,1,0,0,1,0|0,0,2]=4 4724 B19R2.4485 Cc1ccccc1CC(=O)COc2ccccc2 1458a_100000186222_100000211839 [0,1,0,0,1,0|1,0,1]=4 4725 B19R2.4485 Cc1ccccc1CC(=O)COc2ccccc2 7a_100000210340_100011223134 [0,1,0,0,1,0|1,0,1]=4 4726 B19R2.4485 Cc1ccccc1CC(=O)CSc2ccccc2 1458a_100000211596_100000211839 [0,1,0,0,1,0|1,0,1]=4 4727 B19R2.4485 Cc1ccccc1CC(=O)CSc2ccccc2 62a_100000719477_100011223134 [0,1,0,0,1,0|1,0,1]=4 4728 B19R2.4485 Cc1ccccc1CC(=O)CSc2ccccc2 62a_100011223134_100000041952 [0,1,0,0,1,0|1,0,1]=4 4729 B19R2.4485 Cc1ccccc1CC(=O)NCc2ccccc2 11a_100015324214_100000212180 [0,1,0,0,1,0|1,0,1]=4 4730 B19R2.4485 Cc1ccccc1CC(=O)NCc2ccccc2 1626a_100015324214_100000212180 [0,1,0,0,1,0|1,0,1]=4 4731 B19R2.4485 Cc1ccccc1CC(=O)NCc2ccccc2 240690a_100015324214_100000212180 [0,1,0,0,1,0|1,0,1]=4 4732 B19R2.4485 Cc1ccccc1CC(=O)NCc2ccccc2 527a_100015324214_100000212180 [0,1,0,0,1,0|1,0,1]=4 4733 B19R2.4485 Cc1ccccc1CC(=O)NNc2ccccc2 22a_100015195140_100000212180 [0,1,0,0,1,0|2,0,0]=4 4734 B19R2.4485 Cc1ccccc1NC(=O)C=Cc2ccccc2 11a_100015192222_100000210462 [0,1,0,0,1,0|1,0,0]=3 4735 B19R2.4485 Cc1ccccc1NC(=O)C=Cc2ccccc2 1626a_100015192222_100000210462 [0,1,0,0,1,0|1,0,0]=3 4736 B19R2.4485 Cc1ccccc1NC(=O)C=Cc2ccccc2 22a_100015192222_100000210462 [0,1,0,0,1,0|1,0,0]=3 4737 B19R2.4485 Cc1ccccc1NC(=O)C=Cc2ccccn2 11a_100015192222_100000740811 [0,1,0,0,1,0|2,0,0]=4 4738 B19R2.4485 Cc1ccccc1NC(=O)C=Cc2ccccn2 22a_100015192222_100000740811 [0,1,0,0,1,0|2,0,0]=4 4739 B19R2.4485 Cc1ccccc1NC(=O)C=Cc2cccnc2 11a_100015192222_100000735890 [0,1,0,0,1,0|2,0,0]=4 4740 B19R2.4485 Cc1ccccc1NC(=O)C=Cc2cccnc2 22a_100015192222_100000735890 [0,1,0,0,1,0|2,0,0]=4 4741 B19R2.4485 Cc1ccccc1NC(=O)C=Cc2ccncc2 22a_100015192222_100000682801 [0,1,0,0,1,0|2,0,0]=4 4742 B19R2.4485 Cc1ccccc1NC(=O)CCc2ccccc2 11a_100015192222_100000185753 [0,1,0,0,1,0|2,0,0]=4 4743 B19R2.4485 Cc1ccccc1NC(=O)CCc2ccccc2 1626a_100015192222_100000185753 [0,1,0,0,1,0|2,0,0]=4 4744 B19R2.4485 Cc1ccccc1NC(=O)CCc2ccccc2 22a_100015192222_100000185753 [0,1,0,0,1,0|2,0,0]=4 4745 B19R2.4485 Cc1ccccc1NC(=O)CCc2ccccc2 527a_100015192222_100000185753 [0,1,0,0,1,0|2,0,0]=4 4746 B19R2.4485 Cc1ccccc1NC(=O)NCc2ccccc2 2430a_100015192222_100015324214 [0,1,0,0,1,0|2,0,0]=4 4747 B19R2.4485 Cc1cccnc1CC(=O)C=Cc2ccccc2 1458a_100000210462_100000696600 [0,1,0,0,1,0|1,0,0]=3 4748 B19R2.4485 Cc1cccnc1CC(=O)C=Cc2ccccn2 1458a_100000740811_100000696600 [0,1,0,0,1,0|2,0,0]=4 4749 B19R2.4485 Cc1cccnc1CC(=O)C=Cc2cccnc2 1458a_100000735890_100000696600 [0,1,0,0,1,0|2,0,0]=4 4750 B19R2.4485 Cc1cccnc1CC(=O)C=Cc2ccncc2 1458a_100000682801_100000696600 [0,1,0,0,1,0|2,0,0]=4 4751 B19R2.4485 Cc1ccncc1CC(=O)C=Cc2ccccc2 1458a_100000210462_100000690890 [0,1,0,0,1,0|1,0,0]=3 4752 B19R2.4485 Cc1ccncc1CC(=O)C=Cc2ccccn2 1458a_100000740811_100000690890 [0,1,0,0,1,0|2,0,0]=4 4753 B19R2.4485 Cc1ccncc1CC(=O)C=Cc2cccnc2 1458a_100000735890_100000690890 [0,1,0,0,1,0|2,0,0]=4 4754 B19R2.4485 Cc1ccncc1CC(=O)C=Cc2ccncc2 1458a_100000682801_100000690890 [0,1,0,0,1,0|2,0,0]=4 4755 B19R2.4485 Cc1cnccc1CC(=O)C=Cc2ccccc2 1458a_100000210462_100020672808 [0,1,0,0,1,0|1,0,0]=3 4756 B19R2.4485 Cc1cnccc1CC(=O)C=Cc2ccccn2 1458a_100000740811_100020672808 [0,1,0,0,1,0|2,0,0]=4 4757 B19R2.4485 Cc1cnccc1CC(=O)C=Cc2cccnc2 1458a_100000735890_100020672808 [0,1,0,0,1,0|2,0,0]=4 4758 B19R2.4485 Cc1cnccc1CC(=O)C=Cc2ccncc2 1458a_100000682801_100020672808 [0,1,0,0,1,0|2,0,0]=4 4759 B19R2.4485 Cc1ncccc1CC(=O)C=Cc2ccccc2 1458a_100000210462_100000732876 [0,1,0,0,1,0|1,0,0]=3 4760 B19R2.4485 Cc1ncccc1CC(=O)C=Cc2ccccn2 1458a_100000740811_100000732876 [0,1,0,0,1,0|2,0,0]=4 4761 B19R2.4485 Cc1ncccc1CC(=O)C=Cc2cccnc2 1458a_100000735890_100000732876 [0,1,0,0,1,0|2,0,0]=4 4762 B19R2.4485 Cc1ncccc1CC(=O)C=Cc2ccncc2 1458a_100000682801_100000732876 [0,1,0,0,1,0|2,0,0]=4 4763 B19R2.4485 O=C(C#Cc1ccccc1)Cc2ccccc2Br 1458a_100000736102_100000184730 [0,1,0,0,1,0|0,0,2]=4 4764 B19R2.4485 O=C(C#Cc1ccccc1)Cc2ccccc2Cl 1458a_100000736102_100000187162 [0,1,0,0,1,0|0,0,2]=4 4765 B19R2.4485 O=C(C#Cc1ccccc1)Cc2ccccc2F 1458a_100000736102_100000187165 [0,1,0,0,1,0|0,0,2]=4 4766 B19R2.4485 O=C(C#Cc1ccccc1)Cc2ccccc2I 1458a_100000736102_100011216222 [0,1,0,0,1,0|0,0,2]=4 4767 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ccccc2Br 1458a_100000210462_100000184730 [0,1,0,0,1,0|0,0,0]=2 4768 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ccccc2Cl 1458a_100000210462_100000187162 [0,1,0,0,1,0|0,0,0]=2 4769 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ccccc2F 1458a_100000210462_100000187165 [0,1,0,0,1,0|0,0,0]=2 4770 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ccccc2I 1458a_100000210462_100011216222 [0,1,0,0,1,0|0,0,0]=2 4771 B19R2.4485 O=C(C=Cc1ccccc1)Cc2cccnc2Br 1458a_100000210462_100010140945 [0,1,0,0,1,0|1,0,0]=3 4772 B19R2.4485 O=C(C=Cc1ccccc1)Cc2cccnc2Cl 1458a_100000210462_100000045678 [0,1,0,0,1,0|1,0,0]=3 4773 B19R2.4485 O=C(C=Cc1ccccc1)Cc2cccnc2F 1458a_100000210462_100000099810 [0,1,0,0,1,0|1,0,0]=3 4774 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ccncc2Cl 1458a_100000210462_100000763264 [0,1,0,0,1,0|1,0,0]=3 4775 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ncccc2Br 1458a_100000210462_100025702911 [0,1,0,0,1,0|1,0,0]=3 4776 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ncccc2Cl 1458a_100000210462_100000099807 [0,1,0,0,1,0|1,0,0]=3 4777 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ncccc2F 1458a_100000210462_100000104219 [0,1,0,0,1,0|1,0,0]=3 4778 B19R2.4485 O=C(C=Cc1ccccc1)Cc2ncccc2O 1458a_100000210462_200020655725 [0,1,0,0,1,0|1,0,0]=3 4779 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2Br 11a_100000210017_100000210462 [0,1,0,0,1,0|1,0,0]=3 4780 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2Br 1626a_100000210017_100000210462 [0,1,0,0,1,0|1,0,0]=3 4781 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2Cl 11a_100000185783_100000210462 [0,1,0,0,1,0|1,0,0]=3 4782 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2Cl 1626a_100000185783_100000210462 [0,1,0,0,1,0|1,0,0]=3 4783 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2Cl 22a_100000185783_100000210462 [0,1,0,0,1,0|1,0,0]=3 4784 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2F 11a_100000210422_100000210462 [0,1,0,0,1,0|1,0,0]=3 4785 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2F 1626a_100000210422_100000210462 [0,1,0,0,1,0|1,0,0]=3 4786 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2F 22a_100000210422_100000210462 [0,1,0,0,1,0|1,0,0]=3 4787 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2I 11a_100000210053_100000210462 [0,1,0,0,1,0|1,0,0]=3 4788 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2I 1626a_100000210053_100000210462 [0,1,0,0,1,0|1,0,0]=3 4789 B19R2.4485 O=C(C=Cc1ccccc1)Nc2ccccc2O 22a_100000185747_100000210462 [0,1,0,0,1,0|1,0,0]=3 4790 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ccccc2Br 1458a_100000740811_100000184730 [0,1,0,0,1,0|1,0,0]=3 4791 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ccccc2Cl 1458a_100000740811_100000187162 [0,1,0,0,1,0|1,0,0]=3 4792 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ccccc2F 1458a_100000740811_100000187165 [0,1,0,0,1,0|1,0,0]=3 4793 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ccccc2I 1458a_100000740811_100011216222 [0,1,0,0,1,0|1,0,0]=3 4794 B19R2.4485 O=C(C=Cc1ccccn1)Cc2cccnc2Br 1458a_100000740811_100010140945 [0,1,0,0,1,0|2,0,0]=4 4795 B19R2.4485 O=C(C=Cc1ccccn1)Cc2cccnc2Cl 1458a_100000740811_100000045678 [0,1,0,0,1,0|2,0,0]=4 4796 B19R2.4485 O=C(C=Cc1ccccn1)Cc2cccnc2F 1458a_100000740811_100000099810 [0,1,0,0,1,0|2,0,0]=4 4797 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ccncc2Cl 1458a_100000740811_100000763264 [0,1,0,0,1,0|2,0,0]=4 4798 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ncccc2Br 1458a_100000740811_100025702911 [0,1,0,0,1,0|2,0,0]=4 4799 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ncccc2Cl 1458a_100000740811_100000099807 [0,1,0,0,1,0|2,0,0]=4 4800 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ncccc2F 1458a_100000740811_100000104219 [0,1,0,0,1,0|2,0,0]=4 4801 B19R2.4485 O=C(C=Cc1ccccn1)Cc2ncccc2O 1458a_100000740811_200020655725 [0,1,0,0,1,0|2,0,0]=4 4802 B19R2.4485 O=C(C=Cc1ccccn1)Nc2ccccc2Br 11a_100000210017_100000740811 [0,1,0,0,1,0|2,0,0]=4 4803 B19R2.4485 O=C(C=Cc1ccccn1)Nc2ccccc2Cl 11a_100000185783_100000740811 [0,1,0,0,1,0|2,0,0]=4 4804 B19R2.4485 O=C(C=Cc1ccccn1)Nc2ccccc2Cl 22a_100000185783_100000740811 [0,1,0,0,1,0|2,0,0]=4 4805 B19R2.4485 O=C(C=Cc1ccccn1)Nc2ccccc2F 11a_100000210422_100000740811 [0,1,0,0,1,0|2,0,0]=4 4806 B19R2.4485 O=C(C=Cc1ccccn1)Nc2ccccc2F 22a_100000210422_100000740811 [0,1,0,0,1,0|2,0,0]=4 4807 B19R2.4485 O=C(C=Cc1ccccn1)Nc2ccccc2I 11a_100000210053_100000740811 [0,1,0,0,1,0|2,0,0]=4 4808 B19R2.4485 O=C(C=Cc1ccccn1)Nc2ccccc2O 22a_100000185747_100000740811 [0,1,0,0,1,0|2,0,0]=4 4809 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ccccc2Br 1458a_100000735890_100000184730 [0,1,0,0,1,0|1,0,0]=3 4810 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ccccc2Cl 1458a_100000735890_100000187162 [0,1,0,0,1,0|1,0,0]=3 4811 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ccccc2F 1458a_100000735890_100000187165 [0,1,0,0,1,0|1,0,0]=3 4812 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ccccc2I 1458a_100000735890_100011216222 [0,1,0,0,1,0|1,0,0]=3 4813 B19R2.4485 O=C(C=Cc1cccnc1)Cc2cccnc2Br 1458a_100000735890_100010140945 [0,1,0,0,1,0|2,0,0]=4 4814 B19R2.4485 O=C(C=Cc1cccnc1)Cc2cccnc2Cl 1458a_100000735890_100000045678 [0,1,0,0,1,0|2,0,0]=4 4815 B19R2.4485 O=C(C=Cc1cccnc1)Cc2cccnc2F 1458a_100000735890_100000099810 [0,1,0,0,1,0|2,0,0]=4 4816 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ccncc2Cl 1458a_100000735890_100000763264 [0,1,0,0,1,0|2,0,0]=4 4817 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ncccc2Br 1458a_100000735890_100025702911 [0,1,0,0,1,0|2,0,0]=4 4818 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ncccc2Cl 1458a_100000735890_100000099807 [0,1,0,0,1,0|2,0,0]=4 4819 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ncccc2F 1458a_100000735890_100000104219 [0,1,0,0,1,0|2,0,0]=4 4820 B19R2.4485 O=C(C=Cc1cccnc1)Cc2ncccc2O 1458a_100000735890_200020655725 [0,1,0,0,1,0|2,0,0]=4 4821 B19R2.4485 O=C(C=Cc1cccnc1)Nc2ccccc2Br 11a_100000210017_100000735890 [0,1,0,0,1,0|2,0,0]=4 4822 B19R2.4485 O=C(C=Cc1cccnc1)Nc2ccccc2Cl 11a_100000185783_100000735890 [0,1,0,0,1,0|2,0,0]=4 4823 B19R2.4485 O=C(C=Cc1cccnc1)Nc2ccccc2Cl 22a_100000185783_100000735890 [0,1,0,0,1,0|2,0,0]=4 4824 B19R2.4485 O=C(C=Cc1cccnc1)Nc2ccccc2F 11a_100000210422_100000735890 [0,1,0,0,1,0|2,0,0]=4 4825 B19R2.4485 O=C(C=Cc1cccnc1)Nc2ccccc2F 22a_100000210422_100000735890 [0,1,0,0,1,0|2,0,0]=4 4826 B19R2.4485 O=C(C=Cc1cccnc1)Nc2ccccc2I 11a_100000210053_100000735890 [0,1,0,0,1,0|2,0,0]=4 4827 B19R2.4485 O=C(C=Cc1cccnc1)Nc2ccccc2O 22a_100000185747_100000735890 [0,1,0,0,1,0|2,0,0]=4 4828 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ccccc2Br 1458a_100000682801_100000184730 [0,1,0,0,1,0|1,0,0]=3 4829 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ccccc2Cl 1458a_100000682801_100000187162 [0,1,0,0,1,0|1,0,0]=3 4830 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ccccc2F 1458a_100000682801_100000187165 [0,1,0,0,1,0|1,0,0]=3 4831 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ccccc2I 1458a_100000682801_100011216222 [0,1,0,0,1,0|1,0,0]=3 4832 B19R2.4485 O=C(C=Cc1ccncc1)Cc2cccnc2Br 1458a_100000682801_100010140945 [0,1,0,0,1,0|2,0,0]=4 4833 B19R2.4485 O=C(C=Cc1ccncc1)Cc2cccnc2Cl 1458a_100000682801_100000045678 [0,1,0,0,1,0|2,0,0]=4 4834 B19R2.4485 O=C(C=Cc1ccncc1)Cc2cccnc2F 1458a_100000682801_100000099810 [0,1,0,0,1,0|2,0,0]=4 4835 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ccncc2Cl 1458a_100000682801_100000763264 [0,1,0,0,1,0|2,0,0]=4 4836 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ncccc2Br 1458a_100000682801_100025702911 [0,1,0,0,1,0|2,0,0]=4 4837 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ncccc2Cl 1458a_100000682801_100000099807 [0,1,0,0,1,0|2,0,0]=4 4838 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ncccc2F 1458a_100000682801_100000104219 [0,1,0,0,1,0|2,0,0]=4 4839 B19R2.4485 O=C(C=Cc1ccncc1)Cc2ncccc2O 1458a_100000682801_200020655725 [0,1,0,0,1,0|2,0,0]=4 4840 B19R2.4485 O=C(C=Cc1ccncc1)Nc2ccccc2Cl 22a_100000185783_100000682801 [0,1,0,0,1,0|2,0,0]=4 4841 B19R2.4485 O=C(C=Cc1ccncc1)Nc2ccccc2F 22a_100000210422_100000682801 [0,1,0,0,1,0|2,0,0]=4 4842 B19R2.4485 O=C(C=Cc1ccncc1)Nc2ccccc2O 22a_100000185747_100000682801 [0,1,0,0,1,0|2,0,0]=4 4843 B19R2.4485 O=C(C=Cc1cncnc1)Cc2ccccc2Br 6a_100000749868_100011350739 [0,1,0,0,1,0|2,0,0]=4 4844 B19R2.4485 O=C(C=Cc1cncnc1)Cc2ccccc2Cl 6a_100000749868_100000758791 [0,1,0,0,1,0|2,0,0]=4 4845 B19R2.4485 O=C(C=Cc1cncnc1)Cc2ccccc2F 6a_100000749868_100000709178 [0,1,0,0,1,0|2,0,0]=4 4846 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2Br 1458a_100000185753_100000184730 [0,1,0,0,1,0|0,0,2]=4 4847 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2Br 1458a_100000751119_100000765856 [0,1,0,0,1,0|0,0,2]=4 4848 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2Cl 1458a_100000183793_100000765856 [0,1,0,0,1,0|0,0,2]=4 4849 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2Cl 1458a_100000185753_100000187162 [0,1,0,0,1,0|0,0,2]=4 4850 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2F 1458a_100000185753_100000187165 [0,1,0,0,1,0|0,0,2]=4 4851 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2F 1458a_100000212012_100000765856 [0,1,0,0,1,0|0,0,2]=4 4852 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2I 1458a_100000036491_100000765856 [0,1,0,0,1,0|0,0,2]=4 4853 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2I 1458a_100000185753_100011216222 [0,1,0,0,1,0|0,0,2]=4 4854 B19R2.4485 O=C(CCc1ccccc1)Cc2ccccc2O 1458a_100000743006_100000765856 [0,1,0,0,1,0|0,0,2]=4 4855 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2Br 11a_100000210017_100000185753 [0,1,0,0,1,0|2,0,0]=4 4856 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2Br 1626a_100000210017_100000185753 [0,1,0,0,1,0|2,0,0]=4 4857 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2Cl 11a_100000185783_100000185753 [0,1,0,0,1,0|2,0,0]=4 4858 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2Cl 1626a_100000185783_100000185753 [0,1,0,0,1,0|2,0,0]=4 4859 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2Cl 22a_100000185783_100000185753 [0,1,0,0,1,0|2,0,0]=4 4860 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2Cl 527a_100000185783_100000185753 [0,1,0,0,1,0|2,0,0]=4 4861 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2F 11a_100000210422_100000185753 [0,1,0,0,1,0|2,0,0]=4 4862 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2F 1626a_100000210422_100000185753 [0,1,0,0,1,0|2,0,0]=4 4863 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2F 22a_100000210422_100000185753 [0,1,0,0,1,0|2,0,0]=4 4864 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2F 527a_100000210422_100000185753 [0,1,0,0,1,0|2,0,0]=4 4865 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2I 11a_100000210053_100000185753 [0,1,0,0,1,0|2,0,0]=4 4866 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2I 1626a_100000210053_100000185753 [0,1,0,0,1,0|2,0,0]=4 4867 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2O 22a_100000185747_100000185753 [0,1,0,0,1,0|2,0,0]=4 4868 B19R2.4485 O=C(CCc1ccccc1)Nc2ccccc2O 527a_100000185747_100000185753 [0,1,0,0,1,0|2,0,0]=4 4869 B19R2.4485 O=C(CNc1ccccc1)Cc2ccccc2Br 34a_100000106764_100000700504 [0,1,0,0,1,0|1,0,1]=4 4870 B19R2.4485 O=C(COc1ccccc1)Cc2ccccc2Br 1458a_100000186222_100000184730 [0,1,0,0,1,0|1,0,1]=4 4871 B19R2.4485 O=C(COc1ccccc1)Cc2ccccc2Br 34a_100000210340_100000700504 [0,1,0,0,1,0|1,0,1]=4 4872 B19R2.4485 O=C(COc1ccccc1)Cc2ccccc2Br 7a_100000210340_100000700504 [0,1,0,0,1,0|1,0,1]=4 4873 B19R2.4485 O=C(COc1ccccc1)Cc2ccccc2Cl 1458a_100000186222_100000187162 [0,1,0,0,1,0|1,0,1]=4 4874 B19R2.4485 O=C(COc1ccccc1)Cc2ccccc2F 1458a_100000186222_100000187165 [0,1,0,0,1,0|1,0,1]=4 4875 B19R2.4485 O=C(COc1ccccc1)Cc2ccccc2I 1458a_100000186222_100011216222 [0,1,0,0,1,0|1,0,1]=4 4876 B19R2.4485 O=C(CSc1ccccc1)Cc2ccccc2Br 1458a_100000211596_100000184730 [0,1,0,0,1,0|1,0,1]=4 4877 B19R2.4485 O=C(CSc1ccccc1)Cc2ccccc2Br 62a_100000700504_100000041952 [0,1,0,0,1,0|1,0,1]=4 4878 B19R2.4485 O=C(CSc1ccccc1)Cc2ccccc2Br 62a_100000719477_100000700504 [0,1,0,0,1,0|1,0,1]=4 4879 B19R2.4485 O=C(CSc1ccccc1)Cc2ccccc2Cl 1458a_100000211596_100000187162 [0,1,0,0,1,0|1,0,1]=4 4880 B19R2.4485 O=C(CSc1ccccc1)Cc2ccccc2F 1458a_100000211596_100000187165 [0,1,0,0,1,0|1,0,1]=4 4881 B19R2.4485 O=C(CSc1ccccc1)Cc2ccccc2I 1458a_100000211596_100011216222 [0,1,0,0,1,0|1,0,1]=4 4882 B19R2.4485 O=C(Cc1ccccc1Br)NCc2ccccc2 11a_100015324214_100000751119 [0,1,0,0,1,0|1,0,1]=4 4883 B19R2.4485 O=C(Cc1ccccc1Br)NCc2ccccc2 240690a_100015324214_100000751119 [0,1,0,0,1,0|1,0,1]=4 4884 B19R2.4485 O=C(Cc1ccccc1Br)NCc2ccccc2 527a_100015324214_100000751119 [0,1,0,0,1,0|1,0,1]=4 4885 B19R2.4485 O=C(Cc1ccccc1Br)NNc2ccccc2 22a_100015195140_100000751119 [0,1,0,0,1,0|2,0,0]=4 4886 B19R2.4485 O=C(Cc1ccccc1Cl)NCc2ccccc2 11a_100015324214_100000183793 [0,1,0,0,1,0|1,0,1]=4 4887 B19R2.4485 O=C(Cc1ccccc1Cl)NCc2ccccc2 1626a_100015324214_100000183793 [0,1,0,0,1,0|1,0,1]=4 4888 B19R2.4485 O=C(Cc1ccccc1Cl)NCc2ccccc2 240690a_100015324214_100000183793 [0,1,0,0,1,0|1,0,1]=4 4889 B19R2.4485 O=C(Cc1ccccc1Cl)NCc2ccccc2 527a_100015324214_100000183793 [0,1,0,0,1,0|1,0,1]=4 4890 B19R2.4485 O=C(Cc1ccccc1Cl)NNc2ccccc2 22a_100015195140_100000183793 [0,1,0,0,1,0|2,0,0]=4 4891 B19R2.4485 O=C(Cc1ccccc1F)NCc2ccccc2 11a_100015324214_100000212012 [0,1,0,0,1,0|1,0,1]=4 4892 B19R2.4485 O=C(Cc1ccccc1F)NCc2ccccc2 1626a_100015324214_100000212012 [0,1,0,0,1,0|1,0,1]=4 4893 B19R2.4485 O=C(Cc1ccccc1F)NCc2ccccc2 240690a_100015324214_100000212012 [0,1,0,0,1,0|1,0,1]=4 4894 B19R2.4485 O=C(Cc1ccccc1F)NCc2ccccc2 527a_100015324214_100000212012 [0,1,0,0,1,0|1,0,1]=4 4895 B19R2.4485 O=C(Cc1ccccc1F)NNc2ccccc2 22a_100015195140_100000212012 [0,1,0,0,1,0|2,0,0]=4 4896 B19R2.4485 O=C(Cc1ccccc1I)NCc2ccccc2 11a_100015324214_100000036491 [0,1,0,0,1,0|1,0,1]=4 4897 B19R2.4485 O=C(Cc1ccccc1I)NCc2ccccc2 1626a_100015324214_100000036491 [0,1,0,0,1,0|1,0,1]=4 4898 B19R2.4485 O=C(Cc1ccccc1I)NCc2ccccc2 240690a_100015324214_100000036491 [0,1,0,0,1,0|1,0,1]=4 4899 B19R2.4485 O=C(Cc1ccccc1I)NCc2ccccc2 527a_100015324214_100000036491 [0,1,0,0,1,0|1,0,1]=4 4900 B19R2.4485 O=C(Cc1ccccc1I)NNc2ccccc2 22a_100015195140_100000036491 [0,1,0,0,1,0|2,0,0]=4 4901 B19R2.4485 O=C(Cc1ccccc1O)NCc2ccccc2 240690a_100015324214_100000743006 [0,1,0,0,1,0|1,0,1]=4 4902 B19R2.4485 O=C(Cc1ccccc1O)NCc2ccccc2 527a_100015324214_100000743006 [0,1,0,0,1,0|1,0,1]=4 4903 B19R2.4485 O=C(Cc1ccccc1O)NNc2ccccc2 22a_100015195140_100000743006 [0,1,0,0,1,0|2,0,0]=4 4904 B19R2.4485 O=C(NCc1ccccc1)Nc2ccccc2Br 2430a_100000210017_100015324214 [0,1,0,0,1,0|2,0,0]=4 4905 B19R2.4485 O=C(NCc1ccccc1)Nc2ccccc2Cl 2430a_100000185783_100015324214 [0,1,0,0,1,0|2,0,0]=4 4906 B19R2.4485 O=C(NCc1ccccc1)Nc2ccccc2F 2430a_100000210422_100015324214 [0,1,0,0,1,0|2,0,0]=4 4907 B19R2.4485 O=C(NCc1ccccc1)Nc2ccccc2I 2430a_100000210053_100015324214 [0,1,0,0,1,0|2,0,0]=4 4908 B19R2.4485 O=C(NCc1ccccc1)Nc2ccccc2O 2430a_100000185747_100015324214 [0,1,0,0,1,0|2,0,0]=4 4909 B19R2.7672 Cc1cccc(c1)C#CC(=O)Cc2ccccc2 1458a_100011892726_100015291786 [0,1,0,0,1,0|0,0,2]=4 4910 B19R2.7672 Cc1cccc(c1)C=CC(=O)Cc2ccccc2 1458a_100000690095_100015291786 [0,1,0,0,1,0|0,0,0]=2 4911 B19R2.7672 Cc1cccc(c1)C=CC(=O)Cc2ccccn2 1458a_100000690095_100000721315 [0,1,0,0,1,0|1,0,0]=3 4912 B19R2.7672 Cc1cccc(c1)C=CC(=O)Cc2cccnc2 1458a_100000690095_100000733263 [0,1,0,0,1,0|1,0,0]=3 4913 B19R2.7672 Cc1cccc(c1)C=CC(=O)Cc2cccnn2 1458a_100000690095_100016990269 [0,1,0,0,1,0|2,0,0]=4 4914 B19R2.7672 Cc1cccc(c1)C=CC(=O)Cc2ccncc2 1458a_100000690095_100000705612 [0,1,0,0,1,0|1,0,0]=3 4915 B19R2.7672 Cc1cccc(c1)C=CC(=O)Cc2cnccn2 1458a_100000690095_100016995436 [0,1,0,0,1,0|2,0,0]=4 4916 B19R2.7672 Cc1cccc(c1)C=CC(=O)Cc2cncnc2 1458a_100000690095_100015196519 [0,1,0,0,1,0|2,0,0]=4 4917 B19R2.7672 Cc1cccc(c1)C=CC(=O)Cc2ncccn2 1458a_100000690095_100000703007 [0,1,0,0,1,0|2,0,0]=4 4918 B19R2.7672 Cc1cccc(c1)C=CC(=O)Nc2ccccc2 11a_100000106764_100000690095 [0,1,0,0,1,0|1,0,0]=3 4919 B19R2.7672 Cc1cccc(c1)C=CC(=O)Nc2ccccc2 1626a_100000106764_100000690095 [0,1,0,0,1,0|1,0,0]=3 4920 B19R2.7672 Cc1cccc(c1)C=CC(=O)Nc2ccccc2 22a_100000106764_100000690095 [0,1,0,0,1,0|1,0,0]=3 4921 B19R2.7672 Cc1cccc(c1)CCC(=O)Cc2ccccc2 1458a_100000234952_100015291786 [0,1,0,0,1,0|0,0,2]=4 4922 B19R2.7672 Cc1cccc(c1)CCC(=O)Nc2ccccc2 11a_100000106764_100000234952 [0,1,0,0,1,0|2,0,0]=4 4923 B19R2.7672 Cc1cccc(c1)CCC(=O)Nc2ccccc2 1626a_100000106764_100000234952 [0,1,0,0,1,0|2,0,0]=4 4924 B19R2.7672 Cc1cccc(c1)CCC(=O)Nc2ccccc2 22a_100000106764_100000234952 [0,1,0,0,1,0|2,0,0]=4 4925 B19R2.7672 Cc1cccc(c1)CCC(=O)Nc2ccccc2 527a_100000106764_100000234952 [0,1,0,0,1,0|2,0,0]=4 4926 B19R2.7672 Cc1cccc(c1)CNC(=O)Nc2ccccc2 2430a_100000106764_100000185548 [0,1,0,0,1,0|2,0,0]=4 4927 B19R2.7672 Cc1cccc(c1)NCC(=O)Cc2ccccc2 2230a_100000188690_100000233483 [0,1,0,0,1,0|1,0,1]=4 4928 B19R2.7672 Cc1cccc(c1)NCC(=O)Oc2ccccc2 2230a_100000188690_100009813826 [0,1,0,0,1,0|1,0,1]=4 4929 B19R2.7672 Cc1cccc(c1)NCC(=O)Oc2ccccc2 34a_100000188690_100009813826 [0,1,0,0,1,0|1,0,1]=4 4930 B19R2.7672 Cc1cccc(c1)OCC(=O)Cc2ccccc2 1458a_100000183606_100015291786 [0,1,0,0,1,0|1,0,1]=4 4931 B19R2.7672 Cc1cccc(c1)OCC(=O)Cc2ccccc2 7a_100000210337_100000233483 [0,1,0,0,1,0|1,0,1]=4 4932 B19R2.7672 Cc1cccc(c1)OCC(=O)Oc2ccccc2 34a_100000210337_100009813826 [0,1,0,0,1,0|1,0,1]=4 4933 B19R2.7672 Cc1cccc(c1)OCC(=O)Oc2ccccc2 7a_100000210337_100009813826 [0,1,0,0,1,0|1,0,1]=4 4934 B19R2.7672 Cc1cccc(c1)SCC(=O)Cc2ccccc2 62a_100000233483_100011215228 [0,1,0,0,1,0|1,0,1]=4 4935 B19R2.7672 Cc1cccc(c1)SCC(=O)Cc2ccccc2 62a_100011215228_100000233483 [0,1,0,0,1,0|1,0,1]=4 4936 B19R2.7672 Cc1cccc(c1)SCC(=O)Oc2ccccc2 62a_100009813826_100011215228 [0,1,0,0,1,0|1,0,1]=4 4937 B19R2.7672 Cc1cccc(c1)SCC(=O)Oc2ccccc2 62a_100011215228_100009813826 [0,1,0,0,1,0|1,0,1]=4 4938 B19R2.7672 Cc1cncc(c1)C=CC(=O)Cc2ccccc2 6a_100011998712_100000766558 [0,1,0,0,1,0|1,0,0]=3 4939 B19R2.7672 Cc1cncc(c1)C=CC(=O)Cc2cccnc2 6a_100011998712_100015187140 [0,1,0,0,1,0|2,0,0]=4 4940 B19R2.7672 Cc1cncc(n1)C=CC(=O)Cc2ccccc2 6a_100000100294_100000766558 [0,1,0,0,1,0|2,0,0]=4 4941 B19R2.7672 Nc1cccc(c1)OCC(=O)Oc2ccccc2 34a_100000210217_100009813826 [0,1,0,0,1,0|1,0,1]=4 4942 B19R2.7672 Nc1cccc(c1)SCC(=O)Cc2ccccc2 62a_100000210019_100000233483 [0,1,0,0,1,0|1,0,1]=4 4943 B19R2.7672 Nc1cccc(c1)SCC(=O)Cc2ccccc2 62a_100000233483_100000210019 [0,1,0,0,1,0|1,0,1]=4 4944 B19R2.7672 Nc1cccc(c1)SCC(=O)Oc2ccccc2 62a_100000210019_100009813826 [0,1,0,0,1,0|1,0,1]=4 4945 B19R2.7672 Nc1cccc(c1)SCC(=O)Oc2ccccc2 62a_100009813826_100000210019 [0,1,0,0,1,0|1,0,1]=4 4946 B19R2.7672 O=C(C#Cc1cccc(c1)Br)Cc2ccccc2 1458a_100012100324_100015291786 [0,1,0,0,1,0|0,0,2]=4 4947 B19R2.7672 O=C(C#Cc1cccc(c1)Cl)Cc2ccccc2 1458a_100011892777_100015291786 [0,1,0,0,1,0|0,0,2]=4 4948 B19R2.7672 O=C(C#Cc1cccc(c1)F)Cc2ccccc2 1458a_100011892744_100015291786 [0,1,0,0,1,0|0,0,2]=4 4949 B19R2.7672 O=C(C#Cc1cccc(c1)O)Cc2ccccc2 1458a_200009909484_100015291786 [0,1,0,0,1,0|0,0,2]=4 4950 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2ccccc2 1458a_100016258244_100015291786 [0,1,0,0,1,0|0,0,0]=2 4951 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2ccccc2 6a_100000210085_100000766558 [0,1,0,0,1,0|0,0,0]=2 4952 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2ccccn2 1458a_100016258244_100000721315 [0,1,0,0,1,0|1,0,0]=3 4953 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2cccnc2 1458a_100016258244_100000733263 [0,1,0,0,1,0|1,0,0]=3 4954 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2cccnc2 6a_100000210085_100015187140 [0,1,0,0,1,0|1,0,0]=3 4955 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2cccnn2 1458a_100016258244_100016990269 [0,1,0,0,1,0|2,0,0]=4 4956 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2ccncc2 1458a_100016258244_100000705612 [0,1,0,0,1,0|1,0,0]=3 4957 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2cnccn2 1458a_100016258244_100016995436 [0,1,0,0,1,0|2,0,0]=4 4958 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2cncnc2 1458a_100016258244_100015196519 [0,1,0,0,1,0|2,0,0]=4 4959 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Cc2ncccn2 1458a_100016258244_100000703007 [0,1,0,0,1,0|2,0,0]=4 4960 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Nc2ccccc2 11a_100000106764_100016258244 [0,1,0,0,1,0|1,0,0]=3 4961 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Nc2ccccc2 1626a_100000106764_100016258244 [0,1,0,0,1,0|1,0,0]=3 4962 B19R2.7672 O=C(C=Cc1cccc(c1)Br)Nc2ccccc2 22a_100000106764_100016258244 [0,1,0,0,1,0|1,0,0]=3 4963 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Cc2ccccc2 1458a_100000184502_100015291786 [0,1,0,0,1,0|0,0,0]=2 4964 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Cc2ccccn2 1458a_100000184502_100000721315 [0,1,0,0,1,0|1,0,0]=3 4965 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Cc2cccnc2 1458a_100000184502_100000733263 [0,1,0,0,1,0|1,0,0]=3 4966 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Cc2cccnn2 1458a_100000184502_100016990269 [0,1,0,0,1,0|2,0,0]=4 4967 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Cc2ccncc2 1458a_100000184502_100000705612 [0,1,0,0,1,0|1,0,0]=3 4968 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Cc2cnccn2 1458a_100000184502_100016995436 [0,1,0,0,1,0|2,0,0]=4 4969 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Cc2cncnc2 1458a_100000184502_100015196519 [0,1,0,0,1,0|2,0,0]=4 4970 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Cc2ncccn2 1458a_100000184502_100000703007 [0,1,0,0,1,0|2,0,0]=4 4971 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Nc2ccccc2 11a_100000106764_100000184502 [0,1,0,0,1,0|1,0,0]=3 4972 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Nc2ccccc2 1626a_100000106764_100000184502 [0,1,0,0,1,0|1,0,0]=3 4973 B19R2.7672 O=C(C=Cc1cccc(c1)Cl)Nc2ccccc2 22a_100000106764_100000184502 [0,1,0,0,1,0|1,0,0]=3 4974 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2ccccc2 1458a_100000718793_100015291786 [0,1,0,0,1,0|0,0,0]=2 4975 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2ccccc2 6a_100000210812_100000766558 [0,1,0,0,1,0|0,0,0]=2 4976 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2ccccn2 1458a_100000718793_100000721315 [0,1,0,0,1,0|1,0,0]=3 4977 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2cccnc2 1458a_100000718793_100000733263 [0,1,0,0,1,0|1,0,0]=3 4978 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2cccnc2 6a_100000210812_100015187140 [0,1,0,0,1,0|1,0,0]=3 4979 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2cccnn2 1458a_100000718793_100016990269 [0,1,0,0,1,0|2,0,0]=4 4980 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2ccncc2 1458a_100000718793_100000705612 [0,1,0,0,1,0|1,0,0]=3 4981 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2cnccn2 1458a_100000718793_100016995436 [0,1,0,0,1,0|2,0,0]=4 4982 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2cncnc2 1458a_100000718793_100015196519 [0,1,0,0,1,0|2,0,0]=4 4983 B19R2.7672 O=C(C=Cc1cccc(c1)F)Cc2ncccn2 1458a_100000718793_100000703007 [0,1,0,0,1,0|2,0,0]=4 4984 B19R2.7672 O=C(C=Cc1cccc(c1)F)Nc2ccccc2 11a_100000106764_100000718793 [0,1,0,0,1,0|1,0,0]=3 4985 B19R2.7672 O=C(C=Cc1cccc(c1)F)Nc2ccccc2 1626a_100000106764_100000718793 [0,1,0,0,1,0|1,0,0]=3 4986 B19R2.7672 O=C(C=Cc1cccc(c1)F)Nc2ccccc2 22a_100000106764_100000718793 [0,1,0,0,1,0|1,0,0]=3 4987 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2ccccc2 1458a_100020647043_100015291786 [0,1,0,0,1,0|0,0,0]=2 4988 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2ccccc2 6a_100000014684_100000766558 [0,1,0,0,1,0|0,0,0]=2 4989 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2ccccn2 1458a_100020647043_100000721315 [0,1,0,0,1,0|1,0,0]=3 4990 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2cccnc2 1458a_100020647043_100000733263 [0,1,0,0,1,0|1,0,0]=3 4991 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2cccnc2 6a_100000014684_100015187140 [0,1,0,0,1,0|1,0,0]=3 4992 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2cccnn2 1458a_100020647043_100016990269 [0,1,0,0,1,0|2,0,0]=4 4993 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2ccncc2 1458a_100020647043_100000705612 [0,1,0,0,1,0|1,0,0]=3 4994 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2cnccn2 1458a_100020647043_100016995436 [0,1,0,0,1,0|2,0,0]=4 4995 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2cncnc2 1458a_100020647043_100015196519 [0,1,0,0,1,0|2,0,0]=4 4996 B19R2.7672 O=C(C=Cc1cccc(c1)I)Cc2ncccn2 1458a_100020647043_100000703007 [0,1,0,0,1,0|2,0,0]=4 4997 B19R2.7672 O=C(C=Cc1cccc(c1)I)Nc2ccccc2 11a_100000106764_100020647043 [0,1,0,0,1,0|1,0,0]=3 4998 B19R2.7672 O=C(C=Cc1cccc(c1)I)Nc2ccccc2 1626a_100000106764_100020647043 [0,1,0,0,1,0|1,0,0]=3 4999 B19R2.7672 O=C(C=Cc1cccc(c1)I)Nc2ccccc2 22a_100000106764_100020647043 [0,1,0,0,1,0|1,0,0]=3 5000 B19R2.7672 O=C(C=Cc1cccc(c1)O)Nc2ccccc2 22a_100000106764_100102525460 [0,1,0,0,1,0|1,0,0]=3 5001 B19R2.7672 O=C(C=Cc1cncc(c1)Br)Cc2ccccc2 6a_100000687066_100000766558 [0,1,0,0,1,0|1,0,0]=3 5002 B19R2.7672 O=C(C=Cc1cncc(c1)Br)Cc2cccnc2 6a_100000687066_100015187140 [0,1,0,0,1,0|2,0,0]=4 5003 B19R2.7672 O=C(C=Cc1cncc(c1)Cl)Cc2ccccc2 6a_100000088910_100000766558 [0,1,0,0,1,0|1,0,0]=3 5004 B19R2.7672 O=C(C=Cc1cncc(c1)Cl)Cc2cccnc2 6a_100000088910_100015187140 [0,1,0,0,1,0|2,0,0]=4 5005 B19R2.7672 O=C(C=Cc1cncc(c1)F)Cc2ccccc2 6a_100011361476_100000766558 [0,1,0,0,1,0|1,0,0]=3 5006 B19R2.7672 O=C(C=Cc1cncc(c1)F)Cc2cccnc2 6a_100011361476_100015187140 [0,1,0,0,1,0|2,0,0]=4 5007 B19R2.7672 O=C(CCc1cccc(c1)Br)Cc2ccccc2 1458a_100000184314_100015291786 [0,1,0,0,1,0|0,0,2]=4 5008 B19R2.7672 O=C(CCc1cccc(c1)Br)Nc2ccccc2 11a_100000106764_100000184314 [0,1,0,0,1,0|2,0,0]=4 5009 B19R2.7672 O=C(CCc1cccc(c1)Br)Nc2ccccc2 1626a_100000106764_100000184314 [0,1,0,0,1,0|2,0,0]=4 5010 B19R2.7672 O=C(CCc1cccc(c1)Br)Nc2ccccc2 22a_100000106764_100000184314 [0,1,0,0,1,0|2,0,0]=4 5011 B19R2.7672 O=C(CCc1cccc(c1)Br)Nc2ccccc2 527a_100000106764_100000184314 [0,1,0,0,1,0|2,0,0]=4 5012 B19R2.7672 O=C(CCc1cccc(c1)Cl)Cc2ccccc2 1458a_100000235675_100015291786 [0,1,0,0,1,0|0,0,2]=4 5013 B19R2.7672 O=C(CCc1cccc(c1)Cl)Nc2ccccc2 11a_100000106764_100000235675 [0,1,0,0,1,0|2,0,0]=4 5014 B19R2.7672 O=C(CCc1cccc(c1)Cl)Nc2ccccc2 1626a_100000106764_100000235675 [0,1,0,0,1,0|2,0,0]=4 5015 B19R2.7672 O=C(CCc1cccc(c1)Cl)Nc2ccccc2 22a_100000106764_100000235675 [0,1,0,0,1,0|2,0,0]=4 5016 B19R2.7672 O=C(CCc1cccc(c1)Cl)Nc2ccccc2 527a_100000106764_100000235675 [0,1,0,0,1,0|2,0,0]=4 5017 B19R2.7672 O=C(CCc1cccc(c1)F)Cc2ccccc2 1458a_100000235673_100015291786 [0,1,0,0,1,0|0,0,2]=4 5018 B19R2.7672 O=C(CCc1cccc(c1)F)Nc2ccccc2 11a_100000106764_100000235673 [0,1,0,0,1,0|2,0,0]=4 5019 B19R2.7672 O=C(CCc1cccc(c1)F)Nc2ccccc2 1626a_100000106764_100000235673 [0,1,0,0,1,0|2,0,0]=4 5020 B19R2.7672 O=C(CCc1cccc(c1)F)Nc2ccccc2 22a_100000106764_100000235673 [0,1,0,0,1,0|2,0,0]=4 5021 B19R2.7672 O=C(CCc1cccc(c1)F)Nc2ccccc2 527a_100000106764_100000235673 [0,1,0,0,1,0|2,0,0]=4 5022 B19R2.7672 O=C(CCc1cccc(c1)I)Cc2ccccc2 1458a_100010007846_100015291786 [0,1,0,0,1,0|0,0,2]=4 5023 B19R2.7672 O=C(CCc1cccc(c1)I)Nc2ccccc2 11a_100000106764_100010007846 [0,1,0,0,1,0|2,0,0]=4 5024 B19R2.7672 O=C(CCc1cccc(c1)I)Nc2ccccc2 1626a_100000106764_100010007846 [0,1,0,0,1,0|2,0,0]=4 5025 B19R2.7672 O=C(CCc1cccc(c1)I)Nc2ccccc2 22a_100000106764_100010007846 [0,1,0,0,1,0|2,0,0]=4 5026 B19R2.7672 O=C(CCc1cccc(c1)I)Nc2ccccc2 527a_100000106764_100010007846 [0,1,0,0,1,0|2,0,0]=4 5027 B19R2.7672 O=C(CCc1cccc(c1)O)Cc2ccccc2 1458a_100011216126_100015291786 [0,1,0,0,1,0|0,0,2]=4 5028 B19R2.7672 O=C(CCc1cccc(c1)O)Nc2ccccc2 22a_100000106764_100011216126 [0,1,0,0,1,0|2,0,0]=4 5029 B19R2.7672 O=C(CCc1cccc(c1)O)Nc2ccccc2 527a_100000106764_100011216126 [0,1,0,0,1,0|2,0,0]=4 5030 B19R2.7672 O=C(CNc1cccc(c1)Br)Oc2ccccc2 34a_100000210019_100009813826 [0,1,0,0,1,0|1,0,1]=4 5031 B19R2.7672 O=C(CNc1cccc(c1)Cl)Oc2ccccc2 34a_100000185859_100009813826 [0,1,0,0,1,0|1,0,1]=4 5032 B19R2.7672 O=C(CNc1cccc(c1)F)Oc2ccccc2 34a_100000210047_100009813826 [0,1,0,0,1,0|1,0,1]=4 5033 B19R2.7672 O=C(CNc1cccc(c1)I)Oc2ccccc2 34a_100000211102_100009813826 [0,1,0,0,1,0|1,0,1]=4 5034 B19R2.7672 O=C(CNc1cccc(c1)O)Oc2ccccc2 34a_100000210217_100009813826 [0,1,0,0,1,0|1,0,1]=4 5035 B19R2.7672 O=C(COc1cccc(c1)Br)Cc2ccccc2 1458a_100000182359_100015291786 [0,1,0,0,1,0|1,0,1]=4 5036 B19R2.7672 O=C(COc1cccc(c1)Br)Cc2ccccc2 7a_100000210342_100000233483 [0,1,0,0,1,0|1,0,1]=4 5037 B19R2.7672 O=C(COc1cccc(c1)Br)Oc2ccccc2 34a_100000210342_100009813826 [0,1,0,0,1,0|1,0,1]=4 5038 B19R2.7672 O=C(COc1cccc(c1)Br)Oc2ccccc2 7a_100000210342_100009813826 [0,1,0,0,1,0|1,0,1]=4 5039 B19R2.7672 O=C(COc1cccc(c1)Cl)Cc2ccccc2 1458a_100000184978_100015291786 [0,1,0,0,1,0|1,0,1]=4 5040 B19R2.7672 O=C(COc1cccc(c1)Cl)Cc2ccccc2 7a_100000210295_100000233483 [0,1,0,0,1,0|1,0,1]=4 5041 B19R2.7672 O=C(COc1cccc(c1)Cl)Oc2ccccc2 34a_100000210295_100009813826 [0,1,0,0,1,0|1,0,1]=4 5042 B19R2.7672 O=C(COc1cccc(c1)Cl)Oc2ccccc2 7a_100000210295_100009813826 [0,1,0,0,1,0|1,0,1]=4 5043 B19R2.7672 O=C(COc1cccc(c1)F)Cc2ccccc2 1458a_100000182781_100015291786 [0,1,0,0,1,0|1,0,1]=4 5044 B19R2.7672 O=C(COc1cccc(c1)F)Cc2ccccc2 7a_100000210426_100000233483 [0,1,0,0,1,0|1,0,1]=4 5045 B19R2.7672 O=C(COc1cccc(c1)F)Oc2ccccc2 34a_100000210426_100009813826 [0,1,0,0,1,0|1,0,1]=4 5046 B19R2.7672 O=C(COc1cccc(c1)F)Oc2ccccc2 7a_100000210426_100009813826 [0,1,0,0,1,0|1,0,1]=4 5047 B19R2.7672 O=C(COc1cccc(c1)I)Cc2ccccc2 7a_100000211634_100000233483 [0,1,0,0,1,0|1,0,1]=4 5048 B19R2.7672 O=C(COc1cccc(c1)I)Oc2ccccc2 34a_100000211634_100009813826 [0,1,0,0,1,0|1,0,1]=4 5049 B19R2.7672 O=C(COc1cccc(c1)I)Oc2ccccc2 7a_100000211634_100009813826 [0,1,0,0,1,0|1,0,1]=4 5050 B19R2.7672 O=C(CSc1cccc(c1)Br)Cc2ccccc2 1458a_100000760868_100015291786 [0,1,0,0,1,0|1,0,1]=4 5051 B19R2.7672 O=C(CSc1cccc(c1)Br)Cc2ccccc2 62a_100000233483_100000691529 [0,1,0,0,1,0|1,0,1]=4 5052 B19R2.7672 O=C(CSc1cccc(c1)Br)Cc2ccccc2 62a_100000691529_100000233483 [0,1,0,0,1,0|1,0,1]=4 5053 B19R2.7672 O=C(CSc1cccc(c1)Br)Oc2ccccc2 62a_100000691529_100009813826 [0,1,0,0,1,0|1,0,1]=4 5054 B19R2.7672 O=C(CSc1cccc(c1)Br)Oc2ccccc2 62a_100009813826_100000691529 [0,1,0,0,1,0|1,0,1]=4 5055 B19R2.7672 O=C(CSc1cccc(c1)Cl)Cc2ccccc2 62a_100000233483_100000699651 [0,1,0,0,1,0|1,0,1]=4 5056 B19R2.7672 O=C(CSc1cccc(c1)Cl)Cc2ccccc2 62a_100000699651_100000233483 [0,1,0,0,1,0|1,0,1]=4 5057 B19R2.7672 O=C(CSc1cccc(c1)Cl)Oc2ccccc2 62a_100000699651_100009813826 [0,1,0,0,1,0|1,0,1]=4 5058 B19R2.7672 O=C(CSc1cccc(c1)Cl)Oc2ccccc2 62a_100009813826_100000699651 [0,1,0,0,1,0|1,0,1]=4 5059 B19R2.7672 O=C(CSc1cccc(c1)F)Cc2ccccc2 62a_100000233483_100000685547 [0,1,0,0,1,0|1,0,1]=4 5060 B19R2.7672 O=C(CSc1cccc(c1)F)Cc2ccccc2 62a_100000685547_100000233483 [0,1,0,0,1,0|1,0,1]=4 5061 B19R2.7672 O=C(CSc1cccc(c1)F)Oc2ccccc2 62a_100000685547_100009813826 [0,1,0,0,1,0|1,0,1]=4 5062 B19R2.7672 O=C(CSc1cccc(c1)F)Oc2ccccc2 62a_100009813826_100000685547 [0,1,0,0,1,0|1,0,1]=4 5063 B19R2.7672 O=C(CSc1cccc(c1)O)Cc2ccccc2 62a_100000233483_100000211634 [0,1,0,0,1,0|1,0,1]=4 5064 B19R2.7672 O=C(CSc1cccc(c1)O)Oc2ccccc2 62a_100009813826_100000211634 [0,1,0,0,1,0|1,0,1]=4 5065 B19R2.7672 O=C(CSc1cccc(c1)[S])Cc2ccccc2 62a_100000233483_114929384022 [0,1,0,0,1,0|1,0,1]=4 5066 B19R2.7672 O=C(CSc1cccc(c1)[S])Cc2ccccc2 62a_114929384022_100000233483 [0,1,0,0,1,0|1,0,1]=4 5067 B19R2.7672 O=C(CSc1cccc(c1)[S])Oc2ccccc2 62a_100009813826_114929384022 [0,1,0,0,1,0|1,0,1]=4 5068 B19R2.7672 O=C(CSc1cccc(c1)[S])Oc2ccccc2 62a_114929384022_100009813826 [0,1,0,0,1,0|1,0,1]=4 5069 B19R2.7672 O=C(NCc1cccc(c1)Br)Nc2ccccc2 2430a_100000106764_100000174977 [0,1,0,0,1,0|2,0,0]=4 5070 B19R2.7672 O=C(NCc1cccc(c1)Cl)Nc2ccccc2 2430a_100000106764_100000174878 [0,1,0,0,1,0|2,0,0]=4 5071 B19R2.7672 O=C(NCc1cccc(c1)F)Nc2ccccc2 2430a_100000106764_100000174948 [0,1,0,0,1,0|2,0,0]=4 5072 B19R2.7672 O=C(NCc1cccc(c1)I)Nc2ccccc2 2430a_100000106764_100000106179 [0,1,0,0,1,0|2,0,0]=4 5073 B19R2.7672 O=C(NCc1cccc(c1)O)Nc2ccccc2 2430a_100000106764_100000743036 [0,1,0,0,1,0|2,0,0]=4 5074 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Cc2ccccc2 1458a_100016990649_100015291786 [0,1,0,0,1,0|0,0,0]=2 5075 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Cc2ccccn2 1458a_100016990649_100000721315 [0,1,0,0,1,0|1,0,0]=3 5076 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Cc2cccnc2 1458a_100016990649_100000733263 [0,1,0,0,1,0|1,0,0]=3 5077 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Cc2cccnn2 1458a_100016990649_100016990269 [0,1,0,0,1,0|2,0,0]=4 5078 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Cc2ccncc2 1458a_100016990649_100000705612 [0,1,0,0,1,0|1,0,0]=3 5079 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Cc2cnccn2 1458a_100016990649_100016995436 [0,1,0,0,1,0|2,0,0]=4 5080 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Cc2cncnc2 1458a_100016990649_100015196519 [0,1,0,0,1,0|2,0,0]=4 5081 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Cc2ncccn2 1458a_100016990649_100000703007 [0,1,0,0,1,0|2,0,0]=4 5082 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Nc2ccccc2 11a_100000106764_100016990649 [0,1,0,0,1,0|1,0,0]=3 5083 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Nc2ccccc2 1626a_100000106764_100016990649 [0,1,0,0,1,0|1,0,0]=3 5084 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Nc2ccccc2 22a_100000106764_100016990649 [0,1,0,0,1,0|1,0,0]=3 5085 B19R2.8924 C/C(=C\c1ccccc1)/C(=O)Nc2ccccc2 527a_100000106764_100016990649 [0,1,0,0,1,0|1,0,0]=3 5086 B19R2.8924 C/C(=C\c1ccccn1)/C(=O)Cc2ccccc2 1458a_100025712827_100015291786 [0,1,0,0,1,0|1,0,0]=3 5087 B19R2.8924 C/C(=C\c1ccccn1)/C(=O)Cc2ccccn2 1458a_100025712827_100000721315 [0,1,0,0,1,0|2,0,0]=4 5088 B19R2.8924 C/C(=C\c1ccccn1)/C(=O)Cc2cccnc2 1458a_100025712827_100000733263 [0,1,0,0,1,0|2,0,0]=4 5089 B19R2.8924 C/C(=C\c1ccccn1)/C(=O)Cc2ccncc2 1458a_100025712827_100000705612 [0,1,0,0,1,0|2,0,0]=4 5090 B19R2.8924 C/C(=C\c1ccccn1)/C(=O)Nc2ccccc2 11a_100000106764_100025712827 [0,1,0,0,1,0|2,0,0]=4 5091 B19R2.8924 C/C(=C\c1ccccn1)/C(=O)Nc2ccccc2 1626a_100000106764_100025712827 [0,1,0,0,1,0|2,0,0]=4 5092 B19R2.8924 C/C(=C\c1ccccn1)/C(=O)Nc2ccccc2 22a_100000106764_100025712827 [0,1,0,0,1,0|2,0,0]=4 5093 B19R2.8924 C/C(=C\c1ccccn1)/C(=O)Nc2ccccc2 527a_100000106764_100025712827 [0,1,0,0,1,0|2,0,0]=4 5094 B19R2.8924 C=C(Cc1ccccc1)C(=O)Nc2ccccc2 11a_100000106764_100000066491 [0,1,0,0,1,0|1,0,1]=4 5095 B19R2.8924 C=C(Cc1ccccc1)C(=O)Nc2ccccc2 1626a_100000106764_100000066491 [0,1,0,0,1,0|1,0,1]=4 5096 B19R2.8924 C=C(Cc1ccccc1)C(=O)Nc2ccccc2 22a_100000106764_100000066491 [0,1,0,0,1,0|1,0,1]=4 5097 B19R2.8924 CC(Cc1ccccc1)C(=O)Cc2ccccc2 1458a_100000754839_100015291786 [0,1,0,0,1,0|0,0,2]=4 5098 B19R2.8924 CC(Cc1ccccc1)C(=O)Nc2ccccc2 11a_100000106764_100000754839 [0,1,0,0,1,0|2,0,0]=4 5099 B19R2.8924 CC(Cc1ccccc1)C(=O)Nc2ccccc2 1626a_100000106764_100000754839 [0,1,0,0,1,0|2,0,0]=4 5100 B19R2.8924 CC(Cc1ccccc1)C(=O)Nc2ccccc2 22a_100000106764_100000754839 [0,1,0,0,1,0|2,0,0]=4 5101 B19R2.8924 CC(Cc1ccccc1)C(=O)Nc2ccccc2 527a_100000106764_100000754839 [0,1,0,0,1,0|2,0,0]=4 5102 B19R2.8924 CC(Oc1ccccc1)C(=O)Cc2ccccc2 1458a_100000188414_100015291786 [0,1,0,0,1,0|1,0,1]=4 5103 B19R2.8924 CC(Sc1ccccc1)C(=O)Cc2ccccc2 1458a_100000199063_100015291786 [0,1,0,0,1,0|1,0,1]=4 5104 B19R2.8924 CN(Cc1ccccc1)C(=O)Nc2ccccc2 2430a_100000106764_100000186898 [0,1,0,0,1,0|2,0,0]=4 5105 B19R2.8924 O=C(Cc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100015291786 [0,1,0,0,1,0|0,0,0]=2 5106 B19R2.8924 O=C(Cc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100015291786 [0,1,0,0,1,0|0,0,0]=2 5107 B19R2.8924 O=C(Cc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100015291786 [0,1,0,0,1,0|1,0,0]=3 5108 B19R2.8924 O=C(Cc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100015291786 [0,1,0,0,1,0|1,0,0]=3 5109 B19R2.8924 O=C(Cc1ccccc1)[C@H](O)Cc2ccccc2 1458a_100009816399_100015291786 [0,1,0,0,1,0|0,0,2]=4 5110 B19R2.8924 O=C(Cc1ccccn1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000721315 [0,1,0,0,1,0|1,0,0]=3 5111 B19R2.8924 O=C(Cc1ccccn1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000721315 [0,1,0,0,1,0|1,0,0]=3 5112 B19R2.8924 O=C(Cc1ccccn1)C(=Cc2cccnc2)F 1458a_100000731744_100000721315 [0,1,0,0,1,0|2,0,0]=4 5113 B19R2.8924 O=C(Cc1ccccn1)C(=O)Nc2ccccc2 1458a_100000738435_100000721315 [0,1,0,0,1,0|2,0,0]=4 5114 B19R2.8924 O=C(Cc1cccnc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000733263 [0,1,0,0,1,0|1,0,0]=3 5115 B19R2.8924 O=C(Cc1cccnc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000733263 [0,1,0,0,1,0|1,0,0]=3 5116 B19R2.8924 O=C(Cc1cccnc1)C(=Cc2cccnc2)F 1458a_100000731744_100000733263 [0,1,0,0,1,0|2,0,0]=4 5117 B19R2.8924 O=C(Cc1cccnc1)C(=O)Nc2ccccc2 1458a_100000738435_100000733263 [0,1,0,0,1,0|2,0,0]=4 5118 B19R2.8924 O=C(Cc1cccnn1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100016990269 [0,1,0,0,1,0|2,0,0]=4 5119 B19R2.8924 O=C(Cc1cccnn1)/C(=C\c2ccccc2)/F 1458a_100020889036_100016990269 [0,1,0,0,1,0|2,0,0]=4 5120 B19R2.8924 O=C(Cc1ccncc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000705612 [0,1,0,0,1,0|1,0,0]=3 5121 B19R2.8924 O=C(Cc1ccncc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000705612 [0,1,0,0,1,0|1,0,0]=3 5122 B19R2.8924 O=C(Cc1ccncc1)C(=Cc2cccnc2)F 1458a_100000731744_100000705612 [0,1,0,0,1,0|2,0,0]=4 5123 B19R2.8924 O=C(Cc1ccncc1)C(=O)Nc2ccccc2 1458a_100000738435_100000705612 [0,1,0,0,1,0|2,0,0]=4 5124 B19R2.8924 O=C(Cc1cnccn1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100016995436 [0,1,0,0,1,0|2,0,0]=4 5125 B19R2.8924 O=C(Cc1cnccn1)/C(=C\c2ccccc2)/F 1458a_100020889036_100016995436 [0,1,0,0,1,0|2,0,0]=4 5126 B19R2.8924 O=C(Cc1cncnc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100015196519 [0,1,0,0,1,0|2,0,0]=4 5127 B19R2.8924 O=C(Cc1cncnc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100015196519 [0,1,0,0,1,0|2,0,0]=4 5128 B19R2.8924 O=C(Cc1ncccn1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000703007 [0,1,0,0,1,0|2,0,0]=4 5129 B19R2.8924 O=C(Cc1ncccn1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000703007 [0,1,0,0,1,0|2,0,0]=4 5130 B19R2.8924 O=C(Nc1ccccc1)/C(=C/c2ccccc2)/Cl 11a_100000106764_200020598536 [0,1,0,0,1,0|1,0,0]=3 5131 B19R2.8924 O=C(Nc1ccccc1)/C(=C/c2ccccc2)/Cl 1626a_100000106764_200020598536 [0,1,0,0,1,0|1,0,0]=3 5132 B19R2.8924 O=C(Nc1ccccc1)/C(=C/c2ccccc2)/Cl 22a_100000106764_200020598536 [0,1,0,0,1,0|1,0,0]=3 5133 B19R2.8924 O=C(Nc1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100000106764_200020598536 [0,1,0,0,1,0|1,0,0]=3 5134 B19R2.8924 O=C(Nc1ccccc1)/C(=C\c2ccccc2)/F 11a_100000106764_100020889036 [0,1,0,0,1,0|1,0,0]=3 5135 B19R2.8924 O=C(Nc1ccccc1)/C(=C\c2ccccc2)/F 22a_100000106764_100020889036 [0,1,0,0,1,0|1,0,0]=3 5136 B19R2.8924 O=C(Nc1ccccc1)/C(=C\c2ccccc2)/F 527a_100000106764_100020889036 [0,1,0,0,1,0|1,0,0]=3 5137 B19R2.8924 O=C(Nc1ccccc1)C(=Cc2cccnc2)F 11a_100000106764_100000731744 [0,1,0,0,1,0|2,0,0]=4 5138 B19R2.8924 O=C(Nc1ccccc1)C(=Cc2cccnc2)F 22a_100000106764_100000731744 [0,1,0,0,1,0|2,0,0]=4 5139 B19R2.8924 O=C(Nc1ccccc1)C(=Cc2cccnc2)F 527a_100000106764_100000731744 [0,1,0,0,1,0|2,0,0]=4 5140 B19R2.8924 O=C(Nc1ccccc1)C(=O)Nc2ccccc2 22a_100000106764_100000738435 [0,1,0,0,1,0|2,0,0]=4 5141 B19R2.8924 O=C(Nc1ccccc1)[C@H](O)Cc2ccccc2 22a_100000106764_100009816399 [0,1,0,0,1,0|2,0,0]=4 5142 B19R2.8929 CC(=CC(=O)Cc1ccccc1)c2ccccc2 1458a_100000743005_100015291786 [0,1,0,0,1,0|0,0,0]=2 5143 B19R2.8929 CC(=CC(=O)Cc1ccccn1)c2ccccc2 1458a_100000743005_100000721315 [0,1,0,0,1,0|1,0,0]=3 5144 B19R2.8929 CC(=CC(=O)Cc1cccnc1)c2ccccc2 1458a_100000743005_100000733263 [0,1,0,0,1,0|1,0,0]=3 5145 B19R2.8929 CC(=CC(=O)Cc1cccnn1)c2ccccc2 1458a_100000743005_100016990269 [0,1,0,0,1,0|2,0,0]=4 5146 B19R2.8929 CC(=CC(=O)Cc1ccncc1)c2ccccc2 1458a_100000743005_100000705612 [0,1,0,0,1,0|1,0,0]=3 5147 B19R2.8929 CC(=CC(=O)Cc1cnccn1)c2ccccc2 1458a_100000743005_100016995436 [0,1,0,0,1,0|2,0,0]=4 5148 B19R2.8929 CC(=CC(=O)Cc1cncnc1)c2ccccc2 1458a_100000743005_100015196519 [0,1,0,0,1,0|2,0,0]=4 5149 B19R2.8929 CC(=CC(=O)Cc1ncccn1)c2ccccc2 1458a_100000743005_100000703007 [0,1,0,0,1,0|2,0,0]=4 5150 B19R2.8929 CC(=CC(=O)Nc1ccccc1)c2ccccc2 11a_100000106764_100000743005 [0,1,0,0,1,0|1,0,0]=3 5151 B19R2.8929 CC(=CC(=O)Nc1ccccc1)c2ccccc2 1626a_100000106764_100000743005 [0,1,0,0,1,0|1,0,0]=3 5152 B19R2.8929 CC(=CC(=O)Nc1ccccc1)c2ccccc2 22a_100000106764_100000743005 [0,1,0,0,1,0|1,0,0]=3 5153 B19R2.8929 CC(=CC(=O)Nc1ccccc1)c2ccccc2 527a_100000106764_100000743005 [0,1,0,0,1,0|1,0,0]=3 5154 B19R2.8929 CC(CC(=O)Cc1ccccc1)c2ccccc2 1458a_100000183687_100015291786 [0,1,0,0,1,0|0,0,2]=4 5155 B19R2.8929 CC(CC(=O)Nc1ccccc1)c2ccccc2 11a_100000106764_100000183687 [0,1,0,0,1,0|2,0,0]=4 5156 B19R2.8929 CC(CC(=O)Nc1ccccc1)c2ccccc2 1626a_100000106764_100000183687 [0,1,0,0,1,0|2,0,0]=4 5157 B19R2.8929 CC(CC(=O)Nc1ccccc1)c2ccccc2 22a_100000106764_100000183687 [0,1,0,0,1,0|2,0,0]=4 5158 B19R2.8929 CC(CC(=O)Nc1ccccc1)c2ccccc2 527a_100000106764_100000183687 [0,1,0,0,1,0|2,0,0]=4 5159 B19R2.8929 CN(CC(=O)Cc1ccccc1)c2ccccc2 1458a_100000745425_100015291786 [0,1,0,0,1,0|1,0,1]=4 5160 B19R2.8929 CN(CC(=O)Cc1ccccc1)c2ccccc2 2230a_100000210012_100000233483 [0,1,0,0,1,0|1,0,1]=4 5161 B19R2.8929 CN(CC(=O)Cc1ccccc1)c2ccccc2 269982a_100000210012_100000233483 [0,1,0,0,1,0|1,0,1]=4 5162 B19R2.8929 CN(CC(=O)Oc1ccccc1)c2ccccc2 2230a_100000210012_100009813826 [0,1,0,0,1,0|1,0,1]=4 5163 B19R2.8929 CN(CC(=O)Oc1ccccc1)c2ccccc2 269982a_100000210012_100009813826 [0,1,0,0,1,0|1,0,1]=4 5164 B19R2.8929 CN(CC(=O)Oc1ccccc1)c2ccccc2 34a_100000210012_100009813826 [0,1,0,0,1,0|1,0,1]=4 5165 B19R2.8929 C[C@@H](NC(=O)Nc1ccccc1)c2ccccc2 2430a_100000106764_100000751104 [0,1,0,0,1,0|2,0,0]=4 5166 B19R2.8929 O=C(CC(=O)c1ccccc1)C[n+]2ccccc2 1458a_200000086051_100000211460 [0,1,0,0,1,0|1,0,1]=4 5167 B19R2.8929 O=C(CC(=O)c1ccccc1)Cc2ccccc2 1458a_100000185807_100000233483 [0,1,0,0,1,0|0,0,1]=3 5168 B19R2.8929 O=C(CC(=O)c1ccccc1)Cc2ccccn2 1458a_100000233486_100000211460 [0,1,0,0,1,0|1,0,1]=4 5169 B19R2.8929 O=C(CC(=O)c1ccccc1)Cc2cccnc2 1458a_100000737805_100000211460 [0,1,0,0,1,0|1,0,1]=4 5170 B19R2.8929 O=C(CC(=O)c1ccccc1)Nc2ccccc2 1458a_100000185807_100000182850 [0,1,0,0,1,0|1,0,1]=4 5171 B19R2.8929 O=C(CC(=O)c1ccccc1)Oc2ccccc2 1458a_100000185807_100009813826 [0,1,0,0,1,0|0,0,1]=3 5172 B19R2.8929 O=C(CC(O)c1ccccc1)Nc2ccccc2 22a_100000106764_100000690199 [0,1,0,0,1,0|2,0,0]=4 5173 B19R2.8929 O=C(Cc1ccccc1)CC(O)c2ccccc2 1458a_100000690199_100015291786 [0,1,0,0,1,0|0,0,2]=4 5174 B19R2.11857 Cc1ccc(cc1)CC(=O)C#Cc2ccccc2 1458a_100000736102_100000210814 [0,1,0,0,1,0|0,0,2]=4 5175 B19R2.11857 Cc1ccc(cc1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000210814 [0,1,0,0,1,0|0,0,0]=2 5176 B19R2.11857 Cc1ccc(cc1)CC(=O)C=Cc2ccccn2 1458a_100000740811_100000210814 [0,1,0,0,1,0|1,0,0]=3 5177 B19R2.11857 Cc1ccc(cc1)CC(=O)C=Cc2cccnc2 1458a_100000735890_100000210814 [0,1,0,0,1,0|1,0,0]=3 5178 B19R2.11857 Cc1ccc(cc1)CC(=O)C=Cc2ccncc2 1458a_100000682801_100000210814 [0,1,0,0,1,0|1,0,0]=3 5179 B19R2.11857 Cc1ccc(cc1)CC(=O)C=Cc2cncnc2 6a_100000749868_100000751045 [0,1,0,0,1,0|2,0,0]=4 5180 B19R2.11857 Cc1ccc(cc1)CC(=O)CCc2ccccc2 1458a_100000185753_100000210814 [0,1,0,0,1,0|0,0,2]=4 5181 B19R2.11857 Cc1ccc(cc1)CC(=O)CCc2ccccc2 1458a_100000212244_100000765856 [0,1,0,0,1,0|0,0,2]=4 5182 B19R2.11857 Cc1ccc(cc1)CC(=O)COc2ccccc2 1458a_100000186222_100000210814 [0,1,0,0,1,0|1,0,1]=4 5183 B19R2.11857 Cc1ccc(cc1)CC(=O)CSc2ccccc2 1458a_100000211596_100000210814 [0,1,0,0,1,0|1,0,1]=4 5184 B19R2.11857 Cc1ccc(cc1)CC(=O)NCc2ccccc2 11a_100015324214_100000212244 [0,1,0,0,1,0|1,0,1]=4 5185 B19R2.11857 Cc1ccc(cc1)CC(=O)NCc2ccccc2 240690a_100015324214_100000212244 [0,1,0,0,1,0|1,0,1]=4 5186 B19R2.11857 Cc1ccc(cc1)CC(=O)NCc2ccccc2 527a_100015324214_100000212244 [0,1,0,0,1,0|1,0,1]=4 5187 B19R2.11857 Cc1ccc(cc1)CC(=O)NNc2ccccc2 22a_100015195140_100000212244 [0,1,0,0,1,0|2,0,0]=4 5188 B19R2.11857 Cc1ccc(cc1)NC(=O)C=Cc2ccccc2 11a_100000124888_100000210462 [0,1,0,0,1,0|1,0,0]=3 5189 B19R2.11857 Cc1ccc(cc1)NC(=O)C=Cc2ccccc2 1626a_100000124888_100000210462 [0,1,0,0,1,0|1,0,0]=3 5190 B19R2.11857 Cc1ccc(cc1)NC(=O)C=Cc2ccccc2 22a_100000124888_100000210462 [0,1,0,0,1,0|1,0,0]=3 5191 B19R2.11857 Cc1ccc(cc1)NC(=O)C=Cc2ccccn2 11a_100000124888_100000740811 [0,1,0,0,1,0|2,0,0]=4 5192 B19R2.11857 Cc1ccc(cc1)NC(=O)C=Cc2ccccn2 22a_100000124888_100000740811 [0,1,0,0,1,0|2,0,0]=4 5193 B19R2.11857 Cc1ccc(cc1)NC(=O)C=Cc2cccnc2 11a_100000124888_100000735890 [0,1,0,0,1,0|2,0,0]=4 5194 B19R2.11857 Cc1ccc(cc1)NC(=O)C=Cc2cccnc2 22a_100000124888_100000735890 [0,1,0,0,1,0|2,0,0]=4 5195 B19R2.11857 Cc1ccc(cc1)NC(=O)C=Cc2ccncc2 22a_100000124888_100000682801 [0,1,0,0,1,0|2,0,0]=4 5196 B19R2.11857 Cc1ccc(cc1)NC(=O)CCc2ccccc2 11a_100000124888_100000185753 [0,1,0,0,1,0|2,0,0]=4 5197 B19R2.11857 Cc1ccc(cc1)NC(=O)CCc2ccccc2 1626a_100000124888_100000185753 [0,1,0,0,1,0|2,0,0]=4 5198 B19R2.11857 Cc1ccc(cc1)NC(=O)CCc2ccccc2 22a_100000124888_100000185753 [0,1,0,0,1,0|2,0,0]=4 5199 B19R2.11857 Cc1ccc(cc1)NC(=O)CCc2ccccc2 527a_100000124888_100000185753 [0,1,0,0,1,0|2,0,0]=4 5200 B19R2.11857 Cc1ccc(cc1)NC(=O)NCc2ccccc2 2430a_100000124888_100015324214 [0,1,0,0,1,0|2,0,0]=4 5201 B19R2.11857 Cc1ccc(cn1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100016987292 [0,1,0,0,1,0|1,0,0]=3 5202 B19R2.11857 Cc1ccc(cn1)CC(=O)C=Cc2ccccn2 1458a_100000740811_100016987292 [0,1,0,0,1,0|2,0,0]=4 5203 B19R2.11857 Cc1ccc(cn1)CC(=O)C=Cc2cccnc2 1458a_100000735890_100016987292 [0,1,0,0,1,0|2,0,0]=4 5204 B19R2.11857 Cc1ccc(cn1)CC(=O)C=Cc2ccncc2 1458a_100000682801_100016987292 [0,1,0,0,1,0|2,0,0]=4 5205 B19R2.11857 Cc1ccc(nc1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000691093 [0,1,0,0,1,0|1,0,0]=3 5206 B19R2.11857 Cc1ccc(nc1)CC(=O)C=Cc2ccccn2 1458a_100000740811_100000691093 [0,1,0,0,1,0|2,0,0]=4 5207 B19R2.11857 Cc1ccc(nc1)CC(=O)C=Cc2cccnc2 1458a_100000735890_100000691093 [0,1,0,0,1,0|2,0,0]=4 5208 B19R2.11857 Cc1ccc(nc1)CC(=O)C=Cc2ccncc2 1458a_100000682801_100000691093 [0,1,0,0,1,0|2,0,0]=4 5209 B19R2.11857 Cc1cnc(cn1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000752025 [0,1,0,0,1,0|2,0,0]=4 5210 B19R2.11857 Cc1cnc(nc1)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000685645 [0,1,0,0,1,0|2,0,0]=4 5211 B19R2.11857 O=C(C#Cc1ccccc1)Cc2ccc(cc2)Br 1458a_100000736102_100000189115 [0,1,0,0,1,0|0,0,2]=4 5212 B19R2.11857 O=C(C#Cc1ccccc1)Cc2ccc(cc2)Cl 1458a_100000736102_100000694040 [0,1,0,0,1,0|0,0,2]=4 5213 B19R2.11857 O=C(C#Cc1ccccc1)Cc2ccc(cc2)F 1458a_100000736102_100000198546 [0,1,0,0,1,0|0,0,2]=4 5214 B19R2.11857 O=C(C#Cc1ccccc1)Cc2ccc(cc2)I 1458a_100000736102_100000189116 [0,1,0,0,1,0|0,0,2]=4 5215 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(cc2)Br 1458a_100000210462_100000189115 [0,1,0,0,1,0|0,0,0]=2 5216 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(cc2)Cl 1458a_100000210462_100000694040 [0,1,0,0,1,0|0,0,0]=2 5217 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(cc2)F 1458a_100000210462_100000198546 [0,1,0,0,1,0|0,0,0]=2 5218 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(cc2)I 1458a_100000210462_100000189116 [0,1,0,0,1,0|0,0,0]=2 5219 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(cn2)Br 1458a_100000210462_100000702658 [0,1,0,0,1,0|1,0,0]=3 5220 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(cn2)Cl 1458a_100000210462_100012066911 [0,1,0,0,1,0|1,0,0]=3 5221 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(cn2)F 1458a_100000210462_100000703193 [0,1,0,0,1,0|1,0,0]=3 5222 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(nc2)Br 1458a_100000210462_100009831999 [0,1,0,0,1,0|1,0,0]=3 5223 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(nc2)Cl 1458a_100000210462_100000735431 [0,1,0,0,1,0|1,0,0]=3 5224 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(nc2)F 1458a_100000210462_100009820150 [0,1,0,0,1,0|1,0,0]=3 5225 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ccc(nn2)Cl 1458a_100000210462_100016992710 [0,1,0,0,1,0|2,0,0]=4 5226 B19R2.11857 O=C(C=Cc1ccccc1)Cc2ncc(cn2)Br 1458a_100000210462_100010064664 [0,1,0,0,1,0|2,0,0]=4 5227 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)Br 11a_100000210018_100000210462 [0,1,0,0,1,0|1,0,0]=3 5228 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)Br 1626a_100000210018_100000210462 [0,1,0,0,1,0|1,0,0]=3 5229 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)Br 22a_100000210018_100000210462 [0,1,0,0,1,0|1,0,0]=3 5230 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)Cl 11a_100000210052_100000210462 [0,1,0,0,1,0|1,0,0]=3 5231 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)Cl 1626a_100000210052_100000210462 [0,1,0,0,1,0|1,0,0]=3 5232 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)Cl 22a_100000210052_100000210462 [0,1,0,0,1,0|1,0,0]=3 5233 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)F 11a_100000185862_100000210462 [0,1,0,0,1,0|1,0,0]=3 5234 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)F 1626a_100000185862_100000210462 [0,1,0,0,1,0|1,0,0]=3 5235 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)F 22a_100000185862_100000210462 [0,1,0,0,1,0|1,0,0]=3 5236 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)I 11a_100000185761_100000210462 [0,1,0,0,1,0|1,0,0]=3 5237 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)I 1626a_100000185761_100000210462 [0,1,0,0,1,0|1,0,0]=3 5238 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)I 22a_100000185761_100000210462 [0,1,0,0,1,0|1,0,0]=3 5239 B19R2.11857 O=C(C=Cc1ccccc1)Nc2ccc(cc2)O 22a_100000185829_100000210462 [0,1,0,0,1,0|1,0,0]=3 5240 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(cc2)Br 1458a_100000740811_100000189115 [0,1,0,0,1,0|1,0,0]=3 5241 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(cc2)Cl 1458a_100000740811_100000694040 [0,1,0,0,1,0|1,0,0]=3 5242 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(cc2)F 1458a_100000740811_100000198546 [0,1,0,0,1,0|1,0,0]=3 5243 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(cc2)I 1458a_100000740811_100000189116 [0,1,0,0,1,0|1,0,0]=3 5244 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(cn2)Br 1458a_100000740811_100000702658 [0,1,0,0,1,0|2,0,0]=4 5245 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(cn2)Cl 1458a_100000740811_100012066911 [0,1,0,0,1,0|2,0,0]=4 5246 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(cn2)F 1458a_100000740811_100000703193 [0,1,0,0,1,0|2,0,0]=4 5247 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(nc2)Br 1458a_100000740811_100009831999 [0,1,0,0,1,0|2,0,0]=4 5248 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(nc2)Cl 1458a_100000740811_100000735431 [0,1,0,0,1,0|2,0,0]=4 5249 B19R2.11857 O=C(C=Cc1ccccn1)Cc2ccc(nc2)F 1458a_100000740811_100009820150 [0,1,0,0,1,0|2,0,0]=4 5250 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)Br 11a_100000210018_100000740811 [0,1,0,0,1,0|2,0,0]=4 5251 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)Br 22a_100000210018_100000740811 [0,1,0,0,1,0|2,0,0]=4 5252 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)Cl 11a_100000210052_100000740811 [0,1,0,0,1,0|2,0,0]=4 5253 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)Cl 22a_100000210052_100000740811 [0,1,0,0,1,0|2,0,0]=4 5254 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)F 11a_100000185862_100000740811 [0,1,0,0,1,0|2,0,0]=4 5255 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)F 22a_100000185862_100000740811 [0,1,0,0,1,0|2,0,0]=4 5256 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)I 11a_100000185761_100000740811 [0,1,0,0,1,0|2,0,0]=4 5257 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)I 22a_100000185761_100000740811 [0,1,0,0,1,0|2,0,0]=4 5258 B19R2.11857 O=C(C=Cc1ccccn1)Nc2ccc(cc2)O 22a_100000185829_100000740811 [0,1,0,0,1,0|2,0,0]=4 5259 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(cc2)Br 1458a_100000735890_100000189115 [0,1,0,0,1,0|1,0,0]=3 5260 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(cc2)Cl 1458a_100000735890_100000694040 [0,1,0,0,1,0|1,0,0]=3 5261 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(cc2)F 1458a_100000735890_100000198546 [0,1,0,0,1,0|1,0,0]=3 5262 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(cc2)I 1458a_100000735890_100000189116 [0,1,0,0,1,0|1,0,0]=3 5263 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(cn2)Br 1458a_100000735890_100000702658 [0,1,0,0,1,0|2,0,0]=4 5264 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(cn2)Cl 1458a_100000735890_100012066911 [0,1,0,0,1,0|2,0,0]=4 5265 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(cn2)F 1458a_100000735890_100000703193 [0,1,0,0,1,0|2,0,0]=4 5266 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(nc2)Br 1458a_100000735890_100009831999 [0,1,0,0,1,0|2,0,0]=4 5267 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(nc2)Cl 1458a_100000735890_100000735431 [0,1,0,0,1,0|2,0,0]=4 5268 B19R2.11857 O=C(C=Cc1cccnc1)Cc2ccc(nc2)F 1458a_100000735890_100009820150 [0,1,0,0,1,0|2,0,0]=4 5269 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)Br 11a_100000210018_100000735890 [0,1,0,0,1,0|2,0,0]=4 5270 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)Br 22a_100000210018_100000735890 [0,1,0,0,1,0|2,0,0]=4 5271 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)Cl 11a_100000210052_100000735890 [0,1,0,0,1,0|2,0,0]=4 5272 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)Cl 22a_100000210052_100000735890 [0,1,0,0,1,0|2,0,0]=4 5273 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)F 11a_100000185862_100000735890 [0,1,0,0,1,0|2,0,0]=4 5274 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)F 22a_100000185862_100000735890 [0,1,0,0,1,0|2,0,0]=4 5275 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)I 11a_100000185761_100000735890 [0,1,0,0,1,0|2,0,0]=4 5276 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)I 22a_100000185761_100000735890 [0,1,0,0,1,0|2,0,0]=4 5277 B19R2.11857 O=C(C=Cc1cccnc1)Nc2ccc(cc2)O 22a_100000185829_100000735890 [0,1,0,0,1,0|2,0,0]=4 5278 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(cc2)Br 1458a_100000682801_100000189115 [0,1,0,0,1,0|1,0,0]=3 5279 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(cc2)Cl 1458a_100000682801_100000694040 [0,1,0,0,1,0|1,0,0]=3 5280 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(cc2)F 1458a_100000682801_100000198546 [0,1,0,0,1,0|1,0,0]=3 5281 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(cc2)I 1458a_100000682801_100000189116 [0,1,0,0,1,0|1,0,0]=3 5282 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(cn2)Br 1458a_100000682801_100000702658 [0,1,0,0,1,0|2,0,0]=4 5283 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(cn2)Cl 1458a_100000682801_100012066911 [0,1,0,0,1,0|2,0,0]=4 5284 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(cn2)F 1458a_100000682801_100000703193 [0,1,0,0,1,0|2,0,0]=4 5285 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(nc2)Br 1458a_100000682801_100009831999 [0,1,0,0,1,0|2,0,0]=4 5286 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(nc2)Cl 1458a_100000682801_100000735431 [0,1,0,0,1,0|2,0,0]=4 5287 B19R2.11857 O=C(C=Cc1ccncc1)Cc2ccc(nc2)F 1458a_100000682801_100009820150 [0,1,0,0,1,0|2,0,0]=4 5288 B19R2.11857 O=C(C=Cc1ccncc1)Nc2ccc(cc2)Br 22a_100000210018_100000682801 [0,1,0,0,1,0|2,0,0]=4 5289 B19R2.11857 O=C(C=Cc1ccncc1)Nc2ccc(cc2)Cl 22a_100000210052_100000682801 [0,1,0,0,1,0|2,0,0]=4 5290 B19R2.11857 O=C(C=Cc1ccncc1)Nc2ccc(cc2)F 22a_100000185862_100000682801 [0,1,0,0,1,0|2,0,0]=4 5291 B19R2.11857 O=C(C=Cc1ccncc1)Nc2ccc(cc2)I 22a_100000185761_100000682801 [0,1,0,0,1,0|2,0,0]=4 5292 B19R2.11857 O=C(C=Cc1ccncc1)Nc2ccc(cc2)O 22a_100000185829_100000682801 [0,1,0,0,1,0|2,0,0]=4 5293 B19R2.11857 O=C(C=Cc1cncnc1)Cc2ccc(cc2)Br 6a_100000749868_100000691760 [0,1,0,0,1,0|2,0,0]=4 5294 B19R2.11857 O=C(C=Cc1cncnc1)Cc2ccc(cc2)Cl 6a_100000749868_100000747806 [0,1,0,0,1,0|2,0,0]=4 5295 B19R2.11857 O=C(C=Cc1cncnc1)Cc2ccc(cc2)F 6a_100000749868_100000745281 [0,1,0,0,1,0|2,0,0]=4 5296 B19R2.11857 O=C(C=Cc1cncnc1)Cc2ccc(cc2)O 6a_100000749868_100011218180 [0,1,0,0,1,0|2,0,0]=4 5297 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)Br 1458a_100000185753_100000189115 [0,1,0,0,1,0|0,0,2]=4 5298 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)Br 1458a_100000198978_100000765856 [0,1,0,0,1,0|0,0,2]=4 5299 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)Cl 1458a_100000185753_100000694040 [0,1,0,0,1,0|0,0,2]=4 5300 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)Cl 1458a_100000211027_100000765856 [0,1,0,0,1,0|0,0,2]=4 5301 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)F 1458a_100000185753_100000198546 [0,1,0,0,1,0|0,0,2]=4 5302 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)F 1458a_100000210951_100000765856 [0,1,0,0,1,0|0,0,2]=4 5303 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)I 1458a_100000185753_100000189116 [0,1,0,0,1,0|0,0,2]=4 5304 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)I 1458a_100000688869_100000765856 [0,1,0,0,1,0|0,0,2]=4 5305 B19R2.11857 O=C(CCc1ccccc1)Cc2ccc(cc2)O 1458a_100000198540_100000765856 [0,1,0,0,1,0|0,0,2]=4 5306 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)Br 11a_100000210018_100000185753 [0,1,0,0,1,0|2,0,0]=4 5307 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)Br 1626a_100000210018_100000185753 [0,1,0,0,1,0|2,0,0]=4 5308 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)Br 22a_100000210018_100000185753 [0,1,0,0,1,0|2,0,0]=4 5309 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)Br 527a_100000210018_100000185753 [0,1,0,0,1,0|2,0,0]=4 5310 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)Cl 11a_100000210052_100000185753 [0,1,0,0,1,0|2,0,0]=4 5311 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)Cl 1626a_100000210052_100000185753 [0,1,0,0,1,0|2,0,0]=4 5312 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)Cl 22a_100000210052_100000185753 [0,1,0,0,1,0|2,0,0]=4 5313 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)Cl 527a_100000210052_100000185753 [0,1,0,0,1,0|2,0,0]=4 5314 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)F 11a_100000185862_100000185753 [0,1,0,0,1,0|2,0,0]=4 5315 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)F 1626a_100000185862_100000185753 [0,1,0,0,1,0|2,0,0]=4 5316 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)F 22a_100000185862_100000185753 [0,1,0,0,1,0|2,0,0]=4 5317 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)F 527a_100000185862_100000185753 [0,1,0,0,1,0|2,0,0]=4 5318 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)I 11a_100000185761_100000185753 [0,1,0,0,1,0|2,0,0]=4 5319 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)I 1626a_100000185761_100000185753 [0,1,0,0,1,0|2,0,0]=4 5320 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)I 22a_100000185761_100000185753 [0,1,0,0,1,0|2,0,0]=4 5321 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)I 527a_100000185761_100000185753 [0,1,0,0,1,0|2,0,0]=4 5322 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)O 22a_100000185829_100000185753 [0,1,0,0,1,0|2,0,0]=4 5323 B19R2.11857 O=C(CCc1ccccc1)Nc2ccc(cc2)O 271570a_203496583355_100000580017 [0,1,0,0,1,0|2,0,0]=4 5324 B19R2.11857 O=C(CNc1ccccc1)Oc2ccc(cc2)Br 34a_100000106764_200010760497 [0,1,0,0,1,0|1,0,1]=4 5325 B19R2.11857 O=C(COc1ccccc1)Cc2ccc(cc2)Br 1458a_100000186222_100000189115 [0,1,0,0,1,0|1,0,1]=4 5326 B19R2.11857 O=C(COc1ccccc1)Cc2ccc(cc2)Cl 1458a_100000186222_100000694040 [0,1,0,0,1,0|1,0,1]=4 5327 B19R2.11857 O=C(COc1ccccc1)Cc2ccc(cc2)F 1458a_100000186222_100000198546 [0,1,0,0,1,0|1,0,1]=4 5328 B19R2.11857 O=C(COc1ccccc1)Cc2ccc(cc2)I 1458a_100000186222_100000189116 [0,1,0,0,1,0|1,0,1]=4 5329 B19R2.11857 O=C(COc1ccccc1)Oc2ccc(cc2)Br 34a_100000210340_200010760497 [0,1,0,0,1,0|1,0,1]=4 5330 B19R2.11857 O=C(COc1ccccc1)Oc2ccc(cc2)Br 7a_100000210340_200010760497 [0,1,0,0,1,0|1,0,1]=4 5331 B19R2.11857 O=C(CSc1ccccc1)Cc2ccc(cc2)Br 1458a_100000211596_100000189115 [0,1,0,0,1,0|1,0,1]=4 5332 B19R2.11857 O=C(CSc1ccccc1)Cc2ccc(cc2)Cl 1458a_100000211596_100000694040 [0,1,0,0,1,0|1,0,1]=4 5333 B19R2.11857 O=C(CSc1ccccc1)Cc2ccc(cc2)F 1458a_100000211596_100000198546 [0,1,0,0,1,0|1,0,1]=4 5334 B19R2.11857 O=C(CSc1ccccc1)Cc2ccc(cc2)I 1458a_100000211596_100000189116 [0,1,0,0,1,0|1,0,1]=4 5335 B19R2.11857 O=C(CSc1ccccc1)Oc2ccc(cc2)Br 62a_100000719477_200010760497 [0,1,0,0,1,0|1,0,1]=4 5336 B19R2.11857 O=C(CSc1ccccc1)Oc2ccc(cc2)Br 62a_200010760497_100000041952 [0,1,0,0,1,0|1,0,1]=4 5337 B19R2.11857 O=C(Cc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_100000198978 [0,1,0,0,1,0|1,0,1]=4 5338 B19R2.11857 O=C(Cc1ccc(cc1)Br)NCc2ccccc2 240690a_100015324214_100000198978 [0,1,0,0,1,0|1,0,1]=4 5339 B19R2.11857 O=C(Cc1ccc(cc1)Br)NCc2ccccc2 527a_100015324214_100000198978 [0,1,0,0,1,0|1,0,1]=4 5340 B19R2.11857 O=C(Cc1ccc(cc1)Br)NNc2ccccc2 22a_100015195140_100000198978 [0,1,0,0,1,0|2,0,0]=4 5341 B19R2.11857 O=C(Cc1ccc(cc1)Cl)NCc2ccccc2 11a_100015324214_100000211027 [0,1,0,0,1,0|1,0,1]=4 5342 B19R2.11857 O=C(Cc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100000211027 [0,1,0,0,1,0|1,0,1]=4 5343 B19R2.11857 O=C(Cc1ccc(cc1)Cl)NCc2ccccc2 527a_100015324214_100000211027 [0,1,0,0,1,0|1,0,1]=4 5344 B19R2.11857 O=C(Cc1ccc(cc1)Cl)NNc2ccccc2 22a_100015195140_100000211027 [0,1,0,0,1,0|2,0,0]=4 5345 B19R2.11857 O=C(Cc1ccc(cc1)F)NCc2ccccc2 11a_100015324214_100000210951 [0,1,0,0,1,0|1,0,1]=4 5346 B19R2.11857 O=C(Cc1ccc(cc1)F)NCc2ccccc2 1626a_100015324214_100000210951 [0,1,0,0,1,0|1,0,1]=4 5347 B19R2.11857 O=C(Cc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100000210951 [0,1,0,0,1,0|1,0,1]=4 5348 B19R2.11857 O=C(Cc1ccc(cc1)F)NCc2ccccc2 527a_100015324214_100000210951 [0,1,0,0,1,0|1,0,1]=4 5349 B19R2.11857 O=C(Cc1ccc(cc1)F)NNc2ccccc2 22a_100015195140_100000210951 [0,1,0,0,1,0|2,0,0]=4 5350 B19R2.11857 O=C(Cc1ccc(cc1)I)NCc2ccccc2 11a_100015324214_100000688869 [0,1,0,0,1,0|1,0,1]=4 5351 B19R2.11857 O=C(Cc1ccc(cc1)I)NCc2ccccc2 1626a_100015324214_100000688869 [0,1,0,0,1,0|1,0,1]=4 5352 B19R2.11857 O=C(Cc1ccc(cc1)I)NCc2ccccc2 240690a_100015324214_100000688869 [0,1,0,0,1,0|1,0,1]=4 5353 B19R2.11857 O=C(Cc1ccc(cc1)I)NCc2ccccc2 527a_100015324214_100000688869 [0,1,0,0,1,0|1,0,1]=4 5354 B19R2.11857 O=C(Cc1ccc(cc1)I)NNc2ccccc2 22a_100015195140_100000688869 [0,1,0,0,1,0|2,0,0]=4 5355 B19R2.11857 O=C(Cc1ccc(cc1)O)NCc2ccccc2 1626a_100015324214_100000198540 [0,1,0,0,1,0|1,0,1]=4 5356 B19R2.11857 O=C(Cc1ccc(cc1)O)NCc2ccccc2 240690a_100015324214_100000198540 [0,1,0,0,1,0|1,0,1]=4 5357 B19R2.11857 O=C(Cc1ccc(cc1)O)NCc2ccccc2 527a_100015324214_100000198540 [0,1,0,0,1,0|1,0,1]=4 5358 B19R2.11857 O=C(Cc1ccc(cc1)O)NNc2ccccc2 22a_100015195140_100000198540 [0,1,0,0,1,0|2,0,0]=4 5359 B19R2.11857 O=C(NCc1ccccc1)Nc2ccc(cc2)Br 2430a_100000210018_100015324214 [0,1,0,0,1,0|2,0,0]=4 5360 B19R2.11857 O=C(NCc1ccccc1)Nc2ccc(cc2)Cl 2430a_100000210052_100015324214 [0,1,0,0,1,0|2,0,0]=4 5361 B19R2.11857 O=C(NCc1ccccc1)Nc2ccc(cc2)F 2430a_100000185862_100015324214 [0,1,0,0,1,0|2,0,0]=4 5362 B19R2.11857 O=C(NCc1ccccc1)Nc2ccc(cc2)I 2430a_100000185761_100015324214 [0,1,0,0,1,0|2,0,0]=4 5363 B19R2.11857 O=C(NCc1ccccc1)Nc2ccc(cc2)O 2430a_100000185829_100015324214 [0,1,0,0,1,0|2,0,0]=4 5364 B19R2.11857 O=C(Nc1ccc(cc1)O)OCc2ccccc2 271570a_203496583355_100000155246 [0,1,0,0,1,0|1,0,0]=3 5365 B19R2.16158 C=C(C(=O)CCc1ccccc1)c2ccccc2 1458a_100000065200_100000765856 [0,1,0,0,1,0|1,0,0]=3 5366 B19R2.16158 C=C(C(=O)CCc1ccccn1)c2ccccc2 1458a_100000065200_100015183660 [0,1,0,0,1,0|2,0,0]=4 5367 B19R2.16158 C=C(C(=O)CCc1cccnc1)c2ccccc2 1458a_100000065200_200011713674 [0,1,0,0,1,0|2,0,0]=4 5368 B19R2.16158 C=C(C(=O)CCc1ccncc1)c2ccccc2 1458a_100000065200_100000723409 [0,1,0,0,1,0|2,0,0]=4 5369 B19R2.16158 C=C(C(=O)NCc1ccccc1)c2ccccc2 1626a_100015324214_100000065200 [0,1,0,0,1,0|1,0,0]=3 5370 B19R2.16158 C=C(C(=O)NCc1ccccn1)c2ccccc2 1626a_100000210449_100000065200 [0,1,0,0,1,0|2,0,0]=4 5371 B19R2.16158 C=C(C(=O)NCc1ccncc1)c2ccccc2 1626a_100000210450_100000065200 [0,1,0,0,1,0|2,0,0]=4 5372 B19R2.16158 C=C(C(=O)NNc1ccccc1)c2ccccc2 22a_100015195140_100000065200 [0,1,0,0,1,0|2,0,0]=4 5373 B19R2.16158 CC(C(=O)C#Cc1ccccc1)c2ccccc2 1458a_100000736102_100000230085 [0,1,0,0,1,0|0,0,2]=4 5374 B19R2.16158 CC(C(=O)C=Cc1ccccc1)c2ccccc2 1458a_100000210462_100000230085 [0,1,0,0,1,0|0,0,0]=2 5375 B19R2.16158 CC(C(=O)C=Cc1ccccc1)c2cnccn2 1458a_100000210462_200000703233 [0,1,0,0,1,0|2,0,0]=4 5376 B19R2.16158 CC(C(=O)C=Cc1ccccn1)c2ccccc2 1458a_100000740811_100000230085 [0,1,0,0,1,0|1,0,0]=3 5377 B19R2.16158 CC(C(=O)C=Cc1cccnc1)c2ccccc2 1458a_100000735890_100000230085 [0,1,0,0,1,0|1,0,0]=3 5378 B19R2.16158 CC(C(=O)C=Cc1ccncc1)c2ccccc2 1458a_100000682801_100000230085 [0,1,0,0,1,0|1,0,0]=3 5379 B19R2.16158 CC(C(=O)CCc1ccccc1)c2ccccc2 1458a_100000185753_100000230085 [0,1,0,0,1,0|0,0,2]=4 5380 B19R2.16158 CC(C(=O)COc1ccccc1)c2ccccc2 1458a_100000186222_100000230085 [0,1,0,0,1,0|1,0,1]=4 5381 B19R2.16158 CC(C(=O)CSc1ccccc1)c2ccccc2 1458a_100000211596_100000230085 [0,1,0,0,1,0|1,0,1]=4 5382 B19R2.16158 CC(OCc1ccccc1)C(=O)c2ccccc2 7a_100000210790_100000239700 [0,1,0,0,1,0|1,0,1]=4 5383 B19R2.16158 CN(C(=O)C=Cc1ccccc1)c2ccccc2 11a_100000210012_100000210462 [0,1,0,0,1,0|1,0,0]=3 5384 B19R2.16158 CN(C(=O)C=Cc1ccccc1)c2ccccc2 1626a_100000210012_100000210462 [0,1,0,0,1,0|1,0,0]=3 5385 B19R2.16158 CN(C(=O)C=Cc1ccccc1)c2ccccc2 22a_100000210012_100000210462 [0,1,0,0,1,0|1,0,0]=3 5386 B19R2.16158 CN(C(=O)C=Cc1ccccn1)c2ccccc2 11a_100000210012_100000740811 [0,1,0,0,1,0|2,0,0]=4 5387 B19R2.16158 CN(C(=O)C=Cc1ccccn1)c2ccccc2 22a_100000210012_100000740811 [0,1,0,0,1,0|2,0,0]=4 5388 B19R2.16158 CN(C(=O)C=Cc1cccnc1)c2ccccc2 11a_100000210012_100000735890 [0,1,0,0,1,0|2,0,0]=4 5389 B19R2.16158 CN(C(=O)C=Cc1cccnc1)c2ccccc2 22a_100000210012_100000735890 [0,1,0,0,1,0|2,0,0]=4 5390 B19R2.16158 CN(C(=O)C=Cc1ccncc1)c2ccccc2 22a_100000210012_100000682801 [0,1,0,0,1,0|2,0,0]=4 5391 B19R2.16158 CN(C(=O)CCc1ccccc1)c2ccccc2 11a_100000210012_100000185753 [0,1,0,0,1,0|2,0,0]=4 5392 B19R2.16158 CN(C(=O)CCc1ccccc1)c2ccccc2 1626a_100000210012_100000185753 [0,1,0,0,1,0|2,0,0]=4 5393 B19R2.16158 CN(C(=O)CCc1ccccc1)c2ccccc2 22a_100000210012_100000185753 [0,1,0,0,1,0|2,0,0]=4 5394 B19R2.16158 CN(C(=O)NCc1ccccc1)c2ccccc2 512a_100015324214_100000210012 [0,1,0,0,1,0|2,0,0]=4 5395 B19R2.16158 C[C@H](C(=O)CCc1ccccc1)c2ccccc2 1458a_100000751047_100000765856 [0,1,0,0,1,0|0,0,2]=4 5396 B19R2.16158 C[C@H](C(=O)NCc1ccccc1)c2ccccc2 11a_100015324214_100000751047 [0,1,0,0,1,0|1,0,1]=4 5397 B19R2.16158 C[C@H](C(=O)NCc1ccccc1)c2ccccc2 1626a_100015324214_100000751047 [0,1,0,0,1,0|1,0,1]=4 5398 B19R2.16158 C[C@H](C(=O)NCc1ccccc1)c2ccccc2 240690a_100015324214_100000751047 [0,1,0,0,1,0|1,0,1]=4 5399 B19R2.16158 C[C@H](C(=O)NCc1ccccc1)c2ccccc2 527a_100015324214_100000751047 [0,1,0,0,1,0|1,0,1]=4 5400 B19R2.16158 C[C@H](C(=O)NNc1ccccc1)c2ccccc2 22a_100015195140_100000751047 [0,1,0,0,1,0|2,0,0]=4 5401 B19R2.16158 O=C(CCc1ccccc1)C(F)c2ccccc2 1458a_100000698975_100000765856 [0,1,0,0,1,0|0,0,2]=4 5402 B19R2.16158 O=C(CCc1ccccc1)[C@H](O)c2ccccc2 1458a_100000684486_100000765856 [0,1,0,0,1,0|0,0,2]=4 5403 B19R2.16158 O=C(NCc1ccccc1)C(F)c2ccccc2 11a_100015324214_100000698975 [0,1,0,0,1,0|1,0,1]=4 5404 B19R2.16158 O=C(NCc1ccccc1)C(F)c2ccccc2 1626a_100015324214_100000698975 [0,1,0,0,1,0|1,0,1]=4 5405 B19R2.16158 O=C(NCc1ccccc1)C(F)c2ccccc2 240690a_100015324214_100000698975 [0,1,0,0,1,0|1,0,1]=4 5406 B19R2.16158 O=C(NCc1ccccc1)C(F)c2ccccc2 527a_100015324214_100000698975 [0,1,0,0,1,0|1,0,1]=4 5407 B19R2.16158 O=C(NCc1ccccc1)[C@H](O)c2ccccc2 240690a_100015324214_100000684486 [0,1,0,0,1,0|1,0,1]=4 5408 B19R2.16158 O=C(NNc1ccccc1)C(F)c2ccccc2 22a_100015195140_100000698975 [0,1,0,0,1,0|2,0,0]=4 5409 B19R2.16158 O=C(NNc1ccccc1)[C@H](O)c2ccccc2 22a_100015195140_100000684486 [0,1,0,0,1,0|2,0,0]=4 5410 B19R2.4141 Cc1ccc(o1)C=CC(=O)CCc2ccccc2 1458a_100000183563_100000765856 [0,1,0,0,1,0|2,0,0]=4 5411 B19R2.4141 Cc1ccc(o1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000183563 [0,1,0,0,1,0|2,0,0]=4 5412 B19R2.4141 Cc1ccc(o1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000183563 [0,1,0,0,1,0|2,0,0]=4 5413 B19R2.4141 Cc1ccc(o1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100000183563 [0,1,0,0,1,0|2,0,0]=4 5414 B19R2.4141 Cc1ccc(o1)C=CC(=O)NCc2ccccc2 527a_100015324214_100000183563 [0,1,0,0,1,0|2,0,0]=4 5415 B19R2.4141 Cc1ccc(o1)CNC(=O)C=Cc2ccccc2 11a_100011194323_100000210462 [0,1,0,0,1,0|2,0,0]=4 5416 B19R2.4141 Cc1ccc(o1)CNC(=O)C=Cc2ccccc2 1626a_100011194323_100000210462 [0,1,0,0,1,0|2,0,0]=4 5417 B19R2.4141 Cc1ccc(s1)C=CC(=O)CCc2ccccc2 1458a_100102558089_100000765856 [0,1,0,0,1,0|2,0,0]=4 5418 B19R2.4141 Cc1ccc(s1)C=CC(=O)NCc2ccccc2 11a_100015324214_100102558089 [0,1,0,0,1,0|2,0,0]=4 5419 B19R2.4141 Cc1ccc(s1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100102558089 [0,1,0,0,1,0|2,0,0]=4 5420 B19R2.4141 Cc1ccc(s1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100102558089 [0,1,0,0,1,0|2,0,0]=4 5421 B19R2.4141 Cc1ccc(s1)CNC(=O)C=Cc2ccccc2 11a_100000238518_100000210462 [0,1,0,0,1,0|2,0,0]=4 5422 B19R2.4141 Cc1ccc(s1)CNC(=O)C=Cc2ccccc2 1626a_100000238518_100000210462 [0,1,0,0,1,0|2,0,0]=4 5423 B19R2.4141 Cc1csc(c1)CNC(=O)C=Cc2ccccc2 11a_100015204214_100000210462 [0,1,0,0,1,0|2,0,0]=4 5424 B19R2.4141 Cc1csc(c1)CNC(=O)C=Cc2ccccc2 1626a_100015204214_100000210462 [0,1,0,0,1,0|2,0,0]=4 5425 B19R2.4141 O=C(C=Cc1cc(c[nH]1)I)CCc2ccccc2 6a_100000071964_100000210092 [0,1,0,0,1,0|2,0,0]=4 5426 B19R2.4141 O=C(C=Cc1cc(co1)Br)CCc2ccccc2 6a_100000747035_100000210092 [0,1,0,0,1,0|2,0,0]=4 5427 B19R2.4141 O=C(C=Cc1cc(cs1)Br)CCc2ccccc2 1458a_100102601599_100000765856 [0,1,0,0,1,0|2,0,0]=4 5428 B19R2.4141 O=C(C=Cc1cc(cs1)Br)CCc2ccccc2 6a_100000211722_100000210092 [0,1,0,0,1,0|2,0,0]=4 5429 B19R2.4141 O=C(C=Cc1cc(cs1)Br)NCc2ccccc2 11a_100015324214_100102601599 [0,1,0,0,1,0|2,0,0]=4 5430 B19R2.4141 O=C(C=Cc1cc(cs1)Br)NCc2ccccc2 1626a_100015324214_100102601599 [0,1,0,0,1,0|2,0,0]=4 5431 B19R2.4141 O=C(C=Cc1cc(cs1)Br)NCc2ccccc2 240690a_100015324214_100102601599 [0,1,0,0,1,0|2,0,0]=4 5432 B19R2.4141 O=C(C=Cc1cc(cs1)I)CCc2ccccc2 6a_100010179861_100000210092 [0,1,0,0,1,0|2,0,0]=4 5433 B19R2.4141 O=C(C=Cc1ccc(o1)Br)CCc2ccccc2 1458a_100000182240_100000765856 [0,1,0,0,1,0|2,0,0]=4 5434 B19R2.4141 O=C(C=Cc1ccc(o1)Br)NCc2ccccc2 11a_100015324214_100000182240 [0,1,0,0,1,0|2,0,0]=4 5435 B19R2.4141 O=C(C=Cc1ccc(o1)Br)NCc2ccccc2 240690a_100015324214_100000182240 [0,1,0,0,1,0|2,0,0]=4 5436 B19R2.4141 O=C(C=Cc1ccc(o1)I)CCc2ccccc2 1458a_100000679848_100000765856 [0,1,0,0,1,0|2,0,0]=4 5437 B19R2.4141 O=C(C=Cc1ccc(o1)I)CCc2ccccc2 6a_100000186757_100000210092 [0,1,0,0,1,0|2,0,0]=4 5438 B19R2.4141 O=C(C=Cc1ccc(o1)I)NCc2ccccc2 11a_100015324214_100000679848 [0,1,0,0,1,0|2,0,0]=4 5439 B19R2.4141 O=C(C=Cc1ccc(o1)I)NCc2ccccc2 1626a_100015324214_100000679848 [0,1,0,0,1,0|2,0,0]=4 5440 B19R2.4141 O=C(C=Cc1ccc(o1)I)NCc2ccccc2 240690a_100015324214_100000679848 [0,1,0,0,1,0|2,0,0]=4 5441 B19R2.4141 O=C(C=Cc1ccc(s1)Br)CCc2ccccc2 1458a_100102558031_100000765856 [0,1,0,0,1,0|2,0,0]=4 5442 B19R2.4141 O=C(C=Cc1ccc(s1)Br)NCc2ccccc2 11a_100015324214_100102558031 [0,1,0,0,1,0|2,0,0]=4 5443 B19R2.4141 O=C(C=Cc1ccc(s1)Br)NCc2ccccc2 1626a_100015324214_100102558031 [0,1,0,0,1,0|2,0,0]=4 5444 B19R2.4141 O=C(C=Cc1ccc(s1)Br)NCc2ccccc2 240690a_100015324214_100102558031 [0,1,0,0,1,0|2,0,0]=4 5445 B19R2.4141 O=C(C=Cc1ccc(s1)Cl)CCc2ccccc2 1458a_100102558157_100000765856 [0,1,0,0,1,0|2,0,0]=4 5446 B19R2.4141 O=C(C=Cc1ccc(s1)Cl)NCc2ccccc2 11a_100015324214_100102558157 [0,1,0,0,1,0|2,0,0]=4 5447 B19R2.4141 O=C(C=Cc1ccc(s1)Cl)NCc2ccccc2 1626a_100015324214_100102558157 [0,1,0,0,1,0|2,0,0]=4 5448 B19R2.4141 O=C(C=Cc1ccc(s1)Cl)NCc2ccccc2 240690a_100015324214_100102558157 [0,1,0,0,1,0|2,0,0]=4 5449 B19R2.4141 O=C(C=Cc1ccccc1)NCc2cc(cs2)Br 11a_100000741024_100000210462 [0,1,0,0,1,0|2,0,0]=4 5450 B19R2.4141 O=C(C=Cc1ccccc1)NCc2cc(cs2)Br 1626a_100000741024_100000210462 [0,1,0,0,1,0|2,0,0]=4 5451 B19R2.4141 O=C(C=Cc1ccccc1)NCc2ccc(o2)Br 11a_100000708654_100000210462 [0,1,0,0,1,0|2,0,0]=4 5452 B19R2.4141 O=C(C=Cc1ccccc1)NCc2ccc(o2)Br 1626a_100000708654_100000210462 [0,1,0,0,1,0|2,0,0]=4 5453 B19R2.4141 O=C(C=Cc1ccccc1)NCc2ccc(s2)Br 11a_100000737305_100000210462 [0,1,0,0,1,0|2,0,0]=4 5454 B19R2.4141 O=C(C=Cc1ccccc1)NCc2ccc(s2)Br 1626a_100000737305_100000210462 [0,1,0,0,1,0|2,0,0]=4 5455 B19R2.4141 O=C(C=Cc1ccccc1)NCc2ccc(s2)Cl 11a_100000737310_100000210462 [0,1,0,0,1,0|2,0,0]=4 5456 B19R2.4141 O=C(C=Cc1ccccc1)NCc2ccc(s2)Cl 1626a_100000737310_100000210462 [0,1,0,0,1,0|2,0,0]=4 5457 B19R2.4141 O=C(C=Cc1csc(c1)Br)CCc2ccccc2 6a_100000737087_100000210092 [0,1,0,0,1,0|2,0,0]=4 5458 B19R2.4488 Cc1ccccc1C=CC(=O)NCc2ccco2 1626a_100000185738_100016266485 [0,1,0,0,1,0|2,0,0]=4 5459 B19R2.4488 Cc1ccccc1C=CC(=O)NCc2cccs2 1626a_100000211653_100016266485 [0,1,0,0,1,0|2,0,0]=4 5460 B19R2.4488 Cc1ccccc1C=CC(=O)NCc2ccoc2 1626a_100015206860_100016266485 [0,1,0,0,1,0|2,0,0]=4 5461 B19R2.4488 Cc1ccccc1C=CC(=O)NCc2ccsc2 1626a_100000186416_100016266485 [0,1,0,0,1,0|2,0,0]=4 5462 B19R2.4488 Cc1ccccc1CCC(=O)C=Cc2cccs2 1458a_100000182767_100011713688 [0,1,0,0,1,0|2,0,0]=4 5463 B19R2.4488 Cc1ccccc1CCC(=O)C=Cc2ccoc2 1458a_100000238621_100011713688 [0,1,0,0,1,0|2,0,0]=4 5464 B19R2.4488 Cc1ccccc1CCC(=O)C=Cc2ccsc2 1458a_100000698588_100011713688 [0,1,0,0,1,0|2,0,0]=4 5465 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2cccs2 11a_100000174972_100000182767 [0,1,0,0,1,0|2,0,0]=4 5466 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2cccs2 1626a_100000174972_100000182767 [0,1,0,0,1,0|2,0,0]=4 5467 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2cccs2 240690a_100000174972_100000182767 [0,1,0,0,1,0|2,0,0]=4 5468 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2ccoc2 11a_100000174972_100000238621 [0,1,0,0,1,0|2,0,0]=4 5469 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2ccoc2 1626a_100000174972_100000238621 [0,1,0,0,1,0|2,0,0]=4 5470 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2ccoc2 240690a_100000174972_100000238621 [0,1,0,0,1,0|2,0,0]=4 5471 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2ccsc2 11a_100000174972_100000698588 [0,1,0,0,1,0|2,0,0]=4 5472 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2ccsc2 1626a_100000174972_100000698588 [0,1,0,0,1,0|2,0,0]=4 5473 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2ccsc2 240690a_100000174972_100000698588 [0,1,0,0,1,0|2,0,0]=4 5474 B19R2.4488 Cc1ccccc1CNC(=O)C=Cc2ccsc2 527a_100000174972_100000698588 [0,1,0,0,1,0|2,0,0]=4 5475 B19R2.4488 O=C(C=Cc1ccccc1Br)CCc2cccs2 1458a_100000719032_100000748579 [0,1,0,0,1,0|2,0,0]=4 5476 B19R2.4488 O=C(C=Cc1ccccc1Br)CCn2cccc2 1458a_100000719032_200000035178 [0,1,0,0,1,0|2,0,0]=4 5477 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccc[nH]2 11a_100000764082_100000719032 [0,1,0,0,1,0|2,0,0]=4 5478 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccc[nH]2 240690a_100000764082_100000719032 [0,1,0,0,1,0|2,0,0]=4 5479 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccco2 11a_100000185738_100000719032 [0,1,0,0,1,0|2,0,0]=4 5480 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccco2 1626a_100000185738_100000719032 [0,1,0,0,1,0|2,0,0]=4 5481 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccco2 240690a_100000185738_100000719032 [0,1,0,0,1,0|2,0,0]=4 5482 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2cccs2 11a_100000211653_100000719032 [0,1,0,0,1,0|2,0,0]=4 5483 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2cccs2 1626a_100000211653_100000719032 [0,1,0,0,1,0|2,0,0]=4 5484 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2cccs2 240690a_100000211653_100000719032 [0,1,0,0,1,0|2,0,0]=4 5485 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccoc2 11a_100015206860_100000719032 [0,1,0,0,1,0|2,0,0]=4 5486 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccoc2 1626a_100015206860_100000719032 [0,1,0,0,1,0|2,0,0]=4 5487 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccoc2 240690a_100015206860_100000719032 [0,1,0,0,1,0|2,0,0]=4 5488 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccsc2 11a_100000186416_100000719032 [0,1,0,0,1,0|2,0,0]=4 5489 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccsc2 1626a_100000186416_100000719032 [0,1,0,0,1,0|2,0,0]=4 5490 B19R2.4488 O=C(C=Cc1ccccc1Br)NCc2ccsc2 240690a_100000186416_100000719032 [0,1,0,0,1,0|2,0,0]=4 5491 B19R2.4488 O=C(C=Cc1ccccc1Cl)CCc2cccs2 1458a_100000720304_100000748579 [0,1,0,0,1,0|2,0,0]=4 5492 B19R2.4488 O=C(C=Cc1ccccc1Cl)CCn2cccc2 1458a_100000720304_200000035178 [0,1,0,0,1,0|2,0,0]=4 5493 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccc[nH]2 11a_100000764082_100000720304 [0,1,0,0,1,0|2,0,0]=4 5494 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccc[nH]2 240690a_100000764082_100000720304 [0,1,0,0,1,0|2,0,0]=4 5495 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccco2 11a_100000185738_100000720304 [0,1,0,0,1,0|2,0,0]=4 5496 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccco2 1626a_100000185738_100000720304 [0,1,0,0,1,0|2,0,0]=4 5497 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccco2 240690a_100000185738_100000720304 [0,1,0,0,1,0|2,0,0]=4 5498 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2cccs2 11a_100000211653_100000720304 [0,1,0,0,1,0|2,0,0]=4 5499 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2cccs2 1626a_100000211653_100000720304 [0,1,0,0,1,0|2,0,0]=4 5500 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2cccs2 240690a_100000211653_100000720304 [0,1,0,0,1,0|2,0,0]=4 5501 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccoc2 11a_100015206860_100000720304 [0,1,0,0,1,0|2,0,0]=4 5502 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccoc2 1626a_100015206860_100000720304 [0,1,0,0,1,0|2,0,0]=4 5503 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccoc2 240690a_100015206860_100000720304 [0,1,0,0,1,0|2,0,0]=4 5504 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccsc2 11a_100000186416_100000720304 [0,1,0,0,1,0|2,0,0]=4 5505 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccsc2 1626a_100000186416_100000720304 [0,1,0,0,1,0|2,0,0]=4 5506 B19R2.4488 O=C(C=Cc1ccccc1Cl)NCc2ccsc2 240690a_100000186416_100000720304 [0,1,0,0,1,0|2,0,0]=4 5507 B19R2.4488 O=C(C=Cc1ccccc1F)CCc2cccs2 1458a_100016256065_100000748579 [0,1,0,0,1,0|2,0,0]=4 5508 B19R2.4488 O=C(C=Cc1ccccc1F)CCn2cccc2 1458a_100016256065_200000035178 [0,1,0,0,1,0|2,0,0]=4 5509 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccc[nH]2 11a_100000764082_100016256065 [0,1,0,0,1,0|2,0,0]=4 5510 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccc[nH]2 240690a_100000764082_100016256065 [0,1,0,0,1,0|2,0,0]=4 5511 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccco2 11a_100000185738_100016256065 [0,1,0,0,1,0|2,0,0]=4 5512 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccco2 1626a_100000185738_100016256065 [0,1,0,0,1,0|2,0,0]=4 5513 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccco2 240690a_100000185738_100016256065 [0,1,0,0,1,0|2,0,0]=4 5514 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2cccs2 11a_100000211653_100016256065 [0,1,0,0,1,0|2,0,0]=4 5515 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2cccs2 1626a_100000211653_100016256065 [0,1,0,0,1,0|2,0,0]=4 5516 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2cccs2 240690a_100000211653_100016256065 [0,1,0,0,1,0|2,0,0]=4 5517 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccoc2 11a_100015206860_100016256065 [0,1,0,0,1,0|2,0,0]=4 5518 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccoc2 1626a_100015206860_100016256065 [0,1,0,0,1,0|2,0,0]=4 5519 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccoc2 240690a_100015206860_100016256065 [0,1,0,0,1,0|2,0,0]=4 5520 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccsc2 11a_100000186416_100016256065 [0,1,0,0,1,0|2,0,0]=4 5521 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccsc2 1626a_100000186416_100016256065 [0,1,0,0,1,0|2,0,0]=4 5522 B19R2.4488 O=C(C=Cc1ccccc1F)NCc2ccsc2 240690a_100000186416_100016256065 [0,1,0,0,1,0|2,0,0]=4 5523 B19R2.4488 O=C(C=Cc1ccccc1O)CCc2cccs2 1458a_100016263591_100000748579 [0,1,0,0,1,0|2,0,0]=4 5524 B19R2.4488 O=C(C=Cc1ccccc1O)CCn2cccc2 1458a_100016263591_200000035178 [0,1,0,0,1,0|2,0,0]=4 5525 B19R2.4488 O=C(C=Cc1cccs1)CCc2ccccc2Br 1458a_100000182767_100012161201 [0,1,0,0,1,0|2,0,0]=4 5526 B19R2.4488 O=C(C=Cc1cccs1)CCc2ccccc2Cl 1458a_100000182767_100011713703 [0,1,0,0,1,0|2,0,0]=4 5527 B19R2.4488 O=C(C=Cc1cccs1)CCc2ccccc2F 1458a_100000182767_100000720011 [0,1,0,0,1,0|2,0,0]=4 5528 B19R2.4488 O=C(C=Cc1cccs1)CCc2ccccc2O 1458a_100000182767_100000722297 [0,1,0,0,1,0|2,0,0]=4 5529 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2Br 11a_100000689332_100000182767 [0,1,0,0,1,0|2,0,0]=4 5530 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2Br 1626a_100000689332_100000182767 [0,1,0,0,1,0|2,0,0]=4 5531 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2Br 240690a_100000689332_100000182767 [0,1,0,0,1,0|2,0,0]=4 5532 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2Cl 11a_100000174879_100000182767 [0,1,0,0,1,0|2,0,0]=4 5533 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2Cl 1626a_100000174879_100000182767 [0,1,0,0,1,0|2,0,0]=4 5534 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2Cl 240690a_100000174879_100000182767 [0,1,0,0,1,0|2,0,0]=4 5535 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2F 11a_100000174869_100000182767 [0,1,0,0,1,0|2,0,0]=4 5536 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2F 1626a_100000174869_100000182767 [0,1,0,0,1,0|2,0,0]=4 5537 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2F 240690a_100000174869_100000182767 [0,1,0,0,1,0|2,0,0]=4 5538 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2I 11a_100015347259_100000182767 [0,1,0,0,1,0|2,0,0]=4 5539 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2I 1626a_100015347259_100000182767 [0,1,0,0,1,0|2,0,0]=4 5540 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2I 240690a_100015347259_100000182767 [0,1,0,0,1,0|2,0,0]=4 5541 B19R2.4488 O=C(C=Cc1cccs1)NCc2ccccc2O 240690a_100000185550_100000182767 [0,1,0,0,1,0|2,0,0]=4 5542 B19R2.4488 O=C(C=Cc1ccoc1)CCc2ccccc2Br 1458a_100000238621_100012161201 [0,1,0,0,1,0|2,0,0]=4 5543 B19R2.4488 O=C(C=Cc1ccoc1)CCc2ccccc2Cl 1458a_100000238621_100011713703 [0,1,0,0,1,0|2,0,0]=4 5544 B19R2.4488 O=C(C=Cc1ccoc1)CCc2ccccc2F 1458a_100000238621_100000720011 [0,1,0,0,1,0|2,0,0]=4 5545 B19R2.4488 O=C(C=Cc1ccoc1)CCc2ccccc2O 1458a_100000238621_100000722297 [0,1,0,0,1,0|2,0,0]=4 5546 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2Br 11a_100000689332_100000238621 [0,1,0,0,1,0|2,0,0]=4 5547 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2Br 1626a_100000689332_100000238621 [0,1,0,0,1,0|2,0,0]=4 5548 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2Br 240690a_100000689332_100000238621 [0,1,0,0,1,0|2,0,0]=4 5549 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2Cl 11a_100000174879_100000238621 [0,1,0,0,1,0|2,0,0]=4 5550 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2Cl 1626a_100000174879_100000238621 [0,1,0,0,1,0|2,0,0]=4 5551 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2Cl 240690a_100000174879_100000238621 [0,1,0,0,1,0|2,0,0]=4 5552 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2F 11a_100000174869_100000238621 [0,1,0,0,1,0|2,0,0]=4 5553 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2F 1626a_100000174869_100000238621 [0,1,0,0,1,0|2,0,0]=4 5554 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2F 240690a_100000174869_100000238621 [0,1,0,0,1,0|2,0,0]=4 5555 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2I 11a_100015347259_100000238621 [0,1,0,0,1,0|2,0,0]=4 5556 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2I 1626a_100015347259_100000238621 [0,1,0,0,1,0|2,0,0]=4 5557 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2I 240690a_100015347259_100000238621 [0,1,0,0,1,0|2,0,0]=4 5558 B19R2.4488 O=C(C=Cc1ccoc1)NCc2ccccc2O 240690a_100000185550_100000238621 [0,1,0,0,1,0|2,0,0]=4 5559 B19R2.4488 O=C(C=Cc1ccsc1)CCc2ccccc2Br 1458a_100000698588_100012161201 [0,1,0,0,1,0|2,0,0]=4 5560 B19R2.4488 O=C(C=Cc1ccsc1)CCc2ccccc2Cl 1458a_100000698588_100011713703 [0,1,0,0,1,0|2,0,0]=4 5561 B19R2.4488 O=C(C=Cc1ccsc1)CCc2ccccc2F 1458a_100000698588_100000720011 [0,1,0,0,1,0|2,0,0]=4 5562 B19R2.4488 O=C(C=Cc1ccsc1)CCc2ccccc2O 1458a_100000698588_100000722297 [0,1,0,0,1,0|2,0,0]=4 5563 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2Br 11a_100000689332_100000698588 [0,1,0,0,1,0|2,0,0]=4 5564 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2Br 1626a_100000689332_100000698588 [0,1,0,0,1,0|2,0,0]=4 5565 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2Br 240690a_100000689332_100000698588 [0,1,0,0,1,0|2,0,0]=4 5566 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2Br 527a_100000689332_100000698588 [0,1,0,0,1,0|2,0,0]=4 5567 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2Cl 11a_100000174879_100000698588 [0,1,0,0,1,0|2,0,0]=4 5568 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2Cl 1626a_100000174879_100000698588 [0,1,0,0,1,0|2,0,0]=4 5569 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2Cl 240690a_100000174879_100000698588 [0,1,0,0,1,0|2,0,0]=4 5570 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2Cl 527a_100000174879_100000698588 [0,1,0,0,1,0|2,0,0]=4 5571 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2F 11a_100000174869_100000698588 [0,1,0,0,1,0|2,0,0]=4 5572 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2F 1626a_100000174869_100000698588 [0,1,0,0,1,0|2,0,0]=4 5573 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2F 240690a_100000174869_100000698588 [0,1,0,0,1,0|2,0,0]=4 5574 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2F 527a_100000174869_100000698588 [0,1,0,0,1,0|2,0,0]=4 5575 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2I 11a_100015347259_100000698588 [0,1,0,0,1,0|2,0,0]=4 5576 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2I 1626a_100015347259_100000698588 [0,1,0,0,1,0|2,0,0]=4 5577 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2I 240690a_100015347259_100000698588 [0,1,0,0,1,0|2,0,0]=4 5578 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2I 527a_100015347259_100000698588 [0,1,0,0,1,0|2,0,0]=4 5579 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2O 240690a_100000185550_100000698588 [0,1,0,0,1,0|2,0,0]=4 5580 B19R2.4488 O=C(C=Cc1ccsc1)NCc2ccccc2O 527a_100000185550_100000698588 [0,1,0,0,1,0|2,0,0]=4 5581 B19R2.5578 Cc1ccsc1C=CC(=O)CCc2ccccc2 1458a_100000185125_100000765856 [0,1,0,0,1,0|2,0,0]=4 5582 B19R2.5578 Cc1ccsc1C=CC(=O)NCc2ccccc2 11a_100015324214_100000185125 [0,1,0,0,1,0|2,0,0]=4 5583 B19R2.5578 Cc1ccsc1C=CC(=O)NCc2ccccc2 1626a_100015324214_100000185125 [0,1,0,0,1,0|2,0,0]=4 5584 B19R2.5578 Cc1ccsc1C=CC(=O)NCc2ccccc2 240690a_100015324214_100000185125 [0,1,0,0,1,0|2,0,0]=4 5585 B19R2.5578 Cc1ccsc1C=CC(=O)NCc2ccccc2 527a_100015324214_100000185125 [0,1,0,0,1,0|2,0,0]=4 5586 B19R2.5578 Cc1ccsc1CNC(=O)C=Cc2ccccc2 11a_100000238519_100000210462 [0,1,0,0,1,0|2,0,0]=4 5587 B19R2.5578 Cc1ccsc1CNC(=O)C=Cc2ccccc2 1626a_100000238519_100000210462 [0,1,0,0,1,0|2,0,0]=4 5588 B19R2.5578 Cn1cccc1CNC(=O)C=Cc2ccccc2 11a_100011219357_100000210462 [0,1,0,0,1,0|2,0,0]=4 5589 B19R2.5578 Cn1cccc1CNC(=O)C=Cc2ccccc2 1626a_100011219357_100000210462 [0,1,0,0,1,0|2,0,0]=4 5590 B19R2.5578 O=C(C=Cc1ccccc1)NCc2ccsc2Br 11a_100000727803_100000210462 [0,1,0,0,1,0|2,0,0]=4 5591 B19R2.5578 O=C(C=Cc1ccccc1)NCc2ccsc2Br 1626a_100000727803_100000210462 [0,1,0,0,1,0|2,0,0]=4 5592 B19R2.5578 O=C(C=Cc1ccccc1)NCc2sccc2Cl 11a_100011934584_100000210462 [0,1,0,0,1,0|2,0,0]=4 5593 B19R2.5578 O=C(C=Cc1ccccc1)NCc2sccc2Cl 1626a_100011934584_100000210462 [0,1,0,0,1,0|2,0,0]=4 5594 B19R2.11862 Cc1ccc(cc1)C=CC(=O)CCc2cccs2 1458a_100000716854_100000748579 [0,1,0,0,1,0|2,0,0]=4 5595 B19R2.11862 Cc1ccc(cc1)C=CC(=O)CCn2cccc2 1458a_100000716854_200000035178 [0,1,0,0,1,0|2,0,0]=4 5596 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccc[nH]2 11a_100000764082_100000716854 [0,1,0,0,1,0|2,0,0]=4 5597 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccc[nH]2 240690a_100000764082_100000716854 [0,1,0,0,1,0|2,0,0]=4 5598 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccco2 11a_100000185738_100000716854 [0,1,0,0,1,0|2,0,0]=4 5599 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccco2 1626a_100000185738_100000716854 [0,1,0,0,1,0|2,0,0]=4 5600 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccco2 240690a_100000185738_100000716854 [0,1,0,0,1,0|2,0,0]=4 5601 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2cccs2 11a_100000211653_100000716854 [0,1,0,0,1,0|2,0,0]=4 5602 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2cccs2 1626a_100000211653_100000716854 [0,1,0,0,1,0|2,0,0]=4 5603 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2cccs2 240690a_100000211653_100000716854 [0,1,0,0,1,0|2,0,0]=4 5604 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccoc2 11a_100015206860_100000716854 [0,1,0,0,1,0|2,0,0]=4 5605 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccoc2 1626a_100015206860_100000716854 [0,1,0,0,1,0|2,0,0]=4 5606 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccoc2 240690a_100015206860_100000716854 [0,1,0,0,1,0|2,0,0]=4 5607 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccsc2 11a_100000186416_100000716854 [0,1,0,0,1,0|2,0,0]=4 5608 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccsc2 1626a_100000186416_100000716854 [0,1,0,0,1,0|2,0,0]=4 5609 B19R2.11862 Cc1ccc(cc1)C=CC(=O)NCc2ccsc2 240690a_100000186416_100000716854 [0,1,0,0,1,0|2,0,0]=4 5610 B19R2.11862 Cc1ccc(cc1)CCC(=O)C=Cc2cccs2 1458a_100000182767_100011713686 [0,1,0,0,1,0|2,0,0]=4 5611 B19R2.11862 Cc1ccc(cc1)CCC(=O)C=Cc2ccoc2 1458a_100000238621_100011713686 [0,1,0,0,1,0|2,0,0]=4 5612 B19R2.11862 Cc1ccc(cc1)CCC(=O)C=Cc2ccsc2 1458a_100000698588_100011713686 [0,1,0,0,1,0|2,0,0]=4 5613 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2cccs2 11a_100000174908_100000182767 [0,1,0,0,1,0|2,0,0]=4 5614 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2cccs2 1626a_100000174908_100000182767 [0,1,0,0,1,0|2,0,0]=4 5615 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2cccs2 240690a_100000174908_100000182767 [0,1,0,0,1,0|2,0,0]=4 5616 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2ccoc2 11a_100000174908_100000238621 [0,1,0,0,1,0|2,0,0]=4 5617 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2ccoc2 1626a_100000174908_100000238621 [0,1,0,0,1,0|2,0,0]=4 5618 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2ccoc2 240690a_100000174908_100000238621 [0,1,0,0,1,0|2,0,0]=4 5619 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2ccsc2 11a_100000174908_100000698588 [0,1,0,0,1,0|2,0,0]=4 5620 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2ccsc2 1626a_100000174908_100000698588 [0,1,0,0,1,0|2,0,0]=4 5621 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2ccsc2 240690a_100000174908_100000698588 [0,1,0,0,1,0|2,0,0]=4 5622 B19R2.11862 Cc1ccc(cc1)CNC(=O)C=Cc2ccsc2 527a_100000174908_100000698588 [0,1,0,0,1,0|2,0,0]=4 5623 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)CCc2cccs2 1458a_100016267368_100000748579 [0,1,0,0,1,0|2,0,0]=4 5624 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)CCn2cccc2 1458a_100016267368_200000035178 [0,1,0,0,1,0|2,0,0]=4 5625 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2ccc[nH]2 11a_100000764082_100016267368 [0,1,0,0,1,0|2,0,0]=4 5626 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2ccco2 11a_100000185738_100016267368 [0,1,0,0,1,0|2,0,0]=4 5627 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2ccco2 1626a_100000185738_100016267368 [0,1,0,0,1,0|2,0,0]=4 5628 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2cccs2 11a_100000211653_100016267368 [0,1,0,0,1,0|2,0,0]=4 5629 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2cccs2 1626a_100000211653_100016267368 [0,1,0,0,1,0|2,0,0]=4 5630 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2ccoc2 11a_100015206860_100016267368 [0,1,0,0,1,0|2,0,0]=4 5631 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2ccoc2 1626a_100015206860_100016267368 [0,1,0,0,1,0|2,0,0]=4 5632 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2ccsc2 11a_100000186416_100016267368 [0,1,0,0,1,0|2,0,0]=4 5633 B19R2.11862 O=C(C=Cc1ccc(cc1)Br)NCc2ccsc2 1626a_100000186416_100016267368 [0,1,0,0,1,0|2,0,0]=4 5634 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)CCc2cccs2 1458a_100000184863_100000748579 [0,1,0,0,1,0|2,0,0]=4 5635 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)CCn2cccc2 1458a_100000184863_200000035178 [0,1,0,0,1,0|2,0,0]=4 5636 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc[nH]2 11a_100000764082_100000184863 [0,1,0,0,1,0|2,0,0]=4 5637 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc[nH]2 240690a_100000764082_100000184863 [0,1,0,0,1,0|2,0,0]=4 5638 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccco2 11a_100000185738_100000184863 [0,1,0,0,1,0|2,0,0]=4 5639 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccco2 1626a_100000185738_100000184863 [0,1,0,0,1,0|2,0,0]=4 5640 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccco2 240690a_100000185738_100000184863 [0,1,0,0,1,0|2,0,0]=4 5641 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2cccs2 11a_100000211653_100000184863 [0,1,0,0,1,0|2,0,0]=4 5642 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2cccs2 1626a_100000211653_100000184863 [0,1,0,0,1,0|2,0,0]=4 5643 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2cccs2 240690a_100000211653_100000184863 [0,1,0,0,1,0|2,0,0]=4 5644 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccoc2 11a_100015206860_100000184863 [0,1,0,0,1,0|2,0,0]=4 5645 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccoc2 1626a_100015206860_100000184863 [0,1,0,0,1,0|2,0,0]=4 5646 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccoc2 240690a_100015206860_100000184863 [0,1,0,0,1,0|2,0,0]=4 5647 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccsc2 11a_100000186416_100000184863 [0,1,0,0,1,0|2,0,0]=4 5648 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccsc2 1626a_100000186416_100000184863 [0,1,0,0,1,0|2,0,0]=4 5649 B19R2.11862 O=C(C=Cc1ccc(cc1)Cl)NCc2ccsc2 240690a_100000186416_100000184863 [0,1,0,0,1,0|2,0,0]=4 5650 B19R2.11862 O=C(C=Cc1ccc(cc1)F)CCc2cccs2 1458a_100000182136_100000748579 [0,1,0,0,1,0|2,0,0]=4 5651 B19R2.11862 O=C(C=Cc1ccc(cc1)F)CCn2cccc2 1458a_100000182136_200000035178 [0,1,0,0,1,0|2,0,0]=4 5652 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccc[nH]2 11a_100000764082_100000182136 [0,1,0,0,1,0|2,0,0]=4 5653 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccc[nH]2 240690a_100000764082_100000182136 [0,1,0,0,1,0|2,0,0]=4 5654 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccco2 11a_100000185738_100000182136 [0,1,0,0,1,0|2,0,0]=4 5655 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccco2 1626a_100000185738_100000182136 [0,1,0,0,1,0|2,0,0]=4 5656 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccco2 240690a_100000185738_100000182136 [0,1,0,0,1,0|2,0,0]=4 5657 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2cccs2 11a_100000211653_100000182136 [0,1,0,0,1,0|2,0,0]=4 5658 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2cccs2 1626a_100000211653_100000182136 [0,1,0,0,1,0|2,0,0]=4 5659 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2cccs2 240690a_100000211653_100000182136 [0,1,0,0,1,0|2,0,0]=4 5660 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccoc2 11a_100015206860_100000182136 [0,1,0,0,1,0|2,0,0]=4 5661 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccoc2 1626a_100015206860_100000182136 [0,1,0,0,1,0|2,0,0]=4 5662 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccoc2 240690a_100015206860_100000182136 [0,1,0,0,1,0|2,0,0]=4 5663 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccsc2 11a_100000186416_100000182136 [0,1,0,0,1,0|2,0,0]=4 5664 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccsc2 1626a_100000186416_100000182136 [0,1,0,0,1,0|2,0,0]=4 5665 B19R2.11862 O=C(C=Cc1ccc(cc1)F)NCc2ccsc2 240690a_100000186416_100000182136 [0,1,0,0,1,0|2,0,0]=4 5666 B19R2.11862 O=C(C=Cc1ccc(cc1)I)CCc2cccs2 1458a_100102526154_100000748579 [0,1,0,0,1,0|2,0,0]=4 5667 B19R2.11862 O=C(C=Cc1ccc(cc1)I)CCn2cccc2 1458a_100102526154_200000035178 [0,1,0,0,1,0|2,0,0]=4 5668 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccc[nH]2 11a_100000764082_100102526154 [0,1,0,0,1,0|2,0,0]=4 5669 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccc[nH]2 240690a_100000764082_100102526154 [0,1,0,0,1,0|2,0,0]=4 5670 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccco2 11a_100000185738_100102526154 [0,1,0,0,1,0|2,0,0]=4 5671 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccco2 1626a_100000185738_100102526154 [0,1,0,0,1,0|2,0,0]=4 5672 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccco2 240690a_100000185738_100102526154 [0,1,0,0,1,0|2,0,0]=4 5673 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2cccs2 11a_100000211653_100102526154 [0,1,0,0,1,0|2,0,0]=4 5674 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2cccs2 1626a_100000211653_100102526154 [0,1,0,0,1,0|2,0,0]=4 5675 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2cccs2 240690a_100000211653_100102526154 [0,1,0,0,1,0|2,0,0]=4 5676 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccoc2 11a_100015206860_100102526154 [0,1,0,0,1,0|2,0,0]=4 5677 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccoc2 1626a_100015206860_100102526154 [0,1,0,0,1,0|2,0,0]=4 5678 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccoc2 240690a_100015206860_100102526154 [0,1,0,0,1,0|2,0,0]=4 5679 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccsc2 11a_100000186416_100102526154 [0,1,0,0,1,0|2,0,0]=4 5680 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccsc2 1626a_100000186416_100102526154 [0,1,0,0,1,0|2,0,0]=4 5681 B19R2.11862 O=C(C=Cc1ccc(cc1)I)NCc2ccsc2 240690a_100000186416_100102526154 [0,1,0,0,1,0|2,0,0]=4 5682 B19R2.11862 O=C(C=Cc1ccc(cc1)O)NCc2ccc[nH]2 240690a_100000764082_100016269017 [0,1,0,0,1,0|2,0,0]=4 5683 B19R2.11862 O=C(C=Cc1ccc(cc1)O)NCc2ccco2 240690a_100000185738_100016269017 [0,1,0,0,1,0|2,0,0]=4 5684 B19R2.11862 O=C(C=Cc1ccc(cc1)O)NCc2cccs2 240690a_100000211653_100016269017 [0,1,0,0,1,0|2,0,0]=4 5685 B19R2.11862 O=C(C=Cc1ccc(cc1)O)NCc2ccoc2 240690a_100015206860_100016269017 [0,1,0,0,1,0|2,0,0]=4 5686 B19R2.11862 O=C(C=Cc1ccc(cc1)O)NCc2ccsc2 240690a_100000186416_100016269017 [0,1,0,0,1,0|2,0,0]=4 5687 B19R2.11862 O=C(C=Cc1cccs1)CCc2ccc(cc2)Br 1458a_100000182767_100011740612 [0,1,0,0,1,0|2,0,0]=4 5688 B19R2.11862 O=C(C=Cc1cccs1)CCc2ccc(cc2)Cl 1458a_100000182767_100011713675 [0,1,0,0,1,0|2,0,0]=4 5689 B19R2.11862 O=C(C=Cc1cccs1)CCc2ccc(cc2)F 1458a_100000182767_100011217392 [0,1,0,0,1,0|2,0,0]=4 5690 B19R2.11862 O=C(C=Cc1cccs1)CCc2ccc(cc2)O 1458a_100000182767_100009816426 [0,1,0,0,1,0|2,0,0]=4 5691 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)Br 11a_100000174875_100000182767 [0,1,0,0,1,0|2,0,0]=4 5692 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)Br 1626a_100000174875_100000182767 [0,1,0,0,1,0|2,0,0]=4 5693 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)Br 240690a_100000174875_100000182767 [0,1,0,0,1,0|2,0,0]=4 5694 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)Cl 11a_100000174871_100000182767 [0,1,0,0,1,0|2,0,0]=4 5695 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)Cl 1626a_100000174871_100000182767 [0,1,0,0,1,0|2,0,0]=4 5696 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)Cl 240690a_100000174871_100000182767 [0,1,0,0,1,0|2,0,0]=4 5697 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)F 11a_100000174882_100000182767 [0,1,0,0,1,0|2,0,0]=4 5698 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)F 1626a_100000174882_100000182767 [0,1,0,0,1,0|2,0,0]=4 5699 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)F 240690a_100000174882_100000182767 [0,1,0,0,1,0|2,0,0]=4 5700 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)I 11a_100016989417_100000182767 [0,1,0,0,1,0|2,0,0]=4 5701 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)I 1626a_100016989417_100000182767 [0,1,0,0,1,0|2,0,0]=4 5702 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)I 240690a_100016989417_100000182767 [0,1,0,0,1,0|2,0,0]=4 5703 B19R2.11862 O=C(C=Cc1cccs1)NCc2ccc(cc2)O 240690a_100000185549_100000182767 [0,1,0,0,1,0|2,0,0]=4 5704 B19R2.11862 O=C(C=Cc1ccoc1)CCc2ccc(cc2)Br 1458a_100000238621_100011740612 [0,1,0,0,1,0|2,0,0]=4 5705 B19R2.11862 O=C(C=Cc1ccoc1)CCc2ccc(cc2)Cl 1458a_100000238621_100011713675 [0,1,0,0,1,0|2,0,0]=4 5706 B19R2.11862 O=C(C=Cc1ccoc1)CCc2ccc(cc2)F 1458a_100000238621_100011217392 [0,1,0,0,1,0|2,0,0]=4 5707 B19R2.11862 O=C(C=Cc1ccoc1)CCc2ccc(cc2)O 1458a_100000238621_100009816426 [0,1,0,0,1,0|2,0,0]=4 5708 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)Br 11a_100000174875_100000238621 [0,1,0,0,1,0|2,0,0]=4 5709 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)Br 1626a_100000174875_100000238621 [0,1,0,0,1,0|2,0,0]=4 5710 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)Br 240690a_100000174875_100000238621 [0,1,0,0,1,0|2,0,0]=4 5711 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)Cl 11a_100000174871_100000238621 [0,1,0,0,1,0|2,0,0]=4 5712 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000238621 [0,1,0,0,1,0|2,0,0]=4 5713 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000238621 [0,1,0,0,1,0|2,0,0]=4 5714 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)F 11a_100000174882_100000238621 [0,1,0,0,1,0|2,0,0]=4 5715 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)F 1626a_100000174882_100000238621 [0,1,0,0,1,0|2,0,0]=4 5716 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)F 240690a_100000174882_100000238621 [0,1,0,0,1,0|2,0,0]=4 5717 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)I 11a_100016989417_100000238621 [0,1,0,0,1,0|2,0,0]=4 5718 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)I 1626a_100016989417_100000238621 [0,1,0,0,1,0|2,0,0]=4 5719 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)I 240690a_100016989417_100000238621 [0,1,0,0,1,0|2,0,0]=4 5720 B19R2.11862 O=C(C=Cc1ccoc1)NCc2ccc(cc2)O 240690a_100000185549_100000238621 [0,1,0,0,1,0|2,0,0]=4 5721 B19R2.11862 O=C(C=Cc1ccsc1)CCc2ccc(cc2)Br 1458a_100000698588_100011740612 [0,1,0,0,1,0|2,0,0]=4 5722 B19R2.11862 O=C(C=Cc1ccsc1)CCc2ccc(cc2)Cl 1458a_100000698588_100011713675 [0,1,0,0,1,0|2,0,0]=4 5723 B19R2.11862 O=C(C=Cc1ccsc1)CCc2ccc(cc2)F 1458a_100000698588_100011217392 [0,1,0,0,1,0|2,0,0]=4 5724 B19R2.11862 O=C(C=Cc1ccsc1)CCc2ccc(cc2)O 1458a_100000698588_100009816426 [0,1,0,0,1,0|2,0,0]=4 5725 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)Br 11a_100000174875_100000698588 [0,1,0,0,1,0|2,0,0]=4 5726 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)Br 1626a_100000174875_100000698588 [0,1,0,0,1,0|2,0,0]=4 5727 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)Br 240690a_100000174875_100000698588 [0,1,0,0,1,0|2,0,0]=4 5728 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)Br 527a_100000174875_100000698588 [0,1,0,0,1,0|2,0,0]=4 5729 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)Cl 11a_100000174871_100000698588 [0,1,0,0,1,0|2,0,0]=4 5730 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000698588 [0,1,0,0,1,0|2,0,0]=4 5731 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000698588 [0,1,0,0,1,0|2,0,0]=4 5732 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)Cl 527a_100000174871_100000698588 [0,1,0,0,1,0|2,0,0]=4 5733 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)F 11a_100000174882_100000698588 [0,1,0,0,1,0|2,0,0]=4 5734 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)F 1626a_100000174882_100000698588 [0,1,0,0,1,0|2,0,0]=4 5735 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)F 240690a_100000174882_100000698588 [0,1,0,0,1,0|2,0,0]=4 5736 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)F 527a_100000174882_100000698588 [0,1,0,0,1,0|2,0,0]=4 5737 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)I 11a_100016989417_100000698588 [0,1,0,0,1,0|2,0,0]=4 5738 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)I 1626a_100016989417_100000698588 [0,1,0,0,1,0|2,0,0]=4 5739 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)I 240690a_100016989417_100000698588 [0,1,0,0,1,0|2,0,0]=4 5740 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)I 527a_100016989417_100000698588 [0,1,0,0,1,0|2,0,0]=4 5741 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)O 240690a_100000185549_100000698588 [0,1,0,0,1,0|2,0,0]=4 5742 B19R2.11862 O=C(C=Cc1ccsc1)NCc2ccc(cc2)O 527a_100000185549_100000698588 [0,1,0,0,1,0|2,0,0]=4 5743 B19R2.16160 CC(=Cc1ccco1)C(=O)CCc2ccccc2 1458a_100011995979_100000765856 [0,1,0,0,1,0|2,0,0]=4 5744 B19R2.16160 CC(=Cc1ccco1)C(=O)NCc2ccccc2 11a_100015324214_100011995979 [0,1,0,0,1,0|2,0,0]=4 5745 B19R2.16160 CC(=Cc1ccco1)C(=O)NCc2ccccc2 1626a_100015324214_100011995979 [0,1,0,0,1,0|2,0,0]=4 5746 B19R2.16160 CC(=Cc1ccco1)C(=O)NCc2ccccc2 527a_100015324214_100011995979 [0,1,0,0,1,0|2,0,0]=4 5747 B19R2.16160 CN(Cc1ccco1)C(=O)C=Cc2ccccc2 11a_100000185268_100000210462 [0,1,0,0,1,0|2,0,0]=4 5748 B19R2.16160 CN(Cc1cccs1)C(=O)C=Cc2ccccc2 11a_100000184426_100000210462 [0,1,0,0,1,0|2,0,0]=4 5749 B19R2.16160 CN(Cc1ccsc1)C(=O)C=Cc2ccccc2 11a_100020654213_100000210462 [0,1,0,0,1,0|2,0,0]=4 5750 B19R2.16163 CC(NC(=O)C=Cc1ccccc1)c2cccs2 11a_100000703493_100000210462 [0,1,0,0,1,0|2,0,0]=4 5751 B19R2.16163 CC(NC(=O)C=Cc1ccccc1)c2cccs2 1626a_100000703493_100000210462 [0,1,0,0,1,0|2,0,0]=4 5752 B19R2.16163 CC(NC(=O)C=Cc1ccccc1)c2ccoc2 11a_100000690049_100000210462 [0,1,0,0,1,0|2,0,0]=4 5753 B19R2.16163 CC(NC(=O)C=Cc1ccccc1)c2ccoc2 1626a_100000690049_100000210462 [0,1,0,0,1,0|2,0,0]=4 5754 B19R2.16163 CC(NC(=O)C=Cc1ccccc1)c2ccsc2 11a_100000748604_100000210462 [0,1,0,0,1,0|2,0,0]=4 5755 B19R2.16163 CC(NC(=O)C=Cc1ccccc1)c2ccsc2 1626a_100000748604_100000210462 [0,1,0,0,1,0|2,0,0]=4 5756 B19R2.16163 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccco2 11a_100160469435_100000210462 [0,1,0,0,1,0|2,0,0]=4 5757 B19R2.16163 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccco2 1626a_100160469435_100000210462 [0,1,0,0,1,0|2,0,0]=4 5758 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)CCc2cccs2 1458a_100016990649_100000748579 [0,1,0,0,1,0|2,0,0]=4 5759 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)CCn2cccc2 1458a_100016990649_200000035178 [0,1,0,0,1,0|2,0,0]=4 5760 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccc[nH]2 11a_100000764082_100016990649 [0,1,0,0,1,0|2,0,0]=4 5761 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccc[nH]2 527a_100000764082_100016990649 [0,1,0,0,1,0|2,0,0]=4 5762 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccco2 11a_100000185738_100016990649 [0,1,0,0,1,0|2,0,0]=4 5763 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccco2 1626a_100000185738_100016990649 [0,1,0,0,1,0|2,0,0]=4 5764 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccco2 527a_100000185738_100016990649 [0,1,0,0,1,0|2,0,0]=4 5765 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2cccs2 11a_100000211653_100016990649 [0,1,0,0,1,0|2,0,0]=4 5766 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2cccs2 1626a_100000211653_100016990649 [0,1,0,0,1,0|2,0,0]=4 5767 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2cccs2 527a_100000211653_100016990649 [0,1,0,0,1,0|2,0,0]=4 5768 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccoc2 11a_100015206860_100016990649 [0,1,0,0,1,0|2,0,0]=4 5769 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccoc2 1626a_100015206860_100016990649 [0,1,0,0,1,0|2,0,0]=4 5770 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccoc2 527a_100015206860_100016990649 [0,1,0,0,1,0|2,0,0]=4 5771 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccsc2 11a_100000186416_100016990649 [0,1,0,0,1,0|2,0,0]=4 5772 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccsc2 1626a_100000186416_100016990649 [0,1,0,0,1,0|2,0,0]=4 5773 B19R2.16166 C/C(=C\c1ccccc1)/C(=O)NCc2ccsc2 527a_100000186416_100016990649 [0,1,0,0,1,0|2,0,0]=4 5774 B19R2.16166 CC(Cc1ccccc1)C(=O)C=Cc2cccs2 1458a_100000182767_200011218536 [0,1,0,0,1,0|2,0,0]=4 5775 B19R2.16166 CC(Cc1ccccc1)C(=O)C=Cc2ccoc2 1458a_100000238621_200011218536 [0,1,0,0,1,0|2,0,0]=4 5776 B19R2.16166 CC(Cc1ccccc1)C(=O)C=Cc2ccsc2 1458a_100000698588_200011218536 [0,1,0,0,1,0|2,0,0]=4 5777 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2cccs2 11a_100000186898_100000182767 [0,1,0,0,1,0|2,0,0]=4 5778 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2cccs2 1626a_100000186898_100000182767 [0,1,0,0,1,0|2,0,0]=4 5779 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2cccs2 240690a_100000186898_100000182767 [0,1,0,0,1,0|2,0,0]=4 5780 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2ccoc2 11a_100000186898_100000238621 [0,1,0,0,1,0|2,0,0]=4 5781 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2ccoc2 1626a_100000186898_100000238621 [0,1,0,0,1,0|2,0,0]=4 5782 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2ccoc2 240690a_100000186898_100000238621 [0,1,0,0,1,0|2,0,0]=4 5783 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2ccsc2 11a_100000186898_100000698588 [0,1,0,0,1,0|2,0,0]=4 5784 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2ccsc2 1626a_100000186898_100000698588 [0,1,0,0,1,0|2,0,0]=4 5785 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2ccsc2 240690a_100000186898_100000698588 [0,1,0,0,1,0|2,0,0]=4 5786 B19R2.16166 CN(Cc1ccccc1)C(=O)C=Cc2ccsc2 527a_100000186898_100000698588 [0,1,0,0,1,0|2,0,0]=4 5787 B19R2.16166 O=C(CCc1cccs1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000748579 [0,1,0,0,1,0|2,0,0]=4 5788 B19R2.16166 O=C(CCc1cccs1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000748579 [0,1,0,0,1,0|2,0,0]=4 5789 B19R2.16166 O=C(CCn1cccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200000035178 [0,1,0,0,1,0|2,0,0]=4 5790 B19R2.16166 O=C(CCn1cccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_200000035178 [0,1,0,0,1,0|2,0,0]=4 5791 B19R2.16166 O=C(NCc1ccc[nH]1)/C(=C/c2ccccc2)/Cl 11a_100000764082_200020598536 [0,1,0,0,1,0|2,0,0]=4 5792 B19R2.16166 O=C(NCc1ccc[nH]1)/C(=C/c2ccccc2)/Cl 240690a_100000764082_200020598536 [0,1,0,0,1,0|2,0,0]=4 5793 B19R2.16166 O=C(NCc1ccc[nH]1)/C(=C/c2ccccc2)/Cl 527a_100000764082_200020598536 [0,1,0,0,1,0|2,0,0]=4 5794 B19R2.16166 O=C(NCc1ccc[nH]1)/C(=C\c2ccccc2)/F 11a_100000764082_100020889036 [0,1,0,0,1,0|2,0,0]=4 5795 B19R2.16166 O=C(NCc1ccc[nH]1)/C(=C\c2ccccc2)/F 527a_100000764082_100020889036 [0,1,0,0,1,0|2,0,0]=4 5796 B19R2.16166 O=C(NCc1ccco1)/C(=C/c2ccccc2)/Cl 11a_100000185738_200020598536 [0,1,0,0,1,0|2,0,0]=4 5797 B19R2.16166 O=C(NCc1ccco1)/C(=C/c2ccccc2)/Cl 1626a_100000185738_200020598536 [0,1,0,0,1,0|2,0,0]=4 5798 B19R2.16166 O=C(NCc1ccco1)/C(=C/c2ccccc2)/Cl 240690a_100000185738_200020598536 [0,1,0,0,1,0|2,0,0]=4 5799 B19R2.16166 O=C(NCc1ccco1)/C(=C/c2ccccc2)/Cl 527a_100000185738_200020598536 [0,1,0,0,1,0|2,0,0]=4 5800 B19R2.16166 O=C(NCc1ccco1)/C(=C\c2ccccc2)/F 11a_100000185738_100020889036 [0,1,0,0,1,0|2,0,0]=4 5801 B19R2.16166 O=C(NCc1ccco1)/C(=C\c2ccccc2)/F 527a_100000185738_100020889036 [0,1,0,0,1,0|2,0,0]=4 5802 B19R2.16166 O=C(NCc1cccs1)/C(=C/c2ccccc2)/Cl 11a_100000211653_200020598536 [0,1,0,0,1,0|2,0,0]=4 5803 B19R2.16166 O=C(NCc1cccs1)/C(=C/c2ccccc2)/Cl 1626a_100000211653_200020598536 [0,1,0,0,1,0|2,0,0]=4 5804 B19R2.16166 O=C(NCc1cccs1)/C(=C/c2ccccc2)/Cl 240690a_100000211653_200020598536 [0,1,0,0,1,0|2,0,0]=4 5805 B19R2.16166 O=C(NCc1cccs1)/C(=C/c2ccccc2)/Cl 527a_100000211653_200020598536 [0,1,0,0,1,0|2,0,0]=4 5806 B19R2.16166 O=C(NCc1cccs1)/C(=C\c2ccccc2)/F 11a_100000211653_100020889036 [0,1,0,0,1,0|2,0,0]=4 5807 B19R2.16166 O=C(NCc1cccs1)/C(=C\c2ccccc2)/F 527a_100000211653_100020889036 [0,1,0,0,1,0|2,0,0]=4 5808 B19R2.16166 O=C(NCc1ccoc1)/C(=C/c2ccccc2)/Cl 11a_100015206860_200020598536 [0,1,0,0,1,0|2,0,0]=4 5809 B19R2.16166 O=C(NCc1ccoc1)/C(=C/c2ccccc2)/Cl 1626a_100015206860_200020598536 [0,1,0,0,1,0|2,0,0]=4 5810 B19R2.16166 O=C(NCc1ccoc1)/C(=C/c2ccccc2)/Cl 240690a_100015206860_200020598536 [0,1,0,0,1,0|2,0,0]=4 5811 B19R2.16166 O=C(NCc1ccoc1)/C(=C/c2ccccc2)/Cl 527a_100015206860_200020598536 [0,1,0,0,1,0|2,0,0]=4 5812 B19R2.16166 O=C(NCc1ccoc1)/C(=C\c2ccccc2)/F 11a_100015206860_100020889036 [0,1,0,0,1,0|2,0,0]=4 5813 B19R2.16166 O=C(NCc1ccoc1)/C(=C\c2ccccc2)/F 527a_100015206860_100020889036 [0,1,0,0,1,0|2,0,0]=4 5814 B19R2.16166 O=C(NCc1ccsc1)/C(=C/c2ccccc2)/Cl 11a_100000186416_200020598536 [0,1,0,0,1,0|2,0,0]=4 5815 B19R2.16166 O=C(NCc1ccsc1)/C(=C/c2ccccc2)/Cl 1626a_100000186416_200020598536 [0,1,0,0,1,0|2,0,0]=4 5816 B19R2.16166 O=C(NCc1ccsc1)/C(=C/c2ccccc2)/Cl 240690a_100000186416_200020598536 [0,1,0,0,1,0|2,0,0]=4 5817 B19R2.16166 O=C(NCc1ccsc1)/C(=C/c2ccccc2)/Cl 527a_100000186416_200020598536 [0,1,0,0,1,0|2,0,0]=4 5818 B19R2.16166 O=C(NCc1ccsc1)/C(=C\c2ccccc2)/F 11a_100000186416_100020889036 [0,1,0,0,1,0|2,0,0]=4 5819 B19R2.16166 O=C(NCc1ccsc1)/C(=C\c2ccccc2)/F 527a_100000186416_100020889036 [0,1,0,0,1,0|2,0,0]=4 5820 B19R2.16172 CC(=CC(=O)CCc1cccs1)c2ccccc2 1458a_100000743005_100000748579 [0,1,0,0,1,0|2,0,0]=4 5821 B19R2.16172 CC(=CC(=O)CCn1cccc1)c2ccccc2 1458a_100000743005_200000035178 [0,1,0,0,1,0|2,0,0]=4 5822 B19R2.16172 CC(=CC(=O)NCc1ccc[nH]1)c2ccccc2 11a_100000764082_100000743005 [0,1,0,0,1,0|2,0,0]=4 5823 B19R2.16172 CC(=CC(=O)NCc1ccc[nH]1)c2ccccc2 240690a_100000764082_100000743005 [0,1,0,0,1,0|2,0,0]=4 5824 B19R2.16172 CC(=CC(=O)NCc1ccc[nH]1)c2ccccc2 527a_100000764082_100000743005 [0,1,0,0,1,0|2,0,0]=4 5825 B19R2.16172 CC(=CC(=O)NCc1ccco1)c2ccccc2 11a_100000185738_100000743005 [0,1,0,0,1,0|2,0,0]=4 5826 B19R2.16172 CC(=CC(=O)NCc1ccco1)c2ccccc2 1626a_100000185738_100000743005 [0,1,0,0,1,0|2,0,0]=4 5827 B19R2.16172 CC(=CC(=O)NCc1ccco1)c2ccccc2 240690a_100000185738_100000743005 [0,1,0,0,1,0|2,0,0]=4 5828 B19R2.16172 CC(=CC(=O)NCc1ccco1)c2ccccc2 527a_100000185738_100000743005 [0,1,0,0,1,0|2,0,0]=4 5829 B19R2.16172 CC(=CC(=O)NCc1cccs1)c2ccccc2 11a_100000211653_100000743005 [0,1,0,0,1,0|2,0,0]=4 5830 B19R2.16172 CC(=CC(=O)NCc1cccs1)c2ccccc2 1626a_100000211653_100000743005 [0,1,0,0,1,0|2,0,0]=4 5831 B19R2.16172 CC(=CC(=O)NCc1cccs1)c2ccccc2 240690a_100000211653_100000743005 [0,1,0,0,1,0|2,0,0]=4 5832 B19R2.16172 CC(=CC(=O)NCc1cccs1)c2ccccc2 527a_100000211653_100000743005 [0,1,0,0,1,0|2,0,0]=4 5833 B19R2.16172 CC(=CC(=O)NCc1ccoc1)c2ccccc2 11a_100015206860_100000743005 [0,1,0,0,1,0|2,0,0]=4 5834 B19R2.16172 CC(=CC(=O)NCc1ccoc1)c2ccccc2 1626a_100015206860_100000743005 [0,1,0,0,1,0|2,0,0]=4 5835 B19R2.16172 CC(=CC(=O)NCc1ccoc1)c2ccccc2 240690a_100015206860_100000743005 [0,1,0,0,1,0|2,0,0]=4 5836 B19R2.16172 CC(=CC(=O)NCc1ccoc1)c2ccccc2 527a_100015206860_100000743005 [0,1,0,0,1,0|2,0,0]=4 5837 B19R2.16172 CC(=CC(=O)NCc1ccsc1)c2ccccc2 11a_100000186416_100000743005 [0,1,0,0,1,0|2,0,0]=4 5838 B19R2.16172 CC(=CC(=O)NCc1ccsc1)c2ccccc2 1626a_100000186416_100000743005 [0,1,0,0,1,0|2,0,0]=4 5839 B19R2.16172 CC(=CC(=O)NCc1ccsc1)c2ccccc2 240690a_100000186416_100000743005 [0,1,0,0,1,0|2,0,0]=4 5840 B19R2.16172 CC(=CC(=O)NCc1ccsc1)c2ccccc2 527a_100000186416_100000743005 [0,1,0,0,1,0|2,0,0]=4 5841 B19R2.16172 CC(CC(=O)C=Cc1cccs1)c2ccccc2 1458a_100000182767_100000756946 [0,1,0,0,1,0|2,0,0]=4 5842 B19R2.16172 CC(CC(=O)C=Cc1ccoc1)c2ccccc2 1458a_100000238621_100000756946 [0,1,0,0,1,0|2,0,0]=4 5843 B19R2.16172 CC(CC(=O)C=Cc1ccsc1)c2ccccc2 1458a_100000698588_100000756946 [0,1,0,0,1,0|2,0,0]=4 5844 B19R2.16172 C[C@@H](NC(=O)C=Cc1cccs1)c2ccccc2 11a_100000751104_100000182767 [0,1,0,0,1,0|2,0,0]=4 5845 B19R2.16172 C[C@@H](NC(=O)C=Cc1cccs1)c2ccccc2 1626a_100000751104_100000182767 [0,1,0,0,1,0|2,0,0]=4 5846 B19R2.16172 C[C@@H](NC(=O)C=Cc1cccs1)c2ccccc2 240690a_100000751104_100000182767 [0,1,0,0,1,0|2,0,0]=4 5847 B19R2.16172 C[C@@H](NC(=O)C=Cc1ccoc1)c2ccccc2 11a_100000751104_100000238621 [0,1,0,0,1,0|2,0,0]=4 5848 B19R2.16172 C[C@@H](NC(=O)C=Cc1ccoc1)c2ccccc2 1626a_100000751104_100000238621 [0,1,0,0,1,0|2,0,0]=4 5849 B19R2.16172 C[C@@H](NC(=O)C=Cc1ccoc1)c2ccccc2 240690a_100000751104_100000238621 [0,1,0,0,1,0|2,0,0]=4 5850 B19R2.16172 C[C@@H](NC(=O)C=Cc1ccsc1)c2ccccc2 11a_100000751104_100000698588 [0,1,0,0,1,0|2,0,0]=4 5851 B19R2.16172 C[C@@H](NC(=O)C=Cc1ccsc1)c2ccccc2 1626a_100000751104_100000698588 [0,1,0,0,1,0|2,0,0]=4 5852 B19R2.16172 C[C@@H](NC(=O)C=Cc1ccsc1)c2ccccc2 240690a_100000751104_100000698588 [0,1,0,0,1,0|2,0,0]=4 5853 B19R2.16172 C[C@@H](NC(=O)C=Cc1ccsc1)c2ccccc2 527a_100000751104_100000698588 [0,1,0,0,1,0|2,0,0]=4 5854 B19R2.16172 O=C(C=Cc1cccs1)CC(O)c2ccccc2 1458a_100000182767_100000185958 [0,1,0,0,1,0|2,0,0]=4 5855 B19R2.16172 O=C(C=Cc1cccs1)C[C@@H](O)c2ccccc2 1458a_100000182767_100011933945 [0,1,0,0,1,0|2,0,0]=4 5856 B19R2.16172 O=C(C=Cc1ccoc1)CC(O)c2ccccc2 1458a_100000238621_100000185958 [0,1,0,0,1,0|2,0,0]=4 5857 B19R2.16172 O=C(C=Cc1ccoc1)C[C@@H](O)c2ccccc2 1458a_100000238621_100011933945 [0,1,0,0,1,0|2,0,0]=4 5858 B19R2.16172 O=C(C=Cc1ccsc1)CC(O)c2ccccc2 1458a_100000698588_100000185958 [0,1,0,0,1,0|2,0,0]=4 5859 B19R2.16172 O=C(C=Cc1ccsc1)C[C@@H](O)c2ccccc2 1458a_100000698588_100011933945 [0,1,0,0,1,0|2,0,0]=4 5860 B19R2.101114 Cc1cccc(c1)C=CC(=O)CCc2cccs2 1458a_100000690095_100000748579 [0,1,0,0,1,0|2,0,0]=4 5861 B19R2.101114 Cc1cccc(c1)C=CC(=O)CCn2cccc2 1458a_100000690095_200000035178 [0,1,0,0,1,0|2,0,0]=4 5862 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccc[nH]2 11a_100000764082_100000690095 [0,1,0,0,1,0|2,0,0]=4 5863 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccc[nH]2 240690a_100000764082_100000690095 [0,1,0,0,1,0|2,0,0]=4 5864 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccco2 11a_100000185738_100000690095 [0,1,0,0,1,0|2,0,0]=4 5865 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccco2 1626a_100000185738_100000690095 [0,1,0,0,1,0|2,0,0]=4 5866 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccco2 240690a_100000185738_100000690095 [0,1,0,0,1,0|2,0,0]=4 5867 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2cccs2 11a_100000211653_100000690095 [0,1,0,0,1,0|2,0,0]=4 5868 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2cccs2 1626a_100000211653_100000690095 [0,1,0,0,1,0|2,0,0]=4 5869 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2cccs2 240690a_100000211653_100000690095 [0,1,0,0,1,0|2,0,0]=4 5870 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccoc2 11a_100015206860_100000690095 [0,1,0,0,1,0|2,0,0]=4 5871 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccoc2 1626a_100015206860_100000690095 [0,1,0,0,1,0|2,0,0]=4 5872 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccoc2 240690a_100015206860_100000690095 [0,1,0,0,1,0|2,0,0]=4 5873 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccsc2 11a_100000186416_100000690095 [0,1,0,0,1,0|2,0,0]=4 5874 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccsc2 1626a_100000186416_100000690095 [0,1,0,0,1,0|2,0,0]=4 5875 B19R2.101114 Cc1cccc(c1)C=CC(=O)NCc2ccsc2 240690a_100000186416_100000690095 [0,1,0,0,1,0|2,0,0]=4 5876 B19R2.101114 Cc1cccc(c1)CCC(=O)C=Cc2cccs2 1458a_100000182767_100011713685 [0,1,0,0,1,0|2,0,0]=4 5877 B19R2.101114 Cc1cccc(c1)CCC(=O)C=Cc2ccoc2 1458a_100000238621_100011713685 [0,1,0,0,1,0|2,0,0]=4 5878 B19R2.101114 Cc1cccc(c1)CCC(=O)C=Cc2ccsc2 1458a_100000698588_100011713685 [0,1,0,0,1,0|2,0,0]=4 5879 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2cccs2 11a_100000185548_100000182767 [0,1,0,0,1,0|2,0,0]=4 5880 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2cccs2 1626a_100000185548_100000182767 [0,1,0,0,1,0|2,0,0]=4 5881 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2cccs2 240690a_100000185548_100000182767 [0,1,0,0,1,0|2,0,0]=4 5882 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2ccoc2 11a_100000185548_100000238621 [0,1,0,0,1,0|2,0,0]=4 5883 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2ccoc2 1626a_100000185548_100000238621 [0,1,0,0,1,0|2,0,0]=4 5884 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2ccoc2 240690a_100000185548_100000238621 [0,1,0,0,1,0|2,0,0]=4 5885 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2ccsc2 11a_100000185548_100000698588 [0,1,0,0,1,0|2,0,0]=4 5886 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2ccsc2 1626a_100000185548_100000698588 [0,1,0,0,1,0|2,0,0]=4 5887 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2ccsc2 240690a_100000185548_100000698588 [0,1,0,0,1,0|2,0,0]=4 5888 B19R2.101114 Cc1cccc(c1)CNC(=O)C=Cc2ccsc2 527a_100000185548_100000698588 [0,1,0,0,1,0|2,0,0]=4 5889 B19R2.101114 O=C(C=Cc1cccc(c1)Br)CCc2cccs2 1458a_100016258244_100000748579 [0,1,0,0,1,0|2,0,0]=4 5890 B19R2.101114 O=C(C=Cc1cccc(c1)Br)CCn2cccc2 1458a_100016258244_200000035178 [0,1,0,0,1,0|2,0,0]=4 5891 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccc[nH]2 11a_100000764082_100016258244 [0,1,0,0,1,0|2,0,0]=4 5892 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccc[nH]2 240690a_100000764082_100016258244 [0,1,0,0,1,0|2,0,0]=4 5893 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccco2 11a_100000185738_100016258244 [0,1,0,0,1,0|2,0,0]=4 5894 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccco2 1626a_100000185738_100016258244 [0,1,0,0,1,0|2,0,0]=4 5895 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccco2 240690a_100000185738_100016258244 [0,1,0,0,1,0|2,0,0]=4 5896 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2cccs2 11a_100000211653_100016258244 [0,1,0,0,1,0|2,0,0]=4 5897 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2cccs2 1626a_100000211653_100016258244 [0,1,0,0,1,0|2,0,0]=4 5898 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2cccs2 240690a_100000211653_100016258244 [0,1,0,0,1,0|2,0,0]=4 5899 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccoc2 11a_100015206860_100016258244 [0,1,0,0,1,0|2,0,0]=4 5900 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccoc2 1626a_100015206860_100016258244 [0,1,0,0,1,0|2,0,0]=4 5901 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccoc2 240690a_100015206860_100016258244 [0,1,0,0,1,0|2,0,0]=4 5902 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccsc2 11a_100000186416_100016258244 [0,1,0,0,1,0|2,0,0]=4 5903 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccsc2 1626a_100000186416_100016258244 [0,1,0,0,1,0|2,0,0]=4 5904 B19R2.101114 O=C(C=Cc1cccc(c1)Br)NCc2ccsc2 240690a_100000186416_100016258244 [0,1,0,0,1,0|2,0,0]=4 5905 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)CCc2cccs2 1458a_100000184502_100000748579 [0,1,0,0,1,0|2,0,0]=4 5906 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)CCn2cccc2 1458a_100000184502_200000035178 [0,1,0,0,1,0|2,0,0]=4 5907 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccc[nH]2 11a_100000764082_100000184502 [0,1,0,0,1,0|2,0,0]=4 5908 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccc[nH]2 240690a_100000764082_100000184502 [0,1,0,0,1,0|2,0,0]=4 5909 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccco2 11a_100000185738_100000184502 [0,1,0,0,1,0|2,0,0]=4 5910 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccco2 1626a_100000185738_100000184502 [0,1,0,0,1,0|2,0,0]=4 5911 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccco2 240690a_100000185738_100000184502 [0,1,0,0,1,0|2,0,0]=4 5912 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2cccs2 11a_100000211653_100000184502 [0,1,0,0,1,0|2,0,0]=4 5913 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2cccs2 1626a_100000211653_100000184502 [0,1,0,0,1,0|2,0,0]=4 5914 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2cccs2 240690a_100000211653_100000184502 [0,1,0,0,1,0|2,0,0]=4 5915 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccoc2 11a_100015206860_100000184502 [0,1,0,0,1,0|2,0,0]=4 5916 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccoc2 1626a_100015206860_100000184502 [0,1,0,0,1,0|2,0,0]=4 5917 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccoc2 240690a_100015206860_100000184502 [0,1,0,0,1,0|2,0,0]=4 5918 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccsc2 11a_100000186416_100000184502 [0,1,0,0,1,0|2,0,0]=4 5919 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccsc2 1626a_100000186416_100000184502 [0,1,0,0,1,0|2,0,0]=4 5920 B19R2.101114 O=C(C=Cc1cccc(c1)Cl)NCc2ccsc2 240690a_100000186416_100000184502 [0,1,0,0,1,0|2,0,0]=4 5921 B19R2.101114 O=C(C=Cc1cccc(c1)F)CCc2cccs2 1458a_100000718793_100000748579 [0,1,0,0,1,0|2,0,0]=4 5922 B19R2.101114 O=C(C=Cc1cccc(c1)F)CCn2cccc2 1458a_100000718793_200000035178 [0,1,0,0,1,0|2,0,0]=4 5923 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccc[nH]2 11a_100000764082_100000718793 [0,1,0,0,1,0|2,0,0]=4 5924 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccc[nH]2 240690a_100000764082_100000718793 [0,1,0,0,1,0|2,0,0]=4 5925 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccco2 11a_100000185738_100000718793 [0,1,0,0,1,0|2,0,0]=4 5926 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccco2 1626a_100000185738_100000718793 [0,1,0,0,1,0|2,0,0]=4 5927 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccco2 240690a_100000185738_100000718793 [0,1,0,0,1,0|2,0,0]=4 5928 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2cccs2 11a_100000211653_100000718793 [0,1,0,0,1,0|2,0,0]=4 5929 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2cccs2 1626a_100000211653_100000718793 [0,1,0,0,1,0|2,0,0]=4 5930 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2cccs2 240690a_100000211653_100000718793 [0,1,0,0,1,0|2,0,0]=4 5931 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccoc2 11a_100015206860_100000718793 [0,1,0,0,1,0|2,0,0]=4 5932 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccoc2 1626a_100015206860_100000718793 [0,1,0,0,1,0|2,0,0]=4 5933 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccoc2 240690a_100015206860_100000718793 [0,1,0,0,1,0|2,0,0]=4 5934 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccsc2 11a_100000186416_100000718793 [0,1,0,0,1,0|2,0,0]=4 5935 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccsc2 1626a_100000186416_100000718793 [0,1,0,0,1,0|2,0,0]=4 5936 B19R2.101114 O=C(C=Cc1cccc(c1)F)NCc2ccsc2 240690a_100000186416_100000718793 [0,1,0,0,1,0|2,0,0]=4 5937 B19R2.101114 O=C(C=Cc1cccc(c1)I)CCc2cccs2 1458a_100020647043_100000748579 [0,1,0,0,1,0|2,0,0]=4 5938 B19R2.101114 O=C(C=Cc1cccc(c1)I)CCn2cccc2 1458a_100020647043_200000035178 [0,1,0,0,1,0|2,0,0]=4 5939 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccc[nH]2 11a_100000764082_100020647043 [0,1,0,0,1,0|2,0,0]=4 5940 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccc[nH]2 240690a_100000764082_100020647043 [0,1,0,0,1,0|2,0,0]=4 5941 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccco2 11a_100000185738_100020647043 [0,1,0,0,1,0|2,0,0]=4 5942 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccco2 1626a_100000185738_100020647043 [0,1,0,0,1,0|2,0,0]=4 5943 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccco2 240690a_100000185738_100020647043 [0,1,0,0,1,0|2,0,0]=4 5944 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2cccs2 11a_100000211653_100020647043 [0,1,0,0,1,0|2,0,0]=4 5945 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2cccs2 1626a_100000211653_100020647043 [0,1,0,0,1,0|2,0,0]=4 5946 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2cccs2 240690a_100000211653_100020647043 [0,1,0,0,1,0|2,0,0]=4 5947 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccoc2 11a_100015206860_100020647043 [0,1,0,0,1,0|2,0,0]=4 5948 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccoc2 1626a_100015206860_100020647043 [0,1,0,0,1,0|2,0,0]=4 5949 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccoc2 240690a_100015206860_100020647043 [0,1,0,0,1,0|2,0,0]=4 5950 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccsc2 11a_100000186416_100020647043 [0,1,0,0,1,0|2,0,0]=4 5951 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccsc2 1626a_100000186416_100020647043 [0,1,0,0,1,0|2,0,0]=4 5952 B19R2.101114 O=C(C=Cc1cccc(c1)I)NCc2ccsc2 240690a_100000186416_100020647043 [0,1,0,0,1,0|2,0,0]=4 5953 B19R2.101114 O=C(C=Cc1cccs1)CCc2cccc(c2)Br 1458a_100000182767_100011740638 [0,1,0,0,1,0|2,0,0]=4 5954 B19R2.101114 O=C(C=Cc1cccs1)CCc2cccc(c2)Cl 1458a_100000182767_100011713710 [0,1,0,0,1,0|2,0,0]=4 5955 B19R2.101114 O=C(C=Cc1cccs1)CCc2cccc(c2)F 1458a_100000182767_100011217235 [0,1,0,0,1,0|2,0,0]=4 5956 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)Br 11a_100000174977_100000182767 [0,1,0,0,1,0|2,0,0]=4 5957 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)Br 1626a_100000174977_100000182767 [0,1,0,0,1,0|2,0,0]=4 5958 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)Br 240690a_100000174977_100000182767 [0,1,0,0,1,0|2,0,0]=4 5959 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)Cl 11a_100000174878_100000182767 [0,1,0,0,1,0|2,0,0]=4 5960 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)Cl 1626a_100000174878_100000182767 [0,1,0,0,1,0|2,0,0]=4 5961 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)Cl 240690a_100000174878_100000182767 [0,1,0,0,1,0|2,0,0]=4 5962 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)F 11a_100000174948_100000182767 [0,1,0,0,1,0|2,0,0]=4 5963 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)F 1626a_100000174948_100000182767 [0,1,0,0,1,0|2,0,0]=4 5964 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)F 240690a_100000174948_100000182767 [0,1,0,0,1,0|2,0,0]=4 5965 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)I 11a_100000106179_100000182767 [0,1,0,0,1,0|2,0,0]=4 5966 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)I 1626a_100000106179_100000182767 [0,1,0,0,1,0|2,0,0]=4 5967 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)I 240690a_100000106179_100000182767 [0,1,0,0,1,0|2,0,0]=4 5968 B19R2.101114 O=C(C=Cc1cccs1)NCc2cccc(c2)O 240690a_100000743036_100000182767 [0,1,0,0,1,0|2,0,0]=4 5969 B19R2.101114 O=C(C=Cc1ccoc1)CCc2cccc(c2)Br 1458a_100000238621_100011740638 [0,1,0,0,1,0|2,0,0]=4 5970 B19R2.101114 O=C(C=Cc1ccoc1)CCc2cccc(c2)Cl 1458a_100000238621_100011713710 [0,1,0,0,1,0|2,0,0]=4 5971 B19R2.101114 O=C(C=Cc1ccoc1)CCc2cccc(c2)F 1458a_100000238621_100011217235 [0,1,0,0,1,0|2,0,0]=4 5972 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)Br 11a_100000174977_100000238621 [0,1,0,0,1,0|2,0,0]=4 5973 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)Br 1626a_100000174977_100000238621 [0,1,0,0,1,0|2,0,0]=4 5974 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)Br 240690a_100000174977_100000238621 [0,1,0,0,1,0|2,0,0]=4 5975 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)Cl 11a_100000174878_100000238621 [0,1,0,0,1,0|2,0,0]=4 5976 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)Cl 1626a_100000174878_100000238621 [0,1,0,0,1,0|2,0,0]=4 5977 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)Cl 240690a_100000174878_100000238621 [0,1,0,0,1,0|2,0,0]=4 5978 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)F 11a_100000174948_100000238621 [0,1,0,0,1,0|2,0,0]=4 5979 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)F 1626a_100000174948_100000238621 [0,1,0,0,1,0|2,0,0]=4 5980 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)F 240690a_100000174948_100000238621 [0,1,0,0,1,0|2,0,0]=4 5981 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)I 11a_100000106179_100000238621 [0,1,0,0,1,0|2,0,0]=4 5982 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)I 1626a_100000106179_100000238621 [0,1,0,0,1,0|2,0,0]=4 5983 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)I 240690a_100000106179_100000238621 [0,1,0,0,1,0|2,0,0]=4 5984 B19R2.101114 O=C(C=Cc1ccoc1)NCc2cccc(c2)O 240690a_100000743036_100000238621 [0,1,0,0,1,0|2,0,0]=4 5985 B19R2.101114 O=C(C=Cc1ccsc1)CCc2cccc(c2)Br 1458a_100000698588_100011740638 [0,1,0,0,1,0|2,0,0]=4 5986 B19R2.101114 O=C(C=Cc1ccsc1)CCc2cccc(c2)Cl 1458a_100000698588_100011713710 [0,1,0,0,1,0|2,0,0]=4 5987 B19R2.101114 O=C(C=Cc1ccsc1)CCc2cccc(c2)F 1458a_100000698588_100011217235 [0,1,0,0,1,0|2,0,0]=4 5988 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)Br 11a_100000174977_100000698588 [0,1,0,0,1,0|2,0,0]=4 5989 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)Br 1626a_100000174977_100000698588 [0,1,0,0,1,0|2,0,0]=4 5990 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)Br 240690a_100000174977_100000698588 [0,1,0,0,1,0|2,0,0]=4 5991 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)Br 527a_100000174977_100000698588 [0,1,0,0,1,0|2,0,0]=4 5992 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)Cl 11a_100000174878_100000698588 [0,1,0,0,1,0|2,0,0]=4 5993 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)Cl 1626a_100000174878_100000698588 [0,1,0,0,1,0|2,0,0]=4 5994 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)Cl 240690a_100000174878_100000698588 [0,1,0,0,1,0|2,0,0]=4 5995 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)Cl 527a_100000174878_100000698588 [0,1,0,0,1,0|2,0,0]=4 5996 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)F 11a_100000174948_100000698588 [0,1,0,0,1,0|2,0,0]=4 5997 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)F 1626a_100000174948_100000698588 [0,1,0,0,1,0|2,0,0]=4 5998 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)F 240690a_100000174948_100000698588 [0,1,0,0,1,0|2,0,0]=4 5999 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)F 527a_100000174948_100000698588 [0,1,0,0,1,0|2,0,0]=4 6000 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)I 11a_100000106179_100000698588 [0,1,0,0,1,0|2,0,0]=4 6001 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)I 1626a_100000106179_100000698588 [0,1,0,0,1,0|2,0,0]=4 6002 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)I 240690a_100000106179_100000698588 [0,1,0,0,1,0|2,0,0]=4 6003 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)I 527a_100000106179_100000698588 [0,1,0,0,1,0|2,0,0]=4 6004 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)O 240690a_100000743036_100000698588 [0,1,0,0,1,0|2,0,0]=4 6005 B19R2.101114 O=C(C=Cc1ccsc1)NCc2cccc(c2)O 527a_100000743036_100000698588 [0,1,0,0,1,0|2,0,0]=4 6006 B21R2.4733 CC(=NNCc1cccc(c1)Br)C=Cc2ccccc2 4a_100000686200_100000204604 [0,1,0,0,0,1|2,0,0]=4 6007 B21R2.4733 CC(=NNCc1cccc(c1)Cl)C=Cc2ccccc2 4a_100000685877_100000204604 [0,1,0,0,0,1|2,0,0]=4 6008 B21R2.4733 CC(=NNCc1cccc(c1)F)C=Cc2ccccc2 4a_100016993953_100000204604 [0,1,0,0,0,1|2,0,0]=4 6009 B21R2.4733 Cc1cccc(c1)C=NNC(=O)CCc2ccccc2 4a_100000189782_100000211157 [0,1,0,0,0,1|2,0,0]=4 6010 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2 11a_100000749837_100000210462 [0,1,0,0,0,1|1,0,0]=3 6011 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2 1626a_100000749837_100000210462 [0,1,0,0,0,1|1,0,0]=3 6012 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccccn2 11a_100000749837_100000740811 [0,1,0,0,0,1|2,0,0]=4 6013 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccccn2 240690a_100000749837_100000740811 [0,1,0,0,0,1|2,0,0]=4 6014 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2cccnc2 11a_100000749837_100000735890 [0,1,0,0,0,1|2,0,0]=4 6015 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2cccnc2 240690a_100000749837_100000735890 [0,1,0,0,0,1|2,0,0]=4 6016 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccncc2 240690a_100000749837_100000682801 [0,1,0,0,0,1|2,0,0]=4 6017 B21R2.4733 Cc1cccc(c1)CCNC(=O)OCc2ccccc2 271570a_200010239705_100011215228 [0,1,0,0,0,1|0,0,2]=4 6018 B21R2.4733 Cc1cccc(c1)CNCC(=O)OCc2ccccc2 2230a_100000185548_100000753625 [0,1,0,0,0,1|0,0,2]=4 6019 B21R2.4733 Cc1cccc(c1)CNCC(=O)OCc2ccccc2 34a_100000185548_100000753625 [0,1,0,0,0,1|0,0,2]=4 6020 B21R2.4733 Cc1cccc(c1)CNNC(=O)C=Cc2ccccc2 22a_100000689898_100000210462 [0,1,0,0,0,1|1,0,0]=3 6021 B21R2.4733 Cc1cccc(c1)CNNC(=O)C=Cc2ccccn2 22a_100000689898_100000740811 [0,1,0,0,0,1|2,0,0]=4 6022 B21R2.4733 Cc1cccc(c1)CNNC(=O)C=Cc2cccnc2 22a_100000689898_100000735890 [0,1,0,0,0,1|2,0,0]=4 6023 B21R2.4733 Cc1cccc(c1)CNNC(=O)C=Cc2ccncc2 22a_100000689898_100000682801 [0,1,0,0,0,1|2,0,0]=4 6024 B21R2.4733 Cc1cccc(c1)COCC(=O)CCc2ccccc2 34a_100011217746_100012361361 [0,1,0,0,0,1|0,0,2]=4 6025 B21R2.4733 Cc1cccc(c1)COCC(=O)CCc2ccccc2 7a_100011217746_100012361361 [0,1,0,0,0,1|0,0,2]=4 6026 B21R2.4733 Cc1cccc(c1)COCC(=O)NCc2ccccc2 34a_100011217746_100000183539 [0,1,0,0,0,1|1,0,1]=4 6027 B21R2.4733 Cc1cccc(c1)COCC(=O)NCc2ccccc2 7a_100011217746_100000183539 [0,1,0,0,0,1|1,0,1]=4 6028 B21R2.4733 Cc1cccc(c1)COCC(=O)OCc2ccccc2 34a_100011217746_100000753625 [0,1,0,0,0,1|0,0,2]=4 6029 B21R2.4733 Cc1cccc(c1)COCC(=O)OCc2ccccc2 7a_100011217746_100000753625 [0,1,0,0,0,1|0,0,2]=4 6030 B21R2.4733 Cc1cccc(c1)CSCC(=O)OCc2ccccc2 62a_100000211840_100000753625 [0,1,0,0,0,1|0,0,2]=4 6031 B21R2.4733 Cc1cccc(c1)CSCC(=O)OCc2ccccc2 62a_100000753625_100000211840 [0,1,0,0,0,1|0,0,2]=4 6032 B21R2.4733 Cc1cccc(c1)NCCC(=O)OCc2ccccc2 2230a_100000188690_100009813219 [0,1,0,0,0,1|0,0,2]=4 6033 B21R2.4733 Cc1cccc(c1)OCCC(=O)OCc2ccccc2 7a_100000210337_100009813219 [0,1,0,0,0,1|0,0,2]=4 6034 B21R2.4733 Cc1cccc(c1)SCCC(=O)OCc2ccccc2 62a_100009813219_100011215228 [0,1,0,0,0,1|0,0,2]=4 6035 B21R2.4733 Cc1cccc(c1)SCCC(=O)OCc2ccccc2 62a_100011215228_100009813219 [0,1,0,0,0,1|0,0,2]=4 6036 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2 11a_100011824523_100000210462 [0,1,0,0,0,1|2,0,0]=4 6037 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2 1626a_100011824523_100000210462 [0,1,0,0,0,1|2,0,0]=4 6038 B21R2.4733 Nc1cccc(c1)CCNC(=O)OCc2ccccc2 271570a_200010239705_100000210019 [0,1,0,0,0,1|0,0,2]=4 6039 B21R2.4733 Nc1cccc(c1)COCC(=O)CCc2ccccc2 34a_100000211919_100012361361 [0,1,0,0,0,1|0,0,2]=4 6040 B21R2.4733 Nc1cccc(c1)COCC(=O)NCc2ccccc2 34a_100000211919_100000183539 [0,1,0,0,0,1|1,0,1]=4 6041 B21R2.4733 Nc1cccc(c1)COCC(=O)OCc2ccccc2 34a_100000211919_100000753625 [0,1,0,0,0,1|0,0,2]=4 6042 B21R2.4733 Nc1cccc(c1)SCCC(=O)OCc2ccccc2 62a_100000210019_100009813219 [0,1,0,0,0,1|0,0,2]=4 6043 B21R2.4733 Nc1cccc(c1)SCCC(=O)OCc2ccccc2 62a_100009813219_100000210019 [0,1,0,0,0,1|0,0,2]=4 6044 B21R2.4733 O=C(C=Cc1ccccc1)CC#Cc2cccc(c2)Br 1458a_100000210462_100010706776 [0,1,0,0,0,1|1,0,1]=4 6045 B21R2.4733 O=C(C=Cc1ccccc1)CC#Cc2cccc(c2)F 1458a_100000210462_100010402994 [0,1,0,0,0,1|1,0,1]=4 6046 B21R2.4733 O=C(C=Cc1ccccc1)CCCc2cccc(c2)Br 1458a_100000210462_100011713683 [0,1,0,0,0,1|1,0,0]=3 6047 B21R2.4733 O=C(C=Cc1ccccc1)CCCc2cccc(c2)F 1458a_100000210462_200000698031 [0,1,0,0,0,1|1,0,0]=3 6048 B21R2.4733 O=C(C=Cc1ccccc1)CCOc2cccc(c2)Br 1458a_100000210462_100000183150 [0,1,0,0,0,1|1,0,0]=3 6049 B21R2.4733 O=C(C=Cc1ccccc1)CCOc2cccc(c2)Cl 1458a_100000210462_100000181161 [0,1,0,0,0,1|1,0,0]=3 6050 B21R2.4733 O=C(C=Cc1ccccc1)CCOc2cccc(c2)F 1458a_100000210462_100000739188 [0,1,0,0,0,1|1,0,0]=3 6051 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)Br 11a_100011207229_100000210462 [0,1,0,0,0,1|1,0,0]=3 6052 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)Br 1626a_100011207229_100000210462 [0,1,0,0,0,1|1,0,0]=3 6053 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)Cl 11a_100000185263_100000210462 [0,1,0,0,0,1|1,0,0]=3 6054 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)Cl 1626a_100000185263_100000210462 [0,1,0,0,0,1|1,0,0]=3 6055 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)F 11a_100000205154_100000210462 [0,1,0,0,0,1|1,0,0]=3 6056 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)F 1626a_100000205154_100000210462 [0,1,0,0,0,1|1,0,0]=3 6057 B21R2.4733 O=C(C=Cc1ccccc1)NNCc2cccc(c2)Br 22a_100000686200_100000210462 [0,1,0,0,0,1|1,0,0]=3 6058 B21R2.4733 O=C(C=Cc1ccccc1)NNCc2cccc(c2)Cl 22a_100000685877_100000210462 [0,1,0,0,0,1|1,0,0]=3 6059 B21R2.4733 O=C(C=Cc1ccccc1)NNCc2cccc(c2)F 22a_100016993953_100000210462 [0,1,0,0,0,1|1,0,0]=3 6060 B21R2.4733 O=C(C=Cc1ccccc1)NNCc2cccc(c2)O 22a_100000008902_100000210462 [0,1,0,0,0,1|1,0,0]=3 6061 B21R2.4733 O=C(C=Cc1ccccn1)CCCc2cccc(c2)Br 1458a_100000740811_100011713683 [0,1,0,0,0,1|2,0,0]=4 6062 B21R2.4733 O=C(C=Cc1ccccn1)CCCc2cccc(c2)F 1458a_100000740811_200000698031 [0,1,0,0,0,1|2,0,0]=4 6063 B21R2.4733 O=C(C=Cc1ccccn1)CCOc2cccc(c2)Br 1458a_100000740811_100000183150 [0,1,0,0,0,1|2,0,0]=4 6064 B21R2.4733 O=C(C=Cc1ccccn1)CCOc2cccc(c2)Cl 1458a_100000740811_100000181161 [0,1,0,0,0,1|2,0,0]=4 6065 B21R2.4733 O=C(C=Cc1ccccn1)CCOc2cccc(c2)F 1458a_100000740811_100000739188 [0,1,0,0,0,1|2,0,0]=4 6066 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)Br 11a_100011207229_100000740811 [0,1,0,0,0,1|2,0,0]=4 6067 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)Br 240690a_100011207229_100000740811 [0,1,0,0,0,1|2,0,0]=4 6068 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)Cl 11a_100000185263_100000740811 [0,1,0,0,0,1|2,0,0]=4 6069 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)Cl 240690a_100000185263_100000740811 [0,1,0,0,0,1|2,0,0]=4 6070 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)F 11a_100000205154_100000740811 [0,1,0,0,0,1|2,0,0]=4 6071 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)F 240690a_100000205154_100000740811 [0,1,0,0,0,1|2,0,0]=4 6072 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)O 240690a_100000747277_100000740811 [0,1,0,0,0,1|2,0,0]=4 6073 B21R2.4733 O=C(C=Cc1ccccn1)NNCc2cccc(c2)Br 22a_100000686200_100000740811 [0,1,0,0,0,1|2,0,0]=4 6074 B21R2.4733 O=C(C=Cc1ccccn1)NNCc2cccc(c2)Cl 22a_100000685877_100000740811 [0,1,0,0,0,1|2,0,0]=4 6075 B21R2.4733 O=C(C=Cc1ccccn1)NNCc2cccc(c2)F 22a_100016993953_100000740811 [0,1,0,0,0,1|2,0,0]=4 6076 B21R2.4733 O=C(C=Cc1ccccn1)NNCc2cccc(c2)O 22a_100000008902_100000740811 [0,1,0,0,0,1|2,0,0]=4 6077 B21R2.4733 O=C(C=Cc1cccnc1)CCCc2cccc(c2)Br 1458a_100000735890_100011713683 [0,1,0,0,0,1|2,0,0]=4 6078 B21R2.4733 O=C(C=Cc1cccnc1)CCCc2cccc(c2)F 1458a_100000735890_200000698031 [0,1,0,0,0,1|2,0,0]=4 6079 B21R2.4733 O=C(C=Cc1cccnc1)CCOc2cccc(c2)Br 1458a_100000735890_100000183150 [0,1,0,0,0,1|2,0,0]=4 6080 B21R2.4733 O=C(C=Cc1cccnc1)CCOc2cccc(c2)Cl 1458a_100000735890_100000181161 [0,1,0,0,0,1|2,0,0]=4 6081 B21R2.4733 O=C(C=Cc1cccnc1)CCOc2cccc(c2)F 1458a_100000735890_100000739188 [0,1,0,0,0,1|2,0,0]=4 6082 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)Br 11a_100011207229_100000735890 [0,1,0,0,0,1|2,0,0]=4 6083 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)Br 240690a_100011207229_100000735890 [0,1,0,0,0,1|2,0,0]=4 6084 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)Cl 11a_100000185263_100000735890 [0,1,0,0,0,1|2,0,0]=4 6085 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000735890 [0,1,0,0,0,1|2,0,0]=4 6086 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)F 11a_100000205154_100000735890 [0,1,0,0,0,1|2,0,0]=4 6087 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)F 240690a_100000205154_100000735890 [0,1,0,0,0,1|2,0,0]=4 6088 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)O 240690a_100000747277_100000735890 [0,1,0,0,0,1|2,0,0]=4 6089 B21R2.4733 O=C(C=Cc1cccnc1)NNCc2cccc(c2)Br 22a_100000686200_100000735890 [0,1,0,0,0,1|2,0,0]=4 6090 B21R2.4733 O=C(C=Cc1cccnc1)NNCc2cccc(c2)Cl 22a_100000685877_100000735890 [0,1,0,0,0,1|2,0,0]=4 6091 B21R2.4733 O=C(C=Cc1cccnc1)NNCc2cccc(c2)F 22a_100016993953_100000735890 [0,1,0,0,0,1|2,0,0]=4 6092 B21R2.4733 O=C(C=Cc1cccnc1)NNCc2cccc(c2)O 22a_100000008902_100000735890 [0,1,0,0,0,1|2,0,0]=4 6093 B21R2.4733 O=C(C=Cc1ccncc1)CCCc2cccc(c2)Br 1458a_100000682801_100011713683 [0,1,0,0,0,1|2,0,0]=4 6094 B21R2.4733 O=C(C=Cc1ccncc1)CCCc2cccc(c2)F 1458a_100000682801_200000698031 [0,1,0,0,0,1|2,0,0]=4 6095 B21R2.4733 O=C(C=Cc1ccncc1)CCOc2cccc(c2)Br 1458a_100000682801_100000183150 [0,1,0,0,0,1|2,0,0]=4 6096 B21R2.4733 O=C(C=Cc1ccncc1)CCOc2cccc(c2)Cl 1458a_100000682801_100000181161 [0,1,0,0,0,1|2,0,0]=4 6097 B21R2.4733 O=C(C=Cc1ccncc1)CCOc2cccc(c2)F 1458a_100000682801_100000739188 [0,1,0,0,0,1|2,0,0]=4 6098 B21R2.4733 O=C(C=Cc1ccncc1)NCCc2cccc(c2)Br 240690a_100011207229_100000682801 [0,1,0,0,0,1|2,0,0]=4 6099 B21R2.4733 O=C(C=Cc1ccncc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000682801 [0,1,0,0,0,1|2,0,0]=4 6100 B21R2.4733 O=C(C=Cc1ccncc1)NCCc2cccc(c2)F 240690a_100000205154_100000682801 [0,1,0,0,0,1|2,0,0]=4 6101 B21R2.4733 O=C(C=Cc1ccncc1)NCCc2cccc(c2)O 240690a_100000747277_100000682801 [0,1,0,0,0,1|2,0,0]=4 6102 B21R2.4733 O=C(C=Cc1ccncc1)NNCc2cccc(c2)Br 22a_100000686200_100000682801 [0,1,0,0,0,1|2,0,0]=4 6103 B21R2.4733 O=C(C=Cc1ccncc1)NNCc2cccc(c2)Cl 22a_100000685877_100000682801 [0,1,0,0,0,1|2,0,0]=4 6104 B21R2.4733 O=C(C=Cc1ccncc1)NNCc2cccc(c2)F 22a_100016993953_100000682801 [0,1,0,0,0,1|2,0,0]=4 6105 B21R2.4733 O=C(C=Cc1ccncc1)NNCc2cccc(c2)O 22a_100000008902_100000682801 [0,1,0,0,0,1|2,0,0]=4 6106 B21R2.4733 O=C(CCOc1cccc(c1)Br)OCc2ccccc2 7a_100000210342_100009813219 [0,1,0,0,0,1|0,0,2]=4 6107 B21R2.4733 O=C(CCOc1cccc(c1)Cl)OCc2ccccc2 7a_100000210295_100009813219 [0,1,0,0,0,1|0,0,2]=4 6108 B21R2.4733 O=C(CCOc1cccc(c1)F)OCc2ccccc2 7a_100000210426_100009813219 [0,1,0,0,0,1|0,0,2]=4 6109 B21R2.4733 O=C(CCOc1cccc(c1)I)OCc2ccccc2 7a_100000211634_100009813219 [0,1,0,0,0,1|0,0,2]=4 6110 B21R2.4733 O=C(CCSc1cccc(c1)Br)OCc2ccccc2 62a_100000691529_100009813219 [0,1,0,0,0,1|0,0,2]=4 6111 B21R2.4733 O=C(CCSc1cccc(c1)Br)OCc2ccccc2 62a_100009813219_100000691529 [0,1,0,0,0,1|0,0,2]=4 6112 B21R2.4733 O=C(CCSc1cccc(c1)Cl)OCc2ccccc2 62a_100000699651_100009813219 [0,1,0,0,0,1|0,0,2]=4 6113 B21R2.4733 O=C(CCSc1cccc(c1)Cl)OCc2ccccc2 62a_100009813219_100000699651 [0,1,0,0,0,1|0,0,2]=4 6114 B21R2.4733 O=C(CCSc1cccc(c1)F)OCc2ccccc2 62a_100000685547_100009813219 [0,1,0,0,0,1|0,0,2]=4 6115 B21R2.4733 O=C(CCSc1cccc(c1)F)OCc2ccccc2 62a_100009813219_100000685547 [0,1,0,0,0,1|0,0,2]=4 6116 B21R2.4733 O=C(CCSc1cccc(c1)O)OCc2ccccc2 62a_100009813219_100000211634 [0,1,0,0,0,1|0,0,2]=4 6117 B21R2.4733 O=C(CCSc1cccc(c1)[S])OCc2ccccc2 62a_100009813219_114929384022 [0,1,0,0,0,1|0,0,2]=4 6118 B21R2.4733 O=C(CCSc1cccc(c1)[S])OCc2ccccc2 62a_114929384022_100009813219 [0,1,0,0,0,1|0,0,2]=4 6119 B21R2.4733 O=C(CCc1ccccc1)COCc2cccc(c2)Br 34a_100000687537_100012361361 [0,1,0,0,0,1|0,0,2]=4 6120 B21R2.4733 O=C(CCc1ccccc1)COCc2cccc(c2)Br 7a_100000687537_100012361361 [0,1,0,0,0,1|0,0,2]=4 6121 B21R2.4733 O=C(CCc1ccccc1)COCc2cccc(c2)Cl 34a_100000241301_100012361361 [0,1,0,0,0,1|0,0,2]=4 6122 B21R2.4733 O=C(CCc1ccccc1)COCc2cccc(c2)Cl 7a_100000241301_100012361361 [0,1,0,0,0,1|0,0,2]=4 6123 B21R2.4733 O=C(CCc1ccccc1)COCc2cccc(c2)F 34a_100000210976_100012361361 [0,1,0,0,0,1|0,0,2]=4 6124 B21R2.4733 O=C(CCc1ccccc1)COCc2cccc(c2)F 7a_100000210976_100012361361 [0,1,0,0,0,1|0,0,2]=4 6125 B21R2.4733 O=C(CCc1ccccc1)COCc2cccc(c2)I 34a_100011215336_100012361361 [0,1,0,0,0,1|0,0,2]=4 6126 B21R2.4733 O=C(CCc1ccccc1)COCc2cccc(c2)I 7a_100011215336_100012361361 [0,1,0,0,0,1|0,0,2]=4 6127 B21R2.4733 O=C(CCc1ccccc1)NN=Cc2cccc(c2)Br 4a_100000189782_100000210085 [0,1,0,0,0,1|2,0,0]=4 6128 B21R2.4733 O=C(CCc1ccccc1)NN=Cc2cccc(c2)Cl 4a_100000189782_100000210801 [0,1,0,0,0,1|2,0,0]=4 6129 B21R2.4733 O=C(CCc1ccccc1)NN=Cc2cccc(c2)F 4a_100000189782_100000210812 [0,1,0,0,0,1|2,0,0]=4 6130 B21R2.4733 O=C(CCc1ccccc1)NN=Cc2cccc(c2)I 4a_100000189782_100000014684 [0,1,0,0,0,1|2,0,0]=4 6131 B21R2.4733 O=C(CCc1ccccc1)NN=Cc2cccc(c2)O 4a_100000189782_100000188321 [0,1,0,0,0,1|2,0,0]=4 6132 B21R2.4733 O=C(CNCc1cccc(c1)Br)OCc2ccccc2 2230a_100000174977_100000753625 [0,1,0,0,0,1|0,0,2]=4 6133 B21R2.4733 O=C(CNCc1cccc(c1)Br)OCc2ccccc2 34a_100000174977_100000753625 [0,1,0,0,0,1|0,0,2]=4 6134 B21R2.4733 O=C(CNCc1cccc(c1)Cl)OCc2ccccc2 2230a_100000174878_100000753625 [0,1,0,0,0,1|0,0,2]=4 6135 B21R2.4733 O=C(CNCc1cccc(c1)Cl)OCc2ccccc2 34a_100000174878_100000753625 [0,1,0,0,0,1|0,0,2]=4 6136 B21R2.4733 O=C(CNCc1cccc(c1)F)OCc2ccccc2 2230a_100000174948_100000753625 [0,1,0,0,0,1|0,0,2]=4 6137 B21R2.4733 O=C(CNCc1cccc(c1)F)OCc2ccccc2 34a_100000174948_100000753625 [0,1,0,0,0,1|0,0,2]=4 6138 B21R2.4733 O=C(CNCc1cccc(c1)I)OCc2ccccc2 2230a_100000106179_100000753625 [0,1,0,0,0,1|0,0,2]=4 6139 B21R2.4733 O=C(CNCc1cccc(c1)I)OCc2ccccc2 34a_100000106179_100000753625 [0,1,0,0,0,1|0,0,2]=4 6140 B21R2.4733 O=C(CNCc1cccc(c1)O)OCc2ccccc2 2230a_100000743036_100000753625 [0,1,0,0,0,1|0,0,2]=4 6141 B21R2.4733 O=C(CNCc1cccc(c1)O)OCc2ccccc2 34a_100000743036_100000753625 [0,1,0,0,0,1|0,0,2]=4 6142 B21R2.4733 O=C(COCc1cccc(c1)Br)NCc2ccccc2 34a_100000687537_100000183539 [0,1,0,0,0,1|1,0,1]=4 6143 B21R2.4733 O=C(COCc1cccc(c1)Br)NCc2ccccc2 7a_100000687537_100000183539 [0,1,0,0,0,1|1,0,1]=4 6144 B21R2.4733 O=C(COCc1cccc(c1)Br)OCc2ccccc2 34a_100000687537_100000753625 [0,1,0,0,0,1|0,0,2]=4 6145 B21R2.4733 O=C(COCc1cccc(c1)Br)OCc2ccccc2 7a_100000687537_100000753625 [0,1,0,0,0,1|0,0,2]=4 6146 B21R2.4733 O=C(COCc1cccc(c1)Cl)NCc2ccccc2 34a_100000241301_100000183539 [0,1,0,0,0,1|1,0,1]=4 6147 B21R2.4733 O=C(COCc1cccc(c1)Cl)NCc2ccccc2 7a_100000241301_100000183539 [0,1,0,0,0,1|1,0,1]=4 6148 B21R2.4733 O=C(COCc1cccc(c1)Cl)OCc2ccccc2 34a_100000241301_100000753625 [0,1,0,0,0,1|0,0,2]=4 6149 B21R2.4733 O=C(COCc1cccc(c1)Cl)OCc2ccccc2 7a_100000241301_100000753625 [0,1,0,0,0,1|0,0,2]=4 6150 B21R2.4733 O=C(COCc1cccc(c1)F)NCc2ccccc2 34a_100000210976_100000183539 [0,1,0,0,0,1|1,0,1]=4 6151 B21R2.4733 O=C(COCc1cccc(c1)F)NCc2ccccc2 7a_100000210976_100000183539 [0,1,0,0,0,1|1,0,1]=4 6152 B21R2.4733 O=C(COCc1cccc(c1)F)OCc2ccccc2 34a_100000210976_100000753625 [0,1,0,0,0,1|0,0,2]=4 6153 B21R2.4733 O=C(COCc1cccc(c1)F)OCc2ccccc2 7a_100000210976_100000753625 [0,1,0,0,0,1|0,0,2]=4 6154 B21R2.4733 O=C(COCc1cccc(c1)I)NCc2ccccc2 34a_100011215336_100000183539 [0,1,0,0,0,1|1,0,1]=4 6155 B21R2.4733 O=C(COCc1cccc(c1)I)NCc2ccccc2 7a_100011215336_100000183539 [0,1,0,0,0,1|1,0,1]=4 6156 B21R2.4733 O=C(COCc1cccc(c1)I)OCc2ccccc2 34a_100011215336_100000753625 [0,1,0,0,0,1|0,0,2]=4 6157 B21R2.4733 O=C(COCc1cccc(c1)I)OCc2ccccc2 7a_100011215336_100000753625 [0,1,0,0,0,1|0,0,2]=4 6158 B21R2.4733 O=C(CSCc1cccc(c1)Br)OCc2ccccc2 62a_100000211773_100000753625 [0,1,0,0,0,1|0,0,2]=4 6159 B21R2.4733 O=C(CSCc1cccc(c1)Br)OCc2ccccc2 62a_100000753625_100000211773 [0,1,0,0,0,1|0,0,2]=4 6160 B21R2.4733 O=C(CSCc1cccc(c1)Cl)OCc2ccccc2 62a_100000187163_100000753625 [0,1,0,0,0,1|0,0,2]=4 6161 B21R2.4733 O=C(CSCc1cccc(c1)Cl)OCc2ccccc2 62a_100000753625_100000187163 [0,1,0,0,0,1|0,0,2]=4 6162 B21R2.4733 O=C(CSCc1cccc(c1)F)OCc2ccccc2 62a_100000230114_100000753625 [0,1,0,0,0,1|0,0,2]=4 6163 B21R2.4733 O=C(CSCc1cccc(c1)F)OCc2ccccc2 62a_100000753625_100000230114 [0,1,0,0,0,1|0,0,2]=4 6164 B21R2.4733 O=C(CSCc1cccc(c1)I)OCc2ccccc2 62a_100000753625_100011218688 [0,1,0,0,0,1|0,0,2]=4 6165 B21R2.4733 O=C(CSCc1cccc(c1)I)OCc2ccccc2 62a_100011218688_100000753625 [0,1,0,0,0,1|0,0,2]=4 6166 B21R2.4733 O=C(CSCc1cccc(c1)O)OCc2ccccc2 62a_100000753625_100011660834 [0,1,0,0,0,1|0,0,2]=4 6167 B21R2.4733 O=C(CSCc1cccc(c1)O)OCc2ccccc2 62a_100011660834_100000753625 [0,1,0,0,0,1|0,0,2]=4 6168 B21R2.4733 O=C(NCCc1cccc(c1)Br)OCc2ccccc2 271570a_200010239705_100000691529 [0,1,0,0,0,1|0,0,2]=4 6169 B21R2.4733 O=C(NCCc1cccc(c1)Cl)OCc2ccccc2 271570a_200010239705_100000699651 [0,1,0,0,0,1|0,0,2]=4 6170 B21R2.4733 O=C(NCCc1cccc(c1)F)OCc2ccccc2 271570a_200010239705_100000685547 [0,1,0,0,0,1|0,0,2]=4 6171 B21R2.4733 O=C(NCCc1cccc(c1)O)OCc2ccccc2 271570a_200010239705_100000211634 [0,1,0,0,0,1|0,0,2]=4 6172 B21R2.4733 O=C(NCCc1cccc(c1)[S])OCc2ccccc2 271570a_200010239705_114929384022 [0,1,0,0,0,1|0,0,2]=4 6173 B21R2.4848 CC(=NNCc1ccccc1)C=Cc2ccccc2Cl 4a_100000007032_200016284137 [0,1,0,0,0,1|2,0,0]=4 6174 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2ccccc2 1626a_100000106460_100016266485 [0,1,0,0,0,1|1,0,0]=3 6175 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2ccccn2 1626a_100000211156_100016266485 [0,1,0,0,0,1|2,0,0]=4 6176 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2cccnc2 1626a_100000736294_100016266485 [0,1,0,0,0,1|2,0,0]=4 6177 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2ccncc2 1626a_100000742849_100016266485 [0,1,0,0,0,1|2,0,0]=4 6178 B21R2.4848 Cc1ccccc1C=CC(=O)NNCc2ccccc2 22a_100000007032_100016266485 [0,1,0,0,0,1|1,0,0]=3 6179 B21R2.4848 Cc1ccccc1C=CC(=O)NNCc2ccccn2 22a_100000736832_100016266485 [0,1,0,0,0,1|2,0,0]=4 6180 B21R2.4848 Cc1ccccc1C=CC(=O)NNCc2cccnc2 22a_100000738295_100016266485 [0,1,0,0,0,1|2,0,0]=4 6181 B21R2.4848 Cc1ccccc1C=CC(=O)NNCc2ccncc2 22a_100000736929_100016266485 [0,1,0,0,0,1|2,0,0]=4 6182 B21R2.4848 Cc1ccccc1CCC(=O)C/C=C/c2ccccc2 1458a_100000748742_100016265936 [0,1,0,0,0,1|1,0,0]=3 6183 B21R2.4848 Cc1ccccc1CCC(=O)C/C=C/c2ccccc2 1458a_100011219626_100011713688 [0,1,0,0,0,1|1,0,0]=3 6184 B21R2.4848 Cc1ccccc1CCC(=O)C=CSc2ccccc2 1458a_100016262050_100011713688 [0,1,0,0,0,1|1,0,0]=3 6185 B21R2.4848 Cc1ccccc1CCC(=O)COCc2ccccc2 1458a_100000230186_100011713688 [0,1,0,0,0,1|0,0,2]=4 6186 B21R2.4848 Cc1ccccc1CNC(=O)C/C=C/c2ccccc2 11a_100000174972_100011219626 [0,1,0,0,0,1|1,0,0]=3 6187 B21R2.4848 Cc1ccccc1CNC(=O)C/C=C/c2ccccc2 1626a_100000174972_100011219626 [0,1,0,0,0,1|1,0,0]=3 6188 B21R2.4848 Cc1ccccc1CNC(=O)C/C=C/c2ccccc2 240690a_100000174972_100011219626 [0,1,0,0,0,1|1,0,0]=3 6189 B21R2.4848 Cc1ccccc1CNC(=O)C=CSc2ccccc2 11a_100000174972_100016262050 [0,1,0,0,0,1|1,0,0]=3 6190 B21R2.4848 Cc1ccccc1CNC(=O)C=CSc2ccccc2 1626a_100000174972_100016262050 [0,1,0,0,0,1|1,0,0]=3 6191 B21R2.4848 Cc1ccccc1CNC(=O)C=CSc2ccccc2 240690a_100000174972_100016262050 [0,1,0,0,0,1|1,0,0]=3 6192 B21R2.4848 Cc1ccccc1CNC(=O)COCc2ccccc2 11a_100000174972_100000230186 [0,1,0,0,0,1|1,0,1]=4 6193 B21R2.4848 Cc1ccccc1CNC(=O)COCc2ccccc2 1626a_100000174972_100000230186 [0,1,0,0,0,1|1,0,1]=4 6194 B21R2.4848 Cc1ccccc1CNC(=O)COCc2ccccc2 240690a_100000174972_100000230186 [0,1,0,0,0,1|1,0,1]=4 6195 B21R2.4848 Cc1ccccc1CNC(=O)COCc2ccccc2 34a_100000210790_100000230231 [0,1,0,0,0,1|1,0,1]=4 6196 B21R2.4848 Cc1ccccc1CNC(=O)COCc2ccccc2 527a_100000174972_100000230186 [0,1,0,0,0,1|1,0,1]=4 6197 B21R2.4848 Cc1ccccc1CNC(=O)COCc2ccccc2 7a_100000210790_100000230231 [0,1,0,0,0,1|1,0,1]=4 6198 B21R2.4848 Cc1ccccc1NCC(=O)NOCc2ccccc2 34a_100015192222_100000230105 [0,1,0,0,0,1|1,0,1]=4 6199 B21R2.4848 Cc1ccccc1NCC(=O)OCCc2ccccc2 34a_100015192222_200000077782 [0,1,0,0,0,1|1,0,1]=4 6200 B21R2.4848 Cc1ccccc1NNC(=O)C/C=C/c2ccccc2 22a_100000184220_100011219626 [0,1,0,0,0,1|2,0,0]=4 6201 B21R2.4848 Cc1ccccc1NNC(=O)C=CSc2ccccc2 22a_100000184220_100016262050 [0,1,0,0,0,1|2,0,0]=4 6202 B21R2.4848 Cc1ccccc1NNC(=O)COCc2ccccc2 22a_100000184220_100000230186 [0,1,0,0,0,1|2,0,0]=4 6203 B21R2.4848 Cc1ccccc1OCC(=O)C/C=C/c2ccccc2 1458a_100000182418_100016265936 [0,1,0,0,0,1|2,0,0]=4 6204 B21R2.4848 Cc1ccccc1OCC(=O)NOCc2ccccc2 34a_100000210338_100000230105 [0,1,0,0,0,1|1,0,1]=4 6205 B21R2.4848 Cc1ccccc1OCC(=O)NOCc2ccccc2 7a_100000210338_100000230105 [0,1,0,0,0,1|1,0,1]=4 6206 B21R2.4848 Cc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000210338_200000077782 [0,1,0,0,0,1|1,0,1]=4 6207 B21R2.4848 Cc1ccccc1OCC(=O)OCCc2ccccc2 7a_100000210338_200000077782 [0,1,0,0,0,1|1,0,1]=4 6208 B21R2.4848 Cc1ccccc1SCC(=O)C/C=C/c2ccccc2 1458a_100000183026_100016265936 [0,1,0,0,0,1|2,0,0]=4 6209 B21R2.4848 Cc1ccccc1SCC(=O)NOCc2ccccc2 62a_100000210755_100000230105 [0,1,0,0,0,1|1,0,1]=4 6210 B21R2.4848 Cc1ccccc1SCC(=O)NOCc2ccccc2 62a_100000230105_100000210755 [0,1,0,0,0,1|1,0,1]=4 6211 B21R2.4848 Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_100000210755_200000077782 [0,1,0,0,0,1|1,0,1]=4 6212 B21R2.4848 Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000210755 [0,1,0,0,0,1|1,0,1]=4 6213 B21R2.4848 Cc1cccnc1CNC(=O)C/C=C/c2ccccc2 11a_100011223789_100011219626 [0,1,0,0,0,1|2,0,0]=4 6214 B21R2.4848 Cc1cccnc1CNC(=O)C/C=C/c2ccccc2 1626a_100011223789_100011219626 [0,1,0,0,0,1|2,0,0]=4 6215 B21R2.4848 Cc1cccnc1CNC(=O)C/C=C/c2ccccc2 240690a_100011223789_100011219626 [0,1,0,0,0,1|2,0,0]=4 6216 B21R2.4848 Cc1cccnc1CNC(=O)C=CSc2ccccc2 11a_100011223789_100016262050 [0,1,0,0,0,1|2,0,0]=4 6217 B21R2.4848 Cc1cccnc1CNC(=O)C=CSc2ccccc2 1626a_100011223789_100016262050 [0,1,0,0,0,1|2,0,0]=4 6218 B21R2.4848 Cc1cccnc1CNC(=O)C=CSc2ccccc2 240690a_100011223789_100016262050 [0,1,0,0,0,1|2,0,0]=4 6219 B21R2.4848 Cc1ccncc1CNC(=O)C/C=C/c2ccccc2 11a_100011997553_100011219626 [0,1,0,0,0,1|2,0,0]=4 6220 B21R2.4848 Cc1ccncc1CNC(=O)C/C=C/c2ccccc2 240690a_100011997553_100011219626 [0,1,0,0,0,1|2,0,0]=4 6221 B21R2.4848 Cc1ccncc1CNC(=O)C=CSc2ccccc2 11a_100011997553_100016262050 [0,1,0,0,0,1|2,0,0]=4 6222 B21R2.4848 Cc1ccncc1CNC(=O)C=CSc2ccccc2 240690a_100011997553_100016262050 [0,1,0,0,0,1|2,0,0]=4 6223 B21R2.4848 Cc1cnccc1CNC(=O)C/C=C/c2ccccc2 11a_100000708811_100011219626 [0,1,0,0,0,1|2,0,0]=4 6224 B21R2.4848 Cc1cnccc1CNC(=O)C/C=C/c2ccccc2 1626a_100000708811_100011219626 [0,1,0,0,0,1|2,0,0]=4 6225 B21R2.4848 Cc1cnccc1CNC(=O)C/C=C/c2ccccc2 240690a_100000708811_100011219626 [0,1,0,0,0,1|2,0,0]=4 6226 B21R2.4848 Cc1cnccc1CNC(=O)C=CSc2ccccc2 11a_100000708811_100016262050 [0,1,0,0,0,1|2,0,0]=4 6227 B21R2.4848 Cc1cnccc1CNC(=O)C=CSc2ccccc2 1626a_100000708811_100016262050 [0,1,0,0,0,1|2,0,0]=4 6228 B21R2.4848 Cc1cnccc1CNC(=O)C=CSc2ccccc2 240690a_100000708811_100016262050 [0,1,0,0,0,1|2,0,0]=4 6229 B21R2.4848 Nc1ccccc1OCC(=O)NOCc2ccccc2 34a_100000185747_100000230105 [0,1,0,0,0,1|1,0,1]=4 6230 B21R2.4848 Nc1ccccc1OCC(=O)NOCc2ccccc2 7a_100000185747_100000230105 [0,1,0,0,0,1|1,0,1]=4 6231 B21R2.4848 Nc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000185747_200000077782 [0,1,0,0,0,1|1,0,1]=4 6232 B21R2.4848 Nc1ccccc1OCC(=O)OCCc2ccccc2 7a_100000185747_200000077782 [0,1,0,0,0,1|1,0,1]=4 6233 B21R2.4848 Nc1ccccc1SCC(=O)NOCc2ccccc2 62a_100000210017_100000230105 [0,1,0,0,0,1|1,0,1]=4 6234 B21R2.4848 Nc1ccccc1SCC(=O)NOCc2ccccc2 62a_100000230105_100000210017 [0,1,0,0,0,1|1,0,1]=4 6235 B21R2.4848 Nc1ccccc1SCC(=O)OCCc2ccccc2 62a_100000210017_200000077782 [0,1,0,0,0,1|1,0,1]=4 6236 B21R2.4848 Nc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000210017 [0,1,0,0,0,1|1,0,1]=4 6237 B21R2.4848 O=C(C#Cc1ccccc1F)C/C=C/c2ccccc2 1458a_100011892747_100016265936 [0,1,0,0,0,1|1,0,1]=4 6238 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2Br 1458a_100000740810_100016265936 [0,1,0,0,0,1|1,0,0]=3 6239 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2Br 1458a_100011219626_100012161201 [0,1,0,0,0,1|1,0,0]=3 6240 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2Cl 1458a_100000184300_100016265936 [0,1,0,0,0,1|1,0,0]=3 6241 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2Cl 1458a_100011219626_100011713703 [0,1,0,0,0,1|1,0,0]=3 6242 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2F 1458a_100000189703_100016265936 [0,1,0,0,0,1|1,0,0]=3 6243 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2F 1458a_100011219626_100000720011 [0,1,0,0,0,1|1,0,0]=3 6244 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2I 1458a_100000037306_100016265936 [0,1,0,0,0,1|1,0,0]=3 6245 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2O 1458a_100000181328_100016265936 [0,1,0,0,0,1|1,0,0]=3 6246 B21R2.4848 O=C(C/C=C/c1ccccc1)CCc2ccccc2O 1458a_100011219626_100000722297 [0,1,0,0,0,1|1,0,0]=3 6247 B21R2.4848 O=C(C/C=C/c1ccccc1)CCn2ccccc2=O 1458a_100000738505_100016265936 [0,1,0,0,0,1|2,0,0]=4 6248 B21R2.4848 O=C(C/C=C/c1ccccc1)COc2ccccc2Br 1458a_100000216496_100016265936 [0,1,0,0,0,1|2,0,0]=4 6249 B21R2.4848 O=C(C/C=C/c1ccccc1)COc2ccccc2Cl 1458a_100000185159_100016265936 [0,1,0,0,0,1|2,0,0]=4 6250 B21R2.4848 O=C(C/C=C/c1ccccc1)COc2ccccc2F 1458a_100000182486_100016265936 [0,1,0,0,0,1|2,0,0]=4 6251 B21R2.4848 O=C(C/C=C/c1ccccc1)COc2ccccc2O 1458a_100000183020_100016265936 [0,1,0,0,0,1|2,0,0]=4 6252 B21R2.4848 O=C(C/C=C/c1ccccc1)CSc2ccccc2F 1458a_100000179528_100016265936 [0,1,0,0,0,1|2,0,0]=4 6253 B21R2.4848 O=C(C/C=C/c1ccccc1)CSc2ccccc2O 1458a_100000695322_100016265936 [0,1,0,0,0,1|2,0,0]=4 6254 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2Br 11a_100000689332_100011219626 [0,1,0,0,0,1|1,0,0]=3 6255 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2Br 1626a_100000689332_100011219626 [0,1,0,0,0,1|1,0,0]=3 6256 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2Br 240690a_100000689332_100011219626 [0,1,0,0,0,1|1,0,0]=3 6257 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2Cl 11a_100000174879_100011219626 [0,1,0,0,0,1|1,0,0]=3 6258 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100011219626 [0,1,0,0,0,1|1,0,0]=3 6259 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100011219626 [0,1,0,0,0,1|1,0,0]=3 6260 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2F 11a_100000174869_100011219626 [0,1,0,0,0,1|1,0,0]=3 6261 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2F 1626a_100000174869_100011219626 [0,1,0,0,0,1|1,0,0]=3 6262 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2F 240690a_100000174869_100011219626 [0,1,0,0,0,1|1,0,0]=3 6263 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2I 11a_100015347259_100011219626 [0,1,0,0,0,1|1,0,0]=3 6264 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2I 1626a_100015347259_100011219626 [0,1,0,0,0,1|1,0,0]=3 6265 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2I 240690a_100015347259_100011219626 [0,1,0,0,0,1|1,0,0]=3 6266 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccccc2O 240690a_100000185550_100011219626 [0,1,0,0,0,1|1,0,0]=3 6267 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2cccnc2Br 11a_100009818023_100011219626 [0,1,0,0,0,1|2,0,0]=4 6268 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2cccnc2Br 240690a_100009818023_100011219626 [0,1,0,0,0,1|2,0,0]=4 6269 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2cccnc2Cl 11a_100015189234_100011219626 [0,1,0,0,0,1|2,0,0]=4 6270 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2cccnc2Cl 1626a_100015189234_100011219626 [0,1,0,0,0,1|2,0,0]=4 6271 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2cccnc2Cl 240690a_100015189234_100011219626 [0,1,0,0,0,1|2,0,0]=4 6272 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2cccnc2F 11a_100000724633_100011219626 [0,1,0,0,0,1|2,0,0]=4 6273 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2cccnc2F 1626a_100000724633_100011219626 [0,1,0,0,0,1|2,0,0]=4 6274 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2cccnc2F 240690a_100000724633_100011219626 [0,1,0,0,0,1|2,0,0]=4 6275 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccncc2Br 11a_100020640021_100011219626 [0,1,0,0,0,1|2,0,0]=4 6276 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccncc2Br 240690a_100020640021_100011219626 [0,1,0,0,0,1|2,0,0]=4 6277 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccncc2F 11a_100011935246_100011219626 [0,1,0,0,0,1|2,0,0]=4 6278 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccncc2F 1626a_100011935246_100011219626 [0,1,0,0,0,1|2,0,0]=4 6279 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ccncc2F 240690a_100011935246_100011219626 [0,1,0,0,0,1|2,0,0]=4 6280 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ncccc2Br 11a_100020591323_100011219626 [0,1,0,0,0,1|2,0,0]=4 6281 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ncccc2Br 240690a_100020591323_100011219626 [0,1,0,0,0,1|2,0,0]=4 6282 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ncccc2Cl 11a_100015189233_100011219626 [0,1,0,0,0,1|2,0,0]=4 6283 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ncccc2Cl 1626a_100015189233_100011219626 [0,1,0,0,0,1|2,0,0]=4 6284 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ncccc2Cl 240690a_100015189233_100011219626 [0,1,0,0,0,1|2,0,0]=4 6285 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ncccc2F 11a_100000690088_100011219626 [0,1,0,0,0,1|2,0,0]=4 6286 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ncccc2F 1626a_100000690088_100011219626 [0,1,0,0,0,1|2,0,0]=4 6287 B21R2.4848 O=C(C/C=C/c1ccccc1)NCc2ncccc2F 240690a_100000690088_100011219626 [0,1,0,0,0,1|2,0,0]=4 6288 B21R2.4848 O=C(C/C=C/c1ccccc1)NNc2ccccc2Br 22a_100000241748_100011219626 [0,1,0,0,0,1|2,0,0]=4 6289 B21R2.4848 O=C(C/C=C/c1ccccc1)NNc2ccccc2Cl 22a_100000683529_100011219626 [0,1,0,0,0,1|2,0,0]=4 6290 B21R2.4848 O=C(C/C=C/c1ccccc1)NNc2ccccc2F 22a_100000239246_100011219626 [0,1,0,0,0,1|2,0,0]=4 6291 B21R2.4848 O=C(C/C=C/c1ccccc1)NNc2ccccc2I 22a_100011218156_100011219626 [0,1,0,0,0,1|2,0,0]=4 6292 B21R2.4848 O=C(C=CSc1ccccc1)CCc2ccccc2Br 1458a_100016262050_100012161201 [0,1,0,0,0,1|1,0,0]=3 6293 B21R2.4848 O=C(C=CSc1ccccc1)CCc2ccccc2Cl 1458a_100016262050_100011713703 [0,1,0,0,0,1|1,0,0]=3 6294 B21R2.4848 O=C(C=CSc1ccccc1)CCc2ccccc2F 1458a_100016262050_100000720011 [0,1,0,0,0,1|1,0,0]=3 6295 B21R2.4848 O=C(C=CSc1ccccc1)CCc2ccccc2O 1458a_100016262050_100000722297 [0,1,0,0,0,1|1,0,0]=3 6296 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2Br 11a_100000689332_100016262050 [0,1,0,0,0,1|1,0,0]=3 6297 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100016262050 [0,1,0,0,0,1|1,0,0]=3 6298 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2Br 240690a_100000689332_100016262050 [0,1,0,0,0,1|1,0,0]=3 6299 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100016262050 [0,1,0,0,0,1|1,0,0]=3 6300 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100016262050 [0,1,0,0,0,1|1,0,0]=3 6301 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100016262050 [0,1,0,0,0,1|1,0,0]=3 6302 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2F 11a_100000174869_100016262050 [0,1,0,0,0,1|1,0,0]=3 6303 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2F 1626a_100000174869_100016262050 [0,1,0,0,0,1|1,0,0]=3 6304 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2F 240690a_100000174869_100016262050 [0,1,0,0,0,1|1,0,0]=3 6305 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2I 11a_100015347259_100016262050 [0,1,0,0,0,1|1,0,0]=3 6306 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2I 1626a_100015347259_100016262050 [0,1,0,0,0,1|1,0,0]=3 6307 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2I 240690a_100015347259_100016262050 [0,1,0,0,0,1|1,0,0]=3 6308 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccccc2O 240690a_100000185550_100016262050 [0,1,0,0,0,1|1,0,0]=3 6309 B21R2.4848 O=C(C=CSc1ccccc1)NCc2cccnc2Br 11a_100009818023_100016262050 [0,1,0,0,0,1|2,0,0]=4 6310 B21R2.4848 O=C(C=CSc1ccccc1)NCc2cccnc2Br 240690a_100009818023_100016262050 [0,1,0,0,0,1|2,0,0]=4 6311 B21R2.4848 O=C(C=CSc1ccccc1)NCc2cccnc2Cl 11a_100015189234_100016262050 [0,1,0,0,0,1|2,0,0]=4 6312 B21R2.4848 O=C(C=CSc1ccccc1)NCc2cccnc2Cl 1626a_100015189234_100016262050 [0,1,0,0,0,1|2,0,0]=4 6313 B21R2.4848 O=C(C=CSc1ccccc1)NCc2cccnc2Cl 240690a_100015189234_100016262050 [0,1,0,0,0,1|2,0,0]=4 6314 B21R2.4848 O=C(C=CSc1ccccc1)NCc2cccnc2F 11a_100000724633_100016262050 [0,1,0,0,0,1|2,0,0]=4 6315 B21R2.4848 O=C(C=CSc1ccccc1)NCc2cccnc2F 1626a_100000724633_100016262050 [0,1,0,0,0,1|2,0,0]=4 6316 B21R2.4848 O=C(C=CSc1ccccc1)NCc2cccnc2F 240690a_100000724633_100016262050 [0,1,0,0,0,1|2,0,0]=4 6317 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccncc2Br 11a_100020640021_100016262050 [0,1,0,0,0,1|2,0,0]=4 6318 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccncc2Br 240690a_100020640021_100016262050 [0,1,0,0,0,1|2,0,0]=4 6319 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccncc2F 11a_100011935246_100016262050 [0,1,0,0,0,1|2,0,0]=4 6320 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccncc2F 1626a_100011935246_100016262050 [0,1,0,0,0,1|2,0,0]=4 6321 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ccncc2F 240690a_100011935246_100016262050 [0,1,0,0,0,1|2,0,0]=4 6322 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ncccc2Br 11a_100020591323_100016262050 [0,1,0,0,0,1|2,0,0]=4 6323 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ncccc2Br 240690a_100020591323_100016262050 [0,1,0,0,0,1|2,0,0]=4 6324 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ncccc2Cl 11a_100015189233_100016262050 [0,1,0,0,0,1|2,0,0]=4 6325 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ncccc2Cl 1626a_100015189233_100016262050 [0,1,0,0,0,1|2,0,0]=4 6326 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ncccc2Cl 240690a_100015189233_100016262050 [0,1,0,0,0,1|2,0,0]=4 6327 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ncccc2F 11a_100000690088_100016262050 [0,1,0,0,0,1|2,0,0]=4 6328 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ncccc2F 1626a_100000690088_100016262050 [0,1,0,0,0,1|2,0,0]=4 6329 B21R2.4848 O=C(C=CSc1ccccc1)NCc2ncccc2F 240690a_100000690088_100016262050 [0,1,0,0,0,1|2,0,0]=4 6330 B21R2.4848 O=C(C=CSc1ccccc1)NNc2ccccc2Br 22a_100000241748_100016262050 [0,1,0,0,0,1|2,0,0]=4 6331 B21R2.4848 O=C(C=CSc1ccccc1)NNc2ccccc2Cl 22a_100000683529_100016262050 [0,1,0,0,0,1|2,0,0]=4 6332 B21R2.4848 O=C(C=CSc1ccccc1)NNc2ccccc2F 22a_100000239246_100016262050 [0,1,0,0,0,1|2,0,0]=4 6333 B21R2.4848 O=C(C=CSc1ccccc1)NNc2ccccc2I 22a_100011218156_100016262050 [0,1,0,0,0,1|2,0,0]=4 6334 B21R2.4848 O=C(C=Cc1ccccc1Br)C/C=C/c2ccccc2 1458a_100000719032_100016265936 [0,1,0,0,0,1|1,0,1]=4 6335 B21R2.4848 O=C(C=Cc1ccccc1Br)CC#Cc2ccccc2 1458a_100000719032_100011352542 [0,1,0,0,0,1|1,0,1]=4 6336 B21R2.4848 O=C(C=Cc1ccccc1Br)CCCc2ccccc2 1458a_100000719032_100000211621 [0,1,0,0,0,1|1,0,0]=3 6337 B21R2.4848 O=C(C=Cc1ccccc1Br)CCOc2ccccc2 1458a_100000719032_100000184471 [0,1,0,0,0,1|1,0,0]=3 6338 B21R2.4848 O=C(C=Cc1ccccc1Br)CCSc2ccccc2 1458a_100000719032_100000246102 [0,1,0,0,0,1|1,0,0]=3 6339 B21R2.4848 O=C(C=Cc1ccccc1Br)CSCc2ccccc2 1458a_100000719032_200011217039 [0,1,0,0,0,1|0,1,0]=3 6340 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccc2 11a_100000106460_100000719032 [0,1,0,0,0,1|1,0,0]=3 6341 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccc2 1626a_100000106460_100000719032 [0,1,0,0,0,1|1,0,0]=3 6342 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccc2 240690a_100000106460_100000719032 [0,1,0,0,0,1|1,0,0]=3 6343 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccn2 11a_100000211156_100000719032 [0,1,0,0,0,1|2,0,0]=4 6344 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccn2 1626a_100000211156_100000719032 [0,1,0,0,0,1|2,0,0]=4 6345 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccn2 240690a_100000211156_100000719032 [0,1,0,0,0,1|2,0,0]=4 6346 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cccnc2 11a_100000736294_100000719032 [0,1,0,0,0,1|2,0,0]=4 6347 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cccnc2 1626a_100000736294_100000719032 [0,1,0,0,0,1|2,0,0]=4 6348 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cccnc2 240690a_100000736294_100000719032 [0,1,0,0,0,1|2,0,0]=4 6349 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccncc2 11a_100000742849_100000719032 [0,1,0,0,0,1|2,0,0]=4 6350 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccncc2 1626a_100000742849_100000719032 [0,1,0,0,0,1|2,0,0]=4 6351 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccncc2 240690a_100000742849_100000719032 [0,1,0,0,0,1|2,0,0]=4 6352 B21R2.4848 O=C(C=Cc1ccccc1Br)NNCc2ccccc2 22a_100000007032_100000719032 [0,1,0,0,0,1|1,0,0]=3 6353 B21R2.4848 O=C(C=Cc1ccccc1Br)NNCc2ccccn2 22a_100000736832_100000719032 [0,1,0,0,0,1|2,0,0]=4 6354 B21R2.4848 O=C(C=Cc1ccccc1Br)NNCc2cccnc2 22a_100000738295_100000719032 [0,1,0,0,0,1|2,0,0]=4 6355 B21R2.4848 O=C(C=Cc1ccccc1Br)NNCc2ccncc2 22a_100000736929_100000719032 [0,1,0,0,0,1|2,0,0]=4 6356 B21R2.4848 O=C(C=Cc1ccccc1Cl)C/C=C/c2ccccc2 1458a_100000720304_100016265936 [0,1,0,0,0,1|1,0,1]=4 6357 B21R2.4848 O=C(C=Cc1ccccc1Cl)CC#Cc2ccccc2 1458a_100000720304_100011352542 [0,1,0,0,0,1|1,0,1]=4 6358 B21R2.4848 O=C(C=Cc1ccccc1Cl)CCCc2ccccc2 1458a_100000720304_100000211621 [0,1,0,0,0,1|1,0,0]=3 6359 B21R2.4848 O=C(C=Cc1ccccc1Cl)CCOc2ccccc2 1458a_100000720304_100000184471 [0,1,0,0,0,1|1,0,0]=3 6360 B21R2.4848 O=C(C=Cc1ccccc1Cl)CCSc2ccccc2 1458a_100000720304_100000246102 [0,1,0,0,0,1|1,0,0]=3 6361 B21R2.4848 O=C(C=Cc1ccccc1Cl)CSCc2ccccc2 1458a_100000720304_200011217039 [0,1,0,0,0,1|0,1,0]=3 6362 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2 11a_100000106460_100000720304 [0,1,0,0,0,1|1,0,0]=3 6363 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2 1626a_100000106460_100000720304 [0,1,0,0,0,1|1,0,0]=3 6364 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2 240690a_100000106460_100000720304 [0,1,0,0,0,1|1,0,0]=3 6365 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccn2 11a_100000211156_100000720304 [0,1,0,0,0,1|2,0,0]=4 6366 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccn2 1626a_100000211156_100000720304 [0,1,0,0,0,1|2,0,0]=4 6367 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccn2 240690a_100000211156_100000720304 [0,1,0,0,0,1|2,0,0]=4 6368 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cccnc2 11a_100000736294_100000720304 [0,1,0,0,0,1|2,0,0]=4 6369 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cccnc2 1626a_100000736294_100000720304 [0,1,0,0,0,1|2,0,0]=4 6370 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cccnc2 240690a_100000736294_100000720304 [0,1,0,0,0,1|2,0,0]=4 6371 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccncc2 11a_100000742849_100000720304 [0,1,0,0,0,1|2,0,0]=4 6372 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccncc2 1626a_100000742849_100000720304 [0,1,0,0,0,1|2,0,0]=4 6373 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccncc2 240690a_100000742849_100000720304 [0,1,0,0,0,1|2,0,0]=4 6374 B21R2.4848 O=C(C=Cc1ccccc1Cl)NNCc2ccccc2 22a_100000007032_100000720304 [0,1,0,0,0,1|1,0,0]=3 6375 B21R2.4848 O=C(C=Cc1ccccc1Cl)NNCc2ccccn2 22a_100000736832_100000720304 [0,1,0,0,0,1|2,0,0]=4 6376 B21R2.4848 O=C(C=Cc1ccccc1Cl)NNCc2cccnc2 22a_100000738295_100000720304 [0,1,0,0,0,1|2,0,0]=4 6377 B21R2.4848 O=C(C=Cc1ccccc1Cl)NNCc2ccncc2 22a_100000736929_100000720304 [0,1,0,0,0,1|2,0,0]=4 6378 B21R2.4848 O=C(C=Cc1ccccc1F)C/C=C/c2ccccc2 1458a_100016256065_100016265936 [0,1,0,0,0,1|1,0,1]=4 6379 B21R2.4848 O=C(C=Cc1ccccc1F)CC#Cc2ccccc2 1458a_100016256065_100011352542 [0,1,0,0,0,1|1,0,1]=4 6380 B21R2.4848 O=C(C=Cc1ccccc1F)CCCc2ccccc2 1458a_100016256065_100000211621 [0,1,0,0,0,1|1,0,0]=3 6381 B21R2.4848 O=C(C=Cc1ccccc1F)CCOc2ccccc2 1458a_100016256065_100000184471 [0,1,0,0,0,1|1,0,0]=3 6382 B21R2.4848 O=C(C=Cc1ccccc1F)CCSc2ccccc2 1458a_100016256065_100000246102 [0,1,0,0,0,1|1,0,0]=3 6383 B21R2.4848 O=C(C=Cc1ccccc1F)CSCc2ccccc2 1458a_100016256065_200011217039 [0,1,0,0,0,1|0,1,0]=3 6384 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccc2 11a_100000106460_100016256065 [0,1,0,0,0,1|1,0,0]=3 6385 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccc2 1626a_100000106460_100016256065 [0,1,0,0,0,1|1,0,0]=3 6386 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccc2 240690a_100000106460_100016256065 [0,1,0,0,0,1|1,0,0]=3 6387 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccn2 11a_100000211156_100016256065 [0,1,0,0,0,1|2,0,0]=4 6388 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccn2 1626a_100000211156_100016256065 [0,1,0,0,0,1|2,0,0]=4 6389 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccn2 240690a_100000211156_100016256065 [0,1,0,0,0,1|2,0,0]=4 6390 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cccnc2 11a_100000736294_100016256065 [0,1,0,0,0,1|2,0,0]=4 6391 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cccnc2 1626a_100000736294_100016256065 [0,1,0,0,0,1|2,0,0]=4 6392 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cccnc2 240690a_100000736294_100016256065 [0,1,0,0,0,1|2,0,0]=4 6393 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccncc2 11a_100000742849_100016256065 [0,1,0,0,0,1|2,0,0]=4 6394 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccncc2 1626a_100000742849_100016256065 [0,1,0,0,0,1|2,0,0]=4 6395 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccncc2 240690a_100000742849_100016256065 [0,1,0,0,0,1|2,0,0]=4 6396 B21R2.4848 O=C(C=Cc1ccccc1F)NNCc2ccccc2 22a_100000007032_100016256065 [0,1,0,0,0,1|1,0,0]=3 6397 B21R2.4848 O=C(C=Cc1ccccc1F)NNCc2ccccn2 22a_100000736832_100016256065 [0,1,0,0,0,1|2,0,0]=4 6398 B21R2.4848 O=C(C=Cc1ccccc1F)NNCc2cccnc2 22a_100000738295_100016256065 [0,1,0,0,0,1|2,0,0]=4 6399 B21R2.4848 O=C(C=Cc1ccccc1F)NNCc2ccncc2 22a_100000736929_100016256065 [0,1,0,0,0,1|2,0,0]=4 6400 B21R2.4848 O=C(C=Cc1ccccc1O)C/C=C/c2ccccc2 1458a_100016263591_100016265936 [0,1,0,0,0,1|1,0,1]=4 6401 B21R2.4848 O=C(C=Cc1ccccc1O)CC#Cc2ccccc2 1458a_100016263591_100011352542 [0,1,0,0,0,1|1,0,1]=4 6402 B21R2.4848 O=C(C=Cc1ccccc1O)CCCc2ccccc2 1458a_100016263591_100000211621 [0,1,0,0,0,1|1,0,0]=3 6403 B21R2.4848 O=C(C=Cc1ccccc1O)CCOc2ccccc2 1458a_100016263591_100000184471 [0,1,0,0,0,1|1,0,0]=3 6404 B21R2.4848 O=C(C=Cc1ccccc1O)CCSc2ccccc2 1458a_100016263591_100000246102 [0,1,0,0,0,1|1,0,0]=3 6405 B21R2.4848 O=C(C=Cc1ccccc1O)CSCc2ccccc2 1458a_100016263591_200011217039 [0,1,0,0,0,1|0,1,0]=3 6406 B21R2.4848 O=C(C=Cc1ccccc1O)NNCc2ccccc2 22a_100000007032_100016263591 [0,1,0,0,0,1|1,0,0]=3 6407 B21R2.4848 O=C(C=Cc1ccccc1O)NNCc2ccccn2 22a_100000736832_100016263591 [0,1,0,0,0,1|2,0,0]=4 6408 B21R2.4848 O=C(C=Cc1ccccc1O)NNCc2cccnc2 22a_100000738295_100016263591 [0,1,0,0,0,1|2,0,0]=4 6409 B21R2.4848 O=C(C=Cc1ccccc1O)NNCc2ccncc2 22a_100000736929_100016263591 [0,1,0,0,0,1|2,0,0]=4 6410 B21R2.4848 O=C(CCc1ccccc1Br)COCc2ccccc2 1458a_100000230186_100012161201 [0,1,0,0,0,1|0,0,2]=4 6411 B21R2.4848 O=C(CCc1ccccc1Cl)COCc2ccccc2 1458a_100000230186_100011713703 [0,1,0,0,0,1|0,0,2]=4 6412 B21R2.4848 O=C(CCc1ccccc1F)COCc2ccccc2 1458a_100000230186_100000720011 [0,1,0,0,0,1|0,0,2]=4 6413 B21R2.4848 O=C(CCc1ccccc1O)COCc2ccccc2 1458a_100000230186_100000722297 [0,1,0,0,0,1|0,0,2]=4 6414 B21R2.4848 O=C(CNc1ccccc1Br)NOCc2ccccc2 34a_100000210017_100000230105 [0,1,0,0,0,1|1,0,1]=4 6415 B21R2.4848 O=C(CNc1ccccc1Br)OCCc2ccccc2 34a_100000210017_200000077782 [0,1,0,0,0,1|1,0,1]=4 6416 B21R2.4848 O=C(CNc1ccccc1Cl)NOCc2ccccc2 34a_100000185783_100000230105 [0,1,0,0,0,1|1,0,1]=4 6417 B21R2.4848 O=C(CNc1ccccc1Cl)OCCc2ccccc2 34a_100000185783_200000077782 [0,1,0,0,0,1|1,0,1]=4 6418 B21R2.4848 O=C(CNc1ccccc1F)NOCc2ccccc2 34a_100000210422_100000230105 [0,1,0,0,0,1|1,0,1]=4 6419 B21R2.4848 O=C(CNc1ccccc1F)OCCc2ccccc2 34a_100000210422_200000077782 [0,1,0,0,0,1|1,0,1]=4 6420 B21R2.4848 O=C(CNc1ccccc1I)NOCc2ccccc2 34a_100000210053_100000230105 [0,1,0,0,0,1|1,0,1]=4 6421 B21R2.4848 O=C(CNc1ccccc1I)OCCc2ccccc2 34a_100000210053_200000077782 [0,1,0,0,0,1|1,0,1]=4 6422 B21R2.4848 O=C(CNc1ccccc1O)NOCc2ccccc2 34a_100000185747_100000230105 [0,1,0,0,0,1|1,0,1]=4 6423 B21R2.4848 O=C(CNc1ccccc1O)OCCc2ccccc2 34a_100000185747_200000077782 [0,1,0,0,0,1|1,0,1]=4 6424 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2Br 11a_100000689332_100000230186 [0,1,0,0,0,1|1,0,1]=4 6425 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100000230186 [0,1,0,0,0,1|1,0,1]=4 6426 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2Br 240690a_100000689332_100000230186 [0,1,0,0,0,1|1,0,1]=4 6427 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2Br 527a_100000689332_100000230186 [0,1,0,0,0,1|1,0,1]=4 6428 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100000230186 [0,1,0,0,0,1|1,0,1]=4 6429 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100000230186 [0,1,0,0,0,1|1,0,1]=4 6430 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100000230186 [0,1,0,0,0,1|1,0,1]=4 6431 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2Cl 527a_100000174879_100000230186 [0,1,0,0,0,1|1,0,1]=4 6432 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2F 11a_100000174869_100000230186 [0,1,0,0,0,1|1,0,1]=4 6433 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2F 1626a_100000174869_100000230186 [0,1,0,0,0,1|1,0,1]=4 6434 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2F 240690a_100000174869_100000230186 [0,1,0,0,0,1|1,0,1]=4 6435 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2F 34a_100000210790_100000190583 [0,1,0,0,0,1|1,0,1]=4 6436 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2F 527a_100000174869_100000230186 [0,1,0,0,0,1|1,0,1]=4 6437 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2F 7a_100000210790_100000190583 [0,1,0,0,0,1|1,0,1]=4 6438 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2I 11a_100015347259_100000230186 [0,1,0,0,0,1|1,0,1]=4 6439 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2I 1626a_100015347259_100000230186 [0,1,0,0,0,1|1,0,1]=4 6440 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2I 240690a_100015347259_100000230186 [0,1,0,0,0,1|1,0,1]=4 6441 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2I 527a_100015347259_100000230186 [0,1,0,0,0,1|1,0,1]=4 6442 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2O 240690a_100000185550_100000230186 [0,1,0,0,0,1|1,0,1]=4 6443 B21R2.4848 O=C(COCc1ccccc1)NCc2ccccc2O 527a_100000185550_100000230186 [0,1,0,0,0,1|1,0,1]=4 6444 B21R2.4848 O=C(COCc1ccccc1)NNc2ccccc2Br 22a_100000241748_100000230186 [0,1,0,0,0,1|2,0,0]=4 6445 B21R2.4848 O=C(COCc1ccccc1)NNc2ccccc2Cl 22a_100000683529_100000230186 [0,1,0,0,0,1|2,0,0]=4 6446 B21R2.4848 O=C(COCc1ccccc1)NNc2ccccc2F 22a_100000239246_100000230186 [0,1,0,0,0,1|2,0,0]=4 6447 B21R2.4848 O=C(COCc1ccccc1)NNc2ccccc2I 22a_100011218156_100000230186 [0,1,0,0,0,1|2,0,0]=4 6448 B21R2.4848 O=C(COc1ccccc1Br)NOCc2ccccc2 34a_100000181306_100000230105 [0,1,0,0,0,1|1,0,1]=4 6449 B21R2.4848 O=C(COc1ccccc1Br)NOCc2ccccc2 7a_100000181306_100000230105 [0,1,0,0,0,1|1,0,1]=4 6450 B21R2.4848 O=C(COc1ccccc1Br)OCCc2ccccc2 34a_100000181306_200000077782 [0,1,0,0,0,1|1,0,1]=4 6451 B21R2.4848 O=C(COc1ccccc1Br)OCCc2ccccc2 7a_100000181306_200000077782 [0,1,0,0,0,1|1,0,1]=4 6452 B21R2.4848 O=C(COc1ccccc1Cl)NOCc2ccccc2 34a_100000210172_100000230105 [0,1,0,0,0,1|1,0,1]=4 6453 B21R2.4848 O=C(COc1ccccc1Cl)NOCc2ccccc2 7a_100000210172_100000230105 [0,1,0,0,0,1|1,0,1]=4 6454 B21R2.4848 O=C(COc1ccccc1Cl)OCCc2ccccc2 34a_100000210172_200000077782 [0,1,0,0,0,1|1,0,1]=4 6455 B21R2.4848 O=C(COc1ccccc1Cl)OCCc2ccccc2 7a_100000210172_200000077782 [0,1,0,0,0,1|1,0,1]=4 6456 B21R2.4848 O=C(COc1ccccc1F)NOCc2ccccc2 34a_100000210171_100000230105 [0,1,0,0,0,1|1,0,1]=4 6457 B21R2.4848 O=C(COc1ccccc1F)NOCc2ccccc2 7a_100000210171_100000230105 [0,1,0,0,0,1|1,0,1]=4 6458 B21R2.4848 O=C(COc1ccccc1F)OCCc2ccccc2 34a_100000210171_200000077782 [0,1,0,0,0,1|1,0,1]=4 6459 B21R2.4848 O=C(COc1ccccc1F)OCCc2ccccc2 7a_100000210171_200000077782 [0,1,0,0,0,1|1,0,1]=4 6460 B21R2.4848 O=C(COc1ccccc1I)NOCc2ccccc2 34a_100000739446_100000230105 [0,1,0,0,0,1|1,0,1]=4 6461 B21R2.4848 O=C(COc1ccccc1I)NOCc2ccccc2 7a_100000739446_100000230105 [0,1,0,0,0,1|1,0,1]=4 6462 B21R2.4848 O=C(COc1ccccc1I)OCCc2ccccc2 34a_100000739446_200000077782 [0,1,0,0,0,1|1,0,1]=4 6463 B21R2.4848 O=C(COc1ccccc1I)OCCc2ccccc2 7a_100000739446_200000077782 [0,1,0,0,0,1|1,0,1]=4 6464 B21R2.4848 O=C(CSc1ccccc1Br)NOCc2ccccc2 62a_100000230105_100000695589 [0,1,0,0,0,1|1,0,1]=4 6465 B21R2.4848 O=C(CSc1ccccc1Br)NOCc2ccccc2 62a_100000695589_100000230105 [0,1,0,0,0,1|1,0,1]=4 6466 B21R2.4848 O=C(CSc1ccccc1Br)OCCc2ccccc2 62a_100000695589_200000077782 [0,1,0,0,0,1|1,0,1]=4 6467 B21R2.4848 O=C(CSc1ccccc1Br)OCCc2ccccc2 62a_200000077782_100000695589 [0,1,0,0,0,1|1,0,1]=4 6468 B21R2.4848 O=C(CSc1ccccc1Cl)NOCc2ccccc2 62a_100000230105_100000764095 [0,1,0,0,0,1|1,0,1]=4 6469 B21R2.4848 O=C(CSc1ccccc1Cl)NOCc2ccccc2 62a_100000764095_100000230105 [0,1,0,0,0,1|1,0,1]=4 6470 B21R2.4848 O=C(CSc1ccccc1Cl)OCCc2ccccc2 62a_100000764095_200000077782 [0,1,0,0,0,1|1,0,1]=4 6471 B21R2.4848 O=C(CSc1ccccc1Cl)OCCc2ccccc2 62a_200000077782_100000764095 [0,1,0,0,0,1|1,0,1]=4 6472 B21R2.4848 O=C(CSc1ccccc1F)NOCc2ccccc2 62a_100000230105_100011215700 [0,1,0,0,0,1|1,0,1]=4 6473 B21R2.4848 O=C(CSc1ccccc1F)NOCc2ccccc2 62a_100011215700_100000230105 [0,1,0,0,0,1|1,0,1]=4 6474 B21R2.4848 O=C(CSc1ccccc1F)OCCc2ccccc2 62a_100011215700_200000077782 [0,1,0,0,0,1|1,0,1]=4 6475 B21R2.4848 O=C(CSc1ccccc1F)OCCc2ccccc2 62a_200000077782_100011215700 [0,1,0,0,0,1|1,0,1]=4 6476 B21R2.4848 O=C(CSc1ccccc1O)NOCc2ccccc2 62a_100000230105_100000739446 [0,1,0,0,0,1|1,0,1]=4 6477 B21R2.4848 O=C(CSc1ccccc1O)NOCc2ccccc2 62a_100000739446_100000230105 [0,1,0,0,0,1|1,0,1]=4 6478 B21R2.4848 O=C(CSc1ccccc1O)OCCc2ccccc2 62a_100000739446_200000077782 [0,1,0,0,0,1|1,0,1]=4 6479 B21R2.4848 O=C(CSc1ccccc1O)OCCc2ccccc2 62a_200000077782_100000739446 [0,1,0,0,0,1|1,0,1]=4 6480 B21R2.4852 CC(=NNCc1ccccc1Br)C=Cc2ccccc2 4a_200016993956_100000204604 [0,1,0,0,0,1|2,0,0]=4 6481 B21R2.4852 CC(=NNCc1ccccc1C)C=Cc2ccccc2 4a_100000737298_100000204604 [0,1,0,0,0,1|2,0,0]=4 6482 B21R2.4852 CC(=NNCc1ccccc1Cl)C=Cc2ccccc2 4a_100015187261_100000204604 [0,1,0,0,0,1|2,0,0]=4 6483 B21R2.4852 CC(=NNCc1ccccc1F)C=Cc2ccccc2 4a_100015200773_100000204604 [0,1,0,0,0,1|2,0,0]=4 6484 B21R2.4852 Cc1ccccc1C=NNC(=O)CCc2ccccc2 4a_100000189782_100000211143 [0,1,0,0,0,1|2,0,0]=4 6485 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccccc2 11a_100000685071_100000210462 [0,1,0,0,0,1|1,0,0]=3 6486 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccccc2 1626a_100000685071_100000210462 [0,1,0,0,0,1|1,0,0]=3 6487 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccccn2 11a_100000685071_100000740811 [0,1,0,0,0,1|2,0,0]=4 6488 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccccn2 240690a_100000685071_100000740811 [0,1,0,0,0,1|2,0,0]=4 6489 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2cccnc2 11a_100000685071_100000735890 [0,1,0,0,0,1|2,0,0]=4 6490 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2cccnc2 240690a_100000685071_100000735890 [0,1,0,0,0,1|2,0,0]=4 6491 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccncc2 240690a_100000685071_100000682801 [0,1,0,0,0,1|2,0,0]=4 6492 B21R2.4852 Cc1ccccc1CCNC(=O)OCc2ccccc2 271570a_200010239705_100000210755 [0,1,0,0,0,1|0,0,2]=4 6493 B21R2.4852 Cc1ccccc1CNCC(=O)OCc2ccccc2 34a_100000174972_100000753625 [0,1,0,0,0,1|0,0,2]=4 6494 B21R2.4852 Cc1ccccc1CNNC(=O)C=Cc2ccccc2 22a_100000737298_100000210462 [0,1,0,0,0,1|1,0,0]=3 6495 B21R2.4852 Cc1ccccc1CNNC(=O)C=Cc2ccccn2 22a_100000737298_100000740811 [0,1,0,0,0,1|2,0,0]=4 6496 B21R2.4852 Cc1ccccc1CNNC(=O)C=Cc2cccnc2 22a_100000737298_100000735890 [0,1,0,0,0,1|2,0,0]=4 6497 B21R2.4852 Cc1ccccc1CNNC(=O)C=Cc2ccncc2 22a_100000737298_100000682801 [0,1,0,0,0,1|2,0,0]=4 6498 B21R2.4852 Cc1ccccc1COCC(=O)CCc2ccccc2 34a_100000698903_100012361361 [0,1,0,0,0,1|0,0,2]=4 6499 B21R2.4852 Cc1ccccc1COCC(=O)CCc2ccccc2 7a_100000698903_100012361361 [0,1,0,0,0,1|0,0,2]=4 6500 B21R2.4852 Cc1ccccc1COCC(=O)NCc2ccccc2 34a_100000698903_100000183539 [0,1,0,0,0,1|1,0,1]=4 6501 B21R2.4852 Cc1ccccc1COCC(=O)NCc2ccccc2 7a_100000698903_100000183539 [0,1,0,0,0,1|1,0,1]=4 6502 B21R2.4852 Cc1ccccc1COCC(=O)OCc2ccccc2 34a_100000698903_100000753625 [0,1,0,0,0,1|0,0,2]=4 6503 B21R2.4852 Cc1ccccc1COCC(=O)OCc2ccccc2 7a_100000698903_100000753625 [0,1,0,0,0,1|0,0,2]=4 6504 B21R2.4852 Cc1ccccc1CSCC(=O)OCc2ccccc2 62a_100000211839_100000753625 [0,1,0,0,0,1|0,0,2]=4 6505 B21R2.4852 Cc1ccccc1CSCC(=O)OCc2ccccc2 62a_100000753625_100000211839 [0,1,0,0,0,1|0,0,2]=4 6506 B21R2.4852 Cc1ccccc1OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000184434 [0,1,0,0,0,1|1,0,0]=3 6507 B21R2.4852 Cc1ccccc1OCCC(=O)C=Cc2ccccn2 1458a_100000740811_100000184434 [0,1,0,0,0,1|2,0,0]=4 6508 B21R2.4852 Cc1ccccc1OCCC(=O)C=Cc2cccnc2 1458a_100000735890_100000184434 [0,1,0,0,0,1|2,0,0]=4 6509 B21R2.4852 Cc1ccccc1OCCC(=O)C=Cc2ccncc2 1458a_100000682801_100000184434 [0,1,0,0,0,1|2,0,0]=4 6510 B21R2.4852 Cc1ccccc1OCCC(=O)OCc2ccccc2 7a_100000210338_100009813219 [0,1,0,0,0,1|0,0,2]=4 6511 B21R2.4852 Cc1ccccc1SCCC(=O)OCc2ccccc2 62a_100000210755_100009813219 [0,1,0,0,0,1|0,0,2]=4 6512 B21R2.4852 Cc1ccccc1SCCC(=O)OCc2ccccc2 62a_100009813219_100000210755 [0,1,0,0,0,1|0,0,2]=4 6513 B21R2.4852 Nc1ccccc1CCNC(=O)OCc2ccccc2 271570a_200010239705_100000210017 [0,1,0,0,0,1|0,0,2]=4 6514 B21R2.4852 Nc1ccccc1COCC(=O)CCc2ccccc2 34a_100000212039_100012361361 [0,1,0,0,0,1|0,0,2]=4 6515 B21R2.4852 Nc1ccccc1COCC(=O)NCc2ccccc2 34a_100000212039_100000183539 [0,1,0,0,0,1|1,0,1]=4 6516 B21R2.4852 Nc1ccccc1COCC(=O)OCc2ccccc2 34a_100000212039_100000753625 [0,1,0,0,0,1|0,0,2]=4 6517 B21R2.4852 Nc1ccccc1OCCC(=O)OCc2ccccc2 7a_100000185747_100009813219 [0,1,0,0,0,1|0,0,2]=4 6518 B21R2.4852 Nc1ccccc1SCCC(=O)OCc2ccccc2 62a_100000210017_100009813219 [0,1,0,0,0,1|0,0,2]=4 6519 B21R2.4852 Nc1ccccc1SCCC(=O)OCc2ccccc2 62a_100009813219_100000210017 [0,1,0,0,0,1|0,0,2]=4 6520 B21R2.4852 O=C(C=Cc1ccccc1)CC#Cc2ccccc2Br 1458a_100000210462_100010706765 [0,1,0,0,0,1|1,0,1]=4 6521 B21R2.4852 O=C(C=Cc1ccccc1)CC#Cc2ccccc2F 1458a_100000210462_100010404167 [0,1,0,0,0,1|1,0,1]=4 6522 B21R2.4852 O=C(C=Cc1ccccc1)CCCc2ccccc2Br 1458a_100000210462_200011713681 [0,1,0,0,0,1|1,0,0]=3 6523 B21R2.4852 O=C(C=Cc1ccccc1)CCOc2ccccc2Br 1458a_100000210462_100000695877 [0,1,0,0,0,1|1,0,0]=3 6524 B21R2.4852 O=C(C=Cc1ccccc1)CCOc2ccccc2F 1458a_100000210462_100000183290 [0,1,0,0,0,1|1,0,0]=3 6525 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2Br 11a_100000747383_100000210462 [0,1,0,0,0,1|1,0,0]=3 6526 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2Br 1626a_100000747383_100000210462 [0,1,0,0,0,1|1,0,0]=3 6527 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2Cl 11a_100011207228_100000210462 [0,1,0,0,0,1|1,0,0]=3 6528 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2Cl 1626a_100011207228_100000210462 [0,1,0,0,0,1|1,0,0]=3 6529 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2F 11a_100000185272_100000210462 [0,1,0,0,0,1|1,0,0]=3 6530 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2F 1626a_100000185272_100000210462 [0,1,0,0,0,1|1,0,0]=3 6531 B21R2.4852 O=C(C=Cc1ccccc1)NCCn2ccccc2=O 1626a_100000687133_100000210462 [0,1,0,0,0,1|2,0,0]=4 6532 B21R2.4852 O=C(C=Cc1ccccc1)NNCc2ccccc2Br 22a_200016993956_100000210462 [0,1,0,0,0,1|1,0,0]=3 6533 B21R2.4852 O=C(C=Cc1ccccc1)NNCc2ccccc2Cl 22a_100015187261_100000210462 [0,1,0,0,0,1|1,0,0]=3 6534 B21R2.4852 O=C(C=Cc1ccccc1)NNCc2ccccc2F 22a_100015200773_100000210462 [0,1,0,0,0,1|1,0,0]=3 6535 B21R2.4852 O=C(C=Cc1ccccn1)CCCc2ccccc2Br 1458a_100000740811_200011713681 [0,1,0,0,0,1|2,0,0]=4 6536 B21R2.4852 O=C(C=Cc1ccccn1)CCOc2ccccc2Br 1458a_100000740811_100000695877 [0,1,0,0,0,1|2,0,0]=4 6537 B21R2.4852 O=C(C=Cc1ccccn1)CCOc2ccccc2F 1458a_100000740811_100000183290 [0,1,0,0,0,1|2,0,0]=4 6538 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2Br 11a_100000747383_100000740811 [0,1,0,0,0,1|2,0,0]=4 6539 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2Br 240690a_100000747383_100000740811 [0,1,0,0,0,1|2,0,0]=4 6540 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2Cl 11a_100011207228_100000740811 [0,1,0,0,0,1|2,0,0]=4 6541 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2Cl 240690a_100011207228_100000740811 [0,1,0,0,0,1|2,0,0]=4 6542 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2F 11a_100000185272_100000740811 [0,1,0,0,0,1|2,0,0]=4 6543 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2F 240690a_100000185272_100000740811 [0,1,0,0,0,1|2,0,0]=4 6544 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2O 240690a_100011207237_100000740811 [0,1,0,0,0,1|2,0,0]=4 6545 B21R2.4852 O=C(C=Cc1ccccn1)NNCc2ccccc2Br 22a_200016993956_100000740811 [0,1,0,0,0,1|2,0,0]=4 6546 B21R2.4852 O=C(C=Cc1ccccn1)NNCc2ccccc2Cl 22a_100015187261_100000740811 [0,1,0,0,0,1|2,0,0]=4 6547 B21R2.4852 O=C(C=Cc1ccccn1)NNCc2ccccc2F 22a_100015200773_100000740811 [0,1,0,0,0,1|2,0,0]=4 6548 B21R2.4852 O=C(C=Cc1cccnc1)CCCc2ccccc2Br 1458a_100000735890_200011713681 [0,1,0,0,0,1|2,0,0]=4 6549 B21R2.4852 O=C(C=Cc1cccnc1)CCOc2ccccc2Br 1458a_100000735890_100000695877 [0,1,0,0,0,1|2,0,0]=4 6550 B21R2.4852 O=C(C=Cc1cccnc1)CCOc2ccccc2F 1458a_100000735890_100000183290 [0,1,0,0,0,1|2,0,0]=4 6551 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2Br 11a_100000747383_100000735890 [0,1,0,0,0,1|2,0,0]=4 6552 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2Br 240690a_100000747383_100000735890 [0,1,0,0,0,1|2,0,0]=4 6553 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2Cl 11a_100011207228_100000735890 [0,1,0,0,0,1|2,0,0]=4 6554 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2Cl 240690a_100011207228_100000735890 [0,1,0,0,0,1|2,0,0]=4 6555 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2F 11a_100000185272_100000735890 [0,1,0,0,0,1|2,0,0]=4 6556 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2F 240690a_100000185272_100000735890 [0,1,0,0,0,1|2,0,0]=4 6557 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2O 240690a_100011207237_100000735890 [0,1,0,0,0,1|2,0,0]=4 6558 B21R2.4852 O=C(C=Cc1cccnc1)NNCc2ccccc2Br 22a_200016993956_100000735890 [0,1,0,0,0,1|2,0,0]=4 6559 B21R2.4852 O=C(C=Cc1cccnc1)NNCc2ccccc2Cl 22a_100015187261_100000735890 [0,1,0,0,0,1|2,0,0]=4 6560 B21R2.4852 O=C(C=Cc1cccnc1)NNCc2ccccc2F 22a_100015200773_100000735890 [0,1,0,0,0,1|2,0,0]=4 6561 B21R2.4852 O=C(C=Cc1ccncc1)CCCc2ccccc2Br 1458a_100000682801_200011713681 [0,1,0,0,0,1|2,0,0]=4 6562 B21R2.4852 O=C(C=Cc1ccncc1)CCOc2ccccc2Br 1458a_100000682801_100000695877 [0,1,0,0,0,1|2,0,0]=4 6563 B21R2.4852 O=C(C=Cc1ccncc1)CCOc2ccccc2F 1458a_100000682801_100000183290 [0,1,0,0,0,1|2,0,0]=4 6564 B21R2.4852 O=C(C=Cc1ccncc1)NCCc2ccccc2Br 240690a_100000747383_100000682801 [0,1,0,0,0,1|2,0,0]=4 6565 B21R2.4852 O=C(C=Cc1ccncc1)NCCc2ccccc2Cl 240690a_100011207228_100000682801 [0,1,0,0,0,1|2,0,0]=4 6566 B21R2.4852 O=C(C=Cc1ccncc1)NCCc2ccccc2F 240690a_100000185272_100000682801 [0,1,0,0,0,1|2,0,0]=4 6567 B21R2.4852 O=C(C=Cc1ccncc1)NCCc2ccccc2O 240690a_100011207237_100000682801 [0,1,0,0,0,1|2,0,0]=4 6568 B21R2.4852 O=C(C=Cc1ccncc1)NNCc2ccccc2Br 22a_200016993956_100000682801 [0,1,0,0,0,1|2,0,0]=4 6569 B21R2.4852 O=C(C=Cc1ccncc1)NNCc2ccccc2Cl 22a_100015187261_100000682801 [0,1,0,0,0,1|2,0,0]=4 6570 B21R2.4852 O=C(C=Cc1ccncc1)NNCc2ccccc2F 22a_100015200773_100000682801 [0,1,0,0,0,1|2,0,0]=4 6571 B21R2.4852 O=C(CCOc1ccccc1Br)OCc2ccccc2 7a_100000181306_100009813219 [0,1,0,0,0,1|0,0,2]=4 6572 B21R2.4852 O=C(CCOc1ccccc1Cl)OCc2ccccc2 7a_100000210172_100009813219 [0,1,0,0,0,1|0,0,2]=4 6573 B21R2.4852 O=C(CCOc1ccccc1F)OCc2ccccc2 7a_100000210171_100009813219 [0,1,0,0,0,1|0,0,2]=4 6574 B21R2.4852 O=C(CCOc1ccccc1I)OCc2ccccc2 7a_100000739446_100009813219 [0,1,0,0,0,1|0,0,2]=4 6575 B21R2.4852 O=C(CCSc1ccccc1Br)OCc2ccccc2 62a_100000695589_100009813219 [0,1,0,0,0,1|0,0,2]=4 6576 B21R2.4852 O=C(CCSc1ccccc1Br)OCc2ccccc2 62a_100009813219_100000695589 [0,1,0,0,0,1|0,0,2]=4 6577 B21R2.4852 O=C(CCSc1ccccc1Cl)OCc2ccccc2 62a_100000764095_100009813219 [0,1,0,0,0,1|0,0,2]=4 6578 B21R2.4852 O=C(CCSc1ccccc1Cl)OCc2ccccc2 62a_100009813219_100000764095 [0,1,0,0,0,1|0,0,2]=4 6579 B21R2.4852 O=C(CCSc1ccccc1F)OCc2ccccc2 62a_100009813219_100011215700 [0,1,0,0,0,1|0,0,2]=4 6580 B21R2.4852 O=C(CCSc1ccccc1F)OCc2ccccc2 62a_100011215700_100009813219 [0,1,0,0,0,1|0,0,2]=4 6581 B21R2.4852 O=C(CCSc1ccccc1O)OCc2ccccc2 62a_100000739446_100009813219 [0,1,0,0,0,1|0,0,2]=4 6582 B21R2.4852 O=C(CCSc1ccccc1O)OCc2ccccc2 62a_100009813219_100000739446 [0,1,0,0,0,1|0,0,2]=4 6583 B21R2.4852 O=C(CCc1ccccc1)COCc2ccccc2Br 34a_100000756307_100012361361 [0,1,0,0,0,1|0,0,2]=4 6584 B21R2.4852 O=C(CCc1ccccc1)COCc2ccccc2Br 7a_100000756307_100012361361 [0,1,0,0,0,1|0,0,2]=4 6585 B21R2.4852 O=C(CCc1ccccc1)COCc2ccccc2Cl 34a_100000210847_100012361361 [0,1,0,0,0,1|0,0,2]=4 6586 B21R2.4852 O=C(CCc1ccccc1)COCc2ccccc2Cl 7a_100000210847_100012361361 [0,1,0,0,0,1|0,0,2]=4 6587 B21R2.4852 O=C(CCc1ccccc1)COCc2ccccc2F 34a_100000211962_100012361361 [0,1,0,0,0,1|0,0,2]=4 6588 B21R2.4852 O=C(CCc1ccccc1)COCc2ccccc2F 7a_100000211962_100012361361 [0,1,0,0,0,1|0,0,2]=4 6589 B21R2.4852 O=C(CCc1ccccc1)COCc2ccccc2I 34a_100000187465_100012361361 [0,1,0,0,0,1|0,0,2]=4 6590 B21R2.4852 O=C(CCc1ccccc1)COCc2ccccc2I 7a_100000187465_100012361361 [0,1,0,0,0,1|0,0,2]=4 6591 B21R2.4852 O=C(CCc1ccccc1)NN=Cc2ccccc2Br 4a_100000189782_100000211189 [0,1,0,0,0,1|2,0,0]=4 6592 B21R2.4852 O=C(CCc1ccccc1)NN=Cc2ccccc2Cl 4a_100000189782_100000210073 [0,1,0,0,0,1|2,0,0]=4 6593 B21R2.4852 O=C(CCc1ccccc1)NN=Cc2ccccc2F 4a_100000189782_100000210811 [0,1,0,0,0,1|2,0,0]=4 6594 B21R2.4852 O=C(CCc1ccccc1)NN=Cc2ccccc2I 4a_100000189782_100000010305 [0,1,0,0,0,1|2,0,0]=4 6595 B21R2.4852 O=C(CCc1ccccc1)NN=Cc2ccccc2O 4a_100000189782_100000185834 [0,1,0,0,0,1|2,0,0]=4 6596 B21R2.4852 O=C(CNCc1ccccc1Br)OCc2ccccc2 2230a_100000689332_100000753625 [0,1,0,0,0,1|0,0,2]=4 6597 B21R2.4852 O=C(CNCc1ccccc1Br)OCc2ccccc2 34a_100000689332_100000753625 [0,1,0,0,0,1|0,0,2]=4 6598 B21R2.4852 O=C(CNCc1ccccc1Cl)OCc2ccccc2 2230a_100000174879_100000753625 [0,1,0,0,0,1|0,0,2]=4 6599 B21R2.4852 O=C(CNCc1ccccc1Cl)OCc2ccccc2 34a_100000174879_100000753625 [0,1,0,0,0,1|0,0,2]=4 6600 B21R2.4852 O=C(CNCc1ccccc1F)OCc2ccccc2 34a_100000174869_100000753625 [0,1,0,0,0,1|0,0,2]=4 6601 B21R2.4852 O=C(CNCc1ccccc1O)OCc2ccccc2 34a_100000185550_100000753625 [0,1,0,0,0,1|0,0,2]=4 6602 B21R2.4852 O=C(COCc1ccccc1Br)NCc2ccccc2 34a_100000756307_100000183539 [0,1,0,0,0,1|1,0,1]=4 6603 B21R2.4852 O=C(COCc1ccccc1Br)NCc2ccccc2 7a_100000756307_100000183539 [0,1,0,0,0,1|1,0,1]=4 6604 B21R2.4852 O=C(COCc1ccccc1Br)OCc2ccccc2 34a_100000756307_100000753625 [0,1,0,0,0,1|0,0,2]=4 6605 B21R2.4852 O=C(COCc1ccccc1Br)OCc2ccccc2 7a_100000756307_100000753625 [0,1,0,0,0,1|0,0,2]=4 6606 B21R2.4852 O=C(COCc1ccccc1Cl)NCc2ccccc2 34a_100000210847_100000183539 [0,1,0,0,0,1|1,0,1]=4 6607 B21R2.4852 O=C(COCc1ccccc1Cl)NCc2ccccc2 7a_100000210847_100000183539 [0,1,0,0,0,1|1,0,1]=4 6608 B21R2.4852 O=C(COCc1ccccc1Cl)OCc2ccccc2 34a_100000210847_100000753625 [0,1,0,0,0,1|0,0,2]=4 6609 B21R2.4852 O=C(COCc1ccccc1Cl)OCc2ccccc2 7a_100000210847_100000753625 [0,1,0,0,0,1|0,0,2]=4 6610 B21R2.4852 O=C(COCc1ccccc1F)NCc2ccccc2 34a_100000211962_100000183539 [0,1,0,0,0,1|1,0,1]=4 6611 B21R2.4852 O=C(COCc1ccccc1F)NCc2ccccc2 7a_100000211962_100000183539 [0,1,0,0,0,1|1,0,1]=4 6612 B21R2.4852 O=C(COCc1ccccc1F)OCc2ccccc2 34a_100000211962_100000753625 [0,1,0,0,0,1|0,0,2]=4 6613 B21R2.4852 O=C(COCc1ccccc1F)OCc2ccccc2 7a_100000211962_100000753625 [0,1,0,0,0,1|0,0,2]=4 6614 B21R2.4852 O=C(COCc1ccccc1I)NCc2ccccc2 34a_100000187465_100000183539 [0,1,0,0,0,1|1,0,1]=4 6615 B21R2.4852 O=C(COCc1ccccc1I)NCc2ccccc2 7a_100000187465_100000183539 [0,1,0,0,0,1|1,0,1]=4 6616 B21R2.4852 O=C(COCc1ccccc1I)OCc2ccccc2 34a_100000187465_100000753625 [0,1,0,0,0,1|0,0,2]=4 6617 B21R2.4852 O=C(COCc1ccccc1I)OCc2ccccc2 7a_100000187465_100000753625 [0,1,0,0,0,1|0,0,2]=4 6618 B21R2.4852 O=C(CSCc1ccccc1Br)OCc2ccccc2 62a_100000184730_100000753625 [0,1,0,0,0,1|0,0,2]=4 6619 B21R2.4852 O=C(CSCc1ccccc1Br)OCc2ccccc2 62a_100000753625_100000184730 [0,1,0,0,0,1|0,0,2]=4 6620 B21R2.4852 O=C(CSCc1ccccc1Cl)OCc2ccccc2 62a_100000187162_100000753625 [0,1,0,0,0,1|0,0,2]=4 6621 B21R2.4852 O=C(CSCc1ccccc1Cl)OCc2ccccc2 62a_100000753625_100000187162 [0,1,0,0,0,1|0,0,2]=4 6622 B21R2.4852 O=C(CSCc1ccccc1F)OCc2ccccc2 62a_100000211605_100000753625 [0,1,0,0,0,1|0,0,2]=4 6623 B21R2.4852 O=C(CSCc1ccccc1F)OCc2ccccc2 62a_100000753625_100000211605 [0,1,0,0,0,1|0,0,2]=4 6624 B21R2.4852 O=C(CSCc1ccccc1I)OCc2ccccc2 62a_100000753625_100011216222 [0,1,0,0,0,1|0,0,2]=4 6625 B21R2.4852 O=C(CSCc1ccccc1I)OCc2ccccc2 62a_100011216222_100000753625 [0,1,0,0,0,1|0,0,2]=4 6626 B21R2.4852 O=C(NCCc1ccccc1Br)OCc2ccccc2 271570a_200010239705_100000695589 [0,1,0,0,0,1|0,0,2]=4 6627 B21R2.4852 O=C(NCCc1ccccc1Cl)OCc2ccccc2 271570a_200010239705_100000764095 [0,1,0,0,0,1|0,0,2]=4 6628 B21R2.4852 O=C(NCCc1ccccc1F)OCc2ccccc2 271570a_200010239705_100011215700 [0,1,0,0,0,1|0,0,2]=4 6629 B21R2.4852 O=C(NCCc1ccccc1O)OCc2ccccc2 271570a_200010239705_100000739446 [0,1,0,0,0,1|0,0,2]=4 6630 B21R2.18995 CC(=NNCc1ccccc1)C=Cc2ccc(cc2)Br 4a_100000007032_200016259395 [0,1,0,0,0,1|2,0,0]=4 6631 B21R2.18995 CC(=NNCc1ccccc1)C=Cc2ccc(cc2)Cl 4a_100000007032_100016256711 [0,1,0,0,0,1|2,0,0]=4 6632 B21R2.18995 CC(=NNCc1ccccc1)C=Cc2ccc(cc2)O 4a_100000007032_100000189429 [0,1,0,0,0,1|2,0,0]=4 6633 B21R2.18995 Cc1ccc(cc1)C=CC(=O)C/C=C/c2ccccc2 1458a_100000716854_100016265936 [0,1,0,0,0,1|1,0,1]=4 6634 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CC#Cc2ccccc2 1458a_100000716854_100011352542 [0,1,0,0,0,1|1,0,1]=4 6635 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CCCc2ccccc2 1458a_100000716854_100000211621 [0,1,0,0,0,1|1,0,0]=3 6636 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CCOc2ccccc2 1458a_100000716854_100000184471 [0,1,0,0,0,1|1,0,0]=3 6637 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CCSc2ccccc2 1458a_100000716854_100000246102 [0,1,0,0,0,1|1,0,0]=3 6638 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CSCc2ccccc2 1458a_100000716854_200011217039 [0,1,0,0,0,1|0,1,0]=3 6639 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000716854 [0,1,0,0,0,1|1,0,0]=3 6640 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000716854 [0,1,0,0,0,1|1,0,0]=3 6641 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000716854 [0,1,0,0,0,1|1,0,0]=3 6642 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000716854 [0,1,0,0,0,1|2,0,0]=4 6643 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000716854 [0,1,0,0,0,1|2,0,0]=4 6644 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100000716854 [0,1,0,0,0,1|2,0,0]=4 6645 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000716854 [0,1,0,0,0,1|2,0,0]=4 6646 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000716854 [0,1,0,0,0,1|2,0,0]=4 6647 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100000716854 [0,1,0,0,0,1|2,0,0]=4 6648 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000716854 [0,1,0,0,0,1|2,0,0]=4 6649 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000716854 [0,1,0,0,0,1|2,0,0]=4 6650 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100000716854 [0,1,0,0,0,1|2,0,0]=4 6651 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000716854 [0,1,0,0,0,1|1,0,0]=3 6652 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NNCc2ccccn2 22a_100000736832_100000716854 [0,1,0,0,0,1|2,0,0]=4 6653 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NNCc2cccnc2 22a_100000738295_100000716854 [0,1,0,0,0,1|2,0,0]=4 6654 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NNCc2ccncc2 22a_100000736929_100000716854 [0,1,0,0,0,1|2,0,0]=4 6655 B21R2.18995 Cc1ccc(cc1)CCC(=O)C/C=C/c2ccccc2 1458a_100000234883_100016265936 [0,1,0,0,0,1|1,0,0]=3 6656 B21R2.18995 Cc1ccc(cc1)CCC(=O)C/C=C/c2ccccc2 1458a_100011219626_100011713686 [0,1,0,0,0,1|1,0,0]=3 6657 B21R2.18995 Cc1ccc(cc1)CCC(=O)C=CSc2ccccc2 1458a_100016262050_100011713686 [0,1,0,0,0,1|1,0,0]=3 6658 B21R2.18995 Cc1ccc(cc1)CCC(=O)COCc2ccccc2 1458a_100000230186_100011713686 [0,1,0,0,0,1|0,0,2]=4 6659 B21R2.18995 Cc1ccc(cc1)CNC(=O)C/C=C/c2ccccc2 11a_100000174908_100011219626 [0,1,0,0,0,1|1,0,0]=3 6660 B21R2.18995 Cc1ccc(cc1)CNC(=O)C/C=C/c2ccccc2 1626a_100000174908_100011219626 [0,1,0,0,0,1|1,0,0]=3 6661 B21R2.18995 Cc1ccc(cc1)CNC(=O)C/C=C/c2ccccc2 240690a_100000174908_100011219626 [0,1,0,0,0,1|1,0,0]=3 6662 B21R2.18995 Cc1ccc(cc1)CNC(=O)C=CSc2ccccc2 11a_100000174908_100016262050 [0,1,0,0,0,1|1,0,0]=3 6663 B21R2.18995 Cc1ccc(cc1)CNC(=O)C=CSc2ccccc2 1626a_100000174908_100016262050 [0,1,0,0,0,1|1,0,0]=3 6664 B21R2.18995 Cc1ccc(cc1)CNC(=O)C=CSc2ccccc2 240690a_100000174908_100016262050 [0,1,0,0,0,1|1,0,0]=3 6665 B21R2.18995 Cc1ccc(cc1)CNC(=O)COCc2ccccc2 11a_100000174908_100000230186 [0,1,0,0,0,1|1,0,1]=4 6666 B21R2.18995 Cc1ccc(cc1)CNC(=O)COCc2ccccc2 1626a_100000174908_100000230186 [0,1,0,0,0,1|1,0,1]=4 6667 B21R2.18995 Cc1ccc(cc1)CNC(=O)COCc2ccccc2 240690a_100000174908_100000230186 [0,1,0,0,0,1|1,0,1]=4 6668 B21R2.18995 Cc1ccc(cc1)CNC(=O)COCc2ccccc2 34a_100000210790_100000183211 [0,1,0,0,0,1|1,0,1]=4 6669 B21R2.18995 Cc1ccc(cc1)CNC(=O)COCc2ccccc2 527a_100000174908_100000230186 [0,1,0,0,0,1|1,0,1]=4 6670 B21R2.18995 Cc1ccc(cc1)CNC(=O)COCc2ccccc2 7a_100000210790_100000183211 [0,1,0,0,0,1|1,0,1]=4 6671 B21R2.18995 Cc1ccc(cc1)NCC(=O)NOCc2ccccc2 34a_100000124888_100000230105 [0,1,0,0,0,1|1,0,1]=4 6672 B21R2.18995 Cc1ccc(cc1)NCC(=O)OCCc2ccccc2 34a_100000124888_200000077782 [0,1,0,0,0,1|1,0,1]=4 6673 B21R2.18995 Cc1ccc(cc1)NNC(=O)C/C=C/c2ccccc2 22a_100000683527_100011219626 [0,1,0,0,0,1|2,0,0]=4 6674 B21R2.18995 Cc1ccc(cc1)NNC(=O)C=CSc2ccccc2 22a_100000683527_100016262050 [0,1,0,0,0,1|2,0,0]=4 6675 B21R2.18995 Cc1ccc(cc1)NNC(=O)COCc2ccccc2 22a_100000683527_100000230186 [0,1,0,0,0,1|2,0,0]=4 6676 B21R2.18995 Cc1ccc(cc1)OCC(=O)C/C=C/c2ccccc2 1458a_100000182360_100016265936 [0,1,0,0,0,1|2,0,0]=4 6677 B21R2.18995 Cc1ccc(cc1)OCC(=O)NOCc2ccccc2 34a_100000210336_100000230105 [0,1,0,0,0,1|1,0,1]=4 6678 B21R2.18995 Cc1ccc(cc1)OCC(=O)NOCc2ccccc2 7a_100000210336_100000230105 [0,1,0,0,0,1|1,0,1]=4 6679 B21R2.18995 Cc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000210336_200000077782 [0,1,0,0,0,1|1,0,1]=4 6680 B21R2.18995 Cc1ccc(cc1)OCC(=O)OCCc2ccccc2 7a_100000210336_200000077782 [0,1,0,0,0,1|1,0,1]=4 6681 B21R2.18995 Cc1ccc(cc1)SCC(=O)C/C=C/c2ccccc2 1458a_100000179497_100016265936 [0,1,0,0,0,1|2,0,0]=4 6682 B21R2.18995 Cc1ccc(cc1)SCC(=O)NOCc2ccccc2 62a_100000186775_100000230105 [0,1,0,0,0,1|1,0,1]=4 6683 B21R2.18995 Cc1ccc(cc1)SCC(=O)NOCc2ccccc2 62a_100000230105_100000186775 [0,1,0,0,0,1|1,0,1]=4 6684 B21R2.18995 Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100000186775_200000077782 [0,1,0,0,0,1|1,0,1]=4 6685 B21R2.18995 Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000186775 [0,1,0,0,0,1|1,0,1]=4 6686 B21R2.18995 Cc1ccc(cn1)CNC(=O)C/C=C/c2ccccc2 11a_100000740942_100011219626 [0,1,0,0,0,1|2,0,0]=4 6687 B21R2.18995 Cc1ccc(cn1)CNC(=O)C/C=C/c2ccccc2 1626a_100000740942_100011219626 [0,1,0,0,0,1|2,0,0]=4 6688 B21R2.18995 Cc1ccc(cn1)CNC(=O)C/C=C/c2ccccc2 240690a_100000740942_100011219626 [0,1,0,0,0,1|2,0,0]=4 6689 B21R2.18995 Cc1ccc(cn1)CNC(=O)C=CSc2ccccc2 11a_100000740942_100016262050 [0,1,0,0,0,1|2,0,0]=4 6690 B21R2.18995 Cc1ccc(cn1)CNC(=O)C=CSc2ccccc2 1626a_100000740942_100016262050 [0,1,0,0,0,1|2,0,0]=4 6691 B21R2.18995 Cc1ccc(cn1)CNC(=O)C=CSc2ccccc2 240690a_100000740942_100016262050 [0,1,0,0,0,1|2,0,0]=4 6692 B21R2.18995 Cc1ccc(nc1)CNC(=O)C/C=C/c2ccccc2 11a_100015187455_100011219626 [0,1,0,0,0,1|2,0,0]=4 6693 B21R2.18995 Cc1ccc(nc1)CNC(=O)C/C=C/c2ccccc2 1626a_100015187455_100011219626 [0,1,0,0,0,1|2,0,0]=4 6694 B21R2.18995 Cc1ccc(nc1)CNC(=O)C/C=C/c2ccccc2 240690a_100015187455_100011219626 [0,1,0,0,0,1|2,0,0]=4 6695 B21R2.18995 Cc1ccc(nc1)CNC(=O)C=CSc2ccccc2 11a_100015187455_100016262050 [0,1,0,0,0,1|2,0,0]=4 6696 B21R2.18995 Cc1ccc(nc1)CNC(=O)C=CSc2ccccc2 1626a_100015187455_100016262050 [0,1,0,0,0,1|2,0,0]=4 6697 B21R2.18995 Cc1ccc(nc1)CNC(=O)C=CSc2ccccc2 240690a_100015187455_100016262050 [0,1,0,0,0,1|2,0,0]=4 6698 B21R2.18995 Cc1cnc(cn1)C=CC(=O)COCc2ccccc2 6a_100000685221_100011215004 [0,1,0,0,0,1|2,0,0]=4 6699 B21R2.18995 Cc1ncc(cn1)C=CC(=O)COCc2ccccc2 6a_100011202771_100011215004 [0,1,0,0,0,1|2,0,0]=4 6700 B21R2.18995 Nc1ccc(cc1)OCC(=O)NOCc2ccccc2 34a_100000185829_100000230105 [0,1,0,0,0,1|1,0,1]=4 6701 B21R2.18995 Nc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000185829_200000077782 [0,1,0,0,0,1|1,0,1]=4 6702 B21R2.18995 Nc1ccc(cc1)SCC(=O)NOCc2ccccc2 62a_100000185761_100000230105 [0,1,0,0,0,1|1,0,1]=4 6703 B21R2.18995 Nc1ccc(cc1)SCC(=O)NOCc2ccccc2 62a_100000230105_100000185761 [0,1,0,0,0,1|1,0,1]=4 6704 B21R2.18995 Nc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100000185761_200000077782 [0,1,0,0,0,1|1,0,1]=4 6705 B21R2.18995 Nc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000185761 [0,1,0,0,0,1|1,0,1]=4 6706 B21R2.18995 O=C(C#Cc1ccc(cc1)Br)C/C=C/c2ccccc2 1458a_100012100275_100016265936 [0,1,0,0,0,1|1,0,1]=4 6707 B21R2.18995 O=C(C#Cc1ccc(cc1)Cl)C/C=C/c2ccccc2 1458a_100011892723_100016265936 [0,1,0,0,0,1|1,0,1]=4 6708 B21R2.18995 O=C(C#Cc1ccc(cc1)F)C/C=C/c2ccccc2 1458a_100000238512_100016265936 [0,1,0,0,0,1|1,0,1]=4 6709 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)Br 1458a_100000217147_100016265936 [0,1,0,0,0,1|1,0,0]=3 6710 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)Br 1458a_100011219626_100011740612 [0,1,0,0,0,1|1,0,0]=3 6711 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)Cl 1458a_100000235379_100016265936 [0,1,0,0,0,1|1,0,0]=3 6712 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)Cl 1458a_100011219626_100011713675 [0,1,0,0,0,1|1,0,0]=3 6713 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)F 1458a_100000198493_100016265936 [0,1,0,0,0,1|1,0,0]=3 6714 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)F 1458a_100011219626_100011217392 [0,1,0,0,0,1|1,0,0]=3 6715 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)I 1458a_100011217499_100016265936 [0,1,0,0,0,1|1,0,0]=3 6716 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)O 1458a_100000742835_100016265936 [0,1,0,0,0,1|1,0,0]=3 6717 B21R2.18995 O=C(C/C=C/c1ccccc1)CCc2ccc(cc2)O 1458a_100011219626_100009816426 [0,1,0,0,0,1|1,0,0]=3 6718 B21R2.18995 O=C(C/C=C/c1ccccc1)COc2ccc(cc2)Br 1458a_100000182358_100016265936 [0,1,0,0,0,1|2,0,0]=4 6719 B21R2.18995 O=C(C/C=C/c1ccccc1)COc2ccc(cc2)Cl 1458a_100016990877_100016265936 [0,1,0,0,0,1|2,0,0]=4 6720 B21R2.18995 O=C(C/C=C/c1ccccc1)COc2ccc(cc2)F 1458a_100000184765_100016265936 [0,1,0,0,0,1|2,0,0]=4 6721 B21R2.18995 O=C(C/C=C/c1ccccc1)COc2ccc(cc2)I 1458a_100000184369_100016265936 [0,1,0,0,0,1|2,0,0]=4 6722 B21R2.18995 O=C(C/C=C/c1ccccc1)COc2ccc(cc2)O 1458a_100000031633_100016265936 [0,1,0,0,0,1|2,0,0]=4 6723 B21R2.18995 O=C(C/C=C/c1ccccc1)CSc2ccc(cc2)Br 1458a_100000179496_100016265936 [0,1,0,0,0,1|2,0,0]=4 6724 B21R2.18995 O=C(C/C=C/c1ccccc1)CSc2ccc(cc2)Cl 1458a_100000178402_100016265936 [0,1,0,0,0,1|2,0,0]=4 6725 B21R2.18995 O=C(C/C=C/c1ccccc1)CSc2ccc(cc2)F 1458a_100000691584_100016265936 [0,1,0,0,0,1|2,0,0]=4 6726 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100011219626 [0,1,0,0,0,1|1,0,0]=3 6727 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100011219626 [0,1,0,0,0,1|1,0,0]=3 6728 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100011219626 [0,1,0,0,0,1|1,0,0]=3 6729 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100011219626 [0,1,0,0,0,1|1,0,0]=3 6730 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100011219626 [0,1,0,0,0,1|1,0,0]=3 6731 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100011219626 [0,1,0,0,0,1|1,0,0]=3 6732 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100011219626 [0,1,0,0,0,1|1,0,0]=3 6733 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100011219626 [0,1,0,0,0,1|1,0,0]=3 6734 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100011219626 [0,1,0,0,0,1|1,0,0]=3 6735 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100011219626 [0,1,0,0,0,1|1,0,0]=3 6736 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100011219626 [0,1,0,0,0,1|1,0,0]=3 6737 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100011219626 [0,1,0,0,0,1|1,0,0]=3 6738 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100011219626 [0,1,0,0,0,1|1,0,0]=3 6739 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)Br 11a_100015188789_100011219626 [0,1,0,0,0,1|2,0,0]=4 6740 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)Br 1626a_100015188789_100011219626 [0,1,0,0,0,1|2,0,0]=4 6741 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)Br 240690a_100015188789_100011219626 [0,1,0,0,0,1|2,0,0]=4 6742 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)Cl 11a_100000697193_100011219626 [0,1,0,0,0,1|2,0,0]=4 6743 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)Cl 1626a_100000697193_100011219626 [0,1,0,0,0,1|2,0,0]=4 6744 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)Cl 240690a_100000697193_100011219626 [0,1,0,0,0,1|2,0,0]=4 6745 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)F 11a_100020620131_100011219626 [0,1,0,0,0,1|2,0,0]=4 6746 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)F 1626a_100020620131_100011219626 [0,1,0,0,0,1|2,0,0]=4 6747 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)F 240690a_100020620131_100011219626 [0,1,0,0,0,1|2,0,0]=4 6748 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(cn2)O 240690a_100020605196_100011219626 [0,1,0,0,0,1|2,0,0]=4 6749 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)Br 11a_100009817727_100011219626 [0,1,0,0,0,1|2,0,0]=4 6750 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)Br 240690a_100009817727_100011219626 [0,1,0,0,0,1|2,0,0]=4 6751 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)Cl 11a_100000735879_100011219626 [0,1,0,0,0,1|2,0,0]=4 6752 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)Cl 1626a_100000735879_100011219626 [0,1,0,0,0,1|2,0,0]=4 6753 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)Cl 240690a_100000735879_100011219626 [0,1,0,0,0,1|2,0,0]=4 6754 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)F 11a_100000101913_100011219626 [0,1,0,0,0,1|2,0,0]=4 6755 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)F 1626a_100000101913_100011219626 [0,1,0,0,0,1|2,0,0]=4 6756 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)F 240690a_100000101913_100011219626 [0,1,0,0,0,1|2,0,0]=4 6757 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)O 11a_100000757128_100011219626 [0,1,0,0,0,1|2,0,0]=4 6758 B21R2.18995 O=C(C/C=C/c1ccccc1)NCc2ccc(nc2)O 240690a_100000757128_100011219626 [0,1,0,0,0,1|2,0,0]=4 6759 B21R2.18995 O=C(C/C=C/c1ccccc1)NNc2ccc(cc2)Br 22a_100000735608_100011219626 [0,1,0,0,0,1|2,0,0]=4 6760 B21R2.18995 O=C(C/C=C/c1ccccc1)NNc2ccc(cc2)Cl 22a_100000683521_100011219626 [0,1,0,0,0,1|2,0,0]=4 6761 B21R2.18995 O=C(C/C=C/c1ccccc1)NNc2ccc(cc2)F 22a_100000728448_100011219626 [0,1,0,0,0,1|2,0,0]=4 6762 B21R2.18995 O=C(C/C=C/c1ccccc1)NNc2ccc(cc2)I 22a_100016988836_100011219626 [0,1,0,0,0,1|2,0,0]=4 6763 B21R2.18995 O=C(C=CSc1ccccc1)CCc2ccc(cc2)Br 1458a_100016262050_100011740612 [0,1,0,0,0,1|1,0,0]=3 6764 B21R2.18995 O=C(C=CSc1ccccc1)CCc2ccc(cc2)Cl 1458a_100016262050_100011713675 [0,1,0,0,0,1|1,0,0]=3 6765 B21R2.18995 O=C(C=CSc1ccccc1)CCc2ccc(cc2)F 1458a_100016262050_100011217392 [0,1,0,0,0,1|1,0,0]=3 6766 B21R2.18995 O=C(C=CSc1ccccc1)CCc2ccc(cc2)O 1458a_100016262050_100009816426 [0,1,0,0,0,1|1,0,0]=3 6767 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100016262050 [0,1,0,0,0,1|1,0,0]=3 6768 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100016262050 [0,1,0,0,0,1|1,0,0]=3 6769 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100016262050 [0,1,0,0,0,1|1,0,0]=3 6770 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100016262050 [0,1,0,0,0,1|1,0,0]=3 6771 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100016262050 [0,1,0,0,0,1|1,0,0]=3 6772 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100016262050 [0,1,0,0,0,1|1,0,0]=3 6773 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100016262050 [0,1,0,0,0,1|1,0,0]=3 6774 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100016262050 [0,1,0,0,0,1|1,0,0]=3 6775 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100016262050 [0,1,0,0,0,1|1,0,0]=3 6776 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100016262050 [0,1,0,0,0,1|1,0,0]=3 6777 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100016262050 [0,1,0,0,0,1|1,0,0]=3 6778 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100016262050 [0,1,0,0,0,1|1,0,0]=3 6779 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100016262050 [0,1,0,0,0,1|1,0,0]=3 6780 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)Br 11a_100015188789_100016262050 [0,1,0,0,0,1|2,0,0]=4 6781 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)Br 1626a_100015188789_100016262050 [0,1,0,0,0,1|2,0,0]=4 6782 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)Br 240690a_100015188789_100016262050 [0,1,0,0,0,1|2,0,0]=4 6783 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)Cl 11a_100000697193_100016262050 [0,1,0,0,0,1|2,0,0]=4 6784 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)Cl 1626a_100000697193_100016262050 [0,1,0,0,0,1|2,0,0]=4 6785 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)Cl 240690a_100000697193_100016262050 [0,1,0,0,0,1|2,0,0]=4 6786 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)F 11a_100020620131_100016262050 [0,1,0,0,0,1|2,0,0]=4 6787 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)F 1626a_100020620131_100016262050 [0,1,0,0,0,1|2,0,0]=4 6788 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)F 240690a_100020620131_100016262050 [0,1,0,0,0,1|2,0,0]=4 6789 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(cn2)O 240690a_100020605196_100016262050 [0,1,0,0,0,1|2,0,0]=4 6790 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)Br 11a_100009817727_100016262050 [0,1,0,0,0,1|2,0,0]=4 6791 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)Br 240690a_100009817727_100016262050 [0,1,0,0,0,1|2,0,0]=4 6792 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)Cl 11a_100000735879_100016262050 [0,1,0,0,0,1|2,0,0]=4 6793 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)Cl 1626a_100000735879_100016262050 [0,1,0,0,0,1|2,0,0]=4 6794 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)Cl 240690a_100000735879_100016262050 [0,1,0,0,0,1|2,0,0]=4 6795 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)F 11a_100000101913_100016262050 [0,1,0,0,0,1|2,0,0]=4 6796 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)F 1626a_100000101913_100016262050 [0,1,0,0,0,1|2,0,0]=4 6797 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)F 240690a_100000101913_100016262050 [0,1,0,0,0,1|2,0,0]=4 6798 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)O 11a_100000757128_100016262050 [0,1,0,0,0,1|2,0,0]=4 6799 B21R2.18995 O=C(C=CSc1ccccc1)NCc2ccc(nc2)O 240690a_100000757128_100016262050 [0,1,0,0,0,1|2,0,0]=4 6800 B21R2.18995 O=C(C=CSc1ccccc1)NNc2ccc(cc2)Br 22a_100000735608_100016262050 [0,1,0,0,0,1|2,0,0]=4 6801 B21R2.18995 O=C(C=CSc1ccccc1)NNc2ccc(cc2)Cl 22a_100000683521_100016262050 [0,1,0,0,0,1|2,0,0]=4 6802 B21R2.18995 O=C(C=CSc1ccccc1)NNc2ccc(cc2)F 22a_100000728448_100016262050 [0,1,0,0,0,1|2,0,0]=4 6803 B21R2.18995 O=C(C=CSc1ccccc1)NNc2ccc(cc2)I 22a_100016988836_100016262050 [0,1,0,0,0,1|2,0,0]=4 6804 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)C/C=C/c2ccccc2 1458a_100016267368_100016265936 [0,1,0,0,0,1|1,0,1]=4 6805 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CC#Cc2ccccc2 1458a_100016267368_100011352542 [0,1,0,0,0,1|1,0,1]=4 6806 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CCCc2ccccc2 1458a_100016267368_100000211621 [0,1,0,0,0,1|1,0,0]=3 6807 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CCOc2ccccc2 1458a_100016267368_100000184471 [0,1,0,0,0,1|1,0,0]=3 6808 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CCSc2ccccc2 1458a_100016267368_100000246102 [0,1,0,0,0,1|1,0,0]=3 6809 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)COCc2ccccc2 6a_100000186029_100011215004 [0,1,0,0,0,1|0,0,0]=2 6810 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CSCc2ccccc2 1458a_100016267368_200011217039 [0,1,0,0,0,1|0,1,0]=3 6811 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CSCc2ccccc2 6a_100000186029_100000172147 [0,1,0,0,0,1|0,1,0]=3 6812 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2 11a_100000106460_100016267368 [0,1,0,0,0,1|1,0,0]=3 6813 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2 1626a_100000106460_100016267368 [0,1,0,0,0,1|1,0,0]=3 6814 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccn2 11a_100000211156_100016267368 [0,1,0,0,0,1|2,0,0]=4 6815 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccn2 1626a_100000211156_100016267368 [0,1,0,0,0,1|2,0,0]=4 6816 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2cccnc2 11a_100000736294_100016267368 [0,1,0,0,0,1|2,0,0]=4 6817 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2cccnc2 1626a_100000736294_100016267368 [0,1,0,0,0,1|2,0,0]=4 6818 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccncc2 11a_100000742849_100016267368 [0,1,0,0,0,1|2,0,0]=4 6819 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccncc2 1626a_100000742849_100016267368 [0,1,0,0,0,1|2,0,0]=4 6820 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NNCc2ccccc2 22a_100000007032_100016267368 [0,1,0,0,0,1|1,0,0]=3 6821 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NNCc2ccccn2 22a_100000736832_100016267368 [0,1,0,0,0,1|2,0,0]=4 6822 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NNCc2cccnc2 22a_100000738295_100016267368 [0,1,0,0,0,1|2,0,0]=4 6823 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NNCc2ccncc2 22a_100000736929_100016267368 [0,1,0,0,0,1|2,0,0]=4 6824 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)C/C=C/c2ccccc2 1458a_100000184863_100016265936 [0,1,0,0,0,1|1,0,1]=4 6825 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CC#Cc2ccccc2 1458a_100000184863_100011352542 [0,1,0,0,0,1|1,0,1]=4 6826 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CCCc2ccccc2 1458a_100000184863_100000211621 [0,1,0,0,0,1|1,0,0]=3 6827 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CCOc2ccccc2 1458a_100000184863_100000184471 [0,1,0,0,0,1|1,0,0]=3 6828 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CCSc2ccccc2 1458a_100000184863_100000246102 [0,1,0,0,0,1|1,0,0]=3 6829 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CSCc2ccccc2 1458a_100000184863_200011217039 [0,1,0,0,0,1|0,1,0]=3 6830 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2 11a_100000106460_100000184863 [0,1,0,0,0,1|1,0,0]=3 6831 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2 1626a_100000106460_100000184863 [0,1,0,0,0,1|1,0,0]=3 6832 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2 240690a_100000106460_100000184863 [0,1,0,0,0,1|1,0,0]=3 6833 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccn2 11a_100000211156_100000184863 [0,1,0,0,0,1|2,0,0]=4 6834 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccn2 1626a_100000211156_100000184863 [0,1,0,0,0,1|2,0,0]=4 6835 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccn2 240690a_100000211156_100000184863 [0,1,0,0,0,1|2,0,0]=4 6836 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccnc2 11a_100000736294_100000184863 [0,1,0,0,0,1|2,0,0]=4 6837 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccnc2 1626a_100000736294_100000184863 [0,1,0,0,0,1|2,0,0]=4 6838 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccnc2 240690a_100000736294_100000184863 [0,1,0,0,0,1|2,0,0]=4 6839 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccncc2 11a_100000742849_100000184863 [0,1,0,0,0,1|2,0,0]=4 6840 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccncc2 1626a_100000742849_100000184863 [0,1,0,0,0,1|2,0,0]=4 6841 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccncc2 240690a_100000742849_100000184863 [0,1,0,0,0,1|2,0,0]=4 6842 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccccc2 22a_100000007032_100000184863 [0,1,0,0,0,1|1,0,0]=3 6843 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccccn2 22a_100000736832_100000184863 [0,1,0,0,0,1|2,0,0]=4 6844 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NNCc2cccnc2 22a_100000738295_100000184863 [0,1,0,0,0,1|2,0,0]=4 6845 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccncc2 22a_100000736929_100000184863 [0,1,0,0,0,1|2,0,0]=4 6846 B21R2.18995 O=C(C=Cc1ccc(cc1)F)C/C=C/c2ccccc2 1458a_100000182136_100016265936 [0,1,0,0,0,1|1,0,1]=4 6847 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CC#Cc2ccccc2 1458a_100000182136_100011352542 [0,1,0,0,0,1|1,0,1]=4 6848 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CCCc2ccccc2 1458a_100000182136_100000211621 [0,1,0,0,0,1|1,0,0]=3 6849 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CCOc2ccccc2 1458a_100000182136_100000184471 [0,1,0,0,0,1|1,0,0]=3 6850 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CCSc2ccccc2 1458a_100000182136_100000246102 [0,1,0,0,0,1|1,0,0]=3 6851 B21R2.18995 O=C(C=Cc1ccc(cc1)F)COCc2ccccc2 6a_100000210084_100011215004 [0,1,0,0,0,1|0,0,0]=2 6852 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CSCc2ccccc2 1458a_100000182136_200011217039 [0,1,0,0,0,1|0,1,0]=3 6853 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CSCc2ccccc2 6a_100000210084_100000172147 [0,1,0,0,0,1|0,1,0]=3 6854 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2 11a_100000106460_100000182136 [0,1,0,0,0,1|1,0,0]=3 6855 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2 1626a_100000106460_100000182136 [0,1,0,0,0,1|1,0,0]=3 6856 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2 240690a_100000106460_100000182136 [0,1,0,0,0,1|1,0,0]=3 6857 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccn2 11a_100000211156_100000182136 [0,1,0,0,0,1|2,0,0]=4 6858 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccn2 1626a_100000211156_100000182136 [0,1,0,0,0,1|2,0,0]=4 6859 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccn2 240690a_100000211156_100000182136 [0,1,0,0,0,1|2,0,0]=4 6860 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cccnc2 11a_100000736294_100000182136 [0,1,0,0,0,1|2,0,0]=4 6861 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cccnc2 1626a_100000736294_100000182136 [0,1,0,0,0,1|2,0,0]=4 6862 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cccnc2 240690a_100000736294_100000182136 [0,1,0,0,0,1|2,0,0]=4 6863 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccncc2 11a_100000742849_100000182136 [0,1,0,0,0,1|2,0,0]=4 6864 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccncc2 1626a_100000742849_100000182136 [0,1,0,0,0,1|2,0,0]=4 6865 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccncc2 240690a_100000742849_100000182136 [0,1,0,0,0,1|2,0,0]=4 6866 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NNCc2ccccc2 22a_100000007032_100000182136 [0,1,0,0,0,1|1,0,0]=3 6867 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NNCc2ccccn2 22a_100000736832_100000182136 [0,1,0,0,0,1|2,0,0]=4 6868 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NNCc2cccnc2 22a_100000738295_100000182136 [0,1,0,0,0,1|2,0,0]=4 6869 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NNCc2ccncc2 22a_100000736929_100000182136 [0,1,0,0,0,1|2,0,0]=4 6870 B21R2.18995 O=C(C=Cc1ccc(cc1)I)C/C=C/c2ccccc2 1458a_100102526154_100016265936 [0,1,0,0,0,1|1,0,1]=4 6871 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CC#Cc2ccccc2 1458a_100102526154_100011352542 [0,1,0,0,0,1|1,0,1]=4 6872 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CCCc2ccccc2 1458a_100102526154_100000211621 [0,1,0,0,0,1|1,0,0]=3 6873 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CCOc2ccccc2 1458a_100102526154_100000184471 [0,1,0,0,0,1|1,0,0]=3 6874 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CCSc2ccccc2 1458a_100102526154_100000246102 [0,1,0,0,0,1|1,0,0]=3 6875 B21R2.18995 O=C(C=Cc1ccc(cc1)I)COCc2ccccc2 6a_100000188517_100011215004 [0,1,0,0,0,1|0,0,0]=2 6876 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CSCc2ccccc2 1458a_100102526154_200011217039 [0,1,0,0,0,1|0,1,0]=3 6877 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CSCc2ccccc2 6a_100000188517_100000172147 [0,1,0,0,0,1|0,1,0]=3 6878 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2 11a_100000106460_100102526154 [0,1,0,0,0,1|1,0,0]=3 6879 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2 1626a_100000106460_100102526154 [0,1,0,0,0,1|1,0,0]=3 6880 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2 240690a_100000106460_100102526154 [0,1,0,0,0,1|1,0,0]=3 6881 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccn2 11a_100000211156_100102526154 [0,1,0,0,0,1|2,0,0]=4 6882 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccn2 1626a_100000211156_100102526154 [0,1,0,0,0,1|2,0,0]=4 6883 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccn2 240690a_100000211156_100102526154 [0,1,0,0,0,1|2,0,0]=4 6884 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cccnc2 11a_100000736294_100102526154 [0,1,0,0,0,1|2,0,0]=4 6885 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cccnc2 1626a_100000736294_100102526154 [0,1,0,0,0,1|2,0,0]=4 6886 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cccnc2 240690a_100000736294_100102526154 [0,1,0,0,0,1|2,0,0]=4 6887 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccncc2 11a_100000742849_100102526154 [0,1,0,0,0,1|2,0,0]=4 6888 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccncc2 1626a_100000742849_100102526154 [0,1,0,0,0,1|2,0,0]=4 6889 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccncc2 240690a_100000742849_100102526154 [0,1,0,0,0,1|2,0,0]=4 6890 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NNCc2ccccc2 22a_100000007032_100102526154 [0,1,0,0,0,1|1,0,0]=3 6891 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NNCc2ccccn2 22a_100000736832_100102526154 [0,1,0,0,0,1|2,0,0]=4 6892 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NNCc2cccnc2 22a_100000738295_100102526154 [0,1,0,0,0,1|2,0,0]=4 6893 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NNCc2ccncc2 22a_100000736929_100102526154 [0,1,0,0,0,1|2,0,0]=4 6894 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2ccccc2 240690a_100000106460_100016269017 [0,1,0,0,0,1|1,0,0]=3 6895 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2ccccn2 240690a_100000211156_100016269017 [0,1,0,0,0,1|2,0,0]=4 6896 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2cccnc2 240690a_100000736294_100016269017 [0,1,0,0,0,1|2,0,0]=4 6897 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2ccncc2 240690a_100000742849_100016269017 [0,1,0,0,0,1|2,0,0]=4 6898 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NNCc2ccccc2 22a_100000007032_100016269017 [0,1,0,0,0,1|1,0,0]=3 6899 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NNCc2ccccn2 22a_100000736832_100016269017 [0,1,0,0,0,1|2,0,0]=4 6900 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NNCc2cccnc2 22a_100000738295_100016269017 [0,1,0,0,0,1|2,0,0]=4 6901 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NNCc2ccncc2 22a_100000736929_100016269017 [0,1,0,0,0,1|2,0,0]=4 6902 B21R2.18995 O=C(C=Cc1ccc(cn1)Br)COCc2ccccc2 6a_100000754260_100011215004 [0,1,0,0,0,1|1,0,0]=3 6903 B21R2.18995 O=C(C=Cc1ccc(cn1)Br)CSCc2ccccc2 6a_100000754260_100000172147 [0,1,0,0,0,1|1,1,0]=4 6904 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CCCc2ccccc2 1458a_100020630499_100000211621 [0,1,0,0,0,1|2,0,0]=4 6905 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CCOc2ccccc2 1458a_100020630499_100000184471 [0,1,0,0,0,1|2,0,0]=4 6906 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CCSc2ccccc2 1458a_100020630499_100000246102 [0,1,0,0,0,1|2,0,0]=4 6907 B21R2.18995 O=C(C=Cc1ccc(cn1)F)COCc2ccccc2 6a_100011934744_100011215004 [0,1,0,0,0,1|1,0,0]=3 6908 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CSCc2ccccc2 1458a_100020630499_200011217039 [0,1,0,0,0,1|1,1,0]=4 6909 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CSCc2ccccc2 6a_100011934744_100000172147 [0,1,0,0,0,1|1,1,0]=4 6910 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2 11a_100000106460_100020630499 [0,1,0,0,0,1|2,0,0]=4 6911 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2 1626a_100000106460_100020630499 [0,1,0,0,0,1|2,0,0]=4 6912 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2 240690a_100000106460_100020630499 [0,1,0,0,0,1|2,0,0]=4 6913 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NNCc2ccccc2 22a_100000007032_100020630499 [0,1,0,0,0,1|2,0,0]=4 6914 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)CCCc2ccccc2 1458a_100020588214_100000211621 [0,1,0,0,0,1|2,0,0]=4 6915 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)CCOc2ccccc2 1458a_100020588214_100000184471 [0,1,0,0,0,1|2,0,0]=4 6916 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)CCSc2ccccc2 1458a_100020588214_100000246102 [0,1,0,0,0,1|2,0,0]=4 6917 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)CSCc2ccccc2 1458a_100020588214_200011217039 [0,1,0,0,0,1|1,1,0]=4 6918 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2 11a_100000106460_100020588214 [0,1,0,0,0,1|2,0,0]=4 6919 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2 1626a_100000106460_100020588214 [0,1,0,0,0,1|2,0,0]=4 6920 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2 240690a_100000106460_100020588214 [0,1,0,0,0,1|2,0,0]=4 6921 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NNCc2ccccc2 22a_100000007032_100020588214 [0,1,0,0,0,1|2,0,0]=4 6922 B21R2.18995 O=C(C=Cc1cnc(cn1)Cl)COCc2ccccc2 6a_100012001714_100011215004 [0,1,0,0,0,1|2,0,0]=4 6923 B21R2.18995 O=C(CCc1ccc(cc1)Br)COCc2ccccc2 1458a_100000230186_100011740612 [0,1,0,0,0,1|0,0,2]=4 6924 B21R2.18995 O=C(CCc1ccc(cc1)Cl)COCc2ccccc2 1458a_100000230186_100011713675 [0,1,0,0,0,1|0,0,2]=4 6925 B21R2.18995 O=C(CCc1ccc(cc1)F)COCc2ccccc2 1458a_100000230186_100011217392 [0,1,0,0,0,1|0,0,2]=4 6926 B21R2.18995 O=C(CCc1ccc(cc1)O)COCc2ccccc2 1458a_100000230186_100009816426 [0,1,0,0,0,1|0,0,2]=4 6927 B21R2.18995 O=C(CNc1ccc(cc1)Br)NOCc2ccccc2 2230a_100000210018_100000230105 [0,1,0,0,0,1|1,0,1]=4 6928 B21R2.18995 O=C(CNc1ccc(cc1)Br)NOCc2ccccc2 34a_100000210018_100000230105 [0,1,0,0,0,1|1,0,1]=4 6929 B21R2.18995 O=C(CNc1ccc(cc1)Br)OCCc2ccccc2 2230a_100000210018_200000077782 [0,1,0,0,0,1|1,0,1]=4 6930 B21R2.18995 O=C(CNc1ccc(cc1)Br)OCCc2ccccc2 34a_100000210018_200000077782 [0,1,0,0,0,1|1,0,1]=4 6931 B21R2.18995 O=C(CNc1ccc(cc1)Cl)NOCc2ccccc2 2230a_100000210052_100000230105 [0,1,0,0,0,1|1,0,1]=4 6932 B21R2.18995 O=C(CNc1ccc(cc1)Cl)NOCc2ccccc2 34a_100000210052_100000230105 [0,1,0,0,0,1|1,0,1]=4 6933 B21R2.18995 O=C(CNc1ccc(cc1)Cl)OCCc2ccccc2 2230a_100000210052_200000077782 [0,1,0,0,0,1|1,0,1]=4 6934 B21R2.18995 O=C(CNc1ccc(cc1)Cl)OCCc2ccccc2 34a_100000210052_200000077782 [0,1,0,0,0,1|1,0,1]=4 6935 B21R2.18995 O=C(CNc1ccc(cc1)F)NOCc2ccccc2 34a_100000185862_100000230105 [0,1,0,0,0,1|1,0,1]=4 6936 B21R2.18995 O=C(CNc1ccc(cc1)F)OCCc2ccccc2 34a_100000185862_200000077782 [0,1,0,0,0,1|1,0,1]=4 6937 B21R2.18995 O=C(CNc1ccc(cc1)I)NOCc2ccccc2 34a_100000185761_100000230105 [0,1,0,0,0,1|1,0,1]=4 6938 B21R2.18995 O=C(CNc1ccc(cc1)I)OCCc2ccccc2 34a_100000185761_200000077782 [0,1,0,0,0,1|1,0,1]=4 6939 B21R2.18995 O=C(CNc1ccc(cc1)O)NOCc2ccccc2 34a_100000185829_100000230105 [0,1,0,0,0,1|1,0,1]=4 6940 B21R2.18995 O=C(CNc1ccc(cc1)O)OCCc2ccccc2 34a_100000185829_200000077782 [0,1,0,0,0,1|1,0,1]=4 6941 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100000230186 [0,1,0,0,0,1|1,0,1]=4 6942 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100000230186 [0,1,0,0,0,1|1,0,1]=4 6943 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100000230186 [0,1,0,0,0,1|1,0,1]=4 6944 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Br 527a_100000174875_100000230186 [0,1,0,0,0,1|1,0,1]=4 6945 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100000230186 [0,1,0,0,0,1|1,0,1]=4 6946 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000230186 [0,1,0,0,0,1|1,0,1]=4 6947 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000230186 [0,1,0,0,0,1|1,0,1]=4 6948 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Cl 34a_100000210790_100000183476 [0,1,0,0,0,1|1,0,1]=4 6949 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Cl 527a_100000174871_100000230186 [0,1,0,0,0,1|1,0,1]=4 6950 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)Cl 7a_100000210790_100000183476 [0,1,0,0,0,1|1,0,1]=4 6951 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100000230186 [0,1,0,0,0,1|1,0,1]=4 6952 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100000230186 [0,1,0,0,0,1|1,0,1]=4 6953 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100000230186 [0,1,0,0,0,1|1,0,1]=4 6954 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)F 34a_100000210790_100000182461 [0,1,0,0,0,1|1,0,1]=4 6955 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)F 527a_100000174882_100000230186 [0,1,0,0,0,1|1,0,1]=4 6956 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)F 7a_100000210790_100000182461 [0,1,0,0,0,1|1,0,1]=4 6957 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100000230186 [0,1,0,0,0,1|1,0,1]=4 6958 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100000230186 [0,1,0,0,0,1|1,0,1]=4 6959 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100000230186 [0,1,0,0,0,1|1,0,1]=4 6960 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)I 527a_100016989417_100000230186 [0,1,0,0,0,1|1,0,1]=4 6961 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100000230186 [0,1,0,0,0,1|1,0,1]=4 6962 B21R2.18995 O=C(COCc1ccccc1)NCc2ccc(cc2)O 527a_100000185549_100000230186 [0,1,0,0,0,1|1,0,1]=4 6963 B21R2.18995 O=C(COCc1ccccc1)NNc2ccc(cc2)Br 22a_100000735608_100000230186 [0,1,0,0,0,1|2,0,0]=4 6964 B21R2.18995 O=C(COCc1ccccc1)NNc2ccc(cc2)Cl 22a_100000683521_100000230186 [0,1,0,0,0,1|2,0,0]=4 6965 B21R2.18995 O=C(COCc1ccccc1)NNc2ccc(cc2)F 22a_100000728448_100000230186 [0,1,0,0,0,1|2,0,0]=4 6966 B21R2.18995 O=C(COCc1ccccc1)NNc2ccc(cc2)I 22a_100016988836_100000230186 [0,1,0,0,0,1|2,0,0]=4 6967 B21R2.18995 O=C(COc1ccc(cc1)Br)NOCc2ccccc2 34a_100000185759_100000230105 [0,1,0,0,0,1|1,0,1]=4 6968 B21R2.18995 O=C(COc1ccc(cc1)Br)NOCc2ccccc2 7a_100000185759_100000230105 [0,1,0,0,0,1|1,0,1]=4 6969 B21R2.18995 O=C(COc1ccc(cc1)Br)OCCc2ccccc2 34a_100000185759_200000077782 [0,1,0,0,0,1|1,0,1]=4 6970 B21R2.18995 O=C(COc1ccc(cc1)Br)OCCc2ccccc2 7a_100000185759_200000077782 [0,1,0,0,0,1|1,0,1]=4 6971 B21R2.18995 O=C(COc1ccc(cc1)Cl)NOCc2ccccc2 34a_100000210216_100000230105 [0,1,0,0,0,1|1,0,1]=4 6972 B21R2.18995 O=C(COc1ccc(cc1)Cl)NOCc2ccccc2 7a_100000210216_100000230105 [0,1,0,0,0,1|1,0,1]=4 6973 B21R2.18995 O=C(COc1ccc(cc1)Cl)OCCc2ccccc2 34a_100000210216_200000077782 [0,1,0,0,0,1|1,0,1]=4 6974 B21R2.18995 O=C(COc1ccc(cc1)Cl)OCCc2ccccc2 7a_100000210216_200000077782 [0,1,0,0,0,1|1,0,1]=4 6975 B21R2.18995 O=C(COc1ccc(cc1)F)NOCc2ccccc2 34a_100000210339_100000230105 [0,1,0,0,0,1|1,0,1]=4 6976 B21R2.18995 O=C(COc1ccc(cc1)F)OCCc2ccccc2 34a_100000210339_200000077782 [0,1,0,0,0,1|1,0,1]=4 6977 B21R2.18995 O=C(COc1ccc(cc1)I)NOCc2ccccc2 34a_100000212066_100000230105 [0,1,0,0,0,1|1,0,1]=4 6978 B21R2.18995 O=C(COc1ccc(cc1)I)NOCc2ccccc2 7a_100000212066_100000230105 [0,1,0,0,0,1|1,0,1]=4 6979 B21R2.18995 O=C(COc1ccc(cc1)I)OCCc2ccccc2 34a_100000212066_200000077782 [0,1,0,0,0,1|1,0,1]=4 6980 B21R2.18995 O=C(COc1ccc(cc1)I)OCCc2ccccc2 7a_100000212066_200000077782 [0,1,0,0,0,1|1,0,1]=4 6981 B21R2.18995 O=C(CSc1ccc(cc1)Br)NOCc2ccccc2 62a_100000230105_100000752885 [0,1,0,0,0,1|1,0,1]=4 6982 B21R2.18995 O=C(CSc1ccc(cc1)Br)NOCc2ccccc2 62a_100000752885_100000230105 [0,1,0,0,0,1|1,0,1]=4 6983 B21R2.18995 O=C(CSc1ccc(cc1)Br)OCCc2ccccc2 62a_100000752885_200000077782 [0,1,0,0,0,1|1,0,1]=4 6984 B21R2.18995 O=C(CSc1ccc(cc1)Br)OCCc2ccccc2 62a_200000077782_100000752885 [0,1,0,0,0,1|1,0,1]=4 6985 B21R2.18995 O=C(CSc1ccc(cc1)Cl)NOCc2ccccc2 62a_100000230105_100000755918 [0,1,0,0,0,1|1,0,1]=4 6986 B21R2.18995 O=C(CSc1ccc(cc1)Cl)NOCc2ccccc2 62a_100000755918_100000230105 [0,1,0,0,0,1|1,0,1]=4 6987 B21R2.18995 O=C(CSc1ccc(cc1)Cl)OCCc2ccccc2 62a_100000755918_200000077782 [0,1,0,0,0,1|1,0,1]=4 6988 B21R2.18995 O=C(CSc1ccc(cc1)Cl)OCCc2ccccc2 62a_200000077782_100000755918 [0,1,0,0,0,1|1,0,1]=4 6989 B21R2.18995 O=C(CSc1ccc(cc1)F)NOCc2ccccc2 62a_100000211213_100000230105 [0,1,0,0,0,1|1,0,1]=4 6990 B21R2.18995 O=C(CSc1ccc(cc1)F)NOCc2ccccc2 62a_100000230105_100000211213 [0,1,0,0,0,1|1,0,1]=4 6991 B21R2.18995 O=C(CSc1ccc(cc1)F)OCCc2ccccc2 62a_100000211213_200000077782 [0,1,0,0,0,1|1,0,1]=4 6992 B21R2.18995 O=C(CSc1ccc(cc1)F)OCCc2ccccc2 62a_200000077782_100000211213 [0,1,0,0,0,1|1,0,1]=4 6993 B21R2.18995 O=C(CSc1ccc(cc1)O)NOCc2ccccc2 62a_100000230105_100000185759 [0,1,0,0,0,1|1,0,1]=4 6994 B21R2.18995 O=C(CSc1ccc(cc1)O)OCCc2ccccc2 62a_200000077782_100000185759 [0,1,0,0,0,1|1,0,1]=4 6995 B21R2.19000 CC(=NNCc1ccc(cc1)Br)C=Cc2ccccc2 4a_100016993955_100000204604 [0,1,0,0,0,1|2,0,0]=4 6996 B21R2.19000 CC(=NNCc1ccc(cc1)C)C=Cc2ccccc2 4a_100011197965_100000204604 [0,1,0,0,0,1|2,0,0]=4 6997 B21R2.19000 CC(=NNCc1ccc(cc1)Cl)C=Cc2ccccc2 4a_100000689899_100000204604 [0,1,0,0,0,1|2,0,0]=4 6998 B21R2.19000 CC(=NNCc1ccc(cc1)F)C=Cc2ccccc2 4a_100000689900_100000204604 [0,1,0,0,0,1|2,0,0]=4 6999 B21R2.19000 CC(=NNCc1ccc(cc1)I)C=Cc2ccccc2 4a_102495363730_100000204604 [0,1,0,0,0,1|2,0,0]=4 7000 B21R2.19000 Cc1ccc(cc1)C=NNC(=O)CCc2ccccc2 4a_100000189782_100000211033 [0,1,0,0,0,1|2,0,0]=4 7001 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 11a_100000705350_100000210462 [0,1,0,0,0,1|1,0,0]=3 7002 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 1626a_100000705350_100000210462 [0,1,0,0,0,1|1,0,0]=3 7003 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 11a_100000705350_100000740811 [0,1,0,0,0,1|2,0,0]=4 7004 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 240690a_100000705350_100000740811 [0,1,0,0,0,1|2,0,0]=4 7005 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 11a_100000705350_100000735890 [0,1,0,0,0,1|2,0,0]=4 7006 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 240690a_100000705350_100000735890 [0,1,0,0,0,1|2,0,0]=4 7007 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccncc2 240690a_100000705350_100000682801 [0,1,0,0,0,1|2,0,0]=4 7008 B21R2.19000 Cc1ccc(cc1)CCNC(=O)OCc2ccccc2 271570a_200010239705_100000186775 [0,1,0,0,0,1|0,0,2]=4 7009 B21R2.19000 Cc1ccc(cc1)CNCC(=O)OCc2ccccc2 2230a_100000174908_100000753625 [0,1,0,0,0,1|0,0,2]=4 7010 B21R2.19000 Cc1ccc(cc1)CNCC(=O)OCc2ccccc2 34a_100000174908_100000753625 [0,1,0,0,0,1|0,0,2]=4 7011 B21R2.19000 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccc2 22a_100011197965_100000210462 [0,1,0,0,0,1|1,0,0]=3 7012 B21R2.19000 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccn2 22a_100011197965_100000740811 [0,1,0,0,0,1|2,0,0]=4 7013 B21R2.19000 Cc1ccc(cc1)CNNC(=O)C=Cc2cccnc2 22a_100011197965_100000735890 [0,1,0,0,0,1|2,0,0]=4 7014 B21R2.19000 Cc1ccc(cc1)CNNC(=O)C=Cc2ccncc2 22a_100011197965_100000682801 [0,1,0,0,0,1|2,0,0]=4 7015 B21R2.19000 Cc1ccc(cc1)COCC(=O)CCc2ccccc2 34a_100011215236_100012361361 [0,1,0,0,0,1|0,0,2]=4 7016 B21R2.19000 Cc1ccc(cc1)COCC(=O)CCc2ccccc2 7a_100011215236_100012361361 [0,1,0,0,0,1|0,0,2]=4 7017 B21R2.19000 Cc1ccc(cc1)COCC(=O)NCc2ccccc2 34a_100011215236_100000183539 [0,1,0,0,0,1|1,0,1]=4 7018 B21R2.19000 Cc1ccc(cc1)COCC(=O)NCc2ccccc2 7a_100011215236_100000183539 [0,1,0,0,0,1|1,0,1]=4 7019 B21R2.19000 Cc1ccc(cc1)COCC(=O)OCc2ccccc2 34a_100011215236_100000753625 [0,1,0,0,0,1|0,0,2]=4 7020 B21R2.19000 Cc1ccc(cc1)COCC(=O)OCc2ccccc2 7a_100011215236_100000753625 [0,1,0,0,0,1|0,0,2]=4 7021 B21R2.19000 Cc1ccc(cc1)CSCC(=O)OCc2ccccc2 62a_100000210814_100000753625 [0,1,0,0,0,1|0,0,2]=4 7022 B21R2.19000 Cc1ccc(cc1)CSCC(=O)OCc2ccccc2 62a_100000753625_100000210814 [0,1,0,0,0,1|0,0,2]=4 7023 B21R2.19000 Cc1ccc(cc1)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000183172 [0,1,0,0,0,1|1,0,0]=3 7024 B21R2.19000 Cc1ccc(cc1)OCCC(=O)C=Cc2ccccn2 1458a_100000740811_100000183172 [0,1,0,0,0,1|2,0,0]=4 7025 B21R2.19000 Cc1ccc(cc1)OCCC(=O)C=Cc2cccnc2 1458a_100000735890_100000183172 [0,1,0,0,0,1|2,0,0]=4 7026 B21R2.19000 Cc1ccc(cc1)OCCC(=O)C=Cc2ccncc2 1458a_100000682801_100000183172 [0,1,0,0,0,1|2,0,0]=4 7027 B21R2.19000 Cc1ccc(cc1)OCCC(=O)OCc2ccccc2 7a_100000210336_100009813219 [0,1,0,0,0,1|0,0,2]=4 7028 B21R2.19000 Cc1ccc(cc1)SCCC(=O)OCc2ccccc2 62a_100000186775_100009813219 [0,1,0,0,0,1|0,0,2]=4 7029 B21R2.19000 Cc1ccc(cc1)SCCC(=O)OCc2ccccc2 62a_100009813219_100000186775 [0,1,0,0,0,1|0,0,2]=4 7030 B21R2.19000 Nc1ccc(cc1)CCNC(=O)OCc2ccccc2 271570a_200010239705_100000185761 [0,1,0,0,0,1|0,0,2]=4 7031 B21R2.19000 Nc1ccc(cc1)COCC(=O)CCc2ccccc2 34a_100011215238_100012361361 [0,1,0,0,0,1|0,0,2]=4 7032 B21R2.19000 Nc1ccc(cc1)COCC(=O)NCc2ccccc2 34a_100011215238_100000183539 [0,1,0,0,0,1|1,0,1]=4 7033 B21R2.19000 Nc1ccc(cc1)COCC(=O)OCc2ccccc2 34a_100011215238_100000753625 [0,1,0,0,0,1|0,0,2]=4 7034 B21R2.19000 Nc1ccc(cc1)SCCC(=O)OCc2ccccc2 62a_100000185761_100009813219 [0,1,0,0,0,1|0,0,2]=4 7035 B21R2.19000 Nc1ccc(cc1)SCCC(=O)OCc2ccccc2 62a_100009813219_100000185761 [0,1,0,0,0,1|0,0,2]=4 7036 B21R2.19000 O=C(C=Cc1ccccc1)CC#Cc2ccc(cc2)Br 1458a_100000210462_100010706785 [0,1,0,0,0,1|1,0,1]=4 7037 B21R2.19000 O=C(C=Cc1ccccc1)CC#Cc2ccc(cc2)F 1458a_100000210462_100010402171 [0,1,0,0,0,1|1,0,1]=4 7038 B21R2.19000 O=C(C=Cc1ccccc1)CCCc2ccc(cc2)Br 1458a_100000210462_100011713682 [0,1,0,0,0,1|1,0,0]=3 7039 B21R2.19000 O=C(C=Cc1ccccc1)CCCc2ccc(cc2)Cl 1458a_100000210462_100000759440 [0,1,0,0,0,1|1,0,0]=3 7040 B21R2.19000 O=C(C=Cc1ccccc1)CCCc2ccc(cc2)F 1458a_100000210462_200011713563 [0,1,0,0,0,1|1,0,0]=3 7041 B21R2.19000 O=C(C=Cc1ccccc1)CCOc2ccc(cc2)Br 1458a_100000210462_100000183278 [0,1,0,0,0,1|1,0,0]=3 7042 B21R2.19000 O=C(C=Cc1ccccc1)CCOc2ccc(cc2)Cl 1458a_100000210462_100000184122 [0,1,0,0,0,1|1,0,0]=3 7043 B21R2.19000 O=C(C=Cc1ccccc1)CCOc2ccc(cc2)F 1458a_100000210462_100000184936 [0,1,0,0,0,1|1,0,0]=3 7044 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)Br 11a_100000755846_100000210462 [0,1,0,0,0,1|1,0,0]=3 7045 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)Br 1626a_100000755846_100000210462 [0,1,0,0,0,1|1,0,0]=3 7046 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000210462 [0,1,0,0,0,1|1,0,0]=3 7047 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100000210462 [0,1,0,0,0,1|1,0,0]=3 7048 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)F 11a_100000199005_100000210462 [0,1,0,0,0,1|1,0,0]=3 7049 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)F 1626a_100000199005_100000210462 [0,1,0,0,0,1|1,0,0]=3 7050 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)Br 22a_100016993955_100000210462 [0,1,0,0,0,1|1,0,0]=3 7051 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)Cl 22a_100000689899_100000210462 [0,1,0,0,0,1|1,0,0]=3 7052 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)F 22a_100000689900_100000210462 [0,1,0,0,0,1|1,0,0]=3 7053 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)I 22a_102495363730_100000210462 [0,1,0,0,0,1|1,0,0]=3 7054 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(nc2)Cl 22a_106726394036_100000210462 [0,1,0,0,0,1|2,0,0]=4 7055 B21R2.19000 O=C(C=Cc1ccccn1)CCCc2ccc(cc2)Br 1458a_100000740811_100011713682 [0,1,0,0,0,1|2,0,0]=4 7056 B21R2.19000 O=C(C=Cc1ccccn1)CCCc2ccc(cc2)Cl 1458a_100000740811_100000759440 [0,1,0,0,0,1|2,0,0]=4 7057 B21R2.19000 O=C(C=Cc1ccccn1)CCCc2ccc(cc2)F 1458a_100000740811_200011713563 [0,1,0,0,0,1|2,0,0]=4 7058 B21R2.19000 O=C(C=Cc1ccccn1)CCOc2ccc(cc2)Br 1458a_100000740811_100000183278 [0,1,0,0,0,1|2,0,0]=4 7059 B21R2.19000 O=C(C=Cc1ccccn1)CCOc2ccc(cc2)Cl 1458a_100000740811_100000184122 [0,1,0,0,0,1|2,0,0]=4 7060 B21R2.19000 O=C(C=Cc1ccccn1)CCOc2ccc(cc2)F 1458a_100000740811_100000184936 [0,1,0,0,0,1|2,0,0]=4 7061 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)Br 11a_100000755846_100000740811 [0,1,0,0,0,1|2,0,0]=4 7062 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)Br 240690a_100000755846_100000740811 [0,1,0,0,0,1|2,0,0]=4 7063 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)Cl 11a_100000185265_100000740811 [0,1,0,0,0,1|2,0,0]=4 7064 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000740811 [0,1,0,0,0,1|2,0,0]=4 7065 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)F 11a_100000199005_100000740811 [0,1,0,0,0,1|2,0,0]=4 7066 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)F 240690a_100000199005_100000740811 [0,1,0,0,0,1|2,0,0]=4 7067 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)O 240690a_100000743037_100000740811 [0,1,0,0,0,1|2,0,0]=4 7068 B21R2.19000 O=C(C=Cc1ccccn1)NNCc2ccc(cc2)Br 22a_100016993955_100000740811 [0,1,0,0,0,1|2,0,0]=4 7069 B21R2.19000 O=C(C=Cc1ccccn1)NNCc2ccc(cc2)Cl 22a_100000689899_100000740811 [0,1,0,0,0,1|2,0,0]=4 7070 B21R2.19000 O=C(C=Cc1ccccn1)NNCc2ccc(cc2)F 22a_100000689900_100000740811 [0,1,0,0,0,1|2,0,0]=4 7071 B21R2.19000 O=C(C=Cc1ccccn1)NNCc2ccc(cc2)I 22a_102495363730_100000740811 [0,1,0,0,0,1|2,0,0]=4 7072 B21R2.19000 O=C(C=Cc1cccnc1)CCCc2ccc(cc2)Br 1458a_100000735890_100011713682 [0,1,0,0,0,1|2,0,0]=4 7073 B21R2.19000 O=C(C=Cc1cccnc1)CCCc2ccc(cc2)Cl 1458a_100000735890_100000759440 [0,1,0,0,0,1|2,0,0]=4 7074 B21R2.19000 O=C(C=Cc1cccnc1)CCCc2ccc(cc2)F 1458a_100000735890_200011713563 [0,1,0,0,0,1|2,0,0]=4 7075 B21R2.19000 O=C(C=Cc1cccnc1)CCOc2ccc(cc2)Br 1458a_100000735890_100000183278 [0,1,0,0,0,1|2,0,0]=4 7076 B21R2.19000 O=C(C=Cc1cccnc1)CCOc2ccc(cc2)Cl 1458a_100000735890_100000184122 [0,1,0,0,0,1|2,0,0]=4 7077 B21R2.19000 O=C(C=Cc1cccnc1)CCOc2ccc(cc2)F 1458a_100000735890_100000184936 [0,1,0,0,0,1|2,0,0]=4 7078 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)Br 11a_100000755846_100000735890 [0,1,0,0,0,1|2,0,0]=4 7079 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000735890 [0,1,0,0,0,1|2,0,0]=4 7080 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000735890 [0,1,0,0,0,1|2,0,0]=4 7081 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000735890 [0,1,0,0,0,1|2,0,0]=4 7082 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)F 11a_100000199005_100000735890 [0,1,0,0,0,1|2,0,0]=4 7083 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)F 240690a_100000199005_100000735890 [0,1,0,0,0,1|2,0,0]=4 7084 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)O 240690a_100000743037_100000735890 [0,1,0,0,0,1|2,0,0]=4 7085 B21R2.19000 O=C(C=Cc1cccnc1)NNCc2ccc(cc2)Br 22a_100016993955_100000735890 [0,1,0,0,0,1|2,0,0]=4 7086 B21R2.19000 O=C(C=Cc1cccnc1)NNCc2ccc(cc2)Cl 22a_100000689899_100000735890 [0,1,0,0,0,1|2,0,0]=4 7087 B21R2.19000 O=C(C=Cc1cccnc1)NNCc2ccc(cc2)F 22a_100000689900_100000735890 [0,1,0,0,0,1|2,0,0]=4 7088 B21R2.19000 O=C(C=Cc1cccnc1)NNCc2ccc(cc2)I 22a_102495363730_100000735890 [0,1,0,0,0,1|2,0,0]=4 7089 B21R2.19000 O=C(C=Cc1ccncc1)CCCc2ccc(cc2)Br 1458a_100000682801_100011713682 [0,1,0,0,0,1|2,0,0]=4 7090 B21R2.19000 O=C(C=Cc1ccncc1)CCCc2ccc(cc2)Cl 1458a_100000682801_100000759440 [0,1,0,0,0,1|2,0,0]=4 7091 B21R2.19000 O=C(C=Cc1ccncc1)CCCc2ccc(cc2)F 1458a_100000682801_200011713563 [0,1,0,0,0,1|2,0,0]=4 7092 B21R2.19000 O=C(C=Cc1ccncc1)CCOc2ccc(cc2)Br 1458a_100000682801_100000183278 [0,1,0,0,0,1|2,0,0]=4 7093 B21R2.19000 O=C(C=Cc1ccncc1)CCOc2ccc(cc2)Cl 1458a_100000682801_100000184122 [0,1,0,0,0,1|2,0,0]=4 7094 B21R2.19000 O=C(C=Cc1ccncc1)CCOc2ccc(cc2)F 1458a_100000682801_100000184936 [0,1,0,0,0,1|2,0,0]=4 7095 B21R2.19000 O=C(C=Cc1ccncc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000682801 [0,1,0,0,0,1|2,0,0]=4 7096 B21R2.19000 O=C(C=Cc1ccncc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000682801 [0,1,0,0,0,1|2,0,0]=4 7097 B21R2.19000 O=C(C=Cc1ccncc1)NCCc2ccc(cc2)F 240690a_100000199005_100000682801 [0,1,0,0,0,1|2,0,0]=4 7098 B21R2.19000 O=C(C=Cc1ccncc1)NCCc2ccc(cc2)O 240690a_100000743037_100000682801 [0,1,0,0,0,1|2,0,0]=4 7099 B21R2.19000 O=C(C=Cc1ccncc1)NNCc2ccc(cc2)Br 22a_100016993955_100000682801 [0,1,0,0,0,1|2,0,0]=4 7100 B21R2.19000 O=C(C=Cc1ccncc1)NNCc2ccc(cc2)Cl 22a_100000689899_100000682801 [0,1,0,0,0,1|2,0,0]=4 7101 B21R2.19000 O=C(C=Cc1ccncc1)NNCc2ccc(cc2)F 22a_100000689900_100000682801 [0,1,0,0,0,1|2,0,0]=4 7102 B21R2.19000 O=C(C=Cc1ccncc1)NNCc2ccc(cc2)I 22a_102495363730_100000682801 [0,1,0,0,0,1|2,0,0]=4 7103 B21R2.19000 O=C(CCNc1ccc(cc1)Br)OCc2ccccc2 2230a_100000210018_100009813219 [0,1,0,0,0,1|0,0,2]=4 7104 B21R2.19000 O=C(CCNc1ccc(cc1)Cl)OCc2ccccc2 2230a_100000210052_100009813219 [0,1,0,0,0,1|0,0,2]=4 7105 B21R2.19000 O=C(CCOc1ccc(cc1)Br)OCc2ccccc2 7a_100000185759_100009813219 [0,1,0,0,0,1|0,0,2]=4 7106 B21R2.19000 O=C(CCOc1ccc(cc1)Cl)OCc2ccccc2 7a_100000210216_100009813219 [0,1,0,0,0,1|0,0,2]=4 7107 B21R2.19000 O=C(CCOc1ccc(cc1)I)OCc2ccccc2 7a_100000212066_100009813219 [0,1,0,0,0,1|0,0,2]=4 7108 B21R2.19000 O=C(CCSc1ccc(cc1)Br)OCc2ccccc2 62a_100000752885_100009813219 [0,1,0,0,0,1|0,0,2]=4 7109 B21R2.19000 O=C(CCSc1ccc(cc1)Br)OCc2ccccc2 62a_100009813219_100000752885 [0,1,0,0,0,1|0,0,2]=4 7110 B21R2.19000 O=C(CCSc1ccc(cc1)Cl)OCc2ccccc2 62a_100000755918_100009813219 [0,1,0,0,0,1|0,0,2]=4 7111 B21R2.19000 O=C(CCSc1ccc(cc1)Cl)OCc2ccccc2 62a_100009813219_100000755918 [0,1,0,0,0,1|0,0,2]=4 7112 B21R2.19000 O=C(CCSc1ccc(cc1)F)OCc2ccccc2 62a_100000211213_100009813219 [0,1,0,0,0,1|0,0,2]=4 7113 B21R2.19000 O=C(CCSc1ccc(cc1)F)OCc2ccccc2 62a_100009813219_100000211213 [0,1,0,0,0,1|0,0,2]=4 7114 B21R2.19000 O=C(CCSc1ccc(cc1)O)OCc2ccccc2 62a_100009813219_100000185759 [0,1,0,0,0,1|0,0,2]=4 7115 B21R2.19000 O=C(CCc1ccccc1)COCc2ccc(cc2)Br 1458a_200012349173_100000765856 [0,1,0,0,0,1|0,0,2]=4 7116 B21R2.19000 O=C(CCc1ccccc1)COCc2ccc(cc2)Br 34a_100000695286_100012361361 [0,1,0,0,0,1|0,0,2]=4 7117 B21R2.19000 O=C(CCc1ccccc1)COCc2ccc(cc2)Cl 34a_100000211118_100012361361 [0,1,0,0,0,1|0,0,2]=4 7118 B21R2.19000 O=C(CCc1ccccc1)COCc2ccc(cc2)Cl 7a_100000211118_100012361361 [0,1,0,0,0,1|0,0,2]=4 7119 B21R2.19000 O=C(CCc1ccccc1)COCc2ccc(cc2)F 34a_100000210977_100012361361 [0,1,0,0,0,1|0,0,2]=4 7120 B21R2.19000 O=C(CCc1ccccc1)COCc2ccc(cc2)F 7a_100000210977_100012361361 [0,1,0,0,0,1|0,0,2]=4 7121 B21R2.19000 O=C(CCc1ccccc1)COCc2ccc(cc2)I 34a_100000690907_100012361361 [0,1,0,0,0,1|0,0,2]=4 7122 B21R2.19000 O=C(CCc1ccccc1)COCc2ccc(cc2)I 7a_100000690907_100012361361 [0,1,0,0,0,1|0,0,2]=4 7123 B21R2.19000 O=C(CCc1ccccc1)NN=Cc2ccc(cc2)Br 4a_100000189782_100000186029 [0,1,0,0,0,1|2,0,0]=4 7124 B21R2.19000 O=C(CCc1ccccc1)NN=Cc2ccc(cc2)Cl 4a_100000189782_100000189385 [0,1,0,0,0,1|2,0,0]=4 7125 B21R2.19000 O=C(CCc1ccccc1)NN=Cc2ccc(cc2)F 4a_100000189782_100000210084 [0,1,0,0,0,1|2,0,0]=4 7126 B21R2.19000 O=C(CCc1ccccc1)NN=Cc2ccc(cc2)I 4a_100000189782_100000188517 [0,1,0,0,0,1|2,0,0]=4 7127 B21R2.19000 O=C(CCc1ccccc1)NN=Cc2ccc(cc2)O 4a_100000189782_100000185832 [0,1,0,0,0,1|2,0,0]=4 7128 B21R2.19000 O=C(CNCc1ccc(cc1)Br)OCc2ccccc2 2230a_100000174875_100000753625 [0,1,0,0,0,1|0,0,2]=4 7129 B21R2.19000 O=C(CNCc1ccc(cc1)Br)OCc2ccccc2 34a_100000174875_100000753625 [0,1,0,0,0,1|0,0,2]=4 7130 B21R2.19000 O=C(CNCc1ccc(cc1)Cl)OCc2ccccc2 2230a_100000174871_100000753625 [0,1,0,0,0,1|0,0,2]=4 7131 B21R2.19000 O=C(CNCc1ccc(cc1)Cl)OCc2ccccc2 34a_100000174871_100000753625 [0,1,0,0,0,1|0,0,2]=4 7132 B21R2.19000 O=C(CNCc1ccc(cc1)F)OCc2ccccc2 2230a_100000174882_100000753625 [0,1,0,0,0,1|0,0,2]=4 7133 B21R2.19000 O=C(CNCc1ccc(cc1)F)OCc2ccccc2 34a_100000174882_100000753625 [0,1,0,0,0,1|0,0,2]=4 7134 B21R2.19000 O=C(CNCc1ccc(cc1)I)OCc2ccccc2 2230a_100016989417_100000753625 [0,1,0,0,0,1|0,0,2]=4 7135 B21R2.19000 O=C(CNCc1ccc(cc1)I)OCc2ccccc2 34a_100016989417_100000753625 [0,1,0,0,0,1|0,0,2]=4 7136 B21R2.19000 O=C(CNCc1ccc(cc1)O)OCc2ccccc2 34a_100000185549_100000753625 [0,1,0,0,0,1|0,0,2]=4 7137 B21R2.19000 O=C(COCc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_200012349173 [0,1,0,0,0,1|1,0,1]=4 7138 B21R2.19000 O=C(COCc1ccc(cc1)Br)NCc2ccccc2 1626a_100015324214_200012349173 [0,1,0,0,0,1|1,0,1]=4 7139 B21R2.19000 O=C(COCc1ccc(cc1)Br)NCc2ccccc2 34a_100000695286_100000183539 [0,1,0,0,0,1|1,0,1]=4 7140 B21R2.19000 O=C(COCc1ccc(cc1)Br)NCc2ccccc2 527a_100015324214_200012349173 [0,1,0,0,0,1|1,0,1]=4 7141 B21R2.19000 O=C(COCc1ccc(cc1)Br)NNc2ccccc2 22a_100015195140_200012349173 [0,1,0,0,0,1|2,0,0]=4 7142 B21R2.19000 O=C(COCc1ccc(cc1)Br)OCc2ccccc2 34a_100000695286_100000753625 [0,1,0,0,0,1|0,0,2]=4 7143 B21R2.19000 O=C(COCc1ccc(cc1)Cl)NCc2ccccc2 34a_100000211118_100000183539 [0,1,0,0,0,1|1,0,1]=4 7144 B21R2.19000 O=C(COCc1ccc(cc1)Cl)NCc2ccccc2 7a_100000211118_100000183539 [0,1,0,0,0,1|1,0,1]=4 7145 B21R2.19000 O=C(COCc1ccc(cc1)Cl)OCc2ccccc2 34a_100000211118_100000753625 [0,1,0,0,0,1|0,0,2]=4 7146 B21R2.19000 O=C(COCc1ccc(cc1)Cl)OCc2ccccc2 7a_100000211118_100000753625 [0,1,0,0,0,1|0,0,2]=4 7147 B21R2.19000 O=C(COCc1ccc(cc1)F)NCc2ccccc2 34a_100000210977_100000183539 [0,1,0,0,0,1|1,0,1]=4 7148 B21R2.19000 O=C(COCc1ccc(cc1)F)NCc2ccccc2 7a_100000210977_100000183539 [0,1,0,0,0,1|1,0,1]=4 7149 B21R2.19000 O=C(COCc1ccc(cc1)F)OCc2ccccc2 34a_100000210977_100000753625 [0,1,0,0,0,1|0,0,2]=4 7150 B21R2.19000 O=C(COCc1ccc(cc1)F)OCc2ccccc2 7a_100000210977_100000753625 [0,1,0,0,0,1|0,0,2]=4 7151 B21R2.19000 O=C(COCc1ccc(cc1)I)NCc2ccccc2 34a_100000690907_100000183539 [0,1,0,0,0,1|1,0,1]=4 7152 B21R2.19000 O=C(COCc1ccc(cc1)I)NCc2ccccc2 7a_100000690907_100000183539 [0,1,0,0,0,1|1,0,1]=4 7153 B21R2.19000 O=C(COCc1ccc(cc1)I)OCc2ccccc2 34a_100000690907_100000753625 [0,1,0,0,0,1|0,0,2]=4 7154 B21R2.19000 O=C(COCc1ccc(cc1)I)OCc2ccccc2 7a_100000690907_100000753625 [0,1,0,0,0,1|0,0,2]=4 7155 B21R2.19000 O=C(CSCc1ccc(cc1)Br)OCc2ccccc2 62a_100000189115_100000753625 [0,1,0,0,0,1|0,0,2]=4 7156 B21R2.19000 O=C(CSCc1ccc(cc1)Br)OCc2ccccc2 62a_100000753625_100000189115 [0,1,0,0,0,1|0,0,2]=4 7157 B21R2.19000 O=C(CSCc1ccc(cc1)Cl)OCc2ccccc2 62a_100000187161_100000753625 [0,1,0,0,0,1|0,0,2]=4 7158 B21R2.19000 O=C(CSCc1ccc(cc1)Cl)OCc2ccccc2 62a_100000753625_100000187161 [0,1,0,0,0,1|0,0,2]=4 7159 B21R2.19000 O=C(CSCc1ccc(cc1)F)OCc2ccccc2 62a_100000198546_100000753625 [0,1,0,0,0,1|0,0,2]=4 7160 B21R2.19000 O=C(CSCc1ccc(cc1)F)OCc2ccccc2 62a_100000753625_100000187164 [0,1,0,0,0,1|0,0,2]=4 7161 B21R2.19000 O=C(CSCc1ccc(cc1)I)OCc2ccccc2 62a_100000189116_100000753625 [0,1,0,0,0,1|0,0,2]=4 7162 B21R2.19000 O=C(CSCc1ccc(cc1)I)OCc2ccccc2 62a_100000753625_100000189116 [0,1,0,0,0,1|0,0,2]=4 7163 B21R2.19000 O=C(NC=Cc1ccc(cc1)O)OCc2ccccc2 271570a_203496583355_200042841372 [0,1,0,0,0,1|0,0,0]=2 7164 B21R2.19000 O=C(NCCc1ccc(cc1)Br)OCc2ccccc2 271570a_200010239705_100000752885 [0,1,0,0,0,1|0,0,2]=4 7165 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)OCc2ccccc2 271570a_200010239705_100000755918 [0,1,0,0,0,1|0,0,2]=4 7166 B21R2.19000 O=C(NCCc1ccc(cc1)F)OCc2ccccc2 271570a_200010239705_100000211213 [0,1,0,0,0,1|0,0,2]=4 7167 B21R2.19000 O=C(NCCc1ccc(cc1)O)OCc2ccccc2 271570a_200010239705_100000185759 [0,1,0,0,0,1|0,0,2]=4 7168 B21R2.19000 O=C(NCCc1ccc(cc1)O)OCc2ccccc2 271570a_203496583355_200012059363 [0,1,0,0,0,1|0,0,2]=4 7169 B21R2.27922 CC(OCc1ccccc1)C(=O)NCc2ccccc2 34a_100000210790_200011934207 [0,1,0,0,0,1|1,0,1]=4 7170 B21R2.27922 CC(OCc1ccccc1)C(=O)NCc2ccccc2 7a_100000210790_100000183842 [0,1,0,0,0,1|1,0,1]=4 7171 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2 11a_100000207497_100000210462 [0,1,0,0,0,1|1,0,0]=3 7172 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2 1626a_100000207497_100000210462 [0,1,0,0,0,1|1,0,0]=3 7173 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccccn2 11a_100000207497_100000740811 [0,1,0,0,0,1|2,0,0]=4 7174 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccccn2 240690a_100000207497_100000740811 [0,1,0,0,0,1|2,0,0]=4 7175 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2cccnc2 11a_100000207497_100000735890 [0,1,0,0,0,1|2,0,0]=4 7176 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2cccnc2 240690a_100000207497_100000735890 [0,1,0,0,0,1|2,0,0]=4 7177 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccncc2 240690a_100000207497_100000682801 [0,1,0,0,0,1|2,0,0]=4 7178 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2 11a_100000737206_100000210462 [0,1,0,0,0,1|2,0,0]=4 7179 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2 1626a_100000737206_100000210462 [0,1,0,0,0,1|2,0,0]=4 7180 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2 11a_100000763209_100000210462 [0,1,0,0,0,1|2,0,0]=4 7181 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2 1626a_100000763209_100000210462 [0,1,0,0,0,1|2,0,0]=4 7182 B21R2.27922 CN(CCc1ccncc1)C(=O)C=Cc2ccccc2 11a_100000742850_100000210462 [0,1,0,0,0,1|2,0,0]=4 7183 B21R2.27922 C[C@H](OCc1ccccc1)C(=O)CCc2ccccc2 1458a_100000703211_100000765856 [0,1,0,0,0,1|0,0,2]=4 7184 B21R2.27922 C[C@H](OCc1ccccc1)C(=O)NCc2ccccc2 11a_100015324214_100000703211 [0,1,0,0,0,1|1,0,1]=4 7185 B21R2.27922 C[C@H](OCc1ccccc1)C(=O)NCc2ccccc2 1626a_100015324214_100000703211 [0,1,0,0,0,1|1,0,1]=4 7186 B21R2.27922 C[C@H](OCc1ccccc1)C(=O)NCc2ccccc2 240690a_100015324214_100000703211 [0,1,0,0,0,1|1,0,1]=4 7187 B21R2.27922 C[C@H](OCc1ccccc1)C(=O)NCc2ccccc2 527a_100015324214_100000703211 [0,1,0,0,0,1|1,0,1]=4 7188 B21R2.27922 C[C@H](OCc1ccccc1)C(=O)NNc2ccccc2 22a_100015195140_100000703211 [0,1,0,0,0,1|2,0,0]=4 7189 B21R2.27922 C[C@H](OCc1ccccc1)C(=O)OCc2ccccc2 7a_100016105899_100000211182 [0,1,0,0,0,1|0,0,2]=4 7190 B21R2.27922 O=C(OCc1ccccc1)C(F)NCc2ccccc2 2230a_100015324214_100000036447 [0,1,0,0,0,1|0,0,2]=4 7191 B21R2.27922 O=C(OCc1ccccc1)C(F)NCc2ccccc2 34a_100015324214_100000036447 [0,1,0,0,0,1|0,0,2]=4 7192 B21R2.27922 O=C(OCc1ccccc1)C(F)OCc2ccccc2 34a_100000210790_100000036447 [0,1,0,0,0,1|0,0,2]=4 7193 B21R2.27922 O=C(OCc1ccccc1)C(F)OCc2ccccc2 7a_100000210790_100000036447 [0,1,0,0,0,1|0,0,2]=4 7194 B21R2.27922 O=C(OCc1ccccc1)C(F)SCc2ccccc2 62a_100000036447_100015291786 [0,1,0,0,0,1|0,0,2]=4 7195 B21R2.27922 O=C(OCc1ccccc1)C(F)SCc2ccccc2 62a_100000211182_100000036447 [0,1,0,0,0,1|0,0,2]=4 7196 B21R2.27923 CC(=NNC(=O)CCc1ccccc1)c2ccccc2 4a_100000189782_100000185851 [0,1,0,0,0,1|2,0,0]=4 7197 B21R2.27923 CC(CNC(=O)C=Cc1ccccc1)c2ccccc2 11a_100000701038_100000210462 [0,1,0,0,0,1|1,0,0]=3 7198 B21R2.27923 CC(CNC(=O)C=Cc1ccccc1)c2ccccc2 1626a_100000701038_100000210462 [0,1,0,0,0,1|1,0,0]=3 7199 B21R2.27923 CC(CNC(=O)C=Cc1ccccn1)c2ccccc2 11a_100000701038_100000740811 [0,1,0,0,0,1|2,0,0]=4 7200 B21R2.27923 CC(CNC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100000701038_100000740811 [0,1,0,0,0,1|2,0,0]=4 7201 B21R2.27923 CC(CNC(=O)C=Cc1cccnc1)c2ccccc2 11a_100000701038_100000735890 [0,1,0,0,0,1|2,0,0]=4 7202 B21R2.27923 CC(CNC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100000701038_100000735890 [0,1,0,0,0,1|2,0,0]=4 7203 B21R2.27923 CC(CNC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100000701038_100000682801 [0,1,0,0,0,1|2,0,0]=4 7204 B21R2.27923 CC(SCC(=O)OCc1ccccc1)c2ccccc2 62a_100000230085_100000753625 [0,1,0,0,0,1|0,0,2]=4 7205 B21R2.27923 CC(SCC(=O)OCc1ccccc1)c2ccccc2 62a_100000753625_100000230085 [0,1,0,0,0,1|0,0,2]=4 7206 B21R2.27923 CN(CCC(=O)OCc1ccccc1)c2ccccc2 2230a_100000210012_100009813219 [0,1,0,0,0,1|0,0,2]=4 7207 B21R2.27923 CN(CCC(=O)OCc1ccccc1)c2ccccc2 269982a_100000210012_100009813219 [0,1,0,0,0,1|0,0,2]=4 7208 B21R2.27923 C[C@@H](NCC(=O)OCc1ccccc1)c2ccccc2 2230a_100000751104_100000753625 [0,1,0,0,0,1|0,0,2]=4 7209 B21R2.27923 C[C@@H](OCC(=O)CCc1ccccc1)c2ccccc2 34a_100000761318_100012361361 [0,1,0,0,0,1|0,0,2]=4 7210 B21R2.27923 C[C@@H](OCC(=O)CCc1ccccc1)c2ccccc2 7a_100000761318_100012361361 [0,1,0,0,0,1|0,0,2]=4 7211 B21R2.27923 C[C@@H](OCC(=O)NCc1ccccc1)c2ccccc2 34a_100000761318_100000183539 [0,1,0,0,0,1|1,0,1]=4 7212 B21R2.27923 C[C@@H](OCC(=O)NCc1ccccc1)c2ccccc2 7a_100000761318_100000183539 [0,1,0,0,0,1|1,0,1]=4 7213 B21R2.27923 C[C@@H](OCC(=O)OCc1ccccc1)c2ccccc2 34a_100000761318_100000753625 [0,1,0,0,0,1|0,0,2]=4 7214 B21R2.27923 C[C@@H](OCC(=O)OCc1ccccc1)c2ccccc2 7a_100000761318_100000753625 [0,1,0,0,0,1|0,0,2]=4 7215 B21R2.27923 O=C(C=Cc1ccccc1)CCC(=O)c2ccccc2 1458a_100000210462_100000750707 [0,1,0,0,0,1|1,0,0]=3 7216 B21R2.27923 O=C(C=Cc1ccccc1)CC[C@@H](O)c2ccccc2 1458a_100000210462_100000729684 [0,1,0,0,0,1|1,0,0]=3 7217 B21R2.27923 O=C(C=Cc1ccccc1)COC(=O)c2ccccc2 1458a_100000210462_100000073877 [0,1,0,0,0,1|0,0,1]=3 7218 B21R2.27923 O=C(C=Cc1ccccc1)NNC(=O)c2ccccc2 22a_100000184135_100000210462 [0,1,0,0,0,1|1,0,1]=4 7219 B21R2.27923 O=C(C=Cc1ccccn1)CCC(=O)c2ccccc2 1458a_100000740811_100000750707 [0,1,0,0,0,1|2,0,0]=4 7220 B21R2.27923 O=C(C=Cc1ccccn1)CC[C@@H](O)c2ccccc2 1458a_100000740811_100000729684 [0,1,0,0,0,1|2,0,0]=4 7221 B21R2.27923 O=C(C=Cc1ccccn1)COC(=O)c2ccccc2 1458a_100000740811_100000073877 [0,1,0,0,0,1|1,0,1]=4 7222 B21R2.27923 O=C(C=Cc1ccccn1)NCC(O)c2ccccc2 240690a_100000210709_100000740811 [0,1,0,0,0,1|2,0,0]=4 7223 B21R2.27923 O=C(C=Cc1cccnc1)CCC(=O)c2ccccc2 1458a_100000735890_100000750707 [0,1,0,0,0,1|2,0,0]=4 7224 B21R2.27923 O=C(C=Cc1cccnc1)CC[C@@H](O)c2ccccc2 1458a_100000735890_100000729684 [0,1,0,0,0,1|2,0,0]=4 7225 B21R2.27923 O=C(C=Cc1cccnc1)COC(=O)c2ccccc2 1458a_100000735890_100000073877 [0,1,0,0,0,1|1,0,1]=4 7226 B21R2.27923 O=C(C=Cc1cccnc1)NCC(O)c2ccccc2 240690a_100000210709_100000735890 [0,1,0,0,0,1|2,0,0]=4 7227 B21R2.27923 O=C(C=Cc1ccncc1)CCC(=O)c2ccccc2 1458a_100000682801_100000750707 [0,1,0,0,0,1|2,0,0]=4 7228 B21R2.27923 O=C(C=Cc1ccncc1)CC[C@@H](O)c2ccccc2 1458a_100000682801_100000729684 [0,1,0,0,0,1|2,0,0]=4 7229 B21R2.27923 O=C(C=Cc1ccncc1)COC(=O)c2ccccc2 1458a_100000682801_100000073877 [0,1,0,0,0,1|1,0,1]=4 7230 B21R2.27923 O=C(C=Cc1ccncc1)NCC(O)c2ccccc2 240690a_100000210709_100000682801 [0,1,0,0,0,1|2,0,0]=4 7231 B21R2.27923 O=C(CCC(=O)c1ccccc1)CCc2ccccc2 1458a_100000185753_100000750707 [0,1,0,0,0,1|1,0,1]=4 7232 B21R2.27923 O=C(CCC(=O)c1ccccc1)OCc2ccccc2 1458a_100000185807_100009813219 [0,1,0,0,0,1|0,0,1]=3 7233 B21R2.27923 O=C(CCc1ccccc1)CNC(=O)c2ccccc2 1458a_100000182045_100000765856 [0,1,0,0,0,1|1,0,1]=4 7234 B21R2.27923 O=C(CCc1ccccc1)COC(=O)c2ccccc2 1458a_100000185753_100000073877 [0,1,0,0,0,1|1,0,1]=4 7235 B21R2.27923 O=C(CCc1ccccc1)CSC(=S)c2ccccc2 1458a_100000043459_100000765856 [0,1,0,0,0,1|1,0,1]=4 7236 B21R2.27923 O=C(CCc1ccccc1)NNC(=O)c2ccccc2 22a_100000184135_100000185753 [0,1,0,0,0,1|2,0,0]=4 7237 B21R2.27923 O=C(CCc1ccccc1)NNC(=O)c2ccccc2 22a_100000189782_100000185807 [0,1,0,0,0,1|2,0,0]=4 7238 B21R2.27923 O=C(CNC(=O)c1ccccc1)NCc2ccccc2 11a_100000739245_100000185807 [0,1,0,0,0,1|1,0,1]=4 7239 B21R2.27923 O=C(CNC(=O)c1ccccc1)NCc2ccccc2 11a_100015324214_100000182045 [0,1,0,0,0,1|1,0,1]=4 7240 B21R2.27923 O=C(CNC(=O)c1ccccc1)NCc2ccccc2 1626a_100000739245_100000185807 [0,1,0,0,0,1|1,0,1]=4 7241 B21R2.27923 O=C(CNC(=O)c1ccccc1)NCc2ccccc2 1626a_100015324214_100000182045 [0,1,0,0,0,1|1,0,1]=4 7242 B21R2.27923 O=C(CNC(=O)c1ccccc1)NCc2ccccc2 240690a_100000739245_100000185807 [0,1,0,0,0,1|1,0,1]=4 7243 B21R2.27923 O=C(CNC(=O)c1ccccc1)NCc2ccccc2 240690a_100015324214_100000182045 [0,1,0,0,0,1|1,0,1]=4 7244 B21R2.27923 O=C(CNC(=O)c1ccccc1)NCc2ccccc2 527a_100000739245_100000185807 [0,1,0,0,0,1|1,0,1]=4 7245 B21R2.27923 O=C(CNC(=O)c1ccccc1)NCc2ccccc2 527a_100015324214_100000182045 [0,1,0,0,0,1|1,0,1]=4 7246 B21R2.27923 O=C(CNC(=O)c1ccccc1)OCc2ccccc2 188690a_100000687225_100000185807 [0,1,0,0,0,1|0,0,1]=3 7247 B21R2.27923 O=C(CSC(=S)c1ccccc1)NCc2ccccc2 1626a_100015324214_100000043459 [0,1,0,0,0,1|1,0,1]=4 7248 B21R2.27923 O=C(CSC(=S)c1ccccc1)NCc2ccccc2 240690a_100015324214_100000043459 [0,1,0,0,0,1|1,0,1]=4 7249 B21R2.27923 O=C(CSC(=S)c1ccccc1)NCc2ccccc2 527a_100015324214_100000043459 [0,1,0,0,0,1|1,0,1]=4 7250 B21R2.27923 O=C(NCc1ccccc1)NNC(=O)c2ccccc2 273464a_100015324214_100000184135 [0,1,0,0,0,1|2,0,0]=4 7251 B21R2.27923 O=C(NCc1ccccc1)NNC(=O)c2ccccc2 512a_100000184135_100015324214 [0,1,0,0,0,1|2,0,0]=4 7252 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2 11a_100000238496_100000210462 [0,1,0,0,0,1|2,0,0]=4 7253 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2 1626a_100000238496_100000210462 [0,1,0,0,0,1|2,0,0]=4 7254 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2 11a_100011207255_100000210462 [0,1,0,0,0,1|2,0,0]=4 7255 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2 1626a_100011207255_100000210462 [0,1,0,0,0,1|2,0,0]=4 7256 B21R2.27926 CC(OC(=O)OCc1ccccc1)Sc2ccccc2 62a_100000719477_200015597219 [0,1,0,0,0,1|1,0,1]=4 7257 B21R2.27926 CC(OC(=O)OCc1ccccc1)Sc2ccccc2 62a_200015597219_100000041952 [0,1,0,0,0,1|1,0,1]=4 7258 B21R2.27926 CN(CC(=O)OCc1ccccc1)Cc2ccccc2 2230a_100000186898_100000753625 [0,1,0,0,0,1|0,0,2]=4 7259 B21R2.27926 CN(CC(=O)OCc1ccccc1)Cc2ccccc2 2230a_100020626385_100015291786 [0,1,0,0,0,1|0,0,2]=4 7260 B21R2.27926 CN(CC(=O)OCc1ccccc1)Cc2ccccc2 269982a_100000186898_100000753625 [0,1,0,0,0,1|0,0,2]=4 7261 B21R2.27926 CN(CC(=O)OCc1ccccc1)Cc2ccccc2 269982a_100020626385_100000211182 [0,1,0,0,0,1|0,0,2]=4 7262 B21R2.27926 CN(CC(=O)OCc1ccccc1)Cc2ccccc2 270004a_100020626385_100015611070 [0,1,0,0,0,1|0,0,2]=4 7263 B21R2.27926 O=C(C=Cc1ccccc1)CC(=O)Cc2ccccc2 1458a_100000210462_100000233483 [0,1,0,0,0,1|1,0,0]=3 7264 B21R2.27926 O=C(C=Cc1ccccc1)CC(=O)Nc2ccccc2 1458a_100000210462_100000182850 [0,1,0,0,0,1|1,0,1]=4 7265 B21R2.27926 O=C(C=Cc1ccccc1)CC(=O)Oc2ccccc2 1458a_100000210462_100009813826 [0,1,0,0,0,1|1,0,1]=4 7266 B21R2.27926 O=C(C=Cc1ccccn1)CC(=O)Cc2ccccc2 1458a_100000740811_100000233483 [0,1,0,0,0,1|2,0,0]=4 7267 B21R2.27926 O=C(C=Cc1cccnc1)CC(=O)Cc2ccccc2 1458a_100000735890_100000233483 [0,1,0,0,0,1|2,0,0]=4 7268 B21R2.27926 O=C(C=Cc1ccncc1)CC(=O)Cc2ccccc2 1458a_100000682801_100000233483 [0,1,0,0,0,1|2,0,0]=4 7269 B21R2.27926 O=C(CC(=O)OCc1ccccc1)C[n+]2ccccc2 1458a_200000086051_100000753625 [0,1,0,0,0,1|1,0,1]=4 7270 B21R2.27926 O=C(CC(=O)OCc1ccccc1)Cc2ccccc2 1458a_100000037839_100015291786 [0,1,0,0,0,1|0,0,1]=3 7271 B21R2.27926 O=C(CC(=O)OCc1ccccc1)Cc2ccccn2 1458a_100000037839_100000721315 [0,1,0,0,0,1|1,0,1]=4 7272 B21R2.27926 O=C(CC(=O)OCc1ccccc1)Cc2ccccn2 1458a_100000233486_100000753625 [0,1,0,0,0,1|1,0,1]=4 7273 B21R2.27926 O=C(CC(=O)OCc1ccccc1)Cc2cccnc2 1458a_100000037839_100000733263 [0,1,0,0,0,1|1,0,1]=4 7274 B21R2.27926 O=C(CC(=O)OCc1ccccc1)Cc2cccnc2 1458a_100000737805_100000753625 [0,1,0,0,0,1|1,0,1]=4 7275 B21R2.27926 O=C(CC(=O)OCc1ccccc1)Cc2ccncc2 1458a_100000037839_100000705612 [0,1,0,0,0,1|1,0,1]=4 7276 B21R2.27926 O=C(CC(=O)OCc1ccccc1)Nc2ccccc2 22a_100000106764_100000037839 [0,1,0,0,0,1|0,0,1]=3 7277 B21R2.27926 O=C(CC(=O)Oc1ccccc1)NCc2ccccc2 240690a_100015324214_200000075362 [0,1,0,0,0,1|1,0,1]=4 7278 B21R2.27926 O=C(CCc1ccccc1)CC(=O)Cc2ccccc2 1458a_100000185753_100000233483 [0,1,0,0,0,1|1,0,1]=4 7279 B21R2.27926 O=C(CCc1ccccc1)CC(=O)Nc2ccccc2 1458a_100000185753_100000182850 [0,1,0,0,0,1|1,0,1]=4 7280 B21R2.27926 O=C(CCc1ccccc1)CC(=O)Oc2ccccc2 1458a_100000185753_100009813826 [0,1,0,0,0,1|1,0,1]=4 7281 B21R2.221980 CC(=NNCc1ccccc1)C=Cc2cccc(c2)Br 4a_100000007032_200016266566 [0,1,0,0,0,1|2,0,0]=4 7282 B21R2.221980 CC(=NNCc1ccccc1)C=Cc2cccc(c2)Cl 4a_100000007032_200016280735 [0,1,0,0,0,1|2,0,0]=4 7283 B21R2.221980 Cc1cc(ccn1)CNC(=O)C/C=C/c2ccccc2 11a_100011934566_100011219626 [0,1,0,0,0,1|2,0,0]=4 7284 B21R2.221980 Cc1cc(ccn1)CNC(=O)C/C=C/c2ccccc2 1626a_100011934566_100011219626 [0,1,0,0,0,1|2,0,0]=4 7285 B21R2.221980 Cc1cc(ccn1)CNC(=O)C/C=C/c2ccccc2 240690a_100011934566_100011219626 [0,1,0,0,0,1|2,0,0]=4 7286 B21R2.221980 Cc1cc(ccn1)CNC(=O)C=CSc2ccccc2 11a_100011934566_100016262050 [0,1,0,0,0,1|2,0,0]=4 7287 B21R2.221980 Cc1cc(ccn1)CNC(=O)C=CSc2ccccc2 1626a_100011934566_100016262050 [0,1,0,0,0,1|2,0,0]=4 7288 B21R2.221980 Cc1cc(ccn1)CNC(=O)C=CSc2ccccc2 240690a_100011934566_100016262050 [0,1,0,0,0,1|2,0,0]=4 7289 B21R2.221980 Cc1cccc(c1)C#CC(=O)C/C=C/c2ccccc2 1458a_100011892726_100016265936 [0,1,0,0,0,1|1,0,1]=4 7290 B21R2.221980 Cc1cccc(c1)C=CC(=O)C/C=C/c2ccccc2 1458a_100000690095_100016265936 [0,1,0,0,0,1|1,0,1]=4 7291 B21R2.221980 Cc1cccc(c1)C=CC(=O)CC#Cc2ccccc2 1458a_100000690095_100011352542 [0,1,0,0,0,1|1,0,1]=4 7292 B21R2.221980 Cc1cccc(c1)C=CC(=O)CCCc2ccccc2 1458a_100000690095_100000211621 [0,1,0,0,0,1|1,0,0]=3 7293 B21R2.221980 Cc1cccc(c1)C=CC(=O)CCOc2ccccc2 1458a_100000690095_100000184471 [0,1,0,0,0,1|1,0,0]=3 7294 B21R2.221980 Cc1cccc(c1)C=CC(=O)CCSc2ccccc2 1458a_100000690095_100000246102 [0,1,0,0,0,1|1,0,0]=3 7295 B21R2.221980 Cc1cccc(c1)C=CC(=O)CSCc2ccccc2 1458a_100000690095_200011217039 [0,1,0,0,0,1|0,1,0]=3 7296 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000690095 [0,1,0,0,0,1|1,0,0]=3 7297 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000690095 [0,1,0,0,0,1|1,0,0]=3 7298 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000690095 [0,1,0,0,0,1|1,0,0]=3 7299 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000690095 [0,1,0,0,0,1|2,0,0]=4 7300 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000690095 [0,1,0,0,0,1|2,0,0]=4 7301 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100000690095 [0,1,0,0,0,1|2,0,0]=4 7302 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000690095 [0,1,0,0,0,1|2,0,0]=4 7303 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000690095 [0,1,0,0,0,1|2,0,0]=4 7304 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100000690095 [0,1,0,0,0,1|2,0,0]=4 7305 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000690095 [0,1,0,0,0,1|2,0,0]=4 7306 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000690095 [0,1,0,0,0,1|2,0,0]=4 7307 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100000690095 [0,1,0,0,0,1|2,0,0]=4 7308 B21R2.221980 Cc1cccc(c1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000690095 [0,1,0,0,0,1|1,0,0]=3 7309 B21R2.221980 Cc1cccc(c1)C=CC(=O)NNCc2ccccn2 22a_100000736832_100000690095 [0,1,0,0,0,1|2,0,0]=4 7310 B21R2.221980 Cc1cccc(c1)C=CC(=O)NNCc2cccnc2 22a_100000738295_100000690095 [0,1,0,0,0,1|2,0,0]=4 7311 B21R2.221980 Cc1cccc(c1)C=CC(=O)NNCc2ccncc2 22a_100000736929_100000690095 [0,1,0,0,0,1|2,0,0]=4 7312 B21R2.221980 Cc1cccc(c1)CCC(=O)C/C=C/c2ccccc2 1458a_100000234952_100016265936 [0,1,0,0,0,1|1,0,0]=3 7313 B21R2.221980 Cc1cccc(c1)CCC(=O)C/C=C/c2ccccc2 1458a_100011219626_100011713685 [0,1,0,0,0,1|1,0,0]=3 7314 B21R2.221980 Cc1cccc(c1)CCC(=O)C=CSc2ccccc2 1458a_100016262050_100011713685 [0,1,0,0,0,1|1,0,0]=3 7315 B21R2.221980 Cc1cccc(c1)CCC(=O)COCc2ccccc2 1458a_100000230186_100011713685 [0,1,0,0,0,1|0,0,2]=4 7316 B21R2.221980 Cc1cccc(c1)CNC(=O)C/C=C/c2ccccc2 11a_100000185548_100011219626 [0,1,0,0,0,1|1,0,0]=3 7317 B21R2.221980 Cc1cccc(c1)CNC(=O)C/C=C/c2ccccc2 1626a_100000185548_100011219626 [0,1,0,0,0,1|1,0,0]=3 7318 B21R2.221980 Cc1cccc(c1)CNC(=O)C/C=C/c2ccccc2 240690a_100000185548_100011219626 [0,1,0,0,0,1|1,0,0]=3 7319 B21R2.221980 Cc1cccc(c1)CNC(=O)C=CSc2ccccc2 11a_100000185548_100016262050 [0,1,0,0,0,1|1,0,0]=3 7320 B21R2.221980 Cc1cccc(c1)CNC(=O)C=CSc2ccccc2 1626a_100000185548_100016262050 [0,1,0,0,0,1|1,0,0]=3 7321 B21R2.221980 Cc1cccc(c1)CNC(=O)C=CSc2ccccc2 240690a_100000185548_100016262050 [0,1,0,0,0,1|1,0,0]=3 7322 B21R2.221980 Cc1cccc(c1)CNC(=O)COCc2ccccc2 11a_100000185548_100000230186 [0,1,0,0,0,1|1,0,1]=4 7323 B21R2.221980 Cc1cccc(c1)CNC(=O)COCc2ccccc2 1626a_100000185548_100000230186 [0,1,0,0,0,1|1,0,1]=4 7324 B21R2.221980 Cc1cccc(c1)CNC(=O)COCc2ccccc2 240690a_100000185548_100000230186 [0,1,0,0,0,1|1,0,1]=4 7325 B21R2.221980 Cc1cccc(c1)CNC(=O)COCc2ccccc2 34a_100000210790_100000754571 [0,1,0,0,0,1|1,0,1]=4 7326 B21R2.221980 Cc1cccc(c1)CNC(=O)COCc2ccccc2 527a_100000185548_100000230186 [0,1,0,0,0,1|1,0,1]=4 7327 B21R2.221980 Cc1cccc(c1)CNC(=O)COCc2ccccc2 7a_100000210790_100000754571 [0,1,0,0,0,1|1,0,1]=4 7328 B21R2.221980 Cc1cccc(c1)NCC(=O)NOCc2ccccc2 2230a_100000188690_100000230105 [0,1,0,0,0,1|1,0,1]=4 7329 B21R2.221980 Cc1cccc(c1)NCC(=O)NOCc2ccccc2 34a_100000188690_100000230105 [0,1,0,0,0,1|1,0,1]=4 7330 B21R2.221980 Cc1cccc(c1)NCC(=O)OCCc2ccccc2 2230a_100000188690_200000077782 [0,1,0,0,0,1|1,0,1]=4 7331 B21R2.221980 Cc1cccc(c1)NCC(=O)OCCc2ccccc2 34a_100000188690_200000077782 [0,1,0,0,0,1|1,0,1]=4 7332 B21R2.221980 Cc1cccc(c1)NNC(=O)C/C=C/c2ccccc2 22a_100000681630_100011219626 [0,1,0,0,0,1|2,0,0]=4 7333 B21R2.221980 Cc1cccc(c1)NNC(=O)C=CSc2ccccc2 22a_100000681630_100016262050 [0,1,0,0,0,1|2,0,0]=4 7334 B21R2.221980 Cc1cccc(c1)NNC(=O)COCc2ccccc2 22a_100000681630_100000230186 [0,1,0,0,0,1|2,0,0]=4 7335 B21R2.221980 Cc1cccc(c1)OCC(=O)C/C=C/c2ccccc2 1458a_100000183606_100016265936 [0,1,0,0,0,1|2,0,0]=4 7336 B21R2.221980 Cc1cccc(c1)OCC(=O)NOCc2ccccc2 34a_100000210337_100000230105 [0,1,0,0,0,1|1,0,1]=4 7337 B21R2.221980 Cc1cccc(c1)OCC(=O)NOCc2ccccc2 7a_100000210337_100000230105 [0,1,0,0,0,1|1,0,1]=4 7338 B21R2.221980 Cc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000210337_200000077782 [0,1,0,0,0,1|1,0,1]=4 7339 B21R2.221980 Cc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100000210337_200000077782 [0,1,0,0,0,1|1,0,1]=4 7340 B21R2.221980 Cc1cccc(c1)SCC(=O)NOCc2ccccc2 62a_100000230105_100011215228 [0,1,0,0,0,1|1,0,1]=4 7341 B21R2.221980 Cc1cccc(c1)SCC(=O)NOCc2ccccc2 62a_100011215228_100000230105 [0,1,0,0,0,1|1,0,1]=4 7342 B21R2.221980 Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100011215228_200000077782 [0,1,0,0,0,1|1,0,1]=4 7343 B21R2.221980 Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100011215228 [0,1,0,0,0,1|1,0,1]=4 7344 B21R2.221980 Cc1cccc(n1)CNC(=O)C/C=C/c2ccccc2 11a_100000701342_100011219626 [0,1,0,0,0,1|2,0,0]=4 7345 B21R2.221980 Cc1cccc(n1)CNC(=O)C/C=C/c2ccccc2 1626a_100000701342_100011219626 [0,1,0,0,0,1|2,0,0]=4 7346 B21R2.221980 Cc1cccc(n1)CNC(=O)C/C=C/c2ccccc2 240690a_100000701342_100011219626 [0,1,0,0,0,1|2,0,0]=4 7347 B21R2.221980 Cc1cccc(n1)CNC(=O)C=CSc2ccccc2 11a_100000701342_100016262050 [0,1,0,0,0,1|2,0,0]=4 7348 B21R2.221980 Cc1cccc(n1)CNC(=O)C=CSc2ccccc2 1626a_100000701342_100016262050 [0,1,0,0,0,1|2,0,0]=4 7349 B21R2.221980 Cc1cccc(n1)CNC(=O)C=CSc2ccccc2 240690a_100000701342_100016262050 [0,1,0,0,0,1|2,0,0]=4 7350 B21R2.221980 Cc1ccnc(c1)CNC(=O)C/C=C/c2ccccc2 11a_100011934573_100011219626 [0,1,0,0,0,1|2,0,0]=4 7351 B21R2.221980 Cc1ccnc(c1)CNC(=O)C/C=C/c2ccccc2 1626a_100011934573_100011219626 [0,1,0,0,0,1|2,0,0]=4 7352 B21R2.221980 Cc1ccnc(c1)CNC(=O)C/C=C/c2ccccc2 240690a_100011934573_100011219626 [0,1,0,0,0,1|2,0,0]=4 7353 B21R2.221980 Cc1ccnc(c1)CNC(=O)C=CSc2ccccc2 11a_100011934573_100016262050 [0,1,0,0,0,1|2,0,0]=4 7354 B21R2.221980 Cc1ccnc(c1)CNC(=O)C=CSc2ccccc2 1626a_100011934573_100016262050 [0,1,0,0,0,1|2,0,0]=4 7355 B21R2.221980 Cc1ccnc(c1)CNC(=O)C=CSc2ccccc2 240690a_100011934573_100016262050 [0,1,0,0,0,1|2,0,0]=4 7356 B21R2.221980 Cc1cncc(c1)C=CC(=O)COCc2ccccc2 6a_100011998712_100011215004 [0,1,0,0,0,1|1,0,0]=3 7357 B21R2.221980 Cc1cncc(c1)C=CC(=O)CSCc2ccccc2 6a_100011998712_100000172147 [0,1,0,0,0,1|1,1,0]=4 7358 B21R2.221980 Cc1cncc(c1)CNC(=O)C/C=C/c2ccccc2 11a_100000692839_100011219626 [0,1,0,0,0,1|2,0,0]=4 7359 B21R2.221980 Cc1cncc(c1)CNC(=O)C/C=C/c2ccccc2 1626a_100000692839_100011219626 [0,1,0,0,0,1|2,0,0]=4 7360 B21R2.221980 Cc1cncc(c1)CNC(=O)C/C=C/c2ccccc2 240690a_100000692839_100011219626 [0,1,0,0,0,1|2,0,0]=4 7361 B21R2.221980 Cc1cncc(c1)CNC(=O)C=CSc2ccccc2 11a_100000692839_100016262050 [0,1,0,0,0,1|2,0,0]=4 7362 B21R2.221980 Cc1cncc(c1)CNC(=O)C=CSc2ccccc2 1626a_100000692839_100016262050 [0,1,0,0,0,1|2,0,0]=4 7363 B21R2.221980 Cc1cncc(c1)CNC(=O)C=CSc2ccccc2 240690a_100000692839_100016262050 [0,1,0,0,0,1|2,0,0]=4 7364 B21R2.221980 Cc1cncc(n1)C=CC(=O)COCc2ccccc2 6a_100000100294_100011215004 [0,1,0,0,0,1|2,0,0]=4 7365 B21R2.221980 Nc1cccc(c1)OCC(=O)NOCc2ccccc2 34a_100000210217_100000230105 [0,1,0,0,0,1|1,0,1]=4 7366 B21R2.221980 Nc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000210217_200000077782 [0,1,0,0,0,1|1,0,1]=4 7367 B21R2.221980 Nc1cccc(c1)SCC(=O)NOCc2ccccc2 62a_100000210019_100000230105 [0,1,0,0,0,1|1,0,1]=4 7368 B21R2.221980 Nc1cccc(c1)SCC(=O)NOCc2ccccc2 62a_100000230105_100000210019 [0,1,0,0,0,1|1,0,1]=4 7369 B21R2.221980 Nc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100000210019_200000077782 [0,1,0,0,0,1|1,0,1]=4 7370 B21R2.221980 Nc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000210019 [0,1,0,0,0,1|1,0,1]=4 7371 B21R2.221980 O=C(C#Cc1cccc(c1)Br)C/C=C/c2ccccc2 1458a_100012100324_100016265936 [0,1,0,0,0,1|1,0,1]=4 7372 B21R2.221980 O=C(C#Cc1cccc(c1)Cl)C/C=C/c2ccccc2 1458a_100011892777_100016265936 [0,1,0,0,0,1|1,0,1]=4 7373 B21R2.221980 O=C(C#Cc1cccc(c1)F)C/C=C/c2ccccc2 1458a_100011892744_100016265936 [0,1,0,0,0,1|1,0,1]=4 7374 B21R2.221980 O=C(C#Cc1cccc(c1)O)C/C=C/c2ccccc2 1458a_200009909484_100016265936 [0,1,0,0,0,1|1,0,1]=4 7375 B21R2.221980 O=C(C/C=C/c1ccccc1)CCc2cccc(c2)Br 1458a_100000184314_100016265936 [0,1,0,0,0,1|1,0,0]=3 7376 B21R2.221980 O=C(C/C=C/c1ccccc1)CCc2cccc(c2)Br 1458a_100011219626_100011740638 [0,1,0,0,0,1|1,0,0]=3 7377 B21R2.221980 O=C(C/C=C/c1ccccc1)CCc2cccc(c2)Cl 1458a_100000235675_100016265936 [0,1,0,0,0,1|1,0,0]=3 7378 B21R2.221980 O=C(C/C=C/c1ccccc1)CCc2cccc(c2)Cl 1458a_100011219626_100011713710 [0,1,0,0,0,1|1,0,0]=3 7379 B21R2.221980 O=C(C/C=C/c1ccccc1)CCc2cccc(c2)F 1458a_100000235673_100016265936 [0,1,0,0,0,1|1,0,0]=3 7380 B21R2.221980 O=C(C/C=C/c1ccccc1)CCc2cccc(c2)F 1458a_100011219626_100011217235 [0,1,0,0,0,1|1,0,0]=3 7381 B21R2.221980 O=C(C/C=C/c1ccccc1)CCc2cccc(c2)I 1458a_100010007846_100016265936 [0,1,0,0,0,1|1,0,0]=3 7382 B21R2.221980 O=C(C/C=C/c1ccccc1)CCc2cccc(c2)O 1458a_100011216126_100016265936 [0,1,0,0,0,1|1,0,0]=3 7383 B21R2.221980 O=C(C/C=C/c1ccccc1)COc2cccc(c2)Br 1458a_100000182359_100016265936 [0,1,0,0,0,1|2,0,0]=4 7384 B21R2.221980 O=C(C/C=C/c1ccccc1)COc2cccc(c2)Cl 1458a_100000184978_100016265936 [0,1,0,0,0,1|2,0,0]=4 7385 B21R2.221980 O=C(C/C=C/c1ccccc1)COc2cccc(c2)F 1458a_100000182781_100016265936 [0,1,0,0,0,1|2,0,0]=4 7386 B21R2.221980 O=C(C/C=C/c1ccccc1)CSc2cccc(c2)Br 1458a_100000760868_100016265936 [0,1,0,0,0,1|2,0,0]=4 7387 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cc(ccn2)Br 11a_100009818019_100011219626 [0,1,0,0,0,1|2,0,0]=4 7388 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cc(ccn2)Br 1626a_100009818019_100011219626 [0,1,0,0,0,1|2,0,0]=4 7389 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cc(ccn2)Br 240690a_100009818019_100011219626 [0,1,0,0,0,1|2,0,0]=4 7390 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cc(ccn2)Cl 11a_100000085674_100011219626 [0,1,0,0,0,1|2,0,0]=4 7391 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cc(ccn2)Cl 1626a_100000085674_100011219626 [0,1,0,0,0,1|2,0,0]=4 7392 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cc(ccn2)Cl 240690a_100000085674_100011219626 [0,1,0,0,0,1|2,0,0]=4 7393 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(=O)[nH]2 11a_100000696482_100011219626 [0,1,0,0,0,1|2,0,0]=4 7394 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(=O)[nH]2 1626a_100000696482_100011219626 [0,1,0,0,0,1|2,0,0]=4 7395 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(=O)[nH]2 240690a_100000696482_100011219626 [0,1,0,0,0,1|2,0,0]=4 7396 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100011219626 [0,1,0,0,0,1|1,0,0]=3 7397 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100011219626 [0,1,0,0,0,1|1,0,0]=3 7398 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100011219626 [0,1,0,0,0,1|1,0,0]=3 7399 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100011219626 [0,1,0,0,0,1|1,0,0]=3 7400 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100011219626 [0,1,0,0,0,1|1,0,0]=3 7401 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100011219626 [0,1,0,0,0,1|1,0,0]=3 7402 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)F 11a_100000174948_100011219626 [0,1,0,0,0,1|1,0,0]=3 7403 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100011219626 [0,1,0,0,0,1|1,0,0]=3 7404 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100011219626 [0,1,0,0,0,1|1,0,0]=3 7405 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)I 11a_100000106179_100011219626 [0,1,0,0,0,1|1,0,0]=3 7406 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100011219626 [0,1,0,0,0,1|1,0,0]=3 7407 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100011219626 [0,1,0,0,0,1|1,0,0]=3 7408 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100011219626 [0,1,0,0,0,1|1,0,0]=3 7409 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)Br 11a_100016987751_100011219626 [0,1,0,0,0,1|2,0,0]=4 7410 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)Br 1626a_100016987751_100011219626 [0,1,0,0,0,1|2,0,0]=4 7411 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)Br 240690a_100016987751_100011219626 [0,1,0,0,0,1|2,0,0]=4 7412 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)Cl 11a_100016990191_100011219626 [0,1,0,0,0,1|2,0,0]=4 7413 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)Cl 1626a_100016990191_100011219626 [0,1,0,0,0,1|2,0,0]=4 7414 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)Cl 240690a_100016990191_100011219626 [0,1,0,0,0,1|2,0,0]=4 7415 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)F 11a_100015188798_100011219626 [0,1,0,0,0,1|2,0,0]=4 7416 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)F 1626a_100015188798_100011219626 [0,1,0,0,0,1|2,0,0]=4 7417 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cccc(n2)F 240690a_100015188798_100011219626 [0,1,0,0,0,1|2,0,0]=4 7418 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)Br 11a_100025757509_100011219626 [0,1,0,0,0,1|2,0,0]=4 7419 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)Br 240690a_100025757509_100011219626 [0,1,0,0,0,1|2,0,0]=4 7420 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)Cl 11a_100015205668_100011219626 [0,1,0,0,0,1|2,0,0]=4 7421 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)Cl 1626a_100015205668_100011219626 [0,1,0,0,0,1|2,0,0]=4 7422 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)Cl 240690a_100015205668_100011219626 [0,1,0,0,0,1|2,0,0]=4 7423 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)F 11a_100015188774_100011219626 [0,1,0,0,0,1|2,0,0]=4 7424 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)F 1626a_100015188774_100011219626 [0,1,0,0,0,1|2,0,0]=4 7425 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)F 240690a_100015188774_100011219626 [0,1,0,0,0,1|2,0,0]=4 7426 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)O 11a_100000748557_100011219626 [0,1,0,0,0,1|2,0,0]=4 7427 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2ccnc(c2)O 240690a_100000748557_100011219626 [0,1,0,0,0,1|2,0,0]=4 7428 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cncc(c2)Br 11a_100011249555_100011219626 [0,1,0,0,0,1|2,0,0]=4 7429 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cncc(c2)Br 240690a_100011249555_100011219626 [0,1,0,0,0,1|2,0,0]=4 7430 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cncc(c2)Cl 11a_200020614424_100011219626 [0,1,0,0,0,1|2,0,0]=4 7431 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cncc(c2)Cl 1626a_200020614424_100011219626 [0,1,0,0,0,1|2,0,0]=4 7432 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cncc(c2)Cl 240690a_200020614424_100011219626 [0,1,0,0,0,1|2,0,0]=4 7433 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cncc(c2)F 11a_100011962886_100011219626 [0,1,0,0,0,1|2,0,0]=4 7434 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cncc(c2)F 1626a_100011962886_100011219626 [0,1,0,0,0,1|2,0,0]=4 7435 B21R2.221980 O=C(C/C=C/c1ccccc1)NCc2cncc(c2)F 240690a_100011962886_100011219626 [0,1,0,0,0,1|2,0,0]=4 7436 B21R2.221980 O=C(C/C=C/c1ccccc1)NNc2cccc(c2)Br 22a_100000217339_100011219626 [0,1,0,0,0,1|2,0,0]=4 7437 B21R2.221980 O=C(C/C=C/c1ccccc1)NNc2cccc(c2)Cl 22a_100000184277_100011219626 [0,1,0,0,0,1|2,0,0]=4 7438 B21R2.221980 O=C(C/C=C/c1ccccc1)NNc2cccc(c2)F 22a_100000745080_100011219626 [0,1,0,0,0,1|2,0,0]=4 7439 B21R2.221980 O=C(C/C=C/c1ccccc1)NNc2cccc(c2)I 22a_100020605690_100011219626 [0,1,0,0,0,1|2,0,0]=4 7440 B21R2.221980 O=C(C=CSc1ccccc1)CCc2cccc(c2)Br 1458a_100016262050_100011740638 [0,1,0,0,0,1|1,0,0]=3 7441 B21R2.221980 O=C(C=CSc1ccccc1)CCc2cccc(c2)Cl 1458a_100016262050_100011713710 [0,1,0,0,0,1|1,0,0]=3 7442 B21R2.221980 O=C(C=CSc1ccccc1)CCc2cccc(c2)F 1458a_100016262050_100011217235 [0,1,0,0,0,1|1,0,0]=3 7443 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cc(ccn2)Br 11a_100009818019_100016262050 [0,1,0,0,0,1|2,0,0]=4 7444 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cc(ccn2)Br 1626a_100009818019_100016262050 [0,1,0,0,0,1|2,0,0]=4 7445 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cc(ccn2)Br 240690a_100009818019_100016262050 [0,1,0,0,0,1|2,0,0]=4 7446 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cc(ccn2)Cl 11a_100000085674_100016262050 [0,1,0,0,0,1|2,0,0]=4 7447 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cc(ccn2)Cl 1626a_100000085674_100016262050 [0,1,0,0,0,1|2,0,0]=4 7448 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cc(ccn2)Cl 240690a_100000085674_100016262050 [0,1,0,0,0,1|2,0,0]=4 7449 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(=O)[nH]2 11a_100000696482_100016262050 [0,1,0,0,0,1|2,0,0]=4 7450 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(=O)[nH]2 1626a_100000696482_100016262050 [0,1,0,0,0,1|2,0,0]=4 7451 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(=O)[nH]2 240690a_100000696482_100016262050 [0,1,0,0,0,1|2,0,0]=4 7452 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100016262050 [0,1,0,0,0,1|1,0,0]=3 7453 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100016262050 [0,1,0,0,0,1|1,0,0]=3 7454 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100016262050 [0,1,0,0,0,1|1,0,0]=3 7455 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100016262050 [0,1,0,0,0,1|1,0,0]=3 7456 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100016262050 [0,1,0,0,0,1|1,0,0]=3 7457 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100016262050 [0,1,0,0,0,1|1,0,0]=3 7458 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100016262050 [0,1,0,0,0,1|1,0,0]=3 7459 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100016262050 [0,1,0,0,0,1|1,0,0]=3 7460 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100016262050 [0,1,0,0,0,1|1,0,0]=3 7461 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100016262050 [0,1,0,0,0,1|1,0,0]=3 7462 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100016262050 [0,1,0,0,0,1|1,0,0]=3 7463 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100016262050 [0,1,0,0,0,1|1,0,0]=3 7464 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100016262050 [0,1,0,0,0,1|1,0,0]=3 7465 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)Br 11a_100016987751_100016262050 [0,1,0,0,0,1|2,0,0]=4 7466 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)Br 1626a_100016987751_100016262050 [0,1,0,0,0,1|2,0,0]=4 7467 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)Br 240690a_100016987751_100016262050 [0,1,0,0,0,1|2,0,0]=4 7468 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)Cl 11a_100016990191_100016262050 [0,1,0,0,0,1|2,0,0]=4 7469 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)Cl 1626a_100016990191_100016262050 [0,1,0,0,0,1|2,0,0]=4 7470 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)Cl 240690a_100016990191_100016262050 [0,1,0,0,0,1|2,0,0]=4 7471 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)F 11a_100015188798_100016262050 [0,1,0,0,0,1|2,0,0]=4 7472 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)F 1626a_100015188798_100016262050 [0,1,0,0,0,1|2,0,0]=4 7473 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cccc(n2)F 240690a_100015188798_100016262050 [0,1,0,0,0,1|2,0,0]=4 7474 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)Br 11a_100025757509_100016262050 [0,1,0,0,0,1|2,0,0]=4 7475 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)Br 240690a_100025757509_100016262050 [0,1,0,0,0,1|2,0,0]=4 7476 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)Cl 11a_100015205668_100016262050 [0,1,0,0,0,1|2,0,0]=4 7477 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)Cl 1626a_100015205668_100016262050 [0,1,0,0,0,1|2,0,0]=4 7478 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)Cl 240690a_100015205668_100016262050 [0,1,0,0,0,1|2,0,0]=4 7479 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)F 11a_100015188774_100016262050 [0,1,0,0,0,1|2,0,0]=4 7480 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)F 1626a_100015188774_100016262050 [0,1,0,0,0,1|2,0,0]=4 7481 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)F 240690a_100015188774_100016262050 [0,1,0,0,0,1|2,0,0]=4 7482 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)O 11a_100000748557_100016262050 [0,1,0,0,0,1|2,0,0]=4 7483 B21R2.221980 O=C(C=CSc1ccccc1)NCc2ccnc(c2)O 240690a_100000748557_100016262050 [0,1,0,0,0,1|2,0,0]=4 7484 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cncc(c2)Br 11a_100011249555_100016262050 [0,1,0,0,0,1|2,0,0]=4 7485 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cncc(c2)Br 240690a_100011249555_100016262050 [0,1,0,0,0,1|2,0,0]=4 7486 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cncc(c2)Cl 11a_200020614424_100016262050 [0,1,0,0,0,1|2,0,0]=4 7487 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cncc(c2)Cl 1626a_200020614424_100016262050 [0,1,0,0,0,1|2,0,0]=4 7488 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cncc(c2)Cl 240690a_200020614424_100016262050 [0,1,0,0,0,1|2,0,0]=4 7489 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cncc(c2)F 11a_100011962886_100016262050 [0,1,0,0,0,1|2,0,0]=4 7490 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cncc(c2)F 1626a_100011962886_100016262050 [0,1,0,0,0,1|2,0,0]=4 7491 B21R2.221980 O=C(C=CSc1ccccc1)NCc2cncc(c2)F 240690a_100011962886_100016262050 [0,1,0,0,0,1|2,0,0]=4 7492 B21R2.221980 O=C(C=CSc1ccccc1)NNc2cccc(c2)Br 22a_100000217339_100016262050 [0,1,0,0,0,1|2,0,0]=4 7493 B21R2.221980 O=C(C=CSc1ccccc1)NNc2cccc(c2)Cl 22a_100000184277_100016262050 [0,1,0,0,0,1|2,0,0]=4 7494 B21R2.221980 O=C(C=CSc1ccccc1)NNc2cccc(c2)F 22a_100000745080_100016262050 [0,1,0,0,0,1|2,0,0]=4 7495 B21R2.221980 O=C(C=CSc1ccccc1)NNc2cccc(c2)I 22a_100020605690_100016262050 [0,1,0,0,0,1|2,0,0]=4 7496 B21R2.221980 O=C(C=Cc1cccc(c1)Br)C/C=C/c2ccccc2 1458a_100016258244_100016265936 [0,1,0,0,0,1|1,0,1]=4 7497 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CC#Cc2ccccc2 1458a_100016258244_100011352542 [0,1,0,0,0,1|1,0,1]=4 7498 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CCCc2ccccc2 1458a_100016258244_100000211621 [0,1,0,0,0,1|1,0,0]=3 7499 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CCOc2ccccc2 1458a_100016258244_100000184471 [0,1,0,0,0,1|1,0,0]=3 7500 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CCSc2ccccc2 1458a_100016258244_100000246102 [0,1,0,0,0,1|1,0,0]=3 7501 B21R2.221980 O=C(C=Cc1cccc(c1)Br)COCc2ccccc2 6a_100000210085_100011215004 [0,1,0,0,0,1|0,0,0]=2 7502 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CSCc2ccccc2 1458a_100016258244_200011217039 [0,1,0,0,0,1|0,1,0]=3 7503 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CSCc2ccccc2 6a_100000210085_100000172147 [0,1,0,0,0,1|0,1,0]=3 7504 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2 11a_100000106460_100016258244 [0,1,0,0,0,1|1,0,0]=3 7505 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2 1626a_100000106460_100016258244 [0,1,0,0,0,1|1,0,0]=3 7506 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2 240690a_100000106460_100016258244 [0,1,0,0,0,1|1,0,0]=3 7507 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccn2 11a_100000211156_100016258244 [0,1,0,0,0,1|2,0,0]=4 7508 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccn2 1626a_100000211156_100016258244 [0,1,0,0,0,1|2,0,0]=4 7509 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccn2 240690a_100000211156_100016258244 [0,1,0,0,0,1|2,0,0]=4 7510 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cccnc2 11a_100000736294_100016258244 [0,1,0,0,0,1|2,0,0]=4 7511 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cccnc2 1626a_100000736294_100016258244 [0,1,0,0,0,1|2,0,0]=4 7512 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cccnc2 240690a_100000736294_100016258244 [0,1,0,0,0,1|2,0,0]=4 7513 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccncc2 11a_100000742849_100016258244 [0,1,0,0,0,1|2,0,0]=4 7514 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccncc2 1626a_100000742849_100016258244 [0,1,0,0,0,1|2,0,0]=4 7515 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccncc2 240690a_100000742849_100016258244 [0,1,0,0,0,1|2,0,0]=4 7516 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NNCc2ccccc2 22a_100000007032_100016258244 [0,1,0,0,0,1|1,0,0]=3 7517 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NNCc2ccccn2 22a_100000736832_100016258244 [0,1,0,0,0,1|2,0,0]=4 7518 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NNCc2cccnc2 22a_100000738295_100016258244 [0,1,0,0,0,1|2,0,0]=4 7519 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NNCc2ccncc2 22a_100000736929_100016258244 [0,1,0,0,0,1|2,0,0]=4 7520 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)C/C=C/c2ccccc2 1458a_100000184502_100016265936 [0,1,0,0,0,1|1,0,1]=4 7521 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CC#Cc2ccccc2 1458a_100000184502_100011352542 [0,1,0,0,0,1|1,0,1]=4 7522 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CCCc2ccccc2 1458a_100000184502_100000211621 [0,1,0,0,0,1|1,0,0]=3 7523 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CCOc2ccccc2 1458a_100000184502_100000184471 [0,1,0,0,0,1|1,0,0]=3 7524 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CCSc2ccccc2 1458a_100000184502_100000246102 [0,1,0,0,0,1|1,0,0]=3 7525 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CSCc2ccccc2 1458a_100000184502_200011217039 [0,1,0,0,0,1|0,1,0]=3 7526 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2 11a_100000106460_100000184502 [0,1,0,0,0,1|1,0,0]=3 7527 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2 1626a_100000106460_100000184502 [0,1,0,0,0,1|1,0,0]=3 7528 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2 240690a_100000106460_100000184502 [0,1,0,0,0,1|1,0,0]=3 7529 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccn2 11a_100000211156_100000184502 [0,1,0,0,0,1|2,0,0]=4 7530 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccn2 1626a_100000211156_100000184502 [0,1,0,0,0,1|2,0,0]=4 7531 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccn2 240690a_100000211156_100000184502 [0,1,0,0,0,1|2,0,0]=4 7532 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cccnc2 11a_100000736294_100000184502 [0,1,0,0,0,1|2,0,0]=4 7533 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cccnc2 1626a_100000736294_100000184502 [0,1,0,0,0,1|2,0,0]=4 7534 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cccnc2 240690a_100000736294_100000184502 [0,1,0,0,0,1|2,0,0]=4 7535 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccncc2 11a_100000742849_100000184502 [0,1,0,0,0,1|2,0,0]=4 7536 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccncc2 1626a_100000742849_100000184502 [0,1,0,0,0,1|2,0,0]=4 7537 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccncc2 240690a_100000742849_100000184502 [0,1,0,0,0,1|2,0,0]=4 7538 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NNCc2ccccc2 22a_100000007032_100000184502 [0,1,0,0,0,1|1,0,0]=3 7539 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NNCc2ccccn2 22a_100000736832_100000184502 [0,1,0,0,0,1|2,0,0]=4 7540 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NNCc2cccnc2 22a_100000738295_100000184502 [0,1,0,0,0,1|2,0,0]=4 7541 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NNCc2ccncc2 22a_100000736929_100000184502 [0,1,0,0,0,1|2,0,0]=4 7542 B21R2.221980 O=C(C=Cc1cccc(c1)F)C/C=C/c2ccccc2 1458a_100000718793_100016265936 [0,1,0,0,0,1|1,0,1]=4 7543 B21R2.221980 O=C(C=Cc1cccc(c1)F)CC#Cc2ccccc2 1458a_100000718793_100011352542 [0,1,0,0,0,1|1,0,1]=4 7544 B21R2.221980 O=C(C=Cc1cccc(c1)F)CCCc2ccccc2 1458a_100000718793_100000211621 [0,1,0,0,0,1|1,0,0]=3 7545 B21R2.221980 O=C(C=Cc1cccc(c1)F)CCOc2ccccc2 1458a_100000718793_100000184471 [0,1,0,0,0,1|1,0,0]=3 7546 B21R2.221980 O=C(C=Cc1cccc(c1)F)CCSc2ccccc2 1458a_100000718793_100000246102 [0,1,0,0,0,1|1,0,0]=3 7547 B21R2.221980 O=C(C=Cc1cccc(c1)F)COCc2ccccc2 6a_100000210812_100011215004 [0,1,0,0,0,1|0,0,0]=2 7548 B21R2.221980 O=C(C=Cc1cccc(c1)F)CSCc2ccccc2 1458a_100000718793_200011217039 [0,1,0,0,0,1|0,1,0]=3 7549 B21R2.221980 O=C(C=Cc1cccc(c1)F)CSCc2ccccc2 6a_100000210812_100000172147 [0,1,0,0,0,1|0,1,0]=3 7550 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2 11a_100000106460_100000718793 [0,1,0,0,0,1|1,0,0]=3 7551 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2 1626a_100000106460_100000718793 [0,1,0,0,0,1|1,0,0]=3 7552 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2 240690a_100000106460_100000718793 [0,1,0,0,0,1|1,0,0]=3 7553 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccn2 11a_100000211156_100000718793 [0,1,0,0,0,1|2,0,0]=4 7554 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccn2 1626a_100000211156_100000718793 [0,1,0,0,0,1|2,0,0]=4 7555 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccn2 240690a_100000211156_100000718793 [0,1,0,0,0,1|2,0,0]=4 7556 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cccnc2 11a_100000736294_100000718793 [0,1,0,0,0,1|2,0,0]=4 7557 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cccnc2 1626a_100000736294_100000718793 [0,1,0,0,0,1|2,0,0]=4 7558 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cccnc2 240690a_100000736294_100000718793 [0,1,0,0,0,1|2,0,0]=4 7559 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccncc2 11a_100000742849_100000718793 [0,1,0,0,0,1|2,0,0]=4 7560 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccncc2 1626a_100000742849_100000718793 [0,1,0,0,0,1|2,0,0]=4 7561 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccncc2 240690a_100000742849_100000718793 [0,1,0,0,0,1|2,0,0]=4 7562 B21R2.221980 O=C(C=Cc1cccc(c1)F)NNCc2ccccc2 22a_100000007032_100000718793 [0,1,0,0,0,1|1,0,0]=3 7563 B21R2.221980 O=C(C=Cc1cccc(c1)F)NNCc2ccccn2 22a_100000736832_100000718793 [0,1,0,0,0,1|2,0,0]=4 7564 B21R2.221980 O=C(C=Cc1cccc(c1)F)NNCc2cccnc2 22a_100000738295_100000718793 [0,1,0,0,0,1|2,0,0]=4 7565 B21R2.221980 O=C(C=Cc1cccc(c1)F)NNCc2ccncc2 22a_100000736929_100000718793 [0,1,0,0,0,1|2,0,0]=4 7566 B21R2.221980 O=C(C=Cc1cccc(c1)I)C/C=C/c2ccccc2 1458a_100020647043_100016265936 [0,1,0,0,0,1|1,0,1]=4 7567 B21R2.221980 O=C(C=Cc1cccc(c1)I)CC#Cc2ccccc2 1458a_100020647043_100011352542 [0,1,0,0,0,1|1,0,1]=4 7568 B21R2.221980 O=C(C=Cc1cccc(c1)I)CCCc2ccccc2 1458a_100020647043_100000211621 [0,1,0,0,0,1|1,0,0]=3 7569 B21R2.221980 O=C(C=Cc1cccc(c1)I)CCOc2ccccc2 1458a_100020647043_100000184471 [0,1,0,0,0,1|1,0,0]=3 7570 B21R2.221980 O=C(C=Cc1cccc(c1)I)CCSc2ccccc2 1458a_100020647043_100000246102 [0,1,0,0,0,1|1,0,0]=3 7571 B21R2.221980 O=C(C=Cc1cccc(c1)I)COCc2ccccc2 6a_100000014684_100011215004 [0,1,0,0,0,1|0,0,0]=2 7572 B21R2.221980 O=C(C=Cc1cccc(c1)I)CSCc2ccccc2 1458a_100020647043_200011217039 [0,1,0,0,0,1|0,1,0]=3 7573 B21R2.221980 O=C(C=Cc1cccc(c1)I)CSCc2ccccc2 6a_100000014684_100000172147 [0,1,0,0,0,1|0,1,0]=3 7574 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2 11a_100000106460_100020647043 [0,1,0,0,0,1|1,0,0]=3 7575 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2 1626a_100000106460_100020647043 [0,1,0,0,0,1|1,0,0]=3 7576 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2 240690a_100000106460_100020647043 [0,1,0,0,0,1|1,0,0]=3 7577 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccn2 11a_100000211156_100020647043 [0,1,0,0,0,1|2,0,0]=4 7578 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccn2 1626a_100000211156_100020647043 [0,1,0,0,0,1|2,0,0]=4 7579 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccn2 240690a_100000211156_100020647043 [0,1,0,0,0,1|2,0,0]=4 7580 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cccnc2 11a_100000736294_100020647043 [0,1,0,0,0,1|2,0,0]=4 7581 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cccnc2 1626a_100000736294_100020647043 [0,1,0,0,0,1|2,0,0]=4 7582 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cccnc2 240690a_100000736294_100020647043 [0,1,0,0,0,1|2,0,0]=4 7583 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccncc2 11a_100000742849_100020647043 [0,1,0,0,0,1|2,0,0]=4 7584 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccncc2 1626a_100000742849_100020647043 [0,1,0,0,0,1|2,0,0]=4 7585 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccncc2 240690a_100000742849_100020647043 [0,1,0,0,0,1|2,0,0]=4 7586 B21R2.221980 O=C(C=Cc1cccc(c1)I)NNCc2ccccc2 22a_100000007032_100020647043 [0,1,0,0,0,1|1,0,0]=3 7587 B21R2.221980 O=C(C=Cc1cccc(c1)I)NNCc2ccccn2 22a_100000736832_100020647043 [0,1,0,0,0,1|2,0,0]=4 7588 B21R2.221980 O=C(C=Cc1cccc(c1)I)NNCc2cccnc2 22a_100000738295_100020647043 [0,1,0,0,0,1|2,0,0]=4 7589 B21R2.221980 O=C(C=Cc1cccc(c1)I)NNCc2ccncc2 22a_100000736929_100020647043 [0,1,0,0,0,1|2,0,0]=4 7590 B21R2.221980 O=C(C=Cc1cccc(c1)O)NNCc2ccccc2 22a_100000007032_100102525460 [0,1,0,0,0,1|1,0,0]=3 7591 B21R2.221980 O=C(C=Cc1cccc(c1)O)NNCc2ccccn2 22a_100000736832_100102525460 [0,1,0,0,0,1|2,0,0]=4 7592 B21R2.221980 O=C(C=Cc1cccc(c1)O)NNCc2cccnc2 22a_100000738295_100102525460 [0,1,0,0,0,1|2,0,0]=4 7593 B21R2.221980 O=C(C=Cc1cccc(c1)O)NNCc2ccncc2 22a_100000736929_100102525460 [0,1,0,0,0,1|2,0,0]=4 7594 B21R2.221980 O=C(C=Cc1cncc(c1)Br)COCc2ccccc2 6a_100000687066_100011215004 [0,1,0,0,0,1|1,0,0]=3 7595 B21R2.221980 O=C(C=Cc1cncc(c1)Br)CSCc2ccccc2 6a_100000687066_100000172147 [0,1,0,0,0,1|1,1,0]=4 7596 B21R2.221980 O=C(C=Cc1cncc(c1)Cl)COCc2ccccc2 6a_100000088910_100011215004 [0,1,0,0,0,1|1,0,0]=3 7597 B21R2.221980 O=C(C=Cc1cncc(c1)Cl)CSCc2ccccc2 6a_100000088910_100000172147 [0,1,0,0,0,1|1,1,0]=4 7598 B21R2.221980 O=C(C=Cc1cncc(c1)F)COCc2ccccc2 6a_100011361476_100011215004 [0,1,0,0,0,1|1,0,0]=3 7599 B21R2.221980 O=C(C=Cc1cncc(c1)F)CSCc2ccccc2 6a_100011361476_100000172147 [0,1,0,0,0,1|1,1,0]=4 7600 B21R2.221980 O=C(CCc1cccc(c1)Br)COCc2ccccc2 1458a_100000230186_100011740638 [0,1,0,0,0,1|0,0,2]=4 7601 B21R2.221980 O=C(CCc1cccc(c1)Cl)COCc2ccccc2 1458a_100000230186_100011713710 [0,1,0,0,0,1|0,0,2]=4 7602 B21R2.221980 O=C(CCc1cccc(c1)F)COCc2ccccc2 1458a_100000230186_100011217235 [0,1,0,0,0,1|0,0,2]=4 7603 B21R2.221980 O=C(CNc1cccc(c1)Br)NOCc2ccccc2 34a_100000210019_100000230105 [0,1,0,0,0,1|1,0,1]=4 7604 B21R2.221980 O=C(CNc1cccc(c1)Br)OCCc2ccccc2 34a_100000210019_200000077782 [0,1,0,0,0,1|1,0,1]=4 7605 B21R2.221980 O=C(CNc1cccc(c1)Cl)NOCc2ccccc2 34a_100000185859_100000230105 [0,1,0,0,0,1|1,0,1]=4 7606 B21R2.221980 O=C(CNc1cccc(c1)Cl)OCCc2ccccc2 34a_100000185859_200000077782 [0,1,0,0,0,1|1,0,1]=4 7607 B21R2.221980 O=C(CNc1cccc(c1)F)NOCc2ccccc2 34a_100000210047_100000230105 [0,1,0,0,0,1|1,0,1]=4 7608 B21R2.221980 O=C(CNc1cccc(c1)F)OCCc2ccccc2 34a_100000210047_200000077782 [0,1,0,0,0,1|1,0,1]=4 7609 B21R2.221980 O=C(CNc1cccc(c1)I)NOCc2ccccc2 34a_100000211102_100000230105 [0,1,0,0,0,1|1,0,1]=4 7610 B21R2.221980 O=C(CNc1cccc(c1)I)OCCc2ccccc2 34a_100000211102_200000077782 [0,1,0,0,0,1|1,0,1]=4 7611 B21R2.221980 O=C(CNc1cccc(c1)O)NOCc2ccccc2 34a_100000210217_100000230105 [0,1,0,0,0,1|1,0,1]=4 7612 B21R2.221980 O=C(CNc1cccc(c1)O)OCCc2ccccc2 34a_100000210217_200000077782 [0,1,0,0,0,1|1,0,1]=4 7613 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100000230186 [0,1,0,0,0,1|1,0,1]=4 7614 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100000230186 [0,1,0,0,0,1|1,0,1]=4 7615 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100000230186 [0,1,0,0,0,1|1,0,1]=4 7616 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Br 34a_100000210790_100011263252 [0,1,0,0,0,1|1,0,1]=4 7617 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Br 527a_100000174977_100000230186 [0,1,0,0,0,1|1,0,1]=4 7618 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Br 7a_100000210790_100011263252 [0,1,0,0,0,1|1,0,1]=4 7619 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100000230186 [0,1,0,0,0,1|1,0,1]=4 7620 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100000230186 [0,1,0,0,0,1|1,0,1]=4 7621 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100000230186 [0,1,0,0,0,1|1,0,1]=4 7622 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Cl 34a_100000210790_100000181154 [0,1,0,0,0,1|1,0,1]=4 7623 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Cl 527a_100000174878_100000230186 [0,1,0,0,0,1|1,0,1]=4 7624 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)Cl 7a_100000210790_100000181154 [0,1,0,0,0,1|1,0,1]=4 7625 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100000230186 [0,1,0,0,0,1|1,0,1]=4 7626 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100000230186 [0,1,0,0,0,1|1,0,1]=4 7627 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100000230186 [0,1,0,0,0,1|1,0,1]=4 7628 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)F 34a_100000210790_100000738998 [0,1,0,0,0,1|1,0,1]=4 7629 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)F 527a_100000174948_100000230186 [0,1,0,0,0,1|1,0,1]=4 7630 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)F 7a_100000210790_100000738998 [0,1,0,0,0,1|1,0,1]=4 7631 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100000230186 [0,1,0,0,0,1|1,0,1]=4 7632 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100000230186 [0,1,0,0,0,1|1,0,1]=4 7633 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100000230186 [0,1,0,0,0,1|1,0,1]=4 7634 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)I 527a_100000106179_100000230186 [0,1,0,0,0,1|1,0,1]=4 7635 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100000230186 [0,1,0,0,0,1|1,0,1]=4 7636 B21R2.221980 O=C(COCc1ccccc1)NCc2cccc(c2)O 527a_100000743036_100000230186 [0,1,0,0,0,1|1,0,1]=4 7637 B21R2.221980 O=C(COCc1ccccc1)NNc2cccc(c2)Br 22a_100000217339_100000230186 [0,1,0,0,0,1|2,0,0]=4 7638 B21R2.221980 O=C(COCc1ccccc1)NNc2cccc(c2)Cl 22a_100000184277_100000230186 [0,1,0,0,0,1|2,0,0]=4 7639 B21R2.221980 O=C(COCc1ccccc1)NNc2cccc(c2)F 22a_100000745080_100000230186 [0,1,0,0,0,1|2,0,0]=4 7640 B21R2.221980 O=C(COCc1ccccc1)NNc2cccc(c2)I 22a_100020605690_100000230186 [0,1,0,0,0,1|2,0,0]=4 7641 B21R2.221980 O=C(COc1cccc(c1)Br)NOCc2ccccc2 34a_100000210342_100000230105 [0,1,0,0,0,1|1,0,1]=4 7642 B21R2.221980 O=C(COc1cccc(c1)Br)NOCc2ccccc2 7a_100000210342_100000230105 [0,1,0,0,0,1|1,0,1]=4 7643 B21R2.221980 O=C(COc1cccc(c1)Br)OCCc2ccccc2 34a_100000210342_200000077782 [0,1,0,0,0,1|1,0,1]=4 7644 B21R2.221980 O=C(COc1cccc(c1)Br)OCCc2ccccc2 7a_100000210342_200000077782 [0,1,0,0,0,1|1,0,1]=4 7645 B21R2.221980 O=C(COc1cccc(c1)Cl)NOCc2ccccc2 34a_100000210295_100000230105 [0,1,0,0,0,1|1,0,1]=4 7646 B21R2.221980 O=C(COc1cccc(c1)Cl)NOCc2ccccc2 7a_100000210295_100000230105 [0,1,0,0,0,1|1,0,1]=4 7647 B21R2.221980 O=C(COc1cccc(c1)Cl)OCCc2ccccc2 34a_100000210295_200000077782 [0,1,0,0,0,1|1,0,1]=4 7648 B21R2.221980 O=C(COc1cccc(c1)Cl)OCCc2ccccc2 7a_100000210295_200000077782 [0,1,0,0,0,1|1,0,1]=4 7649 B21R2.221980 O=C(COc1cccc(c1)F)NOCc2ccccc2 34a_100000210426_100000230105 [0,1,0,0,0,1|1,0,1]=4 7650 B21R2.221980 O=C(COc1cccc(c1)F)NOCc2ccccc2 7a_100000210426_100000230105 [0,1,0,0,0,1|1,0,1]=4 7651 B21R2.221980 O=C(COc1cccc(c1)F)OCCc2ccccc2 34a_100000210426_200000077782 [0,1,0,0,0,1|1,0,1]=4 7652 B21R2.221980 O=C(COc1cccc(c1)F)OCCc2ccccc2 7a_100000210426_200000077782 [0,1,0,0,0,1|1,0,1]=4 7653 B21R2.221980 O=C(COc1cccc(c1)I)NOCc2ccccc2 34a_100000211634_100000230105 [0,1,0,0,0,1|1,0,1]=4 7654 B21R2.221980 O=C(COc1cccc(c1)I)NOCc2ccccc2 7a_100000211634_100000230105 [0,1,0,0,0,1|1,0,1]=4 7655 B21R2.221980 O=C(COc1cccc(c1)I)OCCc2ccccc2 34a_100000211634_200000077782 [0,1,0,0,0,1|1,0,1]=4 7656 B21R2.221980 O=C(COc1cccc(c1)I)OCCc2ccccc2 7a_100000211634_200000077782 [0,1,0,0,0,1|1,0,1]=4 7657 B21R2.221980 O=C(CSc1cccc(c1)Br)NOCc2ccccc2 62a_100000230105_100000691529 [0,1,0,0,0,1|1,0,1]=4 7658 B21R2.221980 O=C(CSc1cccc(c1)Br)NOCc2ccccc2 62a_100000691529_100000230105 [0,1,0,0,0,1|1,0,1]=4 7659 B21R2.221980 O=C(CSc1cccc(c1)Br)OCCc2ccccc2 62a_100000691529_200000077782 [0,1,0,0,0,1|1,0,1]=4 7660 B21R2.221980 O=C(CSc1cccc(c1)Br)OCCc2ccccc2 62a_200000077782_100000691529 [0,1,0,0,0,1|1,0,1]=4 7661 B21R2.221980 O=C(CSc1cccc(c1)Cl)NOCc2ccccc2 62a_100000230105_100000699651 [0,1,0,0,0,1|1,0,1]=4 7662 B21R2.221980 O=C(CSc1cccc(c1)Cl)NOCc2ccccc2 62a_100000699651_100000230105 [0,1,0,0,0,1|1,0,1]=4 7663 B21R2.221980 O=C(CSc1cccc(c1)Cl)OCCc2ccccc2 62a_100000699651_200000077782 [0,1,0,0,0,1|1,0,1]=4 7664 B21R2.221980 O=C(CSc1cccc(c1)Cl)OCCc2ccccc2 62a_200000077782_100000699651 [0,1,0,0,0,1|1,0,1]=4 7665 B21R2.221980 O=C(CSc1cccc(c1)F)NOCc2ccccc2 62a_100000230105_100000685547 [0,1,0,0,0,1|1,0,1]=4 7666 B21R2.221980 O=C(CSc1cccc(c1)F)NOCc2ccccc2 62a_100000685547_100000230105 [0,1,0,0,0,1|1,0,1]=4 7667 B21R2.221980 O=C(CSc1cccc(c1)F)OCCc2ccccc2 62a_100000685547_200000077782 [0,1,0,0,0,1|1,0,1]=4 7668 B21R2.221980 O=C(CSc1cccc(c1)F)OCCc2ccccc2 62a_200000077782_100000685547 [0,1,0,0,0,1|1,0,1]=4 7669 B21R2.221980 O=C(CSc1cccc(c1)O)NOCc2ccccc2 62a_100000230105_100000211634 [0,1,0,0,0,1|1,0,1]=4 7670 B21R2.221980 O=C(CSc1cccc(c1)O)OCCc2ccccc2 62a_200000077782_100000211634 [0,1,0,0,0,1|1,0,1]=4 7671 B21R2.221980 O=C(CSc1cccc(c1)[S])NOCc2ccccc2 62a_100000230105_114929384022 [0,1,0,0,0,1|1,0,1]=4 7672 B21R2.221980 O=C(CSc1cccc(c1)[S])NOCc2ccccc2 62a_114929384022_100000230105 [0,1,0,0,0,1|1,0,1]=4 7673 B21R2.221980 O=C(CSc1cccc(c1)[S])OCCc2ccccc2 62a_114929384022_200000077782 [0,1,0,0,0,1|1,0,1]=4 7674 B21R2.221980 O=C(CSc1cccc(c1)[S])OCCc2ccccc2 62a_200000077782_114929384022 [0,1,0,0,0,1|1,0,1]=4 7675 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)C/C=C/c2ccccc2 1458a_100016990649_100016265936 [0,1,0,0,0,1|1,0,1]=4 7676 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CC#Cc2ccccc2 1458a_100016990649_100011352542 [0,1,0,0,0,1|1,0,1]=4 7677 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CCCc2ccccc2 1458a_100016990649_100000211621 [0,1,0,0,0,1|1,0,0]=3 7678 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CCOc2ccccc2 1458a_100016990649_100000184471 [0,1,0,0,0,1|1,0,0]=3 7679 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CCSc2ccccc2 1458a_100016990649_100000246102 [0,1,0,0,0,1|1,0,0]=3 7680 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CSCc2ccccc2 1458a_100016990649_200011217039 [0,1,0,0,0,1|0,1,0]=3 7681 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2 11a_100000106460_100016990649 [0,1,0,0,0,1|1,0,0]=3 7682 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2 1626a_100000106460_100016990649 [0,1,0,0,0,1|1,0,0]=3 7683 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2 527a_100000106460_100016990649 [0,1,0,0,0,1|1,0,0]=3 7684 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccn2 11a_100000211156_100016990649 [0,1,0,0,0,1|2,0,0]=4 7685 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccn2 1626a_100000211156_100016990649 [0,1,0,0,0,1|2,0,0]=4 7686 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccn2 527a_100000211156_100016990649 [0,1,0,0,0,1|2,0,0]=4 7687 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cccnc2 11a_100000736294_100016990649 [0,1,0,0,0,1|2,0,0]=4 7688 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cccnc2 1626a_100000736294_100016990649 [0,1,0,0,0,1|2,0,0]=4 7689 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cccnc2 527a_100000736294_100016990649 [0,1,0,0,0,1|2,0,0]=4 7690 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccncc2 11a_100000742849_100016990649 [0,1,0,0,0,1|2,0,0]=4 7691 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccncc2 1626a_100000742849_100016990649 [0,1,0,0,0,1|2,0,0]=4 7692 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccncc2 527a_100000742849_100016990649 [0,1,0,0,0,1|2,0,0]=4 7693 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NNCc2ccccc2 22a_100000007032_100016990649 [0,1,0,0,0,1|1,0,0]=3 7694 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NNCc2ccccn2 22a_100000736832_100016990649 [0,1,0,0,0,1|2,0,0]=4 7695 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NNCc2cccnc2 22a_100000738295_100016990649 [0,1,0,0,0,1|2,0,0]=4 7696 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NNCc2ccncc2 22a_100000736929_100016990649 [0,1,0,0,0,1|2,0,0]=4 7697 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)CCCc2ccccc2 1458a_100025712827_100000211621 [0,1,0,0,0,1|2,0,0]=4 7698 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)CCOc2ccccc2 1458a_100025712827_100000184471 [0,1,0,0,0,1|2,0,0]=4 7699 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)CCSc2ccccc2 1458a_100025712827_100000246102 [0,1,0,0,0,1|2,0,0]=4 7700 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)CSCc2ccccc2 1458a_100025712827_200011217039 [0,1,0,0,0,1|1,1,0]=4 7701 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2 11a_100000106460_100025712827 [0,1,0,0,0,1|2,0,0]=4 7702 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2 1626a_100000106460_100025712827 [0,1,0,0,0,1|2,0,0]=4 7703 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2 527a_100000106460_100025712827 [0,1,0,0,0,1|2,0,0]=4 7704 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NNCc2ccccc2 22a_100000007032_100025712827 [0,1,0,0,0,1|2,0,0]=4 7705 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2 11a_100000106460_100000066491 [0,1,0,0,0,1|1,0,1]=4 7706 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2 1626a_100000106460_100000066491 [0,1,0,0,0,1|1,0,1]=4 7707 B21R2.257667 C=C(Cc1ccccc1)C(=O)NNCc2ccccc2 22a_100000007032_100000066491 [0,1,0,0,0,1|1,0,1]=4 7708 B21R2.257667 CC(Cc1ccccc1)C(=O)C/C=C/c2ccccc2 1458a_100000754839_100016265936 [0,1,0,0,0,1|1,0,0]=3 7709 B21R2.257667 CC(Cc1ccccc1)C(=O)C/C=C/c2ccccc2 1458a_100011219626_200011218536 [0,1,0,0,0,1|1,0,0]=3 7710 B21R2.257667 CC(Cc1ccccc1)C(=O)C=CSc2ccccc2 1458a_100016262050_200011218536 [0,1,0,0,0,1|1,0,0]=3 7711 B21R2.257667 CC(Cc1ccccc1)C(=O)COCc2ccccc2 1458a_100000230186_200011218536 [0,1,0,0,0,1|0,0,2]=4 7712 B21R2.257667 CC(Cc1ccccn1)C(=O)C/C=C/c2ccccc2 1458a_100012000792_100016265936 [0,1,0,0,0,1|2,0,0]=4 7713 B21R2.257667 CC(Oc1ccccc1)C(=O)C/C=C/c2ccccc2 1458a_100000188414_100016265936 [0,1,0,0,0,1|2,0,0]=4 7714 B21R2.257667 CC(Sc1ccccc1)C(=O)C/C=C/c2ccccc2 1458a_100000199063_100016265936 [0,1,0,0,0,1|2,0,0]=4 7715 B21R2.257667 CN(Cc1ccccc1)C(=O)C/C=C/c2ccccc2 11a_100000186898_100011219626 [0,1,0,0,0,1|1,0,0]=3 7716 B21R2.257667 CN(Cc1ccccc1)C(=O)C/C=C/c2ccccc2 1626a_100000186898_100011219626 [0,1,0,0,0,1|1,0,0]=3 7717 B21R2.257667 CN(Cc1ccccc1)C(=O)C/C=C/c2ccccc2 240690a_100000186898_100011219626 [0,1,0,0,0,1|1,0,0]=3 7718 B21R2.257667 CN(Cc1ccccc1)C(=O)C=CSc2ccccc2 11a_100000186898_100016262050 [0,1,0,0,0,1|1,0,0]=3 7719 B21R2.257667 CN(Cc1ccccc1)C(=O)C=CSc2ccccc2 1626a_100000186898_100016262050 [0,1,0,0,0,1|1,0,0]=3 7720 B21R2.257667 CN(Cc1ccccc1)C(=O)C=CSc2ccccc2 240690a_100000186898_100016262050 [0,1,0,0,0,1|1,0,0]=3 7721 B21R2.257667 CN(Cc1ccccc1)C(=O)COCc2ccccc2 11a_100000186898_100000230186 [0,1,0,0,0,1|1,0,1]=4 7722 B21R2.257667 CN(Cc1ccccc1)C(=O)COCc2ccccc2 1626a_100000186898_100000230186 [0,1,0,0,0,1|1,0,1]=4 7723 B21R2.257667 CN(Cc1ccccc1)C(=O)COCc2ccccc2 240690a_100000186898_100000230186 [0,1,0,0,0,1|1,0,1]=4 7724 B21R2.257667 CN(Cc1ccccc1)C(=O)COCc2ccccc2 34a_100000210790_100000182870 [0,1,0,0,0,1|1,0,1]=4 7725 B21R2.257667 CN(Cc1ccccc1)C(=O)COCc2ccccc2 527a_100000186898_100000230186 [0,1,0,0,0,1|1,0,1]=4 7726 B21R2.257667 CN(Cc1ccccc1)C(=O)COCc2ccccc2 7a_100000210790_100000182870 [0,1,0,0,0,1|1,0,1]=4 7727 B21R2.257667 CN(Cc1ccccn1)C(=O)C/C=C/c2ccccc2 11a_100000207498_100011219626 [0,1,0,0,0,1|2,0,0]=4 7728 B21R2.257667 CN(Cc1ccccn1)C(=O)C/C=C/c2ccccc2 240690a_100000207498_100011219626 [0,1,0,0,0,1|2,0,0]=4 7729 B21R2.257667 CN(Cc1ccccn1)C(=O)C=CSc2ccccc2 11a_100000207498_100016262050 [0,1,0,0,0,1|2,0,0]=4 7730 B21R2.257667 CN(Cc1ccccn1)C(=O)C=CSc2ccccc2 240690a_100000207498_100016262050 [0,1,0,0,0,1|2,0,0]=4 7731 B21R2.257667 CN(Cc1cccnc1)C(=O)C/C=C/c2ccccc2 11a_100000184577_100011219626 [0,1,0,0,0,1|2,0,0]=4 7732 B21R2.257667 CN(Cc1cccnc1)C(=O)C/C=C/c2ccccc2 240690a_100000184577_100011219626 [0,1,0,0,0,1|2,0,0]=4 7733 B21R2.257667 CN(Cc1cccnc1)C(=O)C=CSc2ccccc2 11a_100000184577_100016262050 [0,1,0,0,0,1|2,0,0]=4 7734 B21R2.257667 CN(Cc1cccnc1)C(=O)C=CSc2ccccc2 240690a_100000184577_100016262050 [0,1,0,0,0,1|2,0,0]=4 7735 B21R2.257667 CN(Cc1ccncc1)C(=O)C/C=C/c2ccccc2 11a_100000187231_100011219626 [0,1,0,0,0,1|2,0,0]=4 7736 B21R2.257667 CN(Cc1ccncc1)C(=O)C/C=C/c2ccccc2 240690a_100000187231_100011219626 [0,1,0,0,0,1|2,0,0]=4 7737 B21R2.257667 CN(Cc1ccncc1)C(=O)C=CSc2ccccc2 11a_100000187231_100016262050 [0,1,0,0,0,1|2,0,0]=4 7738 B21R2.257667 CN(Cc1ccncc1)C(=O)C=CSc2ccccc2 240690a_100000187231_100016262050 [0,1,0,0,0,1|2,0,0]=4 7739 B21R2.257667 O=C(C/C=C/c1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100016265936 [0,1,0,0,0,1|1,0,1]=4 7740 B21R2.257667 O=C(C/C=C/c1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100016265936 [0,1,0,0,0,1|1,0,1]=4 7741 B21R2.257667 O=C(C/C=C/c1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100016265936 [0,1,0,0,0,1|2,0,0]=4 7742 B21R2.257667 O=C(C/C=C/c1ccccc1)[C@H](O)Cc2ccccc2 1458a_100009816399_100016265936 [0,1,0,0,0,1|1,0,0]=3 7743 B21R2.257667 O=C(CC#Cc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011352542 [0,1,0,0,0,1|1,0,1]=4 7744 B21R2.257667 O=C(CC#Cc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100011352542 [0,1,0,0,0,1|1,0,1]=4 7745 B21R2.257667 O=C(CCCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000211621 [0,1,0,0,0,1|1,0,0]=3 7746 B21R2.257667 O=C(CCCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000211621 [0,1,0,0,0,1|1,0,0]=3 7747 B21R2.257667 O=C(CCCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000211621 [0,1,0,0,0,1|2,0,0]=4 7748 B21R2.257667 O=C(CCCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000211621 [0,1,0,0,0,1|2,0,0]=4 7749 B21R2.257667 O=C(CCOc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000184471 [0,1,0,0,0,1|1,0,0]=3 7750 B21R2.257667 O=C(CCOc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000184471 [0,1,0,0,0,1|1,0,0]=3 7751 B21R2.257667 O=C(CCOc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000184471 [0,1,0,0,0,1|2,0,0]=4 7752 B21R2.257667 O=C(CCOc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000184471 [0,1,0,0,0,1|2,0,0]=4 7753 B21R2.257667 O=C(CCSc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000246102 [0,1,0,0,0,1|1,0,0]=3 7754 B21R2.257667 O=C(CCSc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000246102 [0,1,0,0,0,1|1,0,0]=3 7755 B21R2.257667 O=C(CCSc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000246102 [0,1,0,0,0,1|2,0,0]=4 7756 B21R2.257667 O=C(CCSc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000246102 [0,1,0,0,0,1|2,0,0]=4 7757 B21R2.257667 O=C(CSCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200011217039 [0,1,0,0,0,1|0,1,0]=3 7758 B21R2.257667 O=C(CSCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_200011217039 [0,1,0,0,0,1|0,1,0]=3 7759 B21R2.257667 O=C(CSCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_200011217039 [0,1,0,0,0,1|1,1,0]=4 7760 B21R2.257667 O=C(CSCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_200011217039 [0,1,0,0,0,1|1,1,0]=4 7761 B21R2.257667 O=C(NCCc1ccccc1)/C(=C/c2ccccc2)/Cl 11a_100000106460_200020598536 [0,1,0,0,0,1|1,0,0]=3 7762 B21R2.257667 O=C(NCCc1ccccc1)/C(=C/c2ccccc2)/Cl 1626a_100000106460_200020598536 [0,1,0,0,0,1|1,0,0]=3 7763 B21R2.257667 O=C(NCCc1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100000106460_200020598536 [0,1,0,0,0,1|1,0,0]=3 7764 B21R2.257667 O=C(NCCc1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100000106460_200020598536 [0,1,0,0,0,1|1,0,0]=3 7765 B21R2.257667 O=C(NCCc1ccccc1)/C(=C\c2ccccc2)/F 11a_100000106460_100020889036 [0,1,0,0,0,1|1,0,0]=3 7766 B21R2.257667 O=C(NCCc1ccccc1)/C(=C\c2ccccc2)/F 527a_100000106460_100020889036 [0,1,0,0,0,1|1,0,0]=3 7767 B21R2.257667 O=C(NCCc1ccccc1)C(=Cc2cccnc2)F 11a_100000106460_100000731744 [0,1,0,0,0,1|2,0,0]=4 7768 B21R2.257667 O=C(NCCc1ccccc1)C(=Cc2cccnc2)F 240690a_100000106460_100000731744 [0,1,0,0,0,1|2,0,0]=4 7769 B21R2.257667 O=C(NCCc1ccccc1)C(=Cc2cccnc2)F 527a_100000106460_100000731744 [0,1,0,0,0,1|2,0,0]=4 7770 B21R2.257667 O=C(NCCc1ccccc1)C(=O)Nc2ccccc2 240690a_100000106460_100000738435 [0,1,0,0,0,1|2,0,0]=4 7771 B21R2.257667 O=C(NCCc1ccccn1)/C(=C/c2ccccc2)/Cl 11a_100000211156_200020598536 [0,1,0,0,0,1|2,0,0]=4 7772 B21R2.257667 O=C(NCCc1ccccn1)/C(=C/c2ccccc2)/Cl 1626a_100000211156_200020598536 [0,1,0,0,0,1|2,0,0]=4 7773 B21R2.257667 O=C(NCCc1ccccn1)/C(=C/c2ccccc2)/Cl 240690a_100000211156_200020598536 [0,1,0,0,0,1|2,0,0]=4 7774 B21R2.257667 O=C(NCCc1ccccn1)/C(=C/c2ccccc2)/Cl 527a_100000211156_200020598536 [0,1,0,0,0,1|2,0,0]=4 7775 B21R2.257667 O=C(NCCc1ccccn1)/C(=C\c2ccccc2)/F 11a_100000211156_100020889036 [0,1,0,0,0,1|2,0,0]=4 7776 B21R2.257667 O=C(NCCc1ccccn1)/C(=C\c2ccccc2)/F 527a_100000211156_100020889036 [0,1,0,0,0,1|2,0,0]=4 7777 B21R2.257667 O=C(NCCc1cccnc1)/C(=C/c2ccccc2)/Cl 11a_100000736294_200020598536 [0,1,0,0,0,1|2,0,0]=4 7778 B21R2.257667 O=C(NCCc1cccnc1)/C(=C/c2ccccc2)/Cl 1626a_100000736294_200020598536 [0,1,0,0,0,1|2,0,0]=4 7779 B21R2.257667 O=C(NCCc1cccnc1)/C(=C/c2ccccc2)/Cl 240690a_100000736294_200020598536 [0,1,0,0,0,1|2,0,0]=4 7780 B21R2.257667 O=C(NCCc1cccnc1)/C(=C/c2ccccc2)/Cl 527a_100000736294_200020598536 [0,1,0,0,0,1|2,0,0]=4 7781 B21R2.257667 O=C(NCCc1cccnc1)/C(=C\c2ccccc2)/F 11a_100000736294_100020889036 [0,1,0,0,0,1|2,0,0]=4 7782 B21R2.257667 O=C(NCCc1cccnc1)/C(=C\c2ccccc2)/F 527a_100000736294_100020889036 [0,1,0,0,0,1|2,0,0]=4 7783 B21R2.257667 O=C(NCCc1ccncc1)/C(=C/c2ccccc2)/Cl 11a_100000742849_200020598536 [0,1,0,0,0,1|2,0,0]=4 7784 B21R2.257667 O=C(NCCc1ccncc1)/C(=C/c2ccccc2)/Cl 1626a_100000742849_200020598536 [0,1,0,0,0,1|2,0,0]=4 7785 B21R2.257667 O=C(NCCc1ccncc1)/C(=C/c2ccccc2)/Cl 240690a_100000742849_200020598536 [0,1,0,0,0,1|2,0,0]=4 7786 B21R2.257667 O=C(NCCc1ccncc1)/C(=C/c2ccccc2)/Cl 527a_100000742849_200020598536 [0,1,0,0,0,1|2,0,0]=4 7787 B21R2.257667 O=C(NCCc1ccncc1)/C(=C\c2ccccc2)/F 11a_100000742849_100020889036 [0,1,0,0,0,1|2,0,0]=4 7788 B21R2.257667 O=C(NCCc1ccncc1)/C(=C\c2ccccc2)/F 527a_100000742849_100020889036 [0,1,0,0,0,1|2,0,0]=4 7789 B21R2.257667 O=C(NNCc1ccccc1)/C(=C/c2ccccc2)/Cl 22a_100000007032_200020598536 [0,1,0,0,0,1|1,0,0]=3 7790 B21R2.257667 O=C(NNCc1ccccc1)/C(=C\c2ccccc2)/F 22a_100000007032_100020889036 [0,1,0,0,0,1|1,0,0]=3 7791 B21R2.257667 O=C(NNCc1ccccc1)C(=Cc2cccnc2)F 22a_100000007032_100000731744 [0,1,0,0,0,1|2,0,0]=4 7792 B21R2.257667 O=C(NNCc1ccccc1)C(=O)Nc2ccccc2 22a_100000007032_100000738435 [0,1,0,0,0,1|2,0,0]=4 7793 B21R2.257667 O=C(NNCc1ccccn1)/C(=C/c2ccccc2)/Cl 22a_100000736832_200020598536 [0,1,0,0,0,1|2,0,0]=4 7794 B21R2.257667 O=C(NNCc1ccccn1)/C(=C\c2ccccc2)/F 22a_100000736832_100020889036 [0,1,0,0,0,1|2,0,0]=4 7795 B21R2.257667 O=C(NNCc1cccnc1)/C(=C/c2ccccc2)/Cl 22a_100000738295_200020598536 [0,1,0,0,0,1|2,0,0]=4 7796 B21R2.257667 O=C(NNCc1cccnc1)/C(=C\c2ccccc2)/F 22a_100000738295_100020889036 [0,1,0,0,0,1|2,0,0]=4 7797 B21R2.257667 O=C(NNCc1ccncc1)/C(=C/c2ccccc2)/Cl 22a_100000736929_200020598536 [0,1,0,0,0,1|2,0,0]=4 7798 B21R2.257667 O=C(NNCc1ccncc1)/C(=C\c2ccccc2)/F 22a_100000736929_100020889036 [0,1,0,0,0,1|2,0,0]=4 7799 B21R2.257673 CC(=CC(=O)C/C=C/c1ccccc1)c2ccccc2 1458a_100000743005_100016265936 [0,1,0,0,0,1|1,0,1]=4 7800 B21R2.257673 CC(=CC(=O)CC#Cc1ccccc1)c2ccccc2 1458a_100000743005_100011352542 [0,1,0,0,0,1|1,0,1]=4 7801 B21R2.257673 CC(=CC(=O)CCCc1ccccc1)c2ccccc2 1458a_100000743005_100000211621 [0,1,0,0,0,1|1,0,0]=3 7802 B21R2.257673 CC(=CC(=O)CCOc1ccccc1)c2ccccc2 1458a_100000743005_100000184471 [0,1,0,0,0,1|1,0,0]=3 7803 B21R2.257673 CC(=CC(=O)CCSc1ccccc1)c2ccccc2 1458a_100000743005_100000246102 [0,1,0,0,0,1|1,0,0]=3 7804 B21R2.257673 CC(=CC(=O)CSCc1ccccc1)c2ccccc2 1458a_100000743005_200011217039 [0,1,0,0,0,1|0,1,0]=3 7805 B21R2.257673 CC(=CC(=O)NCCc1ccccc1)c2ccccc2 11a_100000106460_100000743005 [0,1,0,0,0,1|1,0,0]=3 7806 B21R2.257673 CC(=CC(=O)NCCc1ccccc1)c2ccccc2 1626a_100000106460_100000743005 [0,1,0,0,0,1|1,0,0]=3 7807 B21R2.257673 CC(=CC(=O)NCCc1ccccc1)c2ccccc2 240690a_100000106460_100000743005 [0,1,0,0,0,1|1,0,0]=3 7808 B21R2.257673 CC(=CC(=O)NCCc1ccccc1)c2ccccc2 527a_100000106460_100000743005 [0,1,0,0,0,1|1,0,0]=3 7809 B21R2.257673 CC(=CC(=O)NCCc1ccccn1)c2ccccc2 11a_100000211156_100000743005 [0,1,0,0,0,1|2,0,0]=4 7810 B21R2.257673 CC(=CC(=O)NCCc1ccccn1)c2ccccc2 1626a_100000211156_100000743005 [0,1,0,0,0,1|2,0,0]=4 7811 B21R2.257673 CC(=CC(=O)NCCc1ccccn1)c2ccccc2 240690a_100000211156_100000743005 [0,1,0,0,0,1|2,0,0]=4 7812 B21R2.257673 CC(=CC(=O)NCCc1ccccn1)c2ccccc2 527a_100000211156_100000743005 [0,1,0,0,0,1|2,0,0]=4 7813 B21R2.257673 CC(=CC(=O)NCCc1cccnc1)c2ccccc2 11a_100000736294_100000743005 [0,1,0,0,0,1|2,0,0]=4 7814 B21R2.257673 CC(=CC(=O)NCCc1cccnc1)c2ccccc2 1626a_100000736294_100000743005 [0,1,0,0,0,1|2,0,0]=4 7815 B21R2.257673 CC(=CC(=O)NCCc1cccnc1)c2ccccc2 240690a_100000736294_100000743005 [0,1,0,0,0,1|2,0,0]=4 7816 B21R2.257673 CC(=CC(=O)NCCc1cccnc1)c2ccccc2 527a_100000736294_100000743005 [0,1,0,0,0,1|2,0,0]=4 7817 B21R2.257673 CC(=CC(=O)NCCc1ccncc1)c2ccccc2 11a_100000742849_100000743005 [0,1,0,0,0,1|2,0,0]=4 7818 B21R2.257673 CC(=CC(=O)NCCc1ccncc1)c2ccccc2 1626a_100000742849_100000743005 [0,1,0,0,0,1|2,0,0]=4 7819 B21R2.257673 CC(=CC(=O)NCCc1ccncc1)c2ccccc2 240690a_100000742849_100000743005 [0,1,0,0,0,1|2,0,0]=4 7820 B21R2.257673 CC(=CC(=O)NCCc1ccncc1)c2ccccc2 527a_100000742849_100000743005 [0,1,0,0,0,1|2,0,0]=4 7821 B21R2.257673 CC(=CC(=O)NNCc1ccccc1)c2ccccc2 22a_100000007032_100000743005 [0,1,0,0,0,1|1,0,0]=3 7822 B21R2.257673 CC(=CC(=O)NNCc1ccccn1)c2ccccc2 22a_100000736832_100000743005 [0,1,0,0,0,1|2,0,0]=4 7823 B21R2.257673 CC(=CC(=O)NNCc1cccnc1)c2ccccc2 22a_100000738295_100000743005 [0,1,0,0,0,1|2,0,0]=4 7824 B21R2.257673 CC(=CC(=O)NNCc1ccncc1)c2ccccc2 22a_100000736929_100000743005 [0,1,0,0,0,1|2,0,0]=4 7825 B21R2.257673 CC(CC(=O)C/C=C/c1ccccc1)c2ccccc2 1458a_100000183687_100016265936 [0,1,0,0,0,1|1,0,0]=3 7826 B21R2.257673 CC(CC(=O)C/C=C/c1ccccc1)c2ccccc2 1458a_100011219626_100000756946 [0,1,0,0,0,1|1,0,0]=3 7827 B21R2.257673 CC(CC(=O)C=CSc1ccccc1)c2ccccc2 1458a_100016262050_100000756946 [0,1,0,0,0,1|1,0,0]=3 7828 B21R2.257673 CC(CC(=O)COCc1ccccc1)c2ccccc2 1458a_100000230186_100000756946 [0,1,0,0,0,1|0,0,2]=4 7829 B21R2.257673 CC(NC(=O)C/C=C/c1ccccc1)c2ccccn2 11a_100000181244_100011219626 [0,1,0,0,0,1|2,0,0]=4 7830 B21R2.257673 CC(NC(=O)C/C=C/c1ccccc1)c2ccccn2 1626a_100000181244_100011219626 [0,1,0,0,0,1|2,0,0]=4 7831 B21R2.257673 CC(NC(=O)C/C=C/c1ccccc1)c2ccccn2 240690a_100000181244_100011219626 [0,1,0,0,0,1|2,0,0]=4 7832 B21R2.257673 CC(NC(=O)C/C=C/c1ccccc1)c2cccnc2 11a_100000195435_100011219626 [0,1,0,0,0,1|2,0,0]=4 7833 B21R2.257673 CC(NC(=O)C/C=C/c1ccccc1)c2cccnc2 240690a_100000195435_100011219626 [0,1,0,0,0,1|2,0,0]=4 7834 B21R2.257673 CC(NC(=O)C/C=C/c1ccccc1)c2ccncc2 240690a_100000181269_100011219626 [0,1,0,0,0,1|2,0,0]=4 7835 B21R2.257673 CC(NC(=O)C=CSc1ccccc1)c2ccccn2 11a_100000181244_100016262050 [0,1,0,0,0,1|2,0,0]=4 7836 B21R2.257673 CC(NC(=O)C=CSc1ccccc1)c2ccccn2 1626a_100000181244_100016262050 [0,1,0,0,0,1|2,0,0]=4 7837 B21R2.257673 CC(NC(=O)C=CSc1ccccc1)c2ccccn2 240690a_100000181244_100016262050 [0,1,0,0,0,1|2,0,0]=4 7838 B21R2.257673 CC(NC(=O)C=CSc1ccccc1)c2cccnc2 11a_100000195435_100016262050 [0,1,0,0,0,1|2,0,0]=4 7839 B21R2.257673 CC(NC(=O)C=CSc1ccccc1)c2cccnc2 240690a_100000195435_100016262050 [0,1,0,0,0,1|2,0,0]=4 7840 B21R2.257673 CC(NC(=O)C=CSc1ccccc1)c2ccncc2 240690a_100000181269_100016262050 [0,1,0,0,0,1|2,0,0]=4 7841 B21R2.257673 CC(NC(=O)COCc1ccccc1)c2ccccc2 34a_100000210790_200000243715 [0,1,0,0,0,1|1,0,1]=4 7842 B21R2.257673 CC(NC(=O)COCc1ccccc1)c2ccccc2 7a_100000210790_200000243715 [0,1,0,0,0,1|1,0,1]=4 7843 B21R2.257673 CN(CC(=O)C/C=C/c1ccccc1)c2ccccc2 1458a_100000745425_100016265936 [0,1,0,0,0,1|2,0,0]=4 7844 B21R2.257673 CN(CC(=O)NOCc1ccccc1)c2ccccc2 2230a_100000210012_100000230105 [0,1,0,0,0,1|1,0,1]=4 7845 B21R2.257673 CN(CC(=O)NOCc1ccccc1)c2ccccc2 269982a_100000210012_100000230105 [0,1,0,0,0,1|1,0,1]=4 7846 B21R2.257673 CN(CC(=O)NOCc1ccccc1)c2ccccc2 34a_100000210012_100000230105 [0,1,0,0,0,1|1,0,1]=4 7847 B21R2.257673 CN(CC(=O)OCCc1ccccc1)c2ccccc2 2230a_100000210012_200000077782 [0,1,0,0,0,1|1,0,1]=4 7848 B21R2.257673 CN(CC(=O)OCCc1ccccc1)c2ccccc2 269982a_100000210012_200000077782 [0,1,0,0,0,1|1,0,1]=4 7849 B21R2.257673 CN(CC(=O)OCCc1ccccc1)c2ccccc2 34a_100000210012_200000077782 [0,1,0,0,0,1|1,0,1]=4 7850 B21R2.257673 C[C@@H](NC(=O)C/C=C/c1ccccc1)c2ccccc2 11a_100000751104_100011219626 [0,1,0,0,0,1|1,0,0]=3 7851 B21R2.257673 C[C@@H](NC(=O)C/C=C/c1ccccc1)c2ccccc2 1626a_100000751104_100011219626 [0,1,0,0,0,1|1,0,0]=3 7852 B21R2.257673 C[C@@H](NC(=O)C/C=C/c1ccccc1)c2ccccc2 240690a_100000751104_100011219626 [0,1,0,0,0,1|1,0,0]=3 7853 B21R2.257673 C[C@@H](NC(=O)C=CSc1ccccc1)c2ccccc2 11a_100000751104_100016262050 [0,1,0,0,0,1|1,0,0]=3 7854 B21R2.257673 C[C@@H](NC(=O)C=CSc1ccccc1)c2ccccc2 1626a_100000751104_100016262050 [0,1,0,0,0,1|1,0,0]=3 7855 B21R2.257673 C[C@@H](NC(=O)C=CSc1ccccc1)c2ccccc2 240690a_100000751104_100016262050 [0,1,0,0,0,1|1,0,0]=3 7856 B21R2.257673 C[C@@H](NC(=O)COCc1ccccc1)c2ccccc2 11a_100000751104_100000230186 [0,1,0,0,0,1|1,0,1]=4 7857 B21R2.257673 C[C@@H](NC(=O)COCc1ccccc1)c2ccccc2 1626a_100000751104_100000230186 [0,1,0,0,0,1|1,0,1]=4 7858 B21R2.257673 C[C@@H](NC(=O)COCc1ccccc1)c2ccccc2 240690a_100000751104_100000230186 [0,1,0,0,0,1|1,0,1]=4 7859 B21R2.257673 C[C@@H](NC(=O)COCc1ccccc1)c2ccccc2 527a_100000751104_100000230186 [0,1,0,0,0,1|1,0,1]=4 7860 B21R2.257673 C[C@H](NC(=O)COCc1ccccc1)c2ccccc2 34a_100000210790_100011939912 [0,1,0,0,0,1|1,0,1]=4 7861 B21R2.257673 C[C@H](NC(=O)COCc1ccccc1)c2ccccc2 7a_100000210790_100011939912 [0,1,0,0,0,1|1,0,1]=4 7862 B21R2.257673 O=C(C/C=C/c1ccccc1)CC(=O)c2ccccc2 1458a_100011219626_100000211460 [0,1,0,0,0,1|1,0,1]=4 7863 B21R2.257673 O=C(C/C=C/c1ccccc1)CC(O)c2ccccc2 1458a_100000690199_100016265936 [0,1,0,0,0,1|1,0,0]=3 7864 B21R2.257673 O=C(C/C=C/c1ccccc1)CC(O)c2ccccc2 1458a_100011219626_100000185958 [0,1,0,0,0,1|1,0,0]=3 7865 B21R2.257673 O=C(C/C=C/c1ccccc1)C[C@@H](O)c2ccccc2 1458a_100011219626_100011933945 [0,1,0,0,0,1|1,0,0]=3 7866 B21R2.257673 O=C(C=CSc1ccccc1)CC(=O)c2ccccc2 1458a_100016262050_100000211460 [0,1,0,0,0,1|1,0,1]=4 7867 B21R2.257673 O=C(C=CSc1ccccc1)CC(O)c2ccccc2 1458a_100016262050_100000185958 [0,1,0,0,0,1|1,0,0]=3 7868 B21R2.257673 O=C(C=CSc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100016262050_100011933945 [0,1,0,0,0,1|1,0,0]=3 7869 B21R2.257673 O=C(CC(=O)c1ccccc1)NCCc2ccccc2 1458a_100000185807_100000183012 [0,1,0,0,0,1|1,0,1]=4 7870 B21R2.257673 O=C(CC(=O)c1ccccc1)NOCc2ccccc2 1458a_100000185807_100000230105 [0,1,0,0,0,1|0,0,1]=3 7871 B21R2.257673 O=C(CC(=O)c1ccccc1)OCCc2ccccc2 1458a_100000185807_200000077782 [0,1,0,0,0,1|0,0,1]=3 7872 B21R2.257673 O=C(CCCc1ccccc1)CC(=O)c2ccccc2 1458a_100011207963_100000211460 [0,1,0,0,0,1|1,0,1]=4 7873 B21R2.257673 O=C(CCOc1ccccc1)CC(=O)c2ccccc2 1458a_100000182761_100000211460 [0,1,0,0,0,1|1,0,1]=4 7874 B21R2.257673 O=C(CCSc1ccccc1)CC(=O)c2ccccc2 1458a_100000182436_100000211460 [0,1,0,0,0,1|1,0,1]=4 7875 B21R2.257673 O=C(COCc1ccccc1)CC(=O)c2ccccc2 1458a_100000230186_100000211460 [0,1,0,0,0,1|0,0,1]=3 7876 B21R2.257673 O=C(COCc1ccccc1)CC(=O)c2ccccn2 1458a_100000230186_100000027445 [0,1,0,0,0,1|1,0,1]=4 7877 B21R2.257673 O=C(COCc1ccccc1)CC(=O)c2cccnc2 1458a_100000230186_100015188593 [0,1,0,0,0,1|1,0,1]=4 7878 B21R2.257673 O=C(COCc1ccccc1)CC(=O)c2ccncc2 1458a_100000230186_100000027454 [0,1,0,0,0,1|1,0,1]=4 7879 B21R2.257673 O=C(COCc1ccccc1)CC(O)c2ccccc2 1458a_100000230186_100000185958 [0,1,0,0,0,1|0,0,2]=4 7880 B21R2.257673 O=C(COCc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000230186_100011933945 [0,1,0,0,0,1|0,0,2]=4 7881 B21R2.257673 O=C(COCc1ccccc1)NC(=O)c2ccccc2 7a_100000210790_100000010347 [0,1,0,0,0,1|1,0,0]=3 7882 B21R2.257673 O=C(CSCc1ccccc1)CC(=O)c2ccccc2 1458a_100000150264_100000211460 [0,1,0,0,0,1|0,1,1]=4 7883 B21R2.257673 O=C(CSCc1ccccc1)NC(=O)c2ccccc2 62a_100000211182_100000010347 [0,1,0,0,0,1|1,1,0]=4 7884 B21R2.3257524 O=S(=O)(C=Cc1ccccc1)NCCc2ccccc2 40a_100000106460_100011098038 [0,1,0,0,0,1|2,0,0]=4 7885 B21R2.3257524 O=S(=O)(C=Cc1ccccc1)NNCc2ccccc2 40a_100000007032_100011098038 [0,1,0,0,0,1|2,0,0]=4 7886 B21R2.9764 O=C(COc1cccccc1=O)OCc2ccccc2 34a_100000036025_100000753625 [0,1,0,0,0,1|1,0,1]=4 7887 B21R2.9764 O=C(COc1cccccc1=O)OCc2ccccc2 7a_100000036025_100000753625 [0,1,0,0,0,1|1,0,1]=4 7888 B21R2.85 C#Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 11a_100015199678_100000210462 [0,2,0,0,0,0|1,0,0]=3 7889 B21R2.85 C#Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 1626a_100015199678_100000210462 [0,2,0,0,0,0|1,0,0]=3 7890 B21R2.85 C#Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 11a_100015199678_100000740811 [0,2,0,0,0,0|2,0,0]=4 7891 B21R2.85 C#Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 240690a_100015199678_100000740811 [0,2,0,0,0,0|2,0,0]=4 7892 B21R2.85 C#Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 11a_100015199678_100000735890 [0,2,0,0,0,0|2,0,0]=4 7893 B21R2.85 C#Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 240690a_100015199678_100000735890 [0,2,0,0,0,0|2,0,0]=4 7894 B21R2.85 C#Cc1ccc(cc1)CNC(=O)C=Cc2ccncc2 240690a_100015199678_100000682801 [0,2,0,0,0,0|2,0,0]=4 7895 B21R2.85 C#Cc1ccc(cc1)NCC(=O)OCc2ccccc2 34a_100011215031_100000753625 [0,2,0,0,0,0|1,0,1]=4 7896 B21R2.85 C=Cc1ccc(cc1)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100000142037 [0,2,0,0,0,0|1,0,0]=3 7897 B21R2.85 C=Cc1ccc(cc1)CCC(=O)C=Cc2ccccn2 1458a_100000740811_100000142037 [0,2,0,0,0,0|2,0,0]=4 7898 B21R2.85 C=Cc1ccc(cc1)CCC(=O)C=Cc2cccnc2 1458a_100000735890_100000142037 [0,2,0,0,0,0|2,0,0]=4 7899 B21R2.85 C=Cc1ccc(cc1)CCC(=O)C=Cc2ccncc2 1458a_100000682801_100000142037 [0,2,0,0,0,0|2,0,0]=4 7900 B21R2.85 C=Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 11a_200011934891_100000210462 [0,2,0,0,0,0|1,0,0]=3 7901 B21R2.85 C=Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 1626a_200011934891_100000210462 [0,2,0,0,0,0|1,0,0]=3 7902 B21R2.85 C=Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 11a_200011934891_100000740811 [0,2,0,0,0,0|2,0,0]=4 7903 B21R2.85 C=Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 240690a_200011934891_100000740811 [0,2,0,0,0,0|2,0,0]=4 7904 B21R2.85 C=Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 11a_200011934891_100000735890 [0,2,0,0,0,0|2,0,0]=4 7905 B21R2.85 C=Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 240690a_200011934891_100000735890 [0,2,0,0,0,0|2,0,0]=4 7906 B21R2.85 C=Cc1ccc(cc1)CNC(=O)C=Cc2ccncc2 240690a_200011934891_100000682801 [0,2,0,0,0,0|2,0,0]=4 7907 B21R2.85 C=Cc1ccc(cc1)NCC(=O)OCc2ccccc2 34a_100011218248_100000753625 [0,2,0,0,0,0|1,0,1]=4 7908 B21R2.85 C=Cc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000189437_100000753625 [0,2,0,0,0,0|1,0,1]=4 7909 B21R2.85 C=Cc1ccc(cc1)OCC(=O)OCc2ccccc2 7a_100000189437_100000753625 [0,2,0,0,0,0|1,0,1]=4 7910 B21R2.85 C=Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000748128_100000753625 [0,2,0,0,0,0|1,0,1]=4 7911 B21R2.85 C=Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000748128 [0,2,0,0,0,0|1,0,1]=4 7912 B21R2.85 CCc1ccc(cc1)C=CC(=O)CCc2ccccc2 1458a_100000187855_100000765856 [0,2,0,0,0,0|1,0,0]=3 7913 B21R2.85 CCc1ccc(cc1)C=CC(=O)CCc2ccccn2 1458a_100000187855_100015183660 [0,2,0,0,0,0|2,0,0]=4 7914 B21R2.85 CCc1ccc(cc1)C=CC(=O)CCc2cccnc2 1458a_100000187855_200011713674 [0,2,0,0,0,0|2,0,0]=4 7915 B21R2.85 CCc1ccc(cc1)C=CC(=O)CCc2ccncc2 1458a_100000187855_100000723409 [0,2,0,0,0,0|2,0,0]=4 7916 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000187855 [0,2,0,0,0,0|1,0,0]=3 7917 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000187855 [0,2,0,0,0,0|1,0,0]=3 7918 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100000187855 [0,2,0,0,0,0|1,0,0]=3 7919 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccccn2 11a_100000210449_100000187855 [0,2,0,0,0,0|2,0,0]=4 7920 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000187855 [0,2,0,0,0,0|2,0,0]=4 7921 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccccn2 240690a_100000210449_100000187855 [0,2,0,0,0,0|2,0,0]=4 7922 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2cccnc2 11a_100000210453_100000187855 [0,2,0,0,0,0|2,0,0]=4 7923 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2cccnc2 240690a_100000210453_100000187855 [0,2,0,0,0,0|2,0,0]=4 7924 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccncc2 11a_100000210450_100000187855 [0,2,0,0,0,0|2,0,0]=4 7925 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000187855 [0,2,0,0,0,0|2,0,0]=4 7926 B21R2.85 CCc1ccc(cc1)C=CC(=O)NCc2ccncc2 240690a_100000210450_100000187855 [0,2,0,0,0,0|2,0,0]=4 7927 B21R2.85 CCc1ccc(cc1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000187855 [0,2,0,0,0,0|2,0,0]=4 7928 B21R2.85 CCc1ccc(cc1)CNC(=O)C=Cc2ccccc2 11a_100000721222_100000210462 [0,2,0,0,0,0|1,0,0]=3 7929 B21R2.85 CCc1ccc(cc1)CNC(=O)C=Cc2ccccc2 1626a_100000721222_100000210462 [0,2,0,0,0,0|1,0,0]=3 7930 B21R2.85 CCc1ccc(cc1)CNC(=O)C=Cc2ccccn2 11a_100000721222_100000740811 [0,2,0,0,0,0|2,0,0]=4 7931 B21R2.85 CCc1ccc(cc1)CNC(=O)C=Cc2ccccn2 240690a_100000721222_100000740811 [0,2,0,0,0,0|2,0,0]=4 7932 B21R2.85 CCc1ccc(cc1)CNC(=O)C=Cc2cccnc2 11a_100000721222_100000735890 [0,2,0,0,0,0|2,0,0]=4 7933 B21R2.85 CCc1ccc(cc1)CNC(=O)C=Cc2cccnc2 240690a_100000721222_100000735890 [0,2,0,0,0,0|2,0,0]=4 7934 B21R2.85 CCc1ccc(cc1)CNC(=O)C=Cc2ccncc2 240690a_100000721222_100000682801 [0,2,0,0,0,0|2,0,0]=4 7935 B21R2.85 CCc1ccc(cc1)NCC(=O)OCc2ccccc2 2230a_100000211069_100000753625 [0,2,0,0,0,0|1,0,1]=4 7936 B21R2.85 CCc1ccc(cc1)NCC(=O)OCc2ccccc2 34a_100000211069_100000753625 [0,2,0,0,0,0|1,0,1]=4 7937 B21R2.85 CCc1ccc(cc1)NNC(=O)C=Cc2ccccc2 22a_100015204395_100000210462 [0,2,0,0,0,0|2,0,0]=4 7938 B21R2.85 CCc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000211359_100000753625 [0,2,0,0,0,0|1,0,1]=4 7939 B21R2.85 CCc1ccc(cc1)OCC(=O)OCc2ccccc2 7a_100000211359_100000753625 [0,2,0,0,0,0|1,0,1]=4 7940 B21R2.85 CCc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100011215824 [0,2,0,0,0,0|1,0,1]=4 7941 B21R2.85 CCc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100011215824_100000753625 [0,2,0,0,0,0|1,0,1]=4 7942 B21R2.85 CCc1ccc(nc1)CNC(=O)C=Cc2ccccc2 11a_100000069493_100000210462 [0,2,0,0,0,0|2,0,0]=4 7943 B21R2.85 CCc1ccc(nc1)CNC(=O)C=Cc2ccccc2 1626a_100000069493_100000210462 [0,2,0,0,0,0|2,0,0]=4 7944 B21R2.85 CNc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000182112_100000753625 [0,2,0,0,0,0|1,0,1]=4 7945 B21R2.85 CNc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000743151_100000753625 [0,2,0,0,0,0|1,0,1]=4 7946 B21R2.85 CNc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000743151 [0,2,0,0,0,0|1,0,1]=4 7947 B21R2.85 COc1ccc(cc1)C=CC(=O)CCc2ccccc2 1458a_100000184205_100000765856 [0,2,0,0,0,0|1,0,0]=3 7948 B21R2.85 COc1ccc(cc1)C=CC(=O)CCc2ccccn2 1458a_100000184205_100015183660 [0,2,0,0,0,0|2,0,0]=4 7949 B21R2.85 COc1ccc(cc1)C=CC(=O)CCc2cccnc2 1458a_100000184205_200011713674 [0,2,0,0,0,0|2,0,0]=4 7950 B21R2.85 COc1ccc(cc1)C=CC(=O)CCc2ccncc2 1458a_100000184205_100000723409 [0,2,0,0,0,0|2,0,0]=4 7951 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000184205 [0,2,0,0,0,0|1,0,0]=3 7952 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000184205 [0,2,0,0,0,0|1,0,0]=3 7953 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccccc2 527a_100015324214_100000184205 [0,2,0,0,0,0|1,0,0]=3 7954 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccccn2 11a_100000210449_100000184205 [0,2,0,0,0,0|2,0,0]=4 7955 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000184205 [0,2,0,0,0,0|2,0,0]=4 7956 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccccn2 527a_100000210449_100000184205 [0,2,0,0,0,0|2,0,0]=4 7957 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2cccnc2 11a_100000210453_100000184205 [0,2,0,0,0,0|2,0,0]=4 7958 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2cccnc2 527a_100000210453_100000184205 [0,2,0,0,0,0|2,0,0]=4 7959 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccncc2 11a_100000210450_100000184205 [0,2,0,0,0,0|2,0,0]=4 7960 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000184205 [0,2,0,0,0,0|2,0,0]=4 7961 B21R2.85 COc1ccc(cc1)C=CC(=O)NCc2ccncc2 527a_100000210450_100000184205 [0,2,0,0,0,0|2,0,0]=4 7962 B21R2.85 COc1ccc(cc1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000184205 [0,2,0,0,0,0|2,0,0]=4 7963 B21R2.85 COc1ccc(cc1)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100000184700 [0,2,0,0,0,0|1,0,0]=3 7964 B21R2.85 COc1ccc(cc1)CCC(=O)C=Cc2ccccn2 1458a_100000740811_100000184700 [0,2,0,0,0,0|2,0,0]=4 7965 B21R2.85 COc1ccc(cc1)CCC(=O)C=Cc2cccnc2 1458a_100000735890_100000184700 [0,2,0,0,0,0|2,0,0]=4 7966 B21R2.85 COc1ccc(cc1)CCC(=O)C=Cc2ccncc2 1458a_100000682801_100000184700 [0,2,0,0,0,0|2,0,0]=4 7967 B21R2.85 COc1ccc(cc1)CCC(=O)OCc2ccccc2 34a_100000054185_200000210301 [0,2,0,0,0,0|0,0,2]=4 7968 B21R2.85 COc1ccc(cc1)CCC(=O)OCc2ccccc2 7a_100000054185_200000210301 [0,2,0,0,0,0|0,0,2]=4 7969 B21R2.85 COc1ccc(cc1)CNC(=O)C=Cc2ccccc2 11a_100000185587_100000210462 [0,2,0,0,0,0|1,0,0]=3 7970 B21R2.85 COc1ccc(cc1)CNC(=O)C=Cc2ccccc2 1626a_100000185587_100000210462 [0,2,0,0,0,0|1,0,0]=3 7971 B21R2.85 COc1ccc(cc1)CNC(=O)C=Cc2ccccn2 11a_100000185587_100000740811 [0,2,0,0,0,0|2,0,0]=4 7972 B21R2.85 COc1ccc(cc1)CNC(=O)C=Cc2ccccn2 240690a_100000185587_100000740811 [0,2,0,0,0,0|2,0,0]=4 7973 B21R2.85 COc1ccc(cc1)CNC(=O)C=Cc2cccnc2 11a_100000185587_100000735890 [0,2,0,0,0,0|2,0,0]=4 7974 B21R2.85 COc1ccc(cc1)CNC(=O)C=Cc2cccnc2 240690a_100000185587_100000735890 [0,2,0,0,0,0|2,0,0]=4 7975 B21R2.85 COc1ccc(cc1)CNC(=O)C=Cc2ccncc2 240690a_100000185587_100000682801 [0,2,0,0,0,0|2,0,0]=4 7976 B21R2.85 COc1ccc(cc1)NCC(=O)OCc2ccccc2 34a_100000184247_100000753625 [0,2,0,0,0,0|1,0,1]=4 7977 B21R2.85 COc1ccc(cc1)NNC(=O)C=Cc2ccccc2 22a_100000005221_100000210462 [0,2,0,0,0,0|2,0,0]=4 7978 B21R2.85 COc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000210503_100000753625 [0,2,0,0,0,0|1,0,1]=4 7979 B21R2.85 COc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000171711 [0,2,0,0,0,0|1,0,1]=4 7980 B21R2.85 COc1ccc(cn1)CNC(=O)C=Cc2ccccc2 11a_100000241975_100000210462 [0,2,0,0,0,0|2,0,0]=4 7981 B21R2.85 COc1ccc(cn1)CNC(=O)C=Cc2ccccc2 1626a_100000241975_100000210462 [0,2,0,0,0,0|2,0,0]=4 7982 B21R2.85 COc1ccc(nc1)CNC(=O)C=Cc2ccccc2 11a_100000703904_100000210462 [0,2,0,0,0,0|2,0,0]=4 7983 B21R2.85 COc1ccc(nc1)CNC(=O)C=Cc2ccccc2 1626a_100000703904_100000210462 [0,2,0,0,0,0|2,0,0]=4 7984 B21R2.85 CSc1ccc(cc1)C=CC(=O)CCc2ccccc2 1458a_100102526083_100000765856 [0,2,0,0,0,0|1,0,0]=3 7985 B21R2.85 CSc1ccc(cc1)C=CC(=O)CCc2ccccn2 1458a_100102526083_100015183660 [0,2,0,0,0,0|2,0,0]=4 7986 B21R2.85 CSc1ccc(cc1)C=CC(=O)CCc2cccnc2 1458a_100102526083_200011713674 [0,2,0,0,0,0|2,0,0]=4 7987 B21R2.85 CSc1ccc(cc1)C=CC(=O)CCc2ccncc2 1458a_100102526083_100000723409 [0,2,0,0,0,0|2,0,0]=4 7988 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccccc2 11a_100015324214_100102526083 [0,2,0,0,0,0|1,0,0]=3 7989 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100102526083 [0,2,0,0,0,0|1,0,0]=3 7990 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100102526083 [0,2,0,0,0,0|1,0,0]=3 7991 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccccn2 11a_100000210449_100102526083 [0,2,0,0,0,0|2,0,0]=4 7992 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100102526083 [0,2,0,0,0,0|2,0,0]=4 7993 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccccn2 240690a_100000210449_100102526083 [0,2,0,0,0,0|2,0,0]=4 7994 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2cccnc2 11a_100000210453_100102526083 [0,2,0,0,0,0|2,0,0]=4 7995 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2cccnc2 240690a_100000210453_100102526083 [0,2,0,0,0,0|2,0,0]=4 7996 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccncc2 11a_100000210450_100102526083 [0,2,0,0,0,0|2,0,0]=4 7997 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100102526083 [0,2,0,0,0,0|2,0,0]=4 7998 B21R2.85 CSc1ccc(cc1)C=CC(=O)NCc2ccncc2 240690a_100000210450_100102526083 [0,2,0,0,0,0|2,0,0]=4 7999 B21R2.85 CSc1ccc(cc1)C=CC(=O)NNc2ccccc2 22a_100015195140_100102526083 [0,2,0,0,0,0|2,0,0]=4 8000 B21R2.85 CSc1ccc(cc1)CNC(=O)C=Cc2ccccc2 11a_100000174980_100000210462 [0,2,0,0,0,0|1,0,0]=3 8001 B21R2.85 CSc1ccc(cc1)CNC(=O)C=Cc2ccccn2 11a_100000174980_100000740811 [0,2,0,0,0,0|2,0,0]=4 8002 B21R2.85 CSc1ccc(cc1)CNC(=O)C=Cc2ccccn2 240690a_100000174980_100000740811 [0,2,0,0,0,0|2,0,0]=4 8003 B21R2.85 CSc1ccc(cc1)CNC(=O)C=Cc2cccnc2 11a_100000174980_100000735890 [0,2,0,0,0,0|2,0,0]=4 8004 B21R2.85 CSc1ccc(cc1)CNC(=O)C=Cc2cccnc2 240690a_100000174980_100000735890 [0,2,0,0,0,0|2,0,0]=4 8005 B21R2.85 CSc1ccc(cc1)CNC(=O)C=Cc2ccncc2 240690a_100000174980_100000682801 [0,2,0,0,0,0|2,0,0]=4 8006 B21R2.85 CSc1ccc(cc1)NCC(=O)OCc2ccccc2 34a_100000212337_100000753625 [0,2,0,0,0,0|1,0,1]=4 8007 B21R2.85 CSc1ccc(cc1)NNC(=O)C=Cc2ccccc2 22a_100000006515_100000210462 [0,2,0,0,0,0|2,0,0]=4 8008 B21R2.85 CSc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000211864_100000753625 [0,2,0,0,0,0|1,0,1]=4 8009 B21R2.85 CSc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100011263217 [0,2,0,0,0,0|1,0,1]=4 8010 B21R2.85 CSc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100011263217_100000753625 [0,2,0,0,0,0|1,0,1]=4 8011 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)CCc2ccccc2 1458a_100000185084_100000765856 [0,2,0,0,0,0|1,0,0]=3 8012 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)CCc2ccccn2 1458a_100000185084_100015183660 [0,2,0,0,0,0|2,0,0]=4 8013 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)CCc2cccnc2 1458a_100000185084_200011713674 [0,2,0,0,0,0|2,0,0]=4 8014 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)CCc2ccncc2 1458a_100000185084_100000723409 [0,2,0,0,0,0|2,0,0]=4 8015 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000185084 [0,2,0,0,0,0|1,0,0]=3 8016 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000185084 [0,2,0,0,0,0|1,0,0]=3 8017 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100000185084 [0,2,0,0,0,0|1,0,0]=3 8018 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 11a_100000210449_100000185084 [0,2,0,0,0,0|2,0,0]=4 8019 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000185084 [0,2,0,0,0,0|2,0,0]=4 8020 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 240690a_100000210449_100000185084 [0,2,0,0,0,0|2,0,0]=4 8021 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2cccnc2 11a_100000210453_100000185084 [0,2,0,0,0,0|2,0,0]=4 8022 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2cccnc2 240690a_100000210453_100000185084 [0,2,0,0,0,0|2,0,0]=4 8023 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 11a_100000210450_100000185084 [0,2,0,0,0,0|2,0,0]=4 8024 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000185084 [0,2,0,0,0,0|2,0,0]=4 8025 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 240690a_100000210450_100000185084 [0,2,0,0,0,0|2,0,0]=4 8026 B21R2.85 N#Cc1ccc(cc1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000185084 [0,2,0,0,0,0|2,0,0]=4 8027 B21R2.85 N#Cc1ccc(cc1)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100012161189 [0,2,0,0,0,0|1,0,0]=3 8028 B21R2.85 N#Cc1ccc(cc1)CCC(=O)C=Cc2ccccn2 1458a_100000740811_100012161189 [0,2,0,0,0,0|2,0,0]=4 8029 B21R2.85 N#Cc1ccc(cc1)CCC(=O)C=Cc2cccnc2 1458a_100000735890_100012161189 [0,2,0,0,0,0|2,0,0]=4 8030 B21R2.85 N#Cc1ccc(cc1)CCC(=O)C=Cc2ccncc2 1458a_100000682801_100012161189 [0,2,0,0,0,0|2,0,0]=4 8031 B21R2.85 N#Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 11a_100015207190_100000210462 [0,2,0,0,0,0|1,0,0]=3 8032 B21R2.85 N#Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 1626a_100015207190_100000210462 [0,2,0,0,0,0|1,0,0]=3 8033 B21R2.85 N#Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 11a_100015207190_100000740811 [0,2,0,0,0,0|2,0,0]=4 8034 B21R2.85 N#Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 240690a_100015207190_100000740811 [0,2,0,0,0,0|2,0,0]=4 8035 B21R2.85 N#Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 11a_100015207190_100000735890 [0,2,0,0,0,0|2,0,0]=4 8036 B21R2.85 N#Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 240690a_100015207190_100000735890 [0,2,0,0,0,0|2,0,0]=4 8037 B21R2.85 N#Cc1ccc(cc1)CNC(=O)C=Cc2ccncc2 240690a_100015207190_100000682801 [0,2,0,0,0,0|2,0,0]=4 8038 B21R2.85 N#Cc1ccc(cc1)NCC(=O)OCc2ccccc2 34a_100000185469_100000753625 [0,2,0,0,0,0|1,0,1]=4 8039 B21R2.85 N#Cc1ccc(cc1)NNC(=O)C=Cc2ccccc2 22a_100000739705_100000210462 [0,2,0,0,0,0|2,0,0]=4 8040 B21R2.85 N#Cc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000210344_100000753625 [0,2,0,0,0,0|1,0,1]=4 8041 B21R2.85 N#Cc1ccc(cc1)OCC(=O)OCc2ccccc2 7a_100000210344_100000753625 [0,2,0,0,0,0|1,0,1]=4 8042 B21R2.85 N#Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000184291 [0,2,0,0,0,0|1,0,1]=4 8043 B21R2.85 NCc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000185549_100000753625 [0,2,0,0,0,0|1,0,1]=4 8044 B21R2.85 NCc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100016989417 [0,2,0,0,0,0|1,0,1]=4 8045 B21R2.85 NCc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100016989417_100000753625 [0,2,0,0,0,0|1,0,1]=4 8046 B21R2.85 NNc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100016988836 [0,2,0,0,0,0|1,0,1]=4 8047 B21R2.85 NNc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100016988836_100000753625 [0,2,0,0,0,0|1,0,1]=4 8048 B21R2.85 O=C(C=Cc1ccccn1)NCc2ccc(cc2)CO 240690a_100015189231_100000740811 [0,2,0,0,0,0|2,0,0]=4 8049 B21R2.85 O=C(C=Cc1cccnc1)NCc2ccc(cc2)CO 240690a_100015189231_100000735890 [0,2,0,0,0,0|2,0,0]=4 8050 B21R2.85 O=C(C=Cc1ccncc1)NCc2ccc(cc2)CO 240690a_100015189231_100000682801 [0,2,0,0,0,0|2,0,0]=4 8051 B21R2.85 O=C(CNc1ccc(cc1)CO)OCc2ccccc2 2230a_100011215238_100000753625 [0,2,0,0,0,0|1,0,1]=4 8052 B21R2.85 O=C(CNc1ccc(cc1)CO)OCc2ccccc2 34a_100011215238_100000753625 [0,2,0,0,0,0|1,0,1]=4 8053 B21R2.85 O=C(COc1ccc(cc1)CO)OCc2ccccc2 34a_100000211755_100000753625 [0,2,0,0,0,0|1,0,1]=4 8054 B21R2.85 O=C(CSc1ccc(cc1)CF)OCc2ccccc2 62a_100000753625_100010268989 [0,2,0,0,0,0|1,0,1]=4 8055 B21R2.85 O=C(CSc1ccc(cc1)CF)OCc2ccccc2 62a_100010268989_100000753625 [0,2,0,0,0,0|1,0,1]=4 8056 B21R2.85 O=C(CSc1ccc(cc1)CO)OCc2ccccc2 62a_100000690907_100000753625 [0,2,0,0,0,0|1,0,1]=4 8057 B21R2.85 O=C(CSc1ccc(cc1)CO)OCc2ccccc2 62a_100000753625_100000690907 [0,2,0,0,0,0|1,0,1]=4 8058 B21R2.85 O=Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000188517_100000753625 [0,2,0,0,0,0|1,0,1]=4 8059 B21R2.85 O=Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000188517 [0,2,0,0,0,0|1,0,1]=4 8060 B21R2.85 [13CH3]Oc1ccc(cc1)CCC(=O)OCc2ccccc2 34a_100000054185_200025704644 [0,2,0,0,0,0|0,0,2]=4 8061 B21R2.85 [13CH3]Oc1ccc(cc1)CCC(=O)OCc2ccccc2 7a_100000054185_200025704644 [0,2,0,0,0,0|0,0,2]=4 8062 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)CCc2ccccc2 1458a_100053117043_100000765856 [0,2,0,0,0,0|1,0,0]=3 8063 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)CCc2ccccn2 1458a_100053117043_100015183660 [0,2,0,0,0,0|2,0,0]=4 8064 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)CCc2cccnc2 1458a_100053117043_200011713674 [0,2,0,0,0,0|2,0,0]=4 8065 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)CCc2ccncc2 1458a_100053117043_100000723409 [0,2,0,0,0,0|2,0,0]=4 8066 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccccc2 11a_100015324214_100053117043 [0,2,0,0,0,0|1,0,0]=3 8067 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccccc2 1626a_100015324214_100053117043 [0,2,0,0,0,0|1,0,0]=3 8068 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccccc2 240690a_100015324214_100053117043 [0,2,0,0,0,0|1,0,0]=3 8069 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccccc2 527a_100015324214_100053117043 [0,2,0,0,0,0|1,0,0]=3 8070 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccccn2 11a_100000210449_100053117043 [0,2,0,0,0,0|2,0,0]=4 8071 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccccn2 1626a_100000210449_100053117043 [0,2,0,0,0,0|2,0,0]=4 8072 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccccn2 240690a_100000210449_100053117043 [0,2,0,0,0,0|2,0,0]=4 8073 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccccn2 527a_100000210449_100053117043 [0,2,0,0,0,0|2,0,0]=4 8074 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2cccnc2 11a_100000210453_100053117043 [0,2,0,0,0,0|2,0,0]=4 8075 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2cccnc2 240690a_100000210453_100053117043 [0,2,0,0,0,0|2,0,0]=4 8076 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2cccnc2 527a_100000210453_100053117043 [0,2,0,0,0,0|2,0,0]=4 8077 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccncc2 11a_100000210450_100053117043 [0,2,0,0,0,0|2,0,0]=4 8078 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccncc2 1626a_100000210450_100053117043 [0,2,0,0,0,0|2,0,0]=4 8079 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccncc2 240690a_100000210450_100053117043 [0,2,0,0,0,0|2,0,0]=4 8080 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NCc2ccncc2 527a_100000210450_100053117043 [0,2,0,0,0,0|2,0,0]=4 8081 B21R2.4531 C/C(=C\c1ccc(cc1)F)/C(=O)NNc2ccccc2 22a_100015195140_100053117043 [0,2,0,0,0,0|2,0,0]=4 8082 B21R2.4531 CN(Cc1ccc(cc1)Br)C(=O)C=Cc2ccccc2 11a_100000180866_100000210462 [0,2,0,0,0,0|1,0,0]=3 8083 B21R2.4531 CN(Cc1ccc(cc1)Br)C(=O)C=Cc2ccccc2 1626a_100000180866_100000210462 [0,2,0,0,0,0|1,0,0]=3 8084 B21R2.4531 CN(Cc1ccc(cc1)Br)C(=O)C=Cc2ccccn2 11a_100000180866_100000740811 [0,2,0,0,0,0|2,0,0]=4 8085 B21R2.4531 CN(Cc1ccc(cc1)Br)C(=O)C=Cc2ccccn2 240690a_100000180866_100000740811 [0,2,0,0,0,0|2,0,0]=4 8086 B21R2.4531 CN(Cc1ccc(cc1)Br)C(=O)C=Cc2cccnc2 11a_100000180866_100000735890 [0,2,0,0,0,0|2,0,0]=4 8087 B21R2.4531 CN(Cc1ccc(cc1)Br)C(=O)C=Cc2cccnc2 240690a_100000180866_100000735890 [0,2,0,0,0,0|2,0,0]=4 8088 B21R2.4531 CN(Cc1ccc(cc1)Br)C(=O)C=Cc2ccncc2 240690a_100000180866_100000682801 [0,2,0,0,0,0|2,0,0]=4 8089 B21R2.4531 CN(Cc1ccc(cc1)Cl)C(=O)C=Cc2ccccc2 11a_100000184517_100000210462 [0,2,0,0,0,0|1,0,0]=3 8090 B21R2.4531 CN(Cc1ccc(cc1)Cl)C(=O)C=Cc2ccccc2 1626a_100000184517_100000210462 [0,2,0,0,0,0|1,0,0]=3 8091 B21R2.4531 CN(Cc1ccc(cc1)Cl)C(=O)C=Cc2ccccn2 11a_100000184517_100000740811 [0,2,0,0,0,0|2,0,0]=4 8092 B21R2.4531 CN(Cc1ccc(cc1)Cl)C(=O)C=Cc2ccccn2 240690a_100000184517_100000740811 [0,2,0,0,0,0|2,0,0]=4 8093 B21R2.4531 CN(Cc1ccc(cc1)Cl)C(=O)C=Cc2cccnc2 11a_100000184517_100000735890 [0,2,0,0,0,0|2,0,0]=4 8094 B21R2.4531 CN(Cc1ccc(cc1)Cl)C(=O)C=Cc2cccnc2 240690a_100000184517_100000735890 [0,2,0,0,0,0|2,0,0]=4 8095 B21R2.4531 CN(Cc1ccc(cc1)Cl)C(=O)C=Cc2ccncc2 240690a_100000184517_100000682801 [0,2,0,0,0,0|2,0,0]=4 8096 B21R2.4531 CN(Cc1ccc(cc1)F)C(=O)C=Cc2ccccc2 11a_100000184576_100000210462 [0,2,0,0,0,0|1,0,0]=3 8097 B21R2.4531 CN(Cc1ccc(cc1)F)C(=O)C=Cc2ccccc2 1626a_100000184576_100000210462 [0,2,0,0,0,0|1,0,0]=3 8098 B21R2.4531 CN(Cc1ccc(cc1)F)C(=O)C=Cc2ccccn2 11a_100000184576_100000740811 [0,2,0,0,0,0|2,0,0]=4 8099 B21R2.4531 CN(Cc1ccc(cc1)F)C(=O)C=Cc2ccccn2 240690a_100000184576_100000740811 [0,2,0,0,0,0|2,0,0]=4 8100 B21R2.4531 CN(Cc1ccc(cc1)F)C(=O)C=Cc2cccnc2 11a_100000184576_100000735890 [0,2,0,0,0,0|2,0,0]=4 8101 B21R2.4531 CN(Cc1ccc(cc1)F)C(=O)C=Cc2cccnc2 240690a_100000184576_100000735890 [0,2,0,0,0,0|2,0,0]=4 8102 B21R2.4531 CN(Cc1ccc(cc1)F)C(=O)C=Cc2ccncc2 240690a_100000184576_100000682801 [0,2,0,0,0,0|2,0,0]=4 8103 B21R2.4531 CN(Cc1ccc(cc1)O)C(=O)C=Cc2ccccn2 240690a_100000207500_100000740811 [0,2,0,0,0,0|2,0,0]=4 8104 B21R2.4531 CN(Cc1ccc(cc1)O)C(=O)C=Cc2cccnc2 240690a_100000207500_100000735890 [0,2,0,0,0,0|2,0,0]=4 8105 B21R2.4531 CN(Cc1ccc(cc1)O)C(=O)C=Cc2ccncc2 240690a_100000207500_100000682801 [0,2,0,0,0,0|2,0,0]=4 8106 B21R2.4531 CN(Cc1ccc(nc1)Cl)C(=O)C=Cc2ccccc2 11a_100000026953_100000210462 [0,2,0,0,0,0|2,0,0]=4 8107 B21R2.4531 Cc1ccc(cc1)CN(C)C(=O)C=Cc2ccccc2 11a_100000744650_100000210462 [0,2,0,0,0,0|1,0,0]=3 8108 B21R2.4531 Cc1ccc(cc1)CN(C)C(=O)C=Cc2ccccc2 1626a_100000744650_100000210462 [0,2,0,0,0,0|1,0,0]=3 8109 B21R2.4531 Cc1ccc(cc1)CN(C)C(=O)C=Cc2ccccn2 11a_100000744650_100000740811 [0,2,0,0,0,0|2,0,0]=4 8110 B21R2.4531 Cc1ccc(cc1)CN(C)C(=O)C=Cc2ccccn2 240690a_100000744650_100000740811 [0,2,0,0,0,0|2,0,0]=4 8111 B21R2.4531 Cc1ccc(cc1)CN(C)C(=O)C=Cc2cccnc2 11a_100000744650_100000735890 [0,2,0,0,0,0|2,0,0]=4 8112 B21R2.4531 Cc1ccc(cc1)CN(C)C(=O)C=Cc2cccnc2 240690a_100000744650_100000735890 [0,2,0,0,0,0|2,0,0]=4 8113 B21R2.4531 Cc1ccc(cc1)CN(C)C(=O)C=Cc2ccncc2 240690a_100000744650_100000682801 [0,2,0,0,0,0|2,0,0]=4 8114 B21R2.4531 Cc1ccc(cc1)NC(=O)C(=O)CCc2ccccc2 1458a_100000189662_100000765856 [0,2,0,0,0,0|2,0,0]=4 8115 B21R2.4531 Cc1ccc(cc1)NC(=O)C(=O)NCc2ccccc2 1626a_100015324214_100000189662 [0,2,0,0,0,0|2,0,0]=4 8116 B21R2.4531 Cc1ccc(cc1)NC(=O)C(=O)NCc2ccccc2 240690a_100015324214_100000189662 [0,2,0,0,0,0|2,0,0]=4 8117 B21R2.4531 Cc1ccc(cc1)NC(F)C(=O)OCc2ccccc2 34a_100000124888_100000036447 [0,2,0,0,0,0|1,0,1]=4 8118 B21R2.4531 Cc1ccc(cc1)OC(F)C(=O)OCc2ccccc2 34a_100000210336_100000036447 [0,2,0,0,0,0|1,0,1]=4 8119 B21R2.4531 Cc1ccc(cc1)OC(F)C(=O)OCc2ccccc2 7a_100000210336_100000036447 [0,2,0,0,0,0|1,0,1]=4 8120 B21R2.4531 Cc1ccc(cc1)SC(=O)C(=O)NCc2ccccc2 11a_100015324214_100009913200 [0,2,0,0,0,0|2,0,0]=4 8121 B21R2.4531 Cc1ccc(cc1)SC(=O)C(=O)NCc2ccccc2 1626a_100015324214_100009913200 [0,2,0,0,0,0|2,0,0]=4 8122 B21R2.4531 Cc1ccc(cc1)SC(=O)C(=O)NCc2ccccc2 240690a_100015324214_100009913200 [0,2,0,0,0,0|2,0,0]=4 8123 B21R2.4531 Cc1ccc(cc1)SC(=O)C(=O)NCc2ccccc2 527a_100015324214_100009913200 [0,2,0,0,0,0|2,0,0]=4 8124 B21R2.4531 Cc1ccc(cc1)SC(F)C(=O)OCc2ccccc2 62a_100000036447_100000186775 [0,2,0,0,0,0|1,0,1]=4 8125 B21R2.4531 Cc1ccc(cc1)SC(F)C(=O)OCc2ccccc2 62a_100000186775_100000036447 [0,2,0,0,0,0|1,0,1]=4 8126 B21R2.4531 Cc1ccc(cn1)CN(C)C(=O)C=Cc2ccccc2 11a_106623407658_100000210462 [0,2,0,0,0,0|2,0,0]=4 8127 B21R2.4531 Cc1ccc(nc1)CN(C)C(=O)C=Cc2ccccc2 11a_200000717808_100000210462 [0,2,0,0,0,0|2,0,0]=4 8128 B21R2.4531 Cc1ccc(nc1)CN(C)C(=O)C=Cc2ccccc2 1626a_200000717808_100000210462 [0,2,0,0,0,0|2,0,0]=4 8129 B21R2.4531 Nc1ccc(cc1)OC(F)C(=O)OCc2ccccc2 34a_100000185829_100000036447 [0,2,0,0,0,0|1,0,1]=4 8130 B21R2.4531 Nc1ccc(cc1)SC(F)C(=O)OCc2ccccc2 62a_100000036447_100000185761 [0,2,0,0,0,0|1,0,1]=4 8131 B21R2.4531 Nc1ccc(cc1)SC(F)C(=O)OCc2ccccc2 62a_100000185761_100000036447 [0,2,0,0,0,0|1,0,1]=4 8132 B21R2.4531 O=C(NCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 1626a_100015324214_100000199041 [0,2,0,0,0,0|2,0,0]=4 8133 B21R2.4531 O=C(NCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 240690a_100015324214_100000199041 [0,2,0,0,0,0|2,0,0]=4 8134 B21R2.4531 O=C(NCc1ccccc1)C(=O)Nc2ccc(cc2)F 1626a_100015324214_100011297306 [0,2,0,0,0,0|2,0,0]=4 8135 B21R2.4531 O=C(NCc1ccccc1)C(=O)Nc2ccc(cc2)F 240690a_100015324214_100011297306 [0,2,0,0,0,0|2,0,0]=4 8136 B21R2.4531 O=C(OCc1ccccc1)C(F)Nc2ccc(cc2)Br 2230a_100000210018_100000036447 [0,2,0,0,0,0|1,0,1]=4 8137 B21R2.4531 O=C(OCc1ccccc1)C(F)Nc2ccc(cc2)Br 34a_100000210018_100000036447 [0,2,0,0,0,0|1,0,1]=4 8138 B21R2.4531 O=C(OCc1ccccc1)C(F)Nc2ccc(cc2)Cl 2230a_100000210052_100000036447 [0,2,0,0,0,0|1,0,1]=4 8139 B21R2.4531 O=C(OCc1ccccc1)C(F)Nc2ccc(cc2)Cl 34a_100000210052_100000036447 [0,2,0,0,0,0|1,0,1]=4 8140 B21R2.4531 O=C(OCc1ccccc1)C(F)Nc2ccc(cc2)F 34a_100000185862_100000036447 [0,2,0,0,0,0|1,0,1]=4 8141 B21R2.4531 O=C(OCc1ccccc1)C(F)Nc2ccc(cc2)I 34a_100000185761_100000036447 [0,2,0,0,0,0|1,0,1]=4 8142 B21R2.4531 O=C(OCc1ccccc1)C(F)Nc2ccc(cc2)O 34a_100000185829_100000036447 [0,2,0,0,0,0|1,0,1]=4 8143 B21R2.4531 O=C(OCc1ccccc1)C(F)Oc2ccc(cc2)Br 34a_100000185759_100000036447 [0,2,0,0,0,0|1,0,1]=4 8144 B21R2.4531 O=C(OCc1ccccc1)C(F)Oc2ccc(cc2)Br 7a_100000185759_100000036447 [0,2,0,0,0,0|1,0,1]=4 8145 B21R2.4531 O=C(OCc1ccccc1)C(F)Oc2ccc(cc2)Cl 34a_100000210216_100000036447 [0,2,0,0,0,0|1,0,1]=4 8146 B21R2.4531 O=C(OCc1ccccc1)C(F)Oc2ccc(cc2)Cl 7a_100000210216_100000036447 [0,2,0,0,0,0|1,0,1]=4 8147 B21R2.4531 O=C(OCc1ccccc1)C(F)Oc2ccc(cc2)F 34a_100000210339_100000036447 [0,2,0,0,0,0|1,0,1]=4 8148 B21R2.4531 O=C(OCc1ccccc1)C(F)Oc2ccc(cc2)I 34a_100000212066_100000036447 [0,2,0,0,0,0|1,0,1]=4 8149 B21R2.4531 O=C(OCc1ccccc1)C(F)Oc2ccc(cc2)I 7a_100000212066_100000036447 [0,2,0,0,0,0|1,0,1]=4 8150 B21R2.4531 O=C(OCc1ccccc1)C(F)Sc2ccc(cc2)Br 62a_100000036447_100000752885 [0,2,0,0,0,0|1,0,1]=4 8151 B21R2.4531 O=C(OCc1ccccc1)C(F)Sc2ccc(cc2)Br 62a_100000752885_100000036447 [0,2,0,0,0,0|1,0,1]=4 8152 B21R2.4531 O=C(OCc1ccccc1)C(F)Sc2ccc(cc2)Cl 62a_100000036447_100000755918 [0,2,0,0,0,0|1,0,1]=4 8153 B21R2.4531 O=C(OCc1ccccc1)C(F)Sc2ccc(cc2)Cl 62a_100000755918_100000036447 [0,2,0,0,0,0|1,0,1]=4 8154 B21R2.4531 O=C(OCc1ccccc1)C(F)Sc2ccc(cc2)F 62a_100000036447_100000211213 [0,2,0,0,0,0|1,0,1]=4 8155 B21R2.4531 O=C(OCc1ccccc1)C(F)Sc2ccc(cc2)F 62a_100000211213_100000036447 [0,2,0,0,0,0|1,0,1]=4 8156 B21R2.4531 O=C(OCc1ccccc1)C(F)Sc2ccc(cc2)O 62a_100000036447_100000185759 [0,2,0,0,0,0|1,0,1]=4 8157 B21R2.4534 Cc1ccc(cc1)C=CC(=O)CCc2ccc(cc2)Br 1458a_100000716854_100011740612 [0,2,0,0,0,0|1,0,0]=3 8158 B21R2.4534 Cc1ccc(cc1)C=CC(=O)CCc2ccc(cc2)C 1458a_100000716854_100011713686 [0,2,0,0,0,0|1,0,0]=3 8159 B21R2.4534 Cc1ccc(cc1)C=CC(=O)CCc2ccc(cc2)Cl 1458a_100000716854_100011713675 [0,2,0,0,0,0|1,0,0]=3 8160 B21R2.4534 Cc1ccc(cc1)C=CC(=O)CCc2ccc(cc2)F 1458a_100000716854_100011217392 [0,2,0,0,0,0|1,0,0]=3 8161 B21R2.4534 Cc1ccc(cc1)C=CC(=O)CCc2ccc(cc2)O 1458a_100000716854_100009816426 [0,2,0,0,0,0|1,0,0]=3 8162 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)Br 11a_100000174875_100000716854 [0,2,0,0,0,0|1,0,0]=3 8163 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)Br 1626a_100000174875_100000716854 [0,2,0,0,0,0|1,0,0]=3 8164 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)Br 240690a_100000174875_100000716854 [0,2,0,0,0,0|1,0,0]=3 8165 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)C 11a_100000174908_100000716854 [0,2,0,0,0,0|1,0,0]=3 8166 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)C 1626a_100000174908_100000716854 [0,2,0,0,0,0|1,0,0]=3 8167 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)C 240690a_100000174908_100000716854 [0,2,0,0,0,0|1,0,0]=3 8168 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)Cl 11a_100000174871_100000716854 [0,2,0,0,0,0|1,0,0]=3 8169 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)Cl 1626a_100000174871_100000716854 [0,2,0,0,0,0|1,0,0]=3 8170 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)Cl 240690a_100000174871_100000716854 [0,2,0,0,0,0|1,0,0]=3 8171 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)F 11a_100000174882_100000716854 [0,2,0,0,0,0|1,0,0]=3 8172 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)F 1626a_100000174882_100000716854 [0,2,0,0,0,0|1,0,0]=3 8173 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)F 240690a_100000174882_100000716854 [0,2,0,0,0,0|1,0,0]=3 8174 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)I 11a_100016989417_100000716854 [0,2,0,0,0,0|1,0,0]=3 8175 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)I 1626a_100016989417_100000716854 [0,2,0,0,0,0|1,0,0]=3 8176 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)I 240690a_100016989417_100000716854 [0,2,0,0,0,0|1,0,0]=3 8177 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cc2)O 240690a_100000185549_100000716854 [0,2,0,0,0,0|1,0,0]=3 8178 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)Br 11a_100015188789_100000716854 [0,2,0,0,0,0|2,0,0]=4 8179 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)Br 1626a_100015188789_100000716854 [0,2,0,0,0,0|2,0,0]=4 8180 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)Br 240690a_100015188789_100000716854 [0,2,0,0,0,0|2,0,0]=4 8181 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)C 11a_100015187455_100000716854 [0,2,0,0,0,0|2,0,0]=4 8182 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)C 1626a_100015187455_100000716854 [0,2,0,0,0,0|2,0,0]=4 8183 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)C 240690a_100015187455_100000716854 [0,2,0,0,0,0|2,0,0]=4 8184 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)Cl 11a_100000697193_100000716854 [0,2,0,0,0,0|2,0,0]=4 8185 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)Cl 1626a_100000697193_100000716854 [0,2,0,0,0,0|2,0,0]=4 8186 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)Cl 240690a_100000697193_100000716854 [0,2,0,0,0,0|2,0,0]=4 8187 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)F 11a_100020620131_100000716854 [0,2,0,0,0,0|2,0,0]=4 8188 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)F 1626a_100020620131_100000716854 [0,2,0,0,0,0|2,0,0]=4 8189 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)F 240690a_100020620131_100000716854 [0,2,0,0,0,0|2,0,0]=4 8190 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(cn2)O 240690a_100020605196_100000716854 [0,2,0,0,0,0|2,0,0]=4 8191 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)Br 11a_100009817727_100000716854 [0,2,0,0,0,0|2,0,0]=4 8192 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)Br 240690a_100009817727_100000716854 [0,2,0,0,0,0|2,0,0]=4 8193 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)C 11a_100000740942_100000716854 [0,2,0,0,0,0|2,0,0]=4 8194 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)C 1626a_100000740942_100000716854 [0,2,0,0,0,0|2,0,0]=4 8195 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)C 240690a_100000740942_100000716854 [0,2,0,0,0,0|2,0,0]=4 8196 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)Cl 11a_100000735879_100000716854 [0,2,0,0,0,0|2,0,0]=4 8197 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)Cl 1626a_100000735879_100000716854 [0,2,0,0,0,0|2,0,0]=4 8198 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)Cl 240690a_100000735879_100000716854 [0,2,0,0,0,0|2,0,0]=4 8199 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)F 11a_100000101913_100000716854 [0,2,0,0,0,0|2,0,0]=4 8200 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)F 1626a_100000101913_100000716854 [0,2,0,0,0,0|2,0,0]=4 8201 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)F 240690a_100000101913_100000716854 [0,2,0,0,0,0|2,0,0]=4 8202 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)O 11a_100000757128_100000716854 [0,2,0,0,0,0|2,0,0]=4 8203 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NCc2ccc(nc2)O 240690a_100000757128_100000716854 [0,2,0,0,0,0|2,0,0]=4 8204 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NNc2ccc(cc2)Br 22a_100000735608_100000716854 [0,2,0,0,0,0|2,0,0]=4 8205 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NNc2ccc(cc2)C 22a_100000683527_100000716854 [0,2,0,0,0,0|2,0,0]=4 8206 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NNc2ccc(cc2)Cl 22a_100000683521_100000716854 [0,2,0,0,0,0|2,0,0]=4 8207 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NNc2ccc(cc2)F 22a_100000728448_100000716854 [0,2,0,0,0,0|2,0,0]=4 8208 B21R2.4534 Cc1ccc(cc1)C=CC(=O)NNc2ccc(cc2)I 22a_100016988836_100000716854 [0,2,0,0,0,0|2,0,0]=4 8209 B21R2.4534 Cc1ccc(cc1)CCC(=O)C=Cc2ccc(cc2)Br 1458a_100016267368_100011713686 [0,2,0,0,0,0|1,0,0]=3 8210 B21R2.4534 Cc1ccc(cc1)CCC(=O)C=Cc2ccc(cc2)Cl 1458a_100000184863_100011713686 [0,2,0,0,0,0|1,0,0]=3 8211 B21R2.4534 Cc1ccc(cc1)CCC(=O)C=Cc2ccc(cc2)F 1458a_100000182136_100011713686 [0,2,0,0,0,0|1,0,0]=3 8212 B21R2.4534 Cc1ccc(cc1)CCC(=O)C=Cc2ccc(cc2)I 1458a_100102526154_100011713686 [0,2,0,0,0,0|1,0,0]=3 8213 B21R2.4534 Cc1ccc(cc1)CCC(=O)C=Cc2ccc(cn2)F 1458a_100020630499_100011713686 [0,2,0,0,0,0|2,0,0]=4 8214 B21R2.4534 Cc1ccc(cc1)CCC(=O)C=Cc2ccc(nc2)Br 1458a_100020588214_100011713686 [0,2,0,0,0,0|2,0,0]=4 8215 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)Br 11a_100000174908_100016267368 [0,2,0,0,0,0|1,0,0]=3 8216 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)Br 1626a_100000174908_100016267368 [0,2,0,0,0,0|1,0,0]=3 8217 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)Cl 11a_100000174908_100000184863 [0,2,0,0,0,0|1,0,0]=3 8218 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000174908_100000184863 [0,2,0,0,0,0|1,0,0]=3 8219 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000174908_100000184863 [0,2,0,0,0,0|1,0,0]=3 8220 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)F 11a_100000174908_100000182136 [0,2,0,0,0,0|1,0,0]=3 8221 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)F 1626a_100000174908_100000182136 [0,2,0,0,0,0|1,0,0]=3 8222 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)F 240690a_100000174908_100000182136 [0,2,0,0,0,0|1,0,0]=3 8223 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)I 11a_100000174908_100102526154 [0,2,0,0,0,0|1,0,0]=3 8224 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)I 1626a_100000174908_100102526154 [0,2,0,0,0,0|1,0,0]=3 8225 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)I 240690a_100000174908_100102526154 [0,2,0,0,0,0|1,0,0]=3 8226 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cc2)O 240690a_100000174908_100016269017 [0,2,0,0,0,0|1,0,0]=3 8227 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cn2)F 11a_100000174908_100020630499 [0,2,0,0,0,0|2,0,0]=4 8228 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cn2)F 1626a_100000174908_100020630499 [0,2,0,0,0,0|2,0,0]=4 8229 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(cn2)F 240690a_100000174908_100020630499 [0,2,0,0,0,0|2,0,0]=4 8230 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(nc2)Br 11a_100000174908_100020588214 [0,2,0,0,0,0|2,0,0]=4 8231 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(nc2)Br 1626a_100000174908_100020588214 [0,2,0,0,0,0|2,0,0]=4 8232 B21R2.4534 Cc1ccc(cc1)CNC(=O)C=Cc2ccc(nc2)Br 240690a_100000174908_100020588214 [0,2,0,0,0,0|2,0,0]=4 8233 B21R2.4534 Cc1ccc(cc1)NNC(=O)C=Cc2ccc(cc2)Br 22a_100000683527_100016267368 [0,2,0,0,0,0|2,0,0]=4 8234 B21R2.4534 Cc1ccc(cc1)NNC(=O)C=Cc2ccc(cc2)Cl 22a_100000683527_100000184863 [0,2,0,0,0,0|2,0,0]=4 8235 B21R2.4534 Cc1ccc(cc1)NNC(=O)C=Cc2ccc(cc2)F 22a_100000683527_100000182136 [0,2,0,0,0,0|2,0,0]=4 8236 B21R2.4534 Cc1ccc(cc1)NNC(=O)C=Cc2ccc(cc2)I 22a_100000683527_100102526154 [0,2,0,0,0,0|2,0,0]=4 8237 B21R2.4534 Cc1ccc(cc1)NNC(=O)C=Cc2ccc(cc2)O 22a_100000683527_100016269017 [0,2,0,0,0,0|2,0,0]=4 8238 B21R2.4534 Cc1ccc(cc1)SCC(=O)C=Cc2ccc(cc2)Br 6a_100000186029_100000172844 [0,2,0,0,0,0|2,0,0]=4 8239 B21R2.4534 Cc1ccc(cc1)SCC(=O)C=Cc2ccc(cc2)F 6a_100000210084_100000172844 [0,2,0,0,0,0|2,0,0]=4 8240 B21R2.4534 Cc1ccc(cc1)SCC(=O)C=Cc2ccc(cc2)I 6a_100000188517_100000172844 [0,2,0,0,0,0|2,0,0]=4 8241 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)Br 11a_100000740942_100016267368 [0,2,0,0,0,0|2,0,0]=4 8242 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)Br 1626a_100000740942_100016267368 [0,2,0,0,0,0|2,0,0]=4 8243 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)Cl 11a_100000740942_100000184863 [0,2,0,0,0,0|2,0,0]=4 8244 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000740942_100000184863 [0,2,0,0,0,0|2,0,0]=4 8245 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000740942_100000184863 [0,2,0,0,0,0|2,0,0]=4 8246 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)F 11a_100000740942_100000182136 [0,2,0,0,0,0|2,0,0]=4 8247 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)F 1626a_100000740942_100000182136 [0,2,0,0,0,0|2,0,0]=4 8248 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)F 240690a_100000740942_100000182136 [0,2,0,0,0,0|2,0,0]=4 8249 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)I 11a_100000740942_100102526154 [0,2,0,0,0,0|2,0,0]=4 8250 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)I 1626a_100000740942_100102526154 [0,2,0,0,0,0|2,0,0]=4 8251 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)I 240690a_100000740942_100102526154 [0,2,0,0,0,0|2,0,0]=4 8252 B21R2.4534 Cc1ccc(cn1)CNC(=O)C=Cc2ccc(cc2)O 240690a_100000740942_100016269017 [0,2,0,0,0,0|2,0,0]=4 8253 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)Br 11a_100015187455_100016267368 [0,2,0,0,0,0|2,0,0]=4 8254 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)Br 1626a_100015187455_100016267368 [0,2,0,0,0,0|2,0,0]=4 8255 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)Cl 11a_100015187455_100000184863 [0,2,0,0,0,0|2,0,0]=4 8256 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100015187455_100000184863 [0,2,0,0,0,0|2,0,0]=4 8257 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100015187455_100000184863 [0,2,0,0,0,0|2,0,0]=4 8258 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)F 11a_100015187455_100000182136 [0,2,0,0,0,0|2,0,0]=4 8259 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)F 1626a_100015187455_100000182136 [0,2,0,0,0,0|2,0,0]=4 8260 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)F 240690a_100015187455_100000182136 [0,2,0,0,0,0|2,0,0]=4 8261 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)I 11a_100015187455_100102526154 [0,2,0,0,0,0|2,0,0]=4 8262 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)I 1626a_100015187455_100102526154 [0,2,0,0,0,0|2,0,0]=4 8263 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)I 240690a_100015187455_100102526154 [0,2,0,0,0,0|2,0,0]=4 8264 B21R2.4534 Cc1ccc(nc1)CNC(=O)C=Cc2ccc(cc2)O 240690a_100015187455_100016269017 [0,2,0,0,0,0|2,0,0]=4 8265 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CCc2ccc(cc2)Br 1458a_100016267368_100011740612 [0,2,0,0,0,0|1,0,0]=3 8266 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CCc2ccc(cc2)Cl 1458a_100016267368_100011713675 [0,2,0,0,0,0|1,0,0]=3 8267 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CCc2ccc(cc2)Cl 6a_100000186029_100011279170 [0,2,0,0,0,0|1,0,0]=3 8268 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CCc2ccc(cc2)F 1458a_100016267368_100011217392 [0,2,0,0,0,0|1,0,0]=3 8269 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CCc2ccc(cc2)F 6a_100000186029_100000743244 [0,2,0,0,0,0|1,0,0]=3 8270 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CCc2ccc(cc2)I 6a_100000186029_100000723691 [0,2,0,0,0,0|1,0,0]=3 8271 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CCc2ccc(cc2)O 1458a_100016267368_100009816426 [0,2,0,0,0,0|1,0,0]=3 8272 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CCc2ccc(cc2)O 6a_100000186029_100000198047 [0,2,0,0,0,0|1,0,0]=3 8273 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)COc2ccc(cc2)Cl 6a_100000186029_200000150450 [0,2,0,0,0,0|2,0,0]=4 8274 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CSc2ccc(cc2)Cl 6a_100000186029_100000150472 [0,2,0,0,0,0|2,0,0]=4 8275 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)CSc2ccc(cc2)F 6a_100000186029_200000148136 [0,2,0,0,0,0|2,0,0]=4 8276 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cc2)Br 11a_100000174875_100016267368 [0,2,0,0,0,0|1,0,0]=3 8277 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cc2)Br 1626a_100000174875_100016267368 [0,2,0,0,0,0|1,0,0]=3 8278 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cc2)Cl 11a_100000174871_100016267368 [0,2,0,0,0,0|1,0,0]=3 8279 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cc2)Cl 1626a_100000174871_100016267368 [0,2,0,0,0,0|1,0,0]=3 8280 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cc2)F 11a_100000174882_100016267368 [0,2,0,0,0,0|1,0,0]=3 8281 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cc2)F 1626a_100000174882_100016267368 [0,2,0,0,0,0|1,0,0]=3 8282 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cc2)I 11a_100016989417_100016267368 [0,2,0,0,0,0|1,0,0]=3 8283 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cc2)I 1626a_100016989417_100016267368 [0,2,0,0,0,0|1,0,0]=3 8284 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cn2)Br 11a_100015188789_100016267368 [0,2,0,0,0,0|2,0,0]=4 8285 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cn2)Br 1626a_100015188789_100016267368 [0,2,0,0,0,0|2,0,0]=4 8286 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cn2)Cl 11a_100000697193_100016267368 [0,2,0,0,0,0|2,0,0]=4 8287 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cn2)Cl 1626a_100000697193_100016267368 [0,2,0,0,0,0|2,0,0]=4 8288 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cn2)F 11a_100020620131_100016267368 [0,2,0,0,0,0|2,0,0]=4 8289 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(cn2)F 1626a_100020620131_100016267368 [0,2,0,0,0,0|2,0,0]=4 8290 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(nc2)Br 11a_100009817727_100016267368 [0,2,0,0,0,0|2,0,0]=4 8291 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(nc2)Cl 11a_100000735879_100016267368 [0,2,0,0,0,0|2,0,0]=4 8292 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(nc2)Cl 1626a_100000735879_100016267368 [0,2,0,0,0,0|2,0,0]=4 8293 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(nc2)F 11a_100000101913_100016267368 [0,2,0,0,0,0|2,0,0]=4 8294 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(nc2)F 1626a_100000101913_100016267368 [0,2,0,0,0,0|2,0,0]=4 8295 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NCc2ccc(nc2)O 11a_100000757128_100016267368 [0,2,0,0,0,0|2,0,0]=4 8296 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NNc2ccc(cc2)Br 22a_100000735608_100016267368 [0,2,0,0,0,0|2,0,0]=4 8297 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NNc2ccc(cc2)Cl 22a_100000683521_100016267368 [0,2,0,0,0,0|2,0,0]=4 8298 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NNc2ccc(cc2)F 22a_100000728448_100016267368 [0,2,0,0,0,0|2,0,0]=4 8299 B21R2.4534 O=C(C=Cc1ccc(cc1)Br)NNc2ccc(cc2)I 22a_100016988836_100016267368 [0,2,0,0,0,0|2,0,0]=4 8300 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)CCc2ccc(cc2)Br 1458a_100000184863_100011740612 [0,2,0,0,0,0|1,0,0]=3 8301 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)CCc2ccc(cc2)Cl 1458a_100000184863_100011713675 [0,2,0,0,0,0|1,0,0]=3 8302 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)CCc2ccc(cc2)F 1458a_100000184863_100011217392 [0,2,0,0,0,0|1,0,0]=3 8303 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)CCc2ccc(cc2)O 1458a_100000184863_100009816426 [0,2,0,0,0,0|1,0,0]=3 8304 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)Br 11a_100000174875_100000184863 [0,2,0,0,0,0|1,0,0]=3 8305 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)Br 1626a_100000174875_100000184863 [0,2,0,0,0,0|1,0,0]=3 8306 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)Br 240690a_100000174875_100000184863 [0,2,0,0,0,0|1,0,0]=3 8307 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)Cl 11a_100000174871_100000184863 [0,2,0,0,0,0|1,0,0]=3 8308 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)Cl 1626a_100000174871_100000184863 [0,2,0,0,0,0|1,0,0]=3 8309 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)Cl 240690a_100000174871_100000184863 [0,2,0,0,0,0|1,0,0]=3 8310 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)F 11a_100000174882_100000184863 [0,2,0,0,0,0|1,0,0]=3 8311 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)F 1626a_100000174882_100000184863 [0,2,0,0,0,0|1,0,0]=3 8312 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)F 240690a_100000174882_100000184863 [0,2,0,0,0,0|1,0,0]=3 8313 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)I 11a_100016989417_100000184863 [0,2,0,0,0,0|1,0,0]=3 8314 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)I 1626a_100016989417_100000184863 [0,2,0,0,0,0|1,0,0]=3 8315 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)I 240690a_100016989417_100000184863 [0,2,0,0,0,0|1,0,0]=3 8316 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cc2)O 240690a_100000185549_100000184863 [0,2,0,0,0,0|1,0,0]=3 8317 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)Br 11a_100015188789_100000184863 [0,2,0,0,0,0|2,0,0]=4 8318 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)Br 1626a_100015188789_100000184863 [0,2,0,0,0,0|2,0,0]=4 8319 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)Br 240690a_100015188789_100000184863 [0,2,0,0,0,0|2,0,0]=4 8320 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)Cl 11a_100000697193_100000184863 [0,2,0,0,0,0|2,0,0]=4 8321 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)Cl 1626a_100000697193_100000184863 [0,2,0,0,0,0|2,0,0]=4 8322 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)Cl 240690a_100000697193_100000184863 [0,2,0,0,0,0|2,0,0]=4 8323 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)F 11a_100020620131_100000184863 [0,2,0,0,0,0|2,0,0]=4 8324 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)F 1626a_100020620131_100000184863 [0,2,0,0,0,0|2,0,0]=4 8325 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)F 240690a_100020620131_100000184863 [0,2,0,0,0,0|2,0,0]=4 8326 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(cn2)O 240690a_100020605196_100000184863 [0,2,0,0,0,0|2,0,0]=4 8327 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)Br 11a_100009817727_100000184863 [0,2,0,0,0,0|2,0,0]=4 8328 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)Br 240690a_100009817727_100000184863 [0,2,0,0,0,0|2,0,0]=4 8329 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)Cl 11a_100000735879_100000184863 [0,2,0,0,0,0|2,0,0]=4 8330 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)Cl 1626a_100000735879_100000184863 [0,2,0,0,0,0|2,0,0]=4 8331 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)Cl 240690a_100000735879_100000184863 [0,2,0,0,0,0|2,0,0]=4 8332 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)F 11a_100000101913_100000184863 [0,2,0,0,0,0|2,0,0]=4 8333 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)F 1626a_100000101913_100000184863 [0,2,0,0,0,0|2,0,0]=4 8334 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)F 240690a_100000101913_100000184863 [0,2,0,0,0,0|2,0,0]=4 8335 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)O 11a_100000757128_100000184863 [0,2,0,0,0,0|2,0,0]=4 8336 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NCc2ccc(nc2)O 240690a_100000757128_100000184863 [0,2,0,0,0,0|2,0,0]=4 8337 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NNc2ccc(cc2)Br 22a_100000735608_100000184863 [0,2,0,0,0,0|2,0,0]=4 8338 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NNc2ccc(cc2)Cl 22a_100000683521_100000184863 [0,2,0,0,0,0|2,0,0]=4 8339 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NNc2ccc(cc2)F 22a_100000728448_100000184863 [0,2,0,0,0,0|2,0,0]=4 8340 B21R2.4534 O=C(C=Cc1ccc(cc1)Cl)NNc2ccc(cc2)I 22a_100016988836_100000184863 [0,2,0,0,0,0|2,0,0]=4 8341 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CCc2ccc(cc2)Br 1458a_100000182136_100011740612 [0,2,0,0,0,0|1,0,0]=3 8342 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CCc2ccc(cc2)Cl 1458a_100000182136_100011713675 [0,2,0,0,0,0|1,0,0]=3 8343 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CCc2ccc(cc2)Cl 6a_100000210084_100011279170 [0,2,0,0,0,0|1,0,0]=3 8344 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CCc2ccc(cc2)F 1458a_100000182136_100011217392 [0,2,0,0,0,0|1,0,0]=3 8345 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CCc2ccc(cc2)F 6a_100000210084_100000743244 [0,2,0,0,0,0|1,0,0]=3 8346 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CCc2ccc(cc2)I 6a_100000210084_100000723691 [0,2,0,0,0,0|1,0,0]=3 8347 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CCc2ccc(cc2)O 1458a_100000182136_100009816426 [0,2,0,0,0,0|1,0,0]=3 8348 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CCc2ccc(cc2)O 6a_100000210084_100000198047 [0,2,0,0,0,0|1,0,0]=3 8349 B21R2.4534 O=C(C=Cc1ccc(cc1)F)COc2ccc(cc2)Cl 6a_100000210084_200000150450 [0,2,0,0,0,0|2,0,0]=4 8350 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CSc2ccc(cc2)Cl 6a_100000210084_100000150472 [0,2,0,0,0,0|2,0,0]=4 8351 B21R2.4534 O=C(C=Cc1ccc(cc1)F)CSc2ccc(cc2)F 6a_100000210084_200000148136 [0,2,0,0,0,0|2,0,0]=4 8352 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)Br 11a_100000174875_100000182136 [0,2,0,0,0,0|1,0,0]=3 8353 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)Br 1626a_100000174875_100000182136 [0,2,0,0,0,0|1,0,0]=3 8354 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)Br 240690a_100000174875_100000182136 [0,2,0,0,0,0|1,0,0]=3 8355 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)Cl 11a_100000174871_100000182136 [0,2,0,0,0,0|1,0,0]=3 8356 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)Cl 1626a_100000174871_100000182136 [0,2,0,0,0,0|1,0,0]=3 8357 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)Cl 240690a_100000174871_100000182136 [0,2,0,0,0,0|1,0,0]=3 8358 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)F 11a_100000174882_100000182136 [0,2,0,0,0,0|1,0,0]=3 8359 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)F 1626a_100000174882_100000182136 [0,2,0,0,0,0|1,0,0]=3 8360 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)F 240690a_100000174882_100000182136 [0,2,0,0,0,0|1,0,0]=3 8361 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)I 11a_100016989417_100000182136 [0,2,0,0,0,0|1,0,0]=3 8362 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)I 1626a_100016989417_100000182136 [0,2,0,0,0,0|1,0,0]=3 8363 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)I 240690a_100016989417_100000182136 [0,2,0,0,0,0|1,0,0]=3 8364 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cc2)O 240690a_100000185549_100000182136 [0,2,0,0,0,0|1,0,0]=3 8365 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)Br 11a_100015188789_100000182136 [0,2,0,0,0,0|2,0,0]=4 8366 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)Br 1626a_100015188789_100000182136 [0,2,0,0,0,0|2,0,0]=4 8367 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)Br 240690a_100015188789_100000182136 [0,2,0,0,0,0|2,0,0]=4 8368 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)Cl 11a_100000697193_100000182136 [0,2,0,0,0,0|2,0,0]=4 8369 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)Cl 1626a_100000697193_100000182136 [0,2,0,0,0,0|2,0,0]=4 8370 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)Cl 240690a_100000697193_100000182136 [0,2,0,0,0,0|2,0,0]=4 8371 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)F 11a_100020620131_100000182136 [0,2,0,0,0,0|2,0,0]=4 8372 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)F 1626a_100020620131_100000182136 [0,2,0,0,0,0|2,0,0]=4 8373 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)F 240690a_100020620131_100000182136 [0,2,0,0,0,0|2,0,0]=4 8374 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(cn2)O 240690a_100020605196_100000182136 [0,2,0,0,0,0|2,0,0]=4 8375 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)Br 11a_100009817727_100000182136 [0,2,0,0,0,0|2,0,0]=4 8376 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)Br 240690a_100009817727_100000182136 [0,2,0,0,0,0|2,0,0]=4 8377 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)Cl 11a_100000735879_100000182136 [0,2,0,0,0,0|2,0,0]=4 8378 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)Cl 1626a_100000735879_100000182136 [0,2,0,0,0,0|2,0,0]=4 8379 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)Cl 240690a_100000735879_100000182136 [0,2,0,0,0,0|2,0,0]=4 8380 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)F 11a_100000101913_100000182136 [0,2,0,0,0,0|2,0,0]=4 8381 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)F 1626a_100000101913_100000182136 [0,2,0,0,0,0|2,0,0]=4 8382 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)F 240690a_100000101913_100000182136 [0,2,0,0,0,0|2,0,0]=4 8383 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)O 11a_100000757128_100000182136 [0,2,0,0,0,0|2,0,0]=4 8384 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NCc2ccc(nc2)O 240690a_100000757128_100000182136 [0,2,0,0,0,0|2,0,0]=4 8385 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NNc2ccc(cc2)Br 22a_100000735608_100000182136 [0,2,0,0,0,0|2,0,0]=4 8386 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NNc2ccc(cc2)Cl 22a_100000683521_100000182136 [0,2,0,0,0,0|2,0,0]=4 8387 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NNc2ccc(cc2)F 22a_100000728448_100000182136 [0,2,0,0,0,0|2,0,0]=4 8388 B21R2.4534 O=C(C=Cc1ccc(cc1)F)NNc2ccc(cc2)I 22a_100016988836_100000182136 [0,2,0,0,0,0|2,0,0]=4 8389 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CCc2ccc(cc2)Br 1458a_100102526154_100011740612 [0,2,0,0,0,0|1,0,0]=3 8390 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CCc2ccc(cc2)Cl 1458a_100102526154_100011713675 [0,2,0,0,0,0|1,0,0]=3 8391 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CCc2ccc(cc2)Cl 6a_100000188517_100011279170 [0,2,0,0,0,0|1,0,0]=3 8392 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CCc2ccc(cc2)F 1458a_100102526154_100011217392 [0,2,0,0,0,0|1,0,0]=3 8393 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CCc2ccc(cc2)F 6a_100000188517_100000743244 [0,2,0,0,0,0|1,0,0]=3 8394 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CCc2ccc(cc2)I 6a_100000188517_100000723691 [0,2,0,0,0,0|1,0,0]=3 8395 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CCc2ccc(cc2)O 1458a_100102526154_100009816426 [0,2,0,0,0,0|1,0,0]=3 8396 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CCc2ccc(cc2)O 6a_100000188517_100000198047 [0,2,0,0,0,0|1,0,0]=3 8397 B21R2.4534 O=C(C=Cc1ccc(cc1)I)COc2ccc(cc2)Cl 6a_100000188517_200000150450 [0,2,0,0,0,0|2,0,0]=4 8398 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CSc2ccc(cc2)Cl 6a_100000188517_100000150472 [0,2,0,0,0,0|2,0,0]=4 8399 B21R2.4534 O=C(C=Cc1ccc(cc1)I)CSc2ccc(cc2)F 6a_100000188517_200000148136 [0,2,0,0,0,0|2,0,0]=4 8400 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)Br 11a_100000174875_100102526154 [0,2,0,0,0,0|1,0,0]=3 8401 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)Br 1626a_100000174875_100102526154 [0,2,0,0,0,0|1,0,0]=3 8402 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)Br 240690a_100000174875_100102526154 [0,2,0,0,0,0|1,0,0]=3 8403 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)Cl 11a_100000174871_100102526154 [0,2,0,0,0,0|1,0,0]=3 8404 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)Cl 1626a_100000174871_100102526154 [0,2,0,0,0,0|1,0,0]=3 8405 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)Cl 240690a_100000174871_100102526154 [0,2,0,0,0,0|1,0,0]=3 8406 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)F 11a_100000174882_100102526154 [0,2,0,0,0,0|1,0,0]=3 8407 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)F 1626a_100000174882_100102526154 [0,2,0,0,0,0|1,0,0]=3 8408 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)F 240690a_100000174882_100102526154 [0,2,0,0,0,0|1,0,0]=3 8409 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)I 11a_100016989417_100102526154 [0,2,0,0,0,0|1,0,0]=3 8410 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)I 1626a_100016989417_100102526154 [0,2,0,0,0,0|1,0,0]=3 8411 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)I 240690a_100016989417_100102526154 [0,2,0,0,0,0|1,0,0]=3 8412 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cc2)O 240690a_100000185549_100102526154 [0,2,0,0,0,0|1,0,0]=3 8413 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)Br 11a_100015188789_100102526154 [0,2,0,0,0,0|2,0,0]=4 8414 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)Br 1626a_100015188789_100102526154 [0,2,0,0,0,0|2,0,0]=4 8415 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)Br 240690a_100015188789_100102526154 [0,2,0,0,0,0|2,0,0]=4 8416 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)Cl 11a_100000697193_100102526154 [0,2,0,0,0,0|2,0,0]=4 8417 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)Cl 1626a_100000697193_100102526154 [0,2,0,0,0,0|2,0,0]=4 8418 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)Cl 240690a_100000697193_100102526154 [0,2,0,0,0,0|2,0,0]=4 8419 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)F 11a_100020620131_100102526154 [0,2,0,0,0,0|2,0,0]=4 8420 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)F 1626a_100020620131_100102526154 [0,2,0,0,0,0|2,0,0]=4 8421 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)F 240690a_100020620131_100102526154 [0,2,0,0,0,0|2,0,0]=4 8422 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(cn2)O 240690a_100020605196_100102526154 [0,2,0,0,0,0|2,0,0]=4 8423 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)Br 11a_100009817727_100102526154 [0,2,0,0,0,0|2,0,0]=4 8424 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)Br 240690a_100009817727_100102526154 [0,2,0,0,0,0|2,0,0]=4 8425 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)Cl 11a_100000735879_100102526154 [0,2,0,0,0,0|2,0,0]=4 8426 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)Cl 1626a_100000735879_100102526154 [0,2,0,0,0,0|2,0,0]=4 8427 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)Cl 240690a_100000735879_100102526154 [0,2,0,0,0,0|2,0,0]=4 8428 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)F 11a_100000101913_100102526154 [0,2,0,0,0,0|2,0,0]=4 8429 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)F 1626a_100000101913_100102526154 [0,2,0,0,0,0|2,0,0]=4 8430 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)F 240690a_100000101913_100102526154 [0,2,0,0,0,0|2,0,0]=4 8431 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)O 11a_100000757128_100102526154 [0,2,0,0,0,0|2,0,0]=4 8432 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NCc2ccc(nc2)O 240690a_100000757128_100102526154 [0,2,0,0,0,0|2,0,0]=4 8433 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NNc2ccc(cc2)Br 22a_100000735608_100102526154 [0,2,0,0,0,0|2,0,0]=4 8434 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NNc2ccc(cc2)Cl 22a_100000683521_100102526154 [0,2,0,0,0,0|2,0,0]=4 8435 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NNc2ccc(cc2)F 22a_100000728448_100102526154 [0,2,0,0,0,0|2,0,0]=4 8436 B21R2.4534 O=C(C=Cc1ccc(cc1)I)NNc2ccc(cc2)I 22a_100016988836_100102526154 [0,2,0,0,0,0|2,0,0]=4 8437 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cc2)Br 240690a_100000174875_100016269017 [0,2,0,0,0,0|1,0,0]=3 8438 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cc2)Cl 240690a_100000174871_100016269017 [0,2,0,0,0,0|1,0,0]=3 8439 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cc2)F 240690a_100000174882_100016269017 [0,2,0,0,0,0|1,0,0]=3 8440 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cc2)I 240690a_100016989417_100016269017 [0,2,0,0,0,0|1,0,0]=3 8441 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cc2)O 240690a_100000185549_100016269017 [0,2,0,0,0,0|1,0,0]=3 8442 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cn2)Br 240690a_100015188789_100016269017 [0,2,0,0,0,0|2,0,0]=4 8443 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cn2)Cl 240690a_100000697193_100016269017 [0,2,0,0,0,0|2,0,0]=4 8444 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cn2)F 240690a_100020620131_100016269017 [0,2,0,0,0,0|2,0,0]=4 8445 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(cn2)O 240690a_100020605196_100016269017 [0,2,0,0,0,0|2,0,0]=4 8446 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(nc2)Br 240690a_100009817727_100016269017 [0,2,0,0,0,0|2,0,0]=4 8447 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(nc2)Cl 240690a_100000735879_100016269017 [0,2,0,0,0,0|2,0,0]=4 8448 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(nc2)F 240690a_100000101913_100016269017 [0,2,0,0,0,0|2,0,0]=4 8449 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NCc2ccc(nc2)O 240690a_100000757128_100016269017 [0,2,0,0,0,0|2,0,0]=4 8450 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NNc2ccc(cc2)Br 22a_100000735608_100016269017 [0,2,0,0,0,0|2,0,0]=4 8451 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NNc2ccc(cc2)Cl 22a_100000683521_100016269017 [0,2,0,0,0,0|2,0,0]=4 8452 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NNc2ccc(cc2)F 22a_100000728448_100016269017 [0,2,0,0,0,0|2,0,0]=4 8453 B21R2.4534 O=C(C=Cc1ccc(cc1)O)NNc2ccc(cc2)I 22a_100016988836_100016269017 [0,2,0,0,0,0|2,0,0]=4 8454 B21R2.4534 O=C(C=Cc1ccc(cn1)Br)CCc2ccc(cc2)Cl 6a_100000754260_100011279170 [0,2,0,0,0,0|2,0,0]=4 8455 B21R2.4534 O=C(C=Cc1ccc(cn1)Br)CCc2ccc(cc2)F 6a_100000754260_100000743244 [0,2,0,0,0,0|2,0,0]=4 8456 B21R2.4534 O=C(C=Cc1ccc(cn1)Br)CCc2ccc(cc2)I 6a_100000754260_100000723691 [0,2,0,0,0,0|2,0,0]=4 8457 B21R2.4534 O=C(C=Cc1ccc(cn1)Br)CCc2ccc(cc2)O 6a_100000754260_100000198047 [0,2,0,0,0,0|2,0,0]=4 8458 B21R2.4534 O=C(C=Cc1ccc(cn1)F)CCc2ccc(cc2)Br 1458a_100020630499_100011740612 [0,2,0,0,0,0|2,0,0]=4 8459 B21R2.4534 O=C(C=Cc1ccc(cn1)F)CCc2ccc(cc2)Cl 1458a_100020630499_100011713675 [0,2,0,0,0,0|2,0,0]=4 8460 B21R2.4534 O=C(C=Cc1ccc(cn1)F)CCc2ccc(cc2)Cl 6a_100011934744_100011279170 [0,2,0,0,0,0|2,0,0]=4 8461 B21R2.4534 O=C(C=Cc1ccc(cn1)F)CCc2ccc(cc2)F 1458a_100020630499_100011217392 [0,2,0,0,0,0|2,0,0]=4 8462 B21R2.4534 O=C(C=Cc1ccc(cn1)F)CCc2ccc(cc2)F 6a_100011934744_100000743244 [0,2,0,0,0,0|2,0,0]=4 8463 B21R2.4534 O=C(C=Cc1ccc(cn1)F)CCc2ccc(cc2)I 6a_100011934744_100000723691 [0,2,0,0,0,0|2,0,0]=4 8464 B21R2.4534 O=C(C=Cc1ccc(cn1)F)CCc2ccc(cc2)O 1458a_100020630499_100009816426 [0,2,0,0,0,0|2,0,0]=4 8465 B21R2.4534 O=C(C=Cc1ccc(cn1)F)CCc2ccc(cc2)O 6a_100011934744_100000198047 [0,2,0,0,0,0|2,0,0]=4 8466 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)Br 11a_100000174875_100020630499 [0,2,0,0,0,0|2,0,0]=4 8467 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)Br 1626a_100000174875_100020630499 [0,2,0,0,0,0|2,0,0]=4 8468 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)Br 240690a_100000174875_100020630499 [0,2,0,0,0,0|2,0,0]=4 8469 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)Cl 11a_100000174871_100020630499 [0,2,0,0,0,0|2,0,0]=4 8470 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)Cl 1626a_100000174871_100020630499 [0,2,0,0,0,0|2,0,0]=4 8471 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)Cl 240690a_100000174871_100020630499 [0,2,0,0,0,0|2,0,0]=4 8472 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)F 11a_100000174882_100020630499 [0,2,0,0,0,0|2,0,0]=4 8473 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)F 1626a_100000174882_100020630499 [0,2,0,0,0,0|2,0,0]=4 8474 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)F 240690a_100000174882_100020630499 [0,2,0,0,0,0|2,0,0]=4 8475 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)I 11a_100016989417_100020630499 [0,2,0,0,0,0|2,0,0]=4 8476 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)I 1626a_100016989417_100020630499 [0,2,0,0,0,0|2,0,0]=4 8477 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)I 240690a_100016989417_100020630499 [0,2,0,0,0,0|2,0,0]=4 8478 B21R2.4534 O=C(C=Cc1ccc(cn1)F)NCc2ccc(cc2)O 240690a_100000185549_100020630499 [0,2,0,0,0,0|2,0,0]=4 8479 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)CCc2ccc(cc2)Br 1458a_100020588214_100011740612 [0,2,0,0,0,0|2,0,0]=4 8480 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)CCc2ccc(cc2)Cl 1458a_100020588214_100011713675 [0,2,0,0,0,0|2,0,0]=4 8481 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)CCc2ccc(cc2)F 1458a_100020588214_100011217392 [0,2,0,0,0,0|2,0,0]=4 8482 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)CCc2ccc(cc2)O 1458a_100020588214_100009816426 [0,2,0,0,0,0|2,0,0]=4 8483 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)Br 11a_100000174875_100020588214 [0,2,0,0,0,0|2,0,0]=4 8484 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)Br 1626a_100000174875_100020588214 [0,2,0,0,0,0|2,0,0]=4 8485 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)Br 240690a_100000174875_100020588214 [0,2,0,0,0,0|2,0,0]=4 8486 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)Cl 11a_100000174871_100020588214 [0,2,0,0,0,0|2,0,0]=4 8487 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)Cl 1626a_100000174871_100020588214 [0,2,0,0,0,0|2,0,0]=4 8488 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)Cl 240690a_100000174871_100020588214 [0,2,0,0,0,0|2,0,0]=4 8489 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)F 11a_100000174882_100020588214 [0,2,0,0,0,0|2,0,0]=4 8490 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)F 1626a_100000174882_100020588214 [0,2,0,0,0,0|2,0,0]=4 8491 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)F 240690a_100000174882_100020588214 [0,2,0,0,0,0|2,0,0]=4 8492 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)I 11a_100016989417_100020588214 [0,2,0,0,0,0|2,0,0]=4 8493 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)I 1626a_100016989417_100020588214 [0,2,0,0,0,0|2,0,0]=4 8494 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)I 240690a_100016989417_100020588214 [0,2,0,0,0,0|2,0,0]=4 8495 B21R2.4534 O=C(C=Cc1ccc(nc1)Br)NCc2ccc(cc2)O 240690a_100000185549_100020588214 [0,2,0,0,0,0|2,0,0]=4 8496 B21R2.18991 CC(=CC(=O)CCc1ccc(cc1)Br)c2ccccc2 1458a_100000743005_100011740612 [0,2,0,0,0,0|1,0,0]=3 8497 B21R2.18991 CC(=CC(=O)CCc1ccc(cc1)C)c2ccccc2 1458a_100000743005_100011713686 [0,2,0,0,0,0|1,0,0]=3 8498 B21R2.18991 CC(=CC(=O)CCc1ccc(cc1)Cl)c2ccccc2 1458a_100000743005_100011713675 [0,2,0,0,0,0|1,0,0]=3 8499 B21R2.18991 CC(=CC(=O)CCc1ccc(cc1)F)c2ccccc2 1458a_100000743005_100011217392 [0,2,0,0,0,0|1,0,0]=3 8500 B21R2.18991 CC(=CC(=O)CCc1ccc(cc1)O)c2ccccc2 1458a_100000743005_100009816426 [0,2,0,0,0,0|1,0,0]=3 8501 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)Br)c2ccccc2 11a_100000174875_100000743005 [0,2,0,0,0,0|1,0,0]=3 8502 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)Br)c2ccccc2 1626a_100000174875_100000743005 [0,2,0,0,0,0|1,0,0]=3 8503 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)Br)c2ccccc2 240690a_100000174875_100000743005 [0,2,0,0,0,0|1,0,0]=3 8504 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)Br)c2ccccc2 527a_100000174875_100000743005 [0,2,0,0,0,0|1,0,0]=3 8505 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)C)c2ccccc2 11a_100000174908_100000743005 [0,2,0,0,0,0|1,0,0]=3 8506 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)C)c2ccccc2 1626a_100000174908_100000743005 [0,2,0,0,0,0|1,0,0]=3 8507 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)C)c2ccccc2 240690a_100000174908_100000743005 [0,2,0,0,0,0|1,0,0]=3 8508 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)C)c2ccccc2 527a_100000174908_100000743005 [0,2,0,0,0,0|1,0,0]=3 8509 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)Cl)c2ccccc2 11a_100000174871_100000743005 [0,2,0,0,0,0|1,0,0]=3 8510 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)Cl)c2ccccc2 1626a_100000174871_100000743005 [0,2,0,0,0,0|1,0,0]=3 8511 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)Cl)c2ccccc2 240690a_100000174871_100000743005 [0,2,0,0,0,0|1,0,0]=3 8512 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)Cl)c2ccccc2 527a_100000174871_100000743005 [0,2,0,0,0,0|1,0,0]=3 8513 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)F)c2ccccc2 11a_100000174882_100000743005 [0,2,0,0,0,0|1,0,0]=3 8514 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)F)c2ccccc2 1626a_100000174882_100000743005 [0,2,0,0,0,0|1,0,0]=3 8515 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)F)c2ccccc2 240690a_100000174882_100000743005 [0,2,0,0,0,0|1,0,0]=3 8516 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)F)c2ccccc2 527a_100000174882_100000743005 [0,2,0,0,0,0|1,0,0]=3 8517 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)I)c2ccccc2 11a_100016989417_100000743005 [0,2,0,0,0,0|1,0,0]=3 8518 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)I)c2ccccc2 1626a_100016989417_100000743005 [0,2,0,0,0,0|1,0,0]=3 8519 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)I)c2ccccc2 240690a_100016989417_100000743005 [0,2,0,0,0,0|1,0,0]=3 8520 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)I)c2ccccc2 527a_100016989417_100000743005 [0,2,0,0,0,0|1,0,0]=3 8521 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)O)c2ccccc2 240690a_100000185549_100000743005 [0,2,0,0,0,0|1,0,0]=3 8522 B21R2.18991 CC(=CC(=O)NCc1ccc(cc1)O)c2ccccc2 527a_100000185549_100000743005 [0,2,0,0,0,0|1,0,0]=3 8523 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)Br)c2ccccc2 11a_100015188789_100000743005 [0,2,0,0,0,0|2,0,0]=4 8524 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)Br)c2ccccc2 1626a_100015188789_100000743005 [0,2,0,0,0,0|2,0,0]=4 8525 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)Br)c2ccccc2 240690a_100015188789_100000743005 [0,2,0,0,0,0|2,0,0]=4 8526 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)Br)c2ccccc2 527a_100015188789_100000743005 [0,2,0,0,0,0|2,0,0]=4 8527 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)C)c2ccccc2 11a_100015187455_100000743005 [0,2,0,0,0,0|2,0,0]=4 8528 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)C)c2ccccc2 1626a_100015187455_100000743005 [0,2,0,0,0,0|2,0,0]=4 8529 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)C)c2ccccc2 240690a_100015187455_100000743005 [0,2,0,0,0,0|2,0,0]=4 8530 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)C)c2ccccc2 527a_100015187455_100000743005 [0,2,0,0,0,0|2,0,0]=4 8531 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)Cl)c2ccccc2 11a_100000697193_100000743005 [0,2,0,0,0,0|2,0,0]=4 8532 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)Cl)c2ccccc2 1626a_100000697193_100000743005 [0,2,0,0,0,0|2,0,0]=4 8533 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)Cl)c2ccccc2 240690a_100000697193_100000743005 [0,2,0,0,0,0|2,0,0]=4 8534 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)Cl)c2ccccc2 527a_100000697193_100000743005 [0,2,0,0,0,0|2,0,0]=4 8535 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)F)c2ccccc2 11a_100020620131_100000743005 [0,2,0,0,0,0|2,0,0]=4 8536 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)F)c2ccccc2 1626a_100020620131_100000743005 [0,2,0,0,0,0|2,0,0]=4 8537 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)F)c2ccccc2 240690a_100020620131_100000743005 [0,2,0,0,0,0|2,0,0]=4 8538 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)F)c2ccccc2 527a_100020620131_100000743005 [0,2,0,0,0,0|2,0,0]=4 8539 B21R2.18991 CC(=CC(=O)NCc1ccc(cn1)O)c2ccccc2 240690a_100020605196_100000743005 [0,2,0,0,0,0|2,0,0]=4 8540 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)Br)c2ccccc2 11a_100009817727_100000743005 [0,2,0,0,0,0|2,0,0]=4 8541 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)Br)c2ccccc2 240690a_100009817727_100000743005 [0,2,0,0,0,0|2,0,0]=4 8542 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)Br)c2ccccc2 527a_100009817727_100000743005 [0,2,0,0,0,0|2,0,0]=4 8543 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)C)c2ccccc2 11a_100000740942_100000743005 [0,2,0,0,0,0|2,0,0]=4 8544 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)C)c2ccccc2 1626a_100000740942_100000743005 [0,2,0,0,0,0|2,0,0]=4 8545 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)C)c2ccccc2 240690a_100000740942_100000743005 [0,2,0,0,0,0|2,0,0]=4 8546 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)C)c2ccccc2 527a_100000740942_100000743005 [0,2,0,0,0,0|2,0,0]=4 8547 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)Cl)c2ccccc2 11a_100000735879_100000743005 [0,2,0,0,0,0|2,0,0]=4 8548 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)Cl)c2ccccc2 1626a_100000735879_100000743005 [0,2,0,0,0,0|2,0,0]=4 8549 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)Cl)c2ccccc2 240690a_100000735879_100000743005 [0,2,0,0,0,0|2,0,0]=4 8550 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)Cl)c2ccccc2 527a_100000735879_100000743005 [0,2,0,0,0,0|2,0,0]=4 8551 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)F)c2ccccc2 11a_100000101913_100000743005 [0,2,0,0,0,0|2,0,0]=4 8552 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)F)c2ccccc2 1626a_100000101913_100000743005 [0,2,0,0,0,0|2,0,0]=4 8553 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)F)c2ccccc2 240690a_100000101913_100000743005 [0,2,0,0,0,0|2,0,0]=4 8554 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)F)c2ccccc2 527a_100000101913_100000743005 [0,2,0,0,0,0|2,0,0]=4 8555 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)O)c2ccccc2 11a_100000757128_100000743005 [0,2,0,0,0,0|2,0,0]=4 8556 B21R2.18991 CC(=CC(=O)NCc1ccc(nc1)O)c2ccccc2 240690a_100000757128_100000743005 [0,2,0,0,0,0|2,0,0]=4 8557 B21R2.18991 CC(=CC(=O)NNc1ccc(cc1)Br)c2ccccc2 22a_100000735608_100000743005 [0,2,0,0,0,0|2,0,0]=4 8558 B21R2.18991 CC(=CC(=O)NNc1ccc(cc1)C)c2ccccc2 22a_100000683527_100000743005 [0,2,0,0,0,0|2,0,0]=4 8559 B21R2.18991 CC(=CC(=O)NNc1ccc(cc1)Cl)c2ccccc2 22a_100000683521_100000743005 [0,2,0,0,0,0|2,0,0]=4 8560 B21R2.18991 CC(=CC(=O)NNc1ccc(cc1)F)c2ccccc2 22a_100000728448_100000743005 [0,2,0,0,0,0|2,0,0]=4 8561 B21R2.18991 CC(=CC(=O)NNc1ccc(cc1)I)c2ccccc2 22a_100016988836_100000743005 [0,2,0,0,0,0|2,0,0]=4 8562 B21R2.18991 CC(CC(=O)C=Cc1ccc(cc1)Br)c2ccccc2 1458a_100016267368_100000756946 [0,2,0,0,0,0|1,0,0]=3 8563 B21R2.18991 CC(CC(=O)C=Cc1ccc(cc1)Cl)c2ccccc2 1458a_100000184863_100000756946 [0,2,0,0,0,0|1,0,0]=3 8564 B21R2.18991 CC(CC(=O)C=Cc1ccc(cc1)F)c2ccccc2 1458a_100000182136_100000756946 [0,2,0,0,0,0|1,0,0]=3 8565 B21R2.18991 CC(CC(=O)C=Cc1ccc(cc1)I)c2ccccc2 1458a_100102526154_100000756946 [0,2,0,0,0,0|1,0,0]=3 8566 B21R2.18991 CC(CC(=O)C=Cc1ccc(cn1)F)c2ccccc2 1458a_100020630499_100000756946 [0,2,0,0,0,0|2,0,0]=4 8567 B21R2.18991 CC(CC(=O)C=Cc1ccc(nc1)Br)c2ccccc2 1458a_100020588214_100000756946 [0,2,0,0,0,0|2,0,0]=4 8568 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Br)c2ccccn2 11a_100000181244_100016267368 [0,2,0,0,0,0|2,0,0]=4 8569 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Br)c2ccccn2 1626a_100000181244_100016267368 [0,2,0,0,0,0|2,0,0]=4 8570 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Br)c2cccnc2 11a_100000195435_100016267368 [0,2,0,0,0,0|2,0,0]=4 8571 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Cl)c2ccccn2 11a_100000181244_100000184863 [0,2,0,0,0,0|2,0,0]=4 8572 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Cl)c2ccccn2 1626a_100000181244_100000184863 [0,2,0,0,0,0|2,0,0]=4 8573 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Cl)c2ccccn2 240690a_100000181244_100000184863 [0,2,0,0,0,0|2,0,0]=4 8574 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Cl)c2cccnc2 11a_100000195435_100000184863 [0,2,0,0,0,0|2,0,0]=4 8575 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Cl)c2cccnc2 240690a_100000195435_100000184863 [0,2,0,0,0,0|2,0,0]=4 8576 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)Cl)c2ccncc2 240690a_100000181269_100000184863 [0,2,0,0,0,0|2,0,0]=4 8577 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)F)c2ccccn2 11a_100000181244_100000182136 [0,2,0,0,0,0|2,0,0]=4 8578 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)F)c2ccccn2 1626a_100000181244_100000182136 [0,2,0,0,0,0|2,0,0]=4 8579 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)F)c2ccccn2 240690a_100000181244_100000182136 [0,2,0,0,0,0|2,0,0]=4 8580 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)F)c2cccnc2 11a_100000195435_100000182136 [0,2,0,0,0,0|2,0,0]=4 8581 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)F)c2cccnc2 240690a_100000195435_100000182136 [0,2,0,0,0,0|2,0,0]=4 8582 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)F)c2ccncc2 240690a_100000181269_100000182136 [0,2,0,0,0,0|2,0,0]=4 8583 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)I)c2ccccn2 11a_100000181244_100102526154 [0,2,0,0,0,0|2,0,0]=4 8584 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)I)c2ccccn2 1626a_100000181244_100102526154 [0,2,0,0,0,0|2,0,0]=4 8585 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)I)c2ccccn2 240690a_100000181244_100102526154 [0,2,0,0,0,0|2,0,0]=4 8586 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)I)c2cccnc2 11a_100000195435_100102526154 [0,2,0,0,0,0|2,0,0]=4 8587 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)I)c2cccnc2 240690a_100000195435_100102526154 [0,2,0,0,0,0|2,0,0]=4 8588 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)I)c2ccncc2 240690a_100000181269_100102526154 [0,2,0,0,0,0|2,0,0]=4 8589 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)O)c2ccccn2 240690a_100000181244_100016269017 [0,2,0,0,0,0|2,0,0]=4 8590 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)O)c2cccnc2 240690a_100000195435_100016269017 [0,2,0,0,0,0|2,0,0]=4 8591 B21R2.18991 CC(NC(=O)C=Cc1ccc(cc1)O)c2ccncc2 240690a_100000181269_100016269017 [0,2,0,0,0,0|2,0,0]=4 8592 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)Br)c2ccccc2 11a_100000751104_100016267368 [0,2,0,0,0,0|1,0,0]=3 8593 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)Br)c2ccccc2 1626a_100000751104_100016267368 [0,2,0,0,0,0|1,0,0]=3 8594 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)Cl)c2ccccc2 11a_100000751104_100000184863 [0,2,0,0,0,0|1,0,0]=3 8595 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)Cl)c2ccccc2 1626a_100000751104_100000184863 [0,2,0,0,0,0|1,0,0]=3 8596 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)Cl)c2ccccc2 240690a_100000751104_100000184863 [0,2,0,0,0,0|1,0,0]=3 8597 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)F)c2ccccc2 11a_100000751104_100000182136 [0,2,0,0,0,0|1,0,0]=3 8598 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)F)c2ccccc2 1626a_100000751104_100000182136 [0,2,0,0,0,0|1,0,0]=3 8599 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)F)c2ccccc2 240690a_100000751104_100000182136 [0,2,0,0,0,0|1,0,0]=3 8600 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)I)c2ccccc2 11a_100000751104_100102526154 [0,2,0,0,0,0|1,0,0]=3 8601 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)I)c2ccccc2 1626a_100000751104_100102526154 [0,2,0,0,0,0|1,0,0]=3 8602 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)I)c2ccccc2 240690a_100000751104_100102526154 [0,2,0,0,0,0|1,0,0]=3 8603 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cc1)O)c2ccccc2 240690a_100000751104_100016269017 [0,2,0,0,0,0|1,0,0]=3 8604 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cn1)F)c2ccccc2 11a_100000751104_100020630499 [0,2,0,0,0,0|2,0,0]=4 8605 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cn1)F)c2ccccc2 1626a_100000751104_100020630499 [0,2,0,0,0,0|2,0,0]=4 8606 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(cn1)F)c2ccccc2 240690a_100000751104_100020630499 [0,2,0,0,0,0|2,0,0]=4 8607 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(nc1)Br)c2ccccc2 11a_100000751104_100020588214 [0,2,0,0,0,0|2,0,0]=4 8608 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(nc1)Br)c2ccccc2 1626a_100000751104_100020588214 [0,2,0,0,0,0|2,0,0]=4 8609 B21R2.18991 C[C@@H](NC(=O)C=Cc1ccc(nc1)Br)c2ccccc2 240690a_100000751104_100020588214 [0,2,0,0,0,0|2,0,0]=4 8610 B21R2.18991 Cc1ccc(cc1)C=CC(=O)CC(=O)c2ccccc2 1458a_100000716854_100000211460 [0,2,0,0,0,0|1,0,1]=4 8611 B21R2.18991 Cc1ccc(cc1)C=CC(=O)CC(C)c2ccccc2 1458a_100000716854_100000756946 [0,2,0,0,0,0|1,0,0]=3 8612 B21R2.18991 Cc1ccc(cc1)C=CC(=O)CC(O)c2ccccc2 1458a_100000716854_100000185958 [0,2,0,0,0,0|1,0,0]=3 8613 B21R2.18991 Cc1ccc(cc1)C=CC(=O)C[C@@H](O)c2ccccc2 1458a_100000716854_100011933945 [0,2,0,0,0,0|1,0,0]=3 8614 B21R2.18991 Cc1ccc(cc1)C=CC(=O)NC(C)c2ccccn2 11a_100000181244_100000716854 [0,2,0,0,0,0|2,0,0]=4 8615 B21R2.18991 Cc1ccc(cc1)C=CC(=O)NC(C)c2ccccn2 1626a_100000181244_100000716854 [0,2,0,0,0,0|2,0,0]=4 8616 B21R2.18991 Cc1ccc(cc1)C=CC(=O)NC(C)c2ccccn2 240690a_100000181244_100000716854 [0,2,0,0,0,0|2,0,0]=4 8617 B21R2.18991 Cc1ccc(cc1)C=CC(=O)NC(C)c2cccnc2 11a_100000195435_100000716854 [0,2,0,0,0,0|2,0,0]=4 8618 B21R2.18991 Cc1ccc(cc1)C=CC(=O)NC(C)c2cccnc2 240690a_100000195435_100000716854 [0,2,0,0,0,0|2,0,0]=4 8619 B21R2.18991 Cc1ccc(cc1)C=CC(=O)NC(C)c2ccncc2 240690a_100000181269_100000716854 [0,2,0,0,0,0|2,0,0]=4 8620 B21R2.18991 Cc1ccc(cc1)C=CC(=O)N[C@H](C)c2ccccc2 11a_100000751104_100000716854 [0,2,0,0,0,0|1,0,0]=3 8621 B21R2.18991 Cc1ccc(cc1)C=CC(=O)N[C@H](C)c2ccccc2 1626a_100000751104_100000716854 [0,2,0,0,0,0|1,0,0]=3 8622 B21R2.18991 Cc1ccc(cc1)C=CC(=O)N[C@H](C)c2ccccc2 240690a_100000751104_100000716854 [0,2,0,0,0,0|1,0,0]=3 8623 B21R2.18991 Cc1ccc(cc1)CCC(=O)CC(=O)c2ccccc2 1458a_100000234883_100000211460 [0,2,0,0,0,0|1,0,1]=4 8624 B21R2.18991 Cc1ccc(cc1)CNC(=O)CC(=O)c2ccccc2 1458a_100000185807_100000183211 [0,2,0,0,0,0|1,0,1]=4 8625 B21R2.18991 O=C(C=Cc1ccc(cc1)Br)CC(=O)c2ccccc2 1458a_100016267368_100000211460 [0,2,0,0,0,0|1,0,1]=4 8626 B21R2.18991 O=C(C=Cc1ccc(cc1)Br)CC(O)c2ccccc2 1458a_100016267368_100000185958 [0,2,0,0,0,0|1,0,0]=3 8627 B21R2.18991 O=C(C=Cc1ccc(cc1)Br)C[C@@H](O)c2ccccc2 1458a_100016267368_100011933945 [0,2,0,0,0,0|1,0,0]=3 8628 B21R2.18991 O=C(C=Cc1ccc(cc1)Cl)CC(=O)c2ccccc2 1458a_100000184863_100000211460 [0,2,0,0,0,0|1,0,1]=4 8629 B21R2.18991 O=C(C=Cc1ccc(cc1)Cl)CC(O)c2ccccc2 1458a_100000184863_100000185958 [0,2,0,0,0,0|1,0,0]=3 8630 B21R2.18991 O=C(C=Cc1ccc(cc1)Cl)C[C@@H](O)c2ccccc2 1458a_100000184863_100011933945 [0,2,0,0,0,0|1,0,0]=3 8631 B21R2.18991 O=C(C=Cc1ccc(cc1)F)CC(=O)c2ccccc2 1458a_100000182136_100000211460 [0,2,0,0,0,0|1,0,1]=4 8632 B21R2.18991 O=C(C=Cc1ccc(cc1)F)CC(O)c2ccccc2 1458a_100000182136_100000185958 [0,2,0,0,0,0|1,0,0]=3 8633 B21R2.18991 O=C(C=Cc1ccc(cc1)F)C[C@@H](O)c2ccccc2 1458a_100000182136_100011933945 [0,2,0,0,0,0|1,0,0]=3 8634 B21R2.18991 O=C(C=Cc1ccc(cc1)I)CC(=O)c2ccccc2 1458a_100102526154_100000211460 [0,2,0,0,0,0|1,0,1]=4 8635 B21R2.18991 O=C(C=Cc1ccc(cc1)I)CC(O)c2ccccc2 1458a_100102526154_100000185958 [0,2,0,0,0,0|1,0,0]=3 8636 B21R2.18991 O=C(C=Cc1ccc(cc1)I)C[C@@H](O)c2ccccc2 1458a_100102526154_100011933945 [0,2,0,0,0,0|1,0,0]=3 8637 B21R2.18991 O=C(C=Cc1ccc(cn1)F)CC(O)c2ccccc2 1458a_100020630499_100000185958 [0,2,0,0,0,0|2,0,0]=4 8638 B21R2.18991 O=C(C=Cc1ccc(cn1)F)C[C@@H](O)c2ccccc2 1458a_100020630499_100011933945 [0,2,0,0,0,0|2,0,0]=4 8639 B21R2.18991 O=C(C=Cc1ccc(nc1)Br)CC(O)c2ccccc2 1458a_100020588214_100000185958 [0,2,0,0,0,0|2,0,0]=4 8640 B21R2.18991 O=C(C=Cc1ccc(nc1)Br)C[C@@H](O)c2ccccc2 1458a_100020588214_100011933945 [0,2,0,0,0,0|2,0,0]=4 8641 B21R2.18991 O=C(CC(=O)c1ccccc1)NCc2ccc(cc2)Cl 1458a_100000185807_100000183476 [0,2,0,0,0,0|1,0,1]=4 8642 B21R2.18991 O=C(CC(=O)c1ccccc1)NCc2ccc(cc2)F 1458a_100000185807_100000182461 [0,2,0,0,0,0|1,0,1]=4 8643 B21R2.18991 O=C(CCc1ccc(cc1)Br)CC(=O)c2ccccc2 1458a_100000217147_100000211460 [0,2,0,0,0,0|1,0,1]=4 8644 B21R2.18991 O=C(CCc1ccc(cc1)Cl)CC(=O)c2ccccc2 1458a_100000235379_100000211460 [0,2,0,0,0,0|1,0,1]=4 8645 B21R2.18991 O=C(CCc1ccc(cc1)F)CC(=O)c2ccccc2 1458a_100000198493_100000211460 [0,2,0,0,0,0|1,0,1]=4 8646 B21R2.18991 O=C(CCc1ccc(cc1)I)CC(=O)c2ccccc2 1458a_100011217499_100000211460 [0,2,0,0,0,0|1,0,1]=4 8647 B21R2.18991 O=C(CCc1ccc(cc1)O)CC(=O)c2ccccc2 1458a_100000742835_100000211460 [0,2,0,0,0,0|1,0,1]=4 8648 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)Br 11a_100011934566_100016267368 [0,2,0,0,0,0|2,0,0]=4 8649 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)Br 1626a_100011934566_100016267368 [0,2,0,0,0,0|2,0,0]=4 8650 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)Cl 11a_100011934566_100000184863 [0,2,0,0,0,0|2,0,0]=4 8651 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100011934566_100000184863 [0,2,0,0,0,0|2,0,0]=4 8652 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100011934566_100000184863 [0,2,0,0,0,0|2,0,0]=4 8653 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)F 11a_100011934566_100000182136 [0,2,0,0,0,0|2,0,0]=4 8654 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)F 1626a_100011934566_100000182136 [0,2,0,0,0,0|2,0,0]=4 8655 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)F 240690a_100011934566_100000182136 [0,2,0,0,0,0|2,0,0]=4 8656 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)I 11a_100011934566_100102526154 [0,2,0,0,0,0|2,0,0]=4 8657 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)I 1626a_100011934566_100102526154 [0,2,0,0,0,0|2,0,0]=4 8658 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)I 240690a_100011934566_100102526154 [0,2,0,0,0,0|2,0,0]=4 8659 B21R2.18994 Cc1cc(ccn1)CNC(=O)C=Cc2ccc(cc2)O 240690a_100011934566_100016269017 [0,2,0,0,0,0|2,0,0]=4 8660 B21R2.18994 Cc1ccc(cc1)C=CC(=O)CCc2cccc(c2)Br 1458a_100000716854_100011740638 [0,2,0,0,0,0|1,0,0]=3 8661 B21R2.18994 Cc1ccc(cc1)C=CC(=O)CCc2cccc(c2)C 1458a_100000716854_100011713685 [0,2,0,0,0,0|1,0,0]=3 8662 B21R2.18994 Cc1ccc(cc1)C=CC(=O)CCc2cccc(c2)Cl 1458a_100000716854_100011713710 [0,2,0,0,0,0|1,0,0]=3 8663 B21R2.18994 Cc1ccc(cc1)C=CC(=O)CCc2cccc(c2)F 1458a_100000716854_100011217235 [0,2,0,0,0,0|1,0,0]=3 8664 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)Br 11a_100009818019_100000716854 [0,2,0,0,0,0|2,0,0]=4 8665 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)Br 1626a_100009818019_100000716854 [0,2,0,0,0,0|2,0,0]=4 8666 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)Br 240690a_100009818019_100000716854 [0,2,0,0,0,0|2,0,0]=4 8667 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)C 11a_100011934573_100000716854 [0,2,0,0,0,0|2,0,0]=4 8668 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)C 1626a_100011934573_100000716854 [0,2,0,0,0,0|2,0,0]=4 8669 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)C 240690a_100011934573_100000716854 [0,2,0,0,0,0|2,0,0]=4 8670 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)Cl 11a_100000085674_100000716854 [0,2,0,0,0,0|2,0,0]=4 8671 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)Cl 1626a_100000085674_100000716854 [0,2,0,0,0,0|2,0,0]=4 8672 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cc(ccn2)Cl 240690a_100000085674_100000716854 [0,2,0,0,0,0|2,0,0]=4 8673 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(=O)[nH]2 11a_100000696482_100000716854 [0,2,0,0,0,0|2,0,0]=4 8674 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(=O)[nH]2 1626a_100000696482_100000716854 [0,2,0,0,0,0|2,0,0]=4 8675 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(=O)[nH]2 240690a_100000696482_100000716854 [0,2,0,0,0,0|2,0,0]=4 8676 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)Br 11a_100000174977_100000716854 [0,2,0,0,0,0|1,0,0]=3 8677 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)Br 1626a_100000174977_100000716854 [0,2,0,0,0,0|1,0,0]=3 8678 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)Br 240690a_100000174977_100000716854 [0,2,0,0,0,0|1,0,0]=3 8679 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)C 11a_100000185548_100000716854 [0,2,0,0,0,0|1,0,0]=3 8680 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)C 1626a_100000185548_100000716854 [0,2,0,0,0,0|1,0,0]=3 8681 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)C 240690a_100000185548_100000716854 [0,2,0,0,0,0|1,0,0]=3 8682 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)Cl 11a_100000174878_100000716854 [0,2,0,0,0,0|1,0,0]=3 8683 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)Cl 1626a_100000174878_100000716854 [0,2,0,0,0,0|1,0,0]=3 8684 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)Cl 240690a_100000174878_100000716854 [0,2,0,0,0,0|1,0,0]=3 8685 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)F 11a_100000174948_100000716854 [0,2,0,0,0,0|1,0,0]=3 8686 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)F 1626a_100000174948_100000716854 [0,2,0,0,0,0|1,0,0]=3 8687 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)F 240690a_100000174948_100000716854 [0,2,0,0,0,0|1,0,0]=3 8688 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)I 11a_100000106179_100000716854 [0,2,0,0,0,0|1,0,0]=3 8689 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)I 1626a_100000106179_100000716854 [0,2,0,0,0,0|1,0,0]=3 8690 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)I 240690a_100000106179_100000716854 [0,2,0,0,0,0|1,0,0]=3 8691 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(c2)O 240690a_100000743036_100000716854 [0,2,0,0,0,0|1,0,0]=3 8692 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)Br 11a_100016987751_100000716854 [0,2,0,0,0,0|2,0,0]=4 8693 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)Br 1626a_100016987751_100000716854 [0,2,0,0,0,0|2,0,0]=4 8694 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)Br 240690a_100016987751_100000716854 [0,2,0,0,0,0|2,0,0]=4 8695 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)C 11a_100000701342_100000716854 [0,2,0,0,0,0|2,0,0]=4 8696 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)C 1626a_100000701342_100000716854 [0,2,0,0,0,0|2,0,0]=4 8697 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)C 240690a_100000701342_100000716854 [0,2,0,0,0,0|2,0,0]=4 8698 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)Cl 11a_100016990191_100000716854 [0,2,0,0,0,0|2,0,0]=4 8699 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)Cl 1626a_100016990191_100000716854 [0,2,0,0,0,0|2,0,0]=4 8700 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)Cl 240690a_100016990191_100000716854 [0,2,0,0,0,0|2,0,0]=4 8701 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)F 11a_100015188798_100000716854 [0,2,0,0,0,0|2,0,0]=4 8702 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)F 1626a_100015188798_100000716854 [0,2,0,0,0,0|2,0,0]=4 8703 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cccc(n2)F 240690a_100015188798_100000716854 [0,2,0,0,0,0|2,0,0]=4 8704 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)Br 11a_100025757509_100000716854 [0,2,0,0,0,0|2,0,0]=4 8705 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)Br 240690a_100025757509_100000716854 [0,2,0,0,0,0|2,0,0]=4 8706 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)C 11a_100011934566_100000716854 [0,2,0,0,0,0|2,0,0]=4 8707 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)C 1626a_100011934566_100000716854 [0,2,0,0,0,0|2,0,0]=4 8708 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)C 240690a_100011934566_100000716854 [0,2,0,0,0,0|2,0,0]=4 8709 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)Cl 11a_100015205668_100000716854 [0,2,0,0,0,0|2,0,0]=4 8710 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)Cl 1626a_100015205668_100000716854 [0,2,0,0,0,0|2,0,0]=4 8711 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)Cl 240690a_100015205668_100000716854 [0,2,0,0,0,0|2,0,0]=4 8712 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)F 11a_100015188774_100000716854 [0,2,0,0,0,0|2,0,0]=4 8713 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)F 1626a_100015188774_100000716854 [0,2,0,0,0,0|2,0,0]=4 8714 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)F 240690a_100015188774_100000716854 [0,2,0,0,0,0|2,0,0]=4 8715 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)O 11a_100000748557_100000716854 [0,2,0,0,0,0|2,0,0]=4 8716 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2ccnc(c2)O 240690a_100000748557_100000716854 [0,2,0,0,0,0|2,0,0]=4 8717 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)Br 11a_100011249555_100000716854 [0,2,0,0,0,0|2,0,0]=4 8718 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)Br 240690a_100011249555_100000716854 [0,2,0,0,0,0|2,0,0]=4 8719 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)C 11a_100000692839_100000716854 [0,2,0,0,0,0|2,0,0]=4 8720 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)C 1626a_100000692839_100000716854 [0,2,0,0,0,0|2,0,0]=4 8721 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)C 240690a_100000692839_100000716854 [0,2,0,0,0,0|2,0,0]=4 8722 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)Cl 11a_200020614424_100000716854 [0,2,0,0,0,0|2,0,0]=4 8723 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)Cl 1626a_200020614424_100000716854 [0,2,0,0,0,0|2,0,0]=4 8724 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)Cl 240690a_200020614424_100000716854 [0,2,0,0,0,0|2,0,0]=4 8725 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)F 11a_100011962886_100000716854 [0,2,0,0,0,0|2,0,0]=4 8726 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)F 1626a_100011962886_100000716854 [0,2,0,0,0,0|2,0,0]=4 8727 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NCc2cncc(c2)F 240690a_100011962886_100000716854 [0,2,0,0,0,0|2,0,0]=4 8728 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NNc2cccc(c2)Br 22a_100000217339_100000716854 [0,2,0,0,0,0|2,0,0]=4 8729 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NNc2cccc(c2)C 22a_100000681630_100000716854 [0,2,0,0,0,0|2,0,0]=4 8730 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NNc2cccc(c2)Cl 22a_100000184277_100000716854 [0,2,0,0,0,0|2,0,0]=4 8731 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NNc2cccc(c2)F 22a_100000745080_100000716854 [0,2,0,0,0,0|2,0,0]=4 8732 B21R2.18994 Cc1ccc(cc1)C=CC(=O)NNc2cccc(c2)I 22a_100020605690_100000716854 [0,2,0,0,0,0|2,0,0]=4 8733 B21R2.18994 Cc1ccc(cc1)CCC(=O)C=Cc2cccc(c2)Br 1458a_100016258244_100011713686 [0,2,0,0,0,0|1,0,0]=3 8734 B21R2.18994 Cc1ccc(cc1)CCC(=O)C=Cc2cccc(c2)C 1458a_100000690095_100011713686 [0,2,0,0,0,0|1,0,0]=3 8735 B21R2.18994 Cc1ccc(cc1)CCC(=O)C=Cc2cccc(c2)Cl 1458a_100000184502_100011713686 [0,2,0,0,0,0|1,0,0]=3 8736 B21R2.18994 Cc1ccc(cc1)CCC(=O)C=Cc2cccc(c2)F 1458a_100000718793_100011713686 [0,2,0,0,0,0|1,0,0]=3 8737 B21R2.18994 Cc1ccc(cc1)CCC(=O)C=Cc2cccc(c2)I 1458a_100020647043_100011713686 [0,2,0,0,0,0|1,0,0]=3 8738 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)Br 11a_100000174908_100016258244 [0,2,0,0,0,0|1,0,0]=3 8739 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)Br 1626a_100000174908_100016258244 [0,2,0,0,0,0|1,0,0]=3 8740 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)Br 240690a_100000174908_100016258244 [0,2,0,0,0,0|1,0,0]=3 8741 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)C 11a_100000174908_100000690095 [0,2,0,0,0,0|1,0,0]=3 8742 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)C 1626a_100000174908_100000690095 [0,2,0,0,0,0|1,0,0]=3 8743 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)C 240690a_100000174908_100000690095 [0,2,0,0,0,0|1,0,0]=3 8744 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)Cl 11a_100000174908_100000184502 [0,2,0,0,0,0|1,0,0]=3 8745 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)Cl 1626a_100000174908_100000184502 [0,2,0,0,0,0|1,0,0]=3 8746 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)Cl 240690a_100000174908_100000184502 [0,2,0,0,0,0|1,0,0]=3 8747 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)F 11a_100000174908_100000718793 [0,2,0,0,0,0|1,0,0]=3 8748 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)F 1626a_100000174908_100000718793 [0,2,0,0,0,0|1,0,0]=3 8749 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)F 240690a_100000174908_100000718793 [0,2,0,0,0,0|1,0,0]=3 8750 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)I 11a_100000174908_100020647043 [0,2,0,0,0,0|1,0,0]=3 8751 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)I 1626a_100000174908_100020647043 [0,2,0,0,0,0|1,0,0]=3 8752 B21R2.18994 Cc1ccc(cc1)CNC(=O)C=Cc2cccc(c2)I 240690a_100000174908_100020647043 [0,2,0,0,0,0|1,0,0]=3 8753 B21R2.18994 Cc1ccc(cc1)NNC(=O)C=Cc2cccc(c2)Br 22a_100000683527_100016258244 [0,2,0,0,0,0|2,0,0]=4 8754 B21R2.18994 Cc1ccc(cc1)NNC(=O)C=Cc2cccc(c2)C 22a_100000683527_100000690095 [0,2,0,0,0,0|2,0,0]=4 8755 B21R2.18994 Cc1ccc(cc1)NNC(=O)C=Cc2cccc(c2)Cl 22a_100000683527_100000184502 [0,2,0,0,0,0|2,0,0]=4 8756 B21R2.18994 Cc1ccc(cc1)NNC(=O)C=Cc2cccc(c2)F 22a_100000683527_100000718793 [0,2,0,0,0,0|2,0,0]=4 8757 B21R2.18994 Cc1ccc(cc1)NNC(=O)C=Cc2cccc(c2)I 22a_100000683527_100020647043 [0,2,0,0,0,0|2,0,0]=4 8758 B21R2.18994 Cc1ccc(cc1)NNC(=O)C=Cc2cccc(c2)O 22a_100000683527_100102525460 [0,2,0,0,0,0|2,0,0]=4 8759 B21R2.18994 Cc1ccc(cc1)SCC(=O)C=Cc2cccc(c2)Br 6a_100000210085_100000172844 [0,2,0,0,0,0|2,0,0]=4 8760 B21R2.18994 Cc1ccc(cc1)SCC(=O)C=Cc2cccc(c2)F 6a_100000210812_100000172844 [0,2,0,0,0,0|2,0,0]=4 8761 B21R2.18994 Cc1ccc(cc1)SCC(=O)C=Cc2cccc(c2)I 6a_100000014684_100000172844 [0,2,0,0,0,0|2,0,0]=4 8762 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)Br 11a_100000740942_100016258244 [0,2,0,0,0,0|2,0,0]=4 8763 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)Br 1626a_100000740942_100016258244 [0,2,0,0,0,0|2,0,0]=4 8764 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)Br 240690a_100000740942_100016258244 [0,2,0,0,0,0|2,0,0]=4 8765 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)Cl 11a_100000740942_100000184502 [0,2,0,0,0,0|2,0,0]=4 8766 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)Cl 1626a_100000740942_100000184502 [0,2,0,0,0,0|2,0,0]=4 8767 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)Cl 240690a_100000740942_100000184502 [0,2,0,0,0,0|2,0,0]=4 8768 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)F 11a_100000740942_100000718793 [0,2,0,0,0,0|2,0,0]=4 8769 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)F 1626a_100000740942_100000718793 [0,2,0,0,0,0|2,0,0]=4 8770 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)F 240690a_100000740942_100000718793 [0,2,0,0,0,0|2,0,0]=4 8771 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)I 11a_100000740942_100020647043 [0,2,0,0,0,0|2,0,0]=4 8772 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)I 1626a_100000740942_100020647043 [0,2,0,0,0,0|2,0,0]=4 8773 B21R2.18994 Cc1ccc(cn1)CNC(=O)C=Cc2cccc(c2)I 240690a_100000740942_100020647043 [0,2,0,0,0,0|2,0,0]=4 8774 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)Br 11a_100015187455_100016258244 [0,2,0,0,0,0|2,0,0]=4 8775 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)Br 1626a_100015187455_100016258244 [0,2,0,0,0,0|2,0,0]=4 8776 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)Br 240690a_100015187455_100016258244 [0,2,0,0,0,0|2,0,0]=4 8777 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)C 11a_100015187455_100000690095 [0,2,0,0,0,0|2,0,0]=4 8778 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)C 1626a_100015187455_100000690095 [0,2,0,0,0,0|2,0,0]=4 8779 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)C 240690a_100015187455_100000690095 [0,2,0,0,0,0|2,0,0]=4 8780 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)Cl 11a_100015187455_100000184502 [0,2,0,0,0,0|2,0,0]=4 8781 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)Cl 1626a_100015187455_100000184502 [0,2,0,0,0,0|2,0,0]=4 8782 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)Cl 240690a_100015187455_100000184502 [0,2,0,0,0,0|2,0,0]=4 8783 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)F 11a_100015187455_100000718793 [0,2,0,0,0,0|2,0,0]=4 8784 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)F 1626a_100015187455_100000718793 [0,2,0,0,0,0|2,0,0]=4 8785 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)F 240690a_100015187455_100000718793 [0,2,0,0,0,0|2,0,0]=4 8786 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)I 11a_100015187455_100020647043 [0,2,0,0,0,0|2,0,0]=4 8787 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)I 1626a_100015187455_100020647043 [0,2,0,0,0,0|2,0,0]=4 8788 B21R2.18994 Cc1ccc(nc1)CNC(=O)C=Cc2cccc(c2)I 240690a_100015187455_100020647043 [0,2,0,0,0,0|2,0,0]=4 8789 B21R2.18994 Cc1cccc(c1)C=CC(=O)CCc2ccc(cc2)Br 1458a_100000690095_100011740612 [0,2,0,0,0,0|1,0,0]=3 8790 B21R2.18994 Cc1cccc(c1)C=CC(=O)CCc2ccc(cc2)Cl 1458a_100000690095_100011713675 [0,2,0,0,0,0|1,0,0]=3 8791 B21R2.18994 Cc1cccc(c1)C=CC(=O)CCc2ccc(cc2)F 1458a_100000690095_100011217392 [0,2,0,0,0,0|1,0,0]=3 8792 B21R2.18994 Cc1cccc(c1)C=CC(=O)CCc2ccc(cc2)O 1458a_100000690095_100009816426 [0,2,0,0,0,0|1,0,0]=3 8793 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)Br 11a_100000174875_100000690095 [0,2,0,0,0,0|1,0,0]=3 8794 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)Br 1626a_100000174875_100000690095 [0,2,0,0,0,0|1,0,0]=3 8795 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)Br 240690a_100000174875_100000690095 [0,2,0,0,0,0|1,0,0]=3 8796 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)Cl 11a_100000174871_100000690095 [0,2,0,0,0,0|1,0,0]=3 8797 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)Cl 1626a_100000174871_100000690095 [0,2,0,0,0,0|1,0,0]=3 8798 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)Cl 240690a_100000174871_100000690095 [0,2,0,0,0,0|1,0,0]=3 8799 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)F 11a_100000174882_100000690095 [0,2,0,0,0,0|1,0,0]=3 8800 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)F 1626a_100000174882_100000690095 [0,2,0,0,0,0|1,0,0]=3 8801 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)F 240690a_100000174882_100000690095 [0,2,0,0,0,0|1,0,0]=3 8802 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)I 11a_100016989417_100000690095 [0,2,0,0,0,0|1,0,0]=3 8803 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)I 1626a_100016989417_100000690095 [0,2,0,0,0,0|1,0,0]=3 8804 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)I 240690a_100016989417_100000690095 [0,2,0,0,0,0|1,0,0]=3 8805 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cc2)O 240690a_100000185549_100000690095 [0,2,0,0,0,0|1,0,0]=3 8806 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)Br 11a_100015188789_100000690095 [0,2,0,0,0,0|2,0,0]=4 8807 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)Br 1626a_100015188789_100000690095 [0,2,0,0,0,0|2,0,0]=4 8808 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)Br 240690a_100015188789_100000690095 [0,2,0,0,0,0|2,0,0]=4 8809 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)Cl 11a_100000697193_100000690095 [0,2,0,0,0,0|2,0,0]=4 8810 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)Cl 1626a_100000697193_100000690095 [0,2,0,0,0,0|2,0,0]=4 8811 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)Cl 240690a_100000697193_100000690095 [0,2,0,0,0,0|2,0,0]=4 8812 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)F 11a_100020620131_100000690095 [0,2,0,0,0,0|2,0,0]=4 8813 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)F 1626a_100020620131_100000690095 [0,2,0,0,0,0|2,0,0]=4 8814 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)F 240690a_100020620131_100000690095 [0,2,0,0,0,0|2,0,0]=4 8815 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(cn2)O 240690a_100020605196_100000690095 [0,2,0,0,0,0|2,0,0]=4 8816 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)Br 11a_100009817727_100000690095 [0,2,0,0,0,0|2,0,0]=4 8817 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)Br 240690a_100009817727_100000690095 [0,2,0,0,0,0|2,0,0]=4 8818 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)C 11a_100000740942_100000690095 [0,2,0,0,0,0|2,0,0]=4 8819 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)C 1626a_100000740942_100000690095 [0,2,0,0,0,0|2,0,0]=4 8820 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)C 240690a_100000740942_100000690095 [0,2,0,0,0,0|2,0,0]=4 8821 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)Cl 11a_100000735879_100000690095 [0,2,0,0,0,0|2,0,0]=4 8822 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)Cl 1626a_100000735879_100000690095 [0,2,0,0,0,0|2,0,0]=4 8823 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)Cl 240690a_100000735879_100000690095 [0,2,0,0,0,0|2,0,0]=4 8824 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)F 11a_100000101913_100000690095 [0,2,0,0,0,0|2,0,0]=4 8825 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)F 1626a_100000101913_100000690095 [0,2,0,0,0,0|2,0,0]=4 8826 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)F 240690a_100000101913_100000690095 [0,2,0,0,0,0|2,0,0]=4 8827 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)O 11a_100000757128_100000690095 [0,2,0,0,0,0|2,0,0]=4 8828 B21R2.18994 Cc1cccc(c1)C=CC(=O)NCc2ccc(nc2)O 240690a_100000757128_100000690095 [0,2,0,0,0,0|2,0,0]=4 8829 B21R2.18994 Cc1cccc(c1)C=CC(=O)NNc2ccc(cc2)Br 22a_100000735608_100000690095 [0,2,0,0,0,0|2,0,0]=4 8830 B21R2.18994 Cc1cccc(c1)C=CC(=O)NNc2ccc(cc2)Cl 22a_100000683521_100000690095 [0,2,0,0,0,0|2,0,0]=4 8831 B21R2.18994 Cc1cccc(c1)C=CC(=O)NNc2ccc(cc2)F 22a_100000728448_100000690095 [0,2,0,0,0,0|2,0,0]=4 8832 B21R2.18994 Cc1cccc(c1)C=CC(=O)NNc2ccc(cc2)I 22a_100016988836_100000690095 [0,2,0,0,0,0|2,0,0]=4 8833 B21R2.18994 Cc1cccc(c1)CCC(=O)C=Cc2ccc(cc2)Br 1458a_100016267368_100011713685 [0,2,0,0,0,0|1,0,0]=3 8834 B21R2.18994 Cc1cccc(c1)CCC(=O)C=Cc2ccc(cc2)Cl 1458a_100000184863_100011713685 [0,2,0,0,0,0|1,0,0]=3 8835 B21R2.18994 Cc1cccc(c1)CCC(=O)C=Cc2ccc(cc2)F 1458a_100000182136_100011713685 [0,2,0,0,0,0|1,0,0]=3 8836 B21R2.18994 Cc1cccc(c1)CCC(=O)C=Cc2ccc(cc2)I 1458a_100102526154_100011713685 [0,2,0,0,0,0|1,0,0]=3 8837 B21R2.18994 Cc1cccc(c1)CCC(=O)C=Cc2ccc(cn2)F 1458a_100020630499_100011713685 [0,2,0,0,0,0|2,0,0]=4 8838 B21R2.18994 Cc1cccc(c1)CCC(=O)C=Cc2ccc(nc2)Br 1458a_100020588214_100011713685 [0,2,0,0,0,0|2,0,0]=4 8839 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)Br 11a_100000185548_100016267368 [0,2,0,0,0,0|1,0,0]=3 8840 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)Br 1626a_100000185548_100016267368 [0,2,0,0,0,0|1,0,0]=3 8841 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 11a_100000185548_100000184863 [0,2,0,0,0,0|1,0,0]=3 8842 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000185548_100000184863 [0,2,0,0,0,0|1,0,0]=3 8843 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000185548_100000184863 [0,2,0,0,0,0|1,0,0]=3 8844 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)F 11a_100000185548_100000182136 [0,2,0,0,0,0|1,0,0]=3 8845 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)F 1626a_100000185548_100000182136 [0,2,0,0,0,0|1,0,0]=3 8846 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)F 240690a_100000185548_100000182136 [0,2,0,0,0,0|1,0,0]=3 8847 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)I 11a_100000185548_100102526154 [0,2,0,0,0,0|1,0,0]=3 8848 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)I 1626a_100000185548_100102526154 [0,2,0,0,0,0|1,0,0]=3 8849 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)I 240690a_100000185548_100102526154 [0,2,0,0,0,0|1,0,0]=3 8850 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cc2)O 240690a_100000185548_100016269017 [0,2,0,0,0,0|1,0,0]=3 8851 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cn2)F 11a_100000185548_100020630499 [0,2,0,0,0,0|2,0,0]=4 8852 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cn2)F 1626a_100000185548_100020630499 [0,2,0,0,0,0|2,0,0]=4 8853 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(cn2)F 240690a_100000185548_100020630499 [0,2,0,0,0,0|2,0,0]=4 8854 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(nc2)Br 11a_100000185548_100020588214 [0,2,0,0,0,0|2,0,0]=4 8855 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(nc2)Br 1626a_100000185548_100020588214 [0,2,0,0,0,0|2,0,0]=4 8856 B21R2.18994 Cc1cccc(c1)CNC(=O)C=Cc2ccc(nc2)Br 240690a_100000185548_100020588214 [0,2,0,0,0,0|2,0,0]=4 8857 B21R2.18994 Cc1cccc(c1)NNC(=O)C=Cc2ccc(cc2)Br 22a_100000681630_100016267368 [0,2,0,0,0,0|2,0,0]=4 8858 B21R2.18994 Cc1cccc(c1)NNC(=O)C=Cc2ccc(cc2)Cl 22a_100000681630_100000184863 [0,2,0,0,0,0|2,0,0]=4 8859 B21R2.18994 Cc1cccc(c1)NNC(=O)C=Cc2ccc(cc2)F 22a_100000681630_100000182136 [0,2,0,0,0,0|2,0,0]=4 8860 B21R2.18994 Cc1cccc(c1)NNC(=O)C=Cc2ccc(cc2)I 22a_100000681630_100102526154 [0,2,0,0,0,0|2,0,0]=4 8861 B21R2.18994 Cc1cccc(c1)NNC(=O)C=Cc2ccc(cc2)O 22a_100000681630_100016269017 [0,2,0,0,0,0|2,0,0]=4 8862 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)Br 11a_100000701342_100016267368 [0,2,0,0,0,0|2,0,0]=4 8863 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)Br 1626a_100000701342_100016267368 [0,2,0,0,0,0|2,0,0]=4 8864 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)Cl 11a_100000701342_100000184863 [0,2,0,0,0,0|2,0,0]=4 8865 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000701342_100000184863 [0,2,0,0,0,0|2,0,0]=4 8866 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000701342_100000184863 [0,2,0,0,0,0|2,0,0]=4 8867 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)F 11a_100000701342_100000182136 [0,2,0,0,0,0|2,0,0]=4 8868 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)F 1626a_100000701342_100000182136 [0,2,0,0,0,0|2,0,0]=4 8869 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)F 240690a_100000701342_100000182136 [0,2,0,0,0,0|2,0,0]=4 8870 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)I 11a_100000701342_100102526154 [0,2,0,0,0,0|2,0,0]=4 8871 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)I 1626a_100000701342_100102526154 [0,2,0,0,0,0|2,0,0]=4 8872 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)I 240690a_100000701342_100102526154 [0,2,0,0,0,0|2,0,0]=4 8873 B21R2.18994 Cc1cccc(n1)CNC(=O)C=Cc2ccc(cc2)O 240690a_100000701342_100016269017 [0,2,0,0,0,0|2,0,0]=4 8874 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)Br 11a_100011934573_100016267368 [0,2,0,0,0,0|2,0,0]=4 8875 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)Br 1626a_100011934573_100016267368 [0,2,0,0,0,0|2,0,0]=4 8876 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 11a_100011934573_100000184863 [0,2,0,0,0,0|2,0,0]=4 8877 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100011934573_100000184863 [0,2,0,0,0,0|2,0,0]=4 8878 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100011934573_100000184863 [0,2,0,0,0,0|2,0,0]=4 8879 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)F 11a_100011934573_100000182136 [0,2,0,0,0,0|2,0,0]=4 8880 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)F 1626a_100011934573_100000182136 [0,2,0,0,0,0|2,0,0]=4 8881 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)F 240690a_100011934573_100000182136 [0,2,0,0,0,0|2,0,0]=4 8882 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)I 11a_100011934573_100102526154 [0,2,0,0,0,0|2,0,0]=4 8883 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)I 1626a_100011934573_100102526154 [0,2,0,0,0,0|2,0,0]=4 8884 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)I 240690a_100011934573_100102526154 [0,2,0,0,0,0|2,0,0]=4 8885 B21R2.18994 Cc1ccnc(c1)CNC(=O)C=Cc2ccc(cc2)O 240690a_100011934573_100016269017 [0,2,0,0,0,0|2,0,0]=4 8886 B21R2.18994 Cc1cncc(c1)C=CC(=O)CCc2ccc(cc2)Cl 6a_100011998712_100011279170 [0,2,0,0,0,0|2,0,0]=4 8887 B21R2.18994 Cc1cncc(c1)C=CC(=O)CCc2ccc(cc2)F 6a_100011998712_100000743244 [0,2,0,0,0,0|2,0,0]=4 8888 B21R2.18994 Cc1cncc(c1)C=CC(=O)CCc2ccc(cc2)I 6a_100011998712_100000723691 [0,2,0,0,0,0|2,0,0]=4 8889 B21R2.18994 Cc1cncc(c1)C=CC(=O)CCc2ccc(cc2)O 6a_100011998712_100000198047 [0,2,0,0,0,0|2,0,0]=4 8890 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)Br 11a_100000692839_100016267368 [0,2,0,0,0,0|2,0,0]=4 8891 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)Br 1626a_100000692839_100016267368 [0,2,0,0,0,0|2,0,0]=4 8892 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 11a_100000692839_100000184863 [0,2,0,0,0,0|2,0,0]=4 8893 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000692839_100000184863 [0,2,0,0,0,0|2,0,0]=4 8894 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000692839_100000184863 [0,2,0,0,0,0|2,0,0]=4 8895 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)F 11a_100000692839_100000182136 [0,2,0,0,0,0|2,0,0]=4 8896 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)F 1626a_100000692839_100000182136 [0,2,0,0,0,0|2,0,0]=4 8897 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)F 240690a_100000692839_100000182136 [0,2,0,0,0,0|2,0,0]=4 8898 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)I 11a_100000692839_100102526154 [0,2,0,0,0,0|2,0,0]=4 8899 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)I 1626a_100000692839_100102526154 [0,2,0,0,0,0|2,0,0]=4 8900 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)I 240690a_100000692839_100102526154 [0,2,0,0,0,0|2,0,0]=4 8901 B21R2.18994 Cc1cncc(c1)CNC(=O)C=Cc2ccc(cc2)O 240690a_100000692839_100016269017 [0,2,0,0,0,0|2,0,0]=4 8902 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)CCc2cccc(c2)Br 1458a_100016267368_100011740638 [0,2,0,0,0,0|1,0,0]=3 8903 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)CCc2cccc(c2)Br 6a_100000186029_100011279149 [0,2,0,0,0,0|1,0,0]=3 8904 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)CCc2cccc(c2)Cl 1458a_100016267368_100011713710 [0,2,0,0,0,0|1,0,0]=3 8905 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)CCc2cccc(c2)F 1458a_100016267368_100011217235 [0,2,0,0,0,0|1,0,0]=3 8906 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)CCc2cccc(c2)F 6a_100000186029_100000743863 [0,2,0,0,0,0|1,0,0]=3 8907 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cc(ccn2)Br 11a_100009818019_100016267368 [0,2,0,0,0,0|2,0,0]=4 8908 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cc(ccn2)Br 1626a_100009818019_100016267368 [0,2,0,0,0,0|2,0,0]=4 8909 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cc(ccn2)Cl 11a_100000085674_100016267368 [0,2,0,0,0,0|2,0,0]=4 8910 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cc(ccn2)Cl 1626a_100000085674_100016267368 [0,2,0,0,0,0|2,0,0]=4 8911 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(=O)[nH]2 11a_100000696482_100016267368 [0,2,0,0,0,0|2,0,0]=4 8912 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(=O)[nH]2 1626a_100000696482_100016267368 [0,2,0,0,0,0|2,0,0]=4 8913 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(c2)Br 11a_100000174977_100016267368 [0,2,0,0,0,0|1,0,0]=3 8914 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(c2)Br 1626a_100000174977_100016267368 [0,2,0,0,0,0|1,0,0]=3 8915 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(c2)Cl 11a_100000174878_100016267368 [0,2,0,0,0,0|1,0,0]=3 8916 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(c2)Cl 1626a_100000174878_100016267368 [0,2,0,0,0,0|1,0,0]=3 8917 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(c2)F 11a_100000174948_100016267368 [0,2,0,0,0,0|1,0,0]=3 8918 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(c2)F 1626a_100000174948_100016267368 [0,2,0,0,0,0|1,0,0]=3 8919 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(c2)I 11a_100000106179_100016267368 [0,2,0,0,0,0|1,0,0]=3 8920 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(c2)I 1626a_100000106179_100016267368 [0,2,0,0,0,0|1,0,0]=3 8921 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(n2)Br 11a_100016987751_100016267368 [0,2,0,0,0,0|2,0,0]=4 8922 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(n2)Br 1626a_100016987751_100016267368 [0,2,0,0,0,0|2,0,0]=4 8923 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(n2)Cl 11a_100016990191_100016267368 [0,2,0,0,0,0|2,0,0]=4 8924 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(n2)Cl 1626a_100016990191_100016267368 [0,2,0,0,0,0|2,0,0]=4 8925 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(n2)F 11a_100015188798_100016267368 [0,2,0,0,0,0|2,0,0]=4 8926 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cccc(n2)F 1626a_100015188798_100016267368 [0,2,0,0,0,0|2,0,0]=4 8927 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2ccnc(c2)Br 11a_100025757509_100016267368 [0,2,0,0,0,0|2,0,0]=4 8928 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2ccnc(c2)Cl 11a_100015205668_100016267368 [0,2,0,0,0,0|2,0,0]=4 8929 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2ccnc(c2)Cl 1626a_100015205668_100016267368 [0,2,0,0,0,0|2,0,0]=4 8930 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2ccnc(c2)F 11a_100015188774_100016267368 [0,2,0,0,0,0|2,0,0]=4 8931 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2ccnc(c2)F 1626a_100015188774_100016267368 [0,2,0,0,0,0|2,0,0]=4 8932 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2ccnc(c2)O 11a_100000748557_100016267368 [0,2,0,0,0,0|2,0,0]=4 8933 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cncc(c2)Br 11a_100011249555_100016267368 [0,2,0,0,0,0|2,0,0]=4 8934 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cncc(c2)Cl 11a_200020614424_100016267368 [0,2,0,0,0,0|2,0,0]=4 8935 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cncc(c2)Cl 1626a_200020614424_100016267368 [0,2,0,0,0,0|2,0,0]=4 8936 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cncc(c2)F 11a_100011962886_100016267368 [0,2,0,0,0,0|2,0,0]=4 8937 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NCc2cncc(c2)F 1626a_100011962886_100016267368 [0,2,0,0,0,0|2,0,0]=4 8938 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NNc2cccc(c2)Br 22a_100000217339_100016267368 [0,2,0,0,0,0|2,0,0]=4 8939 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NNc2cccc(c2)Cl 22a_100000184277_100016267368 [0,2,0,0,0,0|2,0,0]=4 8940 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NNc2cccc(c2)F 22a_100000745080_100016267368 [0,2,0,0,0,0|2,0,0]=4 8941 B21R2.18994 O=C(C=Cc1ccc(cc1)Br)NNc2cccc(c2)I 22a_100020605690_100016267368 [0,2,0,0,0,0|2,0,0]=4 8942 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)CCc2cccc(c2)Br 1458a_100000184863_100011740638 [0,2,0,0,0,0|1,0,0]=3 8943 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)CCc2cccc(c2)Cl 1458a_100000184863_100011713710 [0,2,0,0,0,0|1,0,0]=3 8944 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)CCc2cccc(c2)F 1458a_100000184863_100011217235 [0,2,0,0,0,0|1,0,0]=3 8945 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cc(ccn2)Br 11a_100009818019_100000184863 [0,2,0,0,0,0|2,0,0]=4 8946 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cc(ccn2)Br 1626a_100009818019_100000184863 [0,2,0,0,0,0|2,0,0]=4 8947 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cc(ccn2)Br 240690a_100009818019_100000184863 [0,2,0,0,0,0|2,0,0]=4 8948 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cc(ccn2)Cl 11a_100000085674_100000184863 [0,2,0,0,0,0|2,0,0]=4 8949 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cc(ccn2)Cl 1626a_100000085674_100000184863 [0,2,0,0,0,0|2,0,0]=4 8950 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cc(ccn2)Cl 240690a_100000085674_100000184863 [0,2,0,0,0,0|2,0,0]=4 8951 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(=O)[nH]2 11a_100000696482_100000184863 [0,2,0,0,0,0|2,0,0]=4 8952 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(=O)[nH]2 1626a_100000696482_100000184863 [0,2,0,0,0,0|2,0,0]=4 8953 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(=O)[nH]2 240690a_100000696482_100000184863 [0,2,0,0,0,0|2,0,0]=4 8954 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)Br 11a_100000174977_100000184863 [0,2,0,0,0,0|1,0,0]=3 8955 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)Br 1626a_100000174977_100000184863 [0,2,0,0,0,0|1,0,0]=3 8956 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)Br 240690a_100000174977_100000184863 [0,2,0,0,0,0|1,0,0]=3 8957 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)Cl 11a_100000174878_100000184863 [0,2,0,0,0,0|1,0,0]=3 8958 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)Cl 1626a_100000174878_100000184863 [0,2,0,0,0,0|1,0,0]=3 8959 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)Cl 240690a_100000174878_100000184863 [0,2,0,0,0,0|1,0,0]=3 8960 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)F 11a_100000174948_100000184863 [0,2,0,0,0,0|1,0,0]=3 8961 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)F 1626a_100000174948_100000184863 [0,2,0,0,0,0|1,0,0]=3 8962 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)F 240690a_100000174948_100000184863 [0,2,0,0,0,0|1,0,0]=3 8963 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)I 11a_100000106179_100000184863 [0,2,0,0,0,0|1,0,0]=3 8964 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)I 1626a_100000106179_100000184863 [0,2,0,0,0,0|1,0,0]=3 8965 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)I 240690a_100000106179_100000184863 [0,2,0,0,0,0|1,0,0]=3 8966 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(c2)O 240690a_100000743036_100000184863 [0,2,0,0,0,0|1,0,0]=3 8967 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)Br 11a_100016987751_100000184863 [0,2,0,0,0,0|2,0,0]=4 8968 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)Br 1626a_100016987751_100000184863 [0,2,0,0,0,0|2,0,0]=4 8969 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)Br 240690a_100016987751_100000184863 [0,2,0,0,0,0|2,0,0]=4 8970 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)Cl 11a_100016990191_100000184863 [0,2,0,0,0,0|2,0,0]=4 8971 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)Cl 1626a_100016990191_100000184863 [0,2,0,0,0,0|2,0,0]=4 8972 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)Cl 240690a_100016990191_100000184863 [0,2,0,0,0,0|2,0,0]=4 8973 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)F 11a_100015188798_100000184863 [0,2,0,0,0,0|2,0,0]=4 8974 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)F 1626a_100015188798_100000184863 [0,2,0,0,0,0|2,0,0]=4 8975 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cccc(n2)F 240690a_100015188798_100000184863 [0,2,0,0,0,0|2,0,0]=4 8976 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)Br 11a_100025757509_100000184863 [0,2,0,0,0,0|2,0,0]=4 8977 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)Br 240690a_100025757509_100000184863 [0,2,0,0,0,0|2,0,0]=4 8978 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)Cl 11a_100015205668_100000184863 [0,2,0,0,0,0|2,0,0]=4 8979 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)Cl 1626a_100015205668_100000184863 [0,2,0,0,0,0|2,0,0]=4 8980 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)Cl 240690a_100015205668_100000184863 [0,2,0,0,0,0|2,0,0]=4 8981 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)F 11a_100015188774_100000184863 [0,2,0,0,0,0|2,0,0]=4 8982 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)F 1626a_100015188774_100000184863 [0,2,0,0,0,0|2,0,0]=4 8983 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)F 240690a_100015188774_100000184863 [0,2,0,0,0,0|2,0,0]=4 8984 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)O 11a_100000748557_100000184863 [0,2,0,0,0,0|2,0,0]=4 8985 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2ccnc(c2)O 240690a_100000748557_100000184863 [0,2,0,0,0,0|2,0,0]=4 8986 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cncc(c2)Br 11a_100011249555_100000184863 [0,2,0,0,0,0|2,0,0]=4 8987 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cncc(c2)Br 240690a_100011249555_100000184863 [0,2,0,0,0,0|2,0,0]=4 8988 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cncc(c2)Cl 11a_200020614424_100000184863 [0,2,0,0,0,0|2,0,0]=4 8989 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cncc(c2)Cl 1626a_200020614424_100000184863 [0,2,0,0,0,0|2,0,0]=4 8990 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cncc(c2)Cl 240690a_200020614424_100000184863 [0,2,0,0,0,0|2,0,0]=4 8991 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cncc(c2)F 11a_100011962886_100000184863 [0,2,0,0,0,0|2,0,0]=4 8992 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cncc(c2)F 1626a_100011962886_100000184863 [0,2,0,0,0,0|2,0,0]=4 8993 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NCc2cncc(c2)F 240690a_100011962886_100000184863 [0,2,0,0,0,0|2,0,0]=4 8994 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NNc2cccc(c2)Br 22a_100000217339_100000184863 [0,2,0,0,0,0|2,0,0]=4 8995 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NNc2cccc(c2)Cl 22a_100000184277_100000184863 [0,2,0,0,0,0|2,0,0]=4 8996 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NNc2cccc(c2)F 22a_100000745080_100000184863 [0,2,0,0,0,0|2,0,0]=4 8997 B21R2.18994 O=C(C=Cc1ccc(cc1)Cl)NNc2cccc(c2)I 22a_100020605690_100000184863 [0,2,0,0,0,0|2,0,0]=4 8998 B21R2.18994 O=C(C=Cc1ccc(cc1)F)CCc2cccc(c2)Br 1458a_100000182136_100011740638 [0,2,0,0,0,0|1,0,0]=3 8999 B21R2.18994 O=C(C=Cc1ccc(cc1)F)CCc2cccc(c2)Br 6a_100000210084_100011279149 [0,2,0,0,0,0|1,0,0]=3 9000 B21R2.18994 O=C(C=Cc1ccc(cc1)F)CCc2cccc(c2)Cl 1458a_100000182136_100011713710 [0,2,0,0,0,0|1,0,0]=3 9001 B21R2.18994 O=C(C=Cc1ccc(cc1)F)CCc2cccc(c2)F 1458a_100000182136_100011217235 [0,2,0,0,0,0|1,0,0]=3 9002 B21R2.18994 O=C(C=Cc1ccc(cc1)F)CCc2cccc(c2)F 6a_100000210084_100000743863 [0,2,0,0,0,0|1,0,0]=3 9003 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cc(ccn2)Br 11a_100009818019_100000182136 [0,2,0,0,0,0|2,0,0]=4 9004 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cc(ccn2)Br 1626a_100009818019_100000182136 [0,2,0,0,0,0|2,0,0]=4 9005 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cc(ccn2)Br 240690a_100009818019_100000182136 [0,2,0,0,0,0|2,0,0]=4 9006 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cc(ccn2)Cl 11a_100000085674_100000182136 [0,2,0,0,0,0|2,0,0]=4 9007 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cc(ccn2)Cl 1626a_100000085674_100000182136 [0,2,0,0,0,0|2,0,0]=4 9008 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cc(ccn2)Cl 240690a_100000085674_100000182136 [0,2,0,0,0,0|2,0,0]=4 9009 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(=O)[nH]2 11a_100000696482_100000182136 [0,2,0,0,0,0|2,0,0]=4 9010 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(=O)[nH]2 1626a_100000696482_100000182136 [0,2,0,0,0,0|2,0,0]=4 9011 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(=O)[nH]2 240690a_100000696482_100000182136 [0,2,0,0,0,0|2,0,0]=4 9012 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)Br 11a_100000174977_100000182136 [0,2,0,0,0,0|1,0,0]=3 9013 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)Br 1626a_100000174977_100000182136 [0,2,0,0,0,0|1,0,0]=3 9014 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)Br 240690a_100000174977_100000182136 [0,2,0,0,0,0|1,0,0]=3 9015 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)Cl 11a_100000174878_100000182136 [0,2,0,0,0,0|1,0,0]=3 9016 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)Cl 1626a_100000174878_100000182136 [0,2,0,0,0,0|1,0,0]=3 9017 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)Cl 240690a_100000174878_100000182136 [0,2,0,0,0,0|1,0,0]=3 9018 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)F 11a_100000174948_100000182136 [0,2,0,0,0,0|1,0,0]=3 9019 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)F 1626a_100000174948_100000182136 [0,2,0,0,0,0|1,0,0]=3 9020 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)F 240690a_100000174948_100000182136 [0,2,0,0,0,0|1,0,0]=3 9021 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)I 11a_100000106179_100000182136 [0,2,0,0,0,0|1,0,0]=3 9022 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)I 1626a_100000106179_100000182136 [0,2,0,0,0,0|1,0,0]=3 9023 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)I 240690a_100000106179_100000182136 [0,2,0,0,0,0|1,0,0]=3 9024 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(c2)O 240690a_100000743036_100000182136 [0,2,0,0,0,0|1,0,0]=3 9025 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)Br 11a_100016987751_100000182136 [0,2,0,0,0,0|2,0,0]=4 9026 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)Br 1626a_100016987751_100000182136 [0,2,0,0,0,0|2,0,0]=4 9027 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)Br 240690a_100016987751_100000182136 [0,2,0,0,0,0|2,0,0]=4 9028 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)Cl 11a_100016990191_100000182136 [0,2,0,0,0,0|2,0,0]=4 9029 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)Cl 1626a_100016990191_100000182136 [0,2,0,0,0,0|2,0,0]=4 9030 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)Cl 240690a_100016990191_100000182136 [0,2,0,0,0,0|2,0,0]=4 9031 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)F 11a_100015188798_100000182136 [0,2,0,0,0,0|2,0,0]=4 9032 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)F 1626a_100015188798_100000182136 [0,2,0,0,0,0|2,0,0]=4 9033 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cccc(n2)F 240690a_100015188798_100000182136 [0,2,0,0,0,0|2,0,0]=4 9034 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)Br 11a_100025757509_100000182136 [0,2,0,0,0,0|2,0,0]=4 9035 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)Br 240690a_100025757509_100000182136 [0,2,0,0,0,0|2,0,0]=4 9036 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)Cl 11a_100015205668_100000182136 [0,2,0,0,0,0|2,0,0]=4 9037 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)Cl 1626a_100015205668_100000182136 [0,2,0,0,0,0|2,0,0]=4 9038 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)Cl 240690a_100015205668_100000182136 [0,2,0,0,0,0|2,0,0]=4 9039 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)F 11a_100015188774_100000182136 [0,2,0,0,0,0|2,0,0]=4 9040 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)F 1626a_100015188774_100000182136 [0,2,0,0,0,0|2,0,0]=4 9041 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)F 240690a_100015188774_100000182136 [0,2,0,0,0,0|2,0,0]=4 9042 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)O 11a_100000748557_100000182136 [0,2,0,0,0,0|2,0,0]=4 9043 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2ccnc(c2)O 240690a_100000748557_100000182136 [0,2,0,0,0,0|2,0,0]=4 9044 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cncc(c2)Br 11a_100011249555_100000182136 [0,2,0,0,0,0|2,0,0]=4 9045 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cncc(c2)Br 240690a_100011249555_100000182136 [0,2,0,0,0,0|2,0,0]=4 9046 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cncc(c2)Cl 11a_200020614424_100000182136 [0,2,0,0,0,0|2,0,0]=4 9047 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cncc(c2)Cl 1626a_200020614424_100000182136 [0,2,0,0,0,0|2,0,0]=4 9048 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cncc(c2)Cl 240690a_200020614424_100000182136 [0,2,0,0,0,0|2,0,0]=4 9049 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cncc(c2)F 11a_100011962886_100000182136 [0,2,0,0,0,0|2,0,0]=4 9050 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cncc(c2)F 1626a_100011962886_100000182136 [0,2,0,0,0,0|2,0,0]=4 9051 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NCc2cncc(c2)F 240690a_100011962886_100000182136 [0,2,0,0,0,0|2,0,0]=4 9052 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NNc2cccc(c2)Br 22a_100000217339_100000182136 [0,2,0,0,0,0|2,0,0]=4 9053 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NNc2cccc(c2)Cl 22a_100000184277_100000182136 [0,2,0,0,0,0|2,0,0]=4 9054 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NNc2cccc(c2)F 22a_100000745080_100000182136 [0,2,0,0,0,0|2,0,0]=4 9055 B21R2.18994 O=C(C=Cc1ccc(cc1)F)NNc2cccc(c2)I 22a_100020605690_100000182136 [0,2,0,0,0,0|2,0,0]=4 9056 B21R2.18994 O=C(C=Cc1ccc(cc1)I)CCc2cccc(c2)Br 1458a_100102526154_100011740638 [0,2,0,0,0,0|1,0,0]=3 9057 B21R2.18994 O=C(C=Cc1ccc(cc1)I)CCc2cccc(c2)Br 6a_100000188517_100011279149 [0,2,0,0,0,0|1,0,0]=3 9058 B21R2.18994 O=C(C=Cc1ccc(cc1)I)CCc2cccc(c2)Cl 1458a_100102526154_100011713710 [0,2,0,0,0,0|1,0,0]=3 9059 B21R2.18994 O=C(C=Cc1ccc(cc1)I)CCc2cccc(c2)F 1458a_100102526154_100011217235 [0,2,0,0,0,0|1,0,0]=3 9060 B21R2.18994 O=C(C=Cc1ccc(cc1)I)CCc2cccc(c2)F 6a_100000188517_100000743863 [0,2,0,0,0,0|1,0,0]=3 9061 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cc(ccn2)Br 11a_100009818019_100102526154 [0,2,0,0,0,0|2,0,0]=4 9062 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cc(ccn2)Br 1626a_100009818019_100102526154 [0,2,0,0,0,0|2,0,0]=4 9063 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cc(ccn2)Br 240690a_100009818019_100102526154 [0,2,0,0,0,0|2,0,0]=4 9064 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cc(ccn2)Cl 11a_100000085674_100102526154 [0,2,0,0,0,0|2,0,0]=4 9065 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cc(ccn2)Cl 1626a_100000085674_100102526154 [0,2,0,0,0,0|2,0,0]=4 9066 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cc(ccn2)Cl 240690a_100000085674_100102526154 [0,2,0,0,0,0|2,0,0]=4 9067 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(=O)[nH]2 11a_100000696482_100102526154 [0,2,0,0,0,0|2,0,0]=4 9068 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(=O)[nH]2 1626a_100000696482_100102526154 [0,2,0,0,0,0|2,0,0]=4 9069 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(=O)[nH]2 240690a_100000696482_100102526154 [0,2,0,0,0,0|2,0,0]=4 9070 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)Br 11a_100000174977_100102526154 [0,2,0,0,0,0|1,0,0]=3 9071 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)Br 1626a_100000174977_100102526154 [0,2,0,0,0,0|1,0,0]=3 9072 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)Br 240690a_100000174977_100102526154 [0,2,0,0,0,0|1,0,0]=3 9073 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)Cl 11a_100000174878_100102526154 [0,2,0,0,0,0|1,0,0]=3 9074 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)Cl 1626a_100000174878_100102526154 [0,2,0,0,0,0|1,0,0]=3 9075 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)Cl 240690a_100000174878_100102526154 [0,2,0,0,0,0|1,0,0]=3 9076 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)F 11a_100000174948_100102526154 [0,2,0,0,0,0|1,0,0]=3 9077 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)F 1626a_100000174948_100102526154 [0,2,0,0,0,0|1,0,0]=3 9078 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)F 240690a_100000174948_100102526154 [0,2,0,0,0,0|1,0,0]=3 9079 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)I 11a_100000106179_100102526154 [0,2,0,0,0,0|1,0,0]=3 9080 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)I 1626a_100000106179_100102526154 [0,2,0,0,0,0|1,0,0]=3 9081 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)I 240690a_100000106179_100102526154 [0,2,0,0,0,0|1,0,0]=3 9082 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(c2)O 240690a_100000743036_100102526154 [0,2,0,0,0,0|1,0,0]=3 9083 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)Br 11a_100016987751_100102526154 [0,2,0,0,0,0|2,0,0]=4 9084 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)Br 1626a_100016987751_100102526154 [0,2,0,0,0,0|2,0,0]=4 9085 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)Br 240690a_100016987751_100102526154 [0,2,0,0,0,0|2,0,0]=4 9086 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)Cl 11a_100016990191_100102526154 [0,2,0,0,0,0|2,0,0]=4 9087 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)Cl 1626a_100016990191_100102526154 [0,2,0,0,0,0|2,0,0]=4 9088 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)Cl 240690a_100016990191_100102526154 [0,2,0,0,0,0|2,0,0]=4 9089 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)F 11a_100015188798_100102526154 [0,2,0,0,0,0|2,0,0]=4 9090 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)F 1626a_100015188798_100102526154 [0,2,0,0,0,0|2,0,0]=4 9091 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cccc(n2)F 240690a_100015188798_100102526154 [0,2,0,0,0,0|2,0,0]=4 9092 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)Br 11a_100025757509_100102526154 [0,2,0,0,0,0|2,0,0]=4 9093 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)Br 240690a_100025757509_100102526154 [0,2,0,0,0,0|2,0,0]=4 9094 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)Cl 11a_100015205668_100102526154 [0,2,0,0,0,0|2,0,0]=4 9095 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)Cl 1626a_100015205668_100102526154 [0,2,0,0,0,0|2,0,0]=4 9096 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)Cl 240690a_100015205668_100102526154 [0,2,0,0,0,0|2,0,0]=4 9097 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)F 11a_100015188774_100102526154 [0,2,0,0,0,0|2,0,0]=4 9098 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)F 1626a_100015188774_100102526154 [0,2,0,0,0,0|2,0,0]=4 9099 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)F 240690a_100015188774_100102526154 [0,2,0,0,0,0|2,0,0]=4 9100 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)O 11a_100000748557_100102526154 [0,2,0,0,0,0|2,0,0]=4 9101 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2ccnc(c2)O 240690a_100000748557_100102526154 [0,2,0,0,0,0|2,0,0]=4 9102 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cncc(c2)Br 11a_100011249555_100102526154 [0,2,0,0,0,0|2,0,0]=4 9103 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cncc(c2)Br 240690a_100011249555_100102526154 [0,2,0,0,0,0|2,0,0]=4 9104 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cncc(c2)Cl 11a_200020614424_100102526154 [0,2,0,0,0,0|2,0,0]=4 9105 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cncc(c2)Cl 1626a_200020614424_100102526154 [0,2,0,0,0,0|2,0,0]=4 9106 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cncc(c2)Cl 240690a_200020614424_100102526154 [0,2,0,0,0,0|2,0,0]=4 9107 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cncc(c2)F 11a_100011962886_100102526154 [0,2,0,0,0,0|2,0,0]=4 9108 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cncc(c2)F 1626a_100011962886_100102526154 [0,2,0,0,0,0|2,0,0]=4 9109 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NCc2cncc(c2)F 240690a_100011962886_100102526154 [0,2,0,0,0,0|2,0,0]=4 9110 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NNc2cccc(c2)Br 22a_100000217339_100102526154 [0,2,0,0,0,0|2,0,0]=4 9111 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NNc2cccc(c2)Cl 22a_100000184277_100102526154 [0,2,0,0,0,0|2,0,0]=4 9112 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NNc2cccc(c2)F 22a_100000745080_100102526154 [0,2,0,0,0,0|2,0,0]=4 9113 B21R2.18994 O=C(C=Cc1ccc(cc1)I)NNc2cccc(c2)I 22a_100020605690_100102526154 [0,2,0,0,0,0|2,0,0]=4 9114 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cc(ccn2)Br 240690a_100009818019_100016269017 [0,2,0,0,0,0|2,0,0]=4 9115 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cc(ccn2)Cl 240690a_100000085674_100016269017 [0,2,0,0,0,0|2,0,0]=4 9116 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(=O)[nH]2 240690a_100000696482_100016269017 [0,2,0,0,0,0|2,0,0]=4 9117 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(c2)Br 240690a_100000174977_100016269017 [0,2,0,0,0,0|1,0,0]=3 9118 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(c2)Cl 240690a_100000174878_100016269017 [0,2,0,0,0,0|1,0,0]=3 9119 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(c2)F 240690a_100000174948_100016269017 [0,2,0,0,0,0|1,0,0]=3 9120 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(c2)I 240690a_100000106179_100016269017 [0,2,0,0,0,0|1,0,0]=3 9121 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(c2)O 240690a_100000743036_100016269017 [0,2,0,0,0,0|1,0,0]=3 9122 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(n2)Br 240690a_100016987751_100016269017 [0,2,0,0,0,0|2,0,0]=4 9123 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(n2)Cl 240690a_100016990191_100016269017 [0,2,0,0,0,0|2,0,0]=4 9124 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cccc(n2)F 240690a_100015188798_100016269017 [0,2,0,0,0,0|2,0,0]=4 9125 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2ccnc(c2)Br 240690a_100025757509_100016269017 [0,2,0,0,0,0|2,0,0]=4 9126 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2ccnc(c2)Cl 240690a_100015205668_100016269017 [0,2,0,0,0,0|2,0,0]=4 9127 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2ccnc(c2)F 240690a_100015188774_100016269017 [0,2,0,0,0,0|2,0,0]=4 9128 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2ccnc(c2)O 240690a_100000748557_100016269017 [0,2,0,0,0,0|2,0,0]=4 9129 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cncc(c2)Br 240690a_100011249555_100016269017 [0,2,0,0,0,0|2,0,0]=4 9130 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cncc(c2)Cl 240690a_200020614424_100016269017 [0,2,0,0,0,0|2,0,0]=4 9131 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NCc2cncc(c2)F 240690a_100011962886_100016269017 [0,2,0,0,0,0|2,0,0]=4 9132 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NNc2cccc(c2)Br 22a_100000217339_100016269017 [0,2,0,0,0,0|2,0,0]=4 9133 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NNc2cccc(c2)Cl 22a_100000184277_100016269017 [0,2,0,0,0,0|2,0,0]=4 9134 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NNc2cccc(c2)F 22a_100000745080_100016269017 [0,2,0,0,0,0|2,0,0]=4 9135 B21R2.18994 O=C(C=Cc1ccc(cc1)O)NNc2cccc(c2)I 22a_100020605690_100016269017 [0,2,0,0,0,0|2,0,0]=4 9136 B21R2.18994 O=C(C=Cc1ccc(cn1)Br)CCc2cccc(c2)Br 6a_100000754260_100011279149 [0,2,0,0,0,0|2,0,0]=4 9137 B21R2.18994 O=C(C=Cc1ccc(cn1)Br)CCc2cccc(c2)F 6a_100000754260_100000743863 [0,2,0,0,0,0|2,0,0]=4 9138 B21R2.18994 O=C(C=Cc1ccc(cn1)F)CCc2cccc(c2)Br 1458a_100020630499_100011740638 [0,2,0,0,0,0|2,0,0]=4 9139 B21R2.18994 O=C(C=Cc1ccc(cn1)F)CCc2cccc(c2)Br 6a_100011934744_100011279149 [0,2,0,0,0,0|2,0,0]=4 9140 B21R2.18994 O=C(C=Cc1ccc(cn1)F)CCc2cccc(c2)Cl 1458a_100020630499_100011713710 [0,2,0,0,0,0|2,0,0]=4 9141 B21R2.18994 O=C(C=Cc1ccc(cn1)F)CCc2cccc(c2)F 1458a_100020630499_100011217235 [0,2,0,0,0,0|2,0,0]=4 9142 B21R2.18994 O=C(C=Cc1ccc(cn1)F)CCc2cccc(c2)F 6a_100011934744_100000743863 [0,2,0,0,0,0|2,0,0]=4 9143 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)Br 11a_100000174977_100020630499 [0,2,0,0,0,0|2,0,0]=4 9144 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)Br 1626a_100000174977_100020630499 [0,2,0,0,0,0|2,0,0]=4 9145 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)Br 240690a_100000174977_100020630499 [0,2,0,0,0,0|2,0,0]=4 9146 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)Cl 11a_100000174878_100020630499 [0,2,0,0,0,0|2,0,0]=4 9147 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)Cl 1626a_100000174878_100020630499 [0,2,0,0,0,0|2,0,0]=4 9148 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)Cl 240690a_100000174878_100020630499 [0,2,0,0,0,0|2,0,0]=4 9149 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)F 11a_100000174948_100020630499 [0,2,0,0,0,0|2,0,0]=4 9150 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)F 1626a_100000174948_100020630499 [0,2,0,0,0,0|2,0,0]=4 9151 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)F 240690a_100000174948_100020630499 [0,2,0,0,0,0|2,0,0]=4 9152 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)I 11a_100000106179_100020630499 [0,2,0,0,0,0|2,0,0]=4 9153 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)I 1626a_100000106179_100020630499 [0,2,0,0,0,0|2,0,0]=4 9154 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)I 240690a_100000106179_100020630499 [0,2,0,0,0,0|2,0,0]=4 9155 B21R2.18994 O=C(C=Cc1ccc(cn1)F)NCc2cccc(c2)O 240690a_100000743036_100020630499 [0,2,0,0,0,0|2,0,0]=4 9156 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)CCc2cccc(c2)Br 1458a_100020588214_100011740638 [0,2,0,0,0,0|2,0,0]=4 9157 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)CCc2cccc(c2)Cl 1458a_100020588214_100011713710 [0,2,0,0,0,0|2,0,0]=4 9158 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)CCc2cccc(c2)F 1458a_100020588214_100011217235 [0,2,0,0,0,0|2,0,0]=4 9159 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)Br 11a_100000174977_100020588214 [0,2,0,0,0,0|2,0,0]=4 9160 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)Br 1626a_100000174977_100020588214 [0,2,0,0,0,0|2,0,0]=4 9161 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)Br 240690a_100000174977_100020588214 [0,2,0,0,0,0|2,0,0]=4 9162 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)Cl 11a_100000174878_100020588214 [0,2,0,0,0,0|2,0,0]=4 9163 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)Cl 1626a_100000174878_100020588214 [0,2,0,0,0,0|2,0,0]=4 9164 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)Cl 240690a_100000174878_100020588214 [0,2,0,0,0,0|2,0,0]=4 9165 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)F 11a_100000174948_100020588214 [0,2,0,0,0,0|2,0,0]=4 9166 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)F 1626a_100000174948_100020588214 [0,2,0,0,0,0|2,0,0]=4 9167 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)F 240690a_100000174948_100020588214 [0,2,0,0,0,0|2,0,0]=4 9168 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)I 11a_100000106179_100020588214 [0,2,0,0,0,0|2,0,0]=4 9169 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)I 1626a_100000106179_100020588214 [0,2,0,0,0,0|2,0,0]=4 9170 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)I 240690a_100000106179_100020588214 [0,2,0,0,0,0|2,0,0]=4 9171 B21R2.18994 O=C(C=Cc1ccc(nc1)Br)NCc2cccc(c2)O 240690a_100000743036_100020588214 [0,2,0,0,0,0|2,0,0]=4 9172 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CCc2ccc(cc2)Br 1458a_100016258244_100011740612 [0,2,0,0,0,0|1,0,0]=3 9173 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CCc2ccc(cc2)Cl 1458a_100016258244_100011713675 [0,2,0,0,0,0|1,0,0]=3 9174 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CCc2ccc(cc2)Cl 6a_100000210085_100011279170 [0,2,0,0,0,0|1,0,0]=3 9175 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CCc2ccc(cc2)F 1458a_100016258244_100011217392 [0,2,0,0,0,0|1,0,0]=3 9176 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CCc2ccc(cc2)F 6a_100000210085_100000743244 [0,2,0,0,0,0|1,0,0]=3 9177 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CCc2ccc(cc2)I 6a_100000210085_100000723691 [0,2,0,0,0,0|1,0,0]=3 9178 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CCc2ccc(cc2)O 1458a_100016258244_100009816426 [0,2,0,0,0,0|1,0,0]=3 9179 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CCc2ccc(cc2)O 6a_100000210085_100000198047 [0,2,0,0,0,0|1,0,0]=3 9180 B21R2.18994 O=C(C=Cc1cccc(c1)Br)COc2ccc(cc2)Cl 6a_100000210085_200000150450 [0,2,0,0,0,0|2,0,0]=4 9181 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CSc2ccc(cc2)Cl 6a_100000210085_100000150472 [0,2,0,0,0,0|2,0,0]=4 9182 B21R2.18994 O=C(C=Cc1cccc(c1)Br)CSc2ccc(cc2)F 6a_100000210085_200000148136 [0,2,0,0,0,0|2,0,0]=4 9183 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)Br 11a_100000174875_100016258244 [0,2,0,0,0,0|1,0,0]=3 9184 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)Br 1626a_100000174875_100016258244 [0,2,0,0,0,0|1,0,0]=3 9185 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)Br 240690a_100000174875_100016258244 [0,2,0,0,0,0|1,0,0]=3 9186 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)Cl 11a_100000174871_100016258244 [0,2,0,0,0,0|1,0,0]=3 9187 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)Cl 1626a_100000174871_100016258244 [0,2,0,0,0,0|1,0,0]=3 9188 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)Cl 240690a_100000174871_100016258244 [0,2,0,0,0,0|1,0,0]=3 9189 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)F 11a_100000174882_100016258244 [0,2,0,0,0,0|1,0,0]=3 9190 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)F 1626a_100000174882_100016258244 [0,2,0,0,0,0|1,0,0]=3 9191 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)F 240690a_100000174882_100016258244 [0,2,0,0,0,0|1,0,0]=3 9192 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)I 11a_100016989417_100016258244 [0,2,0,0,0,0|1,0,0]=3 9193 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)I 1626a_100016989417_100016258244 [0,2,0,0,0,0|1,0,0]=3 9194 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)I 240690a_100016989417_100016258244 [0,2,0,0,0,0|1,0,0]=3 9195 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cc2)O 240690a_100000185549_100016258244 [0,2,0,0,0,0|1,0,0]=3 9196 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)Br 11a_100015188789_100016258244 [0,2,0,0,0,0|2,0,0]=4 9197 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)Br 1626a_100015188789_100016258244 [0,2,0,0,0,0|2,0,0]=4 9198 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)Br 240690a_100015188789_100016258244 [0,2,0,0,0,0|2,0,0]=4 9199 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)Cl 11a_100000697193_100016258244 [0,2,0,0,0,0|2,0,0]=4 9200 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)Cl 1626a_100000697193_100016258244 [0,2,0,0,0,0|2,0,0]=4 9201 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)Cl 240690a_100000697193_100016258244 [0,2,0,0,0,0|2,0,0]=4 9202 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)F 11a_100020620131_100016258244 [0,2,0,0,0,0|2,0,0]=4 9203 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)F 1626a_100020620131_100016258244 [0,2,0,0,0,0|2,0,0]=4 9204 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)F 240690a_100020620131_100016258244 [0,2,0,0,0,0|2,0,0]=4 9205 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(cn2)O 240690a_100020605196_100016258244 [0,2,0,0,0,0|2,0,0]=4 9206 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)Br 11a_100009817727_100016258244 [0,2,0,0,0,0|2,0,0]=4 9207 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)Br 240690a_100009817727_100016258244 [0,2,0,0,0,0|2,0,0]=4 9208 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)Cl 11a_100000735879_100016258244 [0,2,0,0,0,0|2,0,0]=4 9209 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)Cl 1626a_100000735879_100016258244 [0,2,0,0,0,0|2,0,0]=4 9210 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)Cl 240690a_100000735879_100016258244 [0,2,0,0,0,0|2,0,0]=4 9211 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)F 11a_100000101913_100016258244 [0,2,0,0,0,0|2,0,0]=4 9212 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)F 1626a_100000101913_100016258244 [0,2,0,0,0,0|2,0,0]=4 9213 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)F 240690a_100000101913_100016258244 [0,2,0,0,0,0|2,0,0]=4 9214 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)O 11a_100000757128_100016258244 [0,2,0,0,0,0|2,0,0]=4 9215 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NCc2ccc(nc2)O 240690a_100000757128_100016258244 [0,2,0,0,0,0|2,0,0]=4 9216 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NNc2ccc(cc2)Br 22a_100000735608_100016258244 [0,2,0,0,0,0|2,0,0]=4 9217 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NNc2ccc(cc2)Cl 22a_100000683521_100016258244 [0,2,0,0,0,0|2,0,0]=4 9218 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NNc2ccc(cc2)F 22a_100000728448_100016258244 [0,2,0,0,0,0|2,0,0]=4 9219 B21R2.18994 O=C(C=Cc1cccc(c1)Br)NNc2ccc(cc2)I 22a_100016988836_100016258244 [0,2,0,0,0,0|2,0,0]=4 9220 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)CCc2ccc(cc2)Br 1458a_100000184502_100011740612 [0,2,0,0,0,0|1,0,0]=3 9221 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)CCc2ccc(cc2)Cl 1458a_100000184502_100011713675 [0,2,0,0,0,0|1,0,0]=3 9222 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)CCc2ccc(cc2)F 1458a_100000184502_100011217392 [0,2,0,0,0,0|1,0,0]=3 9223 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)CCc2ccc(cc2)O 1458a_100000184502_100009816426 [0,2,0,0,0,0|1,0,0]=3 9224 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)Br 11a_100000174875_100000184502 [0,2,0,0,0,0|1,0,0]=3 9225 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)Br 1626a_100000174875_100000184502 [0,2,0,0,0,0|1,0,0]=3 9226 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)Br 240690a_100000174875_100000184502 [0,2,0,0,0,0|1,0,0]=3 9227 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)Cl 11a_100000174871_100000184502 [0,2,0,0,0,0|1,0,0]=3 9228 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)Cl 1626a_100000174871_100000184502 [0,2,0,0,0,0|1,0,0]=3 9229 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)Cl 240690a_100000174871_100000184502 [0,2,0,0,0,0|1,0,0]=3 9230 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)F 11a_100000174882_100000184502 [0,2,0,0,0,0|1,0,0]=3 9231 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)F 1626a_100000174882_100000184502 [0,2,0,0,0,0|1,0,0]=3 9232 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)F 240690a_100000174882_100000184502 [0,2,0,0,0,0|1,0,0]=3 9233 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)I 11a_100016989417_100000184502 [0,2,0,0,0,0|1,0,0]=3 9234 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)I 1626a_100016989417_100000184502 [0,2,0,0,0,0|1,0,0]=3 9235 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)I 240690a_100016989417_100000184502 [0,2,0,0,0,0|1,0,0]=3 9236 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cc2)O 240690a_100000185549_100000184502 [0,2,0,0,0,0|1,0,0]=3 9237 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)Br 11a_100015188789_100000184502 [0,2,0,0,0,0|2,0,0]=4 9238 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)Br 1626a_100015188789_100000184502 [0,2,0,0,0,0|2,0,0]=4 9239 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)Br 240690a_100015188789_100000184502 [0,2,0,0,0,0|2,0,0]=4 9240 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)Cl 11a_100000697193_100000184502 [0,2,0,0,0,0|2,0,0]=4 9241 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)Cl 1626a_100000697193_100000184502 [0,2,0,0,0,0|2,0,0]=4 9242 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)Cl 240690a_100000697193_100000184502 [0,2,0,0,0,0|2,0,0]=4 9243 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)F 11a_100020620131_100000184502 [0,2,0,0,0,0|2,0,0]=4 9244 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)F 1626a_100020620131_100000184502 [0,2,0,0,0,0|2,0,0]=4 9245 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)F 240690a_100020620131_100000184502 [0,2,0,0,0,0|2,0,0]=4 9246 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(cn2)O 240690a_100020605196_100000184502 [0,2,0,0,0,0|2,0,0]=4 9247 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)Br 11a_100009817727_100000184502 [0,2,0,0,0,0|2,0,0]=4 9248 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)Br 240690a_100009817727_100000184502 [0,2,0,0,0,0|2,0,0]=4 9249 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)Cl 11a_100000735879_100000184502 [0,2,0,0,0,0|2,0,0]=4 9250 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)Cl 1626a_100000735879_100000184502 [0,2,0,0,0,0|2,0,0]=4 9251 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)Cl 240690a_100000735879_100000184502 [0,2,0,0,0,0|2,0,0]=4 9252 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)F 11a_100000101913_100000184502 [0,2,0,0,0,0|2,0,0]=4 9253 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)F 1626a_100000101913_100000184502 [0,2,0,0,0,0|2,0,0]=4 9254 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)F 240690a_100000101913_100000184502 [0,2,0,0,0,0|2,0,0]=4 9255 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)O 11a_100000757128_100000184502 [0,2,0,0,0,0|2,0,0]=4 9256 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NCc2ccc(nc2)O 240690a_100000757128_100000184502 [0,2,0,0,0,0|2,0,0]=4 9257 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NNc2ccc(cc2)Br 22a_100000735608_100000184502 [0,2,0,0,0,0|2,0,0]=4 9258 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NNc2ccc(cc2)Cl 22a_100000683521_100000184502 [0,2,0,0,0,0|2,0,0]=4 9259 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NNc2ccc(cc2)F 22a_100000728448_100000184502 [0,2,0,0,0,0|2,0,0]=4 9260 B21R2.18994 O=C(C=Cc1cccc(c1)Cl)NNc2ccc(cc2)I 22a_100016988836_100000184502 [0,2,0,0,0,0|2,0,0]=4 9261 B21R2.18994 O=C(C=Cc1cccc(c1)F)CCc2ccc(cc2)Br 1458a_100000718793_100011740612 [0,2,0,0,0,0|1,0,0]=3 9262 B21R2.18994 O=C(C=Cc1cccc(c1)F)CCc2ccc(cc2)Cl 1458a_100000718793_100011713675 [0,2,0,0,0,0|1,0,0]=3 9263 B21R2.18994 O=C(C=Cc1cccc(c1)F)CCc2ccc(cc2)Cl 6a_100000210812_100011279170 [0,2,0,0,0,0|1,0,0]=3 9264 B21R2.18994 O=C(C=Cc1cccc(c1)F)CCc2ccc(cc2)F 1458a_100000718793_100011217392 [0,2,0,0,0,0|1,0,0]=3 9265 B21R2.18994 O=C(C=Cc1cccc(c1)F)CCc2ccc(cc2)F 6a_100000210812_100000743244 [0,2,0,0,0,0|1,0,0]=3 9266 B21R2.18994 O=C(C=Cc1cccc(c1)F)CCc2ccc(cc2)I 6a_100000210812_100000723691 [0,2,0,0,0,0|1,0,0]=3 9267 B21R2.18994 O=C(C=Cc1cccc(c1)F)CCc2ccc(cc2)O 1458a_100000718793_100009816426 [0,2,0,0,0,0|1,0,0]=3 9268 B21R2.18994 O=C(C=Cc1cccc(c1)F)CCc2ccc(cc2)O 6a_100000210812_100000198047 [0,2,0,0,0,0|1,0,0]=3 9269 B21R2.18994 O=C(C=Cc1cccc(c1)F)COc2ccc(cc2)Cl 6a_100000210812_200000150450 [0,2,0,0,0,0|2,0,0]=4 9270 B21R2.18994 O=C(C=Cc1cccc(c1)F)CSc2ccc(cc2)Cl 6a_100000210812_100000150472 [0,2,0,0,0,0|2,0,0]=4 9271 B21R2.18994 O=C(C=Cc1cccc(c1)F)CSc2ccc(cc2)F 6a_100000210812_200000148136 [0,2,0,0,0,0|2,0,0]=4 9272 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)Br 11a_100000174875_100000718793 [0,2,0,0,0,0|1,0,0]=3 9273 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)Br 1626a_100000174875_100000718793 [0,2,0,0,0,0|1,0,0]=3 9274 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)Br 240690a_100000174875_100000718793 [0,2,0,0,0,0|1,0,0]=3 9275 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)Cl 11a_100000174871_100000718793 [0,2,0,0,0,0|1,0,0]=3 9276 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)Cl 1626a_100000174871_100000718793 [0,2,0,0,0,0|1,0,0]=3 9277 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)Cl 240690a_100000174871_100000718793 [0,2,0,0,0,0|1,0,0]=3 9278 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)F 11a_100000174882_100000718793 [0,2,0,0,0,0|1,0,0]=3 9279 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)F 1626a_100000174882_100000718793 [0,2,0,0,0,0|1,0,0]=3 9280 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)F 240690a_100000174882_100000718793 [0,2,0,0,0,0|1,0,0]=3 9281 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)I 11a_100016989417_100000718793 [0,2,0,0,0,0|1,0,0]=3 9282 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)I 1626a_100016989417_100000718793 [0,2,0,0,0,0|1,0,0]=3 9283 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)I 240690a_100016989417_100000718793 [0,2,0,0,0,0|1,0,0]=3 9284 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cc2)O 240690a_100000185549_100000718793 [0,2,0,0,0,0|1,0,0]=3 9285 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)Br 11a_100015188789_100000718793 [0,2,0,0,0,0|2,0,0]=4 9286 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)Br 1626a_100015188789_100000718793 [0,2,0,0,0,0|2,0,0]=4 9287 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)Br 240690a_100015188789_100000718793 [0,2,0,0,0,0|2,0,0]=4 9288 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)Cl 11a_100000697193_100000718793 [0,2,0,0,0,0|2,0,0]=4 9289 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)Cl 1626a_100000697193_100000718793 [0,2,0,0,0,0|2,0,0]=4 9290 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)Cl 240690a_100000697193_100000718793 [0,2,0,0,0,0|2,0,0]=4 9291 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)F 11a_100020620131_100000718793 [0,2,0,0,0,0|2,0,0]=4 9292 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)F 1626a_100020620131_100000718793 [0,2,0,0,0,0|2,0,0]=4 9293 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)F 240690a_100020620131_100000718793 [0,2,0,0,0,0|2,0,0]=4 9294 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(cn2)O 240690a_100020605196_100000718793 [0,2,0,0,0,0|2,0,0]=4 9295 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)Br 11a_100009817727_100000718793 [0,2,0,0,0,0|2,0,0]=4 9296 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)Br 240690a_100009817727_100000718793 [0,2,0,0,0,0|2,0,0]=4 9297 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)Cl 11a_100000735879_100000718793 [0,2,0,0,0,0|2,0,0]=4 9298 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)Cl 1626a_100000735879_100000718793 [0,2,0,0,0,0|2,0,0]=4 9299 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)Cl 240690a_100000735879_100000718793 [0,2,0,0,0,0|2,0,0]=4 9300 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)F 11a_100000101913_100000718793 [0,2,0,0,0,0|2,0,0]=4 9301 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)F 1626a_100000101913_100000718793 [0,2,0,0,0,0|2,0,0]=4 9302 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)F 240690a_100000101913_100000718793 [0,2,0,0,0,0|2,0,0]=4 9303 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)O 11a_100000757128_100000718793 [0,2,0,0,0,0|2,0,0]=4 9304 B21R2.18994 O=C(C=Cc1cccc(c1)F)NCc2ccc(nc2)O 240690a_100000757128_100000718793 [0,2,0,0,0,0|2,0,0]=4 9305 B21R2.18994 O=C(C=Cc1cccc(c1)F)NNc2ccc(cc2)Br 22a_100000735608_100000718793 [0,2,0,0,0,0|2,0,0]=4 9306 B21R2.18994 O=C(C=Cc1cccc(c1)F)NNc2ccc(cc2)Cl 22a_100000683521_100000718793 [0,2,0,0,0,0|2,0,0]=4 9307 B21R2.18994 O=C(C=Cc1cccc(c1)F)NNc2ccc(cc2)F 22a_100000728448_100000718793 [0,2,0,0,0,0|2,0,0]=4 9308 B21R2.18994 O=C(C=Cc1cccc(c1)F)NNc2ccc(cc2)I 22a_100016988836_100000718793 [0,2,0,0,0,0|2,0,0]=4 9309 B21R2.18994 O=C(C=Cc1cccc(c1)I)CCc2ccc(cc2)Br 1458a_100020647043_100011740612 [0,2,0,0,0,0|1,0,0]=3 9310 B21R2.18994 O=C(C=Cc1cccc(c1)I)CCc2ccc(cc2)Cl 1458a_100020647043_100011713675 [0,2,0,0,0,0|1,0,0]=3 9311 B21R2.18994 O=C(C=Cc1cccc(c1)I)CCc2ccc(cc2)Cl 6a_100000014684_100011279170 [0,2,0,0,0,0|1,0,0]=3 9312 B21R2.18994 O=C(C=Cc1cccc(c1)I)CCc2ccc(cc2)F 1458a_100020647043_100011217392 [0,2,0,0,0,0|1,0,0]=3 9313 B21R2.18994 O=C(C=Cc1cccc(c1)I)CCc2ccc(cc2)F 6a_100000014684_100000743244 [0,2,0,0,0,0|1,0,0]=3 9314 B21R2.18994 O=C(C=Cc1cccc(c1)I)CCc2ccc(cc2)I 6a_100000014684_100000723691 [0,2,0,0,0,0|1,0,0]=3 9315 B21R2.18994 O=C(C=Cc1cccc(c1)I)CCc2ccc(cc2)O 1458a_100020647043_100009816426 [0,2,0,0,0,0|1,0,0]=3 9316 B21R2.18994 O=C(C=Cc1cccc(c1)I)CCc2ccc(cc2)O 6a_100000014684_100000198047 [0,2,0,0,0,0|1,0,0]=3 9317 B21R2.18994 O=C(C=Cc1cccc(c1)I)COc2ccc(cc2)Cl 6a_100000014684_200000150450 [0,2,0,0,0,0|2,0,0]=4 9318 B21R2.18994 O=C(C=Cc1cccc(c1)I)CSc2ccc(cc2)Cl 6a_100000014684_100000150472 [0,2,0,0,0,0|2,0,0]=4 9319 B21R2.18994 O=C(C=Cc1cccc(c1)I)CSc2ccc(cc2)F 6a_100000014684_200000148136 [0,2,0,0,0,0|2,0,0]=4 9320 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)Br 11a_100000174875_100020647043 [0,2,0,0,0,0|1,0,0]=3 9321 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)Br 1626a_100000174875_100020647043 [0,2,0,0,0,0|1,0,0]=3 9322 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)Br 240690a_100000174875_100020647043 [0,2,0,0,0,0|1,0,0]=3 9323 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)Cl 11a_100000174871_100020647043 [0,2,0,0,0,0|1,0,0]=3 9324 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)Cl 1626a_100000174871_100020647043 [0,2,0,0,0,0|1,0,0]=3 9325 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)Cl 240690a_100000174871_100020647043 [0,2,0,0,0,0|1,0,0]=3 9326 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)F 11a_100000174882_100020647043 [0,2,0,0,0,0|1,0,0]=3 9327 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)F 1626a_100000174882_100020647043 [0,2,0,0,0,0|1,0,0]=3 9328 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)F 240690a_100000174882_100020647043 [0,2,0,0,0,0|1,0,0]=3 9329 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)I 11a_100016989417_100020647043 [0,2,0,0,0,0|1,0,0]=3 9330 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)I 1626a_100016989417_100020647043 [0,2,0,0,0,0|1,0,0]=3 9331 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)I 240690a_100016989417_100020647043 [0,2,0,0,0,0|1,0,0]=3 9332 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cc2)O 240690a_100000185549_100020647043 [0,2,0,0,0,0|1,0,0]=3 9333 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)Br 11a_100015188789_100020647043 [0,2,0,0,0,0|2,0,0]=4 9334 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)Br 1626a_100015188789_100020647043 [0,2,0,0,0,0|2,0,0]=4 9335 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)Br 240690a_100015188789_100020647043 [0,2,0,0,0,0|2,0,0]=4 9336 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)Cl 11a_100000697193_100020647043 [0,2,0,0,0,0|2,0,0]=4 9337 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)Cl 1626a_100000697193_100020647043 [0,2,0,0,0,0|2,0,0]=4 9338 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)Cl 240690a_100000697193_100020647043 [0,2,0,0,0,0|2,0,0]=4 9339 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)F 11a_100020620131_100020647043 [0,2,0,0,0,0|2,0,0]=4 9340 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)F 1626a_100020620131_100020647043 [0,2,0,0,0,0|2,0,0]=4 9341 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)F 240690a_100020620131_100020647043 [0,2,0,0,0,0|2,0,0]=4 9342 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(cn2)O 240690a_100020605196_100020647043 [0,2,0,0,0,0|2,0,0]=4 9343 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)Br 11a_100009817727_100020647043 [0,2,0,0,0,0|2,0,0]=4 9344 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)Br 240690a_100009817727_100020647043 [0,2,0,0,0,0|2,0,0]=4 9345 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)Cl 11a_100000735879_100020647043 [0,2,0,0,0,0|2,0,0]=4 9346 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)Cl 1626a_100000735879_100020647043 [0,2,0,0,0,0|2,0,0]=4 9347 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)Cl 240690a_100000735879_100020647043 [0,2,0,0,0,0|2,0,0]=4 9348 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)F 11a_100000101913_100020647043 [0,2,0,0,0,0|2,0,0]=4 9349 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)F 1626a_100000101913_100020647043 [0,2,0,0,0,0|2,0,0]=4 9350 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)F 240690a_100000101913_100020647043 [0,2,0,0,0,0|2,0,0]=4 9351 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)O 11a_100000757128_100020647043 [0,2,0,0,0,0|2,0,0]=4 9352 B21R2.18994 O=C(C=Cc1cccc(c1)I)NCc2ccc(nc2)O 240690a_100000757128_100020647043 [0,2,0,0,0,0|2,0,0]=4 9353 B21R2.18994 O=C(C=Cc1cccc(c1)I)NNc2ccc(cc2)Br 22a_100000735608_100020647043 [0,2,0,0,0,0|2,0,0]=4 9354 B21R2.18994 O=C(C=Cc1cccc(c1)I)NNc2ccc(cc2)Cl 22a_100000683521_100020647043 [0,2,0,0,0,0|2,0,0]=4 9355 B21R2.18994 O=C(C=Cc1cccc(c1)I)NNc2ccc(cc2)F 22a_100000728448_100020647043 [0,2,0,0,0,0|2,0,0]=4 9356 B21R2.18994 O=C(C=Cc1cccc(c1)I)NNc2ccc(cc2)I 22a_100016988836_100020647043 [0,2,0,0,0,0|2,0,0]=4 9357 B21R2.18994 O=C(C=Cc1cccc(c1)O)NNc2ccc(cc2)Br 22a_100000735608_100102525460 [0,2,0,0,0,0|2,0,0]=4 9358 B21R2.18994 O=C(C=Cc1cccc(c1)O)NNc2ccc(cc2)Cl 22a_100000683521_100102525460 [0,2,0,0,0,0|2,0,0]=4 9359 B21R2.18994 O=C(C=Cc1cccc(c1)O)NNc2ccc(cc2)F 22a_100000728448_100102525460 [0,2,0,0,0,0|2,0,0]=4 9360 B21R2.18994 O=C(C=Cc1cccc(c1)O)NNc2ccc(cc2)I 22a_100016988836_100102525460 [0,2,0,0,0,0|2,0,0]=4 9361 B21R2.18994 O=C(C=Cc1cncc(c1)Br)CCc2ccc(cc2)Cl 6a_100000687066_100011279170 [0,2,0,0,0,0|2,0,0]=4 9362 B21R2.18994 O=C(C=Cc1cncc(c1)Br)CCc2ccc(cc2)F 6a_100000687066_100000743244 [0,2,0,0,0,0|2,0,0]=4 9363 B21R2.18994 O=C(C=Cc1cncc(c1)Br)CCc2ccc(cc2)I 6a_100000687066_100000723691 [0,2,0,0,0,0|2,0,0]=4 9364 B21R2.18994 O=C(C=Cc1cncc(c1)Br)CCc2ccc(cc2)O 6a_100000687066_100000198047 [0,2,0,0,0,0|2,0,0]=4 9365 B21R2.18994 O=C(C=Cc1cncc(c1)Cl)CCc2ccc(cc2)Cl 6a_100000088910_100011279170 [0,2,0,0,0,0|2,0,0]=4 9366 B21R2.18994 O=C(C=Cc1cncc(c1)Cl)CCc2ccc(cc2)F 6a_100000088910_100000743244 [0,2,0,0,0,0|2,0,0]=4 9367 B21R2.18994 O=C(C=Cc1cncc(c1)Cl)CCc2ccc(cc2)I 6a_100000088910_100000723691 [0,2,0,0,0,0|2,0,0]=4 9368 B21R2.18994 O=C(C=Cc1cncc(c1)Cl)CCc2ccc(cc2)O 6a_100000088910_100000198047 [0,2,0,0,0,0|2,0,0]=4 9369 B21R2.18994 O=C(C=Cc1cncc(c1)F)CCc2ccc(cc2)Cl 6a_100011361476_100011279170 [0,2,0,0,0,0|2,0,0]=4 9370 B21R2.18994 O=C(C=Cc1cncc(c1)F)CCc2ccc(cc2)F 6a_100011361476_100000743244 [0,2,0,0,0,0|2,0,0]=4 9371 B21R2.18994 O=C(C=Cc1cncc(c1)F)CCc2ccc(cc2)I 6a_100011361476_100000723691 [0,2,0,0,0,0|2,0,0]=4 9372 B21R2.18994 O=C(C=Cc1cncc(c1)F)CCc2ccc(cc2)O 6a_100011361476_100000198047 [0,2,0,0,0,0|2,0,0]=4 9373 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)CCc2ccc(cc2)Br 1458a_100016990649_100011740612 [0,2,0,0,0,0|1,0,0]=3 9374 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)CCc2ccc(cc2)C 1458a_100016990649_100011713686 [0,2,0,0,0,0|1,0,0]=3 9375 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)CCc2ccc(cc2)Cl 1458a_100016990649_100011713675 [0,2,0,0,0,0|1,0,0]=3 9376 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)CCc2ccc(cc2)F 1458a_100016990649_100011217392 [0,2,0,0,0,0|1,0,0]=3 9377 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)CCc2ccc(cc2)O 1458a_100016990649_100009816426 [0,2,0,0,0,0|1,0,0]=3 9378 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)Br 11a_100000174875_100016990649 [0,2,0,0,0,0|1,0,0]=3 9379 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)Br 1626a_100000174875_100016990649 [0,2,0,0,0,0|1,0,0]=3 9380 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)Br 527a_100000174875_100016990649 [0,2,0,0,0,0|1,0,0]=3 9381 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)C 11a_100000174908_100016990649 [0,2,0,0,0,0|1,0,0]=3 9382 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)C 1626a_100000174908_100016990649 [0,2,0,0,0,0|1,0,0]=3 9383 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)C 527a_100000174908_100016990649 [0,2,0,0,0,0|1,0,0]=3 9384 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)Cl 11a_100000174871_100016990649 [0,2,0,0,0,0|1,0,0]=3 9385 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)Cl 1626a_100000174871_100016990649 [0,2,0,0,0,0|1,0,0]=3 9386 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)Cl 527a_100000174871_100016990649 [0,2,0,0,0,0|1,0,0]=3 9387 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)F 11a_100000174882_100016990649 [0,2,0,0,0,0|1,0,0]=3 9388 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)F 1626a_100000174882_100016990649 [0,2,0,0,0,0|1,0,0]=3 9389 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)F 527a_100000174882_100016990649 [0,2,0,0,0,0|1,0,0]=3 9390 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)I 11a_100016989417_100016990649 [0,2,0,0,0,0|1,0,0]=3 9391 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)I 1626a_100016989417_100016990649 [0,2,0,0,0,0|1,0,0]=3 9392 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)I 527a_100016989417_100016990649 [0,2,0,0,0,0|1,0,0]=3 9393 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cc2)O 527a_100000185549_100016990649 [0,2,0,0,0,0|1,0,0]=3 9394 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)Br 11a_100015188789_100016990649 [0,2,0,0,0,0|2,0,0]=4 9395 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)Br 1626a_100015188789_100016990649 [0,2,0,0,0,0|2,0,0]=4 9396 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)Br 527a_100015188789_100016990649 [0,2,0,0,0,0|2,0,0]=4 9397 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)C 11a_100015187455_100016990649 [0,2,0,0,0,0|2,0,0]=4 9398 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)C 1626a_100015187455_100016990649 [0,2,0,0,0,0|2,0,0]=4 9399 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)C 527a_100015187455_100016990649 [0,2,0,0,0,0|2,0,0]=4 9400 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)Cl 11a_100000697193_100016990649 [0,2,0,0,0,0|2,0,0]=4 9401 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)Cl 1626a_100000697193_100016990649 [0,2,0,0,0,0|2,0,0]=4 9402 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)Cl 527a_100000697193_100016990649 [0,2,0,0,0,0|2,0,0]=4 9403 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)F 11a_100020620131_100016990649 [0,2,0,0,0,0|2,0,0]=4 9404 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)F 1626a_100020620131_100016990649 [0,2,0,0,0,0|2,0,0]=4 9405 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(cn2)F 527a_100020620131_100016990649 [0,2,0,0,0,0|2,0,0]=4 9406 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)Br 11a_100009817727_100016990649 [0,2,0,0,0,0|2,0,0]=4 9407 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)Br 527a_100009817727_100016990649 [0,2,0,0,0,0|2,0,0]=4 9408 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)C 11a_100000740942_100016990649 [0,2,0,0,0,0|2,0,0]=4 9409 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)C 1626a_100000740942_100016990649 [0,2,0,0,0,0|2,0,0]=4 9410 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)C 527a_100000740942_100016990649 [0,2,0,0,0,0|2,0,0]=4 9411 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)Cl 11a_100000735879_100016990649 [0,2,0,0,0,0|2,0,0]=4 9412 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)Cl 1626a_100000735879_100016990649 [0,2,0,0,0,0|2,0,0]=4 9413 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)Cl 527a_100000735879_100016990649 [0,2,0,0,0,0|2,0,0]=4 9414 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)F 11a_100000101913_100016990649 [0,2,0,0,0,0|2,0,0]=4 9415 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)F 1626a_100000101913_100016990649 [0,2,0,0,0,0|2,0,0]=4 9416 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)F 527a_100000101913_100016990649 [0,2,0,0,0,0|2,0,0]=4 9417 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NCc2ccc(nc2)O 11a_100000757128_100016990649 [0,2,0,0,0,0|2,0,0]=4 9418 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NNc2ccc(cc2)Br 22a_100000735608_100016990649 [0,2,0,0,0,0|2,0,0]=4 9419 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NNc2ccc(cc2)C 22a_100000683527_100016990649 [0,2,0,0,0,0|2,0,0]=4 9420 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NNc2ccc(cc2)Cl 22a_100000683521_100016990649 [0,2,0,0,0,0|2,0,0]=4 9421 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NNc2ccc(cc2)F 22a_100000728448_100016990649 [0,2,0,0,0,0|2,0,0]=4 9422 B21R2.19004 C/C(=C\c1ccccc1)/C(=O)NNc2ccc(cc2)I 22a_100016988836_100016990649 [0,2,0,0,0,0|2,0,0]=4 9423 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)CCc2ccc(cc2)Br 1458a_100025712827_100011740612 [0,2,0,0,0,0|2,0,0]=4 9424 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)CCc2ccc(cc2)C 1458a_100025712827_100011713686 [0,2,0,0,0,0|2,0,0]=4 9425 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)CCc2ccc(cc2)Cl 1458a_100025712827_100011713675 [0,2,0,0,0,0|2,0,0]=4 9426 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)CCc2ccc(cc2)F 1458a_100025712827_100011217392 [0,2,0,0,0,0|2,0,0]=4 9427 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)CCc2ccc(cc2)O 1458a_100025712827_100009816426 [0,2,0,0,0,0|2,0,0]=4 9428 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)Br 11a_100000174875_100025712827 [0,2,0,0,0,0|2,0,0]=4 9429 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)Br 1626a_100000174875_100025712827 [0,2,0,0,0,0|2,0,0]=4 9430 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)Br 527a_100000174875_100025712827 [0,2,0,0,0,0|2,0,0]=4 9431 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)C 11a_100000174908_100025712827 [0,2,0,0,0,0|2,0,0]=4 9432 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)C 1626a_100000174908_100025712827 [0,2,0,0,0,0|2,0,0]=4 9433 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)C 527a_100000174908_100025712827 [0,2,0,0,0,0|2,0,0]=4 9434 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)Cl 11a_100000174871_100025712827 [0,2,0,0,0,0|2,0,0]=4 9435 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)Cl 1626a_100000174871_100025712827 [0,2,0,0,0,0|2,0,0]=4 9436 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)Cl 527a_100000174871_100025712827 [0,2,0,0,0,0|2,0,0]=4 9437 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)F 11a_100000174882_100025712827 [0,2,0,0,0,0|2,0,0]=4 9438 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)F 1626a_100000174882_100025712827 [0,2,0,0,0,0|2,0,0]=4 9439 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)F 527a_100000174882_100025712827 [0,2,0,0,0,0|2,0,0]=4 9440 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)I 11a_100016989417_100025712827 [0,2,0,0,0,0|2,0,0]=4 9441 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)I 1626a_100016989417_100025712827 [0,2,0,0,0,0|2,0,0]=4 9442 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)I 527a_100016989417_100025712827 [0,2,0,0,0,0|2,0,0]=4 9443 B21R2.19004 C/C(=C\c1ccccn1)/C(=O)NCc2ccc(cc2)O 527a_100000185549_100025712827 [0,2,0,0,0,0|2,0,0]=4 9444 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)Br 11a_100000174875_100000066491 [0,2,0,0,0,0|1,0,1]=4 9445 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)Br 1626a_100000174875_100000066491 [0,2,0,0,0,0|1,0,1]=4 9446 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)C 11a_100000174908_100000066491 [0,2,0,0,0,0|1,0,1]=4 9447 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)C 1626a_100000174908_100000066491 [0,2,0,0,0,0|1,0,1]=4 9448 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)Cl 11a_100000174871_100000066491 [0,2,0,0,0,0|1,0,1]=4 9449 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)Cl 1626a_100000174871_100000066491 [0,2,0,0,0,0|1,0,1]=4 9450 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)F 11a_100000174882_100000066491 [0,2,0,0,0,0|1,0,1]=4 9451 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)F 1626a_100000174882_100000066491 [0,2,0,0,0,0|1,0,1]=4 9452 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)I 11a_100016989417_100000066491 [0,2,0,0,0,0|1,0,1]=4 9453 B21R2.19004 C=C(Cc1ccccc1)C(=O)NCc2ccc(cc2)I 1626a_100016989417_100000066491 [0,2,0,0,0,0|1,0,1]=4 9454 B21R2.19004 CC(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)Br 1458a_100016267368_200011218536 [0,2,0,0,0,0|1,0,0]=3 9455 B21R2.19004 CC(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)Cl 1458a_100000184863_200011218536 [0,2,0,0,0,0|1,0,0]=3 9456 B21R2.19004 CC(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)F 1458a_100000182136_200011218536 [0,2,0,0,0,0|1,0,0]=3 9457 B21R2.19004 CC(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)I 1458a_100102526154_200011218536 [0,2,0,0,0,0|1,0,0]=3 9458 B21R2.19004 CC(Cc1ccccc1)C(=O)C=Cc2ccc(cn2)F 1458a_100020630499_200011218536 [0,2,0,0,0,0|2,0,0]=4 9459 B21R2.19004 CC(Cc1ccccc1)C(=O)C=Cc2ccc(nc2)Br 1458a_100020588214_200011218536 [0,2,0,0,0,0|2,0,0]=4 9460 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)Br 11a_100000186898_100016267368 [0,2,0,0,0,0|1,0,0]=3 9461 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)Br 1626a_100000186898_100016267368 [0,2,0,0,0,0|1,0,0]=3 9462 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)Cl 11a_100000186898_100000184863 [0,2,0,0,0,0|1,0,0]=3 9463 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)Cl 1626a_100000186898_100000184863 [0,2,0,0,0,0|1,0,0]=3 9464 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)Cl 240690a_100000186898_100000184863 [0,2,0,0,0,0|1,0,0]=3 9465 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)F 11a_100000186898_100000182136 [0,2,0,0,0,0|1,0,0]=3 9466 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)F 1626a_100000186898_100000182136 [0,2,0,0,0,0|1,0,0]=3 9467 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)F 240690a_100000186898_100000182136 [0,2,0,0,0,0|1,0,0]=3 9468 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)I 11a_100000186898_100102526154 [0,2,0,0,0,0|1,0,0]=3 9469 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)I 1626a_100000186898_100102526154 [0,2,0,0,0,0|1,0,0]=3 9470 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)I 240690a_100000186898_100102526154 [0,2,0,0,0,0|1,0,0]=3 9471 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cc2)O 240690a_100000186898_100016269017 [0,2,0,0,0,0|1,0,0]=3 9472 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cn2)F 11a_100000186898_100020630499 [0,2,0,0,0,0|2,0,0]=4 9473 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cn2)F 1626a_100000186898_100020630499 [0,2,0,0,0,0|2,0,0]=4 9474 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(cn2)F 240690a_100000186898_100020630499 [0,2,0,0,0,0|2,0,0]=4 9475 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(nc2)Br 11a_100000186898_100020588214 [0,2,0,0,0,0|2,0,0]=4 9476 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(nc2)Br 1626a_100000186898_100020588214 [0,2,0,0,0,0|2,0,0]=4 9477 B21R2.19004 CN(Cc1ccccc1)C(=O)C=Cc2ccc(nc2)Br 240690a_100000186898_100020588214 [0,2,0,0,0,0|2,0,0]=4 9478 B21R2.19004 CN(Cc1ccccn1)C(=O)C=Cc2ccc(cc2)Br 11a_100000207498_100016267368 [0,2,0,0,0,0|2,0,0]=4 9479 B21R2.19004 CN(Cc1ccccn1)C(=O)C=Cc2ccc(cc2)Cl 11a_100000207498_100000184863 [0,2,0,0,0,0|2,0,0]=4 9480 B21R2.19004 CN(Cc1ccccn1)C(=O)C=Cc2ccc(cc2)Cl 240690a_100000207498_100000184863 [0,2,0,0,0,0|2,0,0]=4 9481 B21R2.19004 CN(Cc1ccccn1)C(=O)C=Cc2ccc(cc2)F 11a_100000207498_100000182136 [0,2,0,0,0,0|2,0,0]=4 9482 B21R2.19004 CN(Cc1ccccn1)C(=O)C=Cc2ccc(cc2)F 240690a_100000207498_100000182136 [0,2,0,0,0,0|2,0,0]=4 9483 B21R2.19004 CN(Cc1ccccn1)C(=O)C=Cc2ccc(cc2)I 11a_100000207498_100102526154 [0,2,0,0,0,0|2,0,0]=4 9484 B21R2.19004 CN(Cc1ccccn1)C(=O)C=Cc2ccc(cc2)I 240690a_100000207498_100102526154 [0,2,0,0,0,0|2,0,0]=4 9485 B21R2.19004 CN(Cc1ccccn1)C(=O)C=Cc2ccc(cc2)O 240690a_100000207498_100016269017 [0,2,0,0,0,0|2,0,0]=4 9486 B21R2.19004 CN(Cc1cccnc1)C(=O)C=Cc2ccc(cc2)Br 11a_100000184577_100016267368 [0,2,0,0,0,0|2,0,0]=4 9487 B21R2.19004 CN(Cc1cccnc1)C(=O)C=Cc2ccc(cc2)Cl 11a_100000184577_100000184863 [0,2,0,0,0,0|2,0,0]=4 9488 B21R2.19004 CN(Cc1cccnc1)C(=O)C=Cc2ccc(cc2)Cl 240690a_100000184577_100000184863 [0,2,0,0,0,0|2,0,0]=4 9489 B21R2.19004 CN(Cc1cccnc1)C(=O)C=Cc2ccc(cc2)F 11a_100000184577_100000182136 [0,2,0,0,0,0|2,0,0]=4 9490 B21R2.19004 CN(Cc1cccnc1)C(=O)C=Cc2ccc(cc2)F 240690a_100000184577_100000182136 [0,2,0,0,0,0|2,0,0]=4 9491 B21R2.19004 CN(Cc1cccnc1)C(=O)C=Cc2ccc(cc2)I 11a_100000184577_100102526154 [0,2,0,0,0,0|2,0,0]=4 9492 B21R2.19004 CN(Cc1cccnc1)C(=O)C=Cc2ccc(cc2)I 240690a_100000184577_100102526154 [0,2,0,0,0,0|2,0,0]=4 9493 B21R2.19004 CN(Cc1cccnc1)C(=O)C=Cc2ccc(cc2)O 240690a_100000184577_100016269017 [0,2,0,0,0,0|2,0,0]=4 9494 B21R2.19004 CN(Cc1ccncc1)C(=O)C=Cc2ccc(cc2)Br 11a_100000187231_100016267368 [0,2,0,0,0,0|2,0,0]=4 9495 B21R2.19004 CN(Cc1ccncc1)C(=O)C=Cc2ccc(cc2)Cl 11a_100000187231_100000184863 [0,2,0,0,0,0|2,0,0]=4 9496 B21R2.19004 CN(Cc1ccncc1)C(=O)C=Cc2ccc(cc2)Cl 240690a_100000187231_100000184863 [0,2,0,0,0,0|2,0,0]=4 9497 B21R2.19004 CN(Cc1ccncc1)C(=O)C=Cc2ccc(cc2)F 11a_100000187231_100000182136 [0,2,0,0,0,0|2,0,0]=4 9498 B21R2.19004 CN(Cc1ccncc1)C(=O)C=Cc2ccc(cc2)F 240690a_100000187231_100000182136 [0,2,0,0,0,0|2,0,0]=4 9499 B21R2.19004 CN(Cc1ccncc1)C(=O)C=Cc2ccc(cc2)I 11a_100000187231_100102526154 [0,2,0,0,0,0|2,0,0]=4 9500 B21R2.19004 CN(Cc1ccncc1)C(=O)C=Cc2ccc(cc2)I 240690a_100000187231_100102526154 [0,2,0,0,0,0|2,0,0]=4 9501 B21R2.19004 CN(Cc1ccncc1)C(=O)C=Cc2ccc(cc2)O 240690a_100000187231_100016269017 [0,2,0,0,0,0|2,0,0]=4 9502 B21R2.19004 Cc1ccc(cc1)C=CC(=O)C(C)Cc2ccccc2 1458a_100000716854_200011218536 [0,2,0,0,0,0|1,0,0]=3 9503 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2ccccc2 11a_100000186898_100000716854 [0,2,0,0,0,0|1,0,0]=3 9504 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2ccccc2 1626a_100000186898_100000716854 [0,2,0,0,0,0|1,0,0]=3 9505 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2ccccc2 240690a_100000186898_100000716854 [0,2,0,0,0,0|1,0,0]=3 9506 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2ccccn2 11a_100000207498_100000716854 [0,2,0,0,0,0|2,0,0]=4 9507 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2ccccn2 240690a_100000207498_100000716854 [0,2,0,0,0,0|2,0,0]=4 9508 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2cccnc2 11a_100000184577_100000716854 [0,2,0,0,0,0|2,0,0]=4 9509 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2cccnc2 240690a_100000184577_100000716854 [0,2,0,0,0,0|2,0,0]=4 9510 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2ccncc2 11a_100000187231_100000716854 [0,2,0,0,0,0|2,0,0]=4 9511 B21R2.19004 Cc1ccc(cc1)C=CC(=O)N(C)Cc2ccncc2 240690a_100000187231_100000716854 [0,2,0,0,0,0|2,0,0]=4 9512 B21R2.19004 Cc1ccc(cc1)CCC(=O)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011713686 [0,2,0,0,0,0|1,0,0]=3 9513 B21R2.19004 Cc1ccc(cc1)CCC(=O)/C(=C\c2ccccc2)/F 1458a_100020889036_100011713686 [0,2,0,0,0,0|1,0,0]=3 9514 B21R2.19004 Cc1ccc(cc1)CCC(=O)C(=Cc2cccnc2)F 1458a_100000731744_100011713686 [0,2,0,0,0,0|2,0,0]=4 9515 B21R2.19004 Cc1ccc(cc1)CCC(=O)C(=O)Nc2ccccc2 1458a_100000738435_100011713686 [0,2,0,0,0,0|2,0,0]=4 9516 B21R2.19004 Cc1ccc(cc1)CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000174908_200020598536 [0,2,0,0,0,0|1,0,0]=3 9517 B21R2.19004 Cc1ccc(cc1)CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000174908_200020598536 [0,2,0,0,0,0|1,0,0]=3 9518 B21R2.19004 Cc1ccc(cc1)CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000174908_200020598536 [0,2,0,0,0,0|1,0,0]=3 9519 B21R2.19004 Cc1ccc(cc1)CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000174908_200020598536 [0,2,0,0,0,0|1,0,0]=3 9520 B21R2.19004 Cc1ccc(cc1)CNC(=O)/C(=C\c2ccccc2)/F 11a_100000174908_100020889036 [0,2,0,0,0,0|1,0,0]=3 9521 B21R2.19004 Cc1ccc(cc1)CNC(=O)/C(=C\c2ccccc2)/F 527a_100000174908_100020889036 [0,2,0,0,0,0|1,0,0]=3 9522 B21R2.19004 Cc1ccc(cc1)CNC(=O)C(=Cc2cccnc2)F 11a_100000174908_100000731744 [0,2,0,0,0,0|2,0,0]=4 9523 B21R2.19004 Cc1ccc(cc1)CNC(=O)C(=Cc2cccnc2)F 240690a_100000174908_100000731744 [0,2,0,0,0,0|2,0,0]=4 9524 B21R2.19004 Cc1ccc(cc1)CNC(=O)C(=Cc2cccnc2)F 527a_100000174908_100000731744 [0,2,0,0,0,0|2,0,0]=4 9525 B21R2.19004 Cc1ccc(cc1)CNC(=O)C(=O)Nc2ccccc2 240690a_100000174908_100000738435 [0,2,0,0,0,0|2,0,0]=4 9526 B21R2.19004 Cc1ccc(cc1)NNC(=O)/C(=C/c2ccccc2)/Cl 22a_100000683527_200020598536 [0,2,0,0,0,0|2,0,0]=4 9527 B21R2.19004 Cc1ccc(cc1)NNC(=O)/C(=C\c2ccccc2)/F 22a_100000683527_100020889036 [0,2,0,0,0,0|2,0,0]=4 9528 B21R2.19004 Cc1ccc(cn1)CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000740942_200020598536 [0,2,0,0,0,0|2,0,0]=4 9529 B21R2.19004 Cc1ccc(cn1)CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000740942_200020598536 [0,2,0,0,0,0|2,0,0]=4 9530 B21R2.19004 Cc1ccc(cn1)CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000740942_200020598536 [0,2,0,0,0,0|2,0,0]=4 9531 B21R2.19004 Cc1ccc(cn1)CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000740942_200020598536 [0,2,0,0,0,0|2,0,0]=4 9532 B21R2.19004 Cc1ccc(cn1)CNC(=O)/C(=C\c2ccccc2)/F 11a_100000740942_100020889036 [0,2,0,0,0,0|2,0,0]=4 9533 B21R2.19004 Cc1ccc(cn1)CNC(=O)/C(=C\c2ccccc2)/F 527a_100000740942_100020889036 [0,2,0,0,0,0|2,0,0]=4 9534 B21R2.19004 Cc1ccc(nc1)CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100015187455_200020598536 [0,2,0,0,0,0|2,0,0]=4 9535 B21R2.19004 Cc1ccc(nc1)CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100015187455_200020598536 [0,2,0,0,0,0|2,0,0]=4 9536 B21R2.19004 Cc1ccc(nc1)CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100015187455_200020598536 [0,2,0,0,0,0|2,0,0]=4 9537 B21R2.19004 Cc1ccc(nc1)CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100015187455_200020598536 [0,2,0,0,0,0|2,0,0]=4 9538 B21R2.19004 Cc1ccc(nc1)CNC(=O)/C(=C\c2ccccc2)/F 11a_100015187455_100020889036 [0,2,0,0,0,0|2,0,0]=4 9539 B21R2.19004 Cc1ccc(nc1)CNC(=O)/C(=C\c2ccccc2)/F 527a_100015187455_100020889036 [0,2,0,0,0,0|2,0,0]=4 9540 B21R2.19004 O=C(CCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011740612 [0,2,0,0,0,0|1,0,0]=3 9541 B21R2.19004 O=C(CCc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 1458a_100020889036_100011740612 [0,2,0,0,0,0|1,0,0]=3 9542 B21R2.19004 O=C(CCc1ccc(cc1)Br)C(=Cc2cccnc2)F 1458a_100000731744_100011740612 [0,2,0,0,0,0|2,0,0]=4 9543 B21R2.19004 O=C(CCc1ccc(cc1)Br)C(=O)Nc2ccccc2 1458a_100000738435_100011740612 [0,2,0,0,0,0|2,0,0]=4 9544 B21R2.19004 O=C(CCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011713675 [0,2,0,0,0,0|1,0,0]=3 9545 B21R2.19004 O=C(CCc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 1458a_100020889036_100011713675 [0,2,0,0,0,0|1,0,0]=3 9546 B21R2.19004 O=C(CCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 1458a_100000731744_100011713675 [0,2,0,0,0,0|2,0,0]=4 9547 B21R2.19004 O=C(CCc1ccc(cc1)Cl)C(=O)Nc2ccccc2 1458a_100000738435_100011713675 [0,2,0,0,0,0|2,0,0]=4 9548 B21R2.19004 O=C(CCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011217392 [0,2,0,0,0,0|1,0,0]=3 9549 B21R2.19004 O=C(CCc1ccc(cc1)F)/C(=C\c2ccccc2)/F 1458a_100020889036_100011217392 [0,2,0,0,0,0|1,0,0]=3 9550 B21R2.19004 O=C(CCc1ccc(cc1)F)C(=Cc2cccnc2)F 1458a_100000731744_100011217392 [0,2,0,0,0,0|2,0,0]=4 9551 B21R2.19004 O=C(CCc1ccc(cc1)F)C(=O)Nc2ccccc2 1458a_100000738435_100011217392 [0,2,0,0,0,0|2,0,0]=4 9552 B21R2.19004 O=C(CCc1ccc(cc1)O)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100009816426 [0,2,0,0,0,0|1,0,0]=3 9553 B21R2.19004 O=C(CCc1ccc(cc1)O)/C(=C\c2ccccc2)/F 1458a_100020889036_100009816426 [0,2,0,0,0,0|1,0,0]=3 9554 B21R2.19004 O=C(CCc1ccc(cc1)O)C(=Cc2cccnc2)F 1458a_100000731744_100009816426 [0,2,0,0,0,0|2,0,0]=4 9555 B21R2.19004 O=C(CCc1ccc(cc1)O)C(=O)Nc2ccccc2 1458a_100000738435_100009816426 [0,2,0,0,0,0|2,0,0]=4 9556 B21R2.19004 O=C(NCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 11a_100000174875_200020598536 [0,2,0,0,0,0|1,0,0]=3 9557 B21R2.19004 O=C(NCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 1626a_100000174875_200020598536 [0,2,0,0,0,0|1,0,0]=3 9558 B21R2.19004 O=C(NCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 240690a_100000174875_200020598536 [0,2,0,0,0,0|1,0,0]=3 9559 B21R2.19004 O=C(NCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 527a_100000174875_200020598536 [0,2,0,0,0,0|1,0,0]=3 9560 B21R2.19004 O=C(NCc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 11a_100000174875_100020889036 [0,2,0,0,0,0|1,0,0]=3 9561 B21R2.19004 O=C(NCc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 527a_100000174875_100020889036 [0,2,0,0,0,0|1,0,0]=3 9562 B21R2.19004 O=C(NCc1ccc(cc1)Br)C(=Cc2cccnc2)F 11a_100000174875_100000731744 [0,2,0,0,0,0|2,0,0]=4 9563 B21R2.19004 O=C(NCc1ccc(cc1)Br)C(=Cc2cccnc2)F 240690a_100000174875_100000731744 [0,2,0,0,0,0|2,0,0]=4 9564 B21R2.19004 O=C(NCc1ccc(cc1)Br)C(=Cc2cccnc2)F 527a_100000174875_100000731744 [0,2,0,0,0,0|2,0,0]=4 9565 B21R2.19004 O=C(NCc1ccc(cc1)Br)C(=O)Nc2ccccc2 240690a_100000174875_100000738435 [0,2,0,0,0,0|2,0,0]=4 9566 B21R2.19004 O=C(NCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 11a_100000174871_200020598536 [0,2,0,0,0,0|1,0,0]=3 9567 B21R2.19004 O=C(NCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100000174871_200020598536 [0,2,0,0,0,0|1,0,0]=3 9568 B21R2.19004 O=C(NCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100000174871_200020598536 [0,2,0,0,0,0|1,0,0]=3 9569 B21R2.19004 O=C(NCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 527a_100000174871_200020598536 [0,2,0,0,0,0|1,0,0]=3 9570 B21R2.19004 O=C(NCc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 11a_100000174871_100020889036 [0,2,0,0,0,0|1,0,0]=3 9571 B21R2.19004 O=C(NCc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 527a_100000174871_100020889036 [0,2,0,0,0,0|1,0,0]=3 9572 B21R2.19004 O=C(NCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 11a_100000174871_100000731744 [0,2,0,0,0,0|2,0,0]=4 9573 B21R2.19004 O=C(NCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 240690a_100000174871_100000731744 [0,2,0,0,0,0|2,0,0]=4 9574 B21R2.19004 O=C(NCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 527a_100000174871_100000731744 [0,2,0,0,0,0|2,0,0]=4 9575 B21R2.19004 O=C(NCc1ccc(cc1)Cl)C(=O)Nc2ccccc2 240690a_100000174871_100000738435 [0,2,0,0,0,0|2,0,0]=4 9576 B21R2.19004 O=C(NCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 11a_100000174882_200020598536 [0,2,0,0,0,0|1,0,0]=3 9577 B21R2.19004 O=C(NCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 1626a_100000174882_200020598536 [0,2,0,0,0,0|1,0,0]=3 9578 B21R2.19004 O=C(NCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 240690a_100000174882_200020598536 [0,2,0,0,0,0|1,0,0]=3 9579 B21R2.19004 O=C(NCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 527a_100000174882_200020598536 [0,2,0,0,0,0|1,0,0]=3 9580 B21R2.19004 O=C(NCc1ccc(cc1)F)/C(=C\c2ccccc2)/F 11a_100000174882_100020889036 [0,2,0,0,0,0|1,0,0]=3 9581 B21R2.19004 O=C(NCc1ccc(cc1)F)/C(=C\c2ccccc2)/F 527a_100000174882_100020889036 [0,2,0,0,0,0|1,0,0]=3 9582 B21R2.19004 O=C(NCc1ccc(cc1)F)C(=Cc2cccnc2)F 11a_100000174882_100000731744 [0,2,0,0,0,0|2,0,0]=4 9583 B21R2.19004 O=C(NCc1ccc(cc1)F)C(=Cc2cccnc2)F 240690a_100000174882_100000731744 [0,2,0,0,0,0|2,0,0]=4 9584 B21R2.19004 O=C(NCc1ccc(cc1)F)C(=Cc2cccnc2)F 527a_100000174882_100000731744 [0,2,0,0,0,0|2,0,0]=4 9585 B21R2.19004 O=C(NCc1ccc(cc1)F)C(=O)Nc2ccccc2 240690a_100000174882_100000738435 [0,2,0,0,0,0|2,0,0]=4 9586 B21R2.19004 O=C(NCc1ccc(cc1)I)/C(=C/c2ccccc2)/Cl 11a_100016989417_200020598536 [0,2,0,0,0,0|1,0,0]=3 9587 B21R2.19004 O=C(NCc1ccc(cc1)I)/C(=C/c2ccccc2)/Cl 1626a_100016989417_200020598536 [0,2,0,0,0,0|1,0,0]=3 9588 B21R2.19004 O=C(NCc1ccc(cc1)I)/C(=C/c2ccccc2)/Cl 240690a_100016989417_200020598536 [0,2,0,0,0,0|1,0,0]=3 9589 B21R2.19004 O=C(NCc1ccc(cc1)I)/C(=C/c2ccccc2)/Cl 527a_100016989417_200020598536 [0,2,0,0,0,0|1,0,0]=3 9590 B21R2.19004 O=C(NCc1ccc(cc1)I)/C(=C\c2ccccc2)/F 11a_100016989417_100020889036 [0,2,0,0,0,0|1,0,0]=3 9591 B21R2.19004 O=C(NCc1ccc(cc1)I)/C(=C\c2ccccc2)/F 527a_100016989417_100020889036 [0,2,0,0,0,0|1,0,0]=3 9592 B21R2.19004 O=C(NCc1ccc(cc1)I)C(=Cc2cccnc2)F 11a_100016989417_100000731744 [0,2,0,0,0,0|2,0,0]=4 9593 B21R2.19004 O=C(NCc1ccc(cc1)I)C(=Cc2cccnc2)F 240690a_100016989417_100000731744 [0,2,0,0,0,0|2,0,0]=4 9594 B21R2.19004 O=C(NCc1ccc(cc1)I)C(=Cc2cccnc2)F 527a_100016989417_100000731744 [0,2,0,0,0,0|2,0,0]=4 9595 B21R2.19004 O=C(NCc1ccc(cc1)I)C(=O)Nc2ccccc2 240690a_100016989417_100000738435 [0,2,0,0,0,0|2,0,0]=4 9596 B21R2.19004 O=C(NCc1ccc(cc1)O)/C(=C/c2ccccc2)/Cl 240690a_100000185549_200020598536 [0,2,0,0,0,0|1,0,0]=3 9597 B21R2.19004 O=C(NCc1ccc(cc1)O)/C(=C/c2ccccc2)/Cl 527a_100000185549_200020598536 [0,2,0,0,0,0|1,0,0]=3 9598 B21R2.19004 O=C(NCc1ccc(cc1)O)/C(=C\c2ccccc2)/F 527a_100000185549_100020889036 [0,2,0,0,0,0|1,0,0]=3 9599 B21R2.19004 O=C(NCc1ccc(cc1)O)C(=Cc2cccnc2)F 240690a_100000185549_100000731744 [0,2,0,0,0,0|2,0,0]=4 9600 B21R2.19004 O=C(NCc1ccc(cc1)O)C(=Cc2cccnc2)F 527a_100000185549_100000731744 [0,2,0,0,0,0|2,0,0]=4 9601 B21R2.19004 O=C(NCc1ccc(cc1)O)C(=O)Nc2ccccc2 240690a_100000185549_100000738435 [0,2,0,0,0,0|2,0,0]=4 9602 B21R2.19004 O=C(NCc1ccc(cn1)Br)/C(=C/c2ccccc2)/Cl 11a_100015188789_200020598536 [0,2,0,0,0,0|2,0,0]=4 9603 B21R2.19004 O=C(NCc1ccc(cn1)Br)/C(=C/c2ccccc2)/Cl 1626a_100015188789_200020598536 [0,2,0,0,0,0|2,0,0]=4 9604 B21R2.19004 O=C(NCc1ccc(cn1)Br)/C(=C/c2ccccc2)/Cl 240690a_100015188789_200020598536 [0,2,0,0,0,0|2,0,0]=4 9605 B21R2.19004 O=C(NCc1ccc(cn1)Br)/C(=C/c2ccccc2)/Cl 527a_100015188789_200020598536 [0,2,0,0,0,0|2,0,0]=4 9606 B21R2.19004 O=C(NCc1ccc(cn1)Br)/C(=C\c2ccccc2)/F 11a_100015188789_100020889036 [0,2,0,0,0,0|2,0,0]=4 9607 B21R2.19004 O=C(NCc1ccc(cn1)Br)/C(=C\c2ccccc2)/F 527a_100015188789_100020889036 [0,2,0,0,0,0|2,0,0]=4 9608 B21R2.19004 O=C(NCc1ccc(cn1)Cl)/C(=C/c2ccccc2)/Cl 11a_100000697193_200020598536 [0,2,0,0,0,0|2,0,0]=4 9609 B21R2.19004 O=C(NCc1ccc(cn1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100000697193_200020598536 [0,2,0,0,0,0|2,0,0]=4 9610 B21R2.19004 O=C(NCc1ccc(cn1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100000697193_200020598536 [0,2,0,0,0,0|2,0,0]=4 9611 B21R2.19004 O=C(NCc1ccc(cn1)Cl)/C(=C/c2ccccc2)/Cl 527a_100000697193_200020598536 [0,2,0,0,0,0|2,0,0]=4 9612 B21R2.19004 O=C(NCc1ccc(cn1)Cl)/C(=C\c2ccccc2)/F 11a_100000697193_100020889036 [0,2,0,0,0,0|2,0,0]=4 9613 B21R2.19004 O=C(NCc1ccc(cn1)Cl)/C(=C\c2ccccc2)/F 527a_100000697193_100020889036 [0,2,0,0,0,0|2,0,0]=4 9614 B21R2.19004 O=C(NCc1ccc(cn1)F)/C(=C/c2ccccc2)/Cl 11a_100020620131_200020598536 [0,2,0,0,0,0|2,0,0]=4 9615 B21R2.19004 O=C(NCc1ccc(cn1)F)/C(=C/c2ccccc2)/Cl 1626a_100020620131_200020598536 [0,2,0,0,0,0|2,0,0]=4 9616 B21R2.19004 O=C(NCc1ccc(cn1)F)/C(=C/c2ccccc2)/Cl 240690a_100020620131_200020598536 [0,2,0,0,0,0|2,0,0]=4 9617 B21R2.19004 O=C(NCc1ccc(cn1)F)/C(=C/c2ccccc2)/Cl 527a_100020620131_200020598536 [0,2,0,0,0,0|2,0,0]=4 9618 B21R2.19004 O=C(NCc1ccc(cn1)F)/C(=C\c2ccccc2)/F 11a_100020620131_100020889036 [0,2,0,0,0,0|2,0,0]=4 9619 B21R2.19004 O=C(NCc1ccc(cn1)F)/C(=C\c2ccccc2)/F 527a_100020620131_100020889036 [0,2,0,0,0,0|2,0,0]=4 9620 B21R2.19004 O=C(NCc1ccc(cn1)O)/C(=C/c2ccccc2)/Cl 240690a_100020605196_200020598536 [0,2,0,0,0,0|2,0,0]=4 9621 B21R2.19004 O=C(NCc1ccc(nc1)Br)/C(=C/c2ccccc2)/Cl 11a_100009817727_200020598536 [0,2,0,0,0,0|2,0,0]=4 9622 B21R2.19004 O=C(NCc1ccc(nc1)Br)/C(=C/c2ccccc2)/Cl 240690a_100009817727_200020598536 [0,2,0,0,0,0|2,0,0]=4 9623 B21R2.19004 O=C(NCc1ccc(nc1)Br)/C(=C/c2ccccc2)/Cl 527a_100009817727_200020598536 [0,2,0,0,0,0|2,0,0]=4 9624 B21R2.19004 O=C(NCc1ccc(nc1)Br)/C(=C\c2ccccc2)/F 11a_100009817727_100020889036 [0,2,0,0,0,0|2,0,0]=4 9625 B21R2.19004 O=C(NCc1ccc(nc1)Br)/C(=C\c2ccccc2)/F 527a_100009817727_100020889036 [0,2,0,0,0,0|2,0,0]=4 9626 B21R2.19004 O=C(NCc1ccc(nc1)Cl)/C(=C/c2ccccc2)/Cl 11a_100000735879_200020598536 [0,2,0,0,0,0|2,0,0]=4 9627 B21R2.19004 O=C(NCc1ccc(nc1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100000735879_200020598536 [0,2,0,0,0,0|2,0,0]=4 9628 B21R2.19004 O=C(NCc1ccc(nc1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100000735879_200020598536 [0,2,0,0,0,0|2,0,0]=4 9629 B21R2.19004 O=C(NCc1ccc(nc1)Cl)/C(=C/c2ccccc2)/Cl 527a_100000735879_200020598536 [0,2,0,0,0,0|2,0,0]=4 9630 B21R2.19004 O=C(NCc1ccc(nc1)Cl)/C(=C\c2ccccc2)/F 11a_100000735879_100020889036 [0,2,0,0,0,0|2,0,0]=4 9631 B21R2.19004 O=C(NCc1ccc(nc1)Cl)/C(=C\c2ccccc2)/F 527a_100000735879_100020889036 [0,2,0,0,0,0|2,0,0]=4 9632 B21R2.19004 O=C(NCc1ccc(nc1)F)/C(=C/c2ccccc2)/Cl 11a_100000101913_200020598536 [0,2,0,0,0,0|2,0,0]=4 9633 B21R2.19004 O=C(NCc1ccc(nc1)F)/C(=C/c2ccccc2)/Cl 1626a_100000101913_200020598536 [0,2,0,0,0,0|2,0,0]=4 9634 B21R2.19004 O=C(NCc1ccc(nc1)F)/C(=C/c2ccccc2)/Cl 240690a_100000101913_200020598536 [0,2,0,0,0,0|2,0,0]=4 9635 B21R2.19004 O=C(NCc1ccc(nc1)F)/C(=C/c2ccccc2)/Cl 527a_100000101913_200020598536 [0,2,0,0,0,0|2,0,0]=4 9636 B21R2.19004 O=C(NCc1ccc(nc1)F)/C(=C\c2ccccc2)/F 11a_100000101913_100020889036 [0,2,0,0,0,0|2,0,0]=4 9637 B21R2.19004 O=C(NCc1ccc(nc1)F)/C(=C\c2ccccc2)/F 527a_100000101913_100020889036 [0,2,0,0,0,0|2,0,0]=4 9638 B21R2.19004 O=C(NCc1ccc(nc1)O)/C(=C/c2ccccc2)/Cl 11a_100000757128_200020598536 [0,2,0,0,0,0|2,0,0]=4 9639 B21R2.19004 O=C(NCc1ccc(nc1)O)/C(=C/c2ccccc2)/Cl 240690a_100000757128_200020598536 [0,2,0,0,0,0|2,0,0]=4 9640 B21R2.19004 O=C(NCc1ccc(nc1)O)/C(=C\c2ccccc2)/F 11a_100000757128_100020889036 [0,2,0,0,0,0|2,0,0]=4 9641 B21R2.19004 O=C(NNc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 22a_100000735608_200020598536 [0,2,0,0,0,0|2,0,0]=4 9642 B21R2.19004 O=C(NNc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 22a_100000735608_100020889036 [0,2,0,0,0,0|2,0,0]=4 9643 B21R2.19004 O=C(NNc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 22a_100000683521_200020598536 [0,2,0,0,0,0|2,0,0]=4 9644 B21R2.19004 O=C(NNc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 22a_100000683521_100020889036 [0,2,0,0,0,0|2,0,0]=4 9645 B21R2.19004 O=C(NNc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 22a_100000728448_200020598536 [0,2,0,0,0,0|2,0,0]=4 9646 B21R2.19004 O=C(NNc1ccc(cc1)F)/C(=C\c2ccccc2)/F 22a_100000728448_100020889036 [0,2,0,0,0,0|2,0,0]=4 9647 B21R2.19004 O=C(NNc1ccc(cc1)I)/C(=C/c2ccccc2)/Cl 22a_100016988836_200020598536 [0,2,0,0,0,0|2,0,0]=4 9648 B21R2.19004 O=C(NNc1ccc(cc1)I)/C(=C\c2ccccc2)/F 22a_100016988836_100020889036 [0,2,0,0,0,0|2,0,0]=4 9649 B21R2.19177 CC(NC(=O)C=Cc1ccccc1)c2ccc(cn2)Br 11a_100000723930_100000210462 [0,2,0,0,0,0|2,0,0]=4 9650 B21R2.19177 CC(NC(=O)C=Cc1ccccc1)c2ccc(cn2)Br 1626a_100000723930_100000210462 [0,2,0,0,0,0|2,0,0]=4 9651 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)Br 2230a_100000219623_100000753625 [0,2,0,0,0,0|1,0,1]=4 9652 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)Br 269982a_100000219623_100000753625 [0,2,0,0,0,0|1,0,1]=4 9653 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)Br 34a_100000219623_100000753625 [0,2,0,0,0,0|1,0,1]=4 9654 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)Cl 2230a_100020629279_100000753625 [0,2,0,0,0,0|1,0,1]=4 9655 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)Cl 269982a_100020629279_100000753625 [0,2,0,0,0,0|1,0,1]=4 9656 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)Cl 34a_100020629279_100000753625 [0,2,0,0,0,0|1,0,1]=4 9657 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)F 2230a_100000219829_100000753625 [0,2,0,0,0,0|1,0,1]=4 9658 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)F 269982a_100000219829_100000753625 [0,2,0,0,0,0|1,0,1]=4 9659 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)F 34a_100000219829_100000753625 [0,2,0,0,0,0|1,0,1]=4 9660 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)I 2230a_100000743151_100000753625 [0,2,0,0,0,0|1,0,1]=4 9661 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)I 269982a_100000743151_100000753625 [0,2,0,0,0,0|1,0,1]=4 9662 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)I 34a_100000743151_100000753625 [0,2,0,0,0,0|1,0,1]=4 9663 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)O 269982a_100000182112_100000753625 [0,2,0,0,0,0|1,0,1]=4 9664 B21R2.19177 CN(CC(=O)OCc1ccccc1)c2ccc(cc2)O 34a_100000182112_100000753625 [0,2,0,0,0,0|1,0,1]=4 9665 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccc(cc2)Br 11a_100000720352_100000210462 [0,2,0,0,0,0|1,0,0]=3 9666 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccc(cc2)Br 1626a_100000720352_100000210462 [0,2,0,0,0,0|1,0,0]=3 9667 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccc(cc2)Cl 11a_100015205461_100000210462 [0,2,0,0,0,0|1,0,0]=3 9668 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccc(cc2)Cl 1626a_100015205461_100000210462 [0,2,0,0,0,0|1,0,0]=3 9669 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)Br 11a_100000720352_100000740811 [0,2,0,0,0,0|2,0,0]=4 9670 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)Br 240690a_100000720352_100000740811 [0,2,0,0,0,0|2,0,0]=4 9671 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)Cl 11a_100015205461_100000740811 [0,2,0,0,0,0|2,0,0]=4 9672 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)Cl 240690a_100015205461_100000740811 [0,2,0,0,0,0|2,0,0]=4 9673 B21R2.19177 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)Br 11a_100000720352_100000735890 [0,2,0,0,0,0|2,0,0]=4 9674 B21R2.19177 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)Br 240690a_100000720352_100000735890 [0,2,0,0,0,0|2,0,0]=4 9675 B21R2.19177 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)Cl 11a_100015205461_100000735890 [0,2,0,0,0,0|2,0,0]=4 9676 B21R2.19177 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)Cl 240690a_100015205461_100000735890 [0,2,0,0,0,0|2,0,0]=4 9677 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccncc1)c2ccc(cc2)Br 240690a_100000720352_100000682801 [0,2,0,0,0,0|2,0,0]=4 9678 B21R2.19177 C[C@@H](NC(=O)C=Cc1ccncc1)c2ccc(cc2)Cl 240690a_100015205461_100000682801 [0,2,0,0,0,0|2,0,0]=4 9679 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccc1)c2ccc(cc2)F 11a_100025705893_100000210462 [0,2,0,0,0,0|1,0,0]=3 9680 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccc1)c2ccc(cc2)F 1626a_100025705893_100000210462 [0,2,0,0,0,0|1,0,0]=3 9681 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccc1)c2ccc(cc2)I 11a_100000753911_100000210462 [0,2,0,0,0,0|1,0,0]=3 9682 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccc1)c2ccc(cc2)I 1626a_100000753911_100000210462 [0,2,0,0,0,0|1,0,0]=3 9683 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccc1)c2ccc(nc2)Br 11a_100015387476_100000210462 [0,2,0,0,0,0|2,0,0]=4 9684 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccc1)c2ccc(nc2)Br 1626a_100015387476_100000210462 [0,2,0,0,0,0|2,0,0]=4 9685 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)F 11a_100025705893_100000740811 [0,2,0,0,0,0|2,0,0]=4 9686 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)F 240690a_100025705893_100000740811 [0,2,0,0,0,0|2,0,0]=4 9687 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)I 11a_100000753911_100000740811 [0,2,0,0,0,0|2,0,0]=4 9688 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)I 240690a_100000753911_100000740811 [0,2,0,0,0,0|2,0,0]=4 9689 B21R2.19177 C[C@H](NC(=O)C=Cc1ccccn1)c2ccc(cc2)O 240690a_100161106496_100000740811 [0,2,0,0,0,0|2,0,0]=4 9690 B21R2.19177 C[C@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)F 11a_100025705893_100000735890 [0,2,0,0,0,0|2,0,0]=4 9691 B21R2.19177 C[C@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)F 240690a_100025705893_100000735890 [0,2,0,0,0,0|2,0,0]=4 9692 B21R2.19177 C[C@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)I 11a_100000753911_100000735890 [0,2,0,0,0,0|2,0,0]=4 9693 B21R2.19177 C[C@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)I 240690a_100000753911_100000735890 [0,2,0,0,0,0|2,0,0]=4 9694 B21R2.19177 C[C@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)O 240690a_100161106496_100000735890 [0,2,0,0,0,0|2,0,0]=4 9695 B21R2.19177 C[C@H](NC(=O)C=Cc1ccncc1)c2ccc(cc2)F 240690a_100025705893_100000682801 [0,2,0,0,0,0|2,0,0]=4 9696 B21R2.19177 C[C@H](NC(=O)C=Cc1ccncc1)c2ccc(cc2)I 240690a_100000753911_100000682801 [0,2,0,0,0,0|2,0,0]=4 9697 B21R2.19177 C[C@H](NC(=O)C=Cc1ccncc1)c2ccc(cc2)O 240690a_100161106496_100000682801 [0,2,0,0,0,0|2,0,0]=4 9698 B21R2.19177 Cc1ccc(cc1)C(=O)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000211441 [0,2,0,0,0,0|1,0,1]=4 9699 B21R2.19177 Cc1ccc(cc1)C(=O)CC(=O)CCc2ccccc2 1458a_100000185753_100000211441 [0,2,0,0,0,0|1,0,1]=4 9700 B21R2.19177 Cc1ccc(cc1)C(=O)CC(=O)CCc2ccccc2 1458a_100000188618_100012361361 [0,2,0,0,0,0|1,0,1]=4 9701 B21R2.19177 Cc1ccc(cc1)C(=O)CC(=O)NCc2ccccc2 1458a_100000188618_100000183539 [0,2,0,0,0,0|1,0,1]=4 9702 B21R2.19177 Cc1ccc(cc1)C(=O)CC(=O)OCc2ccccc2 1458a_100000188618_100000753625 [0,2,0,0,0,0|0,0,1]=3 9703 B21R2.19177 Cc1ccc(cc1)N(C)CC(=O)OCc2ccccc2 2230a_100000219977_100000753625 [0,2,0,0,0,0|1,0,1]=4 9704 B21R2.19177 Cc1ccc(cc1)N(C)CC(=O)OCc2ccccc2 269982a_100000219977_100000753625 [0,2,0,0,0,0|1,0,1]=4 9705 B21R2.19177 Cc1ccc(cc1)N(C)CC(=O)OCc2ccccc2 34a_100000219977_100000753625 [0,2,0,0,0,0|1,0,1]=4 9706 B21R2.19177 Cc1ccc(cc1)[C@@H](C)NC(=O)C=Cc2ccccc2 11a_100016988085_100000210462 [0,2,0,0,0,0|1,0,0]=3 9707 B21R2.19177 Cc1ccc(cc1)[C@@H](C)NC(=O)C=Cc2ccccc2 1626a_100016988085_100000210462 [0,2,0,0,0,0|1,0,0]=3 9708 B21R2.19177 Cc1ccc(cc1)[C@@H](C)NC(=O)C=Cc2ccccn2 11a_100016988085_100000740811 [0,2,0,0,0,0|2,0,0]=4 9709 B21R2.19177 Cc1ccc(cc1)[C@@H](C)NC(=O)C=Cc2ccccn2 240690a_100016988085_100000740811 [0,2,0,0,0,0|2,0,0]=4 9710 B21R2.19177 Cc1ccc(cc1)[C@@H](C)NC(=O)C=Cc2cccnc2 11a_100016988085_100000735890 [0,2,0,0,0,0|2,0,0]=4 9711 B21R2.19177 Cc1ccc(cc1)[C@@H](C)NC(=O)C=Cc2cccnc2 240690a_100016988085_100000735890 [0,2,0,0,0,0|2,0,0]=4 9712 B21R2.19177 Cc1ccc(cc1)[C@@H](C)NC(=O)C=Cc2ccncc2 240690a_100016988085_100000682801 [0,2,0,0,0,0|2,0,0]=4 9713 B21R2.19177 Cc1ccc(cn1)C(C)NC(=O)C=Cc2ccccc2 11a_100011815741_100000210462 [0,2,0,0,0,0|2,0,0]=4 9714 B21R2.19177 Cc1ccc(cn1)C(C)NC(=O)C=Cc2ccccc2 1626a_100011815741_100000210462 [0,2,0,0,0,0|2,0,0]=4 9715 B21R2.19177 O=C(C=Cc1ccccc1)CC(=O)c2ccc(cc2)Br 1458a_100000210462_100000188085 [0,2,0,0,0,0|1,0,1]=4 9716 B21R2.19177 O=C(C=Cc1ccccc1)CC(=O)c2ccc(cc2)Cl 1458a_100000210462_100000211071 [0,2,0,0,0,0|1,0,1]=4 9717 B21R2.19177 O=C(C=Cc1ccccc1)CC(=O)c2ccc(cc2)F 1458a_100000210462_100000211279 [0,2,0,0,0,0|1,0,1]=4 9718 B21R2.19177 O=C(C=Cc1ccccc1)CC(=O)c2ccc(cc2)I 1458a_100000210462_100011216261 [0,2,0,0,0,0|1,0,1]=4 9719 B21R2.19177 O=C(C=Cc1ccccc1)CC(=O)c2ccc(cc2)O 1458a_100000210462_100009814261 [0,2,0,0,0,0|1,0,1]=4 9720 B21R2.19177 O=C(C=Cc1ccccc1)CC(O)c2ccc(cc2)Cl 1458a_100000210462_200011996143 [0,2,0,0,0,0|1,0,0]=3 9721 B21R2.19177 O=C(C=Cc1ccccc1)C[C@H](O)c2ccc(cc2)F 1458a_100000210462_100000720402 [0,2,0,0,0,0|1,0,0]=3 9722 B21R2.19177 O=C(C=Cc1ccccn1)CC(O)c2ccc(cc2)Cl 1458a_100000740811_200011996143 [0,2,0,0,0,0|2,0,0]=4 9723 B21R2.19177 O=C(C=Cc1ccccn1)C[C@H](O)c2ccc(cc2)F 1458a_100000740811_100000720402 [0,2,0,0,0,0|2,0,0]=4 9724 B21R2.19177 O=C(C=Cc1cccnc1)CC(O)c2ccc(cc2)Cl 1458a_100000735890_200011996143 [0,2,0,0,0,0|2,0,0]=4 9725 B21R2.19177 O=C(C=Cc1cccnc1)C[C@H](O)c2ccc(cc2)F 1458a_100000735890_100000720402 [0,2,0,0,0,0|2,0,0]=4 9726 B21R2.19177 O=C(C=Cc1ccncc1)CC(O)c2ccc(cc2)Cl 1458a_100000682801_200011996143 [0,2,0,0,0,0|2,0,0]=4 9727 B21R2.19177 O=C(C=Cc1ccncc1)C[C@H](O)c2ccc(cc2)F 1458a_100000682801_100000720402 [0,2,0,0,0,0|2,0,0]=4 9728 B21R2.19177 O=C(CC(=O)c1ccc(cc1)Br)NCc2ccccc2 1458a_100000185839_100000183539 [0,2,0,0,0,0|1,0,1]=4 9729 B21R2.19177 O=C(CC(=O)c1ccc(cc1)Br)OCc2ccccc2 1458a_100000185839_100000753625 [0,2,0,0,0,0|0,0,1]=3 9730 B21R2.19177 O=C(CC(=O)c1ccc(cc1)Cl)NCc2ccccc2 1458a_100000210187_100000183539 [0,2,0,0,0,0|1,0,1]=4 9731 B21R2.19177 O=C(CC(=O)c1ccc(cc1)Cl)OCc2ccccc2 1458a_100000210187_100000753625 [0,2,0,0,0,0|0,0,1]=3 9732 B21R2.19177 O=C(CC(=O)c1ccc(cc1)F)NCc2ccccc2 1458a_100000187176_100000183539 [0,2,0,0,0,0|1,0,1]=4 9733 B21R2.19177 O=C(CC(=O)c1ccc(cc1)F)OCc2ccccc2 1458a_100000187176_100000753625 [0,2,0,0,0,0|0,0,1]=3 9734 B21R2.19177 O=C(CC(=O)c1ccc(cc1)I)NCc2ccccc2 1458a_100000187904_100000183539 [0,2,0,0,0,0|1,0,1]=4 9735 B21R2.19177 O=C(CC(=O)c1ccc(cc1)I)OCc2ccccc2 1458a_100000187904_100000753625 [0,2,0,0,0,0|0,0,1]=3 9736 B21R2.19177 O=C(CC(=O)c1ccc(cc1)O)NCc2ccccc2 1458a_100000212099_100000183539 [0,2,0,0,0,0|1,0,1]=4 9737 B21R2.19177 O=C(CC(=O)c1ccc(cc1)O)OCc2ccccc2 1458a_100000212099_100000753625 [0,2,0,0,0,0|0,0,1]=3 9738 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)Br 1458a_100000185753_100000188085 [0,2,0,0,0,0|1,0,1]=4 9739 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)Br 1458a_100000185839_100012361361 [0,2,0,0,0,0|1,0,1]=4 9740 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)Cl 1458a_100000185753_100000211071 [0,2,0,0,0,0|1,0,1]=4 9741 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)Cl 1458a_100000210187_100012361361 [0,2,0,0,0,0|1,0,1]=4 9742 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)F 1458a_100000185753_100000211279 [0,2,0,0,0,0|1,0,1]=4 9743 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)F 1458a_100000187176_100012361361 [0,2,0,0,0,0|1,0,1]=4 9744 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)I 1458a_100000185753_100011216261 [0,2,0,0,0,0|1,0,1]=4 9745 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)I 1458a_100000187904_100012361361 [0,2,0,0,0,0|1,0,1]=4 9746 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)O 1458a_100000185753_100009814261 [0,2,0,0,0,0|1,0,1]=4 9747 B21R2.19177 O=C(CCc1ccccc1)CC(=O)c2ccc(cc2)O 1458a_100000212099_100012361361 [0,2,0,0,0,0|1,0,1]=4 9748 B21R2.19361 Cc1cc(ccc1Br)CNC(=O)C=Cc2ccccc2 11a_100015205234_100000210462 [0,2,0,0,0,0|1,0,0]=3 9749 B21R2.19361 Cc1cc(ccc1Br)CNC(=O)C=Cc2ccccc2 1626a_100015205234_100000210462 [0,2,0,0,0,0|1,0,0]=3 9750 B21R2.19361 Cc1cc(ccc1Br)CNC(=O)C=Cc2ccccn2 11a_100015205234_100000740811 [0,2,0,0,0,0|2,0,0]=4 9751 B21R2.19361 Cc1cc(ccc1Br)CNC(=O)C=Cc2ccccn2 240690a_100015205234_100000740811 [0,2,0,0,0,0|2,0,0]=4 9752 B21R2.19361 Cc1cc(ccc1Br)CNC(=O)C=Cc2cccnc2 11a_100015205234_100000735890 [0,2,0,0,0,0|2,0,0]=4 9753 B21R2.19361 Cc1cc(ccc1Br)CNC(=O)C=Cc2cccnc2 240690a_100015205234_100000735890 [0,2,0,0,0,0|2,0,0]=4 9754 B21R2.19361 Cc1cc(ccc1Br)CNC(=O)C=Cc2ccncc2 240690a_100015205234_100000682801 [0,2,0,0,0,0|2,0,0]=4 9755 B21R2.19361 Cc1cc(ccc1Br)NCC(=O)OCc2ccccc2 2230a_100000210723_100000753625 [0,2,0,0,0,0|1,0,1]=4 9756 B21R2.19361 Cc1cc(ccc1Br)NCC(=O)OCc2ccccc2 34a_100000210723_100000753625 [0,2,0,0,0,0|1,0,1]=4 9757 B21R2.19361 Cc1cc(ccc1Br)NCC(=O)OCc2ccccc2 7a_100000210723_100000753625 [0,2,0,0,0,0|1,0,1]=4 9758 B21R2.19361 Cc1cc(ccc1Br)NNC(=O)C=Cc2ccccc2 22a_100000745493_100000210462 [0,2,0,0,0,0|2,0,0]=4 9759 B21R2.19361 Cc1cc(ccc1Br)OCC(=O)OCc2ccccc2 34a_100000690111_100000753625 [0,2,0,0,0,0|1,0,1]=4 9760 B21R2.19361 Cc1cc(ccc1Br)OCC(=O)OCc2ccccc2 7a_100000690111_100000753625 [0,2,0,0,0,0|1,0,1]=4 9761 B21R2.19361 Cc1cc(ccc1Br)SCC(=O)OCc2ccccc2 62a_100000753625_100009813585 [0,2,0,0,0,0|1,0,1]=4 9762 B21R2.19361 Cc1cc(ccc1Br)SCC(=O)OCc2ccccc2 62a_100009813585_100000753625 [0,2,0,0,0,0|1,0,1]=4 9763 B21R2.19361 Cc1cc(ccc1Cl)C=CC(=O)CCc2ccccc2 6a_100000698814_100000210092 [0,2,0,0,0,0|1,0,0]=3 9764 B21R2.19361 Cc1cc(ccc1Cl)C=CC(=O)COc2ccccc2 6a_100000698814_100000150576 [0,2,0,0,0,0|2,0,0]=4 9765 B21R2.19361 Cc1cc(ccc1Cl)C=CC(=O)CSc2ccccc2 6a_100000698814_100000150717 [0,2,0,0,0,0|2,0,0]=4 9766 B21R2.19361 Cc1cc(ccc1Cl)NCC(=O)OCc2ccccc2 2230a_100000187808_100000753625 [0,2,0,0,0,0|1,0,1]=4 9767 B21R2.19361 Cc1cc(ccc1Cl)NCC(=O)OCc2ccccc2 34a_100000187808_100000753625 [0,2,0,0,0,0|1,0,1]=4 9768 B21R2.19361 Cc1cc(ccc1Cl)NCC(=O)OCc2ccccc2 7a_100000187808_100000753625 [0,2,0,0,0,0|1,0,1]=4 9769 B21R2.19361 Cc1cc(ccc1Cl)NNC(=O)C=Cc2ccccc2 22a_100015233126_100000210462 [0,2,0,0,0,0|2,0,0]=4 9770 B21R2.19361 Cc1cc(ccc1Cl)OCC(=O)OCc2ccccc2 34a_100000211092_100000753625 [0,2,0,0,0,0|1,0,1]=4 9771 B21R2.19361 Cc1cc(ccc1Cl)OCC(=O)OCc2ccccc2 7a_100000211092_100000753625 [0,2,0,0,0,0|1,0,1]=4 9772 B21R2.19361 Cc1cc(ccc1Cl)SCC(=O)OCc2ccccc2 62a_100000049509_100000753625 [0,2,0,0,0,0|1,0,1]=4 9773 B21R2.19361 Cc1cc(ccc1Cl)SCC(=O)OCc2ccccc2 62a_100000753625_100000049509 [0,2,0,0,0,0|1,0,1]=4 9774 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)CCc2ccccc2 1458a_100016261966_100000765856 [0,2,0,0,0,0|1,0,0]=3 9775 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)CCc2ccccc2 6a_100000748208_100000210092 [0,2,0,0,0,0|1,0,0]=3 9776 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)CCc2ccccn2 1458a_100016261966_100015183660 [0,2,0,0,0,0|2,0,0]=4 9777 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)CCc2cccnc2 1458a_100016261966_200011713674 [0,2,0,0,0,0|2,0,0]=4 9778 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)CCc2ccncc2 1458a_100016261966_100000723409 [0,2,0,0,0,0|2,0,0]=4 9779 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)COc2ccccc2 6a_100000748208_100000150576 [0,2,0,0,0,0|2,0,0]=4 9780 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)CSc2ccccc2 6a_100000748208_100000150717 [0,2,0,0,0,0|2,0,0]=4 9781 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccccc2 11a_100015324214_100016261966 [0,2,0,0,0,0|1,0,0]=3 9782 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccccc2 1626a_100015324214_100016261966 [0,2,0,0,0,0|1,0,0]=3 9783 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccccc2 240690a_100015324214_100016261966 [0,2,0,0,0,0|1,0,0]=3 9784 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccccn2 11a_100000210449_100016261966 [0,2,0,0,0,0|2,0,0]=4 9785 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccccn2 1626a_100000210449_100016261966 [0,2,0,0,0,0|2,0,0]=4 9786 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccccn2 240690a_100000210449_100016261966 [0,2,0,0,0,0|2,0,0]=4 9787 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2cccnc2 11a_100000210453_100016261966 [0,2,0,0,0,0|2,0,0]=4 9788 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2cccnc2 240690a_100000210453_100016261966 [0,2,0,0,0,0|2,0,0]=4 9789 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccncc2 11a_100000210450_100016261966 [0,2,0,0,0,0|2,0,0]=4 9790 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccncc2 1626a_100000210450_100016261966 [0,2,0,0,0,0|2,0,0]=4 9791 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NCc2ccncc2 240690a_100000210450_100016261966 [0,2,0,0,0,0|2,0,0]=4 9792 B21R2.19361 Cc1cc(ccc1F)C=CC(=O)NNc2ccccc2 22a_100015195140_100016261966 [0,2,0,0,0,0|2,0,0]=4 9793 B21R2.19361 Cc1cc(ccc1F)CNC(=O)C=Cc2ccccc2 11a_100000239911_100000210462 [0,2,0,0,0,0|1,0,0]=3 9794 B21R2.19361 Cc1cc(ccc1F)CNC(=O)C=Cc2ccccc2 1626a_100000239911_100000210462 [0,2,0,0,0,0|1,0,0]=3 9795 B21R2.19361 Cc1cc(ccc1F)CNC(=O)C=Cc2ccccn2 11a_100000239911_100000740811 [0,2,0,0,0,0|2,0,0]=4 9796 B21R2.19361 Cc1cc(ccc1F)CNC(=O)C=Cc2ccccn2 240690a_100000239911_100000740811 [0,2,0,0,0,0|2,0,0]=4 9797 B21R2.19361 Cc1cc(ccc1F)CNC(=O)C=Cc2cccnc2 11a_100000239911_100000735890 [0,2,0,0,0,0|2,0,0]=4 9798 B21R2.19361 Cc1cc(ccc1F)CNC(=O)C=Cc2cccnc2 240690a_100000239911_100000735890 [0,2,0,0,0,0|2,0,0]=4 9799 B21R2.19361 Cc1cc(ccc1F)CNC(=O)C=Cc2ccncc2 240690a_100000239911_100000682801 [0,2,0,0,0,0|2,0,0]=4 9800 B21R2.19361 Cc1cc(ccc1F)NCC(=O)OCc2ccccc2 2230a_100000750164_100000753625 [0,2,0,0,0,0|1,0,1]=4 9801 B21R2.19361 Cc1cc(ccc1F)NCC(=O)OCc2ccccc2 34a_100000750164_100000753625 [0,2,0,0,0,0|1,0,1]=4 9802 B21R2.19361 Cc1cc(ccc1F)NCC(=O)OCc2ccccc2 7a_100000750164_100000753625 [0,2,0,0,0,0|1,0,1]=4 9803 B21R2.19361 Cc1cc(ccc1F)OCC(=O)OCc2ccccc2 34a_100000751312_100000753625 [0,2,0,0,0,0|1,0,1]=4 9804 B21R2.19361 Cc1cc(ccc1F)OCC(=O)OCc2ccccc2 7a_100000751312_100000753625 [0,2,0,0,0,0|1,0,1]=4 9805 B21R2.19361 Cc1cc(ccc1F)SCC(=O)OCc2ccccc2 62a_100000753625_100011218330 [0,2,0,0,0,0|1,0,1]=4 9806 B21R2.19361 Cc1cc(ccc1F)SCC(=O)OCc2ccccc2 62a_100011218330_100000753625 [0,2,0,0,0,0|1,0,1]=4 9807 B21R2.19361 Cc1cc(ccc1I)NCC(=O)OCc2ccccc2 34a_100000198070_100000753625 [0,2,0,0,0,0|1,0,1]=4 9808 B21R2.19361 Cc1cc(ccc1I)NCC(=O)OCc2ccccc2 7a_100000198070_100000753625 [0,2,0,0,0,0|1,0,1]=4 9809 B21R2.19361 Cc1cc(ccc1I)OCC(=O)OCc2ccccc2 34a_100000729255_100000753625 [0,2,0,0,0,0|1,0,1]=4 9810 B21R2.19361 Cc1cc(ccc1I)OCC(=O)OCc2ccccc2 7a_100000729255_100000753625 [0,2,0,0,0,0|1,0,1]=4 9811 B21R2.19361 Cc1cc(ccc1N)OCC(=O)OCc2ccccc2 34a_100000756630_100000753625 [0,2,0,0,0,0|1,0,1]=4 9812 B21R2.19361 Cc1cc(ccc1N)OCC(=O)OCc2ccccc2 7a_100000756630_100000753625 [0,2,0,0,0,0|1,0,1]=4 9813 B21R2.19361 Cc1cc(ccc1N)SCC(=O)OCc2ccccc2 62a_100000211769_100000753625 [0,2,0,0,0,0|1,0,1]=4 9814 B21R2.19361 Cc1cc(ccc1N)SCC(=O)OCc2ccccc2 62a_100000753625_100000211769 [0,2,0,0,0,0|1,0,1]=4 9815 B21R2.19361 Cc1cc(ccc1O)NCC(=O)OCc2ccccc2 34a_100011218179_100000753625 [0,2,0,0,0,0|1,0,1]=4 9816 B21R2.19361 Cc1cc(ccc1O)NCC(=O)OCc2ccccc2 7a_100011218179_100000753625 [0,2,0,0,0,0|1,0,1]=4 9817 B21R2.19361 Cc1cc(ccc1O)SCC(=O)OCc2ccccc2 62a_100000753625_100000186361 [0,2,0,0,0,0|1,0,1]=4 9818 B21R2.19361 Cc1ccc(cc1Br)NCC(=O)OCc2ccccc2 2230a_100000736455_100000753625 [0,2,0,0,0,0|1,0,1]=4 9819 B21R2.19361 Cc1ccc(cc1Br)NCC(=O)OCc2ccccc2 34a_100000736455_100000753625 [0,2,0,0,0,0|1,0,1]=4 9820 B21R2.19361 Cc1ccc(cc1Br)NCC(=O)OCc2ccccc2 7a_100000736455_100000753625 [0,2,0,0,0,0|1,0,1]=4 9821 B21R2.19361 Cc1ccc(cc1Br)NNC(=O)C=Cc2ccccc2 22a_100016991967_100000210462 [0,2,0,0,0,0|2,0,0]=4 9822 B21R2.19361 Cc1ccc(cc1Br)OCC(=O)OCc2ccccc2 34a_100011380479_100000753625 [0,2,0,0,0,0|1,0,1]=4 9823 B21R2.19361 Cc1ccc(cc1Br)OCC(=O)OCc2ccccc2 7a_100011380479_100000753625 [0,2,0,0,0,0|1,0,1]=4 9824 B21R2.19361 Cc1ccc(cc1Br)SCC(=O)OCc2ccccc2 62a_100000753625_100011847877 [0,2,0,0,0,0|1,0,1]=4 9825 B21R2.19361 Cc1ccc(cc1Br)SCC(=O)OCc2ccccc2 62a_100011847877_100000753625 [0,2,0,0,0,0|1,0,1]=4 9826 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)CCc2ccccc2 1458a_100011338269_100000765856 [0,2,0,0,0,0|1,0,0]=3 9827 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)CCc2ccccc2 6a_100000229942_100000210092 [0,2,0,0,0,0|1,0,0]=3 9828 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)CCc2ccccn2 1458a_100011338269_100015183660 [0,2,0,0,0,0|2,0,0]=4 9829 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)CCc2cccnc2 1458a_100011338269_200011713674 [0,2,0,0,0,0|2,0,0]=4 9830 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)CCc2ccncc2 1458a_100011338269_100000723409 [0,2,0,0,0,0|2,0,0]=4 9831 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)COc2ccccc2 6a_100000229942_100000150576 [0,2,0,0,0,0|2,0,0]=4 9832 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)CSc2ccccc2 6a_100000229942_100000150717 [0,2,0,0,0,0|2,0,0]=4 9833 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccccc2 11a_100015324214_100011338269 [0,2,0,0,0,0|1,0,0]=3 9834 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccccc2 1626a_100015324214_100011338269 [0,2,0,0,0,0|1,0,0]=3 9835 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccccc2 240690a_100015324214_100011338269 [0,2,0,0,0,0|1,0,0]=3 9836 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccccn2 11a_100000210449_100011338269 [0,2,0,0,0,0|2,0,0]=4 9837 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccccn2 1626a_100000210449_100011338269 [0,2,0,0,0,0|2,0,0]=4 9838 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccccn2 240690a_100000210449_100011338269 [0,2,0,0,0,0|2,0,0]=4 9839 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2cccnc2 11a_100000210453_100011338269 [0,2,0,0,0,0|2,0,0]=4 9840 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2cccnc2 240690a_100000210453_100011338269 [0,2,0,0,0,0|2,0,0]=4 9841 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccncc2 11a_100000210450_100011338269 [0,2,0,0,0,0|2,0,0]=4 9842 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccncc2 1626a_100000210450_100011338269 [0,2,0,0,0,0|2,0,0]=4 9843 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NCc2ccncc2 240690a_100000210450_100011338269 [0,2,0,0,0,0|2,0,0]=4 9844 B21R2.19361 Cc1ccc(cc1C)C=CC(=O)NNc2ccccc2 22a_100015195140_100011338269 [0,2,0,0,0,0|2,0,0]=4 9845 B21R2.19361 Cc1ccc(cc1C)CNC(=O)C=Cc2ccccc2 11a_100025706692_100000210462 [0,2,0,0,0,0|1,0,0]=3 9846 B21R2.19361 Cc1ccc(cc1C)CNC(=O)C=Cc2ccccc2 1626a_100025706692_100000210462 [0,2,0,0,0,0|1,0,0]=3 9847 B21R2.19361 Cc1ccc(cc1C)CNC(=O)C=Cc2ccccn2 11a_100025706692_100000740811 [0,2,0,0,0,0|2,0,0]=4 9848 B21R2.19361 Cc1ccc(cc1C)CNC(=O)C=Cc2ccccn2 240690a_100025706692_100000740811 [0,2,0,0,0,0|2,0,0]=4 9849 B21R2.19361 Cc1ccc(cc1C)CNC(=O)C=Cc2cccnc2 11a_100025706692_100000735890 [0,2,0,0,0,0|2,0,0]=4 9850 B21R2.19361 Cc1ccc(cc1C)CNC(=O)C=Cc2cccnc2 240690a_100025706692_100000735890 [0,2,0,0,0,0|2,0,0]=4 9851 B21R2.19361 Cc1ccc(cc1C)CNC(=O)C=Cc2ccncc2 240690a_100025706692_100000682801 [0,2,0,0,0,0|2,0,0]=4 9852 B21R2.19361 Cc1ccc(cc1C)NCC(=O)OCc2ccccc2 2230a_100000724040_100000753625 [0,2,0,0,0,0|1,0,1]=4 9853 B21R2.19361 Cc1ccc(cc1C)NCC(=O)OCc2ccccc2 34a_100000724040_100000753625 [0,2,0,0,0,0|1,0,1]=4 9854 B21R2.19361 Cc1ccc(cc1C)NCC(=O)OCc2ccccc2 7a_100000724040_100000753625 [0,2,0,0,0,0|1,0,1]=4 9855 B21R2.19361 Cc1ccc(cc1C)OCC(=O)OCc2ccccc2 34a_100000210932_100000753625 [0,2,0,0,0,0|1,0,1]=4 9856 B21R2.19361 Cc1ccc(cc1C)OCC(=O)OCc2ccccc2 7a_100000210932_100000753625 [0,2,0,0,0,0|1,0,1]=4 9857 B21R2.19361 Cc1ccc(cc1C)SCC(=O)OCc2ccccc2 62a_100000753625_100011215607 [0,2,0,0,0,0|1,0,1]=4 9858 B21R2.19361 Cc1ccc(cc1C)SCC(=O)OCc2ccccc2 62a_100011215607_100000753625 [0,2,0,0,0,0|1,0,1]=4 9859 B21R2.19361 Cc1ccc(cc1Cl)C=CC(=O)CCc2ccccc2 6a_100000760539_100000210092 [0,2,0,0,0,0|1,0,0]=3 9860 B21R2.19361 Cc1ccc(cc1Cl)C=CC(=O)COc2ccccc2 6a_100000760539_100000150576 [0,2,0,0,0,0|2,0,0]=4 9861 B21R2.19361 Cc1ccc(cc1Cl)C=CC(=O)CSc2ccccc2 6a_100000760539_100000150717 [0,2,0,0,0,0|2,0,0]=4 9862 B21R2.19361 Cc1ccc(cc1Cl)CNC(=O)C=Cc2ccccc2 11a_102495364989_100000210462 [0,2,0,0,0,0|1,0,0]=3 9863 B21R2.19361 Cc1ccc(cc1Cl)CNC(=O)C=Cc2ccccc2 1626a_102495364989_100000210462 [0,2,0,0,0,0|1,0,0]=3 9864 B21R2.19361 Cc1ccc(cc1Cl)CNC(=O)C=Cc2ccccn2 11a_102495364989_100000740811 [0,2,0,0,0,0|2,0,0]=4 9865 B21R2.19361 Cc1ccc(cc1Cl)CNC(=O)C=Cc2ccccn2 240690a_102495364989_100000740811 [0,2,0,0,0,0|2,0,0]=4 9866 B21R2.19361 Cc1ccc(cc1Cl)CNC(=O)C=Cc2cccnc2 11a_102495364989_100000735890 [0,2,0,0,0,0|2,0,0]=4 9867 B21R2.19361 Cc1ccc(cc1Cl)CNC(=O)C=Cc2cccnc2 240690a_102495364989_100000735890 [0,2,0,0,0,0|2,0,0]=4 9868 B21R2.19361 Cc1ccc(cc1Cl)CNC(=O)C=Cc2ccncc2 240690a_102495364989_100000682801 [0,2,0,0,0,0|2,0,0]=4 9869 B21R2.19361 Cc1ccc(cc1Cl)NCC(=O)OCc2ccccc2 2230a_100000188892_100000753625 [0,2,0,0,0,0|1,0,1]=4 9870 B21R2.19361 Cc1ccc(cc1Cl)NCC(=O)OCc2ccccc2 34a_100000188892_100000753625 [0,2,0,0,0,0|1,0,1]=4 9871 B21R2.19361 Cc1ccc(cc1Cl)NCC(=O)OCc2ccccc2 7a_100000188892_100000753625 [0,2,0,0,0,0|1,0,1]=4 9872 B21R2.19361 Cc1ccc(cc1Cl)NNC(=O)C=Cc2ccccc2 22a_100000681537_100000210462 [0,2,0,0,0,0|2,0,0]=4 9873 B21R2.19361 Cc1ccc(cc1Cl)OCC(=O)OCc2ccccc2 34a_100011265682_100000753625 [0,2,0,0,0,0|1,0,1]=4 9874 B21R2.19361 Cc1ccc(cc1Cl)OCC(=O)OCc2ccccc2 7a_100011265682_100000753625 [0,2,0,0,0,0|1,0,1]=4 9875 B21R2.19361 Cc1ccc(cc1Cl)SCC(=O)OCc2ccccc2 62a_100000753625_100011216363 [0,2,0,0,0,0|1,0,1]=4 9876 B21R2.19361 Cc1ccc(cc1Cl)SCC(=O)OCc2ccccc2 62a_100011216363_100000753625 [0,2,0,0,0,0|1,0,1]=4 9877 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)CCc2ccccc2 1458a_100102526211_100000765856 [0,2,0,0,0,0|1,0,0]=3 9878 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)CCc2ccccc2 6a_100000753222_100000210092 [0,2,0,0,0,0|1,0,0]=3 9879 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)CCc2ccccn2 1458a_100102526211_100015183660 [0,2,0,0,0,0|2,0,0]=4 9880 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)CCc2cccnc2 1458a_100102526211_200011713674 [0,2,0,0,0,0|2,0,0]=4 9881 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)CCc2ccncc2 1458a_100102526211_100000723409 [0,2,0,0,0,0|2,0,0]=4 9882 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)COc2ccccc2 6a_100000753222_100000150576 [0,2,0,0,0,0|2,0,0]=4 9883 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)CSc2ccccc2 6a_100000753222_100000150717 [0,2,0,0,0,0|2,0,0]=4 9884 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccccc2 11a_100015324214_100102526211 [0,2,0,0,0,0|1,0,0]=3 9885 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccccc2 1626a_100015324214_100102526211 [0,2,0,0,0,0|1,0,0]=3 9886 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccccc2 240690a_100015324214_100102526211 [0,2,0,0,0,0|1,0,0]=3 9887 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccccn2 11a_100000210449_100102526211 [0,2,0,0,0,0|2,0,0]=4 9888 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccccn2 1626a_100000210449_100102526211 [0,2,0,0,0,0|2,0,0]=4 9889 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccccn2 240690a_100000210449_100102526211 [0,2,0,0,0,0|2,0,0]=4 9890 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2cccnc2 11a_100000210453_100102526211 [0,2,0,0,0,0|2,0,0]=4 9891 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2cccnc2 240690a_100000210453_100102526211 [0,2,0,0,0,0|2,0,0]=4 9892 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccncc2 11a_100000210450_100102526211 [0,2,0,0,0,0|2,0,0]=4 9893 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccncc2 1626a_100000210450_100102526211 [0,2,0,0,0,0|2,0,0]=4 9894 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NCc2ccncc2 240690a_100000210450_100102526211 [0,2,0,0,0,0|2,0,0]=4 9895 B21R2.19361 Cc1ccc(cc1F)C=CC(=O)NNc2ccccc2 22a_100015195140_100102526211 [0,2,0,0,0,0|2,0,0]=4 9896 B21R2.19361 Cc1ccc(cc1F)CNC(=O)C=Cc2ccccc2 11a_100102708794_100000210462 [0,2,0,0,0,0|1,0,0]=3 9897 B21R2.19361 Cc1ccc(cc1F)CNC(=O)C=Cc2ccccc2 1626a_100102708794_100000210462 [0,2,0,0,0,0|1,0,0]=3 9898 B21R2.19361 Cc1ccc(cc1F)CNC(=O)C=Cc2ccccn2 11a_100102708794_100000740811 [0,2,0,0,0,0|2,0,0]=4 9899 B21R2.19361 Cc1ccc(cc1F)CNC(=O)C=Cc2ccccn2 240690a_100102708794_100000740811 [0,2,0,0,0,0|2,0,0]=4 9900 B21R2.19361 Cc1ccc(cc1F)CNC(=O)C=Cc2cccnc2 11a_100102708794_100000735890 [0,2,0,0,0,0|2,0,0]=4 9901 B21R2.19361 Cc1ccc(cc1F)CNC(=O)C=Cc2cccnc2 240690a_100102708794_100000735890 [0,2,0,0,0,0|2,0,0]=4 9902 B21R2.19361 Cc1ccc(cc1F)CNC(=O)C=Cc2ccncc2 240690a_100102708794_100000682801 [0,2,0,0,0,0|2,0,0]=4 9903 B21R2.19361 Cc1ccc(cc1F)NCC(=O)OCc2ccccc2 2230a_100000210958_100000753625 [0,2,0,0,0,0|1,0,1]=4 9904 B21R2.19361 Cc1ccc(cc1F)NCC(=O)OCc2ccccc2 34a_100000210958_100000753625 [0,2,0,0,0,0|1,0,1]=4 9905 B21R2.19361 Cc1ccc(cc1F)NCC(=O)OCc2ccccc2 7a_100000210958_100000753625 [0,2,0,0,0,0|1,0,1]=4 9906 B21R2.19361 Cc1ccc(cc1F)NNC(=O)C=Cc2ccccc2 22a_100000689702_100000210462 [0,2,0,0,0,0|2,0,0]=4 9907 B21R2.19361 Cc1ccc(cc1F)OCC(=O)OCc2ccccc2 34a_100000722560_100000753625 [0,2,0,0,0,0|1,0,1]=4 9908 B21R2.19361 Cc1ccc(cc1F)OCC(=O)OCc2ccccc2 7a_100000722560_100000753625 [0,2,0,0,0,0|1,0,1]=4 9909 B21R2.19361 Cc1ccc(cc1F)SCC(=O)OCc2ccccc2 62a_100000720648_100000753625 [0,2,0,0,0,0|1,0,1]=4 9910 B21R2.19361 Cc1ccc(cc1F)SCC(=O)OCc2ccccc2 62a_100000753625_100000720648 [0,2,0,0,0,0|1,0,1]=4 9911 B21R2.19361 Cc1ccc(cc1I)C=CC(=O)CCc2ccccc2 6a_100010197721_100000210092 [0,2,0,0,0,0|1,0,0]=3 9912 B21R2.19361 Cc1ccc(cc1I)C=CC(=O)COc2ccccc2 6a_100010197721_100000150576 [0,2,0,0,0,0|2,0,0]=4 9913 B21R2.19361 Cc1ccc(cc1I)C=CC(=O)CSc2ccccc2 6a_100010197721_100000150717 [0,2,0,0,0,0|2,0,0]=4 9914 B21R2.19361 Cc1ccc(cc1I)NCC(=O)OCc2ccccc2 34a_100000184131_100000753625 [0,2,0,0,0,0|1,0,1]=4 9915 B21R2.19361 Cc1ccc(cc1I)NCC(=O)OCc2ccccc2 7a_100000184131_100000753625 [0,2,0,0,0,0|1,0,1]=4 9916 B21R2.19361 Cc1ccc(cc1N)OCC(=O)OCc2ccccc2 34a_100011216113_100000753625 [0,2,0,0,0,0|1,0,1]=4 9917 B21R2.19361 Cc1ccc(cc1N)OCC(=O)OCc2ccccc2 7a_100011216113_100000753625 [0,2,0,0,0,0|1,0,1]=4 9918 B21R2.19361 Cc1ccc(cc1N)SCC(=O)OCc2ccccc2 62a_100000753625_100000761890 [0,2,0,0,0,0|1,0,1]=4 9919 B21R2.19361 Cc1ccc(cc1N)SCC(=O)OCc2ccccc2 62a_100000761890_100000753625 [0,2,0,0,0,0|1,0,1]=4 9920 B21R2.19361 Cc1ccc(cc1O)NCC(=O)OCc2ccccc2 34a_100000759471_100000753625 [0,2,0,0,0,0|1,0,1]=4 9921 B21R2.19361 Cc1ccc(cc1O)NCC(=O)OCc2ccccc2 7a_100000759471_100000753625 [0,2,0,0,0,0|1,0,1]=4 9922 B21R2.19361 Cc1ccc(cc1O)SCC(=O)OCc2ccccc2 62a_100000685420_100000753625 [0,2,0,0,0,0|1,0,1]=4 9923 B21R2.19361 Cc1ccc(cc1O)SCC(=O)OCc2ccccc2 62a_100000753625_100000685420 [0,2,0,0,0,0|1,0,1]=4 9924 B21R2.19361 Cc1ccc(nc1C)CNC(=O)C=Cc2ccccc2 11a_202515432893_100000210462 [0,2,0,0,0,0|2,0,0]=4 9925 B21R2.19361 Cc1ccc(nc1C)CNC(=O)C=Cc2ccccc2 1626a_202515432893_100000210462 [0,2,0,0,0,0|2,0,0]=4 9926 B21R2.19361 Nc1cc(ccc1Br)OCC(=O)OCc2ccccc2 34a_100011999798_100000753625 [0,2,0,0,0,0|1,0,1]=4 9927 B21R2.19361 Nc1cc(ccc1Br)OCC(=O)OCc2ccccc2 7a_100011999798_100000753625 [0,2,0,0,0,0|1,0,1]=4 9928 B21R2.19361 Nc1cc(ccc1Br)SCC(=O)OCc2ccccc2 62a_100000750456_100000753625 [0,2,0,0,0,0|1,0,1]=4 9929 B21R2.19361 Nc1cc(ccc1Br)SCC(=O)OCc2ccccc2 62a_100000753625_100000750456 [0,2,0,0,0,0|1,0,1]=4 9930 B21R2.19361 Nc1cc(ccc1Cl)OCC(=O)OCc2ccccc2 34a_100011934297_100000753625 [0,2,0,0,0,0|1,0,1]=4 9931 B21R2.19361 Nc1cc(ccc1Cl)SCC(=O)OCc2ccccc2 62a_100000753625_200000761891 [0,2,0,0,0,0|1,0,1]=4 9932 B21R2.19361 Nc1cc(ccc1Cl)SCC(=O)OCc2ccccc2 62a_200000761891_100000753625 [0,2,0,0,0,0|1,0,1]=4 9933 B21R2.19361 Nc1cc(ccc1F)OCC(=O)OCc2ccccc2 34a_100012017239_100000753625 [0,2,0,0,0,0|1,0,1]=4 9934 B21R2.19361 Nc1cc(ccc1F)OCC(=O)OCc2ccccc2 7a_100012017239_100000753625 [0,2,0,0,0,0|1,0,1]=4 9935 B21R2.19361 Nc1cc(ccc1F)SCC(=O)OCc2ccccc2 62a_100000740924_100000753625 [0,2,0,0,0,0|1,0,1]=4 9936 B21R2.19361 Nc1cc(ccc1F)SCC(=O)OCc2ccccc2 62a_100000753625_100000740924 [0,2,0,0,0,0|1,0,1]=4 9937 B21R2.19361 Nc1cc(ccc1O)SCC(=O)OCc2ccccc2 62a_100000752626_100000753625 [0,2,0,0,0,0|1,0,1]=4 9938 B21R2.19361 Nc1cc(ccc1O)SCC(=O)OCc2ccccc2 62a_100000753625_100000752626 [0,2,0,0,0,0|1,0,1]=4 9939 B21R2.19361 Nc1ccc(cc1Br)OCC(=O)OCc2ccccc2 34a_100012001276_100000753625 [0,2,0,0,0,0|1,0,1]=4 9940 B21R2.19361 Nc1ccc(cc1Br)OCC(=O)OCc2ccccc2 7a_100012001276_100000753625 [0,2,0,0,0,0|1,0,1]=4 9941 B21R2.19361 Nc1ccc(cc1Br)SCC(=O)OCc2ccccc2 62a_100000750455_100000753625 [0,2,0,0,0,0|1,0,1]=4 9942 B21R2.19361 Nc1ccc(cc1Br)SCC(=O)OCc2ccccc2 62a_100000753625_100000750455 [0,2,0,0,0,0|1,0,1]=4 9943 B21R2.19361 Nc1ccc(cc1Cl)OCC(=O)OCc2ccccc2 34a_100011215599_100000753625 [0,2,0,0,0,0|1,0,1]=4 9944 B21R2.19361 Nc1ccc(cc1Cl)OCC(=O)OCc2ccccc2 7a_100011215599_100000753625 [0,2,0,0,0,0|1,0,1]=4 9945 B21R2.19361 Nc1ccc(cc1Cl)SCC(=O)OCc2ccccc2 62a_100000753625_100011218065 [0,2,0,0,0,0|1,0,1]=4 9946 B21R2.19361 Nc1ccc(cc1Cl)SCC(=O)OCc2ccccc2 62a_100011218065_100000753625 [0,2,0,0,0,0|1,0,1]=4 9947 B21R2.19361 Nc1ccc(cc1F)OCC(=O)OCc2ccccc2 34a_100000759473_100000753625 [0,2,0,0,0,0|1,0,1]=4 9948 B21R2.19361 Nc1ccc(cc1F)OCC(=O)OCc2ccccc2 7a_100000759473_100000753625 [0,2,0,0,0,0|1,0,1]=4 9949 B21R2.19361 Nc1ccc(cc1F)SCC(=O)OCc2ccccc2 62a_100000753625_100011215594 [0,2,0,0,0,0|1,0,1]=4 9950 B21R2.19361 Nc1ccc(cc1F)SCC(=O)OCc2ccccc2 62a_100011215594_100000753625 [0,2,0,0,0,0|1,0,1]=4 9951 B21R2.19361 Nc1ccc(cc1I)OCC(=O)OCc2ccccc2 34a_100010084370_100000753625 [0,2,0,0,0,0|1,0,1]=4 9952 B21R2.19361 Nc1ccc(cc1I)OCC(=O)OCc2ccccc2 7a_100010084370_100000753625 [0,2,0,0,0,0|1,0,1]=4 9953 B21R2.19361 Nc1ccc(cc1N)OCC(=O)OCc2ccccc2 34a_100025771000_100000753625 [0,2,0,0,0,0|1,0,1]=4 9954 B21R2.19361 Nc1ccc(cc1N)SCC(=O)OCc2ccccc2 62a_100000741789_100000753625 [0,2,0,0,0,0|1,0,1]=4 9955 B21R2.19361 Nc1ccc(cc1N)SCC(=O)OCc2ccccc2 62a_100000753625_100011534411 [0,2,0,0,0,0|1,0,1]=4 9956 B21R2.19361 Nc1ccc(cc1O)SCC(=O)OCc2ccccc2 62a_100000739049_100000753625 [0,2,0,0,0,0|1,0,1]=4 9957 B21R2.19361 Nc1ccc(cc1O)SCC(=O)OCc2ccccc2 62a_100000753625_100000739049 [0,2,0,0,0,0|1,0,1]=4 9958 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)CCc2ccccc2 1458a_100102889548_100000765856 [0,2,0,0,0,0|1,0,0]=3 9959 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)CCc2ccccc2 6a_100000693810_100000210092 [0,2,0,0,0,0|1,0,0]=3 9960 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)CCc2ccccn2 1458a_100102889548_100015183660 [0,2,0,0,0,0|2,0,0]=4 9961 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)CCc2cccnc2 1458a_100102889548_200011713674 [0,2,0,0,0,0|2,0,0]=4 9962 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)CCc2ccncc2 1458a_100102889548_100000723409 [0,2,0,0,0,0|2,0,0]=4 9963 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)COc2ccccc2 6a_100000693810_100000150576 [0,2,0,0,0,0|2,0,0]=4 9964 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)CSc2ccccc2 6a_100000693810_100000150717 [0,2,0,0,0,0|2,0,0]=4 9965 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccccc2 11a_100015324214_100102889548 [0,2,0,0,0,0|1,0,0]=3 9966 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccccc2 1626a_100015324214_100102889548 [0,2,0,0,0,0|1,0,0]=3 9967 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccccc2 240690a_100015324214_100102889548 [0,2,0,0,0,0|1,0,0]=3 9968 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccccn2 11a_100000210449_100102889548 [0,2,0,0,0,0|2,0,0]=4 9969 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccccn2 1626a_100000210449_100102889548 [0,2,0,0,0,0|2,0,0]=4 9970 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccccn2 240690a_100000210449_100102889548 [0,2,0,0,0,0|2,0,0]=4 9971 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2cccnc2 11a_100000210453_100102889548 [0,2,0,0,0,0|2,0,0]=4 9972 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2cccnc2 240690a_100000210453_100102889548 [0,2,0,0,0,0|2,0,0]=4 9973 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccncc2 11a_100000210450_100102889548 [0,2,0,0,0,0|2,0,0]=4 9974 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccncc2 1626a_100000210450_100102889548 [0,2,0,0,0,0|2,0,0]=4 9975 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NCc2ccncc2 240690a_100000210450_100102889548 [0,2,0,0,0,0|2,0,0]=4 9976 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)Cl)NNc2ccccc2 22a_100015195140_100102889548 [0,2,0,0,0,0|2,0,0]=4 9977 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)CCc2ccccc2 1458a_100011195070_100000765856 [0,2,0,0,0,0|1,0,0]=3 9978 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)CCc2ccccc2 6a_100000211747_100000210092 [0,2,0,0,0,0|1,0,0]=3 9979 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)CCc2ccccn2 1458a_100011195070_100015183660 [0,2,0,0,0,0|2,0,0]=4 9980 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)CCc2cccnc2 1458a_100011195070_200011713674 [0,2,0,0,0,0|2,0,0]=4 9981 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)CCc2ccncc2 1458a_100011195070_100000723409 [0,2,0,0,0,0|2,0,0]=4 9982 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)COc2ccccc2 6a_100000211747_100000150576 [0,2,0,0,0,0|2,0,0]=4 9983 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)CSc2ccccc2 6a_100000211747_100000150717 [0,2,0,0,0,0|2,0,0]=4 9984 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccccc2 11a_100015324214_100011195070 [0,2,0,0,0,0|1,0,0]=3 9985 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccccc2 1626a_100015324214_100011195070 [0,2,0,0,0,0|1,0,0]=3 9986 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccccc2 240690a_100015324214_100011195070 [0,2,0,0,0,0|1,0,0]=3 9987 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccccn2 11a_100000210449_100011195070 [0,2,0,0,0,0|2,0,0]=4 9988 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccccn2 1626a_100000210449_100011195070 [0,2,0,0,0,0|2,0,0]=4 9989 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccccn2 240690a_100000210449_100011195070 [0,2,0,0,0,0|2,0,0]=4 9990 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2cccnc2 11a_100000210453_100011195070 [0,2,0,0,0,0|2,0,0]=4 9991 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2cccnc2 240690a_100000210453_100011195070 [0,2,0,0,0,0|2,0,0]=4 9992 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccncc2 11a_100000210450_100011195070 [0,2,0,0,0,0|2,0,0]=4 9993 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccncc2 1626a_100000210450_100011195070 [0,2,0,0,0,0|2,0,0]=4 9994 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NCc2ccncc2 240690a_100000210450_100011195070 [0,2,0,0,0,0|2,0,0]=4 9995 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)F)NNc2ccccc2 22a_100015195140_100011195070 [0,2,0,0,0,0|2,0,0]=4 9996 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)CCc2ccccc2 1458a_200103079279_100000765856 [0,2,0,0,0,0|1,0,0]=3 9997 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)CCc2ccccn2 1458a_200103079279_100015183660 [0,2,0,0,0,0|2,0,0]=4 9998 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)CCc2cccnc2 1458a_200103079279_200011713674 [0,2,0,0,0,0|2,0,0]=4 9999 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)CCc2ccncc2 1458a_200103079279_100000723409 [0,2,0,0,0,0|2,0,0]=4 10000 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)NCc2ccccc2 240690a_100015324214_200103079279 [0,2,0,0,0,0|1,0,0]=3 10001 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)NCc2ccccn2 240690a_100000210449_200103079279 [0,2,0,0,0,0|2,0,0]=4 10002 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)NCc2cccnc2 240690a_100000210453_200103079279 [0,2,0,0,0,0|2,0,0]=4 10003 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)NCc2ccncc2 240690a_100000210450_200103079279 [0,2,0,0,0,0|2,0,0]=4 10004 B21R2.19361 O=C(C=Cc1ccc(c(c1)Br)O)NNc2ccccc2 22a_100015195140_200103079279 [0,2,0,0,0,0|2,0,0]=4 10005 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCc2ccccc2 1458a_100000716972_100000765856 [0,2,0,0,0,0|1,0,0]=3 10006 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCc2ccccc2 6a_100000188533_100000210092 [0,2,0,0,0,0|1,0,0]=3 10007 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCc2ccccn2 1458a_100000716972_100015183660 [0,2,0,0,0,0|2,0,0]=4 10008 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCc2cccnc2 1458a_100000716972_200011713674 [0,2,0,0,0,0|2,0,0]=4 10009 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCc2ccncc2 1458a_100000716972_100000723409 [0,2,0,0,0,0|2,0,0]=4 10010 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)COc2ccccc2 6a_100000188533_100000150576 [0,2,0,0,0,0|2,0,0]=4 10011 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)CSc2ccccc2 6a_100000188533_100000150717 [0,2,0,0,0,0|2,0,0]=4 10012 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccccc2 11a_100015324214_100000716972 [0,2,0,0,0,0|1,0,0]=3 10013 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccccc2 1626a_100015324214_100000716972 [0,2,0,0,0,0|1,0,0]=3 10014 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccccc2 240690a_100015324214_100000716972 [0,2,0,0,0,0|1,0,0]=3 10015 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccccn2 11a_100000210449_100000716972 [0,2,0,0,0,0|2,0,0]=4 10016 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccccn2 1626a_100000210449_100000716972 [0,2,0,0,0,0|2,0,0]=4 10017 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccccn2 240690a_100000210449_100000716972 [0,2,0,0,0,0|2,0,0]=4 10018 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2cccnc2 11a_100000210453_100000716972 [0,2,0,0,0,0|2,0,0]=4 10019 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2cccnc2 240690a_100000210453_100000716972 [0,2,0,0,0,0|2,0,0]=4 10020 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccncc2 11a_100000210450_100000716972 [0,2,0,0,0,0|2,0,0]=4 10021 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccncc2 1626a_100000210450_100000716972 [0,2,0,0,0,0|2,0,0]=4 10022 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCc2ccncc2 240690a_100000210450_100000716972 [0,2,0,0,0,0|2,0,0]=4 10023 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)Cl)NNc2ccccc2 22a_100015195140_100000716972 [0,2,0,0,0,0|2,0,0]=4 10024 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)CCc2ccccc2 1458a_100102525453_100000765856 [0,2,0,0,0,0|1,0,0]=3 10025 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)CCc2ccccc2 6a_100000742290_100000210092 [0,2,0,0,0,0|1,0,0]=3 10026 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)CCc2ccccn2 1458a_100102525453_100015183660 [0,2,0,0,0,0|2,0,0]=4 10027 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)CCc2cccnc2 1458a_100102525453_200011713674 [0,2,0,0,0,0|2,0,0]=4 10028 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)CCc2ccncc2 1458a_100102525453_100000723409 [0,2,0,0,0,0|2,0,0]=4 10029 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)COc2ccccc2 6a_100000742290_100000150576 [0,2,0,0,0,0|2,0,0]=4 10030 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)CSc2ccccc2 6a_100000742290_100000150717 [0,2,0,0,0,0|2,0,0]=4 10031 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccccc2 11a_100015324214_100102525453 [0,2,0,0,0,0|1,0,0]=3 10032 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccccc2 1626a_100015324214_100102525453 [0,2,0,0,0,0|1,0,0]=3 10033 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccccc2 240690a_100015324214_100102525453 [0,2,0,0,0,0|1,0,0]=3 10034 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccccn2 11a_100000210449_100102525453 [0,2,0,0,0,0|2,0,0]=4 10035 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccccn2 1626a_100000210449_100102525453 [0,2,0,0,0,0|2,0,0]=4 10036 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccccn2 240690a_100000210449_100102525453 [0,2,0,0,0,0|2,0,0]=4 10037 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2cccnc2 11a_100000210453_100102525453 [0,2,0,0,0,0|2,0,0]=4 10038 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2cccnc2 240690a_100000210453_100102525453 [0,2,0,0,0,0|2,0,0]=4 10039 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccncc2 11a_100000210450_100102525453 [0,2,0,0,0,0|2,0,0]=4 10040 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccncc2 1626a_100000210450_100102525453 [0,2,0,0,0,0|2,0,0]=4 10041 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NCc2ccncc2 240690a_100000210450_100102525453 [0,2,0,0,0,0|2,0,0]=4 10042 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)F)NNc2ccccc2 22a_100015195140_100102525453 [0,2,0,0,0,0|2,0,0]=4 10043 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)CCc2ccccc2 1458a_200103117615_100000765856 [0,2,0,0,0,0|1,0,0]=3 10044 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)CCc2ccccc2 6a_100000186751_100000210092 [0,2,0,0,0,0|1,0,0]=3 10045 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)CCc2ccccn2 1458a_200103117615_100015183660 [0,2,0,0,0,0|2,0,0]=4 10046 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)CCc2cccnc2 1458a_200103117615_200011713674 [0,2,0,0,0,0|2,0,0]=4 10047 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)CCc2ccncc2 1458a_200103117615_100000723409 [0,2,0,0,0,0|2,0,0]=4 10048 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)COc2ccccc2 6a_100000186751_100000150576 [0,2,0,0,0,0|2,0,0]=4 10049 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)CSc2ccccc2 6a_100000186751_100000150717 [0,2,0,0,0,0|2,0,0]=4 10050 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)NCc2ccccc2 240690a_100015324214_200103117615 [0,2,0,0,0,0|1,0,0]=3 10051 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)NCc2ccccn2 240690a_100000210449_200103117615 [0,2,0,0,0,0|2,0,0]=4 10052 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)NCc2cccnc2 240690a_100000210453_200103117615 [0,2,0,0,0,0|2,0,0]=4 10053 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)NCc2ccncc2 240690a_100000210450_200103117615 [0,2,0,0,0,0|2,0,0]=4 10054 B21R2.19361 O=C(C=Cc1ccc(c(c1)Cl)O)NNc2ccccc2 22a_100015195140_200103117615 [0,2,0,0,0,0|2,0,0]=4 10055 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)CCc2ccccc2 1458a_100102601611_100000765856 [0,2,0,0,0,0|1,0,0]=3 10056 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)CCc2ccccc2 6a_100000686674_100000210092 [0,2,0,0,0,0|1,0,0]=3 10057 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)CCc2ccccn2 1458a_100102601611_100015183660 [0,2,0,0,0,0|2,0,0]=4 10058 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)CCc2cccnc2 1458a_100102601611_200011713674 [0,2,0,0,0,0|2,0,0]=4 10059 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)CCc2ccncc2 1458a_100102601611_100000723409 [0,2,0,0,0,0|2,0,0]=4 10060 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)COc2ccccc2 6a_100000686674_100000150576 [0,2,0,0,0,0|2,0,0]=4 10061 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)CSc2ccccc2 6a_100000686674_100000150717 [0,2,0,0,0,0|2,0,0]=4 10062 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccccc2 11a_100015324214_100102601611 [0,2,0,0,0,0|1,0,0]=3 10063 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccccc2 1626a_100015324214_100102601611 [0,2,0,0,0,0|1,0,0]=3 10064 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccccc2 240690a_100015324214_100102601611 [0,2,0,0,0,0|1,0,0]=3 10065 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccccn2 11a_100000210449_100102601611 [0,2,0,0,0,0|2,0,0]=4 10066 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccccn2 1626a_100000210449_100102601611 [0,2,0,0,0,0|2,0,0]=4 10067 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccccn2 240690a_100000210449_100102601611 [0,2,0,0,0,0|2,0,0]=4 10068 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2cccnc2 11a_100000210453_100102601611 [0,2,0,0,0,0|2,0,0]=4 10069 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2cccnc2 240690a_100000210453_100102601611 [0,2,0,0,0,0|2,0,0]=4 10070 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccncc2 11a_100000210450_100102601611 [0,2,0,0,0,0|2,0,0]=4 10071 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccncc2 1626a_100000210450_100102601611 [0,2,0,0,0,0|2,0,0]=4 10072 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NCc2ccncc2 240690a_100000210450_100102601611 [0,2,0,0,0,0|2,0,0]=4 10073 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Br)NNc2ccccc2 22a_100015195140_100102601611 [0,2,0,0,0,0|2,0,0]=4 10074 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)CCc2ccccc2 1458a_100020610926_100000765856 [0,2,0,0,0,0|1,0,0]=3 10075 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)CCc2ccccc2 6a_100000745630_100000210092 [0,2,0,0,0,0|1,0,0]=3 10076 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)CCc2ccccn2 1458a_100020610926_100015183660 [0,2,0,0,0,0|2,0,0]=4 10077 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)CCc2cccnc2 1458a_100020610926_200011713674 [0,2,0,0,0,0|2,0,0]=4 10078 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)CCc2ccncc2 1458a_100020610926_100000723409 [0,2,0,0,0,0|2,0,0]=4 10079 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)COc2ccccc2 6a_100000745630_100000150576 [0,2,0,0,0,0|2,0,0]=4 10080 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)CSc2ccccc2 6a_100000745630_100000150717 [0,2,0,0,0,0|2,0,0]=4 10081 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccccc2 11a_100015324214_100020610926 [0,2,0,0,0,0|1,0,0]=3 10082 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccccc2 1626a_100015324214_100020610926 [0,2,0,0,0,0|1,0,0]=3 10083 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccccc2 240690a_100015324214_100020610926 [0,2,0,0,0,0|1,0,0]=3 10084 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccccn2 11a_100000210449_100020610926 [0,2,0,0,0,0|2,0,0]=4 10085 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccccn2 1626a_100000210449_100020610926 [0,2,0,0,0,0|2,0,0]=4 10086 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccccn2 240690a_100000210449_100020610926 [0,2,0,0,0,0|2,0,0]=4 10087 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2cccnc2 11a_100000210453_100020610926 [0,2,0,0,0,0|2,0,0]=4 10088 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2cccnc2 240690a_100000210453_100020610926 [0,2,0,0,0,0|2,0,0]=4 10089 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccncc2 11a_100000210450_100020610926 [0,2,0,0,0,0|2,0,0]=4 10090 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccncc2 1626a_100000210450_100020610926 [0,2,0,0,0,0|2,0,0]=4 10091 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NCc2ccncc2 240690a_100000210450_100020610926 [0,2,0,0,0,0|2,0,0]=4 10092 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)Cl)NNc2ccccc2 22a_100015195140_100020610926 [0,2,0,0,0,0|2,0,0]=4 10093 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)CCc2ccccc2 1458a_100011195075_100000765856 [0,2,0,0,0,0|1,0,0]=3 10094 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)CCc2ccccc2 6a_100000211062_100000210092 [0,2,0,0,0,0|1,0,0]=3 10095 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)CCc2ccccn2 1458a_100011195075_100015183660 [0,2,0,0,0,0|2,0,0]=4 10096 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)CCc2cccnc2 1458a_100011195075_200011713674 [0,2,0,0,0,0|2,0,0]=4 10097 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)CCc2ccncc2 1458a_100011195075_100000723409 [0,2,0,0,0,0|2,0,0]=4 10098 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)COc2ccccc2 6a_100000211062_100000150576 [0,2,0,0,0,0|2,0,0]=4 10099 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)CSc2ccccc2 6a_100000211062_100000150717 [0,2,0,0,0,0|2,0,0]=4 10100 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccccc2 11a_100015324214_100011195075 [0,2,0,0,0,0|1,0,0]=3 10101 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccccc2 1626a_100015324214_100011195075 [0,2,0,0,0,0|1,0,0]=3 10102 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccccc2 240690a_100015324214_100011195075 [0,2,0,0,0,0|1,0,0]=3 10103 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccccn2 11a_100000210449_100011195075 [0,2,0,0,0,0|2,0,0]=4 10104 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccccn2 1626a_100000210449_100011195075 [0,2,0,0,0,0|2,0,0]=4 10105 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccccn2 240690a_100000210449_100011195075 [0,2,0,0,0,0|2,0,0]=4 10106 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2cccnc2 11a_100000210453_100011195075 [0,2,0,0,0,0|2,0,0]=4 10107 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2cccnc2 240690a_100000210453_100011195075 [0,2,0,0,0,0|2,0,0]=4 10108 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccncc2 11a_100000210450_100011195075 [0,2,0,0,0,0|2,0,0]=4 10109 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccncc2 1626a_100000210450_100011195075 [0,2,0,0,0,0|2,0,0]=4 10110 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NCc2ccncc2 240690a_100000210450_100011195075 [0,2,0,0,0,0|2,0,0]=4 10111 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)F)NNc2ccccc2 22a_100015195140_100011195075 [0,2,0,0,0,0|2,0,0]=4 10112 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)I)CCc2ccccc2 6a_100000050832_100000210092 [0,2,0,0,0,0|1,0,0]=3 10113 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)I)COc2ccccc2 6a_100000050832_100000150576 [0,2,0,0,0,0|2,0,0]=4 10114 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)I)CSc2ccccc2 6a_100000050832_100000150717 [0,2,0,0,0,0|2,0,0]=4 10115 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)O)CCc2ccccc2 6a_100000742332_100000210092 [0,2,0,0,0,0|1,0,0]=3 10116 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)O)COc2ccccc2 6a_100000742332_100000150576 [0,2,0,0,0,0|2,0,0]=4 10117 B21R2.19361 O=C(C=Cc1ccc(c(c1)F)O)CSc2ccccc2 6a_100000742332_100000150717 [0,2,0,0,0,0|2,0,0]=4 10118 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)Br)CCc2ccccc2 6a_100010146563_100000210092 [0,2,0,0,0,0|1,0,0]=3 10119 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)Br)COc2ccccc2 6a_100010146563_100000150576 [0,2,0,0,0,0|2,0,0]=4 10120 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)Br)CSc2ccccc2 6a_100010146563_100000150717 [0,2,0,0,0,0|2,0,0]=4 10121 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)Cl)CCc2ccccc2 6a_100010209939_100000210092 [0,2,0,0,0,0|1,0,0]=3 10122 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)Cl)COc2ccccc2 6a_100010209939_100000150576 [0,2,0,0,0,0|2,0,0]=4 10123 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)Cl)CSc2ccccc2 6a_100010209939_100000150717 [0,2,0,0,0,0|2,0,0]=4 10124 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)F)CCc2ccccc2 6a_100010188209_100000210092 [0,2,0,0,0,0|1,0,0]=3 10125 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)F)COc2ccccc2 6a_100010188209_100000150576 [0,2,0,0,0,0|2,0,0]=4 10126 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)F)CSc2ccccc2 6a_100010188209_100000150717 [0,2,0,0,0,0|2,0,0]=4 10127 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)O)CCc2ccccc2 6a_100000186752_100000210092 [0,2,0,0,0,0|1,0,0]=3 10128 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)O)COc2ccccc2 6a_100000186752_100000150576 [0,2,0,0,0,0|2,0,0]=4 10129 B21R2.19361 O=C(C=Cc1ccc(c(c1)I)O)CSc2ccccc2 6a_100000186752_100000150717 [0,2,0,0,0,0|2,0,0]=4 10130 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)Cl)CCc2ccccc2 6a_100009876013_100000210092 [0,2,0,0,0,0|1,0,0]=3 10131 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)Cl)COc2ccccc2 6a_100009876013_100000150576 [0,2,0,0,0,0|2,0,0]=4 10132 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)Cl)CSc2ccccc2 6a_100009876013_100000150717 [0,2,0,0,0,0|2,0,0]=4 10133 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)F)CCc2ccccc2 6a_100000102368_100000210092 [0,2,0,0,0,0|1,0,0]=3 10134 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)F)COc2ccccc2 6a_100000102368_100000150576 [0,2,0,0,0,0|2,0,0]=4 10135 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)F)CSc2ccccc2 6a_100000102368_100000150717 [0,2,0,0,0,0|2,0,0]=4 10136 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)I)CCc2ccccc2 6a_100000041418_100000210092 [0,2,0,0,0,0|1,0,0]=3 10137 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)I)COc2ccccc2 6a_100000041418_100000150576 [0,2,0,0,0,0|2,0,0]=4 10138 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)I)CSc2ccccc2 6a_100000041418_100000150717 [0,2,0,0,0,0|2,0,0]=4 10139 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)O)NCc2ccccc2 240690a_100015324214_100011195073 [0,2,0,0,0,0|1,0,0]=3 10140 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)O)NCc2ccccn2 240690a_100000210449_100011195073 [0,2,0,0,0,0|2,0,0]=4 10141 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)O)NCc2cccnc2 240690a_100000210453_100011195073 [0,2,0,0,0,0|2,0,0]=4 10142 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)O)NCc2ccncc2 240690a_100000210450_100011195073 [0,2,0,0,0,0|2,0,0]=4 10143 B21R2.19361 O=C(C=Cc1ccc(c(c1)O)O)NNc2ccccc2 22a_100015195140_100011195073 [0,2,0,0,0,0|2,0,0]=4 10144 B21R2.19361 O=C(C=Cc1ccccc1)CCc2ccc(c(c2)Cl)Cl 1458a_100000210462_100011713676 [0,2,0,0,0,0|1,0,0]=3 10145 B21R2.19361 O=C(C=Cc1ccccc1)CCc2ccc(c(c2)Cl)F 1458a_100000210462_100012361305 [0,2,0,0,0,0|1,0,0]=3 10146 B21R2.19361 O=C(C=Cc1ccccc1)CCc2ccc(c(c2)F)F 1458a_100000210462_100000690553 [0,2,0,0,0,0|1,0,0]=3 10147 B21R2.19361 O=C(C=Cc1ccccc1)CCc2ccc(c(c2)O)O 1458a_100000210462_200010393615 [0,2,0,0,0,0|1,0,0]=3 10148 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Br)Br 11a_100012351559_100000210462 [0,2,0,0,0,0|1,0,0]=3 10149 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Br)Br 1626a_100012351559_100000210462 [0,2,0,0,0,0|1,0,0]=3 10150 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Br)Cl 11a_100012349490_100000210462 [0,2,0,0,0,0|1,0,0]=3 10151 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Br)Cl 1626a_100012349490_100000210462 [0,2,0,0,0,0|1,0,0]=3 10152 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Br)F 11a_100015193890_100000210462 [0,2,0,0,0,0|1,0,0]=3 10153 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Br)F 1626a_100015193890_100000210462 [0,2,0,0,0,0|1,0,0]=3 10154 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Cl)Br 11a_100012362553_100000210462 [0,2,0,0,0,0|1,0,0]=3 10155 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Cl)Br 1626a_100012362553_100000210462 [0,2,0,0,0,0|1,0,0]=3 10156 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Cl)Cl 11a_100000174881_100000210462 [0,2,0,0,0,0|1,0,0]=3 10157 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Cl)Cl 1626a_100000174881_100000210462 [0,2,0,0,0,0|1,0,0]=3 10158 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Cl)F 11a_100000749334_100000210462 [0,2,0,0,0,0|1,0,0]=3 10159 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)Cl)F 1626a_100000749334_100000210462 [0,2,0,0,0,0|1,0,0]=3 10160 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)F)Br 11a_100000755036_100000210462 [0,2,0,0,0,0|1,0,0]=3 10161 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)F)Br 1626a_100000755036_100000210462 [0,2,0,0,0,0|1,0,0]=3 10162 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)F)Cl 11a_100011219866_100000210462 [0,2,0,0,0,0|1,0,0]=3 10163 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)F)Cl 1626a_100011219866_100000210462 [0,2,0,0,0,0|1,0,0]=3 10164 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)F)F 11a_100000737897_100000210462 [0,2,0,0,0,0|1,0,0]=3 10165 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(c2)F)F 1626a_100000737897_100000210462 [0,2,0,0,0,0|1,0,0]=3 10166 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(n2)Cl)Cl 11a_100009887527_100000210462 [0,2,0,0,0,0|2,0,0]=4 10167 B21R2.19361 O=C(C=Cc1ccccc1)NCc2ccc(c(n2)Cl)Cl 1626a_100009887527_100000210462 [0,2,0,0,0,0|2,0,0]=4 10168 B21R2.19361 O=C(C=Cc1ccccc1)NNc2ccc(c(c2)Br)F 22a_200025705588_100000210462 [0,2,0,0,0,0|2,0,0]=4 10169 B21R2.19361 O=C(C=Cc1ccccc1)NNc2ccc(c(c2)Cl)Br 22a_100102421838_100000210462 [0,2,0,0,0,0|2,0,0]=4 10170 B21R2.19361 O=C(C=Cc1ccccc1)NNc2ccc(c(c2)Cl)Cl 22a_100000106602_100000210462 [0,2,0,0,0,0|2,0,0]=4 10171 B21R2.19361 O=C(C=Cc1ccccc1)NNc2ccc(c(c2)Cl)F 22a_100000007618_100000210462 [0,2,0,0,0,0|2,0,0]=4 10172 B21R2.19361 O=C(C=Cc1ccccc1)NNc2ccc(c(c2)F)Br 22a_100016992936_100000210462 [0,2,0,0,0,0|2,0,0]=4 10173 B21R2.19361 O=C(C=Cc1ccccc1)NNc2ccc(c(c2)F)F 22a_100015184291_100000210462 [0,2,0,0,0,0|2,0,0]=4 10174 B21R2.19361 O=C(C=Cc1ccccn1)CCc2ccc(c(c2)Cl)Cl 1458a_100000740811_100011713676 [0,2,0,0,0,0|2,0,0]=4 10175 B21R2.19361 O=C(C=Cc1ccccn1)CCc2ccc(c(c2)Cl)F 1458a_100000740811_100012361305 [0,2,0,0,0,0|2,0,0]=4 10176 B21R2.19361 O=C(C=Cc1ccccn1)CCc2ccc(c(c2)F)F 1458a_100000740811_100000690553 [0,2,0,0,0,0|2,0,0]=4 10177 B21R2.19361 O=C(C=Cc1ccccn1)CCc2ccc(c(c2)O)O 1458a_100000740811_200010393615 [0,2,0,0,0,0|2,0,0]=4 10178 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Br)Br 11a_100012351559_100000740811 [0,2,0,0,0,0|2,0,0]=4 10179 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Br)Br 240690a_100012351559_100000740811 [0,2,0,0,0,0|2,0,0]=4 10180 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Br)Cl 11a_100012349490_100000740811 [0,2,0,0,0,0|2,0,0]=4 10181 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Br)Cl 240690a_100012349490_100000740811 [0,2,0,0,0,0|2,0,0]=4 10182 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Br)F 11a_100015193890_100000740811 [0,2,0,0,0,0|2,0,0]=4 10183 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Br)F 240690a_100015193890_100000740811 [0,2,0,0,0,0|2,0,0]=4 10184 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Cl)Br 11a_100012362553_100000740811 [0,2,0,0,0,0|2,0,0]=4 10185 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Cl)Br 240690a_100012362553_100000740811 [0,2,0,0,0,0|2,0,0]=4 10186 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Cl)Cl 11a_100000174881_100000740811 [0,2,0,0,0,0|2,0,0]=4 10187 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Cl)Cl 240690a_100000174881_100000740811 [0,2,0,0,0,0|2,0,0]=4 10188 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Cl)F 11a_100000749334_100000740811 [0,2,0,0,0,0|2,0,0]=4 10189 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)Cl)F 240690a_100000749334_100000740811 [0,2,0,0,0,0|2,0,0]=4 10190 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)F)Br 11a_100000755036_100000740811 [0,2,0,0,0,0|2,0,0]=4 10191 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)F)Br 240690a_100000755036_100000740811 [0,2,0,0,0,0|2,0,0]=4 10192 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)F)Cl 11a_100011219866_100000740811 [0,2,0,0,0,0|2,0,0]=4 10193 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)F)Cl 240690a_100011219866_100000740811 [0,2,0,0,0,0|2,0,0]=4 10194 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)F)F 11a_100000737897_100000740811 [0,2,0,0,0,0|2,0,0]=4 10195 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)F)F 240690a_100000737897_100000740811 [0,2,0,0,0,0|2,0,0]=4 10196 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)F)O 240690a_100000758358_100000740811 [0,2,0,0,0,0|2,0,0]=4 10197 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)O)Cl 240690a_100020636435_100000740811 [0,2,0,0,0,0|2,0,0]=4 10198 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)O)F 240690a_100160469508_100000740811 [0,2,0,0,0,0|2,0,0]=4 10199 B21R2.19361 O=C(C=Cc1ccccn1)NCc2ccc(c(c2)O)O 240690a_100000010075_100000740811 [0,2,0,0,0,0|2,0,0]=4 10200 B21R2.19361 O=C(C=Cc1cccnc1)CCc2ccc(c(c2)Cl)Cl 1458a_100000735890_100011713676 [0,2,0,0,0,0|2,0,0]=4 10201 B21R2.19361 O=C(C=Cc1cccnc1)CCc2ccc(c(c2)Cl)F 1458a_100000735890_100012361305 [0,2,0,0,0,0|2,0,0]=4 10202 B21R2.19361 O=C(C=Cc1cccnc1)CCc2ccc(c(c2)F)F 1458a_100000735890_100000690553 [0,2,0,0,0,0|2,0,0]=4 10203 B21R2.19361 O=C(C=Cc1cccnc1)CCc2ccc(c(c2)O)O 1458a_100000735890_200010393615 [0,2,0,0,0,0|2,0,0]=4 10204 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Br)Br 11a_100012351559_100000735890 [0,2,0,0,0,0|2,0,0]=4 10205 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Br)Br 240690a_100012351559_100000735890 [0,2,0,0,0,0|2,0,0]=4 10206 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Br)Cl 11a_100012349490_100000735890 [0,2,0,0,0,0|2,0,0]=4 10207 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Br)Cl 240690a_100012349490_100000735890 [0,2,0,0,0,0|2,0,0]=4 10208 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Br)F 11a_100015193890_100000735890 [0,2,0,0,0,0|2,0,0]=4 10209 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Br)F 240690a_100015193890_100000735890 [0,2,0,0,0,0|2,0,0]=4 10210 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Cl)Br 11a_100012362553_100000735890 [0,2,0,0,0,0|2,0,0]=4 10211 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Cl)Br 240690a_100012362553_100000735890 [0,2,0,0,0,0|2,0,0]=4 10212 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Cl)Cl 11a_100000174881_100000735890 [0,2,0,0,0,0|2,0,0]=4 10213 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Cl)Cl 240690a_100000174881_100000735890 [0,2,0,0,0,0|2,0,0]=4 10214 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Cl)F 11a_100000749334_100000735890 [0,2,0,0,0,0|2,0,0]=4 10215 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)Cl)F 240690a_100000749334_100000735890 [0,2,0,0,0,0|2,0,0]=4 10216 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)F)Br 11a_100000755036_100000735890 [0,2,0,0,0,0|2,0,0]=4 10217 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)F)Br 240690a_100000755036_100000735890 [0,2,0,0,0,0|2,0,0]=4 10218 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)F)Cl 11a_100011219866_100000735890 [0,2,0,0,0,0|2,0,0]=4 10219 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)F)Cl 240690a_100011219866_100000735890 [0,2,0,0,0,0|2,0,0]=4 10220 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)F)F 11a_100000737897_100000735890 [0,2,0,0,0,0|2,0,0]=4 10221 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)F)F 240690a_100000737897_100000735890 [0,2,0,0,0,0|2,0,0]=4 10222 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)F)O 240690a_100000758358_100000735890 [0,2,0,0,0,0|2,0,0]=4 10223 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)O)Cl 240690a_100020636435_100000735890 [0,2,0,0,0,0|2,0,0]=4 10224 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)O)F 240690a_100160469508_100000735890 [0,2,0,0,0,0|2,0,0]=4 10225 B21R2.19361 O=C(C=Cc1cccnc1)NCc2ccc(c(c2)O)O 240690a_100000010075_100000735890 [0,2,0,0,0,0|2,0,0]=4 10226 B21R2.19361 O=C(C=Cc1ccncc1)CCc2ccc(c(c2)Cl)Cl 1458a_100000682801_100011713676 [0,2,0,0,0,0|2,0,0]=4 10227 B21R2.19361 O=C(C=Cc1ccncc1)CCc2ccc(c(c2)Cl)F 1458a_100000682801_100012361305 [0,2,0,0,0,0|2,0,0]=4 10228 B21R2.19361 O=C(C=Cc1ccncc1)CCc2ccc(c(c2)F)F 1458a_100000682801_100000690553 [0,2,0,0,0,0|2,0,0]=4 10229 B21R2.19361 O=C(C=Cc1ccncc1)CCc2ccc(c(c2)O)O 1458a_100000682801_200010393615 [0,2,0,0,0,0|2,0,0]=4 10230 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)Br)Br 240690a_100012351559_100000682801 [0,2,0,0,0,0|2,0,0]=4 10231 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)Br)Cl 240690a_100012349490_100000682801 [0,2,0,0,0,0|2,0,0]=4 10232 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)Br)F 240690a_100015193890_100000682801 [0,2,0,0,0,0|2,0,0]=4 10233 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)Cl)Br 240690a_100012362553_100000682801 [0,2,0,0,0,0|2,0,0]=4 10234 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)Cl)Cl 240690a_100000174881_100000682801 [0,2,0,0,0,0|2,0,0]=4 10235 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)Cl)F 240690a_100000749334_100000682801 [0,2,0,0,0,0|2,0,0]=4 10236 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)F)Br 240690a_100000755036_100000682801 [0,2,0,0,0,0|2,0,0]=4 10237 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)F)Cl 240690a_100011219866_100000682801 [0,2,0,0,0,0|2,0,0]=4 10238 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)F)F 240690a_100000737897_100000682801 [0,2,0,0,0,0|2,0,0]=4 10239 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)F)O 240690a_100000758358_100000682801 [0,2,0,0,0,0|2,0,0]=4 10240 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)O)Cl 240690a_100020636435_100000682801 [0,2,0,0,0,0|2,0,0]=4 10241 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)O)F 240690a_100160469508_100000682801 [0,2,0,0,0,0|2,0,0]=4 10242 B21R2.19361 O=C(C=Cc1ccncc1)NCc2ccc(c(c2)O)O 240690a_100000010075_100000682801 [0,2,0,0,0,0|2,0,0]=4 10243 B21R2.19361 O=C(CNc1ccc(c(c1)Br)Br)OCc2ccccc2 2230a_100011306057_100000753625 [0,2,0,0,0,0|1,0,1]=4 10244 B21R2.19361 O=C(CNc1ccc(c(c1)Br)Br)OCc2ccccc2 34a_100011306057_100000753625 [0,2,0,0,0,0|1,0,1]=4 10245 B21R2.19361 O=C(CNc1ccc(c(c1)Br)Br)OCc2ccccc2 7a_100011306057_100000753625 [0,2,0,0,0,0|1,0,1]=4 10246 B21R2.19361 O=C(CNc1ccc(c(c1)Br)Cl)OCc2ccccc2 2230a_100000686031_100000753625 [0,2,0,0,0,0|1,0,1]=4 10247 B21R2.19361 O=C(CNc1ccc(c(c1)Br)Cl)OCc2ccccc2 34a_100000686031_100000753625 [0,2,0,0,0,0|1,0,1]=4 10248 B21R2.19361 O=C(CNc1ccc(c(c1)Br)F)OCc2ccccc2 2230a_100000760356_100000753625 [0,2,0,0,0,0|1,0,1]=4 10249 B21R2.19361 O=C(CNc1ccc(c(c1)Br)F)OCc2ccccc2 34a_100000760356_100000753625 [0,2,0,0,0,0|1,0,1]=4 10250 B21R2.19361 O=C(CNc1ccc(c(c1)Br)F)OCc2ccccc2 7a_100000760356_100000753625 [0,2,0,0,0,0|1,0,1]=4 10251 B21R2.19361 O=C(CNc1ccc(c(c1)Br)I)OCc2ccccc2 34a_100000750458_100000753625 [0,2,0,0,0,0|1,0,1]=4 10252 B21R2.19361 O=C(CNc1ccc(c(c1)Br)O)OCc2ccccc2 34a_100011534360_100000753625 [0,2,0,0,0,0|1,0,1]=4 10253 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)Br)OCc2ccccc2 2230a_100000687081_100000753625 [0,2,0,0,0,0|1,0,1]=4 10254 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)Br)OCc2ccccc2 34a_100000687081_100000753625 [0,2,0,0,0,0|1,0,1]=4 10255 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)Br)OCc2ccccc2 7a_100000687081_100000753625 [0,2,0,0,0,0|1,0,1]=4 10256 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)Cl)OCc2ccccc2 2230a_100000184108_100000753625 [0,2,0,0,0,0|1,0,1]=4 10257 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)Cl)OCc2ccccc2 34a_100000184108_100000753625 [0,2,0,0,0,0|1,0,1]=4 10258 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)F)OCc2ccccc2 2230a_100000211060_100000753625 [0,2,0,0,0,0|1,0,1]=4 10259 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)F)OCc2ccccc2 34a_100000211060_100000753625 [0,2,0,0,0,0|1,0,1]=4 10260 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)F)OCc2ccccc2 7a_100000211060_100000753625 [0,2,0,0,0,0|1,0,1]=4 10261 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)I)OCc2ccccc2 34a_100000761885_100000753625 [0,2,0,0,0,0|1,0,1]=4 10262 B21R2.19361 O=C(CNc1ccc(c(c1)Cl)O)OCc2ccccc2 34a_100000744943_100000753625 [0,2,0,0,0,0|1,0,1]=4 10263 B21R2.19361 O=C(CNc1ccc(c(c1)F)Br)OCc2ccccc2 2230a_100000759894_100000753625 [0,2,0,0,0,0|1,0,1]=4 10264 B21R2.19361 O=C(CNc1ccc(c(c1)F)Br)OCc2ccccc2 34a_100000759894_100000753625 [0,2,0,0,0,0|1,0,1]=4 10265 B21R2.19361 O=C(CNc1ccc(c(c1)F)Br)OCc2ccccc2 7a_100000759894_100000753625 [0,2,0,0,0,0|1,0,1]=4 10266 B21R2.19361 O=C(CNc1ccc(c(c1)F)Cl)OCc2ccccc2 2230a_100000739366_100000753625 [0,2,0,0,0,0|1,0,1]=4 10267 B21R2.19361 O=C(CNc1ccc(c(c1)F)Cl)OCc2ccccc2 34a_100000739366_100000753625 [0,2,0,0,0,0|1,0,1]=4 10268 B21R2.19361 O=C(CNc1ccc(c(c1)F)Cl)OCc2ccccc2 7a_100000739366_100000753625 [0,2,0,0,0,0|1,0,1]=4 10269 B21R2.19361 O=C(CNc1ccc(c(c1)F)F)OCc2ccccc2 2230a_100000210724_100000753625 [0,2,0,0,0,0|1,0,1]=4 10270 B21R2.19361 O=C(CNc1ccc(c(c1)F)F)OCc2ccccc2 34a_100000210724_100000753625 [0,2,0,0,0,0|1,0,1]=4 10271 B21R2.19361 O=C(CNc1ccc(c(c1)F)F)OCc2ccccc2 7a_100000210724_100000753625 [0,2,0,0,0,0|1,0,1]=4 10272 B21R2.19361 O=C(CNc1ccc(c(c1)F)I)OCc2ccccc2 34a_100011356925_100000753625 [0,2,0,0,0,0|1,0,1]=4 10273 B21R2.19361 O=C(CNc1ccc(c(c1)F)I)OCc2ccccc2 7a_100011356925_100000753625 [0,2,0,0,0,0|1,0,1]=4 10274 B21R2.19361 O=C(CNc1ccc(c(c1)F)O)OCc2ccccc2 34a_100011220035_100000753625 [0,2,0,0,0,0|1,0,1]=4 10275 B21R2.19361 O=C(CNc1ccc(c(c1)F)O)OCc2ccccc2 7a_100011220035_100000753625 [0,2,0,0,0,0|1,0,1]=4 10276 B21R2.19361 O=C(CNc1ccc(c(c1)I)Br)OCc2ccccc2 34a_100000750459_100000753625 [0,2,0,0,0,0|1,0,1]=4 10277 B21R2.19361 O=C(CNc1ccc(c(c1)I)Cl)OCc2ccccc2 34a_100012360549_100000753625 [0,2,0,0,0,0|1,0,1]=4 10278 B21R2.19361 O=C(CNc1ccc(c(c1)I)F)OCc2ccccc2 34a_114828291077_100000753625 [0,2,0,0,0,0|1,0,1]=4 10279 B21R2.19361 O=C(CNc1ccc(c(c1)I)F)OCc2ccccc2 7a_114828291077_100000753625 [0,2,0,0,0,0|1,0,1]=4 10280 B21R2.19361 O=C(CNc1ccc(c(c1)O)Cl)OCc2ccccc2 34a_100011934209_100000753625 [0,2,0,0,0,0|1,0,1]=4 10281 B21R2.19361 O=C(CNc1ccc(c(c1)O)F)OCc2ccccc2 34a_100012017398_100000753625 [0,2,0,0,0,0|1,0,1]=4 10282 B21R2.19361 O=C(CNc1ccc(c(c1)O)F)OCc2ccccc2 7a_100012017398_100000753625 [0,2,0,0,0,0|1,0,1]=4 10283 B21R2.19361 O=C(CNc1ccc(c(c1)O)O)OCc2ccccc2 34a_100102946323_100000753625 [0,2,0,0,0,0|1,0,1]=4 10284 B21R2.19361 O=C(COc1ccc(c(c1)Br)Cl)OCc2ccccc2 34a_100011933957_100000753625 [0,2,0,0,0,0|1,0,1]=4 10285 B21R2.19361 O=C(COc1ccc(c(c1)Br)Cl)OCc2ccccc2 7a_100011933957_100000753625 [0,2,0,0,0,0|1,0,1]=4 10286 B21R2.19361 O=C(COc1ccc(c(c1)Br)F)OCc2ccccc2 34a_100000693481_100000753625 [0,2,0,0,0,0|1,0,1]=4 10287 B21R2.19361 O=C(COc1ccc(c(c1)Br)F)OCc2ccccc2 7a_100000693481_100000753625 [0,2,0,0,0,0|1,0,1]=4 10288 B21R2.19361 O=C(COc1ccc(c(c1)Br)I)OCc2ccccc2 34a_100000701344_100000753625 [0,2,0,0,0,0|1,0,1]=4 10289 B21R2.19361 O=C(COc1ccc(c(c1)Br)I)OCc2ccccc2 7a_100000701344_100000753625 [0,2,0,0,0,0|1,0,1]=4 10290 B21R2.19361 O=C(COc1ccc(c(c1)Cl)Br)OCc2ccccc2 34a_100011215161_100000753625 [0,2,0,0,0,0|1,0,1]=4 10291 B21R2.19361 O=C(COc1ccc(c(c1)Cl)Br)OCc2ccccc2 7a_100011215161_100000753625 [0,2,0,0,0,0|1,0,1]=4 10292 B21R2.19361 O=C(COc1ccc(c(c1)Cl)Cl)OCc2ccccc2 34a_100000211054_100000753625 [0,2,0,0,0,0|1,0,1]=4 10293 B21R2.19361 O=C(COc1ccc(c(c1)Cl)Cl)OCc2ccccc2 7a_100000211054_100000753625 [0,2,0,0,0,0|1,0,1]=4 10294 B21R2.19361 O=C(COc1ccc(c(c1)Cl)F)OCc2ccccc2 34a_100000211030_100000753625 [0,2,0,0,0,0|1,0,1]=4 10295 B21R2.19361 O=C(COc1ccc(c(c1)Cl)F)OCc2ccccc2 7a_100000211030_100000753625 [0,2,0,0,0,0|1,0,1]=4 10296 B21R2.19361 O=C(COc1ccc(c(c1)Cl)I)OCc2ccccc2 34a_100000047559_100000753625 [0,2,0,0,0,0|1,0,1]=4 10297 B21R2.19361 O=C(COc1ccc(c(c1)Cl)I)OCc2ccccc2 7a_100000047559_100000753625 [0,2,0,0,0,0|1,0,1]=4 10298 B21R2.19361 O=C(COc1ccc(c(c1)F)Br)OCc2ccccc2 34a_100000755031_100000753625 [0,2,0,0,0,0|1,0,1]=4 10299 B21R2.19361 O=C(COc1ccc(c(c1)F)Br)OCc2ccccc2 7a_100000755031_100000753625 [0,2,0,0,0,0|1,0,1]=4 10300 B21R2.19361 O=C(COc1ccc(c(c1)F)Cl)OCc2ccccc2 34a_100000691581_100000753625 [0,2,0,0,0,0|1,0,1]=4 10301 B21R2.19361 O=C(COc1ccc(c(c1)F)Cl)OCc2ccccc2 7a_100000691581_100000753625 [0,2,0,0,0,0|1,0,1]=4 10302 B21R2.19361 O=C(COc1ccc(c(c1)F)F)OCc2ccccc2 34a_100000181275_100000753625 [0,2,0,0,0,0|1,0,1]=4 10303 B21R2.19361 O=C(COc1ccc(c(c1)F)F)OCc2ccccc2 7a_100000181275_100000753625 [0,2,0,0,0,0|1,0,1]=4 10304 B21R2.19361 O=C(COc1ccc(c(c1)F)I)OCc2ccccc2 34a_100009990212_100000753625 [0,2,0,0,0,0|1,0,1]=4 10305 B21R2.19361 O=C(COc1ccc(c(c1)F)I)OCc2ccccc2 7a_100009990212_100000753625 [0,2,0,0,0,0|1,0,1]=4 10306 B21R2.19361 O=C(COc1ccc(c(c1)I)Br)OCc2ccccc2 34a_100012339312_100000753625 [0,2,0,0,0,0|1,0,1]=4 10307 B21R2.19361 O=C(COc1ccc(c(c1)I)Br)OCc2ccccc2 7a_100012339312_100000753625 [0,2,0,0,0,0|1,0,1]=4 10308 B21R2.19361 O=C(COc1ccc(c(c1)I)Cl)OCc2ccccc2 34a_100000049588_100000753625 [0,2,0,0,0,0|1,0,1]=4 10309 B21R2.19361 O=C(COc1ccc(c(c1)I)Cl)OCc2ccccc2 7a_100000049588_100000753625 [0,2,0,0,0,0|1,0,1]=4 10310 B21R2.19361 O=C(CSc1ccc(c(c1)Br)Br)OCc2ccccc2 62a_100000753625_100012356285 [0,2,0,0,0,0|1,0,1]=4 10311 B21R2.19361 O=C(CSc1ccc(c(c1)Br)Br)OCc2ccccc2 62a_100012356285_100000753625 [0,2,0,0,0,0|1,0,1]=4 10312 B21R2.19361 O=C(CSc1ccc(c(c1)Br)Cl)OCc2ccccc2 62a_100000753625_100012353702 [0,2,0,0,0,0|1,0,1]=4 10313 B21R2.19361 O=C(CSc1ccc(c(c1)Br)Cl)OCc2ccccc2 62a_100012353702_100000753625 [0,2,0,0,0,0|1,0,1]=4 10314 B21R2.19361 O=C(CSc1ccc(c(c1)Br)F)OCc2ccccc2 62a_100000753625_100012047266 [0,2,0,0,0,0|1,0,1]=4 10315 B21R2.19361 O=C(CSc1ccc(c(c1)Br)F)OCc2ccccc2 62a_100012047266_100000753625 [0,2,0,0,0,0|1,0,1]=4 10316 B21R2.19361 O=C(CSc1ccc(c(c1)Br)O)OCc2ccccc2 62a_100000753625_100012361655 [0,2,0,0,0,0|1,0,1]=4 10317 B21R2.19361 O=C(CSc1ccc(c(c1)Br)O)OCc2ccccc2 62a_100012361655_100000753625 [0,2,0,0,0,0|1,0,1]=4 10318 B21R2.19361 O=C(CSc1ccc(c(c1)Cl)Br)OCc2ccccc2 62a_100000753625_100012047281 [0,2,0,0,0,0|1,0,1]=4 10319 B21R2.19361 O=C(CSc1ccc(c(c1)Cl)Br)OCc2ccccc2 62a_100012047281_100000753625 [0,2,0,0,0,0|1,0,1]=4 10320 B21R2.19361 O=C(CSc1ccc(c(c1)Cl)Cl)OCc2ccccc2 62a_100000753625_100011214914 [0,2,0,0,0,0|1,0,1]=4 10321 B21R2.19361 O=C(CSc1ccc(c(c1)Cl)Cl)OCc2ccccc2 62a_100011214914_100000753625 [0,2,0,0,0,0|1,0,1]=4 10322 B21R2.19361 O=C(CSc1ccc(c(c1)Cl)F)OCc2ccccc2 62a_100000753625_100011215976 [0,2,0,0,0,0|1,0,1]=4 10323 B21R2.19361 O=C(CSc1ccc(c(c1)Cl)F)OCc2ccccc2 62a_100011215976_100000753625 [0,2,0,0,0,0|1,0,1]=4 10324 B21R2.19361 O=C(CSc1ccc(c(c1)Cl)O)OCc2ccccc2 62a_100000753625_100012360047 [0,2,0,0,0,0|1,0,1]=4 10325 B21R2.19361 O=C(CSc1ccc(c(c1)Cl)O)OCc2ccccc2 62a_100012360047_100000753625 [0,2,0,0,0,0|1,0,1]=4 10326 B21R2.19361 O=C(CSc1ccc(c(c1)F)Br)OCc2ccccc2 62a_100000685389_100000753625 [0,2,0,0,0,0|1,0,1]=4 10327 B21R2.19361 O=C(CSc1ccc(c(c1)F)Br)OCc2ccccc2 62a_100000753625_100000685389 [0,2,0,0,0,0|1,0,1]=4 10328 B21R2.19361 O=C(CSc1ccc(c(c1)F)Cl)OCc2ccccc2 62a_100000753625_100011216805 [0,2,0,0,0,0|1,0,1]=4 10329 B21R2.19361 O=C(CSc1ccc(c(c1)F)Cl)OCc2ccccc2 62a_100011216805_100000753625 [0,2,0,0,0,0|1,0,1]=4 10330 B21R2.19361 O=C(CSc1ccc(c(c1)F)F)OCc2ccccc2 62a_100000703953_100000753625 [0,2,0,0,0,0|1,0,1]=4 10331 B21R2.19361 O=C(CSc1ccc(c(c1)F)F)OCc2ccccc2 62a_100000753625_100000703953 [0,2,0,0,0,0|1,0,1]=4 10332 B21R2.19361 O=C(CSc1ccc(c(c1)F)O)OCc2ccccc2 62a_100000185481_100000753625 [0,2,0,0,0,0|1,0,1]=4 10333 B21R2.19361 O=C(CSc1ccc(c(c1)F)O)OCc2ccccc2 62a_100000753625_100000185481 [0,2,0,0,0,0|1,0,1]=4 10334 B21R2.19361 O=C(CSc1ccc(c(c1)O)Br)OCc2ccccc2 62a_100000753625_100012356990 [0,2,0,0,0,0|1,0,1]=4 10335 B21R2.19361 O=C(CSc1ccc(c(c1)O)Br)OCc2ccccc2 62a_100012356990_100000753625 [0,2,0,0,0,0|1,0,1]=4 10336 B21R2.19361 O=C(CSc1ccc(c(c1)O)Cl)OCc2ccccc2 62a_100000753625_100011356854 [0,2,0,0,0,0|1,0,1]=4 10337 B21R2.19361 O=C(CSc1ccc(c(c1)O)Cl)OCc2ccccc2 62a_100011356854_100000753625 [0,2,0,0,0,0|1,0,1]=4 10338 B21R2.19361 O=C(CSc1ccc(c(c1)O)F)OCc2ccccc2 62a_100000686035_100000753625 [0,2,0,0,0,0|1,0,1]=4 10339 B21R2.19361 O=C(CSc1ccc(c(c1)O)F)OCc2ccccc2 62a_100000753625_100000686035 [0,2,0,0,0,0|1,0,1]=4 10340 B21R2.19361 O=C(CSc1ccc(c(c1)O)O)OCc2ccccc2 62a_100000753625_100009813601 [0,2,0,0,0,0|1,0,1]=4 10341 B21R2.225945 Cc1cc(ccc1C=CC(=O)NCc2ccccc2)F 11a_100015324214_100016280397 [0,2,0,0,0,0|1,0,0]=3 10342 B21R2.225945 Cc1cc(ccc1C=CC(=O)NCc2ccccc2)F 1626a_100015324214_100016280397 [0,2,0,0,0,0|1,0,0]=3 10343 B21R2.225945 Cc1cc(ccc1C=CC(=O)NCc2ccccn2)F 11a_100000210449_100016280397 [0,2,0,0,0,0|2,0,0]=4 10344 B21R2.225945 Cc1cc(ccc1C=CC(=O)NCc2ccccn2)F 1626a_100000210449_100016280397 [0,2,0,0,0,0|2,0,0]=4 10345 B21R2.225945 Cc1cc(ccc1C=CC(=O)NCc2cccnc2)F 11a_100000210453_100016280397 [0,2,0,0,0,0|2,0,0]=4 10346 B21R2.225945 Cc1cc(ccc1C=CC(=O)NCc2ccncc2)F 11a_100000210450_100016280397 [0,2,0,0,0,0|2,0,0]=4 10347 B21R2.225945 Cc1cc(ccc1C=CC(=O)NCc2ccncc2)F 1626a_100000210450_100016280397 [0,2,0,0,0,0|2,0,0]=4 10348 B21R2.225945 Cc1cc(ccc1C=CC(=O)NNc2ccccc2)F 22a_100015195140_100016280397 [0,2,0,0,0,0|2,0,0]=4 10349 B21R2.225945 Cc1cc(ccc1C=CC(=O)NNc2ccccc2)O 22a_100015195140_200132309679 [0,2,0,0,0,0|2,0,0]=4 10350 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccc2)Br 11a_100000753881_100000210462 [0,2,0,0,0,0|1,0,0]=3 10351 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccc2)Br 1626a_100000753881_100000210462 [0,2,0,0,0,0|1,0,0]=3 10352 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccc2)Cl 11a_103436540063_100000210462 [0,2,0,0,0,0|1,0,0]=3 10353 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccc2)Cl 1626a_103436540063_100000210462 [0,2,0,0,0,0|1,0,0]=3 10354 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccc2)F 11a_100137329023_100000210462 [0,2,0,0,0,0|1,0,0]=3 10355 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccc2)F 1626a_100137329023_100000210462 [0,2,0,0,0,0|1,0,0]=3 10356 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccn2)Br 11a_100000753881_100000740811 [0,2,0,0,0,0|2,0,0]=4 10357 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccn2)Br 240690a_100000753881_100000740811 [0,2,0,0,0,0|2,0,0]=4 10358 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccn2)Cl 11a_103436540063_100000740811 [0,2,0,0,0,0|2,0,0]=4 10359 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccn2)Cl 240690a_103436540063_100000740811 [0,2,0,0,0,0|2,0,0]=4 10360 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccn2)F 11a_100137329023_100000740811 [0,2,0,0,0,0|2,0,0]=4 10361 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccccn2)F 240690a_100137329023_100000740811 [0,2,0,0,0,0|2,0,0]=4 10362 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2cccnc2)Br 11a_100000753881_100000735890 [0,2,0,0,0,0|2,0,0]=4 10363 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2cccnc2)Br 240690a_100000753881_100000735890 [0,2,0,0,0,0|2,0,0]=4 10364 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2cccnc2)Cl 11a_103436540063_100000735890 [0,2,0,0,0,0|2,0,0]=4 10365 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2cccnc2)Cl 240690a_103436540063_100000735890 [0,2,0,0,0,0|2,0,0]=4 10366 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2cccnc2)F 11a_100137329023_100000735890 [0,2,0,0,0,0|2,0,0]=4 10367 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2cccnc2)F 240690a_100137329023_100000735890 [0,2,0,0,0,0|2,0,0]=4 10368 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccncc2)Br 240690a_100000753881_100000682801 [0,2,0,0,0,0|2,0,0]=4 10369 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccncc2)Cl 240690a_103436540063_100000682801 [0,2,0,0,0,0|2,0,0]=4 10370 B21R2.225945 Cc1cc(ccc1CNC(=O)C=Cc2ccncc2)F 240690a_100137329023_100000682801 [0,2,0,0,0,0|2,0,0]=4 10371 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)Br 34a_100000211769_100000753625 [0,2,0,0,0,0|1,0,1]=4 10372 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)Br 7a_100000211769_100000753625 [0,2,0,0,0,0|1,0,1]=4 10373 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)Cl 34a_100000210418_100000753625 [0,2,0,0,0,0|1,0,1]=4 10374 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)Cl 7a_100000210418_100000753625 [0,2,0,0,0,0|1,0,1]=4 10375 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)F 34a_100000211637_100000753625 [0,2,0,0,0,0|1,0,1]=4 10376 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)F 7a_100000211637_100000753625 [0,2,0,0,0,0|1,0,1]=4 10377 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)I 34a_100000184554_100000753625 [0,2,0,0,0,0|1,0,1]=4 10378 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)I 7a_100000184554_100000753625 [0,2,0,0,0,0|1,0,1]=4 10379 B21R2.225945 Cc1cc(ccc1NCC(=O)OCc2ccccc2)O 34a_100000756630_100000753625 [0,2,0,0,0,0|1,0,1]=4 10380 B21R2.225945 Cc1cc(ccc1NNC(=O)C=Cc2ccccc2)Br 22a_100000751375_100000210462 [0,2,0,0,0,0|2,0,0]=4 10381 B21R2.225945 Cc1cc(ccc1NNC(=O)C=Cc2ccccc2)Cl 22a_100011215965_100000210462 [0,2,0,0,0,0|2,0,0]=4 10382 B21R2.225945 Cc1cc(ccc1NNC(=O)C=Cc2ccccc2)F 22a_100000741282_100000210462 [0,2,0,0,0,0|2,0,0]=4 10383 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)Br 34a_100000186361_100000753625 [0,2,0,0,0,0|1,0,1]=4 10384 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)Br 7a_100000186361_100000753625 [0,2,0,0,0,0|1,0,1]=4 10385 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)Cl 34a_100000211091_100000753625 [0,2,0,0,0,0|1,0,1]=4 10386 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)Cl 7a_100000211091_100000753625 [0,2,0,0,0,0|1,0,1]=4 10387 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)F 34a_100000764316_100000753625 [0,2,0,0,0,0|1,0,1]=4 10388 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)F 7a_100000764316_100000753625 [0,2,0,0,0,0|1,0,1]=4 10389 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)I 34a_100011218673_100000753625 [0,2,0,0,0,0|1,0,1]=4 10390 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)I 7a_100011218673_100000753625 [0,2,0,0,0,0|1,0,1]=4 10391 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)N 34a_100011218179_100000753625 [0,2,0,0,0,0|1,0,1]=4 10392 B21R2.225945 Cc1cc(ccc1OCC(=O)OCc2ccccc2)N 7a_100011218179_100000753625 [0,2,0,0,0,0|1,0,1]=4 10393 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)Br 62a_100000701812_100000753625 [0,2,0,0,0,0|1,0,1]=4 10394 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)Br 62a_100000753625_100000701812 [0,2,0,0,0,0|1,0,1]=4 10395 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100011219607 [0,2,0,0,0,0|1,0,1]=4 10396 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)Cl 62a_100011219607_100000753625 [0,2,0,0,0,0|1,0,1]=4 10397 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)F 62a_100000753625_100011205405 [0,2,0,0,0,0|1,0,1]=4 10398 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)F 62a_100011205405_100000753625 [0,2,0,0,0,0|1,0,1]=4 10399 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)N 62a_100000210723_100000753625 [0,2,0,0,0,0|1,0,1]=4 10400 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)N 62a_100000753625_100000210723 [0,2,0,0,0,0|1,0,1]=4 10401 B21R2.225945 Cc1cc(ccc1SCC(=O)OCc2ccccc2)O 62a_100000753625_100000690111 [0,2,0,0,0,0|1,0,1]=4 10402 B21R2.225945 Cc1cc(cnc1C=CC(=O)CCc2ccccc2)Br 6a_100010185443_100000210092 [0,2,0,0,0,0|2,0,0]=4 10403 B21R2.225945 Cc1cc(cnc1C=CC(=O)CCc2ccccc2)Cl 6a_200009887756_100000210092 [0,2,0,0,0,0|2,0,0]=4 10404 B21R2.225945 Cc1ccc(c(c1)Br)NCC(=O)OCc2ccccc2 34a_100000210942_100000753625 [0,2,0,0,0,0|1,0,1]=4 10405 B21R2.225945 Cc1ccc(c(c1)Br)NNC(=O)C=Cc2ccccc2 22a_100016996181_100000210462 [0,2,0,0,0,0|2,0,0]=4 10406 B21R2.225945 Cc1ccc(c(c1)Br)OCC(=O)OCc2ccccc2 34a_100000210800_100000753625 [0,2,0,0,0,0|1,0,1]=4 10407 B21R2.225945 Cc1ccc(c(c1)Br)OCC(=O)OCc2ccccc2 7a_100000210800_100000753625 [0,2,0,0,0,0|1,0,1]=4 10408 B21R2.225945 Cc1ccc(c(c1)Br)SCC(=O)OCc2ccccc2 62a_100000753625_100009813563 [0,2,0,0,0,0|1,0,1]=4 10409 B21R2.225945 Cc1ccc(c(c1)Br)SCC(=O)OCc2ccccc2 62a_100009813563_100000753625 [0,2,0,0,0,0|1,0,1]=4 10410 B21R2.225945 Cc1ccc(c(c1)C)C=CC(=O)NCc2ccccc2 11a_100015324214_100000238256 [0,2,0,0,0,0|1,0,0]=3 10411 B21R2.225945 Cc1ccc(c(c1)C)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000238256 [0,2,0,0,0,0|1,0,0]=3 10412 B21R2.225945 Cc1ccc(c(c1)C)C=CC(=O)NCc2ccccn2 11a_100000210449_100000238256 [0,2,0,0,0,0|2,0,0]=4 10413 B21R2.225945 Cc1ccc(c(c1)C)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000238256 [0,2,0,0,0,0|2,0,0]=4 10414 B21R2.225945 Cc1ccc(c(c1)C)C=CC(=O)NCc2cccnc2 11a_100000210453_100000238256 [0,2,0,0,0,0|2,0,0]=4 10415 B21R2.225945 Cc1ccc(c(c1)C)C=CC(=O)NCc2ccncc2 11a_100000210450_100000238256 [0,2,0,0,0,0|2,0,0]=4 10416 B21R2.225945 Cc1ccc(c(c1)C)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000238256 [0,2,0,0,0,0|2,0,0]=4 10417 B21R2.225945 Cc1ccc(c(c1)C)C=CC(=O)NNc2ccccc2 22a_100015195140_100000238256 [0,2,0,0,0,0|2,0,0]=4 10418 B21R2.225945 Cc1ccc(c(c1)C)CNC(=O)C=Cc2ccccc2 11a_100000737523_100000210462 [0,2,0,0,0,0|1,0,0]=3 10419 B21R2.225945 Cc1ccc(c(c1)C)CNC(=O)C=Cc2ccccc2 1626a_100000737523_100000210462 [0,2,0,0,0,0|1,0,0]=3 10420 B21R2.225945 Cc1ccc(c(c1)C)CNC(=O)C=Cc2ccccn2 11a_100000737523_100000740811 [0,2,0,0,0,0|2,0,0]=4 10421 B21R2.225945 Cc1ccc(c(c1)C)CNC(=O)C=Cc2ccccn2 240690a_100000737523_100000740811 [0,2,0,0,0,0|2,0,0]=4 10422 B21R2.225945 Cc1ccc(c(c1)C)CNC(=O)C=Cc2cccnc2 11a_100000737523_100000735890 [0,2,0,0,0,0|2,0,0]=4 10423 B21R2.225945 Cc1ccc(c(c1)C)CNC(=O)C=Cc2cccnc2 240690a_100000737523_100000735890 [0,2,0,0,0,0|2,0,0]=4 10424 B21R2.225945 Cc1ccc(c(c1)C)CNC(=O)C=Cc2ccncc2 240690a_100000737523_100000682801 [0,2,0,0,0,0|2,0,0]=4 10425 B21R2.225945 Cc1ccc(c(c1)C)NCC(=O)OCc2ccccc2 34a_100000736561_100000753625 [0,2,0,0,0,0|1,0,1]=4 10426 B21R2.225945 Cc1ccc(c(c1)C)NCC(=O)OCc2ccccc2 7a_100000736561_100000753625 [0,2,0,0,0,0|1,0,1]=4 10427 B21R2.225945 Cc1ccc(c(c1)C)NNC(=O)C=Cc2ccccc2 22a_100000184573_100000210462 [0,2,0,0,0,0|2,0,0]=4 10428 B21R2.225945 Cc1ccc(c(c1)C)OCC(=O)OCc2ccccc2 34a_100000211776_100000753625 [0,2,0,0,0,0|1,0,1]=4 10429 B21R2.225945 Cc1ccc(c(c1)C)OCC(=O)OCc2ccccc2 7a_100000211776_100000753625 [0,2,0,0,0,0|1,0,1]=4 10430 B21R2.225945 Cc1ccc(c(c1)C)SCC(=O)OCc2ccccc2 62a_100000753625_100011217332 [0,2,0,0,0,0|1,0,1]=4 10431 B21R2.225945 Cc1ccc(c(c1)C)SCC(=O)OCc2ccccc2 62a_100011217332_100000753625 [0,2,0,0,0,0|1,0,1]=4 10432 B21R2.225945 Cc1ccc(c(c1)Cl)CNC(=O)C=Cc2ccccc2 11a_100011997539_100000210462 [0,2,0,0,0,0|1,0,0]=3 10433 B21R2.225945 Cc1ccc(c(c1)Cl)CNC(=O)C=Cc2ccccc2 1626a_100011997539_100000210462 [0,2,0,0,0,0|1,0,0]=3 10434 B21R2.225945 Cc1ccc(c(c1)Cl)CNC(=O)C=Cc2ccccn2 11a_100011997539_100000740811 [0,2,0,0,0,0|2,0,0]=4 10435 B21R2.225945 Cc1ccc(c(c1)Cl)CNC(=O)C=Cc2ccccn2 240690a_100011997539_100000740811 [0,2,0,0,0,0|2,0,0]=4 10436 B21R2.225945 Cc1ccc(c(c1)Cl)CNC(=O)C=Cc2cccnc2 11a_100011997539_100000735890 [0,2,0,0,0,0|2,0,0]=4 10437 B21R2.225945 Cc1ccc(c(c1)Cl)CNC(=O)C=Cc2cccnc2 240690a_100011997539_100000735890 [0,2,0,0,0,0|2,0,0]=4 10438 B21R2.225945 Cc1ccc(c(c1)Cl)CNC(=O)C=Cc2ccncc2 240690a_100011997539_100000682801 [0,2,0,0,0,0|2,0,0]=4 10439 B21R2.225945 Cc1ccc(c(c1)Cl)NCC(=O)OCc2ccccc2 34a_100000210522_100000753625 [0,2,0,0,0,0|1,0,1]=4 10440 B21R2.225945 Cc1ccc(c(c1)Cl)NNC(=O)C=Cc2ccccc2 22a_100000006747_100000210462 [0,2,0,0,0,0|2,0,0]=4 10441 B21R2.225945 Cc1ccc(c(c1)Cl)OCC(=O)OCc2ccccc2 34a_100000749699_100000753625 [0,2,0,0,0,0|1,0,1]=4 10442 B21R2.225945 Cc1ccc(c(c1)Cl)OCC(=O)OCc2ccccc2 7a_100000749699_100000753625 [0,2,0,0,0,0|1,0,1]=4 10443 B21R2.225945 Cc1ccc(c(c1)Cl)SCC(=O)OCc2ccccc2 62a_100000753625_100011263221 [0,2,0,0,0,0|1,0,1]=4 10444 B21R2.225945 Cc1ccc(c(c1)Cl)SCC(=O)OCc2ccccc2 62a_100011263221_100000753625 [0,2,0,0,0,0|1,0,1]=4 10445 B21R2.225945 Cc1ccc(c(c1)F)C=CC(=O)CCc2ccccc2 6a_100011217368_100000210092 [0,2,0,0,0,0|1,0,0]=3 10446 B21R2.225945 Cc1ccc(c(c1)F)C=CC(=O)COc2ccccc2 6a_100011217368_100000150576 [0,2,0,0,0,0|2,0,0]=4 10447 B21R2.225945 Cc1ccc(c(c1)F)C=CC(=O)CSc2ccccc2 6a_100011217368_100000150717 [0,2,0,0,0,0|2,0,0]=4 10448 B21R2.225945 Cc1ccc(c(c1)F)CNC(=O)C=Cc2ccccc2 11a_100102887089_100000210462 [0,2,0,0,0,0|1,0,0]=3 10449 B21R2.225945 Cc1ccc(c(c1)F)CNC(=O)C=Cc2ccccc2 1626a_100102887089_100000210462 [0,2,0,0,0,0|1,0,0]=3 10450 B21R2.225945 Cc1ccc(c(c1)F)CNC(=O)C=Cc2ccccn2 11a_100102887089_100000740811 [0,2,0,0,0,0|2,0,0]=4 10451 B21R2.225945 Cc1ccc(c(c1)F)CNC(=O)C=Cc2ccccn2 240690a_100102887089_100000740811 [0,2,0,0,0,0|2,0,0]=4 10452 B21R2.225945 Cc1ccc(c(c1)F)CNC(=O)C=Cc2cccnc2 11a_100102887089_100000735890 [0,2,0,0,0,0|2,0,0]=4 10453 B21R2.225945 Cc1ccc(c(c1)F)CNC(=O)C=Cc2cccnc2 240690a_100102887089_100000735890 [0,2,0,0,0,0|2,0,0]=4 10454 B21R2.225945 Cc1ccc(c(c1)F)CNC(=O)C=Cc2ccncc2 240690a_100102887089_100000682801 [0,2,0,0,0,0|2,0,0]=4 10455 B21R2.225945 Cc1ccc(c(c1)F)NCC(=O)OCc2ccccc2 34a_100000211023_100000753625 [0,2,0,0,0,0|1,0,1]=4 10456 B21R2.225945 Cc1ccc(c(c1)F)NNC(=O)C=Cc2ccccc2 22a_100000689694_100000210462 [0,2,0,0,0,0|2,0,0]=4 10457 B21R2.225945 Cc1ccc(c(c1)F)OCC(=O)OCc2ccccc2 34a_100011216688_100000753625 [0,2,0,0,0,0|1,0,1]=4 10458 B21R2.225945 Cc1ccc(c(c1)F)OCC(=O)OCc2ccccc2 7a_100011216688_100000753625 [0,2,0,0,0,0|1,0,1]=4 10459 B21R2.225945 Cc1ccc(c(c1)F)SCC(=O)OCc2ccccc2 62a_100000753625_100011216119 [0,2,0,0,0,0|1,0,1]=4 10460 B21R2.225945 Cc1ccc(c(c1)F)SCC(=O)OCc2ccccc2 62a_100011216119_100000753625 [0,2,0,0,0,0|1,0,1]=4 10461 B21R2.225945 Cc1ccc(c(c1)I)C=CC(=O)CCc2ccccc2 6a_100010150104_100000210092 [0,2,0,0,0,0|1,0,0]=3 10462 B21R2.225945 Cc1ccc(c(c1)I)C=CC(=O)COc2ccccc2 6a_100010150104_100000150576 [0,2,0,0,0,0|2,0,0]=4 10463 B21R2.225945 Cc1ccc(c(c1)I)C=CC(=O)CSc2ccccc2 6a_100010150104_100000150717 [0,2,0,0,0,0|2,0,0]=4 10464 B21R2.225945 Cc1ccc(c(c1)I)NCC(=O)OCc2ccccc2 34a_100011356834_100000753625 [0,2,0,0,0,0|1,0,1]=4 10465 B21R2.225945 Cc1ccc(c(c1)I)OCC(=O)OCc2ccccc2 34a_100000765521_100000753625 [0,2,0,0,0,0|1,0,1]=4 10466 B21R2.225945 Cc1ccc(c(c1)I)OCC(=O)OCc2ccccc2 7a_100000765521_100000753625 [0,2,0,0,0,0|1,0,1]=4 10467 B21R2.225945 Cc1ccc(c(c1)N)OCC(=O)OCc2ccccc2 34a_100011215204_100000753625 [0,2,0,0,0,0|1,0,1]=4 10468 B21R2.225945 Cc1ccc(c(c1)N)OCC(=O)OCc2ccccc2 7a_100011215204_100000753625 [0,2,0,0,0,0|1,0,1]=4 10469 B21R2.225945 Cc1ccc(c(c1)N)SCC(=O)OCc2ccccc2 62a_100000753625_100011216686 [0,2,0,0,0,0|1,0,1]=4 10470 B21R2.225945 Cc1ccc(c(c1)N)SCC(=O)OCc2ccccc2 62a_100011216686_100000753625 [0,2,0,0,0,0|1,0,1]=4 10471 B21R2.225945 Cc1ccc(c(c1)O)NCC(=O)OCc2ccccc2 34a_100000211527_100000753625 [0,2,0,0,0,0|1,0,1]=4 10472 B21R2.225945 Cc1ccc(c(c1)O)SCC(=O)OCc2ccccc2 62a_100000753625_100012002257 [0,2,0,0,0,0|1,0,1]=4 10473 B21R2.225945 Cc1ccc(c(c1)O)SCC(=O)OCc2ccccc2 62a_100012002257_100000753625 [0,2,0,0,0,0|1,0,1]=4 10474 B21R2.225945 Cc1cnc(c(c1)F)C=CC(=O)CCc2ccccc2 6a_100009845184_100000210092 [0,2,0,0,0,0|2,0,0]=4 10475 B21R2.225945 Nc1cc(ccc1OCC(=O)OCc2ccccc2)Br 34a_100000752626_100000753625 [0,2,0,0,0,0|1,0,1]=4 10476 B21R2.225945 Nc1cc(ccc1OCC(=O)OCc2ccccc2)Br 7a_100000752626_100000753625 [0,2,0,0,0,0|1,0,1]=4 10477 B21R2.225945 Nc1cc(ccc1OCC(=O)OCc2ccccc2)Cl 34a_100000210500_100000753625 [0,2,0,0,0,0|1,0,1]=4 10478 B21R2.225945 Nc1cc(ccc1OCC(=O)OCc2ccccc2)Cl 7a_100000210500_100000753625 [0,2,0,0,0,0|1,0,1]=4 10479 B21R2.225945 Nc1cc(ccc1OCC(=O)OCc2ccccc2)F 34a_100000759472_100000753625 [0,2,0,0,0,0|1,0,1]=4 10480 B21R2.225945 Nc1cc(ccc1OCC(=O)OCc2ccccc2)F 7a_100000759472_100000753625 [0,2,0,0,0,0|1,0,1]=4 10481 B21R2.225945 Nc1cc(ccc1OCC(=O)OCc2ccccc2)I 34a_100000753495_100000753625 [0,2,0,0,0,0|1,0,1]=4 10482 B21R2.225945 Nc1cc(ccc1OCC(=O)OCc2ccccc2)I 7a_100000753495_100000753625 [0,2,0,0,0,0|1,0,1]=4 10483 B21R2.225945 Nc1cc(ccc1SCC(=O)OCc2ccccc2)Br 62a_100000743836_100000753625 [0,2,0,0,0,0|1,0,1]=4 10484 B21R2.225945 Nc1cc(ccc1SCC(=O)OCc2ccccc2)Br 62a_100000753625_100000743836 [0,2,0,0,0,0|1,0,1]=4 10485 B21R2.225945 Nc1cc(ccc1SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100000761886 [0,2,0,0,0,0|1,0,1]=4 10486 B21R2.225945 Nc1cc(ccc1SCC(=O)OCc2ccccc2)Cl 62a_100000761886_100000753625 [0,2,0,0,0,0|1,0,1]=4 10487 B21R2.225945 Nc1cc(ccc1SCC(=O)OCc2ccccc2)F 62a_100000687223_100000753625 [0,2,0,0,0,0|1,0,1]=4 10488 B21R2.225945 Nc1cc(ccc1SCC(=O)OCc2ccccc2)F 62a_100000753625_100000687223 [0,2,0,0,0,0|1,0,1]=4 10489 B21R2.225945 Nc1cc(ccc1SCC(=O)OCc2ccccc2)O 62a_100000753625_100011999798 [0,2,0,0,0,0|1,0,1]=4 10490 B21R2.225945 Nc1cc(ccc1SCC(=O)OCc2ccccc2)O 62a_100011999798_100000753625 [0,2,0,0,0,0|1,0,1]=4 10491 B21R2.225945 Nc1ccc(c(c1)Br)OCC(=O)OCc2ccccc2 34a_100011534360_100000753625 [0,2,0,0,0,0|1,0,1]=4 10492 B21R2.225945 Nc1ccc(c(c1)Br)OCC(=O)OCc2ccccc2 7a_100011534360_100000753625 [0,2,0,0,0,0|1,0,1]=4 10493 B21R2.225945 Nc1ccc(c(c1)Br)SCC(=O)OCc2ccccc2 62a_100000750458_100000753625 [0,2,0,0,0,0|1,0,1]=4 10494 B21R2.225945 Nc1ccc(c(c1)Br)SCC(=O)OCc2ccccc2 62a_100000753625_100000750458 [0,2,0,0,0,0|1,0,1]=4 10495 B21R2.225945 Nc1ccc(c(c1)Cl)OCC(=O)OCc2ccccc2 34a_100000744943_100000753625 [0,2,0,0,0,0|1,0,1]=4 10496 B21R2.225945 Nc1ccc(c(c1)Cl)OCC(=O)OCc2ccccc2 7a_100000744943_100000753625 [0,2,0,0,0,0|1,0,1]=4 10497 B21R2.225945 Nc1ccc(c(c1)Cl)SCC(=O)OCc2ccccc2 62a_100000753625_100000761885 [0,2,0,0,0,0|1,0,1]=4 10498 B21R2.225945 Nc1ccc(c(c1)Cl)SCC(=O)OCc2ccccc2 62a_100000761885_100000753625 [0,2,0,0,0,0|1,0,1]=4 10499 B21R2.225945 Nc1ccc(c(c1)F)OCC(=O)OCc2ccccc2 34a_100011220035_100000753625 [0,2,0,0,0,0|1,0,1]=4 10500 B21R2.225945 Nc1ccc(c(c1)F)OCC(=O)OCc2ccccc2 7a_100011220035_100000753625 [0,2,0,0,0,0|1,0,1]=4 10501 B21R2.225945 Nc1ccc(c(c1)F)SCC(=O)OCc2ccccc2 62a_100000753625_100011356925 [0,2,0,0,0,0|1,0,1]=4 10502 B21R2.225945 Nc1ccc(c(c1)F)SCC(=O)OCc2ccccc2 62a_100011356925_100000753625 [0,2,0,0,0,0|1,0,1]=4 10503 B21R2.225945 Nc1ccc(c(c1)N)OCC(=O)OCc2ccccc2 34a_100000725306_100000753625 [0,2,0,0,0,0|1,0,1]=4 10504 B21R2.225945 Nc1ccc(c(c1)N)SCC(=O)OCc2ccccc2 62a_100000753625_200012175722 [0,2,0,0,0,0|1,0,1]=4 10505 B21R2.225945 Nc1ccc(c(c1)N)SCC(=O)OCc2ccccc2 62a_200012175722_100000753625 [0,2,0,0,0,0|1,0,1]=4 10506 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)CCc2ccccc2 1458a_200102591336_100000765856 [0,2,0,0,0,0|1,0,0]=3 10507 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)CCc2ccccn2 1458a_200102591336_100015183660 [0,2,0,0,0,0|2,0,0]=4 10508 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)CCc2cccnc2 1458a_200102591336_200011713674 [0,2,0,0,0,0|2,0,0]=4 10509 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)CCc2ccncc2 1458a_200102591336_100000723409 [0,2,0,0,0,0|2,0,0]=4 10510 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccccc2 11a_100015324214_200102591336 [0,2,0,0,0,0|1,0,0]=3 10511 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccccc2 1626a_100015324214_200102591336 [0,2,0,0,0,0|1,0,0]=3 10512 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccccc2 240690a_100015324214_200102591336 [0,2,0,0,0,0|1,0,0]=3 10513 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccccn2 11a_100000210449_200102591336 [0,2,0,0,0,0|2,0,0]=4 10514 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccccn2 1626a_100000210449_200102591336 [0,2,0,0,0,0|2,0,0]=4 10515 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccccn2 240690a_100000210449_200102591336 [0,2,0,0,0,0|2,0,0]=4 10516 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2cccnc2 11a_100000210453_200102591336 [0,2,0,0,0,0|2,0,0]=4 10517 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2cccnc2 240690a_100000210453_200102591336 [0,2,0,0,0,0|2,0,0]=4 10518 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccncc2 11a_100000210450_200102591336 [0,2,0,0,0,0|2,0,0]=4 10519 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccncc2 1626a_100000210450_200102591336 [0,2,0,0,0,0|2,0,0]=4 10520 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NCc2ccncc2 240690a_100000210450_200102591336 [0,2,0,0,0,0|2,0,0]=4 10521 B21R2.225945 O=C(C=Cc1ccc(cc1Br)F)NNc2ccccc2 22a_100015195140_200102591336 [0,2,0,0,0,0|2,0,0]=4 10522 B21R2.225945 O=C(C=Cc1ccc(cc1Br)I)CCc2ccccc2 6a_100010185650_100000210092 [0,2,0,0,0,0|1,0,0]=3 10523 B21R2.225945 O=C(C=Cc1ccc(cc1Br)I)COc2ccccc2 6a_100010185650_100000150576 [0,2,0,0,0,0|2,0,0]=4 10524 B21R2.225945 O=C(C=Cc1ccc(cc1Br)I)CSc2ccccc2 6a_100010185650_100000150717 [0,2,0,0,0,0|2,0,0]=4 10525 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)CCc2ccccc2 1458a_100102525105_100000765856 [0,2,0,0,0,0|1,0,0]=3 10526 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)CCc2ccccn2 1458a_100102525105_100015183660 [0,2,0,0,0,0|2,0,0]=4 10527 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)CCc2cccnc2 1458a_100102525105_200011713674 [0,2,0,0,0,0|2,0,0]=4 10528 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)CCc2ccncc2 1458a_100102525105_100000723409 [0,2,0,0,0,0|2,0,0]=4 10529 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccccc2 11a_100015324214_100102525105 [0,2,0,0,0,0|1,0,0]=3 10530 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccccc2 1626a_100015324214_100102525105 [0,2,0,0,0,0|1,0,0]=3 10531 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccccc2 240690a_100015324214_100102525105 [0,2,0,0,0,0|1,0,0]=3 10532 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccccn2 11a_100000210449_100102525105 [0,2,0,0,0,0|2,0,0]=4 10533 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccccn2 1626a_100000210449_100102525105 [0,2,0,0,0,0|2,0,0]=4 10534 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccccn2 240690a_100000210449_100102525105 [0,2,0,0,0,0|2,0,0]=4 10535 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2cccnc2 11a_100000210453_100102525105 [0,2,0,0,0,0|2,0,0]=4 10536 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2cccnc2 240690a_100000210453_100102525105 [0,2,0,0,0,0|2,0,0]=4 10537 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccncc2 11a_100000210450_100102525105 [0,2,0,0,0,0|2,0,0]=4 10538 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccncc2 1626a_100000210450_100102525105 [0,2,0,0,0,0|2,0,0]=4 10539 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NCc2ccncc2 240690a_100000210450_100102525105 [0,2,0,0,0,0|2,0,0]=4 10540 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Br)NNc2ccccc2 22a_100015195140_100102525105 [0,2,0,0,0,0|2,0,0]=4 10541 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)CCc2ccccc2 1458a_100016270030_100000765856 [0,2,0,0,0,0|1,0,0]=3 10542 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)CCc2ccccn2 1458a_100016270030_100015183660 [0,2,0,0,0,0|2,0,0]=4 10543 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)CCc2cccnc2 1458a_100016270030_200011713674 [0,2,0,0,0,0|2,0,0]=4 10544 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)CCc2ccncc2 1458a_100016270030_100000723409 [0,2,0,0,0,0|2,0,0]=4 10545 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccccc2 11a_100015324214_100016270030 [0,2,0,0,0,0|1,0,0]=3 10546 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccccc2 1626a_100015324214_100016270030 [0,2,0,0,0,0|1,0,0]=3 10547 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccccc2 240690a_100015324214_100016270030 [0,2,0,0,0,0|1,0,0]=3 10548 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccccn2 11a_100000210449_100016270030 [0,2,0,0,0,0|2,0,0]=4 10549 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccccn2 1626a_100000210449_100016270030 [0,2,0,0,0,0|2,0,0]=4 10550 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccccn2 240690a_100000210449_100016270030 [0,2,0,0,0,0|2,0,0]=4 10551 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2cccnc2 11a_100000210453_100016270030 [0,2,0,0,0,0|2,0,0]=4 10552 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2cccnc2 240690a_100000210453_100016270030 [0,2,0,0,0,0|2,0,0]=4 10553 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccncc2 11a_100000210450_100016270030 [0,2,0,0,0,0|2,0,0]=4 10554 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccncc2 1626a_100000210450_100016270030 [0,2,0,0,0,0|2,0,0]=4 10555 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NCc2ccncc2 240690a_100000210450_100016270030 [0,2,0,0,0,0|2,0,0]=4 10556 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)Cl)NNc2ccccc2 22a_100015195140_100016270030 [0,2,0,0,0,0|2,0,0]=4 10557 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)CCc2ccccc2 1458a_200102525072_100000765856 [0,2,0,0,0,0|1,0,0]=3 10558 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)CCc2ccccn2 1458a_200102525072_100015183660 [0,2,0,0,0,0|2,0,0]=4 10559 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)CCc2cccnc2 1458a_200102525072_200011713674 [0,2,0,0,0,0|2,0,0]=4 10560 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)CCc2ccncc2 1458a_200102525072_100000723409 [0,2,0,0,0,0|2,0,0]=4 10561 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccccc2 11a_100015324214_200102525072 [0,2,0,0,0,0|1,0,0]=3 10562 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccccc2 1626a_100015324214_200102525072 [0,2,0,0,0,0|1,0,0]=3 10563 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccccc2 240690a_100015324214_200102525072 [0,2,0,0,0,0|1,0,0]=3 10564 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccccn2 11a_100000210449_200102525072 [0,2,0,0,0,0|2,0,0]=4 10565 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccccn2 1626a_100000210449_200102525072 [0,2,0,0,0,0|2,0,0]=4 10566 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccccn2 240690a_100000210449_200102525072 [0,2,0,0,0,0|2,0,0]=4 10567 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2cccnc2 11a_100000210453_200102525072 [0,2,0,0,0,0|2,0,0]=4 10568 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2cccnc2 240690a_100000210453_200102525072 [0,2,0,0,0,0|2,0,0]=4 10569 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccncc2 11a_100000210450_200102525072 [0,2,0,0,0,0|2,0,0]=4 10570 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccncc2 1626a_100000210450_200102525072 [0,2,0,0,0,0|2,0,0]=4 10571 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NCc2ccncc2 240690a_100000210450_200102525072 [0,2,0,0,0,0|2,0,0]=4 10572 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)F)NNc2ccccc2 22a_100015195140_200102525072 [0,2,0,0,0,0|2,0,0]=4 10573 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)I)CCc2ccccc2 6a_100000727542_100000210092 [0,2,0,0,0,0|1,0,0]=3 10574 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)I)COc2ccccc2 6a_100000727542_100000150576 [0,2,0,0,0,0|2,0,0]=4 10575 B21R2.225945 O=C(C=Cc1ccc(cc1Cl)I)CSc2ccccc2 6a_100000727542_100000150717 [0,2,0,0,0,0|2,0,0]=4 10576 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)CCc2ccccc2 1458a_100011214948_100000765856 [0,2,0,0,0,0|1,0,0]=3 10577 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)CCc2ccccc2 6a_100000211676_100000210092 [0,2,0,0,0,0|1,0,0]=3 10578 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)CCc2ccccn2 1458a_100011214948_100015183660 [0,2,0,0,0,0|2,0,0]=4 10579 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)CCc2cccnc2 1458a_100011214948_200011713674 [0,2,0,0,0,0|2,0,0]=4 10580 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)CCc2ccncc2 1458a_100011214948_100000723409 [0,2,0,0,0,0|2,0,0]=4 10581 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)COc2ccccc2 6a_100000211676_100000150576 [0,2,0,0,0,0|2,0,0]=4 10582 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)CSc2ccccc2 6a_100000211676_100000150717 [0,2,0,0,0,0|2,0,0]=4 10583 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccccc2 11a_100015324214_100011214948 [0,2,0,0,0,0|1,0,0]=3 10584 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccccc2 1626a_100015324214_100011214948 [0,2,0,0,0,0|1,0,0]=3 10585 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccccc2 240690a_100015324214_100011214948 [0,2,0,0,0,0|1,0,0]=3 10586 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccccn2 11a_100000210449_100011214948 [0,2,0,0,0,0|2,0,0]=4 10587 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccccn2 1626a_100000210449_100011214948 [0,2,0,0,0,0|2,0,0]=4 10588 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccccn2 240690a_100000210449_100011214948 [0,2,0,0,0,0|2,0,0]=4 10589 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2cccnc2 11a_100000210453_100011214948 [0,2,0,0,0,0|2,0,0]=4 10590 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2cccnc2 240690a_100000210453_100011214948 [0,2,0,0,0,0|2,0,0]=4 10591 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccncc2 11a_100000210450_100011214948 [0,2,0,0,0,0|2,0,0]=4 10592 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccncc2 1626a_100000210450_100011214948 [0,2,0,0,0,0|2,0,0]=4 10593 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NCc2ccncc2 240690a_100000210450_100011214948 [0,2,0,0,0,0|2,0,0]=4 10594 B21R2.225945 O=C(C=Cc1ccc(cc1F)Br)NNc2ccccc2 22a_100015195140_100011214948 [0,2,0,0,0,0|2,0,0]=4 10595 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)CCc2ccccc2 1458a_100102561868_100000765856 [0,2,0,0,0,0|1,0,0]=3 10596 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)CCc2ccccn2 1458a_100102561868_100015183660 [0,2,0,0,0,0|2,0,0]=4 10597 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)CCc2cccnc2 1458a_100102561868_200011713674 [0,2,0,0,0,0|2,0,0]=4 10598 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)CCc2ccncc2 1458a_100102561868_100000723409 [0,2,0,0,0,0|2,0,0]=4 10599 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccccc2 11a_100015324214_100102561868 [0,2,0,0,0,0|1,0,0]=3 10600 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccccc2 1626a_100015324214_100102561868 [0,2,0,0,0,0|1,0,0]=3 10601 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccccc2 240690a_100015324214_100102561868 [0,2,0,0,0,0|1,0,0]=3 10602 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccccn2 11a_100000210449_100102561868 [0,2,0,0,0,0|2,0,0]=4 10603 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccccn2 1626a_100000210449_100102561868 [0,2,0,0,0,0|2,0,0]=4 10604 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccccn2 240690a_100000210449_100102561868 [0,2,0,0,0,0|2,0,0]=4 10605 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2cccnc2 11a_100000210453_100102561868 [0,2,0,0,0,0|2,0,0]=4 10606 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2cccnc2 240690a_100000210453_100102561868 [0,2,0,0,0,0|2,0,0]=4 10607 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccncc2 11a_100000210450_100102561868 [0,2,0,0,0,0|2,0,0]=4 10608 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccncc2 1626a_100000210450_100102561868 [0,2,0,0,0,0|2,0,0]=4 10609 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NCc2ccncc2 240690a_100000210450_100102561868 [0,2,0,0,0,0|2,0,0]=4 10610 B21R2.225945 O=C(C=Cc1ccc(cc1F)Cl)NNc2ccccc2 22a_100015195140_100102561868 [0,2,0,0,0,0|2,0,0]=4 10611 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)CCc2ccccc2 1458a_100011195072_100000765856 [0,2,0,0,0,0|1,0,0]=3 10612 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)CCc2ccccc2 6a_100000211964_100000210092 [0,2,0,0,0,0|1,0,0]=3 10613 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)CCc2ccccn2 1458a_100011195072_100015183660 [0,2,0,0,0,0|2,0,0]=4 10614 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)CCc2cccnc2 1458a_100011195072_200011713674 [0,2,0,0,0,0|2,0,0]=4 10615 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)CCc2ccncc2 1458a_100011195072_100000723409 [0,2,0,0,0,0|2,0,0]=4 10616 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)COc2ccccc2 6a_100000211964_100000150576 [0,2,0,0,0,0|2,0,0]=4 10617 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)CSc2ccccc2 6a_100000211964_100000150717 [0,2,0,0,0,0|2,0,0]=4 10618 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccccc2 11a_100015324214_100011195072 [0,2,0,0,0,0|1,0,0]=3 10619 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccccc2 1626a_100015324214_100011195072 [0,2,0,0,0,0|1,0,0]=3 10620 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccccc2 240690a_100015324214_100011195072 [0,2,0,0,0,0|1,0,0]=3 10621 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccccn2 11a_100000210449_100011195072 [0,2,0,0,0,0|2,0,0]=4 10622 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccccn2 1626a_100000210449_100011195072 [0,2,0,0,0,0|2,0,0]=4 10623 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccccn2 240690a_100000210449_100011195072 [0,2,0,0,0,0|2,0,0]=4 10624 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2cccnc2 11a_100000210453_100011195072 [0,2,0,0,0,0|2,0,0]=4 10625 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2cccnc2 240690a_100000210453_100011195072 [0,2,0,0,0,0|2,0,0]=4 10626 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccncc2 11a_100000210450_100011195072 [0,2,0,0,0,0|2,0,0]=4 10627 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccncc2 1626a_100000210450_100011195072 [0,2,0,0,0,0|2,0,0]=4 10628 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NCc2ccncc2 240690a_100000210450_100011195072 [0,2,0,0,0,0|2,0,0]=4 10629 B21R2.225945 O=C(C=Cc1ccc(cc1F)F)NNc2ccccc2 22a_100015195140_100011195072 [0,2,0,0,0,0|2,0,0]=4 10630 B21R2.225945 O=C(C=Cc1ccc(cc1F)I)CCc2ccccc2 6a_100000050965_100000210092 [0,2,0,0,0,0|1,0,0]=3 10631 B21R2.225945 O=C(C=Cc1ccc(cc1F)I)COc2ccccc2 6a_100000050965_100000150576 [0,2,0,0,0,0|2,0,0]=4 10632 B21R2.225945 O=C(C=Cc1ccc(cc1F)I)CSc2ccccc2 6a_100000050965_100000150717 [0,2,0,0,0,0|2,0,0]=4 10633 B21R2.225945 O=C(C=Cc1ccc(cc1I)Br)CCc2ccccc2 6a_100010146562_100000210092 [0,2,0,0,0,0|1,0,0]=3 10634 B21R2.225945 O=C(C=Cc1ccc(cc1I)Br)COc2ccccc2 6a_100010146562_100000150576 [0,2,0,0,0,0|2,0,0]=4 10635 B21R2.225945 O=C(C=Cc1ccc(cc1I)Br)CSc2ccccc2 6a_100010146562_100000150717 [0,2,0,0,0,0|2,0,0]=4 10636 B21R2.225945 O=C(C=Cc1ccc(cc1I)F)CCc2ccccc2 6a_100010254405_100000210092 [0,2,0,0,0,0|1,0,0]=3 10637 B21R2.225945 O=C(C=Cc1ccc(cc1I)F)COc2ccccc2 6a_100010254405_100000150576 [0,2,0,0,0,0|2,0,0]=4 10638 B21R2.225945 O=C(C=Cc1ccc(cc1I)F)CSc2ccccc2 6a_100010254405_100000150717 [0,2,0,0,0,0|2,0,0]=4 10639 B21R2.225945 O=C(C=Cc1ccc(cc1I)O)CCc2ccccc2 6a_100000051608_100000210092 [0,2,0,0,0,0|1,0,0]=3 10640 B21R2.225945 O=C(C=Cc1ccc(cc1I)O)COc2ccccc2 6a_100000051608_100000150576 [0,2,0,0,0,0|2,0,0]=4 10641 B21R2.225945 O=C(C=Cc1ccc(cc1I)O)CSc2ccccc2 6a_100000051608_100000150717 [0,2,0,0,0,0|2,0,0]=4 10642 B21R2.225945 O=C(C=Cc1ccc(cc1O)I)CCc2ccccc2 6a_100000050530_100000210092 [0,2,0,0,0,0|1,0,0]=3 10643 B21R2.225945 O=C(C=Cc1ccc(cc1O)I)COc2ccccc2 6a_100000050530_100000150576 [0,2,0,0,0,0|2,0,0]=4 10644 B21R2.225945 O=C(C=Cc1ccc(cc1O)I)CSc2ccccc2 6a_100000050530_100000150717 [0,2,0,0,0,0|2,0,0]=4 10645 B21R2.225945 O=C(C=Cc1ccccc1)CCc2ccc(cc2Br)Cl 1458a_100000210462_200012945151 [0,2,0,0,0,0|1,0,0]=3 10646 B21R2.225945 O=C(C=Cc1ccccc1)CCc2ccc(cc2Cl)Cl 1458a_100000210462_200012161198 [0,2,0,0,0,0|1,0,0]=3 10647 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Br)Cl 11a_100102692131_100000210462 [0,2,0,0,0,0|1,0,0]=3 10648 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Br)Cl 1626a_100102692131_100000210462 [0,2,0,0,0,0|1,0,0]=3 10649 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Br)F 11a_100000708791_100000210462 [0,2,0,0,0,0|1,0,0]=3 10650 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Br)F 1626a_100000708791_100000210462 [0,2,0,0,0,0|1,0,0]=3 10651 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Cl)Br 11a_100020628970_100000210462 [0,2,0,0,0,0|1,0,0]=3 10652 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Cl)Br 1626a_100020628970_100000210462 [0,2,0,0,0,0|1,0,0]=3 10653 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Cl)Cl 11a_100000174880_100000210462 [0,2,0,0,0,0|1,0,0]=3 10654 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Cl)Cl 1626a_100000174880_100000210462 [0,2,0,0,0,0|1,0,0]=3 10655 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Cl)F 11a_100000174946_100000210462 [0,2,0,0,0,0|1,0,0]=3 10656 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2Cl)F 1626a_100000174946_100000210462 [0,2,0,0,0,0|1,0,0]=3 10657 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2F)Br 11a_100000754580_100000210462 [0,2,0,0,0,0|1,0,0]=3 10658 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2F)Br 1626a_100000754580_100000210462 [0,2,0,0,0,0|1,0,0]=3 10659 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2F)Cl 11a_100000708496_100000210462 [0,2,0,0,0,0|1,0,0]=3 10660 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2F)Cl 1626a_100000708496_100000210462 [0,2,0,0,0,0|1,0,0]=3 10661 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2F)F 11a_100000737868_100000210462 [0,2,0,0,0,0|1,0,0]=3 10662 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ccc(cc2F)F 1626a_100000737868_100000210462 [0,2,0,0,0,0|1,0,0]=3 10663 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2Br)Cl 11a_100010113384_100000210462 [0,2,0,0,0,0|2,0,0]=4 10664 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2Br)Cl 1626a_100010113384_100000210462 [0,2,0,0,0,0|2,0,0]=4 10665 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2Cl)Br 11a_100025703182_100000210462 [0,2,0,0,0,0|2,0,0]=4 10666 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2Cl)Br 1626a_100025703182_100000210462 [0,2,0,0,0,0|2,0,0]=4 10667 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2Cl)Cl 11a_200020636379_100000210462 [0,2,0,0,0,0|2,0,0]=4 10668 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2Cl)Cl 1626a_200020636379_100000210462 [0,2,0,0,0,0|2,0,0]=4 10669 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2Cl)F 11a_100020639648_100000210462 [0,2,0,0,0,0|2,0,0]=4 10670 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2Cl)F 1626a_100020639648_100000210462 [0,2,0,0,0,0|2,0,0]=4 10671 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2F)Br 11a_100015188786_100000210462 [0,2,0,0,0,0|2,0,0]=4 10672 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2F)Br 1626a_100015188786_100000210462 [0,2,0,0,0,0|2,0,0]=4 10673 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2F)F 11a_100015188779_100000210462 [0,2,0,0,0,0|2,0,0]=4 10674 B21R2.225945 O=C(C=Cc1ccccc1)NCc2ncc(cc2F)F 1626a_100015188779_100000210462 [0,2,0,0,0,0|2,0,0]=4 10675 B21R2.225945 O=C(C=Cc1ccccc1)NNc2ccc(cc2Br)Br 22a_100020603695_100000210462 [0,2,0,0,0,0|2,0,0]=4 10676 B21R2.225945 O=C(C=Cc1ccccc1)NNc2ccc(cc2Cl)Br 22a_100000751498_100000210462 [0,2,0,0,0,0|2,0,0]=4 10677 B21R2.225945 O=C(C=Cc1ccccc1)NNc2ccc(cc2Cl)Cl 22a_100000717958_100000210462 [0,2,0,0,0,0|2,0,0]=4 10678 B21R2.225945 O=C(C=Cc1ccccc1)NNc2ccc(cc2Cl)F 22a_100016987656_100000210462 [0,2,0,0,0,0|2,0,0]=4 10679 B21R2.225945 O=C(C=Cc1ccccc1)NNc2ccc(cc2F)Br 22a_100000751572_100000210462 [0,2,0,0,0,0|2,0,0]=4 10680 B21R2.225945 O=C(C=Cc1ccccc1)NNc2ccc(cc2F)Cl 22a_100016989531_100000210462 [0,2,0,0,0,0|2,0,0]=4 10681 B21R2.225945 O=C(C=Cc1ccccc1)NNc2ccc(cc2F)F 22a_100000681581_100000210462 [0,2,0,0,0,0|2,0,0]=4 10682 B21R2.225945 O=C(C=Cc1ccccn1)CCc2ccc(cc2Br)Cl 1458a_100000740811_200012945151 [0,2,0,0,0,0|2,0,0]=4 10683 B21R2.225945 O=C(C=Cc1ccccn1)CCc2ccc(cc2Cl)Cl 1458a_100000740811_200012161198 [0,2,0,0,0,0|2,0,0]=4 10684 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Br)Cl 11a_100102692131_100000740811 [0,2,0,0,0,0|2,0,0]=4 10685 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Br)Cl 240690a_100102692131_100000740811 [0,2,0,0,0,0|2,0,0]=4 10686 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Br)F 11a_100000708791_100000740811 [0,2,0,0,0,0|2,0,0]=4 10687 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Br)F 240690a_100000708791_100000740811 [0,2,0,0,0,0|2,0,0]=4 10688 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Cl)Br 11a_100020628970_100000740811 [0,2,0,0,0,0|2,0,0]=4 10689 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Cl)Br 240690a_100020628970_100000740811 [0,2,0,0,0,0|2,0,0]=4 10690 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Cl)Cl 11a_100000174880_100000740811 [0,2,0,0,0,0|2,0,0]=4 10691 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Cl)Cl 240690a_100000174880_100000740811 [0,2,0,0,0,0|2,0,0]=4 10692 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Cl)F 11a_100000174946_100000740811 [0,2,0,0,0,0|2,0,0]=4 10693 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Cl)F 240690a_100000174946_100000740811 [0,2,0,0,0,0|2,0,0]=4 10694 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2Cl)O 240690a_200161156549_100000740811 [0,2,0,0,0,0|2,0,0]=4 10695 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2F)Br 11a_100000754580_100000740811 [0,2,0,0,0,0|2,0,0]=4 10696 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2F)Br 240690a_100000754580_100000740811 [0,2,0,0,0,0|2,0,0]=4 10697 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2F)Cl 11a_100000708496_100000740811 [0,2,0,0,0,0|2,0,0]=4 10698 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2F)Cl 240690a_100000708496_100000740811 [0,2,0,0,0,0|2,0,0]=4 10699 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2F)F 11a_100000737868_100000740811 [0,2,0,0,0,0|2,0,0]=4 10700 B21R2.225945 O=C(C=Cc1ccccn1)NCc2ccc(cc2F)F 240690a_100000737868_100000740811 [0,2,0,0,0,0|2,0,0]=4 10701 B21R2.225945 O=C(C=Cc1cccnc1)CCc2ccc(cc2Br)Cl 1458a_100000735890_200012945151 [0,2,0,0,0,0|2,0,0]=4 10702 B21R2.225945 O=C(C=Cc1cccnc1)CCc2ccc(cc2Cl)Cl 1458a_100000735890_200012161198 [0,2,0,0,0,0|2,0,0]=4 10703 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Br)Cl 11a_100102692131_100000735890 [0,2,0,0,0,0|2,0,0]=4 10704 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Br)Cl 240690a_100102692131_100000735890 [0,2,0,0,0,0|2,0,0]=4 10705 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Br)F 11a_100000708791_100000735890 [0,2,0,0,0,0|2,0,0]=4 10706 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Br)F 240690a_100000708791_100000735890 [0,2,0,0,0,0|2,0,0]=4 10707 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Cl)Br 11a_100020628970_100000735890 [0,2,0,0,0,0|2,0,0]=4 10708 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Cl)Br 240690a_100020628970_100000735890 [0,2,0,0,0,0|2,0,0]=4 10709 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Cl)Cl 11a_100000174880_100000735890 [0,2,0,0,0,0|2,0,0]=4 10710 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Cl)Cl 240690a_100000174880_100000735890 [0,2,0,0,0,0|2,0,0]=4 10711 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Cl)F 11a_100000174946_100000735890 [0,2,0,0,0,0|2,0,0]=4 10712 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Cl)F 240690a_100000174946_100000735890 [0,2,0,0,0,0|2,0,0]=4 10713 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2Cl)O 240690a_200161156549_100000735890 [0,2,0,0,0,0|2,0,0]=4 10714 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2F)Br 11a_100000754580_100000735890 [0,2,0,0,0,0|2,0,0]=4 10715 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2F)Br 240690a_100000754580_100000735890 [0,2,0,0,0,0|2,0,0]=4 10716 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2F)Cl 11a_100000708496_100000735890 [0,2,0,0,0,0|2,0,0]=4 10717 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2F)Cl 240690a_100000708496_100000735890 [0,2,0,0,0,0|2,0,0]=4 10718 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2F)F 11a_100000737868_100000735890 [0,2,0,0,0,0|2,0,0]=4 10719 B21R2.225945 O=C(C=Cc1cccnc1)NCc2ccc(cc2F)F 240690a_100000737868_100000735890 [0,2,0,0,0,0|2,0,0]=4 10720 B21R2.225945 O=C(C=Cc1ccncc1)CCc2ccc(cc2Br)Cl 1458a_100000682801_200012945151 [0,2,0,0,0,0|2,0,0]=4 10721 B21R2.225945 O=C(C=Cc1ccncc1)CCc2ccc(cc2Cl)Cl 1458a_100000682801_200012161198 [0,2,0,0,0,0|2,0,0]=4 10722 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2Br)Cl 240690a_100102692131_100000682801 [0,2,0,0,0,0|2,0,0]=4 10723 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2Br)F 240690a_100000708791_100000682801 [0,2,0,0,0,0|2,0,0]=4 10724 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2Cl)Br 240690a_100020628970_100000682801 [0,2,0,0,0,0|2,0,0]=4 10725 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2Cl)Cl 240690a_100000174880_100000682801 [0,2,0,0,0,0|2,0,0]=4 10726 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2Cl)F 240690a_100000174946_100000682801 [0,2,0,0,0,0|2,0,0]=4 10727 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2Cl)O 240690a_200161156549_100000682801 [0,2,0,0,0,0|2,0,0]=4 10728 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2F)Br 240690a_100000754580_100000682801 [0,2,0,0,0,0|2,0,0]=4 10729 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2F)Cl 240690a_100000708496_100000682801 [0,2,0,0,0,0|2,0,0]=4 10730 B21R2.225945 O=C(C=Cc1ccncc1)NCc2ccc(cc2F)F 240690a_100000737868_100000682801 [0,2,0,0,0,0|2,0,0]=4 10731 B21R2.225945 O=C(C=Cc1ncc(cc1Br)Br)CCc2ccccc2 6a_100000688198_100000210092 [0,2,0,0,0,0|2,0,0]=4 10732 B21R2.225945 O=C(C=Cc1ncc(cc1Br)Cl)CCc2ccccc2 6a_100010064872_100000210092 [0,2,0,0,0,0|2,0,0]=4 10733 B21R2.225945 O=C(C=Cc1ncc(cc1Cl)Br)CCc2ccccc2 6a_100009814801_100000210092 [0,2,0,0,0,0|2,0,0]=4 10734 B21R2.225945 O=C(C=Cc1ncc(cc1Cl)Cl)CCc2ccccc2 6a_100011361609_100000210092 [0,2,0,0,0,0|2,0,0]=4 10735 B21R2.225945 O=C(C=Cc1ncc(cc1F)Br)CCc2ccccc2 6a_100010180630_100000210092 [0,2,0,0,0,0|2,0,0]=4 10736 B21R2.225945 O=C(C=Cc1ncc(cc1F)Cl)CCc2ccccc2 6a_100009858488_100000210092 [0,2,0,0,0,0|2,0,0]=4 10737 B21R2.225945 O=C(CNc1ccc(cc1Br)Br)OCc2ccccc2 34a_100000211012_100000753625 [0,2,0,0,0,0|1,0,1]=4 10738 B21R2.225945 O=C(CNc1ccc(cc1Br)Cl)OCc2ccccc2 34a_100000752454_100000753625 [0,2,0,0,0,0|1,0,1]=4 10739 B21R2.225945 O=C(CNc1ccc(cc1Br)F)OCc2ccccc2 34a_100000738039_100000753625 [0,2,0,0,0,0|1,0,1]=4 10740 B21R2.225945 O=C(CNc1ccc(cc1Br)O)OCc2ccccc2 34a_100012001276_100000753625 [0,2,0,0,0,0|1,0,1]=4 10741 B21R2.225945 O=C(CNc1ccc(cc1Cl)Br)OCc2ccccc2 34a_100000211467_100000753625 [0,2,0,0,0,0|1,0,1]=4 10742 B21R2.225945 O=C(CNc1ccc(cc1Cl)Cl)OCc2ccccc2 34a_100000185861_100000753625 [0,2,0,0,0,0|1,0,1]=4 10743 B21R2.225945 O=C(CNc1ccc(cc1Cl)F)OCc2ccccc2 34a_100000212003_100000753625 [0,2,0,0,0,0|1,0,1]=4 10744 B21R2.225945 O=C(CNc1ccc(cc1Cl)I)OCc2ccccc2 34a_100011218065_100000753625 [0,2,0,0,0,0|1,0,1]=4 10745 B21R2.225945 O=C(CNc1ccc(cc1Cl)O)OCc2ccccc2 34a_100011215599_100000753625 [0,2,0,0,0,0|1,0,1]=4 10746 B21R2.225945 O=C(CNc1ccc(cc1F)Br)OCc2ccccc2 34a_100000210722_100000753625 [0,2,0,0,0,0|1,0,1]=4 10747 B21R2.225945 O=C(CNc1ccc(cc1F)Cl)OCc2ccccc2 34a_100000211020_100000753625 [0,2,0,0,0,0|1,0,1]=4 10748 B21R2.225945 O=C(CNc1ccc(cc1F)F)OCc2ccccc2 34a_100000210720_100000753625 [0,2,0,0,0,0|1,0,1]=4 10749 B21R2.225945 O=C(CNc1ccc(cc1F)I)OCc2ccccc2 34a_100011215594_100000753625 [0,2,0,0,0,0|1,0,1]=4 10750 B21R2.225945 O=C(CNc1ccc(cc1F)O)OCc2ccccc2 34a_100000759473_100000753625 [0,2,0,0,0,0|1,0,1]=4 10751 B21R2.225945 O=C(CNc1ccc(cc1I)Br)OCc2ccccc2 34a_100000187925_100000753625 [0,2,0,0,0,0|1,0,1]=4 10752 B21R2.225945 O=C(CNc1ccc(cc1I)Cl)OCc2ccccc2 34a_100000761889_100000753625 [0,2,0,0,0,0|1,0,1]=4 10753 B21R2.225945 O=C(CNc1ccc(cc1I)F)OCc2ccccc2 34a_100000760547_100000753625 [0,2,0,0,0,0|1,0,1]=4 10754 B21R2.225945 O=C(CNc1ccc(cc1I)O)OCc2ccccc2 34a_100010084370_100000753625 [0,2,0,0,0,0|1,0,1]=4 10755 B21R2.225945 O=C(CNc1ccc(cc1O)Br)OCc2ccccc2 34a_100000739049_100000753625 [0,2,0,0,0,0|1,0,1]=4 10756 B21R2.225945 O=C(CNc1ccc(cc1O)Cl)OCc2ccccc2 34a_100000185728_100000753625 [0,2,0,0,0,0|1,0,1]=4 10757 B21R2.225945 O=C(CNc1ccc(cc1O)F)OCc2ccccc2 34a_100000753323_100000753625 [0,2,0,0,0,0|1,0,1]=4 10758 B21R2.225945 O=C(CNc1ccc(cc1O)O)OCc2ccccc2 34a_100000106777_100000753625 [0,2,0,0,0,0|1,0,1]=4 10759 B21R2.225945 O=C(COc1ccc(cc1Br)Br)OCc2ccccc2 34a_100000188717_100000753625 [0,2,0,0,0,0|1,0,1]=4 10760 B21R2.225945 O=C(COc1ccc(cc1Br)Br)OCc2ccccc2 7a_100000188717_100000753625 [0,2,0,0,0,0|1,0,1]=4 10761 B21R2.225945 O=C(COc1ccc(cc1Br)Cl)OCc2ccccc2 34a_100000211998_100000753625 [0,2,0,0,0,0|1,0,1]=4 10762 B21R2.225945 O=C(COc1ccc(cc1Br)Cl)OCc2ccccc2 7a_100000211998_100000753625 [0,2,0,0,0,0|1,0,1]=4 10763 B21R2.225945 O=C(COc1ccc(cc1Br)F)OCc2ccccc2 34a_100000211999_100000753625 [0,2,0,0,0,0|1,0,1]=4 10764 B21R2.225945 O=C(COc1ccc(cc1Br)F)OCc2ccccc2 7a_100000211999_100000753625 [0,2,0,0,0,0|1,0,1]=4 10765 B21R2.225945 O=C(COc1ccc(cc1Br)I)OCc2ccccc2 34a_100012361655_100000753625 [0,2,0,0,0,0|1,0,1]=4 10766 B21R2.225945 O=C(COc1ccc(cc1Br)I)OCc2ccccc2 7a_100012361655_100000753625 [0,2,0,0,0,0|1,0,1]=4 10767 B21R2.225945 O=C(COc1ccc(cc1Cl)Br)OCc2ccccc2 34a_100000186472_100000753625 [0,2,0,0,0,0|1,0,1]=4 10768 B21R2.225945 O=C(COc1ccc(cc1Cl)Br)OCc2ccccc2 7a_100000186472_100000753625 [0,2,0,0,0,0|1,0,1]=4 10769 B21R2.225945 O=C(COc1ccc(cc1Cl)Cl)OCc2ccccc2 34a_100015191787_100000753625 [0,2,0,0,0,0|1,0,1]=4 10770 B21R2.225945 O=C(COc1ccc(cc1Cl)Cl)OCc2ccccc2 7a_100015191787_100000753625 [0,2,0,0,0,0|1,0,1]=4 10771 B21R2.225945 O=C(COc1ccc(cc1Cl)F)OCc2ccccc2 34a_100000212004_100000753625 [0,2,0,0,0,0|1,0,1]=4 10772 B21R2.225945 O=C(COc1ccc(cc1Cl)F)OCc2ccccc2 7a_100000212004_100000753625 [0,2,0,0,0,0|1,0,1]=4 10773 B21R2.225945 O=C(COc1ccc(cc1Cl)I)OCc2ccccc2 34a_100012360047_100000753625 [0,2,0,0,0,0|1,0,1]=4 10774 B21R2.225945 O=C(COc1ccc(cc1Cl)I)OCc2ccccc2 7a_100012360047_100000753625 [0,2,0,0,0,0|1,0,1]=4 10775 B21R2.225945 O=C(COc1ccc(cc1F)Br)OCc2ccccc2 34a_100000185481_100000753625 [0,2,0,0,0,0|1,0,1]=4 10776 B21R2.225945 O=C(COc1ccc(cc1F)Br)OCc2ccccc2 7a_100000185481_100000753625 [0,2,0,0,0,0|1,0,1]=4 10777 B21R2.225945 O=C(COc1ccc(cc1F)Cl)OCc2ccccc2 34a_100000230166_100000753625 [0,2,0,0,0,0|1,0,1]=4 10778 B21R2.225945 O=C(COc1ccc(cc1F)Cl)OCc2ccccc2 7a_100000230166_100000753625 [0,2,0,0,0,0|1,0,1]=4 10779 B21R2.225945 O=C(COc1ccc(cc1F)F)OCc2ccccc2 34a_100000230127_100000753625 [0,2,0,0,0,0|1,0,1]=4 10780 B21R2.225945 O=C(COc1ccc(cc1F)F)OCc2ccccc2 7a_100000230127_100000753625 [0,2,0,0,0,0|1,0,1]=4 10781 B21R2.225945 O=C(COc1ccc(cc1F)I)OCc2ccccc2 34a_100011356965_100000753625 [0,2,0,0,0,0|1,0,1]=4 10782 B21R2.225945 O=C(COc1ccc(cc1F)I)OCc2ccccc2 7a_100011356965_100000753625 [0,2,0,0,0,0|1,0,1]=4 10783 B21R2.225945 O=C(COc1ccc(cc1I)Br)OCc2ccccc2 34a_100012355227_100000753625 [0,2,0,0,0,0|1,0,1]=4 10784 B21R2.225945 O=C(COc1ccc(cc1I)Br)OCc2ccccc2 7a_100012355227_100000753625 [0,2,0,0,0,0|1,0,1]=4 10785 B21R2.225945 O=C(COc1ccc(cc1I)Cl)OCc2ccccc2 34a_100011356953_100000753625 [0,2,0,0,0,0|1,0,1]=4 10786 B21R2.225945 O=C(COc1ccc(cc1I)Cl)OCc2ccccc2 7a_100011356953_100000753625 [0,2,0,0,0,0|1,0,1]=4 10787 B21R2.225945 O=C(COc1ccc(cc1I)F)OCc2ccccc2 34a_100012355409_100000753625 [0,2,0,0,0,0|1,0,1]=4 10788 B21R2.225945 O=C(COc1ccc(cc1I)F)OCc2ccccc2 7a_100012355409_100000753625 [0,2,0,0,0,0|1,0,1]=4 10789 B21R2.225945 O=C(COc1ccc(cc1I)I)OCc2ccccc2 7a_100010001573_100000753625 [0,2,0,0,0,0|1,0,1]=4 10790 B21R2.225945 O=C(CSc1ccc(cc1Br)Br)OCc2ccccc2 62a_100000753625_100011484698 [0,2,0,0,0,0|1,0,1]=4 10791 B21R2.225945 O=C(CSc1ccc(cc1Br)Br)OCc2ccccc2 62a_100011484698_100000753625 [0,2,0,0,0,0|1,0,1]=4 10792 B21R2.225945 O=C(CSc1ccc(cc1Br)Cl)OCc2ccccc2 62a_100000753625_100011219703 [0,2,0,0,0,0|1,0,1]=4 10793 B21R2.225945 O=C(CSc1ccc(cc1Br)Cl)OCc2ccccc2 62a_100011219703_100000753625 [0,2,0,0,0,0|1,0,1]=4 10794 B21R2.225945 O=C(CSc1ccc(cc1Br)F)OCc2ccccc2 62a_100000753625_100011217111 [0,2,0,0,0,0|1,0,1]=4 10795 B21R2.225945 O=C(CSc1ccc(cc1Br)F)OCc2ccccc2 62a_100011217111_100000753625 [0,2,0,0,0,0|1,0,1]=4 10796 B21R2.225945 O=C(CSc1ccc(cc1Br)O)OCc2ccccc2 62a_100000701344_100000753625 [0,2,0,0,0,0|1,0,1]=4 10797 B21R2.225945 O=C(CSc1ccc(cc1Br)O)OCc2ccccc2 62a_100000753625_100000701344 [0,2,0,0,0,0|1,0,1]=4 10798 B21R2.225945 O=C(CSc1ccc(cc1Cl)Br)OCc2ccccc2 62a_100000753625_100011216062 [0,2,0,0,0,0|1,0,1]=4 10799 B21R2.225945 O=C(CSc1ccc(cc1Cl)Br)OCc2ccccc2 62a_100011216062_100000753625 [0,2,0,0,0,0|1,0,1]=4 10800 B21R2.225945 O=C(CSc1ccc(cc1Cl)Cl)OCc2ccccc2 62a_100000699841_100000753625 [0,2,0,0,0,0|1,0,1]=4 10801 B21R2.225945 O=C(CSc1ccc(cc1Cl)Cl)OCc2ccccc2 62a_100000753625_100000699841 [0,2,0,0,0,0|1,0,1]=4 10802 B21R2.225945 O=C(CSc1ccc(cc1Cl)F)OCc2ccccc2 62a_100000733362_100000753625 [0,2,0,0,0,0|1,0,1]=4 10803 B21R2.225945 O=C(CSc1ccc(cc1Cl)F)OCc2ccccc2 62a_100000753625_100000733362 [0,2,0,0,0,0|1,0,1]=4 10804 B21R2.225945 O=C(CSc1ccc(cc1Cl)O)OCc2ccccc2 62a_100000047559_100000753625 [0,2,0,0,0,0|1,0,1]=4 10805 B21R2.225945 O=C(CSc1ccc(cc1Cl)O)OCc2ccccc2 62a_100000753625_100000047559 [0,2,0,0,0,0|1,0,1]=4 10806 B21R2.225945 O=C(CSc1ccc(cc1F)Br)OCc2ccccc2 62a_100000753625_100009814013 [0,2,0,0,0,0|1,0,1]=4 10807 B21R2.225945 O=C(CSc1ccc(cc1F)Br)OCc2ccccc2 62a_100009814013_100000753625 [0,2,0,0,0,0|1,0,1]=4 10808 B21R2.225945 O=C(CSc1ccc(cc1F)Cl)OCc2ccccc2 62a_100000753625_100011216042 [0,2,0,0,0,0|1,0,1]=4 10809 B21R2.225945 O=C(CSc1ccc(cc1F)Cl)OCc2ccccc2 62a_100011216042_100000753625 [0,2,0,0,0,0|1,0,1]=4 10810 B21R2.225945 O=C(CSc1ccc(cc1F)F)OCc2ccccc2 62a_100000750030_100000753625 [0,2,0,0,0,0|1,0,1]=4 10811 B21R2.225945 O=C(CSc1ccc(cc1F)F)OCc2ccccc2 62a_100000753625_100000750030 [0,2,0,0,0,0|1,0,1]=4 10812 B21R2.225945 O=C(CSc1ccc(cc1F)O)OCc2ccccc2 62a_100000753625_100000755031 [0,2,0,0,0,0|1,0,1]=4 10813 B21R2.225945 O=C(CSc1ccc(cc1F)O)OCc2ccccc2 62a_100000755031_100000753625 [0,2,0,0,0,0|1,0,1]=4 10814 B21R2.225945 O=C(CSc1ccc(cc1O)Br)OCc2ccccc2 62a_100000753625_100012344904 [0,2,0,0,0,0|1,0,1]=4 10815 B21R2.225945 O=C(CSc1ccc(cc1O)Br)OCc2ccccc2 62a_100012344904_100000753625 [0,2,0,0,0,0|1,0,1]=4 10816 B21R2.225945 O=C(CSc1ccc(cc1O)Cl)OCc2ccccc2 62a_100000050036_100000753625 [0,2,0,0,0,0|1,0,1]=4 10817 B21R2.225945 O=C(CSc1ccc(cc1O)Cl)OCc2ccccc2 62a_100000753625_100000050036 [0,2,0,0,0,0|1,0,1]=4 10818 B21R2.225945 O=C(CSc1ccc(cc1O)F)OCc2ccccc2 62a_100000690578_100000753625 [0,2,0,0,0,0|1,0,1]=4 10819 B21R2.225945 O=C(CSc1ccc(cc1O)F)OCc2ccccc2 62a_100000753625_100000690578 [0,2,0,0,0,0|1,0,1]=4 10820 B21R2.225945 O=C(CSc1ccc(cc1O)O)OCc2ccccc2 62a_100000753625_100009813921 [0,2,0,0,0,0|1,0,1]=4 10821 B21R2.358963 Cc1ccc(cc1)C=CC(=O)CCc2ccccc2Br 1458a_100000716854_100012161201 [0,2,0,0,0,0|1,0,0]=3 10822 B21R2.358963 Cc1ccc(cc1)C=CC(=O)CCc2ccccc2C 1458a_100000716854_100011713688 [0,2,0,0,0,0|1,0,0]=3 10823 B21R2.358963 Cc1ccc(cc1)C=CC(=O)CCc2ccccc2Cl 1458a_100000716854_100011713703 [0,2,0,0,0,0|1,0,0]=3 10824 B21R2.358963 Cc1ccc(cc1)C=CC(=O)CCc2ccccc2F 1458a_100000716854_100000720011 [0,2,0,0,0,0|1,0,0]=3 10825 B21R2.358963 Cc1ccc(cc1)C=CC(=O)CCc2ccccc2O 1458a_100000716854_100000722297 [0,2,0,0,0,0|1,0,0]=3 10826 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2Br 11a_100000689332_100000716854 [0,2,0,0,0,0|1,0,0]=3 10827 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2Br 1626a_100000689332_100000716854 [0,2,0,0,0,0|1,0,0]=3 10828 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2Br 240690a_100000689332_100000716854 [0,2,0,0,0,0|1,0,0]=3 10829 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2C 11a_100000174972_100000716854 [0,2,0,0,0,0|1,0,0]=3 10830 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2C 1626a_100000174972_100000716854 [0,2,0,0,0,0|1,0,0]=3 10831 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2C 240690a_100000174972_100000716854 [0,2,0,0,0,0|1,0,0]=3 10832 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2Cl 11a_100000174879_100000716854 [0,2,0,0,0,0|1,0,0]=3 10833 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2Cl 1626a_100000174879_100000716854 [0,2,0,0,0,0|1,0,0]=3 10834 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2Cl 240690a_100000174879_100000716854 [0,2,0,0,0,0|1,0,0]=3 10835 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2F 11a_100000174869_100000716854 [0,2,0,0,0,0|1,0,0]=3 10836 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2F 1626a_100000174869_100000716854 [0,2,0,0,0,0|1,0,0]=3 10837 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2F 240690a_100000174869_100000716854 [0,2,0,0,0,0|1,0,0]=3 10838 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2I 11a_100015347259_100000716854 [0,2,0,0,0,0|1,0,0]=3 10839 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2I 1626a_100015347259_100000716854 [0,2,0,0,0,0|1,0,0]=3 10840 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2I 240690a_100015347259_100000716854 [0,2,0,0,0,0|1,0,0]=3 10841 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2O 240690a_100000185550_100000716854 [0,2,0,0,0,0|1,0,0]=3 10842 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2Br 11a_100009818023_100000716854 [0,2,0,0,0,0|2,0,0]=4 10843 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2Br 240690a_100009818023_100000716854 [0,2,0,0,0,0|2,0,0]=4 10844 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2Cl 11a_100015189234_100000716854 [0,2,0,0,0,0|2,0,0]=4 10845 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2Cl 1626a_100015189234_100000716854 [0,2,0,0,0,0|2,0,0]=4 10846 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2Cl 240690a_100015189234_100000716854 [0,2,0,0,0,0|2,0,0]=4 10847 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2F 11a_100000724633_100000716854 [0,2,0,0,0,0|2,0,0]=4 10848 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2F 1626a_100000724633_100000716854 [0,2,0,0,0,0|2,0,0]=4 10849 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2F 240690a_100000724633_100000716854 [0,2,0,0,0,0|2,0,0]=4 10850 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2Br 11a_100020640021_100000716854 [0,2,0,0,0,0|2,0,0]=4 10851 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2Br 240690a_100020640021_100000716854 [0,2,0,0,0,0|2,0,0]=4 10852 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2C 11a_100000708811_100000716854 [0,2,0,0,0,0|2,0,0]=4 10853 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2C 1626a_100000708811_100000716854 [0,2,0,0,0,0|2,0,0]=4 10854 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2C 240690a_100000708811_100000716854 [0,2,0,0,0,0|2,0,0]=4 10855 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2F 11a_100011935246_100000716854 [0,2,0,0,0,0|2,0,0]=4 10856 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2F 1626a_100011935246_100000716854 [0,2,0,0,0,0|2,0,0]=4 10857 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2F 240690a_100011935246_100000716854 [0,2,0,0,0,0|2,0,0]=4 10858 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cnccc2C 11a_100011997553_100000716854 [0,2,0,0,0,0|2,0,0]=4 10859 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2cnccc2C 240690a_100011997553_100000716854 [0,2,0,0,0,0|2,0,0]=4 10860 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2Br 11a_100020591323_100000716854 [0,2,0,0,0,0|2,0,0]=4 10861 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2Br 240690a_100020591323_100000716854 [0,2,0,0,0,0|2,0,0]=4 10862 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2C 11a_100011223789_100000716854 [0,2,0,0,0,0|2,0,0]=4 10863 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2C 1626a_100011223789_100000716854 [0,2,0,0,0,0|2,0,0]=4 10864 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2C 240690a_100011223789_100000716854 [0,2,0,0,0,0|2,0,0]=4 10865 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2Cl 11a_100015189233_100000716854 [0,2,0,0,0,0|2,0,0]=4 10866 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2Cl 1626a_100015189233_100000716854 [0,2,0,0,0,0|2,0,0]=4 10867 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2Cl 240690a_100015189233_100000716854 [0,2,0,0,0,0|2,0,0]=4 10868 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2F 11a_100000690088_100000716854 [0,2,0,0,0,0|2,0,0]=4 10869 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2F 1626a_100000690088_100000716854 [0,2,0,0,0,0|2,0,0]=4 10870 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NCc2ncccc2F 240690a_100000690088_100000716854 [0,2,0,0,0,0|2,0,0]=4 10871 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NNc2ccccc2Br 22a_100000241748_100000716854 [0,2,0,0,0,0|2,0,0]=4 10872 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NNc2ccccc2C 22a_100000184220_100000716854 [0,2,0,0,0,0|2,0,0]=4 10873 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NNc2ccccc2Cl 22a_100000683529_100000716854 [0,2,0,0,0,0|2,0,0]=4 10874 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NNc2ccccc2F 22a_100000239246_100000716854 [0,2,0,0,0,0|2,0,0]=4 10875 B21R2.358963 Cc1ccc(cc1)C=CC(=O)NNc2ccccc2I 22a_100011218156_100000716854 [0,2,0,0,0,0|2,0,0]=4 10876 B21R2.358963 Cc1ccc(cc1)CCC(=O)C=Cc2ccccc2Br 1458a_100000719032_100011713686 [0,2,0,0,0,0|1,0,0]=3 10877 B21R2.358963 Cc1ccc(cc1)CCC(=O)C=Cc2ccccc2Cl 1458a_100000720304_100011713686 [0,2,0,0,0,0|1,0,0]=3 10878 B21R2.358963 Cc1ccc(cc1)CCC(=O)C=Cc2ccccc2F 1458a_100016256065_100011713686 [0,2,0,0,0,0|1,0,0]=3 10879 B21R2.358963 Cc1ccc(cc1)CCC(=O)C=Cc2ccccc2O 1458a_100016263591_100011713686 [0,2,0,0,0,0|1,0,0]=3 10880 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2Br 11a_100000174908_100000719032 [0,2,0,0,0,0|1,0,0]=3 10881 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2Br 1626a_100000174908_100000719032 [0,2,0,0,0,0|1,0,0]=3 10882 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2Br 240690a_100000174908_100000719032 [0,2,0,0,0,0|1,0,0]=3 10883 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2C 1626a_100000174908_100016266485 [0,2,0,0,0,0|1,0,0]=3 10884 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2Cl 11a_100000174908_100000720304 [0,2,0,0,0,0|1,0,0]=3 10885 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2Cl 1626a_100000174908_100000720304 [0,2,0,0,0,0|1,0,0]=3 10886 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2Cl 240690a_100000174908_100000720304 [0,2,0,0,0,0|1,0,0]=3 10887 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2F 11a_100000174908_100016256065 [0,2,0,0,0,0|1,0,0]=3 10888 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2F 1626a_100000174908_100016256065 [0,2,0,0,0,0|1,0,0]=3 10889 B21R2.358963 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2F 240690a_100000174908_100016256065 [0,2,0,0,0,0|1,0,0]=3 10890 B21R2.358963 Cc1ccc(cc1)NNC(=O)C=Cc2ccccc2Br 22a_100000683527_100000719032 [0,2,0,0,0,0|2,0,0]=4 10891 B21R2.358963 Cc1ccc(cc1)NNC(=O)C=Cc2ccccc2C 22a_100000683527_100016266485 [0,2,0,0,0,0|2,0,0]=4 10892 B21R2.358963 Cc1ccc(cc1)NNC(=O)C=Cc2ccccc2Cl 22a_100000683527_100000720304 [0,2,0,0,0,0|2,0,0]=4 10893 B21R2.358963 Cc1ccc(cc1)NNC(=O)C=Cc2ccccc2F 22a_100000683527_100016256065 [0,2,0,0,0,0|2,0,0]=4 10894 B21R2.358963 Cc1ccc(cc1)NNC(=O)C=Cc2ccccc2O 22a_100000683527_100016263591 [0,2,0,0,0,0|2,0,0]=4 10895 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2Br 11a_100000740942_100000719032 [0,2,0,0,0,0|2,0,0]=4 10896 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2Br 1626a_100000740942_100000719032 [0,2,0,0,0,0|2,0,0]=4 10897 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2Br 240690a_100000740942_100000719032 [0,2,0,0,0,0|2,0,0]=4 10898 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2C 1626a_100000740942_100016266485 [0,2,0,0,0,0|2,0,0]=4 10899 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2Cl 11a_100000740942_100000720304 [0,2,0,0,0,0|2,0,0]=4 10900 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2Cl 1626a_100000740942_100000720304 [0,2,0,0,0,0|2,0,0]=4 10901 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2Cl 240690a_100000740942_100000720304 [0,2,0,0,0,0|2,0,0]=4 10902 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2F 11a_100000740942_100016256065 [0,2,0,0,0,0|2,0,0]=4 10903 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2F 1626a_100000740942_100016256065 [0,2,0,0,0,0|2,0,0]=4 10904 B21R2.358963 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2F 240690a_100000740942_100016256065 [0,2,0,0,0,0|2,0,0]=4 10905 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2Br 11a_100015187455_100000719032 [0,2,0,0,0,0|2,0,0]=4 10906 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2Br 1626a_100015187455_100000719032 [0,2,0,0,0,0|2,0,0]=4 10907 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2Br 240690a_100015187455_100000719032 [0,2,0,0,0,0|2,0,0]=4 10908 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2C 1626a_100015187455_100016266485 [0,2,0,0,0,0|2,0,0]=4 10909 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2Cl 11a_100015187455_100000720304 [0,2,0,0,0,0|2,0,0]=4 10910 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2Cl 1626a_100015187455_100000720304 [0,2,0,0,0,0|2,0,0]=4 10911 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2Cl 240690a_100015187455_100000720304 [0,2,0,0,0,0|2,0,0]=4 10912 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2F 11a_100015187455_100016256065 [0,2,0,0,0,0|2,0,0]=4 10913 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2F 1626a_100015187455_100016256065 [0,2,0,0,0,0|2,0,0]=4 10914 B21R2.358963 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2F 240690a_100015187455_100016256065 [0,2,0,0,0,0|2,0,0]=4 10915 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(cc2)Br 1626a_100000174875_100016266485 [0,2,0,0,0,0|1,0,0]=3 10916 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(cc2)Cl 1626a_100000174871_100016266485 [0,2,0,0,0,0|1,0,0]=3 10917 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(cc2)F 1626a_100000174882_100016266485 [0,2,0,0,0,0|1,0,0]=3 10918 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(cc2)I 1626a_100016989417_100016266485 [0,2,0,0,0,0|1,0,0]=3 10919 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(cn2)Br 1626a_100015188789_100016266485 [0,2,0,0,0,0|2,0,0]=4 10920 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(cn2)Cl 1626a_100000697193_100016266485 [0,2,0,0,0,0|2,0,0]=4 10921 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(cn2)F 1626a_100020620131_100016266485 [0,2,0,0,0,0|2,0,0]=4 10922 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(nc2)Cl 1626a_100000735879_100016266485 [0,2,0,0,0,0|2,0,0]=4 10923 B21R2.358963 Cc1ccccc1C=CC(=O)NCc2ccc(nc2)F 1626a_100000101913_100016266485 [0,2,0,0,0,0|2,0,0]=4 10924 B21R2.358963 Cc1ccccc1C=CC(=O)NNc2ccc(cc2)Br 22a_100000735608_100016266485 [0,2,0,0,0,0|2,0,0]=4 10925 B21R2.358963 Cc1ccccc1C=CC(=O)NNc2ccc(cc2)Cl 22a_100000683521_100016266485 [0,2,0,0,0,0|2,0,0]=4 10926 B21R2.358963 Cc1ccccc1C=CC(=O)NNc2ccc(cc2)F 22a_100000728448_100016266485 [0,2,0,0,0,0|2,0,0]=4 10927 B21R2.358963 Cc1ccccc1C=CC(=O)NNc2ccc(cc2)I 22a_100016988836_100016266485 [0,2,0,0,0,0|2,0,0]=4 10928 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cc2)Br 1458a_100016267368_100011713688 [0,2,0,0,0,0|1,0,0]=3 10929 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cc2)Br 6a_100000186029_100012183946 [0,2,0,0,0,0|1,0,0]=3 10930 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cc2)Cl 1458a_100000184863_100011713688 [0,2,0,0,0,0|1,0,0]=3 10931 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cc2)F 1458a_100000182136_100011713688 [0,2,0,0,0,0|1,0,0]=3 10932 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cc2)F 6a_100000210084_100012183946 [0,2,0,0,0,0|1,0,0]=3 10933 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cc2)I 1458a_100102526154_100011713688 [0,2,0,0,0,0|1,0,0]=3 10934 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cc2)I 6a_100000188517_100012183946 [0,2,0,0,0,0|1,0,0]=3 10935 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cn2)Br 6a_100000754260_100012183946 [0,2,0,0,0,0|2,0,0]=4 10936 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cn2)F 1458a_100020630499_100011713688 [0,2,0,0,0,0|2,0,0]=4 10937 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(cn2)F 6a_100011934744_100012183946 [0,2,0,0,0,0|2,0,0]=4 10938 B21R2.358963 Cc1ccccc1CCC(=O)C=Cc2ccc(nc2)Br 1458a_100020588214_100011713688 [0,2,0,0,0,0|2,0,0]=4 10939 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)Br 11a_100000174972_100016267368 [0,2,0,0,0,0|1,0,0]=3 10940 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)Br 1626a_100000174972_100016267368 [0,2,0,0,0,0|1,0,0]=3 10941 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)Cl 11a_100000174972_100000184863 [0,2,0,0,0,0|1,0,0]=3 10942 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000174972_100000184863 [0,2,0,0,0,0|1,0,0]=3 10943 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000174972_100000184863 [0,2,0,0,0,0|1,0,0]=3 10944 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)F 11a_100000174972_100000182136 [0,2,0,0,0,0|1,0,0]=3 10945 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)F 1626a_100000174972_100000182136 [0,2,0,0,0,0|1,0,0]=3 10946 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)F 240690a_100000174972_100000182136 [0,2,0,0,0,0|1,0,0]=3 10947 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)I 11a_100000174972_100102526154 [0,2,0,0,0,0|1,0,0]=3 10948 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)I 1626a_100000174972_100102526154 [0,2,0,0,0,0|1,0,0]=3 10949 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)I 240690a_100000174972_100102526154 [0,2,0,0,0,0|1,0,0]=3 10950 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cc2)O 240690a_100000174972_100016269017 [0,2,0,0,0,0|1,0,0]=3 10951 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cn2)F 11a_100000174972_100020630499 [0,2,0,0,0,0|2,0,0]=4 10952 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cn2)F 1626a_100000174972_100020630499 [0,2,0,0,0,0|2,0,0]=4 10953 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(cn2)F 240690a_100000174972_100020630499 [0,2,0,0,0,0|2,0,0]=4 10954 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(nc2)Br 11a_100000174972_100020588214 [0,2,0,0,0,0|2,0,0]=4 10955 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(nc2)Br 1626a_100000174972_100020588214 [0,2,0,0,0,0|2,0,0]=4 10956 B21R2.358963 Cc1ccccc1CNC(=O)C=Cc2ccc(nc2)Br 240690a_100000174972_100020588214 [0,2,0,0,0,0|2,0,0]=4 10957 B21R2.358963 Cc1ccccc1NNC(=O)C=Cc2ccc(cc2)Br 22a_100000184220_100016267368 [0,2,0,0,0,0|2,0,0]=4 10958 B21R2.358963 Cc1ccccc1NNC(=O)C=Cc2ccc(cc2)Cl 22a_100000184220_100000184863 [0,2,0,0,0,0|2,0,0]=4 10959 B21R2.358963 Cc1ccccc1NNC(=O)C=Cc2ccc(cc2)F 22a_100000184220_100000182136 [0,2,0,0,0,0|2,0,0]=4 10960 B21R2.358963 Cc1ccccc1NNC(=O)C=Cc2ccc(cc2)I 22a_100000184220_100102526154 [0,2,0,0,0,0|2,0,0]=4 10961 B21R2.358963 Cc1ccccc1NNC(=O)C=Cc2ccc(cc2)O 22a_100000184220_100016269017 [0,2,0,0,0,0|2,0,0]=4 10962 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)Br 11a_100011223789_100016267368 [0,2,0,0,0,0|2,0,0]=4 10963 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)Br 1626a_100011223789_100016267368 [0,2,0,0,0,0|2,0,0]=4 10964 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)Cl 11a_100011223789_100000184863 [0,2,0,0,0,0|2,0,0]=4 10965 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100011223789_100000184863 [0,2,0,0,0,0|2,0,0]=4 10966 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100011223789_100000184863 [0,2,0,0,0,0|2,0,0]=4 10967 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)F 11a_100011223789_100000182136 [0,2,0,0,0,0|2,0,0]=4 10968 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)F 1626a_100011223789_100000182136 [0,2,0,0,0,0|2,0,0]=4 10969 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)F 240690a_100011223789_100000182136 [0,2,0,0,0,0|2,0,0]=4 10970 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)I 11a_100011223789_100102526154 [0,2,0,0,0,0|2,0,0]=4 10971 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)I 1626a_100011223789_100102526154 [0,2,0,0,0,0|2,0,0]=4 10972 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)I 240690a_100011223789_100102526154 [0,2,0,0,0,0|2,0,0]=4 10973 B21R2.358963 Cc1cccnc1CNC(=O)C=Cc2ccc(cc2)O 240690a_100011223789_100016269017 [0,2,0,0,0,0|2,0,0]=4 10974 B21R2.358963 Cc1ccncc1CNC(=O)C=Cc2ccc(cc2)Br 11a_100011997553_100016267368 [0,2,0,0,0,0|2,0,0]=4 10975 B21R2.358963 Cc1ccncc1CNC(=O)C=Cc2ccc(cc2)Cl 11a_100011997553_100000184863 [0,2,0,0,0,0|2,0,0]=4 10976 B21R2.358963 Cc1ccncc1CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100011997553_100000184863 [0,2,0,0,0,0|2,0,0]=4 10977 B21R2.358963 Cc1ccncc1CNC(=O)C=Cc2ccc(cc2)F 11a_100011997553_100000182136 [0,2,0,0,0,0|2,0,0]=4 10978 B21R2.358963 Cc1ccncc1CNC(=O)C=Cc2ccc(cc2)F 240690a_100011997553_100000182136 [0,2,0,0,0,0|2,0,0]=4 10979 B21R2.358963 Cc1ccncc1CNC(=O)C=Cc2ccc(cc2)I 11a_100011997553_100102526154 [0,2,0,0,0,0|2,0,0]=4 10980 B21R2.358963 Cc1ccncc1CNC(=O)C=Cc2ccc(cc2)I 240690a_100011997553_100102526154 [0,2,0,0,0,0|2,0,0]=4 10981 B21R2.358963 Cc1ccncc1CNC(=O)C=Cc2ccc(cc2)O 240690a_100011997553_100016269017 [0,2,0,0,0,0|2,0,0]=4 10982 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)Br 11a_100000708811_100016267368 [0,2,0,0,0,0|2,0,0]=4 10983 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)Br 1626a_100000708811_100016267368 [0,2,0,0,0,0|2,0,0]=4 10984 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)Cl 11a_100000708811_100000184863 [0,2,0,0,0,0|2,0,0]=4 10985 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000708811_100000184863 [0,2,0,0,0,0|2,0,0]=4 10986 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000708811_100000184863 [0,2,0,0,0,0|2,0,0]=4 10987 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)F 11a_100000708811_100000182136 [0,2,0,0,0,0|2,0,0]=4 10988 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)F 1626a_100000708811_100000182136 [0,2,0,0,0,0|2,0,0]=4 10989 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)F 240690a_100000708811_100000182136 [0,2,0,0,0,0|2,0,0]=4 10990 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)I 11a_100000708811_100102526154 [0,2,0,0,0,0|2,0,0]=4 10991 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)I 1626a_100000708811_100102526154 [0,2,0,0,0,0|2,0,0]=4 10992 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)I 240690a_100000708811_100102526154 [0,2,0,0,0,0|2,0,0]=4 10993 B21R2.358963 Cc1cnccc1CNC(=O)C=Cc2ccc(cc2)O 240690a_100000708811_100016269017 [0,2,0,0,0,0|2,0,0]=4 10994 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)CCc2ccccc2Br 1458a_100016267368_100012161201 [0,2,0,0,0,0|1,0,0]=3 10995 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)CCc2ccccc2Cl 1458a_100016267368_100011713703 [0,2,0,0,0,0|1,0,0]=3 10996 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)CCc2ccccc2F 1458a_100016267368_100000720011 [0,2,0,0,0,0|1,0,0]=3 10997 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)CCc2ccccc2O 1458a_100016267368_100000722297 [0,2,0,0,0,0|1,0,0]=3 10998 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2Br 11a_100000689332_100016267368 [0,2,0,0,0,0|1,0,0]=3 10999 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2Br 1626a_100000689332_100016267368 [0,2,0,0,0,0|1,0,0]=3 11000 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2Cl 11a_100000174879_100016267368 [0,2,0,0,0,0|1,0,0]=3 11001 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2Cl 1626a_100000174879_100016267368 [0,2,0,0,0,0|1,0,0]=3 11002 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2F 11a_100000174869_100016267368 [0,2,0,0,0,0|1,0,0]=3 11003 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2F 1626a_100000174869_100016267368 [0,2,0,0,0,0|1,0,0]=3 11004 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2I 11a_100015347259_100016267368 [0,2,0,0,0,0|1,0,0]=3 11005 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2I 1626a_100015347259_100016267368 [0,2,0,0,0,0|1,0,0]=3 11006 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2cccnc2Br 11a_100009818023_100016267368 [0,2,0,0,0,0|2,0,0]=4 11007 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2cccnc2Cl 11a_100015189234_100016267368 [0,2,0,0,0,0|2,0,0]=4 11008 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2cccnc2Cl 1626a_100015189234_100016267368 [0,2,0,0,0,0|2,0,0]=4 11009 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2cccnc2F 11a_100000724633_100016267368 [0,2,0,0,0,0|2,0,0]=4 11010 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2cccnc2F 1626a_100000724633_100016267368 [0,2,0,0,0,0|2,0,0]=4 11011 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccncc2Br 11a_100020640021_100016267368 [0,2,0,0,0,0|2,0,0]=4 11012 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccncc2F 11a_100011935246_100016267368 [0,2,0,0,0,0|2,0,0]=4 11013 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ccncc2F 1626a_100011935246_100016267368 [0,2,0,0,0,0|2,0,0]=4 11014 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ncccc2Br 11a_100020591323_100016267368 [0,2,0,0,0,0|2,0,0]=4 11015 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ncccc2Cl 11a_100015189233_100016267368 [0,2,0,0,0,0|2,0,0]=4 11016 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ncccc2Cl 1626a_100015189233_100016267368 [0,2,0,0,0,0|2,0,0]=4 11017 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ncccc2F 11a_100000690088_100016267368 [0,2,0,0,0,0|2,0,0]=4 11018 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NCc2ncccc2F 1626a_100000690088_100016267368 [0,2,0,0,0,0|2,0,0]=4 11019 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NNc2ccccc2Br 22a_100000241748_100016267368 [0,2,0,0,0,0|2,0,0]=4 11020 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NNc2ccccc2Cl 22a_100000683529_100016267368 [0,2,0,0,0,0|2,0,0]=4 11021 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NNc2ccccc2F 22a_100000239246_100016267368 [0,2,0,0,0,0|2,0,0]=4 11022 B21R2.358963 O=C(C=Cc1ccc(cc1)Br)NNc2ccccc2I 22a_100011218156_100016267368 [0,2,0,0,0,0|2,0,0]=4 11023 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)CCc2ccccc2Br 1458a_100000184863_100012161201 [0,2,0,0,0,0|1,0,0]=3 11024 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)CCc2ccccc2Cl 1458a_100000184863_100011713703 [0,2,0,0,0,0|1,0,0]=3 11025 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)CCc2ccccc2F 1458a_100000184863_100000720011 [0,2,0,0,0,0|1,0,0]=3 11026 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)CCc2ccccc2O 1458a_100000184863_100000722297 [0,2,0,0,0,0|1,0,0]=3 11027 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2Br 11a_100000689332_100000184863 [0,2,0,0,0,0|1,0,0]=3 11028 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2Br 1626a_100000689332_100000184863 [0,2,0,0,0,0|1,0,0]=3 11029 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2Br 240690a_100000689332_100000184863 [0,2,0,0,0,0|1,0,0]=3 11030 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2Cl 11a_100000174879_100000184863 [0,2,0,0,0,0|1,0,0]=3 11031 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2Cl 1626a_100000174879_100000184863 [0,2,0,0,0,0|1,0,0]=3 11032 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2Cl 240690a_100000174879_100000184863 [0,2,0,0,0,0|1,0,0]=3 11033 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2F 11a_100000174869_100000184863 [0,2,0,0,0,0|1,0,0]=3 11034 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2F 1626a_100000174869_100000184863 [0,2,0,0,0,0|1,0,0]=3 11035 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2F 240690a_100000174869_100000184863 [0,2,0,0,0,0|1,0,0]=3 11036 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2I 11a_100015347259_100000184863 [0,2,0,0,0,0|1,0,0]=3 11037 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2I 1626a_100015347259_100000184863 [0,2,0,0,0,0|1,0,0]=3 11038 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2I 240690a_100015347259_100000184863 [0,2,0,0,0,0|1,0,0]=3 11039 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2O 240690a_100000185550_100000184863 [0,2,0,0,0,0|1,0,0]=3 11040 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2Br 11a_100009818023_100000184863 [0,2,0,0,0,0|2,0,0]=4 11041 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2Br 240690a_100009818023_100000184863 [0,2,0,0,0,0|2,0,0]=4 11042 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2Cl 11a_100015189234_100000184863 [0,2,0,0,0,0|2,0,0]=4 11043 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2Cl 1626a_100015189234_100000184863 [0,2,0,0,0,0|2,0,0]=4 11044 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2Cl 240690a_100015189234_100000184863 [0,2,0,0,0,0|2,0,0]=4 11045 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2F 11a_100000724633_100000184863 [0,2,0,0,0,0|2,0,0]=4 11046 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2F 1626a_100000724633_100000184863 [0,2,0,0,0,0|2,0,0]=4 11047 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2F 240690a_100000724633_100000184863 [0,2,0,0,0,0|2,0,0]=4 11048 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2Br 11a_100020640021_100000184863 [0,2,0,0,0,0|2,0,0]=4 11049 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2Br 240690a_100020640021_100000184863 [0,2,0,0,0,0|2,0,0]=4 11050 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2F 11a_100011935246_100000184863 [0,2,0,0,0,0|2,0,0]=4 11051 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2F 1626a_100011935246_100000184863 [0,2,0,0,0,0|2,0,0]=4 11052 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2F 240690a_100011935246_100000184863 [0,2,0,0,0,0|2,0,0]=4 11053 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccc2Br 11a_100020591323_100000184863 [0,2,0,0,0,0|2,0,0]=4 11054 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccc2Br 240690a_100020591323_100000184863 [0,2,0,0,0,0|2,0,0]=4 11055 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccc2Cl 11a_100015189233_100000184863 [0,2,0,0,0,0|2,0,0]=4 11056 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccc2Cl 1626a_100015189233_100000184863 [0,2,0,0,0,0|2,0,0]=4 11057 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccc2Cl 240690a_100015189233_100000184863 [0,2,0,0,0,0|2,0,0]=4 11058 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccc2F 11a_100000690088_100000184863 [0,2,0,0,0,0|2,0,0]=4 11059 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccc2F 1626a_100000690088_100000184863 [0,2,0,0,0,0|2,0,0]=4 11060 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NCc2ncccc2F 240690a_100000690088_100000184863 [0,2,0,0,0,0|2,0,0]=4 11061 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NNc2ccccc2Br 22a_100000241748_100000184863 [0,2,0,0,0,0|2,0,0]=4 11062 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NNc2ccccc2Cl 22a_100000683529_100000184863 [0,2,0,0,0,0|2,0,0]=4 11063 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NNc2ccccc2F 22a_100000239246_100000184863 [0,2,0,0,0,0|2,0,0]=4 11064 B21R2.358963 O=C(C=Cc1ccc(cc1)Cl)NNc2ccccc2I 22a_100011218156_100000184863 [0,2,0,0,0,0|2,0,0]=4 11065 B21R2.358963 O=C(C=Cc1ccc(cc1)F)CCc2ccccc2Br 1458a_100000182136_100012161201 [0,2,0,0,0,0|1,0,0]=3 11066 B21R2.358963 O=C(C=Cc1ccc(cc1)F)CCc2ccccc2Cl 1458a_100000182136_100011713703 [0,2,0,0,0,0|1,0,0]=3 11067 B21R2.358963 O=C(C=Cc1ccc(cc1)F)CCc2ccccc2F 1458a_100000182136_100000720011 [0,2,0,0,0,0|1,0,0]=3 11068 B21R2.358963 O=C(C=Cc1ccc(cc1)F)CCc2ccccc2O 1458a_100000182136_100000722297 [0,2,0,0,0,0|1,0,0]=3 11069 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2Br 11a_100000689332_100000182136 [0,2,0,0,0,0|1,0,0]=3 11070 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2Br 1626a_100000689332_100000182136 [0,2,0,0,0,0|1,0,0]=3 11071 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2Br 240690a_100000689332_100000182136 [0,2,0,0,0,0|1,0,0]=3 11072 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2Cl 11a_100000174879_100000182136 [0,2,0,0,0,0|1,0,0]=3 11073 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2Cl 1626a_100000174879_100000182136 [0,2,0,0,0,0|1,0,0]=3 11074 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2Cl 240690a_100000174879_100000182136 [0,2,0,0,0,0|1,0,0]=3 11075 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2F 11a_100000174869_100000182136 [0,2,0,0,0,0|1,0,0]=3 11076 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2F 1626a_100000174869_100000182136 [0,2,0,0,0,0|1,0,0]=3 11077 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2F 240690a_100000174869_100000182136 [0,2,0,0,0,0|1,0,0]=3 11078 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2I 11a_100015347259_100000182136 [0,2,0,0,0,0|1,0,0]=3 11079 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2I 1626a_100015347259_100000182136 [0,2,0,0,0,0|1,0,0]=3 11080 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2I 240690a_100015347259_100000182136 [0,2,0,0,0,0|1,0,0]=3 11081 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2O 240690a_100000185550_100000182136 [0,2,0,0,0,0|1,0,0]=3 11082 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2Br 11a_100009818023_100000182136 [0,2,0,0,0,0|2,0,0]=4 11083 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2Br 240690a_100009818023_100000182136 [0,2,0,0,0,0|2,0,0]=4 11084 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2Cl 11a_100015189234_100000182136 [0,2,0,0,0,0|2,0,0]=4 11085 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2Cl 1626a_100015189234_100000182136 [0,2,0,0,0,0|2,0,0]=4 11086 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2Cl 240690a_100015189234_100000182136 [0,2,0,0,0,0|2,0,0]=4 11087 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2F 11a_100000724633_100000182136 [0,2,0,0,0,0|2,0,0]=4 11088 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2F 1626a_100000724633_100000182136 [0,2,0,0,0,0|2,0,0]=4 11089 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2F 240690a_100000724633_100000182136 [0,2,0,0,0,0|2,0,0]=4 11090 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2Br 11a_100020640021_100000182136 [0,2,0,0,0,0|2,0,0]=4 11091 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2Br 240690a_100020640021_100000182136 [0,2,0,0,0,0|2,0,0]=4 11092 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2F 11a_100011935246_100000182136 [0,2,0,0,0,0|2,0,0]=4 11093 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2F 1626a_100011935246_100000182136 [0,2,0,0,0,0|2,0,0]=4 11094 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2F 240690a_100011935246_100000182136 [0,2,0,0,0,0|2,0,0]=4 11095 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ncccc2Br 11a_100020591323_100000182136 [0,2,0,0,0,0|2,0,0]=4 11096 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ncccc2Br 240690a_100020591323_100000182136 [0,2,0,0,0,0|2,0,0]=4 11097 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ncccc2Cl 11a_100015189233_100000182136 [0,2,0,0,0,0|2,0,0]=4 11098 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ncccc2Cl 1626a_100015189233_100000182136 [0,2,0,0,0,0|2,0,0]=4 11099 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ncccc2Cl 240690a_100015189233_100000182136 [0,2,0,0,0,0|2,0,0]=4 11100 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ncccc2F 11a_100000690088_100000182136 [0,2,0,0,0,0|2,0,0]=4 11101 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ncccc2F 1626a_100000690088_100000182136 [0,2,0,0,0,0|2,0,0]=4 11102 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NCc2ncccc2F 240690a_100000690088_100000182136 [0,2,0,0,0,0|2,0,0]=4 11103 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NNc2ccccc2Br 22a_100000241748_100000182136 [0,2,0,0,0,0|2,0,0]=4 11104 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NNc2ccccc2Cl 22a_100000683529_100000182136 [0,2,0,0,0,0|2,0,0]=4 11105 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NNc2ccccc2F 22a_100000239246_100000182136 [0,2,0,0,0,0|2,0,0]=4 11106 B21R2.358963 O=C(C=Cc1ccc(cc1)F)NNc2ccccc2I 22a_100011218156_100000182136 [0,2,0,0,0,0|2,0,0]=4 11107 B21R2.358963 O=C(C=Cc1ccc(cc1)I)CCc2ccccc2Br 1458a_100102526154_100012161201 [0,2,0,0,0,0|1,0,0]=3 11108 B21R2.358963 O=C(C=Cc1ccc(cc1)I)CCc2ccccc2Cl 1458a_100102526154_100011713703 [0,2,0,0,0,0|1,0,0]=3 11109 B21R2.358963 O=C(C=Cc1ccc(cc1)I)CCc2ccccc2F 1458a_100102526154_100000720011 [0,2,0,0,0,0|1,0,0]=3 11110 B21R2.358963 O=C(C=Cc1ccc(cc1)I)CCc2ccccc2O 1458a_100102526154_100000722297 [0,2,0,0,0,0|1,0,0]=3 11111 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2Br 11a_100000689332_100102526154 [0,2,0,0,0,0|1,0,0]=3 11112 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2Br 1626a_100000689332_100102526154 [0,2,0,0,0,0|1,0,0]=3 11113 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2Br 240690a_100000689332_100102526154 [0,2,0,0,0,0|1,0,0]=3 11114 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2Cl 11a_100000174879_100102526154 [0,2,0,0,0,0|1,0,0]=3 11115 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2Cl 1626a_100000174879_100102526154 [0,2,0,0,0,0|1,0,0]=3 11116 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2Cl 240690a_100000174879_100102526154 [0,2,0,0,0,0|1,0,0]=3 11117 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2F 11a_100000174869_100102526154 [0,2,0,0,0,0|1,0,0]=3 11118 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2F 1626a_100000174869_100102526154 [0,2,0,0,0,0|1,0,0]=3 11119 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2F 240690a_100000174869_100102526154 [0,2,0,0,0,0|1,0,0]=3 11120 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2I 11a_100015347259_100102526154 [0,2,0,0,0,0|1,0,0]=3 11121 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2I 1626a_100015347259_100102526154 [0,2,0,0,0,0|1,0,0]=3 11122 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2I 240690a_100015347259_100102526154 [0,2,0,0,0,0|1,0,0]=3 11123 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2O 240690a_100000185550_100102526154 [0,2,0,0,0,0|1,0,0]=3 11124 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2Br 11a_100009818023_100102526154 [0,2,0,0,0,0|2,0,0]=4 11125 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2Br 240690a_100009818023_100102526154 [0,2,0,0,0,0|2,0,0]=4 11126 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2Cl 11a_100015189234_100102526154 [0,2,0,0,0,0|2,0,0]=4 11127 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2Cl 1626a_100015189234_100102526154 [0,2,0,0,0,0|2,0,0]=4 11128 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2Cl 240690a_100015189234_100102526154 [0,2,0,0,0,0|2,0,0]=4 11129 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2F 11a_100000724633_100102526154 [0,2,0,0,0,0|2,0,0]=4 11130 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2F 1626a_100000724633_100102526154 [0,2,0,0,0,0|2,0,0]=4 11131 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2F 240690a_100000724633_100102526154 [0,2,0,0,0,0|2,0,0]=4 11132 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2Br 11a_100020640021_100102526154 [0,2,0,0,0,0|2,0,0]=4 11133 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2Br 240690a_100020640021_100102526154 [0,2,0,0,0,0|2,0,0]=4 11134 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2F 11a_100011935246_100102526154 [0,2,0,0,0,0|2,0,0]=4 11135 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2F 1626a_100011935246_100102526154 [0,2,0,0,0,0|2,0,0]=4 11136 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2F 240690a_100011935246_100102526154 [0,2,0,0,0,0|2,0,0]=4 11137 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ncccc2Br 11a_100020591323_100102526154 [0,2,0,0,0,0|2,0,0]=4 11138 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ncccc2Br 240690a_100020591323_100102526154 [0,2,0,0,0,0|2,0,0]=4 11139 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ncccc2Cl 11a_100015189233_100102526154 [0,2,0,0,0,0|2,0,0]=4 11140 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ncccc2Cl 1626a_100015189233_100102526154 [0,2,0,0,0,0|2,0,0]=4 11141 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ncccc2Cl 240690a_100015189233_100102526154 [0,2,0,0,0,0|2,0,0]=4 11142 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ncccc2F 11a_100000690088_100102526154 [0,2,0,0,0,0|2,0,0]=4 11143 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ncccc2F 1626a_100000690088_100102526154 [0,2,0,0,0,0|2,0,0]=4 11144 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NCc2ncccc2F 240690a_100000690088_100102526154 [0,2,0,0,0,0|2,0,0]=4 11145 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NNc2ccccc2Br 22a_100000241748_100102526154 [0,2,0,0,0,0|2,0,0]=4 11146 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NNc2ccccc2Cl 22a_100000683529_100102526154 [0,2,0,0,0,0|2,0,0]=4 11147 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NNc2ccccc2F 22a_100000239246_100102526154 [0,2,0,0,0,0|2,0,0]=4 11148 B21R2.358963 O=C(C=Cc1ccc(cc1)I)NNc2ccccc2I 22a_100011218156_100102526154 [0,2,0,0,0,0|2,0,0]=4 11149 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ccccc2Br 240690a_100000689332_100016269017 [0,2,0,0,0,0|1,0,0]=3 11150 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ccccc2Cl 240690a_100000174879_100016269017 [0,2,0,0,0,0|1,0,0]=3 11151 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ccccc2F 240690a_100000174869_100016269017 [0,2,0,0,0,0|1,0,0]=3 11152 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ccccc2I 240690a_100015347259_100016269017 [0,2,0,0,0,0|1,0,0]=3 11153 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ccccc2O 240690a_100000185550_100016269017 [0,2,0,0,0,0|1,0,0]=3 11154 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2cccnc2Br 240690a_100009818023_100016269017 [0,2,0,0,0,0|2,0,0]=4 11155 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2cccnc2Cl 240690a_100015189234_100016269017 [0,2,0,0,0,0|2,0,0]=4 11156 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2cccnc2F 240690a_100000724633_100016269017 [0,2,0,0,0,0|2,0,0]=4 11157 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ccncc2Br 240690a_100020640021_100016269017 [0,2,0,0,0,0|2,0,0]=4 11158 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ccncc2F 240690a_100011935246_100016269017 [0,2,0,0,0,0|2,0,0]=4 11159 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ncccc2Br 240690a_100020591323_100016269017 [0,2,0,0,0,0|2,0,0]=4 11160 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ncccc2Cl 240690a_100015189233_100016269017 [0,2,0,0,0,0|2,0,0]=4 11161 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NCc2ncccc2F 240690a_100000690088_100016269017 [0,2,0,0,0,0|2,0,0]=4 11162 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NNc2ccccc2Br 22a_100000241748_100016269017 [0,2,0,0,0,0|2,0,0]=4 11163 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NNc2ccccc2Cl 22a_100000683529_100016269017 [0,2,0,0,0,0|2,0,0]=4 11164 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NNc2ccccc2F 22a_100000239246_100016269017 [0,2,0,0,0,0|2,0,0]=4 11165 B21R2.358963 O=C(C=Cc1ccc(cc1)O)NNc2ccccc2I 22a_100011218156_100016269017 [0,2,0,0,0,0|2,0,0]=4 11166 B21R2.358963 O=C(C=Cc1ccc(cn1)F)CCc2ccccc2Br 1458a_100020630499_100012161201 [0,2,0,0,0,0|2,0,0]=4 11167 B21R2.358963 O=C(C=Cc1ccc(cn1)F)CCc2ccccc2Cl 1458a_100020630499_100011713703 [0,2,0,0,0,0|2,0,0]=4 11168 B21R2.358963 O=C(C=Cc1ccc(cn1)F)CCc2ccccc2F 1458a_100020630499_100000720011 [0,2,0,0,0,0|2,0,0]=4 11169 B21R2.358963 O=C(C=Cc1ccc(cn1)F)CCc2ccccc2O 1458a_100020630499_100000722297 [0,2,0,0,0,0|2,0,0]=4 11170 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2Br 11a_100000689332_100020630499 [0,2,0,0,0,0|2,0,0]=4 11171 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2Br 1626a_100000689332_100020630499 [0,2,0,0,0,0|2,0,0]=4 11172 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2Br 240690a_100000689332_100020630499 [0,2,0,0,0,0|2,0,0]=4 11173 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2Cl 11a_100000174879_100020630499 [0,2,0,0,0,0|2,0,0]=4 11174 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2Cl 1626a_100000174879_100020630499 [0,2,0,0,0,0|2,0,0]=4 11175 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2Cl 240690a_100000174879_100020630499 [0,2,0,0,0,0|2,0,0]=4 11176 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2F 11a_100000174869_100020630499 [0,2,0,0,0,0|2,0,0]=4 11177 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2F 1626a_100000174869_100020630499 [0,2,0,0,0,0|2,0,0]=4 11178 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2F 240690a_100000174869_100020630499 [0,2,0,0,0,0|2,0,0]=4 11179 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2I 11a_100015347259_100020630499 [0,2,0,0,0,0|2,0,0]=4 11180 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2I 1626a_100015347259_100020630499 [0,2,0,0,0,0|2,0,0]=4 11181 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2I 240690a_100015347259_100020630499 [0,2,0,0,0,0|2,0,0]=4 11182 B21R2.358963 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2O 240690a_100000185550_100020630499 [0,2,0,0,0,0|2,0,0]=4 11183 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)CCc2ccccc2Br 1458a_100020588214_100012161201 [0,2,0,0,0,0|2,0,0]=4 11184 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)CCc2ccccc2Cl 1458a_100020588214_100011713703 [0,2,0,0,0,0|2,0,0]=4 11185 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)CCc2ccccc2F 1458a_100020588214_100000720011 [0,2,0,0,0,0|2,0,0]=4 11186 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)CCc2ccccc2O 1458a_100020588214_100000722297 [0,2,0,0,0,0|2,0,0]=4 11187 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2Br 11a_100000689332_100020588214 [0,2,0,0,0,0|2,0,0]=4 11188 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2Br 1626a_100000689332_100020588214 [0,2,0,0,0,0|2,0,0]=4 11189 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2Br 240690a_100000689332_100020588214 [0,2,0,0,0,0|2,0,0]=4 11190 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2Cl 11a_100000174879_100020588214 [0,2,0,0,0,0|2,0,0]=4 11191 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2Cl 1626a_100000174879_100020588214 [0,2,0,0,0,0|2,0,0]=4 11192 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2Cl 240690a_100000174879_100020588214 [0,2,0,0,0,0|2,0,0]=4 11193 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2F 11a_100000174869_100020588214 [0,2,0,0,0,0|2,0,0]=4 11194 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2F 1626a_100000174869_100020588214 [0,2,0,0,0,0|2,0,0]=4 11195 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2F 240690a_100000174869_100020588214 [0,2,0,0,0,0|2,0,0]=4 11196 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2I 11a_100015347259_100020588214 [0,2,0,0,0,0|2,0,0]=4 11197 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2I 1626a_100015347259_100020588214 [0,2,0,0,0,0|2,0,0]=4 11198 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2I 240690a_100015347259_100020588214 [0,2,0,0,0,0|2,0,0]=4 11199 B21R2.358963 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2O 240690a_100000185550_100020588214 [0,2,0,0,0,0|2,0,0]=4 11200 B21R2.358963 O=C(C=Cc1ccccc1Br)CCc2ccc(cc2)Br 1458a_100000719032_100011740612 [0,2,0,0,0,0|1,0,0]=3 11201 B21R2.358963 O=C(C=Cc1ccccc1Br)CCc2ccc(cc2)Cl 1458a_100000719032_100011713675 [0,2,0,0,0,0|1,0,0]=3 11202 B21R2.358963 O=C(C=Cc1ccccc1Br)CCc2ccc(cc2)F 1458a_100000719032_100011217392 [0,2,0,0,0,0|1,0,0]=3 11203 B21R2.358963 O=C(C=Cc1ccccc1Br)CCc2ccc(cc2)O 1458a_100000719032_100009816426 [0,2,0,0,0,0|1,0,0]=3 11204 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)Br 11a_100000174875_100000719032 [0,2,0,0,0,0|1,0,0]=3 11205 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)Br 1626a_100000174875_100000719032 [0,2,0,0,0,0|1,0,0]=3 11206 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)Br 240690a_100000174875_100000719032 [0,2,0,0,0,0|1,0,0]=3 11207 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)Cl 11a_100000174871_100000719032 [0,2,0,0,0,0|1,0,0]=3 11208 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)Cl 1626a_100000174871_100000719032 [0,2,0,0,0,0|1,0,0]=3 11209 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)Cl 240690a_100000174871_100000719032 [0,2,0,0,0,0|1,0,0]=3 11210 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)F 11a_100000174882_100000719032 [0,2,0,0,0,0|1,0,0]=3 11211 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)F 1626a_100000174882_100000719032 [0,2,0,0,0,0|1,0,0]=3 11212 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)F 240690a_100000174882_100000719032 [0,2,0,0,0,0|1,0,0]=3 11213 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)I 11a_100016989417_100000719032 [0,2,0,0,0,0|1,0,0]=3 11214 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)I 1626a_100016989417_100000719032 [0,2,0,0,0,0|1,0,0]=3 11215 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)I 240690a_100016989417_100000719032 [0,2,0,0,0,0|1,0,0]=3 11216 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cc2)O 240690a_100000185549_100000719032 [0,2,0,0,0,0|1,0,0]=3 11217 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)Br 11a_100015188789_100000719032 [0,2,0,0,0,0|2,0,0]=4 11218 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)Br 1626a_100015188789_100000719032 [0,2,0,0,0,0|2,0,0]=4 11219 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)Br 240690a_100015188789_100000719032 [0,2,0,0,0,0|2,0,0]=4 11220 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)Cl 11a_100000697193_100000719032 [0,2,0,0,0,0|2,0,0]=4 11221 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)Cl 1626a_100000697193_100000719032 [0,2,0,0,0,0|2,0,0]=4 11222 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)Cl 240690a_100000697193_100000719032 [0,2,0,0,0,0|2,0,0]=4 11223 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)F 11a_100020620131_100000719032 [0,2,0,0,0,0|2,0,0]=4 11224 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)F 1626a_100020620131_100000719032 [0,2,0,0,0,0|2,0,0]=4 11225 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)F 240690a_100020620131_100000719032 [0,2,0,0,0,0|2,0,0]=4 11226 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(cn2)O 240690a_100020605196_100000719032 [0,2,0,0,0,0|2,0,0]=4 11227 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)Br 11a_100009817727_100000719032 [0,2,0,0,0,0|2,0,0]=4 11228 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)Br 240690a_100009817727_100000719032 [0,2,0,0,0,0|2,0,0]=4 11229 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)Cl 11a_100000735879_100000719032 [0,2,0,0,0,0|2,0,0]=4 11230 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)Cl 1626a_100000735879_100000719032 [0,2,0,0,0,0|2,0,0]=4 11231 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)Cl 240690a_100000735879_100000719032 [0,2,0,0,0,0|2,0,0]=4 11232 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)F 11a_100000101913_100000719032 [0,2,0,0,0,0|2,0,0]=4 11233 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)F 1626a_100000101913_100000719032 [0,2,0,0,0,0|2,0,0]=4 11234 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)F 240690a_100000101913_100000719032 [0,2,0,0,0,0|2,0,0]=4 11235 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)O 11a_100000757128_100000719032 [0,2,0,0,0,0|2,0,0]=4 11236 B21R2.358963 O=C(C=Cc1ccccc1Br)NCc2ccc(nc2)O 240690a_100000757128_100000719032 [0,2,0,0,0,0|2,0,0]=4 11237 B21R2.358963 O=C(C=Cc1ccccc1Br)NNc2ccc(cc2)Br 22a_100000735608_100000719032 [0,2,0,0,0,0|2,0,0]=4 11238 B21R2.358963 O=C(C=Cc1ccccc1Br)NNc2ccc(cc2)Cl 22a_100000683521_100000719032 [0,2,0,0,0,0|2,0,0]=4 11239 B21R2.358963 O=C(C=Cc1ccccc1Br)NNc2ccc(cc2)F 22a_100000728448_100000719032 [0,2,0,0,0,0|2,0,0]=4 11240 B21R2.358963 O=C(C=Cc1ccccc1Br)NNc2ccc(cc2)I 22a_100016988836_100000719032 [0,2,0,0,0,0|2,0,0]=4 11241 B21R2.358963 O=C(C=Cc1ccccc1Cl)CCc2ccc(cc2)Br 1458a_100000720304_100011740612 [0,2,0,0,0,0|1,0,0]=3 11242 B21R2.358963 O=C(C=Cc1ccccc1Cl)CCc2ccc(cc2)Cl 1458a_100000720304_100011713675 [0,2,0,0,0,0|1,0,0]=3 11243 B21R2.358963 O=C(C=Cc1ccccc1Cl)CCc2ccc(cc2)F 1458a_100000720304_100011217392 [0,2,0,0,0,0|1,0,0]=3 11244 B21R2.358963 O=C(C=Cc1ccccc1Cl)CCc2ccc(cc2)O 1458a_100000720304_100009816426 [0,2,0,0,0,0|1,0,0]=3 11245 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)Br 11a_100000174875_100000720304 [0,2,0,0,0,0|1,0,0]=3 11246 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)Br 1626a_100000174875_100000720304 [0,2,0,0,0,0|1,0,0]=3 11247 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)Br 240690a_100000174875_100000720304 [0,2,0,0,0,0|1,0,0]=3 11248 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)Cl 11a_100000174871_100000720304 [0,2,0,0,0,0|1,0,0]=3 11249 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)Cl 1626a_100000174871_100000720304 [0,2,0,0,0,0|1,0,0]=3 11250 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)Cl 240690a_100000174871_100000720304 [0,2,0,0,0,0|1,0,0]=3 11251 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)F 11a_100000174882_100000720304 [0,2,0,0,0,0|1,0,0]=3 11252 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)F 1626a_100000174882_100000720304 [0,2,0,0,0,0|1,0,0]=3 11253 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)F 240690a_100000174882_100000720304 [0,2,0,0,0,0|1,0,0]=3 11254 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)I 11a_100016989417_100000720304 [0,2,0,0,0,0|1,0,0]=3 11255 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)I 1626a_100016989417_100000720304 [0,2,0,0,0,0|1,0,0]=3 11256 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)I 240690a_100016989417_100000720304 [0,2,0,0,0,0|1,0,0]=3 11257 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cc2)O 240690a_100000185549_100000720304 [0,2,0,0,0,0|1,0,0]=3 11258 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)Br 11a_100015188789_100000720304 [0,2,0,0,0,0|2,0,0]=4 11259 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)Br 1626a_100015188789_100000720304 [0,2,0,0,0,0|2,0,0]=4 11260 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)Br 240690a_100015188789_100000720304 [0,2,0,0,0,0|2,0,0]=4 11261 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)Cl 11a_100000697193_100000720304 [0,2,0,0,0,0|2,0,0]=4 11262 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)Cl 1626a_100000697193_100000720304 [0,2,0,0,0,0|2,0,0]=4 11263 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)Cl 240690a_100000697193_100000720304 [0,2,0,0,0,0|2,0,0]=4 11264 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)F 11a_100020620131_100000720304 [0,2,0,0,0,0|2,0,0]=4 11265 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)F 1626a_100020620131_100000720304 [0,2,0,0,0,0|2,0,0]=4 11266 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)F 240690a_100020620131_100000720304 [0,2,0,0,0,0|2,0,0]=4 11267 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(cn2)O 240690a_100020605196_100000720304 [0,2,0,0,0,0|2,0,0]=4 11268 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)Br 11a_100009817727_100000720304 [0,2,0,0,0,0|2,0,0]=4 11269 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)Br 240690a_100009817727_100000720304 [0,2,0,0,0,0|2,0,0]=4 11270 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)Cl 11a_100000735879_100000720304 [0,2,0,0,0,0|2,0,0]=4 11271 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)Cl 1626a_100000735879_100000720304 [0,2,0,0,0,0|2,0,0]=4 11272 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)Cl 240690a_100000735879_100000720304 [0,2,0,0,0,0|2,0,0]=4 11273 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)F 11a_100000101913_100000720304 [0,2,0,0,0,0|2,0,0]=4 11274 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)F 1626a_100000101913_100000720304 [0,2,0,0,0,0|2,0,0]=4 11275 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)F 240690a_100000101913_100000720304 [0,2,0,0,0,0|2,0,0]=4 11276 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)O 11a_100000757128_100000720304 [0,2,0,0,0,0|2,0,0]=4 11277 B21R2.358963 O=C(C=Cc1ccccc1Cl)NCc2ccc(nc2)O 240690a_100000757128_100000720304 [0,2,0,0,0,0|2,0,0]=4 11278 B21R2.358963 O=C(C=Cc1ccccc1Cl)NNc2ccc(cc2)Br 22a_100000735608_100000720304 [0,2,0,0,0,0|2,0,0]=4 11279 B21R2.358963 O=C(C=Cc1ccccc1Cl)NNc2ccc(cc2)Cl 22a_100000683521_100000720304 [0,2,0,0,0,0|2,0,0]=4 11280 B21R2.358963 O=C(C=Cc1ccccc1Cl)NNc2ccc(cc2)F 22a_100000728448_100000720304 [0,2,0,0,0,0|2,0,0]=4 11281 B21R2.358963 O=C(C=Cc1ccccc1Cl)NNc2ccc(cc2)I 22a_100016988836_100000720304 [0,2,0,0,0,0|2,0,0]=4 11282 B21R2.358963 O=C(C=Cc1ccccc1F)CCc2ccc(cc2)Br 1458a_100016256065_100011740612 [0,2,0,0,0,0|1,0,0]=3 11283 B21R2.358963 O=C(C=Cc1ccccc1F)CCc2ccc(cc2)Cl 1458a_100016256065_100011713675 [0,2,0,0,0,0|1,0,0]=3 11284 B21R2.358963 O=C(C=Cc1ccccc1F)CCc2ccc(cc2)F 1458a_100016256065_100011217392 [0,2,0,0,0,0|1,0,0]=3 11285 B21R2.358963 O=C(C=Cc1ccccc1F)CCc2ccc(cc2)O 1458a_100016256065_100009816426 [0,2,0,0,0,0|1,0,0]=3 11286 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)Br 11a_100000174875_100016256065 [0,2,0,0,0,0|1,0,0]=3 11287 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)Br 1626a_100000174875_100016256065 [0,2,0,0,0,0|1,0,0]=3 11288 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)Br 240690a_100000174875_100016256065 [0,2,0,0,0,0|1,0,0]=3 11289 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)Cl 11a_100000174871_100016256065 [0,2,0,0,0,0|1,0,0]=3 11290 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)Cl 1626a_100000174871_100016256065 [0,2,0,0,0,0|1,0,0]=3 11291 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)Cl 240690a_100000174871_100016256065 [0,2,0,0,0,0|1,0,0]=3 11292 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)F 11a_100000174882_100016256065 [0,2,0,0,0,0|1,0,0]=3 11293 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)F 1626a_100000174882_100016256065 [0,2,0,0,0,0|1,0,0]=3 11294 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)F 240690a_100000174882_100016256065 [0,2,0,0,0,0|1,0,0]=3 11295 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)I 11a_100016989417_100016256065 [0,2,0,0,0,0|1,0,0]=3 11296 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)I 1626a_100016989417_100016256065 [0,2,0,0,0,0|1,0,0]=3 11297 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)I 240690a_100016989417_100016256065 [0,2,0,0,0,0|1,0,0]=3 11298 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cc2)O 240690a_100000185549_100016256065 [0,2,0,0,0,0|1,0,0]=3 11299 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)Br 11a_100015188789_100016256065 [0,2,0,0,0,0|2,0,0]=4 11300 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)Br 1626a_100015188789_100016256065 [0,2,0,0,0,0|2,0,0]=4 11301 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)Br 240690a_100015188789_100016256065 [0,2,0,0,0,0|2,0,0]=4 11302 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)Cl 11a_100000697193_100016256065 [0,2,0,0,0,0|2,0,0]=4 11303 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)Cl 1626a_100000697193_100016256065 [0,2,0,0,0,0|2,0,0]=4 11304 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)Cl 240690a_100000697193_100016256065 [0,2,0,0,0,0|2,0,0]=4 11305 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)F 11a_100020620131_100016256065 [0,2,0,0,0,0|2,0,0]=4 11306 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)F 1626a_100020620131_100016256065 [0,2,0,0,0,0|2,0,0]=4 11307 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)F 240690a_100020620131_100016256065 [0,2,0,0,0,0|2,0,0]=4 11308 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(cn2)O 240690a_100020605196_100016256065 [0,2,0,0,0,0|2,0,0]=4 11309 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)Br 11a_100009817727_100016256065 [0,2,0,0,0,0|2,0,0]=4 11310 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)Br 240690a_100009817727_100016256065 [0,2,0,0,0,0|2,0,0]=4 11311 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)Cl 11a_100000735879_100016256065 [0,2,0,0,0,0|2,0,0]=4 11312 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)Cl 1626a_100000735879_100016256065 [0,2,0,0,0,0|2,0,0]=4 11313 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)Cl 240690a_100000735879_100016256065 [0,2,0,0,0,0|2,0,0]=4 11314 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)F 11a_100000101913_100016256065 [0,2,0,0,0,0|2,0,0]=4 11315 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)F 1626a_100000101913_100016256065 [0,2,0,0,0,0|2,0,0]=4 11316 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)F 240690a_100000101913_100016256065 [0,2,0,0,0,0|2,0,0]=4 11317 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)O 11a_100000757128_100016256065 [0,2,0,0,0,0|2,0,0]=4 11318 B21R2.358963 O=C(C=Cc1ccccc1F)NCc2ccc(nc2)O 240690a_100000757128_100016256065 [0,2,0,0,0,0|2,0,0]=4 11319 B21R2.358963 O=C(C=Cc1ccccc1F)NNc2ccc(cc2)Br 22a_100000735608_100016256065 [0,2,0,0,0,0|2,0,0]=4 11320 B21R2.358963 O=C(C=Cc1ccccc1F)NNc2ccc(cc2)Cl 22a_100000683521_100016256065 [0,2,0,0,0,0|2,0,0]=4 11321 B21R2.358963 O=C(C=Cc1ccccc1F)NNc2ccc(cc2)F 22a_100000728448_100016256065 [0,2,0,0,0,0|2,0,0]=4 11322 B21R2.358963 O=C(C=Cc1ccccc1F)NNc2ccc(cc2)I 22a_100016988836_100016256065 [0,2,0,0,0,0|2,0,0]=4 11323 B21R2.358963 O=C(C=Cc1ccccc1O)CCc2ccc(cc2)Br 1458a_100016263591_100011740612 [0,2,0,0,0,0|1,0,0]=3 11324 B21R2.358963 O=C(C=Cc1ccccc1O)CCc2ccc(cc2)Cl 1458a_100016263591_100011713675 [0,2,0,0,0,0|1,0,0]=3 11325 B21R2.358963 O=C(C=Cc1ccccc1O)CCc2ccc(cc2)F 1458a_100016263591_100011217392 [0,2,0,0,0,0|1,0,0]=3 11326 B21R2.358963 O=C(C=Cc1ccccc1O)CCc2ccc(cc2)O 1458a_100016263591_100009816426 [0,2,0,0,0,0|1,0,0]=3 11327 B21R2.358963 O=C(C=Cc1ccccc1O)NNc2ccc(cc2)Br 22a_100000735608_100016263591 [0,2,0,0,0,0|2,0,0]=4 11328 B21R2.358963 O=C(C=Cc1ccccc1O)NNc2ccc(cc2)Cl 22a_100000683521_100016263591 [0,2,0,0,0,0|2,0,0]=4 11329 B21R2.358963 O=C(C=Cc1ccccc1O)NNc2ccc(cc2)F 22a_100000728448_100016263591 [0,2,0,0,0,0|2,0,0]=4 11330 B21R2.358963 O=C(C=Cc1ccccc1O)NNc2ccc(cc2)I 22a_100016988836_100016263591 [0,2,0,0,0,0|2,0,0]=4 11331 B21R2.366834 Cc1ccc(cc1)CNS(=O)(=O)C=Cc2ccccc2 40a_100000174908_100011098038 [0,2,0,0,0,0|2,0,0]=4 11332 B21R2.366834 O=S(=O)(C=Cc1ccccc1)NCc2ccc(cc2)Br 40a_100000174875_100011098038 [0,2,0,0,0,0|2,0,0]=4 11333 B21R2.366834 O=S(=O)(C=Cc1ccccc1)NCc2ccc(cc2)Cl 40a_100000174871_100011098038 [0,2,0,0,0,0|2,0,0]=4 11334 B21R2.366834 O=S(=O)(C=Cc1ccccc1)NCc2ccc(cc2)F 40a_100000174882_100011098038 [0,2,0,0,0,0|2,0,0]=4 11335 B21R2.366834 O=S(=O)(C=Cc1ccccc1)NCc2ccc(cc2)I 40a_100016989417_100011098038 [0,2,0,0,0,0|2,0,0]=4 11336 B21R2.3551 C#Cc1cccc(c1)NCC(=O)OCc2ccccc2 2230a_100000735509_100000753625 [0,2,0,0,0,0|1,0,1]=4 11337 B21R2.3551 C#Cc1cccc(c1)NCC(=O)OCc2ccccc2 34a_100000735509_100000753625 [0,2,0,0,0,0|1,0,1]=4 11338 B21R2.3551 C#Cc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100011216014_100000753625 [0,2,0,0,0,0|1,0,1]=4 11339 B21R2.3551 C#Cc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100011216014_100000753625 [0,2,0,0,0,0|1,0,1]=4 11340 B21R2.3551 C=Cc1cccc(c1)NCC(=O)OCc2ccccc2 34a_100011827668_100000753625 [0,2,0,0,0,0|1,0,1]=4 11341 B21R2.3551 C=Cc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100011309434_100000753625 [0,2,0,0,0,0|1,0,1]=4 11342 B21R2.3551 C=Cc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100011309434_100000753625 [0,2,0,0,0,0|1,0,1]=4 11343 B21R2.3551 C=Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100011215241 [0,2,0,0,0,0|1,0,1]=4 11344 B21R2.3551 C=Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100011215241_100000753625 [0,2,0,0,0,0|1,0,1]=4 11345 B21R2.3551 CCc1cccc(c1)NCC(=O)OCc2ccccc2 2230a_100000211250_100000753625 [0,2,0,0,0,0|1,0,1]=4 11346 B21R2.3551 CCc1cccc(c1)NCC(=O)OCc2ccccc2 34a_100000211250_100000753625 [0,2,0,0,0,0|1,0,1]=4 11347 B21R2.3551 CCc1cccc(c1)NCC(=O)OCc2ccccc2 7a_100000211250_100000753625 [0,2,0,0,0,0|1,0,1]=4 11348 B21R2.3551 CCc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000211550_100000753625 [0,2,0,0,0,0|1,0,1]=4 11349 B21R2.3551 CCc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100000211550_100000753625 [0,2,0,0,0,0|1,0,1]=4 11350 B21R2.3551 CCc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100011263222 [0,2,0,0,0,0|1,0,1]=4 11351 B21R2.3551 CCc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100011263222_100000753625 [0,2,0,0,0,0|1,0,1]=4 11352 B21R2.3551 CNc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000756613_100000753625 [0,2,0,0,0,0|1,0,1]=4 11353 B21R2.3551 CNc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100000756613_100000753625 [0,2,0,0,0,0|1,0,1]=4 11354 B21R2.3551 CNc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000219648_100000753625 [0,2,0,0,0,0|1,0,1]=4 11355 B21R2.3551 CNc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000219648 [0,2,0,0,0,0|1,0,1]=4 11356 B21R2.3551 COc1cc(ccn1)CNC(=O)C=Cc2ccccc2 11a_100102525109_100000210462 [0,2,0,0,0,0|2,0,0]=4 11357 B21R2.3551 COc1cc(ccn1)CNC(=O)C=Cc2ccccc2 1626a_100102525109_100000210462 [0,2,0,0,0,0|2,0,0]=4 11358 B21R2.3551 COc1cccc(c1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000211917 [0,2,0,0,0,0|2,0,0]=4 11359 B21R2.3551 COc1cccc(c1)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100011713679 [0,2,0,0,0,0|1,0,0]=3 11360 B21R2.3551 COc1cccc(c1)CCC(=O)C=Cc2ccccn2 1458a_100000740811_100011713679 [0,2,0,0,0,0|2,0,0]=4 11361 B21R2.3551 COc1cccc(c1)CCC(=O)C=Cc2cccnc2 1458a_100000735890_100011713679 [0,2,0,0,0,0|2,0,0]=4 11362 B21R2.3551 COc1cccc(c1)CCC(=O)C=Cc2ccncc2 1458a_100000682801_100011713679 [0,2,0,0,0,0|2,0,0]=4 11363 B21R2.3551 COc1cccc(c1)CNC(=O)C=Cc2ccccc2 11a_100000174954_100000210462 [0,2,0,0,0,0|1,0,0]=3 11364 B21R2.3551 COc1cccc(c1)CNC(=O)C=Cc2ccccc2 1626a_100000174954_100000210462 [0,2,0,0,0,0|1,0,0]=3 11365 B21R2.3551 COc1cccc(c1)CNC(=O)C=Cc2ccccn2 11a_100000174954_100000740811 [0,2,0,0,0,0|2,0,0]=4 11366 B21R2.3551 COc1cccc(c1)CNC(=O)C=Cc2ccccn2 240690a_100000174954_100000740811 [0,2,0,0,0,0|2,0,0]=4 11367 B21R2.3551 COc1cccc(c1)CNC(=O)C=Cc2cccnc2 11a_100000174954_100000735890 [0,2,0,0,0,0|2,0,0]=4 11368 B21R2.3551 COc1cccc(c1)CNC(=O)C=Cc2cccnc2 240690a_100000174954_100000735890 [0,2,0,0,0,0|2,0,0]=4 11369 B21R2.3551 COc1cccc(c1)CNC(=O)C=Cc2ccncc2 240690a_100000174954_100000682801 [0,2,0,0,0,0|2,0,0]=4 11370 B21R2.3551 COc1cccc(c1)CNC(=O)OCc2ccccc2 34a_100010184939_200000210301 [0,2,0,0,0,0|1,0,1]=4 11371 B21R2.3551 COc1cccc(c1)CNC(=O)OCc2ccccc2 7a_100010184939_200000210301 [0,2,0,0,0,0|1,0,1]=4 11372 B21R2.3551 COc1cccc(c1)NCC(=O)OCc2ccccc2 34a_100000210024_100000753625 [0,2,0,0,0,0|1,0,1]=4 11373 B21R2.3551 COc1cccc(c1)NNC(=O)C=Cc2ccccc2 22a_100000722927_100000210462 [0,2,0,0,0,0|2,0,0]=4 11374 B21R2.3551 COc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000211255_100000753625 [0,2,0,0,0,0|1,0,1]=4 11375 B21R2.3551 COc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100000211255_100000753625 [0,2,0,0,0,0|1,0,1]=4 11376 B21R2.3551 COc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000170001 [0,2,0,0,0,0|1,0,1]=4 11377 B21R2.3551 COc1cccc(n1)CNC(=O)C=Cc2ccccc2 11a_100000746380_100000210462 [0,2,0,0,0,0|2,0,0]=4 11378 B21R2.3551 COc1cccc(n1)CNC(=O)C=Cc2ccccc2 1626a_100000746380_100000210462 [0,2,0,0,0,0|2,0,0]=4 11379 B21R2.3551 COc1ccnc(c1)CNC(=O)C=Cc2ccccc2 11a_100000706253_100000210462 [0,2,0,0,0,0|2,0,0]=4 11380 B21R2.3551 COc1ccnc(c1)CNC(=O)C=Cc2ccccc2 1626a_100000706253_100000210462 [0,2,0,0,0,0|2,0,0]=4 11381 B21R2.3551 COc1cncc(c1)CNC(=O)C=Cc2ccccc2 11a_100020589029_100000210462 [0,2,0,0,0,0|2,0,0]=4 11382 B21R2.3551 CSc1cccc(c1)NCC(=O)OCc2ccccc2 2230a_100000210049_100000753625 [0,2,0,0,0,0|1,0,1]=4 11383 B21R2.3551 CSc1cccc(c1)NCC(=O)OCc2ccccc2 34a_100000210049_100000753625 [0,2,0,0,0,0|1,0,1]=4 11384 B21R2.3551 CSc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100011265683_100000753625 [0,2,0,0,0,0|1,0,1]=4 11385 B21R2.3551 CSc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100011265683_100000753625 [0,2,0,0,0,0|1,0,1]=4 11386 B21R2.3551 CSc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100011215954 [0,2,0,0,0,0|1,0,1]=4 11387 B21R2.3551 CSc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100011215954_100000753625 [0,2,0,0,0,0|1,0,1]=4 11388 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)CCc2ccccc2 1458a_100000738773_100000765856 [0,2,0,0,0,0|1,0,0]=3 11389 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)CCc2ccccn2 1458a_100000738773_100015183660 [0,2,0,0,0,0|2,0,0]=4 11390 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)CCc2cccnc2 1458a_100000738773_200011713674 [0,2,0,0,0,0|2,0,0]=4 11391 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)CCc2ccncc2 1458a_100000738773_100000723409 [0,2,0,0,0,0|2,0,0]=4 11392 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000738773 [0,2,0,0,0,0|1,0,0]=3 11393 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000738773 [0,2,0,0,0,0|1,0,0]=3 11394 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100000738773 [0,2,0,0,0,0|1,0,0]=3 11395 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccccn2 11a_100000210449_100000738773 [0,2,0,0,0,0|2,0,0]=4 11396 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000738773 [0,2,0,0,0,0|2,0,0]=4 11397 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccccn2 240690a_100000210449_100000738773 [0,2,0,0,0,0|2,0,0]=4 11398 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2cccnc2 11a_100000210453_100000738773 [0,2,0,0,0,0|2,0,0]=4 11399 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2cccnc2 240690a_100000210453_100000738773 [0,2,0,0,0,0|2,0,0]=4 11400 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccncc2 11a_100000210450_100000738773 [0,2,0,0,0,0|2,0,0]=4 11401 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000738773 [0,2,0,0,0,0|2,0,0]=4 11402 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NCc2ccncc2 240690a_100000210450_100000738773 [0,2,0,0,0,0|2,0,0]=4 11403 B21R2.3551 N#Cc1cccc(c1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000738773 [0,2,0,0,0,0|2,0,0]=4 11404 B21R2.3551 N#Cc1cccc(c1)CNC(=O)C=Cc2ccccc2 11a_100000755147_100000210462 [0,2,0,0,0,0|1,0,0]=3 11405 B21R2.3551 N#Cc1cccc(c1)CNC(=O)C=Cc2ccccc2 1626a_100000755147_100000210462 [0,2,0,0,0,0|1,0,0]=3 11406 B21R2.3551 N#Cc1cccc(c1)CNC(=O)C=Cc2ccccn2 11a_100000755147_100000740811 [0,2,0,0,0,0|2,0,0]=4 11407 B21R2.3551 N#Cc1cccc(c1)CNC(=O)C=Cc2ccccn2 240690a_100000755147_100000740811 [0,2,0,0,0,0|2,0,0]=4 11408 B21R2.3551 N#Cc1cccc(c1)CNC(=O)C=Cc2cccnc2 11a_100000755147_100000735890 [0,2,0,0,0,0|2,0,0]=4 11409 B21R2.3551 N#Cc1cccc(c1)CNC(=O)C=Cc2cccnc2 240690a_100000755147_100000735890 [0,2,0,0,0,0|2,0,0]=4 11410 B21R2.3551 N#Cc1cccc(c1)CNC(=O)C=Cc2ccncc2 240690a_100000755147_100000682801 [0,2,0,0,0,0|2,0,0]=4 11411 B21R2.3551 N#Cc1cccc(c1)NCC(=O)OCc2ccccc2 34a_100000210922_100000753625 [0,2,0,0,0,0|1,0,1]=4 11412 B21R2.3551 N#Cc1cccc(c1)NCC(=O)OCc2ccccc2 7a_100000210922_100000753625 [0,2,0,0,0,0|1,0,1]=4 11413 B21R2.3551 N#Cc1cccc(c1)NNC(=O)C=Cc2ccccc2 22a_100016987777_100000210462 [0,2,0,0,0,0|2,0,0]=4 11414 B21R2.3551 N#Cc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000184713_100000753625 [0,2,0,0,0,0|1,0,1]=4 11415 B21R2.3551 N#Cc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100000184713_100000753625 [0,2,0,0,0,0|1,0,1]=4 11416 B21R2.3551 N#Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000189340 [0,2,0,0,0,0|1,0,1]=4 11417 B21R2.3551 N#Cc1cncc(c1)C=CC(=O)CCc2ccccc2 6a_100011361567_100000210092 [0,2,0,0,0,0|2,0,0]=4 11418 B21R2.3551 NCc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000743036_100000753625 [0,2,0,0,0,0|1,0,1]=4 11419 B21R2.3551 NCc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000106179_100000753625 [0,2,0,0,0,0|1,0,1]=4 11420 B21R2.3551 NCc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000106179 [0,2,0,0,0,0|1,0,1]=4 11421 B21R2.3551 NNc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000217339_100000753625 [0,2,0,0,0,0|1,0,1]=4 11422 B21R2.3551 NNc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000217339 [0,2,0,0,0,0|1,0,1]=4 11423 B21R2.3551 O=C(C=Cc1ccccn1)NCc2cccc(c2)CO 240690a_100011269909_100000740811 [0,2,0,0,0,0|2,0,0]=4 11424 B21R2.3551 O=C(C=Cc1cccnc1)NCc2cccc(c2)CO 240690a_100011269909_100000735890 [0,2,0,0,0,0|2,0,0]=4 11425 B21R2.3551 O=C(C=Cc1ccncc1)NCc2cccc(c2)CO 240690a_100011269909_100000682801 [0,2,0,0,0,0|2,0,0]=4 11426 B21R2.3551 O=C(CNc1cccc(c1)CF)OCc2ccccc2 2230a_100000126320_100000753625 [0,2,0,0,0,0|1,0,1]=4 11427 B21R2.3551 O=C(CNc1cccc(c1)CF)OCc2ccccc2 34a_100000126320_100000753625 [0,2,0,0,0,0|1,0,1]=4 11428 B21R2.3551 O=C(CNc1cccc(c1)CF)OCc2ccccc2 7a_100000126320_100000753625 [0,2,0,0,0,0|1,0,1]=4 11429 B21R2.3551 O=C(CNc1cccc(c1)CO)OCc2ccccc2 2230a_100000211919_100000753625 [0,2,0,0,0,0|1,0,1]=4 11430 B21R2.3551 O=C(CNc1cccc(c1)CO)OCc2ccccc2 34a_100000211919_100000753625 [0,2,0,0,0,0|1,0,1]=4 11431 B21R2.3551 O=C(COc1cccc(c1)CBr)OCc2ccccc2 34a_100011660834_100000753625 [0,2,0,0,0,0|1,0,1]=4 11432 B21R2.3551 O=C(COc1cccc(c1)CBr)OCc2ccccc2 7a_100011660834_100000753625 [0,2,0,0,0,0|1,0,1]=4 11433 B21R2.3551 O=C(COc1cccc(c1)CCl)OCc2ccccc2 34a_100000084143_100000753625 [0,2,0,0,0,0|1,0,1]=4 11434 B21R2.3551 O=C(COc1cccc(c1)CCl)OCc2ccccc2 7a_100000084143_100000753625 [0,2,0,0,0,0|1,0,1]=4 11435 B21R2.3551 O=C(COc1cccc(c1)CO)OCc2ccccc2 34a_100011214949_100000753625 [0,2,0,0,0,0|1,0,1]=4 11436 B21R2.3551 O=C(COc1cccc(c1)CO)OCc2ccccc2 7a_100011214949_100000753625 [0,2,0,0,0,0|1,0,1]=4 11437 B21R2.3551 O=C(CSc1cccc(c1)CF)OCc2ccccc2 62a_100000753625_100010878472 [0,2,0,0,0,0|1,0,1]=4 11438 B21R2.3551 O=C(CSc1cccc(c1)CF)OCc2ccccc2 62a_100010878472_100000753625 [0,2,0,0,0,0|1,0,1]=4 11439 B21R2.3551 O=C(CSc1cccc(c1)CO)OCc2ccccc2 62a_100000687537_100000753625 [0,2,0,0,0,0|1,0,1]=4 11440 B21R2.3551 O=C(CSc1cccc(c1)CO)OCc2ccccc2 62a_100000753625_100000687537 [0,2,0,0,0,0|1,0,1]=4 11441 B21R2.3551 O=Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000014684_100000753625 [0,2,0,0,0,0|1,0,1]=4 11442 B21R2.3551 O=Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000014684 [0,2,0,0,0,0|1,0,1]=4 11443 B21R2.3551 [13CH3]Oc1cccc(c1)CNC(=O)OCc2ccccc2 34a_100010184939_200025704644 [0,2,0,0,0,0|1,0,1]=4 11444 B21R2.3551 [13CH3]Oc1cccc(c1)CNC(=O)OCc2ccccc2 7a_100010184939_200025704644 [0,2,0,0,0,0|1,0,1]=4 11445 B21R2.4725 CN(Cc1cc(ccn1)Cl)C(=O)C=Cc2ccccc2 11a_100102954512_100000210462 [0,2,0,0,0,0|2,0,0]=4 11446 B21R2.4725 CN(Cc1cc(ccn1)Cl)C(=O)C=Cc2ccccc2 1626a_100102954512_100000210462 [0,2,0,0,0,0|2,0,0]=4 11447 B21R2.4725 CN(Cc1cccc(c1)Br)C(=O)C=Cc2ccccc2 11a_100000187585_100000210462 [0,2,0,0,0,0|1,0,0]=3 11448 B21R2.4725 CN(Cc1cccc(c1)Br)C(=O)C=Cc2ccccc2 1626a_100000187585_100000210462 [0,2,0,0,0,0|1,0,0]=3 11449 B21R2.4725 CN(Cc1cccc(c1)Br)C(=O)C=Cc2ccccn2 11a_100000187585_100000740811 [0,2,0,0,0,0|2,0,0]=4 11450 B21R2.4725 CN(Cc1cccc(c1)Br)C(=O)C=Cc2ccccn2 240690a_100000187585_100000740811 [0,2,0,0,0,0|2,0,0]=4 11451 B21R2.4725 CN(Cc1cccc(c1)Br)C(=O)C=Cc2cccnc2 11a_100000187585_100000735890 [0,2,0,0,0,0|2,0,0]=4 11452 B21R2.4725 CN(Cc1cccc(c1)Br)C(=O)C=Cc2cccnc2 240690a_100000187585_100000735890 [0,2,0,0,0,0|2,0,0]=4 11453 B21R2.4725 CN(Cc1cccc(c1)Br)C(=O)C=Cc2ccncc2 240690a_100000187585_100000682801 [0,2,0,0,0,0|2,0,0]=4 11454 B21R2.4725 CN(Cc1cccc(c1)Cl)C(=O)C=Cc2ccccc2 11a_100020629429_100000210462 [0,2,0,0,0,0|1,0,0]=3 11455 B21R2.4725 CN(Cc1cccc(c1)Cl)C(=O)C=Cc2ccccc2 1626a_100020629429_100000210462 [0,2,0,0,0,0|1,0,0]=3 11456 B21R2.4725 CN(Cc1cccc(c1)Cl)C(=O)C=Cc2ccccn2 11a_100020629429_100000740811 [0,2,0,0,0,0|2,0,0]=4 11457 B21R2.4725 CN(Cc1cccc(c1)Cl)C(=O)C=Cc2ccccn2 240690a_100020629429_100000740811 [0,2,0,0,0,0|2,0,0]=4 11458 B21R2.4725 CN(Cc1cccc(c1)Cl)C(=O)C=Cc2cccnc2 11a_100020629429_100000735890 [0,2,0,0,0,0|2,0,0]=4 11459 B21R2.4725 CN(Cc1cccc(c1)Cl)C(=O)C=Cc2cccnc2 240690a_100020629429_100000735890 [0,2,0,0,0,0|2,0,0]=4 11460 B21R2.4725 CN(Cc1cccc(c1)Cl)C(=O)C=Cc2ccncc2 240690a_100020629429_100000682801 [0,2,0,0,0,0|2,0,0]=4 11461 B21R2.4725 CN(Cc1cccc(c1)F)C(=O)C=Cc2ccccc2 11a_100000184398_100000210462 [0,2,0,0,0,0|1,0,0]=3 11462 B21R2.4725 CN(Cc1cccc(c1)F)C(=O)C=Cc2ccccc2 1626a_100000184398_100000210462 [0,2,0,0,0,0|1,0,0]=3 11463 B21R2.4725 CN(Cc1cccc(c1)F)C(=O)C=Cc2ccccn2 11a_100000184398_100000740811 [0,2,0,0,0,0|2,0,0]=4 11464 B21R2.4725 CN(Cc1cccc(c1)F)C(=O)C=Cc2ccccn2 240690a_100000184398_100000740811 [0,2,0,0,0,0|2,0,0]=4 11465 B21R2.4725 CN(Cc1cccc(c1)F)C(=O)C=Cc2cccnc2 11a_100000184398_100000735890 [0,2,0,0,0,0|2,0,0]=4 11466 B21R2.4725 CN(Cc1cccc(c1)F)C(=O)C=Cc2cccnc2 240690a_100000184398_100000735890 [0,2,0,0,0,0|2,0,0]=4 11467 B21R2.4725 CN(Cc1cccc(c1)F)C(=O)C=Cc2ccncc2 240690a_100000184398_100000682801 [0,2,0,0,0,0|2,0,0]=4 11468 B21R2.4725 CN(Cc1cccc(c1)O)C(=O)C=Cc2ccccn2 240690a_100000207540_100000740811 [0,2,0,0,0,0|2,0,0]=4 11469 B21R2.4725 CN(Cc1cccc(c1)O)C(=O)C=Cc2cccnc2 240690a_100000207540_100000735890 [0,2,0,0,0,0|2,0,0]=4 11470 B21R2.4725 CN(Cc1cccc(c1)O)C(=O)C=Cc2ccncc2 240690a_100000207540_100000682801 [0,2,0,0,0,0|2,0,0]=4 11471 B21R2.4725 CN(Cc1cccc(n1)Br)C(=O)C=Cc2ccccc2 11a_106354212997_100000210462 [0,2,0,0,0,0|2,0,0]=4 11472 B21R2.4725 CN(Cc1cccc(n1)Br)C(=O)C=Cc2ccccc2 1626a_106354212997_100000210462 [0,2,0,0,0,0|2,0,0]=4 11473 B21R2.4725 CN(Cc1cncc(c1)Br)C(=O)C=Cc2ccccc2 11a_103549770560_100000210462 [0,2,0,0,0,0|2,0,0]=4 11474 B21R2.4725 Cc1cccc(c1)CN(C)C(=O)C=Cc2ccccc2 11a_102495364743_100000210462 [0,2,0,0,0,0|1,0,0]=3 11475 B21R2.4725 Cc1cccc(c1)CN(C)C(=O)C=Cc2ccccc2 1626a_102495364743_100000210462 [0,2,0,0,0,0|1,0,0]=3 11476 B21R2.4725 Cc1cccc(c1)CN(C)C(=O)C=Cc2ccccn2 11a_102495364743_100000740811 [0,2,0,0,0,0|2,0,0]=4 11477 B21R2.4725 Cc1cccc(c1)CN(C)C(=O)C=Cc2ccccn2 240690a_102495364743_100000740811 [0,2,0,0,0,0|2,0,0]=4 11478 B21R2.4725 Cc1cccc(c1)CN(C)C(=O)C=Cc2cccnc2 11a_102495364743_100000735890 [0,2,0,0,0,0|2,0,0]=4 11479 B21R2.4725 Cc1cccc(c1)CN(C)C(=O)C=Cc2cccnc2 240690a_102495364743_100000735890 [0,2,0,0,0,0|2,0,0]=4 11480 B21R2.4725 Cc1cccc(c1)CN(C)C(=O)C=Cc2ccncc2 240690a_102495364743_100000682801 [0,2,0,0,0,0|2,0,0]=4 11481 B21R2.4725 Cc1cccc(c1)NC(F)C(=O)OCc2ccccc2 2230a_100000188690_100000036447 [0,2,0,0,0,0|1,0,1]=4 11482 B21R2.4725 Cc1cccc(c1)NC(F)C(=O)OCc2ccccc2 34a_100000188690_100000036447 [0,2,0,0,0,0|1,0,1]=4 11483 B21R2.4725 Cc1cccc(c1)OC(F)C(=O)OCc2ccccc2 34a_100000210337_100000036447 [0,2,0,0,0,0|1,0,1]=4 11484 B21R2.4725 Cc1cccc(c1)OC(F)C(=O)OCc2ccccc2 7a_100000210337_100000036447 [0,2,0,0,0,0|1,0,1]=4 11485 B21R2.4725 Cc1cccc(c1)SC(F)C(=O)OCc2ccccc2 62a_100000036447_100011215228 [0,2,0,0,0,0|1,0,1]=4 11486 B21R2.4725 Cc1cccc(c1)SC(F)C(=O)OCc2ccccc2 62a_100011215228_100000036447 [0,2,0,0,0,0|1,0,1]=4 11487 B21R2.4725 Cc1cccc(n1)CN(C)C(=O)C=Cc2ccccc2 11a_100000687132_100000210462 [0,2,0,0,0,0|2,0,0]=4 11488 B21R2.4725 Cc1cccc(n1)CN(C)C(=O)C=Cc2ccccc2 1626a_100000687132_100000210462 [0,2,0,0,0,0|2,0,0]=4 11489 B21R2.4725 Cc1ccnc(c1)CN(C)C(=O)C=Cc2ccccc2 11a_106354213154_100000210462 [0,2,0,0,0,0|2,0,0]=4 11490 B21R2.4725 Nc1cccc(c1)OC(F)C(=O)OCc2ccccc2 34a_100000210217_100000036447 [0,2,0,0,0,0|1,0,1]=4 11491 B21R2.4725 Nc1cccc(c1)SC(F)C(=O)OCc2ccccc2 62a_100000036447_100000210019 [0,2,0,0,0,0|1,0,1]=4 11492 B21R2.4725 Nc1cccc(c1)SC(F)C(=O)OCc2ccccc2 62a_100000210019_100000036447 [0,2,0,0,0,0|1,0,1]=4 11493 B21R2.4725 O=C(CCc1ccccc1)C(=O)Nc2cccc(c2)Cl 1458a_200011297299_100000765856 [0,2,0,0,0,0|2,0,0]=4 11494 B21R2.4725 O=C(CCc1ccccc1)C(=O)Nc2cccc(c2)F 1458a_200011297300_100000765856 [0,2,0,0,0,0|2,0,0]=4 11495 B21R2.4725 O=C(NCc1ccccc1)C(=O)Nc2cccc(c2)Cl 240690a_100015324214_200011297299 [0,2,0,0,0,0|2,0,0]=4 11496 B21R2.4725 O=C(NCc1ccccc1)C(=O)Nc2cccc(c2)F 240690a_100015324214_200011297300 [0,2,0,0,0,0|2,0,0]=4 11497 B21R2.4725 O=C(OCc1ccccc1)C(F)Nc2cccc(c2)Br 34a_100000210019_100000036447 [0,2,0,0,0,0|1,0,1]=4 11498 B21R2.4725 O=C(OCc1ccccc1)C(F)Nc2cccc(c2)Cl 34a_100000185859_100000036447 [0,2,0,0,0,0|1,0,1]=4 11499 B21R2.4725 O=C(OCc1ccccc1)C(F)Nc2cccc(c2)F 34a_100000210047_100000036447 [0,2,0,0,0,0|1,0,1]=4 11500 B21R2.4725 O=C(OCc1ccccc1)C(F)Nc2cccc(c2)I 34a_100000211102_100000036447 [0,2,0,0,0,0|1,0,1]=4 11501 B21R2.4725 O=C(OCc1ccccc1)C(F)Nc2cccc(c2)O 34a_100000210217_100000036447 [0,2,0,0,0,0|1,0,1]=4 11502 B21R2.4725 O=C(OCc1ccccc1)C(F)Oc2cccc(c2)Br 34a_100000210342_100000036447 [0,2,0,0,0,0|1,0,1]=4 11503 B21R2.4725 O=C(OCc1ccccc1)C(F)Oc2cccc(c2)Br 7a_100000210342_100000036447 [0,2,0,0,0,0|1,0,1]=4 11504 B21R2.4725 O=C(OCc1ccccc1)C(F)Oc2cccc(c2)Cl 34a_100000210295_100000036447 [0,2,0,0,0,0|1,0,1]=4 11505 B21R2.4725 O=C(OCc1ccccc1)C(F)Oc2cccc(c2)Cl 7a_100000210295_100000036447 [0,2,0,0,0,0|1,0,1]=4 11506 B21R2.4725 O=C(OCc1ccccc1)C(F)Oc2cccc(c2)F 34a_100000210426_100000036447 [0,2,0,0,0,0|1,0,1]=4 11507 B21R2.4725 O=C(OCc1ccccc1)C(F)Oc2cccc(c2)F 7a_100000210426_100000036447 [0,2,0,0,0,0|1,0,1]=4 11508 B21R2.4725 O=C(OCc1ccccc1)C(F)Oc2cccc(c2)I 34a_100000211634_100000036447 [0,2,0,0,0,0|1,0,1]=4 11509 B21R2.4725 O=C(OCc1ccccc1)C(F)Oc2cccc(c2)I 7a_100000211634_100000036447 [0,2,0,0,0,0|1,0,1]=4 11510 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)Br 62a_100000036447_100000691529 [0,2,0,0,0,0|1,0,1]=4 11511 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)Br 62a_100000691529_100000036447 [0,2,0,0,0,0|1,0,1]=4 11512 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)Cl 62a_100000036447_100000699651 [0,2,0,0,0,0|1,0,1]=4 11513 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)Cl 62a_100000699651_100000036447 [0,2,0,0,0,0|1,0,1]=4 11514 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)F 62a_100000036447_100000685547 [0,2,0,0,0,0|1,0,1]=4 11515 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)F 62a_100000685547_100000036447 [0,2,0,0,0,0|1,0,1]=4 11516 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)O 62a_100000036447_100000211634 [0,2,0,0,0,0|1,0,1]=4 11517 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)[S] 62a_100000036447_114929384022 [0,2,0,0,0,0|1,0,1]=4 11518 B21R2.4725 O=C(OCc1ccccc1)C(F)Sc2cccc(c2)[S] 62a_114929384022_100000036447 [0,2,0,0,0,0|1,0,1]=4 11519 B21R2.4782 Cc1c(cccc1C=CC(=O)CCc2ccccc2)F 1458a_100102526135_100000765856 [0,2,0,0,0,0|1,0,0]=3 11520 B21R2.4782 Cc1c(cccc1C=CC(=O)CCc2ccccn2)F 1458a_100102526135_100015183660 [0,2,0,0,0,0|2,0,0]=4 11521 B21R2.4782 Cc1c(cccc1C=CC(=O)CCc2cccnc2)F 1458a_100102526135_200011713674 [0,2,0,0,0,0|2,0,0]=4 11522 B21R2.4782 Cc1c(cccc1C=CC(=O)CCc2ccncc2)F 1458a_100102526135_100000723409 [0,2,0,0,0,0|2,0,0]=4 11523 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccccc2)F 11a_100015324214_100102526135 [0,2,0,0,0,0|1,0,0]=3 11524 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccccc2)F 1626a_100015324214_100102526135 [0,2,0,0,0,0|1,0,0]=3 11525 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccccc2)F 240690a_100015324214_100102526135 [0,2,0,0,0,0|1,0,0]=3 11526 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccccn2)F 11a_100000210449_100102526135 [0,2,0,0,0,0|2,0,0]=4 11527 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccccn2)F 1626a_100000210449_100102526135 [0,2,0,0,0,0|2,0,0]=4 11528 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccccn2)F 240690a_100000210449_100102526135 [0,2,0,0,0,0|2,0,0]=4 11529 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2cccnc2)F 11a_100000210453_100102526135 [0,2,0,0,0,0|2,0,0]=4 11530 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2cccnc2)F 240690a_100000210453_100102526135 [0,2,0,0,0,0|2,0,0]=4 11531 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccncc2)F 11a_100000210450_100102526135 [0,2,0,0,0,0|2,0,0]=4 11532 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccncc2)F 1626a_100000210450_100102526135 [0,2,0,0,0,0|2,0,0]=4 11533 B21R2.4782 Cc1c(cccc1C=CC(=O)NCc2ccncc2)F 240690a_100000210450_100102526135 [0,2,0,0,0,0|2,0,0]=4 11534 B21R2.4782 Cc1c(cccc1C=CC(=O)NNc2ccccc2)F 22a_100015195140_100102526135 [0,2,0,0,0,0|2,0,0]=4 11535 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccc2)Br 11a_100000724210_100000210462 [0,2,0,0,0,0|1,0,0]=3 11536 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccc2)Br 1626a_100000724210_100000210462 [0,2,0,0,0,0|1,0,0]=3 11537 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccc2)Cl 11a_100020639605_100000210462 [0,2,0,0,0,0|1,0,0]=3 11538 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccc2)Cl 1626a_100020639605_100000210462 [0,2,0,0,0,0|1,0,0]=3 11539 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccc2)F 11a_100132306986_100000210462 [0,2,0,0,0,0|1,0,0]=3 11540 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccc2)F 1626a_100132306986_100000210462 [0,2,0,0,0,0|1,0,0]=3 11541 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccn2)Br 11a_100000724210_100000740811 [0,2,0,0,0,0|2,0,0]=4 11542 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccn2)Br 240690a_100000724210_100000740811 [0,2,0,0,0,0|2,0,0]=4 11543 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccn2)Cl 11a_100020639605_100000740811 [0,2,0,0,0,0|2,0,0]=4 11544 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccn2)Cl 240690a_100020639605_100000740811 [0,2,0,0,0,0|2,0,0]=4 11545 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccn2)F 11a_100132306986_100000740811 [0,2,0,0,0,0|2,0,0]=4 11546 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccccn2)F 240690a_100132306986_100000740811 [0,2,0,0,0,0|2,0,0]=4 11547 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2cccnc2)Br 11a_100000724210_100000735890 [0,2,0,0,0,0|2,0,0]=4 11548 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2cccnc2)Br 240690a_100000724210_100000735890 [0,2,0,0,0,0|2,0,0]=4 11549 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2cccnc2)Cl 11a_100020639605_100000735890 [0,2,0,0,0,0|2,0,0]=4 11550 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2cccnc2)Cl 240690a_100020639605_100000735890 [0,2,0,0,0,0|2,0,0]=4 11551 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2cccnc2)F 11a_100132306986_100000735890 [0,2,0,0,0,0|2,0,0]=4 11552 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2cccnc2)F 240690a_100132306986_100000735890 [0,2,0,0,0,0|2,0,0]=4 11553 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccncc2)Br 240690a_100000724210_100000682801 [0,2,0,0,0,0|2,0,0]=4 11554 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccncc2)Cl 240690a_100020639605_100000682801 [0,2,0,0,0,0|2,0,0]=4 11555 B21R2.4782 Cc1c(cccc1CNC(=O)C=Cc2ccncc2)F 240690a_100132306986_100000682801 [0,2,0,0,0,0|2,0,0]=4 11556 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)Br 34a_100000750434_100000753625 [0,2,0,0,0,0|1,0,1]=4 11557 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)Cl 2230a_100000210441_100000753625 [0,2,0,0,0,0|1,0,1]=4 11558 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)Cl 34a_100000210441_100000753625 [0,2,0,0,0,0|1,0,1]=4 11559 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)Cl 7a_100000210441_100000753625 [0,2,0,0,0,0|1,0,1]=4 11560 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)F 34a_100000745574_100000753625 [0,2,0,0,0,0|1,0,1]=4 11561 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)F 7a_100000745574_100000753625 [0,2,0,0,0,0|1,0,1]=4 11562 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)I 34a_100000761887_100000753625 [0,2,0,0,0,0|1,0,1]=4 11563 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)O 34a_100011216573_100000753625 [0,2,0,0,0,0|1,0,1]=4 11564 B21R2.4782 Cc1c(cccc1NCC(=O)OCc2ccccc2)O 7a_100011216573_100000753625 [0,2,0,0,0,0|1,0,1]=4 11565 B21R2.4782 Cc1c(cccc1NNC(=O)C=Cc2ccccc2)Cl 22a_100000738547_100000210462 [0,2,0,0,0,0|2,0,0]=4 11566 B21R2.4782 Cc1c(cccc1OCC(=O)OCc2ccccc2)Br 34a_100012002258_100000753625 [0,2,0,0,0,0|1,0,1]=4 11567 B21R2.4782 Cc1c(cccc1OCC(=O)OCc2ccccc2)Br 7a_100012002258_100000753625 [0,2,0,0,0,0|1,0,1]=4 11568 B21R2.4782 Cc1c(cccc1OCC(=O)OCc2ccccc2)Cl 34a_100011265684_100000753625 [0,2,0,0,0,0|1,0,1]=4 11569 B21R2.4782 Cc1c(cccc1OCC(=O)OCc2ccccc2)Cl 7a_100011265684_100000753625 [0,2,0,0,0,0|1,0,1]=4 11570 B21R2.4782 Cc1c(cccc1OCC(=O)OCc2ccccc2)F 34a_100011217231_100000753625 [0,2,0,0,0,0|1,0,1]=4 11571 B21R2.4782 Cc1c(cccc1OCC(=O)OCc2ccccc2)F 7a_100011217231_100000753625 [0,2,0,0,0,0|1,0,1]=4 11572 B21R2.4782 Cc1c(cccc1OCC(=O)OCc2ccccc2)N 34a_100011216573_100000753625 [0,2,0,0,0,0|1,0,1]=4 11573 B21R2.4782 Cc1c(cccc1OCC(=O)OCc2ccccc2)N 7a_100011216573_100000753625 [0,2,0,0,0,0|1,0,1]=4 11574 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)Br 62a_100000753625_100012353703 [0,2,0,0,0,0|1,0,1]=4 11575 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)Br 62a_100012353703_100000753625 [0,2,0,0,0,0|1,0,1]=4 11576 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)Cl 62a_100000726075_100000753625 [0,2,0,0,0,0|1,0,1]=4 11577 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100000726075 [0,2,0,0,0,0|1,0,1]=4 11578 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)F 62a_100000753625_100011216893 [0,2,0,0,0,0|1,0,1]=4 11579 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)F 62a_100011216893_100000753625 [0,2,0,0,0,0|1,0,1]=4 11580 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)N 62a_100000753625_100000761887 [0,2,0,0,0,0|1,0,1]=4 11581 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)N 62a_100000761887_100000753625 [0,2,0,0,0,0|1,0,1]=4 11582 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)O 62a_100000753625_100012002258 [0,2,0,0,0,0|1,0,1]=4 11583 B21R2.4782 Cc1c(cccc1SCC(=O)OCc2ccccc2)O 62a_100012002258_100000753625 [0,2,0,0,0,0|1,0,1]=4 11584 B21R2.4782 Cc1cccc(c1Br)NCC(=O)OCc2ccccc2 34a_100000684715_100000753625 [0,2,0,0,0,0|1,0,1]=4 11585 B21R2.4782 Cc1cccc(c1Br)OCC(=O)OCc2ccccc2 34a_100000686692_100000753625 [0,2,0,0,0,0|1,0,1]=4 11586 B21R2.4782 Cc1cccc(c1Br)OCC(=O)OCc2ccccc2 7a_100000686692_100000753625 [0,2,0,0,0,0|1,0,1]=4 11587 B21R2.4782 Cc1cccc(c1Br)SCC(=O)OCc2ccccc2 62a_100000753625_100012362457 [0,2,0,0,0,0|1,0,1]=4 11588 B21R2.4782 Cc1cccc(c1Br)SCC(=O)OCc2ccccc2 62a_100012362457_100000753625 [0,2,0,0,0,0|1,0,1]=4 11589 B21R2.4782 Cc1cccc(c1C)CNC(=O)C=Cc2ccccc2 11a_100011211637_100000210462 [0,2,0,0,0,0|1,0,0]=3 11590 B21R2.4782 Cc1cccc(c1C)CNC(=O)C=Cc2ccccc2 1626a_100011211637_100000210462 [0,2,0,0,0,0|1,0,0]=3 11591 B21R2.4782 Cc1cccc(c1C)CNC(=O)C=Cc2ccccn2 11a_100011211637_100000740811 [0,2,0,0,0,0|2,0,0]=4 11592 B21R2.4782 Cc1cccc(c1C)CNC(=O)C=Cc2ccccn2 240690a_100011211637_100000740811 [0,2,0,0,0,0|2,0,0]=4 11593 B21R2.4782 Cc1cccc(c1C)CNC(=O)C=Cc2cccnc2 11a_100011211637_100000735890 [0,2,0,0,0,0|2,0,0]=4 11594 B21R2.4782 Cc1cccc(c1C)CNC(=O)C=Cc2cccnc2 240690a_100011211637_100000735890 [0,2,0,0,0,0|2,0,0]=4 11595 B21R2.4782 Cc1cccc(c1C)CNC(=O)C=Cc2ccncc2 240690a_100011211637_100000682801 [0,2,0,0,0,0|2,0,0]=4 11596 B21R2.4782 Cc1cccc(c1C)NCC(=O)OCc2ccccc2 2230a_100000210026_100000753625 [0,2,0,0,0,0|1,0,1]=4 11597 B21R2.4782 Cc1cccc(c1C)NCC(=O)OCc2ccccc2 34a_100000210026_100000753625 [0,2,0,0,0,0|1,0,1]=4 11598 B21R2.4782 Cc1cccc(c1C)NCC(=O)OCc2ccccc2 7a_100000210026_100000753625 [0,2,0,0,0,0|1,0,1]=4 11599 B21R2.4782 Cc1cccc(c1C)NNC(=O)C=Cc2ccccc2 22a_100020604495_100000210462 [0,2,0,0,0,0|2,0,0]=4 11600 B21R2.4782 Cc1cccc(c1C)OCC(=O)OCc2ccccc2 34a_100000185855_100000753625 [0,2,0,0,0,0|1,0,1]=4 11601 B21R2.4782 Cc1cccc(c1C)OCC(=O)OCc2ccccc2 7a_100000185855_100000753625 [0,2,0,0,0,0|1,0,1]=4 11602 B21R2.4782 Cc1cccc(c1C)SCC(=O)OCc2ccccc2 62a_100000753625_100011214922 [0,2,0,0,0,0|1,0,1]=4 11603 B21R2.4782 Cc1cccc(c1C)SCC(=O)OCc2ccccc2 62a_100011214922_100000753625 [0,2,0,0,0,0|1,0,1]=4 11604 B21R2.4782 Cc1cccc(c1Cl)CNC(=O)C=Cc2ccccc2 11a_100025705714_100000210462 [0,2,0,0,0,0|1,0,0]=3 11605 B21R2.4782 Cc1cccc(c1Cl)CNC(=O)C=Cc2ccccc2 1626a_100025705714_100000210462 [0,2,0,0,0,0|1,0,0]=3 11606 B21R2.4782 Cc1cccc(c1Cl)CNC(=O)C=Cc2ccccn2 11a_100025705714_100000740811 [0,2,0,0,0,0|2,0,0]=4 11607 B21R2.4782 Cc1cccc(c1Cl)CNC(=O)C=Cc2ccccn2 240690a_100025705714_100000740811 [0,2,0,0,0,0|2,0,0]=4 11608 B21R2.4782 Cc1cccc(c1Cl)CNC(=O)C=Cc2cccnc2 11a_100025705714_100000735890 [0,2,0,0,0,0|2,0,0]=4 11609 B21R2.4782 Cc1cccc(c1Cl)CNC(=O)C=Cc2cccnc2 240690a_100025705714_100000735890 [0,2,0,0,0,0|2,0,0]=4 11610 B21R2.4782 Cc1cccc(c1Cl)CNC(=O)C=Cc2ccncc2 240690a_100025705714_100000682801 [0,2,0,0,0,0|2,0,0]=4 11611 B21R2.4782 Cc1cccc(c1Cl)NCC(=O)OCc2ccccc2 34a_100000765562_100000753625 [0,2,0,0,0,0|1,0,1]=4 11612 B21R2.4782 Cc1cccc(c1Cl)NCC(=O)OCc2ccccc2 7a_100000765562_100000753625 [0,2,0,0,0,0|1,0,1]=4 11613 B21R2.4782 Cc1cccc(c1Cl)OCC(=O)OCc2ccccc2 34a_100000695629_100000753625 [0,2,0,0,0,0|1,0,1]=4 11614 B21R2.4782 Cc1cccc(c1Cl)OCC(=O)OCc2ccccc2 7a_100000695629_100000753625 [0,2,0,0,0,0|1,0,1]=4 11615 B21R2.4782 Cc1cccc(c1Cl)SCC(=O)OCc2ccccc2 62a_100000753625_200012352035 [0,2,0,0,0,0|1,0,1]=4 11616 B21R2.4782 Cc1cccc(c1Cl)SCC(=O)OCc2ccccc2 62a_200012352035_100000753625 [0,2,0,0,0,0|1,0,1]=4 11617 B21R2.4782 Cc1cccc(c1F)CNC(=O)C=Cc2ccccc2 11a_100012002060_100000210462 [0,2,0,0,0,0|1,0,0]=3 11618 B21R2.4782 Cc1cccc(c1F)CNC(=O)C=Cc2ccccc2 1626a_100012002060_100000210462 [0,2,0,0,0,0|1,0,0]=3 11619 B21R2.4782 Cc1cccc(c1F)CNC(=O)C=Cc2ccccn2 11a_100012002060_100000740811 [0,2,0,0,0,0|2,0,0]=4 11620 B21R2.4782 Cc1cccc(c1F)CNC(=O)C=Cc2ccccn2 240690a_100012002060_100000740811 [0,2,0,0,0,0|2,0,0]=4 11621 B21R2.4782 Cc1cccc(c1F)CNC(=O)C=Cc2cccnc2 11a_100012002060_100000735890 [0,2,0,0,0,0|2,0,0]=4 11622 B21R2.4782 Cc1cccc(c1F)CNC(=O)C=Cc2cccnc2 240690a_100012002060_100000735890 [0,2,0,0,0,0|2,0,0]=4 11623 B21R2.4782 Cc1cccc(c1F)CNC(=O)C=Cc2ccncc2 240690a_100012002060_100000682801 [0,2,0,0,0,0|2,0,0]=4 11624 B21R2.4782 Cc1cccc(c1F)NCC(=O)OCc2ccccc2 2230a_100000697159_100000753625 [0,2,0,0,0,0|1,0,1]=4 11625 B21R2.4782 Cc1cccc(c1F)NCC(=O)OCc2ccccc2 34a_100000697159_100000753625 [0,2,0,0,0,0|1,0,1]=4 11626 B21R2.4782 Cc1cccc(c1F)NCC(=O)OCc2ccccc2 7a_100000697159_100000753625 [0,2,0,0,0,0|1,0,1]=4 11627 B21R2.4782 Cc1cccc(c1F)OCC(=O)OCc2ccccc2 34a_100000751311_100000753625 [0,2,0,0,0,0|1,0,1]=4 11628 B21R2.4782 Cc1cccc(c1F)OCC(=O)OCc2ccccc2 7a_100000751311_100000753625 [0,2,0,0,0,0|1,0,1]=4 11629 B21R2.4782 Cc1cccc(c1F)SCC(=O)OCc2ccccc2 62a_100000717567_100000753625 [0,2,0,0,0,0|1,0,1]=4 11630 B21R2.4782 Cc1cccc(c1F)SCC(=O)OCc2ccccc2 62a_100000753625_100000717567 [0,2,0,0,0,0|1,0,1]=4 11631 B21R2.4782 Cc1cccc(c1I)NCC(=O)OCc2ccccc2 34a_100000761888_100000753625 [0,2,0,0,0,0|1,0,1]=4 11632 B21R2.4782 Cc1cccc(c1I)OCC(=O)OCc2ccccc2 34a_100010083724_100000753625 [0,2,0,0,0,0|1,0,1]=4 11633 B21R2.4782 Cc1cccc(c1I)OCC(=O)OCc2ccccc2 7a_100010083724_100000753625 [0,2,0,0,0,0|1,0,1]=4 11634 B21R2.4782 Cc1cccc(c1N)OCC(=O)OCc2ccccc2 34a_100000743429_100000753625 [0,2,0,0,0,0|1,0,1]=4 11635 B21R2.4782 Cc1cccc(c1N)OCC(=O)OCc2ccccc2 7a_100000743429_100000753625 [0,2,0,0,0,0|1,0,1]=4 11636 B21R2.4782 Cc1cccc(c1N)SCC(=O)OCc2ccccc2 62a_100000753625_100011834072 [0,2,0,0,0,0|1,0,1]=4 11637 B21R2.4782 Cc1cccc(c1N)SCC(=O)OCc2ccccc2 62a_100011834072_100000753625 [0,2,0,0,0,0|1,0,1]=4 11638 B21R2.4782 Cc1cccc(c1O)CNC(=O)C=Cc2ccccc2 11a_100020639391_100000210462 [0,2,0,0,0,0|1,0,0]=3 11639 B21R2.4782 Cc1cccc(c1O)CNC(=O)C=Cc2ccccn2 11a_100020639391_100000740811 [0,2,0,0,0,0|2,0,0]=4 11640 B21R2.4782 Cc1cccc(c1O)CNC(=O)C=Cc2ccccn2 240690a_100020639391_100000740811 [0,2,0,0,0,0|2,0,0]=4 11641 B21R2.4782 Cc1cccc(c1O)CNC(=O)C=Cc2cccnc2 11a_100020639391_100000735890 [0,2,0,0,0,0|2,0,0]=4 11642 B21R2.4782 Cc1cccc(c1O)CNC(=O)C=Cc2cccnc2 240690a_100020639391_100000735890 [0,2,0,0,0,0|2,0,0]=4 11643 B21R2.4782 Cc1cccc(c1O)CNC(=O)C=Cc2ccncc2 240690a_100020639391_100000682801 [0,2,0,0,0,0|2,0,0]=4 11644 B21R2.4782 Cc1cccc(c1O)NCC(=O)OCc2ccccc2 34a_100000756359_100000753625 [0,2,0,0,0,0|1,0,1]=4 11645 B21R2.4782 Cc1cccc(c1O)SCC(=O)OCc2ccccc2 62a_100000753625_100009817157 [0,2,0,0,0,0|1,0,1]=4 11646 B21R2.4782 Cc1cccc(c1O)SCC(=O)OCc2ccccc2 62a_100009817157_100000753625 [0,2,0,0,0,0|1,0,1]=4 11647 B21R2.4782 Nc1c(cccc1OCC(=O)OCc2ccccc2)Br 34a_100011934926_100000753625 [0,2,0,0,0,0|1,0,1]=4 11648 B21R2.4782 Nc1c(cccc1OCC(=O)OCc2ccccc2)Br 7a_100011934926_100000753625 [0,2,0,0,0,0|1,0,1]=4 11649 B21R2.4782 Nc1c(cccc1OCC(=O)OCc2ccccc2)Cl 34a_100012022510_100000753625 [0,2,0,0,0,0|1,0,1]=4 11650 B21R2.4782 Nc1c(cccc1OCC(=O)OCc2ccccc2)Cl 7a_100012022510_100000753625 [0,2,0,0,0,0|1,0,1]=4 11651 B21R2.4782 Nc1c(cccc1OCC(=O)OCc2ccccc2)F 34a_100020591140_100000753625 [0,2,0,0,0,0|1,0,1]=4 11652 B21R2.4782 Nc1c(cccc1OCC(=O)OCc2ccccc2)F 7a_100020591140_100000753625 [0,2,0,0,0,0|1,0,1]=4 11653 B21R2.4782 Nc1c(cccc1OCC(=O)OCc2ccccc2)I 34a_200000049512_100000753625 [0,2,0,0,0,0|1,0,1]=4 11654 B21R2.4782 Nc1c(cccc1OCC(=O)OCc2ccccc2)I 7a_200000049512_100000753625 [0,2,0,0,0,0|1,0,1]=4 11655 B21R2.4782 Nc1c(cccc1SCC(=O)OCc2ccccc2)Br 62a_100000753625_100010146558 [0,2,0,0,0,0|1,0,1]=4 11656 B21R2.4782 Nc1c(cccc1SCC(=O)OCc2ccccc2)Br 62a_100010146558_100000753625 [0,2,0,0,0,0|1,0,1]=4 11657 B21R2.4782 Nc1c(cccc1SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100010190421 [0,2,0,0,0,0|1,0,1]=4 11658 B21R2.4782 Nc1c(cccc1SCC(=O)OCc2ccccc2)Cl 62a_100010190421_100000753625 [0,2,0,0,0,0|1,0,1]=4 11659 B21R2.4782 Nc1c(cccc1SCC(=O)OCc2ccccc2)F 62a_100000042321_100000753625 [0,2,0,0,0,0|1,0,1]=4 11660 B21R2.4782 Nc1c(cccc1SCC(=O)OCc2ccccc2)F 62a_100000753625_100000042321 [0,2,0,0,0,0|1,0,1]=4 11661 B21R2.4782 Nc1c(cccc1SCC(=O)OCc2ccccc2)O 62a_100000753625_100011934926 [0,2,0,0,0,0|1,0,1]=4 11662 B21R2.4782 Nc1cccc(c1Br)OCC(=O)OCc2ccccc2 34a_100012183704_100000753625 [0,2,0,0,0,0|1,0,1]=4 11663 B21R2.4782 Nc1cccc(c1Br)OCC(=O)OCc2ccccc2 7a_100012183704_100000753625 [0,2,0,0,0,0|1,0,1]=4 11664 B21R2.4782 Nc1cccc(c1Cl)OCC(=O)OCc2ccccc2 34a_100012002038_100000753625 [0,2,0,0,0,0|1,0,1]=4 11665 B21R2.4782 Nc1cccc(c1Cl)OCC(=O)OCc2ccccc2 7a_100012002038_100000753625 [0,2,0,0,0,0|1,0,1]=4 11666 B21R2.4782 Nc1cccc(c1F)SCC(=O)OCc2ccccc2 62a_100000753625_100011935091 [0,2,0,0,0,0|1,0,1]=4 11667 B21R2.4782 Nc1cccc(c1F)SCC(=O)OCc2ccccc2 62a_100011935091_100000753625 [0,2,0,0,0,0|1,0,1]=4 11668 B21R2.4782 Nc1cccc(c1N)OCC(=O)OCc2ccccc2 34a_100000033209_100000753625 [0,2,0,0,0,0|1,0,1]=4 11669 B21R2.4782 Nc1cccc(c1N)SCC(=O)OCc2ccccc2 62a_100015191791_100000753625 [0,2,0,0,0,0|1,0,1]=4 11670 B21R2.4782 Nc1cccc(c1O)SCC(=O)OCc2ccccc2 62a_100000753625_100010084371 [0,2,0,0,0,0|1,0,1]=4 11671 B21R2.4782 Nc1cccc(c1O)SCC(=O)OCc2ccccc2 62a_100011934915_100000753625 [0,2,0,0,0,0|1,0,1]=4 11672 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)CCc2ccccc2 1458a_100000184505_100000765856 [0,2,0,0,0,0|1,0,0]=3 11673 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)CCc2ccccn2 1458a_100000184505_100015183660 [0,2,0,0,0,0|2,0,0]=4 11674 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)CCc2cccnc2 1458a_100000184505_200011713674 [0,2,0,0,0,0|2,0,0]=4 11675 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)CCc2ccncc2 1458a_100000184505_100000723409 [0,2,0,0,0,0|2,0,0]=4 11676 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccccc2 11a_100015324214_100000184505 [0,2,0,0,0,0|1,0,0]=3 11677 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccccc2 1626a_100015324214_100000184505 [0,2,0,0,0,0|1,0,0]=3 11678 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccccc2 240690a_100015324214_100000184505 [0,2,0,0,0,0|1,0,0]=3 11679 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccccn2 11a_100000210449_100000184505 [0,2,0,0,0,0|2,0,0]=4 11680 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccccn2 1626a_100000210449_100000184505 [0,2,0,0,0,0|2,0,0]=4 11681 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccccn2 240690a_100000210449_100000184505 [0,2,0,0,0,0|2,0,0]=4 11682 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2cccnc2 11a_100000210453_100000184505 [0,2,0,0,0,0|2,0,0]=4 11683 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2cccnc2 240690a_100000210453_100000184505 [0,2,0,0,0,0|2,0,0]=4 11684 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccncc2 11a_100000210450_100000184505 [0,2,0,0,0,0|2,0,0]=4 11685 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccncc2 1626a_100000210450_100000184505 [0,2,0,0,0,0|2,0,0]=4 11686 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NCc2ccncc2 240690a_100000210450_100000184505 [0,2,0,0,0,0|2,0,0]=4 11687 B21R2.4782 O=C(C=Cc1cccc(c1Cl)Cl)NNc2ccccc2 22a_100015195140_100000184505 [0,2,0,0,0,0|2,0,0]=4 11688 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)CCc2ccccc2 1458a_100012351547_100000765856 [0,2,0,0,0,0|1,0,0]=3 11689 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)CCc2ccccn2 1458a_100012351547_100015183660 [0,2,0,0,0,0|2,0,0]=4 11690 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)CCc2cccnc2 1458a_100012351547_200011713674 [0,2,0,0,0,0|2,0,0]=4 11691 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)CCc2ccncc2 1458a_100012351547_100000723409 [0,2,0,0,0,0|2,0,0]=4 11692 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccccc2 11a_100015324214_100012351547 [0,2,0,0,0,0|1,0,0]=3 11693 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccccc2 1626a_100015324214_100012351547 [0,2,0,0,0,0|1,0,0]=3 11694 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccccc2 240690a_100015324214_100012351547 [0,2,0,0,0,0|1,0,0]=3 11695 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccccn2 11a_100000210449_100012351547 [0,2,0,0,0,0|2,0,0]=4 11696 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccccn2 1626a_100000210449_100012351547 [0,2,0,0,0,0|2,0,0]=4 11697 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccccn2 240690a_100000210449_100012351547 [0,2,0,0,0,0|2,0,0]=4 11698 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2cccnc2 11a_100000210453_100012351547 [0,2,0,0,0,0|2,0,0]=4 11699 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2cccnc2 240690a_100000210453_100012351547 [0,2,0,0,0,0|2,0,0]=4 11700 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccncc2 11a_100000210450_100012351547 [0,2,0,0,0,0|2,0,0]=4 11701 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccncc2 1626a_100000210450_100012351547 [0,2,0,0,0,0|2,0,0]=4 11702 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NCc2ccncc2 240690a_100000210450_100012351547 [0,2,0,0,0,0|2,0,0]=4 11703 B21R2.4782 O=C(C=Cc1cccc(c1F)Br)NNc2ccccc2 22a_100015195140_100012351547 [0,2,0,0,0,0|2,0,0]=4 11704 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)CCc2ccccc2 1458a_100011217667_100000765856 [0,2,0,0,0,0|1,0,0]=3 11705 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)CCc2ccccn2 1458a_100011217667_100015183660 [0,2,0,0,0,0|2,0,0]=4 11706 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)CCc2cccnc2 1458a_100011217667_200011713674 [0,2,0,0,0,0|2,0,0]=4 11707 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)CCc2ccncc2 1458a_100011217667_100000723409 [0,2,0,0,0,0|2,0,0]=4 11708 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccccc2 11a_100015324214_100011217667 [0,2,0,0,0,0|1,0,0]=3 11709 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccccc2 1626a_100015324214_100011217667 [0,2,0,0,0,0|1,0,0]=3 11710 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccccc2 240690a_100015324214_100011217667 [0,2,0,0,0,0|1,0,0]=3 11711 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccccn2 11a_100000210449_100011217667 [0,2,0,0,0,0|2,0,0]=4 11712 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccccn2 1626a_100000210449_100011217667 [0,2,0,0,0,0|2,0,0]=4 11713 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccccn2 240690a_100000210449_100011217667 [0,2,0,0,0,0|2,0,0]=4 11714 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2cccnc2 11a_100000210453_100011217667 [0,2,0,0,0,0|2,0,0]=4 11715 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2cccnc2 240690a_100000210453_100011217667 [0,2,0,0,0,0|2,0,0]=4 11716 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccncc2 11a_100000210450_100011217667 [0,2,0,0,0,0|2,0,0]=4 11717 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccncc2 1626a_100000210450_100011217667 [0,2,0,0,0,0|2,0,0]=4 11718 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NCc2ccncc2 240690a_100000210450_100011217667 [0,2,0,0,0,0|2,0,0]=4 11719 B21R2.4782 O=C(C=Cc1cccc(c1F)Cl)NNc2ccccc2 22a_100015195140_100011217667 [0,2,0,0,0,0|2,0,0]=4 11720 B21R2.4782 O=C(C=Cc1cccc(c1F)F)CCc2ccccc2 1458a_100102526107_100000765856 [0,2,0,0,0,0|1,0,0]=3 11721 B21R2.4782 O=C(C=Cc1cccc(c1F)F)CCc2ccccc2 6a_100000753312_100000210092 [0,2,0,0,0,0|1,0,0]=3 11722 B21R2.4782 O=C(C=Cc1cccc(c1F)F)CCc2ccccn2 1458a_100102526107_100015183660 [0,2,0,0,0,0|2,0,0]=4 11723 B21R2.4782 O=C(C=Cc1cccc(c1F)F)CCc2cccnc2 1458a_100102526107_200011713674 [0,2,0,0,0,0|2,0,0]=4 11724 B21R2.4782 O=C(C=Cc1cccc(c1F)F)CCc2ccncc2 1458a_100102526107_100000723409 [0,2,0,0,0,0|2,0,0]=4 11725 B21R2.4782 O=C(C=Cc1cccc(c1F)F)COc2ccccc2 6a_100000753312_100000150576 [0,2,0,0,0,0|2,0,0]=4 11726 B21R2.4782 O=C(C=Cc1cccc(c1F)F)CSc2ccccc2 6a_100000753312_100000150717 [0,2,0,0,0,0|2,0,0]=4 11727 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccccc2 11a_100015324214_100102526107 [0,2,0,0,0,0|1,0,0]=3 11728 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccccc2 1626a_100015324214_100102526107 [0,2,0,0,0,0|1,0,0]=3 11729 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccccc2 240690a_100015324214_100102526107 [0,2,0,0,0,0|1,0,0]=3 11730 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccccn2 11a_100000210449_100102526107 [0,2,0,0,0,0|2,0,0]=4 11731 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccccn2 1626a_100000210449_100102526107 [0,2,0,0,0,0|2,0,0]=4 11732 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccccn2 240690a_100000210449_100102526107 [0,2,0,0,0,0|2,0,0]=4 11733 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2cccnc2 11a_100000210453_100102526107 [0,2,0,0,0,0|2,0,0]=4 11734 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2cccnc2 240690a_100000210453_100102526107 [0,2,0,0,0,0|2,0,0]=4 11735 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccncc2 11a_100000210450_100102526107 [0,2,0,0,0,0|2,0,0]=4 11736 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccncc2 1626a_100000210450_100102526107 [0,2,0,0,0,0|2,0,0]=4 11737 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NCc2ccncc2 240690a_100000210450_100102526107 [0,2,0,0,0,0|2,0,0]=4 11738 B21R2.4782 O=C(C=Cc1cccc(c1F)F)NNc2ccccc2 22a_100015195140_100102526107 [0,2,0,0,0,0|2,0,0]=4 11739 B21R2.4782 O=C(C=Cc1cccc(c1F)I)CCc2ccccc2 6a_100010202174_100000210092 [0,2,0,0,0,0|1,0,0]=3 11740 B21R2.4782 O=C(C=Cc1cccc(c1F)I)COc2ccccc2 6a_100010202174_100000150576 [0,2,0,0,0,0|2,0,0]=4 11741 B21R2.4782 O=C(C=Cc1cccc(c1F)I)CSc2ccccc2 6a_100010202174_100000150717 [0,2,0,0,0,0|2,0,0]=4 11742 B21R2.4782 O=C(C=Cc1cccc(c1I)F)CCc2ccccc2 6a_100010186293_100000210092 [0,2,0,0,0,0|1,0,0]=3 11743 B21R2.4782 O=C(C=Cc1cccc(c1I)F)COc2ccccc2 6a_100010186293_100000150576 [0,2,0,0,0,0|2,0,0]=4 11744 B21R2.4782 O=C(C=Cc1cccc(c1I)F)CSc2ccccc2 6a_100010186293_100000150717 [0,2,0,0,0,0|2,0,0]=4 11745 B21R2.4782 O=C(C=Cc1ccccc1)CCc2cccc(c2Cl)Cl 1458a_100000210462_100000723033 [0,2,0,0,0,0|1,0,0]=3 11746 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2Br)F 11a_100020638964_100000210462 [0,2,0,0,0,0|1,0,0]=3 11747 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2Br)F 1626a_100020638964_100000210462 [0,2,0,0,0,0|1,0,0]=3 11748 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2Cl)Cl 11a_100011211633_100000210462 [0,2,0,0,0,0|1,0,0]=3 11749 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2Cl)Cl 1626a_100011211633_100000210462 [0,2,0,0,0,0|1,0,0]=3 11750 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2Cl)F 11a_100012001614_100000210462 [0,2,0,0,0,0|1,0,0]=3 11751 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2Cl)F 1626a_100012001614_100000210462 [0,2,0,0,0,0|1,0,0]=3 11752 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2F)Br 11a_100015189953_100000210462 [0,2,0,0,0,0|1,0,0]=3 11753 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2F)Br 1626a_100015189953_100000210462 [0,2,0,0,0,0|1,0,0]=3 11754 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2F)Cl 11a_100000764326_100000210462 [0,2,0,0,0,0|1,0,0]=3 11755 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2F)Cl 1626a_100000764326_100000210462 [0,2,0,0,0,0|1,0,0]=3 11756 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2F)F 11a_100011199105_100000210462 [0,2,0,0,0,0|1,0,0]=3 11757 B21R2.4782 O=C(C=Cc1ccccc1)NCc2cccc(c2F)F 1626a_100011199105_100000210462 [0,2,0,0,0,0|1,0,0]=3 11758 B21R2.4782 O=C(C=Cc1ccccc1)NNc2cccc(c2Br)Cl 22a_100102837889_100000210462 [0,2,0,0,0,0|2,0,0]=4 11759 B21R2.4782 O=C(C=Cc1ccccc1)NNc2cccc(c2Cl)Cl 22a_100000009159_100000210462 [0,2,0,0,0,0|2,0,0]=4 11760 B21R2.4782 O=C(C=Cc1ccccc1)NNc2cccc(c2Cl)F 22a_100000122369_100000210462 [0,2,0,0,0,0|2,0,0]=4 11761 B21R2.4782 O=C(C=Cc1ccccc1)NNc2cccc(c2F)Cl 22a_100000746303_100000210462 [0,2,0,0,0,0|2,0,0]=4 11762 B21R2.4782 O=C(C=Cc1ccccc1)NNc2cccc(c2F)F 22a_100020612164_100000210462 [0,2,0,0,0,0|2,0,0]=4 11763 B21R2.4782 O=C(C=Cc1ccccn1)CCc2cccc(c2Cl)Cl 1458a_100000740811_100000723033 [0,2,0,0,0,0|2,0,0]=4 11764 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2Br)F 11a_100020638964_100000740811 [0,2,0,0,0,0|2,0,0]=4 11765 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2Br)F 240690a_100020638964_100000740811 [0,2,0,0,0,0|2,0,0]=4 11766 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2Cl)Cl 11a_100011211633_100000740811 [0,2,0,0,0,0|2,0,0]=4 11767 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2Cl)Cl 240690a_100011211633_100000740811 [0,2,0,0,0,0|2,0,0]=4 11768 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2Cl)F 11a_100012001614_100000740811 [0,2,0,0,0,0|2,0,0]=4 11769 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2Cl)F 240690a_100012001614_100000740811 [0,2,0,0,0,0|2,0,0]=4 11770 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2F)Br 11a_100015189953_100000740811 [0,2,0,0,0,0|2,0,0]=4 11771 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2F)Br 240690a_100015189953_100000740811 [0,2,0,0,0,0|2,0,0]=4 11772 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2F)Cl 11a_100000764326_100000740811 [0,2,0,0,0,0|2,0,0]=4 11773 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2F)Cl 240690a_100000764326_100000740811 [0,2,0,0,0,0|2,0,0]=4 11774 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2F)F 11a_100011199105_100000740811 [0,2,0,0,0,0|2,0,0]=4 11775 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2F)F 240690a_100011199105_100000740811 [0,2,0,0,0,0|2,0,0]=4 11776 B21R2.4782 O=C(C=Cc1ccccn1)NCc2cccc(c2F)O 240690a_100025773512_100000740811 [0,2,0,0,0,0|2,0,0]=4 11777 B21R2.4782 O=C(C=Cc1cccnc1)CCc2cccc(c2Cl)Cl 1458a_100000735890_100000723033 [0,2,0,0,0,0|2,0,0]=4 11778 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2Br)F 11a_100020638964_100000735890 [0,2,0,0,0,0|2,0,0]=4 11779 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2Br)F 240690a_100020638964_100000735890 [0,2,0,0,0,0|2,0,0]=4 11780 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2Cl)Cl 11a_100011211633_100000735890 [0,2,0,0,0,0|2,0,0]=4 11781 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2Cl)Cl 240690a_100011211633_100000735890 [0,2,0,0,0,0|2,0,0]=4 11782 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2Cl)F 11a_100012001614_100000735890 [0,2,0,0,0,0|2,0,0]=4 11783 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2Cl)F 240690a_100012001614_100000735890 [0,2,0,0,0,0|2,0,0]=4 11784 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2F)Br 11a_100015189953_100000735890 [0,2,0,0,0,0|2,0,0]=4 11785 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2F)Br 240690a_100015189953_100000735890 [0,2,0,0,0,0|2,0,0]=4 11786 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2F)Cl 11a_100000764326_100000735890 [0,2,0,0,0,0|2,0,0]=4 11787 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2F)Cl 240690a_100000764326_100000735890 [0,2,0,0,0,0|2,0,0]=4 11788 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2F)F 11a_100011199105_100000735890 [0,2,0,0,0,0|2,0,0]=4 11789 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2F)F 240690a_100011199105_100000735890 [0,2,0,0,0,0|2,0,0]=4 11790 B21R2.4782 O=C(C=Cc1cccnc1)NCc2cccc(c2F)O 240690a_100025773512_100000735890 [0,2,0,0,0,0|2,0,0]=4 11791 B21R2.4782 O=C(C=Cc1ccncc1)CCc2cccc(c2Cl)Cl 1458a_100000682801_100000723033 [0,2,0,0,0,0|2,0,0]=4 11792 B21R2.4782 O=C(C=Cc1ccncc1)NCc2cccc(c2Br)F 240690a_100020638964_100000682801 [0,2,0,0,0,0|2,0,0]=4 11793 B21R2.4782 O=C(C=Cc1ccncc1)NCc2cccc(c2Cl)Cl 240690a_100011211633_100000682801 [0,2,0,0,0,0|2,0,0]=4 11794 B21R2.4782 O=C(C=Cc1ccncc1)NCc2cccc(c2Cl)F 240690a_100012001614_100000682801 [0,2,0,0,0,0|2,0,0]=4 11795 B21R2.4782 O=C(C=Cc1ccncc1)NCc2cccc(c2F)Br 240690a_100015189953_100000682801 [0,2,0,0,0,0|2,0,0]=4 11796 B21R2.4782 O=C(C=Cc1ccncc1)NCc2cccc(c2F)Cl 240690a_100000764326_100000682801 [0,2,0,0,0,0|2,0,0]=4 11797 B21R2.4782 O=C(C=Cc1ccncc1)NCc2cccc(c2F)F 240690a_100011199105_100000682801 [0,2,0,0,0,0|2,0,0]=4 11798 B21R2.4782 O=C(C=Cc1ccncc1)NCc2cccc(c2F)O 240690a_100025773512_100000682801 [0,2,0,0,0,0|2,0,0]=4 11799 B21R2.4782 O=C(CNc1cccc(c1Br)Cl)OCc2ccccc2 34a_100000687072_100000753625 [0,2,0,0,0,0|1,0,1]=4 11800 B21R2.4782 O=C(CNc1cccc(c1Br)F)OCc2ccccc2 34a_100011934729_100000753625 [0,2,0,0,0,0|1,0,1]=4 11801 B21R2.4782 O=C(CNc1cccc(c1Br)O)OCc2ccccc2 34a_100012183704_100000753625 [0,2,0,0,0,0|1,0,1]=4 11802 B21R2.4782 O=C(CNc1cccc(c1Br)O)OCc2ccccc2 7a_100012183704_100000753625 [0,2,0,0,0,0|1,0,1]=4 11803 B21R2.4782 O=C(CNc1cccc(c1Cl)Br)OCc2ccccc2 34a_100000687075_100000753625 [0,2,0,0,0,0|1,0,1]=4 11804 B21R2.4782 O=C(CNc1cccc(c1Cl)Cl)OCc2ccccc2 34a_100000185733_100000753625 [0,2,0,0,0,0|1,0,1]=4 11805 B21R2.4782 O=C(CNc1cccc(c1Cl)F)OCc2ccccc2 34a_100000692321_100000753625 [0,2,0,0,0,0|1,0,1]=4 11806 B21R2.4782 O=C(CNc1cccc(c1Cl)O)OCc2ccccc2 34a_100012002038_100000753625 [0,2,0,0,0,0|1,0,1]=4 11807 B21R2.4782 O=C(CNc1cccc(c1Cl)O)OCc2ccccc2 7a_100012002038_100000753625 [0,2,0,0,0,0|1,0,1]=4 11808 B21R2.4782 O=C(CNc1cccc(c1F)Br)OCc2ccccc2 2230a_100011935091_100000753625 [0,2,0,0,0,0|1,0,1]=4 11809 B21R2.4782 O=C(CNc1cccc(c1F)Br)OCc2ccccc2 34a_100011935091_100000753625 [0,2,0,0,0,0|1,0,1]=4 11810 B21R2.4782 O=C(CNc1cccc(c1F)Cl)OCc2ccccc2 2230a_100000199060_100000753625 [0,2,0,0,0,0|1,0,1]=4 11811 B21R2.4782 O=C(CNc1cccc(c1F)Cl)OCc2ccccc2 34a_100000199060_100000753625 [0,2,0,0,0,0|1,0,1]=4 11812 B21R2.4782 O=C(CNc1cccc(c1F)F)OCc2ccccc2 34a_100000743855_100000753625 [0,2,0,0,0,0|1,0,1]=4 11813 B21R2.4782 O=C(CNc1cccc(c1I)Br)OCc2ccccc2 34a_100020590159_100000753625 [0,2,0,0,0,0|1,0,1]=4 11814 B21R2.4782 O=C(CNc1cccc(c1I)Cl)OCc2ccccc2 34a_100000049713_100000753625 [0,2,0,0,0,0|1,0,1]=4 11815 B21R2.4782 O=C(CNc1cccc(c1I)F)OCc2ccccc2 34a_100000690935_100000753625 [0,2,0,0,0,0|1,0,1]=4 11816 B21R2.4782 O=C(CNc1cccc(c1O)Br)OCc2ccccc2 34a_100011934915_100000753625 [0,2,0,0,0,0|1,0,1]=4 11817 B21R2.4782 O=C(CNc1cccc(c1O)Cl)OCc2ccccc2 34a_100000754742_100000753625 [0,2,0,0,0,0|1,0,1]=4 11818 B21R2.4782 O=C(CNc1cccc(c1O)F)OCc2ccccc2 34a_100011934987_100000753625 [0,2,0,0,0,0|1,0,1]=4 11819 B21R2.4782 O=C(COc1cccc(c1Br)Br)OCc2ccccc2 34a_100010187966_100000753625 [0,2,0,0,0,0|1,0,1]=4 11820 B21R2.4782 O=C(COc1cccc(c1Br)Br)OCc2ccccc2 7a_100010187966_100000753625 [0,2,0,0,0,0|1,0,1]=4 11821 B21R2.4782 O=C(COc1cccc(c1Br)Cl)OCc2ccccc2 34a_100012348804_100000753625 [0,2,0,0,0,0|1,0,1]=4 11822 B21R2.4782 O=C(COc1cccc(c1Br)Cl)OCc2ccccc2 7a_100012348804_100000753625 [0,2,0,0,0,0|1,0,1]=4 11823 B21R2.4782 O=C(COc1cccc(c1Br)F)OCc2ccccc2 34a_100009820682_100000753625 [0,2,0,0,0,0|1,0,1]=4 11824 B21R2.4782 O=C(COc1cccc(c1Br)F)OCc2ccccc2 7a_100009820682_100000753625 [0,2,0,0,0,0|1,0,1]=4 11825 B21R2.4782 O=C(COc1cccc(c1Br)I)OCc2ccccc2 34a_100010187914_100000753625 [0,2,0,0,0,0|1,0,1]=4 11826 B21R2.4782 O=C(COc1cccc(c1Br)I)OCc2ccccc2 7a_100010187914_100000753625 [0,2,0,0,0,0|1,0,1]=4 11827 B21R2.4782 O=C(COc1cccc(c1Cl)Br)OCc2ccccc2 34a_100010187913_100000753625 [0,2,0,0,0,0|1,0,1]=4 11828 B21R2.4782 O=C(COc1cccc(c1Cl)Br)OCc2ccccc2 7a_100010187913_100000753625 [0,2,0,0,0,0|1,0,1]=4 11829 B21R2.4782 O=C(COc1cccc(c1Cl)Cl)OCc2ccccc2 34a_100000211076_100000753625 [0,2,0,0,0,0|1,0,1]=4 11830 B21R2.4782 O=C(COc1cccc(c1Cl)Cl)OCc2ccccc2 7a_100000211076_100000753625 [0,2,0,0,0,0|1,0,1]=4 11831 B21R2.4782 O=C(COc1cccc(c1Cl)F)OCc2ccccc2 34a_100000087408_100000753625 [0,2,0,0,0,0|1,0,1]=4 11832 B21R2.4782 O=C(COc1cccc(c1Cl)F)OCc2ccccc2 7a_100000087408_100000753625 [0,2,0,0,0,0|1,0,1]=4 11833 B21R2.4782 O=C(COc1cccc(c1Cl)I)OCc2ccccc2 34a_100000049636_100000753625 [0,2,0,0,0,0|1,0,1]=4 11834 B21R2.4782 O=C(COc1cccc(c1Cl)I)OCc2ccccc2 7a_100000049636_100000753625 [0,2,0,0,0,0|1,0,1]=4 11835 B21R2.4782 O=C(COc1cccc(c1F)Br)OCc2ccccc2 34a_100009817021_100000753625 [0,2,0,0,0,0|1,0,1]=4 11836 B21R2.4782 O=C(COc1cccc(c1F)Br)OCc2ccccc2 7a_100009817021_100000753625 [0,2,0,0,0,0|1,0,1]=4 11837 B21R2.4782 O=C(COc1cccc(c1F)Cl)OCc2ccccc2 34a_100000687438_100000753625 [0,2,0,0,0,0|1,0,1]=4 11838 B21R2.4782 O=C(COc1cccc(c1F)Cl)OCc2ccccc2 7a_100000687438_100000753625 [0,2,0,0,0,0|1,0,1]=4 11839 B21R2.4782 O=C(COc1cccc(c1F)F)OCc2ccccc2 34a_100000751161_100000753625 [0,2,0,0,0,0|1,0,1]=4 11840 B21R2.4782 O=C(COc1cccc(c1F)F)OCc2ccccc2 7a_100000751161_100000753625 [0,2,0,0,0,0|1,0,1]=4 11841 B21R2.4782 O=C(COc1cccc(c1I)Br)OCc2ccccc2 34a_100010187912_100000753625 [0,2,0,0,0,0|1,0,1]=4 11842 B21R2.4782 O=C(COc1cccc(c1I)Br)OCc2ccccc2 7a_100010187912_100000753625 [0,2,0,0,0,0|1,0,1]=4 11843 B21R2.4782 O=C(COc1cccc(c1I)Cl)OCc2ccccc2 34a_100000050174_100000753625 [0,2,0,0,0,0|1,0,1]=4 11844 B21R2.4782 O=C(COc1cccc(c1I)Cl)OCc2ccccc2 7a_100000050174_100000753625 [0,2,0,0,0,0|1,0,1]=4 11845 B21R2.4782 O=C(COc1cccc(c1I)F)OCc2ccccc2 34a_100000690913_100000753625 [0,2,0,0,0,0|1,0,1]=4 11846 B21R2.4782 O=C(COc1cccc(c1I)F)OCc2ccccc2 7a_100000690913_100000753625 [0,2,0,0,0,0|1,0,1]=4 11847 B21R2.4782 O=C(CSc1cccc(c1Br)Br)OCc2ccccc2 62a_100000753625_100010175083 [0,2,0,0,0,0|1,0,1]=4 11848 B21R2.4782 O=C(CSc1cccc(c1Br)Br)OCc2ccccc2 62a_100010175083_100000753625 [0,2,0,0,0,0|1,0,1]=4 11849 B21R2.4782 O=C(CSc1cccc(c1Br)Cl)OCc2ccccc2 62a_100000753625_100014021842 [0,2,0,0,0,0|1,0,1]=4 11850 B21R2.4782 O=C(CSc1cccc(c1Br)Cl)OCc2ccccc2 62a_100014021842_100000753625 [0,2,0,0,0,0|1,0,1]=4 11851 B21R2.4782 O=C(CSc1cccc(c1Br)F)OCc2ccccc2 62a_100000753625_100010202630 [0,2,0,0,0,0|1,0,1]=4 11852 B21R2.4782 O=C(CSc1cccc(c1Br)F)OCc2ccccc2 62a_100010202630_100000753625 [0,2,0,0,0,0|1,0,1]=4 11853 B21R2.4782 O=C(CSc1cccc(c1Br)O)OCc2ccccc2 62a_100000753625_100010187914 [0,2,0,0,0,0|1,0,1]=4 11854 B21R2.4782 O=C(CSc1cccc(c1Br)O)OCc2ccccc2 62a_100010187914_100000753625 [0,2,0,0,0,0|1,0,1]=4 11855 B21R2.4782 O=C(CSc1cccc(c1Cl)Br)OCc2ccccc2 62a_100000753625_100010142854 [0,2,0,0,0,0|1,0,1]=4 11856 B21R2.4782 O=C(CSc1cccc(c1Cl)Br)OCc2ccccc2 62a_100010142854_100000753625 [0,2,0,0,0,0|1,0,1]=4 11857 B21R2.4782 O=C(CSc1cccc(c1Cl)Cl)OCc2ccccc2 62a_100000753625_100011215384 [0,2,0,0,0,0|1,0,1]=4 11858 B21R2.4782 O=C(CSc1cccc(c1Cl)Cl)OCc2ccccc2 62a_100011215384_100000753625 [0,2,0,0,0,0|1,0,1]=4 11859 B21R2.4782 O=C(CSc1cccc(c1Cl)F)OCc2ccccc2 62a_100000753625_200010234923 [0,2,0,0,0,0|1,0,1]=4 11860 B21R2.4782 O=C(CSc1cccc(c1Cl)F)OCc2ccccc2 62a_200010234923_100000753625 [0,2,0,0,0,0|1,0,1]=4 11861 B21R2.4782 O=C(CSc1cccc(c1Cl)O)OCc2ccccc2 62a_100000753625_100000049636 [0,2,0,0,0,0|1,0,1]=4 11862 B21R2.4782 O=C(CSc1cccc(c1F)Br)OCc2ccccc2 62a_100000702267_100000753625 [0,2,0,0,0,0|1,0,1]=4 11863 B21R2.4782 O=C(CSc1cccc(c1F)Br)OCc2ccccc2 62a_100000753625_100000702267 [0,2,0,0,0,0|1,0,1]=4 11864 B21R2.4782 O=C(CSc1cccc(c1F)Cl)OCc2ccccc2 62a_100000753625_100011217346 [0,2,0,0,0,0|1,0,1]=4 11865 B21R2.4782 O=C(CSc1cccc(c1F)Cl)OCc2ccccc2 62a_100011217346_100000753625 [0,2,0,0,0,0|1,0,1]=4 11866 B21R2.4782 O=C(CSc1cccc(c1F)F)OCc2ccccc2 62a_100000694657_100000753625 [0,2,0,0,0,0|1,0,1]=4 11867 B21R2.4782 O=C(CSc1cccc(c1F)F)OCc2ccccc2 62a_100000753625_100000694657 [0,2,0,0,0,0|1,0,1]=4 11868 B21R2.4782 O=C(CSc1cccc(c1F)O)OCc2ccccc2 62a_100000753625_100009817021 [0,2,0,0,0,0|1,0,1]=4 11869 B21R2.4782 O=C(CSc1cccc(c1F)O)OCc2ccccc2 62a_100009817021_100000753625 [0,2,0,0,0,0|1,0,1]=4 11870 B21R2.4782 O=C(CSc1cccc(c1O)Br)OCc2ccccc2 62a_100000753625_100010084509 [0,2,0,0,0,0|1,0,1]=4 11871 B21R2.4782 O=C(CSc1cccc(c1O)Br)OCc2ccccc2 62a_100010084509_100000753625 [0,2,0,0,0,0|1,0,1]=4 11872 B21R2.4782 O=C(CSc1cccc(c1O)Cl)OCc2ccccc2 62a_100000753625_100010202889 [0,2,0,0,0,0|1,0,1]=4 11873 B21R2.4782 O=C(CSc1cccc(c1O)Cl)OCc2ccccc2 62a_100010202889_100000753625 [0,2,0,0,0,0|1,0,1]=4 11874 B21R2.4782 O=C(CSc1cccc(c1O)F)OCc2ccccc2 62a_100000753625_100009813666 [0,2,0,0,0,0|1,0,1]=4 11875 B21R2.4782 O=C(CSc1cccc(c1O)F)OCc2ccccc2 62a_100009813666_100000753625 [0,2,0,0,0,0|1,0,1]=4 11876 B21R2.4782 O=C(CSc1cccc(c1O)O)OCc2ccccc2 62a_100000753625_100009815950 [0,2,0,0,0,0|1,0,1]=4 11877 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccc2)Br 6a_100000686105_100000210092 [0,2,0,0,0,0|1,0,0]=3 11878 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccc2)C 1458a_100016257640_100000765856 [0,2,0,0,0,0|1,0,0]=3 11879 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccc2)C 6a_100000745632_100000210092 [0,2,0,0,0,0|1,0,0]=3 11880 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccc2)Cl 6a_100000684525_100000210092 [0,2,0,0,0,0|1,0,0]=3 11881 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccc2)F 1458a_100102526130_100000765856 [0,2,0,0,0,0|1,0,0]=3 11882 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccc2)F 6a_100011217087_100000210092 [0,2,0,0,0,0|1,0,0]=3 11883 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccc2)O 6a_100009853434_100000210092 [0,2,0,0,0,0|1,0,0]=3 11884 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccn2)C 1458a_100016257640_100015183660 [0,2,0,0,0,0|2,0,0]=4 11885 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccccn2)F 1458a_100102526130_100015183660 [0,2,0,0,0,0|2,0,0]=4 11886 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2cccnc2)C 1458a_100016257640_200011713674 [0,2,0,0,0,0|2,0,0]=4 11887 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2cccnc2)F 1458a_100102526130_200011713674 [0,2,0,0,0,0|2,0,0]=4 11888 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccncc2)C 1458a_100016257640_100000723409 [0,2,0,0,0,0|2,0,0]=4 11889 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CCc2ccncc2)F 1458a_100102526130_100000723409 [0,2,0,0,0,0|2,0,0]=4 11890 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)COc2ccccc2)Br 6a_100000686105_100000150576 [0,2,0,0,0,0|2,0,0]=4 11891 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)COc2ccccc2)C 6a_100000745632_100000150576 [0,2,0,0,0,0|2,0,0]=4 11892 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)COc2ccccc2)Cl 6a_100000684525_100000150576 [0,2,0,0,0,0|2,0,0]=4 11893 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)COc2ccccc2)F 6a_100011217087_100000150576 [0,2,0,0,0,0|2,0,0]=4 11894 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)COc2ccccc2)O 6a_100009853434_100000150576 [0,2,0,0,0,0|2,0,0]=4 11895 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CSc2ccccc2)Br 6a_100000686105_100000150717 [0,2,0,0,0,0|2,0,0]=4 11896 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CSc2ccccc2)C 6a_100000745632_100000150717 [0,2,0,0,0,0|2,0,0]=4 11897 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CSc2ccccc2)Cl 6a_100000684525_100000150717 [0,2,0,0,0,0|2,0,0]=4 11898 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CSc2ccccc2)F 6a_100011217087_100000150717 [0,2,0,0,0,0|2,0,0]=4 11899 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)CSc2ccccc2)O 6a_100009853434_100000150717 [0,2,0,0,0,0|2,0,0]=4 11900 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccc2)C 11a_100015324214_100016257640 [0,2,0,0,0,0|1,0,0]=3 11901 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccc2)C 1626a_100015324214_100016257640 [0,2,0,0,0,0|1,0,0]=3 11902 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccc2)C 240690a_100015324214_100016257640 [0,2,0,0,0,0|1,0,0]=3 11903 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccc2)F 11a_100015324214_100102526130 [0,2,0,0,0,0|1,0,0]=3 11904 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccc2)F 1626a_100015324214_100102526130 [0,2,0,0,0,0|1,0,0]=3 11905 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccc2)F 240690a_100015324214_100102526130 [0,2,0,0,0,0|1,0,0]=3 11906 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccn2)C 11a_100000210449_100016257640 [0,2,0,0,0,0|2,0,0]=4 11907 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccn2)C 1626a_100000210449_100016257640 [0,2,0,0,0,0|2,0,0]=4 11908 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccn2)C 240690a_100000210449_100016257640 [0,2,0,0,0,0|2,0,0]=4 11909 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccn2)F 11a_100000210449_100102526130 [0,2,0,0,0,0|2,0,0]=4 11910 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccn2)F 1626a_100000210449_100102526130 [0,2,0,0,0,0|2,0,0]=4 11911 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccccn2)F 240690a_100000210449_100102526130 [0,2,0,0,0,0|2,0,0]=4 11912 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2cccnc2)C 11a_100000210453_100016257640 [0,2,0,0,0,0|2,0,0]=4 11913 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2cccnc2)C 240690a_100000210453_100016257640 [0,2,0,0,0,0|2,0,0]=4 11914 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2cccnc2)F 11a_100000210453_100102526130 [0,2,0,0,0,0|2,0,0]=4 11915 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2cccnc2)F 240690a_100000210453_100102526130 [0,2,0,0,0,0|2,0,0]=4 11916 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccncc2)C 11a_100000210450_100016257640 [0,2,0,0,0,0|2,0,0]=4 11917 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccncc2)C 1626a_100000210450_100016257640 [0,2,0,0,0,0|2,0,0]=4 11918 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccncc2)C 240690a_100000210450_100016257640 [0,2,0,0,0,0|2,0,0]=4 11919 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccncc2)F 11a_100000210450_100102526130 [0,2,0,0,0,0|2,0,0]=4 11920 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccncc2)F 1626a_100000210450_100102526130 [0,2,0,0,0,0|2,0,0]=4 11921 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NCc2ccncc2)F 240690a_100000210450_100102526130 [0,2,0,0,0,0|2,0,0]=4 11922 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NNc2ccccc2)C 22a_100015195140_100016257640 [0,2,0,0,0,0|2,0,0]=4 11923 B21R2.95163 Cc1cc(cc(c1)C=CC(=O)NNc2ccccc2)F 22a_100015195140_100102526130 [0,2,0,0,0,0|2,0,0]=4 11924 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccccc2)C 11a_100020591340_100000210462 [0,2,0,0,0,0|1,0,0]=3 11925 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccccc2)C 1626a_100020591340_100000210462 [0,2,0,0,0,0|1,0,0]=3 11926 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccccc2)F 11a_100011830484_100000210462 [0,2,0,0,0,0|1,0,0]=3 11927 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccccc2)F 1626a_100011830484_100000210462 [0,2,0,0,0,0|1,0,0]=3 11928 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccccn2)C 11a_100020591340_100000740811 [0,2,0,0,0,0|2,0,0]=4 11929 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccccn2)C 240690a_100020591340_100000740811 [0,2,0,0,0,0|2,0,0]=4 11930 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccccn2)F 11a_100011830484_100000740811 [0,2,0,0,0,0|2,0,0]=4 11931 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccccn2)F 240690a_100011830484_100000740811 [0,2,0,0,0,0|2,0,0]=4 11932 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2cccnc2)C 11a_100020591340_100000735890 [0,2,0,0,0,0|2,0,0]=4 11933 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2cccnc2)C 240690a_100020591340_100000735890 [0,2,0,0,0,0|2,0,0]=4 11934 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2cccnc2)F 11a_100011830484_100000735890 [0,2,0,0,0,0|2,0,0]=4 11935 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2cccnc2)F 240690a_100011830484_100000735890 [0,2,0,0,0,0|2,0,0]=4 11936 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccncc2)C 240690a_100020591340_100000682801 [0,2,0,0,0,0|2,0,0]=4 11937 B21R2.95163 Cc1cc(cc(c1)CNC(=O)C=Cc2ccncc2)F 240690a_100011830484_100000682801 [0,2,0,0,0,0|2,0,0]=4 11938 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)Br 34a_100000695972_100000753625 [0,2,0,0,0,0|1,0,1]=4 11939 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)Br 7a_100000695972_100000753625 [0,2,0,0,0,0|1,0,1]=4 11940 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)C 2230a_100000210930_100000753625 [0,2,0,0,0,0|1,0,1]=4 11941 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)C 34a_100000210930_100000753625 [0,2,0,0,0,0|1,0,1]=4 11942 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)C 7a_100000210930_100000753625 [0,2,0,0,0,0|1,0,1]=4 11943 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)Cl 2230a_100012022512_100000753625 [0,2,0,0,0,0|1,0,1]=4 11944 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)Cl 34a_100012022512_100000753625 [0,2,0,0,0,0|1,0,1]=4 11945 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)Cl 7a_100012022512_100000753625 [0,2,0,0,0,0|1,0,1]=4 11946 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)F 2230a_100000742734_100000753625 [0,2,0,0,0,0|1,0,1]=4 11947 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)F 34a_100000742734_100000753625 [0,2,0,0,0,0|1,0,1]=4 11948 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)F 7a_100000742734_100000753625 [0,2,0,0,0,0|1,0,1]=4 11949 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)O 34a_100011995906_100000753625 [0,2,0,0,0,0|1,0,1]=4 11950 B21R2.95163 Cc1cc(cc(c1)NCC(=O)OCc2ccccc2)O 7a_100011995906_100000753625 [0,2,0,0,0,0|1,0,1]=4 11951 B21R2.95163 Cc1cc(cc(c1)NNC(=O)C=Cc2ccccc2)C 22a_100000184486_100000210462 [0,2,0,0,0,0|2,0,0]=4 11952 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)Br 34a_100011999630_100000753625 [0,2,0,0,0,0|1,0,1]=4 11953 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)Br 7a_100011999630_100000753625 [0,2,0,0,0,0|1,0,1]=4 11954 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)C 34a_100000210933_100000753625 [0,2,0,0,0,0|1,0,1]=4 11955 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)C 7a_100000210933_100000753625 [0,2,0,0,0,0|1,0,1]=4 11956 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)Cl 34a_100000087485_100000753625 [0,2,0,0,0,0|1,0,1]=4 11957 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)Cl 7a_100000087485_100000753625 [0,2,0,0,0,0|1,0,1]=4 11958 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)F 34a_100011830401_100000753625 [0,2,0,0,0,0|1,0,1]=4 11959 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)F 7a_100011830401_100000753625 [0,2,0,0,0,0|1,0,1]=4 11960 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)N 34a_100011995906_100000753625 [0,2,0,0,0,0|1,0,1]=4 11961 B21R2.95163 Cc1cc(cc(c1)OCC(=O)OCc2ccccc2)N 7a_100011995906_100000753625 [0,2,0,0,0,0|1,0,1]=4 11962 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)C 62a_100000753625_100011215608 [0,2,0,0,0,0|1,0,1]=4 11963 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)C 62a_100011215608_100000753625 [0,2,0,0,0,0|1,0,1]=4 11964 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100010172791 [0,2,0,0,0,0|1,0,1]=4 11965 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)Cl 62a_100010172791_100000753625 [0,2,0,0,0,0|1,0,1]=4 11966 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)F 62a_100000753625_100011356977 [0,2,0,0,0,0|1,0,1]=4 11967 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)F 62a_100011356977_100000753625 [0,2,0,0,0,0|1,0,1]=4 11968 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)N 62a_100000695972_100000753625 [0,2,0,0,0,0|1,0,1]=4 11969 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)N 62a_100000753625_100000695972 [0,2,0,0,0,0|1,0,1]=4 11970 B21R2.95163 Cc1cc(cc(c1)SCC(=O)OCc2ccccc2)O 62a_100000753625_100011999630 [0,2,0,0,0,0|1,0,1]=4 11971 B21R2.95163 Cc1cc(cc(n1)CNC(=O)C=Cc2ccccc2)Br 11a_100010178683_100000210462 [0,2,0,0,0,0|2,0,0]=4 11972 B21R2.95163 Nc1cc(cc(c1)OCC(=O)OCc2ccccc2)Cl 34a_100000123917_100000753625 [0,2,0,0,0,0|1,0,1]=4 11973 B21R2.95163 Nc1cc(cc(c1)OCC(=O)OCc2ccccc2)Cl 7a_100000123917_100000753625 [0,2,0,0,0,0|1,0,1]=4 11974 B21R2.95163 Nc1cc(cc(c1)SCC(=O)OCc2ccccc2)Br 62a_100000753625_100009814763 [0,2,0,0,0,0|1,0,1]=4 11975 B21R2.95163 Nc1cc(cc(c1)SCC(=O)OCc2ccccc2)Br 62a_100009814763_100000753625 [0,2,0,0,0,0|1,0,1]=4 11976 B21R2.95163 Nc1cc(cc(c1)SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100010147676 [0,2,0,0,0,0|1,0,1]=4 11977 B21R2.95163 Nc1cc(cc(c1)SCC(=O)OCc2ccccc2)Cl 62a_100010147676_100000753625 [0,2,0,0,0,0|1,0,1]=4 11978 B21R2.95163 Nc1cc(cc(c1)SCC(=O)OCc2ccccc2)F 62a_100000753625_100011356972 [0,2,0,0,0,0|1,0,1]=4 11979 B21R2.95163 Nc1cc(cc(c1)SCC(=O)OCc2ccccc2)F 62a_100011356972_100000753625 [0,2,0,0,0,0|1,0,1]=4 11980 B21R2.95163 Nc1cc(cc(c1)SCC(=O)OCc2ccccc2)N 62a_100000753625_100011999608 [0,2,0,0,0,0|1,0,1]=4 11981 B21R2.95163 Nc1cc(cc(c1)SCC(=O)OCc2ccccc2)N 62a_100011999608_100000753625 [0,2,0,0,0,0|1,0,1]=4 11982 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)Br)CCc2ccccc2 6a_100000719502_100000210092 [0,2,0,0,0,0|1,0,0]=3 11983 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)Br)COc2ccccc2 6a_100000719502_100000150576 [0,2,0,0,0,0|2,0,0]=4 11984 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)Br)CSc2ccccc2 6a_100000719502_100000150717 [0,2,0,0,0,0|2,0,0]=4 11985 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)Cl)CCc2ccccc2 6a_100011934515_100000210092 [0,2,0,0,0,0|1,0,0]=3 11986 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)Cl)COc2ccccc2 6a_100011934515_100000150576 [0,2,0,0,0,0|2,0,0]=4 11987 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)Cl)CSc2ccccc2 6a_100011934515_100000150717 [0,2,0,0,0,0|2,0,0]=4 11988 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)F)CCc2ccccc2 6a_100011794424_100000210092 [0,2,0,0,0,0|1,0,0]=3 11989 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)F)COc2ccccc2 6a_100011794424_100000150576 [0,2,0,0,0,0|2,0,0]=4 11990 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)F)CSc2ccccc2 6a_100011794424_100000150717 [0,2,0,0,0,0|2,0,0]=4 11991 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)O)CCc2ccccc2 6a_100010176088_100000210092 [0,2,0,0,0,0|1,0,0]=3 11992 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)O)COc2ccccc2 6a_100010176088_100000150576 [0,2,0,0,0,0|2,0,0]=4 11993 B21R2.95163 O=C(C=Cc1cc(cc(c1)Br)O)CSc2ccccc2 6a_100010176088_100000150717 [0,2,0,0,0,0|2,0,0]=4 11994 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)CCc2ccccc2 1458a_100000234795_100000765856 [0,2,0,0,0,0|1,0,0]=3 11995 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)CCc2ccccc2 6a_100000741761_100000210092 [0,2,0,0,0,0|1,0,0]=3 11996 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)CCc2ccccn2 1458a_100000234795_100015183660 [0,2,0,0,0,0|2,0,0]=4 11997 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)CCc2cccnc2 1458a_100000234795_200011713674 [0,2,0,0,0,0|2,0,0]=4 11998 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)CCc2ccncc2 1458a_100000234795_100000723409 [0,2,0,0,0,0|2,0,0]=4 11999 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)COc2ccccc2 6a_100000741761_100000150576 [0,2,0,0,0,0|2,0,0]=4 12000 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)CSc2ccccc2 6a_100000741761_100000150717 [0,2,0,0,0,0|2,0,0]=4 12001 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccccc2 11a_100015324214_100000234795 [0,2,0,0,0,0|1,0,0]=3 12002 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccccc2 1626a_100015324214_100000234795 [0,2,0,0,0,0|1,0,0]=3 12003 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccccc2 240690a_100015324214_100000234795 [0,2,0,0,0,0|1,0,0]=3 12004 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccccn2 11a_100000210449_100000234795 [0,2,0,0,0,0|2,0,0]=4 12005 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccccn2 1626a_100000210449_100000234795 [0,2,0,0,0,0|2,0,0]=4 12006 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccccn2 240690a_100000210449_100000234795 [0,2,0,0,0,0|2,0,0]=4 12007 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2cccnc2 11a_100000210453_100000234795 [0,2,0,0,0,0|2,0,0]=4 12008 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2cccnc2 240690a_100000210453_100000234795 [0,2,0,0,0,0|2,0,0]=4 12009 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccncc2 11a_100000210450_100000234795 [0,2,0,0,0,0|2,0,0]=4 12010 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccncc2 1626a_100000210450_100000234795 [0,2,0,0,0,0|2,0,0]=4 12011 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCc2ccncc2 240690a_100000210450_100000234795 [0,2,0,0,0,0|2,0,0]=4 12012 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)Cl)NNc2ccccc2 22a_100015195140_100000234795 [0,2,0,0,0,0|2,0,0]=4 12013 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)CCc2ccccc2 1458a_100012349021_100000765856 [0,2,0,0,0,0|1,0,0]=3 12014 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)CCc2ccccc2 6a_100000703917_100000210092 [0,2,0,0,0,0|1,0,0]=3 12015 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)CCc2ccccn2 1458a_100012349021_100015183660 [0,2,0,0,0,0|2,0,0]=4 12016 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)CCc2cccnc2 1458a_100012349021_200011713674 [0,2,0,0,0,0|2,0,0]=4 12017 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)CCc2ccncc2 1458a_100012349021_100000723409 [0,2,0,0,0,0|2,0,0]=4 12018 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)COc2ccccc2 6a_100000703917_100000150576 [0,2,0,0,0,0|2,0,0]=4 12019 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)CSc2ccccc2 6a_100000703917_100000150717 [0,2,0,0,0,0|2,0,0]=4 12020 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccccc2 11a_100015324214_100012349021 [0,2,0,0,0,0|1,0,0]=3 12021 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccccc2 1626a_100015324214_100012349021 [0,2,0,0,0,0|1,0,0]=3 12022 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccccc2 240690a_100015324214_100012349021 [0,2,0,0,0,0|1,0,0]=3 12023 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccccn2 11a_100000210449_100012349021 [0,2,0,0,0,0|2,0,0]=4 12024 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccccn2 1626a_100000210449_100012349021 [0,2,0,0,0,0|2,0,0]=4 12025 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccccn2 240690a_100000210449_100012349021 [0,2,0,0,0,0|2,0,0]=4 12026 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2cccnc2 11a_100000210453_100012349021 [0,2,0,0,0,0|2,0,0]=4 12027 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2cccnc2 240690a_100000210453_100012349021 [0,2,0,0,0,0|2,0,0]=4 12028 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccncc2 11a_100000210450_100012349021 [0,2,0,0,0,0|2,0,0]=4 12029 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccncc2 1626a_100000210450_100012349021 [0,2,0,0,0,0|2,0,0]=4 12030 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NCc2ccncc2 240690a_100000210450_100012349021 [0,2,0,0,0,0|2,0,0]=4 12031 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)F)NNc2ccccc2 22a_100015195140_100012349021 [0,2,0,0,0,0|2,0,0]=4 12032 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)O)CCc2ccccc2 6a_100000050827_100000210092 [0,2,0,0,0,0|1,0,0]=3 12033 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)O)COc2ccccc2 6a_100000050827_100000150576 [0,2,0,0,0,0|2,0,0]=4 12034 B21R2.95163 O=C(C=Cc1cc(cc(c1)Cl)O)CSc2ccccc2 6a_100000050827_100000150717 [0,2,0,0,0,0|2,0,0]=4 12035 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)CCc2ccccc2 1458a_100015207409_100000765856 [0,2,0,0,0,0|1,0,0]=3 12036 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)CCc2ccccc2 6a_100000743029_100000210092 [0,2,0,0,0,0|1,0,0]=3 12037 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)CCc2ccccn2 1458a_100015207409_100015183660 [0,2,0,0,0,0|2,0,0]=4 12038 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)CCc2cccnc2 1458a_100015207409_200011713674 [0,2,0,0,0,0|2,0,0]=4 12039 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)CCc2ccncc2 1458a_100015207409_100000723409 [0,2,0,0,0,0|2,0,0]=4 12040 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)COc2ccccc2 6a_100000743029_100000150576 [0,2,0,0,0,0|2,0,0]=4 12041 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)CSc2ccccc2 6a_100000743029_100000150717 [0,2,0,0,0,0|2,0,0]=4 12042 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccccc2 11a_100015324214_100015207409 [0,2,0,0,0,0|1,0,0]=3 12043 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccccc2 1626a_100015324214_100015207409 [0,2,0,0,0,0|1,0,0]=3 12044 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccccc2 240690a_100015324214_100015207409 [0,2,0,0,0,0|1,0,0]=3 12045 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccccn2 11a_100000210449_100015207409 [0,2,0,0,0,0|2,0,0]=4 12046 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccccn2 1626a_100000210449_100015207409 [0,2,0,0,0,0|2,0,0]=4 12047 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccccn2 240690a_100000210449_100015207409 [0,2,0,0,0,0|2,0,0]=4 12048 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2cccnc2 11a_100000210453_100015207409 [0,2,0,0,0,0|2,0,0]=4 12049 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2cccnc2 240690a_100000210453_100015207409 [0,2,0,0,0,0|2,0,0]=4 12050 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccncc2 11a_100000210450_100015207409 [0,2,0,0,0,0|2,0,0]=4 12051 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccncc2 1626a_100000210450_100015207409 [0,2,0,0,0,0|2,0,0]=4 12052 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NCc2ccncc2 240690a_100000210450_100015207409 [0,2,0,0,0,0|2,0,0]=4 12053 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)F)NNc2ccccc2 22a_100015195140_100015207409 [0,2,0,0,0,0|2,0,0]=4 12054 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)O)CCc2ccccc2 6a_100000703664_100000210092 [0,2,0,0,0,0|1,0,0]=3 12055 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)O)COc2ccccc2 6a_100000703664_100000150576 [0,2,0,0,0,0|2,0,0]=4 12056 B21R2.95163 O=C(C=Cc1cc(cc(c1)F)O)CSc2ccccc2 6a_100000703664_100000150717 [0,2,0,0,0,0|2,0,0]=4 12057 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)Br)CCc2ccccc2 6a_100010185649_100000210092 [0,2,0,0,0,0|1,0,0]=3 12058 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)Br)COc2ccccc2 6a_100010185649_100000150576 [0,2,0,0,0,0|2,0,0]=4 12059 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)Br)CSc2ccccc2 6a_100010185649_100000150717 [0,2,0,0,0,0|2,0,0]=4 12060 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)F)CCc2ccccc2 6a_100010185655_100000210092 [0,2,0,0,0,0|1,0,0]=3 12061 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)F)COc2ccccc2 6a_100010185655_100000150576 [0,2,0,0,0,0|2,0,0]=4 12062 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)F)CSc2ccccc2 6a_100010185655_100000150717 [0,2,0,0,0,0|2,0,0]=4 12063 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)I)CCc2ccccc2 6a_100010185653_100000210092 [0,2,0,0,0,0|1,0,0]=3 12064 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)I)COc2ccccc2 6a_100010185653_100000150576 [0,2,0,0,0,0|2,0,0]=4 12065 B21R2.95163 O=C(C=Cc1cc(cc(c1)I)I)CSc2ccccc2 6a_100010185653_100000150717 [0,2,0,0,0,0|2,0,0]=4 12066 B21R2.95163 O=C(C=Cc1cc(cc(c1)O)O)CCc2ccccc2 6a_100000043415_100000210092 [0,2,0,0,0,0|1,0,0]=3 12067 B21R2.95163 O=C(C=Cc1cc(cc(c1)O)O)COc2ccccc2 6a_100000043415_100000150576 [0,2,0,0,0,0|2,0,0]=4 12068 B21R2.95163 O=C(C=Cc1cc(cc(c1)O)O)CSc2ccccc2 6a_100000043415_100000150717 [0,2,0,0,0,0|2,0,0]=4 12069 B21R2.95163 O=C(C=Cc1cc(cc(c1)O)O)NNc2ccccc2 22a_100015195140_200016280741 [0,2,0,0,0,0|2,0,0]=4 12070 B21R2.95163 O=C(C=Cc1ccccc1)CCc2cc(cc(c2)Cl)Cl 1458a_100000210462_100000691793 [0,2,0,0,0,0|1,0,0]=3 12071 B21R2.95163 O=C(C=Cc1ccccc1)CCc2cc(cc(c2)F)F 1458a_100000210462_100011754442 [0,2,0,0,0,0|1,0,0]=3 12072 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)Br)Br 11a_100015211796_100000210462 [0,2,0,0,0,0|1,0,0]=3 12073 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)Br)F 11a_100020611034_100000210462 [0,2,0,0,0,0|1,0,0]=3 12074 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)Br)F 1626a_100020611034_100000210462 [0,2,0,0,0,0|1,0,0]=3 12075 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)Cl)Cl 11a_100011211636_100000210462 [0,2,0,0,0,0|1,0,0]=3 12076 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)Cl)Cl 1626a_100011211636_100000210462 [0,2,0,0,0,0|1,0,0]=3 12077 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)Cl)F 11a_100137329012_100000210462 [0,2,0,0,0,0|1,0,0]=3 12078 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)Cl)F 1626a_100137329012_100000210462 [0,2,0,0,0,0|1,0,0]=3 12079 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)F)F 11a_100000737602_100000210462 [0,2,0,0,0,0|1,0,0]=3 12080 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(cc(c2)F)F 1626a_100000737602_100000210462 [0,2,0,0,0,0|1,0,0]=3 12081 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(nc(c2)Cl)Cl 11a_103437231814_100000210462 [0,2,0,0,0,0|2,0,0]=4 12082 B21R2.95163 O=C(C=Cc1ccccc1)NCc2cc(nc(c2)Cl)Cl 1626a_103437231814_100000210462 [0,2,0,0,0,0|2,0,0]=4 12083 B21R2.95163 O=C(C=Cc1ccccc1)NNc2cc(cc(c2)Cl)Cl 22a_100000716695_100000210462 [0,2,0,0,0,0|2,0,0]=4 12084 B21R2.95163 O=C(C=Cc1ccccc1)NNc2cc(cc(c2)F)F 22a_100000744470_100000210462 [0,2,0,0,0,0|2,0,0]=4 12085 B21R2.95163 O=C(C=Cc1ccccn1)CCc2cc(cc(c2)Cl)Cl 1458a_100000740811_100000691793 [0,2,0,0,0,0|2,0,0]=4 12086 B21R2.95163 O=C(C=Cc1ccccn1)CCc2cc(cc(c2)F)F 1458a_100000740811_100011754442 [0,2,0,0,0,0|2,0,0]=4 12087 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Br)Br 11a_100015211796_100000740811 [0,2,0,0,0,0|2,0,0]=4 12088 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Br)Br 240690a_100015211796_100000740811 [0,2,0,0,0,0|2,0,0]=4 12089 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Br)F 11a_100020611034_100000740811 [0,2,0,0,0,0|2,0,0]=4 12090 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Br)F 240690a_100020611034_100000740811 [0,2,0,0,0,0|2,0,0]=4 12091 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Cl)Cl 11a_100011211636_100000740811 [0,2,0,0,0,0|2,0,0]=4 12092 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Cl)Cl 240690a_100011211636_100000740811 [0,2,0,0,0,0|2,0,0]=4 12093 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Cl)F 11a_100137329012_100000740811 [0,2,0,0,0,0|2,0,0]=4 12094 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Cl)F 240690a_100137329012_100000740811 [0,2,0,0,0,0|2,0,0]=4 12095 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)Cl)O 240690a_107254831445_100000740811 [0,2,0,0,0,0|2,0,0]=4 12096 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)F)F 11a_100000737602_100000740811 [0,2,0,0,0,0|2,0,0]=4 12097 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)F)F 240690a_100000737602_100000740811 [0,2,0,0,0,0|2,0,0]=4 12098 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)F)O 240690a_100160469513_100000740811 [0,2,0,0,0,0|2,0,0]=4 12099 B21R2.95163 O=C(C=Cc1ccccn1)NCc2cc(cc(c2)O)O 240690a_100159270720_100000740811 [0,2,0,0,0,0|2,0,0]=4 12100 B21R2.95163 O=C(C=Cc1cccnc1)CCc2cc(cc(c2)Cl)Cl 1458a_100000735890_100000691793 [0,2,0,0,0,0|2,0,0]=4 12101 B21R2.95163 O=C(C=Cc1cccnc1)CCc2cc(cc(c2)F)F 1458a_100000735890_100011754442 [0,2,0,0,0,0|2,0,0]=4 12102 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Br)Br 11a_100015211796_100000735890 [0,2,0,0,0,0|2,0,0]=4 12103 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Br)Br 240690a_100015211796_100000735890 [0,2,0,0,0,0|2,0,0]=4 12104 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Br)F 11a_100020611034_100000735890 [0,2,0,0,0,0|2,0,0]=4 12105 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Br)F 240690a_100020611034_100000735890 [0,2,0,0,0,0|2,0,0]=4 12106 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Cl)Cl 11a_100011211636_100000735890 [0,2,0,0,0,0|2,0,0]=4 12107 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Cl)Cl 240690a_100011211636_100000735890 [0,2,0,0,0,0|2,0,0]=4 12108 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Cl)F 11a_100137329012_100000735890 [0,2,0,0,0,0|2,0,0]=4 12109 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Cl)F 240690a_100137329012_100000735890 [0,2,0,0,0,0|2,0,0]=4 12110 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)Cl)O 240690a_107254831445_100000735890 [0,2,0,0,0,0|2,0,0]=4 12111 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)F)F 11a_100000737602_100000735890 [0,2,0,0,0,0|2,0,0]=4 12112 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)F)F 240690a_100000737602_100000735890 [0,2,0,0,0,0|2,0,0]=4 12113 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)F)O 240690a_100160469513_100000735890 [0,2,0,0,0,0|2,0,0]=4 12114 B21R2.95163 O=C(C=Cc1cccnc1)NCc2cc(cc(c2)O)O 240690a_100159270720_100000735890 [0,2,0,0,0,0|2,0,0]=4 12115 B21R2.95163 O=C(C=Cc1ccncc1)CCc2cc(cc(c2)Cl)Cl 1458a_100000682801_100000691793 [0,2,0,0,0,0|2,0,0]=4 12116 B21R2.95163 O=C(C=Cc1ccncc1)CCc2cc(cc(c2)F)F 1458a_100000682801_100011754442 [0,2,0,0,0,0|2,0,0]=4 12117 B21R2.95163 O=C(C=Cc1ccncc1)NCc2cc(cc(c2)Br)Br 240690a_100015211796_100000682801 [0,2,0,0,0,0|2,0,0]=4 12118 B21R2.95163 O=C(C=Cc1ccncc1)NCc2cc(cc(c2)Br)F 240690a_100020611034_100000682801 [0,2,0,0,0,0|2,0,0]=4 12119 B21R2.95163 O=C(C=Cc1ccncc1)NCc2cc(cc(c2)Cl)Cl 240690a_100011211636_100000682801 [0,2,0,0,0,0|2,0,0]=4 12120 B21R2.95163 O=C(C=Cc1ccncc1)NCc2cc(cc(c2)Cl)F 240690a_100137329012_100000682801 [0,2,0,0,0,0|2,0,0]=4 12121 B21R2.95163 O=C(C=Cc1ccncc1)NCc2cc(cc(c2)Cl)O 240690a_107254831445_100000682801 [0,2,0,0,0,0|2,0,0]=4 12122 B21R2.95163 O=C(C=Cc1ccncc1)NCc2cc(cc(c2)F)F 240690a_100000737602_100000682801 [0,2,0,0,0,0|2,0,0]=4 12123 B21R2.95163 O=C(C=Cc1ccncc1)NCc2cc(cc(c2)F)O 240690a_100160469513_100000682801 [0,2,0,0,0,0|2,0,0]=4 12124 B21R2.95163 O=C(C=Cc1ccncc1)NCc2cc(cc(c2)O)O 240690a_100159270720_100000682801 [0,2,0,0,0,0|2,0,0]=4 12125 B21R2.95163 O=C(CNc1cc(cc(c1)Br)Br)OCc2ccccc2 34a_100012047176_100000753625 [0,2,0,0,0,0|1,0,1]=4 12126 B21R2.95163 O=C(CNc1cc(cc(c1)Br)Br)OCc2ccccc2 7a_100012047176_100000753625 [0,2,0,0,0,0|1,0,1]=4 12127 B21R2.95163 O=C(CNc1cc(cc(c1)Br)Cl)OCc2ccccc2 34a_100011934539_100000753625 [0,2,0,0,0,0|1,0,1]=4 12128 B21R2.95163 O=C(CNc1cc(cc(c1)Br)Cl)OCc2ccccc2 7a_100011934539_100000753625 [0,2,0,0,0,0|1,0,1]=4 12129 B21R2.95163 O=C(CNc1cc(cc(c1)Br)F)OCc2ccccc2 34a_100000705686_100000753625 [0,2,0,0,0,0|1,0,1]=4 12130 B21R2.95163 O=C(CNc1cc(cc(c1)Br)F)OCc2ccccc2 7a_100000705686_100000753625 [0,2,0,0,0,0|1,0,1]=4 12131 B21R2.95163 O=C(CNc1cc(cc(c1)Cl)Cl)OCc2ccccc2 34a_100000210456_100000753625 [0,2,0,0,0,0|1,0,1]=4 12132 B21R2.95163 O=C(CNc1cc(cc(c1)Cl)Cl)OCc2ccccc2 7a_100000210456_100000753625 [0,2,0,0,0,0|1,0,1]=4 12133 B21R2.95163 O=C(CNc1cc(cc(c1)Cl)F)OCc2ccccc2 34a_100000686136_100000753625 [0,2,0,0,0,0|1,0,1]=4 12134 B21R2.95163 O=C(CNc1cc(cc(c1)Cl)F)OCc2ccccc2 7a_100000686136_100000753625 [0,2,0,0,0,0|1,0,1]=4 12135 B21R2.95163 O=C(CNc1cc(cc(c1)Cl)O)OCc2ccccc2 34a_100000123917_100000753625 [0,2,0,0,0,0|1,0,1]=4 12136 B21R2.95163 O=C(CNc1cc(cc(c1)Cl)O)OCc2ccccc2 7a_100000123917_100000753625 [0,2,0,0,0,0|1,0,1]=4 12137 B21R2.95163 O=C(CNc1cc(cc(c1)F)F)OCc2ccccc2 34a_100000233717_100000753625 [0,2,0,0,0,0|1,0,1]=4 12138 B21R2.95163 O=C(CNc1cc(cc(c1)F)F)OCc2ccccc2 7a_100000233717_100000753625 [0,2,0,0,0,0|1,0,1]=4 12139 B21R2.95163 O=C(CNc1cc(cc(c1)I)Br)OCc2ccccc2 7a_100009814763_100000753625 [0,2,0,0,0,0|1,0,1]=4 12140 B21R2.95163 O=C(CNc1cc(cc(c1)I)Cl)OCc2ccccc2 7a_100010147676_100000753625 [0,2,0,0,0,0|1,0,1]=4 12141 B21R2.95163 O=C(CNc1cc(cc(c1)I)F)OCc2ccccc2 34a_100011356972_100000753625 [0,2,0,0,0,0|1,0,1]=4 12142 B21R2.95163 O=C(CNc1cc(cc(c1)I)F)OCc2ccccc2 7a_100011356972_100000753625 [0,2,0,0,0,0|1,0,1]=4 12143 B21R2.95163 O=C(CNc1cc(cc(c1)I)I)OCc2ccccc2 7a_200000696836_100000753625 [0,2,0,0,0,0|1,0,1]=4 12144 B21R2.95163 O=C(CNc1cc(cc(c1)O)O)OCc2ccccc2 34a_100000043371_100000753625 [0,2,0,0,0,0|1,0,1]=4 12145 B21R2.95163 O=C(COc1cc(cc(c1)Br)Br)OCc2ccccc2 34a_100010167048_100000753625 [0,2,0,0,0,0|1,0,1]=4 12146 B21R2.95163 O=C(COc1cc(cc(c1)Br)Br)OCc2ccccc2 7a_100010167048_100000753625 [0,2,0,0,0,0|1,0,1]=4 12147 B21R2.95163 O=C(COc1cc(cc(c1)Br)Cl)OCc2ccccc2 34a_100010185897_100000753625 [0,2,0,0,0,0|1,0,1]=4 12148 B21R2.95163 O=C(COc1cc(cc(c1)Br)Cl)OCc2ccccc2 7a_100010185897_100000753625 [0,2,0,0,0,0|1,0,1]=4 12149 B21R2.95163 O=C(COc1cc(cc(c1)Br)F)OCc2ccccc2 34a_100000688818_100000753625 [0,2,0,0,0,0|1,0,1]=4 12150 B21R2.95163 O=C(COc1cc(cc(c1)Br)F)OCc2ccccc2 7a_100000688818_100000753625 [0,2,0,0,0,0|1,0,1]=4 12151 B21R2.95163 O=C(COc1cc(cc(c1)Cl)Cl)OCc2ccccc2 34a_100000181315_100000753625 [0,2,0,0,0,0|1,0,1]=4 12152 B21R2.95163 O=C(COc1cc(cc(c1)Cl)Cl)OCc2ccccc2 7a_100000181315_100000753625 [0,2,0,0,0,0|1,0,1]=4 12153 B21R2.95163 O=C(COc1cc(cc(c1)Cl)F)OCc2ccccc2 34a_100011219751_100000753625 [0,2,0,0,0,0|1,0,1]=4 12154 B21R2.95163 O=C(COc1cc(cc(c1)Cl)F)OCc2ccccc2 7a_100011219751_100000753625 [0,2,0,0,0,0|1,0,1]=4 12155 B21R2.95163 O=C(COc1cc(cc(c1)F)F)OCc2ccccc2 34a_100000747503_100000753625 [0,2,0,0,0,0|1,0,1]=4 12156 B21R2.95163 O=C(COc1cc(cc(c1)F)F)OCc2ccccc2 7a_100000747503_100000753625 [0,2,0,0,0,0|1,0,1]=4 12157 B21R2.95163 O=C(COc1cc(cc(c1)I)Br)OCc2ccccc2 34a_100010068917_100000753625 [0,2,0,0,0,0|1,0,1]=4 12158 B21R2.95163 O=C(COc1cc(cc(c1)I)Br)OCc2ccccc2 7a_100010068917_100000753625 [0,2,0,0,0,0|1,0,1]=4 12159 B21R2.95163 O=C(COc1cc(cc(c1)I)Cl)OCc2ccccc2 34a_100010068924_100000753625 [0,2,0,0,0,0|1,0,1]=4 12160 B21R2.95163 O=C(COc1cc(cc(c1)I)Cl)OCc2ccccc2 7a_100010068924_100000753625 [0,2,0,0,0,0|1,0,1]=4 12161 B21R2.95163 O=C(COc1cc(cc(c1)I)F)OCc2ccccc2 34a_100000717995_100000753625 [0,2,0,0,0,0|1,0,1]=4 12162 B21R2.95163 O=C(COc1cc(cc(c1)I)F)OCc2ccccc2 7a_100000717995_100000753625 [0,2,0,0,0,0|1,0,1]=4 12163 B21R2.95163 O=C(CSc1cc(cc(c1)Br)Br)OCc2ccccc2 62a_100000753625_100009814770 [0,2,0,0,0,0|1,0,1]=4 12164 B21R2.95163 O=C(CSc1cc(cc(c1)Br)Br)OCc2ccccc2 62a_100009814770_100000753625 [0,2,0,0,0,0|1,0,1]=4 12165 B21R2.95163 O=C(CSc1cc(cc(c1)Br)Cl)OCc2ccccc2 62a_100000753625_100009814755 [0,2,0,0,0,0|1,0,1]=4 12166 B21R2.95163 O=C(CSc1cc(cc(c1)Br)Cl)OCc2ccccc2 62a_100009814755_100000753625 [0,2,0,0,0,0|1,0,1]=4 12167 B21R2.95163 O=C(CSc1cc(cc(c1)Br)F)OCc2ccccc2 62a_100000753625_100009814764 [0,2,0,0,0,0|1,0,1]=4 12168 B21R2.95163 O=C(CSc1cc(cc(c1)Br)F)OCc2ccccc2 62a_100009814764_100000753625 [0,2,0,0,0,0|1,0,1]=4 12169 B21R2.95163 O=C(CSc1cc(cc(c1)Br)O)OCc2ccccc2 62a_100000753625_100010068917 [0,2,0,0,0,0|1,0,1]=4 12170 B21R2.95163 O=C(CSc1cc(cc(c1)Br)O)OCc2ccccc2 62a_100010068917_100000753625 [0,2,0,0,0,0|1,0,1]=4 12171 B21R2.95163 O=C(CSc1cc(cc(c1)Cl)Cl)OCc2ccccc2 62a_100000747138_100000753625 [0,2,0,0,0,0|1,0,1]=4 12172 B21R2.95163 O=C(CSc1cc(cc(c1)Cl)Cl)OCc2ccccc2 62a_100000753625_100000747138 [0,2,0,0,0,0|1,0,1]=4 12173 B21R2.95163 O=C(CSc1cc(cc(c1)Cl)F)OCc2ccccc2 62a_100000753625_100013859453 [0,2,0,0,0,0|1,0,1]=4 12174 B21R2.95163 O=C(CSc1cc(cc(c1)Cl)F)OCc2ccccc2 62a_100013859453_100000753625 [0,2,0,0,0,0|1,0,1]=4 12175 B21R2.95163 O=C(CSc1cc(cc(c1)Cl)O)OCc2ccccc2 62a_100000753625_100010068924 [0,2,0,0,0,0|1,0,1]=4 12176 B21R2.95163 O=C(CSc1cc(cc(c1)Cl)O)OCc2ccccc2 62a_100010068924_100000753625 [0,2,0,0,0,0|1,0,1]=4 12177 B21R2.95163 O=C(CSc1cc(cc(c1)F)F)OCc2ccccc2 62a_100000233788_100000753625 [0,2,0,0,0,0|1,0,1]=4 12178 B21R2.95163 O=C(CSc1cc(cc(c1)F)F)OCc2ccccc2 62a_100000753625_100000233788 [0,2,0,0,0,0|1,0,1]=4 12179 B21R2.95163 O=C(CSc1cc(cc(c1)F)O)OCc2ccccc2 62a_100000688818_100000753625 [0,2,0,0,0,0|1,0,1]=4 12180 B21R2.95163 O=C(CSc1cc(cc(c1)F)O)OCc2ccccc2 62a_100000753625_100000688818 [0,2,0,0,0,0|1,0,1]=4 12181 B21R2.95163 O=C(CSc1cc(cc(c1)O)O)OCc2ccccc2 62a_100000753625_100009868816 [0,2,0,0,0,0|1,0,1]=4 12182 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2Br 11a_100011934566_100000719032 [0,2,0,0,0,0|2,0,0]=4 12183 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2Br 1626a_100011934566_100000719032 [0,2,0,0,0,0|2,0,0]=4 12184 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2Br 240690a_100011934566_100000719032 [0,2,0,0,0,0|2,0,0]=4 12185 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2C 1626a_100011934566_100016266485 [0,2,0,0,0,0|2,0,0]=4 12186 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2Cl 11a_100011934566_100000720304 [0,2,0,0,0,0|2,0,0]=4 12187 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2Cl 1626a_100011934566_100000720304 [0,2,0,0,0,0|2,0,0]=4 12188 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2Cl 240690a_100011934566_100000720304 [0,2,0,0,0,0|2,0,0]=4 12189 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2F 11a_100011934566_100016256065 [0,2,0,0,0,0|2,0,0]=4 12190 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2F 1626a_100011934566_100016256065 [0,2,0,0,0,0|2,0,0]=4 12191 B21R2.103648 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2F 240690a_100011934566_100016256065 [0,2,0,0,0,0|2,0,0]=4 12192 B21R2.103648 Cc1cccc(c1)C=CC(=O)CCc2ccccc2Br 1458a_100000690095_100012161201 [0,2,0,0,0,0|1,0,0]=3 12193 B21R2.103648 Cc1cccc(c1)C=CC(=O)CCc2ccccc2C 1458a_100000690095_100011713688 [0,2,0,0,0,0|1,0,0]=3 12194 B21R2.103648 Cc1cccc(c1)C=CC(=O)CCc2ccccc2Cl 1458a_100000690095_100011713703 [0,2,0,0,0,0|1,0,0]=3 12195 B21R2.103648 Cc1cccc(c1)C=CC(=O)CCc2ccccc2F 1458a_100000690095_100000720011 [0,2,0,0,0,0|1,0,0]=3 12196 B21R2.103648 Cc1cccc(c1)C=CC(=O)CCc2ccccc2O 1458a_100000690095_100000722297 [0,2,0,0,0,0|1,0,0]=3 12197 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2Br 11a_100000689332_100000690095 [0,2,0,0,0,0|1,0,0]=3 12198 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2Br 1626a_100000689332_100000690095 [0,2,0,0,0,0|1,0,0]=3 12199 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2Br 240690a_100000689332_100000690095 [0,2,0,0,0,0|1,0,0]=3 12200 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2C 11a_100000174972_100000690095 [0,2,0,0,0,0|1,0,0]=3 12201 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2C 1626a_100000174972_100000690095 [0,2,0,0,0,0|1,0,0]=3 12202 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2C 240690a_100000174972_100000690095 [0,2,0,0,0,0|1,0,0]=3 12203 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2Cl 11a_100000174879_100000690095 [0,2,0,0,0,0|1,0,0]=3 12204 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2Cl 1626a_100000174879_100000690095 [0,2,0,0,0,0|1,0,0]=3 12205 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2Cl 240690a_100000174879_100000690095 [0,2,0,0,0,0|1,0,0]=3 12206 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2F 11a_100000174869_100000690095 [0,2,0,0,0,0|1,0,0]=3 12207 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2F 1626a_100000174869_100000690095 [0,2,0,0,0,0|1,0,0]=3 12208 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2F 240690a_100000174869_100000690095 [0,2,0,0,0,0|1,0,0]=3 12209 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2I 11a_100015347259_100000690095 [0,2,0,0,0,0|1,0,0]=3 12210 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2I 1626a_100015347259_100000690095 [0,2,0,0,0,0|1,0,0]=3 12211 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2I 240690a_100015347259_100000690095 [0,2,0,0,0,0|1,0,0]=3 12212 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccccc2O 240690a_100000185550_100000690095 [0,2,0,0,0,0|1,0,0]=3 12213 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cccnc2Br 11a_100009818023_100000690095 [0,2,0,0,0,0|2,0,0]=4 12214 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cccnc2Br 240690a_100009818023_100000690095 [0,2,0,0,0,0|2,0,0]=4 12215 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cccnc2Cl 11a_100015189234_100000690095 [0,2,0,0,0,0|2,0,0]=4 12216 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cccnc2Cl 1626a_100015189234_100000690095 [0,2,0,0,0,0|2,0,0]=4 12217 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cccnc2Cl 240690a_100015189234_100000690095 [0,2,0,0,0,0|2,0,0]=4 12218 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cccnc2F 11a_100000724633_100000690095 [0,2,0,0,0,0|2,0,0]=4 12219 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cccnc2F 1626a_100000724633_100000690095 [0,2,0,0,0,0|2,0,0]=4 12220 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cccnc2F 240690a_100000724633_100000690095 [0,2,0,0,0,0|2,0,0]=4 12221 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccncc2Br 11a_100020640021_100000690095 [0,2,0,0,0,0|2,0,0]=4 12222 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccncc2Br 240690a_100020640021_100000690095 [0,2,0,0,0,0|2,0,0]=4 12223 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccncc2C 11a_100000708811_100000690095 [0,2,0,0,0,0|2,0,0]=4 12224 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccncc2C 1626a_100000708811_100000690095 [0,2,0,0,0,0|2,0,0]=4 12225 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccncc2C 240690a_100000708811_100000690095 [0,2,0,0,0,0|2,0,0]=4 12226 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccncc2F 11a_100011935246_100000690095 [0,2,0,0,0,0|2,0,0]=4 12227 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccncc2F 1626a_100011935246_100000690095 [0,2,0,0,0,0|2,0,0]=4 12228 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ccncc2F 240690a_100011935246_100000690095 [0,2,0,0,0,0|2,0,0]=4 12229 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cnccc2C 11a_100011997553_100000690095 [0,2,0,0,0,0|2,0,0]=4 12230 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2cnccc2C 240690a_100011997553_100000690095 [0,2,0,0,0,0|2,0,0]=4 12231 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2Br 11a_100020591323_100000690095 [0,2,0,0,0,0|2,0,0]=4 12232 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2Br 240690a_100020591323_100000690095 [0,2,0,0,0,0|2,0,0]=4 12233 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2C 11a_100011223789_100000690095 [0,2,0,0,0,0|2,0,0]=4 12234 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2C 1626a_100011223789_100000690095 [0,2,0,0,0,0|2,0,0]=4 12235 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2C 240690a_100011223789_100000690095 [0,2,0,0,0,0|2,0,0]=4 12236 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2Cl 11a_100015189233_100000690095 [0,2,0,0,0,0|2,0,0]=4 12237 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2Cl 1626a_100015189233_100000690095 [0,2,0,0,0,0|2,0,0]=4 12238 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2Cl 240690a_100015189233_100000690095 [0,2,0,0,0,0|2,0,0]=4 12239 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2F 11a_100000690088_100000690095 [0,2,0,0,0,0|2,0,0]=4 12240 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2F 1626a_100000690088_100000690095 [0,2,0,0,0,0|2,0,0]=4 12241 B21R2.103648 Cc1cccc(c1)C=CC(=O)NCc2ncccc2F 240690a_100000690088_100000690095 [0,2,0,0,0,0|2,0,0]=4 12242 B21R2.103648 Cc1cccc(c1)C=CC(=O)NNc2ccccc2Br 22a_100000241748_100000690095 [0,2,0,0,0,0|2,0,0]=4 12243 B21R2.103648 Cc1cccc(c1)C=CC(=O)NNc2ccccc2C 22a_100000184220_100000690095 [0,2,0,0,0,0|2,0,0]=4 12244 B21R2.103648 Cc1cccc(c1)C=CC(=O)NNc2ccccc2Cl 22a_100000683529_100000690095 [0,2,0,0,0,0|2,0,0]=4 12245 B21R2.103648 Cc1cccc(c1)C=CC(=O)NNc2ccccc2F 22a_100000239246_100000690095 [0,2,0,0,0,0|2,0,0]=4 12246 B21R2.103648 Cc1cccc(c1)C=CC(=O)NNc2ccccc2I 22a_100011218156_100000690095 [0,2,0,0,0,0|2,0,0]=4 12247 B21R2.103648 Cc1cccc(c1)CCC(=O)C=Cc2ccccc2Br 1458a_100000719032_100011713685 [0,2,0,0,0,0|1,0,0]=3 12248 B21R2.103648 Cc1cccc(c1)CCC(=O)C=Cc2ccccc2Cl 1458a_100000720304_100011713685 [0,2,0,0,0,0|1,0,0]=3 12249 B21R2.103648 Cc1cccc(c1)CCC(=O)C=Cc2ccccc2F 1458a_100016256065_100011713685 [0,2,0,0,0,0|1,0,0]=3 12250 B21R2.103648 Cc1cccc(c1)CCC(=O)C=Cc2ccccc2O 1458a_100016263591_100011713685 [0,2,0,0,0,0|1,0,0]=3 12251 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2Br 11a_100000185548_100000719032 [0,2,0,0,0,0|1,0,0]=3 12252 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2Br 1626a_100000185548_100000719032 [0,2,0,0,0,0|1,0,0]=3 12253 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2Br 240690a_100000185548_100000719032 [0,2,0,0,0,0|1,0,0]=3 12254 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2C 1626a_100000185548_100016266485 [0,2,0,0,0,0|1,0,0]=3 12255 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2Cl 11a_100000185548_100000720304 [0,2,0,0,0,0|1,0,0]=3 12256 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2Cl 1626a_100000185548_100000720304 [0,2,0,0,0,0|1,0,0]=3 12257 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2Cl 240690a_100000185548_100000720304 [0,2,0,0,0,0|1,0,0]=3 12258 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2F 11a_100000185548_100016256065 [0,2,0,0,0,0|1,0,0]=3 12259 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2F 1626a_100000185548_100016256065 [0,2,0,0,0,0|1,0,0]=3 12260 B21R2.103648 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2F 240690a_100000185548_100016256065 [0,2,0,0,0,0|1,0,0]=3 12261 B21R2.103648 Cc1cccc(c1)NNC(=O)C=Cc2ccccc2Br 22a_100000681630_100000719032 [0,2,0,0,0,0|2,0,0]=4 12262 B21R2.103648 Cc1cccc(c1)NNC(=O)C=Cc2ccccc2C 22a_100000681630_100016266485 [0,2,0,0,0,0|2,0,0]=4 12263 B21R2.103648 Cc1cccc(c1)NNC(=O)C=Cc2ccccc2Cl 22a_100000681630_100000720304 [0,2,0,0,0,0|2,0,0]=4 12264 B21R2.103648 Cc1cccc(c1)NNC(=O)C=Cc2ccccc2F 22a_100000681630_100016256065 [0,2,0,0,0,0|2,0,0]=4 12265 B21R2.103648 Cc1cccc(c1)NNC(=O)C=Cc2ccccc2O 22a_100000681630_100016263591 [0,2,0,0,0,0|2,0,0]=4 12266 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2Br 11a_100000701342_100000719032 [0,2,0,0,0,0|2,0,0]=4 12267 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2Br 1626a_100000701342_100000719032 [0,2,0,0,0,0|2,0,0]=4 12268 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2Br 240690a_100000701342_100000719032 [0,2,0,0,0,0|2,0,0]=4 12269 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2C 1626a_100000701342_100016266485 [0,2,0,0,0,0|2,0,0]=4 12270 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2Cl 11a_100000701342_100000720304 [0,2,0,0,0,0|2,0,0]=4 12271 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2Cl 1626a_100000701342_100000720304 [0,2,0,0,0,0|2,0,0]=4 12272 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2Cl 240690a_100000701342_100000720304 [0,2,0,0,0,0|2,0,0]=4 12273 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2F 11a_100000701342_100016256065 [0,2,0,0,0,0|2,0,0]=4 12274 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2F 1626a_100000701342_100016256065 [0,2,0,0,0,0|2,0,0]=4 12275 B21R2.103648 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2F 240690a_100000701342_100016256065 [0,2,0,0,0,0|2,0,0]=4 12276 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cc(ccn2)Br 1626a_100009818019_100016266485 [0,2,0,0,0,0|2,0,0]=4 12277 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cc(ccn2)Cl 1626a_100000085674_100016266485 [0,2,0,0,0,0|2,0,0]=4 12278 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cccc(=O)[nH]2 1626a_100000696482_100016266485 [0,2,0,0,0,0|2,0,0]=4 12279 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cccc(c2)Br 1626a_100000174977_100016266485 [0,2,0,0,0,0|1,0,0]=3 12280 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cccc(c2)Cl 1626a_100000174878_100016266485 [0,2,0,0,0,0|1,0,0]=3 12281 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cccc(c2)F 1626a_100000174948_100016266485 [0,2,0,0,0,0|1,0,0]=3 12282 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cccc(c2)I 1626a_100000106179_100016266485 [0,2,0,0,0,0|1,0,0]=3 12283 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cccc(n2)Br 1626a_100016987751_100016266485 [0,2,0,0,0,0|2,0,0]=4 12284 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cccc(n2)Cl 1626a_100016990191_100016266485 [0,2,0,0,0,0|2,0,0]=4 12285 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cccc(n2)F 1626a_100015188798_100016266485 [0,2,0,0,0,0|2,0,0]=4 12286 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2ccnc(c2)Cl 1626a_100015205668_100016266485 [0,2,0,0,0,0|2,0,0]=4 12287 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2ccnc(c2)F 1626a_100015188774_100016266485 [0,2,0,0,0,0|2,0,0]=4 12288 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cncc(c2)Cl 1626a_200020614424_100016266485 [0,2,0,0,0,0|2,0,0]=4 12289 B21R2.103648 Cc1ccccc1C=CC(=O)NCc2cncc(c2)F 1626a_100011962886_100016266485 [0,2,0,0,0,0|2,0,0]=4 12290 B21R2.103648 Cc1ccccc1C=CC(=O)NNc2cccc(c2)Br 22a_100000217339_100016266485 [0,2,0,0,0,0|2,0,0]=4 12291 B21R2.103648 Cc1ccccc1C=CC(=O)NNc2cccc(c2)Cl 22a_100000184277_100016266485 [0,2,0,0,0,0|2,0,0]=4 12292 B21R2.103648 Cc1ccccc1C=CC(=O)NNc2cccc(c2)F 22a_100000745080_100016266485 [0,2,0,0,0,0|2,0,0]=4 12293 B21R2.103648 Cc1ccccc1C=CC(=O)NNc2cccc(c2)I 22a_100020605690_100016266485 [0,2,0,0,0,0|2,0,0]=4 12294 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cccc(c2)Br 1458a_100016258244_100011713688 [0,2,0,0,0,0|1,0,0]=3 12295 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cccc(c2)Br 6a_100000210085_100012183946 [0,2,0,0,0,0|1,0,0]=3 12296 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cccc(c2)Cl 1458a_100000184502_100011713688 [0,2,0,0,0,0|1,0,0]=3 12297 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cccc(c2)F 1458a_100000718793_100011713688 [0,2,0,0,0,0|1,0,0]=3 12298 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cccc(c2)F 6a_100000210812_100012183946 [0,2,0,0,0,0|1,0,0]=3 12299 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cccc(c2)I 1458a_100020647043_100011713688 [0,2,0,0,0,0|1,0,0]=3 12300 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cccc(c2)I 6a_100000014684_100012183946 [0,2,0,0,0,0|1,0,0]=3 12301 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cncc(c2)Br 6a_100000687066_100012183946 [0,2,0,0,0,0|2,0,0]=4 12302 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cncc(c2)Cl 6a_100000088910_100012183946 [0,2,0,0,0,0|2,0,0]=4 12303 B21R2.103648 Cc1ccccc1CCC(=O)C=Cc2cncc(c2)F 6a_100011361476_100012183946 [0,2,0,0,0,0|2,0,0]=4 12304 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)Br 11a_100000174972_100016258244 [0,2,0,0,0,0|1,0,0]=3 12305 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)Br 1626a_100000174972_100016258244 [0,2,0,0,0,0|1,0,0]=3 12306 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)Br 240690a_100000174972_100016258244 [0,2,0,0,0,0|1,0,0]=3 12307 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)Cl 11a_100000174972_100000184502 [0,2,0,0,0,0|1,0,0]=3 12308 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)Cl 1626a_100000174972_100000184502 [0,2,0,0,0,0|1,0,0]=3 12309 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)Cl 240690a_100000174972_100000184502 [0,2,0,0,0,0|1,0,0]=3 12310 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)F 11a_100000174972_100000718793 [0,2,0,0,0,0|1,0,0]=3 12311 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)F 1626a_100000174972_100000718793 [0,2,0,0,0,0|1,0,0]=3 12312 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)F 240690a_100000174972_100000718793 [0,2,0,0,0,0|1,0,0]=3 12313 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)I 11a_100000174972_100020647043 [0,2,0,0,0,0|1,0,0]=3 12314 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)I 1626a_100000174972_100020647043 [0,2,0,0,0,0|1,0,0]=3 12315 B21R2.103648 Cc1ccccc1CNC(=O)C=Cc2cccc(c2)I 240690a_100000174972_100020647043 [0,2,0,0,0,0|1,0,0]=3 12316 B21R2.103648 Cc1ccccc1NNC(=O)C=Cc2cccc(c2)Br 22a_100000184220_100016258244 [0,2,0,0,0,0|2,0,0]=4 12317 B21R2.103648 Cc1ccccc1NNC(=O)C=Cc2cccc(c2)Cl 22a_100000184220_100000184502 [0,2,0,0,0,0|2,0,0]=4 12318 B21R2.103648 Cc1ccccc1NNC(=O)C=Cc2cccc(c2)F 22a_100000184220_100000718793 [0,2,0,0,0,0|2,0,0]=4 12319 B21R2.103648 Cc1ccccc1NNC(=O)C=Cc2cccc(c2)I 22a_100000184220_100020647043 [0,2,0,0,0,0|2,0,0]=4 12320 B21R2.103648 Cc1ccccc1NNC(=O)C=Cc2cccc(c2)O 22a_100000184220_100102525460 [0,2,0,0,0,0|2,0,0]=4 12321 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)Br 11a_100011223789_100016258244 [0,2,0,0,0,0|2,0,0]=4 12322 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)Br 1626a_100011223789_100016258244 [0,2,0,0,0,0|2,0,0]=4 12323 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)Br 240690a_100011223789_100016258244 [0,2,0,0,0,0|2,0,0]=4 12324 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)Cl 11a_100011223789_100000184502 [0,2,0,0,0,0|2,0,0]=4 12325 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)Cl 1626a_100011223789_100000184502 [0,2,0,0,0,0|2,0,0]=4 12326 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)Cl 240690a_100011223789_100000184502 [0,2,0,0,0,0|2,0,0]=4 12327 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)F 11a_100011223789_100000718793 [0,2,0,0,0,0|2,0,0]=4 12328 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)F 1626a_100011223789_100000718793 [0,2,0,0,0,0|2,0,0]=4 12329 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)F 240690a_100011223789_100000718793 [0,2,0,0,0,0|2,0,0]=4 12330 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)I 11a_100011223789_100020647043 [0,2,0,0,0,0|2,0,0]=4 12331 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)I 1626a_100011223789_100020647043 [0,2,0,0,0,0|2,0,0]=4 12332 B21R2.103648 Cc1cccnc1CNC(=O)C=Cc2cccc(c2)I 240690a_100011223789_100020647043 [0,2,0,0,0,0|2,0,0]=4 12333 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2Br 11a_100011934573_100000719032 [0,2,0,0,0,0|2,0,0]=4 12334 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2Br 1626a_100011934573_100000719032 [0,2,0,0,0,0|2,0,0]=4 12335 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2Br 240690a_100011934573_100000719032 [0,2,0,0,0,0|2,0,0]=4 12336 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2C 1626a_100011934573_100016266485 [0,2,0,0,0,0|2,0,0]=4 12337 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2Cl 11a_100011934573_100000720304 [0,2,0,0,0,0|2,0,0]=4 12338 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2Cl 1626a_100011934573_100000720304 [0,2,0,0,0,0|2,0,0]=4 12339 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2Cl 240690a_100011934573_100000720304 [0,2,0,0,0,0|2,0,0]=4 12340 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2F 11a_100011934573_100016256065 [0,2,0,0,0,0|2,0,0]=4 12341 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2F 1626a_100011934573_100016256065 [0,2,0,0,0,0|2,0,0]=4 12342 B21R2.103648 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2F 240690a_100011934573_100016256065 [0,2,0,0,0,0|2,0,0]=4 12343 B21R2.103648 Cc1ccncc1CNC(=O)C=Cc2cccc(c2)Br 11a_100011997553_100016258244 [0,2,0,0,0,0|2,0,0]=4 12344 B21R2.103648 Cc1ccncc1CNC(=O)C=Cc2cccc(c2)Br 240690a_100011997553_100016258244 [0,2,0,0,0,0|2,0,0]=4 12345 B21R2.103648 Cc1ccncc1CNC(=O)C=Cc2cccc(c2)Cl 11a_100011997553_100000184502 [0,2,0,0,0,0|2,0,0]=4 12346 B21R2.103648 Cc1ccncc1CNC(=O)C=Cc2cccc(c2)Cl 240690a_100011997553_100000184502 [0,2,0,0,0,0|2,0,0]=4 12347 B21R2.103648 Cc1ccncc1CNC(=O)C=Cc2cccc(c2)F 11a_100011997553_100000718793 [0,2,0,0,0,0|2,0,0]=4 12348 B21R2.103648 Cc1ccncc1CNC(=O)C=Cc2cccc(c2)F 240690a_100011997553_100000718793 [0,2,0,0,0,0|2,0,0]=4 12349 B21R2.103648 Cc1ccncc1CNC(=O)C=Cc2cccc(c2)I 11a_100011997553_100020647043 [0,2,0,0,0,0|2,0,0]=4 12350 B21R2.103648 Cc1ccncc1CNC(=O)C=Cc2cccc(c2)I 240690a_100011997553_100020647043 [0,2,0,0,0,0|2,0,0]=4 12351 B21R2.103648 Cc1cncc(c1)C=CC(=O)CCc2ccccc2C 6a_100011998712_100012183946 [0,2,0,0,0,0|2,0,0]=4 12352 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2Br 11a_100000692839_100000719032 [0,2,0,0,0,0|2,0,0]=4 12353 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2Br 1626a_100000692839_100000719032 [0,2,0,0,0,0|2,0,0]=4 12354 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2Br 240690a_100000692839_100000719032 [0,2,0,0,0,0|2,0,0]=4 12355 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2C 1626a_100000692839_100016266485 [0,2,0,0,0,0|2,0,0]=4 12356 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2Cl 11a_100000692839_100000720304 [0,2,0,0,0,0|2,0,0]=4 12357 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2Cl 1626a_100000692839_100000720304 [0,2,0,0,0,0|2,0,0]=4 12358 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2Cl 240690a_100000692839_100000720304 [0,2,0,0,0,0|2,0,0]=4 12359 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2F 11a_100000692839_100016256065 [0,2,0,0,0,0|2,0,0]=4 12360 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2F 1626a_100000692839_100016256065 [0,2,0,0,0,0|2,0,0]=4 12361 B21R2.103648 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2F 240690a_100000692839_100016256065 [0,2,0,0,0,0|2,0,0]=4 12362 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)Br 11a_100000708811_100016258244 [0,2,0,0,0,0|2,0,0]=4 12363 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)Br 1626a_100000708811_100016258244 [0,2,0,0,0,0|2,0,0]=4 12364 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)Br 240690a_100000708811_100016258244 [0,2,0,0,0,0|2,0,0]=4 12365 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)Cl 11a_100000708811_100000184502 [0,2,0,0,0,0|2,0,0]=4 12366 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)Cl 1626a_100000708811_100000184502 [0,2,0,0,0,0|2,0,0]=4 12367 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)Cl 240690a_100000708811_100000184502 [0,2,0,0,0,0|2,0,0]=4 12368 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)F 11a_100000708811_100000718793 [0,2,0,0,0,0|2,0,0]=4 12369 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)F 1626a_100000708811_100000718793 [0,2,0,0,0,0|2,0,0]=4 12370 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)F 240690a_100000708811_100000718793 [0,2,0,0,0,0|2,0,0]=4 12371 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)I 11a_100000708811_100020647043 [0,2,0,0,0,0|2,0,0]=4 12372 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)I 1626a_100000708811_100020647043 [0,2,0,0,0,0|2,0,0]=4 12373 B21R2.103648 Cc1cnccc1CNC(=O)C=Cc2cccc(c2)I 240690a_100000708811_100020647043 [0,2,0,0,0,0|2,0,0]=4 12374 B21R2.103648 O=C(C=Cc1cccc(c1)Br)CCc2ccccc2Br 1458a_100016258244_100012161201 [0,2,0,0,0,0|1,0,0]=3 12375 B21R2.103648 O=C(C=Cc1cccc(c1)Br)CCc2ccccc2Cl 1458a_100016258244_100011713703 [0,2,0,0,0,0|1,0,0]=3 12376 B21R2.103648 O=C(C=Cc1cccc(c1)Br)CCc2ccccc2F 1458a_100016258244_100000720011 [0,2,0,0,0,0|1,0,0]=3 12377 B21R2.103648 O=C(C=Cc1cccc(c1)Br)CCc2ccccc2O 1458a_100016258244_100000722297 [0,2,0,0,0,0|1,0,0]=3 12378 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2Br 11a_100000689332_100016258244 [0,2,0,0,0,0|1,0,0]=3 12379 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2Br 1626a_100000689332_100016258244 [0,2,0,0,0,0|1,0,0]=3 12380 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2Br 240690a_100000689332_100016258244 [0,2,0,0,0,0|1,0,0]=3 12381 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2Cl 11a_100000174879_100016258244 [0,2,0,0,0,0|1,0,0]=3 12382 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2Cl 1626a_100000174879_100016258244 [0,2,0,0,0,0|1,0,0]=3 12383 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2Cl 240690a_100000174879_100016258244 [0,2,0,0,0,0|1,0,0]=3 12384 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2F 11a_100000174869_100016258244 [0,2,0,0,0,0|1,0,0]=3 12385 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2F 1626a_100000174869_100016258244 [0,2,0,0,0,0|1,0,0]=3 12386 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2F 240690a_100000174869_100016258244 [0,2,0,0,0,0|1,0,0]=3 12387 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2I 11a_100015347259_100016258244 [0,2,0,0,0,0|1,0,0]=3 12388 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2I 1626a_100015347259_100016258244 [0,2,0,0,0,0|1,0,0]=3 12389 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2I 240690a_100015347259_100016258244 [0,2,0,0,0,0|1,0,0]=3 12390 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2O 240690a_100000185550_100016258244 [0,2,0,0,0,0|1,0,0]=3 12391 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2Br 11a_100009818023_100016258244 [0,2,0,0,0,0|2,0,0]=4 12392 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2Br 240690a_100009818023_100016258244 [0,2,0,0,0,0|2,0,0]=4 12393 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2Cl 11a_100015189234_100016258244 [0,2,0,0,0,0|2,0,0]=4 12394 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2Cl 1626a_100015189234_100016258244 [0,2,0,0,0,0|2,0,0]=4 12395 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2Cl 240690a_100015189234_100016258244 [0,2,0,0,0,0|2,0,0]=4 12396 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2F 11a_100000724633_100016258244 [0,2,0,0,0,0|2,0,0]=4 12397 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2F 1626a_100000724633_100016258244 [0,2,0,0,0,0|2,0,0]=4 12398 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2F 240690a_100000724633_100016258244 [0,2,0,0,0,0|2,0,0]=4 12399 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2Br 11a_100020640021_100016258244 [0,2,0,0,0,0|2,0,0]=4 12400 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2Br 240690a_100020640021_100016258244 [0,2,0,0,0,0|2,0,0]=4 12401 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2F 11a_100011935246_100016258244 [0,2,0,0,0,0|2,0,0]=4 12402 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2F 1626a_100011935246_100016258244 [0,2,0,0,0,0|2,0,0]=4 12403 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2F 240690a_100011935246_100016258244 [0,2,0,0,0,0|2,0,0]=4 12404 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ncccc2Br 11a_100020591323_100016258244 [0,2,0,0,0,0|2,0,0]=4 12405 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ncccc2Br 240690a_100020591323_100016258244 [0,2,0,0,0,0|2,0,0]=4 12406 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ncccc2Cl 11a_100015189233_100016258244 [0,2,0,0,0,0|2,0,0]=4 12407 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ncccc2Cl 1626a_100015189233_100016258244 [0,2,0,0,0,0|2,0,0]=4 12408 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ncccc2Cl 240690a_100015189233_100016258244 [0,2,0,0,0,0|2,0,0]=4 12409 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ncccc2F 11a_100000690088_100016258244 [0,2,0,0,0,0|2,0,0]=4 12410 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ncccc2F 1626a_100000690088_100016258244 [0,2,0,0,0,0|2,0,0]=4 12411 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NCc2ncccc2F 240690a_100000690088_100016258244 [0,2,0,0,0,0|2,0,0]=4 12412 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NNc2ccccc2Br 22a_100000241748_100016258244 [0,2,0,0,0,0|2,0,0]=4 12413 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NNc2ccccc2Cl 22a_100000683529_100016258244 [0,2,0,0,0,0|2,0,0]=4 12414 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NNc2ccccc2F 22a_100000239246_100016258244 [0,2,0,0,0,0|2,0,0]=4 12415 B21R2.103648 O=C(C=Cc1cccc(c1)Br)NNc2ccccc2I 22a_100011218156_100016258244 [0,2,0,0,0,0|2,0,0]=4 12416 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)CCc2ccccc2Br 1458a_100000184502_100012161201 [0,2,0,0,0,0|1,0,0]=3 12417 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)CCc2ccccc2Cl 1458a_100000184502_100011713703 [0,2,0,0,0,0|1,0,0]=3 12418 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)CCc2ccccc2F 1458a_100000184502_100000720011 [0,2,0,0,0,0|1,0,0]=3 12419 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)CCc2ccccc2O 1458a_100000184502_100000722297 [0,2,0,0,0,0|1,0,0]=3 12420 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2Br 11a_100000689332_100000184502 [0,2,0,0,0,0|1,0,0]=3 12421 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2Br 1626a_100000689332_100000184502 [0,2,0,0,0,0|1,0,0]=3 12422 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2Br 240690a_100000689332_100000184502 [0,2,0,0,0,0|1,0,0]=3 12423 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2Cl 11a_100000174879_100000184502 [0,2,0,0,0,0|1,0,0]=3 12424 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2Cl 1626a_100000174879_100000184502 [0,2,0,0,0,0|1,0,0]=3 12425 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2Cl 240690a_100000174879_100000184502 [0,2,0,0,0,0|1,0,0]=3 12426 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2F 11a_100000174869_100000184502 [0,2,0,0,0,0|1,0,0]=3 12427 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2F 1626a_100000174869_100000184502 [0,2,0,0,0,0|1,0,0]=3 12428 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2F 240690a_100000174869_100000184502 [0,2,0,0,0,0|1,0,0]=3 12429 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2I 11a_100015347259_100000184502 [0,2,0,0,0,0|1,0,0]=3 12430 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2I 1626a_100015347259_100000184502 [0,2,0,0,0,0|1,0,0]=3 12431 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2I 240690a_100015347259_100000184502 [0,2,0,0,0,0|1,0,0]=3 12432 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2O 240690a_100000185550_100000184502 [0,2,0,0,0,0|1,0,0]=3 12433 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2Br 11a_100009818023_100000184502 [0,2,0,0,0,0|2,0,0]=4 12434 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2Br 240690a_100009818023_100000184502 [0,2,0,0,0,0|2,0,0]=4 12435 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2Cl 11a_100015189234_100000184502 [0,2,0,0,0,0|2,0,0]=4 12436 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2Cl 1626a_100015189234_100000184502 [0,2,0,0,0,0|2,0,0]=4 12437 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2Cl 240690a_100015189234_100000184502 [0,2,0,0,0,0|2,0,0]=4 12438 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2F 11a_100000724633_100000184502 [0,2,0,0,0,0|2,0,0]=4 12439 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2F 1626a_100000724633_100000184502 [0,2,0,0,0,0|2,0,0]=4 12440 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2F 240690a_100000724633_100000184502 [0,2,0,0,0,0|2,0,0]=4 12441 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2Br 11a_100020640021_100000184502 [0,2,0,0,0,0|2,0,0]=4 12442 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2Br 240690a_100020640021_100000184502 [0,2,0,0,0,0|2,0,0]=4 12443 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2F 11a_100011935246_100000184502 [0,2,0,0,0,0|2,0,0]=4 12444 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2F 1626a_100011935246_100000184502 [0,2,0,0,0,0|2,0,0]=4 12445 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2F 240690a_100011935246_100000184502 [0,2,0,0,0,0|2,0,0]=4 12446 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ncccc2Br 11a_100020591323_100000184502 [0,2,0,0,0,0|2,0,0]=4 12447 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ncccc2Br 240690a_100020591323_100000184502 [0,2,0,0,0,0|2,0,0]=4 12448 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ncccc2Cl 11a_100015189233_100000184502 [0,2,0,0,0,0|2,0,0]=4 12449 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ncccc2Cl 1626a_100015189233_100000184502 [0,2,0,0,0,0|2,0,0]=4 12450 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ncccc2Cl 240690a_100015189233_100000184502 [0,2,0,0,0,0|2,0,0]=4 12451 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ncccc2F 11a_100000690088_100000184502 [0,2,0,0,0,0|2,0,0]=4 12452 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ncccc2F 1626a_100000690088_100000184502 [0,2,0,0,0,0|2,0,0]=4 12453 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NCc2ncccc2F 240690a_100000690088_100000184502 [0,2,0,0,0,0|2,0,0]=4 12454 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NNc2ccccc2Br 22a_100000241748_100000184502 [0,2,0,0,0,0|2,0,0]=4 12455 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NNc2ccccc2Cl 22a_100000683529_100000184502 [0,2,0,0,0,0|2,0,0]=4 12456 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NNc2ccccc2F 22a_100000239246_100000184502 [0,2,0,0,0,0|2,0,0]=4 12457 B21R2.103648 O=C(C=Cc1cccc(c1)Cl)NNc2ccccc2I 22a_100011218156_100000184502 [0,2,0,0,0,0|2,0,0]=4 12458 B21R2.103648 O=C(C=Cc1cccc(c1)F)CCc2ccccc2Br 1458a_100000718793_100012161201 [0,2,0,0,0,0|1,0,0]=3 12459 B21R2.103648 O=C(C=Cc1cccc(c1)F)CCc2ccccc2Cl 1458a_100000718793_100011713703 [0,2,0,0,0,0|1,0,0]=3 12460 B21R2.103648 O=C(C=Cc1cccc(c1)F)CCc2ccccc2F 1458a_100000718793_100000720011 [0,2,0,0,0,0|1,0,0]=3 12461 B21R2.103648 O=C(C=Cc1cccc(c1)F)CCc2ccccc2O 1458a_100000718793_100000722297 [0,2,0,0,0,0|1,0,0]=3 12462 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2Br 11a_100000689332_100000718793 [0,2,0,0,0,0|1,0,0]=3 12463 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2Br 1626a_100000689332_100000718793 [0,2,0,0,0,0|1,0,0]=3 12464 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2Br 240690a_100000689332_100000718793 [0,2,0,0,0,0|1,0,0]=3 12465 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2Cl 11a_100000174879_100000718793 [0,2,0,0,0,0|1,0,0]=3 12466 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2Cl 1626a_100000174879_100000718793 [0,2,0,0,0,0|1,0,0]=3 12467 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2Cl 240690a_100000174879_100000718793 [0,2,0,0,0,0|1,0,0]=3 12468 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2F 11a_100000174869_100000718793 [0,2,0,0,0,0|1,0,0]=3 12469 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2F 1626a_100000174869_100000718793 [0,2,0,0,0,0|1,0,0]=3 12470 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2F 240690a_100000174869_100000718793 [0,2,0,0,0,0|1,0,0]=3 12471 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2I 11a_100015347259_100000718793 [0,2,0,0,0,0|1,0,0]=3 12472 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2I 1626a_100015347259_100000718793 [0,2,0,0,0,0|1,0,0]=3 12473 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2I 240690a_100015347259_100000718793 [0,2,0,0,0,0|1,0,0]=3 12474 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccccc2O 240690a_100000185550_100000718793 [0,2,0,0,0,0|1,0,0]=3 12475 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2cccnc2Br 11a_100009818023_100000718793 [0,2,0,0,0,0|2,0,0]=4 12476 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2cccnc2Br 240690a_100009818023_100000718793 [0,2,0,0,0,0|2,0,0]=4 12477 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2cccnc2Cl 11a_100015189234_100000718793 [0,2,0,0,0,0|2,0,0]=4 12478 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2cccnc2Cl 1626a_100015189234_100000718793 [0,2,0,0,0,0|2,0,0]=4 12479 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2cccnc2Cl 240690a_100015189234_100000718793 [0,2,0,0,0,0|2,0,0]=4 12480 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2cccnc2F 11a_100000724633_100000718793 [0,2,0,0,0,0|2,0,0]=4 12481 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2cccnc2F 1626a_100000724633_100000718793 [0,2,0,0,0,0|2,0,0]=4 12482 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2cccnc2F 240690a_100000724633_100000718793 [0,2,0,0,0,0|2,0,0]=4 12483 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccncc2Br 11a_100020640021_100000718793 [0,2,0,0,0,0|2,0,0]=4 12484 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccncc2Br 240690a_100020640021_100000718793 [0,2,0,0,0,0|2,0,0]=4 12485 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccncc2F 11a_100011935246_100000718793 [0,2,0,0,0,0|2,0,0]=4 12486 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccncc2F 1626a_100011935246_100000718793 [0,2,0,0,0,0|2,0,0]=4 12487 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ccncc2F 240690a_100011935246_100000718793 [0,2,0,0,0,0|2,0,0]=4 12488 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ncccc2Br 11a_100020591323_100000718793 [0,2,0,0,0,0|2,0,0]=4 12489 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ncccc2Br 240690a_100020591323_100000718793 [0,2,0,0,0,0|2,0,0]=4 12490 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ncccc2Cl 11a_100015189233_100000718793 [0,2,0,0,0,0|2,0,0]=4 12491 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ncccc2Cl 1626a_100015189233_100000718793 [0,2,0,0,0,0|2,0,0]=4 12492 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ncccc2Cl 240690a_100015189233_100000718793 [0,2,0,0,0,0|2,0,0]=4 12493 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ncccc2F 11a_100000690088_100000718793 [0,2,0,0,0,0|2,0,0]=4 12494 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ncccc2F 1626a_100000690088_100000718793 [0,2,0,0,0,0|2,0,0]=4 12495 B21R2.103648 O=C(C=Cc1cccc(c1)F)NCc2ncccc2F 240690a_100000690088_100000718793 [0,2,0,0,0,0|2,0,0]=4 12496 B21R2.103648 O=C(C=Cc1cccc(c1)F)NNc2ccccc2Br 22a_100000241748_100000718793 [0,2,0,0,0,0|2,0,0]=4 12497 B21R2.103648 O=C(C=Cc1cccc(c1)F)NNc2ccccc2Cl 22a_100000683529_100000718793 [0,2,0,0,0,0|2,0,0]=4 12498 B21R2.103648 O=C(C=Cc1cccc(c1)F)NNc2ccccc2F 22a_100000239246_100000718793 [0,2,0,0,0,0|2,0,0]=4 12499 B21R2.103648 O=C(C=Cc1cccc(c1)F)NNc2ccccc2I 22a_100011218156_100000718793 [0,2,0,0,0,0|2,0,0]=4 12500 B21R2.103648 O=C(C=Cc1cccc(c1)I)CCc2ccccc2Br 1458a_100020647043_100012161201 [0,2,0,0,0,0|1,0,0]=3 12501 B21R2.103648 O=C(C=Cc1cccc(c1)I)CCc2ccccc2Cl 1458a_100020647043_100011713703 [0,2,0,0,0,0|1,0,0]=3 12502 B21R2.103648 O=C(C=Cc1cccc(c1)I)CCc2ccccc2F 1458a_100020647043_100000720011 [0,2,0,0,0,0|1,0,0]=3 12503 B21R2.103648 O=C(C=Cc1cccc(c1)I)CCc2ccccc2O 1458a_100020647043_100000722297 [0,2,0,0,0,0|1,0,0]=3 12504 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2Br 11a_100000689332_100020647043 [0,2,0,0,0,0|1,0,0]=3 12505 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2Br 1626a_100000689332_100020647043 [0,2,0,0,0,0|1,0,0]=3 12506 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2Br 240690a_100000689332_100020647043 [0,2,0,0,0,0|1,0,0]=3 12507 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2Cl 11a_100000174879_100020647043 [0,2,0,0,0,0|1,0,0]=3 12508 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2Cl 1626a_100000174879_100020647043 [0,2,0,0,0,0|1,0,0]=3 12509 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2Cl 240690a_100000174879_100020647043 [0,2,0,0,0,0|1,0,0]=3 12510 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2F 11a_100000174869_100020647043 [0,2,0,0,0,0|1,0,0]=3 12511 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2F 1626a_100000174869_100020647043 [0,2,0,0,0,0|1,0,0]=3 12512 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2F 240690a_100000174869_100020647043 [0,2,0,0,0,0|1,0,0]=3 12513 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2I 11a_100015347259_100020647043 [0,2,0,0,0,0|1,0,0]=3 12514 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2I 1626a_100015347259_100020647043 [0,2,0,0,0,0|1,0,0]=3 12515 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2I 240690a_100015347259_100020647043 [0,2,0,0,0,0|1,0,0]=3 12516 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccccc2O 240690a_100000185550_100020647043 [0,2,0,0,0,0|1,0,0]=3 12517 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2cccnc2Br 11a_100009818023_100020647043 [0,2,0,0,0,0|2,0,0]=4 12518 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2cccnc2Br 240690a_100009818023_100020647043 [0,2,0,0,0,0|2,0,0]=4 12519 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2cccnc2Cl 11a_100015189234_100020647043 [0,2,0,0,0,0|2,0,0]=4 12520 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2cccnc2Cl 1626a_100015189234_100020647043 [0,2,0,0,0,0|2,0,0]=4 12521 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2cccnc2Cl 240690a_100015189234_100020647043 [0,2,0,0,0,0|2,0,0]=4 12522 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2cccnc2F 11a_100000724633_100020647043 [0,2,0,0,0,0|2,0,0]=4 12523 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2cccnc2F 1626a_100000724633_100020647043 [0,2,0,0,0,0|2,0,0]=4 12524 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2cccnc2F 240690a_100000724633_100020647043 [0,2,0,0,0,0|2,0,0]=4 12525 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccncc2Br 11a_100020640021_100020647043 [0,2,0,0,0,0|2,0,0]=4 12526 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccncc2Br 240690a_100020640021_100020647043 [0,2,0,0,0,0|2,0,0]=4 12527 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccncc2F 11a_100011935246_100020647043 [0,2,0,0,0,0|2,0,0]=4 12528 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccncc2F 1626a_100011935246_100020647043 [0,2,0,0,0,0|2,0,0]=4 12529 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ccncc2F 240690a_100011935246_100020647043 [0,2,0,0,0,0|2,0,0]=4 12530 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ncccc2Br 11a_100020591323_100020647043 [0,2,0,0,0,0|2,0,0]=4 12531 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ncccc2Br 240690a_100020591323_100020647043 [0,2,0,0,0,0|2,0,0]=4 12532 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ncccc2Cl 11a_100015189233_100020647043 [0,2,0,0,0,0|2,0,0]=4 12533 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ncccc2Cl 1626a_100015189233_100020647043 [0,2,0,0,0,0|2,0,0]=4 12534 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ncccc2Cl 240690a_100015189233_100020647043 [0,2,0,0,0,0|2,0,0]=4 12535 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ncccc2F 11a_100000690088_100020647043 [0,2,0,0,0,0|2,0,0]=4 12536 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ncccc2F 1626a_100000690088_100020647043 [0,2,0,0,0,0|2,0,0]=4 12537 B21R2.103648 O=C(C=Cc1cccc(c1)I)NCc2ncccc2F 240690a_100000690088_100020647043 [0,2,0,0,0,0|2,0,0]=4 12538 B21R2.103648 O=C(C=Cc1cccc(c1)I)NNc2ccccc2Br 22a_100000241748_100020647043 [0,2,0,0,0,0|2,0,0]=4 12539 B21R2.103648 O=C(C=Cc1cccc(c1)I)NNc2ccccc2Cl 22a_100000683529_100020647043 [0,2,0,0,0,0|2,0,0]=4 12540 B21R2.103648 O=C(C=Cc1cccc(c1)I)NNc2ccccc2F 22a_100000239246_100020647043 [0,2,0,0,0,0|2,0,0]=4 12541 B21R2.103648 O=C(C=Cc1cccc(c1)I)NNc2ccccc2I 22a_100011218156_100020647043 [0,2,0,0,0,0|2,0,0]=4 12542 B21R2.103648 O=C(C=Cc1cccc(c1)O)NNc2ccccc2Br 22a_100000241748_100102525460 [0,2,0,0,0,0|2,0,0]=4 12543 B21R2.103648 O=C(C=Cc1cccc(c1)O)NNc2ccccc2Cl 22a_100000683529_100102525460 [0,2,0,0,0,0|2,0,0]=4 12544 B21R2.103648 O=C(C=Cc1cccc(c1)O)NNc2ccccc2F 22a_100000239246_100102525460 [0,2,0,0,0,0|2,0,0]=4 12545 B21R2.103648 O=C(C=Cc1cccc(c1)O)NNc2ccccc2I 22a_100011218156_100102525460 [0,2,0,0,0,0|2,0,0]=4 12546 B21R2.103648 O=C(C=Cc1ccccc1Br)CCc2cccc(c2)Br 1458a_100000719032_100011740638 [0,2,0,0,0,0|1,0,0]=3 12547 B21R2.103648 O=C(C=Cc1ccccc1Br)CCc2cccc(c2)Cl 1458a_100000719032_100011713710 [0,2,0,0,0,0|1,0,0]=3 12548 B21R2.103648 O=C(C=Cc1ccccc1Br)CCc2cccc(c2)F 1458a_100000719032_100011217235 [0,2,0,0,0,0|1,0,0]=3 12549 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cc(ccn2)Br 11a_100009818019_100000719032 [0,2,0,0,0,0|2,0,0]=4 12550 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cc(ccn2)Br 1626a_100009818019_100000719032 [0,2,0,0,0,0|2,0,0]=4 12551 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cc(ccn2)Br 240690a_100009818019_100000719032 [0,2,0,0,0,0|2,0,0]=4 12552 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cc(ccn2)Cl 11a_100000085674_100000719032 [0,2,0,0,0,0|2,0,0]=4 12553 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cc(ccn2)Cl 1626a_100000085674_100000719032 [0,2,0,0,0,0|2,0,0]=4 12554 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cc(ccn2)Cl 240690a_100000085674_100000719032 [0,2,0,0,0,0|2,0,0]=4 12555 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(=O)[nH]2 11a_100000696482_100000719032 [0,2,0,0,0,0|2,0,0]=4 12556 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(=O)[nH]2 1626a_100000696482_100000719032 [0,2,0,0,0,0|2,0,0]=4 12557 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(=O)[nH]2 240690a_100000696482_100000719032 [0,2,0,0,0,0|2,0,0]=4 12558 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)Br 11a_100000174977_100000719032 [0,2,0,0,0,0|1,0,0]=3 12559 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)Br 1626a_100000174977_100000719032 [0,2,0,0,0,0|1,0,0]=3 12560 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)Br 240690a_100000174977_100000719032 [0,2,0,0,0,0|1,0,0]=3 12561 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)Cl 11a_100000174878_100000719032 [0,2,0,0,0,0|1,0,0]=3 12562 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)Cl 1626a_100000174878_100000719032 [0,2,0,0,0,0|1,0,0]=3 12563 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)Cl 240690a_100000174878_100000719032 [0,2,0,0,0,0|1,0,0]=3 12564 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)F 11a_100000174948_100000719032 [0,2,0,0,0,0|1,0,0]=3 12565 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)F 1626a_100000174948_100000719032 [0,2,0,0,0,0|1,0,0]=3 12566 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)F 240690a_100000174948_100000719032 [0,2,0,0,0,0|1,0,0]=3 12567 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)I 11a_100000106179_100000719032 [0,2,0,0,0,0|1,0,0]=3 12568 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)I 1626a_100000106179_100000719032 [0,2,0,0,0,0|1,0,0]=3 12569 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)I 240690a_100000106179_100000719032 [0,2,0,0,0,0|1,0,0]=3 12570 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(c2)O 240690a_100000743036_100000719032 [0,2,0,0,0,0|1,0,0]=3 12571 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)Br 11a_100016987751_100000719032 [0,2,0,0,0,0|2,0,0]=4 12572 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)Br 1626a_100016987751_100000719032 [0,2,0,0,0,0|2,0,0]=4 12573 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)Br 240690a_100016987751_100000719032 [0,2,0,0,0,0|2,0,0]=4 12574 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)Cl 11a_100016990191_100000719032 [0,2,0,0,0,0|2,0,0]=4 12575 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)Cl 1626a_100016990191_100000719032 [0,2,0,0,0,0|2,0,0]=4 12576 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)Cl 240690a_100016990191_100000719032 [0,2,0,0,0,0|2,0,0]=4 12577 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)F 11a_100015188798_100000719032 [0,2,0,0,0,0|2,0,0]=4 12578 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)F 1626a_100015188798_100000719032 [0,2,0,0,0,0|2,0,0]=4 12579 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cccc(n2)F 240690a_100015188798_100000719032 [0,2,0,0,0,0|2,0,0]=4 12580 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)Br 11a_100025757509_100000719032 [0,2,0,0,0,0|2,0,0]=4 12581 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)Br 240690a_100025757509_100000719032 [0,2,0,0,0,0|2,0,0]=4 12582 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)Cl 11a_100015205668_100000719032 [0,2,0,0,0,0|2,0,0]=4 12583 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)Cl 1626a_100015205668_100000719032 [0,2,0,0,0,0|2,0,0]=4 12584 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)Cl 240690a_100015205668_100000719032 [0,2,0,0,0,0|2,0,0]=4 12585 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)F 11a_100015188774_100000719032 [0,2,0,0,0,0|2,0,0]=4 12586 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)F 1626a_100015188774_100000719032 [0,2,0,0,0,0|2,0,0]=4 12587 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)F 240690a_100015188774_100000719032 [0,2,0,0,0,0|2,0,0]=4 12588 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)O 11a_100000748557_100000719032 [0,2,0,0,0,0|2,0,0]=4 12589 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2ccnc(c2)O 240690a_100000748557_100000719032 [0,2,0,0,0,0|2,0,0]=4 12590 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cncc(c2)Br 11a_100011249555_100000719032 [0,2,0,0,0,0|2,0,0]=4 12591 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cncc(c2)Br 240690a_100011249555_100000719032 [0,2,0,0,0,0|2,0,0]=4 12592 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cncc(c2)Cl 11a_200020614424_100000719032 [0,2,0,0,0,0|2,0,0]=4 12593 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cncc(c2)Cl 1626a_200020614424_100000719032 [0,2,0,0,0,0|2,0,0]=4 12594 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cncc(c2)Cl 240690a_200020614424_100000719032 [0,2,0,0,0,0|2,0,0]=4 12595 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cncc(c2)F 11a_100011962886_100000719032 [0,2,0,0,0,0|2,0,0]=4 12596 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cncc(c2)F 1626a_100011962886_100000719032 [0,2,0,0,0,0|2,0,0]=4 12597 B21R2.103648 O=C(C=Cc1ccccc1Br)NCc2cncc(c2)F 240690a_100011962886_100000719032 [0,2,0,0,0,0|2,0,0]=4 12598 B21R2.103648 O=C(C=Cc1ccccc1Br)NNc2cccc(c2)Br 22a_100000217339_100000719032 [0,2,0,0,0,0|2,0,0]=4 12599 B21R2.103648 O=C(C=Cc1ccccc1Br)NNc2cccc(c2)Cl 22a_100000184277_100000719032 [0,2,0,0,0,0|2,0,0]=4 12600 B21R2.103648 O=C(C=Cc1ccccc1Br)NNc2cccc(c2)F 22a_100000745080_100000719032 [0,2,0,0,0,0|2,0,0]=4 12601 B21R2.103648 O=C(C=Cc1ccccc1Br)NNc2cccc(c2)I 22a_100020605690_100000719032 [0,2,0,0,0,0|2,0,0]=4 12602 B21R2.103648 O=C(C=Cc1ccccc1Cl)CCc2cccc(c2)Br 1458a_100000720304_100011740638 [0,2,0,0,0,0|1,0,0]=3 12603 B21R2.103648 O=C(C=Cc1ccccc1Cl)CCc2cccc(c2)Cl 1458a_100000720304_100011713710 [0,2,0,0,0,0|1,0,0]=3 12604 B21R2.103648 O=C(C=Cc1ccccc1Cl)CCc2cccc(c2)F 1458a_100000720304_100011217235 [0,2,0,0,0,0|1,0,0]=3 12605 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cc(ccn2)Br 11a_100009818019_100000720304 [0,2,0,0,0,0|2,0,0]=4 12606 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cc(ccn2)Br 1626a_100009818019_100000720304 [0,2,0,0,0,0|2,0,0]=4 12607 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cc(ccn2)Br 240690a_100009818019_100000720304 [0,2,0,0,0,0|2,0,0]=4 12608 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cc(ccn2)Cl 11a_100000085674_100000720304 [0,2,0,0,0,0|2,0,0]=4 12609 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cc(ccn2)Cl 1626a_100000085674_100000720304 [0,2,0,0,0,0|2,0,0]=4 12610 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cc(ccn2)Cl 240690a_100000085674_100000720304 [0,2,0,0,0,0|2,0,0]=4 12611 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(=O)[nH]2 11a_100000696482_100000720304 [0,2,0,0,0,0|2,0,0]=4 12612 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(=O)[nH]2 1626a_100000696482_100000720304 [0,2,0,0,0,0|2,0,0]=4 12613 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(=O)[nH]2 240690a_100000696482_100000720304 [0,2,0,0,0,0|2,0,0]=4 12614 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)Br 11a_100000174977_100000720304 [0,2,0,0,0,0|1,0,0]=3 12615 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)Br 1626a_100000174977_100000720304 [0,2,0,0,0,0|1,0,0]=3 12616 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)Br 240690a_100000174977_100000720304 [0,2,0,0,0,0|1,0,0]=3 12617 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)Cl 11a_100000174878_100000720304 [0,2,0,0,0,0|1,0,0]=3 12618 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)Cl 1626a_100000174878_100000720304 [0,2,0,0,0,0|1,0,0]=3 12619 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)Cl 240690a_100000174878_100000720304 [0,2,0,0,0,0|1,0,0]=3 12620 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)F 11a_100000174948_100000720304 [0,2,0,0,0,0|1,0,0]=3 12621 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)F 1626a_100000174948_100000720304 [0,2,0,0,0,0|1,0,0]=3 12622 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)F 240690a_100000174948_100000720304 [0,2,0,0,0,0|1,0,0]=3 12623 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)I 11a_100000106179_100000720304 [0,2,0,0,0,0|1,0,0]=3 12624 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)I 1626a_100000106179_100000720304 [0,2,0,0,0,0|1,0,0]=3 12625 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)I 240690a_100000106179_100000720304 [0,2,0,0,0,0|1,0,0]=3 12626 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(c2)O 240690a_100000743036_100000720304 [0,2,0,0,0,0|1,0,0]=3 12627 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)Br 11a_100016987751_100000720304 [0,2,0,0,0,0|2,0,0]=4 12628 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)Br 1626a_100016987751_100000720304 [0,2,0,0,0,0|2,0,0]=4 12629 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)Br 240690a_100016987751_100000720304 [0,2,0,0,0,0|2,0,0]=4 12630 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)Cl 11a_100016990191_100000720304 [0,2,0,0,0,0|2,0,0]=4 12631 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)Cl 1626a_100016990191_100000720304 [0,2,0,0,0,0|2,0,0]=4 12632 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)Cl 240690a_100016990191_100000720304 [0,2,0,0,0,0|2,0,0]=4 12633 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)F 11a_100015188798_100000720304 [0,2,0,0,0,0|2,0,0]=4 12634 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)F 1626a_100015188798_100000720304 [0,2,0,0,0,0|2,0,0]=4 12635 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cccc(n2)F 240690a_100015188798_100000720304 [0,2,0,0,0,0|2,0,0]=4 12636 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)Br 11a_100025757509_100000720304 [0,2,0,0,0,0|2,0,0]=4 12637 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)Br 240690a_100025757509_100000720304 [0,2,0,0,0,0|2,0,0]=4 12638 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)Cl 11a_100015205668_100000720304 [0,2,0,0,0,0|2,0,0]=4 12639 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)Cl 1626a_100015205668_100000720304 [0,2,0,0,0,0|2,0,0]=4 12640 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)Cl 240690a_100015205668_100000720304 [0,2,0,0,0,0|2,0,0]=4 12641 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)F 11a_100015188774_100000720304 [0,2,0,0,0,0|2,0,0]=4 12642 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)F 1626a_100015188774_100000720304 [0,2,0,0,0,0|2,0,0]=4 12643 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)F 240690a_100015188774_100000720304 [0,2,0,0,0,0|2,0,0]=4 12644 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)O 11a_100000748557_100000720304 [0,2,0,0,0,0|2,0,0]=4 12645 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2ccnc(c2)O 240690a_100000748557_100000720304 [0,2,0,0,0,0|2,0,0]=4 12646 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cncc(c2)Br 11a_100011249555_100000720304 [0,2,0,0,0,0|2,0,0]=4 12647 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cncc(c2)Br 240690a_100011249555_100000720304 [0,2,0,0,0,0|2,0,0]=4 12648 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cncc(c2)Cl 11a_200020614424_100000720304 [0,2,0,0,0,0|2,0,0]=4 12649 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cncc(c2)Cl 1626a_200020614424_100000720304 [0,2,0,0,0,0|2,0,0]=4 12650 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cncc(c2)Cl 240690a_200020614424_100000720304 [0,2,0,0,0,0|2,0,0]=4 12651 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cncc(c2)F 11a_100011962886_100000720304 [0,2,0,0,0,0|2,0,0]=4 12652 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cncc(c2)F 1626a_100011962886_100000720304 [0,2,0,0,0,0|2,0,0]=4 12653 B21R2.103648 O=C(C=Cc1ccccc1Cl)NCc2cncc(c2)F 240690a_100011962886_100000720304 [0,2,0,0,0,0|2,0,0]=4 12654 B21R2.103648 O=C(C=Cc1ccccc1Cl)NNc2cccc(c2)Br 22a_100000217339_100000720304 [0,2,0,0,0,0|2,0,0]=4 12655 B21R2.103648 O=C(C=Cc1ccccc1Cl)NNc2cccc(c2)Cl 22a_100000184277_100000720304 [0,2,0,0,0,0|2,0,0]=4 12656 B21R2.103648 O=C(C=Cc1ccccc1Cl)NNc2cccc(c2)F 22a_100000745080_100000720304 [0,2,0,0,0,0|2,0,0]=4 12657 B21R2.103648 O=C(C=Cc1ccccc1Cl)NNc2cccc(c2)I 22a_100020605690_100000720304 [0,2,0,0,0,0|2,0,0]=4 12658 B21R2.103648 O=C(C=Cc1ccccc1F)CCc2cccc(c2)Br 1458a_100016256065_100011740638 [0,2,0,0,0,0|1,0,0]=3 12659 B21R2.103648 O=C(C=Cc1ccccc1F)CCc2cccc(c2)Cl 1458a_100016256065_100011713710 [0,2,0,0,0,0|1,0,0]=3 12660 B21R2.103648 O=C(C=Cc1ccccc1F)CCc2cccc(c2)F 1458a_100016256065_100011217235 [0,2,0,0,0,0|1,0,0]=3 12661 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cc(ccn2)Br 11a_100009818019_100016256065 [0,2,0,0,0,0|2,0,0]=4 12662 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cc(ccn2)Br 1626a_100009818019_100016256065 [0,2,0,0,0,0|2,0,0]=4 12663 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cc(ccn2)Br 240690a_100009818019_100016256065 [0,2,0,0,0,0|2,0,0]=4 12664 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cc(ccn2)Cl 11a_100000085674_100016256065 [0,2,0,0,0,0|2,0,0]=4 12665 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cc(ccn2)Cl 1626a_100000085674_100016256065 [0,2,0,0,0,0|2,0,0]=4 12666 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cc(ccn2)Cl 240690a_100000085674_100016256065 [0,2,0,0,0,0|2,0,0]=4 12667 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(=O)[nH]2 11a_100000696482_100016256065 [0,2,0,0,0,0|2,0,0]=4 12668 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(=O)[nH]2 1626a_100000696482_100016256065 [0,2,0,0,0,0|2,0,0]=4 12669 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(=O)[nH]2 240690a_100000696482_100016256065 [0,2,0,0,0,0|2,0,0]=4 12670 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)Br 11a_100000174977_100016256065 [0,2,0,0,0,0|1,0,0]=3 12671 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)Br 1626a_100000174977_100016256065 [0,2,0,0,0,0|1,0,0]=3 12672 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)Br 240690a_100000174977_100016256065 [0,2,0,0,0,0|1,0,0]=3 12673 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)Cl 11a_100000174878_100016256065 [0,2,0,0,0,0|1,0,0]=3 12674 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)Cl 1626a_100000174878_100016256065 [0,2,0,0,0,0|1,0,0]=3 12675 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)Cl 240690a_100000174878_100016256065 [0,2,0,0,0,0|1,0,0]=3 12676 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)F 11a_100000174948_100016256065 [0,2,0,0,0,0|1,0,0]=3 12677 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)F 1626a_100000174948_100016256065 [0,2,0,0,0,0|1,0,0]=3 12678 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)F 240690a_100000174948_100016256065 [0,2,0,0,0,0|1,0,0]=3 12679 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)I 11a_100000106179_100016256065 [0,2,0,0,0,0|1,0,0]=3 12680 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)I 1626a_100000106179_100016256065 [0,2,0,0,0,0|1,0,0]=3 12681 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)I 240690a_100000106179_100016256065 [0,2,0,0,0,0|1,0,0]=3 12682 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(c2)O 240690a_100000743036_100016256065 [0,2,0,0,0,0|1,0,0]=3 12683 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)Br 11a_100016987751_100016256065 [0,2,0,0,0,0|2,0,0]=4 12684 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)Br 1626a_100016987751_100016256065 [0,2,0,0,0,0|2,0,0]=4 12685 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)Br 240690a_100016987751_100016256065 [0,2,0,0,0,0|2,0,0]=4 12686 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)Cl 11a_100016990191_100016256065 [0,2,0,0,0,0|2,0,0]=4 12687 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)Cl 1626a_100016990191_100016256065 [0,2,0,0,0,0|2,0,0]=4 12688 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)Cl 240690a_100016990191_100016256065 [0,2,0,0,0,0|2,0,0]=4 12689 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)F 11a_100015188798_100016256065 [0,2,0,0,0,0|2,0,0]=4 12690 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)F 1626a_100015188798_100016256065 [0,2,0,0,0,0|2,0,0]=4 12691 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cccc(n2)F 240690a_100015188798_100016256065 [0,2,0,0,0,0|2,0,0]=4 12692 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)Br 11a_100025757509_100016256065 [0,2,0,0,0,0|2,0,0]=4 12693 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)Br 240690a_100025757509_100016256065 [0,2,0,0,0,0|2,0,0]=4 12694 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)Cl 11a_100015205668_100016256065 [0,2,0,0,0,0|2,0,0]=4 12695 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)Cl 1626a_100015205668_100016256065 [0,2,0,0,0,0|2,0,0]=4 12696 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)Cl 240690a_100015205668_100016256065 [0,2,0,0,0,0|2,0,0]=4 12697 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)F 11a_100015188774_100016256065 [0,2,0,0,0,0|2,0,0]=4 12698 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)F 1626a_100015188774_100016256065 [0,2,0,0,0,0|2,0,0]=4 12699 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)F 240690a_100015188774_100016256065 [0,2,0,0,0,0|2,0,0]=4 12700 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)O 11a_100000748557_100016256065 [0,2,0,0,0,0|2,0,0]=4 12701 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2ccnc(c2)O 240690a_100000748557_100016256065 [0,2,0,0,0,0|2,0,0]=4 12702 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cncc(c2)Br 11a_100011249555_100016256065 [0,2,0,0,0,0|2,0,0]=4 12703 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cncc(c2)Br 240690a_100011249555_100016256065 [0,2,0,0,0,0|2,0,0]=4 12704 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cncc(c2)Cl 11a_200020614424_100016256065 [0,2,0,0,0,0|2,0,0]=4 12705 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cncc(c2)Cl 1626a_200020614424_100016256065 [0,2,0,0,0,0|2,0,0]=4 12706 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cncc(c2)Cl 240690a_200020614424_100016256065 [0,2,0,0,0,0|2,0,0]=4 12707 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cncc(c2)F 11a_100011962886_100016256065 [0,2,0,0,0,0|2,0,0]=4 12708 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cncc(c2)F 1626a_100011962886_100016256065 [0,2,0,0,0,0|2,0,0]=4 12709 B21R2.103648 O=C(C=Cc1ccccc1F)NCc2cncc(c2)F 240690a_100011962886_100016256065 [0,2,0,0,0,0|2,0,0]=4 12710 B21R2.103648 O=C(C=Cc1ccccc1F)NNc2cccc(c2)Br 22a_100000217339_100016256065 [0,2,0,0,0,0|2,0,0]=4 12711 B21R2.103648 O=C(C=Cc1ccccc1F)NNc2cccc(c2)Cl 22a_100000184277_100016256065 [0,2,0,0,0,0|2,0,0]=4 12712 B21R2.103648 O=C(C=Cc1ccccc1F)NNc2cccc(c2)F 22a_100000745080_100016256065 [0,2,0,0,0,0|2,0,0]=4 12713 B21R2.103648 O=C(C=Cc1ccccc1F)NNc2cccc(c2)I 22a_100020605690_100016256065 [0,2,0,0,0,0|2,0,0]=4 12714 B21R2.103648 O=C(C=Cc1ccccc1O)CCc2cccc(c2)Br 1458a_100016263591_100011740638 [0,2,0,0,0,0|1,0,0]=3 12715 B21R2.103648 O=C(C=Cc1ccccc1O)CCc2cccc(c2)Cl 1458a_100016263591_100011713710 [0,2,0,0,0,0|1,0,0]=3 12716 B21R2.103648 O=C(C=Cc1ccccc1O)CCc2cccc(c2)F 1458a_100016263591_100011217235 [0,2,0,0,0,0|1,0,0]=3 12717 B21R2.103648 O=C(C=Cc1ccccc1O)NNc2cccc(c2)Br 22a_100000217339_100016263591 [0,2,0,0,0,0|2,0,0]=4 12718 B21R2.103648 O=C(C=Cc1ccccc1O)NNc2cccc(c2)Cl 22a_100000184277_100016263591 [0,2,0,0,0,0|2,0,0]=4 12719 B21R2.103648 O=C(C=Cc1ccccc1O)NNc2cccc(c2)F 22a_100000745080_100016263591 [0,2,0,0,0,0|2,0,0]=4 12720 B21R2.103648 O=C(C=Cc1ccccc1O)NNc2cccc(c2)I 22a_100020605690_100016263591 [0,2,0,0,0,0|2,0,0]=4 12721 B21R2.221977 CC(=CC(=O)CCc1cccc(c1)Br)c2ccccc2 1458a_100000743005_100011740638 [0,2,0,0,0,0|1,0,0]=3 12722 B21R2.221977 CC(=CC(=O)CCc1cccc(c1)C)c2ccccc2 1458a_100000743005_100011713685 [0,2,0,0,0,0|1,0,0]=3 12723 B21R2.221977 CC(=CC(=O)CCc1cccc(c1)Cl)c2ccccc2 1458a_100000743005_100011713710 [0,2,0,0,0,0|1,0,0]=3 12724 B21R2.221977 CC(=CC(=O)CCc1cccc(c1)F)c2ccccc2 1458a_100000743005_100011217235 [0,2,0,0,0,0|1,0,0]=3 12725 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)Br)c2ccccc2 11a_100009818019_100000743005 [0,2,0,0,0,0|2,0,0]=4 12726 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)Br)c2ccccc2 1626a_100009818019_100000743005 [0,2,0,0,0,0|2,0,0]=4 12727 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)Br)c2ccccc2 240690a_100009818019_100000743005 [0,2,0,0,0,0|2,0,0]=4 12728 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)Br)c2ccccc2 527a_100009818019_100000743005 [0,2,0,0,0,0|2,0,0]=4 12729 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)C)c2ccccc2 11a_100011934573_100000743005 [0,2,0,0,0,0|2,0,0]=4 12730 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)C)c2ccccc2 1626a_100011934573_100000743005 [0,2,0,0,0,0|2,0,0]=4 12731 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)C)c2ccccc2 240690a_100011934573_100000743005 [0,2,0,0,0,0|2,0,0]=4 12732 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)C)c2ccccc2 527a_100011934573_100000743005 [0,2,0,0,0,0|2,0,0]=4 12733 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)Cl)c2ccccc2 11a_100000085674_100000743005 [0,2,0,0,0,0|2,0,0]=4 12734 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)Cl)c2ccccc2 1626a_100000085674_100000743005 [0,2,0,0,0,0|2,0,0]=4 12735 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)Cl)c2ccccc2 240690a_100000085674_100000743005 [0,2,0,0,0,0|2,0,0]=4 12736 B21R2.221977 CC(=CC(=O)NCc1cc(ccn1)Cl)c2ccccc2 527a_100000085674_100000743005 [0,2,0,0,0,0|2,0,0]=4 12737 B21R2.221977 CC(=CC(=O)NCc1cccc(=O)[nH]1)c2ccccc2 11a_100000696482_100000743005 [0,2,0,0,0,0|2,0,0]=4 12738 B21R2.221977 CC(=CC(=O)NCc1cccc(=O)[nH]1)c2ccccc2 1626a_100000696482_100000743005 [0,2,0,0,0,0|2,0,0]=4 12739 B21R2.221977 CC(=CC(=O)NCc1cccc(=O)[nH]1)c2ccccc2 240690a_100000696482_100000743005 [0,2,0,0,0,0|2,0,0]=4 12740 B21R2.221977 CC(=CC(=O)NCc1cccc(=O)[nH]1)c2ccccc2 527a_100000696482_100000743005 [0,2,0,0,0,0|2,0,0]=4 12741 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)Br)c2ccccc2 11a_100000174977_100000743005 [0,2,0,0,0,0|1,0,0]=3 12742 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)Br)c2ccccc2 1626a_100000174977_100000743005 [0,2,0,0,0,0|1,0,0]=3 12743 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)Br)c2ccccc2 240690a_100000174977_100000743005 [0,2,0,0,0,0|1,0,0]=3 12744 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)Br)c2ccccc2 527a_100000174977_100000743005 [0,2,0,0,0,0|1,0,0]=3 12745 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)C)c2ccccc2 11a_100000185548_100000743005 [0,2,0,0,0,0|1,0,0]=3 12746 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)C)c2ccccc2 1626a_100000185548_100000743005 [0,2,0,0,0,0|1,0,0]=3 12747 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)C)c2ccccc2 240690a_100000185548_100000743005 [0,2,0,0,0,0|1,0,0]=3 12748 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)C)c2ccccc2 527a_100000185548_100000743005 [0,2,0,0,0,0|1,0,0]=3 12749 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)Cl)c2ccccc2 11a_100000174878_100000743005 [0,2,0,0,0,0|1,0,0]=3 12750 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)Cl)c2ccccc2 1626a_100000174878_100000743005 [0,2,0,0,0,0|1,0,0]=3 12751 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)Cl)c2ccccc2 240690a_100000174878_100000743005 [0,2,0,0,0,0|1,0,0]=3 12752 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)Cl)c2ccccc2 527a_100000174878_100000743005 [0,2,0,0,0,0|1,0,0]=3 12753 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)F)c2ccccc2 11a_100000174948_100000743005 [0,2,0,0,0,0|1,0,0]=3 12754 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)F)c2ccccc2 1626a_100000174948_100000743005 [0,2,0,0,0,0|1,0,0]=3 12755 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)F)c2ccccc2 240690a_100000174948_100000743005 [0,2,0,0,0,0|1,0,0]=3 12756 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)F)c2ccccc2 527a_100000174948_100000743005 [0,2,0,0,0,0|1,0,0]=3 12757 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)I)c2ccccc2 11a_100000106179_100000743005 [0,2,0,0,0,0|1,0,0]=3 12758 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)I)c2ccccc2 1626a_100000106179_100000743005 [0,2,0,0,0,0|1,0,0]=3 12759 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)I)c2ccccc2 240690a_100000106179_100000743005 [0,2,0,0,0,0|1,0,0]=3 12760 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)I)c2ccccc2 527a_100000106179_100000743005 [0,2,0,0,0,0|1,0,0]=3 12761 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)O)c2ccccc2 240690a_100000743036_100000743005 [0,2,0,0,0,0|1,0,0]=3 12762 B21R2.221977 CC(=CC(=O)NCc1cccc(c1)O)c2ccccc2 527a_100000743036_100000743005 [0,2,0,0,0,0|1,0,0]=3 12763 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)Br)c2ccccc2 11a_100016987751_100000743005 [0,2,0,0,0,0|2,0,0]=4 12764 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)Br)c2ccccc2 1626a_100016987751_100000743005 [0,2,0,0,0,0|2,0,0]=4 12765 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)Br)c2ccccc2 240690a_100016987751_100000743005 [0,2,0,0,0,0|2,0,0]=4 12766 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)Br)c2ccccc2 527a_100016987751_100000743005 [0,2,0,0,0,0|2,0,0]=4 12767 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)C)c2ccccc2 11a_100000701342_100000743005 [0,2,0,0,0,0|2,0,0]=4 12768 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)C)c2ccccc2 1626a_100000701342_100000743005 [0,2,0,0,0,0|2,0,0]=4 12769 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)C)c2ccccc2 240690a_100000701342_100000743005 [0,2,0,0,0,0|2,0,0]=4 12770 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)C)c2ccccc2 527a_100000701342_100000743005 [0,2,0,0,0,0|2,0,0]=4 12771 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)Cl)c2ccccc2 11a_100016990191_100000743005 [0,2,0,0,0,0|2,0,0]=4 12772 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)Cl)c2ccccc2 1626a_100016990191_100000743005 [0,2,0,0,0,0|2,0,0]=4 12773 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)Cl)c2ccccc2 240690a_100016990191_100000743005 [0,2,0,0,0,0|2,0,0]=4 12774 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)Cl)c2ccccc2 527a_100016990191_100000743005 [0,2,0,0,0,0|2,0,0]=4 12775 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)F)c2ccccc2 11a_100015188798_100000743005 [0,2,0,0,0,0|2,0,0]=4 12776 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)F)c2ccccc2 1626a_100015188798_100000743005 [0,2,0,0,0,0|2,0,0]=4 12777 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)F)c2ccccc2 240690a_100015188798_100000743005 [0,2,0,0,0,0|2,0,0]=4 12778 B21R2.221977 CC(=CC(=O)NCc1cccc(n1)F)c2ccccc2 527a_100015188798_100000743005 [0,2,0,0,0,0|2,0,0]=4 12779 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)Br)c2ccccc2 11a_100025757509_100000743005 [0,2,0,0,0,0|2,0,0]=4 12780 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)Br)c2ccccc2 240690a_100025757509_100000743005 [0,2,0,0,0,0|2,0,0]=4 12781 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)Br)c2ccccc2 527a_100025757509_100000743005 [0,2,0,0,0,0|2,0,0]=4 12782 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)C)c2ccccc2 11a_100011934566_100000743005 [0,2,0,0,0,0|2,0,0]=4 12783 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)C)c2ccccc2 1626a_100011934566_100000743005 [0,2,0,0,0,0|2,0,0]=4 12784 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)C)c2ccccc2 240690a_100011934566_100000743005 [0,2,0,0,0,0|2,0,0]=4 12785 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)C)c2ccccc2 527a_100011934566_100000743005 [0,2,0,0,0,0|2,0,0]=4 12786 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)Cl)c2ccccc2 11a_100015205668_100000743005 [0,2,0,0,0,0|2,0,0]=4 12787 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)Cl)c2ccccc2 1626a_100015205668_100000743005 [0,2,0,0,0,0|2,0,0]=4 12788 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)Cl)c2ccccc2 240690a_100015205668_100000743005 [0,2,0,0,0,0|2,0,0]=4 12789 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)Cl)c2ccccc2 527a_100015205668_100000743005 [0,2,0,0,0,0|2,0,0]=4 12790 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)F)c2ccccc2 11a_100015188774_100000743005 [0,2,0,0,0,0|2,0,0]=4 12791 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)F)c2ccccc2 1626a_100015188774_100000743005 [0,2,0,0,0,0|2,0,0]=4 12792 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)F)c2ccccc2 240690a_100015188774_100000743005 [0,2,0,0,0,0|2,0,0]=4 12793 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)F)c2ccccc2 527a_100015188774_100000743005 [0,2,0,0,0,0|2,0,0]=4 12794 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)O)c2ccccc2 11a_100000748557_100000743005 [0,2,0,0,0,0|2,0,0]=4 12795 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)O)c2ccccc2 240690a_100000748557_100000743005 [0,2,0,0,0,0|2,0,0]=4 12796 B21R2.221977 CC(=CC(=O)NCc1ccnc(c1)O)c2ccccc2 527a_100000748557_100000743005 [0,2,0,0,0,0|2,0,0]=4 12797 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)Br)c2ccccc2 11a_100011249555_100000743005 [0,2,0,0,0,0|2,0,0]=4 12798 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)Br)c2ccccc2 240690a_100011249555_100000743005 [0,2,0,0,0,0|2,0,0]=4 12799 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)Br)c2ccccc2 527a_100011249555_100000743005 [0,2,0,0,0,0|2,0,0]=4 12800 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)C)c2ccccc2 11a_100000692839_100000743005 [0,2,0,0,0,0|2,0,0]=4 12801 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)C)c2ccccc2 1626a_100000692839_100000743005 [0,2,0,0,0,0|2,0,0]=4 12802 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)C)c2ccccc2 240690a_100000692839_100000743005 [0,2,0,0,0,0|2,0,0]=4 12803 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)C)c2ccccc2 527a_100000692839_100000743005 [0,2,0,0,0,0|2,0,0]=4 12804 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)Cl)c2ccccc2 11a_200020614424_100000743005 [0,2,0,0,0,0|2,0,0]=4 12805 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)Cl)c2ccccc2 1626a_200020614424_100000743005 [0,2,0,0,0,0|2,0,0]=4 12806 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)Cl)c2ccccc2 240690a_200020614424_100000743005 [0,2,0,0,0,0|2,0,0]=4 12807 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)Cl)c2ccccc2 527a_200020614424_100000743005 [0,2,0,0,0,0|2,0,0]=4 12808 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)F)c2ccccc2 11a_100011962886_100000743005 [0,2,0,0,0,0|2,0,0]=4 12809 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)F)c2ccccc2 1626a_100011962886_100000743005 [0,2,0,0,0,0|2,0,0]=4 12810 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)F)c2ccccc2 240690a_100011962886_100000743005 [0,2,0,0,0,0|2,0,0]=4 12811 B21R2.221977 CC(=CC(=O)NCc1cncc(c1)F)c2ccccc2 527a_100011962886_100000743005 [0,2,0,0,0,0|2,0,0]=4 12812 B21R2.221977 CC(=CC(=O)NNc1cccc(c1)Br)c2ccccc2 22a_100000217339_100000743005 [0,2,0,0,0,0|2,0,0]=4 12813 B21R2.221977 CC(=CC(=O)NNc1cccc(c1)C)c2ccccc2 22a_100000681630_100000743005 [0,2,0,0,0,0|2,0,0]=4 12814 B21R2.221977 CC(=CC(=O)NNc1cccc(c1)Cl)c2ccccc2 22a_100000184277_100000743005 [0,2,0,0,0,0|2,0,0]=4 12815 B21R2.221977 CC(=CC(=O)NNc1cccc(c1)F)c2ccccc2 22a_100000745080_100000743005 [0,2,0,0,0,0|2,0,0]=4 12816 B21R2.221977 CC(=CC(=O)NNc1cccc(c1)I)c2ccccc2 22a_100020605690_100000743005 [0,2,0,0,0,0|2,0,0]=4 12817 B21R2.221977 CC(CC(=O)C=Cc1cccc(c1)Br)c2ccccc2 1458a_100016258244_100000756946 [0,2,0,0,0,0|1,0,0]=3 12818 B21R2.221977 CC(CC(=O)C=Cc1cccc(c1)Cl)c2ccccc2 1458a_100000184502_100000756946 [0,2,0,0,0,0|1,0,0]=3 12819 B21R2.221977 CC(CC(=O)C=Cc1cccc(c1)F)c2ccccc2 1458a_100000718793_100000756946 [0,2,0,0,0,0|1,0,0]=3 12820 B21R2.221977 CC(CC(=O)C=Cc1cccc(c1)I)c2ccccc2 1458a_100020647043_100000756946 [0,2,0,0,0,0|1,0,0]=3 12821 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Br)c2ccccn2 11a_100000181244_100016258244 [0,2,0,0,0,0|2,0,0]=4 12822 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Br)c2ccccn2 1626a_100000181244_100016258244 [0,2,0,0,0,0|2,0,0]=4 12823 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Br)c2ccccn2 240690a_100000181244_100016258244 [0,2,0,0,0,0|2,0,0]=4 12824 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Br)c2cccnc2 11a_100000195435_100016258244 [0,2,0,0,0,0|2,0,0]=4 12825 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Br)c2cccnc2 240690a_100000195435_100016258244 [0,2,0,0,0,0|2,0,0]=4 12826 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Br)c2ccncc2 240690a_100000181269_100016258244 [0,2,0,0,0,0|2,0,0]=4 12827 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Cl)c2ccccn2 11a_100000181244_100000184502 [0,2,0,0,0,0|2,0,0]=4 12828 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Cl)c2ccccn2 1626a_100000181244_100000184502 [0,2,0,0,0,0|2,0,0]=4 12829 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Cl)c2ccccn2 240690a_100000181244_100000184502 [0,2,0,0,0,0|2,0,0]=4 12830 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Cl)c2cccnc2 11a_100000195435_100000184502 [0,2,0,0,0,0|2,0,0]=4 12831 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Cl)c2cccnc2 240690a_100000195435_100000184502 [0,2,0,0,0,0|2,0,0]=4 12832 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)Cl)c2ccncc2 240690a_100000181269_100000184502 [0,2,0,0,0,0|2,0,0]=4 12833 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)F)c2ccccn2 11a_100000181244_100000718793 [0,2,0,0,0,0|2,0,0]=4 12834 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)F)c2ccccn2 1626a_100000181244_100000718793 [0,2,0,0,0,0|2,0,0]=4 12835 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)F)c2ccccn2 240690a_100000181244_100000718793 [0,2,0,0,0,0|2,0,0]=4 12836 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)F)c2cccnc2 11a_100000195435_100000718793 [0,2,0,0,0,0|2,0,0]=4 12837 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)F)c2cccnc2 240690a_100000195435_100000718793 [0,2,0,0,0,0|2,0,0]=4 12838 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)F)c2ccncc2 240690a_100000181269_100000718793 [0,2,0,0,0,0|2,0,0]=4 12839 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)I)c2ccccn2 11a_100000181244_100020647043 [0,2,0,0,0,0|2,0,0]=4 12840 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)I)c2ccccn2 1626a_100000181244_100020647043 [0,2,0,0,0,0|2,0,0]=4 12841 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)I)c2ccccn2 240690a_100000181244_100020647043 [0,2,0,0,0,0|2,0,0]=4 12842 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)I)c2cccnc2 11a_100000195435_100020647043 [0,2,0,0,0,0|2,0,0]=4 12843 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)I)c2cccnc2 240690a_100000195435_100020647043 [0,2,0,0,0,0|2,0,0]=4 12844 B21R2.221977 CC(NC(=O)C=Cc1cccc(c1)I)c2ccncc2 240690a_100000181269_100020647043 [0,2,0,0,0,0|2,0,0]=4 12845 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)Br)c2ccccc2 11a_100000751104_100016258244 [0,2,0,0,0,0|1,0,0]=3 12846 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)Br)c2ccccc2 1626a_100000751104_100016258244 [0,2,0,0,0,0|1,0,0]=3 12847 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)Br)c2ccccc2 240690a_100000751104_100016258244 [0,2,0,0,0,0|1,0,0]=3 12848 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)Cl)c2ccccc2 11a_100000751104_100000184502 [0,2,0,0,0,0|1,0,0]=3 12849 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)Cl)c2ccccc2 1626a_100000751104_100000184502 [0,2,0,0,0,0|1,0,0]=3 12850 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)Cl)c2ccccc2 240690a_100000751104_100000184502 [0,2,0,0,0,0|1,0,0]=3 12851 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)F)c2ccccc2 11a_100000751104_100000718793 [0,2,0,0,0,0|1,0,0]=3 12852 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)F)c2ccccc2 1626a_100000751104_100000718793 [0,2,0,0,0,0|1,0,0]=3 12853 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)F)c2ccccc2 240690a_100000751104_100000718793 [0,2,0,0,0,0|1,0,0]=3 12854 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)I)c2ccccc2 11a_100000751104_100020647043 [0,2,0,0,0,0|1,0,0]=3 12855 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)I)c2ccccc2 1626a_100000751104_100020647043 [0,2,0,0,0,0|1,0,0]=3 12856 B21R2.221977 C[C@@H](NC(=O)C=Cc1cccc(c1)I)c2ccccc2 240690a_100000751104_100020647043 [0,2,0,0,0,0|1,0,0]=3 12857 B21R2.221977 Cc1cccc(c1)C=CC(=O)CC(=O)c2ccccc2 1458a_100000690095_100000211460 [0,2,0,0,0,0|1,0,1]=4 12858 B21R2.221977 Cc1cccc(c1)C=CC(=O)CC(C)c2ccccc2 1458a_100000690095_100000756946 [0,2,0,0,0,0|1,0,0]=3 12859 B21R2.221977 Cc1cccc(c1)C=CC(=O)CC(O)c2ccccc2 1458a_100000690095_100000185958 [0,2,0,0,0,0|1,0,0]=3 12860 B21R2.221977 Cc1cccc(c1)C=CC(=O)C[C@@H](O)c2ccccc2 1458a_100000690095_100011933945 [0,2,0,0,0,0|1,0,0]=3 12861 B21R2.221977 Cc1cccc(c1)C=CC(=O)NC(C)c2ccccn2 11a_100000181244_100000690095 [0,2,0,0,0,0|2,0,0]=4 12862 B21R2.221977 Cc1cccc(c1)C=CC(=O)NC(C)c2ccccn2 1626a_100000181244_100000690095 [0,2,0,0,0,0|2,0,0]=4 12863 B21R2.221977 Cc1cccc(c1)C=CC(=O)NC(C)c2ccccn2 240690a_100000181244_100000690095 [0,2,0,0,0,0|2,0,0]=4 12864 B21R2.221977 Cc1cccc(c1)C=CC(=O)NC(C)c2cccnc2 11a_100000195435_100000690095 [0,2,0,0,0,0|2,0,0]=4 12865 B21R2.221977 Cc1cccc(c1)C=CC(=O)NC(C)c2cccnc2 240690a_100000195435_100000690095 [0,2,0,0,0,0|2,0,0]=4 12866 B21R2.221977 Cc1cccc(c1)C=CC(=O)NC(C)c2ccncc2 240690a_100000181269_100000690095 [0,2,0,0,0,0|2,0,0]=4 12867 B21R2.221977 Cc1cccc(c1)C=CC(=O)N[C@H](C)c2ccccc2 11a_100000751104_100000690095 [0,2,0,0,0,0|1,0,0]=3 12868 B21R2.221977 Cc1cccc(c1)C=CC(=O)N[C@H](C)c2ccccc2 1626a_100000751104_100000690095 [0,2,0,0,0,0|1,0,0]=3 12869 B21R2.221977 Cc1cccc(c1)C=CC(=O)N[C@H](C)c2ccccc2 240690a_100000751104_100000690095 [0,2,0,0,0,0|1,0,0]=3 12870 B21R2.221977 Cc1cccc(c1)CCC(=O)CC(=O)c2ccccc2 1458a_100000234952_100000211460 [0,2,0,0,0,0|1,0,1]=4 12871 B21R2.221977 Cc1cccc(c1)CNC(=O)CC(=O)c2ccccc2 1458a_100000185807_100000754571 [0,2,0,0,0,0|1,0,1]=4 12872 B21R2.221977 O=C(C=Cc1cccc(c1)Br)CC(=O)c2ccccc2 1458a_100016258244_100000211460 [0,2,0,0,0,0|1,0,1]=4 12873 B21R2.221977 O=C(C=Cc1cccc(c1)Br)CC(O)c2ccccc2 1458a_100016258244_100000185958 [0,2,0,0,0,0|1,0,0]=3 12874 B21R2.221977 O=C(C=Cc1cccc(c1)Br)C[C@@H](O)c2ccccc2 1458a_100016258244_100011933945 [0,2,0,0,0,0|1,0,0]=3 12875 B21R2.221977 O=C(C=Cc1cccc(c1)Cl)CC(=O)c2ccccc2 1458a_100000184502_100000211460 [0,2,0,0,0,0|1,0,1]=4 12876 B21R2.221977 O=C(C=Cc1cccc(c1)Cl)CC(O)c2ccccc2 1458a_100000184502_100000185958 [0,2,0,0,0,0|1,0,0]=3 12877 B21R2.221977 O=C(C=Cc1cccc(c1)Cl)C[C@@H](O)c2ccccc2 1458a_100000184502_100011933945 [0,2,0,0,0,0|1,0,0]=3 12878 B21R2.221977 O=C(C=Cc1cccc(c1)F)CC(=O)c2ccccc2 1458a_100000718793_100000211460 [0,2,0,0,0,0|1,0,1]=4 12879 B21R2.221977 O=C(C=Cc1cccc(c1)F)CC(O)c2ccccc2 1458a_100000718793_100000185958 [0,2,0,0,0,0|1,0,0]=3 12880 B21R2.221977 O=C(C=Cc1cccc(c1)F)C[C@@H](O)c2ccccc2 1458a_100000718793_100011933945 [0,2,0,0,0,0|1,0,0]=3 12881 B21R2.221977 O=C(C=Cc1cccc(c1)I)CC(=O)c2ccccc2 1458a_100020647043_100000211460 [0,2,0,0,0,0|1,0,1]=4 12882 B21R2.221977 O=C(C=Cc1cccc(c1)I)CC(O)c2ccccc2 1458a_100020647043_100000185958 [0,2,0,0,0,0|1,0,0]=3 12883 B21R2.221977 O=C(C=Cc1cccc(c1)I)C[C@@H](O)c2ccccc2 1458a_100020647043_100011933945 [0,2,0,0,0,0|1,0,0]=3 12884 B21R2.221977 O=C(CC(=O)c1ccccc1)NCc2cccc(c2)Br 1458a_100000185807_100011263252 [0,2,0,0,0,0|1,0,1]=4 12885 B21R2.221977 O=C(CC(=O)c1ccccc1)NCc2cccc(c2)Cl 1458a_100000185807_100000181154 [0,2,0,0,0,0|1,0,1]=4 12886 B21R2.221977 O=C(CC(=O)c1ccccc1)NCc2cccc(c2)F 1458a_100000185807_100000738998 [0,2,0,0,0,0|1,0,1]=4 12887 B21R2.221977 O=C(CCc1cccc(c1)Br)CC(=O)c2ccccc2 1458a_100000184314_100000211460 [0,2,0,0,0,0|1,0,1]=4 12888 B21R2.221977 O=C(CCc1cccc(c1)Cl)CC(=O)c2ccccc2 1458a_100000235675_100000211460 [0,2,0,0,0,0|1,0,1]=4 12889 B21R2.221977 O=C(CCc1cccc(c1)F)CC(=O)c2ccccc2 1458a_100000235673_100000211460 [0,2,0,0,0,0|1,0,1]=4 12890 B21R2.221977 O=C(CCc1cccc(c1)I)CC(=O)c2ccccc2 1458a_100010007846_100000211460 [0,2,0,0,0,0|1,0,1]=4 12891 B21R2.221977 O=C(CCc1cccc(c1)O)CC(=O)c2ccccc2 1458a_100011216126_100000211460 [0,2,0,0,0,0|1,0,1]=4 12892 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)Br 11a_100011934566_100016258244 [0,2,0,0,0,0|2,0,0]=4 12893 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)Br 1626a_100011934566_100016258244 [0,2,0,0,0,0|2,0,0]=4 12894 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)Br 240690a_100011934566_100016258244 [0,2,0,0,0,0|2,0,0]=4 12895 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)Cl 11a_100011934566_100000184502 [0,2,0,0,0,0|2,0,0]=4 12896 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)Cl 1626a_100011934566_100000184502 [0,2,0,0,0,0|2,0,0]=4 12897 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)Cl 240690a_100011934566_100000184502 [0,2,0,0,0,0|2,0,0]=4 12898 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)F 11a_100011934566_100000718793 [0,2,0,0,0,0|2,0,0]=4 12899 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)F 1626a_100011934566_100000718793 [0,2,0,0,0,0|2,0,0]=4 12900 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)F 240690a_100011934566_100000718793 [0,2,0,0,0,0|2,0,0]=4 12901 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)I 11a_100011934566_100020647043 [0,2,0,0,0,0|2,0,0]=4 12902 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)I 1626a_100011934566_100020647043 [0,2,0,0,0,0|2,0,0]=4 12903 B21R2.221979 Cc1cc(ccn1)CNC(=O)C=Cc2cccc(c2)I 240690a_100011934566_100020647043 [0,2,0,0,0,0|2,0,0]=4 12904 B21R2.221979 Cc1cccc(c1)C=CC(=O)CCc2cccc(c2)Br 1458a_100000690095_100011740638 [0,2,0,0,0,0|1,0,0]=3 12905 B21R2.221979 Cc1cccc(c1)C=CC(=O)CCc2cccc(c2)C 1458a_100000690095_100011713685 [0,2,0,0,0,0|1,0,0]=3 12906 B21R2.221979 Cc1cccc(c1)C=CC(=O)CCc2cccc(c2)Cl 1458a_100000690095_100011713710 [0,2,0,0,0,0|1,0,0]=3 12907 B21R2.221979 Cc1cccc(c1)C=CC(=O)CCc2cccc(c2)F 1458a_100000690095_100011217235 [0,2,0,0,0,0|1,0,0]=3 12908 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)Br 11a_100009818019_100000690095 [0,2,0,0,0,0|2,0,0]=4 12909 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)Br 1626a_100009818019_100000690095 [0,2,0,0,0,0|2,0,0]=4 12910 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)Br 240690a_100009818019_100000690095 [0,2,0,0,0,0|2,0,0]=4 12911 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)C 11a_100011934573_100000690095 [0,2,0,0,0,0|2,0,0]=4 12912 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)C 1626a_100011934573_100000690095 [0,2,0,0,0,0|2,0,0]=4 12913 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)C 240690a_100011934573_100000690095 [0,2,0,0,0,0|2,0,0]=4 12914 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)Cl 11a_100000085674_100000690095 [0,2,0,0,0,0|2,0,0]=4 12915 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)Cl 1626a_100000085674_100000690095 [0,2,0,0,0,0|2,0,0]=4 12916 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cc(ccn2)Cl 240690a_100000085674_100000690095 [0,2,0,0,0,0|2,0,0]=4 12917 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(=O)[nH]2 11a_100000696482_100000690095 [0,2,0,0,0,0|2,0,0]=4 12918 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(=O)[nH]2 1626a_100000696482_100000690095 [0,2,0,0,0,0|2,0,0]=4 12919 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(=O)[nH]2 240690a_100000696482_100000690095 [0,2,0,0,0,0|2,0,0]=4 12920 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)Br 11a_100000174977_100000690095 [0,2,0,0,0,0|1,0,0]=3 12921 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)Br 1626a_100000174977_100000690095 [0,2,0,0,0,0|1,0,0]=3 12922 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)Br 240690a_100000174977_100000690095 [0,2,0,0,0,0|1,0,0]=3 12923 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)C 11a_100000185548_100000690095 [0,2,0,0,0,0|1,0,0]=3 12924 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)C 1626a_100000185548_100000690095 [0,2,0,0,0,0|1,0,0]=3 12925 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)C 240690a_100000185548_100000690095 [0,2,0,0,0,0|1,0,0]=3 12926 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)Cl 11a_100000174878_100000690095 [0,2,0,0,0,0|1,0,0]=3 12927 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)Cl 1626a_100000174878_100000690095 [0,2,0,0,0,0|1,0,0]=3 12928 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)Cl 240690a_100000174878_100000690095 [0,2,0,0,0,0|1,0,0]=3 12929 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)F 11a_100000174948_100000690095 [0,2,0,0,0,0|1,0,0]=3 12930 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)F 1626a_100000174948_100000690095 [0,2,0,0,0,0|1,0,0]=3 12931 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)F 240690a_100000174948_100000690095 [0,2,0,0,0,0|1,0,0]=3 12932 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)I 11a_100000106179_100000690095 [0,2,0,0,0,0|1,0,0]=3 12933 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)I 1626a_100000106179_100000690095 [0,2,0,0,0,0|1,0,0]=3 12934 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)I 240690a_100000106179_100000690095 [0,2,0,0,0,0|1,0,0]=3 12935 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(c2)O 240690a_100000743036_100000690095 [0,2,0,0,0,0|1,0,0]=3 12936 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)Br 11a_100016987751_100000690095 [0,2,0,0,0,0|2,0,0]=4 12937 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)Br 1626a_100016987751_100000690095 [0,2,0,0,0,0|2,0,0]=4 12938 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)Br 240690a_100016987751_100000690095 [0,2,0,0,0,0|2,0,0]=4 12939 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)C 11a_100000701342_100000690095 [0,2,0,0,0,0|2,0,0]=4 12940 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)C 1626a_100000701342_100000690095 [0,2,0,0,0,0|2,0,0]=4 12941 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)C 240690a_100000701342_100000690095 [0,2,0,0,0,0|2,0,0]=4 12942 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)Cl 11a_100016990191_100000690095 [0,2,0,0,0,0|2,0,0]=4 12943 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)Cl 1626a_100016990191_100000690095 [0,2,0,0,0,0|2,0,0]=4 12944 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)Cl 240690a_100016990191_100000690095 [0,2,0,0,0,0|2,0,0]=4 12945 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)F 11a_100015188798_100000690095 [0,2,0,0,0,0|2,0,0]=4 12946 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)F 1626a_100015188798_100000690095 [0,2,0,0,0,0|2,0,0]=4 12947 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cccc(n2)F 240690a_100015188798_100000690095 [0,2,0,0,0,0|2,0,0]=4 12948 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)Br 11a_100025757509_100000690095 [0,2,0,0,0,0|2,0,0]=4 12949 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)Br 240690a_100025757509_100000690095 [0,2,0,0,0,0|2,0,0]=4 12950 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)C 11a_100011934566_100000690095 [0,2,0,0,0,0|2,0,0]=4 12951 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)C 1626a_100011934566_100000690095 [0,2,0,0,0,0|2,0,0]=4 12952 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)C 240690a_100011934566_100000690095 [0,2,0,0,0,0|2,0,0]=4 12953 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)Cl 11a_100015205668_100000690095 [0,2,0,0,0,0|2,0,0]=4 12954 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)Cl 1626a_100015205668_100000690095 [0,2,0,0,0,0|2,0,0]=4 12955 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)Cl 240690a_100015205668_100000690095 [0,2,0,0,0,0|2,0,0]=4 12956 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)F 11a_100015188774_100000690095 [0,2,0,0,0,0|2,0,0]=4 12957 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)F 1626a_100015188774_100000690095 [0,2,0,0,0,0|2,0,0]=4 12958 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)F 240690a_100015188774_100000690095 [0,2,0,0,0,0|2,0,0]=4 12959 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)O 11a_100000748557_100000690095 [0,2,0,0,0,0|2,0,0]=4 12960 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2ccnc(c2)O 240690a_100000748557_100000690095 [0,2,0,0,0,0|2,0,0]=4 12961 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)Br 11a_100011249555_100000690095 [0,2,0,0,0,0|2,0,0]=4 12962 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)Br 240690a_100011249555_100000690095 [0,2,0,0,0,0|2,0,0]=4 12963 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)C 11a_100000692839_100000690095 [0,2,0,0,0,0|2,0,0]=4 12964 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)C 1626a_100000692839_100000690095 [0,2,0,0,0,0|2,0,0]=4 12965 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)C 240690a_100000692839_100000690095 [0,2,0,0,0,0|2,0,0]=4 12966 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)Cl 11a_200020614424_100000690095 [0,2,0,0,0,0|2,0,0]=4 12967 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)Cl 1626a_200020614424_100000690095 [0,2,0,0,0,0|2,0,0]=4 12968 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)Cl 240690a_200020614424_100000690095 [0,2,0,0,0,0|2,0,0]=4 12969 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)F 11a_100011962886_100000690095 [0,2,0,0,0,0|2,0,0]=4 12970 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)F 1626a_100011962886_100000690095 [0,2,0,0,0,0|2,0,0]=4 12971 B21R2.221979 Cc1cccc(c1)C=CC(=O)NCc2cncc(c2)F 240690a_100011962886_100000690095 [0,2,0,0,0,0|2,0,0]=4 12972 B21R2.221979 Cc1cccc(c1)C=CC(=O)NNc2cccc(c2)Br 22a_100000217339_100000690095 [0,2,0,0,0,0|2,0,0]=4 12973 B21R2.221979 Cc1cccc(c1)C=CC(=O)NNc2cccc(c2)C 22a_100000681630_100000690095 [0,2,0,0,0,0|2,0,0]=4 12974 B21R2.221979 Cc1cccc(c1)C=CC(=O)NNc2cccc(c2)Cl 22a_100000184277_100000690095 [0,2,0,0,0,0|2,0,0]=4 12975 B21R2.221979 Cc1cccc(c1)C=CC(=O)NNc2cccc(c2)F 22a_100000745080_100000690095 [0,2,0,0,0,0|2,0,0]=4 12976 B21R2.221979 Cc1cccc(c1)C=CC(=O)NNc2cccc(c2)I 22a_100020605690_100000690095 [0,2,0,0,0,0|2,0,0]=4 12977 B21R2.221979 Cc1cccc(c1)CCC(=O)C=Cc2cccc(c2)Br 1458a_100016258244_100011713685 [0,2,0,0,0,0|1,0,0]=3 12978 B21R2.221979 Cc1cccc(c1)CCC(=O)C=Cc2cccc(c2)Cl 1458a_100000184502_100011713685 [0,2,0,0,0,0|1,0,0]=3 12979 B21R2.221979 Cc1cccc(c1)CCC(=O)C=Cc2cccc(c2)F 1458a_100000718793_100011713685 [0,2,0,0,0,0|1,0,0]=3 12980 B21R2.221979 Cc1cccc(c1)CCC(=O)C=Cc2cccc(c2)I 1458a_100020647043_100011713685 [0,2,0,0,0,0|1,0,0]=3 12981 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)Br 11a_100000185548_100016258244 [0,2,0,0,0,0|1,0,0]=3 12982 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)Br 1626a_100000185548_100016258244 [0,2,0,0,0,0|1,0,0]=3 12983 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)Br 240690a_100000185548_100016258244 [0,2,0,0,0,0|1,0,0]=3 12984 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)Cl 11a_100000185548_100000184502 [0,2,0,0,0,0|1,0,0]=3 12985 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)Cl 1626a_100000185548_100000184502 [0,2,0,0,0,0|1,0,0]=3 12986 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)Cl 240690a_100000185548_100000184502 [0,2,0,0,0,0|1,0,0]=3 12987 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)F 11a_100000185548_100000718793 [0,2,0,0,0,0|1,0,0]=3 12988 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)F 1626a_100000185548_100000718793 [0,2,0,0,0,0|1,0,0]=3 12989 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)F 240690a_100000185548_100000718793 [0,2,0,0,0,0|1,0,0]=3 12990 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)I 11a_100000185548_100020647043 [0,2,0,0,0,0|1,0,0]=3 12991 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)I 1626a_100000185548_100020647043 [0,2,0,0,0,0|1,0,0]=3 12992 B21R2.221979 Cc1cccc(c1)CNC(=O)C=Cc2cccc(c2)I 240690a_100000185548_100020647043 [0,2,0,0,0,0|1,0,0]=3 12993 B21R2.221979 Cc1cccc(c1)NNC(=O)C=Cc2cccc(c2)Br 22a_100000681630_100016258244 [0,2,0,0,0,0|2,0,0]=4 12994 B21R2.221979 Cc1cccc(c1)NNC(=O)C=Cc2cccc(c2)Cl 22a_100000681630_100000184502 [0,2,0,0,0,0|2,0,0]=4 12995 B21R2.221979 Cc1cccc(c1)NNC(=O)C=Cc2cccc(c2)F 22a_100000681630_100000718793 [0,2,0,0,0,0|2,0,0]=4 12996 B21R2.221979 Cc1cccc(c1)NNC(=O)C=Cc2cccc(c2)I 22a_100000681630_100020647043 [0,2,0,0,0,0|2,0,0]=4 12997 B21R2.221979 Cc1cccc(c1)NNC(=O)C=Cc2cccc(c2)O 22a_100000681630_100102525460 [0,2,0,0,0,0|2,0,0]=4 12998 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)Br 11a_100000701342_100016258244 [0,2,0,0,0,0|2,0,0]=4 12999 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)Br 1626a_100000701342_100016258244 [0,2,0,0,0,0|2,0,0]=4 13000 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)Br 240690a_100000701342_100016258244 [0,2,0,0,0,0|2,0,0]=4 13001 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)Cl 11a_100000701342_100000184502 [0,2,0,0,0,0|2,0,0]=4 13002 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)Cl 1626a_100000701342_100000184502 [0,2,0,0,0,0|2,0,0]=4 13003 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)Cl 240690a_100000701342_100000184502 [0,2,0,0,0,0|2,0,0]=4 13004 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)F 11a_100000701342_100000718793 [0,2,0,0,0,0|2,0,0]=4 13005 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)F 1626a_100000701342_100000718793 [0,2,0,0,0,0|2,0,0]=4 13006 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)F 240690a_100000701342_100000718793 [0,2,0,0,0,0|2,0,0]=4 13007 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)I 11a_100000701342_100020647043 [0,2,0,0,0,0|2,0,0]=4 13008 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)I 1626a_100000701342_100020647043 [0,2,0,0,0,0|2,0,0]=4 13009 B21R2.221979 Cc1cccc(n1)CNC(=O)C=Cc2cccc(c2)I 240690a_100000701342_100020647043 [0,2,0,0,0,0|2,0,0]=4 13010 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)Br 11a_100011934573_100016258244 [0,2,0,0,0,0|2,0,0]=4 13011 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)Br 1626a_100011934573_100016258244 [0,2,0,0,0,0|2,0,0]=4 13012 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)Br 240690a_100011934573_100016258244 [0,2,0,0,0,0|2,0,0]=4 13013 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)Cl 11a_100011934573_100000184502 [0,2,0,0,0,0|2,0,0]=4 13014 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)Cl 1626a_100011934573_100000184502 [0,2,0,0,0,0|2,0,0]=4 13015 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)Cl 240690a_100011934573_100000184502 [0,2,0,0,0,0|2,0,0]=4 13016 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)F 11a_100011934573_100000718793 [0,2,0,0,0,0|2,0,0]=4 13017 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)F 1626a_100011934573_100000718793 [0,2,0,0,0,0|2,0,0]=4 13018 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)F 240690a_100011934573_100000718793 [0,2,0,0,0,0|2,0,0]=4 13019 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)I 11a_100011934573_100020647043 [0,2,0,0,0,0|2,0,0]=4 13020 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)I 1626a_100011934573_100020647043 [0,2,0,0,0,0|2,0,0]=4 13021 B21R2.221979 Cc1ccnc(c1)CNC(=O)C=Cc2cccc(c2)I 240690a_100011934573_100020647043 [0,2,0,0,0,0|2,0,0]=4 13022 B21R2.221979 Cc1cncc(c1)C=CC(=O)CCc2cccc(c2)Br 6a_100011998712_100011279149 [0,2,0,0,0,0|2,0,0]=4 13023 B21R2.221979 Cc1cncc(c1)C=CC(=O)CCc2cccc(c2)F 6a_100011998712_100000743863 [0,2,0,0,0,0|2,0,0]=4 13024 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)Br 11a_100000692839_100016258244 [0,2,0,0,0,0|2,0,0]=4 13025 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)Br 1626a_100000692839_100016258244 [0,2,0,0,0,0|2,0,0]=4 13026 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)Br 240690a_100000692839_100016258244 [0,2,0,0,0,0|2,0,0]=4 13027 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)Cl 11a_100000692839_100000184502 [0,2,0,0,0,0|2,0,0]=4 13028 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)Cl 1626a_100000692839_100000184502 [0,2,0,0,0,0|2,0,0]=4 13029 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)Cl 240690a_100000692839_100000184502 [0,2,0,0,0,0|2,0,0]=4 13030 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)F 11a_100000692839_100000718793 [0,2,0,0,0,0|2,0,0]=4 13031 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)F 1626a_100000692839_100000718793 [0,2,0,0,0,0|2,0,0]=4 13032 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)F 240690a_100000692839_100000718793 [0,2,0,0,0,0|2,0,0]=4 13033 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)I 11a_100000692839_100020647043 [0,2,0,0,0,0|2,0,0]=4 13034 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)I 1626a_100000692839_100020647043 [0,2,0,0,0,0|2,0,0]=4 13035 B21R2.221979 Cc1cncc(c1)CNC(=O)C=Cc2cccc(c2)I 240690a_100000692839_100020647043 [0,2,0,0,0,0|2,0,0]=4 13036 B21R2.221979 O=C(C=Cc1cccc(c1)Br)CCc2cccc(c2)Br 1458a_100016258244_100011740638 [0,2,0,0,0,0|1,0,0]=3 13037 B21R2.221979 O=C(C=Cc1cccc(c1)Br)CCc2cccc(c2)Br 6a_100000210085_100011279149 [0,2,0,0,0,0|1,0,0]=3 13038 B21R2.221979 O=C(C=Cc1cccc(c1)Br)CCc2cccc(c2)Cl 1458a_100016258244_100011713710 [0,2,0,0,0,0|1,0,0]=3 13039 B21R2.221979 O=C(C=Cc1cccc(c1)Br)CCc2cccc(c2)F 1458a_100016258244_100011217235 [0,2,0,0,0,0|1,0,0]=3 13040 B21R2.221979 O=C(C=Cc1cccc(c1)Br)CCc2cccc(c2)F 6a_100000210085_100000743863 [0,2,0,0,0,0|1,0,0]=3 13041 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cc(ccn2)Br 11a_100009818019_100016258244 [0,2,0,0,0,0|2,0,0]=4 13042 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cc(ccn2)Br 1626a_100009818019_100016258244 [0,2,0,0,0,0|2,0,0]=4 13043 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cc(ccn2)Br 240690a_100009818019_100016258244 [0,2,0,0,0,0|2,0,0]=4 13044 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cc(ccn2)Cl 11a_100000085674_100016258244 [0,2,0,0,0,0|2,0,0]=4 13045 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cc(ccn2)Cl 1626a_100000085674_100016258244 [0,2,0,0,0,0|2,0,0]=4 13046 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cc(ccn2)Cl 240690a_100000085674_100016258244 [0,2,0,0,0,0|2,0,0]=4 13047 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(=O)[nH]2 11a_100000696482_100016258244 [0,2,0,0,0,0|2,0,0]=4 13048 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(=O)[nH]2 1626a_100000696482_100016258244 [0,2,0,0,0,0|2,0,0]=4 13049 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(=O)[nH]2 240690a_100000696482_100016258244 [0,2,0,0,0,0|2,0,0]=4 13050 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)Br 11a_100000174977_100016258244 [0,2,0,0,0,0|1,0,0]=3 13051 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)Br 1626a_100000174977_100016258244 [0,2,0,0,0,0|1,0,0]=3 13052 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)Br 240690a_100000174977_100016258244 [0,2,0,0,0,0|1,0,0]=3 13053 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)Cl 11a_100000174878_100016258244 [0,2,0,0,0,0|1,0,0]=3 13054 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)Cl 1626a_100000174878_100016258244 [0,2,0,0,0,0|1,0,0]=3 13055 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)Cl 240690a_100000174878_100016258244 [0,2,0,0,0,0|1,0,0]=3 13056 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)F 11a_100000174948_100016258244 [0,2,0,0,0,0|1,0,0]=3 13057 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)F 1626a_100000174948_100016258244 [0,2,0,0,0,0|1,0,0]=3 13058 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)F 240690a_100000174948_100016258244 [0,2,0,0,0,0|1,0,0]=3 13059 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)I 11a_100000106179_100016258244 [0,2,0,0,0,0|1,0,0]=3 13060 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)I 1626a_100000106179_100016258244 [0,2,0,0,0,0|1,0,0]=3 13061 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)I 240690a_100000106179_100016258244 [0,2,0,0,0,0|1,0,0]=3 13062 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(c2)O 240690a_100000743036_100016258244 [0,2,0,0,0,0|1,0,0]=3 13063 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)Br 11a_100016987751_100016258244 [0,2,0,0,0,0|2,0,0]=4 13064 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)Br 1626a_100016987751_100016258244 [0,2,0,0,0,0|2,0,0]=4 13065 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)Br 240690a_100016987751_100016258244 [0,2,0,0,0,0|2,0,0]=4 13066 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)Cl 11a_100016990191_100016258244 [0,2,0,0,0,0|2,0,0]=4 13067 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)Cl 1626a_100016990191_100016258244 [0,2,0,0,0,0|2,0,0]=4 13068 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)Cl 240690a_100016990191_100016258244 [0,2,0,0,0,0|2,0,0]=4 13069 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)F 11a_100015188798_100016258244 [0,2,0,0,0,0|2,0,0]=4 13070 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)F 1626a_100015188798_100016258244 [0,2,0,0,0,0|2,0,0]=4 13071 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cccc(n2)F 240690a_100015188798_100016258244 [0,2,0,0,0,0|2,0,0]=4 13072 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)Br 11a_100025757509_100016258244 [0,2,0,0,0,0|2,0,0]=4 13073 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)Br 240690a_100025757509_100016258244 [0,2,0,0,0,0|2,0,0]=4 13074 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)Cl 11a_100015205668_100016258244 [0,2,0,0,0,0|2,0,0]=4 13075 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)Cl 1626a_100015205668_100016258244 [0,2,0,0,0,0|2,0,0]=4 13076 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)Cl 240690a_100015205668_100016258244 [0,2,0,0,0,0|2,0,0]=4 13077 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)F 11a_100015188774_100016258244 [0,2,0,0,0,0|2,0,0]=4 13078 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)F 1626a_100015188774_100016258244 [0,2,0,0,0,0|2,0,0]=4 13079 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)F 240690a_100015188774_100016258244 [0,2,0,0,0,0|2,0,0]=4 13080 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)O 11a_100000748557_100016258244 [0,2,0,0,0,0|2,0,0]=4 13081 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2ccnc(c2)O 240690a_100000748557_100016258244 [0,2,0,0,0,0|2,0,0]=4 13082 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cncc(c2)Br 11a_100011249555_100016258244 [0,2,0,0,0,0|2,0,0]=4 13083 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cncc(c2)Br 240690a_100011249555_100016258244 [0,2,0,0,0,0|2,0,0]=4 13084 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cncc(c2)Cl 11a_200020614424_100016258244 [0,2,0,0,0,0|2,0,0]=4 13085 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cncc(c2)Cl 1626a_200020614424_100016258244 [0,2,0,0,0,0|2,0,0]=4 13086 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cncc(c2)Cl 240690a_200020614424_100016258244 [0,2,0,0,0,0|2,0,0]=4 13087 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cncc(c2)F 11a_100011962886_100016258244 [0,2,0,0,0,0|2,0,0]=4 13088 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cncc(c2)F 1626a_100011962886_100016258244 [0,2,0,0,0,0|2,0,0]=4 13089 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NCc2cncc(c2)F 240690a_100011962886_100016258244 [0,2,0,0,0,0|2,0,0]=4 13090 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NNc2cccc(c2)Br 22a_100000217339_100016258244 [0,2,0,0,0,0|2,0,0]=4 13091 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NNc2cccc(c2)Cl 22a_100000184277_100016258244 [0,2,0,0,0,0|2,0,0]=4 13092 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NNc2cccc(c2)F 22a_100000745080_100016258244 [0,2,0,0,0,0|2,0,0]=4 13093 B21R2.221979 O=C(C=Cc1cccc(c1)Br)NNc2cccc(c2)I 22a_100020605690_100016258244 [0,2,0,0,0,0|2,0,0]=4 13094 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)CCc2cccc(c2)Br 1458a_100000184502_100011740638 [0,2,0,0,0,0|1,0,0]=3 13095 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)CCc2cccc(c2)Cl 1458a_100000184502_100011713710 [0,2,0,0,0,0|1,0,0]=3 13096 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)CCc2cccc(c2)F 1458a_100000184502_100011217235 [0,2,0,0,0,0|1,0,0]=3 13097 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cc(ccn2)Br 11a_100009818019_100000184502 [0,2,0,0,0,0|2,0,0]=4 13098 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cc(ccn2)Br 1626a_100009818019_100000184502 [0,2,0,0,0,0|2,0,0]=4 13099 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cc(ccn2)Br 240690a_100009818019_100000184502 [0,2,0,0,0,0|2,0,0]=4 13100 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cc(ccn2)Cl 11a_100000085674_100000184502 [0,2,0,0,0,0|2,0,0]=4 13101 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cc(ccn2)Cl 1626a_100000085674_100000184502 [0,2,0,0,0,0|2,0,0]=4 13102 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cc(ccn2)Cl 240690a_100000085674_100000184502 [0,2,0,0,0,0|2,0,0]=4 13103 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(=O)[nH]2 11a_100000696482_100000184502 [0,2,0,0,0,0|2,0,0]=4 13104 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(=O)[nH]2 1626a_100000696482_100000184502 [0,2,0,0,0,0|2,0,0]=4 13105 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(=O)[nH]2 240690a_100000696482_100000184502 [0,2,0,0,0,0|2,0,0]=4 13106 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)Br 11a_100000174977_100000184502 [0,2,0,0,0,0|1,0,0]=3 13107 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)Br 1626a_100000174977_100000184502 [0,2,0,0,0,0|1,0,0]=3 13108 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)Br 240690a_100000174977_100000184502 [0,2,0,0,0,0|1,0,0]=3 13109 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)Cl 11a_100000174878_100000184502 [0,2,0,0,0,0|1,0,0]=3 13110 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)Cl 1626a_100000174878_100000184502 [0,2,0,0,0,0|1,0,0]=3 13111 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)Cl 240690a_100000174878_100000184502 [0,2,0,0,0,0|1,0,0]=3 13112 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)F 11a_100000174948_100000184502 [0,2,0,0,0,0|1,0,0]=3 13113 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)F 1626a_100000174948_100000184502 [0,2,0,0,0,0|1,0,0]=3 13114 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)F 240690a_100000174948_100000184502 [0,2,0,0,0,0|1,0,0]=3 13115 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)I 11a_100000106179_100000184502 [0,2,0,0,0,0|1,0,0]=3 13116 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)I 1626a_100000106179_100000184502 [0,2,0,0,0,0|1,0,0]=3 13117 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)I 240690a_100000106179_100000184502 [0,2,0,0,0,0|1,0,0]=3 13118 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(c2)O 240690a_100000743036_100000184502 [0,2,0,0,0,0|1,0,0]=3 13119 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)Br 11a_100016987751_100000184502 [0,2,0,0,0,0|2,0,0]=4 13120 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)Br 1626a_100016987751_100000184502 [0,2,0,0,0,0|2,0,0]=4 13121 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)Br 240690a_100016987751_100000184502 [0,2,0,0,0,0|2,0,0]=4 13122 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)Cl 11a_100016990191_100000184502 [0,2,0,0,0,0|2,0,0]=4 13123 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)Cl 1626a_100016990191_100000184502 [0,2,0,0,0,0|2,0,0]=4 13124 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)Cl 240690a_100016990191_100000184502 [0,2,0,0,0,0|2,0,0]=4 13125 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)F 11a_100015188798_100000184502 [0,2,0,0,0,0|2,0,0]=4 13126 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)F 1626a_100015188798_100000184502 [0,2,0,0,0,0|2,0,0]=4 13127 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cccc(n2)F 240690a_100015188798_100000184502 [0,2,0,0,0,0|2,0,0]=4 13128 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)Br 11a_100025757509_100000184502 [0,2,0,0,0,0|2,0,0]=4 13129 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)Br 240690a_100025757509_100000184502 [0,2,0,0,0,0|2,0,0]=4 13130 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)Cl 11a_100015205668_100000184502 [0,2,0,0,0,0|2,0,0]=4 13131 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)Cl 1626a_100015205668_100000184502 [0,2,0,0,0,0|2,0,0]=4 13132 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)Cl 240690a_100015205668_100000184502 [0,2,0,0,0,0|2,0,0]=4 13133 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)F 11a_100015188774_100000184502 [0,2,0,0,0,0|2,0,0]=4 13134 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)F 1626a_100015188774_100000184502 [0,2,0,0,0,0|2,0,0]=4 13135 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)F 240690a_100015188774_100000184502 [0,2,0,0,0,0|2,0,0]=4 13136 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)O 11a_100000748557_100000184502 [0,2,0,0,0,0|2,0,0]=4 13137 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2ccnc(c2)O 240690a_100000748557_100000184502 [0,2,0,0,0,0|2,0,0]=4 13138 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cncc(c2)Br 11a_100011249555_100000184502 [0,2,0,0,0,0|2,0,0]=4 13139 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cncc(c2)Br 240690a_100011249555_100000184502 [0,2,0,0,0,0|2,0,0]=4 13140 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cncc(c2)Cl 11a_200020614424_100000184502 [0,2,0,0,0,0|2,0,0]=4 13141 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cncc(c2)Cl 1626a_200020614424_100000184502 [0,2,0,0,0,0|2,0,0]=4 13142 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cncc(c2)Cl 240690a_200020614424_100000184502 [0,2,0,0,0,0|2,0,0]=4 13143 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cncc(c2)F 11a_100011962886_100000184502 [0,2,0,0,0,0|2,0,0]=4 13144 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cncc(c2)F 1626a_100011962886_100000184502 [0,2,0,0,0,0|2,0,0]=4 13145 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NCc2cncc(c2)F 240690a_100011962886_100000184502 [0,2,0,0,0,0|2,0,0]=4 13146 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NNc2cccc(c2)Br 22a_100000217339_100000184502 [0,2,0,0,0,0|2,0,0]=4 13147 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NNc2cccc(c2)Cl 22a_100000184277_100000184502 [0,2,0,0,0,0|2,0,0]=4 13148 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NNc2cccc(c2)F 22a_100000745080_100000184502 [0,2,0,0,0,0|2,0,0]=4 13149 B21R2.221979 O=C(C=Cc1cccc(c1)Cl)NNc2cccc(c2)I 22a_100020605690_100000184502 [0,2,0,0,0,0|2,0,0]=4 13150 B21R2.221979 O=C(C=Cc1cccc(c1)F)CCc2cccc(c2)Br 1458a_100000718793_100011740638 [0,2,0,0,0,0|1,0,0]=3 13151 B21R2.221979 O=C(C=Cc1cccc(c1)F)CCc2cccc(c2)Br 6a_100000210812_100011279149 [0,2,0,0,0,0|1,0,0]=3 13152 B21R2.221979 O=C(C=Cc1cccc(c1)F)CCc2cccc(c2)Cl 1458a_100000718793_100011713710 [0,2,0,0,0,0|1,0,0]=3 13153 B21R2.221979 O=C(C=Cc1cccc(c1)F)CCc2cccc(c2)F 1458a_100000718793_100011217235 [0,2,0,0,0,0|1,0,0]=3 13154 B21R2.221979 O=C(C=Cc1cccc(c1)F)CCc2cccc(c2)F 6a_100000210812_100000743863 [0,2,0,0,0,0|1,0,0]=3 13155 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cc(ccn2)Br 11a_100009818019_100000718793 [0,2,0,0,0,0|2,0,0]=4 13156 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cc(ccn2)Br 1626a_100009818019_100000718793 [0,2,0,0,0,0|2,0,0]=4 13157 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cc(ccn2)Br 240690a_100009818019_100000718793 [0,2,0,0,0,0|2,0,0]=4 13158 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cc(ccn2)Cl 11a_100000085674_100000718793 [0,2,0,0,0,0|2,0,0]=4 13159 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cc(ccn2)Cl 1626a_100000085674_100000718793 [0,2,0,0,0,0|2,0,0]=4 13160 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cc(ccn2)Cl 240690a_100000085674_100000718793 [0,2,0,0,0,0|2,0,0]=4 13161 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(=O)[nH]2 11a_100000696482_100000718793 [0,2,0,0,0,0|2,0,0]=4 13162 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(=O)[nH]2 1626a_100000696482_100000718793 [0,2,0,0,0,0|2,0,0]=4 13163 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(=O)[nH]2 240690a_100000696482_100000718793 [0,2,0,0,0,0|2,0,0]=4 13164 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)Br 11a_100000174977_100000718793 [0,2,0,0,0,0|1,0,0]=3 13165 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)Br 1626a_100000174977_100000718793 [0,2,0,0,0,0|1,0,0]=3 13166 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)Br 240690a_100000174977_100000718793 [0,2,0,0,0,0|1,0,0]=3 13167 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)Cl 11a_100000174878_100000718793 [0,2,0,0,0,0|1,0,0]=3 13168 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)Cl 1626a_100000174878_100000718793 [0,2,0,0,0,0|1,0,0]=3 13169 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)Cl 240690a_100000174878_100000718793 [0,2,0,0,0,0|1,0,0]=3 13170 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)F 11a_100000174948_100000718793 [0,2,0,0,0,0|1,0,0]=3 13171 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)F 1626a_100000174948_100000718793 [0,2,0,0,0,0|1,0,0]=3 13172 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)F 240690a_100000174948_100000718793 [0,2,0,0,0,0|1,0,0]=3 13173 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)I 11a_100000106179_100000718793 [0,2,0,0,0,0|1,0,0]=3 13174 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)I 1626a_100000106179_100000718793 [0,2,0,0,0,0|1,0,0]=3 13175 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)I 240690a_100000106179_100000718793 [0,2,0,0,0,0|1,0,0]=3 13176 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(c2)O 240690a_100000743036_100000718793 [0,2,0,0,0,0|1,0,0]=3 13177 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)Br 11a_100016987751_100000718793 [0,2,0,0,0,0|2,0,0]=4 13178 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)Br 1626a_100016987751_100000718793 [0,2,0,0,0,0|2,0,0]=4 13179 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)Br 240690a_100016987751_100000718793 [0,2,0,0,0,0|2,0,0]=4 13180 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)Cl 11a_100016990191_100000718793 [0,2,0,0,0,0|2,0,0]=4 13181 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)Cl 1626a_100016990191_100000718793 [0,2,0,0,0,0|2,0,0]=4 13182 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)Cl 240690a_100016990191_100000718793 [0,2,0,0,0,0|2,0,0]=4 13183 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)F 11a_100015188798_100000718793 [0,2,0,0,0,0|2,0,0]=4 13184 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)F 1626a_100015188798_100000718793 [0,2,0,0,0,0|2,0,0]=4 13185 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cccc(n2)F 240690a_100015188798_100000718793 [0,2,0,0,0,0|2,0,0]=4 13186 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)Br 11a_100025757509_100000718793 [0,2,0,0,0,0|2,0,0]=4 13187 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)Br 240690a_100025757509_100000718793 [0,2,0,0,0,0|2,0,0]=4 13188 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)Cl 11a_100015205668_100000718793 [0,2,0,0,0,0|2,0,0]=4 13189 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)Cl 1626a_100015205668_100000718793 [0,2,0,0,0,0|2,0,0]=4 13190 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)Cl 240690a_100015205668_100000718793 [0,2,0,0,0,0|2,0,0]=4 13191 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)F 11a_100015188774_100000718793 [0,2,0,0,0,0|2,0,0]=4 13192 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)F 1626a_100015188774_100000718793 [0,2,0,0,0,0|2,0,0]=4 13193 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)F 240690a_100015188774_100000718793 [0,2,0,0,0,0|2,0,0]=4 13194 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)O 11a_100000748557_100000718793 [0,2,0,0,0,0|2,0,0]=4 13195 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2ccnc(c2)O 240690a_100000748557_100000718793 [0,2,0,0,0,0|2,0,0]=4 13196 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cncc(c2)Br 11a_100011249555_100000718793 [0,2,0,0,0,0|2,0,0]=4 13197 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cncc(c2)Br 240690a_100011249555_100000718793 [0,2,0,0,0,0|2,0,0]=4 13198 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cncc(c2)Cl 11a_200020614424_100000718793 [0,2,0,0,0,0|2,0,0]=4 13199 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cncc(c2)Cl 1626a_200020614424_100000718793 [0,2,0,0,0,0|2,0,0]=4 13200 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cncc(c2)Cl 240690a_200020614424_100000718793 [0,2,0,0,0,0|2,0,0]=4 13201 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cncc(c2)F 11a_100011962886_100000718793 [0,2,0,0,0,0|2,0,0]=4 13202 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cncc(c2)F 1626a_100011962886_100000718793 [0,2,0,0,0,0|2,0,0]=4 13203 B21R2.221979 O=C(C=Cc1cccc(c1)F)NCc2cncc(c2)F 240690a_100011962886_100000718793 [0,2,0,0,0,0|2,0,0]=4 13204 B21R2.221979 O=C(C=Cc1cccc(c1)F)NNc2cccc(c2)Br 22a_100000217339_100000718793 [0,2,0,0,0,0|2,0,0]=4 13205 B21R2.221979 O=C(C=Cc1cccc(c1)F)NNc2cccc(c2)Cl 22a_100000184277_100000718793 [0,2,0,0,0,0|2,0,0]=4 13206 B21R2.221979 O=C(C=Cc1cccc(c1)F)NNc2cccc(c2)F 22a_100000745080_100000718793 [0,2,0,0,0,0|2,0,0]=4 13207 B21R2.221979 O=C(C=Cc1cccc(c1)F)NNc2cccc(c2)I 22a_100020605690_100000718793 [0,2,0,0,0,0|2,0,0]=4 13208 B21R2.221979 O=C(C=Cc1cccc(c1)I)CCc2cccc(c2)Br 1458a_100020647043_100011740638 [0,2,0,0,0,0|1,0,0]=3 13209 B21R2.221979 O=C(C=Cc1cccc(c1)I)CCc2cccc(c2)Br 6a_100000014684_100011279149 [0,2,0,0,0,0|1,0,0]=3 13210 B21R2.221979 O=C(C=Cc1cccc(c1)I)CCc2cccc(c2)Cl 1458a_100020647043_100011713710 [0,2,0,0,0,0|1,0,0]=3 13211 B21R2.221979 O=C(C=Cc1cccc(c1)I)CCc2cccc(c2)F 1458a_100020647043_100011217235 [0,2,0,0,0,0|1,0,0]=3 13212 B21R2.221979 O=C(C=Cc1cccc(c1)I)CCc2cccc(c2)F 6a_100000014684_100000743863 [0,2,0,0,0,0|1,0,0]=3 13213 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cc(ccn2)Br 11a_100009818019_100020647043 [0,2,0,0,0,0|2,0,0]=4 13214 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cc(ccn2)Br 1626a_100009818019_100020647043 [0,2,0,0,0,0|2,0,0]=4 13215 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cc(ccn2)Br 240690a_100009818019_100020647043 [0,2,0,0,0,0|2,0,0]=4 13216 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cc(ccn2)Cl 11a_100000085674_100020647043 [0,2,0,0,0,0|2,0,0]=4 13217 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cc(ccn2)Cl 1626a_100000085674_100020647043 [0,2,0,0,0,0|2,0,0]=4 13218 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cc(ccn2)Cl 240690a_100000085674_100020647043 [0,2,0,0,0,0|2,0,0]=4 13219 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(=O)[nH]2 11a_100000696482_100020647043 [0,2,0,0,0,0|2,0,0]=4 13220 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(=O)[nH]2 1626a_100000696482_100020647043 [0,2,0,0,0,0|2,0,0]=4 13221 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(=O)[nH]2 240690a_100000696482_100020647043 [0,2,0,0,0,0|2,0,0]=4 13222 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)Br 11a_100000174977_100020647043 [0,2,0,0,0,0|1,0,0]=3 13223 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)Br 1626a_100000174977_100020647043 [0,2,0,0,0,0|1,0,0]=3 13224 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)Br 240690a_100000174977_100020647043 [0,2,0,0,0,0|1,0,0]=3 13225 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)Cl 11a_100000174878_100020647043 [0,2,0,0,0,0|1,0,0]=3 13226 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)Cl 1626a_100000174878_100020647043 [0,2,0,0,0,0|1,0,0]=3 13227 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)Cl 240690a_100000174878_100020647043 [0,2,0,0,0,0|1,0,0]=3 13228 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)F 11a_100000174948_100020647043 [0,2,0,0,0,0|1,0,0]=3 13229 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)F 1626a_100000174948_100020647043 [0,2,0,0,0,0|1,0,0]=3 13230 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)F 240690a_100000174948_100020647043 [0,2,0,0,0,0|1,0,0]=3 13231 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)I 11a_100000106179_100020647043 [0,2,0,0,0,0|1,0,0]=3 13232 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)I 1626a_100000106179_100020647043 [0,2,0,0,0,0|1,0,0]=3 13233 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)I 240690a_100000106179_100020647043 [0,2,0,0,0,0|1,0,0]=3 13234 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(c2)O 240690a_100000743036_100020647043 [0,2,0,0,0,0|1,0,0]=3 13235 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)Br 11a_100016987751_100020647043 [0,2,0,0,0,0|2,0,0]=4 13236 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)Br 1626a_100016987751_100020647043 [0,2,0,0,0,0|2,0,0]=4 13237 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)Br 240690a_100016987751_100020647043 [0,2,0,0,0,0|2,0,0]=4 13238 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)Cl 11a_100016990191_100020647043 [0,2,0,0,0,0|2,0,0]=4 13239 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)Cl 1626a_100016990191_100020647043 [0,2,0,0,0,0|2,0,0]=4 13240 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)Cl 240690a_100016990191_100020647043 [0,2,0,0,0,0|2,0,0]=4 13241 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)F 11a_100015188798_100020647043 [0,2,0,0,0,0|2,0,0]=4 13242 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)F 1626a_100015188798_100020647043 [0,2,0,0,0,0|2,0,0]=4 13243 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cccc(n2)F 240690a_100015188798_100020647043 [0,2,0,0,0,0|2,0,0]=4 13244 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)Br 11a_100025757509_100020647043 [0,2,0,0,0,0|2,0,0]=4 13245 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)Br 240690a_100025757509_100020647043 [0,2,0,0,0,0|2,0,0]=4 13246 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)Cl 11a_100015205668_100020647043 [0,2,0,0,0,0|2,0,0]=4 13247 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)Cl 1626a_100015205668_100020647043 [0,2,0,0,0,0|2,0,0]=4 13248 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)Cl 240690a_100015205668_100020647043 [0,2,0,0,0,0|2,0,0]=4 13249 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)F 11a_100015188774_100020647043 [0,2,0,0,0,0|2,0,0]=4 13250 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)F 1626a_100015188774_100020647043 [0,2,0,0,0,0|2,0,0]=4 13251 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)F 240690a_100015188774_100020647043 [0,2,0,0,0,0|2,0,0]=4 13252 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)O 11a_100000748557_100020647043 [0,2,0,0,0,0|2,0,0]=4 13253 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2ccnc(c2)O 240690a_100000748557_100020647043 [0,2,0,0,0,0|2,0,0]=4 13254 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cncc(c2)Br 11a_100011249555_100020647043 [0,2,0,0,0,0|2,0,0]=4 13255 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cncc(c2)Br 240690a_100011249555_100020647043 [0,2,0,0,0,0|2,0,0]=4 13256 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cncc(c2)Cl 11a_200020614424_100020647043 [0,2,0,0,0,0|2,0,0]=4 13257 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cncc(c2)Cl 1626a_200020614424_100020647043 [0,2,0,0,0,0|2,0,0]=4 13258 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cncc(c2)Cl 240690a_200020614424_100020647043 [0,2,0,0,0,0|2,0,0]=4 13259 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cncc(c2)F 11a_100011962886_100020647043 [0,2,0,0,0,0|2,0,0]=4 13260 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cncc(c2)F 1626a_100011962886_100020647043 [0,2,0,0,0,0|2,0,0]=4 13261 B21R2.221979 O=C(C=Cc1cccc(c1)I)NCc2cncc(c2)F 240690a_100011962886_100020647043 [0,2,0,0,0,0|2,0,0]=4 13262 B21R2.221979 O=C(C=Cc1cccc(c1)I)NNc2cccc(c2)Br 22a_100000217339_100020647043 [0,2,0,0,0,0|2,0,0]=4 13263 B21R2.221979 O=C(C=Cc1cccc(c1)I)NNc2cccc(c2)Cl 22a_100000184277_100020647043 [0,2,0,0,0,0|2,0,0]=4 13264 B21R2.221979 O=C(C=Cc1cccc(c1)I)NNc2cccc(c2)F 22a_100000745080_100020647043 [0,2,0,0,0,0|2,0,0]=4 13265 B21R2.221979 O=C(C=Cc1cccc(c1)I)NNc2cccc(c2)I 22a_100020605690_100020647043 [0,2,0,0,0,0|2,0,0]=4 13266 B21R2.221979 O=C(C=Cc1cccc(c1)O)NNc2cccc(c2)Br 22a_100000217339_100102525460 [0,2,0,0,0,0|2,0,0]=4 13267 B21R2.221979 O=C(C=Cc1cccc(c1)O)NNc2cccc(c2)Cl 22a_100000184277_100102525460 [0,2,0,0,0,0|2,0,0]=4 13268 B21R2.221979 O=C(C=Cc1cccc(c1)O)NNc2cccc(c2)F 22a_100000745080_100102525460 [0,2,0,0,0,0|2,0,0]=4 13269 B21R2.221979 O=C(C=Cc1cccc(c1)O)NNc2cccc(c2)I 22a_100020605690_100102525460 [0,2,0,0,0,0|2,0,0]=4 13270 B21R2.221979 O=C(C=Cc1cncc(c1)Br)CCc2cccc(c2)Br 6a_100000687066_100011279149 [0,2,0,0,0,0|2,0,0]=4 13271 B21R2.221979 O=C(C=Cc1cncc(c1)Br)CCc2cccc(c2)F 6a_100000687066_100000743863 [0,2,0,0,0,0|2,0,0]=4 13272 B21R2.221979 O=C(C=Cc1cncc(c1)Cl)CCc2cccc(c2)Br 6a_100000088910_100011279149 [0,2,0,0,0,0|2,0,0]=4 13273 B21R2.221979 O=C(C=Cc1cncc(c1)Cl)CCc2cccc(c2)F 6a_100000088910_100000743863 [0,2,0,0,0,0|2,0,0]=4 13274 B21R2.221979 O=C(C=Cc1cncc(c1)F)CCc2cccc(c2)Br 6a_100011361476_100011279149 [0,2,0,0,0,0|2,0,0]=4 13275 B21R2.221979 O=C(C=Cc1cncc(c1)F)CCc2cccc(c2)F 6a_100011361476_100000743863 [0,2,0,0,0,0|2,0,0]=4 13276 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)CCc2cccc(c2)Br 1458a_100016990649_100011740638 [0,2,0,0,0,0|1,0,0]=3 13277 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)CCc2cccc(c2)C 1458a_100016990649_100011713685 [0,2,0,0,0,0|1,0,0]=3 13278 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)CCc2cccc(c2)Cl 1458a_100016990649_100011713710 [0,2,0,0,0,0|1,0,0]=3 13279 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)CCc2cccc(c2)F 1458a_100016990649_100011217235 [0,2,0,0,0,0|1,0,0]=3 13280 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)Br 11a_100009818019_100016990649 [0,2,0,0,0,0|2,0,0]=4 13281 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)Br 1626a_100009818019_100016990649 [0,2,0,0,0,0|2,0,0]=4 13282 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)Br 527a_100009818019_100016990649 [0,2,0,0,0,0|2,0,0]=4 13283 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)C 11a_100011934573_100016990649 [0,2,0,0,0,0|2,0,0]=4 13284 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)C 1626a_100011934573_100016990649 [0,2,0,0,0,0|2,0,0]=4 13285 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)C 527a_100011934573_100016990649 [0,2,0,0,0,0|2,0,0]=4 13286 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)Cl 11a_100000085674_100016990649 [0,2,0,0,0,0|2,0,0]=4 13287 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)Cl 1626a_100000085674_100016990649 [0,2,0,0,0,0|2,0,0]=4 13288 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cc(ccn2)Cl 527a_100000085674_100016990649 [0,2,0,0,0,0|2,0,0]=4 13289 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(=O)[nH]2 11a_100000696482_100016990649 [0,2,0,0,0,0|2,0,0]=4 13290 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(=O)[nH]2 1626a_100000696482_100016990649 [0,2,0,0,0,0|2,0,0]=4 13291 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(=O)[nH]2 527a_100000696482_100016990649 [0,2,0,0,0,0|2,0,0]=4 13292 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)Br 11a_100000174977_100016990649 [0,2,0,0,0,0|1,0,0]=3 13293 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)Br 1626a_100000174977_100016990649 [0,2,0,0,0,0|1,0,0]=3 13294 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)Br 527a_100000174977_100016990649 [0,2,0,0,0,0|1,0,0]=3 13295 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)C 11a_100000185548_100016990649 [0,2,0,0,0,0|1,0,0]=3 13296 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)C 1626a_100000185548_100016990649 [0,2,0,0,0,0|1,0,0]=3 13297 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)C 527a_100000185548_100016990649 [0,2,0,0,0,0|1,0,0]=3 13298 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)Cl 11a_100000174878_100016990649 [0,2,0,0,0,0|1,0,0]=3 13299 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)Cl 1626a_100000174878_100016990649 [0,2,0,0,0,0|1,0,0]=3 13300 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)Cl 527a_100000174878_100016990649 [0,2,0,0,0,0|1,0,0]=3 13301 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)F 11a_100000174948_100016990649 [0,2,0,0,0,0|1,0,0]=3 13302 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)F 1626a_100000174948_100016990649 [0,2,0,0,0,0|1,0,0]=3 13303 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)F 527a_100000174948_100016990649 [0,2,0,0,0,0|1,0,0]=3 13304 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)I 11a_100000106179_100016990649 [0,2,0,0,0,0|1,0,0]=3 13305 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)I 1626a_100000106179_100016990649 [0,2,0,0,0,0|1,0,0]=3 13306 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)I 527a_100000106179_100016990649 [0,2,0,0,0,0|1,0,0]=3 13307 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(c2)O 527a_100000743036_100016990649 [0,2,0,0,0,0|1,0,0]=3 13308 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)Br 11a_100016987751_100016990649 [0,2,0,0,0,0|2,0,0]=4 13309 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)Br 1626a_100016987751_100016990649 [0,2,0,0,0,0|2,0,0]=4 13310 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)Br 527a_100016987751_100016990649 [0,2,0,0,0,0|2,0,0]=4 13311 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)C 11a_100000701342_100016990649 [0,2,0,0,0,0|2,0,0]=4 13312 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)C 1626a_100000701342_100016990649 [0,2,0,0,0,0|2,0,0]=4 13313 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)C 527a_100000701342_100016990649 [0,2,0,0,0,0|2,0,0]=4 13314 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)Cl 11a_100016990191_100016990649 [0,2,0,0,0,0|2,0,0]=4 13315 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)Cl 1626a_100016990191_100016990649 [0,2,0,0,0,0|2,0,0]=4 13316 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)Cl 527a_100016990191_100016990649 [0,2,0,0,0,0|2,0,0]=4 13317 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)F 11a_100015188798_100016990649 [0,2,0,0,0,0|2,0,0]=4 13318 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)F 1626a_100015188798_100016990649 [0,2,0,0,0,0|2,0,0]=4 13319 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cccc(n2)F 527a_100015188798_100016990649 [0,2,0,0,0,0|2,0,0]=4 13320 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)Br 11a_100025757509_100016990649 [0,2,0,0,0,0|2,0,0]=4 13321 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)Br 527a_100025757509_100016990649 [0,2,0,0,0,0|2,0,0]=4 13322 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)C 11a_100011934566_100016990649 [0,2,0,0,0,0|2,0,0]=4 13323 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)C 1626a_100011934566_100016990649 [0,2,0,0,0,0|2,0,0]=4 13324 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)C 527a_100011934566_100016990649 [0,2,0,0,0,0|2,0,0]=4 13325 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)Cl 11a_100015205668_100016990649 [0,2,0,0,0,0|2,0,0]=4 13326 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)Cl 1626a_100015205668_100016990649 [0,2,0,0,0,0|2,0,0]=4 13327 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)Cl 527a_100015205668_100016990649 [0,2,0,0,0,0|2,0,0]=4 13328 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)F 11a_100015188774_100016990649 [0,2,0,0,0,0|2,0,0]=4 13329 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)F 1626a_100015188774_100016990649 [0,2,0,0,0,0|2,0,0]=4 13330 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)F 527a_100015188774_100016990649 [0,2,0,0,0,0|2,0,0]=4 13331 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)O 11a_100000748557_100016990649 [0,2,0,0,0,0|2,0,0]=4 13332 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2ccnc(c2)O 527a_100000748557_100016990649 [0,2,0,0,0,0|2,0,0]=4 13333 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)Br 11a_100011249555_100016990649 [0,2,0,0,0,0|2,0,0]=4 13334 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)Br 527a_100011249555_100016990649 [0,2,0,0,0,0|2,0,0]=4 13335 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)C 11a_100000692839_100016990649 [0,2,0,0,0,0|2,0,0]=4 13336 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)C 1626a_100000692839_100016990649 [0,2,0,0,0,0|2,0,0]=4 13337 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)C 527a_100000692839_100016990649 [0,2,0,0,0,0|2,0,0]=4 13338 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)Cl 11a_200020614424_100016990649 [0,2,0,0,0,0|2,0,0]=4 13339 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)Cl 1626a_200020614424_100016990649 [0,2,0,0,0,0|2,0,0]=4 13340 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)Cl 527a_200020614424_100016990649 [0,2,0,0,0,0|2,0,0]=4 13341 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)F 11a_100011962886_100016990649 [0,2,0,0,0,0|2,0,0]=4 13342 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)F 1626a_100011962886_100016990649 [0,2,0,0,0,0|2,0,0]=4 13343 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NCc2cncc(c2)F 527a_100011962886_100016990649 [0,2,0,0,0,0|2,0,0]=4 13344 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NNc2cccc(c2)Br 22a_100000217339_100016990649 [0,2,0,0,0,0|2,0,0]=4 13345 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NNc2cccc(c2)C 22a_100000681630_100016990649 [0,2,0,0,0,0|2,0,0]=4 13346 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NNc2cccc(c2)Cl 22a_100000184277_100016990649 [0,2,0,0,0,0|2,0,0]=4 13347 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NNc2cccc(c2)F 22a_100000745080_100016990649 [0,2,0,0,0,0|2,0,0]=4 13348 B21R2.221983 C/C(=C\c1ccccc1)/C(=O)NNc2cccc(c2)I 22a_100020605690_100016990649 [0,2,0,0,0,0|2,0,0]=4 13349 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)CCc2cccc(c2)Br 1458a_100025712827_100011740638 [0,2,0,0,0,0|2,0,0]=4 13350 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)CCc2cccc(c2)C 1458a_100025712827_100011713685 [0,2,0,0,0,0|2,0,0]=4 13351 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)CCc2cccc(c2)Cl 1458a_100025712827_100011713710 [0,2,0,0,0,0|2,0,0]=4 13352 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)CCc2cccc(c2)F 1458a_100025712827_100011217235 [0,2,0,0,0,0|2,0,0]=4 13353 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)Br 11a_100000174977_100025712827 [0,2,0,0,0,0|2,0,0]=4 13354 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)Br 1626a_100000174977_100025712827 [0,2,0,0,0,0|2,0,0]=4 13355 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)Br 527a_100000174977_100025712827 [0,2,0,0,0,0|2,0,0]=4 13356 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)C 11a_100000185548_100025712827 [0,2,0,0,0,0|2,0,0]=4 13357 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)C 1626a_100000185548_100025712827 [0,2,0,0,0,0|2,0,0]=4 13358 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)C 527a_100000185548_100025712827 [0,2,0,0,0,0|2,0,0]=4 13359 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)Cl 11a_100000174878_100025712827 [0,2,0,0,0,0|2,0,0]=4 13360 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)Cl 1626a_100000174878_100025712827 [0,2,0,0,0,0|2,0,0]=4 13361 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)Cl 527a_100000174878_100025712827 [0,2,0,0,0,0|2,0,0]=4 13362 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)F 11a_100000174948_100025712827 [0,2,0,0,0,0|2,0,0]=4 13363 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)F 1626a_100000174948_100025712827 [0,2,0,0,0,0|2,0,0]=4 13364 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)F 527a_100000174948_100025712827 [0,2,0,0,0,0|2,0,0]=4 13365 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)I 11a_100000106179_100025712827 [0,2,0,0,0,0|2,0,0]=4 13366 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)I 1626a_100000106179_100025712827 [0,2,0,0,0,0|2,0,0]=4 13367 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)I 527a_100000106179_100025712827 [0,2,0,0,0,0|2,0,0]=4 13368 B21R2.221983 C/C(=C\c1ccccn1)/C(=O)NCc2cccc(c2)O 527a_100000743036_100025712827 [0,2,0,0,0,0|2,0,0]=4 13369 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)Br 11a_100000174977_100000066491 [0,2,0,0,0,0|1,0,1]=4 13370 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)Br 1626a_100000174977_100000066491 [0,2,0,0,0,0|1,0,1]=4 13371 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)C 11a_100000185548_100000066491 [0,2,0,0,0,0|1,0,1]=4 13372 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)C 1626a_100000185548_100000066491 [0,2,0,0,0,0|1,0,1]=4 13373 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)Cl 11a_100000174878_100000066491 [0,2,0,0,0,0|1,0,1]=4 13374 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)Cl 1626a_100000174878_100000066491 [0,2,0,0,0,0|1,0,1]=4 13375 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)F 11a_100000174948_100000066491 [0,2,0,0,0,0|1,0,1]=4 13376 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)F 1626a_100000174948_100000066491 [0,2,0,0,0,0|1,0,1]=4 13377 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)I 11a_100000106179_100000066491 [0,2,0,0,0,0|1,0,1]=4 13378 B21R2.221983 C=C(Cc1ccccc1)C(=O)NCc2cccc(c2)I 1626a_100000106179_100000066491 [0,2,0,0,0,0|1,0,1]=4 13379 B21R2.221983 CC(Cc1ccccc1)C(=O)C=Cc2cccc(c2)Br 1458a_100016258244_200011218536 [0,2,0,0,0,0|1,0,0]=3 13380 B21R2.221983 CC(Cc1ccccc1)C(=O)C=Cc2cccc(c2)Cl 1458a_100000184502_200011218536 [0,2,0,0,0,0|1,0,0]=3 13381 B21R2.221983 CC(Cc1ccccc1)C(=O)C=Cc2cccc(c2)F 1458a_100000718793_200011218536 [0,2,0,0,0,0|1,0,0]=3 13382 B21R2.221983 CC(Cc1ccccc1)C(=O)C=Cc2cccc(c2)I 1458a_100020647043_200011218536 [0,2,0,0,0,0|1,0,0]=3 13383 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)Br 11a_100000186898_100016258244 [0,2,0,0,0,0|1,0,0]=3 13384 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)Br 1626a_100000186898_100016258244 [0,2,0,0,0,0|1,0,0]=3 13385 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)Br 240690a_100000186898_100016258244 [0,2,0,0,0,0|1,0,0]=3 13386 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)Cl 11a_100000186898_100000184502 [0,2,0,0,0,0|1,0,0]=3 13387 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)Cl 1626a_100000186898_100000184502 [0,2,0,0,0,0|1,0,0]=3 13388 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)Cl 240690a_100000186898_100000184502 [0,2,0,0,0,0|1,0,0]=3 13389 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)F 11a_100000186898_100000718793 [0,2,0,0,0,0|1,0,0]=3 13390 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)F 1626a_100000186898_100000718793 [0,2,0,0,0,0|1,0,0]=3 13391 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)F 240690a_100000186898_100000718793 [0,2,0,0,0,0|1,0,0]=3 13392 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)I 11a_100000186898_100020647043 [0,2,0,0,0,0|1,0,0]=3 13393 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)I 1626a_100000186898_100020647043 [0,2,0,0,0,0|1,0,0]=3 13394 B21R2.221983 CN(Cc1ccccc1)C(=O)C=Cc2cccc(c2)I 240690a_100000186898_100020647043 [0,2,0,0,0,0|1,0,0]=3 13395 B21R2.221983 CN(Cc1ccccn1)C(=O)C=Cc2cccc(c2)Br 11a_100000207498_100016258244 [0,2,0,0,0,0|2,0,0]=4 13396 B21R2.221983 CN(Cc1ccccn1)C(=O)C=Cc2cccc(c2)Br 240690a_100000207498_100016258244 [0,2,0,0,0,0|2,0,0]=4 13397 B21R2.221983 CN(Cc1ccccn1)C(=O)C=Cc2cccc(c2)Cl 11a_100000207498_100000184502 [0,2,0,0,0,0|2,0,0]=4 13398 B21R2.221983 CN(Cc1ccccn1)C(=O)C=Cc2cccc(c2)Cl 240690a_100000207498_100000184502 [0,2,0,0,0,0|2,0,0]=4 13399 B21R2.221983 CN(Cc1ccccn1)C(=O)C=Cc2cccc(c2)F 11a_100000207498_100000718793 [0,2,0,0,0,0|2,0,0]=4 13400 B21R2.221983 CN(Cc1ccccn1)C(=O)C=Cc2cccc(c2)F 240690a_100000207498_100000718793 [0,2,0,0,0,0|2,0,0]=4 13401 B21R2.221983 CN(Cc1ccccn1)C(=O)C=Cc2cccc(c2)I 11a_100000207498_100020647043 [0,2,0,0,0,0|2,0,0]=4 13402 B21R2.221983 CN(Cc1ccccn1)C(=O)C=Cc2cccc(c2)I 240690a_100000207498_100020647043 [0,2,0,0,0,0|2,0,0]=4 13403 B21R2.221983 CN(Cc1cccnc1)C(=O)C=Cc2cccc(c2)Br 11a_100000184577_100016258244 [0,2,0,0,0,0|2,0,0]=4 13404 B21R2.221983 CN(Cc1cccnc1)C(=O)C=Cc2cccc(c2)Br 240690a_100000184577_100016258244 [0,2,0,0,0,0|2,0,0]=4 13405 B21R2.221983 CN(Cc1cccnc1)C(=O)C=Cc2cccc(c2)Cl 11a_100000184577_100000184502 [0,2,0,0,0,0|2,0,0]=4 13406 B21R2.221983 CN(Cc1cccnc1)C(=O)C=Cc2cccc(c2)Cl 240690a_100000184577_100000184502 [0,2,0,0,0,0|2,0,0]=4 13407 B21R2.221983 CN(Cc1cccnc1)C(=O)C=Cc2cccc(c2)F 11a_100000184577_100000718793 [0,2,0,0,0,0|2,0,0]=4 13408 B21R2.221983 CN(Cc1cccnc1)C(=O)C=Cc2cccc(c2)F 240690a_100000184577_100000718793 [0,2,0,0,0,0|2,0,0]=4 13409 B21R2.221983 CN(Cc1cccnc1)C(=O)C=Cc2cccc(c2)I 11a_100000184577_100020647043 [0,2,0,0,0,0|2,0,0]=4 13410 B21R2.221983 CN(Cc1cccnc1)C(=O)C=Cc2cccc(c2)I 240690a_100000184577_100020647043 [0,2,0,0,0,0|2,0,0]=4 13411 B21R2.221983 CN(Cc1ccncc1)C(=O)C=Cc2cccc(c2)Br 11a_100000187231_100016258244 [0,2,0,0,0,0|2,0,0]=4 13412 B21R2.221983 CN(Cc1ccncc1)C(=O)C=Cc2cccc(c2)Br 240690a_100000187231_100016258244 [0,2,0,0,0,0|2,0,0]=4 13413 B21R2.221983 CN(Cc1ccncc1)C(=O)C=Cc2cccc(c2)Cl 11a_100000187231_100000184502 [0,2,0,0,0,0|2,0,0]=4 13414 B21R2.221983 CN(Cc1ccncc1)C(=O)C=Cc2cccc(c2)Cl 240690a_100000187231_100000184502 [0,2,0,0,0,0|2,0,0]=4 13415 B21R2.221983 CN(Cc1ccncc1)C(=O)C=Cc2cccc(c2)F 11a_100000187231_100000718793 [0,2,0,0,0,0|2,0,0]=4 13416 B21R2.221983 CN(Cc1ccncc1)C(=O)C=Cc2cccc(c2)F 240690a_100000187231_100000718793 [0,2,0,0,0,0|2,0,0]=4 13417 B21R2.221983 CN(Cc1ccncc1)C(=O)C=Cc2cccc(c2)I 11a_100000187231_100020647043 [0,2,0,0,0,0|2,0,0]=4 13418 B21R2.221983 CN(Cc1ccncc1)C(=O)C=Cc2cccc(c2)I 240690a_100000187231_100020647043 [0,2,0,0,0,0|2,0,0]=4 13419 B21R2.221983 Cc1cc(ccn1)CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100011934566_200020598536 [0,2,0,0,0,0|2,0,0]=4 13420 B21R2.221983 Cc1cc(ccn1)CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100011934566_200020598536 [0,2,0,0,0,0|2,0,0]=4 13421 B21R2.221983 Cc1cc(ccn1)CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100011934566_200020598536 [0,2,0,0,0,0|2,0,0]=4 13422 B21R2.221983 Cc1cc(ccn1)CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100011934566_200020598536 [0,2,0,0,0,0|2,0,0]=4 13423 B21R2.221983 Cc1cc(ccn1)CNC(=O)/C(=C\c2ccccc2)/F 11a_100011934566_100020889036 [0,2,0,0,0,0|2,0,0]=4 13424 B21R2.221983 Cc1cc(ccn1)CNC(=O)/C(=C\c2ccccc2)/F 527a_100011934566_100020889036 [0,2,0,0,0,0|2,0,0]=4 13425 B21R2.221983 Cc1cccc(c1)C=CC(=O)C(C)Cc2ccccc2 1458a_100000690095_200011218536 [0,2,0,0,0,0|1,0,0]=3 13426 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2ccccc2 11a_100000186898_100000690095 [0,2,0,0,0,0|1,0,0]=3 13427 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2ccccc2 1626a_100000186898_100000690095 [0,2,0,0,0,0|1,0,0]=3 13428 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2ccccc2 240690a_100000186898_100000690095 [0,2,0,0,0,0|1,0,0]=3 13429 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2ccccn2 11a_100000207498_100000690095 [0,2,0,0,0,0|2,0,0]=4 13430 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2ccccn2 240690a_100000207498_100000690095 [0,2,0,0,0,0|2,0,0]=4 13431 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2cccnc2 11a_100000184577_100000690095 [0,2,0,0,0,0|2,0,0]=4 13432 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2cccnc2 240690a_100000184577_100000690095 [0,2,0,0,0,0|2,0,0]=4 13433 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2ccncc2 11a_100000187231_100000690095 [0,2,0,0,0,0|2,0,0]=4 13434 B21R2.221983 Cc1cccc(c1)C=CC(=O)N(C)Cc2ccncc2 240690a_100000187231_100000690095 [0,2,0,0,0,0|2,0,0]=4 13435 B21R2.221983 Cc1cccc(c1)CCC(=O)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011713685 [0,2,0,0,0,0|1,0,0]=3 13436 B21R2.221983 Cc1cccc(c1)CCC(=O)/C(=C\c2ccccc2)/F 1458a_100020889036_100011713685 [0,2,0,0,0,0|1,0,0]=3 13437 B21R2.221983 Cc1cccc(c1)CCC(=O)C(=Cc2cccnc2)F 1458a_100000731744_100011713685 [0,2,0,0,0,0|2,0,0]=4 13438 B21R2.221983 Cc1cccc(c1)CCC(=O)C(=O)Nc2ccccc2 1458a_100000738435_100011713685 [0,2,0,0,0,0|2,0,0]=4 13439 B21R2.221983 Cc1cccc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000185548_200020598536 [0,2,0,0,0,0|1,0,0]=3 13440 B21R2.221983 Cc1cccc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000185548_200020598536 [0,2,0,0,0,0|1,0,0]=3 13441 B21R2.221983 Cc1cccc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000185548_200020598536 [0,2,0,0,0,0|1,0,0]=3 13442 B21R2.221983 Cc1cccc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000185548_200020598536 [0,2,0,0,0,0|1,0,0]=3 13443 B21R2.221983 Cc1cccc(c1)CNC(=O)/C(=C\c2ccccc2)/F 11a_100000185548_100020889036 [0,2,0,0,0,0|1,0,0]=3 13444 B21R2.221983 Cc1cccc(c1)CNC(=O)/C(=C\c2ccccc2)/F 527a_100000185548_100020889036 [0,2,0,0,0,0|1,0,0]=3 13445 B21R2.221983 Cc1cccc(c1)CNC(=O)C(=Cc2cccnc2)F 11a_100000185548_100000731744 [0,2,0,0,0,0|2,0,0]=4 13446 B21R2.221983 Cc1cccc(c1)CNC(=O)C(=Cc2cccnc2)F 240690a_100000185548_100000731744 [0,2,0,0,0,0|2,0,0]=4 13447 B21R2.221983 Cc1cccc(c1)CNC(=O)C(=Cc2cccnc2)F 527a_100000185548_100000731744 [0,2,0,0,0,0|2,0,0]=4 13448 B21R2.221983 Cc1cccc(c1)CNC(=O)C(=O)Nc2ccccc2 240690a_100000185548_100000738435 [0,2,0,0,0,0|2,0,0]=4 13449 B21R2.221983 Cc1cccc(c1)NNC(=O)/C(=C/c2ccccc2)/Cl 22a_100000681630_200020598536 [0,2,0,0,0,0|2,0,0]=4 13450 B21R2.221983 Cc1cccc(c1)NNC(=O)/C(=C\c2ccccc2)/F 22a_100000681630_100020889036 [0,2,0,0,0,0|2,0,0]=4 13451 B21R2.221983 Cc1cccc(n1)CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000701342_200020598536 [0,2,0,0,0,0|2,0,0]=4 13452 B21R2.221983 Cc1cccc(n1)CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000701342_200020598536 [0,2,0,0,0,0|2,0,0]=4 13453 B21R2.221983 Cc1cccc(n1)CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000701342_200020598536 [0,2,0,0,0,0|2,0,0]=4 13454 B21R2.221983 Cc1cccc(n1)CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000701342_200020598536 [0,2,0,0,0,0|2,0,0]=4 13455 B21R2.221983 Cc1cccc(n1)CNC(=O)/C(=C\c2ccccc2)/F 11a_100000701342_100020889036 [0,2,0,0,0,0|2,0,0]=4 13456 B21R2.221983 Cc1cccc(n1)CNC(=O)/C(=C\c2ccccc2)/F 527a_100000701342_100020889036 [0,2,0,0,0,0|2,0,0]=4 13457 B21R2.221983 Cc1ccnc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100011934573_200020598536 [0,2,0,0,0,0|2,0,0]=4 13458 B21R2.221983 Cc1ccnc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100011934573_200020598536 [0,2,0,0,0,0|2,0,0]=4 13459 B21R2.221983 Cc1ccnc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100011934573_200020598536 [0,2,0,0,0,0|2,0,0]=4 13460 B21R2.221983 Cc1ccnc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100011934573_200020598536 [0,2,0,0,0,0|2,0,0]=4 13461 B21R2.221983 Cc1ccnc(c1)CNC(=O)/C(=C\c2ccccc2)/F 11a_100011934573_100020889036 [0,2,0,0,0,0|2,0,0]=4 13462 B21R2.221983 Cc1ccnc(c1)CNC(=O)/C(=C\c2ccccc2)/F 527a_100011934573_100020889036 [0,2,0,0,0,0|2,0,0]=4 13463 B21R2.221983 Cc1cncc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000692839_200020598536 [0,2,0,0,0,0|2,0,0]=4 13464 B21R2.221983 Cc1cncc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000692839_200020598536 [0,2,0,0,0,0|2,0,0]=4 13465 B21R2.221983 Cc1cncc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000692839_200020598536 [0,2,0,0,0,0|2,0,0]=4 13466 B21R2.221983 Cc1cncc(c1)CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000692839_200020598536 [0,2,0,0,0,0|2,0,0]=4 13467 B21R2.221983 Cc1cncc(c1)CNC(=O)/C(=C\c2ccccc2)/F 11a_100000692839_100020889036 [0,2,0,0,0,0|2,0,0]=4 13468 B21R2.221983 Cc1cncc(c1)CNC(=O)/C(=C\c2ccccc2)/F 527a_100000692839_100020889036 [0,2,0,0,0,0|2,0,0]=4 13469 B21R2.221983 O=C(CCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011740638 [0,2,0,0,0,0|1,0,0]=3 13470 B21R2.221983 O=C(CCc1cccc(c1)Br)/C(=C\c2ccccc2)/F 1458a_100020889036_100011740638 [0,2,0,0,0,0|1,0,0]=3 13471 B21R2.221983 O=C(CCc1cccc(c1)Br)C(=Cc2cccnc2)F 1458a_100000731744_100011740638 [0,2,0,0,0,0|2,0,0]=4 13472 B21R2.221983 O=C(CCc1cccc(c1)Br)C(=O)Nc2ccccc2 1458a_100000738435_100011740638 [0,2,0,0,0,0|2,0,0]=4 13473 B21R2.221983 O=C(CCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011713710 [0,2,0,0,0,0|1,0,0]=3 13474 B21R2.221983 O=C(CCc1cccc(c1)Cl)/C(=C\c2ccccc2)/F 1458a_100020889036_100011713710 [0,2,0,0,0,0|1,0,0]=3 13475 B21R2.221983 O=C(CCc1cccc(c1)Cl)C(=Cc2cccnc2)F 1458a_100000731744_100011713710 [0,2,0,0,0,0|2,0,0]=4 13476 B21R2.221983 O=C(CCc1cccc(c1)Cl)C(=O)Nc2ccccc2 1458a_100000738435_100011713710 [0,2,0,0,0,0|2,0,0]=4 13477 B21R2.221983 O=C(CCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011217235 [0,2,0,0,0,0|1,0,0]=3 13478 B21R2.221983 O=C(CCc1cccc(c1)F)/C(=C\c2ccccc2)/F 1458a_100020889036_100011217235 [0,2,0,0,0,0|1,0,0]=3 13479 B21R2.221983 O=C(CCc1cccc(c1)F)C(=Cc2cccnc2)F 1458a_100000731744_100011217235 [0,2,0,0,0,0|2,0,0]=4 13480 B21R2.221983 O=C(CCc1cccc(c1)F)C(=O)Nc2ccccc2 1458a_100000738435_100011217235 [0,2,0,0,0,0|2,0,0]=4 13481 B21R2.221983 O=C(NCc1cc(ccn1)Br)/C(=C/c2ccccc2)/Cl 11a_100009818019_200020598536 [0,2,0,0,0,0|2,0,0]=4 13482 B21R2.221983 O=C(NCc1cc(ccn1)Br)/C(=C/c2ccccc2)/Cl 1626a_100009818019_200020598536 [0,2,0,0,0,0|2,0,0]=4 13483 B21R2.221983 O=C(NCc1cc(ccn1)Br)/C(=C/c2ccccc2)/Cl 240690a_100009818019_200020598536 [0,2,0,0,0,0|2,0,0]=4 13484 B21R2.221983 O=C(NCc1cc(ccn1)Br)/C(=C/c2ccccc2)/Cl 527a_100009818019_200020598536 [0,2,0,0,0,0|2,0,0]=4 13485 B21R2.221983 O=C(NCc1cc(ccn1)Br)/C(=C\c2ccccc2)/F 11a_100009818019_100020889036 [0,2,0,0,0,0|2,0,0]=4 13486 B21R2.221983 O=C(NCc1cc(ccn1)Br)/C(=C\c2ccccc2)/F 527a_100009818019_100020889036 [0,2,0,0,0,0|2,0,0]=4 13487 B21R2.221983 O=C(NCc1cc(ccn1)Cl)/C(=C/c2ccccc2)/Cl 11a_100000085674_200020598536 [0,2,0,0,0,0|2,0,0]=4 13488 B21R2.221983 O=C(NCc1cc(ccn1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100000085674_200020598536 [0,2,0,0,0,0|2,0,0]=4 13489 B21R2.221983 O=C(NCc1cc(ccn1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100000085674_200020598536 [0,2,0,0,0,0|2,0,0]=4 13490 B21R2.221983 O=C(NCc1cc(ccn1)Cl)/C(=C/c2ccccc2)/Cl 527a_100000085674_200020598536 [0,2,0,0,0,0|2,0,0]=4 13491 B21R2.221983 O=C(NCc1cc(ccn1)Cl)/C(=C\c2ccccc2)/F 11a_100000085674_100020889036 [0,2,0,0,0,0|2,0,0]=4 13492 B21R2.221983 O=C(NCc1cc(ccn1)Cl)/C(=C\c2ccccc2)/F 527a_100000085674_100020889036 [0,2,0,0,0,0|2,0,0]=4 13493 B21R2.221983 O=C(NCc1cccc(=O)[nH]1)/C(=C/c2ccccc2)/Cl 11a_100000696482_200020598536 [0,2,0,0,0,0|2,0,0]=4 13494 B21R2.221983 O=C(NCc1cccc(=O)[nH]1)/C(=C/c2ccccc2)/Cl 1626a_100000696482_200020598536 [0,2,0,0,0,0|2,0,0]=4 13495 B21R2.221983 O=C(NCc1cccc(=O)[nH]1)/C(=C/c2ccccc2)/Cl 240690a_100000696482_200020598536 [0,2,0,0,0,0|2,0,0]=4 13496 B21R2.221983 O=C(NCc1cccc(=O)[nH]1)/C(=C/c2ccccc2)/Cl 527a_100000696482_200020598536 [0,2,0,0,0,0|2,0,0]=4 13497 B21R2.221983 O=C(NCc1cccc(=O)[nH]1)/C(=C\c2ccccc2)/F 11a_100000696482_100020889036 [0,2,0,0,0,0|2,0,0]=4 13498 B21R2.221983 O=C(NCc1cccc(=O)[nH]1)/C(=C\c2ccccc2)/F 527a_100000696482_100020889036 [0,2,0,0,0,0|2,0,0]=4 13499 B21R2.221983 O=C(NCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 11a_100000174977_200020598536 [0,2,0,0,0,0|1,0,0]=3 13500 B21R2.221983 O=C(NCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 1626a_100000174977_200020598536 [0,2,0,0,0,0|1,0,0]=3 13501 B21R2.221983 O=C(NCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 240690a_100000174977_200020598536 [0,2,0,0,0,0|1,0,0]=3 13502 B21R2.221983 O=C(NCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 527a_100000174977_200020598536 [0,2,0,0,0,0|1,0,0]=3 13503 B21R2.221983 O=C(NCc1cccc(c1)Br)/C(=C\c2ccccc2)/F 11a_100000174977_100020889036 [0,2,0,0,0,0|1,0,0]=3 13504 B21R2.221983 O=C(NCc1cccc(c1)Br)/C(=C\c2ccccc2)/F 527a_100000174977_100020889036 [0,2,0,0,0,0|1,0,0]=3 13505 B21R2.221983 O=C(NCc1cccc(c1)Br)C(=Cc2cccnc2)F 11a_100000174977_100000731744 [0,2,0,0,0,0|2,0,0]=4 13506 B21R2.221983 O=C(NCc1cccc(c1)Br)C(=Cc2cccnc2)F 240690a_100000174977_100000731744 [0,2,0,0,0,0|2,0,0]=4 13507 B21R2.221983 O=C(NCc1cccc(c1)Br)C(=Cc2cccnc2)F 527a_100000174977_100000731744 [0,2,0,0,0,0|2,0,0]=4 13508 B21R2.221983 O=C(NCc1cccc(c1)Br)C(=O)Nc2ccccc2 240690a_100000174977_100000738435 [0,2,0,0,0,0|2,0,0]=4 13509 B21R2.221983 O=C(NCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 11a_100000174878_200020598536 [0,2,0,0,0,0|1,0,0]=3 13510 B21R2.221983 O=C(NCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100000174878_200020598536 [0,2,0,0,0,0|1,0,0]=3 13511 B21R2.221983 O=C(NCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100000174878_200020598536 [0,2,0,0,0,0|1,0,0]=3 13512 B21R2.221983 O=C(NCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 527a_100000174878_200020598536 [0,2,0,0,0,0|1,0,0]=3 13513 B21R2.221983 O=C(NCc1cccc(c1)Cl)/C(=C\c2ccccc2)/F 11a_100000174878_100020889036 [0,2,0,0,0,0|1,0,0]=3 13514 B21R2.221983 O=C(NCc1cccc(c1)Cl)/C(=C\c2ccccc2)/F 527a_100000174878_100020889036 [0,2,0,0,0,0|1,0,0]=3 13515 B21R2.221983 O=C(NCc1cccc(c1)Cl)C(=Cc2cccnc2)F 11a_100000174878_100000731744 [0,2,0,0,0,0|2,0,0]=4 13516 B21R2.221983 O=C(NCc1cccc(c1)Cl)C(=Cc2cccnc2)F 240690a_100000174878_100000731744 [0,2,0,0,0,0|2,0,0]=4 13517 B21R2.221983 O=C(NCc1cccc(c1)Cl)C(=Cc2cccnc2)F 527a_100000174878_100000731744 [0,2,0,0,0,0|2,0,0]=4 13518 B21R2.221983 O=C(NCc1cccc(c1)Cl)C(=O)Nc2ccccc2 240690a_100000174878_100000738435 [0,2,0,0,0,0|2,0,0]=4 13519 B21R2.221983 O=C(NCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 11a_100000174948_200020598536 [0,2,0,0,0,0|1,0,0]=3 13520 B21R2.221983 O=C(NCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 1626a_100000174948_200020598536 [0,2,0,0,0,0|1,0,0]=3 13521 B21R2.221983 O=C(NCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 240690a_100000174948_200020598536 [0,2,0,0,0,0|1,0,0]=3 13522 B21R2.221983 O=C(NCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 527a_100000174948_200020598536 [0,2,0,0,0,0|1,0,0]=3 13523 B21R2.221983 O=C(NCc1cccc(c1)F)/C(=C\c2ccccc2)/F 11a_100000174948_100020889036 [0,2,0,0,0,0|1,0,0]=3 13524 B21R2.221983 O=C(NCc1cccc(c1)F)/C(=C\c2ccccc2)/F 527a_100000174948_100020889036 [0,2,0,0,0,0|1,0,0]=3 13525 B21R2.221983 O=C(NCc1cccc(c1)F)C(=Cc2cccnc2)F 11a_100000174948_100000731744 [0,2,0,0,0,0|2,0,0]=4 13526 B21R2.221983 O=C(NCc1cccc(c1)F)C(=Cc2cccnc2)F 240690a_100000174948_100000731744 [0,2,0,0,0,0|2,0,0]=4 13527 B21R2.221983 O=C(NCc1cccc(c1)F)C(=Cc2cccnc2)F 527a_100000174948_100000731744 [0,2,0,0,0,0|2,0,0]=4 13528 B21R2.221983 O=C(NCc1cccc(c1)F)C(=O)Nc2ccccc2 240690a_100000174948_100000738435 [0,2,0,0,0,0|2,0,0]=4 13529 B21R2.221983 O=C(NCc1cccc(c1)I)/C(=C/c2ccccc2)/Cl 11a_100000106179_200020598536 [0,2,0,0,0,0|1,0,0]=3 13530 B21R2.221983 O=C(NCc1cccc(c1)I)/C(=C/c2ccccc2)/Cl 1626a_100000106179_200020598536 [0,2,0,0,0,0|1,0,0]=3 13531 B21R2.221983 O=C(NCc1cccc(c1)I)/C(=C/c2ccccc2)/Cl 240690a_100000106179_200020598536 [0,2,0,0,0,0|1,0,0]=3 13532 B21R2.221983 O=C(NCc1cccc(c1)I)/C(=C/c2ccccc2)/Cl 527a_100000106179_200020598536 [0,2,0,0,0,0|1,0,0]=3 13533 B21R2.221983 O=C(NCc1cccc(c1)I)/C(=C\c2ccccc2)/F 11a_100000106179_100020889036 [0,2,0,0,0,0|1,0,0]=3 13534 B21R2.221983 O=C(NCc1cccc(c1)I)/C(=C\c2ccccc2)/F 527a_100000106179_100020889036 [0,2,0,0,0,0|1,0,0]=3 13535 B21R2.221983 O=C(NCc1cccc(c1)I)C(=Cc2cccnc2)F 11a_100000106179_100000731744 [0,2,0,0,0,0|2,0,0]=4 13536 B21R2.221983 O=C(NCc1cccc(c1)I)C(=Cc2cccnc2)F 240690a_100000106179_100000731744 [0,2,0,0,0,0|2,0,0]=4 13537 B21R2.221983 O=C(NCc1cccc(c1)I)C(=Cc2cccnc2)F 527a_100000106179_100000731744 [0,2,0,0,0,0|2,0,0]=4 13538 B21R2.221983 O=C(NCc1cccc(c1)I)C(=O)Nc2ccccc2 240690a_100000106179_100000738435 [0,2,0,0,0,0|2,0,0]=4 13539 B21R2.221983 O=C(NCc1cccc(c1)O)/C(=C/c2ccccc2)/Cl 240690a_100000743036_200020598536 [0,2,0,0,0,0|1,0,0]=3 13540 B21R2.221983 O=C(NCc1cccc(c1)O)/C(=C/c2ccccc2)/Cl 527a_100000743036_200020598536 [0,2,0,0,0,0|1,0,0]=3 13541 B21R2.221983 O=C(NCc1cccc(c1)O)/C(=C\c2ccccc2)/F 527a_100000743036_100020889036 [0,2,0,0,0,0|1,0,0]=3 13542 B21R2.221983 O=C(NCc1cccc(c1)O)C(=Cc2cccnc2)F 240690a_100000743036_100000731744 [0,2,0,0,0,0|2,0,0]=4 13543 B21R2.221983 O=C(NCc1cccc(c1)O)C(=Cc2cccnc2)F 527a_100000743036_100000731744 [0,2,0,0,0,0|2,0,0]=4 13544 B21R2.221983 O=C(NCc1cccc(c1)O)C(=O)Nc2ccccc2 240690a_100000743036_100000738435 [0,2,0,0,0,0|2,0,0]=4 13545 B21R2.221983 O=C(NCc1cccc(n1)Br)/C(=C/c2ccccc2)/Cl 11a_100016987751_200020598536 [0,2,0,0,0,0|2,0,0]=4 13546 B21R2.221983 O=C(NCc1cccc(n1)Br)/C(=C/c2ccccc2)/Cl 1626a_100016987751_200020598536 [0,2,0,0,0,0|2,0,0]=4 13547 B21R2.221983 O=C(NCc1cccc(n1)Br)/C(=C/c2ccccc2)/Cl 240690a_100016987751_200020598536 [0,2,0,0,0,0|2,0,0]=4 13548 B21R2.221983 O=C(NCc1cccc(n1)Br)/C(=C/c2ccccc2)/Cl 527a_100016987751_200020598536 [0,2,0,0,0,0|2,0,0]=4 13549 B21R2.221983 O=C(NCc1cccc(n1)Br)/C(=C\c2ccccc2)/F 11a_100016987751_100020889036 [0,2,0,0,0,0|2,0,0]=4 13550 B21R2.221983 O=C(NCc1cccc(n1)Br)/C(=C\c2ccccc2)/F 527a_100016987751_100020889036 [0,2,0,0,0,0|2,0,0]=4 13551 B21R2.221983 O=C(NCc1cccc(n1)Cl)/C(=C/c2ccccc2)/Cl 11a_100016990191_200020598536 [0,2,0,0,0,0|2,0,0]=4 13552 B21R2.221983 O=C(NCc1cccc(n1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100016990191_200020598536 [0,2,0,0,0,0|2,0,0]=4 13553 B21R2.221983 O=C(NCc1cccc(n1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100016990191_200020598536 [0,2,0,0,0,0|2,0,0]=4 13554 B21R2.221983 O=C(NCc1cccc(n1)Cl)/C(=C/c2ccccc2)/Cl 527a_100016990191_200020598536 [0,2,0,0,0,0|2,0,0]=4 13555 B21R2.221983 O=C(NCc1cccc(n1)Cl)/C(=C\c2ccccc2)/F 11a_100016990191_100020889036 [0,2,0,0,0,0|2,0,0]=4 13556 B21R2.221983 O=C(NCc1cccc(n1)Cl)/C(=C\c2ccccc2)/F 527a_100016990191_100020889036 [0,2,0,0,0,0|2,0,0]=4 13557 B21R2.221983 O=C(NCc1cccc(n1)F)/C(=C/c2ccccc2)/Cl 11a_100015188798_200020598536 [0,2,0,0,0,0|2,0,0]=4 13558 B21R2.221983 O=C(NCc1cccc(n1)F)/C(=C/c2ccccc2)/Cl 1626a_100015188798_200020598536 [0,2,0,0,0,0|2,0,0]=4 13559 B21R2.221983 O=C(NCc1cccc(n1)F)/C(=C/c2ccccc2)/Cl 240690a_100015188798_200020598536 [0,2,0,0,0,0|2,0,0]=4 13560 B21R2.221983 O=C(NCc1cccc(n1)F)/C(=C/c2ccccc2)/Cl 527a_100015188798_200020598536 [0,2,0,0,0,0|2,0,0]=4 13561 B21R2.221983 O=C(NCc1cccc(n1)F)/C(=C\c2ccccc2)/F 11a_100015188798_100020889036 [0,2,0,0,0,0|2,0,0]=4 13562 B21R2.221983 O=C(NCc1cccc(n1)F)/C(=C\c2ccccc2)/F 527a_100015188798_100020889036 [0,2,0,0,0,0|2,0,0]=4 13563 B21R2.221983 O=C(NCc1ccnc(c1)Br)/C(=C/c2ccccc2)/Cl 11a_100025757509_200020598536 [0,2,0,0,0,0|2,0,0]=4 13564 B21R2.221983 O=C(NCc1ccnc(c1)Br)/C(=C/c2ccccc2)/Cl 240690a_100025757509_200020598536 [0,2,0,0,0,0|2,0,0]=4 13565 B21R2.221983 O=C(NCc1ccnc(c1)Br)/C(=C/c2ccccc2)/Cl 527a_100025757509_200020598536 [0,2,0,0,0,0|2,0,0]=4 13566 B21R2.221983 O=C(NCc1ccnc(c1)Br)/C(=C\c2ccccc2)/F 11a_100025757509_100020889036 [0,2,0,0,0,0|2,0,0]=4 13567 B21R2.221983 O=C(NCc1ccnc(c1)Br)/C(=C\c2ccccc2)/F 527a_100025757509_100020889036 [0,2,0,0,0,0|2,0,0]=4 13568 B21R2.221983 O=C(NCc1ccnc(c1)Cl)/C(=C/c2ccccc2)/Cl 11a_100015205668_200020598536 [0,2,0,0,0,0|2,0,0]=4 13569 B21R2.221983 O=C(NCc1ccnc(c1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100015205668_200020598536 [0,2,0,0,0,0|2,0,0]=4 13570 B21R2.221983 O=C(NCc1ccnc(c1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100015205668_200020598536 [0,2,0,0,0,0|2,0,0]=4 13571 B21R2.221983 O=C(NCc1ccnc(c1)Cl)/C(=C/c2ccccc2)/Cl 527a_100015205668_200020598536 [0,2,0,0,0,0|2,0,0]=4 13572 B21R2.221983 O=C(NCc1ccnc(c1)Cl)/C(=C\c2ccccc2)/F 11a_100015205668_100020889036 [0,2,0,0,0,0|2,0,0]=4 13573 B21R2.221983 O=C(NCc1ccnc(c1)Cl)/C(=C\c2ccccc2)/F 527a_100015205668_100020889036 [0,2,0,0,0,0|2,0,0]=4 13574 B21R2.221983 O=C(NCc1ccnc(c1)F)/C(=C/c2ccccc2)/Cl 11a_100015188774_200020598536 [0,2,0,0,0,0|2,0,0]=4 13575 B21R2.221983 O=C(NCc1ccnc(c1)F)/C(=C/c2ccccc2)/Cl 1626a_100015188774_200020598536 [0,2,0,0,0,0|2,0,0]=4 13576 B21R2.221983 O=C(NCc1ccnc(c1)F)/C(=C/c2ccccc2)/Cl 240690a_100015188774_200020598536 [0,2,0,0,0,0|2,0,0]=4 13577 B21R2.221983 O=C(NCc1ccnc(c1)F)/C(=C/c2ccccc2)/Cl 527a_100015188774_200020598536 [0,2,0,0,0,0|2,0,0]=4 13578 B21R2.221983 O=C(NCc1ccnc(c1)F)/C(=C\c2ccccc2)/F 11a_100015188774_100020889036 [0,2,0,0,0,0|2,0,0]=4 13579 B21R2.221983 O=C(NCc1ccnc(c1)F)/C(=C\c2ccccc2)/F 527a_100015188774_100020889036 [0,2,0,0,0,0|2,0,0]=4 13580 B21R2.221983 O=C(NCc1ccnc(c1)O)/C(=C/c2ccccc2)/Cl 11a_100000748557_200020598536 [0,2,0,0,0,0|2,0,0]=4 13581 B21R2.221983 O=C(NCc1ccnc(c1)O)/C(=C/c2ccccc2)/Cl 240690a_100000748557_200020598536 [0,2,0,0,0,0|2,0,0]=4 13582 B21R2.221983 O=C(NCc1ccnc(c1)O)/C(=C/c2ccccc2)/Cl 527a_100000748557_200020598536 [0,2,0,0,0,0|2,0,0]=4 13583 B21R2.221983 O=C(NCc1ccnc(c1)O)/C(=C\c2ccccc2)/F 11a_100000748557_100020889036 [0,2,0,0,0,0|2,0,0]=4 13584 B21R2.221983 O=C(NCc1ccnc(c1)O)/C(=C\c2ccccc2)/F 527a_100000748557_100020889036 [0,2,0,0,0,0|2,0,0]=4 13585 B21R2.221983 O=C(NCc1cncc(c1)Br)/C(=C/c2ccccc2)/Cl 11a_100011249555_200020598536 [0,2,0,0,0,0|2,0,0]=4 13586 B21R2.221983 O=C(NCc1cncc(c1)Br)/C(=C/c2ccccc2)/Cl 240690a_100011249555_200020598536 [0,2,0,0,0,0|2,0,0]=4 13587 B21R2.221983 O=C(NCc1cncc(c1)Br)/C(=C/c2ccccc2)/Cl 527a_100011249555_200020598536 [0,2,0,0,0,0|2,0,0]=4 13588 B21R2.221983 O=C(NCc1cncc(c1)Br)/C(=C\c2ccccc2)/F 11a_100011249555_100020889036 [0,2,0,0,0,0|2,0,0]=4 13589 B21R2.221983 O=C(NCc1cncc(c1)Br)/C(=C\c2ccccc2)/F 527a_100011249555_100020889036 [0,2,0,0,0,0|2,0,0]=4 13590 B21R2.221983 O=C(NCc1cncc(c1)Cl)/C(=C/c2ccccc2)/Cl 11a_200020614424_200020598536 [0,2,0,0,0,0|2,0,0]=4 13591 B21R2.221983 O=C(NCc1cncc(c1)Cl)/C(=C/c2ccccc2)/Cl 1626a_200020614424_200020598536 [0,2,0,0,0,0|2,0,0]=4 13592 B21R2.221983 O=C(NCc1cncc(c1)Cl)/C(=C/c2ccccc2)/Cl 240690a_200020614424_200020598536 [0,2,0,0,0,0|2,0,0]=4 13593 B21R2.221983 O=C(NCc1cncc(c1)Cl)/C(=C/c2ccccc2)/Cl 527a_200020614424_200020598536 [0,2,0,0,0,0|2,0,0]=4 13594 B21R2.221983 O=C(NCc1cncc(c1)Cl)/C(=C\c2ccccc2)/F 11a_200020614424_100020889036 [0,2,0,0,0,0|2,0,0]=4 13595 B21R2.221983 O=C(NCc1cncc(c1)Cl)/C(=C\c2ccccc2)/F 527a_200020614424_100020889036 [0,2,0,0,0,0|2,0,0]=4 13596 B21R2.221983 O=C(NCc1cncc(c1)F)/C(=C/c2ccccc2)/Cl 11a_100011962886_200020598536 [0,2,0,0,0,0|2,0,0]=4 13597 B21R2.221983 O=C(NCc1cncc(c1)F)/C(=C/c2ccccc2)/Cl 1626a_100011962886_200020598536 [0,2,0,0,0,0|2,0,0]=4 13598 B21R2.221983 O=C(NCc1cncc(c1)F)/C(=C/c2ccccc2)/Cl 240690a_100011962886_200020598536 [0,2,0,0,0,0|2,0,0]=4 13599 B21R2.221983 O=C(NCc1cncc(c1)F)/C(=C/c2ccccc2)/Cl 527a_100011962886_200020598536 [0,2,0,0,0,0|2,0,0]=4 13600 B21R2.221983 O=C(NCc1cncc(c1)F)/C(=C\c2ccccc2)/F 11a_100011962886_100020889036 [0,2,0,0,0,0|2,0,0]=4 13601 B21R2.221983 O=C(NCc1cncc(c1)F)/C(=C\c2ccccc2)/F 527a_100011962886_100020889036 [0,2,0,0,0,0|2,0,0]=4 13602 B21R2.221983 O=C(NNc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 22a_100000217339_200020598536 [0,2,0,0,0,0|2,0,0]=4 13603 B21R2.221983 O=C(NNc1cccc(c1)Br)/C(=C\c2ccccc2)/F 22a_100000217339_100020889036 [0,2,0,0,0,0|2,0,0]=4 13604 B21R2.221983 O=C(NNc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 22a_100000184277_200020598536 [0,2,0,0,0,0|2,0,0]=4 13605 B21R2.221983 O=C(NNc1cccc(c1)Cl)/C(=C\c2ccccc2)/F 22a_100000184277_100020889036 [0,2,0,0,0,0|2,0,0]=4 13606 B21R2.221983 O=C(NNc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 22a_100000745080_200020598536 [0,2,0,0,0,0|2,0,0]=4 13607 B21R2.221983 O=C(NNc1cccc(c1)F)/C(=C\c2ccccc2)/F 22a_100000745080_100020889036 [0,2,0,0,0,0|2,0,0]=4 13608 B21R2.221983 O=C(NNc1cccc(c1)I)/C(=C/c2ccccc2)/Cl 22a_100020605690_200020598536 [0,2,0,0,0,0|2,0,0]=4 13609 B21R2.221983 O=C(NNc1cccc(c1)I)/C(=C\c2ccccc2)/F 22a_100020605690_100020889036 [0,2,0,0,0,0|2,0,0]=4 13610 B21R2.222199 CC(NC(=O)C=Cc1ccccc1)c2cccc(c2)Br 11a_100020642005_100000210462 [0,2,0,0,0,0|1,0,0]=3 13611 B21R2.222199 CC(NC(=O)C=Cc1ccccc1)c2cccc(c2)Br 1626a_100020642005_100000210462 [0,2,0,0,0,0|1,0,0]=3 13612 B21R2.222199 CC(NC(=O)C=Cc1ccccc1)c2cccc(c2)Cl 11a_100102723534_100000210462 [0,2,0,0,0,0|1,0,0]=3 13613 B21R2.222199 CC(NC(=O)C=Cc1ccccc1)c2cccc(c2)Cl 1626a_100102723534_100000210462 [0,2,0,0,0,0|1,0,0]=3 13614 B21R2.222199 CC(NC(=O)C=Cc1ccccc1)c2cccc(n2)Br 11a_200010173468_100000210462 [0,2,0,0,0,0|2,0,0]=4 13615 B21R2.222199 CC(NC(=O)C=Cc1ccccc1)c2cccc(n2)Br 1626a_200010173468_100000210462 [0,2,0,0,0,0|2,0,0]=4 13616 B21R2.222199 CC(NC(=O)C=Cc1ccccn1)c2cccc(c2)Br 11a_100020642005_100000740811 [0,2,0,0,0,0|2,0,0]=4 13617 B21R2.222199 CC(NC(=O)C=Cc1ccccn1)c2cccc(c2)Br 240690a_100020642005_100000740811 [0,2,0,0,0,0|2,0,0]=4 13618 B21R2.222199 CC(NC(=O)C=Cc1ccccn1)c2cccc(c2)Cl 11a_100102723534_100000740811 [0,2,0,0,0,0|2,0,0]=4 13619 B21R2.222199 CC(NC(=O)C=Cc1ccccn1)c2cccc(c2)Cl 240690a_100102723534_100000740811 [0,2,0,0,0,0|2,0,0]=4 13620 B21R2.222199 CC(NC(=O)C=Cc1ccccn1)c2cccc(c2)O 240690a_100000740644_100000740811 [0,2,0,0,0,0|2,0,0]=4 13621 B21R2.222199 CC(NC(=O)C=Cc1cccnc1)c2cccc(c2)Br 11a_100020642005_100000735890 [0,2,0,0,0,0|2,0,0]=4 13622 B21R2.222199 CC(NC(=O)C=Cc1cccnc1)c2cccc(c2)Br 240690a_100020642005_100000735890 [0,2,0,0,0,0|2,0,0]=4 13623 B21R2.222199 CC(NC(=O)C=Cc1cccnc1)c2cccc(c2)Cl 11a_100102723534_100000735890 [0,2,0,0,0,0|2,0,0]=4 13624 B21R2.222199 CC(NC(=O)C=Cc1cccnc1)c2cccc(c2)Cl 240690a_100102723534_100000735890 [0,2,0,0,0,0|2,0,0]=4 13625 B21R2.222199 CC(NC(=O)C=Cc1cccnc1)c2cccc(c2)O 240690a_100000740644_100000735890 [0,2,0,0,0,0|2,0,0]=4 13626 B21R2.222199 CC(NC(=O)C=Cc1ccncc1)c2cccc(c2)Br 240690a_100020642005_100000682801 [0,2,0,0,0,0|2,0,0]=4 13627 B21R2.222199 CC(NC(=O)C=Cc1ccncc1)c2cccc(c2)Cl 240690a_100102723534_100000682801 [0,2,0,0,0,0|2,0,0]=4 13628 B21R2.222199 CC(NC(=O)C=Cc1ccncc1)c2cccc(c2)O 240690a_100000740644_100000682801 [0,2,0,0,0,0|2,0,0]=4 13629 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)Br 2230a_100000219648_100000753625 [0,2,0,0,0,0|1,0,1]=4 13630 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)Br 269982a_100000219648_100000753625 [0,2,0,0,0,0|1,0,1]=4 13631 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)Br 34a_100000219648_100000753625 [0,2,0,0,0,0|1,0,1]=4 13632 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)Cl 2230a_100000220044_100000753625 [0,2,0,0,0,0|1,0,1]=4 13633 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)Cl 269982a_100000220044_100000753625 [0,2,0,0,0,0|1,0,1]=4 13634 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)Cl 34a_100000220044_100000753625 [0,2,0,0,0,0|1,0,1]=4 13635 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)F 2230a_100020633736_100000753625 [0,2,0,0,0,0|1,0,1]=4 13636 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)F 269982a_100020633736_100000753625 [0,2,0,0,0,0|1,0,1]=4 13637 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)F 34a_100020633736_100000753625 [0,2,0,0,0,0|1,0,1]=4 13638 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)I 2230a_100000221217_100000753625 [0,2,0,0,0,0|1,0,1]=4 13639 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)I 269982a_100000221217_100000753625 [0,2,0,0,0,0|1,0,1]=4 13640 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)I 34a_100000221217_100000753625 [0,2,0,0,0,0|1,0,1]=4 13641 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)O 2230a_100000756613_100000753625 [0,2,0,0,0,0|1,0,1]=4 13642 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)O 269982a_100000756613_100000753625 [0,2,0,0,0,0|1,0,1]=4 13643 B21R2.222199 CN(CC(=O)OCc1ccccc1)c2cccc(c2)O 34a_100000756613_100000753625 [0,2,0,0,0,0|1,0,1]=4 13644 B21R2.222199 C[C@@H](NC(=O)C=Cc1ccccc1)c2cccc(c2)F 11a_100015193778_100000210462 [0,2,0,0,0,0|1,0,0]=3 13645 B21R2.222199 C[C@@H](NC(=O)C=Cc1ccccc1)c2cccc(c2)F 1626a_100015193778_100000210462 [0,2,0,0,0,0|1,0,0]=3 13646 B21R2.222199 C[C@@H](NC(=O)C=Cc1ccccc1)c2cncc(c2)Br 11a_100012350620_100000210462 [0,2,0,0,0,0|2,0,0]=4 13647 B21R2.222199 C[C@@H](NC(=O)C=Cc1ccccn1)c2cccc(c2)F 11a_100015193778_100000740811 [0,2,0,0,0,0|2,0,0]=4 13648 B21R2.222199 C[C@@H](NC(=O)C=Cc1ccccn1)c2cccc(c2)F 240690a_100015193778_100000740811 [0,2,0,0,0,0|2,0,0]=4 13649 B21R2.222199 C[C@@H](NC(=O)C=Cc1cccnc1)c2cccc(c2)F 11a_100015193778_100000735890 [0,2,0,0,0,0|2,0,0]=4 13650 B21R2.222199 C[C@@H](NC(=O)C=Cc1cccnc1)c2cccc(c2)F 240690a_100015193778_100000735890 [0,2,0,0,0,0|2,0,0]=4 13651 B21R2.222199 C[C@@H](NC(=O)C=Cc1ccncc1)c2cccc(c2)F 240690a_100015193778_100000682801 [0,2,0,0,0,0|2,0,0]=4 13652 B21R2.222199 C[C@H](NC(=O)C=Cc1ccccc1)c2cccc(n2)F 11a_100025709760_100000210462 [0,2,0,0,0,0|2,0,0]=4 13653 B21R2.222199 C[C@H](NC(=O)C=Cc1ccccc1)c2cccc(n2)F 1626a_100025709760_100000210462 [0,2,0,0,0,0|2,0,0]=4 13654 B21R2.222199 Cc1cccc(c1)C(=O)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000739480 [0,2,0,0,0,0|1,0,1]=4 13655 B21R2.222199 Cc1cccc(c1)C(=O)CC(=O)CCc2ccccc2 1458a_100000185753_100000739480 [0,2,0,0,0,0|1,0,1]=4 13656 B21R2.222199 Cc1cccc(c1)C(=O)CC(=O)CCc2ccccc2 1458a_100000189346_100012361361 [0,2,0,0,0,0|1,0,1]=4 13657 B21R2.222199 Cc1cccc(c1)C(=O)CC(=O)NCc2ccccc2 1458a_100000189346_100000183539 [0,2,0,0,0,0|1,0,1]=4 13658 B21R2.222199 Cc1cccc(c1)C(=O)CC(=O)OCc2ccccc2 1458a_100000189346_100000753625 [0,2,0,0,0,0|0,0,1]=3 13659 B21R2.222199 Cc1cccc(c1)N(C)CC(=O)OCc2ccccc2 2230a_100000219674_100000753625 [0,2,0,0,0,0|1,0,1]=4 13660 B21R2.222199 Cc1cccc(c1)N(C)CC(=O)OCc2ccccc2 269982a_100000219674_100000753625 [0,2,0,0,0,0|1,0,1]=4 13661 B21R2.222199 Cc1cccc(c1)N(C)CC(=O)OCc2ccccc2 34a_100000219674_100000753625 [0,2,0,0,0,0|1,0,1]=4 13662 B21R2.222199 Cc1cccc(c1)[C@@H](C)NC(=O)C=Cc2ccccc2 11a_100000698126_100000210462 [0,2,0,0,0,0|1,0,0]=3 13663 B21R2.222199 Cc1cccc(c1)[C@@H](C)NC(=O)C=Cc2ccccc2 1626a_100000698126_100000210462 [0,2,0,0,0,0|1,0,0]=3 13664 B21R2.222199 Cc1cccc(c1)[C@@H](C)NC(=O)C=Cc2ccccn2 11a_100000698126_100000740811 [0,2,0,0,0,0|2,0,0]=4 13665 B21R2.222199 Cc1cccc(c1)[C@@H](C)NC(=O)C=Cc2ccccn2 240690a_100000698126_100000740811 [0,2,0,0,0,0|2,0,0]=4 13666 B21R2.222199 Cc1cccc(c1)[C@@H](C)NC(=O)C=Cc2cccnc2 11a_100000698126_100000735890 [0,2,0,0,0,0|2,0,0]=4 13667 B21R2.222199 Cc1cccc(c1)[C@@H](C)NC(=O)C=Cc2cccnc2 240690a_100000698126_100000735890 [0,2,0,0,0,0|2,0,0]=4 13668 B21R2.222199 Cc1cccc(c1)[C@@H](C)NC(=O)C=Cc2ccncc2 240690a_100000698126_100000682801 [0,2,0,0,0,0|2,0,0]=4 13669 B21R2.222199 Cc1cccc(n1)C(C)NC(=O)C=Cc2ccccc2 11a_100011877385_100000210462 [0,2,0,0,0,0|2,0,0]=4 13670 B21R2.222199 Cc1cccc(n1)C(C)NC(=O)C=Cc2ccccc2 1626a_100011877385_100000210462 [0,2,0,0,0,0|2,0,0]=4 13671 B21R2.222199 Cc1ccnc(c1)C(C)NC(=O)C=Cc2ccccc2 11a_100011933787_100000210462 [0,2,0,0,0,0|2,0,0]=4 13672 B21R2.222199 Cc1ccnc(c1)C(C)NC(=O)C=Cc2ccccc2 1626a_100011933787_100000210462 [0,2,0,0,0,0|2,0,0]=4 13673 B21R2.222199 O=C(C=Cc1ccccc1)CC(=O)c2cccc(c2)Br 1458a_100000210462_100000212080 [0,2,0,0,0,0|1,0,1]=4 13674 B21R2.222199 O=C(C=Cc1ccccc1)CC(=O)c2cccc(c2)Cl 1458a_100000210462_100000211444 [0,2,0,0,0,0|1,0,1]=4 13675 B21R2.222199 O=C(C=Cc1ccccc1)CC(=O)c2cccc(c2)F 1458a_100000210462_100000215616 [0,2,0,0,0,0|1,0,1]=4 13676 B21R2.222199 O=C(C=Cc1ccccc1)CC(=O)c2cccc(c2)O 1458a_100000210462_100009813753 [0,2,0,0,0,0|1,0,1]=4 13677 B21R2.222199 O=C(CC(=O)c1cccc(c1)Br)NCc2ccccc2 1458a_100000210664_100000183539 [0,2,0,0,0,0|1,0,1]=4 13678 B21R2.222199 O=C(CC(=O)c1cccc(c1)Br)OCc2ccccc2 1458a_100000210664_100000753625 [0,2,0,0,0,0|0,0,1]=3 13679 B21R2.222199 O=C(CC(=O)c1cccc(c1)Cl)NCc2ccccc2 1458a_100000210390_100000183539 [0,2,0,0,0,0|1,0,1]=4 13680 B21R2.222199 O=C(CC(=O)c1cccc(c1)Cl)OCc2ccccc2 1458a_100000210390_100000753625 [0,2,0,0,0,0|0,0,1]=3 13681 B21R2.222199 O=C(CC(=O)c1cccc(c1)F)NCc2ccccc2 1458a_100000210950_100000183539 [0,2,0,0,0,0|1,0,1]=4 13682 B21R2.222199 O=C(CC(=O)c1cccc(c1)F)OCc2ccccc2 1458a_100000210950_100000753625 [0,2,0,0,0,0|0,0,1]=3 13683 B21R2.222199 O=C(CC(=O)c1cccc(c1)I)NCc2ccccc2 1458a_100000184098_100000183539 [0,2,0,0,0,0|1,0,1]=4 13684 B21R2.222199 O=C(CC(=O)c1cccc(c1)I)OCc2ccccc2 1458a_100000184098_100000753625 [0,2,0,0,0,0|0,0,1]=3 13685 B21R2.222199 O=C(CC(=O)c1cccc(c1)O)NCc2ccccc2 1458a_100000183914_100000183539 [0,2,0,0,0,0|1,0,1]=4 13686 B21R2.222199 O=C(CC(=O)c1cccc(c1)O)OCc2ccccc2 1458a_100000183914_100000753625 [0,2,0,0,0,0|0,0,1]=3 13687 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)Br 1458a_100000185753_100000212080 [0,2,0,0,0,0|1,0,1]=4 13688 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)Br 1458a_100000210664_100012361361 [0,2,0,0,0,0|1,0,1]=4 13689 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)Cl 1458a_100000185753_100000211444 [0,2,0,0,0,0|1,0,1]=4 13690 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)Cl 1458a_100000210390_100012361361 [0,2,0,0,0,0|1,0,1]=4 13691 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)F 1458a_100000185753_100000215616 [0,2,0,0,0,0|1,0,1]=4 13692 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)F 1458a_100000210950_100012361361 [0,2,0,0,0,0|1,0,1]=4 13693 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)I 1458a_100000184098_100012361361 [0,2,0,0,0,0|1,0,1]=4 13694 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)O 1458a_100000183914_100012361361 [0,2,0,0,0,0|1,0,1]=4 13695 B21R2.222199 O=C(CCc1ccccc1)CC(=O)c2cccc(c2)O 1458a_100000185753_100009813753 [0,2,0,0,0,0|1,0,1]=4 13696 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)CCc2ccccc2)F 1458a_100102526132_100000765856 [0,2,0,0,0,0|1,0,0]=3 13697 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)CCc2ccccc2)F 6a_100000756917_100000210092 [0,2,0,0,0,0|1,0,0]=3 13698 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)CCc2ccccc2)I 6a_100010150105_100000210092 [0,2,0,0,0,0|1,0,0]=3 13699 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)CCc2ccccn2)F 1458a_100102526132_100015183660 [0,2,0,0,0,0|2,0,0]=4 13700 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)CCc2cccnc2)F 1458a_100102526132_200011713674 [0,2,0,0,0,0|2,0,0]=4 13701 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)CCc2ccncc2)F 1458a_100102526132_100000723409 [0,2,0,0,0,0|2,0,0]=4 13702 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)COc2ccccc2)F 6a_100000756917_100000150576 [0,2,0,0,0,0|2,0,0]=4 13703 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)COc2ccccc2)I 6a_100010150105_100000150576 [0,2,0,0,0,0|2,0,0]=4 13704 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)CSc2ccccc2)F 6a_100000756917_100000150717 [0,2,0,0,0,0|2,0,0]=4 13705 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)CSc2ccccc2)I 6a_100010150105_100000150717 [0,2,0,0,0,0|2,0,0]=4 13706 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccccc2)C 1626a_100015324214_200016256798 [0,2,0,0,0,0|1,0,0]=3 13707 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccccc2)F 11a_100015324214_100102526132 [0,2,0,0,0,0|1,0,0]=3 13708 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccccc2)F 1626a_100015324214_100102526132 [0,2,0,0,0,0|1,0,0]=3 13709 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccccc2)F 240690a_100015324214_100102526132 [0,2,0,0,0,0|1,0,0]=3 13710 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccccn2)C 1626a_100000210449_200016256798 [0,2,0,0,0,0|2,0,0]=4 13711 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccccn2)F 11a_100000210449_100102526132 [0,2,0,0,0,0|2,0,0]=4 13712 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccccn2)F 1626a_100000210449_100102526132 [0,2,0,0,0,0|2,0,0]=4 13713 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccccn2)F 240690a_100000210449_100102526132 [0,2,0,0,0,0|2,0,0]=4 13714 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2cccnc2)F 11a_100000210453_100102526132 [0,2,0,0,0,0|2,0,0]=4 13715 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2cccnc2)F 240690a_100000210453_100102526132 [0,2,0,0,0,0|2,0,0]=4 13716 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccncc2)C 1626a_100000210450_200016256798 [0,2,0,0,0,0|2,0,0]=4 13717 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccncc2)F 11a_100000210450_100102526132 [0,2,0,0,0,0|2,0,0]=4 13718 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccncc2)F 1626a_100000210450_100102526132 [0,2,0,0,0,0|2,0,0]=4 13719 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NCc2ccncc2)F 240690a_100000210450_100102526132 [0,2,0,0,0,0|2,0,0]=4 13720 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NNc2ccccc2)C 22a_100015195140_200016256798 [0,2,0,0,0,0|2,0,0]=4 13721 B21R2.225847 Cc1ccc(c(c1)C=CC(=O)NNc2ccccc2)F 22a_100015195140_100102526132 [0,2,0,0,0,0|2,0,0]=4 13722 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccc2)C 11a_100000174964_100000210462 [0,2,0,0,0,0|1,0,0]=3 13723 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccc2)C 1626a_100000174964_100000210462 [0,2,0,0,0,0|1,0,0]=3 13724 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccc2)Cl 11a_100025705715_100000210462 [0,2,0,0,0,0|1,0,0]=3 13725 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccc2)Cl 1626a_100025705715_100000210462 [0,2,0,0,0,0|1,0,0]=3 13726 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccc2)F 11a_100102693586_100000210462 [0,2,0,0,0,0|1,0,0]=3 13727 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccc2)F 1626a_100102693586_100000210462 [0,2,0,0,0,0|1,0,0]=3 13728 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccn2)C 11a_100000174964_100000740811 [0,2,0,0,0,0|2,0,0]=4 13729 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccn2)C 240690a_100000174964_100000740811 [0,2,0,0,0,0|2,0,0]=4 13730 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccn2)Cl 11a_100025705715_100000740811 [0,2,0,0,0,0|2,0,0]=4 13731 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccn2)Cl 240690a_100025705715_100000740811 [0,2,0,0,0,0|2,0,0]=4 13732 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccn2)F 11a_100102693586_100000740811 [0,2,0,0,0,0|2,0,0]=4 13733 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccccn2)F 240690a_100102693586_100000740811 [0,2,0,0,0,0|2,0,0]=4 13734 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2cccnc2)C 11a_100000174964_100000735890 [0,2,0,0,0,0|2,0,0]=4 13735 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2cccnc2)C 240690a_100000174964_100000735890 [0,2,0,0,0,0|2,0,0]=4 13736 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2cccnc2)Cl 11a_100025705715_100000735890 [0,2,0,0,0,0|2,0,0]=4 13737 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2cccnc2)Cl 240690a_100025705715_100000735890 [0,2,0,0,0,0|2,0,0]=4 13738 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2cccnc2)F 11a_100102693586_100000735890 [0,2,0,0,0,0|2,0,0]=4 13739 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2cccnc2)F 240690a_100102693586_100000735890 [0,2,0,0,0,0|2,0,0]=4 13740 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccncc2)C 240690a_100000174964_100000682801 [0,2,0,0,0,0|2,0,0]=4 13741 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccncc2)Cl 240690a_100025705715_100000682801 [0,2,0,0,0,0|2,0,0]=4 13742 B21R2.225847 Cc1ccc(c(c1)CNC(=O)C=Cc2ccncc2)F 240690a_100102693586_100000682801 [0,2,0,0,0,0|2,0,0]=4 13743 B21R2.225847 Cc1ccc(c(c1)NCC(=O)OCc2ccccc2)Br 34a_100000745044_100000753625 [0,2,0,0,0,0|1,0,1]=4 13744 B21R2.225847 Cc1ccc(c(c1)NCC(=O)OCc2ccccc2)C 2230a_100000185781_100000753625 [0,2,0,0,0,0|1,0,1]=4 13745 B21R2.225847 Cc1ccc(c(c1)NCC(=O)OCc2ccccc2)C 34a_100000185781_100000753625 [0,2,0,0,0,0|1,0,1]=4 13746 B21R2.225847 Cc1ccc(c(c1)NCC(=O)OCc2ccccc2)C 7a_100000185781_100000753625 [0,2,0,0,0,0|1,0,1]=4 13747 B21R2.225847 Cc1ccc(c(c1)NCC(=O)OCc2ccccc2)Cl 34a_100011215360_100000753625 [0,2,0,0,0,0|1,0,1]=4 13748 B21R2.225847 Cc1ccc(c(c1)NCC(=O)OCc2ccccc2)F 34a_100000211285_100000753625 [0,2,0,0,0,0|1,0,1]=4 13749 B21R2.225847 Cc1ccc(c(c1)NCC(=O)OCc2ccccc2)I 34a_100011216686_100000753625 [0,2,0,0,0,0|1,0,1]=4 13750 B21R2.225847 Cc1ccc(c(c1)NCC(=O)OCc2ccccc2)O 34a_100011215204_100000753625 [0,2,0,0,0,0|1,0,1]=4 13751 B21R2.225847 Cc1ccc(c(c1)NNC(=O)C=Cc2ccccc2)C 22a_100000683361_100000210462 [0,2,0,0,0,0|2,0,0]=4 13752 B21R2.225847 Cc1ccc(c(c1)NNC(=O)C=Cc2ccccc2)Cl 22a_200020642191_100000210462 [0,2,0,0,0,0|2,0,0]=4 13753 B21R2.225847 Cc1ccc(c(c1)NNC(=O)C=Cc2ccccc2)F 22a_100011248256_100000210462 [0,2,0,0,0,0|2,0,0]=4 13754 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)Br 34a_100012002257_100000753625 [0,2,0,0,0,0|1,0,1]=4 13755 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)Br 7a_100012002257_100000753625 [0,2,0,0,0,0|1,0,1]=4 13756 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)C 34a_100000210931_100000753625 [0,2,0,0,0,0|1,0,1]=4 13757 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)C 7a_100000210931_100000753625 [0,2,0,0,0,0|1,0,1]=4 13758 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)Cl 34a_100000211493_100000753625 [0,2,0,0,0,0|1,0,1]=4 13759 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)Cl 7a_100000211493_100000753625 [0,2,0,0,0,0|1,0,1]=4 13760 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)F 34a_100000759540_100000753625 [0,2,0,0,0,0|1,0,1]=4 13761 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)F 7a_100000759540_100000753625 [0,2,0,0,0,0|1,0,1]=4 13762 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)N 34a_100000211527_100000753625 [0,2,0,0,0,0|1,0,1]=4 13763 B21R2.225847 Cc1ccc(c(c1)OCC(=O)OCc2ccccc2)N 7a_100000211527_100000753625 [0,2,0,0,0,0|1,0,1]=4 13764 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)Br 62a_100000753625_100012353751 [0,2,0,0,0,0|1,0,1]=4 13765 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)Br 62a_100012353751_100000753625 [0,2,0,0,0,0|1,0,1]=4 13766 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)C 62a_100000210833_100000753625 [0,2,0,0,0,0|1,0,1]=4 13767 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)C 62a_100000753625_100000210833 [0,2,0,0,0,0|1,0,1]=4 13768 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100012356289 [0,2,0,0,0,0|1,0,1]=4 13769 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)Cl 62a_100012356289_100000753625 [0,2,0,0,0,0|1,0,1]=4 13770 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)F 62a_100000736223_100000753625 [0,2,0,0,0,0|1,0,1]=4 13771 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)F 62a_100000753625_100000736223 [0,2,0,0,0,0|1,0,1]=4 13772 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)N 62a_100000753625_100011356834 [0,2,0,0,0,0|1,0,1]=4 13773 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)N 62a_100011356834_100000753625 [0,2,0,0,0,0|1,0,1]=4 13774 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)O 62a_100000753625_100000765521 [0,2,0,0,0,0|1,0,1]=4 13775 B21R2.225847 Cc1ccc(c(c1)SCC(=O)OCc2ccccc2)O 62a_100000765521_100000753625 [0,2,0,0,0,0|1,0,1]=4 13776 B21R2.225847 Cc1ccc(cc1C=CC(=O)NCc2ccccc2)F 11a_100015324214_100102526137 [0,2,0,0,0,0|1,0,0]=3 13777 B21R2.225847 Cc1ccc(cc1C=CC(=O)NCc2ccccc2)F 1626a_100015324214_100102526137 [0,2,0,0,0,0|1,0,0]=3 13778 B21R2.225847 Cc1ccc(cc1C=CC(=O)NCc2ccccn2)F 11a_100000210449_100102526137 [0,2,0,0,0,0|2,0,0]=4 13779 B21R2.225847 Cc1ccc(cc1C=CC(=O)NCc2ccccn2)F 1626a_100000210449_100102526137 [0,2,0,0,0,0|2,0,0]=4 13780 B21R2.225847 Cc1ccc(cc1C=CC(=O)NCc2cccnc2)F 11a_100000210453_100102526137 [0,2,0,0,0,0|2,0,0]=4 13781 B21R2.225847 Cc1ccc(cc1C=CC(=O)NCc2ccncc2)F 11a_100000210450_100102526137 [0,2,0,0,0,0|2,0,0]=4 13782 B21R2.225847 Cc1ccc(cc1C=CC(=O)NCc2ccncc2)F 1626a_100000210450_100102526137 [0,2,0,0,0,0|2,0,0]=4 13783 B21R2.225847 Cc1ccc(cc1C=CC(=O)NNc2ccccc2)F 22a_100015195140_100102526137 [0,2,0,0,0,0|2,0,0]=4 13784 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccc2)Cl 11a_100000717755_100000210462 [0,2,0,0,0,0|1,0,0]=3 13785 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccc2)Cl 1626a_100000717755_100000210462 [0,2,0,0,0,0|1,0,0]=3 13786 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccc2)F 11a_100011217291_100000210462 [0,2,0,0,0,0|1,0,0]=3 13787 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccc2)F 1626a_100011217291_100000210462 [0,2,0,0,0,0|1,0,0]=3 13788 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccn2)Cl 11a_100000717755_100000740811 [0,2,0,0,0,0|2,0,0]=4 13789 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccn2)Cl 240690a_100000717755_100000740811 [0,2,0,0,0,0|2,0,0]=4 13790 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccn2)F 11a_100011217291_100000740811 [0,2,0,0,0,0|2,0,0]=4 13791 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccn2)F 240690a_100011217291_100000740811 [0,2,0,0,0,0|2,0,0]=4 13792 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccccn2)O 240690a_200009844824_100000740811 [0,2,0,0,0,0|2,0,0]=4 13793 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2cccnc2)Cl 11a_100000717755_100000735890 [0,2,0,0,0,0|2,0,0]=4 13794 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2cccnc2)Cl 240690a_100000717755_100000735890 [0,2,0,0,0,0|2,0,0]=4 13795 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2cccnc2)F 11a_100011217291_100000735890 [0,2,0,0,0,0|2,0,0]=4 13796 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2cccnc2)F 240690a_100011217291_100000735890 [0,2,0,0,0,0|2,0,0]=4 13797 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2cccnc2)O 240690a_200009844824_100000735890 [0,2,0,0,0,0|2,0,0]=4 13798 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccncc2)Cl 240690a_100000717755_100000682801 [0,2,0,0,0,0|2,0,0]=4 13799 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccncc2)F 240690a_100011217291_100000682801 [0,2,0,0,0,0|2,0,0]=4 13800 B21R2.225847 Cc1ccc(cc1CNC(=O)C=Cc2ccncc2)O 240690a_200009844824_100000682801 [0,2,0,0,0,0|2,0,0]=4 13801 B21R2.225847 Cc1ccc(cc1NCC(=O)OCc2ccccc2)Br 34a_100000741167_100000753625 [0,2,0,0,0,0|1,0,1]=4 13802 B21R2.225847 Cc1ccc(cc1NCC(=O)OCc2ccccc2)Br 7a_100000741167_100000753625 [0,2,0,0,0,0|1,0,1]=4 13803 B21R2.225847 Cc1ccc(cc1NCC(=O)OCc2ccccc2)Cl 34a_100000211374_100000753625 [0,2,0,0,0,0|1,0,1]=4 13804 B21R2.225847 Cc1ccc(cc1NCC(=O)OCc2ccccc2)Cl 7a_100000211374_100000753625 [0,2,0,0,0,0|1,0,1]=4 13805 B21R2.225847 Cc1ccc(cc1NCC(=O)OCc2ccccc2)F 34a_100000211107_100000753625 [0,2,0,0,0,0|1,0,1]=4 13806 B21R2.225847 Cc1ccc(cc1NCC(=O)OCc2ccccc2)F 7a_100000211107_100000753625 [0,2,0,0,0,0|1,0,1]=4 13807 B21R2.225847 Cc1ccc(cc1NCC(=O)OCc2ccccc2)I 7a_100000761890_100000753625 [0,2,0,0,0,0|1,0,1]=4 13808 B21R2.225847 Cc1ccc(cc1NCC(=O)OCc2ccccc2)O 34a_100011216113_100000753625 [0,2,0,0,0,0|1,0,1]=4 13809 B21R2.225847 Cc1ccc(cc1NNC(=O)C=Cc2ccccc2)Cl 22a_100020587667_100000210462 [0,2,0,0,0,0|2,0,0]=4 13810 B21R2.225847 Cc1ccc(cc1NNC(=O)C=Cc2ccccc2)F 22a_100011206524_100000210462 [0,2,0,0,0,0|2,0,0]=4 13811 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)Br 34a_100000685420_100000753625 [0,2,0,0,0,0|1,0,1]=4 13812 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)Br 7a_100000685420_100000753625 [0,2,0,0,0,0|1,0,1]=4 13813 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)Cl 34a_100000756515_100000753625 [0,2,0,0,0,0|1,0,1]=4 13814 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)Cl 7a_100000756515_100000753625 [0,2,0,0,0,0|1,0,1]=4 13815 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)F 34a_100000690566_100000753625 [0,2,0,0,0,0|1,0,1]=4 13816 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)F 7a_100000690566_100000753625 [0,2,0,0,0,0|1,0,1]=4 13817 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)I 7a_100000766334_100000753625 [0,2,0,0,0,0|1,0,1]=4 13818 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)N 34a_100000759471_100000753625 [0,2,0,0,0,0|1,0,1]=4 13819 B21R2.225847 Cc1ccc(cc1OCC(=O)OCc2ccccc2)N 7a_100000759471_100000753625 [0,2,0,0,0,0|1,0,1]=4 13820 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)Br 62a_100000753625_100011344865 [0,2,0,0,0,0|1,0,1]=4 13821 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)Br 62a_100011344865_100000753625 [0,2,0,0,0,0|1,0,1]=4 13822 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100011263213 [0,2,0,0,0,0|1,0,1]=4 13823 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)Cl 62a_100011263213_100000753625 [0,2,0,0,0,0|1,0,1]=4 13824 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)F 62a_100000753625_100011218078 [0,2,0,0,0,0|1,0,1]=4 13825 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)F 62a_100011218078_100000753625 [0,2,0,0,0,0|1,0,1]=4 13826 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)N 62a_100000736455_100000753625 [0,2,0,0,0,0|1,0,1]=4 13827 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)N 62a_100000753625_100000736455 [0,2,0,0,0,0|1,0,1]=4 13828 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)O 62a_100000753625_100011380479 [0,2,0,0,0,0|1,0,1]=4 13829 B21R2.225847 Cc1ccc(cc1SCC(=O)OCc2ccccc2)O 62a_100011380479_100000753625 [0,2,0,0,0,0|1,0,1]=4 13830 B21R2.225847 Nc1ccc(c(c1)OCC(=O)OCc2ccccc2)Cl 34a_100011934209_100000753625 [0,2,0,0,0,0|1,0,1]=4 13831 B21R2.225847 Nc1ccc(c(c1)OCC(=O)OCc2ccccc2)F 34a_100012017398_100000753625 [0,2,0,0,0,0|1,0,1]=4 13832 B21R2.225847 Nc1ccc(c(c1)OCC(=O)OCc2ccccc2)F 7a_100012017398_100000753625 [0,2,0,0,0,0|1,0,1]=4 13833 B21R2.225847 Nc1ccc(c(c1)OCC(=O)OCc2ccccc2)N 34a_100025717382_100000753625 [0,2,0,0,0,0|1,0,1]=4 13834 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)Br 62a_100000750459_100000753625 [0,2,0,0,0,0|1,0,1]=4 13835 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)Br 62a_100000753625_100000750459 [0,2,0,0,0,0|1,0,1]=4 13836 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100012360549 [0,2,0,0,0,0|1,0,1]=4 13837 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)Cl 62a_100012360549_100000753625 [0,2,0,0,0,0|1,0,1]=4 13838 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)F 62a_100000753625_100000760356 [0,2,0,0,0,0|1,0,1]=4 13839 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)F 62a_100000760356_100000753625 [0,2,0,0,0,0|1,0,1]=4 13840 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)N 62a_100000753625_100011534242 [0,2,0,0,0,0|1,0,1]=4 13841 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)N 62a_100011534242_100000753625 [0,2,0,0,0,0|1,0,1]=4 13842 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)O 62a_100000753625_100011534360 [0,2,0,0,0,0|1,0,1]=4 13843 B21R2.225847 Nc1ccc(c(c1)SCC(=O)OCc2ccccc2)O 62a_100011534360_100000753625 [0,2,0,0,0,0|1,0,1]=4 13844 B21R2.225847 Nc1ccc(cc1OCC(=O)OCc2ccccc2)Br 34a_100000739049_100000753625 [0,2,0,0,0,0|1,0,1]=4 13845 B21R2.225847 Nc1ccc(cc1OCC(=O)OCc2ccccc2)Br 7a_100000739049_100000753625 [0,2,0,0,0,0|1,0,1]=4 13846 B21R2.225847 Nc1ccc(cc1OCC(=O)OCc2ccccc2)Cl 34a_100000185728_100000753625 [0,2,0,0,0,0|1,0,1]=4 13847 B21R2.225847 Nc1ccc(cc1OCC(=O)OCc2ccccc2)Cl 7a_100000185728_100000753625 [0,2,0,0,0,0|1,0,1]=4 13848 B21R2.225847 Nc1ccc(cc1OCC(=O)OCc2ccccc2)F 34a_100000753323_100000753625 [0,2,0,0,0,0|1,0,1]=4 13849 B21R2.225847 Nc1ccc(cc1OCC(=O)OCc2ccccc2)F 7a_100000753323_100000753625 [0,2,0,0,0,0|1,0,1]=4 13850 B21R2.225847 Nc1ccc(cc1OCC(=O)OCc2ccccc2)I 34a_100000057187_100000753625 [0,2,0,0,0,0|1,0,1]=4 13851 B21R2.225847 Nc1ccc(cc1OCC(=O)OCc2ccccc2)I 7a_100000057187_100000753625 [0,2,0,0,0,0|1,0,1]=4 13852 B21R2.225847 Nc1ccc(cc1SCC(=O)OCc2ccccc2)Br 62a_100000187925_100000753625 [0,2,0,0,0,0|1,0,1]=4 13853 B21R2.225847 Nc1ccc(cc1SCC(=O)OCc2ccccc2)Br 62a_100000753625_100000187925 [0,2,0,0,0,0|1,0,1]=4 13854 B21R2.225847 Nc1ccc(cc1SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100000761889 [0,2,0,0,0,0|1,0,1]=4 13855 B21R2.225847 Nc1ccc(cc1SCC(=O)OCc2ccccc2)Cl 62a_100000761889_100000753625 [0,2,0,0,0,0|1,0,1]=4 13856 B21R2.225847 Nc1ccc(cc1SCC(=O)OCc2ccccc2)F 62a_100000753625_100000760547 [0,2,0,0,0,0|1,0,1]=4 13857 B21R2.225847 Nc1ccc(cc1SCC(=O)OCc2ccccc2)F 62a_100000760547_100000753625 [0,2,0,0,0,0|1,0,1]=4 13858 B21R2.225847 Nc1ccc(cc1SCC(=O)OCc2ccccc2)O 62a_100000753625_100012001276 [0,2,0,0,0,0|1,0,1]=4 13859 B21R2.225847 Nc1ccc(cc1SCC(=O)OCc2ccccc2)O 62a_100012001276_100000753625 [0,2,0,0,0,0|1,0,1]=4 13860 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)CCc2ccccc2 1458a_100102525183_100000765856 [0,2,0,0,0,0|1,0,0]=3 13861 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)CCc2ccccn2 1458a_100102525183_100015183660 [0,2,0,0,0,0|2,0,0]=4 13862 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)CCc2cccnc2 1458a_100102525183_200011713674 [0,2,0,0,0,0|2,0,0]=4 13863 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)CCc2ccncc2 1458a_100102525183_100000723409 [0,2,0,0,0,0|2,0,0]=4 13864 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccccc2 11a_100015324214_100102525183 [0,2,0,0,0,0|1,0,0]=3 13865 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccccc2 1626a_100015324214_100102525183 [0,2,0,0,0,0|1,0,0]=3 13866 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccccc2 240690a_100015324214_100102525183 [0,2,0,0,0,0|1,0,0]=3 13867 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccccn2 11a_100000210449_100102525183 [0,2,0,0,0,0|2,0,0]=4 13868 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccccn2 1626a_100000210449_100102525183 [0,2,0,0,0,0|2,0,0]=4 13869 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccccn2 240690a_100000210449_100102525183 [0,2,0,0,0,0|2,0,0]=4 13870 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2cccnc2 11a_100000210453_100102525183 [0,2,0,0,0,0|2,0,0]=4 13871 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2cccnc2 240690a_100000210453_100102525183 [0,2,0,0,0,0|2,0,0]=4 13872 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccncc2 11a_100000210450_100102525183 [0,2,0,0,0,0|2,0,0]=4 13873 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccncc2 1626a_100000210450_100102525183 [0,2,0,0,0,0|2,0,0]=4 13874 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NCc2ccncc2 240690a_100000210450_100102525183 [0,2,0,0,0,0|2,0,0]=4 13875 B21R2.225847 O=C(C=Cc1cc(ccc1Br)F)NNc2ccccc2 22a_100015195140_100102525183 [0,2,0,0,0,0|2,0,0]=4 13876 B21R2.225847 O=C(C=Cc1cc(ccc1Br)I)CCc2ccccc2 6a_100010185652_100000210092 [0,2,0,0,0,0|1,0,0]=3 13877 B21R2.225847 O=C(C=Cc1cc(ccc1Br)I)COc2ccccc2 6a_100010185652_100000150576 [0,2,0,0,0,0|2,0,0]=4 13878 B21R2.225847 O=C(C=Cc1cc(ccc1Br)I)CSc2ccccc2 6a_100010185652_100000150717 [0,2,0,0,0,0|2,0,0]=4 13879 B21R2.225847 O=C(C=Cc1cc(ccc1Br)O)NCc2ccccc2 240690a_100015324214_200159324452 [0,2,0,0,0,0|1,0,0]=3 13880 B21R2.225847 O=C(C=Cc1cc(ccc1Br)O)NCc2ccccn2 240690a_100000210449_200159324452 [0,2,0,0,0,0|2,0,0]=4 13881 B21R2.225847 O=C(C=Cc1cc(ccc1Br)O)NCc2cccnc2 240690a_100000210453_200159324452 [0,2,0,0,0,0|2,0,0]=4 13882 B21R2.225847 O=C(C=Cc1cc(ccc1Br)O)NCc2ccncc2 240690a_100000210450_200159324452 [0,2,0,0,0,0|2,0,0]=4 13883 B21R2.225847 O=C(C=Cc1cc(ccc1Br)O)NNc2ccccc2 22a_100015195140_200159324452 [0,2,0,0,0,0|2,0,0]=4 13884 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)CCc2ccccc2 1458a_100000234794_100000765856 [0,2,0,0,0,0|1,0,0]=3 13885 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)CCc2ccccn2 1458a_100000234794_100015183660 [0,2,0,0,0,0|2,0,0]=4 13886 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)CCc2cccnc2 1458a_100000234794_200011713674 [0,2,0,0,0,0|2,0,0]=4 13887 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)CCc2ccncc2 1458a_100000234794_100000723409 [0,2,0,0,0,0|2,0,0]=4 13888 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccccc2 11a_100015324214_100000234794 [0,2,0,0,0,0|1,0,0]=3 13889 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccccc2 1626a_100015324214_100000234794 [0,2,0,0,0,0|1,0,0]=3 13890 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccccc2 240690a_100015324214_100000234794 [0,2,0,0,0,0|1,0,0]=3 13891 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccccn2 11a_100000210449_100000234794 [0,2,0,0,0,0|2,0,0]=4 13892 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccccn2 1626a_100000210449_100000234794 [0,2,0,0,0,0|2,0,0]=4 13893 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccccn2 240690a_100000210449_100000234794 [0,2,0,0,0,0|2,0,0]=4 13894 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2cccnc2 11a_100000210453_100000234794 [0,2,0,0,0,0|2,0,0]=4 13895 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2cccnc2 240690a_100000210453_100000234794 [0,2,0,0,0,0|2,0,0]=4 13896 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccncc2 11a_100000210450_100000234794 [0,2,0,0,0,0|2,0,0]=4 13897 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccncc2 1626a_100000210450_100000234794 [0,2,0,0,0,0|2,0,0]=4 13898 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NCc2ccncc2 240690a_100000210450_100000234794 [0,2,0,0,0,0|2,0,0]=4 13899 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)Cl)NNc2ccccc2 22a_100015195140_100000234794 [0,2,0,0,0,0|2,0,0]=4 13900 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)I)CCc2ccccc2 6a_100010254384_100000210092 [0,2,0,0,0,0|1,0,0]=3 13901 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)I)COc2ccccc2 6a_100010254384_100000150576 [0,2,0,0,0,0|2,0,0]=4 13902 B21R2.225847 O=C(C=Cc1cc(ccc1Cl)I)CSc2ccccc2 6a_100010254384_100000150717 [0,2,0,0,0,0|2,0,0]=4 13903 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)CCc2ccccc2 1458a_100000718207_100000765856 [0,2,0,0,0,0|1,0,0]=3 13904 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)CCc2ccccc2 6a_100000211465_100000210092 [0,2,0,0,0,0|1,0,0]=3 13905 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)CCc2ccccn2 1458a_100000718207_100015183660 [0,2,0,0,0,0|2,0,0]=4 13906 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)CCc2cccnc2 1458a_100000718207_200011713674 [0,2,0,0,0,0|2,0,0]=4 13907 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)CCc2ccncc2 1458a_100000718207_100000723409 [0,2,0,0,0,0|2,0,0]=4 13908 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)COc2ccccc2 6a_100000211465_100000150576 [0,2,0,0,0,0|2,0,0]=4 13909 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)CSc2ccccc2 6a_100000211465_100000150717 [0,2,0,0,0,0|2,0,0]=4 13910 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccccc2 11a_100015324214_100000718207 [0,2,0,0,0,0|1,0,0]=3 13911 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccccc2 1626a_100015324214_100000718207 [0,2,0,0,0,0|1,0,0]=3 13912 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccccc2 240690a_100015324214_100000718207 [0,2,0,0,0,0|1,0,0]=3 13913 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccccn2 11a_100000210449_100000718207 [0,2,0,0,0,0|2,0,0]=4 13914 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccccn2 1626a_100000210449_100000718207 [0,2,0,0,0,0|2,0,0]=4 13915 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccccn2 240690a_100000210449_100000718207 [0,2,0,0,0,0|2,0,0]=4 13916 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2cccnc2 11a_100000210453_100000718207 [0,2,0,0,0,0|2,0,0]=4 13917 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2cccnc2 240690a_100000210453_100000718207 [0,2,0,0,0,0|2,0,0]=4 13918 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccncc2 11a_100000210450_100000718207 [0,2,0,0,0,0|2,0,0]=4 13919 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccncc2 1626a_100000210450_100000718207 [0,2,0,0,0,0|2,0,0]=4 13920 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NCc2ccncc2 240690a_100000210450_100000718207 [0,2,0,0,0,0|2,0,0]=4 13921 B21R2.225847 O=C(C=Cc1cc(ccc1F)Br)NNc2ccccc2 22a_100015195140_100000718207 [0,2,0,0,0,0|2,0,0]=4 13922 B21R2.225847 O=C(C=Cc1cc(ccc1F)Cl)CCc2ccccc2 6a_100000745245_100000210092 [0,2,0,0,0,0|1,0,0]=3 13923 B21R2.225847 O=C(C=Cc1cc(ccc1F)Cl)COc2ccccc2 6a_100000745245_100000150576 [0,2,0,0,0,0|2,0,0]=4 13924 B21R2.225847 O=C(C=Cc1cc(ccc1F)Cl)CSc2ccccc2 6a_100000745245_100000150717 [0,2,0,0,0,0|2,0,0]=4 13925 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)CCc2ccccc2 1458a_100000744626_100000765856 [0,2,0,0,0,0|1,0,0]=3 13926 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)CCc2ccccc2 6a_100000740046_100000210092 [0,2,0,0,0,0|1,0,0]=3 13927 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)CCc2ccccn2 1458a_100000744626_100015183660 [0,2,0,0,0,0|2,0,0]=4 13928 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)CCc2cccnc2 1458a_100000744626_200011713674 [0,2,0,0,0,0|2,0,0]=4 13929 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)CCc2ccncc2 1458a_100000744626_100000723409 [0,2,0,0,0,0|2,0,0]=4 13930 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)COc2ccccc2 6a_100000740046_100000150576 [0,2,0,0,0,0|2,0,0]=4 13931 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)CSc2ccccc2 6a_100000740046_100000150717 [0,2,0,0,0,0|2,0,0]=4 13932 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccccc2 11a_100015324214_100000744626 [0,2,0,0,0,0|1,0,0]=3 13933 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccccc2 1626a_100015324214_100000744626 [0,2,0,0,0,0|1,0,0]=3 13934 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccccc2 240690a_100015324214_100000744626 [0,2,0,0,0,0|1,0,0]=3 13935 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccccn2 11a_100000210449_100000744626 [0,2,0,0,0,0|2,0,0]=4 13936 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccccn2 1626a_100000210449_100000744626 [0,2,0,0,0,0|2,0,0]=4 13937 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccccn2 240690a_100000210449_100000744626 [0,2,0,0,0,0|2,0,0]=4 13938 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2cccnc2 11a_100000210453_100000744626 [0,2,0,0,0,0|2,0,0]=4 13939 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2cccnc2 240690a_100000210453_100000744626 [0,2,0,0,0,0|2,0,0]=4 13940 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccncc2 11a_100000210450_100000744626 [0,2,0,0,0,0|2,0,0]=4 13941 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccncc2 1626a_100000210450_100000744626 [0,2,0,0,0,0|2,0,0]=4 13942 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NCc2ccncc2 240690a_100000210450_100000744626 [0,2,0,0,0,0|2,0,0]=4 13943 B21R2.225847 O=C(C=Cc1cc(ccc1F)F)NNc2ccccc2 22a_100015195140_100000744626 [0,2,0,0,0,0|2,0,0]=4 13944 B21R2.225847 O=C(C=Cc1cc(ccc1F)I)CCc2ccccc2 6a_100000050626_100000210092 [0,2,0,0,0,0|1,0,0]=3 13945 B21R2.225847 O=C(C=Cc1cc(ccc1F)I)COc2ccccc2 6a_100000050626_100000150576 [0,2,0,0,0,0|2,0,0]=4 13946 B21R2.225847 O=C(C=Cc1cc(ccc1F)I)CSc2ccccc2 6a_100000050626_100000150717 [0,2,0,0,0,0|2,0,0]=4 13947 B21R2.225847 O=C(C=Cc1cc(ccc1I)Br)CCc2ccccc2 6a_100010185651_100000210092 [0,2,0,0,0,0|1,0,0]=3 13948 B21R2.225847 O=C(C=Cc1cc(ccc1I)Br)COc2ccccc2 6a_100010185651_100000150576 [0,2,0,0,0,0|2,0,0]=4 13949 B21R2.225847 O=C(C=Cc1cc(ccc1I)Br)CSc2ccccc2 6a_100010185651_100000150717 [0,2,0,0,0,0|2,0,0]=4 13950 B21R2.225847 O=C(C=Cc1cc(ccc1I)Cl)CCc2ccccc2 6a_100010254386_100000210092 [0,2,0,0,0,0|1,0,0]=3 13951 B21R2.225847 O=C(C=Cc1cc(ccc1I)Cl)COc2ccccc2 6a_100010254386_100000150576 [0,2,0,0,0,0|2,0,0]=4 13952 B21R2.225847 O=C(C=Cc1cc(ccc1I)Cl)CSc2ccccc2 6a_100010254386_100000150717 [0,2,0,0,0,0|2,0,0]=4 13953 B21R2.225847 O=C(C=Cc1cc(ccc1I)F)CCc2ccccc2 6a_100010186294_100000210092 [0,2,0,0,0,0|1,0,0]=3 13954 B21R2.225847 O=C(C=Cc1cc(ccc1I)F)COc2ccccc2 6a_100010186294_100000150576 [0,2,0,0,0,0|2,0,0]=4 13955 B21R2.225847 O=C(C=Cc1cc(ccc1I)F)CSc2ccccc2 6a_100010186294_100000150717 [0,2,0,0,0,0|2,0,0]=4 13956 B21R2.225847 O=C(C=Cc1cc(ccc1I)O)CCc2ccccc2 6a_100000069132_100000210092 [0,2,0,0,0,0|1,0,0]=3 13957 B21R2.225847 O=C(C=Cc1cc(ccc1I)O)COc2ccccc2 6a_100000069132_100000150576 [0,2,0,0,0,0|2,0,0]=4 13958 B21R2.225847 O=C(C=Cc1cc(ccc1I)O)CSc2ccccc2 6a_100000069132_100000150717 [0,2,0,0,0,0|2,0,0]=4 13959 B21R2.225847 O=C(C=Cc1cc(ccc1O)I)CCc2ccccc2 6a_100011215628_100000210092 [0,2,0,0,0,0|1,0,0]=3 13960 B21R2.225847 O=C(C=Cc1cc(ccc1O)I)COc2ccccc2 6a_100011215628_100000150576 [0,2,0,0,0,0|2,0,0]=4 13961 B21R2.225847 O=C(C=Cc1cc(ccc1O)I)CSc2ccccc2 6a_100011215628_100000150717 [0,2,0,0,0,0|2,0,0]=4 13962 B21R2.225847 O=C(C=Cc1cc(ncc1Br)I)CCc2ccccc2 6a_200135154921_100000210092 [0,2,0,0,0,0|2,0,0]=4 13963 B21R2.225847 O=C(C=Cc1cc(ncc1F)Br)CCc2ccccc2 6a_100000707870_100000210092 [0,2,0,0,0,0|2,0,0]=4 13964 B21R2.225847 O=C(C=Cc1cc(ncc1F)F)CCc2ccccc2 6a_100000731253_100000210092 [0,2,0,0,0,0|2,0,0]=4 13965 B21R2.225847 O=C(C=Cc1ccccc1)CCc2cc(ccc2F)F 1458a_100000210462_100011755056 [0,2,0,0,0,0|1,0,0]=3 13966 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Br)Br 11a_100000707832_100000210462 [0,2,0,0,0,0|1,0,0]=3 13967 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Br)Br 1626a_100000707832_100000210462 [0,2,0,0,0,0|1,0,0]=3 13968 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Br)F 11a_100000742738_100000210462 [0,2,0,0,0,0|1,0,0]=3 13969 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Br)F 1626a_100000742738_100000210462 [0,2,0,0,0,0|1,0,0]=3 13970 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Cl)Br 11a_100025772652_100000210462 [0,2,0,0,0,0|1,0,0]=3 13971 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Cl)Br 1626a_100025772652_100000210462 [0,2,0,0,0,0|1,0,0]=3 13972 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Cl)Cl 11a_100102946428_100000210462 [0,2,0,0,0,0|1,0,0]=3 13973 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Cl)Cl 1626a_100102946428_100000210462 [0,2,0,0,0,0|1,0,0]=3 13974 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Cl)F 11a_100011830483_100000210462 [0,2,0,0,0,0|1,0,0]=3 13975 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2Cl)F 1626a_100011830483_100000210462 [0,2,0,0,0,0|1,0,0]=3 13976 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2F)Br 11a_100009815772_100000210462 [0,2,0,0,0,0|1,0,0]=3 13977 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2F)Br 1626a_100009815772_100000210462 [0,2,0,0,0,0|1,0,0]=3 13978 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2F)Cl 11a_100011211646_100000210462 [0,2,0,0,0,0|1,0,0]=3 13979 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2F)Cl 1626a_100011211646_100000210462 [0,2,0,0,0,0|1,0,0]=3 13980 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2F)F 11a_100000752317_100000210462 [0,2,0,0,0,0|1,0,0]=3 13981 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(ccc2F)F 1626a_100000752317_100000210462 [0,2,0,0,0,0|1,0,0]=3 13982 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(cnc2Br)F 11a_100010760786_100000210462 [0,2,0,0,0,0|2,0,0]=4 13983 B21R2.225847 O=C(C=Cc1ccccc1)NCc2cc(cnc2Br)F 1626a_100010760786_100000210462 [0,2,0,0,0,0|2,0,0]=4 13984 B21R2.225847 O=C(C=Cc1ccccc1)NCc2nc(ccc2F)Cl 11a_100009887702_100000210462 [0,2,0,0,0,0|2,0,0]=4 13985 B21R2.225847 O=C(C=Cc1ccccc1)NCc2nc(ccc2F)Cl 1626a_100009887702_100000210462 [0,2,0,0,0,0|2,0,0]=4 13986 B21R2.225847 O=C(C=Cc1ccccc1)NNc2cc(ccc2Br)Br 22a_200011483129_100000210462 [0,2,0,0,0,0|2,0,0]=4 13987 B21R2.225847 O=C(C=Cc1ccccc1)NNc2cc(ccc2Br)F 22a_100012362518_100000210462 [0,2,0,0,0,0|2,0,0]=4 13988 B21R2.225847 O=C(C=Cc1ccccc1)NNc2cc(ccc2Cl)Cl 22a_100000765587_100000210462 [0,2,0,0,0,0|2,0,0]=4 13989 B21R2.225847 O=C(C=Cc1ccccc1)NNc2cc(ccc2Cl)F 22a_100016987657_100000210462 [0,2,0,0,0,0|2,0,0]=4 13990 B21R2.225847 O=C(C=Cc1ccccc1)NNc2cc(ccc2F)Br 22a_100020610843_100000210462 [0,2,0,0,0,0|2,0,0]=4 13991 B21R2.225847 O=C(C=Cc1ccccc1)NNc2cc(ccc2F)Cl 22a_100016987663_100000210462 [0,2,0,0,0,0|2,0,0]=4 13992 B21R2.225847 O=C(C=Cc1ccccc1)NNc2cc(ccc2F)F 22a_100000005413_100000210462 [0,2,0,0,0,0|2,0,0]=4 13993 B21R2.225847 O=C(C=Cc1ccccn1)CCc2cc(ccc2F)F 1458a_100000740811_100011755056 [0,2,0,0,0,0|2,0,0]=4 13994 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Br)Br 11a_100000707832_100000740811 [0,2,0,0,0,0|2,0,0]=4 13995 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Br)Br 240690a_100000707832_100000740811 [0,2,0,0,0,0|2,0,0]=4 13996 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Br)F 11a_100000742738_100000740811 [0,2,0,0,0,0|2,0,0]=4 13997 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Br)F 240690a_100000742738_100000740811 [0,2,0,0,0,0|2,0,0]=4 13998 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Cl)Br 11a_100025772652_100000740811 [0,2,0,0,0,0|2,0,0]=4 13999 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Cl)Br 240690a_100025772652_100000740811 [0,2,0,0,0,0|2,0,0]=4 14000 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Cl)Cl 11a_100102946428_100000740811 [0,2,0,0,0,0|2,0,0]=4 14001 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Cl)Cl 240690a_100102946428_100000740811 [0,2,0,0,0,0|2,0,0]=4 14002 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Cl)F 11a_100011830483_100000740811 [0,2,0,0,0,0|2,0,0]=4 14003 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2Cl)F 240690a_100011830483_100000740811 [0,2,0,0,0,0|2,0,0]=4 14004 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2F)Br 11a_100009815772_100000740811 [0,2,0,0,0,0|2,0,0]=4 14005 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2F)Br 240690a_100009815772_100000740811 [0,2,0,0,0,0|2,0,0]=4 14006 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2F)Cl 11a_100011211646_100000740811 [0,2,0,0,0,0|2,0,0]=4 14007 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2F)Cl 240690a_100011211646_100000740811 [0,2,0,0,0,0|2,0,0]=4 14008 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2F)F 11a_100000752317_100000740811 [0,2,0,0,0,0|2,0,0]=4 14009 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2F)F 240690a_100000752317_100000740811 [0,2,0,0,0,0|2,0,0]=4 14010 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2O)Br 240690a_100000730032_100000740811 [0,2,0,0,0,0|2,0,0]=4 14011 B21R2.225847 O=C(C=Cc1ccccn1)NCc2cc(ccc2O)Cl 240690a_100000238540_100000740811 [0,2,0,0,0,0|2,0,0]=4 14012 B21R2.225847 O=C(C=Cc1cccnc1)CCc2cc(ccc2F)F 1458a_100000735890_100011755056 [0,2,0,0,0,0|2,0,0]=4 14013 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Br)Br 11a_100000707832_100000735890 [0,2,0,0,0,0|2,0,0]=4 14014 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Br)Br 240690a_100000707832_100000735890 [0,2,0,0,0,0|2,0,0]=4 14015 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Br)F 11a_100000742738_100000735890 [0,2,0,0,0,0|2,0,0]=4 14016 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Br)F 240690a_100000742738_100000735890 [0,2,0,0,0,0|2,0,0]=4 14017 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Cl)Br 11a_100025772652_100000735890 [0,2,0,0,0,0|2,0,0]=4 14018 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Cl)Br 240690a_100025772652_100000735890 [0,2,0,0,0,0|2,0,0]=4 14019 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Cl)Cl 11a_100102946428_100000735890 [0,2,0,0,0,0|2,0,0]=4 14020 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Cl)Cl 240690a_100102946428_100000735890 [0,2,0,0,0,0|2,0,0]=4 14021 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Cl)F 11a_100011830483_100000735890 [0,2,0,0,0,0|2,0,0]=4 14022 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2Cl)F 240690a_100011830483_100000735890 [0,2,0,0,0,0|2,0,0]=4 14023 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2F)Br 11a_100009815772_100000735890 [0,2,0,0,0,0|2,0,0]=4 14024 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2F)Br 240690a_100009815772_100000735890 [0,2,0,0,0,0|2,0,0]=4 14025 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2F)Cl 11a_100011211646_100000735890 [0,2,0,0,0,0|2,0,0]=4 14026 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2F)Cl 240690a_100011211646_100000735890 [0,2,0,0,0,0|2,0,0]=4 14027 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2F)F 11a_100000752317_100000735890 [0,2,0,0,0,0|2,0,0]=4 14028 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2F)F 240690a_100000752317_100000735890 [0,2,0,0,0,0|2,0,0]=4 14029 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2O)Br 240690a_100000730032_100000735890 [0,2,0,0,0,0|2,0,0]=4 14030 B21R2.225847 O=C(C=Cc1cccnc1)NCc2cc(ccc2O)Cl 240690a_100000238540_100000735890 [0,2,0,0,0,0|2,0,0]=4 14031 B21R2.225847 O=C(C=Cc1ccncc1)CCc2cc(ccc2F)F 1458a_100000682801_100011755056 [0,2,0,0,0,0|2,0,0]=4 14032 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2Br)Br 240690a_100000707832_100000682801 [0,2,0,0,0,0|2,0,0]=4 14033 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2Br)F 240690a_100000742738_100000682801 [0,2,0,0,0,0|2,0,0]=4 14034 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2Cl)Br 240690a_100025772652_100000682801 [0,2,0,0,0,0|2,0,0]=4 14035 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2Cl)Cl 240690a_100102946428_100000682801 [0,2,0,0,0,0|2,0,0]=4 14036 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2Cl)F 240690a_100011830483_100000682801 [0,2,0,0,0,0|2,0,0]=4 14037 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2F)Br 240690a_100009815772_100000682801 [0,2,0,0,0,0|2,0,0]=4 14038 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2F)Cl 240690a_100011211646_100000682801 [0,2,0,0,0,0|2,0,0]=4 14039 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2F)F 240690a_100000752317_100000682801 [0,2,0,0,0,0|2,0,0]=4 14040 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2O)Br 240690a_100000730032_100000682801 [0,2,0,0,0,0|2,0,0]=4 14041 B21R2.225847 O=C(C=Cc1ccncc1)NCc2cc(ccc2O)Cl 240690a_100000238540_100000682801 [0,2,0,0,0,0|2,0,0]=4 14042 B21R2.225847 O=C(CNc1cc(ccc1Br)Br)OCc2ccccc2 34a_100000737762_100000753625 [0,2,0,0,0,0|1,0,1]=4 14043 B21R2.225847 O=C(CNc1cc(ccc1Br)Cl)OCc2ccccc2 34a_100000687073_100000753625 [0,2,0,0,0,0|1,0,1]=4 14044 B21R2.225847 O=C(CNc1cc(ccc1Br)F)OCc2ccccc2 34a_100000687223_100000753625 [0,2,0,0,0,0|1,0,1]=4 14045 B21R2.225847 O=C(CNc1cc(ccc1Br)O)OCc2ccccc2 34a_100011999798_100000753625 [0,2,0,0,0,0|1,0,1]=4 14046 B21R2.225847 O=C(CNc1cc(ccc1Cl)Br)OCc2ccccc2 34a_100000750497_100000753625 [0,2,0,0,0,0|1,0,1]=4 14047 B21R2.225847 O=C(CNc1cc(ccc1Cl)Cl)OCc2ccccc2 34a_100000184485_100000753625 [0,2,0,0,0,0|1,0,1]=4 14048 B21R2.225847 O=C(CNc1cc(ccc1Cl)F)OCc2ccccc2 34a_100000751338_100000753625 [0,2,0,0,0,0|1,0,1]=4 14049 B21R2.225847 O=C(CNc1cc(ccc1Cl)I)OCc2ccccc2 34a_200000761891_100000753625 [0,2,0,0,0,0|1,0,1]=4 14050 B21R2.225847 O=C(CNc1cc(ccc1Cl)O)OCc2ccccc2 34a_100011934297_100000753625 [0,2,0,0,0,0|1,0,1]=4 14051 B21R2.225847 O=C(CNc1cc(ccc1F)Br)OCc2ccccc2 34a_100000740924_100000753625 [0,2,0,0,0,0|1,0,1]=4 14052 B21R2.225847 O=C(CNc1cc(ccc1F)Cl)OCc2ccccc2 34a_100000212115_100000753625 [0,2,0,0,0,0|1,0,1]=4 14053 B21R2.225847 O=C(CNc1cc(ccc1F)F)OCc2ccccc2 34a_100000210742_100000753625 [0,2,0,0,0,0|1,0,1]=4 14054 B21R2.225847 O=C(CNc1cc(ccc1F)I)OCc2ccccc2 34a_100011464823_100000753625 [0,2,0,0,0,0|1,0,1]=4 14055 B21R2.225847 O=C(CNc1cc(ccc1F)O)OCc2ccccc2 34a_100012017239_100000753625 [0,2,0,0,0,0|1,0,1]=4 14056 B21R2.225847 O=C(CNc1cc(ccc1I)Br)OCc2ccccc2 34a_100000743836_100000753625 [0,2,0,0,0,0|1,0,1]=4 14057 B21R2.225847 O=C(CNc1cc(ccc1I)Cl)OCc2ccccc2 34a_100000761886_100000753625 [0,2,0,0,0,0|1,0,1]=4 14058 B21R2.225847 O=C(CNc1cc(ccc1I)F)OCc2ccccc2 34a_100011218093_100000753625 [0,2,0,0,0,0|1,0,1]=4 14059 B21R2.225847 O=C(CNc1cc(ccc1O)Br)OCc2ccccc2 34a_100000752626_100000753625 [0,2,0,0,0,0|1,0,1]=4 14060 B21R2.225847 O=C(CNc1cc(ccc1O)Cl)OCc2ccccc2 34a_100000210500_100000753625 [0,2,0,0,0,0|1,0,1]=4 14061 B21R2.225847 O=C(CNc1cc(ccc1O)F)OCc2ccccc2 34a_100000759472_100000753625 [0,2,0,0,0,0|1,0,1]=4 14062 B21R2.225847 O=C(COc1cc(ccc1Br)Br)OCc2ccccc2 34a_100011220040_100000753625 [0,2,0,0,0,0|1,0,1]=4 14063 B21R2.225847 O=C(COc1cc(ccc1Br)Br)OCc2ccccc2 7a_100011220040_100000753625 [0,2,0,0,0,0|1,0,1]=4 14064 B21R2.225847 O=C(COc1cc(ccc1Br)Cl)OCc2ccccc2 34a_100012339455_100000753625 [0,2,0,0,0,0|1,0,1]=4 14065 B21R2.225847 O=C(COc1cc(ccc1Br)Cl)OCc2ccccc2 7a_100012339455_100000753625 [0,2,0,0,0,0|1,0,1]=4 14066 B21R2.225847 O=C(COc1cc(ccc1Br)F)OCc2ccccc2 34a_100000690578_100000753625 [0,2,0,0,0,0|1,0,1]=4 14067 B21R2.225847 O=C(COc1cc(ccc1Br)F)OCc2ccccc2 7a_100000690578_100000753625 [0,2,0,0,0,0|1,0,1]=4 14068 B21R2.225847 O=C(COc1cc(ccc1Br)I)OCc2ccccc2 34a_100012356990_100000753625 [0,2,0,0,0,0|1,0,1]=4 14069 B21R2.225847 O=C(COc1cc(ccc1Br)I)OCc2ccccc2 7a_100012356990_100000753625 [0,2,0,0,0,0|1,0,1]=4 14070 B21R2.225847 O=C(COc1cc(ccc1Cl)Br)OCc2ccccc2 34a_100000738945_100000753625 [0,2,0,0,0,0|1,0,1]=4 14071 B21R2.225847 O=C(COc1cc(ccc1Cl)Br)OCc2ccccc2 7a_100000738945_100000753625 [0,2,0,0,0,0|1,0,1]=4 14072 B21R2.225847 O=C(COc1cc(ccc1Cl)Cl)OCc2ccccc2 34a_100000211422_100000753625 [0,2,0,0,0,0|1,0,1]=4 14073 B21R2.225847 O=C(COc1cc(ccc1Cl)Cl)OCc2ccccc2 7a_100000211422_100000753625 [0,2,0,0,0,0|1,0,1]=4 14074 B21R2.225847 O=C(COc1cc(ccc1Cl)F)OCc2ccccc2 34a_100000692107_100000753625 [0,2,0,0,0,0|1,0,1]=4 14075 B21R2.225847 O=C(COc1cc(ccc1Cl)F)OCc2ccccc2 7a_100000692107_100000753625 [0,2,0,0,0,0|1,0,1]=4 14076 B21R2.225847 O=C(COc1cc(ccc1Cl)I)OCc2ccccc2 34a_100011356854_100000753625 [0,2,0,0,0,0|1,0,1]=4 14077 B21R2.225847 O=C(COc1cc(ccc1Cl)I)OCc2ccccc2 7a_100011356854_100000753625 [0,2,0,0,0,0|1,0,1]=4 14078 B21R2.225847 O=C(COc1cc(ccc1F)Br)OCc2ccccc2 34a_100000686035_100000753625 [0,2,0,0,0,0|1,0,1]=4 14079 B21R2.225847 O=C(COc1cc(ccc1F)Br)OCc2ccccc2 7a_100000686035_100000753625 [0,2,0,0,0,0|1,0,1]=4 14080 B21R2.225847 O=C(COc1cc(ccc1F)Cl)OCc2ccccc2 34a_100000757397_100000753625 [0,2,0,0,0,0|1,0,1]=4 14081 B21R2.225847 O=C(COc1cc(ccc1F)Cl)OCc2ccccc2 7a_100000757397_100000753625 [0,2,0,0,0,0|1,0,1]=4 14082 B21R2.225847 O=C(COc1cc(ccc1F)F)OCc2ccccc2 34a_100000752141_100000753625 [0,2,0,0,0,0|1,0,1]=4 14083 B21R2.225847 O=C(COc1cc(ccc1F)F)OCc2ccccc2 7a_100000752141_100000753625 [0,2,0,0,0,0|1,0,1]=4 14084 B21R2.225847 O=C(COc1cc(ccc1F)I)OCc2ccccc2 34a_100009958187_100000753625 [0,2,0,0,0,0|1,0,1]=4 14085 B21R2.225847 O=C(COc1cc(ccc1F)I)OCc2ccccc2 7a_100009958187_100000753625 [0,2,0,0,0,0|1,0,1]=4 14086 B21R2.225847 O=C(COc1cc(ccc1I)Br)OCc2ccccc2 34a_100012344904_100000753625 [0,2,0,0,0,0|1,0,1]=4 14087 B21R2.225847 O=C(COc1cc(ccc1I)Br)OCc2ccccc2 7a_100012344904_100000753625 [0,2,0,0,0,0|1,0,1]=4 14088 B21R2.225847 O=C(COc1cc(ccc1I)Cl)OCc2ccccc2 34a_100000050036_100000753625 [0,2,0,0,0,0|1,0,1]=4 14089 B21R2.225847 O=C(COc1cc(ccc1I)Cl)OCc2ccccc2 7a_100000050036_100000753625 [0,2,0,0,0,0|1,0,1]=4 14090 B21R2.225847 O=C(COc1cc(ccc1I)F)OCc2ccccc2 34a_100010084537_100000753625 [0,2,0,0,0,0|1,0,1]=4 14091 B21R2.225847 O=C(COc1cc(ccc1I)F)OCc2ccccc2 7a_100010084537_100000753625 [0,2,0,0,0,0|1,0,1]=4 14092 B21R2.225847 O=C(CSc1cc(ccc1Br)Br)OCc2ccccc2 62a_100000753625_100011483371 [0,2,0,0,0,0|1,0,1]=4 14093 B21R2.225847 O=C(CSc1cc(ccc1Br)Br)OCc2ccccc2 62a_100011483371_100000753625 [0,2,0,0,0,0|1,0,1]=4 14094 B21R2.225847 O=C(CSc1cc(ccc1Br)Cl)OCc2ccccc2 62a_100000753625_100012339723 [0,2,0,0,0,0|1,0,1]=4 14095 B21R2.225847 O=C(CSc1cc(ccc1Br)Cl)OCc2ccccc2 62a_100012339723_100000753625 [0,2,0,0,0,0|1,0,1]=4 14096 B21R2.225847 O=C(CSc1cc(ccc1Br)F)OCc2ccccc2 62a_100000753625_100011217576 [0,2,0,0,0,0|1,0,1]=4 14097 B21R2.225847 O=C(CSc1cc(ccc1Br)F)OCc2ccccc2 62a_100011217576_100000753625 [0,2,0,0,0,0|1,0,1]=4 14098 B21R2.225847 O=C(CSc1cc(ccc1Br)O)OCc2ccccc2 62a_100000753625_100012339312 [0,2,0,0,0,0|1,0,1]=4 14099 B21R2.225847 O=C(CSc1cc(ccc1Br)O)OCc2ccccc2 62a_100012339312_100000753625 [0,2,0,0,0,0|1,0,1]=4 14100 B21R2.225847 O=C(CSc1cc(ccc1Cl)Br)OCc2ccccc2 62a_100000753625_100011772130 [0,2,0,0,0,0|1,0,1]=4 14101 B21R2.225847 O=C(CSc1cc(ccc1Cl)Br)OCc2ccccc2 62a_100011772130_100000753625 [0,2,0,0,0,0|1,0,1]=4 14102 B21R2.225847 O=C(CSc1cc(ccc1Cl)Cl)OCc2ccccc2 62a_100000707729_100000753625 [0,2,0,0,0,0|1,0,1]=4 14103 B21R2.225847 O=C(CSc1cc(ccc1Cl)Cl)OCc2ccccc2 62a_100000753625_100000707729 [0,2,0,0,0,0|1,0,1]=4 14104 B21R2.225847 O=C(CSc1cc(ccc1Cl)F)OCc2ccccc2 62a_100000753625_100011217299 [0,2,0,0,0,0|1,0,1]=4 14105 B21R2.225847 O=C(CSc1cc(ccc1Cl)F)OCc2ccccc2 62a_100011217299_100000753625 [0,2,0,0,0,0|1,0,1]=4 14106 B21R2.225847 O=C(CSc1cc(ccc1Cl)O)OCc2ccccc2 62a_100000049588_100000753625 [0,2,0,0,0,0|1,0,1]=4 14107 B21R2.225847 O=C(CSc1cc(ccc1Cl)O)OCc2ccccc2 62a_100000753625_100000049588 [0,2,0,0,0,0|1,0,1]=4 14108 B21R2.225847 O=C(CSc1cc(ccc1F)Br)OCc2ccccc2 62a_100000753625_100011217312 [0,2,0,0,0,0|1,0,1]=4 14109 B21R2.225847 O=C(CSc1cc(ccc1F)Br)OCc2ccccc2 62a_100011217312_100000753625 [0,2,0,0,0,0|1,0,1]=4 14110 B21R2.225847 O=C(CSc1cc(ccc1F)Cl)OCc2ccccc2 62a_100000753625_100011218116 [0,2,0,0,0,0|1,0,1]=4 14111 B21R2.225847 O=C(CSc1cc(ccc1F)Cl)OCc2ccccc2 62a_100011218116_100000753625 [0,2,0,0,0,0|1,0,1]=4 14112 B21R2.225847 O=C(CSc1cc(ccc1F)F)OCc2ccccc2 62a_100000753625_100011219198 [0,2,0,0,0,0|1,0,1]=4 14113 B21R2.225847 O=C(CSc1cc(ccc1F)F)OCc2ccccc2 62a_100011219198_100000753625 [0,2,0,0,0,0|1,0,1]=4 14114 B21R2.225847 O=C(CSc1cc(ccc1F)O)OCc2ccccc2 62a_100000693481_100000753625 [0,2,0,0,0,0|1,0,1]=4 14115 B21R2.225847 O=C(CSc1cc(ccc1F)O)OCc2ccccc2 62a_100000753625_100000693481 [0,2,0,0,0,0|1,0,1]=4 14116 B21R2.225847 O=C(CSc1cc(ccc1O)Br)OCc2ccccc2 62a_100000753625_100012355227 [0,2,0,0,0,0|1,0,1]=4 14117 B21R2.225847 O=C(CSc1cc(ccc1O)Br)OCc2ccccc2 62a_100012355227_100000753625 [0,2,0,0,0,0|1,0,1]=4 14118 B21R2.225847 O=C(CSc1cc(ccc1O)Cl)OCc2ccccc2 62a_100000753625_100011356953 [0,2,0,0,0,0|1,0,1]=4 14119 B21R2.225847 O=C(CSc1cc(ccc1O)Cl)OCc2ccccc2 62a_100011356953_100000753625 [0,2,0,0,0,0|1,0,1]=4 14120 B21R2.225847 O=C(CSc1cc(ccc1O)F)OCc2ccccc2 62a_100000211999_100000753625 [0,2,0,0,0,0|1,0,1]=4 14121 B21R2.225847 O=C(CSc1cc(ccc1O)F)OCc2ccccc2 62a_100000753625_100000211999 [0,2,0,0,0,0|1,0,1]=4 14122 B21R2.225847 O=C(CSc1cc(ccc1O)O)OCc2ccccc2 62a_100000753625_100009813629 [0,2,0,0,0,0|1,0,1]=4 14123 B21R2.4592439 Cc1cccc(c1)CNS(=O)(=O)C=Cc2ccccc2 40a_100000185548_100011098038 [0,2,0,0,0,0|2,0,0]=4 14124 B21R2.4592439 O=S(=O)(C=Cc1ccccc1)NCc2cccc(c2)Br 40a_100000174977_100011098038 [0,2,0,0,0,0|2,0,0]=4 14125 B21R2.4592439 O=S(=O)(C=Cc1ccccc1)NCc2cccc(c2)Cl 40a_100000174878_100011098038 [0,2,0,0,0,0|2,0,0]=4 14126 B21R2.4592439 O=S(=O)(C=Cc1ccccc1)NCc2cccc(c2)F 40a_100000174948_100011098038 [0,2,0,0,0,0|2,0,0]=4 14127 B21R2.4592439 O=S(=O)(C=Cc1ccccc1)NCc2cccc(c2)I 40a_100000106179_100011098038 [0,2,0,0,0,0|2,0,0]=4 14128 B21R2.4592439 O=S(=O)(C=Cc1ccccc1)NCc2cccc(c2)O 40a_100000743036_100011098038 [0,2,0,0,0,0|2,0,0]=4 14129 B21R2.4847 CC(=CC(=O)CCc1ccccc1Br)c2ccccc2 1458a_100000743005_100012161201 [0,2,0,0,0,0|1,0,0]=3 14130 B21R2.4847 CC(=CC(=O)CCc1ccccc1C)c2ccccc2 1458a_100000743005_100011713688 [0,2,0,0,0,0|1,0,0]=3 14131 B21R2.4847 CC(=CC(=O)CCc1ccccc1Cl)c2ccccc2 1458a_100000743005_100011713703 [0,2,0,0,0,0|1,0,0]=3 14132 B21R2.4847 CC(=CC(=O)CCc1ccccc1F)c2ccccc2 1458a_100000743005_100000720011 [0,2,0,0,0,0|1,0,0]=3 14133 B21R2.4847 CC(=CC(=O)CCc1ccccc1O)c2ccccc2 1458a_100000743005_100000722297 [0,2,0,0,0,0|1,0,0]=3 14134 B21R2.4847 CC(=CC(=O)NCc1ccccc1Br)c2ccccc2 11a_100000689332_100000743005 [0,2,0,0,0,0|1,0,0]=3 14135 B21R2.4847 CC(=CC(=O)NCc1ccccc1Br)c2ccccc2 1626a_100000689332_100000743005 [0,2,0,0,0,0|1,0,0]=3 14136 B21R2.4847 CC(=CC(=O)NCc1ccccc1Br)c2ccccc2 240690a_100000689332_100000743005 [0,2,0,0,0,0|1,0,0]=3 14137 B21R2.4847 CC(=CC(=O)NCc1ccccc1Br)c2ccccc2 527a_100000689332_100000743005 [0,2,0,0,0,0|1,0,0]=3 14138 B21R2.4847 CC(=CC(=O)NCc1ccccc1C)c2ccccc2 11a_100000174972_100000743005 [0,2,0,0,0,0|1,0,0]=3 14139 B21R2.4847 CC(=CC(=O)NCc1ccccc1C)c2ccccc2 1626a_100000174972_100000743005 [0,2,0,0,0,0|1,0,0]=3 14140 B21R2.4847 CC(=CC(=O)NCc1ccccc1C)c2ccccc2 240690a_100000174972_100000743005 [0,2,0,0,0,0|1,0,0]=3 14141 B21R2.4847 CC(=CC(=O)NCc1ccccc1C)c2ccccc2 527a_100000174972_100000743005 [0,2,0,0,0,0|1,0,0]=3 14142 B21R2.4847 CC(=CC(=O)NCc1ccccc1Cl)c2ccccc2 11a_100000174879_100000743005 [0,2,0,0,0,0|1,0,0]=3 14143 B21R2.4847 CC(=CC(=O)NCc1ccccc1Cl)c2ccccc2 1626a_100000174879_100000743005 [0,2,0,0,0,0|1,0,0]=3 14144 B21R2.4847 CC(=CC(=O)NCc1ccccc1Cl)c2ccccc2 240690a_100000174879_100000743005 [0,2,0,0,0,0|1,0,0]=3 14145 B21R2.4847 CC(=CC(=O)NCc1ccccc1Cl)c2ccccc2 527a_100000174879_100000743005 [0,2,0,0,0,0|1,0,0]=3 14146 B21R2.4847 CC(=CC(=O)NCc1ccccc1F)c2ccccc2 11a_100000174869_100000743005 [0,2,0,0,0,0|1,0,0]=3 14147 B21R2.4847 CC(=CC(=O)NCc1ccccc1F)c2ccccc2 1626a_100000174869_100000743005 [0,2,0,0,0,0|1,0,0]=3 14148 B21R2.4847 CC(=CC(=O)NCc1ccccc1F)c2ccccc2 240690a_100000174869_100000743005 [0,2,0,0,0,0|1,0,0]=3 14149 B21R2.4847 CC(=CC(=O)NCc1ccccc1F)c2ccccc2 527a_100000174869_100000743005 [0,2,0,0,0,0|1,0,0]=3 14150 B21R2.4847 CC(=CC(=O)NCc1ccccc1I)c2ccccc2 11a_100015347259_100000743005 [0,2,0,0,0,0|1,0,0]=3 14151 B21R2.4847 CC(=CC(=O)NCc1ccccc1I)c2ccccc2 1626a_100015347259_100000743005 [0,2,0,0,0,0|1,0,0]=3 14152 B21R2.4847 CC(=CC(=O)NCc1ccccc1I)c2ccccc2 240690a_100015347259_100000743005 [0,2,0,0,0,0|1,0,0]=3 14153 B21R2.4847 CC(=CC(=O)NCc1ccccc1I)c2ccccc2 527a_100015347259_100000743005 [0,2,0,0,0,0|1,0,0]=3 14154 B21R2.4847 CC(=CC(=O)NCc1ccccc1O)c2ccccc2 240690a_100000185550_100000743005 [0,2,0,0,0,0|1,0,0]=3 14155 B21R2.4847 CC(=CC(=O)NCc1ccccc1O)c2ccccc2 527a_100000185550_100000743005 [0,2,0,0,0,0|1,0,0]=3 14156 B21R2.4847 CC(=CC(=O)NCc1cccnc1Br)c2ccccc2 11a_100009818023_100000743005 [0,2,0,0,0,0|2,0,0]=4 14157 B21R2.4847 CC(=CC(=O)NCc1cccnc1Br)c2ccccc2 240690a_100009818023_100000743005 [0,2,0,0,0,0|2,0,0]=4 14158 B21R2.4847 CC(=CC(=O)NCc1cccnc1Br)c2ccccc2 527a_100009818023_100000743005 [0,2,0,0,0,0|2,0,0]=4 14159 B21R2.4847 CC(=CC(=O)NCc1cccnc1Cl)c2ccccc2 11a_100015189234_100000743005 [0,2,0,0,0,0|2,0,0]=4 14160 B21R2.4847 CC(=CC(=O)NCc1cccnc1Cl)c2ccccc2 1626a_100015189234_100000743005 [0,2,0,0,0,0|2,0,0]=4 14161 B21R2.4847 CC(=CC(=O)NCc1cccnc1Cl)c2ccccc2 240690a_100015189234_100000743005 [0,2,0,0,0,0|2,0,0]=4 14162 B21R2.4847 CC(=CC(=O)NCc1cccnc1Cl)c2ccccc2 527a_100015189234_100000743005 [0,2,0,0,0,0|2,0,0]=4 14163 B21R2.4847 CC(=CC(=O)NCc1cccnc1F)c2ccccc2 11a_100000724633_100000743005 [0,2,0,0,0,0|2,0,0]=4 14164 B21R2.4847 CC(=CC(=O)NCc1cccnc1F)c2ccccc2 1626a_100000724633_100000743005 [0,2,0,0,0,0|2,0,0]=4 14165 B21R2.4847 CC(=CC(=O)NCc1cccnc1F)c2ccccc2 240690a_100000724633_100000743005 [0,2,0,0,0,0|2,0,0]=4 14166 B21R2.4847 CC(=CC(=O)NCc1cccnc1F)c2ccccc2 527a_100000724633_100000743005 [0,2,0,0,0,0|2,0,0]=4 14167 B21R2.4847 CC(=CC(=O)NCc1ccncc1Br)c2ccccc2 11a_100020640021_100000743005 [0,2,0,0,0,0|2,0,0]=4 14168 B21R2.4847 CC(=CC(=O)NCc1ccncc1Br)c2ccccc2 240690a_100020640021_100000743005 [0,2,0,0,0,0|2,0,0]=4 14169 B21R2.4847 CC(=CC(=O)NCc1ccncc1Br)c2ccccc2 527a_100020640021_100000743005 [0,2,0,0,0,0|2,0,0]=4 14170 B21R2.4847 CC(=CC(=O)NCc1ccncc1C)c2ccccc2 11a_100000708811_100000743005 [0,2,0,0,0,0|2,0,0]=4 14171 B21R2.4847 CC(=CC(=O)NCc1ccncc1C)c2ccccc2 1626a_100000708811_100000743005 [0,2,0,0,0,0|2,0,0]=4 14172 B21R2.4847 CC(=CC(=O)NCc1ccncc1C)c2ccccc2 240690a_100000708811_100000743005 [0,2,0,0,0,0|2,0,0]=4 14173 B21R2.4847 CC(=CC(=O)NCc1ccncc1C)c2ccccc2 527a_100000708811_100000743005 [0,2,0,0,0,0|2,0,0]=4 14174 B21R2.4847 CC(=CC(=O)NCc1ccncc1F)c2ccccc2 11a_100011935246_100000743005 [0,2,0,0,0,0|2,0,0]=4 14175 B21R2.4847 CC(=CC(=O)NCc1ccncc1F)c2ccccc2 1626a_100011935246_100000743005 [0,2,0,0,0,0|2,0,0]=4 14176 B21R2.4847 CC(=CC(=O)NCc1ccncc1F)c2ccccc2 240690a_100011935246_100000743005 [0,2,0,0,0,0|2,0,0]=4 14177 B21R2.4847 CC(=CC(=O)NCc1ccncc1F)c2ccccc2 527a_100011935246_100000743005 [0,2,0,0,0,0|2,0,0]=4 14178 B21R2.4847 CC(=CC(=O)NCc1cnccc1C)c2ccccc2 11a_100011997553_100000743005 [0,2,0,0,0,0|2,0,0]=4 14179 B21R2.4847 CC(=CC(=O)NCc1cnccc1C)c2ccccc2 240690a_100011997553_100000743005 [0,2,0,0,0,0|2,0,0]=4 14180 B21R2.4847 CC(=CC(=O)NCc1cnccc1C)c2ccccc2 527a_100011997553_100000743005 [0,2,0,0,0,0|2,0,0]=4 14181 B21R2.4847 CC(=CC(=O)NCc1ncccc1Br)c2ccccc2 11a_100020591323_100000743005 [0,2,0,0,0,0|2,0,0]=4 14182 B21R2.4847 CC(=CC(=O)NCc1ncccc1Br)c2ccccc2 240690a_100020591323_100000743005 [0,2,0,0,0,0|2,0,0]=4 14183 B21R2.4847 CC(=CC(=O)NCc1ncccc1Br)c2ccccc2 527a_100020591323_100000743005 [0,2,0,0,0,0|2,0,0]=4 14184 B21R2.4847 CC(=CC(=O)NCc1ncccc1C)c2ccccc2 11a_100011223789_100000743005 [0,2,0,0,0,0|2,0,0]=4 14185 B21R2.4847 CC(=CC(=O)NCc1ncccc1C)c2ccccc2 1626a_100011223789_100000743005 [0,2,0,0,0,0|2,0,0]=4 14186 B21R2.4847 CC(=CC(=O)NCc1ncccc1C)c2ccccc2 240690a_100011223789_100000743005 [0,2,0,0,0,0|2,0,0]=4 14187 B21R2.4847 CC(=CC(=O)NCc1ncccc1C)c2ccccc2 527a_100011223789_100000743005 [0,2,0,0,0,0|2,0,0]=4 14188 B21R2.4847 CC(=CC(=O)NCc1ncccc1Cl)c2ccccc2 11a_100015189233_100000743005 [0,2,0,0,0,0|2,0,0]=4 14189 B21R2.4847 CC(=CC(=O)NCc1ncccc1Cl)c2ccccc2 1626a_100015189233_100000743005 [0,2,0,0,0,0|2,0,0]=4 14190 B21R2.4847 CC(=CC(=O)NCc1ncccc1Cl)c2ccccc2 240690a_100015189233_100000743005 [0,2,0,0,0,0|2,0,0]=4 14191 B21R2.4847 CC(=CC(=O)NCc1ncccc1Cl)c2ccccc2 527a_100015189233_100000743005 [0,2,0,0,0,0|2,0,0]=4 14192 B21R2.4847 CC(=CC(=O)NCc1ncccc1F)c2ccccc2 11a_100000690088_100000743005 [0,2,0,0,0,0|2,0,0]=4 14193 B21R2.4847 CC(=CC(=O)NCc1ncccc1F)c2ccccc2 1626a_100000690088_100000743005 [0,2,0,0,0,0|2,0,0]=4 14194 B21R2.4847 CC(=CC(=O)NCc1ncccc1F)c2ccccc2 240690a_100000690088_100000743005 [0,2,0,0,0,0|2,0,0]=4 14195 B21R2.4847 CC(=CC(=O)NCc1ncccc1F)c2ccccc2 527a_100000690088_100000743005 [0,2,0,0,0,0|2,0,0]=4 14196 B21R2.4847 CC(=CC(=O)NNc1ccccc1Br)c2ccccc2 22a_100000241748_100000743005 [0,2,0,0,0,0|2,0,0]=4 14197 B21R2.4847 CC(=CC(=O)NNc1ccccc1C)c2ccccc2 22a_100000184220_100000743005 [0,2,0,0,0,0|2,0,0]=4 14198 B21R2.4847 CC(=CC(=O)NNc1ccccc1Cl)c2ccccc2 22a_100000683529_100000743005 [0,2,0,0,0,0|2,0,0]=4 14199 B21R2.4847 CC(=CC(=O)NNc1ccccc1F)c2ccccc2 22a_100000239246_100000743005 [0,2,0,0,0,0|2,0,0]=4 14200 B21R2.4847 CC(=CC(=O)NNc1ccccc1I)c2ccccc2 22a_100011218156_100000743005 [0,2,0,0,0,0|2,0,0]=4 14201 B21R2.4847 CC(CC(=O)C=Cc1ccccc1Br)c2ccccc2 1458a_100000719032_100000756946 [0,2,0,0,0,0|1,0,0]=3 14202 B21R2.4847 CC(CC(=O)C=Cc1ccccc1Cl)c2ccccc2 1458a_100000720304_100000756946 [0,2,0,0,0,0|1,0,0]=3 14203 B21R2.4847 CC(CC(=O)C=Cc1ccccc1F)c2ccccc2 1458a_100016256065_100000756946 [0,2,0,0,0,0|1,0,0]=3 14204 B21R2.4847 CC(CC(=O)C=Cc1ccccc1O)c2ccccc2 1458a_100016263591_100000756946 [0,2,0,0,0,0|1,0,0]=3 14205 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Br)c2ccccn2 11a_100000181244_100000719032 [0,2,0,0,0,0|2,0,0]=4 14206 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Br)c2ccccn2 1626a_100000181244_100000719032 [0,2,0,0,0,0|2,0,0]=4 14207 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Br)c2ccccn2 240690a_100000181244_100000719032 [0,2,0,0,0,0|2,0,0]=4 14208 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Br)c2cccnc2 11a_100000195435_100000719032 [0,2,0,0,0,0|2,0,0]=4 14209 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Br)c2cccnc2 240690a_100000195435_100000719032 [0,2,0,0,0,0|2,0,0]=4 14210 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Br)c2ccncc2 240690a_100000181269_100000719032 [0,2,0,0,0,0|2,0,0]=4 14211 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Cl)c2ccccn2 11a_100000181244_100000720304 [0,2,0,0,0,0|2,0,0]=4 14212 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Cl)c2ccccn2 1626a_100000181244_100000720304 [0,2,0,0,0,0|2,0,0]=4 14213 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Cl)c2ccccn2 240690a_100000181244_100000720304 [0,2,0,0,0,0|2,0,0]=4 14214 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Cl)c2cccnc2 11a_100000195435_100000720304 [0,2,0,0,0,0|2,0,0]=4 14215 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Cl)c2cccnc2 240690a_100000195435_100000720304 [0,2,0,0,0,0|2,0,0]=4 14216 B21R2.4847 CC(NC(=O)C=Cc1ccccc1Cl)c2ccncc2 240690a_100000181269_100000720304 [0,2,0,0,0,0|2,0,0]=4 14217 B21R2.4847 CC(NC(=O)C=Cc1ccccc1F)c2ccccn2 11a_100000181244_100016256065 [0,2,0,0,0,0|2,0,0]=4 14218 B21R2.4847 CC(NC(=O)C=Cc1ccccc1F)c2ccccn2 1626a_100000181244_100016256065 [0,2,0,0,0,0|2,0,0]=4 14219 B21R2.4847 CC(NC(=O)C=Cc1ccccc1F)c2ccccn2 240690a_100000181244_100016256065 [0,2,0,0,0,0|2,0,0]=4 14220 B21R2.4847 CC(NC(=O)C=Cc1ccccc1F)c2cccnc2 11a_100000195435_100016256065 [0,2,0,0,0,0|2,0,0]=4 14221 B21R2.4847 CC(NC(=O)C=Cc1ccccc1F)c2cccnc2 240690a_100000195435_100016256065 [0,2,0,0,0,0|2,0,0]=4 14222 B21R2.4847 CC(NC(=O)C=Cc1ccccc1F)c2ccncc2 240690a_100000181269_100016256065 [0,2,0,0,0,0|2,0,0]=4 14223 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1Br)c2ccccc2 11a_100000751104_100000719032 [0,2,0,0,0,0|1,0,0]=3 14224 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1Br)c2ccccc2 1626a_100000751104_100000719032 [0,2,0,0,0,0|1,0,0]=3 14225 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1Br)c2ccccc2 240690a_100000751104_100000719032 [0,2,0,0,0,0|1,0,0]=3 14226 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1Cl)c2ccccc2 11a_100000751104_100000720304 [0,2,0,0,0,0|1,0,0]=3 14227 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1Cl)c2ccccc2 1626a_100000751104_100000720304 [0,2,0,0,0,0|1,0,0]=3 14228 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1Cl)c2ccccc2 240690a_100000751104_100000720304 [0,2,0,0,0,0|1,0,0]=3 14229 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1F)c2ccccc2 11a_100000751104_100016256065 [0,2,0,0,0,0|1,0,0]=3 14230 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1F)c2ccccc2 1626a_100000751104_100016256065 [0,2,0,0,0,0|1,0,0]=3 14231 B21R2.4847 C[C@@H](NC(=O)C=Cc1ccccc1F)c2ccccc2 240690a_100000751104_100016256065 [0,2,0,0,0,0|1,0,0]=3 14232 B21R2.4847 Cc1ccccc1C=CC(=O)NC(C)c2ccccn2 1626a_100000181244_100016266485 [0,2,0,0,0,0|2,0,0]=4 14233 B21R2.4847 Cc1ccccc1C=CC(=O)N[C@H](C)c2ccccc2 1626a_100000751104_100016266485 [0,2,0,0,0,0|1,0,0]=3 14234 B21R2.4847 Cc1ccccc1CCC(=O)CC(=O)c2ccccc2 1458a_100000748742_100000211460 [0,2,0,0,0,0|1,0,1]=4 14235 B21R2.4847 Cc1ccccc1CNC(=O)CC(=O)c2ccccc2 1458a_100000185807_100000230231 [0,2,0,0,0,0|1,0,1]=4 14236 B21R2.4847 O=C(C=Cc1ccccc1Br)CC(=O)c2ccccc2 1458a_100000719032_100000211460 [0,2,0,0,0,0|1,0,1]=4 14237 B21R2.4847 O=C(C=Cc1ccccc1Br)CC(O)c2ccccc2 1458a_100000719032_100000185958 [0,2,0,0,0,0|1,0,0]=3 14238 B21R2.4847 O=C(C=Cc1ccccc1Br)C[C@@H](O)c2ccccc2 1458a_100000719032_100011933945 [0,2,0,0,0,0|1,0,0]=3 14239 B21R2.4847 O=C(C=Cc1ccccc1Cl)CC(=O)c2ccccc2 1458a_100000720304_100000211460 [0,2,0,0,0,0|1,0,1]=4 14240 B21R2.4847 O=C(C=Cc1ccccc1Cl)CC(O)c2ccccc2 1458a_100000720304_100000185958 [0,2,0,0,0,0|1,0,0]=3 14241 B21R2.4847 O=C(C=Cc1ccccc1Cl)C[C@@H](O)c2ccccc2 1458a_100000720304_100011933945 [0,2,0,0,0,0|1,0,0]=3 14242 B21R2.4847 O=C(C=Cc1ccccc1F)CC(=O)c2ccccc2 1458a_100016256065_100000211460 [0,2,0,0,0,0|1,0,1]=4 14243 B21R2.4847 O=C(C=Cc1ccccc1F)CC(O)c2ccccc2 1458a_100016256065_100000185958 [0,2,0,0,0,0|1,0,0]=3 14244 B21R2.4847 O=C(C=Cc1ccccc1F)C[C@@H](O)c2ccccc2 1458a_100016256065_100011933945 [0,2,0,0,0,0|1,0,0]=3 14245 B21R2.4847 O=C(C=Cc1ccccc1O)CC(=O)c2ccccc2 1458a_100016263591_100000211460 [0,2,0,0,0,0|1,0,1]=4 14246 B21R2.4847 O=C(C=Cc1ccccc1O)CC(O)c2ccccc2 1458a_100016263591_100000185958 [0,2,0,0,0,0|1,0,0]=3 14247 B21R2.4847 O=C(C=Cc1ccccc1O)C[C@@H](O)c2ccccc2 1458a_100016263591_100011933945 [0,2,0,0,0,0|1,0,0]=3 14248 B21R2.4847 O=C(CC(=O)c1ccccc1)NCc2ccccc2F 1458a_100000185807_100000190583 [0,2,0,0,0,0|1,0,1]=4 14249 B21R2.4847 O=C(CCc1ccccc1Br)CC(=O)c2ccccc2 1458a_100000740810_100000211460 [0,2,0,0,0,0|1,0,1]=4 14250 B21R2.4847 O=C(CCc1ccccc1Cl)CC(=O)c2ccccc2 1458a_100000184300_100000211460 [0,2,0,0,0,0|1,0,1]=4 14251 B21R2.4847 O=C(CCc1ccccc1F)CC(=O)c2ccccc2 1458a_100000189703_100000211460 [0,2,0,0,0,0|1,0,1]=4 14252 B21R2.4847 O=C(CCc1ccccc1I)CC(=O)c2ccccc2 1458a_100000037306_100000211460 [0,2,0,0,0,0|1,0,1]=4 14253 B21R2.4847 O=C(CCc1ccccc1O)CC(=O)c2ccccc2 1458a_100000181328_100000211460 [0,2,0,0,0,0|1,0,1]=4 14254 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)CCc2ccccc2Br 1458a_100016990649_100012161201 [0,2,0,0,0,0|1,0,0]=3 14255 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)CCc2ccccc2C 1458a_100016990649_100011713688 [0,2,0,0,0,0|1,0,0]=3 14256 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)CCc2ccccc2Cl 1458a_100016990649_100011713703 [0,2,0,0,0,0|1,0,0]=3 14257 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)CCc2ccccc2F 1458a_100016990649_100000720011 [0,2,0,0,0,0|1,0,0]=3 14258 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)CCc2ccccc2O 1458a_100016990649_100000722297 [0,2,0,0,0,0|1,0,0]=3 14259 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2Br 11a_100000689332_100016990649 [0,2,0,0,0,0|1,0,0]=3 14260 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2Br 1626a_100000689332_100016990649 [0,2,0,0,0,0|1,0,0]=3 14261 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2Br 527a_100000689332_100016990649 [0,2,0,0,0,0|1,0,0]=3 14262 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2C 11a_100000174972_100016990649 [0,2,0,0,0,0|1,0,0]=3 14263 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2C 1626a_100000174972_100016990649 [0,2,0,0,0,0|1,0,0]=3 14264 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2C 527a_100000174972_100016990649 [0,2,0,0,0,0|1,0,0]=3 14265 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2Cl 11a_100000174879_100016990649 [0,2,0,0,0,0|1,0,0]=3 14266 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2Cl 1626a_100000174879_100016990649 [0,2,0,0,0,0|1,0,0]=3 14267 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2Cl 527a_100000174879_100016990649 [0,2,0,0,0,0|1,0,0]=3 14268 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2F 11a_100000174869_100016990649 [0,2,0,0,0,0|1,0,0]=3 14269 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2F 1626a_100000174869_100016990649 [0,2,0,0,0,0|1,0,0]=3 14270 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2F 527a_100000174869_100016990649 [0,2,0,0,0,0|1,0,0]=3 14271 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2I 11a_100015347259_100016990649 [0,2,0,0,0,0|1,0,0]=3 14272 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2I 1626a_100015347259_100016990649 [0,2,0,0,0,0|1,0,0]=3 14273 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2I 527a_100015347259_100016990649 [0,2,0,0,0,0|1,0,0]=3 14274 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccccc2O 527a_100000185550_100016990649 [0,2,0,0,0,0|1,0,0]=3 14275 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2Br 11a_100009818023_100016990649 [0,2,0,0,0,0|2,0,0]=4 14276 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2Br 527a_100009818023_100016990649 [0,2,0,0,0,0|2,0,0]=4 14277 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2Cl 11a_100015189234_100016990649 [0,2,0,0,0,0|2,0,0]=4 14278 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2Cl 1626a_100015189234_100016990649 [0,2,0,0,0,0|2,0,0]=4 14279 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2Cl 527a_100015189234_100016990649 [0,2,0,0,0,0|2,0,0]=4 14280 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2F 11a_100000724633_100016990649 [0,2,0,0,0,0|2,0,0]=4 14281 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2F 1626a_100000724633_100016990649 [0,2,0,0,0,0|2,0,0]=4 14282 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cccnc2F 527a_100000724633_100016990649 [0,2,0,0,0,0|2,0,0]=4 14283 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2Br 11a_100020640021_100016990649 [0,2,0,0,0,0|2,0,0]=4 14284 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2Br 527a_100020640021_100016990649 [0,2,0,0,0,0|2,0,0]=4 14285 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2C 11a_100000708811_100016990649 [0,2,0,0,0,0|2,0,0]=4 14286 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2C 1626a_100000708811_100016990649 [0,2,0,0,0,0|2,0,0]=4 14287 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2C 527a_100000708811_100016990649 [0,2,0,0,0,0|2,0,0]=4 14288 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2F 11a_100011935246_100016990649 [0,2,0,0,0,0|2,0,0]=4 14289 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2F 1626a_100011935246_100016990649 [0,2,0,0,0,0|2,0,0]=4 14290 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ccncc2F 527a_100011935246_100016990649 [0,2,0,0,0,0|2,0,0]=4 14291 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cnccc2C 11a_100011997553_100016990649 [0,2,0,0,0,0|2,0,0]=4 14292 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2cnccc2C 527a_100011997553_100016990649 [0,2,0,0,0,0|2,0,0]=4 14293 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2Br 11a_100020591323_100016990649 [0,2,0,0,0,0|2,0,0]=4 14294 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2Br 527a_100020591323_100016990649 [0,2,0,0,0,0|2,0,0]=4 14295 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2C 11a_100011223789_100016990649 [0,2,0,0,0,0|2,0,0]=4 14296 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2C 1626a_100011223789_100016990649 [0,2,0,0,0,0|2,0,0]=4 14297 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2C 527a_100011223789_100016990649 [0,2,0,0,0,0|2,0,0]=4 14298 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2Cl 11a_100015189233_100016990649 [0,2,0,0,0,0|2,0,0]=4 14299 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2Cl 1626a_100015189233_100016990649 [0,2,0,0,0,0|2,0,0]=4 14300 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2Cl 527a_100015189233_100016990649 [0,2,0,0,0,0|2,0,0]=4 14301 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2F 11a_100000690088_100016990649 [0,2,0,0,0,0|2,0,0]=4 14302 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2F 1626a_100000690088_100016990649 [0,2,0,0,0,0|2,0,0]=4 14303 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NCc2ncccc2F 527a_100000690088_100016990649 [0,2,0,0,0,0|2,0,0]=4 14304 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NNc2ccccc2Br 22a_100000241748_100016990649 [0,2,0,0,0,0|2,0,0]=4 14305 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NNc2ccccc2C 22a_100000184220_100016990649 [0,2,0,0,0,0|2,0,0]=4 14306 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NNc2ccccc2Cl 22a_100000683529_100016990649 [0,2,0,0,0,0|2,0,0]=4 14307 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NNc2ccccc2F 22a_100000239246_100016990649 [0,2,0,0,0,0|2,0,0]=4 14308 B21R2.4854 C/C(=C\c1ccccc1)/C(=O)NNc2ccccc2I 22a_100011218156_100016990649 [0,2,0,0,0,0|2,0,0]=4 14309 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)CCc2ccccc2Br 1458a_100025712827_100012161201 [0,2,0,0,0,0|2,0,0]=4 14310 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)CCc2ccccc2C 1458a_100025712827_100011713688 [0,2,0,0,0,0|2,0,0]=4 14311 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)CCc2ccccc2Cl 1458a_100025712827_100011713703 [0,2,0,0,0,0|2,0,0]=4 14312 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)CCc2ccccc2F 1458a_100025712827_100000720011 [0,2,0,0,0,0|2,0,0]=4 14313 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)CCc2ccccc2O 1458a_100025712827_100000722297 [0,2,0,0,0,0|2,0,0]=4 14314 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2Br 11a_100000689332_100025712827 [0,2,0,0,0,0|2,0,0]=4 14315 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2Br 1626a_100000689332_100025712827 [0,2,0,0,0,0|2,0,0]=4 14316 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2Br 527a_100000689332_100025712827 [0,2,0,0,0,0|2,0,0]=4 14317 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2C 11a_100000174972_100025712827 [0,2,0,0,0,0|2,0,0]=4 14318 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2C 1626a_100000174972_100025712827 [0,2,0,0,0,0|2,0,0]=4 14319 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2C 527a_100000174972_100025712827 [0,2,0,0,0,0|2,0,0]=4 14320 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2Cl 11a_100000174879_100025712827 [0,2,0,0,0,0|2,0,0]=4 14321 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2Cl 1626a_100000174879_100025712827 [0,2,0,0,0,0|2,0,0]=4 14322 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2Cl 527a_100000174879_100025712827 [0,2,0,0,0,0|2,0,0]=4 14323 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2F 11a_100000174869_100025712827 [0,2,0,0,0,0|2,0,0]=4 14324 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2F 1626a_100000174869_100025712827 [0,2,0,0,0,0|2,0,0]=4 14325 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2F 527a_100000174869_100025712827 [0,2,0,0,0,0|2,0,0]=4 14326 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2I 11a_100015347259_100025712827 [0,2,0,0,0,0|2,0,0]=4 14327 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2I 1626a_100015347259_100025712827 [0,2,0,0,0,0|2,0,0]=4 14328 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2I 527a_100015347259_100025712827 [0,2,0,0,0,0|2,0,0]=4 14329 B21R2.4854 C/C(=C\c1ccccn1)/C(=O)NCc2ccccc2O 527a_100000185550_100025712827 [0,2,0,0,0,0|2,0,0]=4 14330 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2Br 11a_100000689332_100000066491 [0,2,0,0,0,0|1,0,1]=4 14331 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2Br 1626a_100000689332_100000066491 [0,2,0,0,0,0|1,0,1]=4 14332 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2C 11a_100000174972_100000066491 [0,2,0,0,0,0|1,0,1]=4 14333 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2C 1626a_100000174972_100000066491 [0,2,0,0,0,0|1,0,1]=4 14334 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2Cl 11a_100000174879_100000066491 [0,2,0,0,0,0|1,0,1]=4 14335 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2Cl 1626a_100000174879_100000066491 [0,2,0,0,0,0|1,0,1]=4 14336 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2F 11a_100000174869_100000066491 [0,2,0,0,0,0|1,0,1]=4 14337 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2F 1626a_100000174869_100000066491 [0,2,0,0,0,0|1,0,1]=4 14338 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2I 11a_100015347259_100000066491 [0,2,0,0,0,0|1,0,1]=4 14339 B21R2.4854 C=C(Cc1ccccc1)C(=O)NCc2ccccc2I 1626a_100015347259_100000066491 [0,2,0,0,0,0|1,0,1]=4 14340 B21R2.4854 CC(Cc1ccccc1)C(=O)C=Cc2ccccc2Br 1458a_100000719032_200011218536 [0,2,0,0,0,0|1,0,0]=3 14341 B21R2.4854 CC(Cc1ccccc1)C(=O)C=Cc2ccccc2Cl 1458a_100000720304_200011218536 [0,2,0,0,0,0|1,0,0]=3 14342 B21R2.4854 CC(Cc1ccccc1)C(=O)C=Cc2ccccc2F 1458a_100016256065_200011218536 [0,2,0,0,0,0|1,0,0]=3 14343 B21R2.4854 CC(Cc1ccccc1)C(=O)C=Cc2ccccc2O 1458a_100016263591_200011218536 [0,2,0,0,0,0|1,0,0]=3 14344 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2Br 11a_100000186898_100000719032 [0,2,0,0,0,0|1,0,0]=3 14345 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2Br 1626a_100000186898_100000719032 [0,2,0,0,0,0|1,0,0]=3 14346 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2Br 240690a_100000186898_100000719032 [0,2,0,0,0,0|1,0,0]=3 14347 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2Cl 11a_100000186898_100000720304 [0,2,0,0,0,0|1,0,0]=3 14348 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2Cl 1626a_100000186898_100000720304 [0,2,0,0,0,0|1,0,0]=3 14349 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2Cl 240690a_100000186898_100000720304 [0,2,0,0,0,0|1,0,0]=3 14350 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2F 11a_100000186898_100016256065 [0,2,0,0,0,0|1,0,0]=3 14351 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2F 1626a_100000186898_100016256065 [0,2,0,0,0,0|1,0,0]=3 14352 B21R2.4854 CN(Cc1ccccc1)C(=O)C=Cc2ccccc2F 240690a_100000186898_100016256065 [0,2,0,0,0,0|1,0,0]=3 14353 B21R2.4854 CN(Cc1ccccn1)C(=O)C=Cc2ccccc2Br 11a_100000207498_100000719032 [0,2,0,0,0,0|2,0,0]=4 14354 B21R2.4854 CN(Cc1ccccn1)C(=O)C=Cc2ccccc2Br 240690a_100000207498_100000719032 [0,2,0,0,0,0|2,0,0]=4 14355 B21R2.4854 CN(Cc1ccccn1)C(=O)C=Cc2ccccc2Cl 11a_100000207498_100000720304 [0,2,0,0,0,0|2,0,0]=4 14356 B21R2.4854 CN(Cc1ccccn1)C(=O)C=Cc2ccccc2Cl 240690a_100000207498_100000720304 [0,2,0,0,0,0|2,0,0]=4 14357 B21R2.4854 CN(Cc1ccccn1)C(=O)C=Cc2ccccc2F 11a_100000207498_100016256065 [0,2,0,0,0,0|2,0,0]=4 14358 B21R2.4854 CN(Cc1ccccn1)C(=O)C=Cc2ccccc2F 240690a_100000207498_100016256065 [0,2,0,0,0,0|2,0,0]=4 14359 B21R2.4854 CN(Cc1cccnc1)C(=O)C=Cc2ccccc2Br 11a_100000184577_100000719032 [0,2,0,0,0,0|2,0,0]=4 14360 B21R2.4854 CN(Cc1cccnc1)C(=O)C=Cc2ccccc2Br 240690a_100000184577_100000719032 [0,2,0,0,0,0|2,0,0]=4 14361 B21R2.4854 CN(Cc1cccnc1)C(=O)C=Cc2ccccc2Cl 11a_100000184577_100000720304 [0,2,0,0,0,0|2,0,0]=4 14362 B21R2.4854 CN(Cc1cccnc1)C(=O)C=Cc2ccccc2Cl 240690a_100000184577_100000720304 [0,2,0,0,0,0|2,0,0]=4 14363 B21R2.4854 CN(Cc1cccnc1)C(=O)C=Cc2ccccc2F 11a_100000184577_100016256065 [0,2,0,0,0,0|2,0,0]=4 14364 B21R2.4854 CN(Cc1cccnc1)C(=O)C=Cc2ccccc2F 240690a_100000184577_100016256065 [0,2,0,0,0,0|2,0,0]=4 14365 B21R2.4854 CN(Cc1ccncc1)C(=O)C=Cc2ccccc2Br 11a_100000187231_100000719032 [0,2,0,0,0,0|2,0,0]=4 14366 B21R2.4854 CN(Cc1ccncc1)C(=O)C=Cc2ccccc2Br 240690a_100000187231_100000719032 [0,2,0,0,0,0|2,0,0]=4 14367 B21R2.4854 CN(Cc1ccncc1)C(=O)C=Cc2ccccc2Cl 11a_100000187231_100000720304 [0,2,0,0,0,0|2,0,0]=4 14368 B21R2.4854 CN(Cc1ccncc1)C(=O)C=Cc2ccccc2Cl 240690a_100000187231_100000720304 [0,2,0,0,0,0|2,0,0]=4 14369 B21R2.4854 CN(Cc1ccncc1)C(=O)C=Cc2ccccc2F 11a_100000187231_100016256065 [0,2,0,0,0,0|2,0,0]=4 14370 B21R2.4854 CN(Cc1ccncc1)C(=O)C=Cc2ccccc2F 240690a_100000187231_100016256065 [0,2,0,0,0,0|2,0,0]=4 14371 B21R2.4854 Cc1ccccc1C=CC(=O)N(C)Cc2ccccc2 1626a_100000186898_100016266485 [0,2,0,0,0,0|1,0,0]=3 14372 B21R2.4854 Cc1ccccc1CCC(=O)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011713688 [0,2,0,0,0,0|1,0,0]=3 14373 B21R2.4854 Cc1ccccc1CCC(=O)/C(=C\c2ccccc2)/F 1458a_100020889036_100011713688 [0,2,0,0,0,0|1,0,0]=3 14374 B21R2.4854 Cc1ccccc1CCC(=O)C(=Cc2cccnc2)F 1458a_100000731744_100011713688 [0,2,0,0,0,0|2,0,0]=4 14375 B21R2.4854 Cc1ccccc1CCC(=O)C(=O)Nc2ccccc2 1458a_100000738435_100011713688 [0,2,0,0,0,0|2,0,0]=4 14376 B21R2.4854 Cc1ccccc1CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000174972_200020598536 [0,2,0,0,0,0|1,0,0]=3 14377 B21R2.4854 Cc1ccccc1CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000174972_200020598536 [0,2,0,0,0,0|1,0,0]=3 14378 B21R2.4854 Cc1ccccc1CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000174972_200020598536 [0,2,0,0,0,0|1,0,0]=3 14379 B21R2.4854 Cc1ccccc1CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000174972_200020598536 [0,2,0,0,0,0|1,0,0]=3 14380 B21R2.4854 Cc1ccccc1CNC(=O)/C(=C\c2ccccc2)/F 11a_100000174972_100020889036 [0,2,0,0,0,0|1,0,0]=3 14381 B21R2.4854 Cc1ccccc1CNC(=O)/C(=C\c2ccccc2)/F 527a_100000174972_100020889036 [0,2,0,0,0,0|1,0,0]=3 14382 B21R2.4854 Cc1ccccc1CNC(=O)C(=Cc2cccnc2)F 11a_100000174972_100000731744 [0,2,0,0,0,0|2,0,0]=4 14383 B21R2.4854 Cc1ccccc1CNC(=O)C(=Cc2cccnc2)F 240690a_100000174972_100000731744 [0,2,0,0,0,0|2,0,0]=4 14384 B21R2.4854 Cc1ccccc1CNC(=O)C(=Cc2cccnc2)F 527a_100000174972_100000731744 [0,2,0,0,0,0|2,0,0]=4 14385 B21R2.4854 Cc1ccccc1CNC(=O)C(=O)Nc2ccccc2 240690a_100000174972_100000738435 [0,2,0,0,0,0|2,0,0]=4 14386 B21R2.4854 Cc1ccccc1NNC(=O)/C(=C/c2ccccc2)/Cl 22a_100000184220_200020598536 [0,2,0,0,0,0|2,0,0]=4 14387 B21R2.4854 Cc1ccccc1NNC(=O)/C(=C\c2ccccc2)/F 22a_100000184220_100020889036 [0,2,0,0,0,0|2,0,0]=4 14388 B21R2.4854 Cc1cccnc1CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100011223789_200020598536 [0,2,0,0,0,0|2,0,0]=4 14389 B21R2.4854 Cc1cccnc1CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100011223789_200020598536 [0,2,0,0,0,0|2,0,0]=4 14390 B21R2.4854 Cc1cccnc1CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100011223789_200020598536 [0,2,0,0,0,0|2,0,0]=4 14391 B21R2.4854 Cc1cccnc1CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100011223789_200020598536 [0,2,0,0,0,0|2,0,0]=4 14392 B21R2.4854 Cc1cccnc1CNC(=O)/C(=C\c2ccccc2)/F 11a_100011223789_100020889036 [0,2,0,0,0,0|2,0,0]=4 14393 B21R2.4854 Cc1cccnc1CNC(=O)/C(=C\c2ccccc2)/F 527a_100011223789_100020889036 [0,2,0,0,0,0|2,0,0]=4 14394 B21R2.4854 Cc1ccncc1CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100011997553_200020598536 [0,2,0,0,0,0|2,0,0]=4 14395 B21R2.4854 Cc1ccncc1CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100011997553_200020598536 [0,2,0,0,0,0|2,0,0]=4 14396 B21R2.4854 Cc1ccncc1CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100011997553_200020598536 [0,2,0,0,0,0|2,0,0]=4 14397 B21R2.4854 Cc1ccncc1CNC(=O)/C(=C\c2ccccc2)/F 11a_100011997553_100020889036 [0,2,0,0,0,0|2,0,0]=4 14398 B21R2.4854 Cc1ccncc1CNC(=O)/C(=C\c2ccccc2)/F 527a_100011997553_100020889036 [0,2,0,0,0,0|2,0,0]=4 14399 B21R2.4854 Cc1cnccc1CNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000708811_200020598536 [0,2,0,0,0,0|2,0,0]=4 14400 B21R2.4854 Cc1cnccc1CNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000708811_200020598536 [0,2,0,0,0,0|2,0,0]=4 14401 B21R2.4854 Cc1cnccc1CNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000708811_200020598536 [0,2,0,0,0,0|2,0,0]=4 14402 B21R2.4854 Cc1cnccc1CNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000708811_200020598536 [0,2,0,0,0,0|2,0,0]=4 14403 B21R2.4854 Cc1cnccc1CNC(=O)/C(=C\c2ccccc2)/F 11a_100000708811_100020889036 [0,2,0,0,0,0|2,0,0]=4 14404 B21R2.4854 Cc1cnccc1CNC(=O)/C(=C\c2ccccc2)/F 527a_100000708811_100020889036 [0,2,0,0,0,0|2,0,0]=4 14405 B21R2.4854 O=C(CCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100012161201 [0,2,0,0,0,0|1,0,0]=3 14406 B21R2.4854 O=C(CCc1ccccc1Br)/C(=C\c2ccccc2)/F 1458a_100020889036_100012161201 [0,2,0,0,0,0|1,0,0]=3 14407 B21R2.4854 O=C(CCc1ccccc1Br)C(=Cc2cccnc2)F 1458a_100000731744_100012161201 [0,2,0,0,0,0|2,0,0]=4 14408 B21R2.4854 O=C(CCc1ccccc1Br)C(=O)Nc2ccccc2 1458a_100000738435_100012161201 [0,2,0,0,0,0|2,0,0]=4 14409 B21R2.4854 O=C(CCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011713703 [0,2,0,0,0,0|1,0,0]=3 14410 B21R2.4854 O=C(CCc1ccccc1Cl)/C(=C\c2ccccc2)/F 1458a_100020889036_100011713703 [0,2,0,0,0,0|1,0,0]=3 14411 B21R2.4854 O=C(CCc1ccccc1Cl)C(=Cc2cccnc2)F 1458a_100000731744_100011713703 [0,2,0,0,0,0|2,0,0]=4 14412 B21R2.4854 O=C(CCc1ccccc1Cl)C(=O)Nc2ccccc2 1458a_100000738435_100011713703 [0,2,0,0,0,0|2,0,0]=4 14413 B21R2.4854 O=C(CCc1ccccc1F)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000720011 [0,2,0,0,0,0|1,0,0]=3 14414 B21R2.4854 O=C(CCc1ccccc1F)/C(=C\c2ccccc2)/F 1458a_100020889036_100000720011 [0,2,0,0,0,0|1,0,0]=3 14415 B21R2.4854 O=C(CCc1ccccc1F)C(=Cc2cccnc2)F 1458a_100000731744_100000720011 [0,2,0,0,0,0|2,0,0]=4 14416 B21R2.4854 O=C(CCc1ccccc1F)C(=O)Nc2ccccc2 1458a_100000738435_100000720011 [0,2,0,0,0,0|2,0,0]=4 14417 B21R2.4854 O=C(CCc1ccccc1O)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000722297 [0,2,0,0,0,0|1,0,0]=3 14418 B21R2.4854 O=C(CCc1ccccc1O)/C(=C\c2ccccc2)/F 1458a_100020889036_100000722297 [0,2,0,0,0,0|1,0,0]=3 14419 B21R2.4854 O=C(CCc1ccccc1O)C(=Cc2cccnc2)F 1458a_100000731744_100000722297 [0,2,0,0,0,0|2,0,0]=4 14420 B21R2.4854 O=C(CCc1ccccc1O)C(=O)Nc2ccccc2 1458a_100000738435_100000722297 [0,2,0,0,0,0|2,0,0]=4 14421 B21R2.4854 O=C(NCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 11a_100000689332_200020598536 [0,2,0,0,0,0|1,0,0]=3 14422 B21R2.4854 O=C(NCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 1626a_100000689332_200020598536 [0,2,0,0,0,0|1,0,0]=3 14423 B21R2.4854 O=C(NCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 240690a_100000689332_200020598536 [0,2,0,0,0,0|1,0,0]=3 14424 B21R2.4854 O=C(NCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 527a_100000689332_200020598536 [0,2,0,0,0,0|1,0,0]=3 14425 B21R2.4854 O=C(NCc1ccccc1Br)/C(=C\c2ccccc2)/F 11a_100000689332_100020889036 [0,2,0,0,0,0|1,0,0]=3 14426 B21R2.4854 O=C(NCc1ccccc1Br)/C(=C\c2ccccc2)/F 527a_100000689332_100020889036 [0,2,0,0,0,0|1,0,0]=3 14427 B21R2.4854 O=C(NCc1ccccc1Br)C(=Cc2cccnc2)F 11a_100000689332_100000731744 [0,2,0,0,0,0|2,0,0]=4 14428 B21R2.4854 O=C(NCc1ccccc1Br)C(=Cc2cccnc2)F 240690a_100000689332_100000731744 [0,2,0,0,0,0|2,0,0]=4 14429 B21R2.4854 O=C(NCc1ccccc1Br)C(=Cc2cccnc2)F 527a_100000689332_100000731744 [0,2,0,0,0,0|2,0,0]=4 14430 B21R2.4854 O=C(NCc1ccccc1Br)C(=O)Nc2ccccc2 240690a_100000689332_100000738435 [0,2,0,0,0,0|2,0,0]=4 14431 B21R2.4854 O=C(NCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 11a_100000174879_200020598536 [0,2,0,0,0,0|1,0,0]=3 14432 B21R2.4854 O=C(NCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 1626a_100000174879_200020598536 [0,2,0,0,0,0|1,0,0]=3 14433 B21R2.4854 O=C(NCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 240690a_100000174879_200020598536 [0,2,0,0,0,0|1,0,0]=3 14434 B21R2.4854 O=C(NCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 527a_100000174879_200020598536 [0,2,0,0,0,0|1,0,0]=3 14435 B21R2.4854 O=C(NCc1ccccc1Cl)/C(=C\c2ccccc2)/F 11a_100000174879_100020889036 [0,2,0,0,0,0|1,0,0]=3 14436 B21R2.4854 O=C(NCc1ccccc1Cl)/C(=C\c2ccccc2)/F 527a_100000174879_100020889036 [0,2,0,0,0,0|1,0,0]=3 14437 B21R2.4854 O=C(NCc1ccccc1Cl)C(=Cc2cccnc2)F 11a_100000174879_100000731744 [0,2,0,0,0,0|2,0,0]=4 14438 B21R2.4854 O=C(NCc1ccccc1Cl)C(=Cc2cccnc2)F 240690a_100000174879_100000731744 [0,2,0,0,0,0|2,0,0]=4 14439 B21R2.4854 O=C(NCc1ccccc1Cl)C(=Cc2cccnc2)F 527a_100000174879_100000731744 [0,2,0,0,0,0|2,0,0]=4 14440 B21R2.4854 O=C(NCc1ccccc1Cl)C(=O)Nc2ccccc2 240690a_100000174879_100000738435 [0,2,0,0,0,0|2,0,0]=4 14441 B21R2.4854 O=C(NCc1ccccc1F)/C(=C/c2ccccc2)/Cl 11a_100000174869_200020598536 [0,2,0,0,0,0|1,0,0]=3 14442 B21R2.4854 O=C(NCc1ccccc1F)/C(=C/c2ccccc2)/Cl 1626a_100000174869_200020598536 [0,2,0,0,0,0|1,0,0]=3 14443 B21R2.4854 O=C(NCc1ccccc1F)/C(=C/c2ccccc2)/Cl 240690a_100000174869_200020598536 [0,2,0,0,0,0|1,0,0]=3 14444 B21R2.4854 O=C(NCc1ccccc1F)/C(=C/c2ccccc2)/Cl 527a_100000174869_200020598536 [0,2,0,0,0,0|1,0,0]=3 14445 B21R2.4854 O=C(NCc1ccccc1F)/C(=C\c2ccccc2)/F 11a_100000174869_100020889036 [0,2,0,0,0,0|1,0,0]=3 14446 B21R2.4854 O=C(NCc1ccccc1F)/C(=C\c2ccccc2)/F 527a_100000174869_100020889036 [0,2,0,0,0,0|1,0,0]=3 14447 B21R2.4854 O=C(NCc1ccccc1F)C(=Cc2cccnc2)F 11a_100000174869_100000731744 [0,2,0,0,0,0|2,0,0]=4 14448 B21R2.4854 O=C(NCc1ccccc1F)C(=Cc2cccnc2)F 240690a_100000174869_100000731744 [0,2,0,0,0,0|2,0,0]=4 14449 B21R2.4854 O=C(NCc1ccccc1F)C(=Cc2cccnc2)F 527a_100000174869_100000731744 [0,2,0,0,0,0|2,0,0]=4 14450 B21R2.4854 O=C(NCc1ccccc1F)C(=O)Nc2ccccc2 240690a_100000174869_100000738435 [0,2,0,0,0,0|2,0,0]=4 14451 B21R2.4854 O=C(NCc1ccccc1I)/C(=C/c2ccccc2)/Cl 11a_100015347259_200020598536 [0,2,0,0,0,0|1,0,0]=3 14452 B21R2.4854 O=C(NCc1ccccc1I)/C(=C/c2ccccc2)/Cl 1626a_100015347259_200020598536 [0,2,0,0,0,0|1,0,0]=3 14453 B21R2.4854 O=C(NCc1ccccc1I)/C(=C/c2ccccc2)/Cl 240690a_100015347259_200020598536 [0,2,0,0,0,0|1,0,0]=3 14454 B21R2.4854 O=C(NCc1ccccc1I)/C(=C/c2ccccc2)/Cl 527a_100015347259_200020598536 [0,2,0,0,0,0|1,0,0]=3 14455 B21R2.4854 O=C(NCc1ccccc1I)/C(=C\c2ccccc2)/F 11a_100015347259_100020889036 [0,2,0,0,0,0|1,0,0]=3 14456 B21R2.4854 O=C(NCc1ccccc1I)/C(=C\c2ccccc2)/F 527a_100015347259_100020889036 [0,2,0,0,0,0|1,0,0]=3 14457 B21R2.4854 O=C(NCc1ccccc1I)C(=Cc2cccnc2)F 11a_100015347259_100000731744 [0,2,0,0,0,0|2,0,0]=4 14458 B21R2.4854 O=C(NCc1ccccc1I)C(=Cc2cccnc2)F 240690a_100015347259_100000731744 [0,2,0,0,0,0|2,0,0]=4 14459 B21R2.4854 O=C(NCc1ccccc1I)C(=Cc2cccnc2)F 527a_100015347259_100000731744 [0,2,0,0,0,0|2,0,0]=4 14460 B21R2.4854 O=C(NCc1ccccc1I)C(=O)Nc2ccccc2 240690a_100015347259_100000738435 [0,2,0,0,0,0|2,0,0]=4 14461 B21R2.4854 O=C(NCc1ccccc1O)/C(=C/c2ccccc2)/Cl 240690a_100000185550_200020598536 [0,2,0,0,0,0|1,0,0]=3 14462 B21R2.4854 O=C(NCc1ccccc1O)/C(=C/c2ccccc2)/Cl 527a_100000185550_200020598536 [0,2,0,0,0,0|1,0,0]=3 14463 B21R2.4854 O=C(NCc1ccccc1O)/C(=C\c2ccccc2)/F 527a_100000185550_100020889036 [0,2,0,0,0,0|1,0,0]=3 14464 B21R2.4854 O=C(NCc1ccccc1O)C(=Cc2cccnc2)F 240690a_100000185550_100000731744 [0,2,0,0,0,0|2,0,0]=4 14465 B21R2.4854 O=C(NCc1ccccc1O)C(=Cc2cccnc2)F 527a_100000185550_100000731744 [0,2,0,0,0,0|2,0,0]=4 14466 B21R2.4854 O=C(NCc1ccccc1O)C(=O)Nc2ccccc2 240690a_100000185550_100000738435 [0,2,0,0,0,0|2,0,0]=4 14467 B21R2.4854 O=C(NCc1cccnc1Br)/C(=C/c2ccccc2)/Cl 11a_100009818023_200020598536 [0,2,0,0,0,0|2,0,0]=4 14468 B21R2.4854 O=C(NCc1cccnc1Br)/C(=C/c2ccccc2)/Cl 240690a_100009818023_200020598536 [0,2,0,0,0,0|2,0,0]=4 14469 B21R2.4854 O=C(NCc1cccnc1Br)/C(=C/c2ccccc2)/Cl 527a_100009818023_200020598536 [0,2,0,0,0,0|2,0,0]=4 14470 B21R2.4854 O=C(NCc1cccnc1Br)/C(=C\c2ccccc2)/F 11a_100009818023_100020889036 [0,2,0,0,0,0|2,0,0]=4 14471 B21R2.4854 O=C(NCc1cccnc1Br)/C(=C\c2ccccc2)/F 527a_100009818023_100020889036 [0,2,0,0,0,0|2,0,0]=4 14472 B21R2.4854 O=C(NCc1cccnc1Cl)/C(=C/c2ccccc2)/Cl 11a_100015189234_200020598536 [0,2,0,0,0,0|2,0,0]=4 14473 B21R2.4854 O=C(NCc1cccnc1Cl)/C(=C/c2ccccc2)/Cl 1626a_100015189234_200020598536 [0,2,0,0,0,0|2,0,0]=4 14474 B21R2.4854 O=C(NCc1cccnc1Cl)/C(=C/c2ccccc2)/Cl 240690a_100015189234_200020598536 [0,2,0,0,0,0|2,0,0]=4 14475 B21R2.4854 O=C(NCc1cccnc1Cl)/C(=C/c2ccccc2)/Cl 527a_100015189234_200020598536 [0,2,0,0,0,0|2,0,0]=4 14476 B21R2.4854 O=C(NCc1cccnc1Cl)/C(=C\c2ccccc2)/F 11a_100015189234_100020889036 [0,2,0,0,0,0|2,0,0]=4 14477 B21R2.4854 O=C(NCc1cccnc1Cl)/C(=C\c2ccccc2)/F 527a_100015189234_100020889036 [0,2,0,0,0,0|2,0,0]=4 14478 B21R2.4854 O=C(NCc1cccnc1F)/C(=C/c2ccccc2)/Cl 11a_100000724633_200020598536 [0,2,0,0,0,0|2,0,0]=4 14479 B21R2.4854 O=C(NCc1cccnc1F)/C(=C/c2ccccc2)/Cl 1626a_100000724633_200020598536 [0,2,0,0,0,0|2,0,0]=4 14480 B21R2.4854 O=C(NCc1cccnc1F)/C(=C/c2ccccc2)/Cl 240690a_100000724633_200020598536 [0,2,0,0,0,0|2,0,0]=4 14481 B21R2.4854 O=C(NCc1cccnc1F)/C(=C/c2ccccc2)/Cl 527a_100000724633_200020598536 [0,2,0,0,0,0|2,0,0]=4 14482 B21R2.4854 O=C(NCc1cccnc1F)/C(=C\c2ccccc2)/F 11a_100000724633_100020889036 [0,2,0,0,0,0|2,0,0]=4 14483 B21R2.4854 O=C(NCc1cccnc1F)/C(=C\c2ccccc2)/F 527a_100000724633_100020889036 [0,2,0,0,0,0|2,0,0]=4 14484 B21R2.4854 O=C(NCc1ccncc1Br)/C(=C/c2ccccc2)/Cl 11a_100020640021_200020598536 [0,2,0,0,0,0|2,0,0]=4 14485 B21R2.4854 O=C(NCc1ccncc1Br)/C(=C/c2ccccc2)/Cl 240690a_100020640021_200020598536 [0,2,0,0,0,0|2,0,0]=4 14486 B21R2.4854 O=C(NCc1ccncc1Br)/C(=C/c2ccccc2)/Cl 527a_100020640021_200020598536 [0,2,0,0,0,0|2,0,0]=4 14487 B21R2.4854 O=C(NCc1ccncc1Br)/C(=C\c2ccccc2)/F 11a_100020640021_100020889036 [0,2,0,0,0,0|2,0,0]=4 14488 B21R2.4854 O=C(NCc1ccncc1Br)/C(=C\c2ccccc2)/F 527a_100020640021_100020889036 [0,2,0,0,0,0|2,0,0]=4 14489 B21R2.4854 O=C(NCc1ccncc1F)/C(=C/c2ccccc2)/Cl 11a_100011935246_200020598536 [0,2,0,0,0,0|2,0,0]=4 14490 B21R2.4854 O=C(NCc1ccncc1F)/C(=C/c2ccccc2)/Cl 1626a_100011935246_200020598536 [0,2,0,0,0,0|2,0,0]=4 14491 B21R2.4854 O=C(NCc1ccncc1F)/C(=C/c2ccccc2)/Cl 240690a_100011935246_200020598536 [0,2,0,0,0,0|2,0,0]=4 14492 B21R2.4854 O=C(NCc1ccncc1F)/C(=C/c2ccccc2)/Cl 527a_100011935246_200020598536 [0,2,0,0,0,0|2,0,0]=4 14493 B21R2.4854 O=C(NCc1ccncc1F)/C(=C\c2ccccc2)/F 11a_100011935246_100020889036 [0,2,0,0,0,0|2,0,0]=4 14494 B21R2.4854 O=C(NCc1ccncc1F)/C(=C\c2ccccc2)/F 527a_100011935246_100020889036 [0,2,0,0,0,0|2,0,0]=4 14495 B21R2.4854 O=C(NCc1ncccc1Br)/C(=C/c2ccccc2)/Cl 11a_100020591323_200020598536 [0,2,0,0,0,0|2,0,0]=4 14496 B21R2.4854 O=C(NCc1ncccc1Br)/C(=C/c2ccccc2)/Cl 240690a_100020591323_200020598536 [0,2,0,0,0,0|2,0,0]=4 14497 B21R2.4854 O=C(NCc1ncccc1Br)/C(=C/c2ccccc2)/Cl 527a_100020591323_200020598536 [0,2,0,0,0,0|2,0,0]=4 14498 B21R2.4854 O=C(NCc1ncccc1Br)/C(=C\c2ccccc2)/F 11a_100020591323_100020889036 [0,2,0,0,0,0|2,0,0]=4 14499 B21R2.4854 O=C(NCc1ncccc1Br)/C(=C\c2ccccc2)/F 527a_100020591323_100020889036 [0,2,0,0,0,0|2,0,0]=4 14500 B21R2.4854 O=C(NCc1ncccc1Cl)/C(=C/c2ccccc2)/Cl 11a_100015189233_200020598536 [0,2,0,0,0,0|2,0,0]=4 14501 B21R2.4854 O=C(NCc1ncccc1Cl)/C(=C/c2ccccc2)/Cl 1626a_100015189233_200020598536 [0,2,0,0,0,0|2,0,0]=4 14502 B21R2.4854 O=C(NCc1ncccc1Cl)/C(=C/c2ccccc2)/Cl 240690a_100015189233_200020598536 [0,2,0,0,0,0|2,0,0]=4 14503 B21R2.4854 O=C(NCc1ncccc1Cl)/C(=C/c2ccccc2)/Cl 527a_100015189233_200020598536 [0,2,0,0,0,0|2,0,0]=4 14504 B21R2.4854 O=C(NCc1ncccc1Cl)/C(=C\c2ccccc2)/F 11a_100015189233_100020889036 [0,2,0,0,0,0|2,0,0]=4 14505 B21R2.4854 O=C(NCc1ncccc1Cl)/C(=C\c2ccccc2)/F 527a_100015189233_100020889036 [0,2,0,0,0,0|2,0,0]=4 14506 B21R2.4854 O=C(NCc1ncccc1F)/C(=C/c2ccccc2)/Cl 11a_100000690088_200020598536 [0,2,0,0,0,0|2,0,0]=4 14507 B21R2.4854 O=C(NCc1ncccc1F)/C(=C/c2ccccc2)/Cl 1626a_100000690088_200020598536 [0,2,0,0,0,0|2,0,0]=4 14508 B21R2.4854 O=C(NCc1ncccc1F)/C(=C/c2ccccc2)/Cl 240690a_100000690088_200020598536 [0,2,0,0,0,0|2,0,0]=4 14509 B21R2.4854 O=C(NCc1ncccc1F)/C(=C/c2ccccc2)/Cl 527a_100000690088_200020598536 [0,2,0,0,0,0|2,0,0]=4 14510 B21R2.4854 O=C(NCc1ncccc1F)/C(=C\c2ccccc2)/F 11a_100000690088_100020889036 [0,2,0,0,0,0|2,0,0]=4 14511 B21R2.4854 O=C(NCc1ncccc1F)/C(=C\c2ccccc2)/F 527a_100000690088_100020889036 [0,2,0,0,0,0|2,0,0]=4 14512 B21R2.4854 O=C(NNc1ccccc1Br)/C(=C/c2ccccc2)/Cl 22a_100000241748_200020598536 [0,2,0,0,0,0|2,0,0]=4 14513 B21R2.4854 O=C(NNc1ccccc1Br)/C(=C\c2ccccc2)/F 22a_100000241748_100020889036 [0,2,0,0,0,0|2,0,0]=4 14514 B21R2.4854 O=C(NNc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 22a_100000683529_200020598536 [0,2,0,0,0,0|2,0,0]=4 14515 B21R2.4854 O=C(NNc1ccccc1Cl)/C(=C\c2ccccc2)/F 22a_100000683529_100020889036 [0,2,0,0,0,0|2,0,0]=4 14516 B21R2.4854 O=C(NNc1ccccc1F)/C(=C/c2ccccc2)/Cl 22a_100000239246_200020598536 [0,2,0,0,0,0|2,0,0]=4 14517 B21R2.4854 O=C(NNc1ccccc1F)/C(=C\c2ccccc2)/F 22a_100000239246_100020889036 [0,2,0,0,0,0|2,0,0]=4 14518 B21R2.4854 O=C(NNc1ccccc1I)/C(=C/c2ccccc2)/Cl 22a_100011218156_200020598536 [0,2,0,0,0,0|2,0,0]=4 14519 B21R2.4854 O=C(NNc1ccccc1I)/C(=C\c2ccccc2)/F 22a_100011218156_100020889036 [0,2,0,0,0,0|2,0,0]=4 14520 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)CCc2ccccc2 1458a_100000693296_100000765856 [0,2,0,0,0,0|1,0,0]=3 14521 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)CCc2ccccn2 1458a_100000693296_100015183660 [0,2,0,0,0,0|2,0,0]=4 14522 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)CCc2cccnc2 1458a_100000693296_200011713674 [0,2,0,0,0,0|2,0,0]=4 14523 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)CCc2ccncc2 1458a_100000693296_100000723409 [0,2,0,0,0,0|2,0,0]=4 14524 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccccc2 11a_100015324214_100000693296 [0,2,0,0,0,0|1,0,0]=3 14525 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccccc2 1626a_100015324214_100000693296 [0,2,0,0,0,0|1,0,0]=3 14526 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccccc2 240690a_100015324214_100000693296 [0,2,0,0,0,0|1,0,0]=3 14527 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccccc2 527a_100015324214_100000693296 [0,2,0,0,0,0|1,0,0]=3 14528 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccccn2 11a_100000210449_100000693296 [0,2,0,0,0,0|2,0,0]=4 14529 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccccn2 1626a_100000210449_100000693296 [0,2,0,0,0,0|2,0,0]=4 14530 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccccn2 240690a_100000210449_100000693296 [0,2,0,0,0,0|2,0,0]=4 14531 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccccn2 527a_100000210449_100000693296 [0,2,0,0,0,0|2,0,0]=4 14532 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2cccnc2 11a_100000210453_100000693296 [0,2,0,0,0,0|2,0,0]=4 14533 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2cccnc2 240690a_100000210453_100000693296 [0,2,0,0,0,0|2,0,0]=4 14534 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2cccnc2 527a_100000210453_100000693296 [0,2,0,0,0,0|2,0,0]=4 14535 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccncc2 11a_100000210450_100000693296 [0,2,0,0,0,0|2,0,0]=4 14536 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccncc2 1626a_100000210450_100000693296 [0,2,0,0,0,0|2,0,0]=4 14537 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccncc2 240690a_100000210450_100000693296 [0,2,0,0,0,0|2,0,0]=4 14538 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NCc2ccncc2 527a_100000210450_100000693296 [0,2,0,0,0,0|2,0,0]=4 14539 B21R2.7844 CC(=Cc1ccccc1Cl)C(=O)NNc2ccccc2 22a_100015195140_100000693296 [0,2,0,0,0,0|2,0,0]=4 14540 B21R2.7844 CN(Cc1ccccc1Br)C(=O)C=Cc2ccccc2 11a_100000184654_100000210462 [0,2,0,0,0,0|1,0,0]=3 14541 B21R2.7844 CN(Cc1ccccc1Br)C(=O)C=Cc2ccccc2 1626a_100000184654_100000210462 [0,2,0,0,0,0|1,0,0]=3 14542 B21R2.7844 CN(Cc1ccccc1Br)C(=O)C=Cc2ccccn2 11a_100000184654_100000740811 [0,2,0,0,0,0|2,0,0]=4 14543 B21R2.7844 CN(Cc1ccccc1Br)C(=O)C=Cc2ccccn2 240690a_100000184654_100000740811 [0,2,0,0,0,0|2,0,0]=4 14544 B21R2.7844 CN(Cc1ccccc1Br)C(=O)C=Cc2cccnc2 11a_100000184654_100000735890 [0,2,0,0,0,0|2,0,0]=4 14545 B21R2.7844 CN(Cc1ccccc1Br)C(=O)C=Cc2cccnc2 240690a_100000184654_100000735890 [0,2,0,0,0,0|2,0,0]=4 14546 B21R2.7844 CN(Cc1ccccc1Br)C(=O)C=Cc2ccncc2 240690a_100000184654_100000682801 [0,2,0,0,0,0|2,0,0]=4 14547 B21R2.7844 CN(Cc1ccccc1Cl)C(=O)C=Cc2ccccc2 11a_100000184507_100000210462 [0,2,0,0,0,0|1,0,0]=3 14548 B21R2.7844 CN(Cc1ccccc1Cl)C(=O)C=Cc2ccccc2 1626a_100000184507_100000210462 [0,2,0,0,0,0|1,0,0]=3 14549 B21R2.7844 CN(Cc1ccccc1Cl)C(=O)C=Cc2ccccn2 11a_100000184507_100000740811 [0,2,0,0,0,0|2,0,0]=4 14550 B21R2.7844 CN(Cc1ccccc1Cl)C(=O)C=Cc2ccccn2 240690a_100000184507_100000740811 [0,2,0,0,0,0|2,0,0]=4 14551 B21R2.7844 CN(Cc1ccccc1Cl)C(=O)C=Cc2cccnc2 11a_100000184507_100000735890 [0,2,0,0,0,0|2,0,0]=4 14552 B21R2.7844 CN(Cc1ccccc1Cl)C(=O)C=Cc2cccnc2 240690a_100000184507_100000735890 [0,2,0,0,0,0|2,0,0]=4 14553 B21R2.7844 CN(Cc1ccccc1Cl)C(=O)C=Cc2ccncc2 240690a_100000184507_100000682801 [0,2,0,0,0,0|2,0,0]=4 14554 B21R2.7844 CN(Cc1ccccc1F)C(=O)C=Cc2ccccc2 11a_100000742528_100000210462 [0,2,0,0,0,0|1,0,0]=3 14555 B21R2.7844 CN(Cc1ccccc1F)C(=O)C=Cc2ccccc2 1626a_100000742528_100000210462 [0,2,0,0,0,0|1,0,0]=3 14556 B21R2.7844 CN(Cc1ccccc1F)C(=O)C=Cc2ccccn2 11a_100000742528_100000740811 [0,2,0,0,0,0|2,0,0]=4 14557 B21R2.7844 CN(Cc1ccccc1F)C(=O)C=Cc2ccccn2 240690a_100000742528_100000740811 [0,2,0,0,0,0|2,0,0]=4 14558 B21R2.7844 CN(Cc1ccccc1F)C(=O)C=Cc2cccnc2 11a_100000742528_100000735890 [0,2,0,0,0,0|2,0,0]=4 14559 B21R2.7844 CN(Cc1ccccc1F)C(=O)C=Cc2cccnc2 240690a_100000742528_100000735890 [0,2,0,0,0,0|2,0,0]=4 14560 B21R2.7844 CN(Cc1ccccc1F)C(=O)C=Cc2ccncc2 240690a_100000742528_100000682801 [0,2,0,0,0,0|2,0,0]=4 14561 B21R2.7844 CN(Cc1ccccc1O)C(=O)C=Cc2ccccn2 240690a_100015189988_100000740811 [0,2,0,0,0,0|2,0,0]=4 14562 B21R2.7844 CN(Cc1ccccc1O)C(=O)C=Cc2cccnc2 240690a_100015189988_100000735890 [0,2,0,0,0,0|2,0,0]=4 14563 B21R2.7844 CN(Cc1ccccc1O)C(=O)C=Cc2ccncc2 240690a_100015189988_100000682801 [0,2,0,0,0,0|2,0,0]=4 14564 B21R2.7844 CN(Cc1cccnc1Cl)C(=O)C=Cc2ccccc2 11a_103496529121_100000210462 [0,2,0,0,0,0|2,0,0]=4 14565 B21R2.7844 Cc1ccccc1CN(C)C(=O)C=Cc2ccccc2 1626a_100000184421_100000210462 [0,2,0,0,0,0|1,0,0]=3 14566 B21R2.7844 Cc1ccccc1CN(C)C(=O)C=Cc2ccccn2 240690a_100000184421_100000740811 [0,2,0,0,0,0|2,0,0]=4 14567 B21R2.7844 Cc1ccccc1CN(C)C(=O)C=Cc2cccnc2 240690a_100000184421_100000735890 [0,2,0,0,0,0|2,0,0]=4 14568 B21R2.7844 Cc1ccccc1CN(C)C(=O)C=Cc2ccncc2 240690a_100000184421_100000682801 [0,2,0,0,0,0|2,0,0]=4 14569 B21R2.7844 Cc1ccccc1NC(=O)C(=O)CCc2ccccc2 1458a_200011297352_100000765856 [0,2,0,0,0,0|2,0,0]=4 14570 B21R2.7844 Cc1ccccc1NC(=O)C(=O)NCc2ccccc2 240690a_100015324214_200011297352 [0,2,0,0,0,0|2,0,0]=4 14571 B21R2.7844 Cc1ccccc1NC(F)C(=O)OCc2ccccc2 34a_100015192222_100000036447 [0,2,0,0,0,0|1,0,1]=4 14572 B21R2.7844 Cc1ccccc1OC(F)C(=O)OCc2ccccc2 34a_100000210338_100000036447 [0,2,0,0,0,0|1,0,1]=4 14573 B21R2.7844 Cc1ccccc1OC(F)C(=O)OCc2ccccc2 7a_100000210338_100000036447 [0,2,0,0,0,0|1,0,1]=4 14574 B21R2.7844 Cc1ccccc1SC(F)C(=O)OCc2ccccc2 62a_100000036447_100000210755 [0,2,0,0,0,0|1,0,1]=4 14575 B21R2.7844 Cc1ccccc1SC(F)C(=O)OCc2ccccc2 62a_100000210755_100000036447 [0,2,0,0,0,0|1,0,1]=4 14576 B21R2.7844 Cc1ncccc1CN(C)C(=O)C=Cc2ccccc2 11a_200011875998_100000210462 [0,2,0,0,0,0|2,0,0]=4 14577 B21R2.7844 Nc1ccccc1OC(F)C(=O)OCc2ccccc2 34a_100000185747_100000036447 [0,2,0,0,0,0|1,0,1]=4 14578 B21R2.7844 Nc1ccccc1OC(F)C(=O)OCc2ccccc2 7a_100000185747_100000036447 [0,2,0,0,0,0|1,0,1]=4 14579 B21R2.7844 Nc1ccccc1SC(F)C(=O)OCc2ccccc2 62a_100000036447_100000210017 [0,2,0,0,0,0|1,0,1]=4 14580 B21R2.7844 Nc1ccccc1SC(F)C(=O)OCc2ccccc2 62a_100000210017_100000036447 [0,2,0,0,0,0|1,0,1]=4 14581 B21R2.7844 O=C(CCc1ccccc1)C(=O)Nc2ccccc2F 1458a_200011297310_100000765856 [0,2,0,0,0,0|2,0,0]=4 14582 B21R2.7844 O=C(NCc1ccccc1)C(=O)Nc2ccccc2Cl 240690a_100015324214_200011297307 [0,2,0,0,0,0|2,0,0]=4 14583 B21R2.7844 O=C(NCc1ccccc1)C(=O)Nc2ccccc2F 240690a_100015324214_200011297310 [0,2,0,0,0,0|2,0,0]=4 14584 B21R2.7844 O=C(OCc1ccccc1)C(F)Nc2ccccc2Br 34a_100000210017_100000036447 [0,2,0,0,0,0|1,0,1]=4 14585 B21R2.7844 O=C(OCc1ccccc1)C(F)Nc2ccccc2Cl 34a_100000185783_100000036447 [0,2,0,0,0,0|1,0,1]=4 14586 B21R2.7844 O=C(OCc1ccccc1)C(F)Nc2ccccc2F 34a_100000210422_100000036447 [0,2,0,0,0,0|1,0,1]=4 14587 B21R2.7844 O=C(OCc1ccccc1)C(F)Nc2ccccc2I 34a_100000210053_100000036447 [0,2,0,0,0,0|1,0,1]=4 14588 B21R2.7844 O=C(OCc1ccccc1)C(F)Nc2ccccc2O 34a_100000185747_100000036447 [0,2,0,0,0,0|1,0,1]=4 14589 B21R2.7844 O=C(OCc1ccccc1)C(F)Oc2ccccc2Br 34a_100000181306_100000036447 [0,2,0,0,0,0|1,0,1]=4 14590 B21R2.7844 O=C(OCc1ccccc1)C(F)Oc2ccccc2Br 7a_100000181306_100000036447 [0,2,0,0,0,0|1,0,1]=4 14591 B21R2.7844 O=C(OCc1ccccc1)C(F)Oc2ccccc2Cl 34a_100000210172_100000036447 [0,2,0,0,0,0|1,0,1]=4 14592 B21R2.7844 O=C(OCc1ccccc1)C(F)Oc2ccccc2Cl 7a_100000210172_100000036447 [0,2,0,0,0,0|1,0,1]=4 14593 B21R2.7844 O=C(OCc1ccccc1)C(F)Oc2ccccc2F 34a_100000210171_100000036447 [0,2,0,0,0,0|1,0,1]=4 14594 B21R2.7844 O=C(OCc1ccccc1)C(F)Oc2ccccc2F 7a_100000210171_100000036447 [0,2,0,0,0,0|1,0,1]=4 14595 B21R2.7844 O=C(OCc1ccccc1)C(F)Oc2ccccc2I 34a_100000739446_100000036447 [0,2,0,0,0,0|1,0,1]=4 14596 B21R2.7844 O=C(OCc1ccccc1)C(F)Oc2ccccc2I 7a_100000739446_100000036447 [0,2,0,0,0,0|1,0,1]=4 14597 B21R2.7844 O=C(OCc1ccccc1)C(F)Sc2ccccc2Br 62a_100000036447_100000695589 [0,2,0,0,0,0|1,0,1]=4 14598 B21R2.7844 O=C(OCc1ccccc1)C(F)Sc2ccccc2Br 62a_100000695589_100000036447 [0,2,0,0,0,0|1,0,1]=4 14599 B21R2.7844 O=C(OCc1ccccc1)C(F)Sc2ccccc2Cl 62a_100000036447_100000764095 [0,2,0,0,0,0|1,0,1]=4 14600 B21R2.7844 O=C(OCc1ccccc1)C(F)Sc2ccccc2Cl 62a_100000764095_100000036447 [0,2,0,0,0,0|1,0,1]=4 14601 B21R2.7844 O=C(OCc1ccccc1)C(F)Sc2ccccc2F 62a_100000036447_100011215700 [0,2,0,0,0,0|1,0,1]=4 14602 B21R2.7844 O=C(OCc1ccccc1)C(F)Sc2ccccc2F 62a_100011215700_100000036447 [0,2,0,0,0,0|1,0,1]=4 14603 B21R2.7844 O=C(OCc1ccccc1)C(F)Sc2ccccc2O 62a_100000036447_100000739446 [0,2,0,0,0,0|1,0,1]=4 14604 B21R2.7844 O=C(OCc1ccccc1)C(F)Sc2ccccc2O 62a_100000739446_100000036447 [0,2,0,0,0,0|1,0,1]=4 14605 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccccc2)C 11a_100000689800_100000210462 [0,2,0,0,0,0|1,0,0]=3 14606 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccccc2)C 1626a_100000689800_100000210462 [0,2,0,0,0,0|1,0,0]=3 14607 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccccc2)F 11a_100000762012_100000210462 [0,2,0,0,0,0|1,0,0]=3 14608 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccccc2)F 1626a_100000762012_100000210462 [0,2,0,0,0,0|1,0,0]=3 14609 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccccn2)C 11a_100000689800_100000740811 [0,2,0,0,0,0|2,0,0]=4 14610 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccccn2)C 240690a_100000689800_100000740811 [0,2,0,0,0,0|2,0,0]=4 14611 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccccn2)F 11a_100000762012_100000740811 [0,2,0,0,0,0|2,0,0]=4 14612 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccccn2)F 240690a_100000762012_100000740811 [0,2,0,0,0,0|2,0,0]=4 14613 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2cccnc2)C 11a_100000689800_100000735890 [0,2,0,0,0,0|2,0,0]=4 14614 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2cccnc2)C 240690a_100000689800_100000735890 [0,2,0,0,0,0|2,0,0]=4 14615 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2cccnc2)F 11a_100000762012_100000735890 [0,2,0,0,0,0|2,0,0]=4 14616 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2cccnc2)F 240690a_100000762012_100000735890 [0,2,0,0,0,0|2,0,0]=4 14617 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccncc2)C 240690a_100000689800_100000682801 [0,2,0,0,0,0|2,0,0]=4 14618 B21R2.10009 Cc1cccc(c1CNC(=O)C=Cc2ccncc2)F 240690a_100000762012_100000682801 [0,2,0,0,0,0|2,0,0]=4 14619 B21R2.10009 Cc1cccc(c1NCC(=O)OCc2ccccc2)Br 34a_100011834072_100000753625 [0,2,0,0,0,0|1,0,1]=4 14620 B21R2.10009 Cc1cccc(c1NCC(=O)OCc2ccccc2)C 34a_100000185769_100000753625 [0,2,0,0,0,0|1,0,1]=4 14621 B21R2.10009 Cc1cccc(c1NCC(=O)OCc2ccccc2)Cl 34a_100000756524_100000753625 [0,2,0,0,0,0|1,0,1]=4 14622 B21R2.10009 Cc1cccc(c1NCC(=O)OCc2ccccc2)F 34a_100000766463_100000753625 [0,2,0,0,0,0|1,0,1]=4 14623 B21R2.10009 Cc1cccc(c1NCC(=O)OCc2ccccc2)O 34a_100000743429_100000753625 [0,2,0,0,0,0|1,0,1]=4 14624 B21R2.10009 Cc1cccc(c1NNC(=O)C=Cc2ccccc2)C 22a_100016987787_100000210462 [0,2,0,0,0,0|2,0,0]=4 14625 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)Br 34a_100009817157_100000753625 [0,2,0,0,0,0|1,0,1]=4 14626 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)Br 7a_100009817157_100000753625 [0,2,0,0,0,0|1,0,1]=4 14627 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)C 34a_100000210341_100000753625 [0,2,0,0,0,0|1,0,1]=4 14628 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)C 7a_100000210341_100000753625 [0,2,0,0,0,0|1,0,1]=4 14629 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)Cl 34a_100000033731_100000753625 [0,2,0,0,0,0|1,0,1]=4 14630 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)Cl 7a_100000033731_100000753625 [0,2,0,0,0,0|1,0,1]=4 14631 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)F 34a_100011659162_100000753625 [0,2,0,0,0,0|1,0,1]=4 14632 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)F 7a_100011659162_100000753625 [0,2,0,0,0,0|1,0,1]=4 14633 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)N 34a_100000756359_100000753625 [0,2,0,0,0,0|1,0,1]=4 14634 B21R2.10009 Cc1cccc(c1OCC(=O)OCc2ccccc2)N 7a_100000756359_100000753625 [0,2,0,0,0,0|1,0,1]=4 14635 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)Br 62a_100000753625_100010141302 [0,2,0,0,0,0|1,0,1]=4 14636 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)Br 62a_100010141302_100000753625 [0,2,0,0,0,0|1,0,1]=4 14637 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)C 62a_100000033847_100000753625 [0,2,0,0,0,0|1,0,1]=4 14638 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)C 62a_100000753625_100000033847 [0,2,0,0,0,0|1,0,1]=4 14639 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)Cl 62a_100000043165_100000753625 [0,2,0,0,0,0|1,0,1]=4 14640 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100000043165 [0,2,0,0,0,0|1,0,1]=4 14641 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)F 62a_100000753625_100011218421 [0,2,0,0,0,0|1,0,1]=4 14642 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)F 62a_100011218421_100000753625 [0,2,0,0,0,0|1,0,1]=4 14643 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)N 62a_100000684715_100000753625 [0,2,0,0,0,0|1,0,1]=4 14644 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)N 62a_100000753625_100000684715 [0,2,0,0,0,0|1,0,1]=4 14645 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)O 62a_100000686692_100000753625 [0,2,0,0,0,0|1,0,1]=4 14646 B21R2.10009 Cc1cccc(c1SCC(=O)OCc2ccccc2)O 62a_100000753625_100000686692 [0,2,0,0,0,0|1,0,1]=4 14647 B21R2.10009 Nc1cccc(c1OCC(=O)OCc2ccccc2)Br 34a_100011934915_100000753625 [0,2,0,0,0,0|1,0,1]=4 14648 B21R2.10009 Nc1cccc(c1OCC(=O)OCc2ccccc2)Cl 34a_100000754742_100000753625 [0,2,0,0,0,0|1,0,1]=4 14649 B21R2.10009 Nc1cccc(c1OCC(=O)OCc2ccccc2)F 34a_100011934987_100000753625 [0,2,0,0,0,0|1,0,1]=4 14650 B21R2.10009 Nc1cccc(c1OCC(=O)OCc2ccccc2)I 34a_100010084371_100000753625 [0,2,0,0,0,0|1,0,1]=4 14651 B21R2.10009 Nc1cccc(c1OCC(=O)OCc2ccccc2)N 34a_200016994477_100000753625 [0,2,0,0,0,0|1,0,1]=4 14652 B21R2.10009 Nc1cccc(c1SCC(=O)OCc2ccccc2)Br 62a_100000753625_100020590159 [0,2,0,0,0,0|1,0,1]=4 14653 B21R2.10009 Nc1cccc(c1SCC(=O)OCc2ccccc2)Br 62a_100020590159_100000753625 [0,2,0,0,0,0|1,0,1]=4 14654 B21R2.10009 Nc1cccc(c1SCC(=O)OCc2ccccc2)Cl 62a_100000049713_100000753625 [0,2,0,0,0,0|1,0,1]=4 14655 B21R2.10009 Nc1cccc(c1SCC(=O)OCc2ccccc2)Cl 62a_100000753625_100000049713 [0,2,0,0,0,0|1,0,1]=4 14656 B21R2.10009 Nc1cccc(c1SCC(=O)OCc2ccccc2)F 62a_100000690935_100000753625 [0,2,0,0,0,0|1,0,1]=4 14657 B21R2.10009 Nc1cccc(c1SCC(=O)OCc2ccccc2)F 62a_100000753625_100000690935 [0,2,0,0,0,0|1,0,1]=4 14658 B21R2.10009 Nc1cccc(c1SCC(=O)OCc2ccccc2)O 62a_100000753625_100012183704 [0,2,0,0,0,0|1,0,1]=4 14659 B21R2.10009 Nc1cccc(c1SCC(=O)OCc2ccccc2)O 62a_100012183704_100000753625 [0,2,0,0,0,0|1,0,1]=4 14660 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)CCc2ccccc2 1458a_100000185082_100000765856 [0,2,0,0,0,0|1,0,0]=3 14661 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)CCc2ccccn2 1458a_100000185082_100015183660 [0,2,0,0,0,0|2,0,0]=4 14662 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)CCc2cccnc2 1458a_100000185082_200011713674 [0,2,0,0,0,0|2,0,0]=4 14663 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)CCc2ccncc2 1458a_100000185082_100000723409 [0,2,0,0,0,0|2,0,0]=4 14664 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccccc2 11a_100015324214_100000185082 [0,2,0,0,0,0|1,0,0]=3 14665 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccccc2 1626a_100015324214_100000185082 [0,2,0,0,0,0|1,0,0]=3 14666 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccccc2 240690a_100015324214_100000185082 [0,2,0,0,0,0|1,0,0]=3 14667 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccccn2 11a_100000210449_100000185082 [0,2,0,0,0,0|2,0,0]=4 14668 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccccn2 1626a_100000210449_100000185082 [0,2,0,0,0,0|2,0,0]=4 14669 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccccn2 240690a_100000210449_100000185082 [0,2,0,0,0,0|2,0,0]=4 14670 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2cccnc2 11a_100000210453_100000185082 [0,2,0,0,0,0|2,0,0]=4 14671 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2cccnc2 240690a_100000210453_100000185082 [0,2,0,0,0,0|2,0,0]=4 14672 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccncc2 11a_100000210450_100000185082 [0,2,0,0,0,0|2,0,0]=4 14673 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccncc2 1626a_100000210450_100000185082 [0,2,0,0,0,0|2,0,0]=4 14674 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NCc2ccncc2 240690a_100000210450_100000185082 [0,2,0,0,0,0|2,0,0]=4 14675 B21R2.10009 O=C(C=Cc1c(cccc1Cl)Cl)NNc2ccccc2 22a_100015195140_100000185082 [0,2,0,0,0,0|2,0,0]=4 14676 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)CCc2ccccc2 1458a_100016278423_100000765856 [0,2,0,0,0,0|1,0,0]=3 14677 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)CCc2ccccn2 1458a_100016278423_100015183660 [0,2,0,0,0,0|2,0,0]=4 14678 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)CCc2cccnc2 1458a_100016278423_200011713674 [0,2,0,0,0,0|2,0,0]=4 14679 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)CCc2ccncc2 1458a_100016278423_100000723409 [0,2,0,0,0,0|2,0,0]=4 14680 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccccc2 11a_100015324214_100016278423 [0,2,0,0,0,0|1,0,0]=3 14681 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccccc2 1626a_100015324214_100016278423 [0,2,0,0,0,0|1,0,0]=3 14682 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccccc2 240690a_100015324214_100016278423 [0,2,0,0,0,0|1,0,0]=3 14683 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccccn2 11a_100000210449_100016278423 [0,2,0,0,0,0|2,0,0]=4 14684 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccccn2 1626a_100000210449_100016278423 [0,2,0,0,0,0|2,0,0]=4 14685 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccccn2 240690a_100000210449_100016278423 [0,2,0,0,0,0|2,0,0]=4 14686 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2cccnc2 11a_100000210453_100016278423 [0,2,0,0,0,0|2,0,0]=4 14687 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2cccnc2 240690a_100000210453_100016278423 [0,2,0,0,0,0|2,0,0]=4 14688 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccncc2 11a_100000210450_100016278423 [0,2,0,0,0,0|2,0,0]=4 14689 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccncc2 1626a_100000210450_100016278423 [0,2,0,0,0,0|2,0,0]=4 14690 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NCc2ccncc2 240690a_100000210450_100016278423 [0,2,0,0,0,0|2,0,0]=4 14691 B21R2.10009 O=C(C=Cc1c(cccc1Cl)F)NNc2ccccc2 22a_100015195140_100016278423 [0,2,0,0,0,0|2,0,0]=4 14692 B21R2.10009 O=C(C=Cc1c(cccc1F)F)CCc2ccccc2 1458a_100000738813_100000765856 [0,2,0,0,0,0|1,0,0]=3 14693 B21R2.10009 O=C(C=Cc1c(cccc1F)F)CCc2ccccn2 1458a_100000738813_100015183660 [0,2,0,0,0,0|2,0,0]=4 14694 B21R2.10009 O=C(C=Cc1c(cccc1F)F)CCc2cccnc2 1458a_100000738813_200011713674 [0,2,0,0,0,0|2,0,0]=4 14695 B21R2.10009 O=C(C=Cc1c(cccc1F)F)CCc2ccncc2 1458a_100000738813_100000723409 [0,2,0,0,0,0|2,0,0]=4 14696 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccccc2 11a_100015324214_100000738813 [0,2,0,0,0,0|1,0,0]=3 14697 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccccc2 1626a_100015324214_100000738813 [0,2,0,0,0,0|1,0,0]=3 14698 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccccc2 240690a_100015324214_100000738813 [0,2,0,0,0,0|1,0,0]=3 14699 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccccn2 11a_100000210449_100000738813 [0,2,0,0,0,0|2,0,0]=4 14700 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccccn2 1626a_100000210449_100000738813 [0,2,0,0,0,0|2,0,0]=4 14701 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccccn2 240690a_100000210449_100000738813 [0,2,0,0,0,0|2,0,0]=4 14702 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2cccnc2 11a_100000210453_100000738813 [0,2,0,0,0,0|2,0,0]=4 14703 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2cccnc2 240690a_100000210453_100000738813 [0,2,0,0,0,0|2,0,0]=4 14704 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccncc2 11a_100000210450_100000738813 [0,2,0,0,0,0|2,0,0]=4 14705 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccncc2 1626a_100000210450_100000738813 [0,2,0,0,0,0|2,0,0]=4 14706 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NCc2ccncc2 240690a_100000210450_100000738813 [0,2,0,0,0,0|2,0,0]=4 14707 B21R2.10009 O=C(C=Cc1c(cccc1F)F)NNc2ccccc2 22a_100015195140_100000738813 [0,2,0,0,0,0|2,0,0]=4 14708 B21R2.10009 O=C(C=Cc1c(cccc1I)F)CCc2ccccc2 6a_100010178011_100000210092 [0,2,0,0,0,0|1,0,0]=3 14709 B21R2.10009 O=C(C=Cc1c(cccc1I)F)COc2ccccc2 6a_100010178011_100000150576 [0,2,0,0,0,0|2,0,0]=4 14710 B21R2.10009 O=C(C=Cc1c(cccc1I)F)CSc2ccccc2 6a_100010178011_100000150717 [0,2,0,0,0,0|2,0,0]=4 14711 B21R2.10009 O=C(C=Cc1c(cncc1Br)Cl)CCc2ccccc2 6a_100010064873_100000210092 [0,2,0,0,0,0|2,0,0]=4 14712 B21R2.10009 O=C(C=Cc1c(cncc1Br)F)CCc2ccccc2 6a_100010064882_100000210092 [0,2,0,0,0,0|2,0,0]=4 14713 B21R2.10009 O=C(C=Cc1c(cncc1Cl)Cl)CCc2ccccc2 6a_100000067493_100000210092 [0,2,0,0,0,0|2,0,0]=4 14714 B21R2.10009 O=C(C=Cc1c(cncc1F)F)CCc2ccccc2 6a_100000068831_100000210092 [0,2,0,0,0,0|2,0,0]=4 14715 B21R2.10009 O=C(C=Cc1ccccc1)CCc2c(cccc2Cl)Cl 1458a_100000210462_100012161200 [0,2,0,0,0,0|1,0,0]=3 14716 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cccc2Br)F 11a_100012349121_100000210462 [0,2,0,0,0,0|1,0,0]=3 14717 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cccc2Br)F 1626a_100012349121_100000210462 [0,2,0,0,0,0|1,0,0]=3 14718 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cccc2Cl)Cl 11a_100000174884_100000210462 [0,2,0,0,0,0|1,0,0]=3 14719 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cccc2Cl)Cl 1626a_100000174884_100000210462 [0,2,0,0,0,0|1,0,0]=3 14720 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cccc2Cl)F 11a_100000174883_100000210462 [0,2,0,0,0,0|1,0,0]=3 14721 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cccc2Cl)F 1626a_100000174883_100000210462 [0,2,0,0,0,0|1,0,0]=3 14722 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cccc2F)F 11a_100000688400_100000210462 [0,2,0,0,0,0|1,0,0]=3 14723 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cccc2F)F 1626a_100000688400_100000210462 [0,2,0,0,0,0|1,0,0]=3 14724 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cncc2Cl)Cl 11a_200009887528_100000210462 [0,2,0,0,0,0|2,0,0]=4 14725 B21R2.10009 O=C(C=Cc1ccccc1)NCc2c(cncc2Cl)Cl 1626a_200009887528_100000210462 [0,2,0,0,0,0|2,0,0]=4 14726 B21R2.10009 O=C(C=Cc1ccccc1)NNc2c(cccc2Br)F 22a_100016994982_100000210462 [0,2,0,0,0,0|2,0,0]=4 14727 B21R2.10009 O=C(C=Cc1ccccc1)NNc2c(cccc2Cl)Cl 22a_100000688888_100000210462 [0,2,0,0,0,0|2,0,0]=4 14728 B21R2.10009 O=C(C=Cc1ccccc1)NNc2c(cccc2Cl)F 22a_100000703590_100000210462 [0,2,0,0,0,0|2,0,0]=4 14729 B21R2.10009 O=C(C=Cc1ccccc1)NNc2c(cccc2F)F 22a_100000757689_100000210462 [0,2,0,0,0,0|2,0,0]=4 14730 B21R2.10009 O=C(C=Cc1ccccn1)CCc2c(cccc2Cl)Cl 1458a_100000740811_100012161200 [0,2,0,0,0,0|2,0,0]=4 14731 B21R2.10009 O=C(C=Cc1ccccn1)NCc2c(cccc2Br)F 11a_100012349121_100000740811 [0,2,0,0,0,0|2,0,0]=4 14732 B21R2.10009 O=C(C=Cc1ccccn1)NCc2c(cccc2Br)F 240690a_100012349121_100000740811 [0,2,0,0,0,0|2,0,0]=4 14733 B21R2.10009 O=C(C=Cc1ccccn1)NCc2c(cccc2Cl)Cl 11a_100000174884_100000740811 [0,2,0,0,0,0|2,0,0]=4 14734 B21R2.10009 O=C(C=Cc1ccccn1)NCc2c(cccc2Cl)Cl 240690a_100000174884_100000740811 [0,2,0,0,0,0|2,0,0]=4 14735 B21R2.10009 O=C(C=Cc1ccccn1)NCc2c(cccc2Cl)F 11a_100000174883_100000740811 [0,2,0,0,0,0|2,0,0]=4 14736 B21R2.10009 O=C(C=Cc1ccccn1)NCc2c(cccc2Cl)F 240690a_100000174883_100000740811 [0,2,0,0,0,0|2,0,0]=4 14737 B21R2.10009 O=C(C=Cc1ccccn1)NCc2c(cccc2F)F 11a_100000688400_100000740811 [0,2,0,0,0,0|2,0,0]=4 14738 B21R2.10009 O=C(C=Cc1ccccn1)NCc2c(cccc2F)F 240690a_100000688400_100000740811 [0,2,0,0,0,0|2,0,0]=4 14739 B21R2.10009 O=C(C=Cc1cccnc1)CCc2c(cccc2Cl)Cl 1458a_100000735890_100012161200 [0,2,0,0,0,0|2,0,0]=4 14740 B21R2.10009 O=C(C=Cc1cccnc1)NCc2c(cccc2Br)F 11a_100012349121_100000735890 [0,2,0,0,0,0|2,0,0]=4 14741 B21R2.10009 O=C(C=Cc1cccnc1)NCc2c(cccc2Br)F 240690a_100012349121_100000735890 [0,2,0,0,0,0|2,0,0]=4 14742 B21R2.10009 O=C(C=Cc1cccnc1)NCc2c(cccc2Cl)Cl 11a_100000174884_100000735890 [0,2,0,0,0,0|2,0,0]=4 14743 B21R2.10009 O=C(C=Cc1cccnc1)NCc2c(cccc2Cl)Cl 240690a_100000174884_100000735890 [0,2,0,0,0,0|2,0,0]=4 14744 B21R2.10009 O=C(C=Cc1cccnc1)NCc2c(cccc2Cl)F 11a_100000174883_100000735890 [0,2,0,0,0,0|2,0,0]=4 14745 B21R2.10009 O=C(C=Cc1cccnc1)NCc2c(cccc2Cl)F 240690a_100000174883_100000735890 [0,2,0,0,0,0|2,0,0]=4 14746 B21R2.10009 O=C(C=Cc1cccnc1)NCc2c(cccc2F)F 11a_100000688400_100000735890 [0,2,0,0,0,0|2,0,0]=4 14747 B21R2.10009 O=C(C=Cc1cccnc1)NCc2c(cccc2F)F 240690a_100000688400_100000735890 [0,2,0,0,0,0|2,0,0]=4 14748 B21R2.10009 O=C(C=Cc1ccncc1)CCc2c(cccc2Cl)Cl 1458a_100000682801_100012161200 [0,2,0,0,0,0|2,0,0]=4 14749 B21R2.10009 O=C(C=Cc1ccncc1)NCc2c(cccc2Br)F 240690a_100012349121_100000682801 [0,2,0,0,0,0|2,0,0]=4 14750 B21R2.10009 O=C(C=Cc1ccncc1)NCc2c(cccc2Cl)Cl 240690a_100000174884_100000682801 [0,2,0,0,0,0|2,0,0]=4 14751 B21R2.10009 O=C(C=Cc1ccncc1)NCc2c(cccc2Cl)F 240690a_100000174883_100000682801 [0,2,0,0,0,0|2,0,0]=4 14752 B21R2.10009 O=C(C=Cc1ccncc1)NCc2c(cccc2F)F 240690a_100000688400_100000682801 [0,2,0,0,0,0|2,0,0]=4 14753 B21R2.10009 O=C(CNc1c(cccc1Br)Br)OCc2ccccc2 34a_100000690995_100000753625 [0,2,0,0,0,0|1,0,1]=4 14754 B21R2.10009 O=C(CNc1c(cccc1Br)Cl)OCc2ccccc2 34a_100102946385_100000753625 [0,2,0,0,0,0|1,0,1]=4 14755 B21R2.10009 O=C(CNc1c(cccc1Br)F)OCc2ccccc2 34a_100000684712_100000753625 [0,2,0,0,0,0|1,0,1]=4 14756 B21R2.10009 O=C(CNc1c(cccc1Br)O)OCc2ccccc2 34a_100011934926_100000753625 [0,2,0,0,0,0|1,0,1]=4 14757 B21R2.10009 O=C(CNc1c(cccc1Cl)Cl)OCc2ccccc2 34a_100000210028_100000753625 [0,2,0,0,0,0|1,0,1]=4 14758 B21R2.10009 O=C(CNc1c(cccc1Cl)F)OCc2ccccc2 34a_100000760031_100000753625 [0,2,0,0,0,0|1,0,1]=4 14759 B21R2.10009 O=C(CNc1c(cccc1Cl)O)OCc2ccccc2 34a_100012022510_100000753625 [0,2,0,0,0,0|1,0,1]=4 14760 B21R2.10009 O=C(CNc1c(cccc1F)F)OCc2ccccc2 2230a_100000210704_100000753625 [0,2,0,0,0,0|1,0,1]=4 14761 B21R2.10009 O=C(CNc1c(cccc1F)F)OCc2ccccc2 34a_100000210704_100000753625 [0,2,0,0,0,0|1,0,1]=4 14762 B21R2.10009 O=C(CNc1c(cccc1F)O)OCc2ccccc2 34a_100020591140_100000753625 [0,2,0,0,0,0|1,0,1]=4 14763 B21R2.10009 O=C(CNc1c(cccc1I)F)OCc2ccccc2 34a_100000042321_100000753625 [0,2,0,0,0,0|1,0,1]=4 14764 B21R2.10009 O=C(COc1c(cccc1Br)Br)OCc2ccccc2 34a_100000736428_100000753625 [0,2,0,0,0,0|1,0,1]=4 14765 B21R2.10009 O=C(COc1c(cccc1Br)Br)OCc2ccccc2 7a_100000736428_100000753625 [0,2,0,0,0,0|1,0,1]=4 14766 B21R2.10009 O=C(COc1c(cccc1Br)Cl)OCc2ccccc2 34a_100010214474_100000753625 [0,2,0,0,0,0|1,0,1]=4 14767 B21R2.10009 O=C(COc1c(cccc1Br)Cl)OCc2ccccc2 7a_100010214474_100000753625 [0,2,0,0,0,0|1,0,1]=4 14768 B21R2.10009 O=C(COc1c(cccc1Br)F)OCc2ccccc2 34a_100009813666_100000753625 [0,2,0,0,0,0|1,0,1]=4 14769 B21R2.10009 O=C(COc1c(cccc1Br)F)OCc2ccccc2 7a_100009813666_100000753625 [0,2,0,0,0,0|1,0,1]=4 14770 B21R2.10009 O=C(COc1c(cccc1Cl)Cl)OCc2ccccc2 34a_100000211709_100000753625 [0,2,0,0,0,0|1,0,1]=4 14771 B21R2.10009 O=C(COc1c(cccc1Cl)Cl)OCc2ccccc2 7a_100000211709_100000753625 [0,2,0,0,0,0|1,0,1]=4 14772 B21R2.10009 O=C(COc1c(cccc1Cl)F)OCc2ccccc2 34a_100000694953_100000753625 [0,2,0,0,0,0|1,0,1]=4 14773 B21R2.10009 O=C(COc1c(cccc1Cl)F)OCc2ccccc2 7a_100000694953_100000753625 [0,2,0,0,0,0|1,0,1]=4 14774 B21R2.10009 O=C(COc1c(cccc1F)F)OCc2ccccc2 34a_100000230165_100000753625 [0,2,0,0,0,0|1,0,1]=4 14775 B21R2.10009 O=C(COc1c(cccc1F)F)OCc2ccccc2 7a_100000230165_100000753625 [0,2,0,0,0,0|1,0,1]=4 14776 B21R2.10009 O=C(COc1c(cccc1I)Br)OCc2ccccc2 34a_100010084509_100000753625 [0,2,0,0,0,0|1,0,1]=4 14777 B21R2.10009 O=C(COc1c(cccc1I)Br)OCc2ccccc2 7a_100010084509_100000753625 [0,2,0,0,0,0|1,0,1]=4 14778 B21R2.10009 O=C(COc1c(cccc1I)Cl)OCc2ccccc2 34a_100010202889_100000753625 [0,2,0,0,0,0|1,0,1]=4 14779 B21R2.10009 O=C(COc1c(cccc1I)Cl)OCc2ccccc2 7a_100010202889_100000753625 [0,2,0,0,0,0|1,0,1]=4 14780 B21R2.10009 O=C(COc1c(cccc1I)F)OCc2ccccc2 34a_100010186298_100000753625 [0,2,0,0,0,0|1,0,1]=4 14781 B21R2.10009 O=C(COc1c(cccc1I)F)OCc2ccccc2 7a_100010186298_100000753625 [0,2,0,0,0,0|1,0,1]=4 14782 B21R2.10009 O=C(CSc1c(cccc1Br)Br)OCc2ccccc2 62a_100000753625_100009994525 [0,2,0,0,0,0|1,0,1]=4 14783 B21R2.10009 O=C(CSc1c(cccc1Br)Br)OCc2ccccc2 62a_100009994525_100000753625 [0,2,0,0,0,0|1,0,1]=4 14784 B21R2.10009 O=C(CSc1c(cccc1Br)Cl)OCc2ccccc2 62a_100000753625_100010214488 [0,2,0,0,0,0|1,0,1]=4 14785 B21R2.10009 O=C(CSc1c(cccc1Br)Cl)OCc2ccccc2 62a_100010214488_100000753625 [0,2,0,0,0,0|1,0,1]=4 14786 B21R2.10009 O=C(CSc1c(cccc1Br)F)OCc2ccccc2 62a_100000753625_100011219512 [0,2,0,0,0,0|1,0,1]=4 14787 B21R2.10009 O=C(CSc1c(cccc1Br)F)OCc2ccccc2 62a_100011219512_100000753625 [0,2,0,0,0,0|1,0,1]=4 14788 B21R2.10009 O=C(CSc1c(cccc1Br)O)OCc2ccccc2 62a_100000753625_100010187912 [0,2,0,0,0,0|1,0,1]=4 14789 B21R2.10009 O=C(CSc1c(cccc1Br)O)OCc2ccccc2 62a_100010187912_100000753625 [0,2,0,0,0,0|1,0,1]=4 14790 B21R2.10009 O=C(CSc1c(cccc1Cl)Cl)OCc2ccccc2 62a_100000034237_100000753625 [0,2,0,0,0,0|1,0,1]=4 14791 B21R2.10009 O=C(CSc1c(cccc1Cl)Cl)OCc2ccccc2 62a_100000753625_100000034237 [0,2,0,0,0,0|1,0,1]=4 14792 B21R2.10009 O=C(CSc1c(cccc1Cl)F)OCc2ccccc2 62a_100000050007_100000753625 [0,2,0,0,0,0|1,0,1]=4 14793 B21R2.10009 O=C(CSc1c(cccc1Cl)F)OCc2ccccc2 62a_100000753625_100000050007 [0,2,0,0,0,0|1,0,1]=4 14794 B21R2.10009 O=C(CSc1c(cccc1Cl)O)OCc2ccccc2 62a_100000753625_100000050174 [0,2,0,0,0,0|1,0,1]=4 14795 B21R2.10009 O=C(CSc1c(cccc1F)F)OCc2ccccc2 62a_100000693133_100000753625 [0,2,0,0,0,0|1,0,1]=4 14796 B21R2.10009 O=C(CSc1c(cccc1F)F)OCc2ccccc2 62a_100000753625_100000693133 [0,2,0,0,0,0|1,0,1]=4 14797 B21R2.10009 O=C(CSc1c(cccc1F)O)OCc2ccccc2 62a_100000753625_100009820682 [0,2,0,0,0,0|1,0,1]=4 14798 B21R2.10009 O=C(CSc1c(cccc1F)O)OCc2ccccc2 62a_100009820682_100000753625 [0,2,0,0,0,0|1,0,1]=4 14799 B21R2.10009 O=C(CSc1c(cccc1O)O)OCc2ccccc2 62a_100000753625_100010205330 [0,2,0,0,0,0|1,0,1]=4 14800 B21R2.23823 C#Cc1ccccc1CNC(=O)C=Cc2ccccc2 11a_100020634229_100000210462 [0,2,0,0,0,0|1,0,0]=3 14801 B21R2.23823 C#Cc1ccccc1CNC(=O)C=Cc2ccccc2 1626a_100020634229_100000210462 [0,2,0,0,0,0|1,0,0]=3 14802 B21R2.23823 C#Cc1ccccc1CNC(=O)C=Cc2ccccn2 11a_100020634229_100000740811 [0,2,0,0,0,0|2,0,0]=4 14803 B21R2.23823 C#Cc1ccccc1CNC(=O)C=Cc2ccccn2 240690a_100020634229_100000740811 [0,2,0,0,0,0|2,0,0]=4 14804 B21R2.23823 C#Cc1ccccc1CNC(=O)C=Cc2cccnc2 11a_100020634229_100000735890 [0,2,0,0,0,0|2,0,0]=4 14805 B21R2.23823 C#Cc1ccccc1CNC(=O)C=Cc2cccnc2 240690a_100020634229_100000735890 [0,2,0,0,0,0|2,0,0]=4 14806 B21R2.23823 C#Cc1ccccc1CNC(=O)C=Cc2ccncc2 240690a_100020634229_100000682801 [0,2,0,0,0,0|2,0,0]=4 14807 B21R2.23823 C#Cc1ccccc1NCC(=O)OCc2ccccc2 34a_100011470550_100000753625 [0,2,0,0,0,0|1,0,1]=4 14808 B21R2.23823 C#Cc1ccccc1OCC(=O)OCc2ccccc2 34a_200011470546_100000753625 [0,2,0,0,0,0|1,0,1]=4 14809 B21R2.23823 C#Cc1ccccc1OCC(=O)OCc2ccccc2 7a_200011470546_100000753625 [0,2,0,0,0,0|1,0,1]=4 14810 B21R2.23823 C=Cc1ccccc1NCC(=O)OCc2ccccc2 34a_100012022501_100000753625 [0,2,0,0,0,0|1,0,1]=4 14811 B21R2.23823 C=Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100011218376 [0,2,0,0,0,0|1,0,1]=4 14812 B21R2.23823 C=Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100011218376_100000753625 [0,2,0,0,0,0|1,0,1]=4 14813 B21R2.23823 CCc1ccccc1NCC(=O)OCc2ccccc2 2230a_100000212081_100000753625 [0,2,0,0,0,0|1,0,1]=4 14814 B21R2.23823 CCc1ccccc1NCC(=O)OCc2ccccc2 34a_100000212081_100000753625 [0,2,0,0,0,0|1,0,1]=4 14815 B21R2.23823 CCc1ccccc1NCC(=O)OCc2ccccc2 7a_100000212081_100000753625 [0,2,0,0,0,0|1,0,1]=4 14816 B21R2.23823 CCc1ccccc1NNC(=O)C=Cc2ccccc2 22a_100000737054_100000210462 [0,2,0,0,0,0|2,0,0]=4 14817 B21R2.23823 CCc1ccccc1OCC(=O)OCc2ccccc2 34a_100000210936_100000753625 [0,2,0,0,0,0|1,0,1]=4 14818 B21R2.23823 CCc1ccccc1OCC(=O)OCc2ccccc2 7a_100000210936_100000753625 [0,2,0,0,0,0|1,0,1]=4 14819 B21R2.23823 CCc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100011215823 [0,2,0,0,0,0|1,0,1]=4 14820 B21R2.23823 CCc1ccccc1SCC(=O)OCc2ccccc2 62a_100011215823_100000753625 [0,2,0,0,0,0|1,0,1]=4 14821 B21R2.23823 CNc1ccccc1OCC(=O)OCc2ccccc2 34a_100000033821_100000753625 [0,2,0,0,0,0|1,0,1]=4 14822 B21R2.23823 CNc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100020606079 [0,2,0,0,0,0|1,0,1]=4 14823 B21R2.23823 CNc1ccccc1SCC(=O)OCc2ccccc2 62a_100020606079_100000753625 [0,2,0,0,0,0|1,0,1]=4 14824 B21R2.23823 COc1ccccc1C=CC(=O)CCc2ccccc2 1458a_100000182468_100000765856 [0,2,0,0,0,0|1,0,0]=3 14825 B21R2.23823 COc1ccccc1C=CC(=O)CCc2ccccn2 1458a_100000182468_100015183660 [0,2,0,0,0,0|2,0,0]=4 14826 B21R2.23823 COc1ccccc1C=CC(=O)CCc2cccnc2 1458a_100000182468_200011713674 [0,2,0,0,0,0|2,0,0]=4 14827 B21R2.23823 COc1ccccc1C=CC(=O)CCc2ccncc2 1458a_100000182468_100000723409 [0,2,0,0,0,0|2,0,0]=4 14828 B21R2.23823 COc1ccccc1C=CC(=O)NCc2ccccc2 11a_100015324214_100000182468 [0,2,0,0,0,0|1,0,0]=3 14829 B21R2.23823 COc1ccccc1C=CC(=O)NCc2ccccc2 1626a_100015324214_100000182468 [0,2,0,0,0,0|1,0,0]=3 14830 B21R2.23823 COc1ccccc1C=CC(=O)NCc2ccccn2 11a_100000210449_100000182468 [0,2,0,0,0,0|2,0,0]=4 14831 B21R2.23823 COc1ccccc1C=CC(=O)NCc2ccccn2 1626a_100000210449_100000182468 [0,2,0,0,0,0|2,0,0]=4 14832 B21R2.23823 COc1ccccc1C=CC(=O)NCc2cccnc2 11a_100000210453_100000182468 [0,2,0,0,0,0|2,0,0]=4 14833 B21R2.23823 COc1ccccc1C=CC(=O)NCc2ccncc2 11a_100000210450_100000182468 [0,2,0,0,0,0|2,0,0]=4 14834 B21R2.23823 COc1ccccc1C=CC(=O)NCc2ccncc2 1626a_100000210450_100000182468 [0,2,0,0,0,0|2,0,0]=4 14835 B21R2.23823 COc1ccccc1C=CC(=O)NNc2ccccc2 22a_100015195140_100000182468 [0,2,0,0,0,0|2,0,0]=4 14836 B21R2.23823 COc1ccccc1CCC(=O)C=Cc2ccccc2 1458a_100000210462_100011713687 [0,2,0,0,0,0|1,0,0]=3 14837 B21R2.23823 COc1ccccc1CCC(=O)C=Cc2ccccn2 1458a_100000740811_100011713687 [0,2,0,0,0,0|2,0,0]=4 14838 B21R2.23823 COc1ccccc1CCC(=O)C=Cc2cccnc2 1458a_100000735890_100011713687 [0,2,0,0,0,0|2,0,0]=4 14839 B21R2.23823 COc1ccccc1CCC(=O)C=Cc2ccncc2 1458a_100000682801_100011713687 [0,2,0,0,0,0|2,0,0]=4 14840 B21R2.23823 COc1ccccc1CNC(=O)C=Cc2ccccc2 11a_100000188900_100000210462 [0,2,0,0,0,0|1,0,0]=3 14841 B21R2.23823 COc1ccccc1CNC(=O)C=Cc2ccccc2 1626a_100000188900_100000210462 [0,2,0,0,0,0|1,0,0]=3 14842 B21R2.23823 COc1ccccc1CNC(=O)C=Cc2ccccn2 11a_100000188900_100000740811 [0,2,0,0,0,0|2,0,0]=4 14843 B21R2.23823 COc1ccccc1CNC(=O)C=Cc2ccccn2 240690a_100000188900_100000740811 [0,2,0,0,0,0|2,0,0]=4 14844 B21R2.23823 COc1ccccc1CNC(=O)C=Cc2cccnc2 11a_100000188900_100000735890 [0,2,0,0,0,0|2,0,0]=4 14845 B21R2.23823 COc1ccccc1CNC(=O)C=Cc2cccnc2 240690a_100000188900_100000735890 [0,2,0,0,0,0|2,0,0]=4 14846 B21R2.23823 COc1ccccc1CNC(=O)C=Cc2ccncc2 240690a_100000188900_100000682801 [0,2,0,0,0,0|2,0,0]=4 14847 B21R2.23823 COc1ccccc1NCC(=O)OCc2ccccc2 34a_100000210025_100000753625 [0,2,0,0,0,0|1,0,1]=4 14848 B21R2.23823 COc1ccccc1NNC(=O)C=Cc2ccccc2 22a_100000751209_100000210462 [0,2,0,0,0,0|2,0,0]=4 14849 B21R2.23823 COc1ccccc1OCC(=O)OCc2ccccc2 34a_100000210385_100000753625 [0,2,0,0,0,0|1,0,1]=4 14850 B21R2.23823 COc1ccccc1SCC(=O)OCc2ccccc2 62a_100000210334_100000753625 [0,2,0,0,0,0|1,0,1]=4 14851 B21R2.23823 COc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000210334 [0,2,0,0,0,0|1,0,1]=4 14852 B21R2.23823 COc1ncccc1C=CC(=O)CCc2ccccc2 1458a_100102601226_100000765856 [0,2,0,0,0,0|2,0,0]=4 14853 B21R2.23823 COc1ncccc1C=CC(=O)NCc2ccccc2 11a_100015324214_100102601226 [0,2,0,0,0,0|2,0,0]=4 14854 B21R2.23823 COc1ncccc1C=CC(=O)NCc2ccccc2 1626a_100015324214_100102601226 [0,2,0,0,0,0|2,0,0]=4 14855 B21R2.23823 COc1ncccc1CNC(=O)C=Cc2ccccc2 11a_100102524934_100000210462 [0,2,0,0,0,0|2,0,0]=4 14856 B21R2.23823 COc1ncccc1CNC(=O)C=Cc2ccccc2 1626a_100102524934_100000210462 [0,2,0,0,0,0|2,0,0]=4 14857 B21R2.23823 CSc1ccccc1CNC(=O)C=Cc2ccccc2 11a_102495365025_100000210462 [0,2,0,0,0,0|1,0,0]=3 14858 B21R2.23823 CSc1ccccc1CNC(=O)C=Cc2ccccc2 1626a_102495365025_100000210462 [0,2,0,0,0,0|1,0,0]=3 14859 B21R2.23823 CSc1ccccc1CNC(=O)C=Cc2ccccn2 11a_102495365025_100000740811 [0,2,0,0,0,0|2,0,0]=4 14860 B21R2.23823 CSc1ccccc1CNC(=O)C=Cc2ccccn2 240690a_102495365025_100000740811 [0,2,0,0,0,0|2,0,0]=4 14861 B21R2.23823 CSc1ccccc1CNC(=O)C=Cc2cccnc2 11a_102495365025_100000735890 [0,2,0,0,0,0|2,0,0]=4 14862 B21R2.23823 CSc1ccccc1CNC(=O)C=Cc2cccnc2 240690a_102495365025_100000735890 [0,2,0,0,0,0|2,0,0]=4 14863 B21R2.23823 CSc1ccccc1CNC(=O)C=Cc2ccncc2 240690a_102495365025_100000682801 [0,2,0,0,0,0|2,0,0]=4 14864 B21R2.23823 CSc1ccccc1NCC(=O)OCc2ccccc2 34a_100000211160_100000753625 [0,2,0,0,0,0|1,0,1]=4 14865 B21R2.23823 CSc1ccccc1OCC(=O)OCc2ccccc2 34a_100011216402_100000753625 [0,2,0,0,0,0|1,0,1]=4 14866 B21R2.23823 CSc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100011217816 [0,2,0,0,0,0|1,0,1]=4 14867 B21R2.23823 CSc1ccccc1SCC(=O)OCc2ccccc2 62a_100011217816_100000753625 [0,2,0,0,0,0|1,0,1]=4 14868 B21R2.23823 N#Cc1ccccc1C=CC(=O)CCc2ccccc2 1458a_100016294624_100000765856 [0,2,0,0,0,0|1,0,0]=3 14869 B21R2.23823 N#Cc1ccccc1C=CC(=O)CCc2ccccn2 1458a_100016294624_100015183660 [0,2,0,0,0,0|2,0,0]=4 14870 B21R2.23823 N#Cc1ccccc1C=CC(=O)CCc2cccnc2 1458a_100016294624_200011713674 [0,2,0,0,0,0|2,0,0]=4 14871 B21R2.23823 N#Cc1ccccc1C=CC(=O)CCc2ccncc2 1458a_100016294624_100000723409 [0,2,0,0,0,0|2,0,0]=4 14872 B21R2.23823 N#Cc1ccccc1C=CC(=O)NCc2ccccc2 11a_100015324214_100016294624 [0,2,0,0,0,0|1,0,0]=3 14873 B21R2.23823 N#Cc1ccccc1C=CC(=O)NCc2ccccn2 11a_100000210449_100016294624 [0,2,0,0,0,0|2,0,0]=4 14874 B21R2.23823 N#Cc1ccccc1C=CC(=O)NCc2cccnc2 11a_100000210453_100016294624 [0,2,0,0,0,0|2,0,0]=4 14875 B21R2.23823 N#Cc1ccccc1C=CC(=O)NCc2ccncc2 11a_100000210450_100016294624 [0,2,0,0,0,0|2,0,0]=4 14876 B21R2.23823 N#Cc1ccccc1C=CC(=O)NNc2ccccc2 22a_100015195140_100016294624 [0,2,0,0,0,0|2,0,0]=4 14877 B21R2.23823 N#Cc1ccccc1CCC(=O)C=Cc2ccccc2 1458a_100000210462_200013032965 [0,2,0,0,0,0|1,0,0]=3 14878 B21R2.23823 N#Cc1ccccc1CCC(=O)C=Cc2ccccn2 1458a_100000740811_200013032965 [0,2,0,0,0,0|2,0,0]=4 14879 B21R2.23823 N#Cc1ccccc1CCC(=O)C=Cc2cccnc2 1458a_100000735890_200013032965 [0,2,0,0,0,0|2,0,0]=4 14880 B21R2.23823 N#Cc1ccccc1CCC(=O)C=Cc2ccncc2 1458a_100000682801_200013032965 [0,2,0,0,0,0|2,0,0]=4 14881 B21R2.23823 N#Cc1ccccc1CNC(=O)C=Cc2ccccc2 11a_100016989011_100000210462 [0,2,0,0,0,0|1,0,0]=3 14882 B21R2.23823 N#Cc1ccccc1CNC(=O)C=Cc2ccccc2 1626a_100016989011_100000210462 [0,2,0,0,0,0|1,0,0]=3 14883 B21R2.23823 N#Cc1ccccc1CNC(=O)C=Cc2ccccn2 11a_100016989011_100000740811 [0,2,0,0,0,0|2,0,0]=4 14884 B21R2.23823 N#Cc1ccccc1CNC(=O)C=Cc2ccccn2 240690a_100016989011_100000740811 [0,2,0,0,0,0|2,0,0]=4 14885 B21R2.23823 N#Cc1ccccc1CNC(=O)C=Cc2cccnc2 11a_100016989011_100000735890 [0,2,0,0,0,0|2,0,0]=4 14886 B21R2.23823 N#Cc1ccccc1CNC(=O)C=Cc2cccnc2 240690a_100016989011_100000735890 [0,2,0,0,0,0|2,0,0]=4 14887 B21R2.23823 N#Cc1ccccc1CNC(=O)C=Cc2ccncc2 240690a_100016989011_100000682801 [0,2,0,0,0,0|2,0,0]=4 14888 B21R2.23823 N#Cc1ccccc1NCC(=O)OCc2ccccc2 34a_100000211148_100000753625 [0,2,0,0,0,0|1,0,1]=4 14889 B21R2.23823 N#Cc1ccccc1NNC(=O)C=Cc2ccccc2 22a_100016988835_100000210462 [0,2,0,0,0,0|2,0,0]=4 14890 B21R2.23823 N#Cc1ccccc1OCC(=O)OCc2ccccc2 34a_100000211048_100000753625 [0,2,0,0,0,0|1,0,1]=4 14891 B21R2.23823 N#Cc1ccccc1OCC(=O)OCc2ccccc2 7a_100000211048_100000753625 [0,2,0,0,0,0|1,0,1]=4 14892 B21R2.23823 N#Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000188569 [0,2,0,0,0,0|1,0,1]=4 14893 B21R2.23823 NCc1ccccc1OCC(=O)OCc2ccccc2 34a_100000185550_100000753625 [0,2,0,0,0,0|1,0,1]=4 14894 B21R2.23823 NCc1ccccc1SCC(=O)OCc2ccccc2 62a_100000689332_100000753625 [0,2,0,0,0,0|1,0,1]=4 14895 B21R2.23823 NCc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000689332 [0,2,0,0,0,0|1,0,1]=4 14896 B21R2.23823 NNc1ccccc1SCC(=O)OCc2ccccc2 62a_100000241748_100000753625 [0,2,0,0,0,0|1,0,1]=4 14897 B21R2.23823 NNc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000241748 [0,2,0,0,0,0|1,0,1]=4 14898 B21R2.23823 O=C(C=Cc1ccccn1)NCc2ccccc2CO 240690a_100000743596_100000740811 [0,2,0,0,0,0|2,0,0]=4 14899 B21R2.23823 O=C(C=Cc1cccnc1)NCc2ccccc2CO 240690a_100000743596_100000735890 [0,2,0,0,0,0|2,0,0]=4 14900 B21R2.23823 O=C(C=Cc1ccncc1)NCc2ccccc2CO 240690a_100000743596_100000682801 [0,2,0,0,0,0|2,0,0]=4 14901 B21R2.23823 O=C(CNc1ccccc1CO)OCc2ccccc2 34a_100000212039_100000753625 [0,2,0,0,0,0|1,0,1]=4 14902 B21R2.23823 O=C(COc1ccccc1CO)OCc2ccccc2 34a_100011216872_100000753625 [0,2,0,0,0,0|1,0,1]=4 14903 B21R2.23823 O=C(CSc1ccccc1CO)OCc2ccccc2 62a_100000187465_100000753625 [0,2,0,0,0,0|1,0,1]=4 14904 B21R2.23823 O=C(CSc1ccccc1CO)OCc2ccccc2 62a_100000753625_100000187465 [0,2,0,0,0,0|1,0,1]=4 14905 B21R2.23823 O=Cc1ccccc1CCC(=O)C=Cc2ccccc2 1458a_100000210462_100010186698 [0,2,0,0,0,0|1,0,0]=3 14906 B21R2.23823 O=Cc1ccccc1CCC(=O)C=Cc2ccccn2 1458a_100000740811_100010186698 [0,2,0,0,0,0|2,0,0]=4 14907 B21R2.23823 O=Cc1ccccc1CCC(=O)C=Cc2cccnc2 1458a_100000735890_100010186698 [0,2,0,0,0,0|2,0,0]=4 14908 B21R2.23823 O=Cc1ccccc1CCC(=O)C=Cc2ccncc2 1458a_100000682801_100010186698 [0,2,0,0,0,0|2,0,0]=4 14909 B21R2.23823 O=Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100000210073_100000753625 [0,2,0,0,0,0|1,0,1]=4 14910 B21R2.23823 O=Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000210073 [0,2,0,0,0,0|1,0,1]=4 14911 B21R2.106909 Cc1ccccc1CNS(=O)(=O)C=Cc2ccccc2 40a_100000174972_100011098038 [0,2,0,0,0,0|2,0,0]=4 14912 B21R2.106909 O=S(=O)(C=Cc1ccccc1)NCc2ccccc2Br 40a_100000689332_100011098038 [0,2,0,0,0,0|2,0,0]=4 14913 B21R2.106909 O=S(=O)(C=Cc1ccccc1)NCc2ccccc2Cl 40a_100000174879_100011098038 [0,2,0,0,0,0|2,0,0]=4 14914 B21R2.106909 O=S(=O)(C=Cc1ccccc1)NCc2ccccc2F 40a_100000174869_100011098038 [0,2,0,0,0,0|2,0,0]=4 14915 B21R2.106909 O=S(=O)(C=Cc1ccccc1)NCc2ccccc2I 40a_100015347259_100011098038 [0,2,0,0,0,0|2,0,0]=4 14916 B21R2.106909 O=S(=O)(C=Cc1ccccc1)NCc2ccccc2O 40a_100000185550_100011098038 [0,2,0,0,0,0|2,0,0]=4 14917 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ccccc2Br 1626a_100000689332_100016266485 [0,2,0,0,0,0|1,0,0]=3 14918 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ccccc2C 1626a_100000174972_100016266485 [0,2,0,0,0,0|1,0,0]=3 14919 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ccccc2Cl 1626a_100000174879_100016266485 [0,2,0,0,0,0|1,0,0]=3 14920 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ccccc2F 1626a_100000174869_100016266485 [0,2,0,0,0,0|1,0,0]=3 14921 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ccccc2I 1626a_100015347259_100016266485 [0,2,0,0,0,0|1,0,0]=3 14922 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2cccnc2Cl 1626a_100015189234_100016266485 [0,2,0,0,0,0|2,0,0]=4 14923 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2cccnc2F 1626a_100000724633_100016266485 [0,2,0,0,0,0|2,0,0]=4 14924 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ccncc2C 1626a_100000708811_100016266485 [0,2,0,0,0,0|2,0,0]=4 14925 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ccncc2F 1626a_100011935246_100016266485 [0,2,0,0,0,0|2,0,0]=4 14926 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ncccc2C 1626a_100011223789_100016266485 [0,2,0,0,0,0|2,0,0]=4 14927 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ncccc2Cl 1626a_100015189233_100016266485 [0,2,0,0,0,0|2,0,0]=4 14928 B21R2.107355 Cc1ccccc1C=CC(=O)NCc2ncccc2F 1626a_100000690088_100016266485 [0,2,0,0,0,0|2,0,0]=4 14929 B21R2.107355 Cc1ccccc1C=CC(=O)NNc2ccccc2Br 22a_100000241748_100016266485 [0,2,0,0,0,0|2,0,0]=4 14930 B21R2.107355 Cc1ccccc1C=CC(=O)NNc2ccccc2C 22a_100000184220_100016266485 [0,2,0,0,0,0|2,0,0]=4 14931 B21R2.107355 Cc1ccccc1C=CC(=O)NNc2ccccc2Cl 22a_100000683529_100016266485 [0,2,0,0,0,0|2,0,0]=4 14932 B21R2.107355 Cc1ccccc1C=CC(=O)NNc2ccccc2F 22a_100000239246_100016266485 [0,2,0,0,0,0|2,0,0]=4 14933 B21R2.107355 Cc1ccccc1C=CC(=O)NNc2ccccc2I 22a_100011218156_100016266485 [0,2,0,0,0,0|2,0,0]=4 14934 B21R2.107355 Cc1ccccc1CCC(=O)C=Cc2ccccc2Br 1458a_100000719032_100011713688 [0,2,0,0,0,0|1,0,0]=3 14935 B21R2.107355 Cc1ccccc1CCC(=O)C=Cc2ccccc2Cl 1458a_100000720304_100011713688 [0,2,0,0,0,0|1,0,0]=3 14936 B21R2.107355 Cc1ccccc1CCC(=O)C=Cc2ccccc2F 1458a_100016256065_100011713688 [0,2,0,0,0,0|1,0,0]=3 14937 B21R2.107355 Cc1ccccc1CCC(=O)C=Cc2ccccc2O 1458a_100016263591_100011713688 [0,2,0,0,0,0|1,0,0]=3 14938 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2Br 11a_100000174972_100000719032 [0,2,0,0,0,0|1,0,0]=3 14939 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2Br 1626a_100000174972_100000719032 [0,2,0,0,0,0|1,0,0]=3 14940 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2Br 240690a_100000174972_100000719032 [0,2,0,0,0,0|1,0,0]=3 14941 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2Cl 11a_100000174972_100000720304 [0,2,0,0,0,0|1,0,0]=3 14942 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2Cl 1626a_100000174972_100000720304 [0,2,0,0,0,0|1,0,0]=3 14943 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2Cl 240690a_100000174972_100000720304 [0,2,0,0,0,0|1,0,0]=3 14944 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2F 11a_100000174972_100016256065 [0,2,0,0,0,0|1,0,0]=3 14945 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2F 1626a_100000174972_100016256065 [0,2,0,0,0,0|1,0,0]=3 14946 B21R2.107355 Cc1ccccc1CNC(=O)C=Cc2ccccc2F 240690a_100000174972_100016256065 [0,2,0,0,0,0|1,0,0]=3 14947 B21R2.107355 Cc1ccccc1NNC(=O)C=Cc2ccccc2Br 22a_100000184220_100000719032 [0,2,0,0,0,0|2,0,0]=4 14948 B21R2.107355 Cc1ccccc1NNC(=O)C=Cc2ccccc2Cl 22a_100000184220_100000720304 [0,2,0,0,0,0|2,0,0]=4 14949 B21R2.107355 Cc1ccccc1NNC(=O)C=Cc2ccccc2F 22a_100000184220_100016256065 [0,2,0,0,0,0|2,0,0]=4 14950 B21R2.107355 Cc1ccccc1NNC(=O)C=Cc2ccccc2O 22a_100000184220_100016263591 [0,2,0,0,0,0|2,0,0]=4 14951 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2Br 11a_100011223789_100000719032 [0,2,0,0,0,0|2,0,0]=4 14952 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2Br 1626a_100011223789_100000719032 [0,2,0,0,0,0|2,0,0]=4 14953 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2Br 240690a_100011223789_100000719032 [0,2,0,0,0,0|2,0,0]=4 14954 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2Cl 11a_100011223789_100000720304 [0,2,0,0,0,0|2,0,0]=4 14955 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2Cl 1626a_100011223789_100000720304 [0,2,0,0,0,0|2,0,0]=4 14956 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2Cl 240690a_100011223789_100000720304 [0,2,0,0,0,0|2,0,0]=4 14957 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2F 11a_100011223789_100016256065 [0,2,0,0,0,0|2,0,0]=4 14958 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2F 1626a_100011223789_100016256065 [0,2,0,0,0,0|2,0,0]=4 14959 B21R2.107355 Cc1cccnc1CNC(=O)C=Cc2ccccc2F 240690a_100011223789_100016256065 [0,2,0,0,0,0|2,0,0]=4 14960 B21R2.107355 Cc1ccncc1CNC(=O)C=Cc2ccccc2Br 11a_100011997553_100000719032 [0,2,0,0,0,0|2,0,0]=4 14961 B21R2.107355 Cc1ccncc1CNC(=O)C=Cc2ccccc2Br 240690a_100011997553_100000719032 [0,2,0,0,0,0|2,0,0]=4 14962 B21R2.107355 Cc1ccncc1CNC(=O)C=Cc2ccccc2Cl 11a_100011997553_100000720304 [0,2,0,0,0,0|2,0,0]=4 14963 B21R2.107355 Cc1ccncc1CNC(=O)C=Cc2ccccc2Cl 240690a_100011997553_100000720304 [0,2,0,0,0,0|2,0,0]=4 14964 B21R2.107355 Cc1ccncc1CNC(=O)C=Cc2ccccc2F 11a_100011997553_100016256065 [0,2,0,0,0,0|2,0,0]=4 14965 B21R2.107355 Cc1ccncc1CNC(=O)C=Cc2ccccc2F 240690a_100011997553_100016256065 [0,2,0,0,0,0|2,0,0]=4 14966 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2Br 11a_100000708811_100000719032 [0,2,0,0,0,0|2,0,0]=4 14967 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2Br 1626a_100000708811_100000719032 [0,2,0,0,0,0|2,0,0]=4 14968 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2Br 240690a_100000708811_100000719032 [0,2,0,0,0,0|2,0,0]=4 14969 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2Cl 11a_100000708811_100000720304 [0,2,0,0,0,0|2,0,0]=4 14970 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2Cl 1626a_100000708811_100000720304 [0,2,0,0,0,0|2,0,0]=4 14971 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2Cl 240690a_100000708811_100000720304 [0,2,0,0,0,0|2,0,0]=4 14972 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2F 11a_100000708811_100016256065 [0,2,0,0,0,0|2,0,0]=4 14973 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2F 1626a_100000708811_100016256065 [0,2,0,0,0,0|2,0,0]=4 14974 B21R2.107355 Cc1cnccc1CNC(=O)C=Cc2ccccc2F 240690a_100000708811_100016256065 [0,2,0,0,0,0|2,0,0]=4 14975 B21R2.107355 O=C(C=Cc1ccccc1Br)CCc2ccccc2Br 1458a_100000719032_100012161201 [0,2,0,0,0,0|1,0,0]=3 14976 B21R2.107355 O=C(C=Cc1ccccc1Br)CCc2ccccc2Cl 1458a_100000719032_100011713703 [0,2,0,0,0,0|1,0,0]=3 14977 B21R2.107355 O=C(C=Cc1ccccc1Br)CCc2ccccc2F 1458a_100000719032_100000720011 [0,2,0,0,0,0|1,0,0]=3 14978 B21R2.107355 O=C(C=Cc1ccccc1Br)CCc2ccccc2O 1458a_100000719032_100000722297 [0,2,0,0,0,0|1,0,0]=3 14979 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2Br 11a_100000689332_100000719032 [0,2,0,0,0,0|1,0,0]=3 14980 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2Br 1626a_100000689332_100000719032 [0,2,0,0,0,0|1,0,0]=3 14981 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2Br 240690a_100000689332_100000719032 [0,2,0,0,0,0|1,0,0]=3 14982 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2Cl 11a_100000174879_100000719032 [0,2,0,0,0,0|1,0,0]=3 14983 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2Cl 1626a_100000174879_100000719032 [0,2,0,0,0,0|1,0,0]=3 14984 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2Cl 240690a_100000174879_100000719032 [0,2,0,0,0,0|1,0,0]=3 14985 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2F 11a_100000174869_100000719032 [0,2,0,0,0,0|1,0,0]=3 14986 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2F 1626a_100000174869_100000719032 [0,2,0,0,0,0|1,0,0]=3 14987 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2F 240690a_100000174869_100000719032 [0,2,0,0,0,0|1,0,0]=3 14988 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2I 11a_100015347259_100000719032 [0,2,0,0,0,0|1,0,0]=3 14989 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2I 1626a_100015347259_100000719032 [0,2,0,0,0,0|1,0,0]=3 14990 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2I 240690a_100015347259_100000719032 [0,2,0,0,0,0|1,0,0]=3 14991 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccccc2O 240690a_100000185550_100000719032 [0,2,0,0,0,0|1,0,0]=3 14992 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2cccnc2Br 11a_100009818023_100000719032 [0,2,0,0,0,0|2,0,0]=4 14993 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2cccnc2Br 240690a_100009818023_100000719032 [0,2,0,0,0,0|2,0,0]=4 14994 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2cccnc2Cl 11a_100015189234_100000719032 [0,2,0,0,0,0|2,0,0]=4 14995 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2cccnc2Cl 1626a_100015189234_100000719032 [0,2,0,0,0,0|2,0,0]=4 14996 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2cccnc2Cl 240690a_100015189234_100000719032 [0,2,0,0,0,0|2,0,0]=4 14997 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2cccnc2F 11a_100000724633_100000719032 [0,2,0,0,0,0|2,0,0]=4 14998 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2cccnc2F 1626a_100000724633_100000719032 [0,2,0,0,0,0|2,0,0]=4 14999 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2cccnc2F 240690a_100000724633_100000719032 [0,2,0,0,0,0|2,0,0]=4 15000 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccncc2Br 11a_100020640021_100000719032 [0,2,0,0,0,0|2,0,0]=4 15001 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccncc2Br 240690a_100020640021_100000719032 [0,2,0,0,0,0|2,0,0]=4 15002 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccncc2F 11a_100011935246_100000719032 [0,2,0,0,0,0|2,0,0]=4 15003 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccncc2F 1626a_100011935246_100000719032 [0,2,0,0,0,0|2,0,0]=4 15004 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ccncc2F 240690a_100011935246_100000719032 [0,2,0,0,0,0|2,0,0]=4 15005 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ncccc2Br 11a_100020591323_100000719032 [0,2,0,0,0,0|2,0,0]=4 15006 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ncccc2Br 240690a_100020591323_100000719032 [0,2,0,0,0,0|2,0,0]=4 15007 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ncccc2Cl 11a_100015189233_100000719032 [0,2,0,0,0,0|2,0,0]=4 15008 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ncccc2Cl 1626a_100015189233_100000719032 [0,2,0,0,0,0|2,0,0]=4 15009 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ncccc2Cl 240690a_100015189233_100000719032 [0,2,0,0,0,0|2,0,0]=4 15010 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ncccc2F 11a_100000690088_100000719032 [0,2,0,0,0,0|2,0,0]=4 15011 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ncccc2F 1626a_100000690088_100000719032 [0,2,0,0,0,0|2,0,0]=4 15012 B21R2.107355 O=C(C=Cc1ccccc1Br)NCc2ncccc2F 240690a_100000690088_100000719032 [0,2,0,0,0,0|2,0,0]=4 15013 B21R2.107355 O=C(C=Cc1ccccc1Br)NNc2ccccc2Br 22a_100000241748_100000719032 [0,2,0,0,0,0|2,0,0]=4 15014 B21R2.107355 O=C(C=Cc1ccccc1Br)NNc2ccccc2Cl 22a_100000683529_100000719032 [0,2,0,0,0,0|2,0,0]=4 15015 B21R2.107355 O=C(C=Cc1ccccc1Br)NNc2ccccc2F 22a_100000239246_100000719032 [0,2,0,0,0,0|2,0,0]=4 15016 B21R2.107355 O=C(C=Cc1ccccc1Br)NNc2ccccc2I 22a_100011218156_100000719032 [0,2,0,0,0,0|2,0,0]=4 15017 B21R2.107355 O=C(C=Cc1ccccc1Cl)CCc2ccccc2Br 1458a_100000720304_100012161201 [0,2,0,0,0,0|1,0,0]=3 15018 B21R2.107355 O=C(C=Cc1ccccc1Cl)CCc2ccccc2Cl 1458a_100000720304_100011713703 [0,2,0,0,0,0|1,0,0]=3 15019 B21R2.107355 O=C(C=Cc1ccccc1Cl)CCc2ccccc2F 1458a_100000720304_100000720011 [0,2,0,0,0,0|1,0,0]=3 15020 B21R2.107355 O=C(C=Cc1ccccc1Cl)CCc2ccccc2O 1458a_100000720304_100000722297 [0,2,0,0,0,0|1,0,0]=3 15021 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2Br 11a_100000689332_100000720304 [0,2,0,0,0,0|1,0,0]=3 15022 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2Br 1626a_100000689332_100000720304 [0,2,0,0,0,0|1,0,0]=3 15023 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2Br 240690a_100000689332_100000720304 [0,2,0,0,0,0|1,0,0]=3 15024 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2Cl 11a_100000174879_100000720304 [0,2,0,0,0,0|1,0,0]=3 15025 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2Cl 1626a_100000174879_100000720304 [0,2,0,0,0,0|1,0,0]=3 15026 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2Cl 240690a_100000174879_100000720304 [0,2,0,0,0,0|1,0,0]=3 15027 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2F 11a_100000174869_100000720304 [0,2,0,0,0,0|1,0,0]=3 15028 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2F 1626a_100000174869_100000720304 [0,2,0,0,0,0|1,0,0]=3 15029 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2F 240690a_100000174869_100000720304 [0,2,0,0,0,0|1,0,0]=3 15030 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2I 11a_100015347259_100000720304 [0,2,0,0,0,0|1,0,0]=3 15031 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2I 1626a_100015347259_100000720304 [0,2,0,0,0,0|1,0,0]=3 15032 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2I 240690a_100015347259_100000720304 [0,2,0,0,0,0|1,0,0]=3 15033 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccccc2O 240690a_100000185550_100000720304 [0,2,0,0,0,0|1,0,0]=3 15034 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2cccnc2Br 11a_100009818023_100000720304 [0,2,0,0,0,0|2,0,0]=4 15035 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2cccnc2Br 240690a_100009818023_100000720304 [0,2,0,0,0,0|2,0,0]=4 15036 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2cccnc2Cl 11a_100015189234_100000720304 [0,2,0,0,0,0|2,0,0]=4 15037 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2cccnc2Cl 1626a_100015189234_100000720304 [0,2,0,0,0,0|2,0,0]=4 15038 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2cccnc2Cl 240690a_100015189234_100000720304 [0,2,0,0,0,0|2,0,0]=4 15039 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2cccnc2F 11a_100000724633_100000720304 [0,2,0,0,0,0|2,0,0]=4 15040 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2cccnc2F 1626a_100000724633_100000720304 [0,2,0,0,0,0|2,0,0]=4 15041 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2cccnc2F 240690a_100000724633_100000720304 [0,2,0,0,0,0|2,0,0]=4 15042 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccncc2Br 11a_100020640021_100000720304 [0,2,0,0,0,0|2,0,0]=4 15043 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccncc2Br 240690a_100020640021_100000720304 [0,2,0,0,0,0|2,0,0]=4 15044 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccncc2F 11a_100011935246_100000720304 [0,2,0,0,0,0|2,0,0]=4 15045 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccncc2F 1626a_100011935246_100000720304 [0,2,0,0,0,0|2,0,0]=4 15046 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ccncc2F 240690a_100011935246_100000720304 [0,2,0,0,0,0|2,0,0]=4 15047 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ncccc2Br 11a_100020591323_100000720304 [0,2,0,0,0,0|2,0,0]=4 15048 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ncccc2Br 240690a_100020591323_100000720304 [0,2,0,0,0,0|2,0,0]=4 15049 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ncccc2Cl 11a_100015189233_100000720304 [0,2,0,0,0,0|2,0,0]=4 15050 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ncccc2Cl 1626a_100015189233_100000720304 [0,2,0,0,0,0|2,0,0]=4 15051 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ncccc2Cl 240690a_100015189233_100000720304 [0,2,0,0,0,0|2,0,0]=4 15052 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ncccc2F 11a_100000690088_100000720304 [0,2,0,0,0,0|2,0,0]=4 15053 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ncccc2F 1626a_100000690088_100000720304 [0,2,0,0,0,0|2,0,0]=4 15054 B21R2.107355 O=C(C=Cc1ccccc1Cl)NCc2ncccc2F 240690a_100000690088_100000720304 [0,2,0,0,0,0|2,0,0]=4 15055 B21R2.107355 O=C(C=Cc1ccccc1Cl)NNc2ccccc2Br 22a_100000241748_100000720304 [0,2,0,0,0,0|2,0,0]=4 15056 B21R2.107355 O=C(C=Cc1ccccc1Cl)NNc2ccccc2Cl 22a_100000683529_100000720304 [0,2,0,0,0,0|2,0,0]=4 15057 B21R2.107355 O=C(C=Cc1ccccc1Cl)NNc2ccccc2F 22a_100000239246_100000720304 [0,2,0,0,0,0|2,0,0]=4 15058 B21R2.107355 O=C(C=Cc1ccccc1Cl)NNc2ccccc2I 22a_100011218156_100000720304 [0,2,0,0,0,0|2,0,0]=4 15059 B21R2.107355 O=C(C=Cc1ccccc1F)CCc2ccccc2Br 1458a_100016256065_100012161201 [0,2,0,0,0,0|1,0,0]=3 15060 B21R2.107355 O=C(C=Cc1ccccc1F)CCc2ccccc2Cl 1458a_100016256065_100011713703 [0,2,0,0,0,0|1,0,0]=3 15061 B21R2.107355 O=C(C=Cc1ccccc1F)CCc2ccccc2F 1458a_100016256065_100000720011 [0,2,0,0,0,0|1,0,0]=3 15062 B21R2.107355 O=C(C=Cc1ccccc1F)CCc2ccccc2O 1458a_100016256065_100000722297 [0,2,0,0,0,0|1,0,0]=3 15063 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2Br 11a_100000689332_100016256065 [0,2,0,0,0,0|1,0,0]=3 15064 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2Br 1626a_100000689332_100016256065 [0,2,0,0,0,0|1,0,0]=3 15065 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2Br 240690a_100000689332_100016256065 [0,2,0,0,0,0|1,0,0]=3 15066 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2Cl 11a_100000174879_100016256065 [0,2,0,0,0,0|1,0,0]=3 15067 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2Cl 1626a_100000174879_100016256065 [0,2,0,0,0,0|1,0,0]=3 15068 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2Cl 240690a_100000174879_100016256065 [0,2,0,0,0,0|1,0,0]=3 15069 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2F 11a_100000174869_100016256065 [0,2,0,0,0,0|1,0,0]=3 15070 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2F 1626a_100000174869_100016256065 [0,2,0,0,0,0|1,0,0]=3 15071 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2F 240690a_100000174869_100016256065 [0,2,0,0,0,0|1,0,0]=3 15072 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2I 11a_100015347259_100016256065 [0,2,0,0,0,0|1,0,0]=3 15073 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2I 1626a_100015347259_100016256065 [0,2,0,0,0,0|1,0,0]=3 15074 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2I 240690a_100015347259_100016256065 [0,2,0,0,0,0|1,0,0]=3 15075 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccccc2O 240690a_100000185550_100016256065 [0,2,0,0,0,0|1,0,0]=3 15076 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2cccnc2Br 11a_100009818023_100016256065 [0,2,0,0,0,0|2,0,0]=4 15077 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2cccnc2Br 240690a_100009818023_100016256065 [0,2,0,0,0,0|2,0,0]=4 15078 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2cccnc2Cl 11a_100015189234_100016256065 [0,2,0,0,0,0|2,0,0]=4 15079 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2cccnc2Cl 1626a_100015189234_100016256065 [0,2,0,0,0,0|2,0,0]=4 15080 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2cccnc2Cl 240690a_100015189234_100016256065 [0,2,0,0,0,0|2,0,0]=4 15081 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2cccnc2F 11a_100000724633_100016256065 [0,2,0,0,0,0|2,0,0]=4 15082 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2cccnc2F 1626a_100000724633_100016256065 [0,2,0,0,0,0|2,0,0]=4 15083 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2cccnc2F 240690a_100000724633_100016256065 [0,2,0,0,0,0|2,0,0]=4 15084 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccncc2Br 11a_100020640021_100016256065 [0,2,0,0,0,0|2,0,0]=4 15085 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccncc2Br 240690a_100020640021_100016256065 [0,2,0,0,0,0|2,0,0]=4 15086 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccncc2F 11a_100011935246_100016256065 [0,2,0,0,0,0|2,0,0]=4 15087 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccncc2F 1626a_100011935246_100016256065 [0,2,0,0,0,0|2,0,0]=4 15088 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ccncc2F 240690a_100011935246_100016256065 [0,2,0,0,0,0|2,0,0]=4 15089 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ncccc2Br 11a_100020591323_100016256065 [0,2,0,0,0,0|2,0,0]=4 15090 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ncccc2Br 240690a_100020591323_100016256065 [0,2,0,0,0,0|2,0,0]=4 15091 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ncccc2Cl 11a_100015189233_100016256065 [0,2,0,0,0,0|2,0,0]=4 15092 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ncccc2Cl 1626a_100015189233_100016256065 [0,2,0,0,0,0|2,0,0]=4 15093 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ncccc2Cl 240690a_100015189233_100016256065 [0,2,0,0,0,0|2,0,0]=4 15094 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ncccc2F 11a_100000690088_100016256065 [0,2,0,0,0,0|2,0,0]=4 15095 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ncccc2F 1626a_100000690088_100016256065 [0,2,0,0,0,0|2,0,0]=4 15096 B21R2.107355 O=C(C=Cc1ccccc1F)NCc2ncccc2F 240690a_100000690088_100016256065 [0,2,0,0,0,0|2,0,0]=4 15097 B21R2.107355 O=C(C=Cc1ccccc1F)NNc2ccccc2Br 22a_100000241748_100016256065 [0,2,0,0,0,0|2,0,0]=4 15098 B21R2.107355 O=C(C=Cc1ccccc1F)NNc2ccccc2Cl 22a_100000683529_100016256065 [0,2,0,0,0,0|2,0,0]=4 15099 B21R2.107355 O=C(C=Cc1ccccc1F)NNc2ccccc2F 22a_100000239246_100016256065 [0,2,0,0,0,0|2,0,0]=4 15100 B21R2.107355 O=C(C=Cc1ccccc1F)NNc2ccccc2I 22a_100011218156_100016256065 [0,2,0,0,0,0|2,0,0]=4 15101 B21R2.107355 O=C(C=Cc1ccccc1O)CCc2ccccc2Br 1458a_100016263591_100012161201 [0,2,0,0,0,0|1,0,0]=3 15102 B21R2.107355 O=C(C=Cc1ccccc1O)CCc2ccccc2Cl 1458a_100016263591_100011713703 [0,2,0,0,0,0|1,0,0]=3 15103 B21R2.107355 O=C(C=Cc1ccccc1O)CCc2ccccc2F 1458a_100016263591_100000720011 [0,2,0,0,0,0|1,0,0]=3 15104 B21R2.107355 O=C(C=Cc1ccccc1O)CCc2ccccc2O 1458a_100016263591_100000722297 [0,2,0,0,0,0|1,0,0]=3 15105 B21R2.107355 O=C(C=Cc1ccccc1O)NNc2ccccc2Br 22a_100000241748_100016263591 [0,2,0,0,0,0|2,0,0]=4 15106 B21R2.107355 O=C(C=Cc1ccccc1O)NNc2ccccc2Cl 22a_100000683529_100016263591 [0,2,0,0,0,0|2,0,0]=4 15107 B21R2.107355 O=C(C=Cc1ccccc1O)NNc2ccccc2F 22a_100000239246_100016263591 [0,2,0,0,0,0|2,0,0]=4 15108 B21R2.107355 O=C(C=Cc1ccccc1O)NNc2ccccc2I 22a_100011218156_100016263591 [0,2,0,0,0,0|2,0,0]=4 15109 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2ccccc2Br 11a_100000181357_100000210462 [0,2,0,0,0,0|1,0,0]=3 15110 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2ccccc2Br 1626a_100000181357_100000210462 [0,2,0,0,0,0|1,0,0]=3 15111 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2ccccc2Cl 11a_100000174978_100000210462 [0,2,0,0,0,0|1,0,0]=3 15112 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2ccccc2Cl 1626a_100000174978_100000210462 [0,2,0,0,0,0|1,0,0]=3 15113 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2ccccc2F 11a_100000181408_100000210462 [0,2,0,0,0,0|1,0,0]=3 15114 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2ccccc2F 1626a_100000181408_100000210462 [0,2,0,0,0,0|1,0,0]=3 15115 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2cccnc2O 11a_100159269580_100000210462 [0,2,0,0,0,0|2,0,0]=4 15116 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2ncccc2Br 11a_100159271932_100000210462 [0,2,0,0,0,0|2,0,0]=4 15117 B21R2.205889 CC(NC(=O)C=Cc1ccccc1)c2ncccc2Br 1626a_100159271932_100000210462 [0,2,0,0,0,0|2,0,0]=4 15118 B21R2.205889 CC(NC(=O)C=Cc1ccccn1)c2ccccc2Br 11a_100000181357_100000740811 [0,2,0,0,0,0|2,0,0]=4 15119 B21R2.205889 CC(NC(=O)C=Cc1ccccn1)c2ccccc2Br 240690a_100000181357_100000740811 [0,2,0,0,0,0|2,0,0]=4 15120 B21R2.205889 CC(NC(=O)C=Cc1ccccn1)c2ccccc2Cl 11a_100000174978_100000740811 [0,2,0,0,0,0|2,0,0]=4 15121 B21R2.205889 CC(NC(=O)C=Cc1ccccn1)c2ccccc2Cl 240690a_100000174978_100000740811 [0,2,0,0,0,0|2,0,0]=4 15122 B21R2.205889 CC(NC(=O)C=Cc1ccccn1)c2ccccc2F 11a_100000181408_100000740811 [0,2,0,0,0,0|2,0,0]=4 15123 B21R2.205889 CC(NC(=O)C=Cc1ccccn1)c2ccccc2F 240690a_100000181408_100000740811 [0,2,0,0,0,0|2,0,0]=4 15124 B21R2.205889 CC(NC(=O)C=Cc1cccnc1)c2ccccc2Br 11a_100000181357_100000735890 [0,2,0,0,0,0|2,0,0]=4 15125 B21R2.205889 CC(NC(=O)C=Cc1cccnc1)c2ccccc2Br 240690a_100000181357_100000735890 [0,2,0,0,0,0|2,0,0]=4 15126 B21R2.205889 CC(NC(=O)C=Cc1cccnc1)c2ccccc2Cl 11a_100000174978_100000735890 [0,2,0,0,0,0|2,0,0]=4 15127 B21R2.205889 CC(NC(=O)C=Cc1cccnc1)c2ccccc2Cl 240690a_100000174978_100000735890 [0,2,0,0,0,0|2,0,0]=4 15128 B21R2.205889 CC(NC(=O)C=Cc1cccnc1)c2ccccc2F 11a_100000181408_100000735890 [0,2,0,0,0,0|2,0,0]=4 15129 B21R2.205889 CC(NC(=O)C=Cc1cccnc1)c2ccccc2F 240690a_100000181408_100000735890 [0,2,0,0,0,0|2,0,0]=4 15130 B21R2.205889 CC(NC(=O)C=Cc1ccncc1)c2ccccc2Br 240690a_100000181357_100000682801 [0,2,0,0,0,0|2,0,0]=4 15131 B21R2.205889 CC(NC(=O)C=Cc1ccncc1)c2ccccc2Cl 240690a_100000174978_100000682801 [0,2,0,0,0,0|2,0,0]=4 15132 B21R2.205889 CC(NC(=O)C=Cc1ccncc1)c2ccccc2F 240690a_100000181408_100000682801 [0,2,0,0,0,0|2,0,0]=4 15133 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2Br 2230a_100020606079_100000753625 [0,2,0,0,0,0|1,0,1]=4 15134 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2Br 269982a_100020606079_100000753625 [0,2,0,0,0,0|1,0,1]=4 15135 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2Br 34a_100020606079_100000753625 [0,2,0,0,0,0|1,0,1]=4 15136 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2Cl 2230a_100000219374_100000753625 [0,2,0,0,0,0|1,0,1]=4 15137 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2Cl 269982a_100000219374_100000753625 [0,2,0,0,0,0|1,0,1]=4 15138 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2Cl 34a_100000219374_100000753625 [0,2,0,0,0,0|1,0,1]=4 15139 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2F 2230a_100000220357_100000753625 [0,2,0,0,0,0|1,0,1]=4 15140 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2F 269982a_100000220357_100000753625 [0,2,0,0,0,0|1,0,1]=4 15141 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2F 34a_100000220357_100000753625 [0,2,0,0,0,0|1,0,1]=4 15142 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2F 38a_100000220357_100000753625 [0,2,0,0,0,0|1,0,1]=4 15143 B21R2.205889 CN(CC(=O)OCc1ccccc1)c2ccccc2O 269982a_100000033821_100000753625 [0,2,0,0,0,0|1,0,1]=4 15144 B21R2.205889 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccccc2O 240690a_100025703389_100000740811 [0,2,0,0,0,0|2,0,0]=4 15145 B21R2.205889 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccccc2O 240690a_100025703389_100000735890 [0,2,0,0,0,0|2,0,0]=4 15146 B21R2.205889 C[C@@H](NC(=O)C=Cc1ccncc1)c2ccccc2O 240690a_100025703389_100000682801 [0,2,0,0,0,0|2,0,0]=4 15147 B21R2.205889 Cc1ccccc1C(=O)CC(=O)C=Cc2ccccc2 1458a_100000210462_100000741374 [0,2,0,0,0,0|1,0,1]=4 15148 B21R2.205889 Cc1ccccc1C(=O)CC(=O)CCc2ccccc2 1458a_100000185753_100000741374 [0,2,0,0,0,0|1,0,1]=4 15149 B21R2.205889 Cc1ccccc1C(=O)CC(=O)CCc2ccccc2 1458a_100000212026_100012361361 [0,2,0,0,0,0|1,0,1]=4 15150 B21R2.205889 Cc1ccccc1C(=O)CC(=O)NCc2ccccc2 1458a_100000212026_100000183539 [0,2,0,0,0,0|1,0,1]=4 15151 B21R2.205889 Cc1ccccc1C(=O)CC(=O)OCc2ccccc2 1458a_100000212026_100000753625 [0,2,0,0,0,0|0,0,1]=3 15152 B21R2.205889 Cc1ccccc1C(C)NC(=O)C=Cc2ccccc2 11a_100000181355_100000210462 [0,2,0,0,0,0|1,0,0]=3 15153 B21R2.205889 Cc1ccccc1C(C)NC(=O)C=Cc2ccccc2 1626a_100000181355_100000210462 [0,2,0,0,0,0|1,0,0]=3 15154 B21R2.205889 Cc1ccccc1C(C)NC(=O)C=Cc2ccccn2 11a_100000181355_100000740811 [0,2,0,0,0,0|2,0,0]=4 15155 B21R2.205889 Cc1ccccc1C(C)NC(=O)C=Cc2ccccn2 240690a_100000181355_100000740811 [0,2,0,0,0,0|2,0,0]=4 15156 B21R2.205889 Cc1ccccc1C(C)NC(=O)C=Cc2cccnc2 11a_100000181355_100000735890 [0,2,0,0,0,0|2,0,0]=4 15157 B21R2.205889 Cc1ccccc1C(C)NC(=O)C=Cc2cccnc2 240690a_100000181355_100000735890 [0,2,0,0,0,0|2,0,0]=4 15158 B21R2.205889 Cc1ccccc1C(C)NC(=O)C=Cc2ccncc2 240690a_100000181355_100000682801 [0,2,0,0,0,0|2,0,0]=4 15159 B21R2.205889 Cc1ccccc1N(C)CC(=O)OCc2ccccc2 2230a_100000219699_100000753625 [0,2,0,0,0,0|1,0,1]=4 15160 B21R2.205889 Cc1ccccc1N(C)CC(=O)OCc2ccccc2 269982a_100000219699_100000753625 [0,2,0,0,0,0|1,0,1]=4 15161 B21R2.205889 Cc1ccccc1N(C)CC(=O)OCc2ccccc2 34a_100000219699_100000753625 [0,2,0,0,0,0|1,0,1]=4 15162 B21R2.205889 Cc1cccnc1C(C)NC(=O)C=Cc2ccccc2 11a_100011536111_100000210462 [0,2,0,0,0,0|2,0,0]=4 15163 B21R2.205889 Cc1cccnc1C(C)NC(=O)C=Cc2ccccc2 1626a_100011536111_100000210462 [0,2,0,0,0,0|2,0,0]=4 15164 B21R2.205889 O=C(C=Cc1ccccc1)CC(=O)c2ccccc2Br 1458a_100000210462_100000199116 [0,2,0,0,0,0|1,0,1]=4 15165 B21R2.205889 O=C(C=Cc1ccccc1)CC(=O)c2ccccc2Cl 1458a_100000210462_100000211432 [0,2,0,0,0,0|1,0,1]=4 15166 B21R2.205889 O=C(C=Cc1ccccc1)CC(=O)c2ccccc2F 1458a_100000210462_100000204681 [0,2,0,0,0,0|1,0,1]=4 15167 B21R2.205889 O=C(C=Cc1ccccc1)CC(=O)c2ccccc2O 1458a_100000210462_100000188908 [0,2,0,0,0,0|1,0,1]=4 15168 B21R2.205889 O=C(CC(=O)c1ccccc1Br)NCc2ccccc2 1458a_100000188424_100000183539 [0,2,0,0,0,0|1,0,1]=4 15169 B21R2.205889 O=C(CC(=O)c1ccccc1Br)OCc2ccccc2 1458a_100000188424_100000753625 [0,2,0,0,0,0|0,0,1]=3 15170 B21R2.205889 O=C(CC(=O)c1ccccc1Cl)NCc2ccccc2 1458a_100000185844_100000183539 [0,2,0,0,0,0|1,0,1]=4 15171 B21R2.205889 O=C(CC(=O)c1ccccc1Cl)OCc2ccccc2 1458a_100000185844_100000753625 [0,2,0,0,0,0|0,0,1]=3 15172 B21R2.205889 O=C(CC(=O)c1ccccc1F)NCc2ccccc2 1458a_100000188656_100000183539 [0,2,0,0,0,0|1,0,1]=4 15173 B21R2.205889 O=C(CC(=O)c1ccccc1F)OCc2ccccc2 1458a_100000188656_100000753625 [0,2,0,0,0,0|0,0,1]=3 15174 B21R2.205889 O=C(CC(=O)c1ccccc1I)NCc2ccccc2 1458a_100000187884_100000183539 [0,2,0,0,0,0|1,0,1]=4 15175 B21R2.205889 O=C(CC(=O)c1ccccc1I)OCc2ccccc2 1458a_100000187884_100000753625 [0,2,0,0,0,0|0,0,1]=3 15176 B21R2.205889 O=C(CC(=O)c1ccccc1O)NCc2ccccc2 1458a_100015234032_100000183539 [0,2,0,0,0,0|1,0,1]=4 15177 B21R2.205889 O=C(CC(=O)c1ccccc1O)OCc2ccccc2 1458a_100015234032_100000753625 [0,2,0,0,0,0|0,0,1]=3 15178 B21R2.205889 O=C(CC(=O)c1ccccc1[O-])NCc2ccccc2 1458a_100009911694_100000183539 [0,2,0,0,0,0|1,0,1]=4 15179 B21R2.205889 O=C(CC(=O)c1ccccc1[O-])OCc2ccccc2 1458a_100009911694_100000753625 [0,2,0,0,0,0|0,0,1]=3 15180 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2Br 1458a_100000185753_100000199116 [0,2,0,0,0,0|1,0,1]=4 15181 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2Br 1458a_100000188424_100012361361 [0,2,0,0,0,0|1,0,1]=4 15182 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2Cl 1458a_100000185753_100000211432 [0,2,0,0,0,0|1,0,1]=4 15183 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2Cl 1458a_100000185844_100012361361 [0,2,0,0,0,0|1,0,1]=4 15184 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2F 1458a_100000185753_100000204681 [0,2,0,0,0,0|1,0,1]=4 15185 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2F 1458a_100000188656_100012361361 [0,2,0,0,0,0|1,0,1]=4 15186 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2I 1458a_100000187884_100012361361 [0,2,0,0,0,0|1,0,1]=4 15187 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2O 1458a_100000185753_100000188908 [0,2,0,0,0,0|1,0,1]=4 15188 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2O 1458a_100015234032_100012361361 [0,2,0,0,0,0|1,0,1]=4 15189 B21R2.205889 O=C(CCc1ccccc1)CC(=O)c2ccccc2[O-] 1458a_100009911694_100012361361 [0,2,0,0,0,0|1,0,1]=4 15190 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)CC(=O)c2ccccc2 1458a_100016990649_100000211460 [0,2,0,0,0,0|1,0,1]=4 15191 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)CC(C)c2ccccc2 1458a_100016990649_100000756946 [0,2,0,0,0,0|1,0,0]=3 15192 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)CC(O)c2ccccc2 1458a_100016990649_100000185958 [0,2,0,0,0,0|1,0,0]=3 15193 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)C[C@@H](O)c2ccccc2 1458a_100016990649_100011933945 [0,2,0,0,0,0|1,0,0]=3 15194 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)NC(C)c2ccccn2 11a_100000181244_100016990649 [0,2,0,0,0,0|2,0,0]=4 15195 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)NC(C)c2ccccn2 1626a_100000181244_100016990649 [0,2,0,0,0,0|2,0,0]=4 15196 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)NC(C)c2ccccn2 527a_100000181244_100016990649 [0,2,0,0,0,0|2,0,0]=4 15197 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)NC(C)c2cccnc2 11a_100000195435_100016990649 [0,2,0,0,0,0|2,0,0]=4 15198 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)NC(C)c2cccnc2 527a_100000195435_100016990649 [0,2,0,0,0,0|2,0,0]=4 15199 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)NC(C)c2ccncc2 527a_100000181269_100016990649 [0,2,0,0,0,0|2,0,0]=4 15200 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)N[C@H](C)c2ccccc2 11a_100000751104_100016990649 [0,2,0,0,0,0|1,0,0]=3 15201 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)N[C@H](C)c2ccccc2 1626a_100000751104_100016990649 [0,2,0,0,0,0|1,0,0]=3 15202 B21R2.13129 C/C(=C\c1ccccc1)/C(=O)N[C@H](C)c2ccccc2 527a_100000751104_100016990649 [0,2,0,0,0,0|1,0,0]=3 15203 B21R2.13129 C/C(=C\c1ccccn1)/C(=O)CC(C)c2ccccc2 1458a_100025712827_100000756946 [0,2,0,0,0,0|2,0,0]=4 15204 B21R2.13129 C/C(=C\c1ccccn1)/C(=O)CC(O)c2ccccc2 1458a_100025712827_100000185958 [0,2,0,0,0,0|2,0,0]=4 15205 B21R2.13129 C/C(=C\c1ccccn1)/C(=O)C[C@@H](O)c2ccccc2 1458a_100025712827_100011933945 [0,2,0,0,0,0|2,0,0]=4 15206 B21R2.13129 C/C(=C\c1ccccn1)/C(=O)N[C@H](C)c2ccccc2 11a_100000751104_100025712827 [0,2,0,0,0,0|2,0,0]=4 15207 B21R2.13129 C/C(=C\c1ccccn1)/C(=O)N[C@H](C)c2ccccc2 1626a_100000751104_100025712827 [0,2,0,0,0,0|2,0,0]=4 15208 B21R2.13129 C/C(=C\c1ccccn1)/C(=O)N[C@H](C)c2ccccc2 527a_100000751104_100025712827 [0,2,0,0,0,0|2,0,0]=4 15209 B21R2.13129 C=C(Cc1ccccc1)C(=O)N[C@H](C)c2ccccc2 11a_100000751104_100000066491 [0,2,0,0,0,0|1,0,1]=4 15210 B21R2.13129 C=C(Cc1ccccc1)C(=O)N[C@H](C)c2ccccc2 1626a_100000751104_100000066491 [0,2,0,0,0,0|1,0,1]=4 15211 B21R2.13129 CC(=CC(=O)C(C)Cc1ccccc1)c2ccccc2 1458a_100000743005_200011218536 [0,2,0,0,0,0|1,0,0]=3 15212 B21R2.13129 CC(=CC(=O)N(C)Cc1ccccc1)c2ccccc2 11a_100000186898_100000743005 [0,2,0,0,0,0|1,0,0]=3 15213 B21R2.13129 CC(=CC(=O)N(C)Cc1ccccc1)c2ccccc2 1626a_100000186898_100000743005 [0,2,0,0,0,0|1,0,0]=3 15214 B21R2.13129 CC(=CC(=O)N(C)Cc1ccccc1)c2ccccc2 240690a_100000186898_100000743005 [0,2,0,0,0,0|1,0,0]=3 15215 B21R2.13129 CC(=CC(=O)N(C)Cc1ccccc1)c2ccccc2 527a_100000186898_100000743005 [0,2,0,0,0,0|1,0,0]=3 15216 B21R2.13129 CC(=CC(=O)N(C)Cc1ccccn1)c2ccccc2 11a_100000207498_100000743005 [0,2,0,0,0,0|2,0,0]=4 15217 B21R2.13129 CC(=CC(=O)N(C)Cc1ccccn1)c2ccccc2 240690a_100000207498_100000743005 [0,2,0,0,0,0|2,0,0]=4 15218 B21R2.13129 CC(=CC(=O)N(C)Cc1ccccn1)c2ccccc2 527a_100000207498_100000743005 [0,2,0,0,0,0|2,0,0]=4 15219 B21R2.13129 CC(=CC(=O)N(C)Cc1cccnc1)c2ccccc2 11a_100000184577_100000743005 [0,2,0,0,0,0|2,0,0]=4 15220 B21R2.13129 CC(=CC(=O)N(C)Cc1cccnc1)c2ccccc2 240690a_100000184577_100000743005 [0,2,0,0,0,0|2,0,0]=4 15221 B21R2.13129 CC(=CC(=O)N(C)Cc1cccnc1)c2ccccc2 527a_100000184577_100000743005 [0,2,0,0,0,0|2,0,0]=4 15222 B21R2.13129 CC(=CC(=O)N(C)Cc1ccncc1)c2ccccc2 11a_100000187231_100000743005 [0,2,0,0,0,0|2,0,0]=4 15223 B21R2.13129 CC(=CC(=O)N(C)Cc1ccncc1)c2ccccc2 240690a_100000187231_100000743005 [0,2,0,0,0,0|2,0,0]=4 15224 B21R2.13129 CC(=CC(=O)N(C)Cc1ccncc1)c2ccccc2 527a_100000187231_100000743005 [0,2,0,0,0,0|2,0,0]=4 15225 B21R2.13129 CC(CC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 1458a_200020598536_100000756946 [0,2,0,0,0,0|1,0,0]=3 15226 B21R2.13129 CC(CC(=O)/C(=C\c1ccccc1)/F)c2ccccc2 1458a_100020889036_100000756946 [0,2,0,0,0,0|1,0,0]=3 15227 B21R2.13129 CC(CC(=O)C(=Cc1cccnc1)F)c2ccccc2 1458a_100000731744_100000756946 [0,2,0,0,0,0|2,0,0]=4 15228 B21R2.13129 CC(CC(=O)C(=O)Nc1ccccc1)c2ccccc2 1458a_100000738435_100000756946 [0,2,0,0,0,0|2,0,0]=4 15229 B21R2.13129 CC(Cc1ccccc1)C(=O)CC(=O)c2ccccc2 1458a_100000754839_100000211460 [0,2,0,0,0,0|1,0,1]=4 15230 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2ccccn2 11a_100000181244_200020598536 [0,2,0,0,0,0|2,0,0]=4 15231 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2ccccn2 1626a_100000181244_200020598536 [0,2,0,0,0,0|2,0,0]=4 15232 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2ccccn2 240690a_100000181244_200020598536 [0,2,0,0,0,0|2,0,0]=4 15233 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2ccccn2 527a_100000181244_200020598536 [0,2,0,0,0,0|2,0,0]=4 15234 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2cccnc2 11a_100000195435_200020598536 [0,2,0,0,0,0|2,0,0]=4 15235 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2cccnc2 240690a_100000195435_200020598536 [0,2,0,0,0,0|2,0,0]=4 15236 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2cccnc2 527a_100000195435_200020598536 [0,2,0,0,0,0|2,0,0]=4 15237 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2ccncc2 240690a_100000181269_200020598536 [0,2,0,0,0,0|2,0,0]=4 15238 B21R2.13129 CC(NC(=O)/C(=C/c1ccccc1)/Cl)c2ccncc2 527a_100000181269_200020598536 [0,2,0,0,0,0|2,0,0]=4 15239 B21R2.13129 CC(NC(=O)/C(=C\c1ccccc1)/F)c2ccccn2 11a_100000181244_100020889036 [0,2,0,0,0,0|2,0,0]=4 15240 B21R2.13129 CC(NC(=O)/C(=C\c1ccccc1)/F)c2ccccn2 527a_100000181244_100020889036 [0,2,0,0,0,0|2,0,0]=4 15241 B21R2.13129 CC(NC(=O)/C(=C\c1ccccc1)/F)c2cccnc2 11a_100000195435_100020889036 [0,2,0,0,0,0|2,0,0]=4 15242 B21R2.13129 CC(NC(=O)/C(=C\c1ccccc1)/F)c2cccnc2 527a_100000195435_100020889036 [0,2,0,0,0,0|2,0,0]=4 15243 B21R2.13129 CC(NC(=O)/C(=C\c1ccccc1)/F)c2ccncc2 527a_100000181269_100020889036 [0,2,0,0,0,0|2,0,0]=4 15244 B21R2.13129 CN(Cc1ccccc1)C(=O)CC(=O)c2ccccc2 1458a_100000185807_100000182870 [0,2,0,0,0,0|1,0,1]=4 15245 B21R2.13129 C[C@@H](NC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 11a_100000751104_200020598536 [0,2,0,0,0,0|1,0,0]=3 15246 B21R2.13129 C[C@@H](NC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 1626a_100000751104_200020598536 [0,2,0,0,0,0|1,0,0]=3 15247 B21R2.13129 C[C@@H](NC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 240690a_100000751104_200020598536 [0,2,0,0,0,0|1,0,0]=3 15248 B21R2.13129 C[C@@H](NC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 527a_100000751104_200020598536 [0,2,0,0,0,0|1,0,0]=3 15249 B21R2.13129 C[C@@H](NC(=O)/C(=C\c1ccccc1)/F)c2ccccc2 11a_100000751104_100020889036 [0,2,0,0,0,0|1,0,0]=3 15250 B21R2.13129 C[C@@H](NC(=O)/C(=C\c1ccccc1)/F)c2ccccc2 527a_100000751104_100020889036 [0,2,0,0,0,0|1,0,0]=3 15251 B21R2.13129 C[C@@H](NC(=O)C(=Cc1cccnc1)F)c2ccccc2 11a_100000751104_100000731744 [0,2,0,0,0,0|2,0,0]=4 15252 B21R2.13129 C[C@@H](NC(=O)C(=Cc1cccnc1)F)c2ccccc2 240690a_100000751104_100000731744 [0,2,0,0,0,0|2,0,0]=4 15253 B21R2.13129 C[C@@H](NC(=O)C(=Cc1cccnc1)F)c2ccccc2 527a_100000751104_100000731744 [0,2,0,0,0,0|2,0,0]=4 15254 B21R2.13129 C[C@@H](NC(=O)C(=O)Nc1ccccc1)c2ccccc2 240690a_100000751104_100000738435 [0,2,0,0,0,0|2,0,0]=4 15255 B21R2.13129 O=C(CC(=O)[C@H](O)Cc1ccccc1)c2ccccc2 1458a_100009816399_100000211460 [0,2,0,0,0,0|1,0,1]=4 15256 B21R2.13129 O=C(CC(=O)c1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000211460 [0,2,0,0,0,0|1,0,1]=4 15257 B21R2.13129 O=C(CC(=O)c1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000211460 [0,2,0,0,0,0|1,0,1]=4 15258 B21R2.13129 O=C(CC(O)c1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000185958 [0,2,0,0,0,0|1,0,0]=3 15259 B21R2.13129 O=C(CC(O)c1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000185958 [0,2,0,0,0,0|1,0,0]=3 15260 B21R2.13129 O=C(CC(O)c1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000185958 [0,2,0,0,0,0|2,0,0]=4 15261 B21R2.13129 O=C(CC(O)c1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000185958 [0,2,0,0,0,0|2,0,0]=4 15262 B21R2.13129 O=C(C[C@@H](O)c1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011933945 [0,2,0,0,0,0|1,0,0]=3 15263 B21R2.13129 O=C(C[C@@H](O)c1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100011933945 [0,2,0,0,0,0|1,0,0]=3 15264 B21R2.13129 O=C(C[C@@H](O)c1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100011933945 [0,2,0,0,0,0|2,0,0]=4 15265 B21R2.13129 O=C(C[C@@H](O)c1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100011933945 [0,2,0,0,0,0|2,0,0]=4 15266 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)C(C)Cc2ccccc2 1458a_100016990649_200011218536 [0,2,0,0,0,0|1,0,0]=3 15267 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2ccccc2 11a_100000186898_100016990649 [0,2,0,0,0,0|1,0,0]=3 15268 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2ccccc2 1626a_100000186898_100016990649 [0,2,0,0,0,0|1,0,0]=3 15269 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2ccccc2 527a_100000186898_100016990649 [0,2,0,0,0,0|1,0,0]=3 15270 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2ccccn2 11a_100000207498_100016990649 [0,2,0,0,0,0|2,0,0]=4 15271 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2ccccn2 527a_100000207498_100016990649 [0,2,0,0,0,0|2,0,0]=4 15272 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2cccnc2 11a_100000184577_100016990649 [0,2,0,0,0,0|2,0,0]=4 15273 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2cccnc2 527a_100000184577_100016990649 [0,2,0,0,0,0|2,0,0]=4 15274 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2ccncc2 11a_100000187231_100016990649 [0,2,0,0,0,0|2,0,0]=4 15275 B21R2.13164 C/C(=C\c1ccccc1)/C(=O)N(C)Cc2ccncc2 527a_100000187231_100016990649 [0,2,0,0,0,0|2,0,0]=4 15276 B21R2.13164 C/C(=C\c1ccccn1)/C(=O)C(C)Cc2ccccc2 1458a_100025712827_200011218536 [0,2,0,0,0,0|2,0,0]=4 15277 B21R2.13164 C/C(=C\c1ccccn1)/C(=O)N(C)Cc2ccccc2 11a_100000186898_100025712827 [0,2,0,0,0,0|2,0,0]=4 15278 B21R2.13164 C/C(=C\c1ccccn1)/C(=O)N(C)Cc2ccccc2 1626a_100000186898_100025712827 [0,2,0,0,0,0|2,0,0]=4 15279 B21R2.13164 C/C(=C\c1ccccn1)/C(=O)N(C)Cc2ccccc2 527a_100000186898_100025712827 [0,2,0,0,0,0|2,0,0]=4 15280 B21R2.13164 C=C(Cc1ccccc1)C(=O)N(C)Cc2ccccc2 11a_100000186898_100000066491 [0,2,0,0,0,0|1,0,1]=4 15281 B21R2.13164 C=C(Cc1ccccc1)C(=O)N(C)Cc2ccccc2 1626a_100000186898_100000066491 [0,2,0,0,0,0|1,0,1]=4 15282 B21R2.13164 CC(Cc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200011218536 [0,2,0,0,0,0|1,0,0]=3 15283 B21R2.13164 CC(Cc1ccccc1)C(=O)/C(=C\c2ccccc2)/F 1458a_100020889036_200011218536 [0,2,0,0,0,0|1,0,0]=3 15284 B21R2.13164 CC(Cc1ccccc1)C(=O)C(=Cc2cccnc2)F 1458a_100000731744_200011218536 [0,2,0,0,0,0|2,0,0]=4 15285 B21R2.13164 CC(Cc1ccccc1)C(=O)C(=O)Nc2ccccc2 1458a_100000738435_200011218536 [0,2,0,0,0,0|2,0,0]=4 15286 B21R2.13164 CN(Cc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 11a_100000186898_200020598536 [0,2,0,0,0,0|1,0,0]=3 15287 B21R2.13164 CN(Cc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 1626a_100000186898_200020598536 [0,2,0,0,0,0|1,0,0]=3 15288 B21R2.13164 CN(Cc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 240690a_100000186898_200020598536 [0,2,0,0,0,0|1,0,0]=3 15289 B21R2.13164 CN(Cc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 527a_100000186898_200020598536 [0,2,0,0,0,0|1,0,0]=3 15290 B21R2.13164 CN(Cc1ccccc1)C(=O)/C(=C\c2ccccc2)/F 11a_100000186898_100020889036 [0,2,0,0,0,0|1,0,0]=3 15291 B21R2.13164 CN(Cc1ccccc1)C(=O)/C(=C\c2ccccc2)/F 527a_100000186898_100020889036 [0,2,0,0,0,0|1,0,0]=3 15292 B21R2.13164 CN(Cc1ccccc1)C(=O)C(=Cc2cccnc2)F 11a_100000186898_100000731744 [0,2,0,0,0,0|2,0,0]=4 15293 B21R2.13164 CN(Cc1ccccc1)C(=O)C(=Cc2cccnc2)F 240690a_100000186898_100000731744 [0,2,0,0,0,0|2,0,0]=4 15294 B21R2.13164 CN(Cc1ccccc1)C(=O)C(=Cc2cccnc2)F 527a_100000186898_100000731744 [0,2,0,0,0,0|2,0,0]=4 15295 B21R2.13164 CN(Cc1ccccc1)C(=O)C(=O)Nc2ccccc2 240690a_100000186898_100000738435 [0,2,0,0,0,0|2,0,0]=4 15296 B21R2.13164 CN(Cc1ccccn1)C(=O)/C(=C/c2ccccc2)/Cl 11a_100000207498_200020598536 [0,2,0,0,0,0|2,0,0]=4 15297 B21R2.13164 CN(Cc1ccccn1)C(=O)/C(=C/c2ccccc2)/Cl 240690a_100000207498_200020598536 [0,2,0,0,0,0|2,0,0]=4 15298 B21R2.13164 CN(Cc1ccccn1)C(=O)/C(=C/c2ccccc2)/Cl 527a_100000207498_200020598536 [0,2,0,0,0,0|2,0,0]=4 15299 B21R2.13164 CN(Cc1ccccn1)C(=O)/C(=C\c2ccccc2)/F 11a_100000207498_100020889036 [0,2,0,0,0,0|2,0,0]=4 15300 B21R2.13164 CN(Cc1ccccn1)C(=O)/C(=C\c2ccccc2)/F 527a_100000207498_100020889036 [0,2,0,0,0,0|2,0,0]=4 15301 B21R2.13164 CN(Cc1cccnc1)C(=O)/C(=C/c2ccccc2)/Cl 11a_100000184577_200020598536 [0,2,0,0,0,0|2,0,0]=4 15302 B21R2.13164 CN(Cc1cccnc1)C(=O)/C(=C/c2ccccc2)/Cl 240690a_100000184577_200020598536 [0,2,0,0,0,0|2,0,0]=4 15303 B21R2.13164 CN(Cc1cccnc1)C(=O)/C(=C/c2ccccc2)/Cl 527a_100000184577_200020598536 [0,2,0,0,0,0|2,0,0]=4 15304 B21R2.13164 CN(Cc1cccnc1)C(=O)/C(=C\c2ccccc2)/F 11a_100000184577_100020889036 [0,2,0,0,0,0|2,0,0]=4 15305 B21R2.13164 CN(Cc1cccnc1)C(=O)/C(=C\c2ccccc2)/F 527a_100000184577_100020889036 [0,2,0,0,0,0|2,0,0]=4 15306 B21R2.13164 CN(Cc1ccncc1)C(=O)/C(=C/c2ccccc2)/Cl 11a_100000187231_200020598536 [0,2,0,0,0,0|2,0,0]=4 15307 B21R2.13164 CN(Cc1ccncc1)C(=O)/C(=C/c2ccccc2)/Cl 240690a_100000187231_200020598536 [0,2,0,0,0,0|2,0,0]=4 15308 B21R2.13164 CN(Cc1ccncc1)C(=O)/C(=C/c2ccccc2)/Cl 527a_100000187231_200020598536 [0,2,0,0,0,0|2,0,0]=4 15309 B21R2.13164 CN(Cc1ccncc1)C(=O)/C(=C\c2ccccc2)/F 11a_100000187231_100020889036 [0,2,0,0,0,0|2,0,0]=4 15310 B21R2.13164 CN(Cc1ccncc1)C(=O)/C(=C\c2ccccc2)/F 527a_100000187231_100020889036 [0,2,0,0,0,0|2,0,0]=4 15311 B21R2.15276 CCN(Cc1ccccc1)C(=O)C=Cc2ccccc2 11a_100000186914_100000210462 [0,2,0,0,0,0|1,0,0]=3 15312 B21R2.15276 CCN(Cc1ccccc1)C(=O)C=Cc2ccccc2 1626a_100000186914_100000210462 [0,2,0,0,0,0|1,0,0]=3 15313 B21R2.15276 CCN(Cc1ccccc1)C(=O)C=Cc2ccccn2 11a_100000186914_100000740811 [0,2,0,0,0,0|2,0,0]=4 15314 B21R2.15276 CCN(Cc1ccccc1)C(=O)C=Cc2ccccn2 240690a_100000186914_100000740811 [0,2,0,0,0,0|2,0,0]=4 15315 B21R2.15276 CCN(Cc1ccccc1)C(=O)C=Cc2cccnc2 11a_100000186914_100000735890 [0,2,0,0,0,0|2,0,0]=4 15316 B21R2.15276 CCN(Cc1ccccc1)C(=O)C=Cc2cccnc2 240690a_100000186914_100000735890 [0,2,0,0,0,0|2,0,0]=4 15317 B21R2.15276 CCN(Cc1ccccc1)C(=O)C=Cc2ccncc2 240690a_100000186914_100000682801 [0,2,0,0,0,0|2,0,0]=4 15318 B21R2.15276 CCN(Cc1ccccn1)C(=O)C=Cc2ccccc2 11a_100000201164_100000210462 [0,2,0,0,0,0|2,0,0]=4 15319 B21R2.15276 CCN(Cc1ccccn1)C(=O)C=Cc2ccccc2 1626a_100000201164_100000210462 [0,2,0,0,0,0|2,0,0]=4 15320 B21R2.15276 CCN(Cc1cccnc1)C(=O)C=Cc2ccccc2 11a_100000186920_100000210462 [0,2,0,0,0,0|2,0,0]=4 15321 B21R2.15276 CCN(Cc1cccnc1)C(=O)C=Cc2ccccc2 1626a_100000186920_100000210462 [0,2,0,0,0,0|2,0,0]=4 15322 B21R2.15276 CCN(Cc1ccncc1)C(=O)C=Cc2ccccc2 11a_100000186919_100000210462 [0,2,0,0,0,0|2,0,0]=4 15323 B21R2.15276 CCN(Cc1ccncc1)C(=O)C=Cc2ccccc2 1626a_100000186919_100000210462 [0,2,0,0,0,0|2,0,0]=4 15324 B21R2.15276 CO[C@H](Cc1ccccc1)C(=O)OCc2ccccc2 7a_200025756102_200000210301 [0,2,0,0,0,0|0,0,2]=4 15325 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)CCc2ccccc2 1458a_100000162679_100000765856 [0,2,0,0,0,0|1,0,0]=3 15326 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)CCc2ccccn2 1458a_100000162679_100015183660 [0,2,0,0,0,0|2,0,0]=4 15327 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)CCc2cccnc2 1458a_100000162679_200011713674 [0,2,0,0,0,0|2,0,0]=4 15328 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)CCc2ccncc2 1458a_100000162679_100000723409 [0,2,0,0,0,0|2,0,0]=4 15329 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)NCc2ccccc2 527a_100015324214_100000162679 [0,2,0,0,0,0|1,0,0]=3 15330 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)NCc2ccccn2 527a_100000210449_100000162679 [0,2,0,0,0,0|2,0,0]=4 15331 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)NCc2cccnc2 527a_100000210453_100000162679 [0,2,0,0,0,0|2,0,0]=4 15332 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)NCc2ccncc2 527a_100000210450_100000162679 [0,2,0,0,0,0|2,0,0]=4 15333 B21R2.15276 N#CC(=Cc1ccccc1)C(=O)NNc2ccccc2 22a_100015195140_100000162679 [0,2,0,0,0,0|2,0,0]=4 15334 B21R2.15276 N#CC(Cc1ccccc1)C(=O)C=Cc2ccccc2 1458a_100000210462_100000183401 [0,2,0,0,0,0|1,0,0]=3 15335 B21R2.15276 N#CC(Cc1ccccc1)C(=O)C=Cc2ccccn2 1458a_100000740811_100000183401 [0,2,0,0,0,0|2,0,0]=4 15336 B21R2.15276 N#CC(Cc1ccccc1)C(=O)C=Cc2cccnc2 1458a_100000735890_100000183401 [0,2,0,0,0,0|2,0,0]=4 15337 B21R2.15276 N#CC(Cc1ccccc1)C(=O)C=Cc2ccncc2 1458a_100000682801_100000183401 [0,2,0,0,0,0|2,0,0]=4 15338 B21R2.15276 [13CH3]O[C@H](Cc1ccccc1)C(=O)OCc2ccccc2 7a_200025756102_200025704644 [0,2,0,0,0,0|0,0,2]=4 15339 B21R2.27921 CC(C(=O)C=Cc1ccccc1)C(=O)c2ccccc2 1458a_100000210462_100000239700 [0,2,0,0,0,0|1,0,1]=4 15340 B21R2.27921 CC(C(=O)CCc1ccccc1)C(=O)c2ccccc2 1458a_100000185753_100000239700 [0,2,0,0,0,0|1,0,1]=4 15341 B21R2.27921 CC(C(=O)NCc1ccccc1)C(=O)c2ccccc2 1458a_100000185807_100000183842 [0,2,0,0,0,0|1,0,1]=4 15342 B21R2.27921 CC(c1ccccc1)N(C)C(=O)C=Cc2ccccc2 11a_100000195388_100000210462 [0,2,0,0,0,0|1,0,0]=3 15343 B21R2.27921 CC(c1ccccc1)N(C)C(=O)C=Cc2ccccc2 1626a_100000195388_100000210462 [0,2,0,0,0,0|1,0,0]=3 15344 B21R2.27921 CC(c1ccccc1)N(C)C(=O)C=Cc2ccccn2 11a_100000195388_100000740811 [0,2,0,0,0,0|2,0,0]=4 15345 B21R2.27921 CC(c1ccccc1)N(C)C(=O)C=Cc2ccccn2 240690a_100000195388_100000740811 [0,2,0,0,0,0|2,0,0]=4 15346 B21R2.27921 CC(c1ccccc1)N(C)C(=O)C=Cc2cccnc2 11a_100000195388_100000735890 [0,2,0,0,0,0|2,0,0]=4 15347 B21R2.27921 CC(c1ccccc1)N(C)C(=O)C=Cc2cccnc2 240690a_100000195388_100000735890 [0,2,0,0,0,0|2,0,0]=4 15348 B21R2.27921 CC(c1ccccc1)N(C)C(=O)C=Cc2ccncc2 240690a_100000195388_100000682801 [0,2,0,0,0,0|2,0,0]=4 15349 B21R2.27921 CC(c1ccccn1)N(C)C(=O)C=Cc2ccccc2 11a_100000231138_100000210462 [0,2,0,0,0,0|2,0,0]=4 15350 B21R2.27921 CC(c1ccccn1)N(C)C(=O)C=Cc2ccccc2 1626a_100000231138_100000210462 [0,2,0,0,0,0|2,0,0]=4 15351 B21R2.27921 CC(c1cccnc1)N(C)C(=O)C=Cc2ccccc2 11a_100000232774_100000210462 [0,2,0,0,0,0|2,0,0]=4 15352 B21R2.27921 CC(c1ccncc1)N(C)C(=O)C=Cc2ccccc2 11a_100000231139_100000210462 [0,2,0,0,0,0|2,0,0]=4 15353 B21R2.27921 CN(C(=O)C(=O)CCc1ccccc1)c2ccccc2 1458a_100011297159_100000765856 [0,2,0,0,0,0|2,0,0]=4 15354 B21R2.27921 CN(C(=O)C(=O)NCc1ccccc1)c2ccccc2 1626a_100015324214_100011297159 [0,2,0,0,0,0|2,0,0]=4 15355 B21R2.27921 CN(C(=O)C(=O)NCc1ccccc1)c2ccccc2 240690a_100015324214_100011297159 [0,2,0,0,0,0|2,0,0]=4 15356 B21R2.27921 CN(c1ccccc1)C(F)C(=O)OCc2ccccc2 2230a_100000210012_100000036447 [0,2,0,0,0,0|1,0,1]=4 15357 B21R2.27921 CN(c1ccccc1)C(F)C(=O)OCc2ccccc2 269982a_100000210012_100000036447 [0,2,0,0,0,0|1,0,1]=4 15358 B21R2.27921 CN(c1ccccc1)C(F)C(=O)OCc2ccccc2 34a_100000210012_100000036447 [0,2,0,0,0,0|1,0,1]=4 15359 B21R2.27921 O=C(OCc1ccccc1)C(F)C(=O)c2ccccc2 1458a_100000185807_100000036447 [0,2,0,0,0,0|0,0,1]=3 15360 B21R2.27924 O=C(C=Cc1ccccc1)C(F)(F)Oc2ccccc2 1458a_100000210462_200000057402 [0,2,0,0,0,0|2,0,0]=4 15361 B21R2.27924 O=C(OCc1ccccc1)C(F)(F)Nc2ccccc2 34a_100000106764_100015468398 [0,2,0,0,0,0|1,0,1]=4 15362 B21R2.27924 O=C(OCc1ccccc1)C(F)(F)Oc2ccccc2 34a_100000210340_100015468398 [0,2,0,0,0,0|1,0,1]=4 15363 B21R2.27924 O=C(OCc1ccccc1)C(F)(F)Oc2ccccc2 7a_100000210340_100015468398 [0,2,0,0,0,0|1,0,1]=4 15364 B21R2.27924 O=C(OCc1ccccc1)C(F)(F)Sc2ccccc2 62a_100000719477_100015468398 [0,2,0,0,0,0|1,0,1]=4 15365 B21R2.27924 O=C(OCc1ccccc1)C(F)(F)Sc2ccccc2 62a_100015468398_100000041952 [0,2,0,0,0,0|1,0,1]=4 15366 B21R2.257816 CN(Cc1ccccc1)S(=O)(=O)C=Cc2ccccc2 40a_100000186898_100011098038 [0,2,0,0,0,0|2,0,0]=4 15367 B21R2.15366 CCC(NC(=O)C=Cc1ccccc1)c2ccccc2 11a_100000737752_100000210462 [0,2,0,0,0,0|1,0,0]=3 15368 B21R2.15366 CCC(NC(=O)C=Cc1ccccc1)c2ccccc2 1626a_100000737752_100000210462 [0,2,0,0,0,0|1,0,0]=3 15369 B21R2.15366 CCC(NC(=O)C=Cc1ccccc1)c2ccccn2 11a_100015186561_100000210462 [0,2,0,0,0,0|2,0,0]=4 15370 B21R2.15366 CCC(NC(=O)C=Cc1ccccc1)c2ccccn2 1626a_100015186561_100000210462 [0,2,0,0,0,0|2,0,0]=4 15371 B21R2.15366 CCC(NC(=O)C=Cc1ccccc1)c2cccnc2 11a_100000246009_100000210462 [0,2,0,0,0,0|2,0,0]=4 15372 B21R2.15366 CCC(NC(=O)C=Cc1ccccc1)c2cccnc2 1626a_100000246009_100000210462 [0,2,0,0,0,0|2,0,0]=4 15373 B21R2.15366 CCC(NC(=O)C=Cc1ccccc1)c2ccncc2 11a_100000246010_100000210462 [0,2,0,0,0,0|2,0,0]=4 15374 B21R2.15366 CCC(NC(=O)C=Cc1ccccc1)c2ccncc2 1626a_100000246010_100000210462 [0,2,0,0,0,0|2,0,0]=4 15375 B21R2.15366 CCC(NC(=O)C=Cc1ccccn1)c2ccccc2 11a_100000737752_100000740811 [0,2,0,0,0,0|2,0,0]=4 15376 B21R2.15366 CCC(NC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100000737752_100000740811 [0,2,0,0,0,0|2,0,0]=4 15377 B21R2.15366 CCC(NC(=O)C=Cc1cccnc1)c2ccccc2 11a_100000737752_100000735890 [0,2,0,0,0,0|2,0,0]=4 15378 B21R2.15366 CCC(NC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100000737752_100000735890 [0,2,0,0,0,0|2,0,0]=4 15379 B21R2.15366 CCC(NC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100000737752_100000682801 [0,2,0,0,0,0|2,0,0]=4 15380 B21R2.15366 CCN(CC(=O)OCc1ccccc1)c2ccccc2 2230a_100000210013_100000753625 [0,2,0,0,0,0|1,0,1]=4 15381 B21R2.15366 CCN(CC(=O)OCc1ccccc1)c2ccccc2 269982a_100000210013_100000753625 [0,2,0,0,0,0|1,0,1]=4 15382 B21R2.15366 CCN(CC(=O)OCc1ccccc1)c2ccccc2 34a_100000210013_100000753625 [0,2,0,0,0,0|1,0,1]=4 15383 B21R2.15366 N#CC(NC(=O)C=Cc1ccccc1)c2ccccc2 1626a_100020627052_100000210462 [0,2,0,0,0,0|1,0,0]=3 15384 B21R2.15366 N#CC(NC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100020627052_100000740811 [0,2,0,0,0,0|2,0,0]=4 15385 B21R2.15366 N#CC(NC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100020627052_100000735890 [0,2,0,0,0,0|2,0,0]=4 15386 B21R2.15366 N#CC(NC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100020627052_100000682801 [0,2,0,0,0,0|2,0,0]=4 15387 B21R2.15366 O=C(C=Cc1ccccn1)N[C@H](CO)c2ccccc2 240690a_100000751927_100000740811 [0,2,0,0,0,0|2,0,0]=4 15388 B21R2.15366 O=C(C=Cc1cccnc1)N[C@H](CO)c2ccccc2 240690a_100000751927_100000735890 [0,2,0,0,0,0|2,0,0]=4 15389 B21R2.15366 O=C(C=Cc1ccncc1)N[C@H](CO)c2ccccc2 240690a_100000751927_100000682801 [0,2,0,0,0,0|2,0,0]=4 15390 B21R2.27900 CC(C)(NC(=O)C=Cc1ccccc1)c2ccccc2 11a_100011218174_100000210462 [0,2,0,0,0,0|1,0,0]=3 15391 B21R2.27900 CC(C)(NC(=O)C=Cc1ccccc1)c2ccccc2 1626a_100011218174_100000210462 [0,2,0,0,0,0|1,0,0]=3 15392 B21R2.27900 CC(C)(NC(=O)C=Cc1ccccc1)c2ccccn2 11a_100011999416_100000210462 [0,2,0,0,0,0|2,0,0]=4 15393 B21R2.27900 CC(C)(NC(=O)C=Cc1ccccc1)c2ccccn2 1626a_100011999416_100000210462 [0,2,0,0,0,0|2,0,0]=4 15394 B21R2.27900 CC(C)(NC(=O)C=Cc1ccccc1)c2cccnc2 11a_100011376175_100000210462 [0,2,0,0,0,0|2,0,0]=4 15395 B21R2.27900 CC(C)(NC(=O)C=Cc1ccccc1)c2cccnc2 1626a_100011376175_100000210462 [0,2,0,0,0,0|2,0,0]=4 15396 B21R2.27900 CC(C)(NC(=O)C=Cc1ccccn1)c2ccccc2 11a_100011218174_100000740811 [0,2,0,0,0,0|2,0,0]=4 15397 B21R2.27900 CC(C)(NC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100011218174_100000740811 [0,2,0,0,0,0|2,0,0]=4 15398 B21R2.27900 CC(C)(NC(=O)C=Cc1cccnc1)c2ccccc2 11a_100011218174_100000735890 [0,2,0,0,0,0|2,0,0]=4 15399 B21R2.27900 CC(C)(NC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100011218174_100000735890 [0,2,0,0,0,0|2,0,0]=4 15400 B21R2.27900 CC(C)(NC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100011218174_100000682801 [0,2,0,0,0,0|2,0,0]=4 15401 B21R2.27900 C[Si](C)(CC(=O)C=Cc1ccccc1)c2ccccc2 1458a_100000210462_100000038972 [0,2,0,0,0,0|1,1,0]=4 15402 B21R2.27900 O=C(C=Cc1ccccc1)CS(=O)(=O)c2ccccc2 1458a_100000210462_100000240042 [0,2,0,0,0,0|2,0,0]=4 15403 B21R2.27900 O=C(C=Cc1ccccc1)NS(=O)(=O)c2ccccc2 2740a_100000164509_100000210462 [0,2,0,0,0,0|2,0,0]=4 15404 B21R2.93772 CC(=CC(=O)CC(=O)c1ccccc1)c2ccccc2 1458a_100000743005_100000211460 [0,2,0,0,0,0|1,0,1]=4 15405 B21R2.93772 CC(=CC(=O)CC(C)c1ccccc1)c2ccccc2 1458a_100000743005_100000756946 [0,2,0,0,0,0|1,0,0]=3 15406 B21R2.93772 CC(=CC(=O)CC(O)c1ccccc1)c2ccccc2 1458a_100000743005_100000185958 [0,2,0,0,0,0|1,0,0]=3 15407 B21R2.93772 CC(=CC(=O)C[C@@H](O)c1ccccc1)c2ccccc2 1458a_100000743005_100011933945 [0,2,0,0,0,0|1,0,0]=3 15408 B21R2.93772 CC(=CC(=O)NC(C)c1ccccn1)c2ccccc2 11a_100000181244_100000743005 [0,2,0,0,0,0|2,0,0]=4 15409 B21R2.93772 CC(=CC(=O)NC(C)c1ccccn1)c2ccccc2 1626a_100000181244_100000743005 [0,2,0,0,0,0|2,0,0]=4 15410 B21R2.93772 CC(=CC(=O)NC(C)c1ccccn1)c2ccccc2 240690a_100000181244_100000743005 [0,2,0,0,0,0|2,0,0]=4 15411 B21R2.93772 CC(=CC(=O)NC(C)c1ccccn1)c2ccccc2 527a_100000181244_100000743005 [0,2,0,0,0,0|2,0,0]=4 15412 B21R2.93772 CC(=CC(=O)NC(C)c1cccnc1)c2ccccc2 11a_100000195435_100000743005 [0,2,0,0,0,0|2,0,0]=4 15413 B21R2.93772 CC(=CC(=O)NC(C)c1cccnc1)c2ccccc2 240690a_100000195435_100000743005 [0,2,0,0,0,0|2,0,0]=4 15414 B21R2.93772 CC(=CC(=O)NC(C)c1cccnc1)c2ccccc2 527a_100000195435_100000743005 [0,2,0,0,0,0|2,0,0]=4 15415 B21R2.93772 CC(=CC(=O)NC(C)c1ccncc1)c2ccccc2 240690a_100000181269_100000743005 [0,2,0,0,0,0|2,0,0]=4 15416 B21R2.93772 CC(=CC(=O)NC(C)c1ccncc1)c2ccccc2 527a_100000181269_100000743005 [0,2,0,0,0,0|2,0,0]=4 15417 B21R2.93772 CC(=CC(=O)N[C@H](C)c1ccccc1)c2ccccc2 11a_100000751104_100000743005 [0,2,0,0,0,0|1,0,0]=3 15418 B21R2.93772 CC(=CC(=O)N[C@H](C)c1ccccc1)c2ccccc2 1626a_100000751104_100000743005 [0,2,0,0,0,0|1,0,0]=3 15419 B21R2.93772 CC(=CC(=O)N[C@H](C)c1ccccc1)c2ccccc2 240690a_100000751104_100000743005 [0,2,0,0,0,0|1,0,0]=3 15420 B21R2.93772 CC(=CC(=O)N[C@H](C)c1ccccc1)c2ccccc2 527a_100000751104_100000743005 [0,2,0,0,0,0|1,0,0]=3 15421 B21R2.93772 CC(CC(=O)CC(=O)c1ccccc1)c2ccccc2 1458a_100000183687_100000211460 [0,2,0,0,0,0|1,0,1]=4 15422 B21R2.93772 CC(NC(=O)CC(=O)c1ccccc1)c2ccccc2 1458a_100000185807_200000243715 [0,2,0,0,0,0|1,0,1]=4 15423 B21R2.93772 C[C@H](NC(=O)CC(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100011939912 [0,2,0,0,0,0|1,0,1]=4 15424 B21R2.93772 O=C(CC(=O)c1ccccc1)CC(O)c2ccccc2 1458a_100000690199_100000211460 [0,2,0,0,0,0|1,0,1]=4 15425 B21R2.258184 C[C@@H](NS(=O)(=O)C=Cc1ccccc1)c2ccccc2 40a_100000751104_100011098038 [0,2,0,0,0,0|2,0,0]=4 15426 B19R2.3421 C=Cc1ccccc1C(=O)CCc2ccccc2 1458a_100011830265_100000765856 [0,0,1,1,0,0|1,0,0]=3 15427 B19R2.3421 C=Cc1ccccc1C(=O)CCc2ccccn2 1458a_100011830265_100015183660 [0,0,1,1,0,0|2,0,0]=4 15428 B19R2.3421 C=Cc1ccccc1C(=O)CCc2cccnc2 1458a_100011830265_200011713674 [0,0,1,1,0,0|2,0,0]=4 15429 B19R2.3421 C=Cc1ccccc1C(=O)CCc2ccncc2 1458a_100011830265_100000723409 [0,0,1,1,0,0|2,0,0]=4 15430 B19R2.3421 C=Cc1ccccc1C(=O)NCc2ccccc2 1626a_100015324214_100011830265 [0,0,1,1,0,0|1,0,0]=3 15431 B19R2.3421 C=Cc1ccccc1C(=O)NCc2ccccc2 271570a_100011290941_200000153116 [0,0,1,1,0,0|1,0,0]=3 15432 B19R2.3421 C=Cc1ccccc1C(=O)NCc2ccccn2 1626a_100000210449_100011830265 [0,0,1,1,0,0|2,0,0]=4 15433 B19R2.3421 C=Cc1ccccc1C(=O)NCc2ccncc2 1626a_100000210450_100011830265 [0,0,1,1,0,0|2,0,0]=4 15434 B19R2.3421 C=Cc1ccccc1C(=O)NNc2ccccc2 22a_100015195140_100011830265 [0,0,1,1,0,0|2,0,0]=4 15435 B19R2.3421 C=Cc1ncccc1C(=O)NCc2ccccc2 271570a_100011290941_200000153156 [0,0,1,1,0,0|2,0,0]=4 15436 B19R2.3421 COc1ccccc1C(=O)OCc2ccccc2 7a_100000000771_200000210301 [0,0,1,1,0,0|1,0,1]=4 15437 B19R2.3421 [13CH3]Oc1ccccc1C(=O)OCc2ccccc2 7a_100000000771_200025704644 [0,0,1,1,0,0|1,0,1]=4 15438 B19R2.876 C=Cc1cc(ccn1)C(=O)OCc2ccccc2 271570a_100011290941_200012776275 [0,0,1,1,0,0|1,0,0]=3 15439 B19R2.876 C=Cc1cccc(c1)C(=O)CCc2ccccc2 1458a_100011215009_100000765856 [0,0,1,1,0,0|1,0,0]=3 15440 B19R2.876 C=Cc1cccc(c1)C(=O)CCc2ccccn2 1458a_100011215009_100015183660 [0,0,1,1,0,0|2,0,0]=4 15441 B19R2.876 C=Cc1cccc(c1)C(=O)CCc2cccnc2 1458a_100011215009_200011713674 [0,0,1,1,0,0|2,0,0]=4 15442 B19R2.876 C=Cc1cccc(c1)C(=O)CCc2ccncc2 1458a_100011215009_100000723409 [0,0,1,1,0,0|2,0,0]=4 15443 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccc2 11a_100015324214_100011215009 [0,0,1,1,0,0|1,0,0]=3 15444 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccc2 1626a_100015324214_100011215009 [0,0,1,1,0,0|1,0,0]=3 15445 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccc2 240690a_100015324214_100011215009 [0,0,1,1,0,0|1,0,0]=3 15446 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccc2 271570a_100011290941_200000153165 [0,0,1,1,0,0|1,0,0]=3 15447 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccc2 527a_100015324214_100011215009 [0,0,1,1,0,0|1,0,0]=3 15448 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccn2 11a_100000210449_100011215009 [0,0,1,1,0,0|2,0,0]=4 15449 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccn2 1626a_100000210449_100011215009 [0,0,1,1,0,0|2,0,0]=4 15450 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccn2 240690a_100000210449_100011215009 [0,0,1,1,0,0|2,0,0]=4 15451 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccccn2 527a_100000210449_100011215009 [0,0,1,1,0,0|2,0,0]=4 15452 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2cccnc2 11a_100000210453_100011215009 [0,0,1,1,0,0|2,0,0]=4 15453 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2cccnc2 240690a_100000210453_100011215009 [0,0,1,1,0,0|2,0,0]=4 15454 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2cccnc2 527a_100000210453_100011215009 [0,0,1,1,0,0|2,0,0]=4 15455 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccncc2 11a_100000210450_100011215009 [0,0,1,1,0,0|2,0,0]=4 15456 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccncc2 1626a_100000210450_100011215009 [0,0,1,1,0,0|2,0,0]=4 15457 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccncc2 240690a_100000210450_100011215009 [0,0,1,1,0,0|2,0,0]=4 15458 B19R2.876 C=Cc1cccc(c1)C(=O)NCc2ccncc2 527a_100000210450_100011215009 [0,0,1,1,0,0|2,0,0]=4 15459 B19R2.876 C=Cc1cccc(c1)C(=O)NNc2ccccc2 22a_100015195140_100011215009 [0,0,1,1,0,0|2,0,0]=4 15460 B19R2.876 C=Cc1ccnc(c1)C(=O)NCc2ccccc2 271570a_100011290941_100000194103 [0,0,1,1,0,0|2,0,0]=4 15461 B19R2.876 C=Cc1ccnc(c1)C(=O)OCc2ccccc2 271570a_100011290941_200045471927 [0,0,1,1,0,0|1,0,0]=3 15462 B19R2.876 C=Cc1cncc(c1)C(=O)NCc2ccccc2 271570a_100011290941_100000153185 [0,0,1,1,0,0|2,0,0]=4 15463 B19R2.876 COc1cccc(c1)C(=O)OCc2ccccc2 7a_200000000748_200000210301 [0,0,1,1,0,0|1,0,1]=4 15464 B19R2.876 [13CH3]Oc1cccc(c1)C(=O)OCc2ccccc2 7a_200000000748_200025704644 [0,0,1,1,0,0|1,0,1]=4 15465 B19R2.28183 C=Cc1ccc(cc1C=O)OCc2ccccc2 271570a_100011290941_100012340526 [0,0,1,1,0,0|2,0,0]=4 15466 B19R3.25 c1ccc(cc1)c2ccnn2c3ccccc3 271570a_100010749473_100000210277 [1,0,0,1,0,0|2,0,0]=4 15467 B19R3.25 c1ccc(cc1)c2ccnn2c3ccccc3 271570a_100011218836_100011001034 [1,0,0,1,0,0|2,0,0]=4 15468 B19R3.28 c1ccc(cc1)Sc2cccc3c2cccc3 62a_100000719477_100000210605 [1,0,0,1,0,0|2,0,0]=4 15469 B19R3.2370 C(=Cc1coc2c1cccc2)c3ccccc3 271570a_100102527694_100009812202 [1,0,0,1,0,0|2,0,0]=4 15470 B19R3.2370 C(=Cc1csc2c1cccc2)c3ccccc3 271570a_100102527694_100009813928 [1,0,0,1,0,0|2,0,0]=4 15471 B19R3.2370 C(=Cc1n[nH]c2c1cccc2)c3ccccc3 271570a_100102527694_100000050141 [1,0,0,1,0,0|2,0,0]=4 15472 B19R3.2370 c1ccc(cc1)COc2csc3c2cccc3 34a_100000077758_100015291786 [1,0,0,1,0,0|1,0,0]=3 15473 B19R3.2370 c1ccc(cc1)COc2csc3c2cccc3 7a_100000077758_100000211182 [1,0,0,1,0,0|1,0,0]=3 15474 B19R3.2370 c1ccc(cc1)CSc2coc3c2cccc3 62a_100000211182_100009812202 [1,0,0,1,0,0|1,1,0]=4 15475 B19R3.2370 c1ccc(cc1)CSc2csc3c2cccc3 62a_100000211182_100009813928 [1,0,0,1,0,0|1,1,0]=4 15476 B19R3.2370 c1ccc(nc1)COc2csc3c2cccc3 34a_100000077758_100000721315 [1,0,0,1,0,0|2,0,0]=4 15477 B19R3.2370 c1ccc(nc1)COc2csc3c2cccc3 7a_100000077758_100000721315 [1,0,0,1,0,0|2,0,0]=4 15478 B19R3.2370 c1ccc2c(csc2c1)OCc3ccncc3 7a_100000077758_100015193705 [1,0,0,1,0,0|2,0,0]=4 15479 B19R3.2370 c1cncc(c1)COc2csc3c2cccc3 34a_100000077758_100000733263 [1,0,0,1,0,0|2,0,0]=4 15480 B19R3.2370 c1cncc(c1)COc2csc3c2cccc3 7a_100000077758_100000741622 [1,0,0,1,0,0|2,0,0]=4 15481 B19R3.288 Cc1oc2ccccc2c1Sc3ccccc3 62a_100000719477_200010236113 [0,0,0,1,1,0|2,0,0]=4 15482 B19R3.294 Cc1cc(c2ccccc2n1)c3ccccc3 271570a_100011218836_100000764982 [0,0,0,1,1,0|2,0,0]=4 15483 B19R3.294 Nc1cc(c2ccccc2c1)c3ccccc3 271570a_100011218836_100010089974 [0,0,0,1,1,0|1,0,1]=4 15484 B19R3.294 O=c1cc(c2ccccc2[nH]1)c3ccccc3 271570a_100011218836_100000075698 [0,0,0,1,1,0|1,0,0]=3 15485 B19R3.294 O=c1cc(c2ccccc2[nH]1)c3ccccn3 271570a_100011264011_100000075698 [0,0,0,1,1,0|2,0,0]=4 15486 B19R3.294 O=c1cc(c2ccccc2[nH]1)c3cccnc3 271570a_100000757648_100000075698 [0,0,0,1,1,0|2,0,0]=4 15487 B19R3.294 O=c1cc(c2ccccc2[nH]1)c3ccncc3 271570a_100000752145_100000075698 [0,0,0,1,1,0|2,0,0]=4 15488 B19R3.294 O=c1cc(c2cccnc2[nH]1)c3ccccc3 271570a_100011218836_100010499609 [0,0,0,1,1,0|2,0,0]=4 15489 B19R3.294 Oc1cc(c2ccccc2c1)c3ccccc3 271570a_100011218836_100010001680 [0,0,0,1,1,0|0,0,2]=4 15490 B19R3.294 Oc1cc(c2ccccc2c1)c3ccccc3 271570a_100020673302_100000210277 [0,0,0,1,1,0|0,0,2]=4 15491 B19R3.294 Oc1cc(c2ccccc2c1)c3ccccc3 271570a_203496583355_100025706654 [0,0,0,1,1,0|0,0,2]=4 15492 B19R3.294 Oc1cc(c2ccccc2n1)c3ccccc3 271570a_203496583355_200000716144 [0,0,0,1,1,0|1,0,1]=4 15493 B19R3.346 Brc1ccc2ccccc2c1c3ccccc3 271570a_100011218836_100010090040 [0,0,0,1,1,0|1,0,1]=4 15494 B19R3.346 Cc1ccc2ccccc2c1c3ccccc3 271570a_100000693886_100000210277 [0,0,0,1,1,0|1,0,1]=4 15495 B19R3.346 Cc1ccc2ccccc2c1c3ccccc3 271570a_100011218836_100000759710 [0,0,0,1,1,0|1,0,1]=4 15496 B19R3.346 Nc1ccc2ccccc2c1c3ccccc3 271570a_100011218836_100000705303 [0,0,0,1,1,0|1,0,1]=4 15497 B19R3.346 Oc1ccc2ccccc2c1c3ccccc3 271570a_100011218836_100000183829 [0,0,0,1,1,0|0,0,2]=4 15498 B19R3.346 Oc1ccc2ccccc2c1c3ccccc3 271570a_200000093147_100000210277 [0,0,0,1,1,0|0,0,2]=4 15499 B19R3.346 Oc1ccc2ccccc2c1c3ccccc3 271570a_203496583355_100020644368 [0,0,0,1,1,0|0,0,2]=4 15500 B19R3.10796 O=C(Cc1ccccc1)C2Cc3c2cccc3 1458a_200000238571_100015291786 [0,0,0,1,1,0|0,0,2]=4 15501 B19R3.10796 O=C(Nc1ccccc1)C2Cc3c2cccc3 11a_100000106764_200000238571 [0,0,0,1,1,0|2,0,0]=4 15502 B19R3.10796 O=C(Nc1ccccc1)C2Cc3c2cccc3 1626a_100000106764_200000238571 [0,0,0,1,1,0|2,0,0]=4 15503 B19R3.10796 O=C(Nc1ccccc1)C2Cc3c2cccc3 22a_100000106764_200000238571 [0,0,0,1,1,0|2,0,0]=4 15504 B19R3.10796 O=C(Nc1ccccc1)C2Cc3c2cccc3 527a_100000106764_200000238571 [0,0,0,1,1,0|2,0,0]=4 15505 B19R3.19215 c1ccc(cc1)Nc2ccc3ccccc3n2 27a_100000106764_100011291633 [0,0,0,1,1,0|2,0,0]=4 15506 B19R3.19215 c1ccc(cc1)Sc2ccc3ccccc3c2 62a_100000719477_100000233703 [0,0,0,1,1,0|1,1,0]=4 15507 B19R3.19215 c1ccc(cc1)Sc2ccc3ccccc3n2 62a_100000719477_100011291633 [0,0,0,1,1,0|1,1,0]=4 15508 B19R3.19215 c1ccc(cc1)Sc2ccc3ccccc3n2 62a_100011291633_100000041952 [0,0,0,1,1,0|1,1,0]=4 15509 B19R3.19255 C(=Cc1cc2ccccc2[nH]1)c3ccccc3 271570a_100102527694_100010232065 [0,0,0,1,1,0|1,0,1]=4 15510 B19R3.19255 C(=Cc1cc2ccccc2o1)c3ccccc3 271570a_100102527694_100010159458 [0,0,0,1,1,0|1,0,0]=3 15511 B19R3.19255 C(=Cc1cc2ccccc2o1)c3cccnc3 271570a_100102525586_100010159458 [0,0,0,1,1,0|2,0,0]=4 15512 B19R3.19255 C(=Cc1cc2ccccc2s1)c3ccccc3 271570a_100102527694_100009816949 [0,0,0,1,1,0|0,1,1]=4 15513 B19R3.19255 C(=Cc1nc2ccccc2[nH]1)c3ccccc3 271570a_100102527694_100009814255 [0,0,0,1,1,0|2,0,0]=4 15514 B19R3.19255 C(=Cc1nc2ccccc2s1)c3ccccc3 271570a_100102527694_100000751744 [0,0,0,1,1,0|1,1,0]=4 15515 B19R3.19255 c1ccc(cc1)CSc2cc3ccccc3[nH]2 62a_100000211182_100010232065 [0,0,0,1,1,0|1,1,0]=4 15516 B19R3.19255 c1ccc(cc1)CSc2cc3ccccc3o2 62a_100000211182_100010159458 [0,0,0,1,1,0|0,1,1]=4 15517 B19R3.19255 c1ccc(cc1)CSc2cc3ccccc3s2 62a_100000211182_100009816949 [0,0,0,1,1,0|0,2,0]=4 15518 B19R3.19268 c1ccc(cc1)COc2ccc3[nH]ccc3c2 34a_100000756620_100015291786 [0,0,0,1,1,0|2,0,0]=4 15519 B19R3.19268 c1ccc(cc1)COc2ccc3cc[nH]c3c2 34a_100000036713_100015291786 [0,0,0,1,1,0|2,0,0]=4 15520 B19R3.19268 c1ccc(cc1)COc2ccc3ccoc3c2 34a_100000089557_100015291786 [0,0,0,1,1,0|2,0,0]=4 15521 B19R3.19268 c1ccc(cc1)COc2ccc3ccoc3c2 7a_100000089557_100000211182 [0,0,0,1,1,0|2,0,0]=4 15522 B19R3.19268 c1ccc(cc1)COc2ccc3occc3c2 34a_100000070125_100015291786 [0,0,0,1,1,0|2,0,0]=4 15523 B19R3.19268 c1ccc(cc1)COc2ccc3occc3c2 7a_100000070125_100000211182 [0,0,0,1,1,0|2,0,0]=4 15524 B19R3.19268 c1ccc(cc1)COc2ccc3sccc3c2 34a_100012180905_100015291786 [0,0,0,1,1,0|2,0,0]=4 15525 B19R3.19268 c1ccc(cc1)COc2ccc3sccc3c2 7a_100012180905_100000211182 [0,0,0,1,1,0|2,0,0]=4 15526 B19R3.62425 c1ccc2cc(ccc2c1)OCc3ccsc3 34a_100000185828_100011261437 [0,0,0,1,1,0|2,0,0]=4 15527 B19R3.62425 c1ccc2cc(ccc2c1)OCc3ccsc3 7a_100000185828_100011261437 [0,0,0,1,1,0|2,0,0]=4 15528 B21R3.240 O=c1cc(c(n[nH]1)c2ccccc2)c3ccccc3 271570a_100011218836_100009828137 [0,0,0,1,0,1|1,0,1]=4 15529 B21R3.2808 O=C(CCc1ccccc1)C2=CCc3c2cccc3 1458a_100000037392_100000765856 [0,0,0,1,0,1|1,0,0]=3 15530 B21R3.2808 O=C(CCc1ccccc1)C2C=Cc3c2cccc3 1458a_200009832160_100000765856 [0,0,0,1,0,1|1,0,0]=3 15531 B21R3.2808 O=C(CCc1ccccn1)C2=CCc3c2cccc3 1458a_100000037392_100015183660 [0,0,0,1,0,1|2,0,0]=4 15532 B21R3.2808 O=C(CCc1ccccn1)C2C=Cc3c2cccc3 1458a_200009832160_100015183660 [0,0,0,1,0,1|2,0,0]=4 15533 B21R3.2808 O=C(CCc1cccnc1)C2=CCc3c2cccc3 1458a_100000037392_200011713674 [0,0,0,1,0,1|2,0,0]=4 15534 B21R3.2808 O=C(CCc1cccnc1)C2C=Cc3c2cccc3 1458a_200009832160_200011713674 [0,0,0,1,0,1|2,0,0]=4 15535 B21R3.2808 O=C(CCc1ccncc1)C2=CCc3c2cccc3 1458a_100000037392_100000723409 [0,0,0,1,0,1|2,0,0]=4 15536 B21R3.2808 O=C(CCc1ccncc1)C2C=Cc3c2cccc3 1458a_200009832160_100000723409 [0,0,0,1,0,1|2,0,0]=4 15537 B21R3.2808 O=C(COc1ccccc1)c2c[nH]c3c2cccc3 7a_100000210340_100000183220 [0,0,0,1,0,1|2,0,0]=4 15538 B21R3.2808 O=C(COc1ccccc1)c2csc3c2cccc3 7a_100000210340_100000689783 [0,0,0,1,0,1|2,0,0]=4 15539 B21R3.2808 O=C(CSc1ccccc1)c2c[nH]c3c2cccc3 62a_100000719477_100000183220 [0,0,0,1,0,1|2,0,0]=4 15540 B21R3.2808 O=C(CSc1ccccc1)c2coc3c2cccc3 62a_100000233777_100000041952 [0,0,0,1,0,1|2,0,0]=4 15541 B21R3.2808 O=C(CSc1ccccc1)c2csc3c2cccc3 62a_100000689783_100000041952 [0,0,0,1,0,1|2,0,0]=4 15542 B21R3.2808 O=C(NCc1ccccc1)C2=CCc3c2cccc3 11a_100015324214_100000037392 [0,0,0,1,0,1|1,0,0]=3 15543 B21R3.2808 O=C(NCc1ccccc1)C2=CCc3c2cccc3 1626a_100015324214_100000037392 [0,0,0,1,0,1|1,0,0]=3 15544 B21R3.2808 O=C(NCc1ccccc1)C2=CCc3c2cccc3 240690a_100015324214_100000037392 [0,0,0,1,0,1|1,0,0]=3 15545 B21R3.2808 O=C(NCc1ccccc1)C2C=Cc3c2cccc3 1626a_100015324214_200009832160 [0,0,0,1,0,1|1,0,0]=3 15546 B21R3.2808 O=C(NCc1ccccc1)C2C=Cc3c2cccc3 240690a_100015324214_200009832160 [0,0,0,1,0,1|1,0,0]=3 15547 B21R3.2808 O=C(NCc1ccccc1)C2C=Cc3c2cccc3 527a_100015324214_200009832160 [0,0,0,1,0,1|1,0,0]=3 15548 B21R3.2808 O=C(NCc1ccccn1)C2=CCc3c2cccc3 11a_100000210449_100000037392 [0,0,0,1,0,1|2,0,0]=4 15549 B21R3.2808 O=C(NCc1ccccn1)C2=CCc3c2cccc3 1626a_100000210449_100000037392 [0,0,0,1,0,1|2,0,0]=4 15550 B21R3.2808 O=C(NCc1ccccn1)C2=CCc3c2cccc3 240690a_100000210449_100000037392 [0,0,0,1,0,1|2,0,0]=4 15551 B21R3.2808 O=C(NCc1ccccn1)C2C=Cc3c2cccc3 1626a_100000210449_200009832160 [0,0,0,1,0,1|2,0,0]=4 15552 B21R3.2808 O=C(NCc1ccccn1)C2C=Cc3c2cccc3 240690a_100000210449_200009832160 [0,0,0,1,0,1|2,0,0]=4 15553 B21R3.2808 O=C(NCc1ccccn1)C2C=Cc3c2cccc3 527a_100000210449_200009832160 [0,0,0,1,0,1|2,0,0]=4 15554 B21R3.2808 O=C(NCc1cccnc1)C2=CCc3c2cccc3 11a_100000210453_100000037392 [0,0,0,1,0,1|2,0,0]=4 15555 B21R3.2808 O=C(NCc1cccnc1)C2=CCc3c2cccc3 240690a_100000210453_100000037392 [0,0,0,1,0,1|2,0,0]=4 15556 B21R3.2808 O=C(NCc1cccnc1)C2C=Cc3c2cccc3 240690a_100000210453_200009832160 [0,0,0,1,0,1|2,0,0]=4 15557 B21R3.2808 O=C(NCc1cccnc1)C2C=Cc3c2cccc3 527a_100000210453_200009832160 [0,0,0,1,0,1|2,0,0]=4 15558 B21R3.2808 O=C(NCc1ccncc1)C2=CCc3c2cccc3 11a_100000210450_100000037392 [0,0,0,1,0,1|2,0,0]=4 15559 B21R3.2808 O=C(NCc1ccncc1)C2=CCc3c2cccc3 1626a_100000210450_100000037392 [0,0,0,1,0,1|2,0,0]=4 15560 B21R3.2808 O=C(NCc1ccncc1)C2=CCc3c2cccc3 240690a_100000210450_100000037392 [0,0,0,1,0,1|2,0,0]=4 15561 B21R3.2808 O=C(NCc1ccncc1)C2C=Cc3c2cccc3 1626a_100000210450_200009832160 [0,0,0,1,0,1|2,0,0]=4 15562 B21R3.2808 O=C(NCc1ccncc1)C2C=Cc3c2cccc3 240690a_100000210450_200009832160 [0,0,0,1,0,1|2,0,0]=4 15563 B21R3.2808 O=C(NCc1ccncc1)C2C=Cc3c2cccc3 527a_100000210450_200009832160 [0,0,0,1,0,1|2,0,0]=4 15564 B21R3.2808 O=C(NNc1ccccc1)C2=CCc3c2cccc3 22a_100015195140_100000037392 [0,0,0,1,0,1|2,0,0]=4 15565 B21R3.3123 C(=Cc1coc(n1)c2ccccc2)c3ccccc3 271570a_100102527694_100010163736 [0,0,0,1,0,1|1,0,1]=4 15566 B21R3.3123 C(=Cc1noc(n1)c2ccccc2)c3ccccc3 270196a_100000735103_100000185807 [0,0,0,1,0,1|1,0,1]=4 15567 B21R3.3123 C(=Cc1noc(n1)c2ccccc2)c3ccccc3 271570a_100102527694_200000701163 [0,0,0,1,0,1|1,0,1]=4 15568 B21R3.3123 c1ccc(cc1)CNc2nc(cs2)c3ccccc3 27a_100015324214_100011830410 [0,0,0,1,0,1|2,0,0]=4 15569 B21R3.3123 c1ccc(cc1)CNc2ncc(o2)c3ccccc3 27a_100015324214_100000729704 [0,0,0,1,0,1|1,0,1]=4 15570 B21R3.3123 c1ccc(cc1)CNc2ncc(s2)c3ccccc3 27a_100015324214_100000685549 [0,0,0,1,0,1|1,1,0]=4 15571 B21R3.3123 c1ccc(cc1)COn2cc(cn2)c3ccccc3 271570a_100011218836_200010232027 [0,0,0,1,0,1|2,0,0]=4 15572 B21R3.3123 c1ccc(cc1)CSc2c[nH]c(n2)c3ccccc3 62a_100000211182_200010210587 [0,0,0,1,0,1|1,1,0]=4 15573 B21R3.3123 c1ccc(cc1)CSc2c[nH]c(n2)c3ccccc3 62a_200010210587_100015291786 [0,0,0,1,0,1|1,1,0]=4 15574 B21R3.3123 c1ccc(cc1)CSc2ccc(s2)c3ccccc3 62a_100000211182_100009814279 [0,0,0,1,0,1|0,2,0]=4 15575 B21R3.3123 c1ccc(cc1)CSc2ccc(s2)c3ccccc3 62a_100009814279_100015291786 [0,0,0,1,0,1|0,2,0]=4 15576 B21R3.3123 c1ccc(cc1)CSc2cnc(o2)c3ccccc3 62a_100000211182_100009814072 [0,0,0,1,0,1|0,1,1]=4 15577 B21R3.3123 c1ccc(cc1)CSc2cnc(s2)c3ccccc3 62a_100000211182_100000726391 [0,0,0,1,0,1|0,2,0]=4 15578 B21R3.3123 c1ccc(cc1)CSc2cnc(s2)c3ccccc3 62a_100000726391_100015291786 [0,0,0,1,0,1|0,2,0]=4 15579 B21R3.3123 c1ccc(cc1)CSc2coc(n2)c3ccccc3 62a_100000211182_100010163736 [0,0,0,1,0,1|1,1,0]=4 15580 B21R3.3123 c1ccc(cc1)CSc2coc(n2)c3ccccc3 62a_100010163736_100015291786 [0,0,0,1,0,1|1,1,0]=4 15581 B21R3.3123 c1ccc(cc1)CSc2nc(cs2)c3ccccc3 62a_100000211182_100011830410 [0,0,0,1,0,1|1,1,0]=4 15582 B21R3.3123 c1ccc(cc1)CSc2nc(cs2)c3ccccc3 62a_100011830410_100015291786 [0,0,0,1,0,1|1,1,0]=4 15583 B21R3.3123 c1ccc(cc1)CSc2ncc(o2)c3ccccc3 62a_100000211182_100000729704 [0,0,0,1,0,1|0,1,1]=4 15584 B21R3.3123 c1ccc(cc1)CSc2ncc(s2)c3ccccc3 62a_100000211182_100000685549 [0,0,0,1,0,1|0,2,0]=4 15585 B21R3.3123 c1ccc(cc1)CSc2ncc(s2)c3ccccc3 62a_100000685549_100015291786 [0,0,0,1,0,1|0,2,0]=4 15586 B21R3.22167 Brc1ccc2ccccc2c1CNc3ccccc3 207a_100000106764_100010090029 [0,0,0,1,0,1|2,0,0]=4 15587 B21R3.22167 Brc1ccc2ccccc2c1CNc3ccccc3 270302a_100000106764_100010090029 [0,0,0,1,0,1|2,0,0]=4 15588 B21R3.22167 Brc1ccc2ccccc2c1NCc3ccccc3 34a_100009817101_100015291786 [0,0,0,1,0,1|2,0,0]=4 15589 B21R3.22167 Brc1ccc2ccccc2c1OCc3ccccc3 34a_100009996032_100015291786 [0,0,0,1,0,1|1,0,0]=3 15590 B21R3.22167 Brc1ccc2ccccc2c1OCc3ccccc3 7a_100009996032_100000211182 [0,0,0,1,0,1|1,0,0]=3 15591 B21R3.22167 Brc1ccc2ccccc2c1OCc3ccccn3 34a_100009996032_100000721315 [0,0,0,1,0,1|2,0,0]=4 15592 B21R3.22167 Brc1ccc2ccccc2c1OCc3ccccn3 7a_100009996032_100000721315 [0,0,0,1,0,1|2,0,0]=4 15593 B21R3.22167 Brc1ccc2ccccc2c1OCc3cccnc3 34a_100009996032_100000733263 [0,0,0,1,0,1|2,0,0]=4 15594 B21R3.22167 Brc1ccc2ccccc2c1OCc3cccnc3 7a_100009996032_100000741622 [0,0,0,1,0,1|2,0,0]=4 15595 B21R3.22167 Brc1ccc2ccccc2c1OCc3ccncc3 7a_100009996032_100015193705 [0,0,0,1,0,1|2,0,0]=4 15596 B21R3.22167 Brc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100010090040 [0,0,0,1,0,1|1,1,0]=4 15597 B21R3.22167 Brc1ccc2ccccc2c1SCc3ccccc3 62a_100010090040_100015291786 [0,0,0,1,0,1|1,1,0]=4 15598 B21R3.22167 Brc1ccc2cccnc2c1OCc3ccccc3 34a_100009816563_100015291786 [0,0,0,1,0,1|2,0,0]=4 15599 B21R3.22167 Cc1ccc2ccccc2c1CNc3ccccc3 207a_100000106764_100011361466 [0,0,0,1,0,1|2,0,0]=4 15600 B21R3.22167 Cc1ccc2ccccc2c1CNc3ccccc3 270302a_100000106764_100011361466 [0,0,0,1,0,1|2,0,0]=4 15601 B21R3.22167 Cc1ccc2ccccc2c1CNc3ccccc3 34a_100000106764_100000689653 [0,0,0,1,0,1|2,0,0]=4 15602 B21R3.22167 Cc1ccc2ccccc2c1COc3ccccc3 34a_100000210340_100000689653 [0,0,0,1,0,1|2,0,0]=4 15603 B21R3.22167 Cc1ccc2ccccc2c1COc3ccccc3 7a_100000210340_100000689653 [0,0,0,1,0,1|2,0,0]=4 15604 B21R3.22167 Cc1ccc2ccccc2c1CSc3ccccc3 62a_100000689653_100000041952 [0,0,0,1,0,1|2,0,0]=4 15605 B21R3.22167 Cc1ccc2ccccc2c1CSc3ccccc3 62a_100000719477_100000689653 [0,0,0,1,0,1|2,0,0]=4 15606 B21R3.22167 Cc1ccc2ccccc2c1NCc3ccccc3 207a_100000688109_100015611070 [0,0,0,1,0,1|2,0,0]=4 15607 B21R3.22167 Cc1ccc2ccccc2c1NCc3ccccc3 34a_100000688109_100015291786 [0,0,0,1,0,1|2,0,0]=4 15608 B21R3.22167 Cc1ccc2ccccc2c1OCc3ccccc3 34a_100000039261_100015291786 [0,0,0,1,0,1|1,0,0]=3 15609 B21R3.22167 Cc1ccc2ccccc2c1OCc3ccccc3 7a_100000039261_100000211182 [0,0,0,1,0,1|1,0,0]=3 15610 B21R3.22167 Cc1ccc2ccccc2c1OCc3ccccn3 34a_100000039261_100000721315 [0,0,0,1,0,1|2,0,0]=4 15611 B21R3.22167 Cc1ccc2ccccc2c1OCc3ccccn3 7a_100000039261_100000721315 [0,0,0,1,0,1|2,0,0]=4 15612 B21R3.22167 Cc1ccc2ccccc2c1OCc3cccnc3 34a_100000039261_100000733263 [0,0,0,1,0,1|2,0,0]=4 15613 B21R3.22167 Cc1ccc2ccccc2c1OCc3cccnc3 7a_100000039261_100000741622 [0,0,0,1,0,1|2,0,0]=4 15614 B21R3.22167 Cc1ccc2ccccc2c1OCc3ccncc3 7a_100000039261_100015193705 [0,0,0,1,0,1|2,0,0]=4 15615 B21R3.22167 Cc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100000759710 [0,0,0,1,0,1|1,1,0]=4 15616 B21R3.22167 Cc1ccc2ccccc2c1SCc3ccccc3 62a_100000759710_100015291786 [0,0,0,1,0,1|1,1,0]=4 15617 B21R3.22167 Clc1ccc2ccccc2c1NCc3ccccc3 34a_200009860907_100015291786 [0,0,0,1,0,1|2,0,0]=4 15618 B21R3.22167 Clc1ccc2cccnc2c1OCc3ccccc3 34a_100000700379_100015291786 [0,0,0,1,0,1|2,0,0]=4 15619 B21R3.22167 Clc1ccc2cccnc2c1OCc3ccccc3 7a_100000700379_100000211182 [0,0,0,1,0,1|2,0,0]=4 15620 B21R3.22167 Nc1ccc2ccccc2c1OCc3ccccc3 34a_100000007060_100015291786 [0,0,0,1,0,1|1,0,0]=3 15621 B21R3.22167 Nc1ccc2ccccc2c1OCc3ccccn3 34a_100000007060_100000721315 [0,0,0,1,0,1|2,0,0]=4 15622 B21R3.22167 Nc1ccc2ccccc2c1OCc3cccnc3 34a_100000007060_100000733263 [0,0,0,1,0,1|2,0,0]=4 15623 B21R3.22167 Nc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100000705303 [0,0,0,1,0,1|1,1,0]=4 15624 B21R3.22167 Nc1ccc2ccccc2c1SCc3ccccc3 62a_100000705303_100015291786 [0,0,0,1,0,1|1,1,0]=4 15625 B21R3.22167 Oc1ccc2ccccc2c1NCc3ccccc3 34a_100000007056_100015291786 [0,0,0,1,0,1|1,0,1]=4 15626 B21R3.22167 Oc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100000183829 [0,0,0,1,0,1|0,1,1]=4 15627 B21R3.47750 C(=Cc1ccc2ccccc2c1)Cc3ccccc3 271570a_200016263579_100000233703 [0,0,0,1,0,1|2,0,0]=4 15628 B21R3.47750 C(=Cc1ccc2ccccc2n1)Cc3ccccc3 271570a_200016263579_100011291633 [0,0,0,1,0,1|2,0,0]=4 15629 B21R3.47750 c1ccc(cc1)CCNc2ccc3ccccc3c2 34a_100000211940_100000765856 [0,0,0,1,0,1|2,0,0]=4 15630 B21R3.47750 c1ccc(cc1)CCNc2ccc3ccccc3c2 7a_100000211940_100000765856 [0,0,0,1,0,1|2,0,0]=4 15631 B21R3.47750 c1ccc(cc1)CCNc2ccc3ccccc3n2 27a_100000106460_100011291633 [0,0,0,1,0,1|2,0,0]=4 15632 B21R3.47750 c1ccc(cc1)CCOc2ccc3ccccc3c2 34a_100000185828_100000765856 [0,0,0,1,0,1|1,0,0]=3 15633 B21R3.47750 c1ccc(cc1)CCOc2ccc3ccccc3c2 7a_100000185828_100000765856 [0,0,0,1,0,1|1,0,0]=3 15634 B21R3.47750 c1ccc(cc1)CCOc2ccc3cccnc3c2 34a_100011216045_100000765856 [0,0,0,1,0,1|2,0,0]=4 15635 B21R3.47750 c1ccc(cc1)CCOc2ccc3ccncc3c2 7a_100000752006_100000765856 [0,0,0,1,0,1|2,0,0]=4 15636 B21R3.47750 c1ccc(cc1)CCOc2ccc3cnccc3c2 34a_100000046372_100000765856 [0,0,0,1,0,1|2,0,0]=4 15637 B21R3.47750 c1ccc(cc1)CCOc2ccc3cnccc3c2 7a_100000046372_100000765856 [0,0,0,1,0,1|2,0,0]=4 15638 B21R3.47750 c1ccc(cc1)CCOc2ccc3ncccc3c2 34a_100011215586_100000765856 [0,0,0,1,0,1|2,0,0]=4 15639 B21R3.47750 c1ccc(cc1)CCOc2ccc3ncccc3c2 7a_100011215586_100000765856 [0,0,0,1,0,1|2,0,0]=4 15640 B21R3.47750 c1ccc(cc1)CCOc2cnc3ccccc3c2 34a_100011934006_100000765856 [0,0,0,1,0,1|2,0,0]=4 15641 B21R3.47750 c1ccc(cc1)CCOc2cnc3ccccc3c2 7a_100011934006_100000765856 [0,0,0,1,0,1|2,0,0]=4 15642 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccccc3c2 62a_100000765856_100000233703 [0,0,0,1,0,1|1,1,0]=4 15643 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100000765856_100011291633 [0,0,0,1,0,1|1,1,0]=4 15644 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011291633_100011218657 [0,0,0,1,0,1|1,1,0]=4 15645 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 207a_100000739491_100015611070 [0,0,0,1,0,1|2,0,0]=4 15646 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 207a_100015324214_100000211584 [0,0,0,1,0,1|2,0,0]=4 15647 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 2230a_100000739491_100015291786 [0,0,0,1,0,1|2,0,0]=4 15648 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 2230a_100015324214_100011216711 [0,0,0,1,0,1|2,0,0]=4 15649 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 270004a_100000739491_100015611070 [0,0,0,1,0,1|2,0,0]=4 15650 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 270004a_100015324214_100000211584 [0,0,0,1,0,1|2,0,0]=4 15651 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 34a_100000739491_100015291786 [0,0,0,1,0,1|2,0,0]=4 15652 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 34a_100015324214_100011216711 [0,0,0,1,0,1|2,0,0]=4 15653 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3n2 207a_100015324214_100000759686 [0,0,0,1,0,1|2,0,0]=4 15654 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3n2 2230a_100015324214_100000737579 [0,0,0,1,0,1|2,0,0]=4 15655 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3n2 270004a_100015324214_100000759686 [0,0,0,1,0,1|2,0,0]=4 15656 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3n2 34a_100015324214_100000737579 [0,0,0,1,0,1|2,0,0]=4 15657 B21R3.47750 c1ccc(cc1)COCc2cc3ccccc3cn2 34a_100000210790_100009869231 [0,0,0,1,0,1|2,0,0]=4 15658 B21R3.47750 c1ccc(cc1)COCc2cc3ccccc3cn2 7a_100000210790_100009869231 [0,0,0,1,0,1|2,0,0]=4 15659 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3c2 34a_100000210790_100011216711 [0,0,0,1,0,1|1,0,0]=3 15660 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3c2 34a_100011215330_100015291786 [0,0,0,1,0,1|1,0,0]=3 15661 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3c2 7a_100000210790_100011216711 [0,0,0,1,0,1|1,0,0]=3 15662 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3c2 7a_100011215330_100000211182 [0,0,0,1,0,1|1,0,0]=3 15663 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3n2 34a_100000210790_100000737579 [0,0,0,1,0,1|1,0,0]=3 15664 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3n2 7a_100000210790_100000737579 [0,0,0,1,0,1|1,0,0]=3 15665 B21R3.47750 c1ccc(cc1)COCc2ccc3cnccc3c2 34a_100000210790_100020605334 [0,0,0,1,0,1|2,0,0]=4 15666 B21R3.47750 c1ccc(cc1)COCc2ccc3cnccc3c2 7a_100000210790_100020605334 [0,0,0,1,0,1|2,0,0]=4 15667 B21R3.47750 c1ccc(cc1)COCc2ccc3ncccc3c2 34a_100000210790_100000703657 [0,0,0,1,0,1|2,0,0]=4 15668 B21R3.47750 c1ccc(cc1)COCc2ccc3ncccc3c2 34a_100011315636_100015291786 [0,0,0,1,0,1|2,0,0]=4 15669 B21R3.47750 c1ccc(cc1)COCc2ccc3ncccc3c2 7a_100000210790_100000703657 [0,0,0,1,0,1|2,0,0]=4 15670 B21R3.47750 c1ccc(cc1)COCc2cnc3ccccc3c2 34a_100011258773_100015291786 [0,0,0,1,0,1|2,0,0]=4 15671 B21R3.47750 c1ccc(cc1)COCc2cnc3ccccc3n2 7a_100000210790_200000751123 [0,0,0,1,0,1|2,0,0]=4 15672 B21R3.47750 c1ccc(cc1)COCc2ncc3ccccc3n2 34a_100000210790_100009868571 [0,0,0,1,0,1|2,0,0]=4 15673 B21R3.47750 c1ccc(cc1)COCc2ncc3ccccc3n2 7a_100000210790_100009868571 [0,0,0,1,0,1|2,0,0]=4 15674 B21R3.47750 c1ccc(cc1)CSCc2ccc3ccccc3c2 62a_100000211182_100011216711 [0,0,0,1,0,1|1,1,0]=4 15675 B21R3.47750 c1ccc(cc1)CSCc2ccc3ccccc3c2 62a_100011216711_100015291786 [0,0,0,1,0,1|1,1,0]=4 15676 B21R3.47750 c1ccc(cc1)CSCc2ccc3ccccc3n2 62a_100000211182_100000737579 [0,0,0,1,0,1|1,1,0]=4 15677 B21R3.47750 c1ccc(cc1)CSCc2ccc3ccccc3n2 62a_100000737579_100015291786 [0,0,0,1,0,1|1,1,0]=4 15678 B21R3.47750 c1ccc(cc1)SCSc2ccc3ccccc3c2 62a_100011218342_100000233703 [0,0,0,1,0,1|1,1,0]=4 15679 B21R3.47750 c1ccc(cc1)SCSc2ccc3ccccc3n2 62a_100011218342_100011291633 [0,0,0,1,0,1|1,1,0]=4 15680 B21R3.47750 c1ccc(cc1)SCSc2ccc3ccccc3n2 62a_100011291633_100011218342 [0,0,0,1,0,1|1,1,0]=4 15681 B21R3.47750 c1ccc(nc1)CCOc2ccc3ccccc3c2 7a_100000185828_100015183660 [0,0,0,1,0,1|2,0,0]=4 15682 B21R3.47750 c1ccc(nc1)COCc2ccc3ccccc3c2 34a_100011215330_100000721315 [0,0,0,1,0,1|2,0,0]=4 15683 B21R3.47750 c1ccc(nc1)COCc2ccc3ccccc3c2 7a_100011215330_100000721315 [0,0,0,1,0,1|2,0,0]=4 15684 B21R3.47750 c1ccc2cc(ccc2c1)COCc3ccncc3 7a_100011215330_100015193705 [0,0,0,1,0,1|2,0,0]=4 15685 B21R3.47750 c1ccc2cc(ccc2c1)OCCc3ccncc3 7a_100000185828_100000723409 [0,0,0,1,0,1|2,0,0]=4 15686 B21R3.47750 c1cncc(c1)CCOc2ccc3ccccc3c2 7a_100000185828_200011713674 [0,0,0,1,0,1|2,0,0]=4 15687 B21R3.47750 c1cncc(c1)COCc2ccc3ccccc3c2 34a_100011215330_100000733263 [0,0,0,1,0,1|2,0,0]=4 15688 B21R3.47750 c1cncc(c1)COCc2ccc3ccccc3c2 7a_100011215330_100000741622 [0,0,0,1,0,1|2,0,0]=4 15689 B21R3.520292 O=C(C/C=C/c1ccccc1)C2Cc3c2cccc3 1458a_200000238571_100016265936 [0,0,0,1,0,1|1,0,0]=3 15690 B21R3.30927 Brc1ccc(cc1)CNc2ccc3ccccc3c2 207a_100000211940_100000186029 [0,1,0,1,0,0|2,0,0]=4 15691 B21R3.30927 Brc1ccc(cc1)CNc2ccc3ccccc3c2 270302a_100000211940_100000186029 [0,1,0,1,0,0|2,0,0]=4 15692 B21R3.30927 Brc1ccc(cc1)CNc2ccc3ccccc3c2 34a_100000211940_100000189115 [0,1,0,1,0,0|2,0,0]=4 15693 B21R3.30927 Brc1ccc(cc1)CNc2ccc3ccccc3c2 7a_100000211940_100011217064 [0,1,0,1,0,0|2,0,0]=4 15694 B21R3.30927 Brc1ccc(cc1)CNc2ccc3ccccc3n2 27a_100000174875_100011291633 [0,1,0,1,0,0|2,0,0]=4 15695 B21R3.30927 Brc1ccc(cc1)COc2ccc3ccccc3c2 34a_100000185828_100000189115 [0,1,0,1,0,0|1,0,0]=3 15696 B21R3.30927 Brc1ccc(cc1)COc2ccc3ccccc3c2 7a_100000185828_100011217064 [0,1,0,1,0,0|1,0,0]=3 15697 B21R3.30927 Brc1ccc(cc1)COc2ccc3cccnc3c2 34a_100011216045_100000189115 [0,1,0,1,0,0|2,0,0]=4 15698 B21R3.30927 Brc1ccc(cc1)COc2ccc3ccncc3c2 7a_100000752006_100011217064 [0,1,0,1,0,0|2,0,0]=4 15699 B21R3.30927 Brc1ccc(cc1)COc2ccc3cnccc3c2 34a_100000046372_100000189115 [0,1,0,1,0,0|2,0,0]=4 15700 B21R3.30927 Brc1ccc(cc1)COc2ccc3cnccc3c2 7a_100000046372_100011217064 [0,1,0,1,0,0|2,0,0]=4 15701 B21R3.30927 Brc1ccc(cc1)COc2ccc3ncccc3c2 34a_100011215586_100000189115 [0,1,0,1,0,0|2,0,0]=4 15702 B21R3.30927 Brc1ccc(cc1)COc2ccc3ncccc3c2 7a_100011215586_100011217064 [0,1,0,1,0,0|2,0,0]=4 15703 B21R3.30927 Brc1ccc(cc1)COc2cnc3ccccc3c2 34a_100011934006_100000189115 [0,1,0,1,0,0|2,0,0]=4 15704 B21R3.30927 Brc1ccc(cc1)COc2cnc3ccccc3c2 7a_100011934006_100011217064 [0,1,0,1,0,0|2,0,0]=4 15705 B21R3.30927 Brc1ccc(cc1)CSc2ccc3ccccc3c2 62a_100000189115_100000233703 [0,1,0,1,0,0|1,1,0]=4 15706 B21R3.30927 Brc1ccc(cc1)CSc2ccc3ccccc3n2 62a_100000189115_100011291633 [0,1,0,1,0,0|1,1,0]=4 15707 B21R3.30927 Brc1ccc(cc1)CSc2ccc3ccccc3n2 62a_100011291633_100000189115 [0,1,0,1,0,0|1,1,0]=4 15708 B21R3.30927 Brc1ccc(cn1)COc2ccc3ccccc3c2 34a_100000185828_100009831999 [0,1,0,1,0,0|2,0,0]=4 15709 B21R3.30927 Brc1ccc(cn1)COc2ccc3ccccc3c2 7a_100000185828_100009831999 [0,1,0,1,0,0|2,0,0]=4 15710 B21R3.30927 Brc1ccc(nc1)COc2ccc3ccccc3c2 34a_100000185828_100000702658 [0,1,0,1,0,0|2,0,0]=4 15711 B21R3.30927 Brc1ccc(nc1)COc2ccc3ccccc3c2 7a_100000185828_100000702658 [0,1,0,1,0,0|2,0,0]=4 15712 B21R3.30927 Cc1ccc(cc1)CNc2ccc3ccccc3c2 207a_100000211940_100000211033 [0,1,0,1,0,0|2,0,0]=4 15713 B21R3.30927 Cc1ccc(cc1)CNc2ccc3ccccc3c2 270302a_100000211940_100000211033 [0,1,0,1,0,0|2,0,0]=4 15714 B21R3.30927 Cc1ccc(cc1)CNc2ccc3ccccc3c2 34a_100000211940_100000210814 [0,1,0,1,0,0|2,0,0]=4 15715 B21R3.30927 Cc1ccc(cc1)CNc2ccc3ccccc3c2 7a_100000211940_100000210814 [0,1,0,1,0,0|2,0,0]=4 15716 B21R3.30927 Cc1ccc(cc1)CNc2ccc3ccccc3n2 27a_100000174908_100011291633 [0,1,0,1,0,0|2,0,0]=4 15717 B21R3.30927 Cc1ccc(cc1)COc2ccc3ccccc3c2 34a_100000185828_100000210814 [0,1,0,1,0,0|1,0,0]=3 15718 B21R3.30927 Cc1ccc(cc1)COc2ccc3ccccc3c2 7a_100000185828_100000210814 [0,1,0,1,0,0|1,0,0]=3 15719 B21R3.30927 Cc1ccc(cc1)COc2ccc3cccnc3c2 34a_100011216045_100000210814 [0,1,0,1,0,0|2,0,0]=4 15720 B21R3.30927 Cc1ccc(cc1)COc2ccc3ccncc3c2 7a_100000752006_100000210814 [0,1,0,1,0,0|2,0,0]=4 15721 B21R3.30927 Cc1ccc(cc1)COc2ccc3cnccc3c2 34a_100000046372_100000210814 [0,1,0,1,0,0|2,0,0]=4 15722 B21R3.30927 Cc1ccc(cc1)COc2ccc3cnccc3c2 7a_100000046372_100000210814 [0,1,0,1,0,0|2,0,0]=4 15723 B21R3.30927 Cc1ccc(cc1)COc2ccc3ncccc3c2 34a_100011215586_100000210814 [0,1,0,1,0,0|2,0,0]=4 15724 B21R3.30927 Cc1ccc(cc1)COc2ccc3ncccc3c2 7a_100011215586_100000210814 [0,1,0,1,0,0|2,0,0]=4 15725 B21R3.30927 Cc1ccc(cc1)COc2cnc3ccccc3c2 34a_100011934006_100000210814 [0,1,0,1,0,0|2,0,0]=4 15726 B21R3.30927 Cc1ccc(cc1)COc2cnc3ccccc3c2 7a_100011934006_100000210814 [0,1,0,1,0,0|2,0,0]=4 15727 B21R3.30927 Cc1ccc(cc1)CSc2ccc3ccccc3c2 62a_100000210814_100000233703 [0,1,0,1,0,0|1,1,0]=4 15728 B21R3.30927 Cc1ccc(cc1)CSc2ccc3ccccc3n2 62a_100000210814_100011291633 [0,1,0,1,0,0|1,1,0]=4 15729 B21R3.30927 Cc1ccc(cc1)CSc2ccc3ccccc3n2 62a_100011291633_100000210814 [0,1,0,1,0,0|1,1,0]=4 15730 B21R3.30927 Cc1ccc(cn1)COc2ccc3ccccc3c2 34a_100000185828_100016987292 [0,1,0,1,0,0|2,0,0]=4 15731 B21R3.30927 Cc1ccc(cn1)COc2ccc3ccccc3c2 7a_100000185828_100016987292 [0,1,0,1,0,0|2,0,0]=4 15732 B21R3.30927 Cc1ccc(nc1)COc2ccc3ccccc3c2 34a_100000185828_100000691093 [0,1,0,1,0,0|2,0,0]=4 15733 B21R3.30927 Cc1ccc(nc1)COc2ccc3ccccc3c2 7a_100000185828_100000691093 [0,1,0,1,0,0|2,0,0]=4 15734 B21R3.30927 Clc1ccc(cc1)CNc2ccc3ccccc3c2 207a_100000211940_100000189385 [0,1,0,1,0,0|2,0,0]=4 15735 B21R3.30927 Clc1ccc(cc1)CNc2ccc3ccccc3c2 270302a_100000211940_100000189385 [0,1,0,1,0,0|2,0,0]=4 15736 B21R3.30927 Clc1ccc(cc1)CNc2ccc3ccccc3c2 34a_100000211940_100000694040 [0,1,0,1,0,0|2,0,0]=4 15737 B21R3.30927 Clc1ccc(cc1)CNc2ccc3ccccc3c2 7a_100000211940_100000187161 [0,1,0,1,0,0|2,0,0]=4 15738 B21R3.30927 Clc1ccc(cc1)CNc2ccc3ccccc3n2 27a_100000174871_100011291633 [0,1,0,1,0,0|2,0,0]=4 15739 B21R3.30927 Clc1ccc(cc1)COc2ccc3ccccc3c2 34a_100000185828_100000694040 [0,1,0,1,0,0|1,0,0]=3 15740 B21R3.30927 Clc1ccc(cc1)COc2ccc3ccccc3c2 7a_100000185828_100000187161 [0,1,0,1,0,0|1,0,0]=3 15741 B21R3.30927 Clc1ccc(cc1)COc2ccc3cccnc3c2 34a_100011216045_100000694040 [0,1,0,1,0,0|2,0,0]=4 15742 B21R3.30927 Clc1ccc(cc1)COc2ccc3ccncc3c2 7a_100000752006_100000187161 [0,1,0,1,0,0|2,0,0]=4 15743 B21R3.30927 Clc1ccc(cc1)COc2ccc3cnccc3c2 34a_100000046372_100000694040 [0,1,0,1,0,0|2,0,0]=4 15744 B21R3.30927 Clc1ccc(cc1)COc2ccc3cnccc3c2 7a_100000046372_100000187161 [0,1,0,1,0,0|2,0,0]=4 15745 B21R3.30927 Clc1ccc(cc1)COc2ccc3ncccc3c2 34a_100011215586_100000694040 [0,1,0,1,0,0|2,0,0]=4 15746 B21R3.30927 Clc1ccc(cc1)COc2ccc3ncccc3c2 7a_100011215586_100000187161 [0,1,0,1,0,0|2,0,0]=4 15747 B21R3.30927 Clc1ccc(cc1)COc2cnc3ccccc3c2 34a_100011934006_100000694040 [0,1,0,1,0,0|2,0,0]=4 15748 B21R3.30927 Clc1ccc(cc1)COc2cnc3ccccc3c2 7a_100011934006_100000187161 [0,1,0,1,0,0|2,0,0]=4 15749 B21R3.30927 Clc1ccc(cc1)CSc2ccc3ccccc3c2 62a_100000187161_100000233703 [0,1,0,1,0,0|1,1,0]=4 15750 B21R3.30927 Clc1ccc(cc1)CSc2ccc3ccccc3n2 62a_100000187161_100011291633 [0,1,0,1,0,0|1,1,0]=4 15751 B21R3.30927 Clc1ccc(cc1)CSc2ccc3ccccc3n2 62a_100011291633_100000187161 [0,1,0,1,0,0|1,1,0]=4 15752 B21R3.30927 Clc1ccc(cn1)COc2ccc3ccccc3c2 34a_100000185828_100000735431 [0,1,0,1,0,0|2,0,0]=4 15753 B21R3.30927 Clc1ccc(cn1)COc2ccc3ccccc3c2 7a_100000185828_100000735431 [0,1,0,1,0,0|2,0,0]=4 15754 B21R3.30927 Clc1ccc(nc1)COc2ccc3ccccc3c2 34a_100000185828_100012066911 [0,1,0,1,0,0|2,0,0]=4 15755 B21R3.30927 Clc1ccc(nc1)COc2ccc3ccccc3c2 7a_100000185828_100012066911 [0,1,0,1,0,0|2,0,0]=4 15756 B21R3.30927 Fc1ccc(cc1)CNc2ccc3ccccc3c2 207a_100000211940_100000210084 [0,1,0,1,0,0|2,0,0]=4 15757 B21R3.30927 Fc1ccc(cc1)CNc2ccc3ccccc3c2 270302a_100000211940_100000210084 [0,1,0,1,0,0|2,0,0]=4 15758 B21R3.30927 Fc1ccc(cc1)CNc2ccc3ccccc3c2 34a_100000211940_100000198546 [0,1,0,1,0,0|2,0,0]=4 15759 B21R3.30927 Fc1ccc(cc1)CNc2ccc3ccccc3c2 7a_100000211940_100000198546 [0,1,0,1,0,0|2,0,0]=4 15760 B21R3.30927 Fc1ccc(cc1)CNc2ccc3ccccc3n2 27a_100000174882_100011291633 [0,1,0,1,0,0|2,0,0]=4 15761 B21R3.30927 Fc1ccc(cc1)COc2ccc3ccccc3c2 34a_100000185828_100000198546 [0,1,0,1,0,0|1,0,0]=3 15762 B21R3.30927 Fc1ccc(cc1)COc2ccc3ccccc3c2 7a_100000185828_100000198546 [0,1,0,1,0,0|1,0,0]=3 15763 B21R3.30927 Fc1ccc(cc1)COc2ccc3cccnc3c2 34a_100011216045_100000198546 [0,1,0,1,0,0|2,0,0]=4 15764 B21R3.30927 Fc1ccc(cc1)COc2ccc3ccncc3c2 7a_100000752006_100000198546 [0,1,0,1,0,0|2,0,0]=4 15765 B21R3.30927 Fc1ccc(cc1)COc2ccc3cnccc3c2 34a_100000046372_100000198546 [0,1,0,1,0,0|2,0,0]=4 15766 B21R3.30927 Fc1ccc(cc1)COc2ccc3cnccc3c2 7a_100000046372_100000198546 [0,1,0,1,0,0|2,0,0]=4 15767 B21R3.30927 Fc1ccc(cc1)COc2ccc3ncccc3c2 34a_100011215586_100000198546 [0,1,0,1,0,0|2,0,0]=4 15768 B21R3.30927 Fc1ccc(cc1)COc2ccc3ncccc3c2 7a_100011215586_100000198546 [0,1,0,1,0,0|2,0,0]=4 15769 B21R3.30927 Fc1ccc(cc1)COc2cnc3ccccc3c2 34a_100011934006_100000198546 [0,1,0,1,0,0|2,0,0]=4 15770 B21R3.30927 Fc1ccc(cc1)COc2cnc3ccccc3c2 7a_100011934006_100000198546 [0,1,0,1,0,0|2,0,0]=4 15771 B21R3.30927 Fc1ccc(cc1)CSc2ccc3ccccc3c2 62a_100000198546_100000233703 [0,1,0,1,0,0|1,1,0]=4 15772 B21R3.30927 Fc1ccc(cc1)CSc2ccc3ccccc3n2 62a_100000198546_100011291633 [0,1,0,1,0,0|1,1,0]=4 15773 B21R3.30927 Fc1ccc(cc1)CSc2ccc3ccccc3n2 62a_100011291633_100000187164 [0,1,0,1,0,0|1,1,0]=4 15774 B21R3.30927 Fc1ccc(cn1)COc2ccc3ccccc3c2 34a_100000185828_100000099788 [0,1,0,1,0,0|2,0,0]=4 15775 B21R3.30927 Fc1ccc(cn1)COc2ccc3ccccc3c2 7a_100000185828_100009820150 [0,1,0,1,0,0|2,0,0]=4 15776 B21R3.30927 Fc1ccc(nc1)COc2ccc3ccccc3c2 34a_100000185828_100000703193 [0,1,0,1,0,0|2,0,0]=4 15777 B21R3.30927 Fc1ccc(nc1)COc2ccc3ccccc3c2 7a_100000185828_100000703193 [0,1,0,1,0,0|2,0,0]=4 15778 B21R3.30927 Ic1ccc(cc1)CNc2ccc3ccccc3c2 207a_100000211940_100000188517 [0,1,0,1,0,0|2,0,0]=4 15779 B21R3.30927 Ic1ccc(cc1)CNc2ccc3ccccc3c2 270302a_100000211940_100000188517 [0,1,0,1,0,0|2,0,0]=4 15780 B21R3.30927 Ic1ccc(cc1)CNc2ccc3ccccc3c2 34a_100000211940_100000189116 [0,1,0,1,0,0|2,0,0]=4 15781 B21R3.30927 Ic1ccc(cc1)CNc2ccc3ccccc3c2 7a_100000211940_100000189116 [0,1,0,1,0,0|2,0,0]=4 15782 B21R3.30927 Ic1ccc(cc1)CNc2ccc3ccccc3n2 27a_100016989417_100011291633 [0,1,0,1,0,0|2,0,0]=4 15783 B21R3.30927 Ic1ccc(cc1)COc2ccc3ccccc3c2 34a_100000185828_100000189116 [0,1,0,1,0,0|1,0,0]=3 15784 B21R3.30927 Ic1ccc(cc1)COc2ccc3ccccc3c2 7a_100000185828_100000189116 [0,1,0,1,0,0|1,0,0]=3 15785 B21R3.30927 Ic1ccc(cc1)COc2ccc3cccnc3c2 34a_100011216045_100000189116 [0,1,0,1,0,0|2,0,0]=4 15786 B21R3.30927 Ic1ccc(cc1)COc2ccc3ccncc3c2 7a_100000752006_100000189116 [0,1,0,1,0,0|2,0,0]=4 15787 B21R3.30927 Ic1ccc(cc1)COc2ccc3cnccc3c2 34a_100000046372_100000189116 [0,1,0,1,0,0|2,0,0]=4 15788 B21R3.30927 Ic1ccc(cc1)COc2ccc3cnccc3c2 7a_100000046372_100000189116 [0,1,0,1,0,0|2,0,0]=4 15789 B21R3.30927 Ic1ccc(cc1)COc2ccc3ncccc3c2 34a_100011215586_100000189116 [0,1,0,1,0,0|2,0,0]=4 15790 B21R3.30927 Ic1ccc(cc1)COc2ccc3ncccc3c2 7a_100011215586_100000189116 [0,1,0,1,0,0|2,0,0]=4 15791 B21R3.30927 Ic1ccc(cc1)COc2cnc3ccccc3c2 34a_100011934006_100000189116 [0,1,0,1,0,0|2,0,0]=4 15792 B21R3.30927 Ic1ccc(cc1)COc2cnc3ccccc3c2 7a_100011934006_100000189116 [0,1,0,1,0,0|2,0,0]=4 15793 B21R3.30927 Ic1ccc(cc1)CSc2ccc3ccccc3c2 62a_100000189116_100000233703 [0,1,0,1,0,0|1,1,0]=4 15794 B21R3.30927 Ic1ccc(cc1)CSc2ccc3ccccc3n2 62a_100000189116_100011291633 [0,1,0,1,0,0|1,1,0]=4 15795 B21R3.30927 Ic1ccc(cc1)CSc2ccc3ccccc3n2 62a_100011291633_100000189116 [0,1,0,1,0,0|1,1,0]=4 15796 B21R3.30927 Oc1ccc(cc1)CNc2ccc3ccccc3n2 27a_100000185549_100011291633 [0,1,0,1,0,0|2,0,0]=4 15797 B21R3.153116 Brc1ccc2ccc(cc2c1)NCc3ccccc3 207a_100010090036_100015611070 [0,1,0,1,0,0|2,0,0]=4 15798 B21R3.153116 Brc1ccc2ccc(cc2c1)NCc3ccccc3 270302a_100010090036_100015611070 [0,1,0,1,0,0|2,0,0]=4 15799 B21R3.153116 Brc1ccc2ccc(cc2c1)NCc3ccccc3 34a_100010090036_100015291786 [0,1,0,1,0,0|2,0,0]=4 15800 B21R3.153116 Brc1ccc2ccc(cc2c1)NCc3ccccc3 7a_100010090036_100000211182 [0,1,0,1,0,0|2,0,0]=4 15801 B21R3.153116 Brc1ccc2ccc(cc2c1)OCc3ccccc3 34a_100009816537_100015291786 [0,1,0,1,0,0|1,0,0]=3 15802 B21R3.153116 Brc1ccc2ccc(cc2c1)OCc3ccccc3 7a_100009816537_100000211182 [0,1,0,1,0,0|1,0,0]=3 15803 B21R3.153116 Brc1ccc2ccc(cc2c1)OCc3ccccn3 34a_100009816537_100000721315 [0,1,0,1,0,0|2,0,0]=4 15804 B21R3.153116 Brc1ccc2ccc(cc2c1)OCc3ccccn3 7a_100009816537_100000721315 [0,1,0,1,0,0|2,0,0]=4 15805 B21R3.153116 Brc1ccc2ccc(cc2c1)OCc3cccnc3 34a_100009816537_100000733263 [0,1,0,1,0,0|2,0,0]=4 15806 B21R3.153116 Brc1ccc2ccc(cc2c1)OCc3cccnc3 7a_100009816537_100000741622 [0,1,0,1,0,0|2,0,0]=4 15807 B21R3.153116 Brc1ccc2ccc(cc2c1)OCc3ccncc3 7a_100009816537_100015193705 [0,1,0,1,0,0|2,0,0]=4 15808 B21R3.153116 Brc1ccc2ncc(cc2c1)OCc3ccccc3 34a_100000703654_100015291786 [0,1,0,1,0,0|2,0,0]=4 15809 B21R3.153116 Brc1ccc2ncc(cc2c1)OCc3ccccc3 7a_100000703654_100000211182 [0,1,0,1,0,0|2,0,0]=4 15810 B21R3.153116 Brc1cnc2ccc(cc2c1)OCc3ccccc3 34a_100010137430_100015291786 [0,1,0,1,0,0|2,0,0]=4 15811 B21R3.153116 Brc1cnc2ccc(cc2c1)OCc3ccccc3 7a_100010137430_100000211182 [0,1,0,1,0,0|2,0,0]=4 15812 B21R3.153116 Cc1ccc2ccc(cc2c1)OCc3ccccc3 34a_100000091598_100015291786 [0,1,0,1,0,0|1,0,0]=3 15813 B21R3.153116 Cc1ccc2ccc(cc2c1)OCc3ccccc3 7a_100000091598_100000211182 [0,1,0,1,0,0|1,0,0]=3 15814 B21R3.153116 Cc1ccc2ccc(cc2c1)OCc3ccccn3 34a_100000091598_100000721315 [0,1,0,1,0,0|2,0,0]=4 15815 B21R3.153116 Cc1ccc2ccc(cc2c1)OCc3ccccn3 7a_100000091598_100000721315 [0,1,0,1,0,0|2,0,0]=4 15816 B21R3.153116 Cc1ccc2ccc(cc2c1)OCc3cccnc3 34a_100000091598_100000733263 [0,1,0,1,0,0|2,0,0]=4 15817 B21R3.153116 Cc1ccc2ccc(cc2c1)OCc3cccnc3 7a_100000091598_100000741622 [0,1,0,1,0,0|2,0,0]=4 15818 B21R3.153116 Cc1ccc2ccc(cc2c1)OCc3ccncc3 7a_100000091598_100015193705 [0,1,0,1,0,0|2,0,0]=4 15819 B21R3.153116 Cc1ccc2ccc(cc2n1)OCc3ccccc3 34a_100009867695_100015291786 [0,1,0,1,0,0|2,0,0]=4 15820 B21R3.153116 Cc1ccc2ccc(cc2n1)OCc3ccccc3 7a_100009867695_100000211182 [0,1,0,1,0,0|2,0,0]=4 15821 B21R3.153116 Clc1ccc2ccc(cc2n1)OCc3ccccc3 34a_100000079174_100015291786 [0,1,0,1,0,0|2,0,0]=4 15822 B21R3.153116 Clc1ccc2ccc(cc2n1)OCc3ccccc3 7a_100000079174_100000211182 [0,1,0,1,0,0|2,0,0]=4 15823 B21R3.153116 Clc1cnc2ccc(cc2c1)OCc3ccccc3 34a_100009869629_100015291786 [0,1,0,1,0,0|2,0,0]=4 15824 B21R3.153116 Clc1cnc2ccc(cc2c1)OCc3ccccc3 7a_100009869629_100000211182 [0,1,0,1,0,0|2,0,0]=4 15825 B21R3.153116 Fc1ccc2cnc(cc2c1)OCc3ccccc3 34a_200000101709_100015291786 [0,1,0,1,0,0|2,0,0]=4 15826 B21R3.153116 Fc1cnc2ccc(cc2c1)OCc3ccccc3 34a_100009845357_100015291786 [0,1,0,1,0,0|2,0,0]=4 15827 B21R3.153116 Fc1cnc2ccc(cc2c1)OCc3ccccc3 7a_100009845357_100000211182 [0,1,0,1,0,0|2,0,0]=4 15828 B21R3.153116 Nc1ccc2ccc(cc2c1)OCc3ccccc3 34a_100015378740_100015291786 [0,1,0,1,0,0|1,0,0]=3 15829 B21R3.153116 Nc1ccc2ccc(cc2c1)OCc3ccccc3 7a_100015378740_100000211182 [0,1,0,1,0,0|1,0,0]=3 15830 B21R3.153116 Nc1ccc2ccc(cc2c1)OCc3ccccn3 34a_100015378740_100000721315 [0,1,0,1,0,0|2,0,0]=4 15831 B21R3.153116 Nc1ccc2ccc(cc2c1)OCc3ccccn3 7a_100015378740_100000721315 [0,1,0,1,0,0|2,0,0]=4 15832 B21R3.153116 Nc1ccc2ccc(cc2c1)OCc3cccnc3 34a_100015378740_100000733263 [0,1,0,1,0,0|2,0,0]=4 15833 B21R3.153116 Nc1ccc2ccc(cc2c1)OCc3cccnc3 7a_100015378740_100000741622 [0,1,0,1,0,0|2,0,0]=4 15834 B21R3.153116 Nc1ccc2ccc(cc2c1)OCc3ccncc3 7a_100015378740_100015193705 [0,1,0,1,0,0|2,0,0]=4 15835 B21R3.153116 Nc1ccc2ccc(cc2c1)SCc3ccccc3 62a_100000211182_100010090036 [0,1,0,1,0,0|1,1,0]=4 15836 B21R3.153116 Nc1ccc2ccc(cc2c1)SCc3ccccc3 62a_100010090036_100015291786 [0,1,0,1,0,0|1,1,0]=4 15837 B21R3.153116 O=c1ccc2ccc(cc2o1)OCc3ccccc3 34a_100000185914_100015291786 [0,1,0,1,0,0|2,0,0]=4 15838 B21R3.153116 O=c1ccc2ccc(cc2o1)OCc3ccccc3 7a_100000185914_100000211182 [0,1,0,1,0,0|2,0,0]=4 15839 B21R3.153116 Oc1ccc2ccc(cc2c1)NCc3ccccc3 270302a_100015378740_100015611070 [0,1,0,1,0,0|2,0,0]=4 15840 B21R3.153116 Oc1ccc2ccc(cc2c1)NCc3ccccc3 34a_100015378740_100015291786 [0,1,0,1,0,0|2,0,0]=4 15841 B21R3.153116 Oc1ccc2ccc(cc2c1)NCc3ccccc3 7a_100015378740_100000211182 [0,1,0,1,0,0|2,0,0]=4 15842 B21R3.153116 Oc1ccc2ccc(cc2c1)SCc3ccccc3 62a_100000211182_100009816537 [0,1,0,1,0,0|1,1,0]=4 15843 B21R3.153116 Oc1ccc2ccc(nc2c1)SCc3ccccc3 62a_100000211182_100000079174 [0,1,0,1,0,0|1,1,0]=4 15844 B21R3.153330 Brc1ccc2cc(ccc2c1)NCc3ccccc3 207a_100000185457_100015611070 [0,1,0,1,0,0|2,0,0]=4 15845 B21R3.153330 Brc1ccc2cc(ccc2c1)NCc3ccccc3 270302a_100000185457_100015611070 [0,1,0,1,0,0|2,0,0]=4 15846 B21R3.153330 Brc1ccc2cc(ccc2c1)NCc3ccccc3 34a_100000185457_100015291786 [0,1,0,1,0,0|2,0,0]=4 15847 B21R3.153330 Brc1ccc2cc(ccc2c1)NCc3ccccc3 7a_100000185457_100000211182 [0,1,0,1,0,0|2,0,0]=4 15848 B21R3.153330 Brc1ccc2cc(ccc2c1)OCc3ccccc3 34a_100000185455_100015291786 [0,1,0,1,0,0|1,0,0]=3 15849 B21R3.153330 Brc1ccc2cc(ccc2c1)OCc3ccccc3 7a_100000185455_100000211182 [0,1,0,1,0,0|1,0,0]=3 15850 B21R3.153330 Brc1ccc2cc(ccc2c1)OCc3ccccn3 34a_100000185455_100000721315 [0,1,0,1,0,0|2,0,0]=4 15851 B21R3.153330 Brc1ccc2cc(ccc2c1)OCc3ccccn3 7a_100000185455_100000721315 [0,1,0,1,0,0|2,0,0]=4 15852 B21R3.153330 Brc1ccc2cc(ccc2c1)OCc3cccnc3 34a_100000185455_100000733263 [0,1,0,1,0,0|2,0,0]=4 15853 B21R3.153330 Brc1ccc2cc(ccc2c1)OCc3cccnc3 7a_100000185455_100000741622 [0,1,0,1,0,0|2,0,0]=4 15854 B21R3.153330 Brc1ccc2cc(ccc2c1)OCc3ccncc3 7a_100000185455_100015193705 [0,1,0,1,0,0|2,0,0]=4 15855 B21R3.153330 Brc1ccc2cc(ccc2c1)SCc3ccccc3 62a_100000211182_100012344972 [0,1,0,1,0,0|1,1,0]=4 15856 B21R3.153330 Brc1ccc2cc(ccc2c1)SCc3ccccc3 62a_100012344972_100015291786 [0,1,0,1,0,0|1,1,0]=4 15857 B21R3.153330 Brc1cnc2cc(ccc2c1)OCc3ccccc3 34a_200010153753_100015291786 [0,1,0,1,0,0|2,0,0]=4 15858 B21R3.153330 Brc1cnc2cc(ccc2c1)OCc3ccccc3 7a_200010153753_100000211182 [0,1,0,1,0,0|2,0,0]=4 15859 B21R3.153330 Cc1ccc2cc(ccc2c1)OCc3ccccc3 34a_100000074090_100015291786 [0,1,0,1,0,0|1,0,0]=3 15860 B21R3.153330 Cc1ccc2cc(ccc2c1)OCc3ccccc3 7a_100000074090_100000211182 [0,1,0,1,0,0|1,0,0]=3 15861 B21R3.153330 Cc1ccc2cc(ccc2c1)OCc3ccccn3 34a_100000074090_100000721315 [0,1,0,1,0,0|2,0,0]=4 15862 B21R3.153330 Cc1ccc2cc(ccc2c1)OCc3ccccn3 7a_100000074090_100000721315 [0,1,0,1,0,0|2,0,0]=4 15863 B21R3.153330 Cc1ccc2cc(ccc2c1)OCc3cccnc3 34a_100000074090_100000733263 [0,1,0,1,0,0|2,0,0]=4 15864 B21R3.153330 Cc1ccc2cc(ccc2c1)OCc3cccnc3 7a_100000074090_100000741622 [0,1,0,1,0,0|2,0,0]=4 15865 B21R3.153330 Cc1ccc2cc(ccc2c1)OCc3ccncc3 7a_100000074090_100015193705 [0,1,0,1,0,0|2,0,0]=4 15866 B21R3.153330 Cc1ccc2cc(ccc2n1)OCc3ccccc3 34a_100000037634_100015291786 [0,1,0,1,0,0|2,0,0]=4 15867 B21R3.153330 Cc1ccc2cc(ccc2n1)OCc3ccccc3 7a_100000037634_100000211182 [0,1,0,1,0,0|2,0,0]=4 15868 B21R3.153330 Cc1ccc2nc(ccc2c1)NCc3ccccc3 27a_100015324214_100011865911 [0,1,0,1,0,0|2,0,0]=4 15869 B21R3.153330 Cc1ccc2nc(ccc2c1)SCc3ccccc3 62a_100000211182_100011865911 [0,1,0,1,0,0|1,1,0]=4 15870 B21R3.153330 Cc1ccc2nc(ccc2c1)SCc3ccccc3 62a_200000181977_100015291786 [0,1,0,1,0,0|1,1,0]=4 15871 B21R3.153330 Clc1ccc2cc(ccc2c1)OCc3ccccc3 34a_100000074905_100015291786 [0,1,0,1,0,0|1,0,0]=3 15872 B21R3.153330 Clc1ccc2cc(ccc2c1)OCc3ccccc3 7a_100000074905_100000211182 [0,1,0,1,0,0|1,0,0]=3 15873 B21R3.153330 Clc1ccc2cc(ccc2c1)OCc3ccccn3 34a_100000074905_100000721315 [0,1,0,1,0,0|2,0,0]=4 15874 B21R3.153330 Clc1ccc2cc(ccc2c1)OCc3ccccn3 7a_100000074905_100000721315 [0,1,0,1,0,0|2,0,0]=4 15875 B21R3.153330 Clc1ccc2cc(ccc2c1)OCc3cccnc3 34a_100000074905_100000733263 [0,1,0,1,0,0|2,0,0]=4 15876 B21R3.153330 Clc1ccc2cc(ccc2c1)OCc3cccnc3 7a_100000074905_100000741622 [0,1,0,1,0,0|2,0,0]=4 15877 B21R3.153330 Clc1ccc2cc(ccc2c1)OCc3ccncc3 7a_100000074905_100015193705 [0,1,0,1,0,0|2,0,0]=4 15878 B21R3.153330 Clc1ccc2cc(ccc2n1)OCc3ccccc3 34a_100009849208_100015291786 [0,1,0,1,0,0|2,0,0]=4 15879 B21R3.153330 Clc1ccc2cc(ccc2n1)OCc3ccccc3 7a_100009849208_100000211182 [0,1,0,1,0,0|2,0,0]=4 15880 B21R3.153330 Fc1ccc2cc(ccc2c1)OCc3ccccc3 34a_100009847029_100015291786 [0,1,0,1,0,0|1,0,0]=3 15881 B21R3.153330 Fc1ccc2cc(ccc2c1)OCc3ccccc3 7a_100009847029_100000211182 [0,1,0,1,0,0|1,0,0]=3 15882 B21R3.153330 Fc1ccc2cc(ccc2c1)OCc3ccccn3 34a_100009847029_100000721315 [0,1,0,1,0,0|2,0,0]=4 15883 B21R3.153330 Fc1ccc2cc(ccc2c1)OCc3ccccn3 7a_100009847029_100000721315 [0,1,0,1,0,0|2,0,0]=4 15884 B21R3.153330 Fc1ccc2cc(ccc2c1)OCc3cccnc3 34a_100009847029_100000733263 [0,1,0,1,0,0|2,0,0]=4 15885 B21R3.153330 Fc1ccc2cc(ccc2c1)OCc3cccnc3 7a_100009847029_100000741622 [0,1,0,1,0,0|2,0,0]=4 15886 B21R3.153330 Fc1ccc2cc(ccc2c1)OCc3ccncc3 7a_100009847029_100015193705 [0,1,0,1,0,0|2,0,0]=4 15887 B21R3.153330 Fc1ccc2cc(ccc2c1)SCc3ccccc3 62a_100000211182_100009817052 [0,1,0,1,0,0|1,1,0]=4 15888 B21R3.153330 Fc1ccc2cc(ccc2c1)SCc3ccccc3 62a_100009817052_100015291786 [0,1,0,1,0,0|1,1,0]=4 15889 B21R3.153330 Fc1ccc2cc(cnc2c1)OCc3ccccc3 34a_100012184162_100015291786 [0,1,0,1,0,0|2,0,0]=4 15890 B21R3.153330 Fc1ccc2cc(cnc2c1)OCc3ccccc3 7a_100012184162_100000211182 [0,1,0,1,0,0|2,0,0]=4 15891 B21R3.153330 Fc1ccc2nc(ccc2c1)NCc3ccccc3 27a_100015324214_100011998705 [0,1,0,1,0,0|2,0,0]=4 15892 B21R3.153330 Fc1ccc2nc(ccc2c1)SCc3ccccc3 62a_100000211182_100011998705 [0,1,0,1,0,0|1,1,0]=4 15893 B21R3.153330 Fc1ccc2nc(ccc2c1)SCc3ccccc3 62a_200012355665_100015291786 [0,1,0,1,0,0|1,1,0]=4 15894 B21R3.153330 Nc1ccc2cc(ccc2c1)SCc3ccccc3 62a_100000185457_100015291786 [0,1,0,1,0,0|1,1,0]=4 15895 B21R3.153330 Nc1ccc2cc(ccc2c1)SCc3ccccc3 62a_100000211182_100000185457 [0,1,0,1,0,0|1,1,0]=4 15896 B21R3.153330 O=c1ccc2cc(ccc2o1)OCc3ccccc3 34a_100000066265_100015291786 [0,1,0,1,0,0|2,0,0]=4 15897 B21R3.153330 O=c1ccc2cc(ccc2o1)OCc3ccccc3 7a_100000066265_100000211182 [0,1,0,1,0,0|2,0,0]=4 15898 B21R3.153330 Oc1ccc2cc(ccc2c1)OCc3ccccc3 271570a_203496583355_100000149270 [0,1,0,1,0,0|1,0,0]=3 15899 B21R3.153330 Oc1ccc2cc(ccc2c1)SCc3ccccc3 62a_100000211182_100000185455 [0,1,0,1,0,0|1,1,0]=4 15900 B21R3.153330 Oc1ccc2nc(ccc2c1)SCc3ccccc3 62a_100000211182_100009849208 [0,1,0,1,0,0|1,1,0]=4 15901 B21R3.469780 Brc1cc(ccn1)COc2ccc3ccccc3c2 34a_100000185828_100010243470 [0,1,0,1,0,0|2,0,0]=4 15902 B21R3.469780 Brc1cc(ccn1)COc2ccc3ccccc3c2 7a_100000185828_100010254460 [0,1,0,1,0,0|2,0,0]=4 15903 B21R3.469780 Brc1cccc(c1)CNc2ccc3ccccc3c2 207a_100000211940_100000210085 [0,1,0,1,0,0|2,0,0]=4 15904 B21R3.469780 Brc1cccc(c1)CNc2ccc3ccccc3c2 270302a_100000211940_100000210085 [0,1,0,1,0,0|2,0,0]=4 15905 B21R3.469780 Brc1cccc(c1)CNc2ccc3ccccc3c2 34a_100000211940_100000698116 [0,1,0,1,0,0|2,0,0]=4 15906 B21R3.469780 Brc1cccc(c1)CNc2ccc3ccccc3c2 7a_100000211940_100000211773 [0,1,0,1,0,0|2,0,0]=4 15907 B21R3.469780 Brc1cccc(c1)CNc2ccc3ccccc3n2 27a_100000174977_100011291633 [0,1,0,1,0,0|2,0,0]=4 15908 B21R3.469780 Brc1cccc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000698116 [0,1,0,1,0,0|1,0,0]=3 15909 B21R3.469780 Brc1cccc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000211773 [0,1,0,1,0,0|1,0,0]=3 15910 B21R3.469780 Brc1cccc(c1)COc2ccc3cccnc3c2 34a_100011216045_100000698116 [0,1,0,1,0,0|2,0,0]=4 15911 B21R3.469780 Brc1cccc(c1)COc2ccc3ccncc3c2 7a_100000752006_100000211773 [0,1,0,1,0,0|2,0,0]=4 15912 B21R3.469780 Brc1cccc(c1)COc2ccc3cnccc3c2 34a_100000046372_100000698116 [0,1,0,1,0,0|2,0,0]=4 15913 B21R3.469780 Brc1cccc(c1)COc2ccc3cnccc3c2 7a_100000046372_100000211773 [0,1,0,1,0,0|2,0,0]=4 15914 B21R3.469780 Brc1cccc(c1)COc2ccc3ncccc3c2 34a_100011215586_100000698116 [0,1,0,1,0,0|2,0,0]=4 15915 B21R3.469780 Brc1cccc(c1)COc2ccc3ncccc3c2 7a_100011215586_100000211773 [0,1,0,1,0,0|2,0,0]=4 15916 B21R3.469780 Brc1cccc(c1)COc2cnc3ccccc3c2 34a_100011934006_100000698116 [0,1,0,1,0,0|2,0,0]=4 15917 B21R3.469780 Brc1cccc(c1)COc2cnc3ccccc3c2 7a_100011934006_100000211773 [0,1,0,1,0,0|2,0,0]=4 15918 B21R3.469780 Brc1cccc(c1)CSc2ccc3ccccc3c2 62a_100000211773_100000233703 [0,1,0,1,0,0|1,1,0]=4 15919 B21R3.469780 Brc1cccc(c1)CSc2ccc3ccccc3n2 62a_100000211773_100011291633 [0,1,0,1,0,0|1,1,0]=4 15920 B21R3.469780 Brc1cccc(c1)CSc2ccc3ccccc3n2 62a_100011291633_100000211773 [0,1,0,1,0,0|1,1,0]=4 15921 B21R3.469780 Brc1cccc(n1)COc2ccc3ccccc3c2 34a_100000185828_100009889011 [0,1,0,1,0,0|2,0,0]=4 15922 B21R3.469780 Brc1cccc(n1)COc2ccc3ccccc3c2 7a_100000185828_100009889011 [0,1,0,1,0,0|2,0,0]=4 15923 B21R3.469780 Brc1ccnc(c1)COc2ccc3ccccc3c2 34a_100000185828_100010173614 [0,1,0,1,0,0|2,0,0]=4 15924 B21R3.469780 Brc1ccnc(c1)COc2ccc3ccccc3c2 7a_100000185828_100010173614 [0,1,0,1,0,0|2,0,0]=4 15925 B21R3.469780 Brc1cncc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000738771 [0,1,0,1,0,0|2,0,0]=4 15926 B21R3.469780 Brc1cncc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000738771 [0,1,0,1,0,0|2,0,0]=4 15927 B21R3.469780 Cc1cc(ccn1)COc2ccc3ccccc3c2 34a_100000185828_200020672517 [0,1,0,1,0,0|2,0,0]=4 15928 B21R3.469780 Cc1cc(ccn1)COc2ccc3ccccc3c2 7a_100000185828_200020672517 [0,1,0,1,0,0|2,0,0]=4 15929 B21R3.469780 Cc1cccc(c1)CNc2ccc3ccccc3c2 207a_100000211940_100000211157 [0,1,0,1,0,0|2,0,0]=4 15930 B21R3.469780 Cc1cccc(c1)CNc2ccc3ccccc3c2 270302a_100000211940_100000211157 [0,1,0,1,0,0|2,0,0]=4 15931 B21R3.469780 Cc1cccc(c1)CNc2ccc3ccccc3c2 34a_100000211940_100000211840 [0,1,0,1,0,0|2,0,0]=4 15932 B21R3.469780 Cc1cccc(c1)CNc2ccc3ccccc3c2 7a_100000211940_100000211840 [0,1,0,1,0,0|2,0,0]=4 15933 B21R3.469780 Cc1cccc(c1)CNc2ccc3ccccc3n2 27a_100000185548_100011291633 [0,1,0,1,0,0|2,0,0]=4 15934 B21R3.469780 Cc1cccc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000211840 [0,1,0,1,0,0|1,0,0]=3 15935 B21R3.469780 Cc1cccc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000211840 [0,1,0,1,0,0|1,0,0]=3 15936 B21R3.469780 Cc1cccc(c1)COc2ccc3cccnc3c2 34a_100011216045_100000211840 [0,1,0,1,0,0|2,0,0]=4 15937 B21R3.469780 Cc1cccc(c1)COc2ccc3ccncc3c2 7a_100000752006_100000211840 [0,1,0,1,0,0|2,0,0]=4 15938 B21R3.469780 Cc1cccc(c1)COc2ccc3cnccc3c2 34a_100000046372_100000211840 [0,1,0,1,0,0|2,0,0]=4 15939 B21R3.469780 Cc1cccc(c1)COc2ccc3cnccc3c2 7a_100000046372_100000211840 [0,1,0,1,0,0|2,0,0]=4 15940 B21R3.469780 Cc1cccc(c1)COc2ccc3ncccc3c2 34a_100011215586_100000211840 [0,1,0,1,0,0|2,0,0]=4 15941 B21R3.469780 Cc1cccc(c1)COc2ccc3ncccc3c2 7a_100011215586_100000211840 [0,1,0,1,0,0|2,0,0]=4 15942 B21R3.469780 Cc1cccc(c1)COc2cnc3ccccc3c2 34a_100011934006_100000211840 [0,1,0,1,0,0|2,0,0]=4 15943 B21R3.469780 Cc1cccc(c1)COc2cnc3ccccc3c2 7a_100011934006_100000211840 [0,1,0,1,0,0|2,0,0]=4 15944 B21R3.469780 Cc1cccc(c1)CSc2ccc3ccccc3c2 62a_100000211840_100000233703 [0,1,0,1,0,0|1,1,0]=4 15945 B21R3.469780 Cc1cccc(c1)CSc2ccc3ccccc3n2 62a_100000211840_100011291633 [0,1,0,1,0,0|1,1,0]=4 15946 B21R3.469780 Cc1cccc(c1)CSc2ccc3ccccc3n2 62a_100011291633_100000211840 [0,1,0,1,0,0|1,1,0]=4 15947 B21R3.469780 Cc1cccc(n1)COc2ccc3ccccc3c2 34a_100000185828_100000757606 [0,1,0,1,0,0|2,0,0]=4 15948 B21R3.469780 Cc1cccc(n1)COc2ccc3ccccc3c2 7a_100000185828_100000757606 [0,1,0,1,0,0|2,0,0]=4 15949 B21R3.469780 Cc1ccnc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000718516 [0,1,0,1,0,0|2,0,0]=4 15950 B21R3.469780 Cc1ccnc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000718516 [0,1,0,1,0,0|2,0,0]=4 15951 B21R3.469780 Cc1cncc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000716715 [0,1,0,1,0,0|2,0,0]=4 15952 B21R3.469780 Cc1cncc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000716715 [0,1,0,1,0,0|2,0,0]=4 15953 B21R3.469780 Clc1cc(ccn1)COc2ccc3ccccc3c2 34a_100000185828_100000764220 [0,1,0,1,0,0|2,0,0]=4 15954 B21R3.469780 Clc1cc(ccn1)COc2ccc3ccccc3c2 7a_100000185828_100000764220 [0,1,0,1,0,0|2,0,0]=4 15955 B21R3.469780 Clc1cccc(c1)CNc2ccc3ccccc3c2 207a_100000211940_100000210801 [0,1,0,1,0,0|2,0,0]=4 15956 B21R3.469780 Clc1cccc(c1)CNc2ccc3ccccc3c2 270302a_100000211940_100000210801 [0,1,0,1,0,0|2,0,0]=4 15957 B21R3.469780 Clc1cccc(c1)CNc2ccc3ccccc3c2 34a_100000211940_100000187163 [0,1,0,1,0,0|2,0,0]=4 15958 B21R3.469780 Clc1cccc(c1)CNc2ccc3ccccc3c2 7a_100000211940_100000187163 [0,1,0,1,0,0|2,0,0]=4 15959 B21R3.469780 Clc1cccc(c1)CNc2ccc3ccccc3n2 27a_100000174878_100011291633 [0,1,0,1,0,0|2,0,0]=4 15960 B21R3.469780 Clc1cccc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000187163 [0,1,0,1,0,0|1,0,0]=3 15961 B21R3.469780 Clc1cccc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000187163 [0,1,0,1,0,0|1,0,0]=3 15962 B21R3.469780 Clc1cccc(c1)COc2ccc3cccnc3c2 34a_100011216045_100000187163 [0,1,0,1,0,0|2,0,0]=4 15963 B21R3.469780 Clc1cccc(c1)COc2ccc3ccncc3c2 7a_100000752006_100000187163 [0,1,0,1,0,0|2,0,0]=4 15964 B21R3.469780 Clc1cccc(c1)COc2ccc3cnccc3c2 34a_100000046372_100000187163 [0,1,0,1,0,0|2,0,0]=4 15965 B21R3.469780 Clc1cccc(c1)COc2ccc3cnccc3c2 7a_100000046372_100000187163 [0,1,0,1,0,0|2,0,0]=4 15966 B21R3.469780 Clc1cccc(c1)COc2ccc3ncccc3c2 34a_100011215586_100000187163 [0,1,0,1,0,0|2,0,0]=4 15967 B21R3.469780 Clc1cccc(c1)COc2ccc3ncccc3c2 7a_100011215586_100000187163 [0,1,0,1,0,0|2,0,0]=4 15968 B21R3.469780 Clc1cccc(c1)COc2cnc3ccccc3c2 34a_100011934006_100000187163 [0,1,0,1,0,0|2,0,0]=4 15969 B21R3.469780 Clc1cccc(c1)COc2cnc3ccccc3c2 7a_100011934006_100000187163 [0,1,0,1,0,0|2,0,0]=4 15970 B21R3.469780 Clc1cccc(c1)CSc2ccc3ccccc3c2 62a_100000187163_100000233703 [0,1,0,1,0,0|1,1,0]=4 15971 B21R3.469780 Clc1cccc(c1)CSc2ccc3ccccc3n2 62a_100000187163_100011291633 [0,1,0,1,0,0|1,1,0]=4 15972 B21R3.469780 Clc1cccc(c1)CSc2ccc3ccccc3n2 62a_100011291633_100000187163 [0,1,0,1,0,0|1,1,0]=4 15973 B21R3.469780 Clc1cccc(n1)COc2ccc3ccccc3c2 34a_100000185828_100000086093 [0,1,0,1,0,0|2,0,0]=4 15974 B21R3.469780 Clc1cccc(n1)COc2ccc3ccccc3c2 7a_100000185828_100000086093 [0,1,0,1,0,0|2,0,0]=4 15975 B21R3.469780 Clc1ccnc(c1)COc2ccc3ccccc3c2 34a_100000185828_100016988179 [0,1,0,1,0,0|2,0,0]=4 15976 B21R3.469780 Clc1ccnc(c1)COc2ccc3ccccc3c2 7a_100000185828_100016988179 [0,1,0,1,0,0|2,0,0]=4 15977 B21R3.469780 Clc1cncc(c1)COc2ccc3ccccc3c2 34a_100000185828_100016992070 [0,1,0,1,0,0|2,0,0]=4 15978 B21R3.469780 Clc1cncc(c1)COc2ccc3ccccc3c2 7a_100000185828_100016992070 [0,1,0,1,0,0|2,0,0]=4 15979 B21R3.469780 Fc1cccc(c1)CNc2ccc3ccccc3c2 207a_100000211940_100000210812 [0,1,0,1,0,0|2,0,0]=4 15980 B21R3.469780 Fc1cccc(c1)CNc2ccc3ccccc3c2 270302a_100000211940_100000210812 [0,1,0,1,0,0|2,0,0]=4 15981 B21R3.469780 Fc1cccc(c1)CNc2ccc3ccccc3c2 34a_100000211940_100000187166 [0,1,0,1,0,0|2,0,0]=4 15982 B21R3.469780 Fc1cccc(c1)CNc2ccc3ccccc3c2 7a_100000211940_100000230114 [0,1,0,1,0,0|2,0,0]=4 15983 B21R3.469780 Fc1cccc(c1)CNc2ccc3ccccc3n2 27a_100000174948_100011291633 [0,1,0,1,0,0|2,0,0]=4 15984 B21R3.469780 Fc1cccc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000187166 [0,1,0,1,0,0|1,0,0]=3 15985 B21R3.469780 Fc1cccc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000230114 [0,1,0,1,0,0|1,0,0]=3 15986 B21R3.469780 Fc1cccc(c1)COc2ccc3cccnc3c2 34a_100011216045_100000187166 [0,1,0,1,0,0|2,0,0]=4 15987 B21R3.469780 Fc1cccc(c1)COc2ccc3ccncc3c2 7a_100000752006_100000230114 [0,1,0,1,0,0|2,0,0]=4 15988 B21R3.469780 Fc1cccc(c1)COc2ccc3cnccc3c2 34a_100000046372_100000187166 [0,1,0,1,0,0|2,0,0]=4 15989 B21R3.469780 Fc1cccc(c1)COc2ccc3cnccc3c2 7a_100000046372_100000230114 [0,1,0,1,0,0|2,0,0]=4 15990 B21R3.469780 Fc1cccc(c1)COc2ccc3ncccc3c2 34a_100011215586_100000187166 [0,1,0,1,0,0|2,0,0]=4 15991 B21R3.469780 Fc1cccc(c1)COc2ccc3ncccc3c2 7a_100011215586_100000230114 [0,1,0,1,0,0|2,0,0]=4 15992 B21R3.469780 Fc1cccc(c1)COc2cnc3ccccc3c2 34a_100011934006_100000187166 [0,1,0,1,0,0|2,0,0]=4 15993 B21R3.469780 Fc1cccc(c1)COc2cnc3ccccc3c2 7a_100011934006_100000230114 [0,1,0,1,0,0|2,0,0]=4 15994 B21R3.469780 Fc1cccc(c1)CSc2ccc3ccccc3c2 62a_100000230114_100000233703 [0,1,0,1,0,0|1,1,0]=4 15995 B21R3.469780 Fc1cccc(c1)CSc2ccc3ccccc3n2 62a_100000230114_100011291633 [0,1,0,1,0,0|1,1,0]=4 15996 B21R3.469780 Fc1cccc(c1)CSc2ccc3ccccc3n2 62a_100011291633_100000230114 [0,1,0,1,0,0|1,1,0]=4 15997 B21R3.469780 Fc1cccc(n1)COc2ccc3ccccc3c2 34a_100000185828_100009819644 [0,1,0,1,0,0|2,0,0]=4 15998 B21R3.469780 Fc1cccc(n1)COc2ccc3ccccc3c2 7a_100000185828_100009819644 [0,1,0,1,0,0|2,0,0]=4 15999 B21R3.469780 Fc1cncc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000725299 [0,1,0,1,0,0|2,0,0]=4 16000 B21R3.469780 Fc1cncc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000725299 [0,1,0,1,0,0|2,0,0]=4 16001 B21R3.469780 Ic1cccc(c1)CNc2ccc3ccccc3c2 207a_100000211940_100000014684 [0,1,0,1,0,0|2,0,0]=4 16002 B21R3.469780 Ic1cccc(c1)CNc2ccc3ccccc3c2 270302a_100000211940_100000014684 [0,1,0,1,0,0|2,0,0]=4 16003 B21R3.469780 Ic1cccc(c1)CNc2ccc3ccccc3c2 34a_100000211940_100011218688 [0,1,0,1,0,0|2,0,0]=4 16004 B21R3.469780 Ic1cccc(c1)CNc2ccc3ccccc3c2 7a_100000211940_100011218688 [0,1,0,1,0,0|2,0,0]=4 16005 B21R3.469780 Ic1cccc(c1)CNc2ccc3ccccc3n2 27a_100000106179_100011291633 [0,1,0,1,0,0|2,0,0]=4 16006 B21R3.469780 Ic1cccc(c1)COc2ccc3ccccc3c2 34a_100000185828_100011218688 [0,1,0,1,0,0|1,0,0]=3 16007 B21R3.469780 Ic1cccc(c1)COc2ccc3ccccc3c2 7a_100000185828_100011218688 [0,1,0,1,0,0|1,0,0]=3 16008 B21R3.469780 Ic1cccc(c1)COc2ccc3cccnc3c2 34a_100011216045_100011218688 [0,1,0,1,0,0|2,0,0]=4 16009 B21R3.469780 Ic1cccc(c1)COc2ccc3ccncc3c2 7a_100000752006_100011218688 [0,1,0,1,0,0|2,0,0]=4 16010 B21R3.469780 Ic1cccc(c1)COc2ccc3cnccc3c2 34a_100000046372_100011218688 [0,1,0,1,0,0|2,0,0]=4 16011 B21R3.469780 Ic1cccc(c1)COc2ccc3cnccc3c2 7a_100000046372_100011218688 [0,1,0,1,0,0|2,0,0]=4 16012 B21R3.469780 Ic1cccc(c1)COc2ccc3ncccc3c2 34a_100011215586_100011218688 [0,1,0,1,0,0|2,0,0]=4 16013 B21R3.469780 Ic1cccc(c1)COc2ccc3ncccc3c2 7a_100011215586_100011218688 [0,1,0,1,0,0|2,0,0]=4 16014 B21R3.469780 Ic1cccc(c1)COc2cnc3ccccc3c2 34a_100011934006_100011218688 [0,1,0,1,0,0|2,0,0]=4 16015 B21R3.469780 Ic1cccc(c1)COc2cnc3ccccc3c2 7a_100011934006_100011218688 [0,1,0,1,0,0|2,0,0]=4 16016 B21R3.469780 Ic1cccc(c1)CSc2ccc3ccccc3c2 62a_100011218688_100000233703 [0,1,0,1,0,0|1,1,0]=4 16017 B21R3.469780 Ic1cccc(c1)CSc2ccc3ccccc3n2 62a_100011218688_100011291633 [0,1,0,1,0,0|1,1,0]=4 16018 B21R3.469780 Ic1cccc(c1)CSc2ccc3ccccc3n2 62a_100011291633_100011218688 [0,1,0,1,0,0|1,1,0]=4 16019 B21R3.469780 Oc1cccc(c1)CNc2ccc3ccccc3c2 207a_100000211940_100000188321 [0,1,0,1,0,0|2,0,0]=4 16020 B21R3.469780 Oc1cccc(c1)CNc2ccc3ccccc3c2 34a_100000211940_100011660834 [0,1,0,1,0,0|2,0,0]=4 16021 B21R3.469780 Oc1cccc(c1)CNc2ccc3ccccc3c2 7a_100000211940_100000084143 [0,1,0,1,0,0|2,0,0]=4 16022 B21R3.469780 Oc1cccc(c1)CNc2ccc3ccccc3n2 27a_100000743036_100011291633 [0,1,0,1,0,0|2,0,0]=4 16023 B21R3.469780 Oc1cccc(c1)COc2ccc3ccccc3c2 34a_100000185828_100011660834 [0,1,0,1,0,0|1,0,0]=3 16024 B21R3.469780 Oc1cccc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000084143 [0,1,0,1,0,0|1,0,0]=3 16025 B21R3.469780 Oc1cccc(c1)COc2ccc3cccnc3c2 34a_100011216045_100011660834 [0,1,0,1,0,0|2,0,0]=4 16026 B21R3.469780 Oc1cccc(c1)COc2ccc3ccncc3c2 7a_100000752006_100000084143 [0,1,0,1,0,0|2,0,0]=4 16027 B21R3.469780 Oc1cccc(c1)COc2ccc3cnccc3c2 34a_100000046372_100011660834 [0,1,0,1,0,0|2,0,0]=4 16028 B21R3.469780 Oc1cccc(c1)COc2ccc3cnccc3c2 7a_100000046372_100000084143 [0,1,0,1,0,0|2,0,0]=4 16029 B21R3.469780 Oc1cccc(c1)COc2ccc3ncccc3c2 34a_100011215586_100011660834 [0,1,0,1,0,0|2,0,0]=4 16030 B21R3.469780 Oc1cccc(c1)COc2ccc3ncccc3c2 7a_100011215586_100000084143 [0,1,0,1,0,0|2,0,0]=4 16031 B21R3.469780 Oc1cccc(c1)COc2cnc3ccccc3c2 34a_100011934006_100011660834 [0,1,0,1,0,0|2,0,0]=4 16032 B21R3.469780 Oc1cccc(c1)COc2cnc3ccccc3c2 7a_100011934006_100000084143 [0,1,0,1,0,0|2,0,0]=4 16033 B21R3.469780 Oc1cccc(c1)CSc2ccc3ccccc3c2 62a_100011660834_100000233703 [0,1,0,1,0,0|1,1,0]=4 16034 B21R3.469780 Oc1cccc(c1)CSc2ccc3ccccc3n2 62a_100011291633_100011660834 [0,1,0,1,0,0|1,1,0]=4 16035 B21R3.469780 Oc1cccc(c1)CSc2ccc3ccccc3n2 62a_100011660834_100011291633 [0,1,0,1,0,0|1,1,0]=4 16036 B21R3.6681832 Brc1cccc2c1cc(cc2)OCc3ccccc3 34a_100010169565_100015291786 [0,1,0,1,0,0|1,0,0]=3 16037 B21R3.6681832 Brc1cccc2c1cc(cc2)OCc3ccccc3 7a_100010169565_100000211182 [0,1,0,1,0,0|1,0,0]=3 16038 B21R3.6681832 Brc1cccc2c1cc(cc2)OCc3ccccn3 34a_100010169565_100000721315 [0,1,0,1,0,0|2,0,0]=4 16039 B21R3.6681832 Brc1cccc2c1cc(cc2)OCc3ccccn3 7a_100010169565_100000721315 [0,1,0,1,0,0|2,0,0]=4 16040 B21R3.6681832 Brc1cccc2c1cc(cc2)OCc3cccnc3 34a_100010169565_100000733263 [0,1,0,1,0,0|2,0,0]=4 16041 B21R3.6681832 Brc1cccc2c1cc(cc2)OCc3cccnc3 7a_100010169565_100000741622 [0,1,0,1,0,0|2,0,0]=4 16042 B21R3.6681832 Brc1cccc2c1cc(cc2)OCc3ccncc3 7a_100010169565_100015193705 [0,1,0,1,0,0|2,0,0]=4 16043 B21R3.6681832 Brc1ccnc2c1cc(cc2)OCc3ccccc3 34a_100010204251_100015291786 [0,1,0,1,0,0|2,0,0]=4 16044 B21R3.6681832 Brc1ccnc2c1cc(cc2)OCc3ccccc3 7a_100010204251_100000211182 [0,1,0,1,0,0|2,0,0]=4 16045 B21R3.6681832 Cc1cccc2c1cc(cc2)OCc3ccccc3 34a_200000091600_100015291786 [0,1,0,1,0,0|1,0,0]=3 16046 B21R3.6681832 Cc1cccc2c1cc(cc2)OCc3ccccc3 7a_200000091600_100000211182 [0,1,0,1,0,0|1,0,0]=3 16047 B21R3.6681832 Cc1cccc2c1cc(cc2)OCc3ccccn3 34a_200000091600_100000721315 [0,1,0,1,0,0|2,0,0]=4 16048 B21R3.6681832 Cc1cccc2c1cc(cc2)OCc3ccccn3 7a_200000091600_100000721315 [0,1,0,1,0,0|2,0,0]=4 16049 B21R3.6681832 Cc1cccc2c1cc(cc2)OCc3cccnc3 34a_200000091600_100000733263 [0,1,0,1,0,0|2,0,0]=4 16050 B21R3.6681832 Cc1cccc2c1cc(cc2)OCc3cccnc3 7a_200000091600_100000741622 [0,1,0,1,0,0|2,0,0]=4 16051 B21R3.6681832 Cc1cccc2c1cc(cc2)OCc3ccncc3 7a_200000091600_100015193705 [0,1,0,1,0,0|2,0,0]=4 16052 B21R3.6681832 Cc1cccc2c1cc(cc2)SCc3ccccc3 62a_100000211182_100010089936 [0,1,0,1,0,0|1,1,0]=4 16053 B21R3.6681832 Cc1cccc2c1nc(cc2)NCc3ccccc3 27a_100015324214_100012002297 [0,1,0,1,0,0|2,0,0]=4 16054 B21R3.6681832 Cc1cccc2c1nc(cc2)SCc3ccccc3 62a_100000211182_100012002297 [0,1,0,1,0,0|1,1,0]=4 16055 B21R3.6681832 Clc1ccnc2c1cc(cc2)OCc3ccccc3 34a_100000075933_100015291786 [0,1,0,1,0,0|2,0,0]=4 16056 B21R3.6681832 Clc1ccnc2c1cc(cc2)OCc3ccccc3 7a_100000075933_100000211182 [0,1,0,1,0,0|2,0,0]=4 16057 B21R3.6681832 Clc1nccc2c1cc(cc2)OCc3ccccc3 34a_200009844553_100015291786 [0,1,0,1,0,0|2,0,0]=4 16058 B21R3.6681832 Clc1nccc2c1cc(cc2)OCc3ccccc3 7a_200009844553_100000211182 [0,1,0,1,0,0|2,0,0]=4 16059 B21R3.6681832 Fc1cccc2c1cc(cc2)OCc3ccccc3 34a_100000091619_100015291786 [0,1,0,1,0,0|1,0,0]=3 16060 B21R3.6681832 Fc1cccc2c1cc(cc2)OCc3ccccc3 7a_100000091619_100000211182 [0,1,0,1,0,0|1,0,0]=3 16061 B21R3.6681832 Fc1cccc2c1cc(cc2)OCc3ccccn3 34a_100000091619_100000721315 [0,1,0,1,0,0|2,0,0]=4 16062 B21R3.6681832 Fc1cccc2c1cc(cc2)OCc3ccccn3 7a_100000091619_100000721315 [0,1,0,1,0,0|2,0,0]=4 16063 B21R3.6681832 Fc1cccc2c1cc(cc2)OCc3cccnc3 34a_100000091619_100000733263 [0,1,0,1,0,0|2,0,0]=4 16064 B21R3.6681832 Fc1cccc2c1cc(cc2)OCc3cccnc3 7a_100000091619_100000741622 [0,1,0,1,0,0|2,0,0]=4 16065 B21R3.6681832 Fc1cccc2c1cc(cc2)OCc3ccncc3 7a_100000091619_100015193705 [0,1,0,1,0,0|2,0,0]=4 16066 B21R3.6681832 Fc1cccc2c1nc(cc2)SCc3ccccc3 62a_100000211182_100012017632 [0,1,0,1,0,0|1,1,0]=4 16067 B21R3.6681832 Nc1cccc2c1cc(cc2)OCc3ccccc3 34a_100000034012_100015291786 [0,1,0,1,0,0|1,0,0]=3 16068 B21R3.6681832 Nc1cccc2c1cc(cc2)OCc3ccccc3 7a_100000034012_100000211182 [0,1,0,1,0,0|1,0,0]=3 16069 B21R3.6681832 Nc1cccc2c1cc(cc2)OCc3ccccn3 34a_100000034012_100000721315 [0,1,0,1,0,0|2,0,0]=4 16070 B21R3.6681832 Nc1cccc2c1cc(cc2)OCc3ccccn3 7a_100000034012_100000721315 [0,1,0,1,0,0|2,0,0]=4 16071 B21R3.6681832 Nc1cccc2c1cc(cc2)OCc3cccnc3 34a_100000034012_100000733263 [0,1,0,1,0,0|2,0,0]=4 16072 B21R3.6681832 Nc1cccc2c1cc(cc2)OCc3cccnc3 7a_100000034012_100000741622 [0,1,0,1,0,0|2,0,0]=4 16073 B21R3.6681832 Nc1cccc2c1cc(cc2)OCc3ccncc3 7a_100000034012_100015193705 [0,1,0,1,0,0|2,0,0]=4 16074 B21R3.6681832 Nc1cccc2c1cc(cc2)SCc3ccccc3 62a_100000211182_100010090012 [0,1,0,1,0,0|1,1,0]=4 16075 B21R3.6681832 Nc1cccc2c1cc(cc2)SCc3ccccc3 62a_100010090012_100015291786 [0,1,0,1,0,0|1,1,0]=4 16076 B21R3.6681832 Oc1cccc2c1cc(cc2)NCc3ccccc3 34a_100132313934_100015291786 [0,1,0,1,0,0|2,0,0]=4 16077 B21R3.6681832 Oc1cccc2c1cc(cc2)SCc3ccccc3 62a_100000211182_100010089991 [0,1,0,1,0,0|1,1,0]=4 16078 B21R3.6681832 Oc1cccc2c1nc(cc2)NCc3ccccc3 27a_100015324214_100010153751 [0,1,0,1,0,0|2,0,0]=4 16079 B21R3.6681832 Oc1cccc2c1nc(cc2)SCc3ccccc3 62a_100000211182_100000013812 [0,1,0,1,0,0|1,1,0]=4 16080 B21R3.218733 Brc1ccccc1CNc2ccc3ccccc3c2 207a_100000211940_100000211189 [0,1,0,1,0,0|2,0,0]=4 16081 B21R3.218733 Brc1ccccc1CNc2ccc3ccccc3c2 270302a_100000211940_100000211189 [0,1,0,1,0,0|2,0,0]=4 16082 B21R3.218733 Brc1ccccc1CNc2ccc3ccccc3c2 34a_100000211940_100000184730 [0,1,0,1,0,0|2,0,0]=4 16083 B21R3.218733 Brc1ccccc1CNc2ccc3ccccc3c2 7a_100000211940_100000184730 [0,1,0,1,0,0|2,0,0]=4 16084 B21R3.218733 Brc1ccccc1CNc2ccc3ccccc3n2 27a_100000689332_100011291633 [0,1,0,1,0,0|2,0,0]=4 16085 B21R3.218733 Brc1ccccc1COc2ccc3ccccc3c2 34a_100000185828_100000184730 [0,1,0,1,0,0|1,0,0]=3 16086 B21R3.218733 Brc1ccccc1COc2ccc3ccccc3c2 7a_100000185828_100000184730 [0,1,0,1,0,0|1,0,0]=3 16087 B21R3.218733 Brc1ccccc1COc2ccc3cccnc3c2 34a_100011216045_100000184730 [0,1,0,1,0,0|2,0,0]=4 16088 B21R3.218733 Brc1ccccc1COc2ccc3ccncc3c2 7a_100000752006_100000184730 [0,1,0,1,0,0|2,0,0]=4 16089 B21R3.218733 Brc1ccccc1COc2ccc3cnccc3c2 34a_100000046372_100000184730 [0,1,0,1,0,0|2,0,0]=4 16090 B21R3.218733 Brc1ccccc1COc2ccc3cnccc3c2 7a_100000046372_100000184730 [0,1,0,1,0,0|2,0,0]=4 16091 B21R3.218733 Brc1ccccc1COc2ccc3ncccc3c2 34a_100011215586_100000184730 [0,1,0,1,0,0|2,0,0]=4 16092 B21R3.218733 Brc1ccccc1COc2ccc3ncccc3c2 7a_100011215586_100000184730 [0,1,0,1,0,0|2,0,0]=4 16093 B21R3.218733 Brc1ccccc1COc2cnc3ccccc3c2 34a_100011934006_100000184730 [0,1,0,1,0,0|2,0,0]=4 16094 B21R3.218733 Brc1ccccc1COc2cnc3ccccc3c2 7a_100011934006_100000184730 [0,1,0,1,0,0|2,0,0]=4 16095 B21R3.218733 Brc1ccccc1CSc2ccc3ccccc3c2 62a_100000184730_100000233703 [0,1,0,1,0,0|1,1,0]=4 16096 B21R3.218733 Brc1ccccc1CSc2ccc3ccccc3n2 62a_100000184730_100011291633 [0,1,0,1,0,0|1,1,0]=4 16097 B21R3.218733 Brc1ccccc1CSc2ccc3ccccc3n2 62a_100011291633_100000184730 [0,1,0,1,0,0|1,1,0]=4 16098 B21R3.218733 Brc1cccnc1COc2ccc3ccccc3c2 34a_100000185828_100025702911 [0,1,0,1,0,0|2,0,0]=4 16099 B21R3.218733 Brc1cccnc1COc2ccc3ccccc3c2 7a_100000185828_100025702911 [0,1,0,1,0,0|2,0,0]=4 16100 B21R3.218733 Brc1ncccc1COc2ccc3ccccc3c2 34a_100000185828_100010140945 [0,1,0,1,0,0|2,0,0]=4 16101 B21R3.218733 Brc1ncccc1COc2ccc3ccccc3c2 7a_100000185828_100010140945 [0,1,0,1,0,0|2,0,0]=4 16102 B21R3.218733 Cc1ccccc1CNc2ccc3ccccc3c2 207a_100000211940_100000211143 [0,1,0,1,0,0|2,0,0]=4 16103 B21R3.218733 Cc1ccccc1CNc2ccc3ccccc3c2 270302a_100000211940_100000211143 [0,1,0,1,0,0|2,0,0]=4 16104 B21R3.218733 Cc1ccccc1CNc2ccc3ccccc3c2 34a_100000211940_100000211839 [0,1,0,1,0,0|2,0,0]=4 16105 B21R3.218733 Cc1ccccc1CNc2ccc3ccccc3c2 7a_100000211940_100000211839 [0,1,0,1,0,0|2,0,0]=4 16106 B21R3.218733 Cc1ccccc1CNc2ccc3ccccc3n2 27a_100000174972_100011291633 [0,1,0,1,0,0|2,0,0]=4 16107 B21R3.218733 Cc1ccccc1COc2ccc3ccccc3c2 34a_100000185828_100000211839 [0,1,0,1,0,0|1,0,0]=3 16108 B21R3.218733 Cc1ccccc1COc2ccc3ccccc3c2 7a_100000185828_100000211839 [0,1,0,1,0,0|1,0,0]=3 16109 B21R3.218733 Cc1ccccc1COc2ccc3cccnc3c2 34a_100011216045_100000211839 [0,1,0,1,0,0|2,0,0]=4 16110 B21R3.218733 Cc1ccccc1COc2ccc3ccncc3c2 7a_100000752006_100000211839 [0,1,0,1,0,0|2,0,0]=4 16111 B21R3.218733 Cc1ccccc1COc2ccc3cnccc3c2 34a_100000046372_100000211839 [0,1,0,1,0,0|2,0,0]=4 16112 B21R3.218733 Cc1ccccc1COc2ccc3cnccc3c2 7a_100000046372_100000211839 [0,1,0,1,0,0|2,0,0]=4 16113 B21R3.218733 Cc1ccccc1COc2ccc3ncccc3c2 34a_100011215586_100000211839 [0,1,0,1,0,0|2,0,0]=4 16114 B21R3.218733 Cc1ccccc1COc2ccc3ncccc3c2 7a_100011215586_100000211839 [0,1,0,1,0,0|2,0,0]=4 16115 B21R3.218733 Cc1ccccc1COc2cnc3ccccc3c2 34a_100011934006_100000211839 [0,1,0,1,0,0|2,0,0]=4 16116 B21R3.218733 Cc1ccccc1COc2cnc3ccccc3c2 7a_100011934006_100000211839 [0,1,0,1,0,0|2,0,0]=4 16117 B21R3.218733 Cc1ccccc1CSc2ccc3ccccc3c2 62a_100000211839_100000233703 [0,1,0,1,0,0|1,1,0]=4 16118 B21R3.218733 Cc1ccccc1CSc2ccc3ccccc3n2 62a_100000211839_100011291633 [0,1,0,1,0,0|1,1,0]=4 16119 B21R3.218733 Cc1ccccc1CSc2ccc3ccccc3n2 62a_100011291633_100000211839 [0,1,0,1,0,0|1,1,0]=4 16120 B21R3.218733 Cc1cccnc1COc2ccc3ccccc3c2 34a_100000185828_100000696600 [0,1,0,1,0,0|2,0,0]=4 16121 B21R3.218733 Cc1cccnc1COc2ccc3ccccc3c2 7a_100000185828_100000696600 [0,1,0,1,0,0|2,0,0]=4 16122 B21R3.218733 Cc1ccncc1COc2ccc3ccccc3c2 34a_100000185828_100000690890 [0,1,0,1,0,0|2,0,0]=4 16123 B21R3.218733 Cc1ccncc1COc2ccc3ccccc3c2 7a_100000185828_100000690890 [0,1,0,1,0,0|2,0,0]=4 16124 B21R3.218733 Cc1cnccc1COc2ccc3ccccc3c2 34a_100000185828_100020672809 [0,1,0,1,0,0|2,0,0]=4 16125 B21R3.218733 Cc1cnccc1COc2ccc3ccccc3c2 7a_100000185828_100020672808 [0,1,0,1,0,0|2,0,0]=4 16126 B21R3.218733 Cc1ncccc1COc2ccc3ccccc3c2 34a_100000185828_100000732876 [0,1,0,1,0,0|2,0,0]=4 16127 B21R3.218733 Cc1ncccc1COc2ccc3ccccc3c2 7a_100000185828_100000732876 [0,1,0,1,0,0|2,0,0]=4 16128 B21R3.218733 Clc1ccccc1CNc2ccc3ccccc3c2 207a_100000211940_100000210073 [0,1,0,1,0,0|2,0,0]=4 16129 B21R3.218733 Clc1ccccc1CNc2ccc3ccccc3c2 270302a_100000211940_100000210073 [0,1,0,1,0,0|2,0,0]=4 16130 B21R3.218733 Clc1ccccc1CNc2ccc3ccccc3c2 34a_100000211940_100000187162 [0,1,0,1,0,0|2,0,0]=4 16131 B21R3.218733 Clc1ccccc1CNc2ccc3ccccc3c2 7a_100000211940_100000187162 [0,1,0,1,0,0|2,0,0]=4 16132 B21R3.218733 Clc1ccccc1CNc2ccc3ccccc3n2 27a_100000174879_100011291633 [0,1,0,1,0,0|2,0,0]=4 16133 B21R3.218733 Clc1ccccc1COc2ccc3ccccc3c2 34a_100000185828_100000187162 [0,1,0,1,0,0|1,0,0]=3 16134 B21R3.218733 Clc1ccccc1COc2ccc3ccccc3c2 7a_100000185828_100000187162 [0,1,0,1,0,0|1,0,0]=3 16135 B21R3.218733 Clc1ccccc1COc2ccc3cccnc3c2 34a_100011216045_100000187162 [0,1,0,1,0,0|2,0,0]=4 16136 B21R3.218733 Clc1ccccc1COc2ccc3ccncc3c2 7a_100000752006_100000187162 [0,1,0,1,0,0|2,0,0]=4 16137 B21R3.218733 Clc1ccccc1COc2ccc3cnccc3c2 34a_100000046372_100000187162 [0,1,0,1,0,0|2,0,0]=4 16138 B21R3.218733 Clc1ccccc1COc2ccc3cnccc3c2 7a_100000046372_100000187162 [0,1,0,1,0,0|2,0,0]=4 16139 B21R3.218733 Clc1ccccc1COc2ccc3ncccc3c2 34a_100011215586_100000187162 [0,1,0,1,0,0|2,0,0]=4 16140 B21R3.218733 Clc1ccccc1COc2ccc3ncccc3c2 7a_100011215586_100000187162 [0,1,0,1,0,0|2,0,0]=4 16141 B21R3.218733 Clc1ccccc1COc2cnc3ccccc3c2 34a_100011934006_100000187162 [0,1,0,1,0,0|2,0,0]=4 16142 B21R3.218733 Clc1ccccc1COc2cnc3ccccc3c2 7a_100011934006_100000187162 [0,1,0,1,0,0|2,0,0]=4 16143 B21R3.218733 Clc1ccccc1CSc2ccc3ccccc3c2 62a_100000187162_100000233703 [0,1,0,1,0,0|1,1,0]=4 16144 B21R3.218733 Clc1ccccc1CSc2ccc3ccccc3n2 62a_100000187162_100011291633 [0,1,0,1,0,0|1,1,0]=4 16145 B21R3.218733 Clc1ccccc1CSc2ccc3ccccc3n2 62a_100011291633_100000187162 [0,1,0,1,0,0|1,1,0]=4 16146 B21R3.218733 Clc1cccnc1COc2ccc3ccccc3c2 7a_100000185828_100000099807 [0,1,0,1,0,0|2,0,0]=4 16147 B21R3.218733 Clc1cnccc1COc2ccc3ccccc3c2 7a_100000185828_100000763264 [0,1,0,1,0,0|2,0,0]=4 16148 B21R3.218733 Clc1ncccc1COc2ccc3ccccc3c2 34a_100000185828_100000045678 [0,1,0,1,0,0|2,0,0]=4 16149 B21R3.218733 Clc1ncccc1COc2ccc3ccccc3c2 7a_100000185828_100000045678 [0,1,0,1,0,0|2,0,0]=4 16150 B21R3.218733 Fc1ccccc1CNc2ccc3ccccc3c2 207a_100000211940_100000210811 [0,1,0,1,0,0|2,0,0]=4 16151 B21R3.218733 Fc1ccccc1CNc2ccc3ccccc3c2 270302a_100000211940_100000210811 [0,1,0,1,0,0|2,0,0]=4 16152 B21R3.218733 Fc1ccccc1CNc2ccc3ccccc3c2 34a_100000211940_100000211605 [0,1,0,1,0,0|2,0,0]=4 16153 B21R3.218733 Fc1ccccc1CNc2ccc3ccccc3c2 7a_100000211940_100000211605 [0,1,0,1,0,0|2,0,0]=4 16154 B21R3.218733 Fc1ccccc1CNc2ccc3ccccc3n2 27a_100000174869_100011291633 [0,1,0,1,0,0|2,0,0]=4 16155 B21R3.218733 Fc1ccccc1COc2ccc3ccccc3c2 34a_100000185828_100000211605 [0,1,0,1,0,0|1,0,0]=3 16156 B21R3.218733 Fc1ccccc1COc2ccc3ccccc3c2 7a_100000185828_100000211605 [0,1,0,1,0,0|1,0,0]=3 16157 B21R3.218733 Fc1ccccc1COc2ccc3cccnc3c2 34a_100011216045_100000211605 [0,1,0,1,0,0|2,0,0]=4 16158 B21R3.218733 Fc1ccccc1COc2ccc3ccncc3c2 7a_100000752006_100000211605 [0,1,0,1,0,0|2,0,0]=4 16159 B21R3.218733 Fc1ccccc1COc2ccc3cnccc3c2 34a_100000046372_100000211605 [0,1,0,1,0,0|2,0,0]=4 16160 B21R3.218733 Fc1ccccc1COc2ccc3cnccc3c2 7a_100000046372_100000211605 [0,1,0,1,0,0|2,0,0]=4 16161 B21R3.218733 Fc1ccccc1COc2ccc3ncccc3c2 34a_100011215586_100000211605 [0,1,0,1,0,0|2,0,0]=4 16162 B21R3.218733 Fc1ccccc1COc2ccc3ncccc3c2 7a_100011215586_100000211605 [0,1,0,1,0,0|2,0,0]=4 16163 B21R3.218733 Fc1ccccc1COc2cnc3ccccc3c2 34a_100011934006_100000211605 [0,1,0,1,0,0|2,0,0]=4 16164 B21R3.218733 Fc1ccccc1COc2cnc3ccccc3c2 7a_100011934006_100000211605 [0,1,0,1,0,0|2,0,0]=4 16165 B21R3.218733 Fc1ccccc1CSc2ccc3ccccc3c2 62a_100000211605_100000233703 [0,1,0,1,0,0|1,1,0]=4 16166 B21R3.218733 Fc1ccccc1CSc2ccc3ccccc3n2 62a_100000211605_100011291633 [0,1,0,1,0,0|1,1,0]=4 16167 B21R3.218733 Fc1ccccc1CSc2ccc3ccccc3n2 62a_100011291633_100000211605 [0,1,0,1,0,0|1,1,0]=4 16168 B21R3.218733 Fc1cccnc1COc2ccc3ccccc3c2 34a_100000185828_100000104219 [0,1,0,1,0,0|2,0,0]=4 16169 B21R3.218733 Fc1cccnc1COc2ccc3ccccc3c2 7a_100000185828_100000104219 [0,1,0,1,0,0|2,0,0]=4 16170 B21R3.218733 Fc1ncccc1COc2ccc3ccccc3c2 34a_100000185828_100000099810 [0,1,0,1,0,0|2,0,0]=4 16171 B21R3.218733 Fc1ncccc1COc2ccc3ccccc3c2 7a_100000185828_100000099810 [0,1,0,1,0,0|2,0,0]=4 16172 B21R3.218733 Ic1ccccc1CNc2ccc3ccccc3c2 207a_100000211940_100000010305 [0,1,0,1,0,0|2,0,0]=4 16173 B21R3.218733 Ic1ccccc1CNc2ccc3ccccc3c2 34a_100000211940_100011215278 [0,1,0,1,0,0|2,0,0]=4 16174 B21R3.218733 Ic1ccccc1CNc2ccc3ccccc3c2 7a_100000211940_100011215278 [0,1,0,1,0,0|2,0,0]=4 16175 B21R3.218733 Ic1ccccc1CNc2ccc3ccccc3n2 27a_100015347259_100011291633 [0,1,0,1,0,0|2,0,0]=4 16176 B21R3.218733 Ic1ccccc1COc2ccc3ccccc3c2 34a_100000185828_100011215278 [0,1,0,1,0,0|1,0,0]=3 16177 B21R3.218733 Ic1ccccc1COc2ccc3ccccc3c2 7a_100000185828_100011215278 [0,1,0,1,0,0|1,0,0]=3 16178 B21R3.218733 Ic1ccccc1COc2ccc3cccnc3c2 34a_100011216045_100011215278 [0,1,0,1,0,0|2,0,0]=4 16179 B21R3.218733 Ic1ccccc1COc2ccc3ccncc3c2 7a_100000752006_100011215278 [0,1,0,1,0,0|2,0,0]=4 16180 B21R3.218733 Ic1ccccc1COc2ccc3cnccc3c2 34a_100000046372_100011215278 [0,1,0,1,0,0|2,0,0]=4 16181 B21R3.218733 Ic1ccccc1COc2ccc3cnccc3c2 7a_100000046372_100011215278 [0,1,0,1,0,0|2,0,0]=4 16182 B21R3.218733 Ic1ccccc1COc2ccc3ncccc3c2 34a_100011215586_100011215278 [0,1,0,1,0,0|2,0,0]=4 16183 B21R3.218733 Ic1ccccc1COc2ccc3ncccc3c2 7a_100011215586_100011215278 [0,1,0,1,0,0|2,0,0]=4 16184 B21R3.218733 Ic1ccccc1COc2cnc3ccccc3c2 34a_100011934006_100011215278 [0,1,0,1,0,0|2,0,0]=4 16185 B21R3.218733 Ic1ccccc1COc2cnc3ccccc3c2 7a_100011934006_100011215278 [0,1,0,1,0,0|2,0,0]=4 16186 B21R3.218733 Ic1ccccc1CSc2ccc3ccccc3c2 62a_100011216222_100000233703 [0,1,0,1,0,0|1,1,0]=4 16187 B21R3.218733 Ic1ccccc1CSc2ccc3ccccc3n2 62a_100011216222_100011291633 [0,1,0,1,0,0|1,1,0]=4 16188 B21R3.218733 Ic1ccccc1CSc2ccc3ccccc3n2 62a_100011291633_100011216222 [0,1,0,1,0,0|1,1,0]=4 16189 B21R3.218733 Oc1ccccc1CNc2ccc3ccccc3c2 270302a_100000211940_100000185834 [0,1,0,1,0,0|2,0,0]=4 16190 B21R3.218733 Oc1ccccc1CNc2ccc3ccccc3n2 27a_100000185550_100011291633 [0,1,0,1,0,0|2,0,0]=4 16191 B21R3.218733 Oc1cccnc1COc2ccc3ccccc3c2 34a_100000185828_200020655725 [0,1,0,1,0,0|2,0,0]=4 16192 B21R3.218733 Oc1cccnc1COc2ccc3ccccc3c2 7a_100000185828_200020655725 [0,1,0,1,0,0|2,0,0]=4 16193 B21R3.397713 Brc1ccnc2c1ccc(c2)OCc3ccccc3 34a_100010204257_100015291786 [0,1,0,1,0,0|2,0,0]=4 16194 B21R3.397713 Brc1ccnc2c1ccc(c2)OCc3ccccc3 7a_100010204257_100000211182 [0,1,0,1,0,0|2,0,0]=4 16195 B21R3.397713 Cc1ccnc2c1ccc(c2)OCc3ccccc3 34a_200009854145_100015291786 [0,1,0,1,0,0|2,0,0]=4 16196 B21R3.397713 Cc1ccnc2c1ccc(c2)OCc3ccccc3 7a_200009854145_100000211182 [0,1,0,1,0,0|2,0,0]=4 16197 B21R3.397713 Clc1ccnc2c1ccc(c2)OCc3ccccc3 34a_100000045489_100015291786 [0,1,0,1,0,0|2,0,0]=4 16198 B21R3.397713 Clc1ccnc2c1ccc(c2)OCc3ccccc3 7a_100000045489_100000211182 [0,1,0,1,0,0|2,0,0]=4 16199 B21R3.397713 Clc1nccc2c1ccc(c2)OCc3ccccc3 34a_100009867704_100015291786 [0,1,0,1,0,0|2,0,0]=4 16200 B21R3.397713 Clc1nccc2c1ccc(c2)OCc3ccccc3 7a_100009867704_100000211182 [0,1,0,1,0,0|2,0,0]=4 16201 B21R3.397713 Fc1cccc2c1ncc(c2)OCc3ccccc3 34a_100012184956_100015291786 [0,1,0,1,0,0|2,0,0]=4 16202 B21R3.397713 Fc1cccc2c1ncc(c2)OCc3ccccc3 7a_100012184956_100000211182 [0,1,0,1,0,0|2,0,0]=4 16203 B21R3.397713 Nc1cccc2c1ccc(c2)OCc3ccccc3 34a_100000034668_100015291786 [0,1,0,1,0,0|1,0,0]=3 16204 B21R3.397713 Nc1cccc2c1ccc(c2)OCc3ccccc3 7a_100000034668_100000211182 [0,1,0,1,0,0|1,0,0]=3 16205 B21R3.397713 Nc1cccc2c1ccc(c2)OCc3ccccn3 34a_100000034668_100000721315 [0,1,0,1,0,0|2,0,0]=4 16206 B21R3.397713 Nc1cccc2c1ccc(c2)OCc3ccccn3 7a_100000034668_100000721315 [0,1,0,1,0,0|2,0,0]=4 16207 B21R3.397713 Nc1cccc2c1ccc(c2)OCc3cccnc3 34a_100000034668_100000733263 [0,1,0,1,0,0|2,0,0]=4 16208 B21R3.397713 Nc1cccc2c1ccc(c2)OCc3cccnc3 7a_100000034668_100000741622 [0,1,0,1,0,0|2,0,0]=4 16209 B21R3.397713 Nc1cccc2c1ccc(c2)OCc3ccncc3 7a_100000034668_100015193705 [0,1,0,1,0,0|2,0,0]=4 16210 B21R3.397713 Nc1cccc2c1ccc(c2)SCc3ccccc3 62a_100000211182_100010090037 [0,1,0,1,0,0|1,1,0]=4 16211 B21R3.397713 Nc1cccc2c1ccc(c2)SCc3ccccc3 62a_100010090037_100015291786 [0,1,0,1,0,0|1,1,0]=4 16212 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCc3ccccc3 34a_100009857879_100015291786 [0,1,0,1,0,0|2,0,0]=4 16213 B21R3.397713 O=c1[nH]ccc2c1ccc(c2)OCc3ccccc3 7a_100009857879_100000211182 [0,1,0,1,0,0|2,0,0]=4 16214 B21R3.397713 O=c1ccoc2c1ccc(c2)OCc3ccccc3 34a_200000065989_100015291786 [0,1,0,1,0,0|2,0,0]=4 16215 B21R3.397713 O=c1ccoc2c1ccc(c2)OCc3ccccc3 7a_200000065989_100000211182 [0,1,0,1,0,0|2,0,0]=4 16216 B21R3.397713 Oc1cccc2c1ccc(c2)NCc3ccccc3 34a_100000035793_100015291786 [0,1,0,1,0,0|2,0,0]=4 16217 B21R3.397713 Oc1cccc2c1ccc(c2)NCc3ccccc3 7a_100000035793_100000211182 [0,1,0,1,0,0|2,0,0]=4 16218 B21R3.397713 Oc1cccc2c1ccc(c2)SCc3ccccc3 62a_100000211182_100010202202 [0,1,0,1,0,0|1,1,0]=4 16219 B21R3.397713 Oc1ccnc2c1ccc(c2)OCc3ccccc3 271570a_203496583355_100012351436 [0,1,0,1,0,0|2,0,0]=4 16220 B21R3.2280253 CC(OCc1ccccc1)c2cc3ccccc3o2 34a_100000198572_100015291786 [0,1,0,1,0,0|1,0,1]=4 16221 B21R3.2280253 CC(OCc1ccccc1)c2cc3ccccc3o2 7a_100000198572_100000211182 [0,1,0,1,0,0|1,0,1]=4 16222 B21R3.2280253 O=C(C=Cc1ccccc1)C2Cc3ccccc3C2 1458a_100000210462_100000753484 [0,1,0,1,0,0|1,0,0]=3 16223 B21R3.2280253 O=C(C=Cc1ccccc1)N2Cc3ccccc3C2 11a_100000752595_100000210462 [0,1,0,1,0,0|1,0,0]=3 16224 B21R3.2280253 O=C(C=Cc1ccccc1)N2Cc3ccccc3C2 1626a_100000752595_100000210462 [0,1,0,1,0,0|1,0,0]=3 16225 B21R3.2280253 O=C(C=Cc1ccccc1)N2Cc3cccnc3C2 11a_100000726175_100000210462 [0,1,0,1,0,0|2,0,0]=4 16226 B21R3.2280253 O=C(C=Cc1ccccc1)N2Cc3cccnc3C2 1626a_100000726175_100000210462 [0,1,0,1,0,0|2,0,0]=4 16227 B21R3.2280253 O=C(C=Cc1ccccc1)N2Cc3ccncc3C2 11a_100000730608_100000210462 [0,1,0,1,0,0|2,0,0]=4 16228 B21R3.2280253 O=C(C=Cc1ccccc1)N2Cc3ccncc3C2 1626a_100000730608_100000210462 [0,1,0,1,0,0|2,0,0]=4 16229 B21R3.2280253 O=C(C=Cc1ccccn1)C2Cc3ccccc3C2 1458a_100000740811_100000753484 [0,1,0,1,0,0|2,0,0]=4 16230 B21R3.2280253 O=C(C=Cc1ccccn1)N2Cc3ccccc3C2 11a_100000752595_100000740811 [0,1,0,1,0,0|2,0,0]=4 16231 B21R3.2280253 O=C(C=Cc1ccccn1)N2Cc3ccccc3C2 240690a_100000752595_100000740811 [0,1,0,1,0,0|2,0,0]=4 16232 B21R3.2280253 O=C(C=Cc1cccnc1)C2Cc3ccccc3C2 1458a_100000735890_100000753484 [0,1,0,1,0,0|2,0,0]=4 16233 B21R3.2280253 O=C(C=Cc1cccnc1)N2Cc3ccccc3C2 11a_100000752595_100000735890 [0,1,0,1,0,0|2,0,0]=4 16234 B21R3.2280253 O=C(C=Cc1cccnc1)N2Cc3ccccc3C2 240690a_100000752595_100000735890 [0,1,0,1,0,0|2,0,0]=4 16235 B21R3.2280253 O=C(C=Cc1ccncc1)C2Cc3ccccc3C2 1458a_100000682801_100000753484 [0,1,0,1,0,0|2,0,0]=4 16236 B21R3.2280253 O=C(C=Cc1ccncc1)N2Cc3ccccc3C2 240690a_100000752595_100000682801 [0,1,0,1,0,0|2,0,0]=4 16237 B21R3.2280253 O=C(CCc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_100000765856 [0,1,0,1,0,0|1,0,0]=3 16238 B21R3.2280253 O=C(CCc1ccccn1)C2=Cc3ccccc3C2 1458a_100009862756_100015183660 [0,1,0,1,0,0|2,0,0]=4 16239 B21R3.2280253 O=C(CCc1cccnc1)C2=Cc3ccccc3C2 1458a_100009862756_200011713674 [0,1,0,1,0,0|2,0,0]=4 16240 B21R3.2280253 O=C(CCc1ccncc1)C2=Cc3ccccc3C2 1458a_100009862756_100000723409 [0,1,0,1,0,0|2,0,0]=4 16241 B21R3.2280253 O=C(COc1ccccc1)c2cc3ccccc3s2 7a_100000210340_100012351422 [0,1,0,1,0,0|2,0,0]=4 16242 B21R3.2280253 O=C(CSc1ccccc1)c2cc3ccccc3o2 62a_100000719477_100000209828 [0,1,0,1,0,0|2,0,0]=4 16243 B21R3.2280253 O=C(CSc1ccccc1)c2cc3ccccc3s2 62a_100012351422_100000041952 [0,1,0,1,0,0|2,0,0]=4 16244 B21R3.2280253 O=C(NCc1ccccc1)C2=Cc3ccccc3C2 11a_100015324214_100009862756 [0,1,0,1,0,0|1,0,0]=3 16245 B21R3.2280253 O=C(NCc1ccccc1)C2=Cc3ccccc3C2 1626a_100015324214_100009862756 [0,1,0,1,0,0|1,0,0]=3 16246 B21R3.2280253 O=C(NCc1ccccc1)C2=Cc3ccccc3C2 240690a_100015324214_100009862756 [0,1,0,1,0,0|1,0,0]=3 16247 B21R3.2280253 O=C(NCc1ccccn1)C2=Cc3ccccc3C2 11a_100000210449_100009862756 [0,1,0,1,0,0|2,0,0]=4 16248 B21R3.2280253 O=C(NCc1ccccn1)C2=Cc3ccccc3C2 1626a_100000210449_100009862756 [0,1,0,1,0,0|2,0,0]=4 16249 B21R3.2280253 O=C(NCc1ccccn1)C2=Cc3ccccc3C2 240690a_100000210449_100009862756 [0,1,0,1,0,0|2,0,0]=4 16250 B21R3.2280253 O=C(NCc1cccnc1)C2=Cc3ccccc3C2 11a_100000210453_100009862756 [0,1,0,1,0,0|2,0,0]=4 16251 B21R3.2280253 O=C(NCc1cccnc1)C2=Cc3ccccc3C2 240690a_100000210453_100009862756 [0,1,0,1,0,0|2,0,0]=4 16252 B21R3.2280253 O=C(NCc1ccncc1)C2=Cc3ccccc3C2 11a_100000210450_100009862756 [0,1,0,1,0,0|2,0,0]=4 16253 B21R3.2280253 O=C(NCc1ccncc1)C2=Cc3ccccc3C2 1626a_100000210450_100009862756 [0,1,0,1,0,0|2,0,0]=4 16254 B21R3.2280253 O=C(NCc1ccncc1)C2=Cc3ccccc3C2 240690a_100000210450_100009862756 [0,1,0,1,0,0|2,0,0]=4 16255 B21R3.2280253 O=C(NNc1ccccc1)C2=Cc3ccccc3C2 22a_100015195140_100009862756 [0,1,0,1,0,0|2,0,0]=4 16256 B21R3.505 Brc1cc2ccccc2cc1NCc3ccccc3 34a_100009991566_100015291786 [0,1,0,1,0,0|2,0,0]=4 16257 B21R3.505 Brc1cc2ccccc2cc1NCc3ccccc3 7a_100009991566_100000211182 [0,1,0,1,0,0|2,0,0]=4 16258 B21R3.505 Brc1cc2ccccc2cc1OCc3ccccc3 34a_100009817189_100015291786 [0,1,0,1,0,0|1,0,0]=3 16259 B21R3.505 Brc1cc2ccccc2cc1OCc3ccccc3 7a_100009817189_100000211182 [0,1,0,1,0,0|1,0,0]=3 16260 B21R3.505 Brc1cc2ccccc2cc1OCc3ccccn3 34a_100009817189_100000721315 [0,1,0,1,0,0|2,0,0]=4 16261 B21R3.505 Brc1cc2ccccc2cc1OCc3ccccn3 7a_100009817189_100000721315 [0,1,0,1,0,0|2,0,0]=4 16262 B21R3.505 Brc1cc2ccccc2cc1OCc3cccnc3 34a_100009817189_100000733263 [0,1,0,1,0,0|2,0,0]=4 16263 B21R3.505 Brc1cc2ccccc2cc1OCc3cccnc3 7a_100009817189_100000741622 [0,1,0,1,0,0|2,0,0]=4 16264 B21R3.505 Brc1cc2ccccc2cc1OCc3ccncc3 7a_100009817189_100015193705 [0,1,0,1,0,0|2,0,0]=4 16265 B21R3.505 Brc1cc2ccccc2cc1SCc3ccccc3 62a_100000211182_200010169544 [0,1,0,1,0,0|1,1,0]=4 16266 B21R3.505 Brc1cc2ccccc2cc1SCc3ccccc3 62a_200010169544_100015291786 [0,1,0,1,0,0|1,1,0]=4 16267 B21R3.505 Brc1cc2ccccc2nc1SCc3ccccc3 62a_100000211182_100010072790 [0,1,0,1,0,0|1,1,0]=4 16268 B21R3.505 Brc1cc2ccccc2nc1SCc3ccccc3 62a_100010072790_100015291786 [0,1,0,1,0,0|1,1,0]=4 16269 B21R3.505 Brc1cc2ncccc2cc1OCc3ccccc3 34a_200010153759_100015291786 [0,1,0,1,0,0|2,0,0]=4 16270 B21R3.505 Brc1cc2ncccc2cc1OCc3ccccc3 7a_200010153759_100000211182 [0,1,0,1,0,0|2,0,0]=4 16271 B21R3.505 Cc1cc2ccccc2cc1OCc3ccccc3 34a_100000091601_100015291786 [0,1,0,1,0,0|1,0,0]=3 16272 B21R3.505 Cc1cc2ccccc2cc1OCc3ccccc3 7a_100000091601_100000211182 [0,1,0,1,0,0|1,0,0]=3 16273 B21R3.505 Cc1cc2ccccc2cc1OCc3ccccn3 34a_100000091601_100000721315 [0,1,0,1,0,0|2,0,0]=4 16274 B21R3.505 Cc1cc2ccccc2cc1OCc3ccccn3 7a_100000091601_100000721315 [0,1,0,1,0,0|2,0,0]=4 16275 B21R3.505 Cc1cc2ccccc2cc1OCc3cccnc3 34a_100000091601_100000733263 [0,1,0,1,0,0|2,0,0]=4 16276 B21R3.505 Cc1cc2ccccc2cc1OCc3cccnc3 7a_100000091601_100000741622 [0,1,0,1,0,0|2,0,0]=4 16277 B21R3.505 Cc1cc2ccccc2cc1OCc3ccncc3 7a_100000091601_100015193705 [0,1,0,1,0,0|2,0,0]=4 16278 B21R3.505 Cc1cc2ccccc2nc1NCc3ccccc3 27a_100015324214_100000751756 [0,1,0,1,0,0|2,0,0]=4 16279 B21R3.505 Cc1cc2ccccc2nc1SCc3ccccc3 62a_100000211182_100000751756 [0,1,0,1,0,0|1,1,0]=4 16280 B21R3.505 Cc1nc2ccccc2cc1OCc3ccccc3 34a_200000079175_100015291786 [0,1,0,1,0,0|2,0,0]=4 16281 B21R3.505 Cc1nc2ccccc2cc1OCc3ccccc3 7a_200000079175_100000211182 [0,1,0,1,0,0|2,0,0]=4 16282 B21R3.505 Clc1cc2ccccc2cc1SCc3ccccc3 62a_100000211182_100010152806 [0,1,0,1,0,0|1,1,0]=4 16283 B21R3.505 Clc1cc2ccccc2cc1SCc3ccccc3 62a_100010152806_100015291786 [0,1,0,1,0,0|1,1,0]=4 16284 B21R3.505 Clc1nc2ccccc2cc1OCc3ccccc3 34a_200000100762_100015291786 [0,1,0,1,0,0|2,0,0]=4 16285 B21R3.505 Clc1nc2ccccc2cc1OCc3ccccc3 7a_200000100762_100000211182 [0,1,0,1,0,0|2,0,0]=4 16286 B21R3.505 Nc1cc2ccccc2cc1OCc3ccccc3 34a_106744474703_100015291786 [0,1,0,1,0,0|1,0,0]=3 16287 B21R3.505 Nc1cc2ccccc2cc1OCc3ccccc3 7a_106744474703_100000211182 [0,1,0,1,0,0|1,0,0]=3 16288 B21R3.505 Nc1cc2ccccc2cc1OCc3ccccn3 34a_106744474703_100000721315 [0,1,0,1,0,0|2,0,0]=4 16289 B21R3.505 Nc1cc2ccccc2cc1OCc3ccccn3 7a_106744474703_100000721315 [0,1,0,1,0,0|2,0,0]=4 16290 B21R3.505 Nc1cc2ccccc2cc1OCc3cccnc3 34a_106744474703_100000733263 [0,1,0,1,0,0|2,0,0]=4 16291 B21R3.505 Nc1cc2ccccc2cc1OCc3cccnc3 7a_106744474703_100000741622 [0,1,0,1,0,0|2,0,0]=4 16292 B21R3.505 Nc1cc2ccccc2cc1OCc3ccncc3 7a_106744474703_100015193705 [0,1,0,1,0,0|2,0,0]=4 16293 B21R3.505 Nc1cc2ccccc2cc1SCc3ccccc3 62a_100000211182_100009991566 [0,1,0,1,0,0|1,1,0]=4 16294 B21R3.505 Nc1cc2ccccc2cc1SCc3ccccc3 62a_100009991566_100015291786 [0,1,0,1,0,0|1,1,0]=4 16295 B21R3.505 O=c1oc2ccccc2cc1OCc3ccccc3 7a_100000061252_100000211182 [0,1,0,1,0,0|2,0,0]=4 16296 B21R3.505 Oc1cc2ccccc2cc1SCc3ccccc3 62a_100000211182_100009817189 [0,1,0,1,0,0|1,1,0]=4 16297 B21R3.505 Oc1cc2ccccc2nc1SCc3ccccc3 62a_100000211182_200000100762 [0,1,0,1,0,0|1,1,0]=4 16298 B21R3.24438 CN(Cc1ccccc1)c2ccc3ccccc3c2 2230a_100000181211_100015291786 [0,1,0,1,0,0|2,0,0]=4 16299 B21R3.24438 CN(Cc1ccccc1)c2ccc3ccccc3c2 2230a_100000224561_200000210301 [0,1,0,1,0,0|2,0,0]=4 16300 B21R3.24438 CN(Cc1ccccc1)c2ccc3ccccc3c2 269982a_100000181211_100000211182 [0,1,0,1,0,0|2,0,0]=4 16301 B21R3.24438 CN(Cc1ccccc1)c2ccc3ccccc3c2 269982a_100000224561_200000210301 [0,1,0,1,0,0|2,0,0]=4 16302 B21R3.24438 CN(Cc1ccccc1)c2ccc3ccccc3c2 34a_100000181211_100015291786 [0,1,0,1,0,0|2,0,0]=4 16303 B21R3.24438 CN(Cc1ccccc1)c2ccc3ccccc3c2 34a_100000224561_200000210301 [0,1,0,1,0,0|2,0,0]=4 16304 B21R3.24438 CN(Cc1ccccc1)c2ccc3ccccc3n2 27a_100000186898_100011291633 [0,1,0,1,0,0|2,0,0]=4 16305 B21R3.24438 O=C(Cc1ccccc1)c2ccc3ccccc3c2 1458a_100000210637_100015291786 [0,1,0,1,0,0|2,0,0]=4 16306 B21R3.24438 [13CH3]N(Cc1ccccc1)c2ccc3ccccc3c2 2230a_100000224561_200025704644 [0,1,0,1,0,0|2,0,0]=4 16307 B21R3.24438 [13CH3]N(Cc1ccccc1)c2ccc3ccccc3c2 269982a_100000224561_200025704644 [0,1,0,1,0,0|2,0,0]=4 16308 B21R3.24438 [13CH3]N(Cc1ccccc1)c2ccc3ccccc3c2 34a_100000224561_200025704644 [0,1,0,1,0,0|2,0,0]=4 16309 B21R3.24492 CC(Cc1ccc2ccccc2c1)c3ccccc3 271570a_100000062452_100000233703 [0,1,0,1,0,0|2,0,0]=4 16310 B21R3.24492 CC(Cc1ccc2ccccc2n1)c3ccccc3 271570a_100000062452_100011291633 [0,1,0,1,0,0|2,0,0]=4 16311 B21R3.24492 CC(Nc1ccc2ccccc2c1)c3ccccc3 34a_100000211940_100000211855 [0,1,0,1,0,0|2,0,0]=4 16312 B21R3.24492 CC(Nc1ccc2ccccc2c1)c3ccccc3 7a_100000211940_100000230085 [0,1,0,1,0,0|2,0,0]=4 16313 B21R3.24492 CC(Oc1ccc2ccccc2c1)c3ccccc3 34a_100000185828_100000211855 [0,1,0,1,0,0|1,0,0]=3 16314 B21R3.24492 CC(Oc1ccc2ccccc2c1)c3ccccc3 7a_100000185828_100000230085 [0,1,0,1,0,0|1,0,0]=3 16315 B21R3.24492 CC(Oc1ccc2cccnc2c1)c3ccccc3 34a_100011216045_100000211855 [0,1,0,1,0,0|2,0,0]=4 16316 B21R3.24492 CC(Oc1ccc2ccncc2c1)c3ccccc3 7a_100000752006_100000230085 [0,1,0,1,0,0|2,0,0]=4 16317 B21R3.24492 CC(Oc1ccc2cnccc2c1)c3ccccc3 34a_100000046372_100000211855 [0,1,0,1,0,0|2,0,0]=4 16318 B21R3.24492 CC(Oc1ccc2cnccc2c1)c3ccccc3 7a_100000046372_100000230085 [0,1,0,1,0,0|2,0,0]=4 16319 B21R3.24492 CC(Oc1ccc2ncccc2c1)c3ccccc3 34a_100011215586_100000211855 [0,1,0,1,0,0|2,0,0]=4 16320 B21R3.24492 CC(Oc1ccc2ncccc2c1)c3ccccc3 7a_100011215586_100000230085 [0,1,0,1,0,0|2,0,0]=4 16321 B21R3.24492 CC(Oc1cnc2ccccc2c1)c3ccccc3 34a_100011934006_100000211855 [0,1,0,1,0,0|2,0,0]=4 16322 B21R3.24492 CC(Oc1cnc2ccccc2c1)c3ccccc3 7a_100011934006_100000230085 [0,1,0,1,0,0|2,0,0]=4 16323 B21R3.24492 CC(Sc1ccc2ccccc2c1)c3ccccc3 62a_100000230085_100000233703 [0,1,0,1,0,0|1,1,0]=4 16324 B21R3.24492 CC(Sc1ccc2ccccc2n1)c3ccccc3 62a_100000230085_100011291633 [0,1,0,1,0,0|1,1,0]=4 16325 B21R3.24492 CC(Sc1ccc2ccccc2n1)c3ccccc3 62a_100011291633_100000230085 [0,1,0,1,0,0|1,1,0]=4 16326 B21R3.24492 C[C@@H](Nc1ccc2ccccc2n1)c3ccccc3 27a_100000751104_100011291633 [0,1,0,1,0,0|2,0,0]=4 16327 B21R3.444247 Brc1cc(cc2c1cccc2)NCc3ccccc3 207a_100010089974_100015611070 [0,1,0,1,0,0|2,0,0]=4 16328 B21R3.444247 Brc1cc(cc2c1cccc2)NCc3ccccc3 270302a_100010089974_100015611070 [0,1,0,1,0,0|2,0,0]=4 16329 B21R3.444247 Brc1cc(cc2c1cccc2)NCc3ccccc3 34a_100010089974_100015291786 [0,1,0,1,0,0|2,0,0]=4 16330 B21R3.444247 Brc1cc(cc2c1cccc2)NCc3ccccc3 7a_100010089974_100000211182 [0,1,0,1,0,0|2,0,0]=4 16331 B21R3.444247 Brc1cc(cc2c1cccc2)OCc3ccccc3 34a_100010001680_100015291786 [0,1,0,1,0,0|1,0,0]=3 16332 B21R3.444247 Brc1cc(cc2c1cccc2)OCc3ccccc3 7a_100010001680_100000211182 [0,1,0,1,0,0|1,0,0]=3 16333 B21R3.444247 Brc1cc(cc2c1cccc2)OCc3ccccn3 34a_100010001680_100000721315 [0,1,0,1,0,0|2,0,0]=4 16334 B21R3.444247 Brc1cc(cc2c1cccc2)OCc3ccccn3 7a_100010001680_100000721315 [0,1,0,1,0,0|2,0,0]=4 16335 B21R3.444247 Brc1cc(cc2c1cccc2)OCc3cccnc3 34a_100010001680_100000733263 [0,1,0,1,0,0|2,0,0]=4 16336 B21R3.444247 Brc1cc(cc2c1cccc2)OCc3cccnc3 7a_100010001680_100000741622 [0,1,0,1,0,0|2,0,0]=4 16337 B21R3.444247 Brc1cc(cc2c1cccc2)OCc3ccncc3 7a_100010001680_100015193705 [0,1,0,1,0,0|2,0,0]=4 16338 B21R3.444247 Brc1cc(cc2c1cncc2)OCc3ccccc3 34a_100011009069_100015291786 [0,1,0,1,0,0|2,0,0]=4 16339 B21R3.444247 Brc1cc(cc2c1cncc2)OCc3ccccc3 7a_100011009069_100000211182 [0,1,0,1,0,0|2,0,0]=4 16340 B21R3.444247 Cc1cc(nc2c1cccc2)NCc3ccccc3 27a_100015324214_100000184993 [0,1,0,1,0,0|2,0,0]=4 16341 B21R3.444247 Cc1cc(nc2c1cccc2)SCc3ccccc3 62a_100000211182_100000184993 [0,1,0,1,0,0|1,1,0]=4 16342 B21R3.444247 Cc1cc(nc2c1cccc2)SCc3ccccc3 62a_100012354972_100015291786 [0,1,0,1,0,0|1,1,0]=4 16343 B21R3.444247 Clc1cc(cc2c1nccc2)OCc3ccccc3 34a_100000097192_100015291786 [0,1,0,1,0,0|2,0,0]=4 16344 B21R3.444247 Clc1cc(cc2c1nccc2)OCc3ccccc3 7a_100000097192_100000211182 [0,1,0,1,0,0|2,0,0]=4 16345 B21R3.444247 Fc1cc(cc2c1nccc2)OCc3ccccc3 34a_100009888031_100015291786 [0,1,0,1,0,0|2,0,0]=4 16346 B21R3.444247 Fc1cc(cc2c1nccc2)OCc3ccccc3 7a_100009888031_100000211182 [0,1,0,1,0,0|2,0,0]=4 16347 B21R3.444247 Nc1cc(cc2c1cccc2)SCc3ccccc3 62a_100000211182_100010171453 [0,1,0,1,0,0|1,1,0]=4 16348 B21R3.444247 Nc1cc(cc2c1cccc2)SCc3ccccc3 62a_100010171453_100015291786 [0,1,0,1,0,0|1,1,0]=4 16349 B21R3.444247 Nc1cc(cc2c1nccc2)OCc3ccccc3 34a_100000083691_100015291786 [0,1,0,1,0,0|2,0,0]=4 16350 B21R3.444247 Nc1cc(nc2c1cccc2)SCc3ccccc3 62a_100010197925_100015291786 [0,1,0,1,0,0|1,1,0]=4 16351 B21R3.444247 O=c1cc([nH]c2c1cccc2)SCc3ccccc3 62a_100000211182_100000090176 [0,1,0,1,0,0|1,1,0]=4 16352 B21R3.444247 O=c1cc(nc2n1cccc2)OCc3ccccc3 34a_100000751361_100015291786 [0,1,0,1,0,0|2,0,0]=4 16353 B21R3.444247 Oc1cc(cc2c1cccc2)SCc3ccccc3 62a_100000211182_100010089979 [0,1,0,1,0,0|1,1,0]=4 16354 B21R3.3717181 O=C(CC(=O)C1Cc2c1cccc2)c3ccccc3 1458a_200000238571_100000211460 [0,1,0,1,0,0|1,0,1]=4 16355 B21R3.1099 O=Cc1ccc2ccccc2c1Sc3ccccc3 62a_100000719477_100009813496 [0,1,0,1,0,0|2,0,0]=4 16356 B21R3.1099 O=Cc1ccc2ccccc2c1Sc3ccccc3 62a_100009813496_100000041952 [0,1,0,1,0,0|2,0,0]=4 16357 B21R3.3944604 Brc1c(ccc2c1cccc2)NCc3ccccc3 34a_100000705303_100015291786 [0,1,0,1,0,0|2,0,0]=4 16358 B21R3.3944604 Brc1c(ccc2c1cccc2)OCc3ccccc3 34a_100000183829_100015291786 [0,1,0,1,0,0|1,0,0]=3 16359 B21R3.3944604 Brc1c(ccc2c1cccc2)OCc3ccccc3 7a_100000183829_100000211182 [0,1,0,1,0,0|1,0,0]=3 16360 B21R3.3944604 Brc1c(ccc2c1cccc2)OCc3ccccn3 34a_100000183829_100000721315 [0,1,0,1,0,0|2,0,0]=4 16361 B21R3.3944604 Brc1c(ccc2c1cccc2)OCc3ccccn3 7a_100000183829_100000721315 [0,1,0,1,0,0|2,0,0]=4 16362 B21R3.3944604 Brc1c(ccc2c1cccc2)OCc3cccnc3 34a_100000183829_100000733263 [0,1,0,1,0,0|2,0,0]=4 16363 B21R3.3944604 Brc1c(ccc2c1cccc2)OCc3cccnc3 7a_100000183829_100000741622 [0,1,0,1,0,0|2,0,0]=4 16364 B21R3.3944604 Brc1c(ccc2c1cccc2)OCc3ccncc3 7a_100000183829_100015193705 [0,1,0,1,0,0|2,0,0]=4 16365 B21R3.3944604 Brc1c(ccc2c1cccc2)SCc3ccccc3 62a_100000211182_200010089984 [0,1,0,1,0,0|1,1,0]=4 16366 B21R3.3944604 Brc1c(ccc2c1cccc2)SCc3ccccc3 62a_200010089984_100015291786 [0,1,0,1,0,0|1,1,0]=4 16367 B21R3.3944604 Brc1c(ccc2c1cncc2)OCc3ccccc3 34a_200010115057_100015291786 [0,1,0,1,0,0|2,0,0]=4 16368 B21R3.3944604 Brc1c(ccc2c1cncc2)OCc3ccccc3 7a_200010115057_100000211182 [0,1,0,1,0,0|2,0,0]=4 16369 B21R3.3944604 Brc1c(ccc2c1nccc2)OCc3ccccc3 34a_100010173343_100015291786 [0,1,0,1,0,0|2,0,0]=4 16370 B21R3.3944604 Brc1c(ccc2c1nccc2)OCc3ccccc3 7a_100010173343_100000211182 [0,1,0,1,0,0|2,0,0]=4 16371 B21R3.3944604 Cc1c(ccc2c1cccc2)OCc3ccccc3 34a_100009830054_100015291786 [0,1,0,1,0,0|1,0,0]=3 16372 B21R3.3944604 Cc1c(ccc2c1cccc2)OCc3ccccc3 7a_100009830054_100000211182 [0,1,0,1,0,0|1,0,0]=3 16373 B21R3.3944604 Cc1c(ccc2c1cccc2)OCc3ccccn3 34a_100009830054_100000721315 [0,1,0,1,0,0|2,0,0]=4 16374 B21R3.3944604 Cc1c(ccc2c1cccc2)OCc3ccccn3 7a_100009830054_100000721315 [0,1,0,1,0,0|2,0,0]=4 16375 B21R3.3944604 Cc1c(ccc2c1cccc2)OCc3cccnc3 34a_100009830054_100000733263 [0,1,0,1,0,0|2,0,0]=4 16376 B21R3.3944604 Cc1c(ccc2c1cccc2)OCc3cccnc3 7a_100009830054_100000741622 [0,1,0,1,0,0|2,0,0]=4 16377 B21R3.3944604 Cc1c(ccc2c1cccc2)OCc3ccncc3 7a_100009830054_100015193705 [0,1,0,1,0,0|2,0,0]=4 16378 B21R3.3944604 Cc1c(ccc2c1cccc2)SCc3ccccc3 62a_100000211182_100010221197 [0,1,0,1,0,0|1,1,0]=4 16379 B21R3.3944604 Cc1c(ccc2c1cccc2)SCc3ccccc3 62a_100010221197_100015291786 [0,1,0,1,0,0|1,1,0]=4 16380 B21R3.3944604 Clc1c(ccc2c1cccc2)NCc3ccccc3 34a_100000075557_100015291786 [0,1,0,1,0,0|2,0,0]=4 16381 B21R3.3944604 Clc1c(ccc2c1cccc2)OCc3ccccc3 34a_100000029778_100015291786 [0,1,0,1,0,0|1,0,0]=3 16382 B21R3.3944604 Clc1c(ccc2c1cccc2)OCc3ccccc3 7a_100000029778_100000211182 [0,1,0,1,0,0|1,0,0]=3 16383 B21R3.3944604 Clc1c(ccc2c1cccc2)OCc3ccccn3 34a_100000029778_100000721315 [0,1,0,1,0,0|2,0,0]=4 16384 B21R3.3944604 Clc1c(ccc2c1cccc2)OCc3ccccn3 7a_100000029778_100000721315 [0,1,0,1,0,0|2,0,0]=4 16385 B21R3.3944604 Clc1c(ccc2c1cccc2)OCc3cccnc3 34a_100000029778_100000733263 [0,1,0,1,0,0|2,0,0]=4 16386 B21R3.3944604 Clc1c(ccc2c1cccc2)OCc3cccnc3 7a_100000029778_100000741622 [0,1,0,1,0,0|2,0,0]=4 16387 B21R3.3944604 Clc1c(ccc2c1cccc2)OCc3ccncc3 7a_100000029778_100015193705 [0,1,0,1,0,0|2,0,0]=4 16388 B21R3.3944604 Clc1c(ccc2c1ccnc2)OCc3ccccc3 34a_100009824633_100015291786 [0,1,0,1,0,0|2,0,0]=4 16389 B21R3.3944604 Clc1c(ccc2c1ccnc2)OCc3ccccc3 7a_100009824633_100000211182 [0,1,0,1,0,0|2,0,0]=4 16390 B21R3.3944604 Fc1c(ccc2c1cccc2)SCc3ccccc3 62a_100000211182_100009832041 [0,1,0,1,0,0|1,1,0]=4 16391 B21R3.3944604 Fc1c(ccc2c1cccc2)SCc3ccccc3 62a_100009832041_100015291786 [0,1,0,1,0,0|1,1,0]=4 16392 B21R3.3944604 Ic1c(ccc2c1cccc2)OCc3ccccc3 34a_100000041551_100015291786 [0,1,0,1,0,0|1,0,0]=3 16393 B21R3.3944604 Ic1c(ccc2c1cccc2)OCc3ccccc3 7a_100000041551_100000211182 [0,1,0,1,0,0|1,0,0]=3 16394 B21R3.3944604 Ic1c(ccc2c1cccc2)OCc3ccccn3 34a_100000041551_100000721315 [0,1,0,1,0,0|2,0,0]=4 16395 B21R3.3944604 Ic1c(ccc2c1cccc2)OCc3ccccn3 7a_100000041551_100000721315 [0,1,0,1,0,0|2,0,0]=4 16396 B21R3.3944604 Ic1c(ccc2c1cccc2)OCc3cccnc3 34a_100000041551_100000733263 [0,1,0,1,0,0|2,0,0]=4 16397 B21R3.3944604 Ic1c(ccc2c1cccc2)OCc3cccnc3 7a_100000041551_100000741622 [0,1,0,1,0,0|2,0,0]=4 16398 B21R3.3944604 Ic1c(ccc2c1cccc2)OCc3ccncc3 7a_100000041551_100015193705 [0,1,0,1,0,0|2,0,0]=4 16399 B21R3.3944604 Nc1c(ccc2c1cccc2)OCc3ccccc3 34a_100000007056_100015291786 [0,1,0,1,0,0|1,0,0]=3 16400 B21R3.3944604 Nc1c(ccc2c1cccc2)OCc3ccccc3 7a_100000007056_100000211182 [0,1,0,1,0,0|1,0,0]=3 16401 B21R3.3944604 Nc1c(ccc2c1cccc2)OCc3ccccn3 34a_100000007056_100000721315 [0,1,0,1,0,0|2,0,0]=4 16402 B21R3.3944604 Nc1c(ccc2c1cccc2)OCc3ccccn3 7a_100000007056_100000721315 [0,1,0,1,0,0|2,0,0]=4 16403 B21R3.3944604 Nc1c(ccc2c1cccc2)OCc3cccnc3 34a_100000007056_100000733263 [0,1,0,1,0,0|2,0,0]=4 16404 B21R3.3944604 Nc1c(ccc2c1cccc2)OCc3cccnc3 7a_100000007056_100000741622 [0,1,0,1,0,0|2,0,0]=4 16405 B21R3.3944604 Nc1c(ccc2c1cccc2)OCc3ccncc3 7a_100000007056_100015193705 [0,1,0,1,0,0|2,0,0]=4 16406 B21R3.3944604 Nc1c(ccc2c1cccc2)SCc3ccccc3 62a_100009817101_100015291786 [0,1,0,1,0,0|1,1,0]=4 16407 B21R3.3944604 O=c1c(c[nH]c2c1cccc2)C=Cc3ccccc3 271570a_100102527694_100012339567 [0,1,0,1,0,0|2,0,0]=4 16408 B21R3.3944604 O=c1c(c[nH]c2c1cccc2)SCc3ccccc3 62a_100000211182_100012348052 [0,1,0,1,0,0|1,1,0]=4 16409 B21R3.3944604 O=c1c(coc2c1cccc2)C=Cc3ccccc3 271570a_100102527694_100009813851 [0,1,0,1,0,0|2,0,0]=4 16410 B21R3.3944604 O=c1c(coc2c1cccc2)SCc3ccccc3 62a_100000211182_100009813851 [0,1,0,1,0,0|1,1,0]=4 16411 B21R3.3944604 Oc1c(ccc2c1cccc2)NCc3ccccc3 34a_100000007060_100015291786 [0,1,0,1,0,0|1,0,1]=4 16412 B21R3.3944604 Oc1c(ccc2c1cccc2)OCc3ccccc3 271570a_203496583355_100000148093 [0,1,0,1,0,0|0,0,1]=3 16413 B21R3.3944604 Oc1c(ccc2c1cccc2)SCc3ccccc3 62a_100000211182_100009996032 [0,1,0,1,0,0|0,1,1]=4 16414 B17R1.4937 C=CC=CC(=O)CC(=O)OCc1ccccc1 1458a_100016291481_100000753625 [0,0,1,0,1,0|1,0,1]=4 16415 B17R2.2382 C(=C/c1ccccc1)\CNc2ccccc2 34a_100000106764_100016265936 [1,0,0,0,1,0|1,0,1]=4 16416 B17R2.2382 C(=C/c1ccccc1)\COc2ccccc2 34a_100000210340_100016265936 [1,0,0,0,1,0|0,0,1]=3 16417 B17R2.2382 C(=C/c1ccccc1)\COc2ccccc2 7a_100000210340_100016265936 [1,0,0,0,1,0|0,0,1]=3 16418 B17R2.2382 C(=C/c1ccccc1)\COc2cccnc2 34a_100000210849_100016265936 [1,0,0,0,1,0|1,0,1]=4 16419 B17R2.2382 C(=C/c1ccccc1)\COc2cccnc2 7a_100000210849_100016265936 [1,0,0,0,1,0|1,0,1]=4 16420 B17R2.2382 C(=C/c1ccccc1)\COc2ccncc2 34a_100000212176_100016265936 [1,0,0,0,1,0|1,0,1]=4 16421 B17R2.2382 C(=C/c1ccccc1)\CSc2ccccc2 62a_100000719477_100016265936 [1,0,0,0,1,0|0,1,1]=4 16422 B17R2.2382 C(=C/c1ccccc1)\CSc2ccccc2 62a_100016265936_100000041952 [1,0,0,0,1,0|0,1,1]=4 16423 B17R2.2382 C(=NNCc1ccccc1)c2ccccc2 4a_100000007032_100015611070 [1,0,0,0,1,0|2,0,0]=4 16424 B17R2.2382 C(=NNc1ccccc1)Cc2ccccc2 4a_100015195140_100000209964 [1,0,0,0,1,0|2,0,0]=4 16425 B17R2.2382 c1ccc(cc1)CCOCc2ccccc2 34a_100000210268_100015291786 [1,0,0,0,1,0|0,0,2]=4 16426 B17R2.2382 c1ccc(cc1)CCOCc2ccccc2 34a_100000210790_100000765856 [1,0,0,0,1,0|0,0,2]=4 16427 B17R2.2382 c1ccc(cc1)CCOCc2ccccc2 7a_100000210268_100000211182 [1,0,0,0,1,0|0,0,2]=4 16428 B17R2.2382 c1ccc(cc1)CCOCc2ccccc2 7a_100000210790_100000765856 [1,0,0,0,1,0|0,0,2]=4 16429 B17R2.2382 c1ccc(cc1)COCNc2ccccc2 34a_100000106764_100000763385 [1,0,0,0,1,0|1,0,1]=4 16430 B17R2.2382 c1ccc(cc1)COCOc2ccccc2 34a_100000210340_100000763385 [1,0,0,0,1,0|1,0,1]=4 16431 B17R2.2382 c1ccc(cc1)COCSc2ccccc2 62a_100000719477_100000763385 [1,0,0,0,1,0|1,0,1]=4 16432 B17R2.2382 c1ccc(cc1)COCSc2ccccc2 62a_100000763385_100000041952 [1,0,0,0,1,0|1,0,1]=4 16433 B17R2.2383 C(=C/c1ccccc1)\COCc2ccco2 34a_100000210059_100016265936 [1,0,0,0,1,0|1,0,1]=4 16434 B17R2.2383 C(=C/c1ccccc1)\COCc2cccs2 34a_100000211240_100016265936 [1,0,0,0,1,0|1,0,1]=4 16435 B17R2.2383 C(=C/c1ccccc1)\COCc2ccoc2 34a_100011215357_100016265936 [1,0,0,0,1,0|1,0,1]=4 16436 B17R2.2383 C(=C/c1ccccc1)\COCc2ccsc2 34a_100000210256_100011261437 [1,0,0,0,1,0|1,0,1]=4 16437 B17R2.2383 C(=C/c1ccccc1)\COCc2ccsc2 34a_100011215551_100016265936 [1,0,0,0,1,0|1,0,1]=4 16438 B17R2.2383 C(=Cc1ccco1)COCc2ccccc2 271570a_200011106559_100009814098 [1,0,0,0,1,0|1,0,1]=4 16439 B17R2.2383 C(=Cc1cccs1)COCc2ccccc2 271570a_200011106559_100011215356 [1,0,0,0,1,0|1,0,1]=4 16440 B17R2.2383 C(=Cc1ccoc1)COCc2ccccc2 271570a_200011106559_100011215275 [1,0,0,0,1,0|1,0,1]=4 16441 B17R2.2383 C(=Cc1ccsc1)COCc2ccccc2 271570a_200011106559_100000738268 [1,0,0,0,1,0|1,0,1]=4 16442 B17R2.143 O=C(C[n+]1ccccc1)Nc2ccccc2 11a_100000106764_200000086051 [0,0,0,0,2,0|2,0,0]=4 16443 B17R2.143 O=C(C[n+]1ccccc1)Nc2ccccc2 22a_100000106764_200000086051 [0,0,0,0,2,0|2,0,0]=4 16444 B17R2.143 O=C(C[n+]1ccccc1)Nc2ccccc2 527a_100000106764_200000086051 [0,0,0,0,2,0|2,0,0]=4 16445 B17R2.143 O=C(Cc1ccccc1)C[n+]2ccccc2 1458a_200000086051_100015291786 [0,0,0,0,2,0|1,0,1]=4 16446 B17R2.143 O=C(Cc1ccccc1)Cc2ccccn2 1458a_100000233486_100015291786 [0,0,0,0,2,0|1,0,1]=4 16447 B17R2.143 O=C(Cc1ccccc1)Cc2cccnc2 1458a_100000737805_100015291786 [0,0,0,0,2,0|1,0,1]=4 16448 B17R2.143 O=C(Cc1ccccn1)Nc2ccccc2 11a_100000106764_100000233486 [0,0,0,0,2,0|2,0,0]=4 16449 B17R2.143 O=C(Cc1ccccn1)Nc2ccccc2 22a_100000106764_100000233486 [0,0,0,0,2,0|2,0,0]=4 16450 B17R2.143 O=C(Cc1cccnc1)Nc2ccccc2 11a_100000106764_100000737805 [0,0,0,0,2,0|2,0,0]=4 16451 B17R2.143 O=C(Cc1cccnc1)Nc2ccccc2 22a_100000106764_100000737805 [0,0,0,0,2,0|2,0,0]=4 16452 B17R2.143 O=C(Cc1cccnc1)Nc2ccccc2 527a_100000106764_100000737805 [0,0,0,0,2,0|2,0,0]=4 16453 B17R2.143 O=C(Cc1ccncc1)Nc2ccccc2 11a_100000106764_100011201483 [0,0,0,0,2,0|2,0,0]=4 16454 B17R2.143 O=C(Cc1ccncc1)Nc2ccccc2 22a_100000106764_100011201483 [0,0,0,0,2,0|2,0,0]=4 16455 B17R2.2342 CC(OCc1ccccc1)c2ccccc2 34a_100000210790_100000211855 [0,0,0,0,2,0|1,0,1]=4 16456 B17R2.2342 CC(OCc1ccccc1)c2ccccc2 7a_100000210790_100000230085 [0,0,0,0,2,0|1,0,1]=4 16457 B17R2.2342 C[C@@H](OCc1ccccc1)c2ccccc2 34a_100000761318_100015291786 [0,0,0,0,2,0|1,0,1]=4 16458 B17R2.2342 C[C@@H](OCc1ccccc1)c2ccccc2 7a_100000761318_100000211182 [0,0,0,0,2,0|1,0,1]=4 16459 B17R2.2342 O=C(CCc1ccccc1)c2ccccc2 1458a_100000185807_100000765856 [0,0,0,0,2,0|1,0,0]=3 16460 B17R2.2342 O=C(CCc1ccccn1)c2ccccc2 1458a_100000185807_100015183660 [0,0,0,0,2,0|2,0,0]=4 16461 B17R2.2342 O=C(CCc1cccnc1)c2ccccc2 1458a_100000185807_200011713674 [0,0,0,0,2,0|2,0,0]=4 16462 B17R2.2342 O=C(CCc1ccncc1)c2ccccc2 1458a_100000185807_100000723409 [0,0,0,0,2,0|2,0,0]=4 16463 B17R2.2342 O=C(COc1ccccc1)c2ccccc2 7a_100000210340_100000211460 [0,0,0,0,2,0|1,0,1]=4 16464 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 62a_100000211460_100000041952 [0,0,0,0,2,0|1,0,1]=4 16465 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 62a_100000719477_100000211460 [0,0,0,0,2,0|1,0,1]=4 16466 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 11a_100015324214_100000185807 [0,0,0,0,2,0|1,0,0]=3 16467 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 1626a_100015324214_100000185807 [0,0,0,0,2,0|1,0,0]=3 16468 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 240690a_100015324214_100000185807 [0,0,0,0,2,0|1,0,0]=3 16469 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 527a_100015324214_100000185807 [0,0,0,0,2,0|1,0,0]=3 16470 B17R2.2342 O=C(NCc1ccccn1)c2ccccc2 11a_100000210449_100000185807 [0,0,0,0,2,0|2,0,0]=4 16471 B17R2.2342 O=C(NCc1ccccn1)c2ccccc2 1626a_100000210449_100000185807 [0,0,0,0,2,0|2,0,0]=4 16472 B17R2.2342 O=C(NCc1ccccn1)c2ccccc2 240690a_100000210449_100000185807 [0,0,0,0,2,0|2,0,0]=4 16473 B17R2.2342 O=C(NCc1ccccn1)c2ccccc2 527a_100000210449_100000185807 [0,0,0,0,2,0|2,0,0]=4 16474 B17R2.2342 O=C(NCc1cccnc1)c2ccccc2 11a_100000210453_100000185807 [0,0,0,0,2,0|2,0,0]=4 16475 B17R2.2342 O=C(NCc1cccnc1)c2ccccc2 240690a_100000210453_100000185807 [0,0,0,0,2,0|2,0,0]=4 16476 B17R2.2342 O=C(NCc1cccnc1)c2ccccc2 527a_100000210453_100000185807 [0,0,0,0,2,0|2,0,0]=4 16477 B17R2.2342 O=C(NCc1ccncc1)c2ccccc2 11a_100000210450_100000185807 [0,0,0,0,2,0|2,0,0]=4 16478 B17R2.2342 O=C(NCc1ccncc1)c2ccccc2 1626a_100000210450_100000185807 [0,0,0,0,2,0|2,0,0]=4 16479 B17R2.2342 O=C(NCc1ccncc1)c2ccccc2 240690a_100000210450_100000185807 [0,0,0,0,2,0|2,0,0]=4 16480 B17R2.2342 O=C(NCc1ccncc1)c2ccccc2 527a_100000210450_100000185807 [0,0,0,0,2,0|2,0,0]=4 16481 B17R2.2342 O=C(NNc1ccccc1)c2ccccc2 22a_100015195140_100000185807 [0,0,0,0,2,0|2,0,0]=4 16482 B17R2.8341 O=C(C=Cc1c[nH]cn1)Cc2ccccc2 1458a_100102678534_100015291786 [0,0,0,0,2,0|2,0,0]=4 16483 B17R2.8341 O=C(C=Cc1ccco1)Nc2ccccc2 22a_100000106764_100000720202 [0,0,0,0,2,0|2,0,0]=4 16484 B17R2.8341 O=C(C=Cc1cccs1)Cc2ccccc2 1458a_100000182767_100015291786 [0,0,0,0,2,0|1,0,0]=3 16485 B17R2.8341 O=C(C=Cc1cccs1)Cc2ccccn2 1458a_100000182767_100000721315 [0,0,0,0,2,0|2,0,0]=4 16486 B17R2.8341 O=C(C=Cc1cccs1)Cc2cccnc2 1458a_100000182767_100000733263 [0,0,0,0,2,0|2,0,0]=4 16487 B17R2.8341 O=C(C=Cc1cccs1)Cc2ccncc2 1458a_100000182767_100000705612 [0,0,0,0,2,0|2,0,0]=4 16488 B17R2.8341 O=C(C=Cc1cccs1)Nc2ccccc2 11a_100000106764_100000182767 [0,0,0,0,2,0|2,0,0]=4 16489 B17R2.8341 O=C(C=Cc1cccs1)Nc2ccccc2 1626a_100000106764_100000182767 [0,0,0,0,2,0|2,0,0]=4 16490 B17R2.8341 O=C(C=Cc1cccs1)Nc2ccccc2 22a_100000106764_100000182767 [0,0,0,0,2,0|2,0,0]=4 16491 B17R2.8341 O=C(C=Cc1ccoc1)Cc2ccccc2 1458a_100000238621_100015291786 [0,0,0,0,2,0|1,0,0]=3 16492 B17R2.8341 O=C(C=Cc1ccoc1)Cc2ccccn2 1458a_100000238621_100000721315 [0,0,0,0,2,0|2,0,0]=4 16493 B17R2.8341 O=C(C=Cc1ccoc1)Cc2cccnc2 1458a_100000238621_100000733263 [0,0,0,0,2,0|2,0,0]=4 16494 B17R2.8341 O=C(C=Cc1ccoc1)Cc2ccncc2 1458a_100000238621_100000705612 [0,0,0,0,2,0|2,0,0]=4 16495 B17R2.8341 O=C(C=Cc1ccoc1)Nc2ccccc2 11a_100000106764_100000238621 [0,0,0,0,2,0|2,0,0]=4 16496 B17R2.8341 O=C(C=Cc1ccoc1)Nc2ccccc2 1626a_100000106764_100000238621 [0,0,0,0,2,0|2,0,0]=4 16497 B17R2.8341 O=C(C=Cc1ccoc1)Nc2ccccc2 22a_100000106764_100000238621 [0,0,0,0,2,0|2,0,0]=4 16498 B17R2.8341 O=C(C=Cc1ccsc1)Cc2ccccc2 1458a_100000698588_100015291786 [0,0,0,0,2,0|1,0,0]=3 16499 B17R2.8341 O=C(C=Cc1ccsc1)Cc2ccccn2 1458a_100000698588_100000721315 [0,0,0,0,2,0|2,0,0]=4 16500 B17R2.8341 O=C(C=Cc1ccsc1)Cc2cccnc2 1458a_100000698588_100000733263 [0,0,0,0,2,0|2,0,0]=4 16501 B17R2.8341 O=C(C=Cc1ccsc1)Cc2ccncc2 1458a_100000698588_100000705612 [0,0,0,0,2,0|2,0,0]=4 16502 B17R2.8341 O=C(C=Cc1ccsc1)Nc2ccccc2 11a_100000106764_100000698588 [0,0,0,0,2,0|2,0,0]=4 16503 B17R2.8341 O=C(C=Cc1ccsc1)Nc2ccccc2 1626a_100000106764_100000698588 [0,0,0,0,2,0|2,0,0]=4 16504 B17R2.8341 O=C(C=Cc1ccsc1)Nc2ccccc2 22a_100000106764_100000698588 [0,0,0,0,2,0|2,0,0]=4 16505 B17R2.8341 O=C(C=Cc1ccsc1)Nc2ccccc2 527a_100000106764_100000698588 [0,0,0,0,2,0|2,0,0]=4 16506 B17R2.8341 O=C(C=Cc1cscn1)Cc2ccccc2 1458a_200000747928_100015291786 [0,0,0,0,2,0|2,0,0]=4 16507 B17R2.8341 O=C(C=Cc1nccs1)Cc2ccccc2 1458a_100102558208_100015291786 [0,0,0,0,2,0|2,0,0]=4 16508 B17R2.8341 O=C(C=Cc1nccs1)Cc2ccccc2 6a_100000750902_100000766558 [0,0,0,0,2,0|2,0,0]=4 16509 B17R2.8343 O=C(C=Cc1ccccc1)Cc2c[nH]cn2 1458a_100000210462_100000707719 [0,0,0,0,2,0|2,0,0]=4 16510 B17R2.8343 O=C(C=Cc1ccccc1)Cc2ccn[nH]2 1458a_100000210462_100000728653 [0,0,0,0,2,0|2,0,0]=4 16511 B17R2.8343 O=C(C=Cc1ccccc1)Cc2ccon2 1458a_100000210462_100000234950 [0,0,0,0,2,0|2,0,0]=4 16512 B17R2.8343 O=C(C=Cc1ccccc1)Cc2ccsc2 1458a_100000210462_100011233845 [0,0,0,0,2,0|1,0,0]=3 16513 B17R2.8343 O=C(C=Cc1ccccc1)Cc2cncs2 1458a_100000210462_100015185245 [0,0,0,0,2,0|2,0,0]=4 16514 B17R2.8343 O=C(C=Cc1ccccc1)Cc2cscn2 1458a_100000210462_100000205941 [0,0,0,0,2,0|2,0,0]=4 16515 B17R2.8343 O=C(C=Cc1ccccc1)Cc2ncco2 1458a_100000210462_103436540062 [0,0,0,0,2,0|2,0,0]=4 16516 B17R2.8343 O=C(C=Cc1ccccc1)Cc2nccs2 1458a_100000210462_100015184050 [0,0,0,0,2,0|2,0,0]=4 16517 B17R2.8343 O=C(C=Cc1ccccn1)Cc2ccsc2 1458a_100000740811_100011233845 [0,0,0,0,2,0|2,0,0]=4 16518 B17R2.8343 O=C(C=Cc1cccnc1)Cc2ccsc2 1458a_100000735890_100011233845 [0,0,0,0,2,0|2,0,0]=4 16519 B17R2.8343 O=C(C=Cc1ccncc1)Cc2ccsc2 1458a_100000682801_100011233845 [0,0,0,0,2,0|2,0,0]=4 16520 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccc2 2230a_100000106460_100016265936 [1,0,0,0,0,1|1,0,1]=4 16521 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccc2 2230a_100020603302_100000765856 [1,0,0,0,0,1|1,0,1]=4 16522 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccc2 34a_100000106460_100016265936 [1,0,0,0,0,1|1,0,1]=4 16523 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccc2 34a_100020603302_100000765856 [1,0,0,0,0,1|1,0,1]=4 16524 B19R2.2628 C(=C/c1ccccc1)\CNCSc2ccccc2 2230a_100020603302_100011218342 [1,0,0,0,0,1|1,0,1]=4 16525 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccccc2 34a_100000210256_100000765856 [1,0,0,0,0,1|0,0,1]=3 16526 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccccc2 34a_100000210268_100016265936 [1,0,0,0,0,1|0,0,1]=3 16527 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccccc2 7a_100000210268_100016265936 [1,0,0,0,0,1|0,0,1]=3 16528 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccccn2 34a_100000210271_100016265936 [1,0,0,0,0,1|1,0,1]=4 16529 B19R2.2628 C(=C/c1ccccc1)\COCCc2cccnc2 34a_100011217484_100016265936 [1,0,0,0,0,1|1,0,1]=4 16530 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccncc2 34a_100011216225_100016265936 [1,0,0,0,0,1|1,0,1]=4 16531 B19R2.2628 C(=C/c1ccccc1)\CSCCc2ccccc2 62a_100000765856_100016265936 [1,0,0,0,0,1|0,1,1]=4 16532 B19R2.2628 C(=C/c1ccccc1)\CSCCc2ccccc2 62a_100016265936_100011218657 [1,0,0,0,0,1|0,1,1]=4 16533 B19R2.2628 C(=C/c1ccccc1)\CSCSc2ccccc2 62a_100011218342_100016265936 [1,0,0,0,0,1|0,1,1]=4 16534 B19R2.2628 C(=C/c1ccccc1)\CSCSc2ccccc2 62a_100016265936_100011218342 [1,0,0,0,0,1|0,1,1]=4 16535 B19R2.2628 C(=C/c1cccnc1)\COCCc2ccccc2 34a_200102594124_100000765856 [1,0,0,0,0,1|1,0,1]=4 16536 B19R2.2628 C(=Cc1ccccc1)C=NNCc2ccccc2 4a_100000007032_100000210105 [1,0,0,0,0,1|1,0,0]=3 16537 B19R2.2628 C(=Cc1ccccc1)C=NNCc2ccccn2 4a_100000736832_100000210105 [1,0,0,0,0,1|2,0,0]=4 16538 B19R2.2628 C(=Cc1ccccc1)C=NNCc2cccnc2 4a_100000738295_100000210105 [1,0,0,0,0,1|2,0,0]=4 16539 B19R2.2628 C(=Cc1ccccc1)C=NNCc2ccncc2 4a_100000736929_100000210105 [1,0,0,0,0,1|2,0,0]=4 16540 B19R2.2628 C(=Cc1ccccc1)CNCCc2ccccc2 270004a_100000106460_100000210105 [1,0,0,0,0,1|1,0,1]=4 16541 B19R2.2628 C(=Cc1ccncc1)C=NNCc2ccccc2 4a_100000007032_100000703957 [1,0,0,0,0,1|2,0,0]=4 16542 B19R2.2628 C(=NNc1ccccc1)COCc2ccccc2 4a_100015195140_100011215530 [1,0,0,0,0,1|1,0,1]=4 16543 B19R2.113693 O=C(C/C=C/c1ccccc1)CCc2cc[nH]c2 1458a_200000093579_100016265936 [0,0,0,0,1,1|2,0,0]=4 16544 B19R2.113693 O=C(C/C=C/c1ccccc1)CCc2ccc[nH]2 1458a_200011998680_100016265936 [0,0,0,0,1,1|2,0,0]=4 16545 B19R2.113693 O=C(C/C=C/c1ccccc1)CCc2ccco2 1458a_100000185103_100016265936 [0,0,0,0,1,1|2,0,0]=4 16546 B19R2.113693 O=C(C/C=C/c1ccccc1)CCc2cccs2 1458a_100000185280_100016265936 [0,0,0,0,1,1|2,0,0]=4 16547 B19R2.113693 O=C(C/C=C/c1ccccc1)CCc2cccs2 1458a_100011219626_100000748579 [0,0,0,0,1,1|2,0,0]=4 16548 B19R2.113693 O=C(C/C=C/c1ccccc1)CCc2ccsc2 1458a_100000195497_100016265936 [0,0,0,0,1,1|2,0,0]=4 16549 B19R2.113693 O=C(C/C=C/c1ccccc1)CCn2cccc2 1458a_100011196273_100016265936 [0,0,0,0,1,1|2,0,0]=4 16550 B19R2.113693 O=C(C/C=C/c1ccccc1)CCn2cccc2 1458a_100011219626_200000035178 [0,0,0,0,1,1|2,0,0]=4 16551 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccc[nH]2 11a_100000764082_100011219626 [0,0,0,0,1,1|2,0,0]=4 16552 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccc[nH]2 240690a_100000764082_100011219626 [0,0,0,0,1,1|2,0,0]=4 16553 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccco2 11a_100000185738_100011219626 [0,0,0,0,1,1|2,0,0]=4 16554 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccco2 1626a_100000185738_100011219626 [0,0,0,0,1,1|2,0,0]=4 16555 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccco2 240690a_100000185738_100011219626 [0,0,0,0,1,1|2,0,0]=4 16556 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2cccs2 11a_100000211653_100011219626 [0,0,0,0,1,1|2,0,0]=4 16557 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2cccs2 1626a_100000211653_100011219626 [0,0,0,0,1,1|2,0,0]=4 16558 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2cccs2 240690a_100000211653_100011219626 [0,0,0,0,1,1|2,0,0]=4 16559 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccoc2 11a_100015206860_100011219626 [0,0,0,0,1,1|2,0,0]=4 16560 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccoc2 1626a_100015206860_100011219626 [0,0,0,0,1,1|2,0,0]=4 16561 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccoc2 240690a_100015206860_100011219626 [0,0,0,0,1,1|2,0,0]=4 16562 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccsc2 11a_100000186416_100011219626 [0,0,0,0,1,1|2,0,0]=4 16563 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccsc2 1626a_100000186416_100011219626 [0,0,0,0,1,1|2,0,0]=4 16564 B19R2.113693 O=C(C/C=C/c1ccccc1)NCc2ccsc2 240690a_100000186416_100011219626 [0,0,0,0,1,1|2,0,0]=4 16565 B19R2.113693 O=C(C=CSc1ccccc1)CCc2cccs2 1458a_100016262050_100000748579 [0,0,0,0,1,1|2,0,0]=4 16566 B19R2.113693 O=C(C=CSc1ccccc1)CCn2cccc2 1458a_100016262050_200000035178 [0,0,0,0,1,1|2,0,0]=4 16567 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccc[nH]2 11a_100000764082_100016262050 [0,0,0,0,1,1|2,0,0]=4 16568 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccc[nH]2 240690a_100000764082_100016262050 [0,0,0,0,1,1|2,0,0]=4 16569 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccco2 11a_100000185738_100016262050 [0,0,0,0,1,1|2,0,0]=4 16570 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccco2 1626a_100000185738_100016262050 [0,0,0,0,1,1|2,0,0]=4 16571 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccco2 240690a_100000185738_100016262050 [0,0,0,0,1,1|2,0,0]=4 16572 B19R2.113693 O=C(C=CSc1ccccc1)NCc2cccs2 11a_100000211653_100016262050 [0,0,0,0,1,1|2,0,0]=4 16573 B19R2.113693 O=C(C=CSc1ccccc1)NCc2cccs2 1626a_100000211653_100016262050 [0,0,0,0,1,1|2,0,0]=4 16574 B19R2.113693 O=C(C=CSc1ccccc1)NCc2cccs2 240690a_100000211653_100016262050 [0,0,0,0,1,1|2,0,0]=4 16575 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccoc2 11a_100015206860_100016262050 [0,0,0,0,1,1|2,0,0]=4 16576 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccoc2 1626a_100015206860_100016262050 [0,0,0,0,1,1|2,0,0]=4 16577 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccoc2 240690a_100015206860_100016262050 [0,0,0,0,1,1|2,0,0]=4 16578 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccsc2 11a_100000186416_100016262050 [0,0,0,0,1,1|2,0,0]=4 16579 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccsc2 1626a_100000186416_100016262050 [0,0,0,0,1,1|2,0,0]=4 16580 B19R2.113693 O=C(C=CSc1ccccc1)NCc2ccsc2 240690a_100000186416_100016262050 [0,0,0,0,1,1|2,0,0]=4 16581 B19R2.113693 O=C(C=Cc1ccco1)NNCc2ccccc2 22a_100000007032_100000720202 [0,0,0,0,1,1|2,0,0]=4 16582 B19R2.113693 O=C(C=Cc1cccs1)CCCc2ccccc2 1458a_100000182767_100000211621 [0,0,0,0,1,1|2,0,0]=4 16583 B19R2.113693 O=C(C=Cc1cccs1)CCOc2ccccc2 1458a_100000182767_100000184471 [0,0,0,0,1,1|2,0,0]=4 16584 B19R2.113693 O=C(C=Cc1cccs1)CCSc2ccccc2 1458a_100000182767_100000246102 [0,0,0,0,1,1|2,0,0]=4 16585 B19R2.113693 O=C(C=Cc1cccs1)CSCc2ccccc2 1458a_100000182767_200011217039 [0,0,0,0,1,1|1,1,0]=4 16586 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccc2 11a_100000106460_100000182767 [0,0,0,0,1,1|2,0,0]=4 16587 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccc2 1626a_100000106460_100000182767 [0,0,0,0,1,1|2,0,0]=4 16588 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccc2 240690a_100000106460_100000182767 [0,0,0,0,1,1|2,0,0]=4 16589 B19R2.113693 O=C(C=Cc1cccs1)NNCc2ccccc2 22a_100000007032_100000182767 [0,0,0,0,1,1|2,0,0]=4 16590 B19R2.113693 O=C(C=Cc1ccoc1)CCCc2ccccc2 1458a_100000238621_100000211621 [0,0,0,0,1,1|2,0,0]=4 16591 B19R2.113693 O=C(C=Cc1ccoc1)CCOc2ccccc2 1458a_100000238621_100000184471 [0,0,0,0,1,1|2,0,0]=4 16592 B19R2.113693 O=C(C=Cc1ccoc1)CCSc2ccccc2 1458a_100000238621_100000246102 [0,0,0,0,1,1|2,0,0]=4 16593 B19R2.113693 O=C(C=Cc1ccoc1)CSCc2ccccc2 1458a_100000238621_200011217039 [0,0,0,0,1,1|1,1,0]=4 16594 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccc2 11a_100000106460_100000238621 [0,0,0,0,1,1|2,0,0]=4 16595 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccc2 1626a_100000106460_100000238621 [0,0,0,0,1,1|2,0,0]=4 16596 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccc2 240690a_100000106460_100000238621 [0,0,0,0,1,1|2,0,0]=4 16597 B19R2.113693 O=C(C=Cc1ccoc1)NNCc2ccccc2 22a_100000007032_100000238621 [0,0,0,0,1,1|2,0,0]=4 16598 B19R2.113693 O=C(C=Cc1ccsc1)CCCc2ccccc2 1458a_100000698588_100000211621 [0,0,0,0,1,1|2,0,0]=4 16599 B19R2.113693 O=C(C=Cc1ccsc1)CCOc2ccccc2 1458a_100000698588_100000184471 [0,0,0,0,1,1|2,0,0]=4 16600 B19R2.113693 O=C(C=Cc1ccsc1)CCSc2ccccc2 1458a_100000698588_100000246102 [0,0,0,0,1,1|2,0,0]=4 16601 B19R2.113693 O=C(C=Cc1ccsc1)CSCc2ccccc2 1458a_100000698588_200011217039 [0,0,0,0,1,1|1,1,0]=4 16602 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccc2 11a_100000106460_100000698588 [0,0,0,0,1,1|2,0,0]=4 16603 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccc2 1626a_100000106460_100000698588 [0,0,0,0,1,1|2,0,0]=4 16604 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccc2 240690a_100000106460_100000698588 [0,0,0,0,1,1|2,0,0]=4 16605 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccc2 527a_100000106460_100000698588 [0,0,0,0,1,1|2,0,0]=4 16606 B19R2.113693 O=C(C=Cc1ccsc1)NNCc2ccccc2 22a_100000007032_100000698588 [0,0,0,0,1,1|2,0,0]=4 16607 B19R2.113693 O=C(C=Cc1nccs1)COCc2ccccc2 6a_100000750902_100011215004 [0,0,0,0,1,1|2,0,0]=4 16608 B21R2.257631 CC(=NNCCc1ccccc1)C=Cc2ccccc2 4a_100000740470_100000204604 [0,0,0,0,0,2|2,0,0]=4 16609 B21R2.257631 O=C(C#Cc1ccccc1)CCOCc2ccccc2 1458a_100000736102_100000234347 [0,0,0,0,0,2|0,0,2]=4 16610 B21R2.257631 O=C(C#Cc1ccccc1)NC/C=C/c2ccccc2 240690a_100020603302_100000736102 [0,0,0,0,0,2|1,0,1]=4 16611 B21R2.257631 O=C(C=C/C=C/c1ccccc1)CCc2ccccc2 1458a_100016289705_100000765856 [0,0,0,0,0,2|1,0,0]=3 16612 B21R2.257631 O=C(C=C/C=C/c1ccccc1)CCc2ccccn2 1458a_100016289705_100015183660 [0,0,0,0,0,2|2,0,0]=4 16613 B21R2.257631 O=C(C=C/C=C/c1ccccc1)CCc2cccnc2 1458a_100016289705_200011713674 [0,0,0,0,0,2|2,0,0]=4 16614 B21R2.257631 O=C(C=C/C=C/c1ccccc1)CCc2ccncc2 1458a_100016289705_100000723409 [0,0,0,0,0,2|2,0,0]=4 16615 B21R2.257631 O=C(C=C/C=C/c1ccccc1)NCc2ccccc2 1626a_100015324214_100016289705 [0,0,0,0,0,2|1,0,0]=3 16616 B21R2.257631 O=C(C=C/C=C/c1ccccc1)NCc2ccccn2 1626a_100000210449_100016289705 [0,0,0,0,0,2|2,0,0]=4 16617 B21R2.257631 O=C(C=C/C=C/c1ccccc1)NCc2ccncc2 1626a_100000210450_100016289705 [0,0,0,0,0,2|2,0,0]=4 16618 B21R2.257631 O=C(C=C/C=C/c1ccccc1)NNc2ccccc2 22a_100015195140_100016289705 [0,0,0,0,0,2|2,0,0]=4 16619 B21R2.257631 O=C(C=CCCc1ccccc1)CCc2ccccc2 1458a_100016484021_100000765856 [0,0,0,0,0,2|1,0,0]=3 16620 B21R2.257631 O=C(C=CCCc1ccccc1)CCc2ccccn2 1458a_100016484021_100015183660 [0,0,0,0,0,2|2,0,0]=4 16621 B21R2.257631 O=C(C=CCCc1ccccc1)CCc2cccnc2 1458a_100016484021_200011713674 [0,0,0,0,0,2|2,0,0]=4 16622 B21R2.257631 O=C(C=CCCc1ccccc1)CCc2ccncc2 1458a_100016484021_100000723409 [0,0,0,0,0,2|2,0,0]=4 16623 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccc2 11a_100015324214_100016484021 [0,0,0,0,0,2|1,0,0]=3 16624 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccc2 1626a_100015324214_100016484021 [0,0,0,0,0,2|1,0,0]=3 16625 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccc2 240690a_100015324214_100016484021 [0,0,0,0,0,2|1,0,0]=3 16626 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccn2 11a_100000210449_100016484021 [0,0,0,0,0,2|2,0,0]=4 16627 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccn2 1626a_100000210449_100016484021 [0,0,0,0,0,2|2,0,0]=4 16628 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccn2 240690a_100000210449_100016484021 [0,0,0,0,0,2|2,0,0]=4 16629 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2cccnc2 11a_100000210453_100016484021 [0,0,0,0,0,2|2,0,0]=4 16630 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2cccnc2 240690a_100000210453_100016484021 [0,0,0,0,0,2|2,0,0]=4 16631 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccncc2 11a_100000210450_100016484021 [0,0,0,0,0,2|2,0,0]=4 16632 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccncc2 1626a_100000210450_100016484021 [0,0,0,0,0,2|2,0,0]=4 16633 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccncc2 240690a_100000210450_100016484021 [0,0,0,0,0,2|2,0,0]=4 16634 B21R2.257631 O=C(C=CCCc1ccccc1)NNc2ccccc2 22a_100015195140_100016484021 [0,0,0,0,0,2|2,0,0]=4 16635 B21R2.257631 O=C(C=Cc1ccccc1)CCCCc2ccccc2 1458a_100000210462_100000701786 [0,0,0,0,0,2|1,0,0]=3 16636 B21R2.257631 O=C(C=Cc1ccccc1)CCCCc2ccncc2 1458a_100000210462_100020630000 [0,0,0,0,0,2|2,0,0]=4 16637 B21R2.257631 O=C(C=Cc1ccccc1)CCCOc2ccccc2 1458a_100000210462_100000199009 [0,0,0,0,0,2|1,0,0]=3 16638 B21R2.257631 O=C(C=Cc1ccccc1)CCCSc2ccccc2 1458a_100000210462_200011203293 [0,0,0,0,0,2|1,0,0]=3 16639 B21R2.257631 O=C(C=Cc1ccccc1)CCOCc2ccccc2 1458a_100000210462_100000234347 [0,0,0,0,0,2|0,0,0]=2 16640 B21R2.257631 O=C(C=Cc1ccccc1)CCSCc2ccccc2 1458a_100000210462_200011297719 [0,0,0,0,0,2|0,1,0]=3 16641 B21R2.257631 O=C(C=Cc1ccccc1)NC/C=C/c2ccccc2 11a_100020603302_100000210462 [0,0,0,0,0,2|1,0,0]=3 16642 B21R2.257631 O=C(C=Cc1ccccc1)NC/C=C/c2ccccc2 1626a_100020603302_100000210462 [0,0,0,0,0,2|1,0,0]=3 16643 B21R2.257631 O=C(C=Cc1ccccc1)NCC#Cc2ccccc2 11a_100000735379_100000210462 [0,0,0,0,0,2|1,0,0]=3 16644 B21R2.257631 O=C(C=Cc1ccccc1)NCC#Cc2ccccc2 1626a_100000735379_100000210462 [0,0,0,0,0,2|1,0,0]=3 16645 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccccc2 11a_100000211184_100000210462 [0,0,0,0,0,2|1,0,0]=3 16646 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccccc2 1626a_100000211184_100000210462 [0,0,0,0,0,2|1,0,0]=3 16647 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccccn2 11a_100000689020_100000210462 [0,0,0,0,0,2|2,0,0]=4 16648 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccccn2 1626a_100000689020_100000210462 [0,0,0,0,0,2|2,0,0]=4 16649 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2cccnc2 11a_100011532358_100000210462 [0,0,0,0,0,2|2,0,0]=4 16650 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccncc2 1626a_100011275580_100000210462 [0,0,0,0,0,2|2,0,0]=4 16651 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccccc2 11a_100000174943_100000210462 [0,0,0,0,0,2|1,0,0]=3 16652 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccccc2 1626a_100000174943_100000210462 [0,0,0,0,0,2|1,0,0]=3 16653 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccccn2 11a_106741647558_100000210462 [0,0,0,0,0,2|2,0,0]=4 16654 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccccn2 1626a_106741647558_100000210462 [0,0,0,0,0,2|2,0,0]=4 16655 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2cccnc2 11a_100000754688_100000210462 [0,0,0,0,0,2|2,0,0]=4 16656 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccncc2 11a_100025717301_100000210462 [0,0,0,0,0,2|2,0,0]=4 16657 B21R2.257631 O=C(C=Cc1ccccc1)NNCCc2ccccc2 22a_100000740470_100000210462 [0,0,0,0,0,2|1,0,0]=3 16658 B21R2.257631 O=C(C=Cc1ccccn1)CCCCc2ccccc2 1458a_100000740811_100000701786 [0,0,0,0,0,2|2,0,0]=4 16659 B21R2.257631 O=C(C=Cc1ccccn1)CCCOc2ccccc2 1458a_100000740811_100000199009 [0,0,0,0,0,2|2,0,0]=4 16660 B21R2.257631 O=C(C=Cc1ccccn1)CCCSc2ccccc2 1458a_100000740811_200011203293 [0,0,0,0,0,2|2,0,0]=4 16661 B21R2.257631 O=C(C=Cc1ccccn1)CCOCc2ccccc2 1458a_100000740811_100000234347 [0,0,0,0,0,2|1,0,0]=3 16662 B21R2.257631 O=C(C=Cc1ccccn1)CCSCc2ccccc2 1458a_100000740811_200011297719 [0,0,0,0,0,2|1,1,0]=4 16663 B21R2.257631 O=C(C=Cc1ccccn1)NC/C=C/c2ccccc2 11a_100020603302_100000740811 [0,0,0,0,0,2|2,0,0]=4 16664 B21R2.257631 O=C(C=Cc1ccccn1)NC/C=C/c2ccccc2 240690a_100020603302_100000740811 [0,0,0,0,0,2|2,0,0]=4 16665 B21R2.257631 O=C(C=Cc1ccccn1)NCC#Cc2ccccc2 11a_100000735379_100000740811 [0,0,0,0,0,2|2,0,0]=4 16666 B21R2.257631 O=C(C=Cc1ccccn1)NCC#Cc2ccccc2 240690a_100000735379_100000740811 [0,0,0,0,0,2|2,0,0]=4 16667 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2ccccc2 11a_100000211184_100000740811 [0,0,0,0,0,2|2,0,0]=4 16668 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2ccccc2 240690a_100000211184_100000740811 [0,0,0,0,0,2|2,0,0]=4 16669 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2ccccc2 11a_100000174943_100000740811 [0,0,0,0,0,2|2,0,0]=4 16670 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2ccccc2 240690a_100000174943_100000740811 [0,0,0,0,0,2|2,0,0]=4 16671 B21R2.257631 O=C(C=Cc1ccccn1)NCCSc2ccccc2 240690a_100000189519_100000740811 [0,0,0,0,0,2|2,0,0]=4 16672 B21R2.257631 O=C(C=Cc1ccccn1)NNCCc2ccccc2 22a_100000740470_100000740811 [0,0,0,0,0,2|2,0,0]=4 16673 B21R2.257631 O=C(C=Cc1cccnc1)CCCCc2ccccc2 1458a_100000735890_100000701786 [0,0,0,0,0,2|2,0,0]=4 16674 B21R2.257631 O=C(C=Cc1cccnc1)CCCOc2ccccc2 1458a_100000735890_100000199009 [0,0,0,0,0,2|2,0,0]=4 16675 B21R2.257631 O=C(C=Cc1cccnc1)CCCSc2ccccc2 1458a_100000735890_200011203293 [0,0,0,0,0,2|2,0,0]=4 16676 B21R2.257631 O=C(C=Cc1cccnc1)CCOCc2ccccc2 1458a_100000735890_100000234347 [0,0,0,0,0,2|1,0,0]=3 16677 B21R2.257631 O=C(C=Cc1cccnc1)CCSCc2ccccc2 1458a_100000735890_200011297719 [0,0,0,0,0,2|1,1,0]=4 16678 B21R2.257631 O=C(C=Cc1cccnc1)NC/C=C/c2ccccc2 11a_100020603302_100000735890 [0,0,0,0,0,2|2,0,0]=4 16679 B21R2.257631 O=C(C=Cc1cccnc1)NC/C=C/c2ccccc2 240690a_100020603302_100000735890 [0,0,0,0,0,2|2,0,0]=4 16680 B21R2.257631 O=C(C=Cc1cccnc1)NCC#Cc2ccccc2 11a_100000735379_100000735890 [0,0,0,0,0,2|2,0,0]=4 16681 B21R2.257631 O=C(C=Cc1cccnc1)NCC#Cc2ccccc2 240690a_100000735379_100000735890 [0,0,0,0,0,2|2,0,0]=4 16682 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2ccccc2 11a_100000211184_100000735890 [0,0,0,0,0,2|2,0,0]=4 16683 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2ccccc2 240690a_100000211184_100000735890 [0,0,0,0,0,2|2,0,0]=4 16684 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2ccccc2 11a_100000174943_100000735890 [0,0,0,0,0,2|2,0,0]=4 16685 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2ccccc2 240690a_100000174943_100000735890 [0,0,0,0,0,2|2,0,0]=4 16686 B21R2.257631 O=C(C=Cc1cccnc1)NCCSc2ccccc2 240690a_100000189519_100000735890 [0,0,0,0,0,2|2,0,0]=4 16687 B21R2.257631 O=C(C=Cc1cccnc1)NNCCc2ccccc2 22a_100000740470_100000735890 [0,0,0,0,0,2|2,0,0]=4 16688 B21R2.257631 O=C(C=Cc1ccncc1)CCCCc2ccccc2 1458a_100000682801_100000701786 [0,0,0,0,0,2|2,0,0]=4 16689 B21R2.257631 O=C(C=Cc1ccncc1)CCCOc2ccccc2 1458a_100000682801_100000199009 [0,0,0,0,0,2|2,0,0]=4 16690 B21R2.257631 O=C(C=Cc1ccncc1)CCCSc2ccccc2 1458a_100000682801_200011203293 [0,0,0,0,0,2|2,0,0]=4 16691 B21R2.257631 O=C(C=Cc1ccncc1)CCOCc2ccccc2 1458a_100000682801_100000234347 [0,0,0,0,0,2|1,0,0]=3 16692 B21R2.257631 O=C(C=Cc1ccncc1)CCSCc2ccccc2 1458a_100000682801_200011297719 [0,0,0,0,0,2|1,1,0]=4 16693 B21R2.257631 O=C(C=Cc1ccncc1)NC/C=C/c2ccccc2 240690a_100020603302_100000682801 [0,0,0,0,0,2|2,0,0]=4 16694 B21R2.257631 O=C(C=Cc1ccncc1)NCC#Cc2ccccc2 240690a_100000735379_100000682801 [0,0,0,0,0,2|2,0,0]=4 16695 B21R2.257631 O=C(C=Cc1ccncc1)NCCCc2ccccc2 240690a_100000211184_100000682801 [0,0,0,0,0,2|2,0,0]=4 16696 B21R2.257631 O=C(C=Cc1ccncc1)NCCOc2ccccc2 240690a_100000174943_100000682801 [0,0,0,0,0,2|2,0,0]=4 16697 B21R2.257631 O=C(C=Cc1ccncc1)NCCSc2ccccc2 240690a_100000189519_100000682801 [0,0,0,0,0,2|2,0,0]=4 16698 B21R2.257631 O=C(C=Cc1ccncc1)NNCCc2ccccc2 22a_100000740470_100000682801 [0,0,0,0,0,2|2,0,0]=4 16699 B21R2.257631 O=C(C=Cc1cncnc1)CCOCc2ccccc2 6a_100000749868_100011219826 [0,0,0,0,0,2|2,0,0]=4 16700 B21R2.257631 O=C(CCCNc1ccccc1)OCc2ccccc2 34a_100000106764_100009813218 [0,0,0,0,0,2|0,0,2]=4 16701 B21R2.257631 O=C(CCCOc1ccccc1)OCc2ccccc2 34a_100000210340_100009813218 [0,0,0,0,0,2|0,0,2]=4 16702 B21R2.257631 O=C(CCCOc1ccccc1)OCc2ccccc2 7a_100000210340_100009813218 [0,0,0,0,0,2|0,0,2]=4 16703 B21R2.257631 O=C(CCCSc1ccccc1)OCc2ccccc2 62a_100000719477_100009813218 [0,0,0,0,0,2|0,0,2]=4 16704 B21R2.257631 O=C(CCCSc1ccccc1)OCc2ccccc2 62a_100009813218_100000041952 [0,0,0,0,0,2|0,0,2]=4 16705 B21R2.257631 O=C(CCNCc1ccccc1)OCc2ccccc2 2230a_100015324214_100009813219 [0,0,0,0,0,2|0,0,2]=4 16706 B21R2.257631 O=C(CCOCc1ccccc1)CCc2ccccc2 1458a_100000185753_100000234347 [0,0,0,0,0,2|0,0,2]=4 16707 B21R2.257631 O=C(CCOCc1ccccc1)CCc2ccccc2 1458a_100000743319_100000765856 [0,0,0,0,0,2|0,0,2]=4 16708 B21R2.257631 O=C(CCOCc1ccccc1)COc2ccccc2 1458a_100000186222_100000234347 [0,0,0,0,0,2|1,0,1]=4 16709 B21R2.257631 O=C(CCOCc1ccccc1)CSc2ccccc2 1458a_100000211596_100000234347 [0,0,0,0,0,2|1,0,1]=4 16710 B21R2.257631 O=C(CCOCc1ccccc1)NCc2ccccc2 11a_100015324214_100000743319 [0,0,0,0,0,2|1,0,1]=4 16711 B21R2.257631 O=C(CCOCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000743319 [0,0,0,0,0,2|1,0,1]=4 16712 B21R2.257631 O=C(CCOCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000743319 [0,0,0,0,0,2|1,0,1]=4 16713 B21R2.257631 O=C(CCOCc1ccccc1)NCc2ccccc2 527a_100015324214_100000743319 [0,0,0,0,0,2|1,0,1]=4 16714 B21R2.257631 O=C(CCOCc1ccccc1)NNc2ccccc2 22a_100015195140_100000743319 [0,0,0,0,0,2|2,0,0]=4 16715 B21R2.257631 O=C(CCOCc1ccccc1)OCc2ccccc2 7a_100000210790_100009813219 [0,0,0,0,0,2|0,0,2]=4 16716 B21R2.257631 O=C(CCOCc1ccccc1)OCc2ccccc2 7a_100009831632_100000211182 [0,0,0,0,0,2|0,0,2]=4 16717 B21R2.257631 O=C(CCSCc1ccccc1)OCc2ccccc2 62a_100000211182_100009813219 [0,0,0,0,0,2|0,0,2]=4 16718 B21R2.257631 O=C(CCSCc1ccccc1)OCc2ccccc2 62a_100009813219_100015291786 [0,0,0,0,0,2|0,0,2]=4 16719 B21R2.257631 O=C(CCc1ccccc1)COCCc2ccccc2 34a_100000210268_100012361361 [0,0,0,0,0,2|0,0,2]=4 16720 B21R2.257631 O=C(CCc1ccccc1)COCCc2ccccc2 7a_100000210268_100012361361 [0,0,0,0,0,2|0,0,2]=4 16721 B21R2.257631 O=C(CCc1ccccc1)NC/C=C/c2ccccc2 11a_100020603302_100000185753 [0,0,0,0,0,2|1,0,0]=3 16722 B21R2.257631 O=C(CCc1ccccc1)NC/C=C/c2ccccc2 1626a_100020603302_100000185753 [0,0,0,0,0,2|1,0,0]=3 16723 B21R2.257631 O=C(CCc1ccccc1)NC/C=C/c2ccccc2 240690a_100020603302_100000185753 [0,0,0,0,0,2|1,0,0]=3 16724 B21R2.257631 O=C(CCc1ccccc1)NC/C=C/c2ccccc2 527a_100020603302_100000185753 [0,0,0,0,0,2|1,0,0]=3 16725 B21R2.257631 O=C(CCc1ccccc1)NN=CCc2ccccc2 4a_100000189782_100000209964 [0,0,0,0,0,2|1,0,1]=4 16726 B21R2.257631 O=C(CCc1ccccn1)NC/C=C/c2ccccc2 11a_100020603302_100015195070 [0,0,0,0,0,2|2,0,0]=4 16727 B21R2.257631 O=C(CCc1ccccn1)NC/C=C/c2ccccc2 240690a_100020603302_100015195070 [0,0,0,0,0,2|2,0,0]=4 16728 B21R2.257631 O=C(CCc1ccccn1)NC/C=C/c2ccccc2 527a_100020603302_100015195070 [0,0,0,0,0,2|2,0,0]=4 16729 B21R2.257631 O=C(CCc1cccnc1)NC/C=C/c2ccccc2 11a_100020603302_100000198484 [0,0,0,0,0,2|2,0,0]=4 16730 B21R2.257631 O=C(CCc1cccnc1)NC/C=C/c2ccccc2 1626a_100020603302_100000198484 [0,0,0,0,0,2|2,0,0]=4 16731 B21R2.257631 O=C(CCc1cccnc1)NC/C=C/c2ccccc2 240690a_100020603302_100000198484 [0,0,0,0,0,2|2,0,0]=4 16732 B21R2.257631 O=C(CCc1cccnc1)NC/C=C/c2ccccc2 527a_100020603302_100000198484 [0,0,0,0,0,2|2,0,0]=4 16733 B21R2.257631 O=C(CCc1ccncc1)NC/C=C/c2ccccc2 11a_100020603302_100011225043 [0,0,0,0,0,2|2,0,0]=4 16734 B21R2.257631 O=C(CCc1ccncc1)NC/C=C/c2ccccc2 240690a_100020603302_100011225043 [0,0,0,0,0,2|2,0,0]=4 16735 B21R2.257631 O=C(CCc1ccncc1)NC/C=C/c2ccccc2 527a_100020603302_100011225043 [0,0,0,0,0,2|2,0,0]=4 16736 B21R2.257631 O=C(CNCCc1ccccc1)OCc2ccccc2 2230a_100000106460_100000753625 [0,0,0,0,0,2|0,0,2]=4 16737 B21R2.257631 O=C(CNCCc1ccccc1)OCc2ccccc2 34a_100000106460_100000753625 [0,0,0,0,0,2|0,0,2]=4 16738 B21R2.257631 O=C(CNc1ccccc1)NC/C=C/c2ccccc2 34a_100000106764_100102863107 [0,0,0,0,0,2|2,0,0]=4 16739 B21R2.257631 O=C(COCCc1ccccc1)NCc2ccccc2 34a_100000210268_100000183539 [0,0,0,0,0,2|1,0,1]=4 16740 B21R2.257631 O=C(COCCc1ccccc1)NCc2ccccc2 7a_100000210268_100000183539 [0,0,0,0,0,2|1,0,1]=4 16741 B21R2.257631 O=C(COCCc1ccccc1)OCc2ccccc2 34a_100000210268_100000753625 [0,0,0,0,0,2|0,0,2]=4 16742 B21R2.257631 O=C(COCCc1ccccc1)OCc2ccccc2 7a_100000210268_100000753625 [0,0,0,0,0,2|0,0,2]=4 16743 B21R2.257631 O=C(COc1ccccc1)NC/C=C/c2ccccc2 11a_100020603302_100000186222 [0,0,0,0,0,2|2,0,0]=4 16744 B21R2.257631 O=C(COc1ccccc1)NC/C=C/c2ccccc2 1626a_100020603302_100000186222 [0,0,0,0,0,2|2,0,0]=4 16745 B21R2.257631 O=C(COc1ccccc1)NC/C=C/c2ccccc2 240690a_100020603302_100000186222 [0,0,0,0,0,2|2,0,0]=4 16746 B21R2.257631 O=C(COc1ccccc1)NC/C=C/c2ccccc2 34a_100000210340_100102863107 [0,0,0,0,0,2|2,0,0]=4 16747 B21R2.257631 O=C(COc1ccccc1)NC/C=C/c2ccccc2 527a_100020603302_100000186222 [0,0,0,0,0,2|2,0,0]=4 16748 B21R2.257631 O=C(COc1ccccc1)NC/C=C/c2ccccc2 7a_100000210340_100102863107 [0,0,0,0,0,2|2,0,0]=4 16749 B21R2.257631 O=C(CSCCc1ccccc1)OCc2ccccc2 62a_100000753625_100011218657 [0,0,0,0,0,2|0,0,2]=4 16750 B21R2.257631 O=C(CSCCc1ccccc1)OCc2ccccc2 62a_100000765856_100000753625 [0,0,0,0,0,2|0,0,2]=4 16751 B21R2.257631 O=C(CSCSc1ccccc1)OCc2ccccc2 62a_100000753625_100011218342 [0,0,0,0,0,2|0,0,2]=4 16752 B21R2.257631 O=C(CSCSc1ccccc1)OCc2ccccc2 62a_100011218342_100000753625 [0,0,0,0,0,2|0,0,2]=4 16753 B21R2.257631 O=C(CSc1ccccc1)NC/C=C/c2ccccc2 11a_100020603302_100000211596 [0,0,0,0,0,2|2,0,0]=4 16754 B21R2.257631 O=C(CSc1ccccc1)NC/C=C/c2ccccc2 1626a_100020603302_100000211596 [0,0,0,0,0,2|2,0,0]=4 16755 B21R2.257631 O=C(CSc1ccccc1)NC/C=C/c2ccccc2 240690a_100020603302_100000211596 [0,0,0,0,0,2|2,0,0]=4 16756 B21R2.257631 O=C(CSc1ccccc1)NC/C=C/c2ccccc2 527a_100020603302_100000211596 [0,0,0,0,0,2|2,0,0]=4 16757 B21R2.257631 O=C(CSc1ccccc1)NC/C=C/c2ccccc2 62a_100000719477_100102863107 [0,0,0,0,0,2|2,0,0]=4 16758 B21R2.257631 O=C(CSc1ccccc1)NC/C=C/c2ccccc2 62a_100102863107_100000041952 [0,0,0,0,0,2|2,0,0]=4 16759 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccc2 2708a_100015324214_100020603302 [0,0,0,0,0,2|1,0,0]=3 16760 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccc2 2708a_100020603302_100015324214 [0,0,0,0,0,2|1,0,0]=3 16761 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccc2 273464a_100015324214_100020603302 [0,0,0,0,0,2|1,0,0]=3 16762 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccc2 273464a_100020603302_100015324214 [0,0,0,0,0,2|1,0,0]=3 16763 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccc2 512a_100015324214_100020603302 [0,0,0,0,0,2|1,0,0]=3 16764 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccc2 512a_100020603302_100015324214 [0,0,0,0,0,2|1,0,0]=3 16765 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccn2 2708a_100000210449_100020603302 [0,0,0,0,0,2|2,0,0]=4 16766 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccn2 2708a_100020603302_100000210449 [0,0,0,0,0,2|2,0,0]=4 16767 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccn2 273464a_100000210449_100020603302 [0,0,0,0,0,2|2,0,0]=4 16768 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccn2 273464a_100020603302_100000210449 [0,0,0,0,0,2|2,0,0]=4 16769 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccccn2 512a_100020603302_100000210449 [0,0,0,0,0,2|2,0,0]=4 16770 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2cccnc2 2708a_100000210453_100020603302 [0,0,0,0,0,2|2,0,0]=4 16771 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2cccnc2 2708a_100020603302_100000210453 [0,0,0,0,0,2|2,0,0]=4 16772 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2cccnc2 273464a_100000210453_100020603302 [0,0,0,0,0,2|2,0,0]=4 16773 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2cccnc2 273464a_100020603302_100000210453 [0,0,0,0,0,2|2,0,0]=4 16774 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2cccnc2 512a_100000210453_100020603302 [0,0,0,0,0,2|2,0,0]=4 16775 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2cccnc2 512a_100020603302_100000210453 [0,0,0,0,0,2|2,0,0]=4 16776 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccncc2 2708a_100000210450_100020603302 [0,0,0,0,0,2|2,0,0]=4 16777 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccncc2 2708a_100020603302_100000210450 [0,0,0,0,0,2|2,0,0]=4 16778 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccncc2 273464a_100000210450_100020603302 [0,0,0,0,0,2|2,0,0]=4 16779 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccncc2 273464a_100020603302_100000210450 [0,0,0,0,0,2|2,0,0]=4 16780 B21R2.257631 O=C(NC/C=C/c1ccccc1)NCc2ccncc2 512a_100020603302_100000210450 [0,0,0,0,0,2|2,0,0]=4 16781 B21R2.257631 O=C(NC/C=C/c1ccccc1)NNc2ccccc2 273464a_100020603302_100015195140 [0,0,0,0,0,2|2,0,0]=4 16782 B21R2.257631 O=C(NC/C=C/c1ccccc1)NNc2ccccc2 512a_100020603302_100015195140 [0,0,0,0,0,2|2,0,0]=4 16783 B21R2.257631 O=C(NCCOc1ccccc1)OCc2ccccc2 7a_100000210340_100012357035 [0,0,0,0,0,2|0,0,2]=4 16784 B21R2.257631 O=C(NCCSc1ccccc1)OCc2ccccc2 62a_100000719477_100012357035 [0,0,0,0,0,2|0,0,2]=4 16785 B21R2.257631 O=C(NCCSc1ccccc1)OCc2ccccc2 62a_100012357035_100000041952 [0,0,0,0,0,2|0,0,2]=4 16786 B21R2.257676 O=C(C/C=C/c1ccccc1)C/C=C/c2ccccc2 1458a_100011219626_100016265936 [0,0,0,0,0,2|1,0,1]=4 16787 B21R2.257676 O=C(C/C=C/c1ccccc1)CCCc2ccccc2 1458a_100011207963_100016265936 [0,0,0,0,0,2|1,0,0]=3 16788 B21R2.257676 O=C(C/C=C/c1ccccc1)CCCc2ccccc2 1458a_100011219626_100000211621 [0,0,0,0,0,2|1,0,0]=3 16789 B21R2.257676 O=C(C/C=C/c1ccccc1)CCCc2ccccn2 1458a_100000752327_100016265936 [0,0,0,0,0,2|2,0,0]=4 16790 B21R2.257676 O=C(C/C=C/c1ccccc1)CCCc2ccncc2 1458a_100020654287_100016265936 [0,0,0,0,0,2|2,0,0]=4 16791 B21R2.257676 O=C(C/C=C/c1ccccc1)CCOc2ccccc2 1458a_100000182761_100016265936 [0,0,0,0,0,2|1,0,0]=3 16792 B21R2.257676 O=C(C/C=C/c1ccccc1)CCOc2ccccc2 1458a_100011219626_100000184471 [0,0,0,0,0,2|1,0,0]=3 16793 B21R2.257676 O=C(C/C=C/c1ccccc1)CCSc2ccccc2 1458a_100000182436_100016265936 [0,0,0,0,0,2|1,0,0]=3 16794 B21R2.257676 O=C(C/C=C/c1ccccc1)CCSc2ccccc2 1458a_100011219626_100000246102 [0,0,0,0,0,2|1,0,0]=3 16795 B21R2.257676 O=C(C/C=C/c1ccccc1)COCc2ccccc2 1458a_100000230186_100016265936 [0,0,0,0,0,2|0,0,0]=2 16796 B21R2.257676 O=C(C/C=C/c1ccccc1)CSCc2ccccc2 1458a_100000150264_100016265936 [0,0,0,0,0,2|0,1,0]=3 16797 B21R2.257676 O=C(C/C=C/c1ccccc1)CSCc2ccccc2 1458a_100011219626_200011217039 [0,0,0,0,0,2|0,1,0]=3 16798 B21R2.257676 O=C(C/C=C/c1ccccc1)CSCc2ccccn2 1458a_100000742634_100016265936 [0,0,0,0,0,2|1,1,0]=4 16799 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccc2 11a_100000106460_100011219626 [0,0,0,0,0,2|1,0,0]=3 16800 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccc2 1626a_100000106460_100011219626 [0,0,0,0,0,2|1,0,0]=3 16801 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccc2 240690a_100000106460_100011219626 [0,0,0,0,0,2|1,0,0]=3 16802 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccn2 11a_100000211156_100011219626 [0,0,0,0,0,2|2,0,0]=4 16803 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccn2 1626a_100000211156_100011219626 [0,0,0,0,0,2|2,0,0]=4 16804 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccn2 240690a_100000211156_100011219626 [0,0,0,0,0,2|2,0,0]=4 16805 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cccnc2 11a_100000736294_100011219626 [0,0,0,0,0,2|2,0,0]=4 16806 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cccnc2 1626a_100000736294_100011219626 [0,0,0,0,0,2|2,0,0]=4 16807 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cccnc2 240690a_100000736294_100011219626 [0,0,0,0,0,2|2,0,0]=4 16808 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccncc2 11a_100000742849_100011219626 [0,0,0,0,0,2|2,0,0]=4 16809 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccncc2 1626a_100000742849_100011219626 [0,0,0,0,0,2|2,0,0]=4 16810 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccncc2 240690a_100000742849_100011219626 [0,0,0,0,0,2|2,0,0]=4 16811 B21R2.257676 O=C(C/C=C/c1ccccc1)NNCc2ccccc2 22a_100000007032_100011219626 [0,0,0,0,0,2|1,0,0]=3 16812 B21R2.257676 O=C(C/C=C/c1ccccc1)NNCc2ccccn2 22a_100000736832_100011219626 [0,0,0,0,0,2|2,0,0]=4 16813 B21R2.257676 O=C(C/C=C/c1ccccc1)NNCc2cccnc2 22a_100000738295_100011219626 [0,0,0,0,0,2|2,0,0]=4 16814 B21R2.257676 O=C(C/C=C/c1ccccc1)NNCc2ccncc2 22a_100000736929_100011219626 [0,0,0,0,0,2|2,0,0]=4 16815 B21R2.257676 O=C(C=CSc1ccccc1)C/C=C/c2ccccc2 1458a_100016262050_100016265936 [0,0,0,0,0,2|1,0,1]=4 16816 B21R2.257676 O=C(C=CSc1ccccc1)CC#Cc2ccccc2 1458a_100016262050_100011352542 [0,0,0,0,0,2|1,0,1]=4 16817 B21R2.257676 O=C(C=CSc1ccccc1)CCCc2ccccc2 1458a_100016262050_100000211621 [0,0,0,0,0,2|1,0,0]=3 16818 B21R2.257676 O=C(C=CSc1ccccc1)CCOc2ccccc2 1458a_100016262050_100000184471 [0,0,0,0,0,2|1,0,0]=3 16819 B21R2.257676 O=C(C=CSc1ccccc1)CCSc2ccccc2 1458a_100016262050_100000246102 [0,0,0,0,0,2|1,0,0]=3 16820 B21R2.257676 O=C(C=CSc1ccccc1)CSCc2ccccc2 1458a_100016262050_200011217039 [0,0,0,0,0,2|0,1,0]=3 16821 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccc2 11a_100000106460_100016262050 [0,0,0,0,0,2|1,0,0]=3 16822 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccc2 1626a_100000106460_100016262050 [0,0,0,0,0,2|1,0,0]=3 16823 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccc2 240690a_100000106460_100016262050 [0,0,0,0,0,2|1,0,0]=3 16824 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccn2 11a_100000211156_100016262050 [0,0,0,0,0,2|2,0,0]=4 16825 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccn2 1626a_100000211156_100016262050 [0,0,0,0,0,2|2,0,0]=4 16826 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccn2 240690a_100000211156_100016262050 [0,0,0,0,0,2|2,0,0]=4 16827 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cccnc2 11a_100000736294_100016262050 [0,0,0,0,0,2|2,0,0]=4 16828 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cccnc2 1626a_100000736294_100016262050 [0,0,0,0,0,2|2,0,0]=4 16829 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cccnc2 240690a_100000736294_100016262050 [0,0,0,0,0,2|2,0,0]=4 16830 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccncc2 11a_100000742849_100016262050 [0,0,0,0,0,2|2,0,0]=4 16831 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccncc2 1626a_100000742849_100016262050 [0,0,0,0,0,2|2,0,0]=4 16832 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccncc2 240690a_100000742849_100016262050 [0,0,0,0,0,2|2,0,0]=4 16833 B21R2.257676 O=C(C=CSc1ccccc1)NNCc2ccccc2 22a_100000007032_100016262050 [0,0,0,0,0,2|1,0,0]=3 16834 B21R2.257676 O=C(C=CSc1ccccc1)NNCc2ccccn2 22a_100000736832_100016262050 [0,0,0,0,0,2|2,0,0]=4 16835 B21R2.257676 O=C(C=CSc1ccccc1)NNCc2cccnc2 22a_100000738295_100016262050 [0,0,0,0,0,2|2,0,0]=4 16836 B21R2.257676 O=C(C=CSc1ccccc1)NNCc2ccncc2 22a_100000736929_100016262050 [0,0,0,0,0,2|2,0,0]=4 16837 B21R2.257676 O=C(CC#Cc1ccccc1)C/C=C/c2ccccc2 1458a_100011219626_100011352542 [0,0,0,0,0,2|1,0,1]=4 16838 B21R2.257676 O=C(CC#Cc1ccccc1)COCc2ccccc2 1458a_100000230186_100011352542 [0,0,0,0,0,2|0,0,2]=4 16839 B21R2.257676 O=C(CCCc1ccccc1)COCc2ccccc2 1458a_100000230186_100000211621 [0,0,0,0,0,2|0,0,2]=4 16840 B21R2.257676 O=C(CCCc1ccccc1)NN=Cc2ccccc2 4a_100011246310_100015611070 [0,0,0,0,0,2|2,0,0]=4 16841 B21R2.257676 O=C(CCOc1ccccc1)COCc2ccccc2 1458a_100000230186_100000184471 [0,0,0,0,0,2|0,0,2]=4 16842 B21R2.257676 O=C(CCSc1ccccc1)COCc2ccccc2 1458a_100000230186_100000246102 [0,0,0,0,0,2|0,0,2]=4 16843 B21R2.257676 O=C(CNCc1ccccc1)NOCc2ccccc2 2230a_100015324214_100000230105 [0,0,0,0,0,2|0,0,2]=4 16844 B21R2.257676 O=C(CNCc1ccccc1)NOCc2ccccc2 34a_100015324214_100000230105 [0,0,0,0,0,2|0,0,2]=4 16845 B21R2.257676 O=C(CNCc1ccccc1)OCCc2ccccc2 2230a_100015324214_200000077782 [0,0,0,0,0,2|0,0,2]=4 16846 B21R2.257676 O=C(CNCc1ccccc1)OCCc2ccccc2 34a_100015324214_200000077782 [0,0,0,0,0,2|0,0,2]=4 16847 B21R2.257676 O=C(COCc1ccccc1)CSCc2ccccc2 1458a_100000230186_200011217039 [0,0,0,0,0,2|0,0,2]=4 16848 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 11a_100000106460_100000230186 [0,0,0,0,0,2|0,0,2]=4 16849 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000230186 [0,0,0,0,0,2|0,0,2]=4 16850 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000230186 [0,0,0,0,0,2|0,0,2]=4 16851 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 34a_100000210790_100000183012 [0,0,0,0,0,2|0,0,2]=4 16852 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 527a_100000106460_100000230186 [0,0,0,0,0,2|0,0,2]=4 16853 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 7a_100000210790_100000183012 [0,0,0,0,0,2|0,0,2]=4 16854 B21R2.257676 O=C(COCc1ccccc1)NNCc2ccccc2 22a_100000007032_100000230186 [0,0,0,0,0,2|1,0,1]=4 16855 B21R2.257676 O=C(COCc1ccccc1)NOCc2ccccc2 34a_100000210790_100000230105 [0,0,0,0,0,2|0,0,2]=4 16856 B21R2.257676 O=C(COCc1ccccc1)NOCc2ccccc2 7a_100000210790_100000230105 [0,0,0,0,0,2|0,0,2]=4 16857 B21R2.257676 O=C(COCc1ccccc1)OCCc2ccccc2 34a_100000210790_200000077782 [0,0,0,0,0,2|0,0,2]=4 16858 B21R2.257676 O=C(COCc1ccccc1)OCCc2ccccc2 7a_100000210790_200000077782 [0,0,0,0,0,2|0,0,2]=4 16859 B21R2.257676 O=C(CSCc1ccccc1)NOCc2ccccc2 62a_100000211182_100000230105 [0,0,0,0,0,2|0,0,2]=4 16860 B21R2.257676 O=C(CSCc1ccccc1)NOCc2ccccc2 62a_100000230105_100015291786 [0,0,0,0,0,2|0,0,2]=4 16861 B21R2.257676 O=C(CSCc1ccccc1)OCCc2ccccc2 62a_100000211182_200000077782 [0,0,0,0,0,2|0,0,2]=4 16862 B21R2.257676 O=C(CSCc1ccccc1)OCCc2ccccc2 62a_200000077782_100015291786 [0,0,0,0,0,2|0,0,2]=4