0 B20R2.174735 CC(=NNCc1ccccc1)C=Cc2ccccc2 4a_100000007032_100000204604 [0,0,0,0,0,0|3,0,0]=3 1 B20R2.174735 CC(=NNCc1ccccc1)C=Cc2ccccn2 4a_100000007032_100102710650 [0,0,0,0,0,0|4,0,0]=4 2 B20R2.174735 CC(=NNCc1ccccn1)C=Cc2ccccc2 4a_100000736832_100000204604 [0,0,0,0,0,0|4,0,0]=4 3 B20R2.174735 CC(=NNCc1cccnc1)C=Cc2ccccc2 4a_100000738295_100000204604 [0,0,0,0,0,0|4,0,0]=4 4 B20R2.174735 CC(=NNCc1ccncc1)C=Cc2ccccc2 4a_100000736929_100000204604 [0,0,0,0,0,0|4,0,0]=4 5 B20R2.174735 CC(C#Cc1ccccc1)OCCc2ccccc2 34a_200000065209_100000765856 [0,0,0,0,0,0|1,0,3]=4 6 B20R2.174735 CC(C#Cc1ccccc1)OCCc2ccccc2 7a_200000065209_100000765856 [0,0,0,0,0,0|1,0,3]=4 7 B20R2.174735 CC(COc1ccccc1)OCCc2ccccc2 34a_100000210911_100000765856 [0,0,0,0,0,0|2,0,2]=4 8 B20R2.174735 CC(COc1ccccc1)OCCc2ccccc2 7a_100000210911_100000765856 [0,0,0,0,0,0|2,0,2]=4 9 B20R2.174735 C[C@@H](CCc1ccccc1)OCCc2ccccc2 34a_100009815974_100000765856 [0,0,0,0,0,0|1,0,3]=4 10 B20R2.174735 C[C@@H](CCc1ccccc1)OCCc2ccccc2 7a_100009815974_100000765856 [0,0,0,0,0,0|1,0,3]=4 11 B20R2.174735 O=C(C#Cc1ccccc1)CCCc2ccccc2 1458a_100000736102_100000211621 [0,0,0,0,0,0|1,0,2]=3 12 B20R2.174735 O=C(C#Cc1ccccc1)CCOc2ccccc2 1458a_100000736102_100000184471 [0,0,0,0,0,0|2,0,2]=4 13 B20R2.174735 O=C(C#Cc1ccccc1)CCSc2ccccc2 1458a_100000736102_100000246102 [0,0,0,0,0,0|2,0,2]=4 14 B20R2.174735 O=C(C#Cc1ccccc1)CSCc2ccccc2 1458a_100000736102_200011217039 [0,0,0,0,0,0|2,0,2]=4 15 B20R2.174735 O=C(C#Cc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000736102 [0,0,0,0,0,0|1,0,2]=3 16 B20R2.174735 O=C(C#Cc1ccccc1)NCCc2ccccn2 240690a_100000211156_100000736102 [0,0,0,0,0,0|2,0,2]=4 17 B20R2.174735 O=C(C#Cc1ccccc1)NCCc2cccnc2 240690a_100000736294_100000736102 [0,0,0,0,0,0|2,0,2]=4 18 B20R2.174735 O=C(C#Cc1ccccc1)NCCc2ccncc2 240690a_100000742849_100000736102 [0,0,0,0,0,0|2,0,2]=4 19 B20R2.174735 O=C(C#Cc1ccccc1)NNCc2ccccc2 22a_100000007032_100000736102 [0,0,0,0,0,0|2,0,2]=4 20 B20R2.174735 O=C(C#Cc1ccccn1)CCCc2ccccc2 1458a_102125277312_100000211621 [0,0,0,0,0,0|2,0,2]=4 21 B20R2.174735 O=C(C=Cc1ccccc1)C/C=C/c2ccccc2 1458a_100000210462_100016265936 [0,0,0,0,0,0|1,0,2]=3 22 B20R2.174735 O=C(C=Cc1ccccc1)CC#Cc2ccccc2 1458a_100000210462_100011352542 [0,0,0,0,0,0|1,0,2]=3 23 B20R2.174735 O=C(C=Cc1ccccc1)CCCc2ccccc2 1458a_100000210462_100000211621 [0,0,0,0,0,0|1,0,0]=1 24 B20R2.174735 O=C(C=Cc1ccccc1)CCOc2ccccc2 1458a_100000210462_100000184471 [0,0,0,0,0,0|2,0,0]=2 25 B20R2.174735 O=C(C=Cc1ccccc1)CCSc2ccccc2 1458a_100000210462_100000246102 [0,0,0,0,0,0|2,0,0]=2 26 B20R2.174735 O=C(C=Cc1ccccc1)CSCc2ccccc2 1458a_100000210462_200011217039 [0,0,0,0,0,0|2,0,0]=2 27 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccccc2 11a_100000106460_100000210462 [0,0,0,0,0,0|1,0,0]=1 28 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000210462 [0,0,0,0,0,0|1,0,0]=1 29 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccccn2 11a_100000211156_100000210462 [0,0,0,0,0,0|2,0,0]=2 30 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccccn2 1626a_100000211156_100000210462 [0,0,0,0,0,0|2,0,0]=2 31 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2cccnc2 11a_100000736294_100000210462 [0,0,0,0,0,0|2,0,0]=2 32 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2cccnc2 1626a_100000736294_100000210462 [0,0,0,0,0,0|2,0,0]=2 33 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccncc2 11a_100000742849_100000210462 [0,0,0,0,0,0|2,0,0]=2 34 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2ccncc2 1626a_100000742849_100000210462 [0,0,0,0,0,0|2,0,0]=2 35 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2cnccn2 11a_100000723456_100000210462 [0,0,0,0,0,0|3,0,0]=3 36 B20R2.174735 O=C(C=Cc1ccccc1)NCCc2cnccn2 1626a_100000723456_100000210462 [0,0,0,0,0,0|3,0,0]=3 37 B20R2.174735 O=C(C=Cc1ccccc1)NNCc2ccccc2 22a_100000007032_100000210462 [0,0,0,0,0,0|2,0,0]=2 38 B20R2.174735 O=C(C=Cc1ccccc1)NNCc2ccccn2 22a_100000736832_100000210462 [0,0,0,0,0,0|3,0,0]=3 39 B20R2.174735 O=C(C=Cc1ccccc1)NNCc2cccnc2 22a_100000738295_100000210462 [0,0,0,0,0,0|3,0,0]=3 40 B20R2.174735 O=C(C=Cc1ccccc1)NNCc2ccncc2 22a_100000736929_100000210462 [0,0,0,0,0,0|3,0,0]=3 41 B20R2.174735 O=C(C=Cc1ccccn1)C/C=C/c2ccccc2 1458a_100000740811_100016265936 [0,0,0,0,0,0|2,0,2]=4 42 B20R2.174735 O=C(C=Cc1ccccn1)CC#Cc2ccccc2 1458a_100000740811_100011352542 [0,0,0,0,0,0|2,0,2]=4 43 B20R2.174735 O=C(C=Cc1ccccn1)CCCc2ccccc2 1458a_100000740811_100000211621 [0,0,0,0,0,0|2,0,0]=2 44 B20R2.174735 O=C(C=Cc1ccccn1)CCOc2ccccc2 1458a_100000740811_100000184471 [0,0,0,0,0,0|3,0,0]=3 45 B20R2.174735 O=C(C=Cc1ccccn1)CCSc2ccccc2 1458a_100000740811_100000246102 [0,0,0,0,0,0|3,0,0]=3 46 B20R2.174735 O=C(C=Cc1ccccn1)CSCc2ccccc2 1458a_100000740811_200011217039 [0,0,0,0,0,0|3,0,0]=3 47 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccccc2 11a_100000106460_100000740811 [0,0,0,0,0,0|2,0,0]=2 48 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccccc2 240690a_100000106460_100000740811 [0,0,0,0,0,0|2,0,0]=2 49 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccccn2 11a_100000211156_100000740811 [0,0,0,0,0,0|3,0,0]=3 50 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccccn2 240690a_100000211156_100000740811 [0,0,0,0,0,0|3,0,0]=3 51 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2cccnc2 11a_100000736294_100000740811 [0,0,0,0,0,0|3,0,0]=3 52 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2cccnc2 240690a_100000736294_100000740811 [0,0,0,0,0,0|3,0,0]=3 53 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccncc2 11a_100000742849_100000740811 [0,0,0,0,0,0|3,0,0]=3 54 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2ccncc2 240690a_100000742849_100000740811 [0,0,0,0,0,0|3,0,0]=3 55 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2cnccn2 11a_100000723456_100000740811 [0,0,0,0,0,0|4,0,0]=4 56 B20R2.174735 O=C(C=Cc1ccccn1)NCCc2cnccn2 240690a_100000723456_100000740811 [0,0,0,0,0,0|4,0,0]=4 57 B20R2.174735 O=C(C=Cc1ccccn1)NNCc2ccccc2 22a_100000007032_100000740811 [0,0,0,0,0,0|3,0,0]=3 58 B20R2.174735 O=C(C=Cc1ccccn1)NNCc2ccccn2 22a_100000736832_100000740811 [0,0,0,0,0,0|4,0,0]=4 59 B20R2.174735 O=C(C=Cc1ccccn1)NNCc2cccnc2 22a_100000738295_100000740811 [0,0,0,0,0,0|4,0,0]=4 60 B20R2.174735 O=C(C=Cc1ccccn1)NNCc2ccncc2 22a_100000736929_100000740811 [0,0,0,0,0,0|4,0,0]=4 61 B20R2.174735 O=C(C=Cc1cccnc1)C/C=C/c2ccccc2 1458a_100000735890_100016265936 [0,0,0,0,0,0|2,0,2]=4 62 B20R2.174735 O=C(C=Cc1cccnc1)CC#Cc2ccccc2 1458a_100000735890_100011352542 [0,0,0,0,0,0|2,0,2]=4 63 B20R2.174735 O=C(C=Cc1cccnc1)CCCc2ccccc2 1458a_100000735890_100000211621 [0,0,0,0,0,0|2,0,0]=2 64 B20R2.174735 O=C(C=Cc1cccnc1)CCOc2ccccc2 1458a_100000735890_100000184471 [0,0,0,0,0,0|3,0,0]=3 65 B20R2.174735 O=C(C=Cc1cccnc1)CCSc2ccccc2 1458a_100000735890_100000246102 [0,0,0,0,0,0|3,0,0]=3 66 B20R2.174735 O=C(C=Cc1cccnc1)CSCc2ccccc2 1458a_100000735890_200011217039 [0,0,0,0,0,0|3,0,0]=3 67 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccccc2 11a_100000106460_100000735890 [0,0,0,0,0,0|2,0,0]=2 68 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccccc2 240690a_100000106460_100000735890 [0,0,0,0,0,0|2,0,0]=2 69 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccccn2 11a_100000211156_100000735890 [0,0,0,0,0,0|3,0,0]=3 70 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccccn2 240690a_100000211156_100000735890 [0,0,0,0,0,0|3,0,0]=3 71 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2cccnc2 11a_100000736294_100000735890 [0,0,0,0,0,0|3,0,0]=3 72 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2cccnc2 240690a_100000736294_100000735890 [0,0,0,0,0,0|3,0,0]=3 73 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccncc2 11a_100000742849_100000735890 [0,0,0,0,0,0|3,0,0]=3 74 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2ccncc2 240690a_100000742849_100000735890 [0,0,0,0,0,0|3,0,0]=3 75 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2cnccn2 11a_100000723456_100000735890 [0,0,0,0,0,0|4,0,0]=4 76 B20R2.174735 O=C(C=Cc1cccnc1)NCCc2cnccn2 240690a_100000723456_100000735890 [0,0,0,0,0,0|4,0,0]=4 77 B20R2.174735 O=C(C=Cc1cccnc1)NNCc2ccccc2 22a_100000007032_100000735890 [0,0,0,0,0,0|3,0,0]=3 78 B20R2.174735 O=C(C=Cc1cccnc1)NNCc2ccccn2 22a_100000736832_100000735890 [0,0,0,0,0,0|4,0,0]=4 79 B20R2.174735 O=C(C=Cc1cccnc1)NNCc2cccnc2 22a_100000738295_100000735890 [0,0,0,0,0,0|4,0,0]=4 80 B20R2.174735 O=C(C=Cc1cccnc1)NNCc2ccncc2 22a_100000736929_100000735890 [0,0,0,0,0,0|4,0,0]=4 81 B20R2.174735 O=C(C=Cc1ccncc1)C/C=C/c2ccccc2 1458a_100000682801_100016265936 [0,0,0,0,0,0|2,0,2]=4 82 B20R2.174735 O=C(C=Cc1ccncc1)CC#Cc2ccccc2 1458a_100000682801_100011352542 [0,0,0,0,0,0|2,0,2]=4 83 B20R2.174735 O=C(C=Cc1ccncc1)CCCc2ccccc2 1458a_100000682801_100000211621 [0,0,0,0,0,0|2,0,0]=2 84 B20R2.174735 O=C(C=Cc1ccncc1)CCOc2ccccc2 1458a_100000682801_100000184471 [0,0,0,0,0,0|3,0,0]=3 85 B20R2.174735 O=C(C=Cc1ccncc1)CCSc2ccccc2 1458a_100000682801_100000246102 [0,0,0,0,0,0|3,0,0]=3 86 B20R2.174735 O=C(C=Cc1ccncc1)CSCc2ccccc2 1458a_100000682801_200011217039 [0,0,0,0,0,0|3,0,0]=3 87 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2ccccc2 240690a_100000106460_100000682801 [0,0,0,0,0,0|2,0,0]=2 88 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2ccccn2 240690a_100000211156_100000682801 [0,0,0,0,0,0|3,0,0]=3 89 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2cccnc2 240690a_100000736294_100000682801 [0,0,0,0,0,0|3,0,0]=3 90 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2ccncc2 240690a_100000742849_100000682801 [0,0,0,0,0,0|3,0,0]=3 91 B20R2.174735 O=C(C=Cc1ccncc1)NCCc2cnccn2 240690a_100000723456_100000682801 [0,0,0,0,0,0|4,0,0]=4 92 B20R2.174735 O=C(C=Cc1ccncc1)NNCc2ccccc2 22a_100000007032_100000682801 [0,0,0,0,0,0|3,0,0]=3 93 B20R2.174735 O=C(C=Cc1ccncc1)NNCc2ccccn2 22a_100000736832_100000682801 [0,0,0,0,0,0|4,0,0]=4 94 B20R2.174735 O=C(C=Cc1ccncc1)NNCc2cccnc2 22a_100000738295_100000682801 [0,0,0,0,0,0|4,0,0]=4 95 B20R2.174735 O=C(C=Cc1ccncc1)NNCc2ccncc2 22a_100000736929_100000682801 [0,0,0,0,0,0|4,0,0]=4 96 B20R2.174735 O=C(C=Cc1cncnc1)COCc2ccccc2 6a_100000749868_100011215004 [0,0,0,0,0,0|4,0,0]=4 97 B20R2.174735 O=C(C=Cc1cncnc1)CSCc2ccccc2 6a_100000749868_100000172147 [0,0,0,0,0,0|4,0,0]=4 98 B20R2.174735 O=C(CCCc1ccccc1)CCc2ccccc2 1458a_100000185753_100000211621 [0,0,0,0,0,0|1,0,2]=3 99 B20R2.174735 O=C(CCCc1ccccc1)CCc2ccccc2 1458a_100011207963_100000765856 [0,0,0,0,0,0|1,0,2]=3 100 B20R2.174735 O=C(CCCc1ccccc1)CCc2ccccn2 1458a_100011207963_100015183660 [0,0,0,0,0,0|2,0,2]=4 101 B20R2.174735 O=C(CCCc1ccccc1)CCc2ccccn2 1458a_100015195070_100000211621 [0,0,0,0,0,0|2,0,2]=4 102 B20R2.174735 O=C(CCCc1ccccc1)CCc2cccnc2 1458a_100000198484_100000211621 [0,0,0,0,0,0|2,0,2]=4 103 B20R2.174735 O=C(CCCc1ccccc1)CCc2cccnc2 1458a_100011207963_200011713674 [0,0,0,0,0,0|2,0,2]=4 104 B20R2.174735 O=C(CCCc1ccccc1)CCc2ccncc2 1458a_100011207963_100000723409 [0,0,0,0,0,0|2,0,2]=4 105 B20R2.174735 O=C(CCCc1ccccc1)CCc2ccncc2 1458a_100011225043_100000211621 [0,0,0,0,0,0|2,0,2]=4 106 B20R2.174735 O=C(CCCc1ccccc1)COc2ccccc2 1458a_100000186222_100000211621 [0,0,0,0,0,0|2,0,1]=3 107 B20R2.174735 O=C(CCCc1ccccc1)COc2ccccn2 1458a_100102699861_100000211621 [0,0,0,0,0,0|3,0,1]=4 108 B20R2.174735 O=C(CCCc1ccccc1)COc2cccnc2 1458a_100015207166_100000211621 [0,0,0,0,0,0|3,0,1]=4 109 B20R2.174735 O=C(CCCc1ccccc1)CSc2ccccc2 1458a_100000211596_100000211621 [0,0,0,0,0,0|2,0,1]=3 110 B20R2.174735 O=C(CCCc1ccccc1)CSc2ccccn2 1458a_100000156281_100000211621 [0,0,0,0,0,0|3,0,1]=4 111 B20R2.174735 O=C(CCCc1ccccc1)CSc2ccncc2 1458a_100000211328_100000211621 [0,0,0,0,0,0|3,0,1]=4 112 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 11a_100015324214_100011207963 [0,0,0,0,0,0|2,0,1]=3 113 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 1626a_100015324214_100011207963 [0,0,0,0,0,0|2,0,1]=3 114 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 240690a_100015324214_100011207963 [0,0,0,0,0,0|2,0,1]=3 115 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 527a_100015324214_100011207963 [0,0,0,0,0,0|2,0,1]=3 116 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccn2 11a_100000210449_100011207963 [0,0,0,0,0,0|3,0,1]=4 117 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccn2 1626a_100000210449_100011207963 [0,0,0,0,0,0|3,0,1]=4 118 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccn2 240690a_100000210449_100011207963 [0,0,0,0,0,0|3,0,1]=4 119 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccn2 527a_100000210449_100011207963 [0,0,0,0,0,0|3,0,1]=4 120 B20R2.174735 O=C(CCCc1ccccc1)NCc2cccnc2 11a_100000210453_100011207963 [0,0,0,0,0,0|3,0,1]=4 121 B20R2.174735 O=C(CCCc1ccccc1)NCc2cccnc2 240690a_100000210453_100011207963 [0,0,0,0,0,0|3,0,1]=4 122 B20R2.174735 O=C(CCCc1ccccc1)NCc2cccnc2 527a_100000210453_100011207963 [0,0,0,0,0,0|3,0,1]=4 123 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccncc2 11a_100000210450_100011207963 [0,0,0,0,0,0|3,0,1]=4 124 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccncc2 1626a_100000210450_100011207963 [0,0,0,0,0,0|3,0,1]=4 125 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccncc2 240690a_100000210450_100011207963 [0,0,0,0,0,0|3,0,1]=4 126 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccncc2 527a_100000210450_100011207963 [0,0,0,0,0,0|3,0,1]=4 127 B20R2.174735 O=C(CCCc1ccccc1)NNc2ccccc2 22a_100015195140_100011207963 [0,0,0,0,0,0|3,0,0]=3 128 B20R2.174735 O=C(CCCc1ccccc1)NNc2ccccn2 22a_100000183288_100011207963 [0,0,0,0,0,0|4,0,0]=4 129 B20R2.174735 O=C(CCCc1ccccc1)NNc2cccnc2 22a_100000728903_100011207963 [0,0,0,0,0,0|4,0,0]=4 130 B20R2.174735 O=C(CCCc1ccccc1)NNc2ccncc2 22a_100000698918_100011207963 [0,0,0,0,0,0|4,0,0]=4 131 B20R2.174735 O=C(CCCc1ccccn1)CCc2ccccc2 1458a_100000752327_100000765856 [0,0,0,0,0,0|2,0,2]=4 132 B20R2.174735 O=C(CCCc1ccccn1)NCc2ccccc2 11a_100015324214_100000752327 [0,0,0,0,0,0|3,0,1]=4 133 B20R2.174735 O=C(CCCc1ccccn1)NCc2ccccc2 1626a_100015324214_100000752327 [0,0,0,0,0,0|3,0,1]=4 134 B20R2.174735 O=C(CCCc1ccccn1)NCc2ccccc2 240690a_100015324214_100000752327 [0,0,0,0,0,0|3,0,1]=4 135 B20R2.174735 O=C(CCCc1ccccn1)NCc2ccccc2 527a_100015324214_100000752327 [0,0,0,0,0,0|3,0,1]=4 136 B20R2.174735 O=C(CCCc1ccccn1)NNc2ccccc2 22a_100015195140_100000752327 [0,0,0,0,0,0|4,0,0]=4 137 B20R2.174735 O=C(CCCc1ccncc1)CCc2ccccc2 1458a_100020654287_100000765856 [0,0,0,0,0,0|2,0,2]=4 138 B20R2.174735 O=C(CCCc1ccncc1)NCc2ccccc2 11a_100015324214_100020654287 [0,0,0,0,0,0|3,0,1]=4 139 B20R2.174735 O=C(CCCc1ccncc1)NCc2ccccc2 1626a_100015324214_100020654287 [0,0,0,0,0,0|3,0,1]=4 140 B20R2.174735 O=C(CCCc1ccncc1)NCc2ccccc2 240690a_100015324214_100020654287 [0,0,0,0,0,0|3,0,1]=4 141 B20R2.174735 O=C(CCCc1ccncc1)NCc2ccccc2 527a_100015324214_100020654287 [0,0,0,0,0,0|3,0,1]=4 142 B20R2.174735 O=C(CCCc1ccncc1)NNc2ccccc2 22a_100015195140_100020654287 [0,0,0,0,0,0|4,0,0]=4 143 B20R2.174735 O=C(CCOc1ccccc1)CCc2ccccc2 1458a_100000182761_100000765856 [0,0,0,0,0,0|2,0,2]=4 144 B20R2.174735 O=C(CCOc1ccccc1)CCc2ccccc2 1458a_100000185753_100000184471 [0,0,0,0,0,0|2,0,2]=4 145 B20R2.174735 O=C(CCOc1ccccc1)COc2ccccc2 1458a_100000186222_100000184471 [0,0,0,0,0,0|3,0,1]=4 146 B20R2.174735 O=C(CCOc1ccccc1)CSc2ccccc2 1458a_100000211596_100000184471 [0,0,0,0,0,0|3,0,1]=4 147 B20R2.174735 O=C(CCOc1ccccc1)NCc2ccccc2 11a_100015324214_100000182761 [0,0,0,0,0,0|3,0,1]=4 148 B20R2.174735 O=C(CCOc1ccccc1)NCc2ccccc2 1626a_100015324214_100000182761 [0,0,0,0,0,0|3,0,1]=4 149 B20R2.174735 O=C(CCOc1ccccc1)NCc2ccccc2 240690a_100015324214_100000182761 [0,0,0,0,0,0|3,0,1]=4 150 B20R2.174735 O=C(CCOc1ccccc1)NNc2ccccc2 22a_100015195140_100000182761 [0,0,0,0,0,0|4,0,0]=4 151 B20R2.174735 O=C(CCOc1ccccc1)OCc2ccccc2 7a_100000210340_100009813219 [0,0,0,0,0,0|3,0,1]=4 152 B20R2.174735 O=C(CCSc1ccccc1)CCc2ccccc2 1458a_100000182436_100000765856 [0,0,0,0,0,0|2,0,2]=4 153 B20R2.174735 O=C(CCSc1ccccc1)CCc2ccccc2 1458a_100000185753_100000246102 [0,0,0,0,0,0|2,0,2]=4 154 B20R2.174735 O=C(CCSc1ccccc1)COc2ccccc2 1458a_100000186222_100000246102 [0,0,0,0,0,0|3,0,1]=4 155 B20R2.174735 O=C(CCSc1ccccc1)CSc2ccccc2 1458a_100000211596_100000246102 [0,0,0,0,0,0|3,0,1]=4 156 B20R2.174735 O=C(CCSc1ccccc1)NCc2ccccc2 11a_100015324214_100000182436 [0,0,0,0,0,0|3,0,1]=4 157 B20R2.174735 O=C(CCSc1ccccc1)NCc2ccccc2 1626a_100015324214_100000182436 [0,0,0,0,0,0|3,0,1]=4 158 B20R2.174735 O=C(CCSc1ccccc1)NCc2ccccc2 240690a_100015324214_100000182436 [0,0,0,0,0,0|3,0,1]=4 159 B20R2.174735 O=C(CCSc1ccccc1)NNc2ccccc2 22a_100015195140_100000182436 [0,0,0,0,0,0|4,0,0]=4 160 B20R2.174735 O=C(CCSc1ccccc1)OCc2ccccc2 62a_100000719477_100009813219 [0,0,0,0,0,0|3,0,1]=4 161 B20R2.174735 O=C(CCSc1ccccc1)OCc2ccccc2 62a_100009813219_100000041952 [0,0,0,0,0,0|3,0,1]=4 162 B20R2.174735 O=C(CCc1ccccc1)CNCc2ccccc2 2230a_100015324214_100012361361 [0,0,0,0,0,0|2,0,2]=4 163 B20R2.174735 O=C(CCc1ccccc1)CNCc2ccccc2 34a_100015324214_100012361361 [0,0,0,0,0,0|2,0,2]=4 164 B20R2.174735 O=C(CCc1ccccc1)COCc2ccccc2 1458a_100000230186_100000765856 [0,0,0,0,0,0|2,0,2]=4 165 B20R2.174735 O=C(CCc1ccccc1)COCc2ccccc2 34a_100000210790_100012361361 [0,0,0,0,0,0|2,0,2]=4 166 B20R2.174735 O=C(CCc1ccccc1)COCc2ccccc2 7a_100000210790_100012361361 [0,0,0,0,0,0|2,0,2]=4 167 B20R2.174735 O=C(CCc1ccccc1)CSCc2ccccc2 1458a_100000150264_100000765856 [0,0,0,0,0,0|2,0,2]=4 168 B20R2.174735 O=C(CCc1ccccc1)CSCc2ccccc2 1458a_100000185753_200011217039 [0,0,0,0,0,0|2,0,2]=4 169 B20R2.174735 O=C(CCc1ccccc1)CSCc2ccccc2 62a_100000211182_100012361361 [0,0,0,0,0,0|2,0,2]=4 170 B20R2.174735 O=C(CCc1ccccc1)CSCc2ccccc2 62a_100012361361_100015291786 [0,0,0,0,0,0|2,0,2]=4 171 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccc2 11a_100000106460_100000185753 [0,0,0,0,0,0|1,0,2]=3 172 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000185753 [0,0,0,0,0,0|1,0,2]=3 173 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000185753 [0,0,0,0,0,0|1,0,2]=3 174 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccc2 527a_100000106460_100000185753 [0,0,0,0,0,0|1,0,2]=3 175 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccn2 11a_100000211156_100000185753 [0,0,0,0,0,0|2,0,2]=4 176 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccn2 1626a_100000211156_100000185753 [0,0,0,0,0,0|2,0,2]=4 177 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccn2 240690a_100000211156_100000185753 [0,0,0,0,0,0|2,0,2]=4 178 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccccn2 527a_100000211156_100000185753 [0,0,0,0,0,0|2,0,2]=4 179 B20R2.174735 O=C(CCc1ccccc1)NCCc2cccnc2 11a_100000736294_100000185753 [0,0,0,0,0,0|2,0,2]=4 180 B20R2.174735 O=C(CCc1ccccc1)NCCc2cccnc2 1626a_100000736294_100000185753 [0,0,0,0,0,0|2,0,2]=4 181 B20R2.174735 O=C(CCc1ccccc1)NCCc2cccnc2 240690a_100000736294_100000185753 [0,0,0,0,0,0|2,0,2]=4 182 B20R2.174735 O=C(CCc1ccccc1)NCCc2cccnc2 527a_100000736294_100000185753 [0,0,0,0,0,0|2,0,2]=4 183 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccncc2 11a_100000742849_100000185753 [0,0,0,0,0,0|2,0,2]=4 184 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccncc2 1626a_100000742849_100000185753 [0,0,0,0,0,0|2,0,2]=4 185 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccncc2 240690a_100000742849_100000185753 [0,0,0,0,0,0|2,0,2]=4 186 B20R2.174735 O=C(CCc1ccccc1)NCCc2ccncc2 527a_100000742849_100000185753 [0,0,0,0,0,0|2,0,2]=4 187 B20R2.174735 O=C(CCc1ccccc1)NNCc2ccccc2 22a_100000007032_100000185753 [0,0,0,0,0,0|2,0,2]=4 188 B20R2.174735 O=C(CCc1ccccn1)NCCc2ccccc2 11a_100000106460_100015195070 [0,0,0,0,0,0|2,0,2]=4 189 B20R2.174735 O=C(CCc1ccccn1)NCCc2ccccc2 240690a_100000106460_100015195070 [0,0,0,0,0,0|2,0,2]=4 190 B20R2.174735 O=C(CCc1ccccn1)NCCc2ccccc2 527a_100000106460_100015195070 [0,0,0,0,0,0|2,0,2]=4 191 B20R2.174735 O=C(CCc1cccnc1)NCCc2ccccc2 11a_100000106460_100000198484 [0,0,0,0,0,0|2,0,2]=4 192 B20R2.174735 O=C(CCc1cccnc1)NCCc2ccccc2 1626a_100000106460_100000198484 [0,0,0,0,0,0|2,0,2]=4 193 B20R2.174735 O=C(CCc1cccnc1)NCCc2ccccc2 240690a_100000106460_100000198484 [0,0,0,0,0,0|2,0,2]=4 194 B20R2.174735 O=C(CCc1cccnc1)NCCc2ccccc2 527a_100000106460_100000198484 [0,0,0,0,0,0|2,0,2]=4 195 B20R2.174735 O=C(CCc1ccncc1)NCCc2ccccc2 11a_100000106460_100011225043 [0,0,0,0,0,0|2,0,2]=4 196 B20R2.174735 O=C(CCc1ccncc1)NCCc2ccccc2 240690a_100000106460_100011225043 [0,0,0,0,0,0|2,0,2]=4 197 B20R2.174735 O=C(CCc1ccncc1)NCCc2ccccc2 527a_100000106460_100011225043 [0,0,0,0,0,0|2,0,2]=4 198 B20R2.174735 O=C(CNCc1ccccc1)NCc2ccccc2 2230a_100000739245_100015291786 [0,0,0,0,0,0|3,0,1]=4 199 B20R2.174735 O=C(CNCc1ccccc1)NCc2ccccc2 2230a_100015324214_100000183539 [0,0,0,0,0,0|3,0,1]=4 200 B20R2.174735 O=C(CNCc1ccccc1)NCc2ccccc2 270004a_100000739245_100015611070 [0,0,0,0,0,0|3,0,1]=4 201 B20R2.174735 O=C(CNCc1ccccc1)NCc2ccccc2 34a_100015324214_100000183539 [0,0,0,0,0,0|3,0,1]=4 202 B20R2.174735 O=C(CNCc1ccccc1)OCc2ccccc2 2230a_100015324214_100000753625 [0,0,0,0,0,0|3,0,1]=4 203 B20R2.174735 O=C(CNCc1ccccc1)OCc2ccccc2 34a_100015324214_100000753625 [0,0,0,0,0,0|3,0,1]=4 204 B20R2.174735 O=C(CNc1ccccc1)NCCc2ccccc2 34a_100000106764_100000183012 [0,0,0,0,0,0|2,0,1]=3 205 B20R2.174735 O=C(CNc1ccccc1)NOCc2ccccc2 34a_100000106764_100000230105 [0,0,0,0,0,0|3,0,1]=4 206 B20R2.174735 O=C(CNc1ccccc1)OCCc2ccccc2 34a_100000106764_200000077782 [0,0,0,0,0,0|1,0,1]=2 207 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 11a_100015324214_100000230186 [0,0,0,0,0,0|3,0,1]=4 208 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000230186 [0,0,0,0,0,0|3,0,1]=4 209 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000230186 [0,0,0,0,0,0|3,0,1]=4 210 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 34a_100000210790_100000183539 [0,0,0,0,0,0|3,0,1]=4 211 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 527a_100015324214_100000230186 [0,0,0,0,0,0|3,0,1]=4 212 B20R2.174735 O=C(COCc1ccccc1)NCc2ccccc2 7a_100000210790_100000183539 [0,0,0,0,0,0|3,0,1]=4 213 B20R2.174735 O=C(COCc1ccccc1)NNc2ccccc2 22a_100015195140_100000230186 [0,0,0,0,0,0|4,0,0]=4 214 B20R2.174735 O=C(COCc1ccccc1)OCc2ccccc2 34a_100000210790_100000753625 [0,0,0,0,0,0|3,0,1]=4 215 B20R2.174735 O=C(COCc1ccccc1)OCc2ccccc2 7a_100000210790_100000753625 [0,0,0,0,0,0|3,0,1]=4 216 B20R2.174735 O=C(COc1ccccc1)CSCc2ccccc2 1458a_100000186222_200011217039 [0,0,0,0,0,0|3,0,1]=4 217 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 11a_100000106460_100000186222 [0,0,0,0,0,0|2,0,1]=3 218 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000186222 [0,0,0,0,0,0|2,0,1]=3 219 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000186222 [0,0,0,0,0,0|2,0,1]=3 220 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 34a_100000210340_100000183012 [0,0,0,0,0,0|2,0,1]=3 221 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 527a_100000106460_100000186222 [0,0,0,0,0,0|2,0,1]=3 222 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 7a_100000210340_100000183012 [0,0,0,0,0,0|2,0,1]=3 223 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccn2 11a_100000211156_100000186222 [0,0,0,0,0,0|3,0,1]=4 224 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccn2 1626a_100000211156_100000186222 [0,0,0,0,0,0|3,0,1]=4 225 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccn2 240690a_100000211156_100000186222 [0,0,0,0,0,0|3,0,1]=4 226 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccn2 527a_100000211156_100000186222 [0,0,0,0,0,0|3,0,1]=4 227 B20R2.174735 O=C(COc1ccccc1)NCCc2cccnc2 11a_100000736294_100000186222 [0,0,0,0,0,0|3,0,1]=4 228 B20R2.174735 O=C(COc1ccccc1)NCCc2cccnc2 1626a_100000736294_100000186222 [0,0,0,0,0,0|3,0,1]=4 229 B20R2.174735 O=C(COc1ccccc1)NCCc2cccnc2 240690a_100000736294_100000186222 [0,0,0,0,0,0|3,0,1]=4 230 B20R2.174735 O=C(COc1ccccc1)NCCc2cccnc2 527a_100000736294_100000186222 [0,0,0,0,0,0|3,0,1]=4 231 B20R2.174735 O=C(COc1ccccc1)NCCc2ccncc2 11a_100000742849_100000186222 [0,0,0,0,0,0|3,0,1]=4 232 B20R2.174735 O=C(COc1ccccc1)NCCc2ccncc2 1626a_100000742849_100000186222 [0,0,0,0,0,0|3,0,1]=4 233 B20R2.174735 O=C(COc1ccccc1)NCCc2ccncc2 240690a_100000742849_100000186222 [0,0,0,0,0,0|3,0,1]=4 234 B20R2.174735 O=C(COc1ccccc1)NCCc2ccncc2 527a_100000742849_100000186222 [0,0,0,0,0,0|3,0,1]=4 235 B20R2.174735 O=C(COc1ccccc1)NNCc2ccccc2 22a_100000007032_100000186222 [0,0,0,0,0,0|3,0,1]=4 236 B20R2.174735 O=C(COc1ccccc1)NOCc2ccccc2 34a_100000210340_100000230105 [0,0,0,0,0,0|3,0,1]=4 237 B20R2.174735 O=C(COc1ccccc1)NOCc2ccccc2 7a_100000210340_100000230105 [0,0,0,0,0,0|3,0,1]=4 238 B20R2.174735 O=C(COc1ccccc1)OCCc2ccccc2 34a_100000210340_200000077782 [0,0,0,0,0,0|1,0,1]=2 239 B20R2.174735 O=C(COc1ccccc1)OCCc2ccccc2 7a_100000210340_200000077782 [0,0,0,0,0,0|1,0,1]=2 240 B20R2.174735 O=C(COc1ccccn1)NCCc2ccccc2 1626a_100000106460_100102699861 [0,0,0,0,0,0|3,0,1]=4 241 B20R2.174735 O=C(COc1ccccn1)NCCc2ccccc2 240690a_100000106460_100102699861 [0,0,0,0,0,0|3,0,1]=4 242 B20R2.174735 O=C(COc1ccccn1)NCCc2ccccc2 527a_100000106460_100102699861 [0,0,0,0,0,0|3,0,1]=4 243 B20R2.174735 O=C(COc1cccnc1)NCCc2ccccc2 11a_100000106460_100015207166 [0,0,0,0,0,0|3,0,1]=4 244 B20R2.174735 O=C(COc1cccnc1)NCCc2ccccc2 1626a_100000106460_100015207166 [0,0,0,0,0,0|3,0,1]=4 245 B20R2.174735 O=C(COc1cccnc1)NCCc2ccccc2 240690a_100000106460_100015207166 [0,0,0,0,0,0|3,0,1]=4 246 B20R2.174735 O=C(COc1cccnc1)NCCc2ccccc2 34a_100000210849_100000183012 [0,0,0,0,0,0|3,0,1]=4 247 B20R2.174735 O=C(COc1cccnc1)NCCc2ccccc2 527a_100000106460_100015207166 [0,0,0,0,0,0|3,0,1]=4 248 B20R2.174735 O=C(COc1cccnc1)NCCc2ccccc2 7a_100000210849_100000183012 [0,0,0,0,0,0|3,0,1]=4 249 B20R2.174735 O=C(COc1cccnc1)OCCc2ccccc2 34a_100000210849_200000077782 [0,0,0,0,0,0|2,0,1]=3 250 B20R2.174735 O=C(COc1cccnc1)OCCc2ccccc2 7a_100000210849_200000077782 [0,0,0,0,0,0|2,0,1]=3 251 B20R2.174735 O=C(COc1ccncc1)NCCc2ccccc2 34a_100000212176_100000183012 [0,0,0,0,0,0|3,0,1]=4 252 B20R2.174735 O=C(COc1ccncc1)OCCc2ccccc2 34a_100000212176_200000077782 [0,0,0,0,0,0|2,0,1]=3 253 B20R2.174735 O=C(COc1ccnnc1)OCCc2ccccc2 34a_100015204005_200000077782 [0,0,0,0,0,0|3,0,1]=4 254 B20R2.174735 O=C(COc1cncnc1)OCCc2ccccc2 7a_100000754086_200000077782 [0,0,0,0,0,0|3,0,1]=4 255 B20R2.174735 O=C(CSCc1ccccc1)CSc2ccccc2 1458a_100000211596_200011217039 [0,0,0,0,0,0|3,0,1]=4 256 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 11a_100015324214_100000150264 [0,0,0,0,0,0|3,0,1]=4 257 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000150264 [0,0,0,0,0,0|3,0,1]=4 258 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000150264 [0,0,0,0,0,0|3,0,1]=4 259 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 527a_100015324214_100000150264 [0,0,0,0,0,0|3,0,1]=4 260 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 62a_100000183539_100015291786 [0,0,0,0,0,0|3,0,1]=4 261 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 62a_100000211182_100000183539 [0,0,0,0,0,0|3,0,1]=4 262 B20R2.174735 O=C(CSCc1ccccc1)NNc2ccccc2 22a_100015195140_100000150264 [0,0,0,0,0,0|4,0,0]=4 263 B20R2.174735 O=C(CSCc1ccccc1)OCc2ccccc2 62a_100000211182_100000753625 [0,0,0,0,0,0|3,0,1]=4 264 B20R2.174735 O=C(CSCc1ccccc1)OCc2ccccc2 62a_100000753625_100015291786 [0,0,0,0,0,0|3,0,1]=4 265 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 11a_100000106460_100000211596 [0,0,0,0,0,0|2,0,1]=3 266 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000211596 [0,0,0,0,0,0|2,0,1]=3 267 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000211596 [0,0,0,0,0,0|2,0,1]=3 268 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 527a_100000106460_100000211596 [0,0,0,0,0,0|2,0,1]=3 269 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 62a_100000183012_100000041952 [0,0,0,0,0,0|2,0,1]=3 270 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 62a_100000719477_100000183012 [0,0,0,0,0,0|2,0,1]=3 271 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccn2 11a_100000211156_100000211596 [0,0,0,0,0,0|3,0,1]=4 272 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccn2 1626a_100000211156_100000211596 [0,0,0,0,0,0|3,0,1]=4 273 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccn2 240690a_100000211156_100000211596 [0,0,0,0,0,0|3,0,1]=4 274 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccn2 527a_100000211156_100000211596 [0,0,0,0,0,0|3,0,1]=4 275 B20R2.174735 O=C(CSc1ccccc1)NCCc2cccnc2 11a_100000736294_100000211596 [0,0,0,0,0,0|3,0,1]=4 276 B20R2.174735 O=C(CSc1ccccc1)NCCc2cccnc2 1626a_100000736294_100000211596 [0,0,0,0,0,0|3,0,1]=4 277 B20R2.174735 O=C(CSc1ccccc1)NCCc2cccnc2 240690a_100000736294_100000211596 [0,0,0,0,0,0|3,0,1]=4 278 B20R2.174735 O=C(CSc1ccccc1)NCCc2cccnc2 527a_100000736294_100000211596 [0,0,0,0,0,0|3,0,1]=4 279 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccncc2 11a_100000742849_100000211596 [0,0,0,0,0,0|3,0,1]=4 280 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccncc2 1626a_100000742849_100000211596 [0,0,0,0,0,0|3,0,1]=4 281 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccncc2 240690a_100000742849_100000211596 [0,0,0,0,0,0|3,0,1]=4 282 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccncc2 527a_100000742849_100000211596 [0,0,0,0,0,0|3,0,1]=4 283 B20R2.174735 O=C(CSc1ccccc1)NNCc2ccccc2 22a_100000007032_100000211596 [0,0,0,0,0,0|3,0,1]=4 284 B20R2.174735 O=C(CSc1ccccc1)NOCc2ccccc2 62a_100000230105_100000041952 [0,0,0,0,0,0|3,0,1]=4 285 B20R2.174735 O=C(CSc1ccccc1)NOCc2ccccc2 62a_100000719477_100000230105 [0,0,0,0,0,0|3,0,1]=4 286 B20R2.174735 O=C(CSc1ccccc1)OCCc2ccccc2 62a_100000719477_200000077782 [0,0,0,0,0,0|1,0,1]=2 287 B20R2.174735 O=C(CSc1ccccc1)OCCc2ccccc2 62a_200000077782_100000041952 [0,0,0,0,0,0|1,0,1]=2 288 B20R2.174735 O=C(CSc1ccccn1)NCCc2ccccc2 11a_100000106460_100000156281 [0,0,0,0,0,0|3,0,1]=4 289 B20R2.174735 O=C(CSc1ccccn1)NCCc2ccccc2 240690a_100000106460_100000156281 [0,0,0,0,0,0|3,0,1]=4 290 B20R2.174735 O=C(CSc1ccccn1)NCCc2ccccc2 527a_100000106460_100000156281 [0,0,0,0,0,0|3,0,1]=4 291 B20R2.174735 O=C(CSc1ccccn1)NCCc2ccccc2 62a_100000183012_100011216584 [0,0,0,0,0,0|3,0,1]=4 292 B20R2.174735 O=C(CSc1ccccn1)NCCc2ccccc2 62a_100011216584_100000183012 [0,0,0,0,0,0|3,0,1]=4 293 B20R2.174735 O=C(CSc1ccccn1)OCCc2ccccc2 62a_100011216584_200000077782 [0,0,0,0,0,0|2,0,1]=3 294 B20R2.174735 O=C(CSc1ccccn1)OCCc2ccccc2 62a_200000077782_100011216584 [0,0,0,0,0,0|2,0,1]=3 295 B20R2.174735 O=C(CSc1cccnc1)NCCc2ccccc2 62a_100000183012_100000210063 [0,0,0,0,0,0|3,0,1]=4 296 B20R2.174735 O=C(CSc1cccnc1)NCCc2ccccc2 62a_100000210063_100000183012 [0,0,0,0,0,0|3,0,1]=4 297 B20R2.174735 O=C(CSc1cccnc1)OCCc2ccccc2 62a_100000210063_200000077782 [0,0,0,0,0,0|2,0,1]=3 298 B20R2.174735 O=C(CSc1cccnc1)OCCc2ccccc2 62a_200000077782_100000210063 [0,0,0,0,0,0|2,0,1]=3 299 B20R2.174735 O=C(CSc1cccnn1)OCCc2ccccc2 62a_100016991348_200000077782 [0,0,0,0,0,0|3,0,1]=4 300 B20R2.174735 O=C(CSc1cccnn1)OCCc2ccccc2 62a_200000077782_100016991348 [0,0,0,0,0,0|3,0,1]=4 301 B20R2.174735 O=C(CSc1ccncc1)NCCc2ccccc2 11a_100000106460_100000211328 [0,0,0,0,0,0|3,0,1]=4 302 B20R2.174735 O=C(CSc1ccncc1)NCCc2ccccc2 1626a_100000106460_100000211328 [0,0,0,0,0,0|3,0,1]=4 303 B20R2.174735 O=C(CSc1ccncc1)NCCc2ccccc2 240690a_100000106460_100000211328 [0,0,0,0,0,0|3,0,1]=4 304 B20R2.174735 O=C(CSc1ccncc1)NCCc2ccccc2 527a_100000106460_100000211328 [0,0,0,0,0,0|3,0,1]=4 305 B20R2.174735 O=C(CSc1ccncc1)NCCc2ccccc2 62a_100000183012_100000728582 [0,0,0,0,0,0|3,0,1]=4 306 B20R2.174735 O=C(CSc1ccncc1)NCCc2ccccc2 62a_100000728582_100000183012 [0,0,0,0,0,0|3,0,1]=4 307 B20R2.174735 O=C(CSc1ccncc1)OCCc2ccccc2 62a_100000728582_200000077782 [0,0,0,0,0,0|2,0,1]=3 308 B20R2.174735 O=C(CSc1ccncc1)OCCc2ccccc2 62a_200000077782_100000728582 [0,0,0,0,0,0|2,0,1]=3 309 B20R2.174735 O=C(CSc1ccncn1)OCCc2ccccc2 62a_100000703185_200000077782 [0,0,0,0,0,0|3,0,1]=4 310 B20R2.174735 O=C(CSc1ccncn1)OCCc2ccccc2 62a_200000077782_100000703185 [0,0,0,0,0,0|3,0,1]=4 311 B20R2.174735 O=C(CSc1ccnnc1)OCCc2ccccc2 62a_100000732662_200000077782 [0,0,0,0,0,0|3,0,1]=4 312 B20R2.174735 O=C(CSc1ccnnc1)OCCc2ccccc2 62a_200000077782_100000732662 [0,0,0,0,0,0|3,0,1]=4 313 B20R2.174735 O=C(CSc1cnccn1)OCCc2ccccc2 62a_100000211759_200000077782 [0,0,0,0,0,0|3,0,1]=4 314 B20R2.174735 O=C(CSc1cnccn1)OCCc2ccccc2 62a_200000077782_100000211759 [0,0,0,0,0,0|3,0,1]=4 315 B20R2.174735 O=C(CSc1cncnc1)OCCc2ccccc2 62a_100011206942_200000077782 [0,0,0,0,0,0|3,0,1]=4 316 B20R2.174735 O=C(CSc1cncnc1)OCCc2ccccc2 62a_200000077782_100011206942 [0,0,0,0,0,0|3,0,1]=4 317 B20R2.174735 O=C(CSc1ncccn1)OCCc2ccccc2 62a_100000211032_200000077782 [0,0,0,0,0,0|3,0,1]=4 318 B20R2.174735 O=C(CSc1ncccn1)OCCc2ccccc2 62a_200000077782_100000211032 [0,0,0,0,0,0|3,0,1]=4 319 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 2708a_100000106460_100015324214 [0,0,0,0,0,0|2,0,1]=3 320 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 2708a_100015324214_100000106460 [0,0,0,0,0,0|2,0,1]=3 321 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 273464a_100000106460_100015324214 [0,0,0,0,0,0|2,0,1]=3 322 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 273464a_100015324214_100000106460 [0,0,0,0,0,0|2,0,1]=3 323 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 512a_100000106460_100015324214 [0,0,0,0,0,0|2,0,1]=3 324 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccc2 512a_100015324214_100000106460 [0,0,0,0,0,0|2,0,1]=3 325 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccn2 2708a_100000106460_100000210449 [0,0,0,0,0,0|3,0,1]=4 326 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccn2 2708a_100000210449_100000106460 [0,0,0,0,0,0|3,0,1]=4 327 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccn2 273464a_100000106460_100000210449 [0,0,0,0,0,0|3,0,1]=4 328 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccn2 273464a_100000210449_100000106460 [0,0,0,0,0,0|3,0,1]=4 329 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccccn2 512a_100000106460_100000210449 [0,0,0,0,0,0|3,0,1]=4 330 B20R2.174735 O=C(NCCc1ccccc1)NCc2cccnc2 2708a_100000106460_100000210453 [0,0,0,0,0,0|3,0,1]=4 331 B20R2.174735 O=C(NCCc1ccccc1)NCc2cccnc2 2708a_100000210453_100000106460 [0,0,0,0,0,0|3,0,1]=4 332 B20R2.174735 O=C(NCCc1ccccc1)NCc2cccnc2 273464a_100000106460_100000210453 [0,0,0,0,0,0|3,0,1]=4 333 B20R2.174735 O=C(NCCc1ccccc1)NCc2cccnc2 273464a_100000210453_100000106460 [0,0,0,0,0,0|3,0,1]=4 334 B20R2.174735 O=C(NCCc1ccccc1)NCc2cccnc2 512a_100000106460_100000210453 [0,0,0,0,0,0|3,0,1]=4 335 B20R2.174735 O=C(NCCc1ccccc1)NCc2cccnc2 512a_100000210453_100000106460 [0,0,0,0,0,0|3,0,1]=4 336 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccncc2 2708a_100000106460_100000210450 [0,0,0,0,0,0|3,0,1]=4 337 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccncc2 2708a_100000210450_100000106460 [0,0,0,0,0,0|3,0,1]=4 338 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccncc2 273464a_100000106460_100000210450 [0,0,0,0,0,0|3,0,1]=4 339 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccncc2 273464a_100000210450_100000106460 [0,0,0,0,0,0|3,0,1]=4 340 B20R2.174735 O=C(NCCc1ccccc1)NCc2ccncc2 512a_100000106460_100000210450 [0,0,0,0,0,0|3,0,1]=4 341 B20R2.174735 O=C(NCCc1ccccc1)NNc2ccccc2 273464a_100000106460_100015195140 [0,0,0,0,0,0|3,0,0]=3 342 B20R2.174735 O=C(NCCc1ccccc1)NNc2ccccc2 512a_100000106460_100015195140 [0,0,0,0,0,0|3,0,0]=3 343 B20R2.174735 O=C(NCCc1ccccc1)NNc2ccccn2 273464a_100000106460_100000183288 [0,0,0,0,0,0|4,0,0]=4 344 B20R2.174735 O=C(NCCc1ccccc1)NNc2ccccn2 512a_100000106460_100000183288 [0,0,0,0,0,0|4,0,0]=4 345 B20R2.174735 O=C(NCCc1ccccc1)NNc2cccnc2 273464a_100000106460_100000728903 [0,0,0,0,0,0|4,0,0]=4 346 B20R2.174735 O=C(NCCc1ccccc1)NNc2cccnc2 512a_100000106460_100000728903 [0,0,0,0,0,0|4,0,0]=4 347 B20R2.174735 O=C(NCCc1ccccc1)NNc2ccncc2 273464a_100000106460_100000698918 [0,0,0,0,0,0|4,0,0]=4 348 B20R2.174735 O=C(NCCc1ccccc1)NNc2ccncc2 512a_100000106460_100000698918 [0,0,0,0,0,0|4,0,0]=4 349 B20R2.174735 O=C(NCCc1ccccc1)OCc2ccccc2 271570a_200010239705_100000210277 [0,0,0,0,0,0|2,0,1]=3 350 B20R2.174735 O=C(NCCc1ccccn1)NCc2ccccc2 2708a_100000211156_100015324214 [0,0,0,0,0,0|3,0,1]=4 351 B20R2.174735 O=C(NCCc1ccccn1)NCc2ccccc2 2708a_100015324214_100000211156 [0,0,0,0,0,0|3,0,1]=4 352 B20R2.174735 O=C(NCCc1ccccn1)NCc2ccccc2 273464a_100000211156_100015324214 [0,0,0,0,0,0|3,0,1]=4 353 B20R2.174735 O=C(NCCc1ccccn1)NCc2ccccc2 273464a_100015324214_100000211156 [0,0,0,0,0,0|3,0,1]=4 354 B20R2.174735 O=C(NCCc1ccccn1)NCc2ccccc2 512a_100015324214_100000211156 [0,0,0,0,0,0|3,0,1]=4 355 B20R2.174735 O=C(NCCc1ccccn1)NNc2ccccc2 273464a_100000211156_100015195140 [0,0,0,0,0,0|4,0,0]=4 356 B20R2.174735 O=C(NCCc1ccccn1)OCc2ccccc2 271570a_200010239705_100011216584 [0,0,0,0,0,0|3,0,1]=4 357 B20R2.174735 O=C(NCCc1cccnc1)NCc2ccccc2 2708a_100000736294_100015324214 [0,0,0,0,0,0|3,0,1]=4 358 B20R2.174735 O=C(NCCc1cccnc1)NCc2ccccc2 2708a_100015324214_100000736294 [0,0,0,0,0,0|3,0,1]=4 359 B20R2.174735 O=C(NCCc1cccnc1)NCc2ccccc2 273464a_100000736294_100015324214 [0,0,0,0,0,0|3,0,1]=4 360 B20R2.174735 O=C(NCCc1cccnc1)NCc2ccccc2 273464a_100015324214_100000736294 [0,0,0,0,0,0|3,0,1]=4 361 B20R2.174735 O=C(NCCc1cccnc1)NCc2ccccc2 512a_100000736294_100015324214 [0,0,0,0,0,0|3,0,1]=4 362 B20R2.174735 O=C(NCCc1cccnc1)NCc2ccccc2 512a_100015324214_100000736294 [0,0,0,0,0,0|3,0,1]=4 363 B20R2.174735 O=C(NCCc1cccnc1)NNc2ccccc2 273464a_100000736294_100015195140 [0,0,0,0,0,0|4,0,0]=4 364 B20R2.174735 O=C(NCCc1cccnc1)NNc2ccccc2 512a_100000736294_100015195140 [0,0,0,0,0,0|4,0,0]=4 365 B20R2.174735 O=C(NCCc1cccnc1)OCc2ccccc2 271570a_200010239705_100000752921 [0,0,0,0,0,0|3,0,1]=4 366 B20R2.174735 O=C(NCCc1ccncc1)NCc2ccccc2 2708a_100000742849_100015324214 [0,0,0,0,0,0|3,0,1]=4 367 B20R2.174735 O=C(NCCc1ccncc1)NCc2ccccc2 2708a_100015324214_100000742849 [0,0,0,0,0,0|3,0,1]=4 368 B20R2.174735 O=C(NCCc1ccncc1)NCc2ccccc2 273464a_100000742849_100015324214 [0,0,0,0,0,0|3,0,1]=4 369 B20R2.174735 O=C(NCCc1ccncc1)NCc2ccccc2 273464a_100015324214_100000742849 [0,0,0,0,0,0|3,0,1]=4 370 B20R2.174735 O=C(NCCc1ccncc1)NCc2ccccc2 512a_100015324214_100000742849 [0,0,0,0,0,0|3,0,1]=4 371 B20R2.174735 O=C(NCCc1ccncc1)NNc2ccccc2 273464a_100000742849_100015195140 [0,0,0,0,0,0|4,0,0]=4 372 B20R2.174735 O=C(NCCc1ccncc1)OCc2ccccc2 271570a_200010239705_100000035832 [0,0,0,0,0,0|3,0,1]=4 373 B20R2.174735 O=C(NCc1ccccc1)NNCc2ccccc2 273464a_100015324214_100000007032 [0,0,0,0,0,0|3,0,1]=4 374 B20R2.174735 O=C(NCc1ccccc1)NNCc2ccccc2 512a_100015324214_100000007032 [0,0,0,0,0,0|3,0,1]=4 375 B19R2.2628 C(#Cc1ccccc1)COCCc2ccccc2 34a_100000210268_100011352542 [1,0,0,0,0,0|0,0,3]=4 376 B19R2.2628 C(#Cc1ccccc1)COCCc2ccccc2 34a_100011217464_100000765856 [1,0,0,0,0,0|0,0,3]=4 377 B19R2.2628 C(#Cc1ccccc1)COCCc2ccccc2 7a_100000210268_100011352542 [1,0,0,0,0,0|0,0,3]=4 378 B19R2.2628 C(#Cc1ccccc1)COCCc2ccccc2 7a_100011217464_100000765856 [1,0,0,0,0,0|0,0,3]=4 379 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccc2 2230a_100000106460_100016265936 [1,0,0,0,0,0|1,0,1]=3 380 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccc2 2230a_100020603302_100000765856 [1,0,0,0,0,0|1,0,1]=3 381 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccc2 34a_100000106460_100016265936 [1,0,0,0,0,0|1,0,1]=3 382 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccc2 34a_100020603302_100000765856 [1,0,0,0,0,0|1,0,1]=3 383 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccccn2 2230a_100020603302_100015183660 [1,0,0,0,0,0|2,0,1]=4 384 B19R2.2628 C(=C/c1ccccc1)\CNCCc2cccnc2 2230a_100000736294_100016265936 [1,0,0,0,0,0|2,0,1]=4 385 B19R2.2628 C(=C/c1ccccc1)\CNCCc2cccnc2 2230a_100020603302_200011713674 [1,0,0,0,0,0|2,0,1]=4 386 B19R2.2628 C(=C/c1ccccc1)\CNCCc2ccncc2 2230a_100020603302_100000723409 [1,0,0,0,0,0|2,0,1]=4 387 B19R2.2628 C(=C/c1ccccc1)\CNCSc2ccccc2 2230a_100020603302_100011218342 [1,0,0,0,0,0|2,0,1]=4 388 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccccc2 34a_100000210256_100000765856 [1,0,0,0,0,0|0,0,1]=2 389 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccccc2 34a_100000210268_100016265936 [1,0,0,0,0,0|0,0,1]=2 390 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccccc2 7a_100000210268_100016265936 [1,0,0,0,0,0|0,0,1]=2 391 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccccn2 34a_100000210271_100016265936 [1,0,0,0,0,0|1,0,1]=3 392 B19R2.2628 C(=C/c1ccccc1)\COCCc2cccnc2 34a_100011217484_100016265936 [1,0,0,0,0,0|1,0,1]=3 393 B19R2.2628 C(=C/c1ccccc1)\COCCc2ccncc2 34a_100011216225_100016265936 [1,0,0,0,0,0|1,0,1]=3 394 B19R2.2628 C(=C/c1ccccc1)\COCCc2cnccn2 34a_100011349526_100016265936 [1,0,0,0,0,0|2,0,1]=4 395 B19R2.2628 C(=C/c1ccccc1)\COCCc2cncnc2 34a_100011709255_100016265936 [1,0,0,0,0,0|2,0,1]=4 396 B19R2.2628 C(=C/c1ccccc1)\CSCCc2ccccc2 62a_100000765856_100016265936 [1,0,0,0,0,0|0,1,1]=3 397 B19R2.2628 C(=C/c1ccccc1)\CSCCc2ccccc2 62a_100016265936_100011218657 [1,0,0,0,0,0|0,1,1]=3 398 B19R2.2628 C(=C/c1ccccc1)\CSCCc2ccccn2 62a_100015183660_100016265936 [1,0,0,0,0,0|1,1,1]=4 399 B19R2.2628 C(=C/c1ccccc1)\CSCCc2ccccn2 62a_100016265936_100015183660 [1,0,0,0,0,0|1,1,1]=4 400 B19R2.2628 C(=C/c1ccccc1)\CSCCc2cccnc2 62a_100016265936_200011713674 [1,0,0,0,0,0|1,1,1]=4 401 B19R2.2628 C(=C/c1ccccc1)\CSCCc2cccnc2 62a_200011713674_100016265936 [1,0,0,0,0,0|1,1,1]=4 402 B19R2.2628 C(=C/c1ccccc1)\CSCCc2ccncc2 62a_100000723409_100016265936 [1,0,0,0,0,0|1,1,1]=4 403 B19R2.2628 C(=C/c1ccccc1)\CSCCc2ccncc2 62a_100016265936_100000723409 [1,0,0,0,0,0|1,1,1]=4 404 B19R2.2628 C(=C/c1ccccc1)\CSCSc2ccccc2 62a_100011218342_100016265936 [1,0,0,0,0,0|1,1,1]=4 405 B19R2.2628 C(=C/c1ccccc1)\CSCSc2ccccc2 62a_100016265936_100011218342 [1,0,0,0,0,0|1,1,1]=4 406 B19R2.2628 C(=C/c1cccnc1)\COCCc2ccccc2 34a_200102594124_100000765856 [1,0,0,0,0,0|1,0,1]=3 407 B19R2.2628 C(=Cc1ccccc1)C=NNCc2ccccc2 4a_100000007032_100000210105 [1,0,0,0,0,0|2,0,0]=3 408 B19R2.2628 C(=Cc1ccccc1)C=NNCc2ccccn2 4a_100000736832_100000210105 [1,0,0,0,0,0|3,0,0]=4 409 B19R2.2628 C(=Cc1ccccc1)C=NNCc2cccnc2 4a_100000738295_100000210105 [1,0,0,0,0,0|3,0,0]=4 410 B19R2.2628 C(=Cc1ccccc1)C=NNCc2ccncc2 4a_100000736929_100000210105 [1,0,0,0,0,0|3,0,0]=4 411 B19R2.2628 C(=Cc1ccccc1)CNCCc2ccccc2 270004a_100000106460_100000210105 [1,0,0,0,0,0|1,0,1]=3 412 B19R2.2628 C(=Cc1ccccc1)CNCCc2ccccn2 270004a_100000211156_100000210105 [1,0,0,0,0,0|2,0,1]=4 413 B19R2.2628 C(=Cc1ccccc1)CNCCc2cccnc2 270004a_100000736294_100000210105 [1,0,0,0,0,0|2,0,1]=4 414 B19R2.2628 C(=Cc1ccccc1)CNCCc2ccncc2 270004a_100000742849_100000210105 [1,0,0,0,0,0|2,0,1]=4 415 B19R2.2628 C(=Cc1ccncc1)C=NNCc2ccccc2 4a_100000007032_100000703957 [1,0,0,0,0,0|3,0,0]=4 416 B19R2.2628 C(=NNCCc1ccccc1)Cc2ccccc2 4a_100000740470_100000209964 [1,0,0,0,0,0|2,0,1]=4 417 B19R2.2628 C(=NNc1ccccc1)CCCc2ccccc2 4a_100015195140_100011361547 [1,0,0,0,0,0|3,0,0]=4 418 B19R2.2628 c1ccc(cc1)CCCOCCc2ccccc2 34a_100000210268_100000211621 [1,0,0,0,0,0|0,0,3]=4 419 B19R2.2628 c1ccc(cc1)CCCOCCc2ccccc2 34a_100000210828_100000765856 [1,0,0,0,0,0|0,0,3]=4 420 B19R2.2628 c1ccc(cc1)CCCOCCc2ccccc2 7a_100000210268_100000211621 [1,0,0,0,0,0|0,0,3]=4 421 B19R2.2628 c1ccc(cc1)CCCOCCc2ccccc2 7a_100000210828_100000765856 [1,0,0,0,0,0|0,0,3]=4 422 B19R2.2628 c1ccc(cc1)CCOCCNc2ccccc2 34a_100000211345_100000765856 [1,0,0,0,0,0|1,0,2]=4 423 B19R2.2628 c1ccc(cc1)CCOCCOc2ccccc2 34a_100000210260_100000765856 [1,0,0,0,0,0|1,0,2]=4 424 B19R2.2628 c1ccc(cc1)CCOCCOc2ccccc2 34a_100000210268_100000184471 [1,0,0,0,0,0|1,0,2]=4 425 B19R2.2628 c1ccc(cc1)CCOCCOc2ccccc2 7a_100000210260_100000765856 [1,0,0,0,0,0|1,0,2]=4 426 B19R2.2628 c1ccc(cc1)CCOCCOc2ccccc2 7a_100000210268_100000184471 [1,0,0,0,0,0|1,0,2]=4 427 B19R2.2628 c1ccc(cc1)CCOCCSc2ccccc2 34a_100000210268_100000246102 [1,0,0,0,0,0|1,0,2]=4 428 B19R2.2628 c1ccc(cc1)CCOCCSc2ccccc2 7a_100000210268_100000246102 [1,0,0,0,0,0|1,0,2]=4 429 B19R2.2628 c1ccc(cc1)CCOCCSc2ccccc2 7a_100000230494_100000765856 [1,0,0,0,0,0|1,0,2]=4 430 B19R2.2628 c1ccc(cc1)CCOCOCc2ccccc2 34a_100000210268_100000763385 [1,0,0,0,0,0|1,0,2]=4 431 B19R2.2628 c1ccc(cc1)CCOCSCc2ccccc2 34a_100000210268_200011217039 [1,0,0,0,0,0|1,0,2]=4 432 B21R2.4733 CC(=NNCc1cccc(c1)Br)C=Cc2ccccc2 4a_100000686200_100000204604 [0,1,0,0,0,0|3,0,0]=4 433 B21R2.4733 CC(=NNCc1cccc(c1)Cl)C=Cc2ccccc2 4a_100000685877_100000204604 [0,1,0,0,0,0|3,0,0]=4 434 B21R2.4733 CC(=NNCc1cccc(c1)F)C=Cc2ccccc2 4a_100016993953_100000204604 [0,1,0,0,0,0|3,0,0]=4 435 B21R2.4733 Cc1cccc(c1)CCNC(=O)C#Cc2ccccc2 240690a_100000749837_100000736102 [0,1,0,0,0,0|1,0,2]=4 436 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2 11a_100000749837_100000210462 [0,1,0,0,0,0|1,0,0]=2 437 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2 1626a_100000749837_100000210462 [0,1,0,0,0,0|1,0,0]=2 438 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccccn2 11a_100000749837_100000740811 [0,1,0,0,0,0|2,0,0]=3 439 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccccn2 240690a_100000749837_100000740811 [0,1,0,0,0,0|2,0,0]=3 440 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2cccnc2 11a_100000749837_100000735890 [0,1,0,0,0,0|2,0,0]=3 441 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2cccnc2 240690a_100000749837_100000735890 [0,1,0,0,0,0|2,0,0]=3 442 B21R2.4733 Cc1cccc(c1)CCNC(=O)C=Cc2ccncc2 240690a_100000749837_100000682801 [0,1,0,0,0,0|2,0,0]=3 443 B21R2.4733 Cc1cccc(c1)CCNC(=O)CCc2ccccc2 11a_100000749837_100000185753 [0,1,0,0,0,0|1,0,2]=4 444 B21R2.4733 Cc1cccc(c1)CCNC(=O)CCc2ccccc2 1626a_100000749837_100000185753 [0,1,0,0,0,0|1,0,2]=4 445 B21R2.4733 Cc1cccc(c1)CCNC(=O)CCc2ccccc2 240690a_100000749837_100000185753 [0,1,0,0,0,0|1,0,2]=4 446 B21R2.4733 Cc1cccc(c1)CCNC(=O)CCc2ccccc2 527a_100000749837_100000185753 [0,1,0,0,0,0|1,0,2]=4 447 B21R2.4733 Cc1cccc(c1)CCNC(=O)COc2ccccc2 11a_100000749837_100000186222 [0,1,0,0,0,0|2,0,1]=4 448 B21R2.4733 Cc1cccc(c1)CCNC(=O)COc2ccccc2 1626a_100000749837_100000186222 [0,1,0,0,0,0|2,0,1]=4 449 B21R2.4733 Cc1cccc(c1)CCNC(=O)COc2ccccc2 240690a_100000749837_100000186222 [0,1,0,0,0,0|2,0,1]=4 450 B21R2.4733 Cc1cccc(c1)CCNC(=O)COc2ccccc2 527a_100000749837_100000186222 [0,1,0,0,0,0|2,0,1]=4 451 B21R2.4733 Cc1cccc(c1)CCNC(=O)CSc2ccccc2 11a_100000749837_100000211596 [0,1,0,0,0,0|2,0,1]=4 452 B21R2.4733 Cc1cccc(c1)CCNC(=O)CSc2ccccc2 1626a_100000749837_100000211596 [0,1,0,0,0,0|2,0,1]=4 453 B21R2.4733 Cc1cccc(c1)CCNC(=O)CSc2ccccc2 240690a_100000749837_100000211596 [0,1,0,0,0,0|2,0,1]=4 454 B21R2.4733 Cc1cccc(c1)CCNC(=O)CSc2ccccc2 527a_100000749837_100000211596 [0,1,0,0,0,0|2,0,1]=4 455 B21R2.4733 Cc1cccc(c1)CCNC(=O)NCc2ccccc2 2708a_100000749837_100015324214 [0,1,0,0,0,0|2,0,1]=4 456 B21R2.4733 Cc1cccc(c1)CCNC(=O)NCc2ccccc2 2708a_100015324214_100000749837 [0,1,0,0,0,0|2,0,1]=4 457 B21R2.4733 Cc1cccc(c1)CCNC(=O)NCc2ccccc2 273464a_100000749837_100015324214 [0,1,0,0,0,0|2,0,1]=4 458 B21R2.4733 Cc1cccc(c1)CCNC(=O)NCc2ccccc2 273464a_100015324214_100000749837 [0,1,0,0,0,0|2,0,1]=4 459 B21R2.4733 Cc1cccc(c1)CCNC(=O)NCc2ccccc2 512a_100000749837_100015324214 [0,1,0,0,0,0|2,0,1]=4 460 B21R2.4733 Cc1cccc(c1)CCNC(=O)NCc2ccccc2 512a_100015324214_100000749837 [0,1,0,0,0,0|2,0,1]=4 461 B21R2.4733 Cc1cccc(c1)CCNC(=O)NNc2ccccc2 273464a_100000749837_100015195140 [0,1,0,0,0,0|3,0,0]=4 462 B21R2.4733 Cc1cccc(c1)CCNC(=O)NNc2ccccc2 512a_100000749837_100015195140 [0,1,0,0,0,0|3,0,0]=4 463 B21R2.4733 Cc1cccc(c1)CCNC(=O)OCc2ccccc2 271570a_200010239705_100011215228 [0,1,0,0,0,0|2,0,1]=4 464 B21R2.4733 Cc1cccc(c1)CNNC(=O)C=Cc2ccccc2 22a_100000689898_100000210462 [0,1,0,0,0,0|2,0,0]=3 465 B21R2.4733 Cc1cccc(c1)CNNC(=O)C=Cc2ccccn2 22a_100000689898_100000740811 [0,1,0,0,0,0|3,0,0]=4 466 B21R2.4733 Cc1cccc(c1)CNNC(=O)C=Cc2cccnc2 22a_100000689898_100000735890 [0,1,0,0,0,0|3,0,0]=4 467 B21R2.4733 Cc1cccc(c1)CNNC(=O)C=Cc2ccncc2 22a_100000689898_100000682801 [0,1,0,0,0,0|3,0,0]=4 468 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2 11a_100011824523_100000210462 [0,1,0,0,0,0|2,0,0]=3 469 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2 1626a_100011824523_100000210462 [0,1,0,0,0,0|2,0,0]=3 470 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2ccccn2 11a_100011824523_100000740811 [0,1,0,0,0,0|3,0,0]=4 471 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2ccccn2 240690a_100011824523_100000740811 [0,1,0,0,0,0|3,0,0]=4 472 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2cccnc2 11a_100011824523_100000735890 [0,1,0,0,0,0|3,0,0]=4 473 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2cccnc2 240690a_100011824523_100000735890 [0,1,0,0,0,0|3,0,0]=4 474 B21R2.4733 Cc1cccc(n1)CCNC(=O)C=Cc2ccncc2 240690a_100011824523_100000682801 [0,1,0,0,0,0|3,0,0]=4 475 B21R2.4733 Nc1cccc(c1)CCNC(=O)OCc2ccccc2 271570a_200010239705_100000210019 [0,1,0,0,0,0|2,0,1]=4 476 B21R2.4733 O=C(C#Cc1ccccc1)CCCc2cccc(c2)Br 1458a_100000736102_100011713683 [0,1,0,0,0,0|1,0,2]=4 477 B21R2.4733 O=C(C#Cc1ccccc1)CCCc2cccc(c2)F 1458a_100000736102_200000698031 [0,1,0,0,0,0|1,0,2]=4 478 B21R2.4733 O=C(C#Cc1ccccc1)NCCc2cccc(c2)Br 240690a_100011207229_100000736102 [0,1,0,0,0,0|1,0,2]=4 479 B21R2.4733 O=C(C#Cc1ccccc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000736102 [0,1,0,0,0,0|1,0,2]=4 480 B21R2.4733 O=C(C#Cc1ccccc1)NCCc2cccc(c2)F 240690a_100000205154_100000736102 [0,1,0,0,0,0|1,0,2]=4 481 B21R2.4733 O=C(C#Cc1ccccc1)NCCc2cccc(c2)O 240690a_100000747277_100000736102 [0,1,0,0,0,0|1,0,2]=4 482 B21R2.4733 O=C(C=Cc1ccccc1)CC#Cc2cccc(c2)Br 1458a_100000210462_100010706776 [0,1,0,0,0,0|1,0,2]=4 483 B21R2.4733 O=C(C=Cc1ccccc1)CC#Cc2cccc(c2)F 1458a_100000210462_100010402994 [0,1,0,0,0,0|1,0,2]=4 484 B21R2.4733 O=C(C=Cc1ccccc1)CCCc2cccc(c2)Br 1458a_100000210462_100011713683 [0,1,0,0,0,0|1,0,0]=2 485 B21R2.4733 O=C(C=Cc1ccccc1)CCCc2cccc(c2)F 1458a_100000210462_200000698031 [0,1,0,0,0,0|1,0,0]=2 486 B21R2.4733 O=C(C=Cc1ccccc1)CCOc2cccc(c2)Br 1458a_100000210462_100000183150 [0,1,0,0,0,0|2,0,0]=3 487 B21R2.4733 O=C(C=Cc1ccccc1)CCOc2cccc(c2)Cl 1458a_100000210462_100000181161 [0,1,0,0,0,0|2,0,0]=3 488 B21R2.4733 O=C(C=Cc1ccccc1)CCOc2cccc(c2)F 1458a_100000210462_100000739188 [0,1,0,0,0,0|2,0,0]=3 489 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)Br 11a_100011207229_100000210462 [0,1,0,0,0,0|1,0,0]=2 490 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)Br 1626a_100011207229_100000210462 [0,1,0,0,0,0|1,0,0]=2 491 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)Cl 11a_100000185263_100000210462 [0,1,0,0,0,0|1,0,0]=2 492 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)Cl 1626a_100000185263_100000210462 [0,1,0,0,0,0|1,0,0]=2 493 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)F 11a_100000205154_100000210462 [0,1,0,0,0,0|1,0,0]=2 494 B21R2.4733 O=C(C=Cc1ccccc1)NCCc2cccc(c2)F 1626a_100000205154_100000210462 [0,1,0,0,0,0|1,0,0]=2 495 B21R2.4733 O=C(C=Cc1ccccc1)NNCc2cccc(c2)Br 22a_100000686200_100000210462 [0,1,0,0,0,0|2,0,0]=3 496 B21R2.4733 O=C(C=Cc1ccccc1)NNCc2cccc(c2)Cl 22a_100000685877_100000210462 [0,1,0,0,0,0|2,0,0]=3 497 B21R2.4733 O=C(C=Cc1ccccc1)NNCc2cccc(c2)F 22a_100016993953_100000210462 [0,1,0,0,0,0|2,0,0]=3 498 B21R2.4733 O=C(C=Cc1ccccc1)NNCc2cccc(c2)O 22a_100000008902_100000210462 [0,1,0,0,0,0|2,0,0]=3 499 B21R2.4733 O=C(C=Cc1ccccn1)CCCc2cccc(c2)Br 1458a_100000740811_100011713683 [0,1,0,0,0,0|2,0,0]=3 500 B21R2.4733 O=C(C=Cc1ccccn1)CCCc2cccc(c2)F 1458a_100000740811_200000698031 [0,1,0,0,0,0|2,0,0]=3 501 B21R2.4733 O=C(C=Cc1ccccn1)CCOc2cccc(c2)Br 1458a_100000740811_100000183150 [0,1,0,0,0,0|3,0,0]=4 502 B21R2.4733 O=C(C=Cc1ccccn1)CCOc2cccc(c2)Cl 1458a_100000740811_100000181161 [0,1,0,0,0,0|3,0,0]=4 503 B21R2.4733 O=C(C=Cc1ccccn1)CCOc2cccc(c2)F 1458a_100000740811_100000739188 [0,1,0,0,0,0|3,0,0]=4 504 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)Br 11a_100011207229_100000740811 [0,1,0,0,0,0|2,0,0]=3 505 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)Br 240690a_100011207229_100000740811 [0,1,0,0,0,0|2,0,0]=3 506 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)Cl 11a_100000185263_100000740811 [0,1,0,0,0,0|2,0,0]=3 507 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)Cl 240690a_100000185263_100000740811 [0,1,0,0,0,0|2,0,0]=3 508 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)F 11a_100000205154_100000740811 [0,1,0,0,0,0|2,0,0]=3 509 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)F 240690a_100000205154_100000740811 [0,1,0,0,0,0|2,0,0]=3 510 B21R2.4733 O=C(C=Cc1ccccn1)NCCc2cccc(c2)O 240690a_100000747277_100000740811 [0,1,0,0,0,0|2,0,0]=3 511 B21R2.4733 O=C(C=Cc1ccccn1)NNCc2cccc(c2)Br 22a_100000686200_100000740811 [0,1,0,0,0,0|3,0,0]=4 512 B21R2.4733 O=C(C=Cc1ccccn1)NNCc2cccc(c2)Cl 22a_100000685877_100000740811 [0,1,0,0,0,0|3,0,0]=4 513 B21R2.4733 O=C(C=Cc1ccccn1)NNCc2cccc(c2)F 22a_100016993953_100000740811 [0,1,0,0,0,0|3,0,0]=4 514 B21R2.4733 O=C(C=Cc1ccccn1)NNCc2cccc(c2)O 22a_100000008902_100000740811 [0,1,0,0,0,0|3,0,0]=4 515 B21R2.4733 O=C(C=Cc1cccnc1)CCCc2cccc(c2)Br 1458a_100000735890_100011713683 [0,1,0,0,0,0|2,0,0]=3 516 B21R2.4733 O=C(C=Cc1cccnc1)CCCc2cccc(c2)F 1458a_100000735890_200000698031 [0,1,0,0,0,0|2,0,0]=3 517 B21R2.4733 O=C(C=Cc1cccnc1)CCOc2cccc(c2)Br 1458a_100000735890_100000183150 [0,1,0,0,0,0|3,0,0]=4 518 B21R2.4733 O=C(C=Cc1cccnc1)CCOc2cccc(c2)Cl 1458a_100000735890_100000181161 [0,1,0,0,0,0|3,0,0]=4 519 B21R2.4733 O=C(C=Cc1cccnc1)CCOc2cccc(c2)F 1458a_100000735890_100000739188 [0,1,0,0,0,0|3,0,0]=4 520 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)Br 11a_100011207229_100000735890 [0,1,0,0,0,0|2,0,0]=3 521 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)Br 240690a_100011207229_100000735890 [0,1,0,0,0,0|2,0,0]=3 522 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)Cl 11a_100000185263_100000735890 [0,1,0,0,0,0|2,0,0]=3 523 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000735890 [0,1,0,0,0,0|2,0,0]=3 524 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)F 11a_100000205154_100000735890 [0,1,0,0,0,0|2,0,0]=3 525 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)F 240690a_100000205154_100000735890 [0,1,0,0,0,0|2,0,0]=3 526 B21R2.4733 O=C(C=Cc1cccnc1)NCCc2cccc(c2)O 240690a_100000747277_100000735890 [0,1,0,0,0,0|2,0,0]=3 527 B21R2.4733 O=C(C=Cc1cccnc1)NNCc2cccc(c2)Br 22a_100000686200_100000735890 [0,1,0,0,0,0|3,0,0]=4 528 B21R2.4733 O=C(C=Cc1cccnc1)NNCc2cccc(c2)Cl 22a_100000685877_100000735890 [0,1,0,0,0,0|3,0,0]=4 529 B21R2.4733 O=C(C=Cc1cccnc1)NNCc2cccc(c2)F 22a_100016993953_100000735890 [0,1,0,0,0,0|3,0,0]=4 530 B21R2.4733 O=C(C=Cc1cccnc1)NNCc2cccc(c2)O 22a_100000008902_100000735890 [0,1,0,0,0,0|3,0,0]=4 531 B21R2.4733 O=C(C=Cc1ccncc1)CCCc2cccc(c2)Br 1458a_100000682801_100011713683 [0,1,0,0,0,0|2,0,0]=3 532 B21R2.4733 O=C(C=Cc1ccncc1)CCCc2cccc(c2)F 1458a_100000682801_200000698031 [0,1,0,0,0,0|2,0,0]=3 533 B21R2.4733 O=C(C=Cc1ccncc1)CCOc2cccc(c2)Br 1458a_100000682801_100000183150 [0,1,0,0,0,0|3,0,0]=4 534 B21R2.4733 O=C(C=Cc1ccncc1)CCOc2cccc(c2)Cl 1458a_100000682801_100000181161 [0,1,0,0,0,0|3,0,0]=4 535 B21R2.4733 O=C(C=Cc1ccncc1)CCOc2cccc(c2)F 1458a_100000682801_100000739188 [0,1,0,0,0,0|3,0,0]=4 536 B21R2.4733 O=C(C=Cc1ccncc1)NCCc2cccc(c2)Br 240690a_100011207229_100000682801 [0,1,0,0,0,0|2,0,0]=3 537 B21R2.4733 O=C(C=Cc1ccncc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000682801 [0,1,0,0,0,0|2,0,0]=3 538 B21R2.4733 O=C(C=Cc1ccncc1)NCCc2cccc(c2)F 240690a_100000205154_100000682801 [0,1,0,0,0,0|2,0,0]=3 539 B21R2.4733 O=C(C=Cc1ccncc1)NCCc2cccc(c2)O 240690a_100000747277_100000682801 [0,1,0,0,0,0|2,0,0]=3 540 B21R2.4733 O=C(C=Cc1ccncc1)NNCc2cccc(c2)Br 22a_100000686200_100000682801 [0,1,0,0,0,0|3,0,0]=4 541 B21R2.4733 O=C(C=Cc1ccncc1)NNCc2cccc(c2)Cl 22a_100000685877_100000682801 [0,1,0,0,0,0|3,0,0]=4 542 B21R2.4733 O=C(C=Cc1ccncc1)NNCc2cccc(c2)F 22a_100016993953_100000682801 [0,1,0,0,0,0|3,0,0]=4 543 B21R2.4733 O=C(C=Cc1ccncc1)NNCc2cccc(c2)O 22a_100000008902_100000682801 [0,1,0,0,0,0|3,0,0]=4 544 B21R2.4733 O=C(CCCc1cccc(c1)Br)CCc2ccccc2 1458a_100000185753_100011713683 [0,1,0,0,0,0|1,0,2]=4 545 B21R2.4733 O=C(CCCc1cccc(c1)Br)CCc2ccccc2 1458a_100000685939_100000765856 [0,1,0,0,0,0|1,0,2]=4 546 B21R2.4733 O=C(CCCc1cccc(c1)Br)COc2ccccc2 1458a_100000186222_100011713683 [0,1,0,0,0,0|2,0,1]=4 547 B21R2.4733 O=C(CCCc1cccc(c1)Br)CSc2ccccc2 1458a_100000211596_100011713683 [0,1,0,0,0,0|2,0,1]=4 548 B21R2.4733 O=C(CCCc1cccc(c1)Br)NCc2ccccc2 11a_100015324214_100000685939 [0,1,0,0,0,0|2,0,1]=4 549 B21R2.4733 O=C(CCCc1cccc(c1)Br)NCc2ccccc2 1626a_100015324214_100000685939 [0,1,0,0,0,0|2,0,1]=4 550 B21R2.4733 O=C(CCCc1cccc(c1)Br)NCc2ccccc2 240690a_100015324214_100000685939 [0,1,0,0,0,0|2,0,1]=4 551 B21R2.4733 O=C(CCCc1cccc(c1)Br)NCc2ccccc2 527a_100015324214_100000685939 [0,1,0,0,0,0|2,0,1]=4 552 B21R2.4733 O=C(CCCc1cccc(c1)Br)NNc2ccccc2 22a_100015195140_100000685939 [0,1,0,0,0,0|3,0,0]=4 553 B21R2.4733 O=C(CCCc1cccc(c1)F)CCc2ccccc2 1458a_100000185753_200000698031 [0,1,0,0,0,0|1,0,2]=4 554 B21R2.4733 O=C(CCCc1cccc(c1)F)COc2ccccc2 1458a_100000186222_200000698031 [0,1,0,0,0,0|2,0,1]=4 555 B21R2.4733 O=C(CCCc1cccc(c1)F)CSc2ccccc2 1458a_100000211596_200000698031 [0,1,0,0,0,0|2,0,1]=4 556 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)Br 11a_100011207229_100000185753 [0,1,0,0,0,0|1,0,2]=4 557 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)Br 1626a_100011207229_100000185753 [0,1,0,0,0,0|1,0,2]=4 558 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)Br 240690a_100011207229_100000185753 [0,1,0,0,0,0|1,0,2]=4 559 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)Br 527a_100011207229_100000185753 [0,1,0,0,0,0|1,0,2]=4 560 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)Cl 11a_100000185263_100000185753 [0,1,0,0,0,0|1,0,2]=4 561 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)Cl 1626a_100000185263_100000185753 [0,1,0,0,0,0|1,0,2]=4 562 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000185753 [0,1,0,0,0,0|1,0,2]=4 563 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)Cl 527a_100000185263_100000185753 [0,1,0,0,0,0|1,0,2]=4 564 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)F 11a_100000205154_100000185753 [0,1,0,0,0,0|1,0,2]=4 565 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)F 1626a_100000205154_100000185753 [0,1,0,0,0,0|1,0,2]=4 566 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)F 240690a_100000205154_100000185753 [0,1,0,0,0,0|1,0,2]=4 567 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)F 527a_100000205154_100000185753 [0,1,0,0,0,0|1,0,2]=4 568 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)O 240690a_100000747277_100000185753 [0,1,0,0,0,0|1,0,2]=4 569 B21R2.4733 O=C(CCc1ccccc1)NCCc2cccc(c2)O 527a_100000747277_100000185753 [0,1,0,0,0,0|1,0,2]=4 570 B21R2.4733 O=C(CNc1ccccc1)NCCc2cccc(c2)Cl 34a_100000106764_100000230230 [0,1,0,0,0,0|2,0,1]=4 571 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Br 11a_100011207229_100000186222 [0,1,0,0,0,0|2,0,1]=4 572 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Br 1626a_100011207229_100000186222 [0,1,0,0,0,0|2,0,1]=4 573 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Br 240690a_100011207229_100000186222 [0,1,0,0,0,0|2,0,1]=4 574 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Br 527a_100011207229_100000186222 [0,1,0,0,0,0|2,0,1]=4 575 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Cl 11a_100000185263_100000186222 [0,1,0,0,0,0|2,0,1]=4 576 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Cl 1626a_100000185263_100000186222 [0,1,0,0,0,0|2,0,1]=4 577 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000186222 [0,1,0,0,0,0|2,0,1]=4 578 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Cl 34a_100000210340_100000230230 [0,1,0,0,0,0|2,0,1]=4 579 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Cl 527a_100000185263_100000186222 [0,1,0,0,0,0|2,0,1]=4 580 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)Cl 7a_100000210340_100000230230 [0,1,0,0,0,0|2,0,1]=4 581 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)F 11a_100000205154_100000186222 [0,1,0,0,0,0|2,0,1]=4 582 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)F 1626a_100000205154_100000186222 [0,1,0,0,0,0|2,0,1]=4 583 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)F 240690a_100000205154_100000186222 [0,1,0,0,0,0|2,0,1]=4 584 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)F 527a_100000205154_100000186222 [0,1,0,0,0,0|2,0,1]=4 585 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)O 240690a_100000747277_100000186222 [0,1,0,0,0,0|2,0,1]=4 586 B21R2.4733 O=C(COc1ccccc1)NCCc2cccc(c2)O 527a_100000747277_100000186222 [0,1,0,0,0,0|2,0,1]=4 587 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Br 11a_100011207229_100000211596 [0,1,0,0,0,0|2,0,1]=4 588 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Br 1626a_100011207229_100000211596 [0,1,0,0,0,0|2,0,1]=4 589 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Br 240690a_100011207229_100000211596 [0,1,0,0,0,0|2,0,1]=4 590 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Br 527a_100011207229_100000211596 [0,1,0,0,0,0|2,0,1]=4 591 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Cl 11a_100000185263_100000211596 [0,1,0,0,0,0|2,0,1]=4 592 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Cl 1626a_100000185263_100000211596 [0,1,0,0,0,0|2,0,1]=4 593 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000211596 [0,1,0,0,0,0|2,0,1]=4 594 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Cl 527a_100000185263_100000211596 [0,1,0,0,0,0|2,0,1]=4 595 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Cl 62a_100000230230_100000041952 [0,1,0,0,0,0|2,0,1]=4 596 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)Cl 62a_100000719477_100000230230 [0,1,0,0,0,0|2,0,1]=4 597 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)F 11a_100000205154_100000211596 [0,1,0,0,0,0|2,0,1]=4 598 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)F 1626a_100000205154_100000211596 [0,1,0,0,0,0|2,0,1]=4 599 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)F 240690a_100000205154_100000211596 [0,1,0,0,0,0|2,0,1]=4 600 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)F 527a_100000205154_100000211596 [0,1,0,0,0,0|2,0,1]=4 601 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)O 240690a_100000747277_100000211596 [0,1,0,0,0,0|2,0,1]=4 602 B21R2.4733 O=C(CSc1ccccc1)NCCc2cccc(c2)O 527a_100000747277_100000211596 [0,1,0,0,0,0|2,0,1]=4 603 B21R2.4733 O=C(NCCc1cccc(c1)Br)NCc2ccccc2 2708a_100011207229_100015324214 [0,1,0,0,0,0|2,0,1]=4 604 B21R2.4733 O=C(NCCc1cccc(c1)Br)NCc2ccccc2 2708a_100015324214_100011207229 [0,1,0,0,0,0|2,0,1]=4 605 B21R2.4733 O=C(NCCc1cccc(c1)Br)NCc2ccccc2 273464a_100011207229_100015324214 [0,1,0,0,0,0|2,0,1]=4 606 B21R2.4733 O=C(NCCc1cccc(c1)Br)NCc2ccccc2 273464a_100015324214_100011207229 [0,1,0,0,0,0|2,0,1]=4 607 B21R2.4733 O=C(NCCc1cccc(c1)Br)NCc2ccccc2 512a_100011207229_100015324214 [0,1,0,0,0,0|2,0,1]=4 608 B21R2.4733 O=C(NCCc1cccc(c1)Br)NCc2ccccc2 512a_100015324214_100011207229 [0,1,0,0,0,0|2,0,1]=4 609 B21R2.4733 O=C(NCCc1cccc(c1)Br)NNc2ccccc2 273464a_100011207229_100015195140 [0,1,0,0,0,0|3,0,0]=4 610 B21R2.4733 O=C(NCCc1cccc(c1)Br)NNc2ccccc2 512a_100011207229_100015195140 [0,1,0,0,0,0|3,0,0]=4 611 B21R2.4733 O=C(NCCc1cccc(c1)Br)OCc2ccccc2 271570a_200010239705_100000691529 [0,1,0,0,0,0|2,0,1]=4 612 B21R2.4733 O=C(NCCc1cccc(c1)Cl)NCc2ccccc2 2708a_100000185263_100015324214 [0,1,0,0,0,0|2,0,1]=4 613 B21R2.4733 O=C(NCCc1cccc(c1)Cl)NCc2ccccc2 2708a_100015324214_100000185263 [0,1,0,0,0,0|2,0,1]=4 614 B21R2.4733 O=C(NCCc1cccc(c1)Cl)NCc2ccccc2 273464a_100000185263_100015324214 [0,1,0,0,0,0|2,0,1]=4 615 B21R2.4733 O=C(NCCc1cccc(c1)Cl)NCc2ccccc2 273464a_100015324214_100000185263 [0,1,0,0,0,0|2,0,1]=4 616 B21R2.4733 O=C(NCCc1cccc(c1)Cl)NCc2ccccc2 512a_100000185263_100015324214 [0,1,0,0,0,0|2,0,1]=4 617 B21R2.4733 O=C(NCCc1cccc(c1)Cl)NCc2ccccc2 512a_100015324214_100000185263 [0,1,0,0,0,0|2,0,1]=4 618 B21R2.4733 O=C(NCCc1cccc(c1)Cl)NNc2ccccc2 273464a_100000185263_100015195140 [0,1,0,0,0,0|3,0,0]=4 619 B21R2.4733 O=C(NCCc1cccc(c1)Cl)NNc2ccccc2 512a_100000185263_100015195140 [0,1,0,0,0,0|3,0,0]=4 620 B21R2.4733 O=C(NCCc1cccc(c1)Cl)OCc2ccccc2 271570a_200010239705_100000699651 [0,1,0,0,0,0|2,0,1]=4 621 B21R2.4733 O=C(NCCc1cccc(c1)F)NCc2ccccc2 2708a_100000205154_100015324214 [0,1,0,0,0,0|2,0,1]=4 622 B21R2.4733 O=C(NCCc1cccc(c1)F)NCc2ccccc2 2708a_100015324214_100000205154 [0,1,0,0,0,0|2,0,1]=4 623 B21R2.4733 O=C(NCCc1cccc(c1)F)NCc2ccccc2 273464a_100000205154_100015324214 [0,1,0,0,0,0|2,0,1]=4 624 B21R2.4733 O=C(NCCc1cccc(c1)F)NCc2ccccc2 273464a_100015324214_100000205154 [0,1,0,0,0,0|2,0,1]=4 625 B21R2.4733 O=C(NCCc1cccc(c1)F)NCc2ccccc2 512a_100000205154_100015324214 [0,1,0,0,0,0|2,0,1]=4 626 B21R2.4733 O=C(NCCc1cccc(c1)F)NCc2ccccc2 512a_100015324214_100000205154 [0,1,0,0,0,0|2,0,1]=4 627 B21R2.4733 O=C(NCCc1cccc(c1)F)NNc2ccccc2 273464a_100000205154_100015195140 [0,1,0,0,0,0|3,0,0]=4 628 B21R2.4733 O=C(NCCc1cccc(c1)F)NNc2ccccc2 512a_100000205154_100015195140 [0,1,0,0,0,0|3,0,0]=4 629 B21R2.4733 O=C(NCCc1cccc(c1)F)OCc2ccccc2 271570a_200010239705_100000685547 [0,1,0,0,0,0|2,0,1]=4 630 B21R2.4733 O=C(NCCc1cccc(c1)O)NCc2ccccc2 2708a_100000747277_100015324214 [0,1,0,0,0,0|2,0,1]=4 631 B21R2.4733 O=C(NCCc1cccc(c1)O)NCc2ccccc2 2708a_100015324214_100000747277 [0,1,0,0,0,0|2,0,1]=4 632 B21R2.4733 O=C(NCCc1cccc(c1)O)NCc2ccccc2 273464a_100000747277_100015324214 [0,1,0,0,0,0|2,0,1]=4 633 B21R2.4733 O=C(NCCc1cccc(c1)O)NCc2ccccc2 273464a_100015324214_100000747277 [0,1,0,0,0,0|2,0,1]=4 634 B21R2.4733 O=C(NCCc1cccc(c1)O)NCc2ccccc2 512a_100000747277_100015324214 [0,1,0,0,0,0|2,0,1]=4 635 B21R2.4733 O=C(NCCc1cccc(c1)O)NCc2ccccc2 512a_100015324214_100000747277 [0,1,0,0,0,0|2,0,1]=4 636 B21R2.4733 O=C(NCCc1cccc(c1)O)NNc2ccccc2 273464a_100000747277_100015195140 [0,1,0,0,0,0|3,0,0]=4 637 B21R2.4733 O=C(NCCc1cccc(c1)O)NNc2ccccc2 512a_100000747277_100015195140 [0,1,0,0,0,0|3,0,0]=4 638 B21R2.4733 O=C(NCCc1cccc(c1)O)OCc2ccccc2 271570a_200010239705_100000211634 [0,1,0,0,0,0|2,0,1]=4 639 B21R2.4733 O=C(NCCc1cccc(c1)[S])OCc2ccccc2 271570a_200010239705_114929384022 [0,1,0,0,0,0|2,0,1]=4 640 B21R2.4848 CC(=NNCc1ccccc1)C=Cc2ccccc2Cl 4a_100000007032_200016284137 [0,1,0,0,0,0|3,0,0]=4 641 B21R2.4848 C[n+]1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000212160 [0,1,0,0,0,0|2,0,1]=4 642 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2ccccc2 1626a_100000106460_100016266485 [0,1,0,0,0,0|1,0,0]=2 643 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2ccccn2 1626a_100000211156_100016266485 [0,1,0,0,0,0|2,0,0]=3 644 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2cccnc2 1626a_100000736294_100016266485 [0,1,0,0,0,0|2,0,0]=3 645 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2ccncc2 1626a_100000742849_100016266485 [0,1,0,0,0,0|2,0,0]=3 646 B21R2.4848 Cc1ccccc1C=CC(=O)NCCc2cnccn2 1626a_100000723456_100016266485 [0,1,0,0,0,0|3,0,0]=4 647 B21R2.4848 Cc1ccccc1C=CC(=O)NNCc2ccccc2 22a_100000007032_100016266485 [0,1,0,0,0,0|2,0,0]=3 648 B21R2.4848 Cc1ccccc1C=CC(=O)NNCc2ccccn2 22a_100000736832_100016266485 [0,1,0,0,0,0|3,0,0]=4 649 B21R2.4848 Cc1ccccc1C=CC(=O)NNCc2cccnc2 22a_100000738295_100016266485 [0,1,0,0,0,0|3,0,0]=4 650 B21R2.4848 Cc1ccccc1C=CC(=O)NNCc2ccncc2 22a_100000736929_100016266485 [0,1,0,0,0,0|3,0,0]=4 651 B21R2.4848 Cc1ccccc1CCC(=O)CCCc2ccccc2 1458a_100000748742_100000211621 [0,1,0,0,0,0|1,0,2]=4 652 B21R2.4848 Cc1ccccc1CCC(=O)CCCc2ccccc2 1458a_100011207963_100011713688 [0,1,0,0,0,0|1,0,2]=4 653 B21R2.4848 Cc1ccccc1CCC(=O)NCCc2ccccc2 11a_100000106460_100000748742 [0,1,0,0,0,0|1,0,2]=4 654 B21R2.4848 Cc1ccccc1CCC(=O)NCCc2ccccc2 1626a_100000106460_100000748742 [0,1,0,0,0,0|1,0,2]=4 655 B21R2.4848 Cc1ccccc1CCC(=O)NCCc2ccccc2 240690a_100000106460_100000748742 [0,1,0,0,0,0|1,0,2]=4 656 B21R2.4848 Cc1ccccc1CCC(=O)NCCc2ccccc2 527a_100000106460_100000748742 [0,1,0,0,0,0|1,0,2]=4 657 B21R2.4848 Cc1ccccc1CNC(=O)CCCc2ccccc2 11a_100000174972_100011207963 [0,1,0,0,0,0|2,0,1]=4 658 B21R2.4848 Cc1ccccc1CNC(=O)CCCc2ccccc2 1626a_100000174972_100011207963 [0,1,0,0,0,0|2,0,1]=4 659 B21R2.4848 Cc1ccccc1CNC(=O)CCCc2ccccc2 240690a_100000174972_100011207963 [0,1,0,0,0,0|2,0,1]=4 660 B21R2.4848 Cc1ccccc1CNC(=O)CCCc2ccccc2 527a_100000174972_100011207963 [0,1,0,0,0,0|2,0,1]=4 661 B21R2.4848 Cc1ccccc1CNC(=O)NCCc2ccccc2 2708a_100000106460_100000174972 [0,1,0,0,0,0|2,0,1]=4 662 B21R2.4848 Cc1ccccc1CNC(=O)NCCc2ccccc2 2708a_100000174972_100000106460 [0,1,0,0,0,0|2,0,1]=4 663 B21R2.4848 Cc1ccccc1CNC(=O)NCCc2ccccc2 273464a_100000106460_100000174972 [0,1,0,0,0,0|2,0,1]=4 664 B21R2.4848 Cc1ccccc1CNC(=O)NCCc2ccccc2 273464a_100000174972_100000106460 [0,1,0,0,0,0|2,0,1]=4 665 B21R2.4848 Cc1ccccc1CNC(=O)NCCc2ccccc2 512a_100000106460_100000174972 [0,1,0,0,0,0|2,0,1]=4 666 B21R2.4848 Cc1ccccc1CNC(=O)NCCc2ccccc2 512a_100000174972_100000106460 [0,1,0,0,0,0|2,0,1]=4 667 B21R2.4848 Cc1ccccc1NCC(=O)NCCc2ccccc2 34a_100015192222_100000183012 [0,1,0,0,0,0|2,0,1]=4 668 B21R2.4848 Cc1ccccc1NCC(=O)OCCc2ccccc2 34a_100015192222_200000077782 [0,1,0,0,0,0|1,0,1]=3 669 B21R2.4848 Cc1ccccc1NNC(=O)CCCc2ccccc2 22a_100000184220_100011207963 [0,1,0,0,0,0|3,0,0]=4 670 B21R2.4848 Cc1ccccc1NNC(=O)NCCc2ccccc2 273464a_100000106460_100000184220 [0,1,0,0,0,0|3,0,0]=4 671 B21R2.4848 Cc1ccccc1NNC(=O)NCCc2ccccc2 512a_100000106460_100000184220 [0,1,0,0,0,0|3,0,0]=4 672 B21R2.4848 Cc1ccccc1OCC(=O)CCCc2ccccc2 1458a_100000182418_100000211621 [0,1,0,0,0,0|2,0,1]=4 673 B21R2.4848 Cc1ccccc1OCC(=O)NCCc2ccccc2 11a_100000106460_100000182418 [0,1,0,0,0,0|2,0,1]=4 674 B21R2.4848 Cc1ccccc1OCC(=O)NCCc2ccccc2 1626a_100000106460_100000182418 [0,1,0,0,0,0|2,0,1]=4 675 B21R2.4848 Cc1ccccc1OCC(=O)NCCc2ccccc2 240690a_100000106460_100000182418 [0,1,0,0,0,0|2,0,1]=4 676 B21R2.4848 Cc1ccccc1OCC(=O)NCCc2ccccc2 34a_100000210338_100000183012 [0,1,0,0,0,0|2,0,1]=4 677 B21R2.4848 Cc1ccccc1OCC(=O)NCCc2ccccc2 527a_100000106460_100000182418 [0,1,0,0,0,0|2,0,1]=4 678 B21R2.4848 Cc1ccccc1OCC(=O)NCCc2ccccc2 7a_100000210338_100000183012 [0,1,0,0,0,0|2,0,1]=4 679 B21R2.4848 Cc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000210338_200000077782 [0,1,0,0,0,0|1,0,1]=3 680 B21R2.4848 Cc1ccccc1OCC(=O)OCCc2ccccc2 7a_100000210338_200000077782 [0,1,0,0,0,0|1,0,1]=3 681 B21R2.4848 Cc1ccccc1SCC(=O)CCCc2ccccc2 1458a_100000183026_100000211621 [0,1,0,0,0,0|2,0,1]=4 682 B21R2.4848 Cc1ccccc1SCC(=O)NCCc2ccccc2 11a_100000106460_100000183026 [0,1,0,0,0,0|2,0,1]=4 683 B21R2.4848 Cc1ccccc1SCC(=O)NCCc2ccccc2 1626a_100000106460_100000183026 [0,1,0,0,0,0|2,0,1]=4 684 B21R2.4848 Cc1ccccc1SCC(=O)NCCc2ccccc2 240690a_100000106460_100000183026 [0,1,0,0,0,0|2,0,1]=4 685 B21R2.4848 Cc1ccccc1SCC(=O)NCCc2ccccc2 527a_100000106460_100000183026 [0,1,0,0,0,0|2,0,1]=4 686 B21R2.4848 Cc1ccccc1SCC(=O)NCCc2ccccc2 62a_100000183012_100000210755 [0,1,0,0,0,0|2,0,1]=4 687 B21R2.4848 Cc1ccccc1SCC(=O)NCCc2ccccc2 62a_100000210755_100000183012 [0,1,0,0,0,0|2,0,1]=4 688 B21R2.4848 Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_100000210755_200000077782 [0,1,0,0,0,0|1,0,1]=3 689 B21R2.4848 Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000210755 [0,1,0,0,0,0|1,0,1]=3 690 B21R2.4848 Cc1cccnc1SCC(=O)OCCc2ccccc2 62a_100000751373_200000077782 [0,1,0,0,0,0|2,0,1]=4 691 B21R2.4848 Cc1cccnc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000751373 [0,1,0,0,0,0|2,0,1]=4 692 B21R2.4848 Cc1ccncc1OCC(=O)OCCc2ccccc2 34a_100011997053_200000077782 [0,1,0,0,0,0|2,0,1]=4 693 B21R2.4848 Cc1ccncc1OCC(=O)OCCc2ccccc2 7a_100011997053_200000077782 [0,1,0,0,0,0|2,0,1]=4 694 B21R2.4848 Cc1ccncc1SCC(=O)OCCc2ccccc2 62a_100000761580_200000077782 [0,1,0,0,0,0|2,0,1]=4 695 B21R2.4848 Cc1ccncc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000761580 [0,1,0,0,0,0|2,0,1]=4 696 B21R2.4848 Cc1cnccc1OCC(=O)OCCc2ccccc2 34a_100000694293_200000077782 [0,1,0,0,0,0|2,0,1]=4 697 B21R2.4848 Cc1cnccc1SCC(=O)OCCc2ccccc2 62a_100000765111_200000077782 [0,1,0,0,0,0|2,0,1]=4 698 B21R2.4848 Cc1cnccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000765111 [0,1,0,0,0,0|2,0,1]=4 699 B21R2.4848 Cc1ncccc1OCC(=O)OCCc2ccccc2 34a_100000745507_200000077782 [0,1,0,0,0,0|2,0,1]=4 700 B21R2.4848 Cc1ncccc1OCC(=O)OCCc2ccccc2 7a_100000745507_200000077782 [0,1,0,0,0,0|2,0,1]=4 701 B21R2.4848 Cc1ncccc1SCC(=O)OCCc2ccccc2 62a_100000751574_200000077782 [0,1,0,0,0,0|2,0,1]=4 702 B21R2.4848 Cc1ncccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000751574 [0,1,0,0,0,0|2,0,1]=4 703 B21R2.4848 Nc1ccccc1OCC(=O)NCCc2ccccc2 34a_100000185747_100000183012 [0,1,0,0,0,0|2,0,1]=4 704 B21R2.4848 Nc1ccccc1OCC(=O)NCCc2ccccc2 7a_100000185747_100000183012 [0,1,0,0,0,0|2,0,1]=4 705 B21R2.4848 Nc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000185747_200000077782 [0,1,0,0,0,0|1,0,1]=3 706 B21R2.4848 Nc1ccccc1OCC(=O)OCCc2ccccc2 7a_100000185747_200000077782 [0,1,0,0,0,0|1,0,1]=3 707 B21R2.4848 Nc1ccccc1SCC(=O)NCCc2ccccc2 62a_100000183012_100000210017 [0,1,0,0,0,0|2,0,1]=4 708 B21R2.4848 Nc1ccccc1SCC(=O)NCCc2ccccc2 62a_100000210017_100000183012 [0,1,0,0,0,0|2,0,1]=4 709 B21R2.4848 Nc1ccccc1SCC(=O)OCCc2ccccc2 62a_100000210017_200000077782 [0,1,0,0,0,0|1,0,1]=3 710 B21R2.4848 Nc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000210017 [0,1,0,0,0,0|1,0,1]=3 711 B21R2.4848 Nc1cccnc1OCC(=O)OCCc2ccccc2 34a_100000746358_200000077782 [0,1,0,0,0,0|2,0,1]=4 712 B21R2.4848 Nc1cccnc1SCC(=O)OCCc2ccccc2 62a_100000688686_200000077782 [0,1,0,0,0,0|2,0,1]=4 713 B21R2.4848 Nc1cccnc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000688686 [0,1,0,0,0,0|2,0,1]=4 714 B21R2.4848 Nc1ccncc1OCC(=O)OCCc2ccccc2 34a_100000753702_200000077782 [0,1,0,0,0,0|2,0,1]=4 715 B21R2.4848 Nc1ccncc1SCC(=O)OCCc2ccccc2 62a_100000047001_200000077782 [0,1,0,0,0,0|2,0,1]=4 716 B21R2.4848 Nc1ccncc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000047001 [0,1,0,0,0,0|2,0,1]=4 717 B21R2.4848 Nc1cnccc1SCC(=O)OCCc2ccccc2 62a_100000756074_200000077782 [0,1,0,0,0,0|2,0,1]=4 718 B21R2.4848 Nc1cnccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000756074 [0,1,0,0,0,0|2,0,1]=4 719 B21R2.4848 Nc1ncccc1OCC(=O)OCCc2ccccc2 34a_100000211975_200000077782 [0,1,0,0,0,0|2,0,1]=4 720 B21R2.4848 Nc1ncccc1OCC(=O)OCCc2ccccc2 7a_100000211975_200000077782 [0,1,0,0,0,0|2,0,1]=4 721 B21R2.4848 Nc1ncccc1SCC(=O)OCCc2ccccc2 62a_100000045569_200000077782 [0,1,0,0,0,0|2,0,1]=4 722 B21R2.4848 Nc1ncccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000045569 [0,1,0,0,0,0|2,0,1]=4 723 B21R2.4848 O=C(C#Cc1ccccc1F)CCCc2ccccc2 1458a_100011892747_100000211621 [0,1,0,0,0,0|1,0,2]=4 724 B21R2.4848 O=C(C=Cc1ccccc1Br)C/C=C/c2ccccc2 1458a_100000719032_100016265936 [0,1,0,0,0,0|1,0,2]=4 725 B21R2.4848 O=C(C=Cc1ccccc1Br)CC#Cc2ccccc2 1458a_100000719032_100011352542 [0,1,0,0,0,0|1,0,2]=4 726 B21R2.4848 O=C(C=Cc1ccccc1Br)CCCc2ccccc2 1458a_100000719032_100000211621 [0,1,0,0,0,0|1,0,0]=2 727 B21R2.4848 O=C(C=Cc1ccccc1Br)CCOc2ccccc2 1458a_100000719032_100000184471 [0,1,0,0,0,0|2,0,0]=3 728 B21R2.4848 O=C(C=Cc1ccccc1Br)CCSc2ccccc2 1458a_100000719032_100000246102 [0,1,0,0,0,0|2,0,0]=3 729 B21R2.4848 O=C(C=Cc1ccccc1Br)CSCc2ccccc2 1458a_100000719032_200011217039 [0,1,0,0,0,0|2,0,0]=3 730 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccc2 11a_100000106460_100000719032 [0,1,0,0,0,0|1,0,0]=2 731 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccc2 1626a_100000106460_100000719032 [0,1,0,0,0,0|1,0,0]=2 732 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccc2 240690a_100000106460_100000719032 [0,1,0,0,0,0|1,0,0]=2 733 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccn2 11a_100000211156_100000719032 [0,1,0,0,0,0|2,0,0]=3 734 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccn2 1626a_100000211156_100000719032 [0,1,0,0,0,0|2,0,0]=3 735 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccccn2 240690a_100000211156_100000719032 [0,1,0,0,0,0|2,0,0]=3 736 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cccnc2 11a_100000736294_100000719032 [0,1,0,0,0,0|2,0,0]=3 737 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cccnc2 1626a_100000736294_100000719032 [0,1,0,0,0,0|2,0,0]=3 738 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cccnc2 240690a_100000736294_100000719032 [0,1,0,0,0,0|2,0,0]=3 739 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccncc2 11a_100000742849_100000719032 [0,1,0,0,0,0|2,0,0]=3 740 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccncc2 1626a_100000742849_100000719032 [0,1,0,0,0,0|2,0,0]=3 741 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2ccncc2 240690a_100000742849_100000719032 [0,1,0,0,0,0|2,0,0]=3 742 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cnccn2 11a_100000723456_100000719032 [0,1,0,0,0,0|3,0,0]=4 743 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cnccn2 1626a_100000723456_100000719032 [0,1,0,0,0,0|3,0,0]=4 744 B21R2.4848 O=C(C=Cc1ccccc1Br)NCCc2cnccn2 240690a_100000723456_100000719032 [0,1,0,0,0,0|3,0,0]=4 745 B21R2.4848 O=C(C=Cc1ccccc1Br)NNCc2ccccc2 22a_100000007032_100000719032 [0,1,0,0,0,0|2,0,0]=3 746 B21R2.4848 O=C(C=Cc1ccccc1Br)NNCc2ccccn2 22a_100000736832_100000719032 [0,1,0,0,0,0|3,0,0]=4 747 B21R2.4848 O=C(C=Cc1ccccc1Br)NNCc2cccnc2 22a_100000738295_100000719032 [0,1,0,0,0,0|3,0,0]=4 748 B21R2.4848 O=C(C=Cc1ccccc1Br)NNCc2ccncc2 22a_100000736929_100000719032 [0,1,0,0,0,0|3,0,0]=4 749 B21R2.4848 O=C(C=Cc1ccccc1Cl)C/C=C/c2ccccc2 1458a_100000720304_100016265936 [0,1,0,0,0,0|1,0,2]=4 750 B21R2.4848 O=C(C=Cc1ccccc1Cl)CC#Cc2ccccc2 1458a_100000720304_100011352542 [0,1,0,0,0,0|1,0,2]=4 751 B21R2.4848 O=C(C=Cc1ccccc1Cl)CCCc2ccccc2 1458a_100000720304_100000211621 [0,1,0,0,0,0|1,0,0]=2 752 B21R2.4848 O=C(C=Cc1ccccc1Cl)CCOc2ccccc2 1458a_100000720304_100000184471 [0,1,0,0,0,0|2,0,0]=3 753 B21R2.4848 O=C(C=Cc1ccccc1Cl)CCSc2ccccc2 1458a_100000720304_100000246102 [0,1,0,0,0,0|2,0,0]=3 754 B21R2.4848 O=C(C=Cc1ccccc1Cl)CSCc2ccccc2 1458a_100000720304_200011217039 [0,1,0,0,0,0|2,0,0]=3 755 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2 11a_100000106460_100000720304 [0,1,0,0,0,0|1,0,0]=2 756 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2 1626a_100000106460_100000720304 [0,1,0,0,0,0|1,0,0]=2 757 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2 240690a_100000106460_100000720304 [0,1,0,0,0,0|1,0,0]=2 758 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccn2 11a_100000211156_100000720304 [0,1,0,0,0,0|2,0,0]=3 759 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccn2 1626a_100000211156_100000720304 [0,1,0,0,0,0|2,0,0]=3 760 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccccn2 240690a_100000211156_100000720304 [0,1,0,0,0,0|2,0,0]=3 761 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cccnc2 11a_100000736294_100000720304 [0,1,0,0,0,0|2,0,0]=3 762 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cccnc2 1626a_100000736294_100000720304 [0,1,0,0,0,0|2,0,0]=3 763 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cccnc2 240690a_100000736294_100000720304 [0,1,0,0,0,0|2,0,0]=3 764 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccncc2 11a_100000742849_100000720304 [0,1,0,0,0,0|2,0,0]=3 765 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccncc2 1626a_100000742849_100000720304 [0,1,0,0,0,0|2,0,0]=3 766 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2ccncc2 240690a_100000742849_100000720304 [0,1,0,0,0,0|2,0,0]=3 767 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cnccn2 11a_100000723456_100000720304 [0,1,0,0,0,0|3,0,0]=4 768 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cnccn2 1626a_100000723456_100000720304 [0,1,0,0,0,0|3,0,0]=4 769 B21R2.4848 O=C(C=Cc1ccccc1Cl)NCCc2cnccn2 240690a_100000723456_100000720304 [0,1,0,0,0,0|3,0,0]=4 770 B21R2.4848 O=C(C=Cc1ccccc1Cl)NNCc2ccccc2 22a_100000007032_100000720304 [0,1,0,0,0,0|2,0,0]=3 771 B21R2.4848 O=C(C=Cc1ccccc1Cl)NNCc2ccccn2 22a_100000736832_100000720304 [0,1,0,0,0,0|3,0,0]=4 772 B21R2.4848 O=C(C=Cc1ccccc1Cl)NNCc2cccnc2 22a_100000738295_100000720304 [0,1,0,0,0,0|3,0,0]=4 773 B21R2.4848 O=C(C=Cc1ccccc1Cl)NNCc2ccncc2 22a_100000736929_100000720304 [0,1,0,0,0,0|3,0,0]=4 774 B21R2.4848 O=C(C=Cc1ccccc1F)C/C=C/c2ccccc2 1458a_100016256065_100016265936 [0,1,0,0,0,0|1,0,2]=4 775 B21R2.4848 O=C(C=Cc1ccccc1F)CC#Cc2ccccc2 1458a_100016256065_100011352542 [0,1,0,0,0,0|1,0,2]=4 776 B21R2.4848 O=C(C=Cc1ccccc1F)CCCc2ccccc2 1458a_100016256065_100000211621 [0,1,0,0,0,0|1,0,0]=2 777 B21R2.4848 O=C(C=Cc1ccccc1F)CCOc2ccccc2 1458a_100016256065_100000184471 [0,1,0,0,0,0|2,0,0]=3 778 B21R2.4848 O=C(C=Cc1ccccc1F)CCSc2ccccc2 1458a_100016256065_100000246102 [0,1,0,0,0,0|2,0,0]=3 779 B21R2.4848 O=C(C=Cc1ccccc1F)CSCc2ccccc2 1458a_100016256065_200011217039 [0,1,0,0,0,0|2,0,0]=3 780 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccc2 11a_100000106460_100016256065 [0,1,0,0,0,0|1,0,0]=2 781 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccc2 1626a_100000106460_100016256065 [0,1,0,0,0,0|1,0,0]=2 782 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccc2 240690a_100000106460_100016256065 [0,1,0,0,0,0|1,0,0]=2 783 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccn2 11a_100000211156_100016256065 [0,1,0,0,0,0|2,0,0]=3 784 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccn2 1626a_100000211156_100016256065 [0,1,0,0,0,0|2,0,0]=3 785 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccccn2 240690a_100000211156_100016256065 [0,1,0,0,0,0|2,0,0]=3 786 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cccnc2 11a_100000736294_100016256065 [0,1,0,0,0,0|2,0,0]=3 787 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cccnc2 1626a_100000736294_100016256065 [0,1,0,0,0,0|2,0,0]=3 788 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cccnc2 240690a_100000736294_100016256065 [0,1,0,0,0,0|2,0,0]=3 789 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccncc2 11a_100000742849_100016256065 [0,1,0,0,0,0|2,0,0]=3 790 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccncc2 1626a_100000742849_100016256065 [0,1,0,0,0,0|2,0,0]=3 791 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2ccncc2 240690a_100000742849_100016256065 [0,1,0,0,0,0|2,0,0]=3 792 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cnccn2 11a_100000723456_100016256065 [0,1,0,0,0,0|3,0,0]=4 793 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cnccn2 1626a_100000723456_100016256065 [0,1,0,0,0,0|3,0,0]=4 794 B21R2.4848 O=C(C=Cc1ccccc1F)NCCc2cnccn2 240690a_100000723456_100016256065 [0,1,0,0,0,0|3,0,0]=4 795 B21R2.4848 O=C(C=Cc1ccccc1F)NNCc2ccccc2 22a_100000007032_100016256065 [0,1,0,0,0,0|2,0,0]=3 796 B21R2.4848 O=C(C=Cc1ccccc1F)NNCc2ccccn2 22a_100000736832_100016256065 [0,1,0,0,0,0|3,0,0]=4 797 B21R2.4848 O=C(C=Cc1ccccc1F)NNCc2cccnc2 22a_100000738295_100016256065 [0,1,0,0,0,0|3,0,0]=4 798 B21R2.4848 O=C(C=Cc1ccccc1F)NNCc2ccncc2 22a_100000736929_100016256065 [0,1,0,0,0,0|3,0,0]=4 799 B21R2.4848 O=C(C=Cc1ccccc1O)C/C=C/c2ccccc2 1458a_100016263591_100016265936 [0,1,0,0,0,0|1,0,2]=4 800 B21R2.4848 O=C(C=Cc1ccccc1O)CC#Cc2ccccc2 1458a_100016263591_100011352542 [0,1,0,0,0,0|1,0,2]=4 801 B21R2.4848 O=C(C=Cc1ccccc1O)CCCc2ccccc2 1458a_100016263591_100000211621 [0,1,0,0,0,0|1,0,0]=2 802 B21R2.4848 O=C(C=Cc1ccccc1O)CCOc2ccccc2 1458a_100016263591_100000184471 [0,1,0,0,0,0|2,0,0]=3 803 B21R2.4848 O=C(C=Cc1ccccc1O)CCSc2ccccc2 1458a_100016263591_100000246102 [0,1,0,0,0,0|2,0,0]=3 804 B21R2.4848 O=C(C=Cc1ccccc1O)CSCc2ccccc2 1458a_100016263591_200011217039 [0,1,0,0,0,0|2,0,0]=3 805 B21R2.4848 O=C(C=Cc1ccccc1O)NNCc2ccccc2 22a_100000007032_100016263591 [0,1,0,0,0,0|2,0,0]=3 806 B21R2.4848 O=C(C=Cc1ccccc1O)NNCc2ccccn2 22a_100000736832_100016263591 [0,1,0,0,0,0|3,0,0]=4 807 B21R2.4848 O=C(C=Cc1ccccc1O)NNCc2cccnc2 22a_100000738295_100016263591 [0,1,0,0,0,0|3,0,0]=4 808 B21R2.4848 O=C(C=Cc1ccccc1O)NNCc2ccncc2 22a_100000736929_100016263591 [0,1,0,0,0,0|3,0,0]=4 809 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2Br 1458a_100000740810_100000211621 [0,1,0,0,0,0|1,0,2]=4 810 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2Br 1458a_100011207963_100012161201 [0,1,0,0,0,0|1,0,2]=4 811 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2Cl 1458a_100000184300_100000211621 [0,1,0,0,0,0|1,0,2]=4 812 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2Cl 1458a_100011207963_100011713703 [0,1,0,0,0,0|1,0,2]=4 813 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2F 1458a_100000189703_100000211621 [0,1,0,0,0,0|1,0,2]=4 814 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2F 1458a_100011207963_100000720011 [0,1,0,0,0,0|1,0,2]=4 815 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2I 1458a_100000037306_100000211621 [0,1,0,0,0,0|1,0,2]=4 816 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2O 1458a_100000181328_100000211621 [0,1,0,0,0,0|1,0,2]=4 817 B21R2.4848 O=C(CCCc1ccccc1)CCc2ccccc2O 1458a_100011207963_100000722297 [0,1,0,0,0,0|1,0,2]=4 818 B21R2.4848 O=C(CCCc1ccccc1)COc2ccccc2Br 1458a_100000216496_100000211621 [0,1,0,0,0,0|2,0,1]=4 819 B21R2.4848 O=C(CCCc1ccccc1)COc2ccccc2Cl 1458a_100000185159_100000211621 [0,1,0,0,0,0|2,0,1]=4 820 B21R2.4848 O=C(CCCc1ccccc1)COc2ccccc2F 1458a_100000182486_100000211621 [0,1,0,0,0,0|2,0,1]=4 821 B21R2.4848 O=C(CCCc1ccccc1)COc2ccccc2O 1458a_100000183020_100000211621 [0,1,0,0,0,0|2,0,1]=4 822 B21R2.4848 O=C(CCCc1ccccc1)CSc2ccccc2F 1458a_100000179528_100000211621 [0,1,0,0,0,0|2,0,1]=4 823 B21R2.4848 O=C(CCCc1ccccc1)CSc2ccccc2O 1458a_100000695322_100000211621 [0,1,0,0,0,0|2,0,1]=4 824 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2Br 11a_100000689332_100011207963 [0,1,0,0,0,0|2,0,1]=4 825 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100011207963 [0,1,0,0,0,0|2,0,1]=4 826 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2Br 240690a_100000689332_100011207963 [0,1,0,0,0,0|2,0,1]=4 827 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2Br 527a_100000689332_100011207963 [0,1,0,0,0,0|2,0,1]=4 828 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100011207963 [0,1,0,0,0,0|2,0,1]=4 829 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100011207963 [0,1,0,0,0,0|2,0,1]=4 830 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100011207963 [0,1,0,0,0,0|2,0,1]=4 831 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2Cl 527a_100000174879_100011207963 [0,1,0,0,0,0|2,0,1]=4 832 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2F 11a_100000174869_100011207963 [0,1,0,0,0,0|2,0,1]=4 833 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2F 1626a_100000174869_100011207963 [0,1,0,0,0,0|2,0,1]=4 834 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2F 240690a_100000174869_100011207963 [0,1,0,0,0,0|2,0,1]=4 835 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2F 527a_100000174869_100011207963 [0,1,0,0,0,0|2,0,1]=4 836 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2I 11a_100015347259_100011207963 [0,1,0,0,0,0|2,0,1]=4 837 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2I 1626a_100015347259_100011207963 [0,1,0,0,0,0|2,0,1]=4 838 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2I 240690a_100015347259_100011207963 [0,1,0,0,0,0|2,0,1]=4 839 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2I 527a_100015347259_100011207963 [0,1,0,0,0,0|2,0,1]=4 840 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2O 240690a_100000185550_100011207963 [0,1,0,0,0,0|2,0,1]=4 841 B21R2.4848 O=C(CCCc1ccccc1)NCc2ccccc2O 527a_100000185550_100011207963 [0,1,0,0,0,0|2,0,1]=4 842 B21R2.4848 O=C(CCCc1ccccc1)NNc2ccccc2Br 22a_100000241748_100011207963 [0,1,0,0,0,0|3,0,0]=4 843 B21R2.4848 O=C(CCCc1ccccc1)NNc2ccccc2Cl 22a_100000683529_100011207963 [0,1,0,0,0,0|3,0,0]=4 844 B21R2.4848 O=C(CCCc1ccccc1)NNc2ccccc2F 22a_100000239246_100011207963 [0,1,0,0,0,0|3,0,0]=4 845 B21R2.4848 O=C(CCCc1ccccc1)NNc2ccccc2I 22a_100011218156_100011207963 [0,1,0,0,0,0|3,0,0]=4 846 B21R2.4848 O=C(CCc1ccccc1Br)NCCc2ccccc2 11a_100000106460_100000740810 [0,1,0,0,0,0|1,0,2]=4 847 B21R2.4848 O=C(CCc1ccccc1Br)NCCc2ccccc2 1626a_100000106460_100000740810 [0,1,0,0,0,0|1,0,2]=4 848 B21R2.4848 O=C(CCc1ccccc1Br)NCCc2ccccc2 240690a_100000106460_100000740810 [0,1,0,0,0,0|1,0,2]=4 849 B21R2.4848 O=C(CCc1ccccc1Br)NCCc2ccccc2 527a_100000106460_100000740810 [0,1,0,0,0,0|1,0,2]=4 850 B21R2.4848 O=C(CCc1ccccc1Cl)NCCc2ccccc2 11a_100000106460_100000184300 [0,1,0,0,0,0|1,0,2]=4 851 B21R2.4848 O=C(CCc1ccccc1Cl)NCCc2ccccc2 1626a_100000106460_100000184300 [0,1,0,0,0,0|1,0,2]=4 852 B21R2.4848 O=C(CCc1ccccc1Cl)NCCc2ccccc2 240690a_100000106460_100000184300 [0,1,0,0,0,0|1,0,2]=4 853 B21R2.4848 O=C(CCc1ccccc1Cl)NCCc2ccccc2 527a_100000106460_100000184300 [0,1,0,0,0,0|1,0,2]=4 854 B21R2.4848 O=C(CCc1ccccc1F)NCCc2ccccc2 11a_100000106460_100000189703 [0,1,0,0,0,0|1,0,2]=4 855 B21R2.4848 O=C(CCc1ccccc1F)NCCc2ccccc2 1626a_100000106460_100000189703 [0,1,0,0,0,0|1,0,2]=4 856 B21R2.4848 O=C(CCc1ccccc1F)NCCc2ccccc2 240690a_100000106460_100000189703 [0,1,0,0,0,0|1,0,2]=4 857 B21R2.4848 O=C(CCc1ccccc1F)NCCc2ccccc2 527a_100000106460_100000189703 [0,1,0,0,0,0|1,0,2]=4 858 B21R2.4848 O=C(CCc1ccccc1I)NCCc2ccccc2 11a_100000106460_100000037306 [0,1,0,0,0,0|1,0,2]=4 859 B21R2.4848 O=C(CCc1ccccc1I)NCCc2ccccc2 1626a_100000106460_100000037306 [0,1,0,0,0,0|1,0,2]=4 860 B21R2.4848 O=C(CCc1ccccc1I)NCCc2ccccc2 240690a_100000106460_100000037306 [0,1,0,0,0,0|1,0,2]=4 861 B21R2.4848 O=C(CCc1ccccc1I)NCCc2ccccc2 527a_100000106460_100000037306 [0,1,0,0,0,0|1,0,2]=4 862 B21R2.4848 O=C(CCc1ccccc1O)NCCc2ccccc2 11a_100000106460_100000181328 [0,1,0,0,0,0|1,0,2]=4 863 B21R2.4848 O=C(CCc1ccccc1O)NCCc2ccccc2 240690a_100000106460_100000181328 [0,1,0,0,0,0|1,0,2]=4 864 B21R2.4848 O=C(CCc1ccccc1O)NCCc2ccccc2 527a_100000106460_100000181328 [0,1,0,0,0,0|1,0,2]=4 865 B21R2.4848 O=C(CNc1ccccc1Br)NCCc2ccccc2 34a_100000210017_100000183012 [0,1,0,0,0,0|2,0,1]=4 866 B21R2.4848 O=C(CNc1ccccc1Br)OCCc2ccccc2 34a_100000210017_200000077782 [0,1,0,0,0,0|1,0,1]=3 867 B21R2.4848 O=C(CNc1ccccc1Cl)NCCc2ccccc2 34a_100000185783_100000183012 [0,1,0,0,0,0|2,0,1]=4 868 B21R2.4848 O=C(CNc1ccccc1Cl)OCCc2ccccc2 34a_100000185783_200000077782 [0,1,0,0,0,0|1,0,1]=3 869 B21R2.4848 O=C(CNc1ccccc1F)NCCc2ccccc2 34a_100000210422_100000183012 [0,1,0,0,0,0|2,0,1]=4 870 B21R2.4848 O=C(CNc1ccccc1F)OCCc2ccccc2 34a_100000210422_200000077782 [0,1,0,0,0,0|1,0,1]=3 871 B21R2.4848 O=C(CNc1ccccc1I)NCCc2ccccc2 34a_100000210053_100000183012 [0,1,0,0,0,0|2,0,1]=4 872 B21R2.4848 O=C(CNc1ccccc1I)OCCc2ccccc2 34a_100000210053_200000077782 [0,1,0,0,0,0|1,0,1]=3 873 B21R2.4848 O=C(CNc1ccccc1O)NCCc2ccccc2 34a_100000185747_100000183012 [0,1,0,0,0,0|2,0,1]=4 874 B21R2.4848 O=C(CNc1ccccc1O)OCCc2ccccc2 34a_100000185747_200000077782 [0,1,0,0,0,0|1,0,1]=3 875 B21R2.4848 O=C(COc1cccc[n+]1[O-])OCCc2ccccc2 7a_100000211761_200000077782 [0,1,0,0,0,0|2,0,1]=4 876 B21R2.4848 O=C(COc1ccccc1Br)NCCc2ccccc2 11a_100000106460_100000216496 [0,1,0,0,0,0|2,0,1]=4 877 B21R2.4848 O=C(COc1ccccc1Br)NCCc2ccccc2 1626a_100000106460_100000216496 [0,1,0,0,0,0|2,0,1]=4 878 B21R2.4848 O=C(COc1ccccc1Br)NCCc2ccccc2 240690a_100000106460_100000216496 [0,1,0,0,0,0|2,0,1]=4 879 B21R2.4848 O=C(COc1ccccc1Br)NCCc2ccccc2 34a_100000181306_100000183012 [0,1,0,0,0,0|2,0,1]=4 880 B21R2.4848 O=C(COc1ccccc1Br)NCCc2ccccc2 527a_100000106460_100000216496 [0,1,0,0,0,0|2,0,1]=4 881 B21R2.4848 O=C(COc1ccccc1Br)NCCc2ccccc2 7a_100000181306_100000183012 [0,1,0,0,0,0|2,0,1]=4 882 B21R2.4848 O=C(COc1ccccc1Br)OCCc2ccccc2 34a_100000181306_200000077782 [0,1,0,0,0,0|1,0,1]=3 883 B21R2.4848 O=C(COc1ccccc1Br)OCCc2ccccc2 7a_100000181306_200000077782 [0,1,0,0,0,0|1,0,1]=3 884 B21R2.4848 O=C(COc1ccccc1Cl)NCCc2ccccc2 11a_100000106460_100000185159 [0,1,0,0,0,0|2,0,1]=4 885 B21R2.4848 O=C(COc1ccccc1Cl)NCCc2ccccc2 1626a_100000106460_100000185159 [0,1,0,0,0,0|2,0,1]=4 886 B21R2.4848 O=C(COc1ccccc1Cl)NCCc2ccccc2 240690a_100000106460_100000185159 [0,1,0,0,0,0|2,0,1]=4 887 B21R2.4848 O=C(COc1ccccc1Cl)NCCc2ccccc2 34a_100000210172_100000183012 [0,1,0,0,0,0|2,0,1]=4 888 B21R2.4848 O=C(COc1ccccc1Cl)NCCc2ccccc2 527a_100000106460_100000185159 [0,1,0,0,0,0|2,0,1]=4 889 B21R2.4848 O=C(COc1ccccc1Cl)NCCc2ccccc2 7a_100000210172_100000183012 [0,1,0,0,0,0|2,0,1]=4 890 B21R2.4848 O=C(COc1ccccc1Cl)OCCc2ccccc2 34a_100000210172_200000077782 [0,1,0,0,0,0|1,0,1]=3 891 B21R2.4848 O=C(COc1ccccc1Cl)OCCc2ccccc2 7a_100000210172_200000077782 [0,1,0,0,0,0|1,0,1]=3 892 B21R2.4848 O=C(COc1ccccc1F)NCCc2ccccc2 11a_100000106460_100000182486 [0,1,0,0,0,0|2,0,1]=4 893 B21R2.4848 O=C(COc1ccccc1F)NCCc2ccccc2 1626a_100000106460_100000182486 [0,1,0,0,0,0|2,0,1]=4 894 B21R2.4848 O=C(COc1ccccc1F)NCCc2ccccc2 240690a_100000106460_100000182486 [0,1,0,0,0,0|2,0,1]=4 895 B21R2.4848 O=C(COc1ccccc1F)NCCc2ccccc2 34a_100000210171_100000183012 [0,1,0,0,0,0|2,0,1]=4 896 B21R2.4848 O=C(COc1ccccc1F)NCCc2ccccc2 527a_100000106460_100000182486 [0,1,0,0,0,0|2,0,1]=4 897 B21R2.4848 O=C(COc1ccccc1F)NCCc2ccccc2 7a_100000210171_100000183012 [0,1,0,0,0,0|2,0,1]=4 898 B21R2.4848 O=C(COc1ccccc1F)OCCc2ccccc2 34a_100000210171_200000077782 [0,1,0,0,0,0|1,0,1]=3 899 B21R2.4848 O=C(COc1ccccc1F)OCCc2ccccc2 7a_100000210171_200000077782 [0,1,0,0,0,0|1,0,1]=3 900 B21R2.4848 O=C(COc1ccccc1I)NCCc2ccccc2 34a_100000739446_100000183012 [0,1,0,0,0,0|2,0,1]=4 901 B21R2.4848 O=C(COc1ccccc1I)NCCc2ccccc2 7a_100000739446_100000183012 [0,1,0,0,0,0|2,0,1]=4 902 B21R2.4848 O=C(COc1ccccc1I)OCCc2ccccc2 34a_100000739446_200000077782 [0,1,0,0,0,0|1,0,1]=3 903 B21R2.4848 O=C(COc1ccccc1I)OCCc2ccccc2 7a_100000739446_200000077782 [0,1,0,0,0,0|1,0,1]=3 904 B21R2.4848 O=C(COc1ccccc1O)NCCc2ccccc2 240690a_100000106460_100000183020 [0,1,0,0,0,0|2,0,1]=4 905 B21R2.4848 O=C(COc1ccccc1O)NCCc2ccccc2 527a_100000106460_100000183020 [0,1,0,0,0,0|2,0,1]=4 906 B21R2.4848 O=C(COc1cccnc1Br)OCCc2ccccc2 34a_100000744436_200000077782 [0,1,0,0,0,0|2,0,1]=4 907 B21R2.4848 O=C(COc1cccnc1Br)OCCc2ccccc2 7a_100000744436_200000077782 [0,1,0,0,0,0|2,0,1]=4 908 B21R2.4848 O=C(COc1cccnc1Cl)OCCc2ccccc2 34a_100000757616_200000077782 [0,1,0,0,0,0|2,0,1]=4 909 B21R2.4848 O=C(COc1cccnc1Cl)OCCc2ccccc2 7a_100000757616_200000077782 [0,1,0,0,0,0|2,0,1]=4 910 B21R2.4848 O=C(COc1cccnc1F)OCCc2ccccc2 34a_100000061740_200000077782 [0,1,0,0,0,0|2,0,1]=4 911 B21R2.4848 O=C(COc1cccnc1F)OCCc2ccccc2 7a_100000061740_200000077782 [0,1,0,0,0,0|2,0,1]=4 912 B21R2.4848 O=C(COc1cccnc1I)OCCc2ccccc2 34a_100000034122_200000077782 [0,1,0,0,0,0|2,0,1]=4 913 B21R2.4848 O=C(COc1cccnc1I)OCCc2ccccc2 7a_100000034122_200000077782 [0,1,0,0,0,0|2,0,1]=4 914 B21R2.4848 O=C(COc1cccoc1=O)OCCc2ccccc2 34a_100000077404_200000077782 [0,1,0,0,0,0|2,0,1]=4 915 B21R2.4848 O=C(COc1cccoc1=O)OCCc2ccccc2 7a_100000077404_200000077782 [0,1,0,0,0,0|2,0,1]=4 916 B21R2.4848 O=C(COc1ccncc1Br)OCCc2ccccc2 34a_100011996408_200000077782 [0,1,0,0,0,0|2,0,1]=4 917 B21R2.4848 O=C(COc1ccncc1Cl)OCCc2ccccc2 34a_100011997054_200000077782 [0,1,0,0,0,0|2,0,1]=4 918 B21R2.4848 O=C(COc1ccncc1F)OCCc2ccccc2 34a_200000081243_200000077782 [0,1,0,0,0,0|2,0,1]=4 919 B21R2.4848 O=C(COc1cnccc1Cl)OCCc2ccccc2 34a_100011996695_200000077782 [0,1,0,0,0,0|2,0,1]=4 920 B21R2.4848 O=C(COc1cnccc1I)OCCc2ccccc2 34a_100000050107_200000077782 [0,1,0,0,0,0|2,0,1]=4 921 B21R2.4848 O=C(COc1coccc1=O)OCCc2ccccc2 34a_100000060831_200000077782 [0,1,0,0,0,0|2,0,1]=4 922 B21R2.4848 O=C(COc1ncccc1Cl)OCCc2ccccc2 34a_100011290957_200000077782 [0,1,0,0,0,0|2,0,1]=4 923 B21R2.4848 O=C(COc1ncccc1F)OCCc2ccccc2 34a_100011219419_200000077782 [0,1,0,0,0,0|2,0,1]=4 924 B21R2.4848 O=C(CSc1c[nH]ccc1=O)OCCc2ccccc2 62a_100009998708_200000077782 [0,1,0,0,0,0|2,0,1]=4 925 B21R2.4848 O=C(CSc1c[nH]ccc1=O)OCCc2ccccc2 62a_200000077782_100009998708 [0,1,0,0,0,0|2,0,1]=4 926 B21R2.4848 O=C(CSc1c[nH]ccc1=S)OCCc2ccccc2 62a_200000077782_200012280681 [0,1,0,0,0,0|2,0,1]=4 927 B21R2.4848 O=C(CSc1c[nH]ccc1=S)OCCc2ccccc2 62a_200012280681_200000077782 [0,1,0,0,0,0|2,0,1]=4 928 B21R2.4848 O=C(CSc1cccc[n+]1[O-])OCCc2ccccc2 62a_200000077782_200000042595 [0,1,0,0,0,0|2,0,1]=4 929 B21R2.4848 O=C(CSc1ccccc1Br)NCCc2ccccc2 62a_100000183012_100000695589 [0,1,0,0,0,0|2,0,1]=4 930 B21R2.4848 O=C(CSc1ccccc1Br)NCCc2ccccc2 62a_100000695589_100000183012 [0,1,0,0,0,0|2,0,1]=4 931 B21R2.4848 O=C(CSc1ccccc1Br)OCCc2ccccc2 62a_100000695589_200000077782 [0,1,0,0,0,0|1,0,1]=3 932 B21R2.4848 O=C(CSc1ccccc1Br)OCCc2ccccc2 62a_200000077782_100000695589 [0,1,0,0,0,0|1,0,1]=3 933 B21R2.4848 O=C(CSc1ccccc1Cl)NCCc2ccccc2 62a_100000183012_100000764095 [0,1,0,0,0,0|2,0,1]=4 934 B21R2.4848 O=C(CSc1ccccc1Cl)NCCc2ccccc2 62a_100000764095_100000183012 [0,1,0,0,0,0|2,0,1]=4 935 B21R2.4848 O=C(CSc1ccccc1Cl)OCCc2ccccc2 62a_100000764095_200000077782 [0,1,0,0,0,0|1,0,1]=3 936 B21R2.4848 O=C(CSc1ccccc1Cl)OCCc2ccccc2 62a_200000077782_100000764095 [0,1,0,0,0,0|1,0,1]=3 937 B21R2.4848 O=C(CSc1ccccc1F)NCCc2ccccc2 11a_100000106460_100000179528 [0,1,0,0,0,0|2,0,1]=4 938 B21R2.4848 O=C(CSc1ccccc1F)NCCc2ccccc2 1626a_100000106460_100000179528 [0,1,0,0,0,0|2,0,1]=4 939 B21R2.4848 O=C(CSc1ccccc1F)NCCc2ccccc2 240690a_100000106460_100000179528 [0,1,0,0,0,0|2,0,1]=4 940 B21R2.4848 O=C(CSc1ccccc1F)NCCc2ccccc2 62a_100000183012_100011215700 [0,1,0,0,0,0|2,0,1]=4 941 B21R2.4848 O=C(CSc1ccccc1F)NCCc2ccccc2 62a_100011215700_100000183012 [0,1,0,0,0,0|2,0,1]=4 942 B21R2.4848 O=C(CSc1ccccc1F)OCCc2ccccc2 62a_100011215700_200000077782 [0,1,0,0,0,0|1,0,1]=3 943 B21R2.4848 O=C(CSc1ccccc1F)OCCc2ccccc2 62a_200000077782_100011215700 [0,1,0,0,0,0|1,0,1]=3 944 B21R2.4848 O=C(CSc1ccccc1O)NCCc2ccccc2 240690a_100000106460_100000695322 [0,1,0,0,0,0|2,0,1]=4 945 B21R2.4848 O=C(CSc1ccccc1O)NCCc2ccccc2 527a_100000106460_100000695322 [0,1,0,0,0,0|2,0,1]=4 946 B21R2.4848 O=C(CSc1ccccc1O)NCCc2ccccc2 62a_100000183012_100000739446 [0,1,0,0,0,0|2,0,1]=4 947 B21R2.4848 O=C(CSc1ccccc1O)NCCc2ccccc2 62a_100000739446_100000183012 [0,1,0,0,0,0|2,0,1]=4 948 B21R2.4848 O=C(CSc1ccccc1O)OCCc2ccccc2 62a_100000739446_200000077782 [0,1,0,0,0,0|1,0,1]=3 949 B21R2.4848 O=C(CSc1ccccc1O)OCCc2ccccc2 62a_200000077782_100000739446 [0,1,0,0,0,0|1,0,1]=3 950 B21R2.4848 O=C(CSc1cccnc1Br)OCCc2ccccc2 62a_100010202626_200000077782 [0,1,0,0,0,0|2,0,1]=4 951 B21R2.4848 O=C(CSc1cccnc1Br)OCCc2ccccc2 62a_200000077782_100010202626 [0,1,0,0,0,0|2,0,1]=4 952 B21R2.4848 O=C(CSc1cccnc1Cl)OCCc2ccccc2 62a_100000036424_200000077782 [0,1,0,0,0,0|2,0,1]=4 953 B21R2.4848 O=C(CSc1cccnc1Cl)OCCc2ccccc2 62a_200000077782_100000036424 [0,1,0,0,0,0|2,0,1]=4 954 B21R2.4848 O=C(CSc1cccnc1F)OCCc2ccccc2 62a_100009816115_200000077782 [0,1,0,0,0,0|2,0,1]=4 955 B21R2.4848 O=C(CSc1cccnc1F)OCCc2ccccc2 62a_200000077782_100009816115 [0,1,0,0,0,0|2,0,1]=4 956 B21R2.4848 O=C(CSc1cccnc1O)OCCc2ccccc2 62a_100000760158_200000077782 [0,1,0,0,0,0|2,0,1]=4 957 B21R2.4848 O=C(CSc1cccnc1O)OCCc2ccccc2 62a_200000077782_100000760158 [0,1,0,0,0,0|2,0,1]=4 958 B21R2.4848 O=C(CSc1ccncc1Br)OCCc2ccccc2 62a_100000726257_200000077782 [0,1,0,0,0,0|2,0,1]=4 959 B21R2.4848 O=C(CSc1ccncc1Br)OCCc2ccccc2 62a_200000077782_100000726257 [0,1,0,0,0,0|2,0,1]=4 960 B21R2.4848 O=C(CSc1ccncc1Cl)OCCc2ccccc2 62a_100000708259_200000077782 [0,1,0,0,0,0|2,0,1]=4 961 B21R2.4848 O=C(CSc1ccncc1Cl)OCCc2ccccc2 62a_200000077782_100000708259 [0,1,0,0,0,0|2,0,1]=4 962 B21R2.4848 O=C(CSc1ccncc1F)OCCc2ccccc2 62a_100000047030_200000077782 [0,1,0,0,0,0|2,0,1]=4 963 B21R2.4848 O=C(CSc1ccncc1F)OCCc2ccccc2 62a_200000077782_100000047030 [0,1,0,0,0,0|2,0,1]=4 964 B21R2.4848 O=C(CSc1ccncc1O)OCCc2ccccc2 62a_100009817591_200000077782 [0,1,0,0,0,0|2,0,1]=4 965 B21R2.4848 O=C(CSc1ccncc1O)OCCc2ccccc2 62a_200000077782_100009817591 [0,1,0,0,0,0|2,0,1]=4 966 B21R2.4848 O=C(CSc1cnccc1Br)OCCc2ccccc2 62a_100010138639_200000077782 [0,1,0,0,0,0|2,0,1]=4 967 B21R2.4848 O=C(CSc1cnccc1Br)OCCc2ccccc2 62a_200000077782_100010138639 [0,1,0,0,0,0|2,0,1]=4 968 B21R2.4848 O=C(CSc1cnccc1Cl)OCCc2ccccc2 62a_100009995489_200000077782 [0,1,0,0,0,0|2,0,1]=4 969 B21R2.4848 O=C(CSc1cnccc1Cl)OCCc2ccccc2 62a_200000077782_100009995489 [0,1,0,0,0,0|2,0,1]=4 970 B21R2.4848 O=C(CSc1cnccc1F)OCCc2ccccc2 62a_100009820683_200000077782 [0,1,0,0,0,0|2,0,1]=4 971 B21R2.4848 O=C(CSc1cnccc1F)OCCc2ccccc2 62a_200000077782_100009820683 [0,1,0,0,0,0|2,0,1]=4 972 B21R2.4848 O=C(CSc1ncccc1Br)OCCc2ccccc2 62a_100000696092_200000077782 [0,1,0,0,0,0|2,0,1]=4 973 B21R2.4848 O=C(CSc1ncccc1Br)OCCc2ccccc2 62a_200000077782_100000696092 [0,1,0,0,0,0|2,0,1]=4 974 B21R2.4848 O=C(CSc1ncccc1Cl)OCCc2ccccc2 62a_100011356963_200000077782 [0,1,0,0,0,0|2,0,1]=4 975 B21R2.4848 O=C(CSc1ncccc1Cl)OCCc2ccccc2 62a_200000077782_100011356963 [0,1,0,0,0,0|2,0,1]=4 976 B21R2.4848 O=C(CSc1ncccc1F)OCCc2ccccc2 62a_100000685392_200000077782 [0,1,0,0,0,0|2,0,1]=4 977 B21R2.4848 O=C(CSc1ncccc1F)OCCc2ccccc2 62a_200000077782_100000685392 [0,1,0,0,0,0|2,0,1]=4 978 B21R2.4848 O=C(CSc1ncccc1O)OCCc2ccccc2 62a_100000034122_200000077782 [0,1,0,0,0,0|2,0,1]=4 979 B21R2.4848 O=C(CSc1ncccc1O)OCCc2ccccc2 62a_200000077782_100000034122 [0,1,0,0,0,0|2,0,1]=4 980 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Br 2708a_100000106460_100000689332 [0,1,0,0,0,0|2,0,1]=4 981 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Br 2708a_100000689332_100000106460 [0,1,0,0,0,0|2,0,1]=4 982 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Br 273464a_100000106460_100000689332 [0,1,0,0,0,0|2,0,1]=4 983 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Br 273464a_100000689332_100000106460 [0,1,0,0,0,0|2,0,1]=4 984 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Br 512a_100000106460_100000689332 [0,1,0,0,0,0|2,0,1]=4 985 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Br 512a_100000689332_100000106460 [0,1,0,0,0,0|2,0,1]=4 986 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Cl 2708a_100000106460_100000174879 [0,1,0,0,0,0|2,0,1]=4 987 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Cl 2708a_100000174879_100000106460 [0,1,0,0,0,0|2,0,1]=4 988 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Cl 273464a_100000106460_100000174879 [0,1,0,0,0,0|2,0,1]=4 989 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Cl 273464a_100000174879_100000106460 [0,1,0,0,0,0|2,0,1]=4 990 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2Cl 512a_100000106460_100000174879 [0,1,0,0,0,0|2,0,1]=4 991 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2F 2708a_100000106460_100000174869 [0,1,0,0,0,0|2,0,1]=4 992 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2F 2708a_100000174869_100000106460 [0,1,0,0,0,0|2,0,1]=4 993 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2F 273464a_100000106460_100000174869 [0,1,0,0,0,0|2,0,1]=4 994 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2F 273464a_100000174869_100000106460 [0,1,0,0,0,0|2,0,1]=4 995 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2F 512a_100000106460_100000174869 [0,1,0,0,0,0|2,0,1]=4 996 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2F 512a_100000174869_100000106460 [0,1,0,0,0,0|2,0,1]=4 997 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2I 2708a_100000106460_100015347259 [0,1,0,0,0,0|2,0,1]=4 998 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2I 2708a_100015347259_100000106460 [0,1,0,0,0,0|2,0,1]=4 999 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2I 273464a_100000106460_100015347259 [0,1,0,0,0,0|2,0,1]=4 1000 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2I 273464a_100015347259_100000106460 [0,1,0,0,0,0|2,0,1]=4 1001 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2I 512a_100000106460_100015347259 [0,1,0,0,0,0|2,0,1]=4 1002 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2I 512a_100015347259_100000106460 [0,1,0,0,0,0|2,0,1]=4 1003 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2O 2708a_100000106460_100000185550 [0,1,0,0,0,0|2,0,1]=4 1004 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2O 2708a_100000185550_100000106460 [0,1,0,0,0,0|2,0,1]=4 1005 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2O 273464a_100000106460_100000185550 [0,1,0,0,0,0|2,0,1]=4 1006 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2O 273464a_100000185550_100000106460 [0,1,0,0,0,0|2,0,1]=4 1007 B21R2.4848 O=C(NCCc1ccccc1)NCc2ccccc2O 512a_100000185550_100000106460 [0,1,0,0,0,0|2,0,1]=4 1008 B21R2.4848 O=C(NCCc1ccccc1)NNc2ccccc2Br 273464a_100000106460_100000241748 [0,1,0,0,0,0|3,0,0]=4 1009 B21R2.4848 O=C(NCCc1ccccc1)NNc2ccccc2Br 512a_100000106460_100000241748 [0,1,0,0,0,0|3,0,0]=4 1010 B21R2.4848 O=C(NCCc1ccccc1)NNc2ccccc2Cl 273464a_100000106460_100000683529 [0,1,0,0,0,0|3,0,0]=4 1011 B21R2.4848 O=C(NCCc1ccccc1)NNc2ccccc2Cl 512a_100000106460_100000683529 [0,1,0,0,0,0|3,0,0]=4 1012 B21R2.4848 O=C(NCCc1ccccc1)NNc2ccccc2F 273464a_100000106460_100000239246 [0,1,0,0,0,0|3,0,0]=4 1013 B21R2.4848 O=C(NCCc1ccccc1)NNc2ccccc2F 512a_100000106460_100000239246 [0,1,0,0,0,0|3,0,0]=4 1014 B21R2.4848 O=C(NCCc1ccccc1)NNc2ccccc2I 273464a_100000106460_100011218156 [0,1,0,0,0,0|3,0,0]=4 1015 B21R2.4848 O=C(NCCc1ccccc1)NNc2ccccc2I 512a_100000106460_100011218156 [0,1,0,0,0,0|3,0,0]=4 1016 B21R2.4852 CC(=NNCc1ccccc1Br)C=Cc2ccccc2 4a_200016993956_100000204604 [0,1,0,0,0,0|3,0,0]=4 1017 B21R2.4852 CC(=NNCc1ccccc1C)C=Cc2ccccc2 4a_100000737298_100000204604 [0,1,0,0,0,0|3,0,0]=4 1018 B21R2.4852 CC(=NNCc1ccccc1Cl)C=Cc2ccccc2 4a_100015187261_100000204604 [0,1,0,0,0,0|3,0,0]=4 1019 B21R2.4852 CC(=NNCc1ccccc1F)C=Cc2ccccc2 4a_100015200773_100000204604 [0,1,0,0,0,0|3,0,0]=4 1020 B21R2.4852 Cc1ccccc1CCNC(=O)C#Cc2ccccc2 240690a_100000685071_100000736102 [0,1,0,0,0,0|1,0,2]=4 1021 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccccc2 11a_100000685071_100000210462 [0,1,0,0,0,0|1,0,0]=2 1022 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccccc2 1626a_100000685071_100000210462 [0,1,0,0,0,0|1,0,0]=2 1023 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccccn2 11a_100000685071_100000740811 [0,1,0,0,0,0|2,0,0]=3 1024 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccccn2 240690a_100000685071_100000740811 [0,1,0,0,0,0|2,0,0]=3 1025 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2cccnc2 11a_100000685071_100000735890 [0,1,0,0,0,0|2,0,0]=3 1026 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2cccnc2 240690a_100000685071_100000735890 [0,1,0,0,0,0|2,0,0]=3 1027 B21R2.4852 Cc1ccccc1CCNC(=O)C=Cc2ccncc2 240690a_100000685071_100000682801 [0,1,0,0,0,0|2,0,0]=3 1028 B21R2.4852 Cc1ccccc1CCNC(=O)CCc2ccccc2 11a_100000685071_100000185753 [0,1,0,0,0,0|1,0,2]=4 1029 B21R2.4852 Cc1ccccc1CCNC(=O)CCc2ccccc2 1626a_100000685071_100000185753 [0,1,0,0,0,0|1,0,2]=4 1030 B21R2.4852 Cc1ccccc1CCNC(=O)CCc2ccccc2 240690a_100000685071_100000185753 [0,1,0,0,0,0|1,0,2]=4 1031 B21R2.4852 Cc1ccccc1CCNC(=O)CCc2ccccc2 527a_100000685071_100000185753 [0,1,0,0,0,0|1,0,2]=4 1032 B21R2.4852 Cc1ccccc1CCNC(=O)CNc2ccccc2 34a_100000106764_100000230229 [0,1,0,0,0,0|2,0,1]=4 1033 B21R2.4852 Cc1ccccc1CCNC(=O)COc2ccccc2 11a_100000685071_100000186222 [0,1,0,0,0,0|2,0,1]=4 1034 B21R2.4852 Cc1ccccc1CCNC(=O)COc2ccccc2 1626a_100000685071_100000186222 [0,1,0,0,0,0|2,0,1]=4 1035 B21R2.4852 Cc1ccccc1CCNC(=O)COc2ccccc2 240690a_100000685071_100000186222 [0,1,0,0,0,0|2,0,1]=4 1036 B21R2.4852 Cc1ccccc1CCNC(=O)COc2ccccc2 34a_100000210340_100000230229 [0,1,0,0,0,0|2,0,1]=4 1037 B21R2.4852 Cc1ccccc1CCNC(=O)COc2ccccc2 527a_100000685071_100000186222 [0,1,0,0,0,0|2,0,1]=4 1038 B21R2.4852 Cc1ccccc1CCNC(=O)COc2ccccc2 7a_100000210340_100000230229 [0,1,0,0,0,0|2,0,1]=4 1039 B21R2.4852 Cc1ccccc1CCNC(=O)CSc2ccccc2 11a_100000685071_100000211596 [0,1,0,0,0,0|2,0,1]=4 1040 B21R2.4852 Cc1ccccc1CCNC(=O)CSc2ccccc2 1626a_100000685071_100000211596 [0,1,0,0,0,0|2,0,1]=4 1041 B21R2.4852 Cc1ccccc1CCNC(=O)CSc2ccccc2 240690a_100000685071_100000211596 [0,1,0,0,0,0|2,0,1]=4 1042 B21R2.4852 Cc1ccccc1CCNC(=O)CSc2ccccc2 527a_100000685071_100000211596 [0,1,0,0,0,0|2,0,1]=4 1043 B21R2.4852 Cc1ccccc1CCNC(=O)CSc2ccccc2 62a_100000230229_100000041952 [0,1,0,0,0,0|2,0,1]=4 1044 B21R2.4852 Cc1ccccc1CCNC(=O)CSc2ccccc2 62a_100000719477_100000230229 [0,1,0,0,0,0|2,0,1]=4 1045 B21R2.4852 Cc1ccccc1CCNC(=O)NCc2ccccc2 2708a_100000685071_100015324214 [0,1,0,0,0,0|2,0,1]=4 1046 B21R2.4852 Cc1ccccc1CCNC(=O)NCc2ccccc2 2708a_100015324214_100000685071 [0,1,0,0,0,0|2,0,1]=4 1047 B21R2.4852 Cc1ccccc1CCNC(=O)NCc2ccccc2 273464a_100000685071_100015324214 [0,1,0,0,0,0|2,0,1]=4 1048 B21R2.4852 Cc1ccccc1CCNC(=O)NCc2ccccc2 273464a_100015324214_100000685071 [0,1,0,0,0,0|2,0,1]=4 1049 B21R2.4852 Cc1ccccc1CCNC(=O)NCc2ccccc2 512a_100000685071_100015324214 [0,1,0,0,0,0|2,0,1]=4 1050 B21R2.4852 Cc1ccccc1CCNC(=O)NCc2ccccc2 512a_100015324214_100000685071 [0,1,0,0,0,0|2,0,1]=4 1051 B21R2.4852 Cc1ccccc1CCNC(=O)NNc2ccccc2 273464a_100000685071_100015195140 [0,1,0,0,0,0|3,0,0]=4 1052 B21R2.4852 Cc1ccccc1CCNC(=O)NNc2ccccc2 512a_100000685071_100015195140 [0,1,0,0,0,0|3,0,0]=4 1053 B21R2.4852 Cc1ccccc1CCNC(=O)OCc2ccccc2 271570a_200010239705_100000210755 [0,1,0,0,0,0|2,0,1]=4 1054 B21R2.4852 Cc1ccccc1CNNC(=O)C=Cc2ccccc2 22a_100000737298_100000210462 [0,1,0,0,0,0|2,0,0]=3 1055 B21R2.4852 Cc1ccccc1CNNC(=O)C=Cc2ccccn2 22a_100000737298_100000740811 [0,1,0,0,0,0|3,0,0]=4 1056 B21R2.4852 Cc1ccccc1CNNC(=O)C=Cc2cccnc2 22a_100000737298_100000735890 [0,1,0,0,0,0|3,0,0]=4 1057 B21R2.4852 Cc1ccccc1CNNC(=O)C=Cc2ccncc2 22a_100000737298_100000682801 [0,1,0,0,0,0|3,0,0]=4 1058 B21R2.4852 Cc1ccccc1OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000184434 [0,1,0,0,0,0|2,0,0]=3 1059 B21R2.4852 Cc1ccccc1OCCC(=O)C=Cc2ccccn2 1458a_100000740811_100000184434 [0,1,0,0,0,0|3,0,0]=4 1060 B21R2.4852 Cc1ccccc1OCCC(=O)C=Cc2cccnc2 1458a_100000735890_100000184434 [0,1,0,0,0,0|3,0,0]=4 1061 B21R2.4852 Cc1ccccc1OCCC(=O)C=Cc2ccncc2 1458a_100000682801_100000184434 [0,1,0,0,0,0|3,0,0]=4 1062 B21R2.4852 Nc1ccccc1CCNC(=O)OCc2ccccc2 271570a_200010239705_100000210017 [0,1,0,0,0,0|2,0,1]=4 1063 B21R2.4852 O=C(C#Cc1ccccc1)CCCc2ccccc2Br 1458a_100000736102_200011713681 [0,1,0,0,0,0|1,0,2]=4 1064 B21R2.4852 O=C(C#Cc1ccccc1)NCCc2ccccc2Br 240690a_100000747383_100000736102 [0,1,0,0,0,0|1,0,2]=4 1065 B21R2.4852 O=C(C#Cc1ccccc1)NCCc2ccccc2Cl 240690a_100011207228_100000736102 [0,1,0,0,0,0|1,0,2]=4 1066 B21R2.4852 O=C(C#Cc1ccccc1)NCCc2ccccc2F 240690a_100000185272_100000736102 [0,1,0,0,0,0|1,0,2]=4 1067 B21R2.4852 O=C(C#Cc1ccccc1)NCCc2ccccc2O 240690a_100011207237_100000736102 [0,1,0,0,0,0|1,0,2]=4 1068 B21R2.4852 O=C(C=Cc1ccccc1)CC#Cc2ccccc2Br 1458a_100000210462_100010706765 [0,1,0,0,0,0|1,0,2]=4 1069 B21R2.4852 O=C(C=Cc1ccccc1)CC#Cc2ccccc2F 1458a_100000210462_100010404167 [0,1,0,0,0,0|1,0,2]=4 1070 B21R2.4852 O=C(C=Cc1ccccc1)CCCc2ccccc2Br 1458a_100000210462_200011713681 [0,1,0,0,0,0|1,0,0]=2 1071 B21R2.4852 O=C(C=Cc1ccccc1)CCOc2ccccc2Br 1458a_100000210462_100000695877 [0,1,0,0,0,0|2,0,0]=3 1072 B21R2.4852 O=C(C=Cc1ccccc1)CCOc2ccccc2F 1458a_100000210462_100000183290 [0,1,0,0,0,0|2,0,0]=3 1073 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2Br 11a_100000747383_100000210462 [0,1,0,0,0,0|1,0,0]=2 1074 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2Br 1626a_100000747383_100000210462 [0,1,0,0,0,0|1,0,0]=2 1075 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2Cl 11a_100011207228_100000210462 [0,1,0,0,0,0|1,0,0]=2 1076 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2Cl 1626a_100011207228_100000210462 [0,1,0,0,0,0|1,0,0]=2 1077 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2F 11a_100000185272_100000210462 [0,1,0,0,0,0|1,0,0]=2 1078 B21R2.4852 O=C(C=Cc1ccccc1)NCCc2ccccc2F 1626a_100000185272_100000210462 [0,1,0,0,0,0|1,0,0]=2 1079 B21R2.4852 O=C(C=Cc1ccccc1)NCCn2ccccc2=O 1626a_100000687133_100000210462 [0,1,0,0,0,0|2,0,0]=3 1080 B21R2.4852 O=C(C=Cc1ccccc1)NNCc2ccccc2Br 22a_200016993956_100000210462 [0,1,0,0,0,0|2,0,0]=3 1081 B21R2.4852 O=C(C=Cc1ccccc1)NNCc2ccccc2Cl 22a_100015187261_100000210462 [0,1,0,0,0,0|2,0,0]=3 1082 B21R2.4852 O=C(C=Cc1ccccc1)NNCc2ccccc2F 22a_100015200773_100000210462 [0,1,0,0,0,0|2,0,0]=3 1083 B21R2.4852 O=C(C=Cc1ccccn1)CCCc2ccccc2Br 1458a_100000740811_200011713681 [0,1,0,0,0,0|2,0,0]=3 1084 B21R2.4852 O=C(C=Cc1ccccn1)CCOc2ccccc2Br 1458a_100000740811_100000695877 [0,1,0,0,0,0|3,0,0]=4 1085 B21R2.4852 O=C(C=Cc1ccccn1)CCOc2ccccc2F 1458a_100000740811_100000183290 [0,1,0,0,0,0|3,0,0]=4 1086 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2Br 11a_100000747383_100000740811 [0,1,0,0,0,0|2,0,0]=3 1087 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2Br 240690a_100000747383_100000740811 [0,1,0,0,0,0|2,0,0]=3 1088 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2Cl 11a_100011207228_100000740811 [0,1,0,0,0,0|2,0,0]=3 1089 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2Cl 240690a_100011207228_100000740811 [0,1,0,0,0,0|2,0,0]=3 1090 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2F 11a_100000185272_100000740811 [0,1,0,0,0,0|2,0,0]=3 1091 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2F 240690a_100000185272_100000740811 [0,1,0,0,0,0|2,0,0]=3 1092 B21R2.4852 O=C(C=Cc1ccccn1)NCCc2ccccc2O 240690a_100011207237_100000740811 [0,1,0,0,0,0|2,0,0]=3 1093 B21R2.4852 O=C(C=Cc1ccccn1)NCCn2ccccc2=O 240690a_100000687133_100000740811 [0,1,0,0,0,0|3,0,0]=4 1094 B21R2.4852 O=C(C=Cc1ccccn1)NNCc2ccccc2Br 22a_200016993956_100000740811 [0,1,0,0,0,0|3,0,0]=4 1095 B21R2.4852 O=C(C=Cc1ccccn1)NNCc2ccccc2Cl 22a_100015187261_100000740811 [0,1,0,0,0,0|3,0,0]=4 1096 B21R2.4852 O=C(C=Cc1ccccn1)NNCc2ccccc2F 22a_100015200773_100000740811 [0,1,0,0,0,0|3,0,0]=4 1097 B21R2.4852 O=C(C=Cc1cccnc1)CCCc2ccccc2Br 1458a_100000735890_200011713681 [0,1,0,0,0,0|2,0,0]=3 1098 B21R2.4852 O=C(C=Cc1cccnc1)CCOc2ccccc2Br 1458a_100000735890_100000695877 [0,1,0,0,0,0|3,0,0]=4 1099 B21R2.4852 O=C(C=Cc1cccnc1)CCOc2ccccc2F 1458a_100000735890_100000183290 [0,1,0,0,0,0|3,0,0]=4 1100 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2Br 11a_100000747383_100000735890 [0,1,0,0,0,0|2,0,0]=3 1101 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2Br 240690a_100000747383_100000735890 [0,1,0,0,0,0|2,0,0]=3 1102 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2Cl 11a_100011207228_100000735890 [0,1,0,0,0,0|2,0,0]=3 1103 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2Cl 240690a_100011207228_100000735890 [0,1,0,0,0,0|2,0,0]=3 1104 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2F 11a_100000185272_100000735890 [0,1,0,0,0,0|2,0,0]=3 1105 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2F 240690a_100000185272_100000735890 [0,1,0,0,0,0|2,0,0]=3 1106 B21R2.4852 O=C(C=Cc1cccnc1)NCCc2ccccc2O 240690a_100011207237_100000735890 [0,1,0,0,0,0|2,0,0]=3 1107 B21R2.4852 O=C(C=Cc1cccnc1)NCCn2ccccc2=O 240690a_100000687133_100000735890 [0,1,0,0,0,0|3,0,0]=4 1108 B21R2.4852 O=C(C=Cc1cccnc1)NNCc2ccccc2Br 22a_200016993956_100000735890 [0,1,0,0,0,0|3,0,0]=4 1109 B21R2.4852 O=C(C=Cc1cccnc1)NNCc2ccccc2Cl 22a_100015187261_100000735890 [0,1,0,0,0,0|3,0,0]=4 1110 B21R2.4852 O=C(C=Cc1cccnc1)NNCc2ccccc2F 22a_100015200773_100000735890 [0,1,0,0,0,0|3,0,0]=4 1111 B21R2.4852 O=C(C=Cc1ccncc1)CCCc2ccccc2Br 1458a_100000682801_200011713681 [0,1,0,0,0,0|2,0,0]=3 1112 B21R2.4852 O=C(C=Cc1ccncc1)CCOc2ccccc2Br 1458a_100000682801_100000695877 [0,1,0,0,0,0|3,0,0]=4 1113 B21R2.4852 O=C(C=Cc1ccncc1)CCOc2ccccc2F 1458a_100000682801_100000183290 [0,1,0,0,0,0|3,0,0]=4 1114 B21R2.4852 O=C(C=Cc1ccncc1)NCCc2ccccc2Br 240690a_100000747383_100000682801 [0,1,0,0,0,0|2,0,0]=3 1115 B21R2.4852 O=C(C=Cc1ccncc1)NCCc2ccccc2Cl 240690a_100011207228_100000682801 [0,1,0,0,0,0|2,0,0]=3 1116 B21R2.4852 O=C(C=Cc1ccncc1)NCCc2ccccc2F 240690a_100000185272_100000682801 [0,1,0,0,0,0|2,0,0]=3 1117 B21R2.4852 O=C(C=Cc1ccncc1)NCCc2ccccc2O 240690a_100011207237_100000682801 [0,1,0,0,0,0|2,0,0]=3 1118 B21R2.4852 O=C(C=Cc1ccncc1)NCCn2ccccc2=O 240690a_100000687133_100000682801 [0,1,0,0,0,0|3,0,0]=4 1119 B21R2.4852 O=C(C=Cc1ccncc1)NNCc2ccccc2Br 22a_200016993956_100000682801 [0,1,0,0,0,0|3,0,0]=4 1120 B21R2.4852 O=C(C=Cc1ccncc1)NNCc2ccccc2Cl 22a_100015187261_100000682801 [0,1,0,0,0,0|3,0,0]=4 1121 B21R2.4852 O=C(C=Cc1ccncc1)NNCc2ccccc2F 22a_100015200773_100000682801 [0,1,0,0,0,0|3,0,0]=4 1122 B21R2.4852 O=C(CCCc1ccccc1Br)CCc2ccccc2 1458a_100000185753_200011713681 [0,1,0,0,0,0|1,0,2]=4 1123 B21R2.4852 O=C(CCCc1ccccc1Br)COc2ccccc2 1458a_100000186222_200011713681 [0,1,0,0,0,0|2,0,1]=4 1124 B21R2.4852 O=C(CCCc1ccccc1Br)CSc2ccccc2 1458a_100000211596_200011713681 [0,1,0,0,0,0|2,0,1]=4 1125 B21R2.4852 O=C(CCCc1ccccc1Cl)CCc2ccccc2 1458a_100000700343_100000765856 [0,1,0,0,0,0|1,0,2]=4 1126 B21R2.4852 O=C(CCCc1ccccc1Cl)NCc2ccccc2 11a_100015324214_100000700343 [0,1,0,0,0,0|2,0,1]=4 1127 B21R2.4852 O=C(CCCc1ccccc1Cl)NCc2ccccc2 1626a_100015324214_100000700343 [0,1,0,0,0,0|2,0,1]=4 1128 B21R2.4852 O=C(CCCc1ccccc1Cl)NCc2ccccc2 240690a_100015324214_100000700343 [0,1,0,0,0,0|2,0,1]=4 1129 B21R2.4852 O=C(CCCc1ccccc1Cl)NCc2ccccc2 527a_100015324214_100000700343 [0,1,0,0,0,0|2,0,1]=4 1130 B21R2.4852 O=C(CCCc1ccccc1Cl)NNc2ccccc2 22a_100015195140_100000700343 [0,1,0,0,0,0|3,0,0]=4 1131 B21R2.4852 O=C(CCCc1ccccc1O)CCc2ccccc2 1458a_100009859317_100000765856 [0,1,0,0,0,0|1,0,2]=4 1132 B21R2.4852 O=C(CCCc1ccccc1O)NCc2ccccc2 240690a_100015324214_100009859317 [0,1,0,0,0,0|2,0,1]=4 1133 B21R2.4852 O=C(CCCc1ccccc1O)NCc2ccccc2 527a_100015324214_100009859317 [0,1,0,0,0,0|2,0,1]=4 1134 B21R2.4852 O=C(CCCc1ccccc1O)NNc2ccccc2 22a_100015195140_100009859317 [0,1,0,0,0,0|3,0,0]=4 1135 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2Br 11a_100000747383_100000185753 [0,1,0,0,0,0|1,0,2]=4 1136 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2Br 1626a_100000747383_100000185753 [0,1,0,0,0,0|1,0,2]=4 1137 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2Br 240690a_100000747383_100000185753 [0,1,0,0,0,0|1,0,2]=4 1138 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2Br 527a_100000747383_100000185753 [0,1,0,0,0,0|1,0,2]=4 1139 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2Cl 11a_100011207228_100000185753 [0,1,0,0,0,0|1,0,2]=4 1140 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2Cl 1626a_100011207228_100000185753 [0,1,0,0,0,0|1,0,2]=4 1141 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2Cl 240690a_100011207228_100000185753 [0,1,0,0,0,0|1,0,2]=4 1142 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2Cl 527a_100011207228_100000185753 [0,1,0,0,0,0|1,0,2]=4 1143 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2F 11a_100000185272_100000185753 [0,1,0,0,0,0|1,0,2]=4 1144 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2F 1626a_100000185272_100000185753 [0,1,0,0,0,0|1,0,2]=4 1145 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2F 240690a_100000185272_100000185753 [0,1,0,0,0,0|1,0,2]=4 1146 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2F 527a_100000185272_100000185753 [0,1,0,0,0,0|1,0,2]=4 1147 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2O 240690a_100011207237_100000185753 [0,1,0,0,0,0|1,0,2]=4 1148 B21R2.4852 O=C(CCc1ccccc1)NCCc2ccccc2O 527a_100011207237_100000185753 [0,1,0,0,0,0|1,0,2]=4 1149 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2Br 11a_100000747383_100000186222 [0,1,0,0,0,0|2,0,1]=4 1150 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2Br 1626a_100000747383_100000186222 [0,1,0,0,0,0|2,0,1]=4 1151 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2Br 240690a_100000747383_100000186222 [0,1,0,0,0,0|2,0,1]=4 1152 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2Br 527a_100000747383_100000186222 [0,1,0,0,0,0|2,0,1]=4 1153 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2Cl 11a_100011207228_100000186222 [0,1,0,0,0,0|2,0,1]=4 1154 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2Cl 1626a_100011207228_100000186222 [0,1,0,0,0,0|2,0,1]=4 1155 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2Cl 240690a_100011207228_100000186222 [0,1,0,0,0,0|2,0,1]=4 1156 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2Cl 527a_100011207228_100000186222 [0,1,0,0,0,0|2,0,1]=4 1157 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2F 11a_100000185272_100000186222 [0,1,0,0,0,0|2,0,1]=4 1158 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2F 1626a_100000185272_100000186222 [0,1,0,0,0,0|2,0,1]=4 1159 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2F 240690a_100000185272_100000186222 [0,1,0,0,0,0|2,0,1]=4 1160 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2F 527a_100000185272_100000186222 [0,1,0,0,0,0|2,0,1]=4 1161 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2O 240690a_100011207237_100000186222 [0,1,0,0,0,0|2,0,1]=4 1162 B21R2.4852 O=C(COc1ccccc1)NCCc2ccccc2O 527a_100011207237_100000186222 [0,1,0,0,0,0|2,0,1]=4 1163 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2Br 11a_100000747383_100000211596 [0,1,0,0,0,0|2,0,1]=4 1164 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2Br 1626a_100000747383_100000211596 [0,1,0,0,0,0|2,0,1]=4 1165 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2Br 240690a_100000747383_100000211596 [0,1,0,0,0,0|2,0,1]=4 1166 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2Br 527a_100000747383_100000211596 [0,1,0,0,0,0|2,0,1]=4 1167 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2Cl 11a_100011207228_100000211596 [0,1,0,0,0,0|2,0,1]=4 1168 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2Cl 1626a_100011207228_100000211596 [0,1,0,0,0,0|2,0,1]=4 1169 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2Cl 240690a_100011207228_100000211596 [0,1,0,0,0,0|2,0,1]=4 1170 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2Cl 527a_100011207228_100000211596 [0,1,0,0,0,0|2,0,1]=4 1171 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2F 11a_100000185272_100000211596 [0,1,0,0,0,0|2,0,1]=4 1172 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2F 1626a_100000185272_100000211596 [0,1,0,0,0,0|2,0,1]=4 1173 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2F 240690a_100000185272_100000211596 [0,1,0,0,0,0|2,0,1]=4 1174 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2F 527a_100000185272_100000211596 [0,1,0,0,0,0|2,0,1]=4 1175 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2O 240690a_100011207237_100000211596 [0,1,0,0,0,0|2,0,1]=4 1176 B21R2.4852 O=C(CSc1ccccc1)NCCc2ccccc2O 527a_100011207237_100000211596 [0,1,0,0,0,0|2,0,1]=4 1177 B21R2.4852 O=C(NCCc1ccccc1Br)NCc2ccccc2 2708a_100000747383_100015324214 [0,1,0,0,0,0|2,0,1]=4 1178 B21R2.4852 O=C(NCCc1ccccc1Br)NCc2ccccc2 2708a_100015324214_100000747383 [0,1,0,0,0,0|2,0,1]=4 1179 B21R2.4852 O=C(NCCc1ccccc1Br)NCc2ccccc2 273464a_100000747383_100015324214 [0,1,0,0,0,0|2,0,1]=4 1180 B21R2.4852 O=C(NCCc1ccccc1Br)NCc2ccccc2 273464a_100015324214_100000747383 [0,1,0,0,0,0|2,0,1]=4 1181 B21R2.4852 O=C(NCCc1ccccc1Br)NCc2ccccc2 512a_100000747383_100015324214 [0,1,0,0,0,0|2,0,1]=4 1182 B21R2.4852 O=C(NCCc1ccccc1Br)NCc2ccccc2 512a_100015324214_100000747383 [0,1,0,0,0,0|2,0,1]=4 1183 B21R2.4852 O=C(NCCc1ccccc1Br)NNc2ccccc2 273464a_100000747383_100015195140 [0,1,0,0,0,0|3,0,0]=4 1184 B21R2.4852 O=C(NCCc1ccccc1Br)NNc2ccccc2 512a_100000747383_100015195140 [0,1,0,0,0,0|3,0,0]=4 1185 B21R2.4852 O=C(NCCc1ccccc1Br)OCc2ccccc2 271570a_200010239705_100000695589 [0,1,0,0,0,0|2,0,1]=4 1186 B21R2.4852 O=C(NCCc1ccccc1Cl)NCc2ccccc2 2708a_100011207228_100015324214 [0,1,0,0,0,0|2,0,1]=4 1187 B21R2.4852 O=C(NCCc1ccccc1Cl)NCc2ccccc2 2708a_100015324214_100011207228 [0,1,0,0,0,0|2,0,1]=4 1188 B21R2.4852 O=C(NCCc1ccccc1Cl)NCc2ccccc2 273464a_100011207228_100015324214 [0,1,0,0,0,0|2,0,1]=4 1189 B21R2.4852 O=C(NCCc1ccccc1Cl)NCc2ccccc2 273464a_100015324214_100011207228 [0,1,0,0,0,0|2,0,1]=4 1190 B21R2.4852 O=C(NCCc1ccccc1Cl)NCc2ccccc2 512a_100011207228_100015324214 [0,1,0,0,0,0|2,0,1]=4 1191 B21R2.4852 O=C(NCCc1ccccc1Cl)NCc2ccccc2 512a_100015324214_100011207228 [0,1,0,0,0,0|2,0,1]=4 1192 B21R2.4852 O=C(NCCc1ccccc1Cl)NNc2ccccc2 273464a_100011207228_100015195140 [0,1,0,0,0,0|3,0,0]=4 1193 B21R2.4852 O=C(NCCc1ccccc1Cl)NNc2ccccc2 512a_100011207228_100015195140 [0,1,0,0,0,0|3,0,0]=4 1194 B21R2.4852 O=C(NCCc1ccccc1Cl)OCc2ccccc2 271570a_200010239705_100000764095 [0,1,0,0,0,0|2,0,1]=4 1195 B21R2.4852 O=C(NCCc1ccccc1F)NCc2ccccc2 2708a_100000185272_100015324214 [0,1,0,0,0,0|2,0,1]=4 1196 B21R2.4852 O=C(NCCc1ccccc1F)NCc2ccccc2 2708a_100015324214_100000185272 [0,1,0,0,0,0|2,0,1]=4 1197 B21R2.4852 O=C(NCCc1ccccc1F)NCc2ccccc2 273464a_100000185272_100015324214 [0,1,0,0,0,0|2,0,1]=4 1198 B21R2.4852 O=C(NCCc1ccccc1F)NCc2ccccc2 273464a_100015324214_100000185272 [0,1,0,0,0,0|2,0,1]=4 1199 B21R2.4852 O=C(NCCc1ccccc1F)NCc2ccccc2 512a_100000185272_100015324214 [0,1,0,0,0,0|2,0,1]=4 1200 B21R2.4852 O=C(NCCc1ccccc1F)NCc2ccccc2 512a_100015324214_100000185272 [0,1,0,0,0,0|2,0,1]=4 1201 B21R2.4852 O=C(NCCc1ccccc1F)NNc2ccccc2 273464a_100000185272_100015195140 [0,1,0,0,0,0|3,0,0]=4 1202 B21R2.4852 O=C(NCCc1ccccc1F)NNc2ccccc2 512a_100000185272_100015195140 [0,1,0,0,0,0|3,0,0]=4 1203 B21R2.4852 O=C(NCCc1ccccc1F)OCc2ccccc2 271570a_200010239705_100011215700 [0,1,0,0,0,0|2,0,1]=4 1204 B21R2.4852 O=C(NCCc1ccccc1O)NCc2ccccc2 2708a_100011207237_100015324214 [0,1,0,0,0,0|2,0,1]=4 1205 B21R2.4852 O=C(NCCc1ccccc1O)NCc2ccccc2 2708a_100015324214_100011207237 [0,1,0,0,0,0|2,0,1]=4 1206 B21R2.4852 O=C(NCCc1ccccc1O)NCc2ccccc2 273464a_100011207237_100015324214 [0,1,0,0,0,0|2,0,1]=4 1207 B21R2.4852 O=C(NCCc1ccccc1O)NCc2ccccc2 273464a_100015324214_100011207237 [0,1,0,0,0,0|2,0,1]=4 1208 B21R2.4852 O=C(NCCc1ccccc1O)NCc2ccccc2 512a_100011207237_100015324214 [0,1,0,0,0,0|2,0,1]=4 1209 B21R2.4852 O=C(NCCc1ccccc1O)NCc2ccccc2 512a_100015324214_100011207237 [0,1,0,0,0,0|2,0,1]=4 1210 B21R2.4852 O=C(NCCc1ccccc1O)NNc2ccccc2 273464a_100011207237_100015195140 [0,1,0,0,0,0|3,0,0]=4 1211 B21R2.4852 O=C(NCCc1ccccc1O)NNc2ccccc2 512a_100011207237_100015195140 [0,1,0,0,0,0|3,0,0]=4 1212 B21R2.4852 O=C(NCCc1ccccc1O)OCc2ccccc2 271570a_200010239705_100000739446 [0,1,0,0,0,0|2,0,1]=4 1213 B21R2.18995 CC(=NNCc1ccccc1)C=Cc2ccc(cc2)Br 4a_100000007032_200016259395 [0,1,0,0,0,0|3,0,0]=4 1214 B21R2.18995 CC(=NNCc1ccccc1)C=Cc2ccc(cc2)Cl 4a_100000007032_100016256711 [0,1,0,0,0,0|3,0,0]=4 1215 B21R2.18995 CC(=NNCc1ccccc1)C=Cc2ccc(cc2)O 4a_100000007032_100000189429 [0,1,0,0,0,0|3,0,0]=4 1216 B21R2.18995 Cc1ccc(cc1)C=CC(=O)C/C=C/c2ccccc2 1458a_100000716854_100016265936 [0,1,0,0,0,0|1,0,2]=4 1217 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CC#Cc2ccccc2 1458a_100000716854_100011352542 [0,1,0,0,0,0|1,0,2]=4 1218 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CCCc2ccccc2 1458a_100000716854_100000211621 [0,1,0,0,0,0|1,0,0]=2 1219 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CCOc2ccccc2 1458a_100000716854_100000184471 [0,1,0,0,0,0|2,0,0]=3 1220 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CCSc2ccccc2 1458a_100000716854_100000246102 [0,1,0,0,0,0|2,0,0]=3 1221 B21R2.18995 Cc1ccc(cc1)C=CC(=O)CSCc2ccccc2 1458a_100000716854_200011217039 [0,1,0,0,0,0|2,0,0]=3 1222 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000716854 [0,1,0,0,0,0|1,0,0]=2 1223 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000716854 [0,1,0,0,0,0|1,0,0]=2 1224 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000716854 [0,1,0,0,0,0|1,0,0]=2 1225 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000716854 [0,1,0,0,0,0|2,0,0]=3 1226 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000716854 [0,1,0,0,0,0|2,0,0]=3 1227 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100000716854 [0,1,0,0,0,0|2,0,0]=3 1228 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000716854 [0,1,0,0,0,0|2,0,0]=3 1229 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000716854 [0,1,0,0,0,0|2,0,0]=3 1230 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100000716854 [0,1,0,0,0,0|2,0,0]=3 1231 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000716854 [0,1,0,0,0,0|2,0,0]=3 1232 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000716854 [0,1,0,0,0,0|2,0,0]=3 1233 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100000716854 [0,1,0,0,0,0|2,0,0]=3 1234 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cnccn2 11a_100000723456_100000716854 [0,1,0,0,0,0|3,0,0]=4 1235 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cnccn2 1626a_100000723456_100000716854 [0,1,0,0,0,0|3,0,0]=4 1236 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NCCc2cnccn2 240690a_100000723456_100000716854 [0,1,0,0,0,0|3,0,0]=4 1237 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000716854 [0,1,0,0,0,0|2,0,0]=3 1238 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NNCc2ccccn2 22a_100000736832_100000716854 [0,1,0,0,0,0|3,0,0]=4 1239 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NNCc2cccnc2 22a_100000738295_100000716854 [0,1,0,0,0,0|3,0,0]=4 1240 B21R2.18995 Cc1ccc(cc1)C=CC(=O)NNCc2ccncc2 22a_100000736929_100000716854 [0,1,0,0,0,0|3,0,0]=4 1241 B21R2.18995 Cc1ccc(cc1)CCC(=O)CCCc2ccccc2 1458a_100000234883_100000211621 [0,1,0,0,0,0|1,0,2]=4 1242 B21R2.18995 Cc1ccc(cc1)CCC(=O)CCCc2ccccc2 1458a_100011207963_100011713686 [0,1,0,0,0,0|1,0,2]=4 1243 B21R2.18995 Cc1ccc(cc1)CCC(=O)NCCc2ccccc2 11a_100000106460_100000234883 [0,1,0,0,0,0|1,0,2]=4 1244 B21R2.18995 Cc1ccc(cc1)CCC(=O)NCCc2ccccc2 1626a_100000106460_100000234883 [0,1,0,0,0,0|1,0,2]=4 1245 B21R2.18995 Cc1ccc(cc1)CCC(=O)NCCc2ccccc2 240690a_100000106460_100000234883 [0,1,0,0,0,0|1,0,2]=4 1246 B21R2.18995 Cc1ccc(cc1)CCC(=O)NCCc2ccccc2 527a_100000106460_100000234883 [0,1,0,0,0,0|1,0,2]=4 1247 B21R2.18995 Cc1ccc(cc1)CNC(=O)CCCc2ccccc2 11a_100000174908_100011207963 [0,1,0,0,0,0|2,0,1]=4 1248 B21R2.18995 Cc1ccc(cc1)CNC(=O)CCCc2ccccc2 1626a_100000174908_100011207963 [0,1,0,0,0,0|2,0,1]=4 1249 B21R2.18995 Cc1ccc(cc1)CNC(=O)CCCc2ccccc2 240690a_100000174908_100011207963 [0,1,0,0,0,0|2,0,1]=4 1250 B21R2.18995 Cc1ccc(cc1)CNC(=O)CCCc2ccccc2 527a_100000174908_100011207963 [0,1,0,0,0,0|2,0,1]=4 1251 B21R2.18995 Cc1ccc(cc1)CNC(=O)NCCc2ccccc2 2708a_100000106460_100000174908 [0,1,0,0,0,0|2,0,1]=4 1252 B21R2.18995 Cc1ccc(cc1)CNC(=O)NCCc2ccccc2 2708a_100000174908_100000106460 [0,1,0,0,0,0|2,0,1]=4 1253 B21R2.18995 Cc1ccc(cc1)CNC(=O)NCCc2ccccc2 273464a_100000106460_100000174908 [0,1,0,0,0,0|2,0,1]=4 1254 B21R2.18995 Cc1ccc(cc1)CNC(=O)NCCc2ccccc2 273464a_100000174908_100000106460 [0,1,0,0,0,0|2,0,1]=4 1255 B21R2.18995 Cc1ccc(cc1)CNC(=O)NCCc2ccccc2 512a_100000106460_100000174908 [0,1,0,0,0,0|2,0,1]=4 1256 B21R2.18995 Cc1ccc(cc1)CNC(=O)NCCc2ccccc2 512a_100000174908_100000106460 [0,1,0,0,0,0|2,0,1]=4 1257 B21R2.18995 Cc1ccc(cc1)NCC(=O)NCCc2ccccc2 34a_100000124888_100000183012 [0,1,0,0,0,0|2,0,1]=4 1258 B21R2.18995 Cc1ccc(cc1)NCC(=O)OCCc2ccccc2 34a_100000124888_200000077782 [0,1,0,0,0,0|1,0,1]=3 1259 B21R2.18995 Cc1ccc(cc1)NNC(=O)CCCc2ccccc2 22a_100000683527_100011207963 [0,1,0,0,0,0|3,0,0]=4 1260 B21R2.18995 Cc1ccc(cc1)NNC(=O)NCCc2ccccc2 273464a_100000106460_100000683527 [0,1,0,0,0,0|3,0,0]=4 1261 B21R2.18995 Cc1ccc(cc1)NNC(=O)NCCc2ccccc2 512a_100000106460_100000683527 [0,1,0,0,0,0|3,0,0]=4 1262 B21R2.18995 Cc1ccc(cc1)OCC(=O)CCCc2ccccc2 1458a_100000182360_100000211621 [0,1,0,0,0,0|2,0,1]=4 1263 B21R2.18995 Cc1ccc(cc1)OCC(=O)NCCc2ccccc2 11a_100000106460_100000182360 [0,1,0,0,0,0|2,0,1]=4 1264 B21R2.18995 Cc1ccc(cc1)OCC(=O)NCCc2ccccc2 1626a_100000106460_100000182360 [0,1,0,0,0,0|2,0,1]=4 1265 B21R2.18995 Cc1ccc(cc1)OCC(=O)NCCc2ccccc2 240690a_100000106460_100000182360 [0,1,0,0,0,0|2,0,1]=4 1266 B21R2.18995 Cc1ccc(cc1)OCC(=O)NCCc2ccccc2 34a_100000210336_100000183012 [0,1,0,0,0,0|2,0,1]=4 1267 B21R2.18995 Cc1ccc(cc1)OCC(=O)NCCc2ccccc2 527a_100000106460_100000182360 [0,1,0,0,0,0|2,0,1]=4 1268 B21R2.18995 Cc1ccc(cc1)OCC(=O)NCCc2ccccc2 7a_100000210336_100000183012 [0,1,0,0,0,0|2,0,1]=4 1269 B21R2.18995 Cc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000210336_200000077782 [0,1,0,0,0,0|1,0,1]=3 1270 B21R2.18995 Cc1ccc(cc1)OCC(=O)OCCc2ccccc2 7a_100000210336_200000077782 [0,1,0,0,0,0|1,0,1]=3 1271 B21R2.18995 Cc1ccc(cc1)SCC(=O)CCCc2ccccc2 1458a_100000179497_100000211621 [0,1,0,0,0,0|2,0,1]=4 1272 B21R2.18995 Cc1ccc(cc1)SCC(=O)NCCc2ccccc2 11a_100000106460_100000179497 [0,1,0,0,0,0|2,0,1]=4 1273 B21R2.18995 Cc1ccc(cc1)SCC(=O)NCCc2ccccc2 1626a_100000106460_100000179497 [0,1,0,0,0,0|2,0,1]=4 1274 B21R2.18995 Cc1ccc(cc1)SCC(=O)NCCc2ccccc2 240690a_100000106460_100000179497 [0,1,0,0,0,0|2,0,1]=4 1275 B21R2.18995 Cc1ccc(cc1)SCC(=O)NCCc2ccccc2 527a_100000106460_100000179497 [0,1,0,0,0,0|2,0,1]=4 1276 B21R2.18995 Cc1ccc(cc1)SCC(=O)NCCc2ccccc2 62a_100000183012_100000186775 [0,1,0,0,0,0|2,0,1]=4 1277 B21R2.18995 Cc1ccc(cc1)SCC(=O)NCCc2ccccc2 62a_100000186775_100000183012 [0,1,0,0,0,0|2,0,1]=4 1278 B21R2.18995 Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100000186775_200000077782 [0,1,0,0,0,0|1,0,1]=3 1279 B21R2.18995 Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000186775 [0,1,0,0,0,0|1,0,1]=3 1280 B21R2.18995 Cc1ccc(cn1)OCC(=O)OCCc2ccccc2 34a_100000745506_200000077782 [0,1,0,0,0,0|2,0,1]=4 1281 B21R2.18995 Cc1ccc(cn1)OCC(=O)OCCc2ccccc2 7a_100000745506_200000077782 [0,1,0,0,0,0|2,0,1]=4 1282 B21R2.18995 Cc1ccc(cn1)SCC(=O)OCCc2ccccc2 62a_100000751577_200000077782 [0,1,0,0,0,0|2,0,1]=4 1283 B21R2.18995 Cc1ccc(cn1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000751577 [0,1,0,0,0,0|2,0,1]=4 1284 B21R2.18995 Cc1ccc(nc1)OCC(=O)OCCc2ccccc2 34a_100000759353_200000077782 [0,1,0,0,0,0|2,0,1]=4 1285 B21R2.18995 Cc1ccc(nc1)SCC(=O)OCCc2ccccc2 62a_100011192072_200000077782 [0,1,0,0,0,0|2,0,1]=4 1286 B21R2.18995 Cc1ccc(nc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000754016 [0,1,0,0,0,0|2,0,1]=4 1287 B21R2.18995 Nc1ccc(cc1)OCC(=O)NCCc2ccccc2 34a_100000185829_100000183012 [0,1,0,0,0,0|2,0,1]=4 1288 B21R2.18995 Nc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000185829_200000077782 [0,1,0,0,0,0|1,0,1]=3 1289 B21R2.18995 Nc1ccc(cc1)SCC(=O)NCCc2ccccc2 62a_100000183012_100000185761 [0,1,0,0,0,0|2,0,1]=4 1290 B21R2.18995 Nc1ccc(cc1)SCC(=O)NCCc2ccccc2 62a_100000185761_100000183012 [0,1,0,0,0,0|2,0,1]=4 1291 B21R2.18995 Nc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100000185761_200000077782 [0,1,0,0,0,0|1,0,1]=3 1292 B21R2.18995 Nc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000185761 [0,1,0,0,0,0|1,0,1]=3 1293 B21R2.18995 Nc1ccc(cn1)OCC(=O)OCCc2ccccc2 34a_100015188713_200000077782 [0,1,0,0,0,0|2,0,1]=4 1294 B21R2.18995 Nc1ccc(cn1)OCC(=O)OCCc2ccccc2 7a_100015188713_200000077782 [0,1,0,0,0,0|2,0,1]=4 1295 B21R2.18995 Nc1ccc(cn1)SCC(=O)OCCc2ccccc2 62a_100000187370_200000077782 [0,1,0,0,0,0|2,0,1]=4 1296 B21R2.18995 Nc1ccc(cn1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000187370 [0,1,0,0,0,0|2,0,1]=4 1297 B21R2.18995 Nc1ccc(nc1)OCC(=O)OCCc2ccccc2 34a_100000729260_200000077782 [0,1,0,0,0,0|2,0,1]=4 1298 B21R2.18995 Nc1ccc(nc1)SCC(=O)OCCc2ccccc2 62a_100000737798_200000077782 [0,1,0,0,0,0|2,0,1]=4 1299 B21R2.18995 Nc1ccc(nc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000737798 [0,1,0,0,0,0|2,0,1]=4 1300 B21R2.18995 O=C(C#Cc1ccc(cc1)Br)CCCc2ccccc2 1458a_100012100275_100000211621 [0,1,0,0,0,0|1,0,2]=4 1301 B21R2.18995 O=C(C#Cc1ccc(cc1)Cl)CCCc2ccccc2 1458a_100011892723_100000211621 [0,1,0,0,0,0|1,0,2]=4 1302 B21R2.18995 O=C(C#Cc1ccc(cc1)Cl)NCCc2ccccc2 240690a_100000106460_100011892723 [0,1,0,0,0,0|1,0,2]=4 1303 B21R2.18995 O=C(C#Cc1ccc(cc1)F)CCCc2ccccc2 1458a_100000238512_100000211621 [0,1,0,0,0,0|1,0,2]=4 1304 B21R2.18995 O=C(C#Cc1ccc(cc1)F)NCCc2ccccc2 240690a_100000106460_100000238512 [0,1,0,0,0,0|1,0,2]=4 1305 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)C/C=C/c2ccccc2 1458a_100016267368_100016265936 [0,1,0,0,0,0|1,0,2]=4 1306 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CC#Cc2ccccc2 1458a_100016267368_100011352542 [0,1,0,0,0,0|1,0,2]=4 1307 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CCCc2ccccc2 1458a_100016267368_100000211621 [0,1,0,0,0,0|1,0,0]=2 1308 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CCOc2ccccc2 1458a_100016267368_100000184471 [0,1,0,0,0,0|2,0,0]=3 1309 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CCSc2ccccc2 1458a_100016267368_100000246102 [0,1,0,0,0,0|2,0,0]=3 1310 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)COCc2ccccc2 6a_100000186029_100011215004 [0,1,0,0,0,0|2,0,0]=3 1311 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CSCc2ccccc2 1458a_100016267368_200011217039 [0,1,0,0,0,0|2,0,0]=3 1312 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)CSCc2ccccc2 6a_100000186029_100000172147 [0,1,0,0,0,0|2,0,0]=3 1313 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2 11a_100000106460_100016267368 [0,1,0,0,0,0|1,0,0]=2 1314 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2 1626a_100000106460_100016267368 [0,1,0,0,0,0|1,0,0]=2 1315 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccn2 11a_100000211156_100016267368 [0,1,0,0,0,0|2,0,0]=3 1316 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccn2 1626a_100000211156_100016267368 [0,1,0,0,0,0|2,0,0]=3 1317 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2cccnc2 11a_100000736294_100016267368 [0,1,0,0,0,0|2,0,0]=3 1318 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2cccnc2 1626a_100000736294_100016267368 [0,1,0,0,0,0|2,0,0]=3 1319 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccncc2 11a_100000742849_100016267368 [0,1,0,0,0,0|2,0,0]=3 1320 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2ccncc2 1626a_100000742849_100016267368 [0,1,0,0,0,0|2,0,0]=3 1321 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2cnccn2 11a_100000723456_100016267368 [0,1,0,0,0,0|3,0,0]=4 1322 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NCCc2cnccn2 1626a_100000723456_100016267368 [0,1,0,0,0,0|3,0,0]=4 1323 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NNCc2ccccc2 22a_100000007032_100016267368 [0,1,0,0,0,0|2,0,0]=3 1324 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NNCc2ccccn2 22a_100000736832_100016267368 [0,1,0,0,0,0|3,0,0]=4 1325 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NNCc2cccnc2 22a_100000738295_100016267368 [0,1,0,0,0,0|3,0,0]=4 1326 B21R2.18995 O=C(C=Cc1ccc(cc1)Br)NNCc2ccncc2 22a_100000736929_100016267368 [0,1,0,0,0,0|3,0,0]=4 1327 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)C/C=C/c2ccccc2 1458a_100000184863_100016265936 [0,1,0,0,0,0|1,0,2]=4 1328 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CC#Cc2ccccc2 1458a_100000184863_100011352542 [0,1,0,0,0,0|1,0,2]=4 1329 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CCCc2ccccc2 1458a_100000184863_100000211621 [0,1,0,0,0,0|1,0,0]=2 1330 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CCOc2ccccc2 1458a_100000184863_100000184471 [0,1,0,0,0,0|2,0,0]=3 1331 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CCSc2ccccc2 1458a_100000184863_100000246102 [0,1,0,0,0,0|2,0,0]=3 1332 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)CSCc2ccccc2 1458a_100000184863_200011217039 [0,1,0,0,0,0|2,0,0]=3 1333 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2 11a_100000106460_100000184863 [0,1,0,0,0,0|1,0,0]=2 1334 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2 1626a_100000106460_100000184863 [0,1,0,0,0,0|1,0,0]=2 1335 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2 240690a_100000106460_100000184863 [0,1,0,0,0,0|1,0,0]=2 1336 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccn2 11a_100000211156_100000184863 [0,1,0,0,0,0|2,0,0]=3 1337 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccn2 1626a_100000211156_100000184863 [0,1,0,0,0,0|2,0,0]=3 1338 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccn2 240690a_100000211156_100000184863 [0,1,0,0,0,0|2,0,0]=3 1339 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccnc2 11a_100000736294_100000184863 [0,1,0,0,0,0|2,0,0]=3 1340 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccnc2 1626a_100000736294_100000184863 [0,1,0,0,0,0|2,0,0]=3 1341 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccnc2 240690a_100000736294_100000184863 [0,1,0,0,0,0|2,0,0]=3 1342 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccncc2 11a_100000742849_100000184863 [0,1,0,0,0,0|2,0,0]=3 1343 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccncc2 1626a_100000742849_100000184863 [0,1,0,0,0,0|2,0,0]=3 1344 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccncc2 240690a_100000742849_100000184863 [0,1,0,0,0,0|2,0,0]=3 1345 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cnccn2 11a_100000723456_100000184863 [0,1,0,0,0,0|3,0,0]=4 1346 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cnccn2 1626a_100000723456_100000184863 [0,1,0,0,0,0|3,0,0]=4 1347 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NCCc2cnccn2 240690a_100000723456_100000184863 [0,1,0,0,0,0|3,0,0]=4 1348 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccccc2 22a_100000007032_100000184863 [0,1,0,0,0,0|2,0,0]=3 1349 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccccn2 22a_100000736832_100000184863 [0,1,0,0,0,0|3,0,0]=4 1350 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NNCc2cccnc2 22a_100000738295_100000184863 [0,1,0,0,0,0|3,0,0]=4 1351 B21R2.18995 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccncc2 22a_100000736929_100000184863 [0,1,0,0,0,0|3,0,0]=4 1352 B21R2.18995 O=C(C=Cc1ccc(cc1)F)C/C=C/c2ccccc2 1458a_100000182136_100016265936 [0,1,0,0,0,0|1,0,2]=4 1353 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CC#Cc2ccccc2 1458a_100000182136_100011352542 [0,1,0,0,0,0|1,0,2]=4 1354 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CCCc2ccccc2 1458a_100000182136_100000211621 [0,1,0,0,0,0|1,0,0]=2 1355 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CCOc2ccccc2 1458a_100000182136_100000184471 [0,1,0,0,0,0|2,0,0]=3 1356 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CCSc2ccccc2 1458a_100000182136_100000246102 [0,1,0,0,0,0|2,0,0]=3 1357 B21R2.18995 O=C(C=Cc1ccc(cc1)F)COCc2ccccc2 6a_100000210084_100011215004 [0,1,0,0,0,0|2,0,0]=3 1358 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CSCc2ccccc2 1458a_100000182136_200011217039 [0,1,0,0,0,0|2,0,0]=3 1359 B21R2.18995 O=C(C=Cc1ccc(cc1)F)CSCc2ccccc2 6a_100000210084_100000172147 [0,1,0,0,0,0|2,0,0]=3 1360 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2 11a_100000106460_100000182136 [0,1,0,0,0,0|1,0,0]=2 1361 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2 1626a_100000106460_100000182136 [0,1,0,0,0,0|1,0,0]=2 1362 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2 240690a_100000106460_100000182136 [0,1,0,0,0,0|1,0,0]=2 1363 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccn2 11a_100000211156_100000182136 [0,1,0,0,0,0|2,0,0]=3 1364 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccn2 1626a_100000211156_100000182136 [0,1,0,0,0,0|2,0,0]=3 1365 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccccn2 240690a_100000211156_100000182136 [0,1,0,0,0,0|2,0,0]=3 1366 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cccnc2 11a_100000736294_100000182136 [0,1,0,0,0,0|2,0,0]=3 1367 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cccnc2 1626a_100000736294_100000182136 [0,1,0,0,0,0|2,0,0]=3 1368 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cccnc2 240690a_100000736294_100000182136 [0,1,0,0,0,0|2,0,0]=3 1369 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccncc2 11a_100000742849_100000182136 [0,1,0,0,0,0|2,0,0]=3 1370 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccncc2 1626a_100000742849_100000182136 [0,1,0,0,0,0|2,0,0]=3 1371 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2ccncc2 240690a_100000742849_100000182136 [0,1,0,0,0,0|2,0,0]=3 1372 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cnccn2 11a_100000723456_100000182136 [0,1,0,0,0,0|3,0,0]=4 1373 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cnccn2 1626a_100000723456_100000182136 [0,1,0,0,0,0|3,0,0]=4 1374 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NCCc2cnccn2 240690a_100000723456_100000182136 [0,1,0,0,0,0|3,0,0]=4 1375 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NNCc2ccccc2 22a_100000007032_100000182136 [0,1,0,0,0,0|2,0,0]=3 1376 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NNCc2ccccn2 22a_100000736832_100000182136 [0,1,0,0,0,0|3,0,0]=4 1377 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NNCc2cccnc2 22a_100000738295_100000182136 [0,1,0,0,0,0|3,0,0]=4 1378 B21R2.18995 O=C(C=Cc1ccc(cc1)F)NNCc2ccncc2 22a_100000736929_100000182136 [0,1,0,0,0,0|3,0,0]=4 1379 B21R2.18995 O=C(C=Cc1ccc(cc1)I)C/C=C/c2ccccc2 1458a_100102526154_100016265936 [0,1,0,0,0,0|1,0,2]=4 1380 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CC#Cc2ccccc2 1458a_100102526154_100011352542 [0,1,0,0,0,0|1,0,2]=4 1381 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CCCc2ccccc2 1458a_100102526154_100000211621 [0,1,0,0,0,0|1,0,0]=2 1382 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CCOc2ccccc2 1458a_100102526154_100000184471 [0,1,0,0,0,0|2,0,0]=3 1383 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CCSc2ccccc2 1458a_100102526154_100000246102 [0,1,0,0,0,0|2,0,0]=3 1384 B21R2.18995 O=C(C=Cc1ccc(cc1)I)COCc2ccccc2 6a_100000188517_100011215004 [0,1,0,0,0,0|2,0,0]=3 1385 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CSCc2ccccc2 1458a_100102526154_200011217039 [0,1,0,0,0,0|2,0,0]=3 1386 B21R2.18995 O=C(C=Cc1ccc(cc1)I)CSCc2ccccc2 6a_100000188517_100000172147 [0,1,0,0,0,0|2,0,0]=3 1387 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2 11a_100000106460_100102526154 [0,1,0,0,0,0|1,0,0]=2 1388 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2 1626a_100000106460_100102526154 [0,1,0,0,0,0|1,0,0]=2 1389 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2 240690a_100000106460_100102526154 [0,1,0,0,0,0|1,0,0]=2 1390 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccn2 11a_100000211156_100102526154 [0,1,0,0,0,0|2,0,0]=3 1391 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccn2 1626a_100000211156_100102526154 [0,1,0,0,0,0|2,0,0]=3 1392 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccccn2 240690a_100000211156_100102526154 [0,1,0,0,0,0|2,0,0]=3 1393 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cccnc2 11a_100000736294_100102526154 [0,1,0,0,0,0|2,0,0]=3 1394 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cccnc2 1626a_100000736294_100102526154 [0,1,0,0,0,0|2,0,0]=3 1395 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cccnc2 240690a_100000736294_100102526154 [0,1,0,0,0,0|2,0,0]=3 1396 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccncc2 11a_100000742849_100102526154 [0,1,0,0,0,0|2,0,0]=3 1397 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccncc2 1626a_100000742849_100102526154 [0,1,0,0,0,0|2,0,0]=3 1398 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2ccncc2 240690a_100000742849_100102526154 [0,1,0,0,0,0|2,0,0]=3 1399 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cnccn2 11a_100000723456_100102526154 [0,1,0,0,0,0|3,0,0]=4 1400 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cnccn2 1626a_100000723456_100102526154 [0,1,0,0,0,0|3,0,0]=4 1401 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NCCc2cnccn2 240690a_100000723456_100102526154 [0,1,0,0,0,0|3,0,0]=4 1402 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NNCc2ccccc2 22a_100000007032_100102526154 [0,1,0,0,0,0|2,0,0]=3 1403 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NNCc2ccccn2 22a_100000736832_100102526154 [0,1,0,0,0,0|3,0,0]=4 1404 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NNCc2cccnc2 22a_100000738295_100102526154 [0,1,0,0,0,0|3,0,0]=4 1405 B21R2.18995 O=C(C=Cc1ccc(cc1)I)NNCc2ccncc2 22a_100000736929_100102526154 [0,1,0,0,0,0|3,0,0]=4 1406 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2ccccc2 240690a_100000106460_100016269017 [0,1,0,0,0,0|1,0,0]=2 1407 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2ccccn2 240690a_100000211156_100016269017 [0,1,0,0,0,0|2,0,0]=3 1408 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2cccnc2 240690a_100000736294_100016269017 [0,1,0,0,0,0|2,0,0]=3 1409 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2ccncc2 240690a_100000742849_100016269017 [0,1,0,0,0,0|2,0,0]=3 1410 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NCCc2cnccn2 240690a_100000723456_100016269017 [0,1,0,0,0,0|3,0,0]=4 1411 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NNCc2ccccc2 22a_100000007032_100016269017 [0,1,0,0,0,0|2,0,0]=3 1412 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NNCc2ccccn2 22a_100000736832_100016269017 [0,1,0,0,0,0|3,0,0]=4 1413 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NNCc2cccnc2 22a_100000738295_100016269017 [0,1,0,0,0,0|3,0,0]=4 1414 B21R2.18995 O=C(C=Cc1ccc(cc1)O)NNCc2ccncc2 22a_100000736929_100016269017 [0,1,0,0,0,0|3,0,0]=4 1415 B21R2.18995 O=C(C=Cc1ccc(cn1)Br)COCc2ccccc2 6a_100000754260_100011215004 [0,1,0,0,0,0|3,0,0]=4 1416 B21R2.18995 O=C(C=Cc1ccc(cn1)Br)CSCc2ccccc2 6a_100000754260_100000172147 [0,1,0,0,0,0|3,0,0]=4 1417 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CCCc2ccccc2 1458a_100020630499_100000211621 [0,1,0,0,0,0|2,0,0]=3 1418 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CCOc2ccccc2 1458a_100020630499_100000184471 [0,1,0,0,0,0|3,0,0]=4 1419 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CCSc2ccccc2 1458a_100020630499_100000246102 [0,1,0,0,0,0|3,0,0]=4 1420 B21R2.18995 O=C(C=Cc1ccc(cn1)F)COCc2ccccc2 6a_100011934744_100011215004 [0,1,0,0,0,0|3,0,0]=4 1421 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CSCc2ccccc2 1458a_100020630499_200011217039 [0,1,0,0,0,0|3,0,0]=4 1422 B21R2.18995 O=C(C=Cc1ccc(cn1)F)CSCc2ccccc2 6a_100011934744_100000172147 [0,1,0,0,0,0|3,0,0]=4 1423 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2 11a_100000106460_100020630499 [0,1,0,0,0,0|2,0,0]=3 1424 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2 1626a_100000106460_100020630499 [0,1,0,0,0,0|2,0,0]=3 1425 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2 240690a_100000106460_100020630499 [0,1,0,0,0,0|2,0,0]=3 1426 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccn2 11a_100000211156_100020630499 [0,1,0,0,0,0|3,0,0]=4 1427 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccn2 1626a_100000211156_100020630499 [0,1,0,0,0,0|3,0,0]=4 1428 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccccn2 240690a_100000211156_100020630499 [0,1,0,0,0,0|3,0,0]=4 1429 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2cccnc2 11a_100000736294_100020630499 [0,1,0,0,0,0|3,0,0]=4 1430 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2cccnc2 1626a_100000736294_100020630499 [0,1,0,0,0,0|3,0,0]=4 1431 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2cccnc2 240690a_100000736294_100020630499 [0,1,0,0,0,0|3,0,0]=4 1432 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccncc2 11a_100000742849_100020630499 [0,1,0,0,0,0|3,0,0]=4 1433 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccncc2 1626a_100000742849_100020630499 [0,1,0,0,0,0|3,0,0]=4 1434 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NCCc2ccncc2 240690a_100000742849_100020630499 [0,1,0,0,0,0|3,0,0]=4 1435 B21R2.18995 O=C(C=Cc1ccc(cn1)F)NNCc2ccccc2 22a_100000007032_100020630499 [0,1,0,0,0,0|3,0,0]=4 1436 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)CCCc2ccccc2 1458a_100020588214_100000211621 [0,1,0,0,0,0|2,0,0]=3 1437 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)CCOc2ccccc2 1458a_100020588214_100000184471 [0,1,0,0,0,0|3,0,0]=4 1438 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)CCSc2ccccc2 1458a_100020588214_100000246102 [0,1,0,0,0,0|3,0,0]=4 1439 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)CSCc2ccccc2 1458a_100020588214_200011217039 [0,1,0,0,0,0|3,0,0]=4 1440 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2 11a_100000106460_100020588214 [0,1,0,0,0,0|2,0,0]=3 1441 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2 1626a_100000106460_100020588214 [0,1,0,0,0,0|2,0,0]=3 1442 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2 240690a_100000106460_100020588214 [0,1,0,0,0,0|2,0,0]=3 1443 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccn2 11a_100000211156_100020588214 [0,1,0,0,0,0|3,0,0]=4 1444 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccn2 1626a_100000211156_100020588214 [0,1,0,0,0,0|3,0,0]=4 1445 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccn2 240690a_100000211156_100020588214 [0,1,0,0,0,0|3,0,0]=4 1446 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2cccnc2 11a_100000736294_100020588214 [0,1,0,0,0,0|3,0,0]=4 1447 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2cccnc2 1626a_100000736294_100020588214 [0,1,0,0,0,0|3,0,0]=4 1448 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2cccnc2 240690a_100000736294_100020588214 [0,1,0,0,0,0|3,0,0]=4 1449 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccncc2 11a_100000742849_100020588214 [0,1,0,0,0,0|3,0,0]=4 1450 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccncc2 1626a_100000742849_100020588214 [0,1,0,0,0,0|3,0,0]=4 1451 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NCCc2ccncc2 240690a_100000742849_100020588214 [0,1,0,0,0,0|3,0,0]=4 1452 B21R2.18995 O=C(C=Cc1ccc(nc1)Br)NNCc2ccccc2 22a_100000007032_100020588214 [0,1,0,0,0,0|3,0,0]=4 1453 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)Br 1458a_100000217147_100000211621 [0,1,0,0,0,0|1,0,2]=4 1454 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)Br 1458a_100011207963_100011740612 [0,1,0,0,0,0|1,0,2]=4 1455 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000235379_100000211621 [0,1,0,0,0,0|1,0,2]=4 1456 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)Cl 1458a_100011207963_100011713675 [0,1,0,0,0,0|1,0,2]=4 1457 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)F 1458a_100000198493_100000211621 [0,1,0,0,0,0|1,0,2]=4 1458 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)F 1458a_100011207963_100011217392 [0,1,0,0,0,0|1,0,2]=4 1459 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)I 1458a_100011217499_100000211621 [0,1,0,0,0,0|1,0,2]=4 1460 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)O 1458a_100000742835_100000211621 [0,1,0,0,0,0|1,0,2]=4 1461 B21R2.18995 O=C(CCCc1ccccc1)CCc2ccc(cc2)O 1458a_100011207963_100009816426 [0,1,0,0,0,0|1,0,2]=4 1462 B21R2.18995 O=C(CCCc1ccccc1)COc2ccc(cc2)Br 1458a_100000182358_100000211621 [0,1,0,0,0,0|2,0,1]=4 1463 B21R2.18995 O=C(CCCc1ccccc1)COc2ccc(cc2)Cl 1458a_100016990877_100000211621 [0,1,0,0,0,0|2,0,1]=4 1464 B21R2.18995 O=C(CCCc1ccccc1)COc2ccc(cc2)F 1458a_100000184765_100000211621 [0,1,0,0,0,0|2,0,1]=4 1465 B21R2.18995 O=C(CCCc1ccccc1)COc2ccc(cc2)I 1458a_100000184369_100000211621 [0,1,0,0,0,0|2,0,1]=4 1466 B21R2.18995 O=C(CCCc1ccccc1)COc2ccc(cc2)O 1458a_100000031633_100000211621 [0,1,0,0,0,0|2,0,1]=4 1467 B21R2.18995 O=C(CCCc1ccccc1)CSc2ccc(cc2)Br 1458a_100000179496_100000211621 [0,1,0,0,0,0|2,0,1]=4 1468 B21R2.18995 O=C(CCCc1ccccc1)CSc2ccc(cc2)Cl 1458a_100000178402_100000211621 [0,1,0,0,0,0|2,0,1]=4 1469 B21R2.18995 O=C(CCCc1ccccc1)CSc2ccc(cc2)F 1458a_100000691584_100000211621 [0,1,0,0,0,0|2,0,1]=4 1470 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100011207963 [0,1,0,0,0,0|2,0,1]=4 1471 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100011207963 [0,1,0,0,0,0|2,0,1]=4 1472 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100011207963 [0,1,0,0,0,0|2,0,1]=4 1473 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)Br 527a_100000174875_100011207963 [0,1,0,0,0,0|2,0,1]=4 1474 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100011207963 [0,1,0,0,0,0|2,0,1]=4 1475 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100011207963 [0,1,0,0,0,0|2,0,1]=4 1476 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100011207963 [0,1,0,0,0,0|2,0,1]=4 1477 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)Cl 527a_100000174871_100011207963 [0,1,0,0,0,0|2,0,1]=4 1478 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100011207963 [0,1,0,0,0,0|2,0,1]=4 1479 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100011207963 [0,1,0,0,0,0|2,0,1]=4 1480 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100011207963 [0,1,0,0,0,0|2,0,1]=4 1481 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)F 527a_100000174882_100011207963 [0,1,0,0,0,0|2,0,1]=4 1482 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100011207963 [0,1,0,0,0,0|2,0,1]=4 1483 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100011207963 [0,1,0,0,0,0|2,0,1]=4 1484 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100011207963 [0,1,0,0,0,0|2,0,1]=4 1485 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)I 527a_100016989417_100011207963 [0,1,0,0,0,0|2,0,1]=4 1486 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100011207963 [0,1,0,0,0,0|2,0,1]=4 1487 B21R2.18995 O=C(CCCc1ccccc1)NCc2ccc(cc2)O 527a_100000185549_100011207963 [0,1,0,0,0,0|2,0,1]=4 1488 B21R2.18995 O=C(CCCc1ccccc1)NNc2ccc(cc2)Br 22a_100000735608_100011207963 [0,1,0,0,0,0|3,0,0]=4 1489 B21R2.18995 O=C(CCCc1ccccc1)NNc2ccc(cc2)Cl 22a_100000683521_100011207963 [0,1,0,0,0,0|3,0,0]=4 1490 B21R2.18995 O=C(CCCc1ccccc1)NNc2ccc(cc2)F 22a_100000728448_100011207963 [0,1,0,0,0,0|3,0,0]=4 1491 B21R2.18995 O=C(CCCc1ccccc1)NNc2ccc(cc2)I 22a_100016988836_100011207963 [0,1,0,0,0,0|3,0,0]=4 1492 B21R2.18995 O=C(CCc1ccc(cc1)Br)NCCc2ccccc2 11a_100000106460_100000217147 [0,1,0,0,0,0|1,0,2]=4 1493 B21R2.18995 O=C(CCc1ccc(cc1)Br)NCCc2ccccc2 1626a_100000106460_100000217147 [0,1,0,0,0,0|1,0,2]=4 1494 B21R2.18995 O=C(CCc1ccc(cc1)Br)NCCc2ccccc2 240690a_100000106460_100000217147 [0,1,0,0,0,0|1,0,2]=4 1495 B21R2.18995 O=C(CCc1ccc(cc1)Br)NCCc2ccccc2 527a_100000106460_100000217147 [0,1,0,0,0,0|1,0,2]=4 1496 B21R2.18995 O=C(CCc1ccc(cc1)Cl)NCCc2ccccc2 11a_100000106460_100000235379 [0,1,0,0,0,0|1,0,2]=4 1497 B21R2.18995 O=C(CCc1ccc(cc1)Cl)NCCc2ccccc2 1626a_100000106460_100000235379 [0,1,0,0,0,0|1,0,2]=4 1498 B21R2.18995 O=C(CCc1ccc(cc1)Cl)NCCc2ccccc2 240690a_100000106460_100000235379 [0,1,0,0,0,0|1,0,2]=4 1499 B21R2.18995 O=C(CCc1ccc(cc1)Cl)NCCc2ccccc2 527a_100000106460_100000235379 [0,1,0,0,0,0|1,0,2]=4 1500 B21R2.18995 O=C(CCc1ccc(cc1)F)NCCc2ccccc2 11a_100000106460_100000198493 [0,1,0,0,0,0|1,0,2]=4 1501 B21R2.18995 O=C(CCc1ccc(cc1)F)NCCc2ccccc2 1626a_100000106460_100000198493 [0,1,0,0,0,0|1,0,2]=4 1502 B21R2.18995 O=C(CCc1ccc(cc1)F)NCCc2ccccc2 240690a_100000106460_100000198493 [0,1,0,0,0,0|1,0,2]=4 1503 B21R2.18995 O=C(CCc1ccc(cc1)F)NCCc2ccccc2 527a_100000106460_100000198493 [0,1,0,0,0,0|1,0,2]=4 1504 B21R2.18995 O=C(CCc1ccc(cc1)I)NCCc2ccccc2 11a_100000106460_100011217499 [0,1,0,0,0,0|1,0,2]=4 1505 B21R2.18995 O=C(CCc1ccc(cc1)I)NCCc2ccccc2 1626a_100000106460_100011217499 [0,1,0,0,0,0|1,0,2]=4 1506 B21R2.18995 O=C(CCc1ccc(cc1)I)NCCc2ccccc2 240690a_100000106460_100011217499 [0,1,0,0,0,0|1,0,2]=4 1507 B21R2.18995 O=C(CCc1ccc(cc1)I)NCCc2ccccc2 527a_100000106460_100011217499 [0,1,0,0,0,0|1,0,2]=4 1508 B21R2.18995 O=C(CCc1ccc(cc1)O)NCCc2ccccc2 240690a_100000106460_100000742835 [0,1,0,0,0,0|1,0,2]=4 1509 B21R2.18995 O=C(CNc1ccc(cc1)Br)NCCc2ccccc2 2230a_100000210018_100000183012 [0,1,0,0,0,0|2,0,1]=4 1510 B21R2.18995 O=C(CNc1ccc(cc1)Br)NCCc2ccccc2 34a_100000210018_100000183012 [0,1,0,0,0,0|2,0,1]=4 1511 B21R2.18995 O=C(CNc1ccc(cc1)Br)OCCc2ccccc2 2230a_100000210018_200000077782 [0,1,0,0,0,0|1,0,1]=3 1512 B21R2.18995 O=C(CNc1ccc(cc1)Br)OCCc2ccccc2 34a_100000210018_200000077782 [0,1,0,0,0,0|1,0,1]=3 1513 B21R2.18995 O=C(CNc1ccc(cc1)Cl)NCCc2ccccc2 2230a_100000210052_100000183012 [0,1,0,0,0,0|2,0,1]=4 1514 B21R2.18995 O=C(CNc1ccc(cc1)Cl)NCCc2ccccc2 34a_100000210052_100000183012 [0,1,0,0,0,0|2,0,1]=4 1515 B21R2.18995 O=C(CNc1ccc(cc1)Cl)OCCc2ccccc2 2230a_100000210052_200000077782 [0,1,0,0,0,0|1,0,1]=3 1516 B21R2.18995 O=C(CNc1ccc(cc1)Cl)OCCc2ccccc2 34a_100000210052_200000077782 [0,1,0,0,0,0|1,0,1]=3 1517 B21R2.18995 O=C(CNc1ccc(cc1)F)NCCc2ccccc2 34a_100000185862_100000183012 [0,1,0,0,0,0|2,0,1]=4 1518 B21R2.18995 O=C(CNc1ccc(cc1)F)OCCc2ccccc2 34a_100000185862_200000077782 [0,1,0,0,0,0|1,0,1]=3 1519 B21R2.18995 O=C(CNc1ccc(cc1)I)NCCc2ccccc2 34a_100000185761_100000183012 [0,1,0,0,0,0|2,0,1]=4 1520 B21R2.18995 O=C(CNc1ccc(cc1)I)OCCc2ccccc2 34a_100000185761_200000077782 [0,1,0,0,0,0|1,0,1]=3 1521 B21R2.18995 O=C(CNc1ccc(cc1)O)NCCc2ccccc2 34a_100000185829_100000183012 [0,1,0,0,0,0|2,0,1]=4 1522 B21R2.18995 O=C(CNc1ccc(cc1)O)OCCc2ccccc2 34a_100000185829_200000077782 [0,1,0,0,0,0|1,0,1]=3 1523 B21R2.18995 O=C(COc1ccc(=O)[nH]c1)OCCc2ccccc2 34a_100000075641_200000077782 [0,1,0,0,0,0|2,0,1]=4 1524 B21R2.18995 O=C(COc1ccc(cc1)Br)NCCc2ccccc2 11a_100000106460_100000182358 [0,1,0,0,0,0|2,0,1]=4 1525 B21R2.18995 O=C(COc1ccc(cc1)Br)NCCc2ccccc2 1626a_100000106460_100000182358 [0,1,0,0,0,0|2,0,1]=4 1526 B21R2.18995 O=C(COc1ccc(cc1)Br)NCCc2ccccc2 240690a_100000106460_100000182358 [0,1,0,0,0,0|2,0,1]=4 1527 B21R2.18995 O=C(COc1ccc(cc1)Br)NCCc2ccccc2 34a_100000185759_100000183012 [0,1,0,0,0,0|2,0,1]=4 1528 B21R2.18995 O=C(COc1ccc(cc1)Br)NCCc2ccccc2 527a_100000106460_100000182358 [0,1,0,0,0,0|2,0,1]=4 1529 B21R2.18995 O=C(COc1ccc(cc1)Br)NCCc2ccccc2 7a_100000185759_100000183012 [0,1,0,0,0,0|2,0,1]=4 1530 B21R2.18995 O=C(COc1ccc(cc1)Br)OCCc2ccccc2 34a_100000185759_200000077782 [0,1,0,0,0,0|1,0,1]=3 1531 B21R2.18995 O=C(COc1ccc(cc1)Br)OCCc2ccccc2 7a_100000185759_200000077782 [0,1,0,0,0,0|1,0,1]=3 1532 B21R2.18995 O=C(COc1ccc(cc1)Cl)NCCc2ccccc2 11a_100000106460_100016990877 [0,1,0,0,0,0|2,0,1]=4 1533 B21R2.18995 O=C(COc1ccc(cc1)Cl)NCCc2ccccc2 1626a_100000106460_100016990877 [0,1,0,0,0,0|2,0,1]=4 1534 B21R2.18995 O=C(COc1ccc(cc1)Cl)NCCc2ccccc2 240690a_100000106460_100016990877 [0,1,0,0,0,0|2,0,1]=4 1535 B21R2.18995 O=C(COc1ccc(cc1)Cl)NCCc2ccccc2 34a_100000210216_100000183012 [0,1,0,0,0,0|2,0,1]=4 1536 B21R2.18995 O=C(COc1ccc(cc1)Cl)NCCc2ccccc2 527a_100000106460_100016990877 [0,1,0,0,0,0|2,0,1]=4 1537 B21R2.18995 O=C(COc1ccc(cc1)Cl)NCCc2ccccc2 7a_100000210216_100000183012 [0,1,0,0,0,0|2,0,1]=4 1538 B21R2.18995 O=C(COc1ccc(cc1)Cl)OCCc2ccccc2 34a_100000210216_200000077782 [0,1,0,0,0,0|1,0,1]=3 1539 B21R2.18995 O=C(COc1ccc(cc1)Cl)OCCc2ccccc2 7a_100000210216_200000077782 [0,1,0,0,0,0|1,0,1]=3 1540 B21R2.18995 O=C(COc1ccc(cc1)F)NCCc2ccccc2 11a_100000106460_100000184765 [0,1,0,0,0,0|2,0,1]=4 1541 B21R2.18995 O=C(COc1ccc(cc1)F)NCCc2ccccc2 1626a_100000106460_100000184765 [0,1,0,0,0,0|2,0,1]=4 1542 B21R2.18995 O=C(COc1ccc(cc1)F)NCCc2ccccc2 240690a_100000106460_100000184765 [0,1,0,0,0,0|2,0,1]=4 1543 B21R2.18995 O=C(COc1ccc(cc1)F)NCCc2ccccc2 34a_100000210339_100000183012 [0,1,0,0,0,0|2,0,1]=4 1544 B21R2.18995 O=C(COc1ccc(cc1)F)NCCc2ccccc2 527a_100000106460_100000184765 [0,1,0,0,0,0|2,0,1]=4 1545 B21R2.18995 O=C(COc1ccc(cc1)F)OCCc2ccccc2 34a_100000210339_200000077782 [0,1,0,0,0,0|1,0,1]=3 1546 B21R2.18995 O=C(COc1ccc(cc1)I)NCCc2ccccc2 11a_100000106460_100000184369 [0,1,0,0,0,0|2,0,1]=4 1547 B21R2.18995 O=C(COc1ccc(cc1)I)NCCc2ccccc2 1626a_100000106460_100000184369 [0,1,0,0,0,0|2,0,1]=4 1548 B21R2.18995 O=C(COc1ccc(cc1)I)NCCc2ccccc2 240690a_100000106460_100000184369 [0,1,0,0,0,0|2,0,1]=4 1549 B21R2.18995 O=C(COc1ccc(cc1)I)NCCc2ccccc2 34a_100000212066_100000183012 [0,1,0,0,0,0|2,0,1]=4 1550 B21R2.18995 O=C(COc1ccc(cc1)I)NCCc2ccccc2 527a_100000106460_100000184369 [0,1,0,0,0,0|2,0,1]=4 1551 B21R2.18995 O=C(COc1ccc(cc1)I)NCCc2ccccc2 7a_100000212066_100000183012 [0,1,0,0,0,0|2,0,1]=4 1552 B21R2.18995 O=C(COc1ccc(cc1)I)OCCc2ccccc2 34a_100000212066_200000077782 [0,1,0,0,0,0|1,0,1]=3 1553 B21R2.18995 O=C(COc1ccc(cc1)I)OCCc2ccccc2 7a_100000212066_200000077782 [0,1,0,0,0,0|1,0,1]=3 1554 B21R2.18995 O=C(COc1ccc(cc1)O)NCCc2ccccc2 240690a_100000106460_100000031633 [0,1,0,0,0,0|2,0,1]=4 1555 B21R2.18995 O=C(COc1ccc(cc1)O)NCCc2ccccc2 527a_100000106460_100000031633 [0,1,0,0,0,0|2,0,1]=4 1556 B21R2.18995 O=C(COc1ccc(cn1)Cl)OCCc2ccccc2 34a_100011215309_200000077782 [0,1,0,0,0,0|2,0,1]=4 1557 B21R2.18995 O=C(COc1ccc(cn1)F)OCCc2ccccc2 34a_100000742473_200000077782 [0,1,0,0,0,0|2,0,1]=4 1558 B21R2.18995 O=C(COc1ccc(nc1)Br)OCCc2ccccc2 34a_100000685995_200000077782 [0,1,0,0,0,0|2,0,1]=4 1559 B21R2.18995 O=C(COc1ccc(nc1)Br)OCCc2ccccc2 7a_100000685995_200000077782 [0,1,0,0,0,0|2,0,1]=4 1560 B21R2.18995 O=C(COc1ccc(nc1)Cl)OCCc2ccccc2 34a_100000744096_200000077782 [0,1,0,0,0,0|2,0,1]=4 1561 B21R2.18995 O=C(COc1ccc(nc1)Cl)OCCc2ccccc2 7a_100000744096_200000077782 [0,1,0,0,0,0|2,0,1]=4 1562 B21R2.18995 O=C(COc1ccc(nc1)F)OCCc2ccccc2 34a_100000688820_200000077782 [0,1,0,0,0,0|2,0,1]=4 1563 B21R2.18995 O=C(COc1ccc(nc1)F)OCCc2ccccc2 7a_100000688820_200000077782 [0,1,0,0,0,0|2,0,1]=4 1564 B21R2.18995 O=C(COc1ccc(nc1)I)OCCc2ccccc2 34a_100000687607_200000077782 [0,1,0,0,0,0|2,0,1]=4 1565 B21R2.18995 O=C(COc1ccc(nc1)I)OCCc2ccccc2 7a_100000687607_200000077782 [0,1,0,0,0,0|2,0,1]=4 1566 B21R2.18995 O=C(CSc1cc[n+](cc1)[O-])OCCc2ccccc2 62a_200000077782_100000039755 [0,1,0,0,0,0|2,0,1]=4 1567 B21R2.18995 O=C(CSc1ccc(=O)[nH]c1)OCCc2ccccc2 62a_100000212171_200000077782 [0,1,0,0,0,0|2,0,1]=4 1568 B21R2.18995 O=C(CSc1ccc(=O)[nH]c1)OCCc2ccccc2 62a_200000077782_100000212171 [0,1,0,0,0,0|2,0,1]=4 1569 B21R2.18995 O=C(CSc1ccc(cc1)Br)NCCc2ccccc2 11a_100000106460_100000179496 [0,1,0,0,0,0|2,0,1]=4 1570 B21R2.18995 O=C(CSc1ccc(cc1)Br)NCCc2ccccc2 1626a_100000106460_100000179496 [0,1,0,0,0,0|2,0,1]=4 1571 B21R2.18995 O=C(CSc1ccc(cc1)Br)NCCc2ccccc2 240690a_100000106460_100000179496 [0,1,0,0,0,0|2,0,1]=4 1572 B21R2.18995 O=C(CSc1ccc(cc1)Br)NCCc2ccccc2 527a_100000106460_100000179496 [0,1,0,0,0,0|2,0,1]=4 1573 B21R2.18995 O=C(CSc1ccc(cc1)Br)NCCc2ccccc2 62a_100000183012_100000752885 [0,1,0,0,0,0|2,0,1]=4 1574 B21R2.18995 O=C(CSc1ccc(cc1)Br)NCCc2ccccc2 62a_100000752885_100000183012 [0,1,0,0,0,0|2,0,1]=4 1575 B21R2.18995 O=C(CSc1ccc(cc1)Br)OCCc2ccccc2 62a_100000752885_200000077782 [0,1,0,0,0,0|1,0,1]=3 1576 B21R2.18995 O=C(CSc1ccc(cc1)Br)OCCc2ccccc2 62a_200000077782_100000752885 [0,1,0,0,0,0|1,0,1]=3 1577 B21R2.18995 O=C(CSc1ccc(cc1)Cl)NCCc2ccccc2 11a_100000106460_100000178402 [0,1,0,0,0,0|2,0,1]=4 1578 B21R2.18995 O=C(CSc1ccc(cc1)Cl)NCCc2ccccc2 1626a_100000106460_100000178402 [0,1,0,0,0,0|2,0,1]=4 1579 B21R2.18995 O=C(CSc1ccc(cc1)Cl)NCCc2ccccc2 240690a_100000106460_100000178402 [0,1,0,0,0,0|2,0,1]=4 1580 B21R2.18995 O=C(CSc1ccc(cc1)Cl)NCCc2ccccc2 527a_100000106460_100000178402 [0,1,0,0,0,0|2,0,1]=4 1581 B21R2.18995 O=C(CSc1ccc(cc1)Cl)NCCc2ccccc2 62a_100000183012_100000755918 [0,1,0,0,0,0|2,0,1]=4 1582 B21R2.18995 O=C(CSc1ccc(cc1)Cl)NCCc2ccccc2 62a_100000755918_100000183012 [0,1,0,0,0,0|2,0,1]=4 1583 B21R2.18995 O=C(CSc1ccc(cc1)Cl)OCCc2ccccc2 62a_100000755918_200000077782 [0,1,0,0,0,0|1,0,1]=3 1584 B21R2.18995 O=C(CSc1ccc(cc1)Cl)OCCc2ccccc2 62a_200000077782_100000755918 [0,1,0,0,0,0|1,0,1]=3 1585 B21R2.18995 O=C(CSc1ccc(cc1)F)NCCc2ccccc2 11a_100000106460_100000691584 [0,1,0,0,0,0|2,0,1]=4 1586 B21R2.18995 O=C(CSc1ccc(cc1)F)NCCc2ccccc2 1626a_100000106460_100000691584 [0,1,0,0,0,0|2,0,1]=4 1587 B21R2.18995 O=C(CSc1ccc(cc1)F)NCCc2ccccc2 240690a_100000106460_100000691584 [0,1,0,0,0,0|2,0,1]=4 1588 B21R2.18995 O=C(CSc1ccc(cc1)F)NCCc2ccccc2 527a_100000106460_100000691584 [0,1,0,0,0,0|2,0,1]=4 1589 B21R2.18995 O=C(CSc1ccc(cc1)F)NCCc2ccccc2 62a_100000183012_100000211213 [0,1,0,0,0,0|2,0,1]=4 1590 B21R2.18995 O=C(CSc1ccc(cc1)F)NCCc2ccccc2 62a_100000211213_100000183012 [0,1,0,0,0,0|2,0,1]=4 1591 B21R2.18995 O=C(CSc1ccc(cc1)F)OCCc2ccccc2 62a_100000211213_200000077782 [0,1,0,0,0,0|1,0,1]=3 1592 B21R2.18995 O=C(CSc1ccc(cc1)F)OCCc2ccccc2 62a_200000077782_100000211213 [0,1,0,0,0,0|1,0,1]=3 1593 B21R2.18995 O=C(CSc1ccc(cc1)O)NCCc2ccccc2 62a_100000183012_100000185759 [0,1,0,0,0,0|2,0,1]=4 1594 B21R2.18995 O=C(CSc1ccc(cc1)O)OCCc2ccccc2 62a_200000077782_100000185759 [0,1,0,0,0,0|1,0,1]=3 1595 B21R2.18995 O=C(CSc1ccc(cn1)Br)OCCc2ccccc2 62a_100000686858_200000077782 [0,1,0,0,0,0|2,0,1]=4 1596 B21R2.18995 O=C(CSc1ccc(cn1)Br)OCCc2ccccc2 62a_200000077782_100000686858 [0,1,0,0,0,0|2,0,1]=4 1597 B21R2.18995 O=C(CSc1ccc(cn1)Cl)OCCc2ccccc2 62a_100011356976_200000077782 [0,1,0,0,0,0|2,0,1]=4 1598 B21R2.18995 O=C(CSc1ccc(cn1)Cl)OCCc2ccccc2 62a_200000077782_100011356976 [0,1,0,0,0,0|2,0,1]=4 1599 B21R2.18995 O=C(CSc1ccc(cn1)F)OCCc2ccccc2 62a_100000744514_200000077782 [0,1,0,0,0,0|2,0,1]=4 1600 B21R2.18995 O=C(CSc1ccc(cn1)F)OCCc2ccccc2 62a_200000077782_100000744514 [0,1,0,0,0,0|2,0,1]=4 1601 B21R2.18995 O=C(CSc1ccc(cn1)O)OCCc2ccccc2 62a_100000685995_200000077782 [0,1,0,0,0,0|2,0,1]=4 1602 B21R2.18995 O=C(CSc1ccc(cn1)O)OCCc2ccccc2 62a_200000077782_100000744096 [0,1,0,0,0,0|2,0,1]=4 1603 B21R2.18995 O=C(CSc1ccc(nc1)Br)OCCc2ccccc2 62a_100009814638_200000077782 [0,1,0,0,0,0|2,0,1]=4 1604 B21R2.18995 O=C(CSc1ccc(nc1)Br)OCCc2ccccc2 62a_200000077782_100009814638 [0,1,0,0,0,0|2,0,1]=4 1605 B21R2.18995 O=C(CSc1ccc(nc1)Cl)OCCc2ccccc2 62a_100000034144_200000077782 [0,1,0,0,0,0|2,0,1]=4 1606 B21R2.18995 O=C(CSc1ccc(nc1)Cl)OCCc2ccccc2 62a_200000077782_100000034144 [0,1,0,0,0,0|2,0,1]=4 1607 B21R2.18995 O=C(CSc1ccc(nc1)F)OCCc2ccccc2 62a_100000042367_200000077782 [0,1,0,0,0,0|2,0,1]=4 1608 B21R2.18995 O=C(CSc1ccc(nc1)F)OCCc2ccccc2 62a_200000077782_100000042367 [0,1,0,0,0,0|2,0,1]=4 1609 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Br 2708a_100000106460_100000174875 [0,1,0,0,0,0|2,0,1]=4 1610 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Br 2708a_100000174875_100000106460 [0,1,0,0,0,0|2,0,1]=4 1611 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Br 273464a_100000106460_100000174875 [0,1,0,0,0,0|2,0,1]=4 1612 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Br 273464a_100000174875_100000106460 [0,1,0,0,0,0|2,0,1]=4 1613 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Br 512a_100000106460_100000174875 [0,1,0,0,0,0|2,0,1]=4 1614 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Br 512a_100000174875_100000106460 [0,1,0,0,0,0|2,0,1]=4 1615 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Cl 2708a_100000106460_100000174871 [0,1,0,0,0,0|2,0,1]=4 1616 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Cl 2708a_100000174871_100000106460 [0,1,0,0,0,0|2,0,1]=4 1617 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Cl 273464a_100000106460_100000174871 [0,1,0,0,0,0|2,0,1]=4 1618 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Cl 273464a_100000174871_100000106460 [0,1,0,0,0,0|2,0,1]=4 1619 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)Cl 512a_100000106460_100000174871 [0,1,0,0,0,0|2,0,1]=4 1620 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)F 2708a_100000106460_100000174882 [0,1,0,0,0,0|2,0,1]=4 1621 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)F 2708a_100000174882_100000106460 [0,1,0,0,0,0|2,0,1]=4 1622 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)F 273464a_100000106460_100000174882 [0,1,0,0,0,0|2,0,1]=4 1623 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)F 273464a_100000174882_100000106460 [0,1,0,0,0,0|2,0,1]=4 1624 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)F 512a_100000106460_100000174882 [0,1,0,0,0,0|2,0,1]=4 1625 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)F 512a_100000174882_100000106460 [0,1,0,0,0,0|2,0,1]=4 1626 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)I 2708a_100000106460_100016989417 [0,1,0,0,0,0|2,0,1]=4 1627 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)I 2708a_100016989417_100000106460 [0,1,0,0,0,0|2,0,1]=4 1628 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)I 273464a_100000106460_100016989417 [0,1,0,0,0,0|2,0,1]=4 1629 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)I 273464a_100016989417_100000106460 [0,1,0,0,0,0|2,0,1]=4 1630 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)I 512a_100000106460_100016989417 [0,1,0,0,0,0|2,0,1]=4 1631 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)I 512a_100016989417_100000106460 [0,1,0,0,0,0|2,0,1]=4 1632 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)O 2708a_100000106460_100000185549 [0,1,0,0,0,0|2,0,1]=4 1633 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)O 2708a_100000185549_100000106460 [0,1,0,0,0,0|2,0,1]=4 1634 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)O 273464a_100000106460_100000185549 [0,1,0,0,0,0|2,0,1]=4 1635 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)O 273464a_100000185549_100000106460 [0,1,0,0,0,0|2,0,1]=4 1636 B21R2.18995 O=C(NCCc1ccccc1)NCc2ccc(cc2)O 512a_100000106460_100000185549 [0,1,0,0,0,0|2,0,1]=4 1637 B21R2.18995 O=C(NCCc1ccccc1)NNc2ccc(cc2)Br 273464a_100000106460_100000735608 [0,1,0,0,0,0|3,0,0]=4 1638 B21R2.18995 O=C(NCCc1ccccc1)NNc2ccc(cc2)Br 512a_100000106460_100000735608 [0,1,0,0,0,0|3,0,0]=4 1639 B21R2.18995 O=C(NCCc1ccccc1)NNc2ccc(cc2)Cl 273464a_100000106460_100000683521 [0,1,0,0,0,0|3,0,0]=4 1640 B21R2.18995 O=C(NCCc1ccccc1)NNc2ccc(cc2)Cl 512a_100000106460_100000683521 [0,1,0,0,0,0|3,0,0]=4 1641 B21R2.18995 O=C(NCCc1ccccc1)NNc2ccc(cc2)F 273464a_100000106460_100000728448 [0,1,0,0,0,0|3,0,0]=4 1642 B21R2.18995 O=C(NCCc1ccccc1)NNc2ccc(cc2)F 512a_100000106460_100000728448 [0,1,0,0,0,0|3,0,0]=4 1643 B21R2.18995 O=C(NCCc1ccccc1)NNc2ccc(cc2)I 273464a_100000106460_100016988836 [0,1,0,0,0,0|3,0,0]=4 1644 B21R2.18995 O=C(NCCc1ccccc1)NNc2ccc(cc2)I 512a_100000106460_100016988836 [0,1,0,0,0,0|3,0,0]=4 1645 B21R2.19000 CC(=NNCc1ccc(cc1)Br)C=Cc2ccccc2 4a_100016993955_100000204604 [0,1,0,0,0,0|3,0,0]=4 1646 B21R2.19000 CC(=NNCc1ccc(cc1)C)C=Cc2ccccc2 4a_100011197965_100000204604 [0,1,0,0,0,0|3,0,0]=4 1647 B21R2.19000 CC(=NNCc1ccc(cc1)Cl)C=Cc2ccccc2 4a_100000689899_100000204604 [0,1,0,0,0,0|3,0,0]=4 1648 B21R2.19000 CC(=NNCc1ccc(cc1)F)C=Cc2ccccc2 4a_100000689900_100000204604 [0,1,0,0,0,0|3,0,0]=4 1649 B21R2.19000 CC(=NNCc1ccc(cc1)I)C=Cc2ccccc2 4a_102495363730_100000204604 [0,1,0,0,0,0|3,0,0]=4 1650 B21R2.19000 Cc1ccc(cc1)CCCC(=O)CCc2ccccc2 1458a_100000741418_100000765856 [0,1,0,0,0,0|1,0,2]=4 1651 B21R2.19000 Cc1ccc(cc1)CCCC(=O)NCc2ccccc2 11a_100015324214_100000741418 [0,1,0,0,0,0|2,0,1]=4 1652 B21R2.19000 Cc1ccc(cc1)CCCC(=O)NCc2ccccc2 1626a_100015324214_100000741418 [0,1,0,0,0,0|2,0,1]=4 1653 B21R2.19000 Cc1ccc(cc1)CCCC(=O)NCc2ccccc2 240690a_100015324214_100000741418 [0,1,0,0,0,0|2,0,1]=4 1654 B21R2.19000 Cc1ccc(cc1)CCCC(=O)NCc2ccccc2 527a_100015324214_100000741418 [0,1,0,0,0,0|2,0,1]=4 1655 B21R2.19000 Cc1ccc(cc1)CCCC(=O)NNc2ccccc2 22a_100015195140_100000741418 [0,1,0,0,0,0|3,0,0]=4 1656 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C#Cc2ccccc2 240690a_100000705350_100000736102 [0,1,0,0,0,0|1,0,2]=4 1657 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 11a_100000705350_100000210462 [0,1,0,0,0,0|1,0,0]=2 1658 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 1626a_100000705350_100000210462 [0,1,0,0,0,0|1,0,0]=2 1659 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 11a_100000705350_100000740811 [0,1,0,0,0,0|2,0,0]=3 1660 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 240690a_100000705350_100000740811 [0,1,0,0,0,0|2,0,0]=3 1661 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 11a_100000705350_100000735890 [0,1,0,0,0,0|2,0,0]=3 1662 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 240690a_100000705350_100000735890 [0,1,0,0,0,0|2,0,0]=3 1663 B21R2.19000 Cc1ccc(cc1)CCNC(=O)C=Cc2ccncc2 240690a_100000705350_100000682801 [0,1,0,0,0,0|2,0,0]=3 1664 B21R2.19000 Cc1ccc(cc1)CCNC(=O)CCc2ccccc2 11a_100000705350_100000185753 [0,1,0,0,0,0|1,0,2]=4 1665 B21R2.19000 Cc1ccc(cc1)CCNC(=O)CCc2ccccc2 1626a_100000705350_100000185753 [0,1,0,0,0,0|1,0,2]=4 1666 B21R2.19000 Cc1ccc(cc1)CCNC(=O)CCc2ccccc2 240690a_100000705350_100000185753 [0,1,0,0,0,0|1,0,2]=4 1667 B21R2.19000 Cc1ccc(cc1)CCNC(=O)CCc2ccccc2 527a_100000705350_100000185753 [0,1,0,0,0,0|1,0,2]=4 1668 B21R2.19000 Cc1ccc(cc1)CCNC(=O)COc2ccccc2 11a_100000705350_100000186222 [0,1,0,0,0,0|2,0,1]=4 1669 B21R2.19000 Cc1ccc(cc1)CCNC(=O)COc2ccccc2 1626a_100000705350_100000186222 [0,1,0,0,0,0|2,0,1]=4 1670 B21R2.19000 Cc1ccc(cc1)CCNC(=O)COc2ccccc2 240690a_100000705350_100000186222 [0,1,0,0,0,0|2,0,1]=4 1671 B21R2.19000 Cc1ccc(cc1)CCNC(=O)COc2ccccc2 527a_100000705350_100000186222 [0,1,0,0,0,0|2,0,1]=4 1672 B21R2.19000 Cc1ccc(cc1)CCNC(=O)CSc2ccccc2 11a_100000705350_100000211596 [0,1,0,0,0,0|2,0,1]=4 1673 B21R2.19000 Cc1ccc(cc1)CCNC(=O)CSc2ccccc2 1626a_100000705350_100000211596 [0,1,0,0,0,0|2,0,1]=4 1674 B21R2.19000 Cc1ccc(cc1)CCNC(=O)CSc2ccccc2 240690a_100000705350_100000211596 [0,1,0,0,0,0|2,0,1]=4 1675 B21R2.19000 Cc1ccc(cc1)CCNC(=O)CSc2ccccc2 527a_100000705350_100000211596 [0,1,0,0,0,0|2,0,1]=4 1676 B21R2.19000 Cc1ccc(cc1)CCNC(=O)NCc2ccccc2 2708a_100000705350_100015324214 [0,1,0,0,0,0|2,0,1]=4 1677 B21R2.19000 Cc1ccc(cc1)CCNC(=O)NCc2ccccc2 2708a_100015324214_100000705350 [0,1,0,0,0,0|2,0,1]=4 1678 B21R2.19000 Cc1ccc(cc1)CCNC(=O)NCc2ccccc2 273464a_100000705350_100015324214 [0,1,0,0,0,0|2,0,1]=4 1679 B21R2.19000 Cc1ccc(cc1)CCNC(=O)NCc2ccccc2 273464a_100015324214_100000705350 [0,1,0,0,0,0|2,0,1]=4 1680 B21R2.19000 Cc1ccc(cc1)CCNC(=O)NCc2ccccc2 512a_100000705350_100015324214 [0,1,0,0,0,0|2,0,1]=4 1681 B21R2.19000 Cc1ccc(cc1)CCNC(=O)NCc2ccccc2 512a_100015324214_100000705350 [0,1,0,0,0,0|2,0,1]=4 1682 B21R2.19000 Cc1ccc(cc1)CCNC(=O)NNc2ccccc2 273464a_100000705350_100015195140 [0,1,0,0,0,0|3,0,0]=4 1683 B21R2.19000 Cc1ccc(cc1)CCNC(=O)NNc2ccccc2 512a_100000705350_100015195140 [0,1,0,0,0,0|3,0,0]=4 1684 B21R2.19000 Cc1ccc(cc1)CCNC(=O)OCc2ccccc2 271570a_200010239705_100000186775 [0,1,0,0,0,0|2,0,1]=4 1685 B21R2.19000 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccc2 22a_100011197965_100000210462 [0,1,0,0,0,0|2,0,0]=3 1686 B21R2.19000 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccn2 22a_100011197965_100000740811 [0,1,0,0,0,0|3,0,0]=4 1687 B21R2.19000 Cc1ccc(cc1)CNNC(=O)C=Cc2cccnc2 22a_100011197965_100000735890 [0,1,0,0,0,0|3,0,0]=4 1688 B21R2.19000 Cc1ccc(cc1)CNNC(=O)C=Cc2ccncc2 22a_100011197965_100000682801 [0,1,0,0,0,0|3,0,0]=4 1689 B21R2.19000 Cc1ccc(cc1)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000183172 [0,1,0,0,0,0|2,0,0]=3 1690 B21R2.19000 Cc1ccc(cc1)OCCC(=O)C=Cc2ccccn2 1458a_100000740811_100000183172 [0,1,0,0,0,0|3,0,0]=4 1691 B21R2.19000 Cc1ccc(cc1)OCCC(=O)C=Cc2cccnc2 1458a_100000735890_100000183172 [0,1,0,0,0,0|3,0,0]=4 1692 B21R2.19000 Cc1ccc(cc1)OCCC(=O)C=Cc2ccncc2 1458a_100000682801_100000183172 [0,1,0,0,0,0|3,0,0]=4 1693 B21R2.19000 Nc1ccc(cc1)CCNC(=O)OCc2ccccc2 271570a_200010239705_100000185761 [0,1,0,0,0,0|2,0,1]=4 1694 B21R2.19000 O=C(C#Cc1ccccc1)CCCc2ccc(cc2)Br 1458a_100000736102_100011713682 [0,1,0,0,0,0|1,0,2]=4 1695 B21R2.19000 O=C(C#Cc1ccccc1)CCCc2ccc(cc2)Cl 1458a_100000736102_100000759440 [0,1,0,0,0,0|1,0,2]=4 1696 B21R2.19000 O=C(C#Cc1ccccc1)CCCc2ccc(cc2)F 1458a_100000736102_200011713563 [0,1,0,0,0,0|1,0,2]=4 1697 B21R2.19000 O=C(C#Cc1ccccc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000736102 [0,1,0,0,0,0|1,0,2]=4 1698 B21R2.19000 O=C(C#Cc1ccccc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000736102 [0,1,0,0,0,0|1,0,2]=4 1699 B21R2.19000 O=C(C#Cc1ccccc1)NCCc2ccc(cc2)F 240690a_100000199005_100000736102 [0,1,0,0,0,0|1,0,2]=4 1700 B21R2.19000 O=C(C#Cc1ccccc1)NCCc2ccc(cc2)O 240690a_100000743037_100000736102 [0,1,0,0,0,0|1,0,2]=4 1701 B21R2.19000 O=C(C=Cc1ccccc1)CC#Cc2ccc(cc2)Br 1458a_100000210462_100010706785 [0,1,0,0,0,0|1,0,2]=4 1702 B21R2.19000 O=C(C=Cc1ccccc1)CC#Cc2ccc(cc2)F 1458a_100000210462_100010402171 [0,1,0,0,0,0|1,0,2]=4 1703 B21R2.19000 O=C(C=Cc1ccccc1)CCCc2ccc(cc2)Br 1458a_100000210462_100011713682 [0,1,0,0,0,0|1,0,0]=2 1704 B21R2.19000 O=C(C=Cc1ccccc1)CCCc2ccc(cc2)Cl 1458a_100000210462_100000759440 [0,1,0,0,0,0|1,0,0]=2 1705 B21R2.19000 O=C(C=Cc1ccccc1)CCCc2ccc(cc2)F 1458a_100000210462_200011713563 [0,1,0,0,0,0|1,0,0]=2 1706 B21R2.19000 O=C(C=Cc1ccccc1)CCOc2ccc(cc2)Br 1458a_100000210462_100000183278 [0,1,0,0,0,0|2,0,0]=3 1707 B21R2.19000 O=C(C=Cc1ccccc1)CCOc2ccc(cc2)Cl 1458a_100000210462_100000184122 [0,1,0,0,0,0|2,0,0]=3 1708 B21R2.19000 O=C(C=Cc1ccccc1)CCOc2ccc(cc2)F 1458a_100000210462_100000184936 [0,1,0,0,0,0|2,0,0]=3 1709 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)Br 11a_100000755846_100000210462 [0,1,0,0,0,0|1,0,0]=2 1710 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)Br 1626a_100000755846_100000210462 [0,1,0,0,0,0|1,0,0]=2 1711 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000210462 [0,1,0,0,0,0|1,0,0]=2 1712 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100000210462 [0,1,0,0,0,0|1,0,0]=2 1713 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)F 11a_100000199005_100000210462 [0,1,0,0,0,0|1,0,0]=2 1714 B21R2.19000 O=C(C=Cc1ccccc1)NCCc2ccc(cc2)F 1626a_100000199005_100000210462 [0,1,0,0,0,0|1,0,0]=2 1715 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)Br 22a_100016993955_100000210462 [0,1,0,0,0,0|2,0,0]=3 1716 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)Cl 22a_100000689899_100000210462 [0,1,0,0,0,0|2,0,0]=3 1717 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)F 22a_100000689900_100000210462 [0,1,0,0,0,0|2,0,0]=3 1718 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)I 22a_102495363730_100000210462 [0,1,0,0,0,0|2,0,0]=3 1719 B21R2.19000 O=C(C=Cc1ccccc1)NNCc2ccc(nc2)Cl 22a_106726394036_100000210462 [0,1,0,0,0,0|3,0,0]=4 1720 B21R2.19000 O=C(C=Cc1ccccn1)CCCc2ccc(cc2)Br 1458a_100000740811_100011713682 [0,1,0,0,0,0|2,0,0]=3 1721 B21R2.19000 O=C(C=Cc1ccccn1)CCCc2ccc(cc2)Cl 1458a_100000740811_100000759440 [0,1,0,0,0,0|2,0,0]=3 1722 B21R2.19000 O=C(C=Cc1ccccn1)CCCc2ccc(cc2)F 1458a_100000740811_200011713563 [0,1,0,0,0,0|2,0,0]=3 1723 B21R2.19000 O=C(C=Cc1ccccn1)CCOc2ccc(cc2)Br 1458a_100000740811_100000183278 [0,1,0,0,0,0|3,0,0]=4 1724 B21R2.19000 O=C(C=Cc1ccccn1)CCOc2ccc(cc2)Cl 1458a_100000740811_100000184122 [0,1,0,0,0,0|3,0,0]=4 1725 B21R2.19000 O=C(C=Cc1ccccn1)CCOc2ccc(cc2)F 1458a_100000740811_100000184936 [0,1,0,0,0,0|3,0,0]=4 1726 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)Br 11a_100000755846_100000740811 [0,1,0,0,0,0|2,0,0]=3 1727 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)Br 240690a_100000755846_100000740811 [0,1,0,0,0,0|2,0,0]=3 1728 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)Cl 11a_100000185265_100000740811 [0,1,0,0,0,0|2,0,0]=3 1729 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000740811 [0,1,0,0,0,0|2,0,0]=3 1730 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)F 11a_100000199005_100000740811 [0,1,0,0,0,0|2,0,0]=3 1731 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)F 240690a_100000199005_100000740811 [0,1,0,0,0,0|2,0,0]=3 1732 B21R2.19000 O=C(C=Cc1ccccn1)NCCc2ccc(cc2)O 240690a_100000743037_100000740811 [0,1,0,0,0,0|2,0,0]=3 1733 B21R2.19000 O=C(C=Cc1ccccn1)NNCc2ccc(cc2)Br 22a_100016993955_100000740811 [0,1,0,0,0,0|3,0,0]=4 1734 B21R2.19000 O=C(C=Cc1ccccn1)NNCc2ccc(cc2)Cl 22a_100000689899_100000740811 [0,1,0,0,0,0|3,0,0]=4 1735 B21R2.19000 O=C(C=Cc1ccccn1)NNCc2ccc(cc2)F 22a_100000689900_100000740811 [0,1,0,0,0,0|3,0,0]=4 1736 B21R2.19000 O=C(C=Cc1ccccn1)NNCc2ccc(cc2)I 22a_102495363730_100000740811 [0,1,0,0,0,0|3,0,0]=4 1737 B21R2.19000 O=C(C=Cc1cccnc1)CCCc2ccc(cc2)Br 1458a_100000735890_100011713682 [0,1,0,0,0,0|2,0,0]=3 1738 B21R2.19000 O=C(C=Cc1cccnc1)CCCc2ccc(cc2)Cl 1458a_100000735890_100000759440 [0,1,0,0,0,0|2,0,0]=3 1739 B21R2.19000 O=C(C=Cc1cccnc1)CCCc2ccc(cc2)F 1458a_100000735890_200011713563 [0,1,0,0,0,0|2,0,0]=3 1740 B21R2.19000 O=C(C=Cc1cccnc1)CCOc2ccc(cc2)Br 1458a_100000735890_100000183278 [0,1,0,0,0,0|3,0,0]=4 1741 B21R2.19000 O=C(C=Cc1cccnc1)CCOc2ccc(cc2)Cl 1458a_100000735890_100000184122 [0,1,0,0,0,0|3,0,0]=4 1742 B21R2.19000 O=C(C=Cc1cccnc1)CCOc2ccc(cc2)F 1458a_100000735890_100000184936 [0,1,0,0,0,0|3,0,0]=4 1743 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)Br 11a_100000755846_100000735890 [0,1,0,0,0,0|2,0,0]=3 1744 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000735890 [0,1,0,0,0,0|2,0,0]=3 1745 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000735890 [0,1,0,0,0,0|2,0,0]=3 1746 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000735890 [0,1,0,0,0,0|2,0,0]=3 1747 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)F 11a_100000199005_100000735890 [0,1,0,0,0,0|2,0,0]=3 1748 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)F 240690a_100000199005_100000735890 [0,1,0,0,0,0|2,0,0]=3 1749 B21R2.19000 O=C(C=Cc1cccnc1)NCCc2ccc(cc2)O 240690a_100000743037_100000735890 [0,1,0,0,0,0|2,0,0]=3 1750 B21R2.19000 O=C(C=Cc1cccnc1)NNCc2ccc(cc2)Br 22a_100016993955_100000735890 [0,1,0,0,0,0|3,0,0]=4 1751 B21R2.19000 O=C(C=Cc1cccnc1)NNCc2ccc(cc2)Cl 22a_100000689899_100000735890 [0,1,0,0,0,0|3,0,0]=4 1752 B21R2.19000 O=C(C=Cc1cccnc1)NNCc2ccc(cc2)F 22a_100000689900_100000735890 [0,1,0,0,0,0|3,0,0]=4 1753 B21R2.19000 O=C(C=Cc1cccnc1)NNCc2ccc(cc2)I 22a_102495363730_100000735890 [0,1,0,0,0,0|3,0,0]=4 1754 B21R2.19000 O=C(C=Cc1ccncc1)CCCc2ccc(cc2)Br 1458a_100000682801_100011713682 [0,1,0,0,0,0|2,0,0]=3 1755 B21R2.19000 O=C(C=Cc1ccncc1)CCCc2ccc(cc2)Cl 1458a_100000682801_100000759440 [0,1,0,0,0,0|2,0,0]=3 1756 B21R2.19000 O=C(C=Cc1ccncc1)CCCc2ccc(cc2)F 1458a_100000682801_200011713563 [0,1,0,0,0,0|2,0,0]=3 1757 B21R2.19000 O=C(C=Cc1ccncc1)CCOc2ccc(cc2)Br 1458a_100000682801_100000183278 [0,1,0,0,0,0|3,0,0]=4 1758 B21R2.19000 O=C(C=Cc1ccncc1)CCOc2ccc(cc2)Cl 1458a_100000682801_100000184122 [0,1,0,0,0,0|3,0,0]=4 1759 B21R2.19000 O=C(C=Cc1ccncc1)CCOc2ccc(cc2)F 1458a_100000682801_100000184936 [0,1,0,0,0,0|3,0,0]=4 1760 B21R2.19000 O=C(C=Cc1ccncc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000682801 [0,1,0,0,0,0|2,0,0]=3 1761 B21R2.19000 O=C(C=Cc1ccncc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000682801 [0,1,0,0,0,0|2,0,0]=3 1762 B21R2.19000 O=C(C=Cc1ccncc1)NCCc2ccc(cc2)F 240690a_100000199005_100000682801 [0,1,0,0,0,0|2,0,0]=3 1763 B21R2.19000 O=C(C=Cc1ccncc1)NCCc2ccc(cc2)O 240690a_100000743037_100000682801 [0,1,0,0,0,0|2,0,0]=3 1764 B21R2.19000 O=C(C=Cc1ccncc1)NNCc2ccc(cc2)Br 22a_100016993955_100000682801 [0,1,0,0,0,0|3,0,0]=4 1765 B21R2.19000 O=C(C=Cc1ccncc1)NNCc2ccc(cc2)Cl 22a_100000689899_100000682801 [0,1,0,0,0,0|3,0,0]=4 1766 B21R2.19000 O=C(C=Cc1ccncc1)NNCc2ccc(cc2)F 22a_100000689900_100000682801 [0,1,0,0,0,0|3,0,0]=4 1767 B21R2.19000 O=C(C=Cc1ccncc1)NNCc2ccc(cc2)I 22a_102495363730_100000682801 [0,1,0,0,0,0|3,0,0]=4 1768 B21R2.19000 O=C(CCCc1ccc(cc1)Br)CCc2ccccc2 1458a_100000185753_100011713682 [0,1,0,0,0,0|1,0,2]=4 1769 B21R2.19000 O=C(CCCc1ccc(cc1)Br)CCc2ccccc2 1458a_100011236545_100000765856 [0,1,0,0,0,0|1,0,2]=4 1770 B21R2.19000 O=C(CCCc1ccc(cc1)Br)COc2ccccc2 1458a_100000186222_100011713682 [0,1,0,0,0,0|2,0,1]=4 1771 B21R2.19000 O=C(CCCc1ccc(cc1)Br)CSc2ccccc2 1458a_100000211596_100011713682 [0,1,0,0,0,0|2,0,1]=4 1772 B21R2.19000 O=C(CCCc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_100011236545 [0,1,0,0,0,0|2,0,1]=4 1773 B21R2.19000 O=C(CCCc1ccc(cc1)Br)NCc2ccccc2 1626a_100015324214_100011236545 [0,1,0,0,0,0|2,0,1]=4 1774 B21R2.19000 O=C(CCCc1ccc(cc1)Br)NCc2ccccc2 240690a_100015324214_100011236545 [0,1,0,0,0,0|2,0,1]=4 1775 B21R2.19000 O=C(CCCc1ccc(cc1)Br)NCc2ccccc2 527a_100015324214_100011236545 [0,1,0,0,0,0|2,0,1]=4 1776 B21R2.19000 O=C(CCCc1ccc(cc1)Br)NNc2ccccc2 22a_100015195140_100011236545 [0,1,0,0,0,0|3,0,0]=4 1777 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)CCc2ccccc2 1458a_100000185753_100000759440 [0,1,0,0,0,0|1,0,2]=4 1778 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)CCc2ccccc2 1458a_100000741339_100000765856 [0,1,0,0,0,0|1,0,2]=4 1779 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)COc2ccccc2 1458a_100000186222_100000759440 [0,1,0,0,0,0|2,0,1]=4 1780 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)CSc2ccccc2 1458a_100000211596_100000759440 [0,1,0,0,0,0|2,0,1]=4 1781 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)NCc2ccccc2 11a_100015324214_100000741339 [0,1,0,0,0,0|2,0,1]=4 1782 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)NCc2ccccc2 1626a_100015324214_100000741339 [0,1,0,0,0,0|2,0,1]=4 1783 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100000741339 [0,1,0,0,0,0|2,0,1]=4 1784 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)NCc2ccccc2 527a_100015324214_100000741339 [0,1,0,0,0,0|2,0,1]=4 1785 B21R2.19000 O=C(CCCc1ccc(cc1)Cl)NNc2ccccc2 22a_100015195140_100000741339 [0,1,0,0,0,0|3,0,0]=4 1786 B21R2.19000 O=C(CCCc1ccc(cc1)F)CCc2ccccc2 1458a_100000185753_200011713563 [0,1,0,0,0,0|1,0,2]=4 1787 B21R2.19000 O=C(CCCc1ccc(cc1)F)CCc2ccccc2 1458a_100011219804_100000765856 [0,1,0,0,0,0|1,0,2]=4 1788 B21R2.19000 O=C(CCCc1ccc(cc1)F)COc2ccccc2 1458a_100000186222_200011713563 [0,1,0,0,0,0|2,0,1]=4 1789 B21R2.19000 O=C(CCCc1ccc(cc1)F)CSc2ccccc2 1458a_100000211596_200011713563 [0,1,0,0,0,0|2,0,1]=4 1790 B21R2.19000 O=C(CCCc1ccc(cc1)F)NCc2ccccc2 11a_100015324214_100011219804 [0,1,0,0,0,0|2,0,1]=4 1791 B21R2.19000 O=C(CCCc1ccc(cc1)F)NCc2ccccc2 1626a_100015324214_100011219804 [0,1,0,0,0,0|2,0,1]=4 1792 B21R2.19000 O=C(CCCc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100011219804 [0,1,0,0,0,0|2,0,1]=4 1793 B21R2.19000 O=C(CCCc1ccc(cc1)F)NCc2ccccc2 527a_100015324214_100011219804 [0,1,0,0,0,0|2,0,1]=4 1794 B21R2.19000 O=C(CCCc1ccc(cc1)F)NNc2ccccc2 22a_100015195140_100011219804 [0,1,0,0,0,0|3,0,0]=4 1795 B21R2.19000 O=C(CCCc1ccc(cc1)I)CCc2ccccc2 1458a_100011236544_100000765856 [0,1,0,0,0,0|1,0,2]=4 1796 B21R2.19000 O=C(CCCc1ccc(cc1)I)NCc2ccccc2 11a_100015324214_100011236544 [0,1,0,0,0,0|2,0,1]=4 1797 B21R2.19000 O=C(CCCc1ccc(cc1)I)NCc2ccccc2 1626a_100015324214_100011236544 [0,1,0,0,0,0|2,0,1]=4 1798 B21R2.19000 O=C(CCCc1ccc(cc1)I)NCc2ccccc2 240690a_100015324214_100011236544 [0,1,0,0,0,0|2,0,1]=4 1799 B21R2.19000 O=C(CCCc1ccc(cc1)I)NCc2ccccc2 527a_100015324214_100011236544 [0,1,0,0,0,0|2,0,1]=4 1800 B21R2.19000 O=C(CCCc1ccc(cc1)I)NNc2ccccc2 22a_100015195140_100011236544 [0,1,0,0,0,0|3,0,0]=4 1801 B21R2.19000 O=C(CCCc1ccc(cc1)O)CCc2ccccc2 1458a_100000116853_100000765856 [0,1,0,0,0,0|1,0,2]=4 1802 B21R2.19000 O=C(CCCc1ccc(cc1)O)NCc2ccccc2 240690a_100015324214_100000116853 [0,1,0,0,0,0|2,0,1]=4 1803 B21R2.19000 O=C(CCCc1ccc(cc1)O)NCc2ccccc2 527a_100015324214_100000116853 [0,1,0,0,0,0|2,0,1]=4 1804 B21R2.19000 O=C(CCCc1ccc(cc1)O)NNc2ccccc2 22a_100015195140_100000116853 [0,1,0,0,0,0|3,0,0]=4 1805 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)Br 11a_100000755846_100000185753 [0,1,0,0,0,0|1,0,2]=4 1806 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)Br 1626a_100000755846_100000185753 [0,1,0,0,0,0|1,0,2]=4 1807 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000185753 [0,1,0,0,0,0|1,0,2]=4 1808 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)Br 527a_100000755846_100000185753 [0,1,0,0,0,0|1,0,2]=4 1809 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000185753 [0,1,0,0,0,0|1,0,2]=4 1810 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100000185753 [0,1,0,0,0,0|1,0,2]=4 1811 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000185753 [0,1,0,0,0,0|1,0,2]=4 1812 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)Cl 527a_100000185265_100000185753 [0,1,0,0,0,0|1,0,2]=4 1813 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)F 11a_100000199005_100000185753 [0,1,0,0,0,0|1,0,2]=4 1814 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)F 1626a_100000199005_100000185753 [0,1,0,0,0,0|1,0,2]=4 1815 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)F 240690a_100000199005_100000185753 [0,1,0,0,0,0|1,0,2]=4 1816 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)F 527a_100000199005_100000185753 [0,1,0,0,0,0|1,0,2]=4 1817 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)O 240690a_100000743037_100000185753 [0,1,0,0,0,0|1,0,2]=4 1818 B21R2.19000 O=C(CCc1ccccc1)NCCc2ccc(cc2)O 527a_100000743037_100000185753 [0,1,0,0,0,0|1,0,2]=4 1819 B21R2.19000 O=C(CNc1ccccc1)NCCc2ccc(cc2)Cl 34a_100000106764_200000183373 [0,1,0,0,0,0|2,0,1]=4 1820 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Br 11a_100000755846_100000186222 [0,1,0,0,0,0|2,0,1]=4 1821 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Br 1626a_100000755846_100000186222 [0,1,0,0,0,0|2,0,1]=4 1822 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000186222 [0,1,0,0,0,0|2,0,1]=4 1823 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Br 527a_100000755846_100000186222 [0,1,0,0,0,0|2,0,1]=4 1824 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000186222 [0,1,0,0,0,0|2,0,1]=4 1825 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100000186222 [0,1,0,0,0,0|2,0,1]=4 1826 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000186222 [0,1,0,0,0,0|2,0,1]=4 1827 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Cl 34a_100000210340_200000183373 [0,1,0,0,0,0|2,0,1]=4 1828 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Cl 527a_100000185265_100000186222 [0,1,0,0,0,0|2,0,1]=4 1829 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)Cl 7a_100000210340_200000183373 [0,1,0,0,0,0|2,0,1]=4 1830 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)F 11a_100000199005_100000186222 [0,1,0,0,0,0|2,0,1]=4 1831 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)F 1626a_100000199005_100000186222 [0,1,0,0,0,0|2,0,1]=4 1832 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)F 240690a_100000199005_100000186222 [0,1,0,0,0,0|2,0,1]=4 1833 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)F 527a_100000199005_100000186222 [0,1,0,0,0,0|2,0,1]=4 1834 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)O 240690a_100000743037_100000186222 [0,1,0,0,0,0|2,0,1]=4 1835 B21R2.19000 O=C(COc1ccccc1)NCCc2ccc(cc2)O 527a_100000743037_100000186222 [0,1,0,0,0,0|2,0,1]=4 1836 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Br 11a_100000755846_100000211596 [0,1,0,0,0,0|2,0,1]=4 1837 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Br 1626a_100000755846_100000211596 [0,1,0,0,0,0|2,0,1]=4 1838 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000211596 [0,1,0,0,0,0|2,0,1]=4 1839 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Br 527a_100000755846_100000211596 [0,1,0,0,0,0|2,0,1]=4 1840 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000211596 [0,1,0,0,0,0|2,0,1]=4 1841 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100000211596 [0,1,0,0,0,0|2,0,1]=4 1842 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000211596 [0,1,0,0,0,0|2,0,1]=4 1843 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Cl 527a_100000185265_100000211596 [0,1,0,0,0,0|2,0,1]=4 1844 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Cl 62a_100000719477_200000183373 [0,1,0,0,0,0|2,0,1]=4 1845 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)Cl 62a_200000183373_100000041952 [0,1,0,0,0,0|2,0,1]=4 1846 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)F 11a_100000199005_100000211596 [0,1,0,0,0,0|2,0,1]=4 1847 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)F 1626a_100000199005_100000211596 [0,1,0,0,0,0|2,0,1]=4 1848 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)F 240690a_100000199005_100000211596 [0,1,0,0,0,0|2,0,1]=4 1849 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)F 527a_100000199005_100000211596 [0,1,0,0,0,0|2,0,1]=4 1850 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)O 240690a_100000743037_100000211596 [0,1,0,0,0,0|2,0,1]=4 1851 B21R2.19000 O=C(CSc1ccccc1)NCCc2ccc(cc2)O 527a_100000743037_100000211596 [0,1,0,0,0,0|2,0,1]=4 1852 B21R2.19000 O=C(NCCc1ccc(cc1)Br)NCc2ccccc2 2708a_100000755846_100015324214 [0,1,0,0,0,0|2,0,1]=4 1853 B21R2.19000 O=C(NCCc1ccc(cc1)Br)NCc2ccccc2 2708a_100015324214_100000755846 [0,1,0,0,0,0|2,0,1]=4 1854 B21R2.19000 O=C(NCCc1ccc(cc1)Br)NCc2ccccc2 273464a_100000755846_100015324214 [0,1,0,0,0,0|2,0,1]=4 1855 B21R2.19000 O=C(NCCc1ccc(cc1)Br)NCc2ccccc2 273464a_100015324214_100000755846 [0,1,0,0,0,0|2,0,1]=4 1856 B21R2.19000 O=C(NCCc1ccc(cc1)Br)NCc2ccccc2 512a_100000755846_100015324214 [0,1,0,0,0,0|2,0,1]=4 1857 B21R2.19000 O=C(NCCc1ccc(cc1)Br)NCc2ccccc2 512a_100015324214_100000755846 [0,1,0,0,0,0|2,0,1]=4 1858 B21R2.19000 O=C(NCCc1ccc(cc1)Br)NNc2ccccc2 273464a_100000755846_100015195140 [0,1,0,0,0,0|3,0,0]=4 1859 B21R2.19000 O=C(NCCc1ccc(cc1)Br)NNc2ccccc2 512a_100000755846_100015195140 [0,1,0,0,0,0|3,0,0]=4 1860 B21R2.19000 O=C(NCCc1ccc(cc1)Br)OCc2ccccc2 271570a_200010239705_100000752885 [0,1,0,0,0,0|2,0,1]=4 1861 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)NCc2ccccc2 2708a_100000185265_100015324214 [0,1,0,0,0,0|2,0,1]=4 1862 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)NCc2ccccc2 2708a_100015324214_100000185265 [0,1,0,0,0,0|2,0,1]=4 1863 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)NCc2ccccc2 273464a_100000185265_100015324214 [0,1,0,0,0,0|2,0,1]=4 1864 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)NCc2ccccc2 273464a_100015324214_100000185265 [0,1,0,0,0,0|2,0,1]=4 1865 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)NCc2ccccc2 512a_100000185265_100015324214 [0,1,0,0,0,0|2,0,1]=4 1866 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)NCc2ccccc2 512a_100015324214_100000185265 [0,1,0,0,0,0|2,0,1]=4 1867 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)NNc2ccccc2 273464a_100000185265_100015195140 [0,1,0,0,0,0|3,0,0]=4 1868 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)NNc2ccccc2 512a_100000185265_100015195140 [0,1,0,0,0,0|3,0,0]=4 1869 B21R2.19000 O=C(NCCc1ccc(cc1)Cl)OCc2ccccc2 271570a_200010239705_100000755918 [0,1,0,0,0,0|2,0,1]=4 1870 B21R2.19000 O=C(NCCc1ccc(cc1)F)NCc2ccccc2 2708a_100000199005_100015324214 [0,1,0,0,0,0|2,0,1]=4 1871 B21R2.19000 O=C(NCCc1ccc(cc1)F)NCc2ccccc2 2708a_100015324214_100000199005 [0,1,0,0,0,0|2,0,1]=4 1872 B21R2.19000 O=C(NCCc1ccc(cc1)F)NCc2ccccc2 273464a_100000199005_100015324214 [0,1,0,0,0,0|2,0,1]=4 1873 B21R2.19000 O=C(NCCc1ccc(cc1)F)NCc2ccccc2 273464a_100015324214_100000199005 [0,1,0,0,0,0|2,0,1]=4 1874 B21R2.19000 O=C(NCCc1ccc(cc1)F)NCc2ccccc2 512a_100000199005_100015324214 [0,1,0,0,0,0|2,0,1]=4 1875 B21R2.19000 O=C(NCCc1ccc(cc1)F)NCc2ccccc2 512a_100015324214_100000199005 [0,1,0,0,0,0|2,0,1]=4 1876 B21R2.19000 O=C(NCCc1ccc(cc1)F)NNc2ccccc2 273464a_100000199005_100015195140 [0,1,0,0,0,0|3,0,0]=4 1877 B21R2.19000 O=C(NCCc1ccc(cc1)F)NNc2ccccc2 512a_100000199005_100015195140 [0,1,0,0,0,0|3,0,0]=4 1878 B21R2.19000 O=C(NCCc1ccc(cc1)F)OCc2ccccc2 271570a_200010239705_100000211213 [0,1,0,0,0,0|2,0,1]=4 1879 B21R2.19000 O=C(NCCc1ccc(cc1)O)NCc2ccccc2 2708a_100000743037_100015324214 [0,1,0,0,0,0|2,0,1]=4 1880 B21R2.19000 O=C(NCCc1ccc(cc1)O)NCc2ccccc2 2708a_100015324214_100000743037 [0,1,0,0,0,0|2,0,1]=4 1881 B21R2.19000 O=C(NCCc1ccc(cc1)O)NCc2ccccc2 273464a_100000743037_100015324214 [0,1,0,0,0,0|2,0,1]=4 1882 B21R2.19000 O=C(NCCc1ccc(cc1)O)NCc2ccccc2 273464a_100015324214_100000743037 [0,1,0,0,0,0|2,0,1]=4 1883 B21R2.19000 O=C(NCCc1ccc(cc1)O)NCc2ccccc2 512a_100015324214_100000743037 [0,1,0,0,0,0|2,0,1]=4 1884 B21R2.19000 O=C(NCCc1ccc(cc1)O)NNc2ccccc2 273464a_100000743037_100015195140 [0,1,0,0,0,0|3,0,0]=4 1885 B21R2.19000 O=C(NCCc1ccc(cc1)O)OCc2ccccc2 271570a_200010239705_100000185759 [0,1,0,0,0,0|2,0,1]=4 1886 B21R2.19000 O=C(NCCc1ccc(cc1)O)OCc2ccccc2 271570a_203496583355_200012059363 [0,1,0,0,0,0|2,0,1]=4 1887 B21R2.27922 CC(CCc1ccccc1)C(=O)CCc2ccccc2 1458a_100011435293_100000765856 [0,1,0,0,0,0|1,0,2]=4 1888 B21R2.27922 CC(CCc1ccccc1)C(=O)NCc2ccccc2 11a_100015324214_100011435293 [0,1,0,0,0,0|2,0,1]=4 1889 B21R2.27922 CC(CCc1ccccc1)C(=O)NCc2ccccc2 1626a_100015324214_100011435293 [0,1,0,0,0,0|2,0,1]=4 1890 B21R2.27922 CC(CCc1ccccc1)C(=O)NCc2ccccc2 240690a_100015324214_100011435293 [0,1,0,0,0,0|2,0,1]=4 1891 B21R2.27922 CC(CCc1ccccc1)C(=O)NCc2ccccc2 527a_100015324214_100011435293 [0,1,0,0,0,0|2,0,1]=4 1892 B21R2.27922 CC(CCc1ccccc1)C(=O)NNc2ccccc2 22a_100015195140_100011435293 [0,1,0,0,0,0|3,0,0]=4 1893 B21R2.27922 CN(CCc1ccccc1)C(=O)C#Cc2ccccc2 240690a_100000207497_100000736102 [0,1,0,0,0,0|1,0,2]=4 1894 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2 11a_100000207497_100000210462 [0,1,0,0,0,0|1,0,0]=2 1895 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2 1626a_100000207497_100000210462 [0,1,0,0,0,0|1,0,0]=2 1896 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccccn2 11a_100000207497_100000740811 [0,1,0,0,0,0|2,0,0]=3 1897 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccccn2 240690a_100000207497_100000740811 [0,1,0,0,0,0|2,0,0]=3 1898 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2cccnc2 11a_100000207497_100000735890 [0,1,0,0,0,0|2,0,0]=3 1899 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2cccnc2 240690a_100000207497_100000735890 [0,1,0,0,0,0|2,0,0]=3 1900 B21R2.27922 CN(CCc1ccccc1)C(=O)C=Cc2ccncc2 240690a_100000207497_100000682801 [0,1,0,0,0,0|2,0,0]=3 1901 B21R2.27922 CN(CCc1ccccc1)C(=O)CCc2ccccc2 11a_100000207497_100000185753 [0,1,0,0,0,0|1,0,2]=4 1902 B21R2.27922 CN(CCc1ccccc1)C(=O)CCc2ccccc2 1626a_100000207497_100000185753 [0,1,0,0,0,0|1,0,2]=4 1903 B21R2.27922 CN(CCc1ccccc1)C(=O)CCc2ccccc2 240690a_100000207497_100000185753 [0,1,0,0,0,0|1,0,2]=4 1904 B21R2.27922 CN(CCc1ccccc1)C(=O)CCc2ccccc2 527a_100000207497_100000185753 [0,1,0,0,0,0|1,0,2]=4 1905 B21R2.27922 CN(CCc1ccccc1)C(=O)COc2ccccc2 11a_100000207497_100000186222 [0,1,0,0,0,0|2,0,1]=4 1906 B21R2.27922 CN(CCc1ccccc1)C(=O)COc2ccccc2 1626a_100000207497_100000186222 [0,1,0,0,0,0|2,0,1]=4 1907 B21R2.27922 CN(CCc1ccccc1)C(=O)COc2ccccc2 240690a_100000207497_100000186222 [0,1,0,0,0,0|2,0,1]=4 1908 B21R2.27922 CN(CCc1ccccc1)C(=O)COc2ccccc2 527a_100000207497_100000186222 [0,1,0,0,0,0|2,0,1]=4 1909 B21R2.27922 CN(CCc1ccccc1)C(=O)CSc2ccccc2 11a_100000207497_100000211596 [0,1,0,0,0,0|2,0,1]=4 1910 B21R2.27922 CN(CCc1ccccc1)C(=O)CSc2ccccc2 1626a_100000207497_100000211596 [0,1,0,0,0,0|2,0,1]=4 1911 B21R2.27922 CN(CCc1ccccc1)C(=O)CSc2ccccc2 240690a_100000207497_100000211596 [0,1,0,0,0,0|2,0,1]=4 1912 B21R2.27922 CN(CCc1ccccc1)C(=O)CSc2ccccc2 527a_100000207497_100000211596 [0,1,0,0,0,0|2,0,1]=4 1913 B21R2.27922 CN(CCc1ccccc1)C(=O)NCc2ccccc2 2708a_100015324214_100000207497 [0,1,0,0,0,0|2,0,1]=4 1914 B21R2.27922 CN(CCc1ccccc1)C(=O)NCc2ccccc2 273464a_100015324214_100000207497 [0,1,0,0,0,0|2,0,1]=4 1915 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2 11a_100000737206_100000210462 [0,1,0,0,0,0|2,0,0]=3 1916 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2 1626a_100000737206_100000210462 [0,1,0,0,0,0|2,0,0]=3 1917 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2ccccn2 11a_100000737206_100000740811 [0,1,0,0,0,0|3,0,0]=4 1918 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2ccccn2 240690a_100000737206_100000740811 [0,1,0,0,0,0|3,0,0]=4 1919 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2cccnc2 11a_100000737206_100000735890 [0,1,0,0,0,0|3,0,0]=4 1920 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2cccnc2 240690a_100000737206_100000735890 [0,1,0,0,0,0|3,0,0]=4 1921 B21R2.27922 CN(CCc1ccccn1)C(=O)C=Cc2ccncc2 240690a_100000737206_100000682801 [0,1,0,0,0,0|3,0,0]=4 1922 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2 11a_100000763209_100000210462 [0,1,0,0,0,0|2,0,0]=3 1923 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2 1626a_100000763209_100000210462 [0,1,0,0,0,0|2,0,0]=3 1924 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2ccccn2 11a_100000763209_100000740811 [0,1,0,0,0,0|3,0,0]=4 1925 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2ccccn2 240690a_100000763209_100000740811 [0,1,0,0,0,0|3,0,0]=4 1926 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2cccnc2 11a_100000763209_100000735890 [0,1,0,0,0,0|3,0,0]=4 1927 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2cccnc2 240690a_100000763209_100000735890 [0,1,0,0,0,0|3,0,0]=4 1928 B21R2.27922 CN(CCc1cccnc1)C(=O)C=Cc2ccncc2 240690a_100000763209_100000682801 [0,1,0,0,0,0|3,0,0]=4 1929 B21R2.27922 CN(CCc1ccncc1)C(=O)C=Cc2ccccc2 11a_100000742850_100000210462 [0,1,0,0,0,0|2,0,0]=3 1930 B21R2.27922 CN(CCc1ccncc1)C(=O)C=Cc2ccccn2 11a_100000742850_100000740811 [0,1,0,0,0,0|3,0,0]=4 1931 B21R2.27922 CN(CCc1ccncc1)C(=O)C=Cc2ccccn2 240690a_100000742850_100000740811 [0,1,0,0,0,0|3,0,0]=4 1932 B21R2.27922 CN(CCc1ccncc1)C(=O)C=Cc2cccnc2 11a_100000742850_100000735890 [0,1,0,0,0,0|3,0,0]=4 1933 B21R2.27922 CN(CCc1ccncc1)C(=O)C=Cc2cccnc2 240690a_100000742850_100000735890 [0,1,0,0,0,0|3,0,0]=4 1934 B21R2.27922 CN(CCc1ccncc1)C(=O)C=Cc2ccncc2 240690a_100000742850_100000682801 [0,1,0,0,0,0|3,0,0]=4 1935 B21R2.27922 O=C(CCc1ccccc1)C(O)CCc2ccccc2 1458a_100000242596_100000765856 [0,1,0,0,0,0|1,0,2]=4 1936 B21R2.27922 O=C(NCc1ccccc1)C(O)CCc2ccccc2 240690a_100015324214_100000242596 [0,1,0,0,0,0|2,0,1]=4 1937 B21R2.27922 O=C(NNc1ccccc1)C(O)CCc2ccccc2 22a_100015195140_100000242596 [0,1,0,0,0,0|3,0,0]=4 1938 B21R2.27923 CC(CNC(=O)C#Cc1ccccc1)c2ccccc2 240690a_100000701038_100000736102 [0,1,0,0,0,0|1,0,2]=4 1939 B21R2.27923 CC(CNC(=O)C=Cc1ccccc1)c2ccccc2 11a_100000701038_100000210462 [0,1,0,0,0,0|1,0,0]=2 1940 B21R2.27923 CC(CNC(=O)C=Cc1ccccc1)c2ccccc2 1626a_100000701038_100000210462 [0,1,0,0,0,0|1,0,0]=2 1941 B21R2.27923 CC(CNC(=O)C=Cc1ccccn1)c2ccccc2 11a_100000701038_100000740811 [0,1,0,0,0,0|2,0,0]=3 1942 B21R2.27923 CC(CNC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100000701038_100000740811 [0,1,0,0,0,0|2,0,0]=3 1943 B21R2.27923 CC(CNC(=O)C=Cc1cccnc1)c2ccccc2 11a_100000701038_100000735890 [0,1,0,0,0,0|2,0,0]=3 1944 B21R2.27923 CC(CNC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100000701038_100000735890 [0,1,0,0,0,0|2,0,0]=3 1945 B21R2.27923 CC(CNC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100000701038_100000682801 [0,1,0,0,0,0|2,0,0]=3 1946 B21R2.27923 CC(CNC(=O)CCc1ccccc1)c2ccccc2 11a_100000701038_100000185753 [0,1,0,0,0,0|1,0,2]=4 1947 B21R2.27923 CC(CNC(=O)CCc1ccccc1)c2ccccc2 1626a_100000701038_100000185753 [0,1,0,0,0,0|1,0,2]=4 1948 B21R2.27923 CC(CNC(=O)CCc1ccccc1)c2ccccc2 240690a_100000701038_100000185753 [0,1,0,0,0,0|1,0,2]=4 1949 B21R2.27923 CC(CNC(=O)CCc1ccccc1)c2ccccc2 527a_100000701038_100000185753 [0,1,0,0,0,0|1,0,2]=4 1950 B21R2.27923 CC(CNC(=O)COc1ccccc1)c2ccccc2 11a_100000701038_100000186222 [0,1,0,0,0,0|2,0,1]=4 1951 B21R2.27923 CC(CNC(=O)COc1ccccc1)c2ccccc2 1626a_100000701038_100000186222 [0,1,0,0,0,0|2,0,1]=4 1952 B21R2.27923 CC(CNC(=O)COc1ccccc1)c2ccccc2 240690a_100000701038_100000186222 [0,1,0,0,0,0|2,0,1]=4 1953 B21R2.27923 CC(CNC(=O)COc1ccccc1)c2ccccc2 527a_100000701038_100000186222 [0,1,0,0,0,0|2,0,1]=4 1954 B21R2.27923 CC(CNC(=O)CSc1ccccc1)c2ccccc2 11a_100000701038_100000211596 [0,1,0,0,0,0|2,0,1]=4 1955 B21R2.27923 CC(CNC(=O)CSc1ccccc1)c2ccccc2 1626a_100000701038_100000211596 [0,1,0,0,0,0|2,0,1]=4 1956 B21R2.27923 CC(CNC(=O)CSc1ccccc1)c2ccccc2 240690a_100000701038_100000211596 [0,1,0,0,0,0|2,0,1]=4 1957 B21R2.27923 CC(CNC(=O)CSc1ccccc1)c2ccccc2 527a_100000701038_100000211596 [0,1,0,0,0,0|2,0,1]=4 1958 B21R2.27923 CC(CNC(=O)NCc1ccccc1)c2ccccc2 2708a_100000701038_100015324214 [0,1,0,0,0,0|2,0,1]=4 1959 B21R2.27923 CC(CNC(=O)NCc1ccccc1)c2ccccc2 2708a_100015324214_100000701038 [0,1,0,0,0,0|2,0,1]=4 1960 B21R2.27923 CC(CNC(=O)NCc1ccccc1)c2ccccc2 273464a_100000701038_100015324214 [0,1,0,0,0,0|2,0,1]=4 1961 B21R2.27923 CC(CNC(=O)NCc1ccccc1)c2ccccc2 273464a_100015324214_100000701038 [0,1,0,0,0,0|2,0,1]=4 1962 B21R2.27923 CC(CNC(=O)NCc1ccccc1)c2ccccc2 512a_100015324214_100000701038 [0,1,0,0,0,0|2,0,1]=4 1963 B21R2.27923 CC(CNC(=O)NNc1ccccc1)c2ccccc2 273464a_100000701038_100015195140 [0,1,0,0,0,0|3,0,0]=4 1964 B21R2.27923 O=C(C#Cc1ccccc1)CC[C@@H](O)c2ccccc2 1458a_100000736102_100000729684 [0,1,0,0,0,0|1,0,2]=4 1965 B21R2.27923 O=C(C#Cc1ccccc1)NCC(O)c2ccccc2 240690a_100000210709_100000736102 [0,1,0,0,0,0|1,0,2]=4 1966 B21R2.27923 O=C(C=Cc1ccccc1)CCC(=O)c2ccccc2 1458a_100000210462_100000750707 [0,1,0,0,0,0|1,0,1]=3 1967 B21R2.27923 O=C(C=Cc1ccccc1)CC[C@@H](O)c2ccccc2 1458a_100000210462_100000729684 [0,1,0,0,0,0|1,0,0]=2 1968 B21R2.27923 O=C(C=Cc1ccccc1)COC(=O)c2ccccc2 1458a_100000210462_100000073877 [0,1,0,0,0,0|2,0,1]=4 1969 B21R2.27923 O=C(C=Cc1ccccc1)NNC(=O)c2ccccc2 22a_100000184135_100000210462 [0,1,0,0,0,0|2,0,1]=4 1970 B21R2.27923 O=C(C=Cc1ccccn1)CCC(=O)c2ccccc2 1458a_100000740811_100000750707 [0,1,0,0,0,0|2,0,1]=4 1971 B21R2.27923 O=C(C=Cc1ccccn1)CC[C@@H](O)c2ccccc2 1458a_100000740811_100000729684 [0,1,0,0,0,0|2,0,0]=3 1972 B21R2.27923 O=C(C=Cc1ccccn1)NCC(O)c2ccccc2 240690a_100000210709_100000740811 [0,1,0,0,0,0|2,0,0]=3 1973 B21R2.27923 O=C(C=Cc1ccccn1)NCC(O)c2ccccn2 240690a_100000691469_100000740811 [0,1,0,0,0,0|3,0,0]=4 1974 B21R2.27923 O=C(C=Cc1ccccn1)NCC(O)c2cccnc2 240690a_100020605170_100000740811 [0,1,0,0,0,0|3,0,0]=4 1975 B21R2.27923 O=C(C=Cc1cccnc1)CCC(=O)c2ccccc2 1458a_100000735890_100000750707 [0,1,0,0,0,0|2,0,1]=4 1976 B21R2.27923 O=C(C=Cc1cccnc1)CC[C@@H](O)c2ccccc2 1458a_100000735890_100000729684 [0,1,0,0,0,0|2,0,0]=3 1977 B21R2.27923 O=C(C=Cc1cccnc1)NCC(O)c2ccccc2 240690a_100000210709_100000735890 [0,1,0,0,0,0|2,0,0]=3 1978 B21R2.27923 O=C(C=Cc1cccnc1)NCC(O)c2ccccn2 240690a_100000691469_100000735890 [0,1,0,0,0,0|3,0,0]=4 1979 B21R2.27923 O=C(C=Cc1cccnc1)NCC(O)c2cccnc2 240690a_100020605170_100000735890 [0,1,0,0,0,0|3,0,0]=4 1980 B21R2.27923 O=C(C=Cc1ccncc1)CCC(=O)c2ccccc2 1458a_100000682801_100000750707 [0,1,0,0,0,0|2,0,1]=4 1981 B21R2.27923 O=C(C=Cc1ccncc1)CC[C@@H](O)c2ccccc2 1458a_100000682801_100000729684 [0,1,0,0,0,0|2,0,0]=3 1982 B21R2.27923 O=C(C=Cc1ccncc1)NCC(O)c2ccccc2 240690a_100000210709_100000682801 [0,1,0,0,0,0|2,0,0]=3 1983 B21R2.27923 O=C(C=Cc1ccncc1)NCC(O)c2ccccn2 240690a_100000691469_100000682801 [0,1,0,0,0,0|3,0,0]=4 1984 B21R2.27923 O=C(C=Cc1ccncc1)NCC(O)c2cccnc2 240690a_100020605170_100000682801 [0,1,0,0,0,0|3,0,0]=4 1985 B21R2.27923 O=C(CC[C@@H](O)c1ccccc1)COc2ccccc2 1458a_100000186222_100000729684 [0,1,0,0,0,0|2,0,1]=4 1986 B21R2.27923 O=C(CC[C@@H](O)c1ccccc1)CSc2ccccc2 1458a_100000211596_100000729684 [0,1,0,0,0,0|2,0,1]=4 1987 B21R2.27923 O=C(CCc1ccccc1)CC[C@@H](O)c2ccccc2 1458a_100000185753_100000729684 [0,1,0,0,0,0|1,0,2]=4 1988 B21R2.27923 O=C(CCc1ccccc1)NCC(O)c2ccccc2 240690a_100000210709_100000185753 [0,1,0,0,0,0|1,0,2]=4 1989 B21R2.27923 O=C(CCc1ccccc1)NCC(O)c2ccccc2 527a_100000210709_100000185753 [0,1,0,0,0,0|1,0,2]=4 1990 B21R2.27923 O=C(COc1ccccc1)NCC(O)c2ccccc2 240690a_100000210709_100000186222 [0,1,0,0,0,0|2,0,1]=4 1991 B21R2.27923 O=C(COc1ccccc1)NCC(O)c2ccccc2 527a_100000210709_100000186222 [0,1,0,0,0,0|2,0,1]=4 1992 B21R2.27923 O=C(CSc1ccccc1)NCC(O)c2ccccc2 240690a_100000210709_100000211596 [0,1,0,0,0,0|2,0,1]=4 1993 B21R2.27923 O=C(CSc1ccccc1)NCC(O)c2ccccc2 527a_100000210709_100000211596 [0,1,0,0,0,0|2,0,1]=4 1994 B21R2.27923 O=C(NCC(O)c1ccccc1)NNc2ccccc2 273464a_100000210709_100015195140 [0,1,0,0,0,0|3,0,0]=4 1995 B21R2.27923 O=C(NCc1ccccc1)NCC(O)c2ccccc2 2708a_100015324214_100000210709 [0,1,0,0,0,0|2,0,1]=4 1996 B21R2.27923 O=C(NCc1ccccc1)NCC(O)c2ccccc2 273464a_100000210709_100015324214 [0,1,0,0,0,0|2,0,1]=4 1997 B21R2.27923 O=C(NCc1ccccc1)NCC(O)c2ccccc2 273464a_100015324214_100000210709 [0,1,0,0,0,0|2,0,1]=4 1998 B21R2.27923 O=C(NCc1ccccc1)NCC(O)c2ccccc2 512a_100015324214_100000210709 [0,1,0,0,0,0|2,0,1]=4 1999 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2 11a_100000238496_100000210462 [0,1,0,0,0,0|2,0,0]=3 2000 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2 1626a_100000238496_100000210462 [0,1,0,0,0,0|2,0,0]=3 2001 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2ccccn2 11a_100000238496_100000740811 [0,1,0,0,0,0|3,0,0]=4 2002 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2ccccn2 240690a_100000238496_100000740811 [0,1,0,0,0,0|3,0,0]=4 2003 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2cccnc2 11a_100000238496_100000735890 [0,1,0,0,0,0|3,0,0]=4 2004 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2cccnc2 240690a_100000238496_100000735890 [0,1,0,0,0,0|3,0,0]=4 2005 B21R2.27926 CC(Cc1ccccn1)NC(=O)C=Cc2ccncc2 240690a_100000238496_100000682801 [0,1,0,0,0,0|3,0,0]=4 2006 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2 11a_100011207255_100000210462 [0,1,0,0,0,0|2,0,0]=3 2007 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2 1626a_100011207255_100000210462 [0,1,0,0,0,0|2,0,0]=3 2008 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2ccccn2 11a_100011207255_100000740811 [0,1,0,0,0,0|3,0,0]=4 2009 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2ccccn2 240690a_100011207255_100000740811 [0,1,0,0,0,0|3,0,0]=4 2010 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2cccnc2 11a_100011207255_100000735890 [0,1,0,0,0,0|3,0,0]=4 2011 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2cccnc2 240690a_100011207255_100000735890 [0,1,0,0,0,0|3,0,0]=4 2012 B21R2.27926 CC(Cc1cccnc1)NC(=O)C=Cc2ccncc2 240690a_100011207255_100000682801 [0,1,0,0,0,0|3,0,0]=4 2013 B21R2.27926 CC(Cc1cnccn1)NC(=O)C=Cc2ccccc2 11a_100011277835_100000210462 [0,1,0,0,0,0|3,0,0]=4 2014 B21R2.27926 CC(Cc1cnccn1)NC(=O)C=Cc2ccccc2 1626a_100011277835_100000210462 [0,1,0,0,0,0|3,0,0]=4 2015 B21R2.27926 CC(OC(=O)OCc1ccccc1)Sc2ccccc2 62a_100000719477_200015597219 [0,1,0,0,0,0|2,0,1]=4 2016 B21R2.27926 CC(OC(=O)OCc1ccccc1)Sc2ccccc2 62a_200015597219_100000041952 [0,1,0,0,0,0|2,0,1]=4 2017 B21R2.27926 O=C(C=Cc1ccccc1)CC(=O)Cc2ccccc2 1458a_100000210462_100000233483 [0,1,0,0,0,0|1,0,1]=3 2018 B21R2.27926 O=C(C=Cc1ccccc1)CC(=O)Nc2ccccc2 1458a_100000210462_100000182850 [0,1,0,0,0,0|2,0,1]=4 2019 B21R2.27926 O=C(C=Cc1ccccc1)CC(=O)Oc2ccccc2 1458a_100000210462_100009813826 [0,1,0,0,0,0|2,0,1]=4 2020 B21R2.27926 O=C(C=Cc1ccccn1)CC(=O)Cc2ccccc2 1458a_100000740811_100000233483 [0,1,0,0,0,0|2,0,1]=4 2021 B21R2.27926 O=C(C=Cc1cccnc1)CC(=O)Cc2ccccc2 1458a_100000735890_100000233483 [0,1,0,0,0,0|2,0,1]=4 2022 B21R2.27926 O=C(C=Cc1ccncc1)CC(=O)Cc2ccccc2 1458a_100000682801_100000233483 [0,1,0,0,0,0|2,0,1]=4 2023 B21R2.221980 CC(=NNCc1ccccc1)C=Cc2cccc(c2)Br 4a_100000007032_200016266566 [0,1,0,0,0,0|3,0,0]=4 2024 B21R2.221980 CC(=NNCc1ccccc1)C=Cc2cccc(c2)Cl 4a_100000007032_200016280735 [0,1,0,0,0,0|3,0,0]=4 2025 B21R2.221980 C[n+]1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100009996589_200000077782 [0,1,0,0,0,0|2,0,1]=4 2026 B21R2.221980 C[n+]1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100009996589 [0,1,0,0,0,0|2,0,1]=4 2027 B21R2.221980 Cc1cc(ccn1)OCC(=O)OCCc2ccccc2 34a_100000688365_200000077782 [0,1,0,0,0,0|2,0,1]=4 2028 B21R2.221980 Cc1cc(ccn1)SCC(=O)OCCc2ccccc2 62a_100000758586_200000077782 [0,1,0,0,0,0|2,0,1]=4 2029 B21R2.221980 Cc1cc(ccn1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000758586 [0,1,0,0,0,0|2,0,1]=4 2030 B21R2.221980 Cc1cccc(c1)C#CC(=O)CCCc2ccccc2 1458a_100011892726_100000211621 [0,1,0,0,0,0|1,0,2]=4 2031 B21R2.221980 Cc1cccc(c1)C#CC(=O)NCCc2ccccc2 240690a_100000106460_100011892726 [0,1,0,0,0,0|1,0,2]=4 2032 B21R2.221980 Cc1cccc(c1)C=CC(=O)C/C=C/c2ccccc2 1458a_100000690095_100016265936 [0,1,0,0,0,0|1,0,2]=4 2033 B21R2.221980 Cc1cccc(c1)C=CC(=O)CC#Cc2ccccc2 1458a_100000690095_100011352542 [0,1,0,0,0,0|1,0,2]=4 2034 B21R2.221980 Cc1cccc(c1)C=CC(=O)CCCc2ccccc2 1458a_100000690095_100000211621 [0,1,0,0,0,0|1,0,0]=2 2035 B21R2.221980 Cc1cccc(c1)C=CC(=O)CCOc2ccccc2 1458a_100000690095_100000184471 [0,1,0,0,0,0|2,0,0]=3 2036 B21R2.221980 Cc1cccc(c1)C=CC(=O)CCSc2ccccc2 1458a_100000690095_100000246102 [0,1,0,0,0,0|2,0,0]=3 2037 B21R2.221980 Cc1cccc(c1)C=CC(=O)CSCc2ccccc2 1458a_100000690095_200011217039 [0,1,0,0,0,0|2,0,0]=3 2038 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000690095 [0,1,0,0,0,0|1,0,0]=2 2039 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000690095 [0,1,0,0,0,0|1,0,0]=2 2040 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000690095 [0,1,0,0,0,0|1,0,0]=2 2041 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000690095 [0,1,0,0,0,0|2,0,0]=3 2042 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000690095 [0,1,0,0,0,0|2,0,0]=3 2043 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100000690095 [0,1,0,0,0,0|2,0,0]=3 2044 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000690095 [0,1,0,0,0,0|2,0,0]=3 2045 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000690095 [0,1,0,0,0,0|2,0,0]=3 2046 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100000690095 [0,1,0,0,0,0|2,0,0]=3 2047 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000690095 [0,1,0,0,0,0|2,0,0]=3 2048 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000690095 [0,1,0,0,0,0|2,0,0]=3 2049 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100000690095 [0,1,0,0,0,0|2,0,0]=3 2050 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cnccn2 11a_100000723456_100000690095 [0,1,0,0,0,0|3,0,0]=4 2051 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cnccn2 1626a_100000723456_100000690095 [0,1,0,0,0,0|3,0,0]=4 2052 B21R2.221980 Cc1cccc(c1)C=CC(=O)NCCc2cnccn2 240690a_100000723456_100000690095 [0,1,0,0,0,0|3,0,0]=4 2053 B21R2.221980 Cc1cccc(c1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000690095 [0,1,0,0,0,0|2,0,0]=3 2054 B21R2.221980 Cc1cccc(c1)C=CC(=O)NNCc2ccccn2 22a_100000736832_100000690095 [0,1,0,0,0,0|3,0,0]=4 2055 B21R2.221980 Cc1cccc(c1)C=CC(=O)NNCc2cccnc2 22a_100000738295_100000690095 [0,1,0,0,0,0|3,0,0]=4 2056 B21R2.221980 Cc1cccc(c1)C=CC(=O)NNCc2ccncc2 22a_100000736929_100000690095 [0,1,0,0,0,0|3,0,0]=4 2057 B21R2.221980 Cc1cccc(c1)CCC(=O)CCCc2ccccc2 1458a_100000234952_100000211621 [0,1,0,0,0,0|1,0,2]=4 2058 B21R2.221980 Cc1cccc(c1)CCC(=O)CCCc2ccccc2 1458a_100011207963_100011713685 [0,1,0,0,0,0|1,0,2]=4 2059 B21R2.221980 Cc1cccc(c1)CCC(=O)NCCc2ccccc2 11a_100000106460_100000234952 [0,1,0,0,0,0|1,0,2]=4 2060 B21R2.221980 Cc1cccc(c1)CCC(=O)NCCc2ccccc2 1626a_100000106460_100000234952 [0,1,0,0,0,0|1,0,2]=4 2061 B21R2.221980 Cc1cccc(c1)CCC(=O)NCCc2ccccc2 240690a_100000106460_100000234952 [0,1,0,0,0,0|1,0,2]=4 2062 B21R2.221980 Cc1cccc(c1)CCC(=O)NCCc2ccccc2 527a_100000106460_100000234952 [0,1,0,0,0,0|1,0,2]=4 2063 B21R2.221980 Cc1cccc(c1)CNC(=O)CCCc2ccccc2 11a_100000185548_100011207963 [0,1,0,0,0,0|2,0,1]=4 2064 B21R2.221980 Cc1cccc(c1)CNC(=O)CCCc2ccccc2 1626a_100000185548_100011207963 [0,1,0,0,0,0|2,0,1]=4 2065 B21R2.221980 Cc1cccc(c1)CNC(=O)CCCc2ccccc2 240690a_100000185548_100011207963 [0,1,0,0,0,0|2,0,1]=4 2066 B21R2.221980 Cc1cccc(c1)CNC(=O)CCCc2ccccc2 527a_100000185548_100011207963 [0,1,0,0,0,0|2,0,1]=4 2067 B21R2.221980 Cc1cccc(c1)CNC(=O)NCCc2ccccc2 2708a_100000106460_100000185548 [0,1,0,0,0,0|2,0,1]=4 2068 B21R2.221980 Cc1cccc(c1)CNC(=O)NCCc2ccccc2 2708a_100000185548_100000106460 [0,1,0,0,0,0|2,0,1]=4 2069 B21R2.221980 Cc1cccc(c1)CNC(=O)NCCc2ccccc2 273464a_100000106460_100000185548 [0,1,0,0,0,0|2,0,1]=4 2070 B21R2.221980 Cc1cccc(c1)CNC(=O)NCCc2ccccc2 273464a_100000185548_100000106460 [0,1,0,0,0,0|2,0,1]=4 2071 B21R2.221980 Cc1cccc(c1)CNC(=O)NCCc2ccccc2 512a_100000106460_100000185548 [0,1,0,0,0,0|2,0,1]=4 2072 B21R2.221980 Cc1cccc(c1)CNC(=O)NCCc2ccccc2 512a_100000185548_100000106460 [0,1,0,0,0,0|2,0,1]=4 2073 B21R2.221980 Cc1cccc(c1)NCC(=O)NCCc2ccccc2 2230a_100000188690_100000183012 [0,1,0,0,0,0|2,0,1]=4 2074 B21R2.221980 Cc1cccc(c1)NCC(=O)NCCc2ccccc2 34a_100000188690_100000183012 [0,1,0,0,0,0|2,0,1]=4 2075 B21R2.221980 Cc1cccc(c1)NCC(=O)OCCc2ccccc2 2230a_100000188690_200000077782 [0,1,0,0,0,0|1,0,1]=3 2076 B21R2.221980 Cc1cccc(c1)NCC(=O)OCCc2ccccc2 34a_100000188690_200000077782 [0,1,0,0,0,0|1,0,1]=3 2077 B21R2.221980 Cc1cccc(c1)NNC(=O)CCCc2ccccc2 22a_100000681630_100011207963 [0,1,0,0,0,0|3,0,0]=4 2078 B21R2.221980 Cc1cccc(c1)NNC(=O)NCCc2ccccc2 273464a_100000106460_100000681630 [0,1,0,0,0,0|3,0,0]=4 2079 B21R2.221980 Cc1cccc(c1)NNC(=O)NCCc2ccccc2 512a_100000106460_100000681630 [0,1,0,0,0,0|3,0,0]=4 2080 B21R2.221980 Cc1cccc(c1)NNC(=O)NCCc2ccccc2 512a_100000681630_100000106460 [0,1,0,0,0,0|3,0,0]=4 2081 B21R2.221980 Cc1cccc(c1)OCC(=O)CCCc2ccccc2 1458a_100000183606_100000211621 [0,1,0,0,0,0|2,0,1]=4 2082 B21R2.221980 Cc1cccc(c1)OCC(=O)NCCc2ccccc2 11a_100000106460_100000183606 [0,1,0,0,0,0|2,0,1]=4 2083 B21R2.221980 Cc1cccc(c1)OCC(=O)NCCc2ccccc2 1626a_100000106460_100000183606 [0,1,0,0,0,0|2,0,1]=4 2084 B21R2.221980 Cc1cccc(c1)OCC(=O)NCCc2ccccc2 240690a_100000106460_100000183606 [0,1,0,0,0,0|2,0,1]=4 2085 B21R2.221980 Cc1cccc(c1)OCC(=O)NCCc2ccccc2 34a_100000210337_100000183012 [0,1,0,0,0,0|2,0,1]=4 2086 B21R2.221980 Cc1cccc(c1)OCC(=O)NCCc2ccccc2 527a_100000106460_100000183606 [0,1,0,0,0,0|2,0,1]=4 2087 B21R2.221980 Cc1cccc(c1)OCC(=O)NCCc2ccccc2 7a_100000210337_100000183012 [0,1,0,0,0,0|2,0,1]=4 2088 B21R2.221980 Cc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000210337_200000077782 [0,1,0,0,0,0|1,0,1]=3 2089 B21R2.221980 Cc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100000210337_200000077782 [0,1,0,0,0,0|1,0,1]=3 2090 B21R2.221980 Cc1cccc(c1)SCC(=O)NCCc2ccccc2 62a_100000183012_100011215228 [0,1,0,0,0,0|2,0,1]=4 2091 B21R2.221980 Cc1cccc(c1)SCC(=O)NCCc2ccccc2 62a_100011215228_100000183012 [0,1,0,0,0,0|2,0,1]=4 2092 B21R2.221980 Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100011215228_200000077782 [0,1,0,0,0,0|1,0,1]=3 2093 B21R2.221980 Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100011215228 [0,1,0,0,0,0|1,0,1]=3 2094 B21R2.221980 Cc1cccc(n1)SCC(=O)OCCc2ccccc2 62a_100000742759_200000077782 [0,1,0,0,0,0|2,0,1]=4 2095 B21R2.221980 Cc1cccc(n1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000742759 [0,1,0,0,0,0|2,0,1]=4 2096 B21R2.221980 Cc1ccnc(c1)SCC(=O)OCCc2ccccc2 62a_100000750283_200000077782 [0,1,0,0,0,0|2,0,1]=4 2097 B21R2.221980 Cc1ccnc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000750283 [0,1,0,0,0,0|2,0,1]=4 2098 B21R2.221980 Cc1cncc(c1)C=CC(=O)COCc2ccccc2 6a_100011998712_100011215004 [0,1,0,0,0,0|3,0,0]=4 2099 B21R2.221980 Cc1cncc(c1)C=CC(=O)CSCc2ccccc2 6a_100011998712_100000172147 [0,1,0,0,0,0|3,0,0]=4 2100 B21R2.221980 Cc1cncc(c1)OCC(=O)OCCc2ccccc2 34a_100011830280_200000077782 [0,1,0,0,0,0|2,0,1]=4 2101 B21R2.221980 Cc1cncc(c1)OCC(=O)OCCc2ccccc2 7a_100011830280_200000077782 [0,1,0,0,0,0|2,0,1]=4 2102 B21R2.221980 Cc1cncc(c1)SCC(=O)OCCc2ccccc2 62a_100000760492_200000077782 [0,1,0,0,0,0|2,0,1]=4 2103 B21R2.221980 Cc1cncc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000760492 [0,1,0,0,0,0|2,0,1]=4 2104 B21R2.221980 Nc1cc(ccn1)OCC(=O)OCCc2ccccc2 34a_100011834064_200000077782 [0,1,0,0,0,0|2,0,1]=4 2105 B21R2.221980 Nc1cc(ccn1)SCC(=O)OCCc2ccccc2 62a_100000049665_200000077782 [0,1,0,0,0,0|2,0,1]=4 2106 B21R2.221980 Nc1cc(ccn1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000049665 [0,1,0,0,0,0|2,0,1]=4 2107 B21R2.221980 Nc1cccc(c1)OCC(=O)NCCc2ccccc2 34a_100000210217_100000183012 [0,1,0,0,0,0|2,0,1]=4 2108 B21R2.221980 Nc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000210217_200000077782 [0,1,0,0,0,0|1,0,1]=3 2109 B21R2.221980 Nc1cccc(c1)SCC(=O)NCCc2ccccc2 62a_100000183012_100000210019 [0,1,0,0,0,0|2,0,1]=4 2110 B21R2.221980 Nc1cccc(c1)SCC(=O)NCCc2ccccc2 62a_100000210019_100000183012 [0,1,0,0,0,0|2,0,1]=4 2111 B21R2.221980 Nc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100000210019_200000077782 [0,1,0,0,0,0|1,0,1]=3 2112 B21R2.221980 Nc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000210019 [0,1,0,0,0,0|1,0,1]=3 2113 B21R2.221980 Nc1cccc(n1)SCC(=O)OCCc2ccccc2 62a_100000740741_200000077782 [0,1,0,0,0,0|2,0,1]=4 2114 B21R2.221980 Nc1cccc(n1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000740741 [0,1,0,0,0,0|2,0,1]=4 2115 B21R2.221980 Nc1ccnc(c1)SCC(=O)OCCc2ccccc2 62a_100009814236_200000077782 [0,1,0,0,0,0|2,0,1]=4 2116 B21R2.221980 Nc1ccnc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100009814236 [0,1,0,0,0,0|2,0,1]=4 2117 B21R2.221980 Nc1cncc(c1)OCC(=O)OCCc2ccccc2 34a_100011997051_200000077782 [0,1,0,0,0,0|2,0,1]=4 2118 B21R2.221980 Nc1cncc(c1)SCC(=O)OCCc2ccccc2 62a_100000687067_200000077782 [0,1,0,0,0,0|2,0,1]=4 2119 B21R2.221980 Nc1cncc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000687067 [0,1,0,0,0,0|2,0,1]=4 2120 B21R2.221980 O=C(C#Cc1cccc(c1)Br)CCCc2ccccc2 1458a_100012100324_100000211621 [0,1,0,0,0,0|1,0,2]=4 2121 B21R2.221980 O=C(C#Cc1cccc(c1)Cl)CCCc2ccccc2 1458a_100011892777_100000211621 [0,1,0,0,0,0|1,0,2]=4 2122 B21R2.221980 O=C(C#Cc1cccc(c1)Cl)NCCc2ccccc2 240690a_100000106460_100011892777 [0,1,0,0,0,0|1,0,2]=4 2123 B21R2.221980 O=C(C#Cc1cccc(c1)F)CCCc2ccccc2 1458a_100011892744_100000211621 [0,1,0,0,0,0|1,0,2]=4 2124 B21R2.221980 O=C(C#Cc1cccc(c1)F)NCCc2ccccc2 240690a_100000106460_100011892744 [0,1,0,0,0,0|1,0,2]=4 2125 B21R2.221980 O=C(C#Cc1cccc(c1)O)CCCc2ccccc2 1458a_200009909484_100000211621 [0,1,0,0,0,0|1,0,2]=4 2126 B21R2.221980 O=C(C=Cc1cccc(c1)Br)C/C=C/c2ccccc2 1458a_100016258244_100016265936 [0,1,0,0,0,0|1,0,2]=4 2127 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CC#Cc2ccccc2 1458a_100016258244_100011352542 [0,1,0,0,0,0|1,0,2]=4 2128 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CCCc2ccccc2 1458a_100016258244_100000211621 [0,1,0,0,0,0|1,0,0]=2 2129 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CCOc2ccccc2 1458a_100016258244_100000184471 [0,1,0,0,0,0|2,0,0]=3 2130 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CCSc2ccccc2 1458a_100016258244_100000246102 [0,1,0,0,0,0|2,0,0]=3 2131 B21R2.221980 O=C(C=Cc1cccc(c1)Br)COCc2ccccc2 6a_100000210085_100011215004 [0,1,0,0,0,0|2,0,0]=3 2132 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CSCc2ccccc2 1458a_100016258244_200011217039 [0,1,0,0,0,0|2,0,0]=3 2133 B21R2.221980 O=C(C=Cc1cccc(c1)Br)CSCc2ccccc2 6a_100000210085_100000172147 [0,1,0,0,0,0|2,0,0]=3 2134 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2 11a_100000106460_100016258244 [0,1,0,0,0,0|1,0,0]=2 2135 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2 1626a_100000106460_100016258244 [0,1,0,0,0,0|1,0,0]=2 2136 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2 240690a_100000106460_100016258244 [0,1,0,0,0,0|1,0,0]=2 2137 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccn2 11a_100000211156_100016258244 [0,1,0,0,0,0|2,0,0]=3 2138 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccn2 1626a_100000211156_100016258244 [0,1,0,0,0,0|2,0,0]=3 2139 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccccn2 240690a_100000211156_100016258244 [0,1,0,0,0,0|2,0,0]=3 2140 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cccnc2 11a_100000736294_100016258244 [0,1,0,0,0,0|2,0,0]=3 2141 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cccnc2 1626a_100000736294_100016258244 [0,1,0,0,0,0|2,0,0]=3 2142 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cccnc2 240690a_100000736294_100016258244 [0,1,0,0,0,0|2,0,0]=3 2143 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccncc2 11a_100000742849_100016258244 [0,1,0,0,0,0|2,0,0]=3 2144 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccncc2 1626a_100000742849_100016258244 [0,1,0,0,0,0|2,0,0]=3 2145 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2ccncc2 240690a_100000742849_100016258244 [0,1,0,0,0,0|2,0,0]=3 2146 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cnccn2 11a_100000723456_100016258244 [0,1,0,0,0,0|3,0,0]=4 2147 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cnccn2 1626a_100000723456_100016258244 [0,1,0,0,0,0|3,0,0]=4 2148 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NCCc2cnccn2 240690a_100000723456_100016258244 [0,1,0,0,0,0|3,0,0]=4 2149 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NNCc2ccccc2 22a_100000007032_100016258244 [0,1,0,0,0,0|2,0,0]=3 2150 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NNCc2ccccn2 22a_100000736832_100016258244 [0,1,0,0,0,0|3,0,0]=4 2151 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NNCc2cccnc2 22a_100000738295_100016258244 [0,1,0,0,0,0|3,0,0]=4 2152 B21R2.221980 O=C(C=Cc1cccc(c1)Br)NNCc2ccncc2 22a_100000736929_100016258244 [0,1,0,0,0,0|3,0,0]=4 2153 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)C/C=C/c2ccccc2 1458a_100000184502_100016265936 [0,1,0,0,0,0|1,0,2]=4 2154 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CC#Cc2ccccc2 1458a_100000184502_100011352542 [0,1,0,0,0,0|1,0,2]=4 2155 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CCCc2ccccc2 1458a_100000184502_100000211621 [0,1,0,0,0,0|1,0,0]=2 2156 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CCOc2ccccc2 1458a_100000184502_100000184471 [0,1,0,0,0,0|2,0,0]=3 2157 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CCSc2ccccc2 1458a_100000184502_100000246102 [0,1,0,0,0,0|2,0,0]=3 2158 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)CSCc2ccccc2 1458a_100000184502_200011217039 [0,1,0,0,0,0|2,0,0]=3 2159 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2 11a_100000106460_100000184502 [0,1,0,0,0,0|1,0,0]=2 2160 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2 1626a_100000106460_100000184502 [0,1,0,0,0,0|1,0,0]=2 2161 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2 240690a_100000106460_100000184502 [0,1,0,0,0,0|1,0,0]=2 2162 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccn2 11a_100000211156_100000184502 [0,1,0,0,0,0|2,0,0]=3 2163 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccn2 1626a_100000211156_100000184502 [0,1,0,0,0,0|2,0,0]=3 2164 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccn2 240690a_100000211156_100000184502 [0,1,0,0,0,0|2,0,0]=3 2165 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cccnc2 11a_100000736294_100000184502 [0,1,0,0,0,0|2,0,0]=3 2166 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cccnc2 1626a_100000736294_100000184502 [0,1,0,0,0,0|2,0,0]=3 2167 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cccnc2 240690a_100000736294_100000184502 [0,1,0,0,0,0|2,0,0]=3 2168 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccncc2 11a_100000742849_100000184502 [0,1,0,0,0,0|2,0,0]=3 2169 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccncc2 1626a_100000742849_100000184502 [0,1,0,0,0,0|2,0,0]=3 2170 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2ccncc2 240690a_100000742849_100000184502 [0,1,0,0,0,0|2,0,0]=3 2171 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cnccn2 11a_100000723456_100000184502 [0,1,0,0,0,0|3,0,0]=4 2172 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cnccn2 1626a_100000723456_100000184502 [0,1,0,0,0,0|3,0,0]=4 2173 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NCCc2cnccn2 240690a_100000723456_100000184502 [0,1,0,0,0,0|3,0,0]=4 2174 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NNCc2ccccc2 22a_100000007032_100000184502 [0,1,0,0,0,0|2,0,0]=3 2175 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NNCc2ccccn2 22a_100000736832_100000184502 [0,1,0,0,0,0|3,0,0]=4 2176 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NNCc2cccnc2 22a_100000738295_100000184502 [0,1,0,0,0,0|3,0,0]=4 2177 B21R2.221980 O=C(C=Cc1cccc(c1)Cl)NNCc2ccncc2 22a_100000736929_100000184502 [0,1,0,0,0,0|3,0,0]=4 2178 B21R2.221980 O=C(C=Cc1cccc(c1)F)C/C=C/c2ccccc2 1458a_100000718793_100016265936 [0,1,0,0,0,0|1,0,2]=4 2179 B21R2.221980 O=C(C=Cc1cccc(c1)F)CC#Cc2ccccc2 1458a_100000718793_100011352542 [0,1,0,0,0,0|1,0,2]=4 2180 B21R2.221980 O=C(C=Cc1cccc(c1)F)CCCc2ccccc2 1458a_100000718793_100000211621 [0,1,0,0,0,0|1,0,0]=2 2181 B21R2.221980 O=C(C=Cc1cccc(c1)F)CCOc2ccccc2 1458a_100000718793_100000184471 [0,1,0,0,0,0|2,0,0]=3 2182 B21R2.221980 O=C(C=Cc1cccc(c1)F)CCSc2ccccc2 1458a_100000718793_100000246102 [0,1,0,0,0,0|2,0,0]=3 2183 B21R2.221980 O=C(C=Cc1cccc(c1)F)COCc2ccccc2 6a_100000210812_100011215004 [0,1,0,0,0,0|2,0,0]=3 2184 B21R2.221980 O=C(C=Cc1cccc(c1)F)CSCc2ccccc2 1458a_100000718793_200011217039 [0,1,0,0,0,0|2,0,0]=3 2185 B21R2.221980 O=C(C=Cc1cccc(c1)F)CSCc2ccccc2 6a_100000210812_100000172147 [0,1,0,0,0,0|2,0,0]=3 2186 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2 11a_100000106460_100000718793 [0,1,0,0,0,0|1,0,0]=2 2187 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2 1626a_100000106460_100000718793 [0,1,0,0,0,0|1,0,0]=2 2188 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2 240690a_100000106460_100000718793 [0,1,0,0,0,0|1,0,0]=2 2189 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccn2 11a_100000211156_100000718793 [0,1,0,0,0,0|2,0,0]=3 2190 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccn2 1626a_100000211156_100000718793 [0,1,0,0,0,0|2,0,0]=3 2191 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccccn2 240690a_100000211156_100000718793 [0,1,0,0,0,0|2,0,0]=3 2192 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cccnc2 11a_100000736294_100000718793 [0,1,0,0,0,0|2,0,0]=3 2193 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cccnc2 1626a_100000736294_100000718793 [0,1,0,0,0,0|2,0,0]=3 2194 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cccnc2 240690a_100000736294_100000718793 [0,1,0,0,0,0|2,0,0]=3 2195 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccncc2 11a_100000742849_100000718793 [0,1,0,0,0,0|2,0,0]=3 2196 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccncc2 1626a_100000742849_100000718793 [0,1,0,0,0,0|2,0,0]=3 2197 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2ccncc2 240690a_100000742849_100000718793 [0,1,0,0,0,0|2,0,0]=3 2198 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cnccn2 11a_100000723456_100000718793 [0,1,0,0,0,0|3,0,0]=4 2199 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cnccn2 1626a_100000723456_100000718793 [0,1,0,0,0,0|3,0,0]=4 2200 B21R2.221980 O=C(C=Cc1cccc(c1)F)NCCc2cnccn2 240690a_100000723456_100000718793 [0,1,0,0,0,0|3,0,0]=4 2201 B21R2.221980 O=C(C=Cc1cccc(c1)F)NNCc2ccccc2 22a_100000007032_100000718793 [0,1,0,0,0,0|2,0,0]=3 2202 B21R2.221980 O=C(C=Cc1cccc(c1)F)NNCc2ccccn2 22a_100000736832_100000718793 [0,1,0,0,0,0|3,0,0]=4 2203 B21R2.221980 O=C(C=Cc1cccc(c1)F)NNCc2cccnc2 22a_100000738295_100000718793 [0,1,0,0,0,0|3,0,0]=4 2204 B21R2.221980 O=C(C=Cc1cccc(c1)F)NNCc2ccncc2 22a_100000736929_100000718793 [0,1,0,0,0,0|3,0,0]=4 2205 B21R2.221980 O=C(C=Cc1cccc(c1)I)C/C=C/c2ccccc2 1458a_100020647043_100016265936 [0,1,0,0,0,0|1,0,2]=4 2206 B21R2.221980 O=C(C=Cc1cccc(c1)I)CC#Cc2ccccc2 1458a_100020647043_100011352542 [0,1,0,0,0,0|1,0,2]=4 2207 B21R2.221980 O=C(C=Cc1cccc(c1)I)CCCc2ccccc2 1458a_100020647043_100000211621 [0,1,0,0,0,0|1,0,0]=2 2208 B21R2.221980 O=C(C=Cc1cccc(c1)I)CCOc2ccccc2 1458a_100020647043_100000184471 [0,1,0,0,0,0|2,0,0]=3 2209 B21R2.221980 O=C(C=Cc1cccc(c1)I)CCSc2ccccc2 1458a_100020647043_100000246102 [0,1,0,0,0,0|2,0,0]=3 2210 B21R2.221980 O=C(C=Cc1cccc(c1)I)COCc2ccccc2 6a_100000014684_100011215004 [0,1,0,0,0,0|2,0,0]=3 2211 B21R2.221980 O=C(C=Cc1cccc(c1)I)CSCc2ccccc2 1458a_100020647043_200011217039 [0,1,0,0,0,0|2,0,0]=3 2212 B21R2.221980 O=C(C=Cc1cccc(c1)I)CSCc2ccccc2 6a_100000014684_100000172147 [0,1,0,0,0,0|2,0,0]=3 2213 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2 11a_100000106460_100020647043 [0,1,0,0,0,0|1,0,0]=2 2214 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2 1626a_100000106460_100020647043 [0,1,0,0,0,0|1,0,0]=2 2215 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2 240690a_100000106460_100020647043 [0,1,0,0,0,0|1,0,0]=2 2216 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccn2 11a_100000211156_100020647043 [0,1,0,0,0,0|2,0,0]=3 2217 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccn2 1626a_100000211156_100020647043 [0,1,0,0,0,0|2,0,0]=3 2218 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccccn2 240690a_100000211156_100020647043 [0,1,0,0,0,0|2,0,0]=3 2219 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cccnc2 11a_100000736294_100020647043 [0,1,0,0,0,0|2,0,0]=3 2220 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cccnc2 1626a_100000736294_100020647043 [0,1,0,0,0,0|2,0,0]=3 2221 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cccnc2 240690a_100000736294_100020647043 [0,1,0,0,0,0|2,0,0]=3 2222 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccncc2 11a_100000742849_100020647043 [0,1,0,0,0,0|2,0,0]=3 2223 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccncc2 1626a_100000742849_100020647043 [0,1,0,0,0,0|2,0,0]=3 2224 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2ccncc2 240690a_100000742849_100020647043 [0,1,0,0,0,0|2,0,0]=3 2225 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cnccn2 11a_100000723456_100020647043 [0,1,0,0,0,0|3,0,0]=4 2226 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cnccn2 1626a_100000723456_100020647043 [0,1,0,0,0,0|3,0,0]=4 2227 B21R2.221980 O=C(C=Cc1cccc(c1)I)NCCc2cnccn2 240690a_100000723456_100020647043 [0,1,0,0,0,0|3,0,0]=4 2228 B21R2.221980 O=C(C=Cc1cccc(c1)I)NNCc2ccccc2 22a_100000007032_100020647043 [0,1,0,0,0,0|2,0,0]=3 2229 B21R2.221980 O=C(C=Cc1cccc(c1)I)NNCc2ccccn2 22a_100000736832_100020647043 [0,1,0,0,0,0|3,0,0]=4 2230 B21R2.221980 O=C(C=Cc1cccc(c1)I)NNCc2cccnc2 22a_100000738295_100020647043 [0,1,0,0,0,0|3,0,0]=4 2231 B21R2.221980 O=C(C=Cc1cccc(c1)I)NNCc2ccncc2 22a_100000736929_100020647043 [0,1,0,0,0,0|3,0,0]=4 2232 B21R2.221980 O=C(C=Cc1cccc(c1)O)NNCc2ccccc2 22a_100000007032_100102525460 [0,1,0,0,0,0|2,0,0]=3 2233 B21R2.221980 O=C(C=Cc1cccc(c1)O)NNCc2ccccn2 22a_100000736832_100102525460 [0,1,0,0,0,0|3,0,0]=4 2234 B21R2.221980 O=C(C=Cc1cccc(c1)O)NNCc2cccnc2 22a_100000738295_100102525460 [0,1,0,0,0,0|3,0,0]=4 2235 B21R2.221980 O=C(C=Cc1cccc(c1)O)NNCc2ccncc2 22a_100000736929_100102525460 [0,1,0,0,0,0|3,0,0]=4 2236 B21R2.221980 O=C(C=Cc1cncc(c1)Br)COCc2ccccc2 6a_100000687066_100011215004 [0,1,0,0,0,0|3,0,0]=4 2237 B21R2.221980 O=C(C=Cc1cncc(c1)Br)CSCc2ccccc2 6a_100000687066_100000172147 [0,1,0,0,0,0|3,0,0]=4 2238 B21R2.221980 O=C(C=Cc1cncc(c1)Cl)COCc2ccccc2 6a_100000088910_100011215004 [0,1,0,0,0,0|3,0,0]=4 2239 B21R2.221980 O=C(C=Cc1cncc(c1)Cl)CSCc2ccccc2 6a_100000088910_100000172147 [0,1,0,0,0,0|3,0,0]=4 2240 B21R2.221980 O=C(C=Cc1cncc(c1)F)COCc2ccccc2 6a_100011361476_100011215004 [0,1,0,0,0,0|3,0,0]=4 2241 B21R2.221980 O=C(C=Cc1cncc(c1)F)CSCc2ccccc2 6a_100011361476_100000172147 [0,1,0,0,0,0|3,0,0]=4 2242 B21R2.221980 O=C(CCCc1ccccc1)CCc2cccc(c2)Br 1458a_100000184314_100000211621 [0,1,0,0,0,0|1,0,2]=4 2243 B21R2.221980 O=C(CCCc1ccccc1)CCc2cccc(c2)Br 1458a_100011207963_100011740638 [0,1,0,0,0,0|1,0,2]=4 2244 B21R2.221980 O=C(CCCc1ccccc1)CCc2cccc(c2)Cl 1458a_100000235675_100000211621 [0,1,0,0,0,0|1,0,2]=4 2245 B21R2.221980 O=C(CCCc1ccccc1)CCc2cccc(c2)Cl 1458a_100011207963_100011713710 [0,1,0,0,0,0|1,0,2]=4 2246 B21R2.221980 O=C(CCCc1ccccc1)CCc2cccc(c2)F 1458a_100000235673_100000211621 [0,1,0,0,0,0|1,0,2]=4 2247 B21R2.221980 O=C(CCCc1ccccc1)CCc2cccc(c2)F 1458a_100011207963_100011217235 [0,1,0,0,0,0|1,0,2]=4 2248 B21R2.221980 O=C(CCCc1ccccc1)CCc2cccc(c2)I 1458a_100010007846_100000211621 [0,1,0,0,0,0|1,0,2]=4 2249 B21R2.221980 O=C(CCCc1ccccc1)CCc2cccc(c2)O 1458a_100011216126_100000211621 [0,1,0,0,0,0|1,0,2]=4 2250 B21R2.221980 O=C(CCCc1ccccc1)COc2cccc(c2)Br 1458a_100000182359_100000211621 [0,1,0,0,0,0|2,0,1]=4 2251 B21R2.221980 O=C(CCCc1ccccc1)COc2cccc(c2)Cl 1458a_100000184978_100000211621 [0,1,0,0,0,0|2,0,1]=4 2252 B21R2.221980 O=C(CCCc1ccccc1)COc2cccc(c2)F 1458a_100000182781_100000211621 [0,1,0,0,0,0|2,0,1]=4 2253 B21R2.221980 O=C(CCCc1ccccc1)CSc2cccc(c2)Br 1458a_100000760868_100000211621 [0,1,0,0,0,0|2,0,1]=4 2254 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100011207963 [0,1,0,0,0,0|2,0,1]=4 2255 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100011207963 [0,1,0,0,0,0|2,0,1]=4 2256 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100011207963 [0,1,0,0,0,0|2,0,1]=4 2257 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)Br 527a_100000174977_100011207963 [0,1,0,0,0,0|2,0,1]=4 2258 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100011207963 [0,1,0,0,0,0|2,0,1]=4 2259 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100011207963 [0,1,0,0,0,0|2,0,1]=4 2260 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100011207963 [0,1,0,0,0,0|2,0,1]=4 2261 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)Cl 527a_100000174878_100011207963 [0,1,0,0,0,0|2,0,1]=4 2262 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100011207963 [0,1,0,0,0,0|2,0,1]=4 2263 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100011207963 [0,1,0,0,0,0|2,0,1]=4 2264 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100011207963 [0,1,0,0,0,0|2,0,1]=4 2265 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)F 527a_100000174948_100011207963 [0,1,0,0,0,0|2,0,1]=4 2266 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100011207963 [0,1,0,0,0,0|2,0,1]=4 2267 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100011207963 [0,1,0,0,0,0|2,0,1]=4 2268 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100011207963 [0,1,0,0,0,0|2,0,1]=4 2269 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)I 527a_100000106179_100011207963 [0,1,0,0,0,0|2,0,1]=4 2270 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100011207963 [0,1,0,0,0,0|2,0,1]=4 2271 B21R2.221980 O=C(CCCc1ccccc1)NCc2cccc(c2)O 527a_100000743036_100011207963 [0,1,0,0,0,0|2,0,1]=4 2272 B21R2.221980 O=C(CCCc1ccccc1)NNc2cccc(c2)Br 22a_100000217339_100011207963 [0,1,0,0,0,0|3,0,0]=4 2273 B21R2.221980 O=C(CCCc1ccccc1)NNc2cccc(c2)Cl 22a_100000184277_100011207963 [0,1,0,0,0,0|3,0,0]=4 2274 B21R2.221980 O=C(CCCc1ccccc1)NNc2cccc(c2)F 22a_100000745080_100011207963 [0,1,0,0,0,0|3,0,0]=4 2275 B21R2.221980 O=C(CCCc1ccccc1)NNc2cccc(c2)I 22a_100020605690_100011207963 [0,1,0,0,0,0|3,0,0]=4 2276 B21R2.221980 O=C(CCc1cccc(c1)Br)NCCc2ccccc2 11a_100000106460_100000184314 [0,1,0,0,0,0|1,0,2]=4 2277 B21R2.221980 O=C(CCc1cccc(c1)Br)NCCc2ccccc2 1626a_100000106460_100000184314 [0,1,0,0,0,0|1,0,2]=4 2278 B21R2.221980 O=C(CCc1cccc(c1)Br)NCCc2ccccc2 240690a_100000106460_100000184314 [0,1,0,0,0,0|1,0,2]=4 2279 B21R2.221980 O=C(CCc1cccc(c1)Br)NCCc2ccccc2 527a_100000106460_100000184314 [0,1,0,0,0,0|1,0,2]=4 2280 B21R2.221980 O=C(CCc1cccc(c1)Cl)NCCc2ccccc2 11a_100000106460_100000235675 [0,1,0,0,0,0|1,0,2]=4 2281 B21R2.221980 O=C(CCc1cccc(c1)Cl)NCCc2ccccc2 1626a_100000106460_100000235675 [0,1,0,0,0,0|1,0,2]=4 2282 B21R2.221980 O=C(CCc1cccc(c1)Cl)NCCc2ccccc2 240690a_100000106460_100000235675 [0,1,0,0,0,0|1,0,2]=4 2283 B21R2.221980 O=C(CCc1cccc(c1)Cl)NCCc2ccccc2 527a_100000106460_100000235675 [0,1,0,0,0,0|1,0,2]=4 2284 B21R2.221980 O=C(CCc1cccc(c1)F)NCCc2ccccc2 11a_100000106460_100000235673 [0,1,0,0,0,0|1,0,2]=4 2285 B21R2.221980 O=C(CCc1cccc(c1)F)NCCc2ccccc2 1626a_100000106460_100000235673 [0,1,0,0,0,0|1,0,2]=4 2286 B21R2.221980 O=C(CCc1cccc(c1)F)NCCc2ccccc2 240690a_100000106460_100000235673 [0,1,0,0,0,0|1,0,2]=4 2287 B21R2.221980 O=C(CCc1cccc(c1)F)NCCc2ccccc2 527a_100000106460_100000235673 [0,1,0,0,0,0|1,0,2]=4 2288 B21R2.221980 O=C(CCc1cccc(c1)I)NCCc2ccccc2 11a_100000106460_100010007846 [0,1,0,0,0,0|1,0,2]=4 2289 B21R2.221980 O=C(CCc1cccc(c1)I)NCCc2ccccc2 1626a_100000106460_100010007846 [0,1,0,0,0,0|1,0,2]=4 2290 B21R2.221980 O=C(CCc1cccc(c1)I)NCCc2ccccc2 240690a_100000106460_100010007846 [0,1,0,0,0,0|1,0,2]=4 2291 B21R2.221980 O=C(CCc1cccc(c1)I)NCCc2ccccc2 527a_100000106460_100010007846 [0,1,0,0,0,0|1,0,2]=4 2292 B21R2.221980 O=C(CCc1cccc(c1)O)NCCc2ccccc2 240690a_100000106460_100011216126 [0,1,0,0,0,0|1,0,2]=4 2293 B21R2.221980 O=C(CCc1cccc(c1)O)NCCc2ccccc2 527a_100000106460_100011216126 [0,1,0,0,0,0|1,0,2]=4 2294 B21R2.221980 O=C(CNc1cccc(c1)Br)NCCc2ccccc2 34a_100000210019_100000183012 [0,1,0,0,0,0|2,0,1]=4 2295 B21R2.221980 O=C(CNc1cccc(c1)Br)OCCc2ccccc2 34a_100000210019_200000077782 [0,1,0,0,0,0|1,0,1]=3 2296 B21R2.221980 O=C(CNc1cccc(c1)Cl)NCCc2ccccc2 34a_100000185859_100000183012 [0,1,0,0,0,0|2,0,1]=4 2297 B21R2.221980 O=C(CNc1cccc(c1)Cl)OCCc2ccccc2 34a_100000185859_200000077782 [0,1,0,0,0,0|1,0,1]=3 2298 B21R2.221980 O=C(CNc1cccc(c1)F)NCCc2ccccc2 34a_100000210047_100000183012 [0,1,0,0,0,0|2,0,1]=4 2299 B21R2.221980 O=C(CNc1cccc(c1)F)OCCc2ccccc2 34a_100000210047_200000077782 [0,1,0,0,0,0|1,0,1]=3 2300 B21R2.221980 O=C(CNc1cccc(c1)I)NCCc2ccccc2 34a_100000211102_100000183012 [0,1,0,0,0,0|2,0,1]=4 2301 B21R2.221980 O=C(CNc1cccc(c1)I)OCCc2ccccc2 34a_100000211102_200000077782 [0,1,0,0,0,0|1,0,1]=3 2302 B21R2.221980 O=C(CNc1cccc(c1)O)NCCc2ccccc2 34a_100000210217_100000183012 [0,1,0,0,0,0|2,0,1]=4 2303 B21R2.221980 O=C(CNc1cccc(c1)O)OCCc2ccccc2 34a_100000210217_200000077782 [0,1,0,0,0,0|1,0,1]=3 2304 B21R2.221980 O=C(COc1cc[nH]c(=O)c1)OCCc2ccccc2 34a_100000032262_200000077782 [0,1,0,0,0,0|2,0,1]=4 2305 B21R2.221980 O=C(COc1ccc[n+](c1)[O-])OCCc2ccccc2 34a_100000039713_200000077782 [0,1,0,0,0,0|2,0,1]=4 2306 B21R2.221980 O=C(COc1ccc[n+](c1)[O-])OCCc2ccccc2 7a_100000039713_200000077782 [0,1,0,0,0,0|2,0,1]=4 2307 B21R2.221980 O=C(COc1cccc(=O)[nH]1)OCCc2ccccc2 34a_100000033347_200000077782 [0,1,0,0,0,0|2,0,1]=4 2308 B21R2.221980 O=C(COc1cccc(c1)Br)NCCc2ccccc2 11a_100000106460_100000182359 [0,1,0,0,0,0|2,0,1]=4 2309 B21R2.221980 O=C(COc1cccc(c1)Br)NCCc2ccccc2 1626a_100000106460_100000182359 [0,1,0,0,0,0|2,0,1]=4 2310 B21R2.221980 O=C(COc1cccc(c1)Br)NCCc2ccccc2 240690a_100000106460_100000182359 [0,1,0,0,0,0|2,0,1]=4 2311 B21R2.221980 O=C(COc1cccc(c1)Br)NCCc2ccccc2 34a_100000210342_100000183012 [0,1,0,0,0,0|2,0,1]=4 2312 B21R2.221980 O=C(COc1cccc(c1)Br)NCCc2ccccc2 527a_100000106460_100000182359 [0,1,0,0,0,0|2,0,1]=4 2313 B21R2.221980 O=C(COc1cccc(c1)Br)NCCc2ccccc2 7a_100000210342_100000183012 [0,1,0,0,0,0|2,0,1]=4 2314 B21R2.221980 O=C(COc1cccc(c1)Br)OCCc2ccccc2 34a_100000210342_200000077782 [0,1,0,0,0,0|1,0,1]=3 2315 B21R2.221980 O=C(COc1cccc(c1)Br)OCCc2ccccc2 7a_100000210342_200000077782 [0,1,0,0,0,0|1,0,1]=3 2316 B21R2.221980 O=C(COc1cccc(c1)Cl)NCCc2ccccc2 11a_100000106460_100000184978 [0,1,0,0,0,0|2,0,1]=4 2317 B21R2.221980 O=C(COc1cccc(c1)Cl)NCCc2ccccc2 1626a_100000106460_100000184978 [0,1,0,0,0,0|2,0,1]=4 2318 B21R2.221980 O=C(COc1cccc(c1)Cl)NCCc2ccccc2 240690a_100000106460_100000184978 [0,1,0,0,0,0|2,0,1]=4 2319 B21R2.221980 O=C(COc1cccc(c1)Cl)NCCc2ccccc2 34a_100000210295_100000183012 [0,1,0,0,0,0|2,0,1]=4 2320 B21R2.221980 O=C(COc1cccc(c1)Cl)NCCc2ccccc2 527a_100000106460_100000184978 [0,1,0,0,0,0|2,0,1]=4 2321 B21R2.221980 O=C(COc1cccc(c1)Cl)NCCc2ccccc2 7a_100000210295_100000183012 [0,1,0,0,0,0|2,0,1]=4 2322 B21R2.221980 O=C(COc1cccc(c1)Cl)OCCc2ccccc2 34a_100000210295_200000077782 [0,1,0,0,0,0|1,0,1]=3 2323 B21R2.221980 O=C(COc1cccc(c1)Cl)OCCc2ccccc2 7a_100000210295_200000077782 [0,1,0,0,0,0|1,0,1]=3 2324 B21R2.221980 O=C(COc1cccc(c1)F)NCCc2ccccc2 11a_100000106460_100000182781 [0,1,0,0,0,0|2,0,1]=4 2325 B21R2.221980 O=C(COc1cccc(c1)F)NCCc2ccccc2 1626a_100000106460_100000182781 [0,1,0,0,0,0|2,0,1]=4 2326 B21R2.221980 O=C(COc1cccc(c1)F)NCCc2ccccc2 240690a_100000106460_100000182781 [0,1,0,0,0,0|2,0,1]=4 2327 B21R2.221980 O=C(COc1cccc(c1)F)NCCc2ccccc2 34a_100000210426_100000183012 [0,1,0,0,0,0|2,0,1]=4 2328 B21R2.221980 O=C(COc1cccc(c1)F)NCCc2ccccc2 527a_100000106460_100000182781 [0,1,0,0,0,0|2,0,1]=4 2329 B21R2.221980 O=C(COc1cccc(c1)F)NCCc2ccccc2 7a_100000210426_100000183012 [0,1,0,0,0,0|2,0,1]=4 2330 B21R2.221980 O=C(COc1cccc(c1)F)OCCc2ccccc2 34a_100000210426_200000077782 [0,1,0,0,0,0|1,0,1]=3 2331 B21R2.221980 O=C(COc1cccc(c1)F)OCCc2ccccc2 7a_100000210426_200000077782 [0,1,0,0,0,0|1,0,1]=3 2332 B21R2.221980 O=C(COc1cccc(c1)I)NCCc2ccccc2 34a_100000211634_100000183012 [0,1,0,0,0,0|2,0,1]=4 2333 B21R2.221980 O=C(COc1cccc(c1)I)NCCc2ccccc2 7a_100000211634_100000183012 [0,1,0,0,0,0|2,0,1]=4 2334 B21R2.221980 O=C(COc1cccc(c1)I)OCCc2ccccc2 34a_100000211634_200000077782 [0,1,0,0,0,0|1,0,1]=3 2335 B21R2.221980 O=C(COc1cccc(c1)I)OCCc2ccccc2 7a_100000211634_200000077782 [0,1,0,0,0,0|1,0,1]=3 2336 B21R2.221980 O=C(COc1cccc(n1)F)OCCc2ccccc2 34a_100011432558_200000077782 [0,1,0,0,0,0|2,0,1]=4 2337 B21R2.221980 O=C(COc1ccnc(c1)Cl)OCCc2ccccc2 34a_100000762945_200000077782 [0,1,0,0,0,0|2,0,1]=4 2338 B21R2.221980 O=C(COc1ccnc(c1)F)OCCc2ccccc2 34a_100000732698_200000077782 [0,1,0,0,0,0|2,0,1]=4 2339 B21R2.221980 O=C(COc1cncc(c1)Br)OCCc2ccccc2 34a_100000754920_200000077782 [0,1,0,0,0,0|2,0,1]=4 2340 B21R2.221980 O=C(COc1cncc(c1)Br)OCCc2ccccc2 7a_100000754920_200000077782 [0,1,0,0,0,0|2,0,1]=4 2341 B21R2.221980 O=C(COc1cncc(c1)Cl)OCCc2ccccc2 7a_100000032511_200000077782 [0,1,0,0,0,0|2,0,1]=4 2342 B21R2.221980 O=C(COc1cncc(c1)F)OCCc2ccccc2 34a_100011830296_200000077782 [0,1,0,0,0,0|2,0,1]=4 2343 B21R2.221980 O=C(COc1cncc(c1)F)OCCc2ccccc2 7a_100011830296_200000077782 [0,1,0,0,0,0|2,0,1]=4 2344 B21R2.221980 O=C(CSc1cc(=O)cc[nH]1)OCCc2ccccc2 62a_100009817434_200000077782 [0,1,0,0,0,0|2,0,1]=4 2345 B21R2.221980 O=C(CSc1cc(ccn1)Cl)OCCc2ccccc2 62a_100010167805_200000077782 [0,1,0,0,0,0|2,0,1]=4 2346 B21R2.221980 O=C(CSc1cc(ccn1)Cl)OCCc2ccccc2 62a_200000077782_100010167805 [0,1,0,0,0,0|2,0,1]=4 2347 B21R2.221980 O=C(CSc1cc(ccn1)F)OCCc2ccccc2 62a_100000764206_200000077782 [0,1,0,0,0,0|2,0,1]=4 2348 B21R2.221980 O=C(CSc1cc(ccn1)F)OCCc2ccccc2 62a_200000077782_100000764206 [0,1,0,0,0,0|2,0,1]=4 2349 B21R2.221980 O=C(CSc1cc(ccn1)O)OCCc2ccccc2 62a_200000077782_100000762945 [0,1,0,0,0,0|2,0,1]=4 2350 B21R2.221980 O=C(CSc1cc[nH]c(=O)c1)OCCc2ccccc2 62a_100009816521_200000077782 [0,1,0,0,0,0|2,0,1]=4 2351 B21R2.221980 O=C(CSc1cc[nH]c(=O)c1)OCCc2ccccc2 62a_200000077782_100009816521 [0,1,0,0,0,0|2,0,1]=4 2352 B21R2.221980 O=C(CSc1ccc[n+](c1)[O-])OCCc2ccccc2 62a_200000077782_100009815978 [0,1,0,0,0,0|2,0,1]=4 2353 B21R2.221980 O=C(CSc1cccc(=O)[nH]1)OCCc2ccccc2 62a_200000077782_100000752884 [0,1,0,0,0,0|2,0,1]=4 2354 B21R2.221980 O=C(CSc1cccc(c1)Br)NCCc2ccccc2 11a_100000106460_100000760868 [0,1,0,0,0,0|2,0,1]=4 2355 B21R2.221980 O=C(CSc1cccc(c1)Br)NCCc2ccccc2 1626a_100000106460_100000760868 [0,1,0,0,0,0|2,0,1]=4 2356 B21R2.221980 O=C(CSc1cccc(c1)Br)NCCc2ccccc2 240690a_100000106460_100000760868 [0,1,0,0,0,0|2,0,1]=4 2357 B21R2.221980 O=C(CSc1cccc(c1)Br)NCCc2ccccc2 527a_100000106460_100000760868 [0,1,0,0,0,0|2,0,1]=4 2358 B21R2.221980 O=C(CSc1cccc(c1)Br)NCCc2ccccc2 62a_100000183012_100000691529 [0,1,0,0,0,0|2,0,1]=4 2359 B21R2.221980 O=C(CSc1cccc(c1)Br)NCCc2ccccc2 62a_100000691529_100000183012 [0,1,0,0,0,0|2,0,1]=4 2360 B21R2.221980 O=C(CSc1cccc(c1)Br)OCCc2ccccc2 62a_100000691529_200000077782 [0,1,0,0,0,0|1,0,1]=3 2361 B21R2.221980 O=C(CSc1cccc(c1)Br)OCCc2ccccc2 62a_200000077782_100000691529 [0,1,0,0,0,0|1,0,1]=3 2362 B21R2.221980 O=C(CSc1cccc(c1)Cl)NCCc2ccccc2 62a_100000183012_100000699651 [0,1,0,0,0,0|2,0,1]=4 2363 B21R2.221980 O=C(CSc1cccc(c1)Cl)NCCc2ccccc2 62a_100000699651_100000183012 [0,1,0,0,0,0|2,0,1]=4 2364 B21R2.221980 O=C(CSc1cccc(c1)Cl)OCCc2ccccc2 62a_100000699651_200000077782 [0,1,0,0,0,0|1,0,1]=3 2365 B21R2.221980 O=C(CSc1cccc(c1)Cl)OCCc2ccccc2 62a_200000077782_100000699651 [0,1,0,0,0,0|1,0,1]=3 2366 B21R2.221980 O=C(CSc1cccc(c1)F)NCCc2ccccc2 62a_100000183012_100000685547 [0,1,0,0,0,0|2,0,1]=4 2367 B21R2.221980 O=C(CSc1cccc(c1)F)NCCc2ccccc2 62a_100000685547_100000183012 [0,1,0,0,0,0|2,0,1]=4 2368 B21R2.221980 O=C(CSc1cccc(c1)F)OCCc2ccccc2 62a_100000685547_200000077782 [0,1,0,0,0,0|1,0,1]=3 2369 B21R2.221980 O=C(CSc1cccc(c1)F)OCCc2ccccc2 62a_200000077782_100000685547 [0,1,0,0,0,0|1,0,1]=3 2370 B21R2.221980 O=C(CSc1cccc(c1)O)NCCc2ccccc2 62a_100000183012_100000211634 [0,1,0,0,0,0|2,0,1]=4 2371 B21R2.221980 O=C(CSc1cccc(c1)O)OCCc2ccccc2 62a_200000077782_100000211634 [0,1,0,0,0,0|1,0,1]=3 2372 B21R2.221980 O=C(CSc1cccc(c1)[S])NCCc2ccccc2 62a_100000183012_114929384022 [0,1,0,0,0,0|2,0,1]=4 2373 B21R2.221980 O=C(CSc1cccc(c1)[S])NCCc2ccccc2 62a_114929384022_100000183012 [0,1,0,0,0,0|2,0,1]=4 2374 B21R2.221980 O=C(CSc1cccc(c1)[S])OCCc2ccccc2 62a_114929384022_200000077782 [0,1,0,0,0,0|1,0,1]=3 2375 B21R2.221980 O=C(CSc1cccc(c1)[S])OCCc2ccccc2 62a_200000077782_114929384022 [0,1,0,0,0,0|1,0,1]=3 2376 B21R2.221980 O=C(CSc1cccc(n1)Br)OCCc2ccccc2 62a_100000684672_200000077782 [0,1,0,0,0,0|2,0,1]=4 2377 B21R2.221980 O=C(CSc1cccc(n1)Br)OCCc2ccccc2 62a_200000077782_100000684672 [0,1,0,0,0,0|2,0,1]=4 2378 B21R2.221980 O=C(CSc1cccc(n1)Cl)OCCc2ccccc2 62a_100000051397_200000077782 [0,1,0,0,0,0|2,0,1]=4 2379 B21R2.221980 O=C(CSc1cccc(n1)Cl)OCCc2ccccc2 62a_200000077782_100000051397 [0,1,0,0,0,0|2,0,1]=4 2380 B21R2.221980 O=C(CSc1cccc(n1)F)OCCc2ccccc2 62a_100009815982_200000077782 [0,1,0,0,0,0|2,0,1]=4 2381 B21R2.221980 O=C(CSc1cccc(n1)F)OCCc2ccccc2 62a_200000077782_100009815982 [0,1,0,0,0,0|2,0,1]=4 2382 B21R2.221980 O=C(CSc1ccnc(c1)Br)OCCc2ccccc2 62a_100009814637_200000077782 [0,1,0,0,0,0|2,0,1]=4 2383 B21R2.221980 O=C(CSc1ccnc(c1)Br)OCCc2ccccc2 62a_200000077782_100009814637 [0,1,0,0,0,0|2,0,1]=4 2384 B21R2.221980 O=C(CSc1ccnc(c1)Cl)OCCc2ccccc2 62a_100000035001_200000077782 [0,1,0,0,0,0|2,0,1]=4 2385 B21R2.221980 O=C(CSc1ccnc(c1)Cl)OCCc2ccccc2 62a_200000077782_100000035001 [0,1,0,0,0,0|2,0,1]=4 2386 B21R2.221980 O=C(CSc1ccnc(c1)F)OCCc2ccccc2 62a_100009816116_200000077782 [0,1,0,0,0,0|2,0,1]=4 2387 B21R2.221980 O=C(CSc1ccnc(c1)F)OCCc2ccccc2 62a_200000077782_100009816116 [0,1,0,0,0,0|2,0,1]=4 2388 B21R2.221980 O=C(CSc1cncc(c1)Br)OCCc2ccccc2 62a_100000728054_200000077782 [0,1,0,0,0,0|2,0,1]=4 2389 B21R2.221980 O=C(CSc1cncc(c1)Br)OCCc2ccccc2 62a_200000077782_100000728054 [0,1,0,0,0,0|2,0,1]=4 2390 B21R2.221980 O=C(CSc1cncc(c1)Cl)OCCc2ccccc2 62a_100000049639_200000077782 [0,1,0,0,0,0|2,0,1]=4 2391 B21R2.221980 O=C(CSc1cncc(c1)Cl)OCCc2ccccc2 62a_200000077782_100000049639 [0,1,0,0,0,0|2,0,1]=4 2392 B21R2.221980 O=C(CSc1cncc(c1)F)OCCc2ccccc2 62a_100000744099_200000077782 [0,1,0,0,0,0|2,0,1]=4 2393 B21R2.221980 O=C(CSc1cncc(c1)F)OCCc2ccccc2 62a_200000077782_100000744099 [0,1,0,0,0,0|2,0,1]=4 2394 B21R2.221980 O=C(CSc1cncc(c1)O)OCCc2ccccc2 62a_100000754920_200000077782 [0,1,0,0,0,0|2,0,1]=4 2395 B21R2.221980 O=C(CSc1cncc(c1)O)OCCc2ccccc2 62a_200000077782_100000754920 [0,1,0,0,0,0|2,0,1]=4 2396 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Br 2708a_100000106460_100000174977 [0,1,0,0,0,0|2,0,1]=4 2397 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Br 2708a_100000174977_100000106460 [0,1,0,0,0,0|2,0,1]=4 2398 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Br 273464a_100000106460_100000174977 [0,1,0,0,0,0|2,0,1]=4 2399 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Br 273464a_100000174977_100000106460 [0,1,0,0,0,0|2,0,1]=4 2400 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Br 512a_100000106460_100000174977 [0,1,0,0,0,0|2,0,1]=4 2401 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Br 512a_100000174977_100000106460 [0,1,0,0,0,0|2,0,1]=4 2402 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Cl 2708a_100000106460_100000174878 [0,1,0,0,0,0|2,0,1]=4 2403 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Cl 2708a_100000174878_100000106460 [0,1,0,0,0,0|2,0,1]=4 2404 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Cl 273464a_100000106460_100000174878 [0,1,0,0,0,0|2,0,1]=4 2405 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Cl 273464a_100000174878_100000106460 [0,1,0,0,0,0|2,0,1]=4 2406 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Cl 512a_100000106460_100000174878 [0,1,0,0,0,0|2,0,1]=4 2407 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)Cl 512a_100000174878_100000106460 [0,1,0,0,0,0|2,0,1]=4 2408 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)F 2708a_100000106460_100000174948 [0,1,0,0,0,0|2,0,1]=4 2409 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)F 2708a_100000174948_100000106460 [0,1,0,0,0,0|2,0,1]=4 2410 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)F 273464a_100000106460_100000174948 [0,1,0,0,0,0|2,0,1]=4 2411 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)F 273464a_100000174948_100000106460 [0,1,0,0,0,0|2,0,1]=4 2412 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)F 512a_100000106460_100000174948 [0,1,0,0,0,0|2,0,1]=4 2413 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)F 512a_100000174948_100000106460 [0,1,0,0,0,0|2,0,1]=4 2414 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)I 2708a_100000106179_100000106460 [0,1,0,0,0,0|2,0,1]=4 2415 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)I 2708a_100000106460_100000106179 [0,1,0,0,0,0|2,0,1]=4 2416 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)I 273464a_100000106179_100000106460 [0,1,0,0,0,0|2,0,1]=4 2417 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)I 273464a_100000106460_100000106179 [0,1,0,0,0,0|2,0,1]=4 2418 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)I 512a_100000106179_100000106460 [0,1,0,0,0,0|2,0,1]=4 2419 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)I 512a_100000106460_100000106179 [0,1,0,0,0,0|2,0,1]=4 2420 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)O 2708a_100000106460_100000743036 [0,1,0,0,0,0|2,0,1]=4 2421 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)O 2708a_100000743036_100000106460 [0,1,0,0,0,0|2,0,1]=4 2422 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)O 273464a_100000106460_100000743036 [0,1,0,0,0,0|2,0,1]=4 2423 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)O 273464a_100000743036_100000106460 [0,1,0,0,0,0|2,0,1]=4 2424 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)O 512a_100000106460_100000743036 [0,1,0,0,0,0|2,0,1]=4 2425 B21R2.221980 O=C(NCCc1ccccc1)NCc2cccc(c2)O 512a_100000743036_100000106460 [0,1,0,0,0,0|2,0,1]=4 2426 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)Br 273464a_100000106460_100000217339 [0,1,0,0,0,0|3,0,0]=4 2427 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)Br 512a_100000106460_100000217339 [0,1,0,0,0,0|3,0,0]=4 2428 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)Br 512a_100000217339_100000106460 [0,1,0,0,0,0|3,0,0]=4 2429 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)Cl 273464a_100000106460_100000184277 [0,1,0,0,0,0|3,0,0]=4 2430 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)Cl 512a_100000106460_100000184277 [0,1,0,0,0,0|3,0,0]=4 2431 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)F 273464a_100000106460_100000745080 [0,1,0,0,0,0|3,0,0]=4 2432 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)F 512a_100000106460_100000745080 [0,1,0,0,0,0|3,0,0]=4 2433 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)F 512a_100000745080_100000106460 [0,1,0,0,0,0|3,0,0]=4 2434 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)I 273464a_100000106460_100020605690 [0,1,0,0,0,0|3,0,0]=4 2435 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)I 512a_100000106460_100020605690 [0,1,0,0,0,0|3,0,0]=4 2436 B21R2.221980 O=C(NCCc1ccccc1)NNc2cccc(c2)I 512a_100020605690_100000106460 [0,1,0,0,0,0|3,0,0]=4 2437 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)C/C=C/c2ccccc2 1458a_100016990649_100016265936 [0,1,0,0,0,0|1,0,2]=4 2438 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CC#Cc2ccccc2 1458a_100016990649_100011352542 [0,1,0,0,0,0|1,0,2]=4 2439 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CCCc2ccccc2 1458a_100016990649_100000211621 [0,1,0,0,0,0|1,0,0]=2 2440 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CCOc2ccccc2 1458a_100016990649_100000184471 [0,1,0,0,0,0|2,0,0]=3 2441 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CCSc2ccccc2 1458a_100016990649_100000246102 [0,1,0,0,0,0|2,0,0]=3 2442 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)CSCc2ccccc2 1458a_100016990649_200011217039 [0,1,0,0,0,0|2,0,0]=3 2443 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2 11a_100000106460_100016990649 [0,1,0,0,0,0|1,0,0]=2 2444 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2 1626a_100000106460_100016990649 [0,1,0,0,0,0|1,0,0]=2 2445 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2 527a_100000106460_100016990649 [0,1,0,0,0,0|1,0,0]=2 2446 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccn2 11a_100000211156_100016990649 [0,1,0,0,0,0|2,0,0]=3 2447 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccn2 1626a_100000211156_100016990649 [0,1,0,0,0,0|2,0,0]=3 2448 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccn2 527a_100000211156_100016990649 [0,1,0,0,0,0|2,0,0]=3 2449 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cccnc2 11a_100000736294_100016990649 [0,1,0,0,0,0|2,0,0]=3 2450 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cccnc2 1626a_100000736294_100016990649 [0,1,0,0,0,0|2,0,0]=3 2451 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cccnc2 527a_100000736294_100016990649 [0,1,0,0,0,0|2,0,0]=3 2452 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccncc2 11a_100000742849_100016990649 [0,1,0,0,0,0|2,0,0]=3 2453 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccncc2 1626a_100000742849_100016990649 [0,1,0,0,0,0|2,0,0]=3 2454 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2ccncc2 527a_100000742849_100016990649 [0,1,0,0,0,0|2,0,0]=3 2455 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cnccn2 11a_100000723456_100016990649 [0,1,0,0,0,0|3,0,0]=4 2456 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cnccn2 1626a_100000723456_100016990649 [0,1,0,0,0,0|3,0,0]=4 2457 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NCCc2cnccn2 527a_100000723456_100016990649 [0,1,0,0,0,0|3,0,0]=4 2458 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NNCc2ccccc2 22a_100000007032_100016990649 [0,1,0,0,0,0|2,0,0]=3 2459 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NNCc2ccccn2 22a_100000736832_100016990649 [0,1,0,0,0,0|3,0,0]=4 2460 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NNCc2cccnc2 22a_100000738295_100016990649 [0,1,0,0,0,0|3,0,0]=4 2461 B21R2.257667 C/C(=C\c1ccccc1)/C(=O)NNCc2ccncc2 22a_100000736929_100016990649 [0,1,0,0,0,0|3,0,0]=4 2462 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)CCCc2ccccc2 1458a_100025712827_100000211621 [0,1,0,0,0,0|2,0,0]=3 2463 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)CCOc2ccccc2 1458a_100025712827_100000184471 [0,1,0,0,0,0|3,0,0]=4 2464 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)CCSc2ccccc2 1458a_100025712827_100000246102 [0,1,0,0,0,0|3,0,0]=4 2465 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)CSCc2ccccc2 1458a_100025712827_200011217039 [0,1,0,0,0,0|3,0,0]=4 2466 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2 11a_100000106460_100025712827 [0,1,0,0,0,0|2,0,0]=3 2467 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2 1626a_100000106460_100025712827 [0,1,0,0,0,0|2,0,0]=3 2468 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2 527a_100000106460_100025712827 [0,1,0,0,0,0|2,0,0]=3 2469 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccn2 11a_100000211156_100025712827 [0,1,0,0,0,0|3,0,0]=4 2470 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccn2 1626a_100000211156_100025712827 [0,1,0,0,0,0|3,0,0]=4 2471 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccn2 527a_100000211156_100025712827 [0,1,0,0,0,0|3,0,0]=4 2472 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2cccnc2 11a_100000736294_100025712827 [0,1,0,0,0,0|3,0,0]=4 2473 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2cccnc2 1626a_100000736294_100025712827 [0,1,0,0,0,0|3,0,0]=4 2474 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2cccnc2 527a_100000736294_100025712827 [0,1,0,0,0,0|3,0,0]=4 2475 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccncc2 11a_100000742849_100025712827 [0,1,0,0,0,0|3,0,0]=4 2476 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccncc2 1626a_100000742849_100025712827 [0,1,0,0,0,0|3,0,0]=4 2477 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NCCc2ccncc2 527a_100000742849_100025712827 [0,1,0,0,0,0|3,0,0]=4 2478 B21R2.257667 C/C(=C\c1ccccn1)/C(=O)NNCc2ccccc2 22a_100000007032_100025712827 [0,1,0,0,0,0|3,0,0]=4 2479 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2 11a_100000106460_100000066491 [0,1,0,0,0,0|1,0,1]=3 2480 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2 1626a_100000106460_100000066491 [0,1,0,0,0,0|1,0,1]=3 2481 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2ccccn2 11a_100000211156_100000066491 [0,1,0,0,0,0|2,0,1]=4 2482 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2ccccn2 1626a_100000211156_100000066491 [0,1,0,0,0,0|2,0,1]=4 2483 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2cccnc2 11a_100000736294_100000066491 [0,1,0,0,0,0|2,0,1]=4 2484 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2cccnc2 1626a_100000736294_100000066491 [0,1,0,0,0,0|2,0,1]=4 2485 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2ccncc2 11a_100000742849_100000066491 [0,1,0,0,0,0|2,0,1]=4 2486 B21R2.257667 C=C(Cc1ccccc1)C(=O)NCCc2ccncc2 1626a_100000742849_100000066491 [0,1,0,0,0,0|2,0,1]=4 2487 B21R2.257667 C=C(Cc1ccccc1)C(=O)NNCc2ccccc2 22a_100000007032_100000066491 [0,1,0,0,0,0|2,0,1]=4 2488 B21R2.257667 CC(Cc1ccccc1)C(=O)CCCc2ccccc2 1458a_100000754839_100000211621 [0,1,0,0,0,0|1,0,2]=4 2489 B21R2.257667 CC(Cc1ccccc1)C(=O)CCCc2ccccc2 1458a_100011207963_200011218536 [0,1,0,0,0,0|1,0,2]=4 2490 B21R2.257667 CC(Cc1ccccc1)C(=O)NCCc2ccccc2 11a_100000106460_100000754839 [0,1,0,0,0,0|1,0,2]=4 2491 B21R2.257667 CC(Cc1ccccc1)C(=O)NCCc2ccccc2 1626a_100000106460_100000754839 [0,1,0,0,0,0|1,0,2]=4 2492 B21R2.257667 CC(Cc1ccccc1)C(=O)NCCc2ccccc2 240690a_100000106460_100000754839 [0,1,0,0,0,0|1,0,2]=4 2493 B21R2.257667 CC(Cc1ccccc1)C(=O)NCCc2ccccc2 527a_100000106460_100000754839 [0,1,0,0,0,0|1,0,2]=4 2494 B21R2.257667 CC(Nc1ccccc1)C(=O)NCCc2ccccc2 34a_100000106764_100000230280 [0,1,0,0,0,0|2,0,1]=4 2495 B21R2.257667 CC(OCCc1ccccc1)C(=O)Nc2ccccc2 34a_100000210268_100000183986 [0,1,0,0,0,0|2,0,1]=4 2496 B21R2.257667 CC(OCCc1ccccc1)C(=O)Nc2ccccc2 7a_100000210268_100000183986 [0,1,0,0,0,0|2,0,1]=4 2497 B21R2.257667 CC(Oc1ccccc1)C(=O)CCCc2ccccc2 1458a_100000188414_100000211621 [0,1,0,0,0,0|2,0,1]=4 2498 B21R2.257667 CC(Oc1ccccc1)C(=O)NCCc2ccccc2 11a_100000106460_100000188414 [0,1,0,0,0,0|2,0,1]=4 2499 B21R2.257667 CC(Oc1ccccc1)C(=O)NCCc2ccccc2 1626a_100000106460_100000188414 [0,1,0,0,0,0|2,0,1]=4 2500 B21R2.257667 CC(Oc1ccccc1)C(=O)NCCc2ccccc2 240690a_100000106460_100000188414 [0,1,0,0,0,0|2,0,1]=4 2501 B21R2.257667 CC(Oc1ccccc1)C(=O)NCCc2ccccc2 34a_100000210340_100000230280 [0,1,0,0,0,0|2,0,1]=4 2502 B21R2.257667 CC(Oc1ccccc1)C(=O)NCCc2ccccc2 527a_100000106460_100000188414 [0,1,0,0,0,0|2,0,1]=4 2503 B21R2.257667 CC(Oc1ccccc1)C(=O)NCCc2ccccc2 7a_100000210340_100000230280 [0,1,0,0,0,0|2,0,1]=4 2504 B21R2.257667 CC(Sc1ccccc1)C(=O)CCCc2ccccc2 1458a_100000199063_100000211621 [0,1,0,0,0,0|2,0,1]=4 2505 B21R2.257667 CC(Sc1ccccc1)C(=O)NCCc2ccccc2 11a_100000106460_100000199063 [0,1,0,0,0,0|2,0,1]=4 2506 B21R2.257667 CC(Sc1ccccc1)C(=O)NCCc2ccccc2 1626a_100000106460_100000199063 [0,1,0,0,0,0|2,0,1]=4 2507 B21R2.257667 CC(Sc1ccccc1)C(=O)NCCc2ccccc2 240690a_100000106460_100000199063 [0,1,0,0,0,0|2,0,1]=4 2508 B21R2.257667 CC(Sc1ccccc1)C(=O)NCCc2ccccc2 527a_100000106460_100000199063 [0,1,0,0,0,0|2,0,1]=4 2509 B21R2.257667 CC(Sc1ccccc1)C(=O)NCCc2ccccc2 62a_100000230280_100000041952 [0,1,0,0,0,0|2,0,1]=4 2510 B21R2.257667 CC(Sc1ccccc1)C(=O)NCCc2ccccc2 62a_100000719477_100000230280 [0,1,0,0,0,0|2,0,1]=4 2511 B21R2.257667 CN(Cc1ccccc1)C(=O)CCCc2ccccc2 11a_100000186898_100011207963 [0,1,0,0,0,0|2,0,1]=4 2512 B21R2.257667 CN(Cc1ccccc1)C(=O)CCCc2ccccc2 1626a_100000186898_100011207963 [0,1,0,0,0,0|2,0,1]=4 2513 B21R2.257667 CN(Cc1ccccc1)C(=O)CCCc2ccccc2 240690a_100000186898_100011207963 [0,1,0,0,0,0|2,0,1]=4 2514 B21R2.257667 CN(Cc1ccccc1)C(=O)CCCc2ccccc2 527a_100000186898_100011207963 [0,1,0,0,0,0|2,0,1]=4 2515 B21R2.257667 CN(Cc1ccccc1)C(=O)NCCc2ccccc2 2708a_100000106460_100000186898 [0,1,0,0,0,0|2,0,1]=4 2516 B21R2.257667 CN(Cc1ccccc1)C(=O)NCCc2ccccc2 273464a_100000106460_100000186898 [0,1,0,0,0,0|2,0,1]=4 2517 B21R2.257667 O=C(C/C=C/c1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100016265936 [0,1,0,0,0,0|1,0,2]=4 2518 B21R2.257667 O=C(C/C=C/c1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100016265936 [0,1,0,0,0,0|1,0,2]=4 2519 B21R2.257667 O=C(CC#Cc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011352542 [0,1,0,0,0,0|1,0,2]=4 2520 B21R2.257667 O=C(CC#Cc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100011352542 [0,1,0,0,0,0|1,0,2]=4 2521 B21R2.257667 O=C(CCCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000211621 [0,1,0,0,0,0|1,0,0]=2 2522 B21R2.257667 O=C(CCCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000211621 [0,1,0,0,0,0|1,0,0]=2 2523 B21R2.257667 O=C(CCCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000211621 [0,1,0,0,0,0|2,0,0]=3 2524 B21R2.257667 O=C(CCCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000211621 [0,1,0,0,0,0|2,0,0]=3 2525 B21R2.257667 O=C(CCCc1ccccc1)[C@H](O)Cc2ccccc2 1458a_100009816399_100000211621 [0,1,0,0,0,0|1,0,2]=4 2526 B21R2.257667 O=C(CCOc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000184471 [0,1,0,0,0,0|2,0,0]=3 2527 B21R2.257667 O=C(CCOc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000184471 [0,1,0,0,0,0|2,0,0]=3 2528 B21R2.257667 O=C(CCOc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000184471 [0,1,0,0,0,0|3,0,0]=4 2529 B21R2.257667 O=C(CCOc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000184471 [0,1,0,0,0,0|3,0,0]=4 2530 B21R2.257667 O=C(CCSc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000246102 [0,1,0,0,0,0|2,0,0]=3 2531 B21R2.257667 O=C(CCSc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000246102 [0,1,0,0,0,0|2,0,0]=3 2532 B21R2.257667 O=C(CCSc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000246102 [0,1,0,0,0,0|3,0,0]=4 2533 B21R2.257667 O=C(CCSc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000246102 [0,1,0,0,0,0|3,0,0]=4 2534 B21R2.257667 O=C(CSCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200011217039 [0,1,0,0,0,0|2,0,0]=3 2535 B21R2.257667 O=C(CSCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_200011217039 [0,1,0,0,0,0|2,0,0]=3 2536 B21R2.257667 O=C(CSCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_200011217039 [0,1,0,0,0,0|3,0,0]=4 2537 B21R2.257667 O=C(CSCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_200011217039 [0,1,0,0,0,0|3,0,0]=4 2538 B21R2.257667 O=C(NCCc1ccccc1)/C(=C/c2ccccc2)/Cl 11a_100000106460_200020598536 [0,1,0,0,0,0|1,0,0]=2 2539 B21R2.257667 O=C(NCCc1ccccc1)/C(=C/c2ccccc2)/Cl 1626a_100000106460_200020598536 [0,1,0,0,0,0|1,0,0]=2 2540 B21R2.257667 O=C(NCCc1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100000106460_200020598536 [0,1,0,0,0,0|1,0,0]=2 2541 B21R2.257667 O=C(NCCc1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100000106460_200020598536 [0,1,0,0,0,0|1,0,0]=2 2542 B21R2.257667 O=C(NCCc1ccccc1)/C(=C\c2ccccc2)/F 11a_100000106460_100020889036 [0,1,0,0,0,0|1,0,0]=2 2543 B21R2.257667 O=C(NCCc1ccccc1)/C(=C\c2ccccc2)/F 527a_100000106460_100020889036 [0,1,0,0,0,0|1,0,0]=2 2544 B21R2.257667 O=C(NCCc1ccccc1)C(=Cc2cccnc2)F 11a_100000106460_100000731744 [0,1,0,0,0,0|2,0,0]=3 2545 B21R2.257667 O=C(NCCc1ccccc1)C(=Cc2cccnc2)F 240690a_100000106460_100000731744 [0,1,0,0,0,0|2,0,0]=3 2546 B21R2.257667 O=C(NCCc1ccccc1)C(=Cc2cccnc2)F 527a_100000106460_100000731744 [0,1,0,0,0,0|2,0,0]=3 2547 B21R2.257667 O=C(NCCc1ccccc1)C(=O)Nc2ccccc2 240690a_100000106460_100000738435 [0,1,0,0,0,0|2,0,0]=3 2548 B21R2.257667 O=C(NCCc1ccccc1)[C@H](O)Cc2ccccc2 240690a_100000106460_100009816399 [0,1,0,0,0,0|1,0,2]=4 2549 B21R2.257667 O=C(NCCc1ccccn1)/C(=C/c2ccccc2)/Cl 11a_100000211156_200020598536 [0,1,0,0,0,0|2,0,0]=3 2550 B21R2.257667 O=C(NCCc1ccccn1)/C(=C/c2ccccc2)/Cl 1626a_100000211156_200020598536 [0,1,0,0,0,0|2,0,0]=3 2551 B21R2.257667 O=C(NCCc1ccccn1)/C(=C/c2ccccc2)/Cl 240690a_100000211156_200020598536 [0,1,0,0,0,0|2,0,0]=3 2552 B21R2.257667 O=C(NCCc1ccccn1)/C(=C/c2ccccc2)/Cl 527a_100000211156_200020598536 [0,1,0,0,0,0|2,0,0]=3 2553 B21R2.257667 O=C(NCCc1ccccn1)/C(=C\c2ccccc2)/F 11a_100000211156_100020889036 [0,1,0,0,0,0|2,0,0]=3 2554 B21R2.257667 O=C(NCCc1ccccn1)/C(=C\c2ccccc2)/F 527a_100000211156_100020889036 [0,1,0,0,0,0|2,0,0]=3 2555 B21R2.257667 O=C(NCCc1ccccn1)C(=Cc2cccnc2)F 11a_100000211156_100000731744 [0,1,0,0,0,0|3,0,0]=4 2556 B21R2.257667 O=C(NCCc1ccccn1)C(=Cc2cccnc2)F 240690a_100000211156_100000731744 [0,1,0,0,0,0|3,0,0]=4 2557 B21R2.257667 O=C(NCCc1ccccn1)C(=Cc2cccnc2)F 527a_100000211156_100000731744 [0,1,0,0,0,0|3,0,0]=4 2558 B21R2.257667 O=C(NCCc1ccccn1)C(=O)Nc2ccccc2 240690a_100000211156_100000738435 [0,1,0,0,0,0|3,0,0]=4 2559 B21R2.257667 O=C(NCCc1cccnc1)/C(=C/c2ccccc2)/Cl 11a_100000736294_200020598536 [0,1,0,0,0,0|2,0,0]=3 2560 B21R2.257667 O=C(NCCc1cccnc1)/C(=C/c2ccccc2)/Cl 1626a_100000736294_200020598536 [0,1,0,0,0,0|2,0,0]=3 2561 B21R2.257667 O=C(NCCc1cccnc1)/C(=C/c2ccccc2)/Cl 240690a_100000736294_200020598536 [0,1,0,0,0,0|2,0,0]=3 2562 B21R2.257667 O=C(NCCc1cccnc1)/C(=C/c2ccccc2)/Cl 527a_100000736294_200020598536 [0,1,0,0,0,0|2,0,0]=3 2563 B21R2.257667 O=C(NCCc1cccnc1)/C(=C\c2ccccc2)/F 11a_100000736294_100020889036 [0,1,0,0,0,0|2,0,0]=3 2564 B21R2.257667 O=C(NCCc1cccnc1)/C(=C\c2ccccc2)/F 527a_100000736294_100020889036 [0,1,0,0,0,0|2,0,0]=3 2565 B21R2.257667 O=C(NCCc1cccnc1)C(=Cc2cccnc2)F 11a_100000736294_100000731744 [0,1,0,0,0,0|3,0,0]=4 2566 B21R2.257667 O=C(NCCc1cccnc1)C(=Cc2cccnc2)F 240690a_100000736294_100000731744 [0,1,0,0,0,0|3,0,0]=4 2567 B21R2.257667 O=C(NCCc1cccnc1)C(=Cc2cccnc2)F 527a_100000736294_100000731744 [0,1,0,0,0,0|3,0,0]=4 2568 B21R2.257667 O=C(NCCc1cccnc1)C(=O)Nc2ccccc2 240690a_100000736294_100000738435 [0,1,0,0,0,0|3,0,0]=4 2569 B21R2.257667 O=C(NCCc1ccncc1)/C(=C/c2ccccc2)/Cl 11a_100000742849_200020598536 [0,1,0,0,0,0|2,0,0]=3 2570 B21R2.257667 O=C(NCCc1ccncc1)/C(=C/c2ccccc2)/Cl 1626a_100000742849_200020598536 [0,1,0,0,0,0|2,0,0]=3 2571 B21R2.257667 O=C(NCCc1ccncc1)/C(=C/c2ccccc2)/Cl 240690a_100000742849_200020598536 [0,1,0,0,0,0|2,0,0]=3 2572 B21R2.257667 O=C(NCCc1ccncc1)/C(=C/c2ccccc2)/Cl 527a_100000742849_200020598536 [0,1,0,0,0,0|2,0,0]=3 2573 B21R2.257667 O=C(NCCc1ccncc1)/C(=C\c2ccccc2)/F 11a_100000742849_100020889036 [0,1,0,0,0,0|2,0,0]=3 2574 B21R2.257667 O=C(NCCc1ccncc1)/C(=C\c2ccccc2)/F 527a_100000742849_100020889036 [0,1,0,0,0,0|2,0,0]=3 2575 B21R2.257667 O=C(NCCc1ccncc1)C(=Cc2cccnc2)F 11a_100000742849_100000731744 [0,1,0,0,0,0|3,0,0]=4 2576 B21R2.257667 O=C(NCCc1ccncc1)C(=Cc2cccnc2)F 240690a_100000742849_100000731744 [0,1,0,0,0,0|3,0,0]=4 2577 B21R2.257667 O=C(NCCc1ccncc1)C(=Cc2cccnc2)F 527a_100000742849_100000731744 [0,1,0,0,0,0|3,0,0]=4 2578 B21R2.257667 O=C(NCCc1ccncc1)C(=O)Nc2ccccc2 240690a_100000742849_100000738435 [0,1,0,0,0,0|3,0,0]=4 2579 B21R2.257667 O=C(NCCc1cnccn1)/C(=C/c2ccccc2)/Cl 11a_100000723456_200020598536 [0,1,0,0,0,0|3,0,0]=4 2580 B21R2.257667 O=C(NCCc1cnccn1)/C(=C/c2ccccc2)/Cl 1626a_100000723456_200020598536 [0,1,0,0,0,0|3,0,0]=4 2581 B21R2.257667 O=C(NCCc1cnccn1)/C(=C/c2ccccc2)/Cl 240690a_100000723456_200020598536 [0,1,0,0,0,0|3,0,0]=4 2582 B21R2.257667 O=C(NCCc1cnccn1)/C(=C/c2ccccc2)/Cl 527a_100000723456_200020598536 [0,1,0,0,0,0|3,0,0]=4 2583 B21R2.257667 O=C(NCCc1cnccn1)/C(=C\c2ccccc2)/F 11a_100000723456_100020889036 [0,1,0,0,0,0|3,0,0]=4 2584 B21R2.257667 O=C(NCCc1cnccn1)/C(=C\c2ccccc2)/F 527a_100000723456_100020889036 [0,1,0,0,0,0|3,0,0]=4 2585 B21R2.257667 O=C(NNCc1ccccc1)/C(=C/c2ccccc2)/Cl 22a_100000007032_200020598536 [0,1,0,0,0,0|2,0,0]=3 2586 B21R2.257667 O=C(NNCc1ccccc1)/C(=C\c2ccccc2)/F 22a_100000007032_100020889036 [0,1,0,0,0,0|2,0,0]=3 2587 B21R2.257667 O=C(NNCc1ccccc1)C(=Cc2cccnc2)F 22a_100000007032_100000731744 [0,1,0,0,0,0|3,0,0]=4 2588 B21R2.257667 O=C(NNCc1ccccc1)C(=O)Nc2ccccc2 22a_100000007032_100000738435 [0,1,0,0,0,0|3,0,0]=4 2589 B21R2.257667 O=C(NNCc1ccccn1)/C(=C/c2ccccc2)/Cl 22a_100000736832_200020598536 [0,1,0,0,0,0|3,0,0]=4 2590 B21R2.257667 O=C(NNCc1ccccn1)/C(=C\c2ccccc2)/F 22a_100000736832_100020889036 [0,1,0,0,0,0|3,0,0]=4 2591 B21R2.257667 O=C(NNCc1cccnc1)/C(=C/c2ccccc2)/Cl 22a_100000738295_200020598536 [0,1,0,0,0,0|3,0,0]=4 2592 B21R2.257667 O=C(NNCc1cccnc1)/C(=C\c2ccccc2)/F 22a_100000738295_100020889036 [0,1,0,0,0,0|3,0,0]=4 2593 B21R2.257667 O=C(NNCc1ccncc1)/C(=C/c2ccccc2)/Cl 22a_100000736929_200020598536 [0,1,0,0,0,0|3,0,0]=4 2594 B21R2.257667 O=C(NNCc1ccncc1)/C(=C\c2ccccc2)/F 22a_100000736929_100020889036 [0,1,0,0,0,0|3,0,0]=4 2595 B21R2.257673 CC(=CC(=O)C/C=C/c1ccccc1)c2ccccc2 1458a_100000743005_100016265936 [0,1,0,0,0,0|1,0,2]=4 2596 B21R2.257673 CC(=CC(=O)CC#Cc1ccccc1)c2ccccc2 1458a_100000743005_100011352542 [0,1,0,0,0,0|1,0,2]=4 2597 B21R2.257673 CC(=CC(=O)CCCc1ccccc1)c2ccccc2 1458a_100000743005_100000211621 [0,1,0,0,0,0|1,0,0]=2 2598 B21R2.257673 CC(=CC(=O)CCOc1ccccc1)c2ccccc2 1458a_100000743005_100000184471 [0,1,0,0,0,0|2,0,0]=3 2599 B21R2.257673 CC(=CC(=O)CCSc1ccccc1)c2ccccc2 1458a_100000743005_100000246102 [0,1,0,0,0,0|2,0,0]=3 2600 B21R2.257673 CC(=CC(=O)CSCc1ccccc1)c2ccccc2 1458a_100000743005_200011217039 [0,1,0,0,0,0|2,0,0]=3 2601 B21R2.257673 CC(=CC(=O)NCCc1ccccc1)c2ccccc2 11a_100000106460_100000743005 [0,1,0,0,0,0|1,0,0]=2 2602 B21R2.257673 CC(=CC(=O)NCCc1ccccc1)c2ccccc2 1626a_100000106460_100000743005 [0,1,0,0,0,0|1,0,0]=2 2603 B21R2.257673 CC(=CC(=O)NCCc1ccccc1)c2ccccc2 240690a_100000106460_100000743005 [0,1,0,0,0,0|1,0,0]=2 2604 B21R2.257673 CC(=CC(=O)NCCc1ccccc1)c2ccccc2 527a_100000106460_100000743005 [0,1,0,0,0,0|1,0,0]=2 2605 B21R2.257673 CC(=CC(=O)NCCc1ccccn1)c2ccccc2 11a_100000211156_100000743005 [0,1,0,0,0,0|2,0,0]=3 2606 B21R2.257673 CC(=CC(=O)NCCc1ccccn1)c2ccccc2 1626a_100000211156_100000743005 [0,1,0,0,0,0|2,0,0]=3 2607 B21R2.257673 CC(=CC(=O)NCCc1ccccn1)c2ccccc2 240690a_100000211156_100000743005 [0,1,0,0,0,0|2,0,0]=3 2608 B21R2.257673 CC(=CC(=O)NCCc1ccccn1)c2ccccc2 527a_100000211156_100000743005 [0,1,0,0,0,0|2,0,0]=3 2609 B21R2.257673 CC(=CC(=O)NCCc1cccnc1)c2ccccc2 11a_100000736294_100000743005 [0,1,0,0,0,0|2,0,0]=3 2610 B21R2.257673 CC(=CC(=O)NCCc1cccnc1)c2ccccc2 1626a_100000736294_100000743005 [0,1,0,0,0,0|2,0,0]=3 2611 B21R2.257673 CC(=CC(=O)NCCc1cccnc1)c2ccccc2 240690a_100000736294_100000743005 [0,1,0,0,0,0|2,0,0]=3 2612 B21R2.257673 CC(=CC(=O)NCCc1cccnc1)c2ccccc2 527a_100000736294_100000743005 [0,1,0,0,0,0|2,0,0]=3 2613 B21R2.257673 CC(=CC(=O)NCCc1ccncc1)c2ccccc2 11a_100000742849_100000743005 [0,1,0,0,0,0|2,0,0]=3 2614 B21R2.257673 CC(=CC(=O)NCCc1ccncc1)c2ccccc2 1626a_100000742849_100000743005 [0,1,0,0,0,0|2,0,0]=3 2615 B21R2.257673 CC(=CC(=O)NCCc1ccncc1)c2ccccc2 240690a_100000742849_100000743005 [0,1,0,0,0,0|2,0,0]=3 2616 B21R2.257673 CC(=CC(=O)NCCc1ccncc1)c2ccccc2 527a_100000742849_100000743005 [0,1,0,0,0,0|2,0,0]=3 2617 B21R2.257673 CC(=CC(=O)NCCc1cnccn1)c2ccccc2 11a_100000723456_100000743005 [0,1,0,0,0,0|3,0,0]=4 2618 B21R2.257673 CC(=CC(=O)NCCc1cnccn1)c2ccccc2 1626a_100000723456_100000743005 [0,1,0,0,0,0|3,0,0]=4 2619 B21R2.257673 CC(=CC(=O)NCCc1cnccn1)c2ccccc2 240690a_100000723456_100000743005 [0,1,0,0,0,0|3,0,0]=4 2620 B21R2.257673 CC(=CC(=O)NCCc1cnccn1)c2ccccc2 527a_100000723456_100000743005 [0,1,0,0,0,0|3,0,0]=4 2621 B21R2.257673 CC(=CC(=O)NNCc1ccccc1)c2ccccc2 22a_100000007032_100000743005 [0,1,0,0,0,0|2,0,0]=3 2622 B21R2.257673 CC(=CC(=O)NNCc1ccccn1)c2ccccc2 22a_100000736832_100000743005 [0,1,0,0,0,0|3,0,0]=4 2623 B21R2.257673 CC(=CC(=O)NNCc1cccnc1)c2ccccc2 22a_100000738295_100000743005 [0,1,0,0,0,0|3,0,0]=4 2624 B21R2.257673 CC(=CC(=O)NNCc1ccncc1)c2ccccc2 22a_100000736929_100000743005 [0,1,0,0,0,0|3,0,0]=4 2625 B21R2.257673 CC(CC(=O)CCCc1ccccc1)c2ccccc2 1458a_100000183687_100000211621 [0,1,0,0,0,0|1,0,2]=4 2626 B21R2.257673 CC(CC(=O)CCCc1ccccc1)c2ccccc2 1458a_100011207963_100000756946 [0,1,0,0,0,0|1,0,2]=4 2627 B21R2.257673 CC(CC(=O)NCCc1ccccc1)c2ccccc2 11a_100000106460_100000183687 [0,1,0,0,0,0|1,0,2]=4 2628 B21R2.257673 CC(CC(=O)NCCc1ccccc1)c2ccccc2 1626a_100000106460_100000183687 [0,1,0,0,0,0|1,0,2]=4 2629 B21R2.257673 CC(CC(=O)NCCc1ccccc1)c2ccccc2 240690a_100000106460_100000183687 [0,1,0,0,0,0|1,0,2]=4 2630 B21R2.257673 CC(CC(=O)NCCc1ccccc1)c2ccccc2 527a_100000106460_100000183687 [0,1,0,0,0,0|1,0,2]=4 2631 B21R2.257673 CN(CC(=O)CCCc1ccccc1)c2ccccc2 1458a_100000745425_100000211621 [0,1,0,0,0,0|2,0,1]=4 2632 B21R2.257673 CN(CC(=O)NCCc1ccccc1)c2ccccc2 2230a_100000210012_100000183012 [0,1,0,0,0,0|2,0,1]=4 2633 B21R2.257673 CN(CC(=O)NCCc1ccccc1)c2ccccc2 240690a_100000106460_100000745425 [0,1,0,0,0,0|2,0,1]=4 2634 B21R2.257673 CN(CC(=O)NCCc1ccccc1)c2ccccc2 269982a_100000210012_100000183012 [0,1,0,0,0,0|2,0,1]=4 2635 B21R2.257673 CN(CC(=O)NCCc1ccccc1)c2ccccc2 34a_100000210012_100000183012 [0,1,0,0,0,0|2,0,1]=4 2636 B21R2.257673 CN(CC(=O)NCCc1ccccc1)c2ccccc2 527a_100000106460_100000745425 [0,1,0,0,0,0|2,0,1]=4 2637 B21R2.257673 CN(CC(=O)OCCc1ccccc1)c2ccccc2 2230a_100000210012_200000077782 [0,1,0,0,0,0|1,0,1]=3 2638 B21R2.257673 CN(CC(=O)OCCc1ccccc1)c2ccccc2 269982a_100000210012_200000077782 [0,1,0,0,0,0|1,0,1]=3 2639 B21R2.257673 CN(CC(=O)OCCc1ccccc1)c2ccccc2 34a_100000210012_200000077782 [0,1,0,0,0,0|1,0,1]=3 2640 B21R2.257673 C[C@@H](NC(=O)CCCc1ccccc1)c2ccccc2 11a_100000751104_100011207963 [0,1,0,0,0,0|2,0,1]=4 2641 B21R2.257673 C[C@@H](NC(=O)CCCc1ccccc1)c2ccccc2 1626a_100000751104_100011207963 [0,1,0,0,0,0|2,0,1]=4 2642 B21R2.257673 C[C@@H](NC(=O)CCCc1ccccc1)c2ccccc2 240690a_100000751104_100011207963 [0,1,0,0,0,0|2,0,1]=4 2643 B21R2.257673 C[C@@H](NC(=O)CCCc1ccccc1)c2ccccc2 527a_100000751104_100011207963 [0,1,0,0,0,0|2,0,1]=4 2644 B21R2.257673 C[C@@H](NC(=O)NCCc1ccccc1)c2ccccc2 2708a_100000106460_100000751104 [0,1,0,0,0,0|2,0,1]=4 2645 B21R2.257673 C[C@@H](NC(=O)NCCc1ccccc1)c2ccccc2 2708a_100000751104_100000106460 [0,1,0,0,0,0|2,0,1]=4 2646 B21R2.257673 C[C@@H](NC(=O)NCCc1ccccc1)c2ccccc2 273464a_100000106460_100000751104 [0,1,0,0,0,0|2,0,1]=4 2647 B21R2.257673 C[C@@H](NC(=O)NCCc1ccccc1)c2ccccc2 273464a_100000751104_100000106460 [0,1,0,0,0,0|2,0,1]=4 2648 B21R2.257673 C[C@@H](NC(=O)NCCc1ccccc1)c2ccccc2 512a_100000106460_100000751104 [0,1,0,0,0,0|2,0,1]=4 2649 B21R2.257673 C[C@@H](NC(=O)NCCc1ccccc1)c2ccccc2 512a_100000751104_100000106460 [0,1,0,0,0,0|2,0,1]=4 2650 B21R2.257673 O=C(CC(=O)c1ccccc1)NCCc2ccccc2 1458a_100000185807_100000183012 [0,1,0,0,0,0|1,0,1]=3 2651 B21R2.257673 O=C(CC(=O)c1ccccc1)NOCc2ccccc2 1458a_100000185807_100000230105 [0,1,0,0,0,0|2,0,1]=4 2652 B21R2.257673 O=C(CC(=O)c1ccccc1)OCCc2ccccc2 1458a_100000185807_200000077782 [0,1,0,0,0,0|0,0,1]=2 2653 B21R2.257673 O=C(CC(O)c1ccccc1)NCCc2ccccc2 240690a_100000106460_100000690199 [0,1,0,0,0,0|1,0,2]=4 2654 B21R2.257673 O=C(CCCc1ccccc1)CC(=O)c2ccccc2 1458a_100011207963_100000211460 [0,1,0,0,0,0|1,0,1]=3 2655 B21R2.257673 O=C(CCCc1ccccc1)CC(=O)c2ccccn2 1458a_100011207963_100000027445 [0,1,0,0,0,0|2,0,1]=4 2656 B21R2.257673 O=C(CCCc1ccccc1)CC(=O)c2cccnc2 1458a_100011207963_100015188593 [0,1,0,0,0,0|2,0,1]=4 2657 B21R2.257673 O=C(CCCc1ccccc1)CC(=O)c2ccncc2 1458a_100011207963_100000027454 [0,1,0,0,0,0|2,0,1]=4 2658 B21R2.257673 O=C(CCCc1ccccc1)CC(O)c2ccccc2 1458a_100000690199_100000211621 [0,1,0,0,0,0|1,0,2]=4 2659 B21R2.257673 O=C(CCCc1ccccc1)CC(O)c2ccccc2 1458a_100011207963_100000185958 [0,1,0,0,0,0|1,0,2]=4 2660 B21R2.257673 O=C(CCCc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100011207963_100011933945 [0,1,0,0,0,0|1,0,2]=4 2661 B21R2.257673 O=C(CCCc1ccccn1)CC(=O)c2ccccc2 1458a_100000752327_100000211460 [0,1,0,0,0,0|2,0,1]=4 2662 B21R2.257673 O=C(CCCc1ccncc1)CC(=O)c2ccccc2 1458a_100020654287_100000211460 [0,1,0,0,0,0|2,0,1]=4 2663 B21R2.257673 O=C(CCOc1ccccc1)CC(=O)c2ccccc2 1458a_100000182761_100000211460 [0,1,0,0,0,0|2,0,1]=4 2664 B21R2.257673 O=C(CCSc1ccccc1)CC(=O)c2ccccc2 1458a_100000182436_100000211460 [0,1,0,0,0,0|2,0,1]=4 2665 B21R2.257673 O=C(COCc1ccccc1)CC(=O)c2ccccc2 1458a_100000230186_100000211460 [0,1,0,0,0,0|2,0,1]=4 2666 B21R2.257673 O=C(COCc1ccccc1)NC(=O)c2ccccc2 7a_100000210790_100000010347 [0,1,0,0,0,0|3,0,0]=4 2667 B21R2.257673 O=C(CSCc1ccccc1)CC(=O)c2ccccc2 1458a_100000150264_100000211460 [0,1,0,0,0,0|2,0,1]=4 2668 B21R2.257673 O=C(CSCc1ccccc1)NC(=O)c2ccccc2 62a_100000211182_100000010347 [0,1,0,0,0,0|3,0,0]=4 2669 B21R2.3257524 O=S(=O)(C=Cc1ccccc1)NCCc2ccccc2 40a_100000106460_100011098038 [0,1,0,0,0,0|2,0,0]=3 2670 B21R2.3257524 O=S(=O)(C=Cc1ccccc1)NCCc2ccccn2 40a_100000211156_100011098038 [0,1,0,0,0,0|3,0,0]=4 2671 B21R2.3257524 O=S(=O)(C=Cc1ccccc1)NCCc2cccnc2 40a_100000736294_100011098038 [0,1,0,0,0,0|3,0,0]=4 2672 B21R2.3257524 O=S(=O)(C=Cc1ccccc1)NCCc2ccncc2 40a_100000742849_100011098038 [0,1,0,0,0,0|3,0,0]=4 2673 B21R2.3257524 O=S(=O)(C=Cc1ccccc1)NNCc2ccccc2 40a_100000007032_100011098038 [0,1,0,0,0,0|3,0,0]=4 2674 B21R3.240 O=c1cc(c(n[nH]1)c2ccccc2)c3ccccc3 271570a_100011218836_100009828137 [0,0,0,1,0,0|2,0,1]=4 2675 B21R3.2808 O=C(CCc1ccccc1)C2CCc3c2cccc3 1458a_100000750891_100000765856 [0,0,0,1,0,0|1,0,2]=4 2676 B21R3.2808 O=C(CNc1ccccc1)N2CCc3c2cccc3 34a_100000106764_100000183021 [0,0,0,1,0,0|2,0,1]=4 2677 B21R3.2808 O=C(COc1ccccc1)N2CCc3c2cccc3 34a_100000210340_100000183021 [0,0,0,1,0,0|2,0,1]=4 2678 B21R3.2808 O=C(COc1ccccc1)N2CCc3c2cccc3 7a_100000210340_100000183021 [0,0,0,1,0,0|2,0,1]=4 2679 B21R3.2808 O=C(CSc1ccccc1)N2CCc3c2cccc3 62a_100000183021_100000041952 [0,0,0,1,0,0|2,0,1]=4 2680 B21R3.2808 O=C(CSc1ccccc1)N2CCc3c2cccc3 62a_100000719477_100000183021 [0,0,0,1,0,0|2,0,1]=4 2681 B21R3.2808 O=C(NCc1ccccc1)C2CCc3c2cccc3 11a_100015324214_100000750891 [0,0,0,1,0,0|2,0,1]=4 2682 B21R3.2808 O=C(NCc1ccccc1)C2CCc3c2cccc3 1626a_100015324214_100000750891 [0,0,0,1,0,0|2,0,1]=4 2683 B21R3.2808 O=C(NCc1ccccc1)C2CCc3c2cccc3 240690a_100015324214_100000750891 [0,0,0,1,0,0|2,0,1]=4 2684 B21R3.2808 O=C(NCc1ccccc1)C2CCc3c2cccc3 527a_100015324214_100000750891 [0,0,0,1,0,0|2,0,1]=4 2685 B21R3.2808 O=C(NNc1ccccc1)C2CCc3c2cccc3 22a_100015195140_100000750891 [0,0,0,1,0,0|3,0,0]=4 2686 B21R3.22167 Brc1ccc2ccccc2c1CNc3ccccc3 207a_100000106764_100010090029 [0,0,0,1,0,0|3,0,0]=4 2687 B21R3.22167 Brc1ccc2ccccc2c1CNc3ccccc3 270302a_100000106764_100010090029 [0,0,0,1,0,0|3,0,0]=4 2688 B21R3.22167 Brc1ccc2ccccc2c1NCc3ccccc3 34a_100009817101_100015291786 [0,0,0,1,0,0|3,0,0]=4 2689 B21R3.22167 Brc1ccc2ccccc2c1OCc3ccccc3 34a_100009996032_100015291786 [0,0,0,1,0,0|3,0,0]=4 2690 B21R3.22167 Brc1ccc2ccccc2c1OCc3ccccc3 7a_100009996032_100000211182 [0,0,0,1,0,0|3,0,0]=4 2691 B21R3.22167 Brc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100010090040 [0,0,0,1,0,0|3,0,0]=4 2692 B21R3.22167 Brc1ccc2ccccc2c1SCc3ccccc3 62a_100010090040_100015291786 [0,0,0,1,0,0|3,0,0]=4 2693 B21R3.22167 Cc1ccc2ccccc2c1CNc3ccccc3 207a_100000106764_100011361466 [0,0,0,1,0,0|3,0,0]=4 2694 B21R3.22167 Cc1ccc2ccccc2c1CNc3ccccc3 270302a_100000106764_100011361466 [0,0,0,1,0,0|3,0,0]=4 2695 B21R3.22167 Cc1ccc2ccccc2c1CNc3ccccc3 34a_100000106764_100000689653 [0,0,0,1,0,0|3,0,0]=4 2696 B21R3.22167 Cc1ccc2ccccc2c1COc3ccccc3 34a_100000210340_100000689653 [0,0,0,1,0,0|3,0,0]=4 2697 B21R3.22167 Cc1ccc2ccccc2c1COc3ccccc3 7a_100000210340_100000689653 [0,0,0,1,0,0|3,0,0]=4 2698 B21R3.22167 Cc1ccc2ccccc2c1CSc3ccccc3 62a_100000689653_100000041952 [0,0,0,1,0,0|3,0,0]=4 2699 B21R3.22167 Cc1ccc2ccccc2c1CSc3ccccc3 62a_100000719477_100000689653 [0,0,0,1,0,0|3,0,0]=4 2700 B21R3.22167 Cc1ccc2ccccc2c1NCc3ccccc3 207a_100000688109_100015611070 [0,0,0,1,0,0|3,0,0]=4 2701 B21R3.22167 Cc1ccc2ccccc2c1NCc3ccccc3 34a_100000688109_100015291786 [0,0,0,1,0,0|3,0,0]=4 2702 B21R3.22167 Cc1ccc2ccccc2c1OCc3ccccc3 34a_100000039261_100015291786 [0,0,0,1,0,0|3,0,0]=4 2703 B21R3.22167 Cc1ccc2ccccc2c1OCc3ccccc3 7a_100000039261_100000211182 [0,0,0,1,0,0|3,0,0]=4 2704 B21R3.22167 Cc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100000759710 [0,0,0,1,0,0|3,0,0]=4 2705 B21R3.22167 Cc1ccc2ccccc2c1SCc3ccccc3 62a_100000759710_100015291786 [0,0,0,1,0,0|3,0,0]=4 2706 B21R3.22167 Clc1ccc2ccccc2c1NCc3ccccc3 34a_200009860907_100015291786 [0,0,0,1,0,0|3,0,0]=4 2707 B21R3.22167 Nc1ccc2ccccc2c1OCc3ccccc3 34a_100000007060_100015291786 [0,0,0,1,0,0|3,0,0]=4 2708 B21R3.22167 Nc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100000705303 [0,0,0,1,0,0|3,0,0]=4 2709 B21R3.22167 Nc1ccc2ccccc2c1SCc3ccccc3 62a_100000705303_100015291786 [0,0,0,1,0,0|3,0,0]=4 2710 B21R3.22167 Oc1ccc2ccccc2c1NCc3ccccc3 34a_100000007056_100015291786 [0,0,0,1,0,0|2,0,1]=4 2711 B21R3.22167 Oc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100000183829 [0,0,0,1,0,0|2,0,1]=4 2712 B21R3.41505 O=C(CCc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 1458a_100009815801_100000765856 [0,0,0,1,0,0|1,0,2]=4 2713 B21R3.41505 O=C(NCc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 11a_100015324214_100009815801 [0,0,0,1,0,0|2,0,1]=4 2714 B21R3.41505 O=C(NCc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 240690a_100015324214_100009815801 [0,0,0,1,0,0|2,0,1]=4 2715 B21R3.41505 O=C(NCc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 527a_100015324214_100009815801 [0,0,0,1,0,0|2,0,1]=4 2716 B21R3.41505 O=C(NNc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 22a_100015195140_100009815801 [0,0,0,1,0,0|3,0,0]=4 2717 B21R3.47750 C(=Cc1ccc2ccccc2c1)Cc3ccccc3 271570a_200016263579_100000233703 [0,0,0,1,0,0|2,0,1]=4 2718 B21R3.47750 C(=Cc1ccc2ccccc2n1)Cc3ccccc3 271570a_200016263579_100011291633 [0,0,0,1,0,0|2,0,1]=4 2719 B21R3.47750 c1cc(ccn1)CCOc2ccc3ccncc3c2 7a_100000752006_100000723409 [0,0,0,1,0,0|3,0,0]=4 2720 B21R3.47750 c1cc(ccn1)CCOc2ccc3cnccc3c2 7a_100000046372_100000723409 [0,0,0,1,0,0|3,0,0]=4 2721 B21R3.47750 c1ccc(cc1)CCNc2ccc3ccccc3c2 34a_100000211940_100000765856 [0,0,0,1,0,0|2,0,0]=3 2722 B21R3.47750 c1ccc(cc1)CCNc2ccc3ccccc3c2 7a_100000211940_100000765856 [0,0,0,1,0,0|2,0,0]=3 2723 B21R3.47750 c1ccc(cc1)CCNc2ccc3ccccc3n2 27a_100000106460_100011291633 [0,0,0,1,0,0|2,0,0]=3 2724 B21R3.47750 c1ccc(cc1)CCNc2ccc3cccnc3c2 34a_100102887122_100000765856 [0,0,0,1,0,0|3,0,0]=4 2725 B21R3.47750 c1ccc(cc1)CCNc2ccc3cccnc3n2 27a_100000106460_100000075685 [0,0,0,1,0,0|3,0,0]=4 2726 B21R3.47750 c1ccc(cc1)CCNc2ccc3ccncc3n2 27a_100000106460_100000020162 [0,0,0,1,0,0|3,0,0]=4 2727 B21R3.47750 c1ccc(cc1)CCNc2ccc3cnccc3c2 34a_100000039641_100000765856 [0,0,0,1,0,0|3,0,0]=4 2728 B21R3.47750 c1ccc(cc1)CCNc2ccc3ncccc3c2 34a_100011198106_100000765856 [0,0,0,1,0,0|3,0,0]=4 2729 B21R3.47750 c1ccc(cc1)CCNc2ccc3ncccc3n2 27a_100000106460_100000073381 [0,0,0,1,0,0|3,0,0]=4 2730 B21R3.47750 c1ccc(cc1)CCNc2cnc3ccccc3n2 27a_100000106460_100000756483 [0,0,0,1,0,0|3,0,0]=4 2731 B21R3.47750 c1ccc(cc1)CCNc2ncc3ccccc3n2 27a_100000106460_100000097389 [0,0,0,1,0,0|3,0,0]=4 2732 B21R3.47750 c1ccc(cc1)CCOc2ccc3ccccc3c2 34a_100000185828_100000765856 [0,0,0,1,0,0|1,0,0]=2 2733 B21R3.47750 c1ccc(cc1)CCOc2ccc3ccccc3c2 7a_100000185828_100000765856 [0,0,0,1,0,0|1,0,0]=2 2734 B21R3.47750 c1ccc(cc1)CCOc2ccc3cccnc3c2 34a_100011216045_100000765856 [0,0,0,1,0,0|2,0,0]=3 2735 B21R3.47750 c1ccc(cc1)CCOc2ccc3ccncc3c2 7a_100000752006_100000765856 [0,0,0,1,0,0|2,0,0]=3 2736 B21R3.47750 c1ccc(cc1)CCOc2ccc3cnccc3c2 34a_100000046372_100000765856 [0,0,0,1,0,0|2,0,0]=3 2737 B21R3.47750 c1ccc(cc1)CCOc2ccc3cnccc3c2 7a_100000046372_100000765856 [0,0,0,1,0,0|2,0,0]=3 2738 B21R3.47750 c1ccc(cc1)CCOc2ccc3ncccc3c2 34a_100011215586_100000765856 [0,0,0,1,0,0|2,0,0]=3 2739 B21R3.47750 c1ccc(cc1)CCOc2ccc3ncccc3c2 7a_100011215586_100000765856 [0,0,0,1,0,0|2,0,0]=3 2740 B21R3.47750 c1ccc(cc1)CCOc2ccc3nccnc3c2 34a_100000694412_100000765856 [0,0,0,1,0,0|3,0,0]=4 2741 B21R3.47750 c1ccc(cc1)CCOc2cnc3ccccc3c2 34a_100011934006_100000765856 [0,0,0,1,0,0|2,0,0]=3 2742 B21R3.47750 c1ccc(cc1)CCOc2cnc3ccccc3c2 7a_100011934006_100000765856 [0,0,0,1,0,0|2,0,0]=3 2743 B21R3.47750 c1ccc(cc1)CCSc2cc3ccccc3cn2 62a_100000765856_100000047361 [0,0,0,1,0,0|2,1,0]=4 2744 B21R3.47750 c1ccc(cc1)CCSc2cc3ccccc3cn2 62a_100009816522_100011218657 [0,0,0,1,0,0|2,1,0]=4 2745 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccccc3c2 62a_100000765856_100000233703 [0,0,0,1,0,0|1,1,0]=3 2746 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100000765856_100011291633 [0,0,0,1,0,0|1,1,0]=3 2747 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011291633_100011218657 [0,0,0,1,0,0|1,1,0]=3 2748 B21R3.47750 c1ccc(cc1)CCSc2ccc3cccnc3c2 62a_100000765856_100009816655 [0,0,0,1,0,0|2,1,0]=4 2749 B21R3.47750 c1ccc(cc1)CCSc2ccc3cccnc3n2 62a_100000075685_100011218657 [0,0,0,1,0,0|2,1,0]=4 2750 B21R3.47750 c1ccc(cc1)CCSc2ccc3cccnc3n2 62a_100000765856_100000075685 [0,0,0,1,0,0|2,1,0]=4 2751 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccncc3c2 62a_100000686496_100011218657 [0,0,0,1,0,0|2,1,0]=4 2752 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccncc3c2 62a_100000765856_100000686496 [0,0,0,1,0,0|2,1,0]=4 2753 B21R3.47750 c1ccc(cc1)CCSc2ccc3ccncc3n2 62a_100000765856_100000020162 [0,0,0,1,0,0|2,1,0]=4 2754 B21R3.47750 c1ccc(cc1)CCSc2ccc3cnccc3c2 62a_100000765856_100009816743 [0,0,0,1,0,0|2,1,0]=4 2755 B21R3.47750 c1ccc(cc1)CCSc2ccc3cnccc3c2 62a_100009816743_100011218657 [0,0,0,1,0,0|2,1,0]=4 2756 B21R3.47750 c1ccc(cc1)CCSc2ccc3ncccc3c2 62a_100000765856_100011215947 [0,0,0,1,0,0|2,1,0]=4 2757 B21R3.47750 c1ccc(cc1)CCSc2ccc3ncccc3c2 62a_100011215947_100011218657 [0,0,0,1,0,0|2,1,0]=4 2758 B21R3.47750 c1ccc(cc1)CCSc2ccc3ncccc3n2 62a_100000765856_100000073381 [0,0,0,1,0,0|2,1,0]=4 2759 B21R3.47750 c1ccc(cc1)CCSc2cnc3ccccc3c2 62a_100000765856_100000737414 [0,0,0,1,0,0|2,1,0]=4 2760 B21R3.47750 c1ccc(cc1)CCSc2cnc3ccccc3n2 62a_100000756483_100011218657 [0,0,0,1,0,0|2,1,0]=4 2761 B21R3.47750 c1ccc(cc1)CCSc2cnc3ccccc3n2 62a_100000765856_100000756483 [0,0,0,1,0,0|2,1,0]=4 2762 B21R3.47750 c1ccc(cc1)CCSc2ncc3ccccc3n2 62a_100000765856_100000097389 [0,0,0,1,0,0|2,1,0]=4 2763 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 207a_100000739491_100015611070 [0,0,0,1,0,0|3,0,0]=4 2764 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 207a_100015324214_100000211584 [0,0,0,1,0,0|3,0,0]=4 2765 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 2230a_100000739491_100015291786 [0,0,0,1,0,0|3,0,0]=4 2766 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 2230a_100015324214_100011216711 [0,0,0,1,0,0|3,0,0]=4 2767 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 270004a_100000739491_100015611070 [0,0,0,1,0,0|3,0,0]=4 2768 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 270004a_100015324214_100000211584 [0,0,0,1,0,0|3,0,0]=4 2769 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 34a_100000739491_100015291786 [0,0,0,1,0,0|3,0,0]=4 2770 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3c2 34a_100015324214_100011216711 [0,0,0,1,0,0|3,0,0]=4 2771 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3n2 207a_100015324214_100000759686 [0,0,0,1,0,0|3,0,0]=4 2772 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3n2 2230a_100015324214_100000737579 [0,0,0,1,0,0|3,0,0]=4 2773 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3n2 270004a_100015324214_100000759686 [0,0,0,1,0,0|3,0,0]=4 2774 B21R3.47750 c1ccc(cc1)CNCc2ccc3ccccc3n2 34a_100015324214_100000737579 [0,0,0,1,0,0|3,0,0]=4 2775 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3c2 34a_100000210790_100011216711 [0,0,0,1,0,0|3,0,0]=4 2776 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3c2 34a_100011215330_100015291786 [0,0,0,1,0,0|3,0,0]=4 2777 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3c2 7a_100000210790_100011216711 [0,0,0,1,0,0|3,0,0]=4 2778 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3c2 7a_100011215330_100000211182 [0,0,0,1,0,0|3,0,0]=4 2779 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3n2 34a_100000210790_100000737579 [0,0,0,1,0,0|3,0,0]=4 2780 B21R3.47750 c1ccc(cc1)COCc2ccc3ccccc3n2 7a_100000210790_100000737579 [0,0,0,1,0,0|3,0,0]=4 2781 B21R3.47750 c1ccc(cc1)CSCc2ccc3ccccc3c2 62a_100000211182_100011216711 [0,0,0,1,0,0|3,0,0]=4 2782 B21R3.47750 c1ccc(cc1)CSCc2ccc3ccccc3c2 62a_100011216711_100015291786 [0,0,0,1,0,0|3,0,0]=4 2783 B21R3.47750 c1ccc(cc1)CSCc2ccc3ccccc3n2 62a_100000211182_100000737579 [0,0,0,1,0,0|3,0,0]=4 2784 B21R3.47750 c1ccc(cc1)CSCc2ccc3ccccc3n2 62a_100000737579_100015291786 [0,0,0,1,0,0|3,0,0]=4 2785 B21R3.47750 c1ccc(cc1)SCSc2ccc3ccccc3c2 62a_100011218342_100000233703 [0,0,0,1,0,0|2,1,0]=4 2786 B21R3.47750 c1ccc(cc1)SCSc2ccc3ccccc3n2 62a_100011218342_100011291633 [0,0,0,1,0,0|2,1,0]=4 2787 B21R3.47750 c1ccc(cc1)SCSc2ccc3ccccc3n2 62a_100011291633_100011218342 [0,0,0,1,0,0|2,1,0]=4 2788 B21R3.47750 c1ccc(nc1)CCNc2ccc3ccccc3c2 7a_100000211940_100015183660 [0,0,0,1,0,0|3,0,0]=4 2789 B21R3.47750 c1ccc(nc1)CCNc2ccc3ccccc3n2 27a_100000211156_100011291633 [0,0,0,1,0,0|3,0,0]=4 2790 B21R3.47750 c1ccc(nc1)CCOc2ccc3ccccc3c2 7a_100000185828_100015183660 [0,0,0,1,0,0|2,0,0]=3 2791 B21R3.47750 c1ccc(nc1)CCOc2ccc3ccncc3c2 7a_100000752006_100015183660 [0,0,0,1,0,0|3,0,0]=4 2792 B21R3.47750 c1ccc(nc1)CCOc2ccc3cnccc3c2 7a_100000046372_100015183660 [0,0,0,1,0,0|3,0,0]=4 2793 B21R3.47750 c1ccc(nc1)CCOc2ccc3ncccc3c2 7a_100011215586_100015183660 [0,0,0,1,0,0|3,0,0]=4 2794 B21R3.47750 c1ccc(nc1)CCOc2cnc3ccccc3c2 7a_100011934006_100015183660 [0,0,0,1,0,0|3,0,0]=4 2795 B21R3.47750 c1ccc(nc1)CCSc2ccc3ccccc3c2 62a_100015183660_100000233703 [0,0,0,1,0,0|2,1,0]=4 2796 B21R3.47750 c1ccc(nc1)CCSc2ccc3ccccc3n2 62a_100011291633_100015183660 [0,0,0,1,0,0|2,1,0]=4 2797 B21R3.47750 c1ccc(nc1)CCSc2ccc3ccccc3n2 62a_100015183660_100011291633 [0,0,0,1,0,0|2,1,0]=4 2798 B21R3.47750 c1ccc2cc(ccc2c1)NCCc3ccncc3 7a_100000211940_100000723409 [0,0,0,1,0,0|3,0,0]=4 2799 B21R3.47750 c1ccc2cc(ccc2c1)OCCc3ccncc3 7a_100000185828_100000723409 [0,0,0,1,0,0|2,0,0]=3 2800 B21R3.47750 c1ccc2cc(ccc2c1)SCCc3ccncc3 62a_100000723409_100000233703 [0,0,0,1,0,0|2,1,0]=4 2801 B21R3.47750 c1ccc2nc(ccc2c1)NCCc3ccncc3 27a_100000742849_100011291633 [0,0,0,1,0,0|3,0,0]=4 2802 B21R3.47750 c1ccc2nc(ccc2c1)SCCc3ccncc3 62a_100000723409_100011291633 [0,0,0,1,0,0|2,1,0]=4 2803 B21R3.47750 c1ccc2nc(ccc2c1)SCCc3ccncc3 62a_100011291633_100000723409 [0,0,0,1,0,0|2,1,0]=4 2804 B21R3.47750 c1ccc2ncc(cc2c1)OCCc3ccncc3 7a_100011934006_100000723409 [0,0,0,1,0,0|3,0,0]=4 2805 B21R3.47750 c1cnc2ccc(cc2c1)OCCc3ccncc3 7a_100011215586_100000723409 [0,0,0,1,0,0|3,0,0]=4 2806 B21R3.47750 c1cncc(c1)CCNc2ccc3ccccc3c2 7a_100000211940_200011713674 [0,0,0,1,0,0|3,0,0]=4 2807 B21R3.47750 c1cncc(c1)CCNc2ccc3ccccc3n2 27a_100000736294_100011291633 [0,0,0,1,0,0|3,0,0]=4 2808 B21R3.47750 c1cncc(c1)CCOc2ccc3ccccc3c2 7a_100000185828_200011713674 [0,0,0,1,0,0|2,0,0]=3 2809 B21R3.47750 c1cncc(c1)CCOc2ccc3ccncc3c2 7a_100000752006_200011713674 [0,0,0,1,0,0|3,0,0]=4 2810 B21R3.47750 c1cncc(c1)CCOc2ccc3cnccc3c2 7a_100000046372_200011713674 [0,0,0,1,0,0|3,0,0]=4 2811 B21R3.47750 c1cncc(c1)CCOc2ccc3ncccc3c2 7a_100011215586_200011713674 [0,0,0,1,0,0|3,0,0]=4 2812 B21R3.47750 c1cncc(c1)CCOc2cnc3ccccc3c2 7a_100011934006_200011713674 [0,0,0,1,0,0|3,0,0]=4 2813 B21R3.47750 c1cncc(c1)CCSc2ccc3ccccc3c2 62a_200011713674_100000233703 [0,0,0,1,0,0|2,1,0]=4 2814 B21R3.47750 c1cncc(c1)CCSc2ccc3ccccc3n2 62a_100011291633_200011713674 [0,0,0,1,0,0|2,1,0]=4 2815 B21R3.47750 c1cncc(c1)CCSc2ccc3ccccc3n2 62a_200011713674_100011291633 [0,0,0,1,0,0|2,1,0]=4 2816 B21R3.520292 O=C(CCCc1ccccc1)C2Cc3c2cccc3 1458a_200000238571_100000211621 [0,0,0,1,0,0|1,0,2]=4 2817 B21R3.520292 O=C(NCCc1ccccc1)C2Cc3c2cccc3 11a_100000106460_200000238571 [0,0,0,1,0,0|1,0,2]=4 2818 B21R3.520292 O=C(NCCc1ccccc1)C2Cc3c2cccc3 1626a_100000106460_200000238571 [0,0,0,1,0,0|1,0,2]=4 2819 B21R3.520292 O=C(NCCc1ccccc1)C2Cc3c2cccc3 240690a_100000106460_200000238571 [0,0,0,1,0,0|1,0,2]=4 2820 B21R3.520292 O=C(NCCc1ccccc1)C2Cc3c2cccc3 527a_100000106460_200000238571 [0,0,0,1,0,0|1,0,2]=4 2821 B19R2.8900 C/C(=C\c1ccccc1)/COCc2ccccc2 34a_200025717232_100015291786 [0,0,0,0,1,0|3,0,0]=4 2822 B19R2.8900 C/C(=C\c1ccccc1)/COCc2ccccc2 7a_200025717232_100000211182 [0,0,0,0,1,0|3,0,0]=4 2823 B19R2.8900 CC(Cc1ccccc1)OCCc2ccccc2 34a_100000210268_200011218536 [0,0,0,0,1,0|1,0,2]=4 2824 B19R2.8900 CC(Cc1ccccc1)OCCc2ccccc2 34a_100000748627_100000765856 [0,0,0,0,1,0|1,0,2]=4 2825 B19R2.8900 CC(Cc1ccccc1)OCCc2ccccc2 7a_100000210268_200011218536 [0,0,0,0,1,0|1,0,2]=4 2826 B19R2.8900 CC(Cc1ccccc1)OCCc2ccccc2 7a_100000748627_100000765856 [0,0,0,0,1,0|1,0,2]=4 2827 B19R2.8900 O=C(CCCc1ccccc1)C[n+]2ccccc2 1458a_200000086051_100000211621 [0,0,0,0,1,0|2,0,1]=4 2828 B19R2.8900 O=C(CCCc1ccccc1)Cc2ccccc2 1458a_100011207963_100015291786 [0,0,0,0,1,0|1,0,1]=3 2829 B19R2.8900 O=C(CCCc1ccccc1)Cc2ccccn2 1458a_100000233486_100000211621 [0,0,0,0,1,0|2,0,1]=4 2830 B19R2.8900 O=C(CCCc1ccccc1)Cc2ccccn2 1458a_100011207963_100000721315 [0,0,0,0,1,0|2,0,1]=4 2831 B19R2.8900 O=C(CCCc1ccccc1)Cc2cccnc2 1458a_100000737805_100000211621 [0,0,0,0,1,0|2,0,1]=4 2832 B19R2.8900 O=C(CCCc1ccccc1)Cc2cccnc2 1458a_100011207963_100000733263 [0,0,0,0,1,0|2,0,1]=4 2833 B19R2.8900 O=C(CCCc1ccccc1)Cc2ccncc2 1458a_100011207963_100000705612 [0,0,0,0,1,0|2,0,1]=4 2834 B19R2.8900 O=C(CCCc1ccccc1)Nc2ccccc2 11a_100000106764_100011207963 [0,0,0,0,1,0|2,0,0]=3 2835 B19R2.8900 O=C(CCCc1ccccc1)Nc2ccccc2 1626a_100000106764_100011207963 [0,0,0,0,1,0|2,0,0]=3 2836 B19R2.8900 O=C(CCCc1ccccc1)Nc2ccccc2 22a_100000106764_100011207963 [0,0,0,0,1,0|2,0,0]=3 2837 B19R2.8900 O=C(CCCc1ccccc1)Nc2ccccc2 527a_100000106764_100011207963 [0,0,0,0,1,0|2,0,0]=3 2838 B19R2.8900 O=C(CCCc1ccccn1)Cc2ccccc2 1458a_100000752327_100015291786 [0,0,0,0,1,0|2,0,1]=4 2839 B19R2.8900 O=C(CCCc1ccccn1)Nc2ccccc2 11a_100000106764_100000752327 [0,0,0,0,1,0|3,0,0]=4 2840 B19R2.8900 O=C(CCCc1ccccn1)Nc2ccccc2 1626a_100000106764_100000752327 [0,0,0,0,1,0|3,0,0]=4 2841 B19R2.8900 O=C(CCCc1ccccn1)Nc2ccccc2 22a_100000106764_100000752327 [0,0,0,0,1,0|3,0,0]=4 2842 B19R2.8900 O=C(CCCc1ccccn1)Nc2ccccc2 527a_100000106764_100000752327 [0,0,0,0,1,0|3,0,0]=4 2843 B19R2.8900 O=C(CCCc1ccncc1)Cc2ccccc2 1458a_100020654287_100015291786 [0,0,0,0,1,0|2,0,1]=4 2844 B19R2.8900 O=C(CCCc1ccncc1)Nc2ccccc2 11a_100000106764_100020654287 [0,0,0,0,1,0|3,0,0]=4 2845 B19R2.8900 O=C(CCCc1ccncc1)Nc2ccccc2 1626a_100000106764_100020654287 [0,0,0,0,1,0|3,0,0]=4 2846 B19R2.8900 O=C(CCCc1ccncc1)Nc2ccccc2 22a_100000106764_100020654287 [0,0,0,0,1,0|3,0,0]=4 2847 B19R2.8900 O=C(CCCc1ccncc1)Nc2ccccc2 527a_100000106764_100020654287 [0,0,0,0,1,0|3,0,0]=4 2848 B19R2.8900 O=C(CCNc1ccccc1)Nc2ccccc2 34a_100000106764_100000242058 [0,0,0,0,1,0|3,0,0]=4 2849 B19R2.8900 O=C(CCOc1ccccc1)Cc2ccccc2 1458a_100000182761_100015291786 [0,0,0,0,1,0|2,0,1]=4 2850 B19R2.8900 O=C(CCOc1ccccc1)Nc2ccccc2 11a_100000106764_100000182761 [0,0,0,0,1,0|3,0,0]=4 2851 B19R2.8900 O=C(CCOc1ccccc1)Nc2ccccc2 1626a_100000106764_100000182761 [0,0,0,0,1,0|3,0,0]=4 2852 B19R2.8900 O=C(CCOc1ccccc1)Nc2ccccc2 22a_100000106764_100000182761 [0,0,0,0,1,0|3,0,0]=4 2853 B19R2.8900 O=C(CCOc1ccccc1)Nc2ccccc2 34a_100000210340_100000242058 [0,0,0,0,1,0|3,0,0]=4 2854 B19R2.8900 O=C(CCOc1ccccc1)Nc2ccccc2 7a_100000210340_100000242058 [0,0,0,0,1,0|3,0,0]=4 2855 B19R2.8900 O=C(CCOc1ccccc1)Oc2ccccc2 7a_100000210340_200000035796 [0,0,0,0,1,0|3,0,0]=4 2856 B19R2.8900 O=C(CCSc1ccccc1)Cc2ccccc2 1458a_100000182436_100015291786 [0,0,0,0,1,0|2,0,1]=4 2857 B19R2.8900 O=C(CCSc1ccccc1)Nc2ccccc2 11a_100000106764_100000182436 [0,0,0,0,1,0|3,0,0]=4 2858 B19R2.8900 O=C(CCSc1ccccc1)Nc2ccccc2 1626a_100000106764_100000182436 [0,0,0,0,1,0|3,0,0]=4 2859 B19R2.8900 O=C(CCSc1ccccc1)Nc2ccccc2 22a_100000106764_100000182436 [0,0,0,0,1,0|3,0,0]=4 2860 B19R2.8900 O=C(CCSc1ccccc1)Nc2ccccc2 62a_100000719477_100000242058 [0,0,0,0,1,0|3,0,0]=4 2861 B19R2.8900 O=C(CCSc1ccccc1)Oc2ccccc2 62a_100000719477_200000035796 [0,0,0,0,1,0|3,0,0]=4 2862 B19R2.8900 O=C(CNCc1ccccc1)Cc2ccccc2 2230a_100015324214_100000233483 [0,0,0,0,1,0|2,0,1]=4 2863 B19R2.8900 O=C(CNCc1ccccc1)Nc2ccccc2 2230a_100015324214_100000182850 [0,0,0,0,1,0|3,0,0]=4 2864 B19R2.8900 O=C(CNCc1ccccc1)Nc2ccccc2 270004a_100000742222_100015611070 [0,0,0,0,1,0|3,0,0]=4 2865 B19R2.8900 O=C(CNCc1ccccc1)Nc2ccccc2 34a_100015324214_100000182850 [0,0,0,0,1,0|3,0,0]=4 2866 B19R2.8900 O=C(CNCc1ccccc1)Oc2ccccc2 2230a_100015324214_100009813826 [0,0,0,0,1,0|3,0,0]=4 2867 B19R2.8900 O=C(CNCc1ccccc1)Oc2ccccc2 34a_100015324214_100009813826 [0,0,0,0,1,0|3,0,0]=4 2868 B19R2.8900 O=C(COCc1ccccc1)Cc2ccccc2 1458a_100000230186_100015291786 [0,0,0,0,1,0|2,0,1]=4 2869 B19R2.8900 O=C(COCc1ccccc1)Cc2ccccc2 7a_100000210790_100000233483 [0,0,0,0,1,0|2,0,1]=4 2870 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 11a_100000106764_100000230186 [0,0,0,0,1,0|3,0,0]=4 2871 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 1626a_100000106764_100000230186 [0,0,0,0,1,0|3,0,0]=4 2872 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 22a_100000106764_100000230186 [0,0,0,0,1,0|3,0,0]=4 2873 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 34a_100000210790_100000182850 [0,0,0,0,1,0|3,0,0]=4 2874 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 34a_100000246334_100015291786 [0,0,0,0,1,0|3,0,0]=4 2875 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 527a_100000106764_100000230186 [0,0,0,0,1,0|3,0,0]=4 2876 B19R2.8900 O=C(COCc1ccccc1)Nc2ccccc2 7a_100000210790_100000182850 [0,0,0,0,1,0|3,0,0]=4 2877 B19R2.8900 O=C(COCc1ccccc1)Oc2ccccc2 34a_100000210790_100009813826 [0,0,0,0,1,0|3,0,0]=4 2878 B19R2.8900 O=C(COCc1ccccc1)Oc2ccccc2 7a_100000210790_100009813826 [0,0,0,0,1,0|3,0,0]=4 2879 B19R2.8900 O=C(CSCc1ccccc1)Cc2ccccc2 1458a_100000150264_100015291786 [0,0,0,0,1,0|2,0,1]=4 2880 B19R2.8900 O=C(CSCc1ccccc1)Cc2ccccc2 62a_100000211182_100000233483 [0,0,0,0,1,0|2,0,1]=4 2881 B19R2.8900 O=C(CSCc1ccccc1)Cc2ccccc2 62a_100000233483_100015291786 [0,0,0,0,1,0|2,0,1]=4 2882 B19R2.8900 O=C(CSCc1ccccc1)Nc2ccccc2 11a_100000106764_100000150264 [0,0,0,0,1,0|3,0,0]=4 2883 B19R2.8900 O=C(CSCc1ccccc1)Nc2ccccc2 1626a_100000106764_100000150264 [0,0,0,0,1,0|3,0,0]=4 2884 B19R2.8900 O=C(CSCc1ccccc1)Nc2ccccc2 22a_100000106764_100000150264 [0,0,0,0,1,0|3,0,0]=4 2885 B19R2.8900 O=C(CSCc1ccccc1)Nc2ccccc2 527a_100000106764_100000150264 [0,0,0,0,1,0|3,0,0]=4 2886 B19R2.8900 O=C(CSCc1ccccc1)Nc2ccccc2 62a_100000211182_100000182850 [0,0,0,0,1,0|3,0,0]=4 2887 B19R2.8900 O=C(CSCc1ccccc1)Nc2ccccc2 62a_100012148978_100015291786 [0,0,0,0,1,0|3,0,0]=4 2888 B19R2.8900 O=C(CSCc1ccccc1)Oc2ccccc2 62a_100000211182_100009813826 [0,0,0,0,1,0|3,0,0]=4 2889 B19R2.8900 O=C(CSCc1ccccc1)Oc2ccccc2 62a_100009813826_100015291786 [0,0,0,0,1,0|3,0,0]=4 2890 B19R2.8900 O=C(C[n+]1ccccc1)NCCc2ccccc2 11a_100000106460_200000086051 [0,0,0,0,1,0|2,0,1]=4 2891 B19R2.8900 O=C(C[n+]1ccccc1)NCCc2ccccc2 240690a_100000106460_200000086051 [0,0,0,0,1,0|2,0,1]=4 2892 B19R2.8900 O=C(C[n+]1ccccc1)NCCc2ccccc2 527a_100000106460_200000086051 [0,0,0,0,1,0|2,0,1]=4 2893 B19R2.8900 O=C(Cc1ccccn1)NCCc2ccccc2 11a_100000106460_100000233486 [0,0,0,0,1,0|2,0,1]=4 2894 B19R2.8900 O=C(Cc1cccnc1)NCCc2ccccc2 11a_100000106460_100000737805 [0,0,0,0,1,0|2,0,1]=4 2895 B19R2.8900 O=C(Cc1cccnc1)NCCc2ccccc2 240690a_100000106460_100000737805 [0,0,0,0,1,0|2,0,1]=4 2896 B19R2.8900 O=C(Cc1cccnc1)NCCc2ccccc2 527a_100000106460_100000737805 [0,0,0,0,1,0|2,0,1]=4 2897 B19R2.8900 O=C(Cc1ccncc1)NCCc2ccccc2 11a_100000106460_100011201483 [0,0,0,0,1,0|2,0,1]=4 2898 B19R2.8900 O=C(Cc1ccncc1)NCCc2ccccc2 240690a_100000106460_100011201483 [0,0,0,0,1,0|2,0,1]=4 2899 B19R2.8900 O=C(NCCc1ccccc1)Nc2ccccc2 2430a_100000106764_100000106460 [0,0,0,0,1,0|2,0,0]=3 2900 B19R2.8900 O=C(NCCc1ccccn1)Nc2ccccc2 2430a_100000106764_100000211156 [0,0,0,0,1,0|3,0,0]=4 2901 B19R2.8900 O=C(NCCc1cccnc1)Nc2ccccc2 2430a_100000106764_100000736294 [0,0,0,0,1,0|3,0,0]=4 2902 B19R2.8900 O=C(NCCc1ccncc1)Nc2ccccc2 2430a_100000106764_100000742849 [0,0,0,0,1,0|3,0,0]=4 2903 B19R2.16162 CC(=NNc1ccccc1)C=Cc2ccccc2 4a_100015195140_100000204604 [0,0,0,0,1,0|3,0,0]=4 2904 B19R2.16162 CC(=NNc1ccccc1)CCc2ccccc2 4a_100015195140_100000210092 [0,0,0,0,1,0|3,0,0]=4 2905 B19R2.16162 O=C(C#Cc1ccccc1)CCc2ccccc2 1458a_100000736102_100000765856 [0,0,0,0,1,0|0,0,2]=3 2906 B19R2.16162 O=C(C#Cc1ccccc1)CCc2ccccn2 1458a_100000736102_100015183660 [0,0,0,0,1,0|1,0,2]=4 2907 B19R2.16162 O=C(C#Cc1ccccc1)CCc2cccnc2 1458a_100000736102_200011713674 [0,0,0,0,1,0|1,0,2]=4 2908 B19R2.16162 O=C(C#Cc1ccccc1)CCc2ccncc2 1458a_100000736102_100000723409 [0,0,0,0,1,0|1,0,2]=4 2909 B19R2.16162 O=C(C#Cc1ccccc1)NCc2ccccc2 240690a_100015324214_100000736102 [0,0,0,0,1,0|1,0,2]=4 2910 B19R2.16162 O=C(C#Cc1ccccn1)CCc2ccccc2 1458a_102125277312_100000765856 [0,0,0,0,1,0|1,0,2]=4 2911 B19R2.16162 O=C(C=Cc1ccccc1)CCc2ccccc2 1458a_100000210462_100000765856 [0,0,0,0,1,0|0,0,0]=1 2912 B19R2.16162 O=C(C=Cc1ccccc1)CCc2ccccn2 1458a_100000210462_100015183660 [0,0,0,0,1,0|1,0,0]=2 2913 B19R2.16162 O=C(C=Cc1ccccc1)CCc2cccnc2 1458a_100000210462_200011713674 [0,0,0,0,1,0|1,0,0]=2 2914 B19R2.16162 O=C(C=Cc1ccccc1)CCc2ccncc2 1458a_100000210462_100000723409 [0,0,0,0,1,0|1,0,0]=2 2915 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccccc2 11a_100015324214_100000210462 [0,0,0,0,1,0|1,0,0]=2 2916 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccccc2 1626a_100015324214_100000210462 [0,0,0,0,1,0|1,0,0]=2 2917 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccccn2 11a_100000210449_100000210462 [0,0,0,0,1,0|2,0,0]=3 2918 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccccn2 1626a_100000210449_100000210462 [0,0,0,0,1,0|2,0,0]=3 2919 B19R2.16162 O=C(C=Cc1ccccc1)NCc2cccnc2 11a_100000210453_100000210462 [0,0,0,0,1,0|2,0,0]=3 2920 B19R2.16162 O=C(C=Cc1ccccc1)NCc2cccnn2 11a_100159270163_100000210462 [0,0,0,0,1,0|3,0,0]=4 2921 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccncc2 11a_100000210450_100000210462 [0,0,0,0,1,0|2,0,0]=3 2922 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccncc2 1626a_100000210450_100000210462 [0,0,0,0,1,0|2,0,0]=3 2923 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ccncn2 11a_100000736019_100000210462 [0,0,0,0,1,0|3,0,0]=4 2924 B19R2.16162 O=C(C=Cc1ccccc1)NCc2cnccn2 11a_100000737960_100000210462 [0,0,0,0,1,0|3,0,0]=4 2925 B19R2.16162 O=C(C=Cc1ccccc1)NCc2cncnc2 11a_100011243677_100000210462 [0,0,0,0,1,0|3,0,0]=4 2926 B19R2.16162 O=C(C=Cc1ccccc1)NCc2ncccn2 11a_100015189908_100000210462 [0,0,0,0,1,0|3,0,0]=4 2927 B19R2.16162 O=C(C=Cc1ccccc1)NNc2ccccc2 22a_100015195140_100000210462 [0,0,0,0,1,0|2,0,0]=3 2928 B19R2.16162 O=C(C=Cc1ccccc1)NNc2ccccn2 22a_100000183288_100000210462 [0,0,0,0,1,0|3,0,0]=4 2929 B19R2.16162 O=C(C=Cc1ccccc1)NNc2cccnc2 22a_100000728903_100000210462 [0,0,0,0,1,0|3,0,0]=4 2930 B19R2.16162 O=C(C=Cc1ccccc1)NNc2ccncc2 22a_100000698918_100000210462 [0,0,0,0,1,0|3,0,0]=4 2931 B19R2.16162 O=C(C=Cc1ccccn1)CCc2ccccc2 1458a_100000740811_100000765856 [0,0,0,0,1,0|1,0,0]=2 2932 B19R2.16162 O=C(C=Cc1ccccn1)CCc2ccccn2 1458a_100000740811_100015183660 [0,0,0,0,1,0|2,0,0]=3 2933 B19R2.16162 O=C(C=Cc1ccccn1)CCc2cccnc2 1458a_100000740811_200011713674 [0,0,0,0,1,0|2,0,0]=3 2934 B19R2.16162 O=C(C=Cc1ccccn1)CCc2ccncc2 1458a_100000740811_100000723409 [0,0,0,0,1,0|2,0,0]=3 2935 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccccc2 11a_100015324214_100000740811 [0,0,0,0,1,0|2,0,0]=3 2936 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccccc2 240690a_100015324214_100000740811 [0,0,0,0,1,0|2,0,0]=3 2937 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccccn2 11a_100000210449_100000740811 [0,0,0,0,1,0|3,0,0]=4 2938 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccccn2 240690a_100000210449_100000740811 [0,0,0,0,1,0|3,0,0]=4 2939 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cccnc2 11a_100000210453_100000740811 [0,0,0,0,1,0|3,0,0]=4 2940 B19R2.16162 O=C(C=Cc1ccccn1)NCc2cccnc2 240690a_100000210453_100000740811 [0,0,0,0,1,0|3,0,0]=4 2941 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccncc2 11a_100000210450_100000740811 [0,0,0,0,1,0|3,0,0]=4 2942 B19R2.16162 O=C(C=Cc1ccccn1)NCc2ccncc2 240690a_100000210450_100000740811 [0,0,0,0,1,0|3,0,0]=4 2943 B19R2.16162 O=C(C=Cc1ccccn1)NNc2ccccc2 22a_100015195140_100000740811 [0,0,0,0,1,0|3,0,0]=4 2944 B19R2.16162 O=C(C=Cc1cccnc1)CCc2ccccc2 1458a_100000735890_100000765856 [0,0,0,0,1,0|1,0,0]=2 2945 B19R2.16162 O=C(C=Cc1cccnc1)CCc2ccccn2 1458a_100000735890_100015183660 [0,0,0,0,1,0|2,0,0]=3 2946 B19R2.16162 O=C(C=Cc1cccnc1)CCc2cccnc2 1458a_100000735890_200011713674 [0,0,0,0,1,0|2,0,0]=3 2947 B19R2.16162 O=C(C=Cc1cccnc1)CCc2ccncc2 1458a_100000735890_100000723409 [0,0,0,0,1,0|2,0,0]=3 2948 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccccc2 11a_100015324214_100000735890 [0,0,0,0,1,0|2,0,0]=3 2949 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccccc2 240690a_100015324214_100000735890 [0,0,0,0,1,0|2,0,0]=3 2950 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccccn2 11a_100000210449_100000735890 [0,0,0,0,1,0|3,0,0]=4 2951 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccccn2 240690a_100000210449_100000735890 [0,0,0,0,1,0|3,0,0]=4 2952 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cccnc2 11a_100000210453_100000735890 [0,0,0,0,1,0|3,0,0]=4 2953 B19R2.16162 O=C(C=Cc1cccnc1)NCc2cccnc2 240690a_100000210453_100000735890 [0,0,0,0,1,0|3,0,0]=4 2954 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccncc2 11a_100000210450_100000735890 [0,0,0,0,1,0|3,0,0]=4 2955 B19R2.16162 O=C(C=Cc1cccnc1)NCc2ccncc2 240690a_100000210450_100000735890 [0,0,0,0,1,0|3,0,0]=4 2956 B19R2.16162 O=C(C=Cc1cccnc1)NNc2ccccc2 22a_100015195140_100000735890 [0,0,0,0,1,0|3,0,0]=4 2957 B19R2.16162 O=C(C=Cc1ccncc1)CCc2ccccc2 1458a_100000682801_100000765856 [0,0,0,0,1,0|1,0,0]=2 2958 B19R2.16162 O=C(C=Cc1ccncc1)CCc2ccccn2 1458a_100000682801_100015183660 [0,0,0,0,1,0|2,0,0]=3 2959 B19R2.16162 O=C(C=Cc1ccncc1)CCc2cccnc2 1458a_100000682801_200011713674 [0,0,0,0,1,0|2,0,0]=3 2960 B19R2.16162 O=C(C=Cc1ccncc1)CCc2ccncc2 1458a_100000682801_100000723409 [0,0,0,0,1,0|2,0,0]=3 2961 B19R2.16162 O=C(C=Cc1ccncc1)NCc2ccccc2 240690a_100015324214_100000682801 [0,0,0,0,1,0|2,0,0]=3 2962 B19R2.16162 O=C(C=Cc1ccncc1)NCc2ccccn2 240690a_100000210449_100000682801 [0,0,0,0,1,0|3,0,0]=4 2963 B19R2.16162 O=C(C=Cc1ccncc1)NCc2cccnc2 240690a_100000210453_100000682801 [0,0,0,0,1,0|3,0,0]=4 2964 B19R2.16162 O=C(C=Cc1ccncc1)NCc2ccncc2 240690a_100000210450_100000682801 [0,0,0,0,1,0|3,0,0]=4 2965 B19R2.16162 O=C(C=Cc1ccncc1)NNc2ccccc2 22a_100015195140_100000682801 [0,0,0,0,1,0|3,0,0]=4 2966 B19R2.16162 O=C(C=Cc1cncnc1)CCc2ccccc2 6a_100000749868_100000210092 [0,0,0,0,1,0|2,0,0]=3 2967 B19R2.16162 O=C(C=Cc1cncnc1)COc2ccccc2 6a_100000749868_100000150576 [0,0,0,0,1,0|3,0,0]=4 2968 B19R2.16162 O=C(C=Cc1cncnc1)CSc2ccccc2 6a_100000749868_100000150717 [0,0,0,0,1,0|3,0,0]=4 2969 B19R2.16162 O=C(CCc1ccccc1)CCc2ccccc2 1458a_100000185753_100000765856 [0,0,0,0,1,0|0,0,2]=3 2970 B19R2.16162 O=C(CCc1ccccc1)CCc2ccccn2 1458a_100000185753_100015183660 [0,0,0,0,1,0|1,0,2]=4 2971 B19R2.16162 O=C(CCc1ccccc1)CCc2ccccn2 1458a_100015195070_100000765856 [0,0,0,0,1,0|1,0,2]=4 2972 B19R2.16162 O=C(CCc1ccccc1)CCc2cccnc2 1458a_100000185753_200011713674 [0,0,0,0,1,0|1,0,2]=4 2973 B19R2.16162 O=C(CCc1ccccc1)CCc2cccnc2 1458a_100000198484_100000765856 [0,0,0,0,1,0|1,0,2]=4 2974 B19R2.16162 O=C(CCc1ccccc1)CCc2ccncc2 1458a_100000185753_100000723409 [0,0,0,0,1,0|1,0,2]=4 2975 B19R2.16162 O=C(CCc1ccccc1)CCc2ccncc2 1458a_100011225043_100000765856 [0,0,0,0,1,0|1,0,2]=4 2976 B19R2.16162 O=C(CCc1ccccc1)CNc2ccccc2 34a_100000106764_100012361361 [0,0,0,0,1,0|1,0,1]=3 2977 B19R2.16162 O=C(CCc1ccccc1)COc2ccccc2 1458a_100000186222_100000765856 [0,0,0,0,1,0|1,0,1]=3 2978 B19R2.16162 O=C(CCc1ccccc1)COc2ccccc2 34a_100000210340_100012361361 [0,0,0,0,1,0|1,0,1]=3 2979 B19R2.16162 O=C(CCc1ccccc1)COc2ccccc2 7a_100000210340_100012361361 [0,0,0,0,1,0|1,0,1]=3 2980 B19R2.16162 O=C(CCc1ccccc1)COc2ccccn2 1458a_100102699861_100000765856 [0,0,0,0,1,0|2,0,1]=4 2981 B19R2.16162 O=C(CCc1ccccc1)COc2cccnc2 1458a_100015207166_100000765856 [0,0,0,0,1,0|2,0,1]=4 2982 B19R2.16162 O=C(CCc1ccccc1)COc2cccnc2 34a_100000210849_100012361361 [0,0,0,0,1,0|2,0,1]=4 2983 B19R2.16162 O=C(CCc1ccccc1)COc2cccnc2 7a_100000210849_100012361361 [0,0,0,0,1,0|2,0,1]=4 2984 B19R2.16162 O=C(CCc1ccccc1)COc2ccncc2 34a_100000212176_100012361361 [0,0,0,0,1,0|2,0,1]=4 2985 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccc2 1458a_100000211596_100000765856 [0,0,0,0,1,0|1,0,1]=3 2986 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccc2 62a_100000719477_100012361361 [0,0,0,0,1,0|1,0,1]=3 2987 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccc2 62a_100012361361_100000041952 [0,0,0,0,1,0|1,0,1]=3 2988 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccn2 1458a_100000156281_100000765856 [0,0,0,0,1,0|2,0,1]=4 2989 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccn2 62a_100011216584_100012361361 [0,0,0,0,1,0|2,0,1]=4 2990 B19R2.16162 O=C(CCc1ccccc1)CSc2ccccn2 62a_100012361361_100011216584 [0,0,0,0,1,0|2,0,1]=4 2991 B19R2.16162 O=C(CCc1ccccc1)CSc2cccnc2 62a_100000210063_100012361361 [0,0,0,0,1,0|2,0,1]=4 2992 B19R2.16162 O=C(CCc1ccccc1)CSc2cccnc2 62a_100012361361_100000210063 [0,0,0,0,1,0|2,0,1]=4 2993 B19R2.16162 O=C(CCc1ccccc1)CSc2ccncc2 1458a_100000211328_100000765856 [0,0,0,0,1,0|2,0,1]=4 2994 B19R2.16162 O=C(CCc1ccccc1)CSc2ccncc2 62a_100000728582_100012361361 [0,0,0,0,1,0|2,0,1]=4 2995 B19R2.16162 O=C(CCc1ccccc1)CSc2ccncc2 62a_100012361361_100000728582 [0,0,0,0,1,0|2,0,1]=4 2996 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 11a_100015324214_100000185753 [0,0,0,0,1,0|1,0,1]=3 2997 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000185753 [0,0,0,0,1,0|1,0,1]=3 2998 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000185753 [0,0,0,0,1,0|1,0,1]=3 2999 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 527a_100015324214_100000185753 [0,0,0,0,1,0|1,0,1]=3 3000 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccn2 11a_100000210449_100000185753 [0,0,0,0,1,0|2,0,1]=4 3001 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccn2 1626a_100000210449_100000185753 [0,0,0,0,1,0|2,0,1]=4 3002 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccn2 240690a_100000210449_100000185753 [0,0,0,0,1,0|2,0,1]=4 3003 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccn2 527a_100000210449_100000185753 [0,0,0,0,1,0|2,0,1]=4 3004 B19R2.16162 O=C(CCc1ccccc1)NCc2cccnc2 11a_100000210453_100000185753 [0,0,0,0,1,0|2,0,1]=4 3005 B19R2.16162 O=C(CCc1ccccc1)NCc2cccnc2 240690a_100000210453_100000185753 [0,0,0,0,1,0|2,0,1]=4 3006 B19R2.16162 O=C(CCc1ccccc1)NCc2cccnc2 527a_100000210453_100000185753 [0,0,0,0,1,0|2,0,1]=4 3007 B19R2.16162 O=C(CCc1ccccc1)NCc2ccncc2 11a_100000210450_100000185753 [0,0,0,0,1,0|2,0,1]=4 3008 B19R2.16162 O=C(CCc1ccccc1)NCc2ccncc2 1626a_100000210450_100000185753 [0,0,0,0,1,0|2,0,1]=4 3009 B19R2.16162 O=C(CCc1ccccc1)NCc2ccncc2 240690a_100000210450_100000185753 [0,0,0,0,1,0|2,0,1]=4 3010 B19R2.16162 O=C(CCc1ccccc1)NCc2ccncc2 527a_100000210450_100000185753 [0,0,0,0,1,0|2,0,1]=4 3011 B19R2.16162 O=C(CCc1ccccc1)NNc2ccccc2 22a_100015195140_100000185753 [0,0,0,0,1,0|2,0,0]=3 3012 B19R2.16162 O=C(CCc1ccccc1)NNc2ccccn2 22a_100000183288_100000185753 [0,0,0,0,1,0|3,0,0]=4 3013 B19R2.16162 O=C(CCc1ccccc1)NNc2cccnc2 22a_100000728903_100000185753 [0,0,0,0,1,0|3,0,0]=4 3014 B19R2.16162 O=C(CCc1ccccc1)NNc2ccncc2 22a_100000698918_100000185753 [0,0,0,0,1,0|3,0,0]=4 3015 B19R2.16162 O=C(CCc1ccccn1)COc2ccccc2 1458a_100000186222_100015183660 [0,0,0,0,1,0|2,0,1]=4 3016 B19R2.16162 O=C(CCc1ccccn1)CSc2ccccc2 1458a_100000211596_100015183660 [0,0,0,0,1,0|2,0,1]=4 3017 B19R2.16162 O=C(CCc1ccccn1)NCc2ccccc2 11a_100015324214_100015195070 [0,0,0,0,1,0|2,0,1]=4 3018 B19R2.16162 O=C(CCc1ccccn1)NCc2ccccc2 240690a_100015324214_100015195070 [0,0,0,0,1,0|2,0,1]=4 3019 B19R2.16162 O=C(CCc1ccccn1)NCc2ccccc2 527a_100015324214_100015195070 [0,0,0,0,1,0|2,0,1]=4 3020 B19R2.16162 O=C(CCc1ccccn1)NNc2ccccc2 22a_100015195140_100015195070 [0,0,0,0,1,0|3,0,0]=4 3021 B19R2.16162 O=C(CCc1cccnc1)COc2ccccc2 1458a_100000186222_200011713674 [0,0,0,0,1,0|2,0,1]=4 3022 B19R2.16162 O=C(CCc1cccnc1)CSc2ccccc2 1458a_100000211596_200011713674 [0,0,0,0,1,0|2,0,1]=4 3023 B19R2.16162 O=C(CCc1cccnc1)NCc2ccccc2 11a_100015324214_100000198484 [0,0,0,0,1,0|2,0,1]=4 3024 B19R2.16162 O=C(CCc1cccnc1)NCc2ccccc2 1626a_100015324214_100000198484 [0,0,0,0,1,0|2,0,1]=4 3025 B19R2.16162 O=C(CCc1cccnc1)NCc2ccccc2 240690a_100015324214_100000198484 [0,0,0,0,1,0|2,0,1]=4 3026 B19R2.16162 O=C(CCc1cccnc1)NCc2ccccc2 527a_100015324214_100000198484 [0,0,0,0,1,0|2,0,1]=4 3027 B19R2.16162 O=C(CCc1cccnc1)NNc2ccccc2 22a_100015195140_100000198484 [0,0,0,0,1,0|3,0,0]=4 3028 B19R2.16162 O=C(CCc1ccncc1)COc2ccccc2 1458a_100000186222_100000723409 [0,0,0,0,1,0|2,0,1]=4 3029 B19R2.16162 O=C(CCc1ccncc1)CSc2ccccc2 1458a_100000211596_100000723409 [0,0,0,0,1,0|2,0,1]=4 3030 B19R2.16162 O=C(CCc1ccncc1)NCc2ccccc2 11a_100015324214_100011225043 [0,0,0,0,1,0|2,0,1]=4 3031 B19R2.16162 O=C(CCc1ccncc1)NCc2ccccc2 240690a_100015324214_100011225043 [0,0,0,0,1,0|2,0,1]=4 3032 B19R2.16162 O=C(CCc1ccncc1)NCc2ccccc2 527a_100015324214_100011225043 [0,0,0,0,1,0|2,0,1]=4 3033 B19R2.16162 O=C(CCc1ccncc1)NNc2ccccc2 22a_100015195140_100011225043 [0,0,0,0,1,0|3,0,0]=4 3034 B19R2.16162 O=C(CNc1ccccc1)NCc2ccccc2 34a_100000106764_100000183539 [0,0,0,0,1,0|2,0,1]=4 3035 B19R2.16162 O=C(CNc1ccccc1)OCc2ccccc2 34a_100000106764_100000753625 [0,0,0,0,1,0|1,0,1]=3 3036 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 11a_100015324214_100000186222 [0,0,0,0,1,0|2,0,1]=4 3037 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 1626a_100015324214_100000186222 [0,0,0,0,1,0|2,0,1]=4 3038 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 240690a_100015324214_100000186222 [0,0,0,0,1,0|2,0,1]=4 3039 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 34a_100000210340_100000183539 [0,0,0,0,1,0|2,0,1]=4 3040 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 527a_100015324214_100000186222 [0,0,0,0,1,0|2,0,1]=4 3041 B19R2.16162 O=C(COc1ccccc1)NCc2ccccc2 7a_100000210340_100000183539 [0,0,0,0,1,0|2,0,1]=4 3042 B19R2.16162 O=C(COc1ccccc1)NNc2ccccc2 22a_100015195140_100000186222 [0,0,0,0,1,0|3,0,0]=4 3043 B19R2.16162 O=C(COc1ccccc1)OCc2ccccc2 34a_100000210340_100000753625 [0,0,0,0,1,0|1,0,1]=3 3044 B19R2.16162 O=C(COc1ccccc1)OCc2ccccc2 7a_100000210340_100000753625 [0,0,0,0,1,0|1,0,1]=3 3045 B19R2.16162 O=C(COc1cccnc1)OCc2ccccc2 34a_100000210849_100000753625 [0,0,0,0,1,0|2,0,1]=4 3046 B19R2.16162 O=C(COc1cccnc1)OCc2ccccc2 7a_100000210849_100000753625 [0,0,0,0,1,0|2,0,1]=4 3047 B19R2.16162 O=C(COc1ccncc1)OCc2ccccc2 34a_100000212176_100000753625 [0,0,0,0,1,0|2,0,1]=4 3048 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 11a_100015324214_100000211596 [0,0,0,0,1,0|2,0,1]=4 3049 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 1626a_100015324214_100000211596 [0,0,0,0,1,0|2,0,1]=4 3050 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 240690a_100015324214_100000211596 [0,0,0,0,1,0|2,0,1]=4 3051 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 527a_100015324214_100000211596 [0,0,0,0,1,0|2,0,1]=4 3052 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 62a_100000183539_100000041952 [0,0,0,0,1,0|2,0,1]=4 3053 B19R2.16162 O=C(CSc1ccccc1)NCc2ccccc2 62a_100000719477_100000183539 [0,0,0,0,1,0|2,0,1]=4 3054 B19R2.16162 O=C(CSc1ccccc1)NNc2ccccc2 22a_100015195140_100000211596 [0,0,0,0,1,0|3,0,0]=4 3055 B19R2.16162 O=C(CSc1ccccc1)OCc2ccccc2 62a_100000719477_100000753625 [0,0,0,0,1,0|1,0,1]=3 3056 B19R2.16162 O=C(CSc1ccccc1)OCc2ccccc2 62a_100000753625_100000041952 [0,0,0,0,1,0|1,0,1]=3 3057 B19R2.16162 O=C(CSc1ccccn1)OCc2ccccc2 62a_100000753625_100011216584 [0,0,0,0,1,0|2,0,1]=4 3058 B19R2.16162 O=C(CSc1ccccn1)OCc2ccccc2 62a_100011216584_100000753625 [0,0,0,0,1,0|2,0,1]=4 3059 B19R2.16162 O=C(CSc1cccnc1)OCc2ccccc2 62a_100000210063_100000753625 [0,0,0,0,1,0|2,0,1]=4 3060 B19R2.16162 O=C(CSc1cccnc1)OCc2ccccc2 62a_100000753625_100000210063 [0,0,0,0,1,0|2,0,1]=4 3061 B19R2.16162 O=C(CSc1ccncc1)OCc2ccccc2 62a_100000728582_100000753625 [0,0,0,0,1,0|2,0,1]=4 3062 B19R2.16162 O=C(CSc1ccncc1)OCc2ccccc2 62a_100000753625_100000728582 [0,0,0,0,1,0|2,0,1]=4 3063 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccc2 2708a_100015324214_100015324214 [0,0,0,0,1,0|2,0,1]=4 3064 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccc2 273464a_100015324214_100015324214 [0,0,0,0,1,0|2,0,1]=4 3065 B19R2.16162 O=C(NCc1ccccc1)NCc2ccccc2 512a_100015324214_100015324214 [0,0,0,0,1,0|2,0,1]=4 3066 B19R2.16162 O=C(NCc1ccccc1)NNc2ccccc2 273464a_100015324214_100015195140 [0,0,0,0,1,0|3,0,0]=4 3067 B19R2.16162 O=C(NCc1ccccc1)NNc2ccccc2 512a_100015324214_100015195140 [0,0,0,0,1,0|3,0,0]=4 3068 B19R2.113693 O=C(C=Cc1c[nH]cn1)CCCc2ccccc2 1458a_100102678534_100000211621 [0,0,0,0,1,0|3,0,0]=4 3069 B19R2.113693 O=C(C=Cc1c[nH]cn1)NCCc2ccccc2 240690a_100000106460_100102678534 [0,0,0,0,1,0|3,0,0]=4 3070 B19R2.113693 O=C(C=Cc1ccco1)NNCc2ccccc2 22a_100000007032_100000720202 [0,0,0,0,1,0|3,0,0]=4 3071 B19R2.113693 O=C(C=Cc1cccs1)CCCc2ccccc2 1458a_100000182767_100000211621 [0,0,0,0,1,0|2,0,0]=3 3072 B19R2.113693 O=C(C=Cc1cccs1)CCOc2ccccc2 1458a_100000182767_100000184471 [0,0,0,0,1,0|3,0,0]=4 3073 B19R2.113693 O=C(C=Cc1cccs1)CCSc2ccccc2 1458a_100000182767_100000246102 [0,0,0,0,1,0|3,0,0]=4 3074 B19R2.113693 O=C(C=Cc1cccs1)CSCc2ccccc2 1458a_100000182767_200011217039 [0,0,0,0,1,0|3,0,0]=4 3075 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccc2 11a_100000106460_100000182767 [0,0,0,0,1,0|2,0,0]=3 3076 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccc2 1626a_100000106460_100000182767 [0,0,0,0,1,0|2,0,0]=3 3077 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccc2 240690a_100000106460_100000182767 [0,0,0,0,1,0|2,0,0]=3 3078 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccn2 11a_100000211156_100000182767 [0,0,0,0,1,0|3,0,0]=4 3079 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccn2 1626a_100000211156_100000182767 [0,0,0,0,1,0|3,0,0]=4 3080 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccccn2 240690a_100000211156_100000182767 [0,0,0,0,1,0|3,0,0]=4 3081 B19R2.113693 O=C(C=Cc1cccs1)NCCc2cccnc2 11a_100000736294_100000182767 [0,0,0,0,1,0|3,0,0]=4 3082 B19R2.113693 O=C(C=Cc1cccs1)NCCc2cccnc2 1626a_100000736294_100000182767 [0,0,0,0,1,0|3,0,0]=4 3083 B19R2.113693 O=C(C=Cc1cccs1)NCCc2cccnc2 240690a_100000736294_100000182767 [0,0,0,0,1,0|3,0,0]=4 3084 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccncc2 11a_100000742849_100000182767 [0,0,0,0,1,0|3,0,0]=4 3085 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccncc2 1626a_100000742849_100000182767 [0,0,0,0,1,0|3,0,0]=4 3086 B19R2.113693 O=C(C=Cc1cccs1)NCCc2ccncc2 240690a_100000742849_100000182767 [0,0,0,0,1,0|3,0,0]=4 3087 B19R2.113693 O=C(C=Cc1cccs1)NNCc2ccccc2 22a_100000007032_100000182767 [0,0,0,0,1,0|3,0,0]=4 3088 B19R2.113693 O=C(C=Cc1ccoc1)CCCc2ccccc2 1458a_100000238621_100000211621 [0,0,0,0,1,0|2,0,0]=3 3089 B19R2.113693 O=C(C=Cc1ccoc1)CCOc2ccccc2 1458a_100000238621_100000184471 [0,0,0,0,1,0|3,0,0]=4 3090 B19R2.113693 O=C(C=Cc1ccoc1)CCSc2ccccc2 1458a_100000238621_100000246102 [0,0,0,0,1,0|3,0,0]=4 3091 B19R2.113693 O=C(C=Cc1ccoc1)CSCc2ccccc2 1458a_100000238621_200011217039 [0,0,0,0,1,0|3,0,0]=4 3092 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccc2 11a_100000106460_100000238621 [0,0,0,0,1,0|2,0,0]=3 3093 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccc2 1626a_100000106460_100000238621 [0,0,0,0,1,0|2,0,0]=3 3094 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccc2 240690a_100000106460_100000238621 [0,0,0,0,1,0|2,0,0]=3 3095 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccn2 11a_100000211156_100000238621 [0,0,0,0,1,0|3,0,0]=4 3096 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccn2 1626a_100000211156_100000238621 [0,0,0,0,1,0|3,0,0]=4 3097 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccccn2 240690a_100000211156_100000238621 [0,0,0,0,1,0|3,0,0]=4 3098 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2cccnc2 11a_100000736294_100000238621 [0,0,0,0,1,0|3,0,0]=4 3099 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2cccnc2 1626a_100000736294_100000238621 [0,0,0,0,1,0|3,0,0]=4 3100 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2cccnc2 240690a_100000736294_100000238621 [0,0,0,0,1,0|3,0,0]=4 3101 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccncc2 11a_100000742849_100000238621 [0,0,0,0,1,0|3,0,0]=4 3102 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccncc2 1626a_100000742849_100000238621 [0,0,0,0,1,0|3,0,0]=4 3103 B19R2.113693 O=C(C=Cc1ccoc1)NCCc2ccncc2 240690a_100000742849_100000238621 [0,0,0,0,1,0|3,0,0]=4 3104 B19R2.113693 O=C(C=Cc1ccoc1)NNCc2ccccc2 22a_100000007032_100000238621 [0,0,0,0,1,0|3,0,0]=4 3105 B19R2.113693 O=C(C=Cc1ccsc1)CCCc2ccccc2 1458a_100000698588_100000211621 [0,0,0,0,1,0|2,0,0]=3 3106 B19R2.113693 O=C(C=Cc1ccsc1)CCOc2ccccc2 1458a_100000698588_100000184471 [0,0,0,0,1,0|3,0,0]=4 3107 B19R2.113693 O=C(C=Cc1ccsc1)CCSc2ccccc2 1458a_100000698588_100000246102 [0,0,0,0,1,0|3,0,0]=4 3108 B19R2.113693 O=C(C=Cc1ccsc1)CSCc2ccccc2 1458a_100000698588_200011217039 [0,0,0,0,1,0|3,0,0]=4 3109 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccc2 11a_100000106460_100000698588 [0,0,0,0,1,0|2,0,0]=3 3110 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccc2 1626a_100000106460_100000698588 [0,0,0,0,1,0|2,0,0]=3 3111 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccc2 240690a_100000106460_100000698588 [0,0,0,0,1,0|2,0,0]=3 3112 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccc2 527a_100000106460_100000698588 [0,0,0,0,1,0|2,0,0]=3 3113 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccn2 11a_100000211156_100000698588 [0,0,0,0,1,0|3,0,0]=4 3114 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccn2 1626a_100000211156_100000698588 [0,0,0,0,1,0|3,0,0]=4 3115 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccn2 240690a_100000211156_100000698588 [0,0,0,0,1,0|3,0,0]=4 3116 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccccn2 527a_100000211156_100000698588 [0,0,0,0,1,0|3,0,0]=4 3117 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2cccnc2 11a_100000736294_100000698588 [0,0,0,0,1,0|3,0,0]=4 3118 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2cccnc2 1626a_100000736294_100000698588 [0,0,0,0,1,0|3,0,0]=4 3119 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2cccnc2 240690a_100000736294_100000698588 [0,0,0,0,1,0|3,0,0]=4 3120 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2cccnc2 527a_100000736294_100000698588 [0,0,0,0,1,0|3,0,0]=4 3121 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccncc2 11a_100000742849_100000698588 [0,0,0,0,1,0|3,0,0]=4 3122 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccncc2 1626a_100000742849_100000698588 [0,0,0,0,1,0|3,0,0]=4 3123 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccncc2 240690a_100000742849_100000698588 [0,0,0,0,1,0|3,0,0]=4 3124 B19R2.113693 O=C(C=Cc1ccsc1)NCCc2ccncc2 527a_100000742849_100000698588 [0,0,0,0,1,0|3,0,0]=4 3125 B19R2.113693 O=C(C=Cc1ccsc1)NNCc2ccccc2 22a_100000007032_100000698588 [0,0,0,0,1,0|3,0,0]=4 3126 B19R2.113693 O=C(C=Cc1cscn1)CCCc2ccccc2 1458a_200000747928_100000211621 [0,0,0,0,1,0|3,0,0]=4 3127 B19R2.113693 O=C(C=Cc1cscn1)NCCc2ccccc2 11a_100000106460_200000747928 [0,0,0,0,1,0|3,0,0]=4 3128 B19R2.113693 O=C(C=Cc1cscn1)NCCc2ccccc2 1626a_100000106460_200000747928 [0,0,0,0,1,0|3,0,0]=4 3129 B19R2.113693 O=C(C=Cc1cscn1)NCCc2ccccc2 240690a_100000106460_200000747928 [0,0,0,0,1,0|3,0,0]=4 3130 B19R2.113693 O=C(C=Cc1nccs1)CCCc2ccccc2 1458a_100102558208_100000211621 [0,0,0,0,1,0|3,0,0]=4 3131 B19R2.113693 O=C(C=Cc1nccs1)NCCc2ccccc2 11a_100000106460_100102558208 [0,0,0,0,1,0|3,0,0]=4 3132 B19R2.113693 O=C(C=Cc1nccs1)NCCc2ccccc2 240690a_100000106460_100102558208 [0,0,0,0,1,0|3,0,0]=4 3133 B19R2.113693 O=C(COc1ccsc1)OCCc2ccccc2 34a_100000106738_200000077782 [0,0,0,0,1,0|2,0,1]=4 3134 B19R2.113693 O=C(COc1ccsc1)OCCc2ccccc2 7a_100000106738_200000077782 [0,0,0,0,1,0|2,0,1]=4 3135 B19R2.113693 O=C(CSc1ccco1)OCCc2ccccc2 62a_100009814098_200000077782 [0,0,0,0,1,0|2,0,1]=4 3136 B19R2.113693 O=C(CSc1ccco1)OCCc2ccccc2 62a_200000077782_100009814098 [0,0,0,0,1,0|2,0,1]=4 3137 B19R2.113693 O=C(CSc1cccs1)OCCc2ccccc2 62a_100011215356_200000077782 [0,0,0,0,1,0|2,0,1]=4 3138 B19R2.113693 O=C(CSc1cccs1)OCCc2ccccc2 62a_200000077782_100011215356 [0,0,0,0,1,0|2,0,1]=4 3139 B19R2.113693 O=C(CSc1ccoc1)OCCc2ccccc2 62a_100011215275_200000077782 [0,0,0,0,1,0|2,0,1]=4 3140 B19R2.113693 O=C(CSc1ccoc1)OCCc2ccccc2 62a_200000077782_100011215275 [0,0,0,0,1,0|2,0,1]=4 3141 B19R2.113693 O=C(CSc1ccsc1)OCCc2ccccc2 62a_100000738268_200000077782 [0,0,0,0,1,0|2,0,1]=4 3142 B19R2.113693 O=C(CSc1ccsc1)OCCc2ccccc2 62a_200000077782_100000738268 [0,0,0,0,1,0|2,0,1]=4 3143 B19R2.113698 O=C(C=Cc1ccccc1)CCCc2cccs2 1458a_100000210462_100010992444 [0,0,0,0,1,0|2,0,0]=3 3144 B19R2.113698 O=C(C=Cc1ccccc1)CCCn2cccc2 1458a_100000210462_200009814367 [0,0,0,0,1,0|2,0,0]=3 3145 B19R2.113698 O=C(C=Cc1ccccc1)CCCn2cccn2 1458a_100000210462_100000739983 [0,0,0,0,1,0|3,0,0]=4 3146 B19R2.113698 O=C(C=Cc1ccccc1)CCCn2ccnc2 1458a_100000210462_100000756272 [0,0,0,0,1,0|3,0,0]=4 3147 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2c[nH]cn2 11a_100000755092_100000210462 [0,0,0,0,1,0|3,0,0]=4 3148 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2ccco2 11a_100000694680_100000210462 [0,0,0,0,1,0|2,0,0]=3 3149 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2ccco2 1626a_100000694680_100000210462 [0,0,0,0,1,0|2,0,0]=3 3150 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2cccs2 11a_100000203755_100000210462 [0,0,0,0,1,0|2,0,0]=3 3151 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2cccs2 1626a_100000203755_100000210462 [0,0,0,0,1,0|2,0,0]=3 3152 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2ccsc2 11a_100000692642_100000210462 [0,0,0,0,1,0|2,0,0]=3 3153 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2ccsc2 1626a_100000692642_100000210462 [0,0,0,0,1,0|2,0,0]=3 3154 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2cncs2 11a_100016991637_100000210462 [0,0,0,0,1,0|3,0,0]=4 3155 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2cncs2 1626a_100016991637_100000210462 [0,0,0,0,1,0|3,0,0]=4 3156 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2ncc[nH]2 11a_100000754300_100000210462 [0,0,0,0,1,0|3,0,0]=4 3157 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2nccs2 11a_100015186391_100000210462 [0,0,0,0,1,0|3,0,0]=4 3158 B19R2.113698 O=C(C=Cc1ccccc1)NCCc2nccs2 1626a_100015186391_100000210462 [0,0,0,0,1,0|3,0,0]=4 3159 B19R2.113698 O=C(C=Cc1ccccc1)NCCn2cccc2 11a_100011368172_100000210462 [0,0,0,0,1,0|2,0,0]=3 3160 B19R2.113698 O=C(C=Cc1ccccc1)NCCn2cccn2 11a_100011200920_100000210462 [0,0,0,0,1,0|3,0,0]=4 3161 B19R2.113698 O=C(C=Cc1ccccc1)NCCn2ccnc2 11a_100000230061_100000210462 [0,0,0,0,1,0|3,0,0]=4 3162 B19R2.113698 O=C(C=Cc1ccccn1)CCCc2cccs2 1458a_100000740811_100010992444 [0,0,0,0,1,0|3,0,0]=4 3163 B19R2.113698 O=C(C=Cc1ccccn1)CCCn2cccc2 1458a_100000740811_200009814367 [0,0,0,0,1,0|3,0,0]=4 3164 B19R2.113698 O=C(C=Cc1ccccn1)NCCc2ccco2 11a_100000694680_100000740811 [0,0,0,0,1,0|3,0,0]=4 3165 B19R2.113698 O=C(C=Cc1ccccn1)NCCc2ccco2 240690a_100000694680_100000740811 [0,0,0,0,1,0|3,0,0]=4 3166 B19R2.113698 O=C(C=Cc1ccccn1)NCCc2cccs2 11a_100000203755_100000740811 [0,0,0,0,1,0|3,0,0]=4 3167 B19R2.113698 O=C(C=Cc1ccccn1)NCCc2cccs2 240690a_100000203755_100000740811 [0,0,0,0,1,0|3,0,0]=4 3168 B19R2.113698 O=C(C=Cc1ccccn1)NCCc2ccsc2 11a_100000692642_100000740811 [0,0,0,0,1,0|3,0,0]=4 3169 B19R2.113698 O=C(C=Cc1ccccn1)NCCc2ccsc2 240690a_100000692642_100000740811 [0,0,0,0,1,0|3,0,0]=4 3170 B19R2.113698 O=C(C=Cc1ccccn1)NCCn2cccc2 11a_100011368172_100000740811 [0,0,0,0,1,0|3,0,0]=4 3171 B19R2.113698 O=C(C=Cc1ccccn1)NCCn2cccc2 240690a_100011368172_100000740811 [0,0,0,0,1,0|3,0,0]=4 3172 B19R2.113698 O=C(C=Cc1cccnc1)CCCc2cccs2 1458a_100000735890_100010992444 [0,0,0,0,1,0|3,0,0]=4 3173 B19R2.113698 O=C(C=Cc1cccnc1)CCCn2cccc2 1458a_100000735890_200009814367 [0,0,0,0,1,0|3,0,0]=4 3174 B19R2.113698 O=C(C=Cc1cccnc1)NCCc2ccco2 11a_100000694680_100000735890 [0,0,0,0,1,0|3,0,0]=4 3175 B19R2.113698 O=C(C=Cc1cccnc1)NCCc2ccco2 240690a_100000694680_100000735890 [0,0,0,0,1,0|3,0,0]=4 3176 B19R2.113698 O=C(C=Cc1cccnc1)NCCc2cccs2 11a_100000203755_100000735890 [0,0,0,0,1,0|3,0,0]=4 3177 B19R2.113698 O=C(C=Cc1cccnc1)NCCc2cccs2 240690a_100000203755_100000735890 [0,0,0,0,1,0|3,0,0]=4 3178 B19R2.113698 O=C(C=Cc1cccnc1)NCCc2ccsc2 11a_100000692642_100000735890 [0,0,0,0,1,0|3,0,0]=4 3179 B19R2.113698 O=C(C=Cc1cccnc1)NCCc2ccsc2 240690a_100000692642_100000735890 [0,0,0,0,1,0|3,0,0]=4 3180 B19R2.113698 O=C(C=Cc1cccnc1)NCCn2cccc2 11a_100011368172_100000735890 [0,0,0,0,1,0|3,0,0]=4 3181 B19R2.113698 O=C(C=Cc1cccnc1)NCCn2cccc2 240690a_100011368172_100000735890 [0,0,0,0,1,0|3,0,0]=4 3182 B19R2.113698 O=C(C=Cc1ccncc1)CCCc2cccs2 1458a_100000682801_100010992444 [0,0,0,0,1,0|3,0,0]=4 3183 B19R2.113698 O=C(C=Cc1ccncc1)CCCn2cccc2 1458a_100000682801_200009814367 [0,0,0,0,1,0|3,0,0]=4 3184 B19R2.113698 O=C(C=Cc1ccncc1)NCCc2ccco2 240690a_100000694680_100000682801 [0,0,0,0,1,0|3,0,0]=4 3185 B19R2.113698 O=C(C=Cc1ccncc1)NCCc2cccs2 240690a_100000203755_100000682801 [0,0,0,0,1,0|3,0,0]=4 3186 B19R2.113698 O=C(C=Cc1ccncc1)NCCc2ccsc2 240690a_100000692642_100000682801 [0,0,0,0,1,0|3,0,0]=4 3187 B19R2.113698 O=C(C=Cc1ccncc1)NCCn2cccc2 240690a_100011368172_100000682801 [0,0,0,0,1,0|3,0,0]=4 3188 B21R2.257631 CC(=NNCCc1ccccc1)C=Cc2ccccc2 4a_100000740470_100000204604 [0,0,0,0,0,1|2,0,0]=3 3189 B21R2.257631 CC(=NNCCc1ccccc1)C=Cc2ccccn2 4a_100000740470_100102710650 [0,0,0,0,0,1|3,0,0]=4 3190 B21R2.257631 O=C(C#Cc1ccccc1)CCCCc2ccccc2 1458a_100000736102_100000701786 [0,0,0,0,0,1|1,0,2]=4 3191 B21R2.257631 O=C(C#Cc1ccccc1)CCCOc2ccccc2 1458a_100000736102_100000199009 [0,0,0,0,0,1|1,0,2]=4 3192 B21R2.257631 O=C(C#Cc1ccccc1)CCCSc2ccccc2 1458a_100000736102_200011203293 [0,0,0,0,0,1|1,0,2]=4 3193 B21R2.257631 O=C(C#Cc1ccccc1)CCOCc2ccccc2 1458a_100000736102_100000234347 [0,0,0,0,0,1|1,0,2]=4 3194 B21R2.257631 O=C(C#Cc1ccccc1)CCSCc2ccccc2 1458a_100000736102_200011297719 [0,0,0,0,0,1|1,0,2]=4 3195 B21R2.257631 O=C(C#Cc1ccccc1)NCCCc2ccccc2 240690a_100000211184_100000736102 [0,0,0,0,0,1|1,0,2]=4 3196 B21R2.257631 O=C(C#Cc1ccccc1)NCCOc2ccccc2 240690a_100000174943_100000736102 [0,0,0,0,0,1|1,0,2]=4 3197 B21R2.257631 O=C(C#Cc1ccccc1)NCCSc2ccccc2 240690a_100000189519_100000736102 [0,0,0,0,0,1|1,0,2]=4 3198 B21R2.257631 O=C(C#Cc1ccccc1)NNCCc2ccccc2 22a_100000740470_100000736102 [0,0,0,0,0,1|1,0,2]=4 3199 B21R2.257631 O=C(C=CCCc1ccccc1)CCc2ccccc2 1458a_100016484021_100000765856 [0,0,0,0,0,1|1,0,2]=4 3200 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccc2 11a_100015324214_100016484021 [0,0,0,0,0,1|2,0,1]=4 3201 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccc2 1626a_100015324214_100016484021 [0,0,0,0,0,1|2,0,1]=4 3202 B21R2.257631 O=C(C=CCCc1ccccc1)NCc2ccccc2 240690a_100015324214_100016484021 [0,0,0,0,0,1|2,0,1]=4 3203 B21R2.257631 O=C(C=CCCc1ccccc1)NNc2ccccc2 22a_100015195140_100016484021 [0,0,0,0,0,1|3,0,0]=4 3204 B21R2.257631 O=C(C=Cc1ccccc1)CCCCc2ccccc2 1458a_100000210462_100000701786 [0,0,0,0,0,1|1,0,0]=2 3205 B21R2.257631 O=C(C=Cc1ccccc1)CCCCc2ccncc2 1458a_100000210462_100020630000 [0,0,0,0,0,1|2,0,0]=3 3206 B21R2.257631 O=C(C=Cc1ccccc1)CCCOc2ccccc2 1458a_100000210462_100000199009 [0,0,0,0,0,1|1,0,0]=2 3207 B21R2.257631 O=C(C=Cc1ccccc1)CCCSc2ccccc2 1458a_100000210462_200011203293 [0,0,0,0,0,1|1,0,0]=2 3208 B21R2.257631 O=C(C=Cc1ccccc1)CCOCc2ccccc2 1458a_100000210462_100000234347 [0,0,0,0,0,1|1,0,0]=2 3209 B21R2.257631 O=C(C=Cc1ccccc1)CCSCc2ccccc2 1458a_100000210462_200011297719 [0,0,0,0,0,1|1,0,0]=2 3210 B21R2.257631 O=C(C=Cc1ccccc1)NC/C=C/c2ccccc2 11a_100020603302_100000210462 [0,0,0,0,0,1|1,0,1]=3 3211 B21R2.257631 O=C(C=Cc1ccccc1)NC/C=C/c2ccccc2 1626a_100020603302_100000210462 [0,0,0,0,0,1|1,0,1]=3 3212 B21R2.257631 O=C(C=Cc1ccccc1)NCC#Cc2ccccc2 11a_100000735379_100000210462 [0,0,0,0,0,1|1,0,1]=3 3213 B21R2.257631 O=C(C=Cc1ccccc1)NCC#Cc2ccccc2 1626a_100000735379_100000210462 [0,0,0,0,0,1|1,0,1]=3 3214 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccccc2 11a_100000211184_100000210462 [0,0,0,0,0,1|1,0,0]=2 3215 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccccc2 1626a_100000211184_100000210462 [0,0,0,0,0,1|1,0,0]=2 3216 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccccn2 11a_100000689020_100000210462 [0,0,0,0,0,1|2,0,0]=3 3217 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccccn2 1626a_100000689020_100000210462 [0,0,0,0,0,1|2,0,0]=3 3218 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2cccnc2 11a_100011532358_100000210462 [0,0,0,0,0,1|2,0,0]=3 3219 B21R2.257631 O=C(C=Cc1ccccc1)NCCCc2ccncc2 1626a_100011275580_100000210462 [0,0,0,0,0,1|2,0,0]=3 3220 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccccc2 11a_100000174943_100000210462 [0,0,0,0,0,1|1,0,0]=2 3221 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccccc2 1626a_100000174943_100000210462 [0,0,0,0,0,1|1,0,0]=2 3222 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccccn2 11a_106741647558_100000210462 [0,0,0,0,0,1|2,0,0]=3 3223 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccccn2 1626a_106741647558_100000210462 [0,0,0,0,0,1|2,0,0]=3 3224 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2cccnc2 11a_100000754688_100000210462 [0,0,0,0,0,1|2,0,0]=3 3225 B21R2.257631 O=C(C=Cc1ccccc1)NCCOc2ccncc2 11a_100025717301_100000210462 [0,0,0,0,0,1|2,0,0]=3 3226 B21R2.257631 O=C(C=Cc1ccccc1)NNCCc2ccccc2 22a_100000740470_100000210462 [0,0,0,0,0,1|1,0,0]=2 3227 B21R2.257631 O=C(C=Cc1ccccn1)CCCCc2ccccc2 1458a_100000740811_100000701786 [0,0,0,0,0,1|2,0,0]=3 3228 B21R2.257631 O=C(C=Cc1ccccn1)CCCCc2ccncc2 1458a_100000740811_100020630000 [0,0,0,0,0,1|3,0,0]=4 3229 B21R2.257631 O=C(C=Cc1ccccn1)CCCOc2ccccc2 1458a_100000740811_100000199009 [0,0,0,0,0,1|2,0,0]=3 3230 B21R2.257631 O=C(C=Cc1ccccn1)CCCSc2ccccc2 1458a_100000740811_200011203293 [0,0,0,0,0,1|2,0,0]=3 3231 B21R2.257631 O=C(C=Cc1ccccn1)CCOCc2ccccc2 1458a_100000740811_100000234347 [0,0,0,0,0,1|2,0,0]=3 3232 B21R2.257631 O=C(C=Cc1ccccn1)CCSCc2ccccc2 1458a_100000740811_200011297719 [0,0,0,0,0,1|2,0,0]=3 3233 B21R2.257631 O=C(C=Cc1ccccn1)NC/C=C/c2ccccc2 11a_100020603302_100000740811 [0,0,0,0,0,1|2,0,1]=4 3234 B21R2.257631 O=C(C=Cc1ccccn1)NC/C=C/c2ccccc2 240690a_100020603302_100000740811 [0,0,0,0,0,1|2,0,1]=4 3235 B21R2.257631 O=C(C=Cc1ccccn1)NCC#Cc2ccccc2 11a_100000735379_100000740811 [0,0,0,0,0,1|2,0,1]=4 3236 B21R2.257631 O=C(C=Cc1ccccn1)NCC#Cc2ccccc2 240690a_100000735379_100000740811 [0,0,0,0,0,1|2,0,1]=4 3237 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2ccccc2 11a_100000211184_100000740811 [0,0,0,0,0,1|2,0,0]=3 3238 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2ccccc2 240690a_100000211184_100000740811 [0,0,0,0,0,1|2,0,0]=3 3239 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2ccccn2 11a_100000689020_100000740811 [0,0,0,0,0,1|3,0,0]=4 3240 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2ccccn2 240690a_100000689020_100000740811 [0,0,0,0,0,1|3,0,0]=4 3241 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2cccnc2 11a_100011532358_100000740811 [0,0,0,0,0,1|3,0,0]=4 3242 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2cccnc2 240690a_100011532358_100000740811 [0,0,0,0,0,1|3,0,0]=4 3243 B21R2.257631 O=C(C=Cc1ccccn1)NCCCc2ccncc2 240690a_100011275580_100000740811 [0,0,0,0,0,1|3,0,0]=4 3244 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2ccccc2 11a_100000174943_100000740811 [0,0,0,0,0,1|2,0,0]=3 3245 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2ccccc2 240690a_100000174943_100000740811 [0,0,0,0,0,1|2,0,0]=3 3246 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2ccccn2 11a_106741647558_100000740811 [0,0,0,0,0,1|3,0,0]=4 3247 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2ccccn2 240690a_106741647558_100000740811 [0,0,0,0,0,1|3,0,0]=4 3248 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2cccnc2 11a_100000754688_100000740811 [0,0,0,0,0,1|3,0,0]=4 3249 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2cccnc2 240690a_100000754688_100000740811 [0,0,0,0,0,1|3,0,0]=4 3250 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2ccncc2 11a_100025717301_100000740811 [0,0,0,0,0,1|3,0,0]=4 3251 B21R2.257631 O=C(C=Cc1ccccn1)NCCOc2ccncc2 240690a_100025717301_100000740811 [0,0,0,0,0,1|3,0,0]=4 3252 B21R2.257631 O=C(C=Cc1ccccn1)NCCSc2ccccc2 240690a_100000189519_100000740811 [0,0,0,0,0,1|2,0,0]=3 3253 B21R2.257631 O=C(C=Cc1ccccn1)NNCCc2ccccc2 22a_100000740470_100000740811 [0,0,0,0,0,1|2,0,0]=3 3254 B21R2.257631 O=C(C=Cc1cccnc1)CCCCc2ccccc2 1458a_100000735890_100000701786 [0,0,0,0,0,1|2,0,0]=3 3255 B21R2.257631 O=C(C=Cc1cccnc1)CCCCc2ccncc2 1458a_100000735890_100020630000 [0,0,0,0,0,1|3,0,0]=4 3256 B21R2.257631 O=C(C=Cc1cccnc1)CCCOc2ccccc2 1458a_100000735890_100000199009 [0,0,0,0,0,1|2,0,0]=3 3257 B21R2.257631 O=C(C=Cc1cccnc1)CCCSc2ccccc2 1458a_100000735890_200011203293 [0,0,0,0,0,1|2,0,0]=3 3258 B21R2.257631 O=C(C=Cc1cccnc1)CCOCc2ccccc2 1458a_100000735890_100000234347 [0,0,0,0,0,1|2,0,0]=3 3259 B21R2.257631 O=C(C=Cc1cccnc1)CCSCc2ccccc2 1458a_100000735890_200011297719 [0,0,0,0,0,1|2,0,0]=3 3260 B21R2.257631 O=C(C=Cc1cccnc1)NC/C=C/c2ccccc2 11a_100020603302_100000735890 [0,0,0,0,0,1|2,0,1]=4 3261 B21R2.257631 O=C(C=Cc1cccnc1)NC/C=C/c2ccccc2 240690a_100020603302_100000735890 [0,0,0,0,0,1|2,0,1]=4 3262 B21R2.257631 O=C(C=Cc1cccnc1)NCC#Cc2ccccc2 11a_100000735379_100000735890 [0,0,0,0,0,1|2,0,1]=4 3263 B21R2.257631 O=C(C=Cc1cccnc1)NCC#Cc2ccccc2 240690a_100000735379_100000735890 [0,0,0,0,0,1|2,0,1]=4 3264 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2ccccc2 11a_100000211184_100000735890 [0,0,0,0,0,1|2,0,0]=3 3265 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2ccccc2 240690a_100000211184_100000735890 [0,0,0,0,0,1|2,0,0]=3 3266 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2ccccn2 11a_100000689020_100000735890 [0,0,0,0,0,1|3,0,0]=4 3267 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2ccccn2 240690a_100000689020_100000735890 [0,0,0,0,0,1|3,0,0]=4 3268 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2cccnc2 11a_100011532358_100000735890 [0,0,0,0,0,1|3,0,0]=4 3269 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2cccnc2 240690a_100011532358_100000735890 [0,0,0,0,0,1|3,0,0]=4 3270 B21R2.257631 O=C(C=Cc1cccnc1)NCCCc2ccncc2 240690a_100011275580_100000735890 [0,0,0,0,0,1|3,0,0]=4 3271 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2ccccc2 11a_100000174943_100000735890 [0,0,0,0,0,1|2,0,0]=3 3272 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2ccccc2 240690a_100000174943_100000735890 [0,0,0,0,0,1|2,0,0]=3 3273 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2ccccn2 11a_106741647558_100000735890 [0,0,0,0,0,1|3,0,0]=4 3274 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2ccccn2 240690a_106741647558_100000735890 [0,0,0,0,0,1|3,0,0]=4 3275 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2cccnc2 11a_100000754688_100000735890 [0,0,0,0,0,1|3,0,0]=4 3276 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2cccnc2 240690a_100000754688_100000735890 [0,0,0,0,0,1|3,0,0]=4 3277 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2ccncc2 11a_100025717301_100000735890 [0,0,0,0,0,1|3,0,0]=4 3278 B21R2.257631 O=C(C=Cc1cccnc1)NCCOc2ccncc2 240690a_100025717301_100000735890 [0,0,0,0,0,1|3,0,0]=4 3279 B21R2.257631 O=C(C=Cc1cccnc1)NCCSc2ccccc2 240690a_100000189519_100000735890 [0,0,0,0,0,1|2,0,0]=3 3280 B21R2.257631 O=C(C=Cc1cccnc1)NNCCc2ccccc2 22a_100000740470_100000735890 [0,0,0,0,0,1|2,0,0]=3 3281 B21R2.257631 O=C(C=Cc1ccncc1)CCCCc2ccccc2 1458a_100000682801_100000701786 [0,0,0,0,0,1|2,0,0]=3 3282 B21R2.257631 O=C(C=Cc1ccncc1)CCCCc2ccncc2 1458a_100000682801_100020630000 [0,0,0,0,0,1|3,0,0]=4 3283 B21R2.257631 O=C(C=Cc1ccncc1)CCCOc2ccccc2 1458a_100000682801_100000199009 [0,0,0,0,0,1|2,0,0]=3 3284 B21R2.257631 O=C(C=Cc1ccncc1)CCCSc2ccccc2 1458a_100000682801_200011203293 [0,0,0,0,0,1|2,0,0]=3 3285 B21R2.257631 O=C(C=Cc1ccncc1)CCOCc2ccccc2 1458a_100000682801_100000234347 [0,0,0,0,0,1|2,0,0]=3 3286 B21R2.257631 O=C(C=Cc1ccncc1)CCSCc2ccccc2 1458a_100000682801_200011297719 [0,0,0,0,0,1|2,0,0]=3 3287 B21R2.257631 O=C(C=Cc1ccncc1)NC/C=C/c2ccccc2 240690a_100020603302_100000682801 [0,0,0,0,0,1|2,0,1]=4 3288 B21R2.257631 O=C(C=Cc1ccncc1)NCC#Cc2ccccc2 240690a_100000735379_100000682801 [0,0,0,0,0,1|2,0,1]=4 3289 B21R2.257631 O=C(C=Cc1ccncc1)NCCCc2ccccc2 240690a_100000211184_100000682801 [0,0,0,0,0,1|2,0,0]=3 3290 B21R2.257631 O=C(C=Cc1ccncc1)NCCCc2ccccn2 240690a_100000689020_100000682801 [0,0,0,0,0,1|3,0,0]=4 3291 B21R2.257631 O=C(C=Cc1ccncc1)NCCCc2cccnc2 240690a_100011532358_100000682801 [0,0,0,0,0,1|3,0,0]=4 3292 B21R2.257631 O=C(C=Cc1ccncc1)NCCCc2ccncc2 240690a_100011275580_100000682801 [0,0,0,0,0,1|3,0,0]=4 3293 B21R2.257631 O=C(C=Cc1ccncc1)NCCOc2ccccc2 240690a_100000174943_100000682801 [0,0,0,0,0,1|2,0,0]=3 3294 B21R2.257631 O=C(C=Cc1ccncc1)NCCOc2ccccn2 240690a_106741647558_100000682801 [0,0,0,0,0,1|3,0,0]=4 3295 B21R2.257631 O=C(C=Cc1ccncc1)NCCOc2cccnc2 240690a_100000754688_100000682801 [0,0,0,0,0,1|3,0,0]=4 3296 B21R2.257631 O=C(C=Cc1ccncc1)NCCOc2ccncc2 240690a_100025717301_100000682801 [0,0,0,0,0,1|3,0,0]=4 3297 B21R2.257631 O=C(C=Cc1ccncc1)NCCSc2ccccc2 240690a_100000189519_100000682801 [0,0,0,0,0,1|2,0,0]=3 3298 B21R2.257631 O=C(C=Cc1ccncc1)NNCCc2ccccc2 22a_100000740470_100000682801 [0,0,0,0,0,1|2,0,0]=3 3299 B21R2.257631 O=C(C=Cc1cncnc1)CCCCc2ccccc2 6a_100000749868_200011485782 [0,0,0,0,0,1|3,0,0]=4 3300 B21R2.257631 O=C(C=Cc1cncnc1)CCOCc2ccccc2 6a_100000749868_100011219826 [0,0,0,0,0,1|3,0,0]=4 3301 B21R2.257631 O=C(CCCCc1ccccc1)CCc2ccccc2 1458a_100000185753_100000701786 [0,0,0,0,0,1|1,0,2]=4 3302 B21R2.257631 O=C(CCCCc1ccccc1)CCc2ccccc2 1458a_100011215911_100000765856 [0,0,0,0,0,1|1,0,2]=4 3303 B21R2.257631 O=C(CCCCc1ccccc1)COc2ccccc2 1458a_100000186222_100000701786 [0,0,0,0,0,1|2,0,1]=4 3304 B21R2.257631 O=C(CCCCc1ccccc1)CSc2ccccc2 1458a_100000211596_100000701786 [0,0,0,0,0,1|2,0,1]=4 3305 B21R2.257631 O=C(CCCCc1ccccc1)NCc2ccccc2 11a_100015324214_100011215911 [0,0,0,0,0,1|2,0,1]=4 3306 B21R2.257631 O=C(CCCCc1ccccc1)NCc2ccccc2 1626a_100015324214_100011215911 [0,0,0,0,0,1|2,0,1]=4 3307 B21R2.257631 O=C(CCCCc1ccccc1)NCc2ccccc2 240690a_100015324214_100011215911 [0,0,0,0,0,1|2,0,1]=4 3308 B21R2.257631 O=C(CCCCc1ccccc1)NCc2ccccc2 527a_100015324214_100011215911 [0,0,0,0,0,1|2,0,1]=4 3309 B21R2.257631 O=C(CCCCc1ccccc1)NNc2ccccc2 22a_100015195140_100011215911 [0,0,0,0,0,1|3,0,0]=4 3310 B21R2.257631 O=C(CCCNc1ccccc1)OCc2ccccc2 34a_100000106764_100009813218 [0,0,0,0,0,1|2,0,1]=4 3311 B21R2.257631 O=C(CCCOc1ccccc1)CCc2ccccc2 1458a_100000185753_100000199009 [0,0,0,0,0,1|1,0,2]=4 3312 B21R2.257631 O=C(CCCOc1ccccc1)CCc2ccccc2 1458a_100000212059_100000765856 [0,0,0,0,0,1|1,0,2]=4 3313 B21R2.257631 O=C(CCCOc1ccccc1)COc2ccccc2 1458a_100000186222_100000199009 [0,0,0,0,0,1|2,0,1]=4 3314 B21R2.257631 O=C(CCCOc1ccccc1)CSc2ccccc2 1458a_100000211596_100000199009 [0,0,0,0,0,1|2,0,1]=4 3315 B21R2.257631 O=C(CCCOc1ccccc1)NCc2ccccc2 11a_100015324214_100000212059 [0,0,0,0,0,1|2,0,1]=4 3316 B21R2.257631 O=C(CCCOc1ccccc1)NCc2ccccc2 1626a_100015324214_100000212059 [0,0,0,0,0,1|2,0,1]=4 3317 B21R2.257631 O=C(CCCOc1ccccc1)NCc2ccccc2 240690a_100015324214_100000212059 [0,0,0,0,0,1|2,0,1]=4 3318 B21R2.257631 O=C(CCCOc1ccccc1)NCc2ccccc2 527a_100015324214_100000212059 [0,0,0,0,0,1|2,0,1]=4 3319 B21R2.257631 O=C(CCCOc1ccccc1)NNc2ccccc2 22a_100015195140_100000212059 [0,0,0,0,0,1|3,0,0]=4 3320 B21R2.257631 O=C(CCCOc1ccccc1)OCc2ccccc2 34a_100000210340_100009813218 [0,0,0,0,0,1|2,0,1]=4 3321 B21R2.257631 O=C(CCCOc1ccccc1)OCc2ccccc2 7a_100000210340_100009813218 [0,0,0,0,0,1|2,0,1]=4 3322 B21R2.257631 O=C(CCCSc1ccccc1)CCc2ccccc2 1458a_100000182835_100000765856 [0,0,0,0,0,1|1,0,2]=4 3323 B21R2.257631 O=C(CCCSc1ccccc1)CCc2ccccc2 1458a_100000185753_200011203293 [0,0,0,0,0,1|1,0,2]=4 3324 B21R2.257631 O=C(CCCSc1ccccc1)COc2ccccc2 1458a_100000186222_200011203293 [0,0,0,0,0,1|2,0,1]=4 3325 B21R2.257631 O=C(CCCSc1ccccc1)CSc2ccccc2 1458a_100000211596_200011203293 [0,0,0,0,0,1|2,0,1]=4 3326 B21R2.257631 O=C(CCCSc1ccccc1)NCc2ccccc2 11a_100015324214_100000182835 [0,0,0,0,0,1|2,0,1]=4 3327 B21R2.257631 O=C(CCCSc1ccccc1)NCc2ccccc2 1626a_100015324214_100000182835 [0,0,0,0,0,1|2,0,1]=4 3328 B21R2.257631 O=C(CCCSc1ccccc1)NCc2ccccc2 240690a_100015324214_100000182835 [0,0,0,0,0,1|2,0,1]=4 3329 B21R2.257631 O=C(CCCSc1ccccc1)NCc2ccccc2 527a_100015324214_100000182835 [0,0,0,0,0,1|2,0,1]=4 3330 B21R2.257631 O=C(CCCSc1ccccc1)NNc2ccccc2 22a_100015195140_100000182835 [0,0,0,0,0,1|3,0,0]=4 3331 B21R2.257631 O=C(CCCSc1ccccc1)OCc2ccccc2 62a_100000719477_100009813218 [0,0,0,0,0,1|2,0,1]=4 3332 B21R2.257631 O=C(CCCSc1ccccc1)OCc2ccccc2 62a_100009813218_100000041952 [0,0,0,0,0,1|2,0,1]=4 3333 B21R2.257631 O=C(CCNCc1ccccc1)NCc2ccccc2 207a_100025741942_100015611070 [0,0,0,0,0,1|2,0,1]=4 3334 B21R2.257631 O=C(CCNCc1ccccc1)NCc2ccccc2 2230a_100025741942_100015291786 [0,0,0,0,0,1|2,0,1]=4 3335 B21R2.257631 O=C(CCNCc1ccccc1)NCc2ccccc2 270004a_100025741942_100015611070 [0,0,0,0,0,1|2,0,1]=4 3336 B21R2.257631 O=C(CCNCc1ccccc1)NCc2ccccc2 34a_100025741942_100015291786 [0,0,0,0,0,1|2,0,1]=4 3337 B21R2.257631 O=C(CCNCc1ccccc1)OCc2ccccc2 2230a_100015324214_100009813219 [0,0,0,0,0,1|2,0,1]=4 3338 B21R2.257631 O=C(CCOCc1ccccc1)CCc2ccccc2 1458a_100000185753_100000234347 [0,0,0,0,0,1|1,0,2]=4 3339 B21R2.257631 O=C(CCOCc1ccccc1)CCc2ccccc2 1458a_100000743319_100000765856 [0,0,0,0,0,1|1,0,2]=4 3340 B21R2.257631 O=C(CCOCc1ccccc1)COc2ccccc2 1458a_100000186222_100000234347 [0,0,0,0,0,1|2,0,1]=4 3341 B21R2.257631 O=C(CCOCc1ccccc1)CSc2ccccc2 1458a_100000211596_100000234347 [0,0,0,0,0,1|2,0,1]=4 3342 B21R2.257631 O=C(CCOCc1ccccc1)NCc2ccccc2 11a_100015324214_100000743319 [0,0,0,0,0,1|2,0,1]=4 3343 B21R2.257631 O=C(CCOCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000743319 [0,0,0,0,0,1|2,0,1]=4 3344 B21R2.257631 O=C(CCOCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000743319 [0,0,0,0,0,1|2,0,1]=4 3345 B21R2.257631 O=C(CCOCc1ccccc1)NCc2ccccc2 527a_100015324214_100000743319 [0,0,0,0,0,1|2,0,1]=4 3346 B21R2.257631 O=C(CCOCc1ccccc1)NNc2ccccc2 22a_100015195140_100000743319 [0,0,0,0,0,1|3,0,0]=4 3347 B21R2.257631 O=C(CCOCc1ccccc1)OCc2ccccc2 7a_100000210790_100009813219 [0,0,0,0,0,1|2,0,1]=4 3348 B21R2.257631 O=C(CCOCc1ccccc1)OCc2ccccc2 7a_100009831632_100000211182 [0,0,0,0,0,1|2,0,1]=4 3349 B21R2.257631 O=C(CCSCc1ccccc1)CCc2ccccc2 1458a_100000173759_100000765856 [0,0,0,0,0,1|1,0,2]=4 3350 B21R2.257631 O=C(CCSCc1ccccc1)CCc2ccccc2 1458a_100000185753_200011297719 [0,0,0,0,0,1|1,0,2]=4 3351 B21R2.257631 O=C(CCSCc1ccccc1)COc2ccccc2 1458a_100000186222_200011297719 [0,0,0,0,0,1|2,0,1]=4 3352 B21R2.257631 O=C(CCSCc1ccccc1)CSc2ccccc2 1458a_100000211596_200011297719 [0,0,0,0,0,1|2,0,1]=4 3353 B21R2.257631 O=C(CCSCc1ccccc1)NCc2ccccc2 11a_100015324214_100000173759 [0,0,0,0,0,1|2,0,1]=4 3354 B21R2.257631 O=C(CCSCc1ccccc1)NCc2ccccc2 1626a_100015324214_100000173759 [0,0,0,0,0,1|2,0,1]=4 3355 B21R2.257631 O=C(CCSCc1ccccc1)NCc2ccccc2 240690a_100015324214_100000173759 [0,0,0,0,0,1|2,0,1]=4 3356 B21R2.257631 O=C(CCSCc1ccccc1)NCc2ccccc2 527a_100015324214_100000173759 [0,0,0,0,0,1|2,0,1]=4 3357 B21R2.257631 O=C(CCSCc1ccccc1)NNc2ccccc2 22a_100015195140_100000173759 [0,0,0,0,0,1|3,0,0]=4 3358 B21R2.257631 O=C(CCSCc1ccccc1)OCc2ccccc2 62a_100000211182_100009813219 [0,0,0,0,0,1|2,0,1]=4 3359 B21R2.257631 O=C(CCSCc1ccccc1)OCc2ccccc2 62a_100009813219_100015291786 [0,0,0,0,0,1|2,0,1]=4 3360 B21R2.257631 O=C(CCc1ccccc1)CNCCc2ccccc2 2230a_100000106460_100012361361 [0,0,0,0,0,1|1,0,2]=4 3361 B21R2.257631 O=C(CCc1ccccc1)CNCCc2ccccc2 34a_100000106460_100012361361 [0,0,0,0,0,1|1,0,2]=4 3362 B21R2.257631 O=C(CCc1ccccc1)COCCc2ccccc2 34a_100000210268_100012361361 [0,0,0,0,0,1|0,0,2]=3 3363 B21R2.257631 O=C(CCc1ccccc1)COCCc2ccccc2 7a_100000210268_100012361361 [0,0,0,0,0,1|0,0,2]=3 3364 B21R2.257631 O=C(CCc1ccccc1)COCCc2ccccn2 34a_100000210271_100012361361 [0,0,0,0,0,1|1,0,2]=4 3365 B21R2.257631 O=C(CCc1ccccc1)COCCc2cccnc2 34a_100011217484_100012361361 [0,0,0,0,0,1|1,0,2]=4 3366 B21R2.257631 O=C(CCc1ccccc1)COCCc2ccncc2 34a_100011216225_100012361361 [0,0,0,0,0,1|1,0,2]=4 3367 B21R2.257631 O=C(CCc1ccccc1)CSCCc2ccccc2 62a_100000765856_100012361361 [0,0,0,0,0,1|0,1,2]=4 3368 B21R2.257631 O=C(CCc1ccccc1)CSCCc2ccccc2 62a_100012361361_100011218657 [0,0,0,0,0,1|0,1,2]=4 3369 B21R2.257631 O=C(CCc1ccccc1)NCCCc2ccccc2 11a_100000211184_100000185753 [0,0,0,0,0,1|1,0,2]=4 3370 B21R2.257631 O=C(CCc1ccccc1)NCCCc2ccccc2 1626a_100000211184_100000185753 [0,0,0,0,0,1|1,0,2]=4 3371 B21R2.257631 O=C(CCc1ccccc1)NCCCc2ccccc2 240690a_100000211184_100000185753 [0,0,0,0,0,1|1,0,2]=4 3372 B21R2.257631 O=C(CCc1ccccc1)NCCCc2ccccc2 527a_100000211184_100000185753 [0,0,0,0,0,1|1,0,2]=4 3373 B21R2.257631 O=C(CCc1ccccc1)NCCOc2ccccc2 11a_100000174943_100000185753 [0,0,0,0,0,1|1,0,2]=4 3374 B21R2.257631 O=C(CCc1ccccc1)NCCOc2ccccc2 1626a_100000174943_100000185753 [0,0,0,0,0,1|1,0,2]=4 3375 B21R2.257631 O=C(CCc1ccccc1)NCCOc2ccccc2 240690a_100000174943_100000185753 [0,0,0,0,0,1|1,0,2]=4 3376 B21R2.257631 O=C(CCc1ccccc1)NCCOc2ccccc2 527a_100000174943_100000185753 [0,0,0,0,0,1|1,0,2]=4 3377 B21R2.257631 O=C(CCc1ccccc1)NCCSc2ccccc2 240690a_100000189519_100000185753 [0,0,0,0,0,1|1,0,2]=4 3378 B21R2.257631 O=C(CCc1ccccc1)NCCSc2ccccc2 527a_100000189519_100000185753 [0,0,0,0,0,1|1,0,2]=4 3379 B21R2.257631 O=C(CCc1ccccc1)NNCCc2ccccc2 22a_100000740470_100000185753 [0,0,0,0,0,1|1,0,2]=4 3380 B21R2.257631 O=C(CNCCc1ccccc1)NCc2ccccc2 2230a_100000106460_100000183539 [0,0,0,0,0,1|2,0,1]=4 3381 B21R2.257631 O=C(CNCCc1ccccc1)NCc2ccccc2 2230a_100000739245_100000765856 [0,0,0,0,0,1|2,0,1]=4 3382 B21R2.257631 O=C(CNCCc1ccccc1)NCc2ccccc2 34a_100000106460_100000183539 [0,0,0,0,0,1|2,0,1]=4 3383 B21R2.257631 O=C(CNCCc1ccccc1)OCc2ccccc2 2230a_100000106460_100000753625 [0,0,0,0,0,1|2,0,1]=4 3384 B21R2.257631 O=C(CNCCc1ccccc1)OCc2ccccc2 34a_100000106460_100000753625 [0,0,0,0,0,1|2,0,1]=4 3385 B21R2.257631 O=C(CNc1ccccc1)NCCCc2ccccc2 34a_100000106764_100000182878 [0,0,0,0,0,1|2,0,1]=4 3386 B21R2.257631 O=C(CNc1ccccc1)NCCOc2ccccc2 34a_100000106764_100000181728 [0,0,0,0,0,1|2,0,1]=4 3387 B21R2.257631 O=C(COCCc1ccccc1)NCc2ccccc2 34a_100000210268_100000183539 [0,0,0,0,0,1|1,0,1]=3 3388 B21R2.257631 O=C(COCCc1ccccc1)NCc2ccccc2 7a_100000210268_100000183539 [0,0,0,0,0,1|1,0,1]=3 3389 B21R2.257631 O=C(COCCc1ccccc1)NCc2ccccn2 34a_100000210268_100000684169 [0,0,0,0,0,1|2,0,1]=4 3390 B21R2.257631 O=C(COCCc1ccccc1)NCc2ccccn2 7a_100000210268_100000684169 [0,0,0,0,0,1|2,0,1]=4 3391 B21R2.257631 O=C(COCCc1ccccc1)NCc2cccnc2 7a_100000210268_100000752408 [0,0,0,0,0,1|2,0,1]=4 3392 B21R2.257631 O=C(COCCc1ccccc1)NCc2ccncc2 7a_100000210268_100011243468 [0,0,0,0,0,1|2,0,1]=4 3393 B21R2.257631 O=C(COCCc1ccccc1)OCc2ccccc2 34a_100000210268_100000753625 [0,0,0,0,0,1|1,0,1]=3 3394 B21R2.257631 O=C(COCCc1ccccc1)OCc2ccccc2 7a_100000210268_100000753625 [0,0,0,0,0,1|1,0,1]=3 3395 B21R2.257631 O=C(COCCc1ccccn1)NCc2ccccc2 34a_100000210271_100000183539 [0,0,0,0,0,1|2,0,1]=4 3396 B21R2.257631 O=C(COCCc1ccccn1)OCc2ccccc2 34a_100000210271_100000753625 [0,0,0,0,0,1|2,0,1]=4 3397 B21R2.257631 O=C(COCCc1cccnc1)NCc2ccccc2 34a_100011217484_100000183539 [0,0,0,0,0,1|2,0,1]=4 3398 B21R2.257631 O=C(COCCc1cccnc1)OCc2ccccc2 34a_100011217484_100000753625 [0,0,0,0,0,1|2,0,1]=4 3399 B21R2.257631 O=C(COCCc1ccncc1)NCc2ccccc2 34a_100011216225_100000183539 [0,0,0,0,0,1|2,0,1]=4 3400 B21R2.257631 O=C(COCCc1ccncc1)OCc2ccccc2 34a_100011216225_100000753625 [0,0,0,0,0,1|2,0,1]=4 3401 B21R2.257631 O=C(COc1ccccc1)NCCCc2ccccc2 11a_100000211184_100000186222 [0,0,0,0,0,1|2,0,1]=4 3402 B21R2.257631 O=C(COc1ccccc1)NCCCc2ccccc2 1626a_100000211184_100000186222 [0,0,0,0,0,1|2,0,1]=4 3403 B21R2.257631 O=C(COc1ccccc1)NCCCc2ccccc2 240690a_100000211184_100000186222 [0,0,0,0,0,1|2,0,1]=4 3404 B21R2.257631 O=C(COc1ccccc1)NCCCc2ccccc2 34a_100000210340_100000182878 [0,0,0,0,0,1|2,0,1]=4 3405 B21R2.257631 O=C(COc1ccccc1)NCCCc2ccccc2 527a_100000211184_100000186222 [0,0,0,0,0,1|2,0,1]=4 3406 B21R2.257631 O=C(COc1ccccc1)NCCCc2ccccc2 7a_100000210340_100000182878 [0,0,0,0,0,1|2,0,1]=4 3407 B21R2.257631 O=C(COc1ccccc1)NCCOc2ccccc2 11a_100000174943_100000186222 [0,0,0,0,0,1|2,0,1]=4 3408 B21R2.257631 O=C(COc1ccccc1)NCCOc2ccccc2 1626a_100000174943_100000186222 [0,0,0,0,0,1|2,0,1]=4 3409 B21R2.257631 O=C(COc1ccccc1)NCCOc2ccccc2 240690a_100000174943_100000186222 [0,0,0,0,0,1|2,0,1]=4 3410 B21R2.257631 O=C(COc1ccccc1)NCCOc2ccccc2 34a_100000210340_100000181728 [0,0,0,0,0,1|2,0,1]=4 3411 B21R2.257631 O=C(COc1ccccc1)NCCOc2ccccc2 527a_100000174943_100000186222 [0,0,0,0,0,1|2,0,1]=4 3412 B21R2.257631 O=C(COc1ccccc1)NCCOc2ccccc2 7a_100000210340_100000181728 [0,0,0,0,0,1|2,0,1]=4 3413 B21R2.257631 O=C(COc1ccccc1)NCCSc2ccccc2 240690a_100000189519_100000186222 [0,0,0,0,0,1|2,0,1]=4 3414 B21R2.257631 O=C(COc1ccccc1)NCCSc2ccccc2 527a_100000189519_100000186222 [0,0,0,0,0,1|2,0,1]=4 3415 B21R2.257631 O=C(COc1ccccc1)NNCCc2ccccc2 22a_100000740470_100000186222 [0,0,0,0,0,1|2,0,1]=4 3416 B21R2.257631 O=C(CSCCc1ccccc1)NCc2ccccc2 62a_100000183539_100011218657 [0,0,0,0,0,1|1,1,1]=4 3417 B21R2.257631 O=C(CSCCc1ccccc1)NCc2ccccc2 62a_100000765856_100000183539 [0,0,0,0,0,1|1,1,1]=4 3418 B21R2.257631 O=C(CSCCc1ccccc1)OCc2ccccc2 62a_100000753625_100011218657 [0,0,0,0,0,1|1,1,1]=4 3419 B21R2.257631 O=C(CSCCc1ccccc1)OCc2ccccc2 62a_100000765856_100000753625 [0,0,0,0,0,1|1,1,1]=4 3420 B21R2.257631 O=C(CSc1ccccc1)NCCCc2ccccc2 11a_100000211184_100000211596 [0,0,0,0,0,1|2,0,1]=4 3421 B21R2.257631 O=C(CSc1ccccc1)NCCCc2ccccc2 1626a_100000211184_100000211596 [0,0,0,0,0,1|2,0,1]=4 3422 B21R2.257631 O=C(CSc1ccccc1)NCCCc2ccccc2 240690a_100000211184_100000211596 [0,0,0,0,0,1|2,0,1]=4 3423 B21R2.257631 O=C(CSc1ccccc1)NCCCc2ccccc2 527a_100000211184_100000211596 [0,0,0,0,0,1|2,0,1]=4 3424 B21R2.257631 O=C(CSc1ccccc1)NCCCc2ccccc2 62a_100000182878_100000041952 [0,0,0,0,0,1|2,0,1]=4 3425 B21R2.257631 O=C(CSc1ccccc1)NCCCc2ccccc2 62a_100000719477_100000182878 [0,0,0,0,0,1|2,0,1]=4 3426 B21R2.257631 O=C(CSc1ccccc1)NCCOc2ccccc2 11a_100000174943_100000211596 [0,0,0,0,0,1|2,0,1]=4 3427 B21R2.257631 O=C(CSc1ccccc1)NCCOc2ccccc2 1626a_100000174943_100000211596 [0,0,0,0,0,1|2,0,1]=4 3428 B21R2.257631 O=C(CSc1ccccc1)NCCOc2ccccc2 240690a_100000174943_100000211596 [0,0,0,0,0,1|2,0,1]=4 3429 B21R2.257631 O=C(CSc1ccccc1)NCCOc2ccccc2 527a_100000174943_100000211596 [0,0,0,0,0,1|2,0,1]=4 3430 B21R2.257631 O=C(CSc1ccccc1)NCCOc2ccccc2 62a_100000181728_100000041952 [0,0,0,0,0,1|2,0,1]=4 3431 B21R2.257631 O=C(CSc1ccccc1)NCCOc2ccccc2 62a_100000719477_100000181728 [0,0,0,0,0,1|2,0,1]=4 3432 B21R2.257631 O=C(CSc1ccccc1)NCCSc2ccccc2 240690a_100000189519_100000211596 [0,0,0,0,0,1|2,0,1]=4 3433 B21R2.257631 O=C(CSc1ccccc1)NCCSc2ccccc2 527a_100000189519_100000211596 [0,0,0,0,0,1|2,0,1]=4 3434 B21R2.257631 O=C(CSc1ccccc1)NNCCc2ccccc2 22a_100000740470_100000211596 [0,0,0,0,0,1|2,0,1]=4 3435 B21R2.257631 O=C(NCCCc1ccccc1)NCc2ccccc2 2708a_100000211184_100015324214 [0,0,0,0,0,1|2,0,1]=4 3436 B21R2.257631 O=C(NCCCc1ccccc1)NCc2ccccc2 2708a_100015324214_100000211184 [0,0,0,0,0,1|2,0,1]=4 3437 B21R2.257631 O=C(NCCCc1ccccc1)NCc2ccccc2 273464a_100000211184_100015324214 [0,0,0,0,0,1|2,0,1]=4 3438 B21R2.257631 O=C(NCCCc1ccccc1)NCc2ccccc2 273464a_100015324214_100000211184 [0,0,0,0,0,1|2,0,1]=4 3439 B21R2.257631 O=C(NCCCc1ccccc1)NCc2ccccc2 512a_100000211184_100015324214 [0,0,0,0,0,1|2,0,1]=4 3440 B21R2.257631 O=C(NCCCc1ccccc1)NCc2ccccc2 512a_100015324214_100000211184 [0,0,0,0,0,1|2,0,1]=4 3441 B21R2.257631 O=C(NCCCc1ccccc1)NNc2ccccc2 273464a_100000211184_100015195140 [0,0,0,0,0,1|3,0,0]=4 3442 B21R2.257631 O=C(NCCCc1ccccc1)NNc2ccccc2 512a_100000211184_100015195140 [0,0,0,0,0,1|3,0,0]=4 3443 B21R2.257631 O=C(NCCOc1ccccc1)NCc2ccccc2 2708a_100000174943_100015324214 [0,0,0,0,0,1|2,0,1]=4 3444 B21R2.257631 O=C(NCCOc1ccccc1)NCc2ccccc2 2708a_100015324214_100000174943 [0,0,0,0,0,1|2,0,1]=4 3445 B21R2.257631 O=C(NCCOc1ccccc1)NCc2ccccc2 273464a_100000174943_100015324214 [0,0,0,0,0,1|2,0,1]=4 3446 B21R2.257631 O=C(NCCOc1ccccc1)NCc2ccccc2 273464a_100015324214_100000174943 [0,0,0,0,0,1|2,0,1]=4 3447 B21R2.257631 O=C(NCCOc1ccccc1)NCc2ccccc2 512a_100000174943_100015324214 [0,0,0,0,0,1|2,0,1]=4 3448 B21R2.257631 O=C(NCCOc1ccccc1)NCc2ccccc2 512a_100015324214_100000174943 [0,0,0,0,0,1|2,0,1]=4 3449 B21R2.257631 O=C(NCCOc1ccccc1)NNc2ccccc2 273464a_100000174943_100015195140 [0,0,0,0,0,1|3,0,0]=4 3450 B21R2.257631 O=C(NCCOc1ccccc1)NNc2ccccc2 512a_100000174943_100015195140 [0,0,0,0,0,1|3,0,0]=4 3451 B21R2.257631 O=C(NCCOc1ccccc1)OCc2ccccc2 7a_100000210340_100012357035 [0,0,0,0,0,1|2,0,1]=4 3452 B21R2.257631 O=C(NCCSc1ccccc1)NCc2ccccc2 2708a_100000189519_100015324214 [0,0,0,0,0,1|2,0,1]=4 3453 B21R2.257631 O=C(NCCSc1ccccc1)NCc2ccccc2 2708a_100015324214_100000189519 [0,0,0,0,0,1|2,0,1]=4 3454 B21R2.257631 O=C(NCCSc1ccccc1)NCc2ccccc2 273464a_100000189519_100015324214 [0,0,0,0,0,1|2,0,1]=4 3455 B21R2.257631 O=C(NCCSc1ccccc1)NCc2ccccc2 273464a_100015324214_100000189519 [0,0,0,0,0,1|2,0,1]=4 3456 B21R2.257631 O=C(NCCSc1ccccc1)NCc2ccccc2 512a_100000189519_100015324214 [0,0,0,0,0,1|2,0,1]=4 3457 B21R2.257631 O=C(NCCSc1ccccc1)NCc2ccccc2 512a_100015324214_100000189519 [0,0,0,0,0,1|2,0,1]=4 3458 B21R2.257631 O=C(NCCSc1ccccc1)NNc2ccccc2 273464a_100000189519_100015195140 [0,0,0,0,0,1|3,0,0]=4 3459 B21R2.257631 O=C(NCCSc1ccccc1)NNc2ccccc2 512a_100000189519_100015195140 [0,0,0,0,0,1|3,0,0]=4 3460 B21R2.257631 O=C(NCCSc1ccccc1)OCc2ccccc2 62a_100000719477_100012357035 [0,0,0,0,0,1|2,0,1]=4 3461 B21R2.257631 O=C(NCCSc1ccccc1)OCc2ccccc2 62a_100012357035_100000041952 [0,0,0,0,0,1|2,0,1]=4 3462 B21R2.257631 O=C(NCc1ccccc1)NNCCc2ccccc2 273464a_100015324214_100000740470 [0,0,0,0,0,1|2,0,1]=4 3463 B21R2.257631 O=C(NCc1ccccc1)NNCCc2ccccc2 512a_100000740470_100015324214 [0,0,0,0,0,1|2,0,1]=4 3464 B21R2.257631 O=C(NCc1ccccc1)NNCCc2ccccc2 512a_100015324214_100000740470 [0,0,0,0,0,1|2,0,1]=4 3465 B21R2.257631 O=C(NNCCc1ccccc1)NNc2ccccc2 512a_100000740470_100015195140 [0,0,0,0,0,1|3,0,0]=4 3466 B21R2.257676 CN(C/C=C/c1ccccc1)CCCc2ccccc2 2230a_100000693637_100016265936 [0,0,0,0,0,1|3,0,0]=4 3467 B21R2.257676 CN(C/C=C/c1ccccc1)CCCc2ccccc2 269982a_100000693637_100016265936 [0,0,0,0,0,1|3,0,0]=4 3468 B21R2.257676 CN(CC=Cc1ccccc1)CCCc2ccccc2 270004a_100000693637_100000210105 [0,0,0,0,0,1|3,0,0]=4 3469 B21R2.257676 O=C(C/C=C/c1ccccc1)C/C=C/c2ccccc2 1458a_100011219626_100016265936 [0,0,0,0,0,1|1,0,2]=4 3470 B21R2.257676 O=C(C/C=C/c1ccccc1)CCCc2ccccc2 1458a_100011207963_100016265936 [0,0,0,0,0,1|1,0,0]=2 3471 B21R2.257676 O=C(C/C=C/c1ccccc1)CCCc2ccccc2 1458a_100011219626_100000211621 [0,0,0,0,0,1|1,0,0]=2 3472 B21R2.257676 O=C(C/C=C/c1ccccc1)CCCc2ccccn2 1458a_100000752327_100016265936 [0,0,0,0,0,1|2,0,0]=3 3473 B21R2.257676 O=C(C/C=C/c1ccccc1)CCCc2ccncc2 1458a_100020654287_100016265936 [0,0,0,0,0,1|2,0,0]=3 3474 B21R2.257676 O=C(C/C=C/c1ccccc1)CCOc2ccccc2 1458a_100000182761_100016265936 [0,0,0,0,0,1|2,0,0]=3 3475 B21R2.257676 O=C(C/C=C/c1ccccc1)CCOc2ccccc2 1458a_100011219626_100000184471 [0,0,0,0,0,1|2,0,0]=3 3476 B21R2.257676 O=C(C/C=C/c1ccccc1)CCSc2ccccc2 1458a_100000182436_100016265936 [0,0,0,0,0,1|2,0,0]=3 3477 B21R2.257676 O=C(C/C=C/c1ccccc1)CCSc2ccccc2 1458a_100011219626_100000246102 [0,0,0,0,0,1|2,0,0]=3 3478 B21R2.257676 O=C(C/C=C/c1ccccc1)COCc2ccccc2 1458a_100000230186_100016265936 [0,0,0,0,0,1|2,0,0]=3 3479 B21R2.257676 O=C(C/C=C/c1ccccc1)CSCc2ccccc2 1458a_100000150264_100016265936 [0,0,0,0,0,1|2,0,0]=3 3480 B21R2.257676 O=C(C/C=C/c1ccccc1)CSCc2ccccc2 1458a_100011219626_200011217039 [0,0,0,0,0,1|2,0,0]=3 3481 B21R2.257676 O=C(C/C=C/c1ccccc1)CSCc2ccccn2 1458a_100000742634_100016265936 [0,0,0,0,0,1|3,0,0]=4 3482 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccc2 11a_100000106460_100011219626 [0,0,0,0,0,1|1,0,0]=2 3483 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccc2 1626a_100000106460_100011219626 [0,0,0,0,0,1|1,0,0]=2 3484 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccc2 240690a_100000106460_100011219626 [0,0,0,0,0,1|1,0,0]=2 3485 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccn2 11a_100000211156_100011219626 [0,0,0,0,0,1|2,0,0]=3 3486 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccn2 1626a_100000211156_100011219626 [0,0,0,0,0,1|2,0,0]=3 3487 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccccn2 240690a_100000211156_100011219626 [0,0,0,0,0,1|2,0,0]=3 3488 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cccnc2 11a_100000736294_100011219626 [0,0,0,0,0,1|2,0,0]=3 3489 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cccnc2 1626a_100000736294_100011219626 [0,0,0,0,0,1|2,0,0]=3 3490 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cccnc2 240690a_100000736294_100011219626 [0,0,0,0,0,1|2,0,0]=3 3491 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccncc2 11a_100000742849_100011219626 [0,0,0,0,0,1|2,0,0]=3 3492 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccncc2 1626a_100000742849_100011219626 [0,0,0,0,0,1|2,0,0]=3 3493 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2ccncc2 240690a_100000742849_100011219626 [0,0,0,0,0,1|2,0,0]=3 3494 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cnccn2 11a_100000723456_100011219626 [0,0,0,0,0,1|3,0,0]=4 3495 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cnccn2 1626a_100000723456_100011219626 [0,0,0,0,0,1|3,0,0]=4 3496 B21R2.257676 O=C(C/C=C/c1ccccc1)NCCc2cnccn2 240690a_100000723456_100011219626 [0,0,0,0,0,1|3,0,0]=4 3497 B21R2.257676 O=C(C/C=C/c1ccccc1)NNCc2ccccc2 22a_100000007032_100011219626 [0,0,0,0,0,1|2,0,0]=3 3498 B21R2.257676 O=C(C/C=C/c1ccccc1)NNCc2ccccn2 22a_100000736832_100011219626 [0,0,0,0,0,1|3,0,0]=4 3499 B21R2.257676 O=C(C/C=C/c1ccccc1)NNCc2cccnc2 22a_100000738295_100011219626 [0,0,0,0,0,1|3,0,0]=4 3500 B21R2.257676 O=C(C/C=C/c1ccccc1)NNCc2ccncc2 22a_100000736929_100011219626 [0,0,0,0,0,1|3,0,0]=4 3501 B21R2.257676 O=C(C=CSc1ccccc1)C/C=C/c2ccccc2 1458a_100016262050_100016265936 [0,0,0,0,0,1|1,0,2]=4 3502 B21R2.257676 O=C(C=CSc1ccccc1)CC#Cc2ccccc2 1458a_100016262050_100011352542 [0,0,0,0,0,1|1,0,2]=4 3503 B21R2.257676 O=C(C=CSc1ccccc1)CCCc2ccccc2 1458a_100016262050_100000211621 [0,0,0,0,0,1|1,0,0]=2 3504 B21R2.257676 O=C(C=CSc1ccccc1)CCOc2ccccc2 1458a_100016262050_100000184471 [0,0,0,0,0,1|2,0,0]=3 3505 B21R2.257676 O=C(C=CSc1ccccc1)CCSc2ccccc2 1458a_100016262050_100000246102 [0,0,0,0,0,1|2,0,0]=3 3506 B21R2.257676 O=C(C=CSc1ccccc1)CSCc2ccccc2 1458a_100016262050_200011217039 [0,0,0,0,0,1|2,0,0]=3 3507 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccc2 11a_100000106460_100016262050 [0,0,0,0,0,1|1,0,0]=2 3508 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccc2 1626a_100000106460_100016262050 [0,0,0,0,0,1|1,0,0]=2 3509 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccc2 240690a_100000106460_100016262050 [0,0,0,0,0,1|1,0,0]=2 3510 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccn2 11a_100000211156_100016262050 [0,0,0,0,0,1|2,0,0]=3 3511 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccn2 1626a_100000211156_100016262050 [0,0,0,0,0,1|2,0,0]=3 3512 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccccn2 240690a_100000211156_100016262050 [0,0,0,0,0,1|2,0,0]=3 3513 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cccnc2 11a_100000736294_100016262050 [0,0,0,0,0,1|2,0,0]=3 3514 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cccnc2 1626a_100000736294_100016262050 [0,0,0,0,0,1|2,0,0]=3 3515 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cccnc2 240690a_100000736294_100016262050 [0,0,0,0,0,1|2,0,0]=3 3516 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccncc2 11a_100000742849_100016262050 [0,0,0,0,0,1|2,0,0]=3 3517 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccncc2 1626a_100000742849_100016262050 [0,0,0,0,0,1|2,0,0]=3 3518 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2ccncc2 240690a_100000742849_100016262050 [0,0,0,0,0,1|2,0,0]=3 3519 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cnccn2 11a_100000723456_100016262050 [0,0,0,0,0,1|3,0,0]=4 3520 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cnccn2 1626a_100000723456_100016262050 [0,0,0,0,0,1|3,0,0]=4 3521 B21R2.257676 O=C(C=CSc1ccccc1)NCCc2cnccn2 240690a_100000723456_100016262050 [0,0,0,0,0,1|3,0,0]=4 3522 B21R2.257676 O=C(C=CSc1ccccc1)NNCc2ccccc2 22a_100000007032_100016262050 [0,0,0,0,0,1|2,0,0]=3 3523 B21R2.257676 O=C(C=CSc1ccccc1)NNCc2ccccn2 22a_100000736832_100016262050 [0,0,0,0,0,1|3,0,0]=4 3524 B21R2.257676 O=C(C=CSc1ccccc1)NNCc2cccnc2 22a_100000738295_100016262050 [0,0,0,0,0,1|3,0,0]=4 3525 B21R2.257676 O=C(C=CSc1ccccc1)NNCc2ccncc2 22a_100000736929_100016262050 [0,0,0,0,0,1|3,0,0]=4 3526 B21R2.257676 O=C(CC#Cc1ccccc1)C/C=C/c2ccccc2 1458a_100011219626_100011352542 [0,0,0,0,0,1|1,0,2]=4 3527 B21R2.257676 O=C(CC#Cc1ccccc1)CCCc2ccccc2 1458a_100011207963_100011352542 [0,0,0,0,0,1|1,0,2]=4 3528 B21R2.257676 O=C(CCCc1ccccc1)CCCc2ccccc2 1458a_100011207963_100000211621 [0,0,0,0,0,1|1,0,2]=4 3529 B21R2.257676 O=C(CCCc1ccccc1)CCOc2ccccc2 1458a_100000182761_100000211621 [0,0,0,0,0,1|1,0,2]=4 3530 B21R2.257676 O=C(CCCc1ccccc1)CCOc2ccccc2 1458a_100011207963_100000184471 [0,0,0,0,0,1|1,0,2]=4 3531 B21R2.257676 O=C(CCCc1ccccc1)CCSc2ccccc2 1458a_100000182436_100000211621 [0,0,0,0,0,1|1,0,2]=4 3532 B21R2.257676 O=C(CCCc1ccccc1)CCSc2ccccc2 1458a_100011207963_100000246102 [0,0,0,0,0,1|1,0,2]=4 3533 B21R2.257676 O=C(CCCc1ccccc1)COCc2ccccc2 1458a_100000230186_100000211621 [0,0,0,0,0,1|1,0,2]=4 3534 B21R2.257676 O=C(CCCc1ccccc1)CSCc2ccccc2 1458a_100000150264_100000211621 [0,0,0,0,0,1|1,0,2]=4 3535 B21R2.257676 O=C(CCCc1ccccc1)CSCc2ccccc2 1458a_100011207963_200011217039 [0,0,0,0,0,1|1,0,2]=4 3536 B21R2.257676 O=C(CCCc1ccccc1)NCCc2ccccc2 11a_100000106460_100011207963 [0,0,0,0,0,1|1,0,2]=4 3537 B21R2.257676 O=C(CCCc1ccccc1)NCCc2ccccc2 1626a_100000106460_100011207963 [0,0,0,0,0,1|1,0,2]=4 3538 B21R2.257676 O=C(CCCc1ccccc1)NCCc2ccccc2 240690a_100000106460_100011207963 [0,0,0,0,0,1|1,0,2]=4 3539 B21R2.257676 O=C(CCCc1ccccc1)NCCc2ccccc2 527a_100000106460_100011207963 [0,0,0,0,0,1|1,0,2]=4 3540 B21R2.257676 O=C(CCCc1ccccc1)NN=Cc2ccccc2 4a_100011246310_100015611070 [0,0,0,0,0,1|2,0,0]=3 3541 B21R2.257676 O=C(CCCc1ccccc1)NN=Cc2ccccn2 4a_100011246310_100000209966 [0,0,0,0,0,1|3,0,0]=4 3542 B21R2.257676 O=C(CCCc1ccccc1)NN=Cc2cccnc2 4a_100011246310_100000209961 [0,0,0,0,0,1|3,0,0]=4 3543 B21R2.257676 O=C(CCCc1ccccc1)NN=Cc2ccncc2 4a_100011246310_100000186114 [0,0,0,0,0,1|3,0,0]=4 3544 B21R2.257676 O=C(CCCc1ccccc1)NNCc2ccccc2 22a_100000007032_100011207963 [0,0,0,0,0,1|2,0,1]=4 3545 B21R2.257676 O=C(CCOc1ccccc1)NCCc2ccccc2 11a_100000106460_100000182761 [0,0,0,0,0,1|1,0,2]=4 3546 B21R2.257676 O=C(CCOc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000182761 [0,0,0,0,0,1|1,0,2]=4 3547 B21R2.257676 O=C(CCOc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000182761 [0,0,0,0,0,1|1,0,2]=4 3548 B21R2.257676 O=C(CCSc1ccccc1)NCCc2ccccc2 11a_100000106460_100000182436 [0,0,0,0,0,1|1,0,2]=4 3549 B21R2.257676 O=C(CCSc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000182436 [0,0,0,0,0,1|1,0,2]=4 3550 B21R2.257676 O=C(CCSc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000182436 [0,0,0,0,0,1|1,0,2]=4 3551 B21R2.257676 O=C(CNCc1ccccc1)NCCc2ccccc2 2230a_100000747479_100015291786 [0,0,0,0,0,1|1,0,2]=4 3552 B21R2.257676 O=C(CNCc1ccccc1)NCCc2ccccc2 2230a_100015324214_100000183012 [0,0,0,0,0,1|1,0,2]=4 3553 B21R2.257676 O=C(CNCc1ccccc1)NCCc2ccccc2 270004a_100000747479_100015611070 [0,0,0,0,0,1|1,0,2]=4 3554 B21R2.257676 O=C(CNCc1ccccc1)NCCc2ccccc2 34a_100000747479_100015291786 [0,0,0,0,0,1|1,0,2]=4 3555 B21R2.257676 O=C(CNCc1ccccc1)NCCc2ccccc2 34a_100015324214_100000183012 [0,0,0,0,0,1|1,0,2]=4 3556 B21R2.257676 O=C(CNCc1ccccc1)OCCc2ccccc2 2230a_100015324214_200000077782 [0,0,0,0,0,1|0,0,2]=3 3557 B21R2.257676 O=C(CNCc1ccccc1)OCCc2ccccc2 34a_100015324214_200000077782 [0,0,0,0,0,1|0,0,2]=3 3558 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 11a_100000106460_100000230186 [0,0,0,0,0,1|1,0,2]=4 3559 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000230186 [0,0,0,0,0,1|1,0,2]=4 3560 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000230186 [0,0,0,0,0,1|1,0,2]=4 3561 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 34a_100000210790_100000183012 [0,0,0,0,0,1|1,0,2]=4 3562 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 527a_100000106460_100000230186 [0,0,0,0,0,1|1,0,2]=4 3563 B21R2.257676 O=C(COCc1ccccc1)NCCc2ccccc2 7a_100000210790_100000183012 [0,0,0,0,0,1|1,0,2]=4 3564 B21R2.257676 O=C(COCc1ccccc1)OCCc2ccccc2 34a_100000210790_200000077782 [0,0,0,0,0,1|0,0,2]=3 3565 B21R2.257676 O=C(COCc1ccccc1)OCCc2ccccc2 7a_100000210790_200000077782 [0,0,0,0,0,1|0,0,2]=3 3566 B21R2.257676 O=C(CSCc1ccccc1)NCCc2ccccc2 11a_100000106460_100000150264 [0,0,0,0,0,1|1,0,2]=4 3567 B21R2.257676 O=C(CSCc1ccccc1)NCCc2ccccc2 1626a_100000106460_100000150264 [0,0,0,0,0,1|1,0,2]=4 3568 B21R2.257676 O=C(CSCc1ccccc1)NCCc2ccccc2 240690a_100000106460_100000150264 [0,0,0,0,0,1|1,0,2]=4 3569 B21R2.257676 O=C(CSCc1ccccc1)NCCc2ccccc2 527a_100000106460_100000150264 [0,0,0,0,0,1|1,0,2]=4 3570 B21R2.257676 O=C(CSCc1ccccc1)NCCc2ccccc2 62a_100000183012_100015291786 [0,0,0,0,0,1|1,0,2]=4 3571 B21R2.257676 O=C(CSCc1ccccc1)NCCc2ccccc2 62a_100000211182_100000183012 [0,0,0,0,0,1|1,0,2]=4 3572 B21R2.257676 O=C(CSCc1ccccc1)OCCc2ccccc2 62a_100000211182_200000077782 [0,0,0,0,0,1|0,0,2]=3 3573 B21R2.257676 O=C(CSCc1ccccc1)OCCc2ccccc2 62a_200000077782_100015291786 [0,0,0,0,0,1|0,0,2]=3 3574 B21R2.257676 O=C(CSCc1ccccn1)OCCc2ccccc2 62a_100000721315_200000077782 [0,0,0,0,0,1|1,0,2]=4 3575 B21R2.257676 O=C(CSCc1ccccn1)OCCc2ccccc2 62a_200000077782_100000721315 [0,0,0,0,0,1|1,0,2]=4 3576 B21R2.257676 O=C(CSCc1cccnc1)OCCc2ccccc2 62a_100000741622_200000077782 [0,0,0,0,0,1|1,0,2]=4 3577 B21R2.257676 O=C(CSCc1cccnc1)OCCc2ccccc2 62a_200000077782_100000741622 [0,0,0,0,0,1|1,0,2]=4 3578 B21R2.257676 O=C(CSCc1ccncc1)OCCc2ccccc2 62a_100015193705_200000077782 [0,0,0,0,0,1|1,0,2]=4 3579 B21R2.257676 O=C(CSCc1ccncc1)OCCc2ccccc2 62a_200000077782_100015193705 [0,0,0,0,0,1|1,0,2]=4 3580 B21R2.257676 O=C(NCCc1ccccc1)NCCc2ccccc2 2708a_100000106460_100000106460 [0,0,0,0,0,1|1,0,2]=4 3581 B21R2.257676 O=C(NCCc1ccccc1)NCCc2ccccc2 273464a_100000106460_100000106460 [0,0,0,0,0,1|1,0,2]=4 3582 B21R2.257676 O=C(NCCc1ccccc1)NCCc2ccccc2 512a_100000106460_100000106460 [0,0,0,0,0,1|1,0,2]=4 3583 B21R2.257676 O=C(NCCc1ccccc1)NNCc2ccccc2 273464a_100000106460_100000007032 [0,0,0,0,0,1|2,0,1]=4 3584 B21R2.257676 O=C(NCCc1ccccc1)NNCc2ccccc2 512a_100000106460_100000007032 [0,0,0,0,0,1|2,0,1]=4 3585 B20R2.4656 Brc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100011207229_100016265936 [1,1,0,0,0,0|1,0,1]=4 3586 B20R2.4656 Brc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100020603302_100011740638 [1,1,0,0,0,0|1,0,1]=4 3587 B20R2.4656 Brc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100011207229_100016265936 [1,1,0,0,0,0|1,0,1]=4 3588 B20R2.4656 Brc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100020603302_100011740638 [1,1,0,0,0,0|1,0,1]=4 3589 B20R2.4656 Brc1cccc(c1)CCNCC=Cc2ccccc2 270004a_100011207229_100000210105 [1,1,0,0,0,0|1,0,1]=4 3590 B20R2.4656 Brc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100000210256_100011740638 [1,1,0,0,0,0|0,0,1]=3 3591 B20R2.4656 Brc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100011217444_100016265936 [1,1,0,0,0,0|0,0,1]=3 3592 B20R2.4656 Brc1cccc(c1)CCOC/C=C/c2ccccc2 7a_100011217444_100016265936 [1,1,0,0,0,0|0,0,1]=3 3593 B20R2.4656 Brc1cccc(c1)CCOC/C=C/c2cccnc2 34a_200102594124_100011740638 [1,1,0,0,0,0|1,0,1]=4 3594 B20R2.4656 Brc1cccc(c1)CCSC/C=C/c2ccccc2 62a_100011740638_100016265936 [1,1,0,0,0,0|0,1,1]=4 3595 B20R2.4656 Brc1cccc(c1)CCSC/C=C/c2ccccc2 62a_100016265936_100011740638 [1,1,0,0,0,0|0,1,1]=4 3596 B20R2.4656 Brc1cccc(c1)CNN=CC=Cc2ccccc2 4a_100000686200_100000210105 [1,1,0,0,0,0|2,0,0]=4 3597 B20R2.4656 Brc1cccc(n1)CCOC/C=C/c2ccccc2 34a_100010221043_100016265936 [1,1,0,0,0,0|1,0,1]=4 3598 B20R2.4656 Brc1cccc(n1)CCOC/C=C/c2ccccc2 7a_100010221043_100016265936 [1,1,0,0,0,0|1,0,1]=4 3599 B20R2.4656 Cc1cccc(c1)C=CC=NNCc2ccccc2 4a_100000007032_100102525846 [1,1,0,0,0,0|2,0,0]=4 3600 B20R2.4656 Cc1cccc(c1)C=CCNCCc2ccccc2 270004a_100000106460_100102525846 [1,1,0,0,0,0|1,0,1]=4 3601 B20R2.4656 Cc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100000749837_100016265936 [1,1,0,0,0,0|1,0,1]=4 3602 B20R2.4656 Cc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100020603302_100011713685 [1,1,0,0,0,0|1,0,1]=4 3603 B20R2.4656 Cc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100000749837_100016265936 [1,1,0,0,0,0|1,0,1]=4 3604 B20R2.4656 Cc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100020603302_100011713685 [1,1,0,0,0,0|1,0,1]=4 3605 B20R2.4656 Cc1cccc(c1)CCNCC=Cc2ccccc2 270004a_100000749837_100000210105 [1,1,0,0,0,0|1,0,1]=4 3606 B20R2.4656 Cc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100000210256_100011713685 [1,1,0,0,0,0|0,0,1]=3 3607 B20R2.4656 Cc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100011217157_100016265936 [1,1,0,0,0,0|0,0,1]=3 3608 B20R2.4656 Cc1cccc(c1)CCOC/C=C/c2ccccc2 7a_100011217157_100016265936 [1,1,0,0,0,0|0,0,1]=3 3609 B20R2.4656 Cc1cccc(c1)CCOC/C=C/c2cccnc2 34a_200102594124_100011713685 [1,1,0,0,0,0|1,0,1]=4 3610 B20R2.4656 Cc1cccc(c1)CCSC/C=C/c2ccccc2 62a_100011713685_100016265936 [1,1,0,0,0,0|0,1,1]=4 3611 B20R2.4656 Cc1cccc(c1)CCSC/C=C/c2ccccc2 62a_100016265936_100011713685 [1,1,0,0,0,0|0,1,1]=4 3612 B20R2.4656 Clc1cccc(c1)C=CC=NNCc2ccccc2 4a_100000007032_100016268971 [1,1,0,0,0,0|2,0,0]=4 3613 B20R2.4656 Clc1cccc(c1)C=CCNCCc2ccccc2 270004a_100000106460_100016268971 [1,1,0,0,0,0|1,0,1]=4 3614 B20R2.4656 Clc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100000185263_100016265936 [1,1,0,0,0,0|1,0,1]=4 3615 B20R2.4656 Clc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100020603302_100011713710 [1,1,0,0,0,0|1,0,1]=4 3616 B20R2.4656 Clc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100000185263_100016265936 [1,1,0,0,0,0|1,0,1]=4 3617 B20R2.4656 Clc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100020603302_100011713710 [1,1,0,0,0,0|1,0,1]=4 3618 B20R2.4656 Clc1cccc(c1)CCNCC=Cc2ccccc2 270004a_100000185263_100000210105 [1,1,0,0,0,0|1,0,1]=4 3619 B20R2.4656 Clc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100000210256_100011713710 [1,1,0,0,0,0|0,0,1]=3 3620 B20R2.4656 Clc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100000754733_100016265936 [1,1,0,0,0,0|0,0,1]=3 3621 B20R2.4656 Clc1cccc(c1)CCOC/C=C/c2ccccc2 7a_100000754733_100016265936 [1,1,0,0,0,0|0,0,1]=3 3622 B20R2.4656 Clc1cccc(c1)CCOC/C=C/c2cccnc2 34a_200102594124_100011713710 [1,1,0,0,0,0|1,0,1]=4 3623 B20R2.4656 Clc1cccc(c1)CCSC/C=C/c2ccccc2 62a_100011713710_100016265936 [1,1,0,0,0,0|0,1,1]=4 3624 B20R2.4656 Clc1cccc(c1)CCSC/C=C/c2ccccc2 62a_100016265936_100011713710 [1,1,0,0,0,0|0,1,1]=4 3625 B20R2.4656 Clc1cccc(c1)CNN=CC=Cc2ccccc2 4a_100000685877_100000210105 [1,1,0,0,0,0|2,0,0]=4 3626 B20R2.4656 Fc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100000205154_100016265936 [1,1,0,0,0,0|1,0,1]=4 3627 B20R2.4656 Fc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100020603302_100011217235 [1,1,0,0,0,0|1,0,1]=4 3628 B20R2.4656 Fc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100000205154_100016265936 [1,1,0,0,0,0|1,0,1]=4 3629 B20R2.4656 Fc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100020603302_100011217235 [1,1,0,0,0,0|1,0,1]=4 3630 B20R2.4656 Fc1cccc(c1)CCNCC=Cc2ccccc2 270004a_100000205154_100000210105 [1,1,0,0,0,0|1,0,1]=4 3631 B20R2.4656 Fc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100000210256_100011217235 [1,1,0,0,0,0|0,0,1]=3 3632 B20R2.4656 Fc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100000763591_100016265936 [1,1,0,0,0,0|0,0,1]=3 3633 B20R2.4656 Fc1cccc(c1)CCOC/C=C/c2ccccc2 7a_100000763591_100016265936 [1,1,0,0,0,0|0,0,1]=3 3634 B20R2.4656 Fc1cccc(c1)CCOC/C=C/c2cccnc2 34a_200102594124_100011217235 [1,1,0,0,0,0|1,0,1]=4 3635 B20R2.4656 Fc1cccc(c1)CCSC/C=C/c2ccccc2 62a_100011217235_100016265936 [1,1,0,0,0,0|0,1,1]=4 3636 B20R2.4656 Fc1cccc(c1)CCSC/C=C/c2ccccc2 62a_100016265936_100011217235 [1,1,0,0,0,0|0,1,1]=4 3637 B20R2.4656 Fc1cccc(c1)CNN=CC=Cc2ccccc2 4a_100016993953_100000210105 [1,1,0,0,0,0|2,0,0]=4 3638 B20R2.4656 Nc1cccc(c1)CCOC/C=C/c2ccccc2 34a_100011996697_100016265936 [1,1,0,0,0,0|0,0,1]=3 3639 B20R2.4656 Oc1cccc(c1)CCNC/C=C/c2ccccc2 2230a_100000747277_100016265936 [1,1,0,0,0,0|1,0,1]=4 3640 B20R2.4656 Oc1cccc(c1)CCNC/C=C/c2ccccc2 34a_100000747277_100016265936 [1,1,0,0,0,0|1,0,1]=4 3641 B20R2.4783 Brc1ccccc1C=CC=NNCc2ccccc2 4a_100000007032_200016268969 [1,1,0,0,0,0|2,0,0]=4 3642 B20R2.4783 Brc1ccccc1C=CCNCCc2ccccc2 270004a_100000106460_200016268969 [1,1,0,0,0,0|1,0,1]=4 3643 B20R2.4783 Brc1ccccc1CCNC/C=C/c2ccccc2 2230a_100000747383_100016265936 [1,1,0,0,0,0|1,0,1]=4 3644 B20R2.4783 Brc1ccccc1CCNC/C=C/c2ccccc2 2230a_100020603302_100012161201 [1,1,0,0,0,0|1,0,1]=4 3645 B20R2.4783 Brc1ccccc1CCNC/C=C/c2ccccc2 34a_100000747383_100016265936 [1,1,0,0,0,0|1,0,1]=4 3646 B20R2.4783 Brc1ccccc1CCNC/C=C/c2ccccc2 34a_100020603302_100012161201 [1,1,0,0,0,0|1,0,1]=4 3647 B20R2.4783 Brc1ccccc1CCNCC=Cc2ccccc2 270004a_100000747383_100000210105 [1,1,0,0,0,0|1,0,1]=4 3648 B20R2.4783 Brc1ccccc1CCOC/C=C/c2ccccc2 34a_100000210256_100012161201 [1,1,0,0,0,0|0,0,1]=3 3649 B20R2.4783 Brc1ccccc1CCOC/C=C/c2ccccc2 34a_100000731337_100016265936 [1,1,0,0,0,0|0,0,1]=3 3650 B20R2.4783 Brc1ccccc1CCOC/C=C/c2ccccc2 7a_100000731337_100016265936 [1,1,0,0,0,0|0,0,1]=3 3651 B20R2.4783 Brc1ccccc1CCOC/C=C/c2cccnc2 34a_200102594124_100012161201 [1,1,0,0,0,0|1,0,1]=4 3652 B20R2.4783 Brc1ccccc1CCSC/C=C/c2ccccc2 62a_100012161201_100016265936 [1,1,0,0,0,0|0,1,1]=4 3653 B20R2.4783 Brc1ccccc1CCSC/C=C/c2ccccc2 62a_100016265936_100012161201 [1,1,0,0,0,0|0,1,1]=4 3654 B20R2.4783 Brc1ccccc1CNN=CC=Cc2ccccc2 4a_200016993956_100000210105 [1,1,0,0,0,0|2,0,0]=4 3655 B20R2.4783 Cc1ccccc1CCNC/C=C/c2ccccc2 2230a_100000685071_100016265936 [1,1,0,0,0,0|1,0,1]=4 3656 B20R2.4783 Cc1ccccc1CCNC/C=C/c2ccccc2 2230a_100020603302_100011713688 [1,1,0,0,0,0|1,0,1]=4 3657 B20R2.4783 Cc1ccccc1CCNC/C=C/c2ccccc2 34a_100000685071_100016265936 [1,1,0,0,0,0|1,0,1]=4 3658 B20R2.4783 Cc1ccccc1CCNC/C=C/c2ccccc2 34a_100020603302_100011713688 [1,1,0,0,0,0|1,0,1]=4 3659 B20R2.4783 Cc1ccccc1CCNCC=Cc2ccccc2 270004a_100000685071_100000210105 [1,1,0,0,0,0|1,0,1]=4 3660 B20R2.4783 Cc1ccccc1CCOC/C=C/c2ccccc2 34a_100000210256_100011713688 [1,1,0,0,0,0|0,0,1]=3 3661 B20R2.4783 Cc1ccccc1CCOC/C=C/c2ccccc2 34a_100011220023_100016265936 [1,1,0,0,0,0|0,0,1]=3 3662 B20R2.4783 Cc1ccccc1CCOC/C=C/c2ccccc2 7a_100011220023_100016265936 [1,1,0,0,0,0|0,0,1]=3 3663 B20R2.4783 Cc1ccccc1CCOC/C=C/c2cccnc2 34a_200102594124_100011713688 [1,1,0,0,0,0|1,0,1]=4 3664 B20R2.4783 Cc1ccccc1CCSC/C=C/c2ccccc2 62a_100011713688_100016265936 [1,1,0,0,0,0|0,1,1]=4 3665 B20R2.4783 Cc1ccccc1CCSC/C=C/c2ccccc2 62a_100016265936_100011713688 [1,1,0,0,0,0|0,1,1]=4 3666 B20R2.4783 Cc1ccccc1CNN=CC=Cc2ccccc2 4a_100000737298_100000210105 [1,1,0,0,0,0|2,0,0]=4 3667 B20R2.4783 Cc1cccnc1CCOC/C=C/c2ccccc2 34a_100011997706_100016265936 [1,1,0,0,0,0|1,0,1]=4 3668 B20R2.4783 Cc1cccnc1CCOC/C=C/c2ccccc2 7a_100011997706_100016265936 [1,1,0,0,0,0|1,0,1]=4 3669 B20R2.4783 Clc1ccccc1C=CC=NNCc2ccccc2 4a_100000007032_200102525841 [1,1,0,0,0,0|2,0,0]=4 3670 B20R2.4783 Clc1ccccc1C=CCNCCc2ccccc2 270004a_100000106460_200102525841 [1,1,0,0,0,0|1,0,1]=4 3671 B20R2.4783 Clc1ccccc1CCNC/C=C/c2ccccc2 2230a_100011207228_100016265936 [1,1,0,0,0,0|1,0,1]=4 3672 B20R2.4783 Clc1ccccc1CCNC/C=C/c2ccccc2 2230a_100020603302_100011713703 [1,1,0,0,0,0|1,0,1]=4 3673 B20R2.4783 Clc1ccccc1CCNC/C=C/c2ccccc2 270004a_100020603302_200011713468 [1,1,0,0,0,0|1,0,1]=4 3674 B20R2.4783 Clc1ccccc1CCNC/C=C/c2ccccc2 34a_100011207228_100016265936 [1,1,0,0,0,0|1,0,1]=4 3675 B20R2.4783 Clc1ccccc1CCNC/C=C/c2ccccc2 34a_100020603302_100011713703 [1,1,0,0,0,0|1,0,1]=4 3676 B20R2.4783 Clc1ccccc1CCNCC=Cc2ccccc2 270004a_100011207228_100000210105 [1,1,0,0,0,0|1,0,1]=4 3677 B20R2.4783 Clc1ccccc1CCOC/C=C/c2ccccc2 34a_100000210256_100011713703 [1,1,0,0,0,0|0,0,1]=3 3678 B20R2.4783 Clc1ccccc1CCOC/C=C/c2ccccc2 34a_100011215284_100016265936 [1,1,0,0,0,0|0,0,1]=3 3679 B20R2.4783 Clc1ccccc1CCOC/C=C/c2ccccc2 7a_100011215284_100016265936 [1,1,0,0,0,0|0,0,1]=3 3680 B20R2.4783 Clc1ccccc1CCOC/C=C/c2cccnc2 34a_200102594124_100011713703 [1,1,0,0,0,0|1,0,1]=4 3681 B20R2.4783 Clc1ccccc1CCSC/C=C/c2ccccc2 62a_100011713703_100016265936 [1,1,0,0,0,0|0,1,1]=4 3682 B20R2.4783 Clc1ccccc1CCSC/C=C/c2ccccc2 62a_100016265936_100011713703 [1,1,0,0,0,0|0,1,1]=4 3683 B20R2.4783 Clc1ccccc1CNN=CC=Cc2ccccc2 4a_100015187261_100000210105 [1,1,0,0,0,0|2,0,0]=4 3684 B20R2.4783 Fc1ccccc1C=CC=NNCc2ccccc2 4a_100000007032_200102525844 [1,1,0,0,0,0|2,0,0]=4 3685 B20R2.4783 Fc1ccccc1C=CCNCCc2ccccc2 270004a_100000106460_200102525844 [1,1,0,0,0,0|1,0,1]=4 3686 B20R2.4783 Fc1ccccc1CCNC/C=C/c2ccccc2 2230a_100000185272_100016265936 [1,1,0,0,0,0|1,0,1]=4 3687 B20R2.4783 Fc1ccccc1CCNC/C=C/c2ccccc2 2230a_100020603302_100011713696 [1,1,0,0,0,0|1,0,1]=4 3688 B20R2.4783 Fc1ccccc1CCNC/C=C/c2ccccc2 34a_100000185272_100016265936 [1,1,0,0,0,0|1,0,1]=4 3689 B20R2.4783 Fc1ccccc1CCNC/C=C/c2ccccc2 34a_100020603302_100000720011 [1,1,0,0,0,0|1,0,1]=4 3690 B20R2.4783 Fc1ccccc1CCNCC=Cc2ccccc2 270004a_100000185272_100000210105 [1,1,0,0,0,0|1,0,1]=4 3691 B20R2.4783 Fc1ccccc1CCOC/C=C/c2ccccc2 34a_100000210256_100000720011 [1,1,0,0,0,0|0,0,1]=3 3692 B20R2.4783 Fc1ccccc1CCOC/C=C/c2ccccc2 34a_100000753711_100016265936 [1,1,0,0,0,0|0,0,1]=3 3693 B20R2.4783 Fc1ccccc1CCOC/C=C/c2ccccc2 7a_100000753711_100016265936 [1,1,0,0,0,0|0,0,1]=3 3694 B20R2.4783 Fc1ccccc1CCOC/C=C/c2cccnc2 34a_200102594124_100000720011 [1,1,0,0,0,0|1,0,1]=4 3695 B20R2.4783 Fc1ccccc1CCSC/C=C/c2ccccc2 62a_100011713696_100016265936 [1,1,0,0,0,0|0,1,1]=4 3696 B20R2.4783 Fc1ccccc1CCSC/C=C/c2ccccc2 62a_100016265936_100011713696 [1,1,0,0,0,0|0,1,1]=4 3697 B20R2.4783 Fc1ccccc1CNN=CC=Cc2ccccc2 4a_100015200773_100000210105 [1,1,0,0,0,0|2,0,0]=4 3698 B20R2.4783 Ic1ccccc1CCOC/C=C/c2ccccc2 34a_100010255290_100016265936 [1,1,0,0,0,0|0,0,1]=3 3699 B20R2.4783 Ic1ccccc1CCOC/C=C/c2ccccc2 7a_100010255290_100016265936 [1,1,0,0,0,0|0,0,1]=3 3700 B20R2.4783 Nc1ccccc1CCOC/C=C/c2ccccc2 34a_100011215289_100016265936 [1,1,0,0,0,0|0,0,1]=3 3701 B20R2.4783 Oc1ccccc1CCNC/C=C/c2ccccc2 34a_100011207237_100016265936 [1,1,0,0,0,0|1,0,1]=4 3702 B20R2.4783 Oc1ccccc1CCNC/C=C/c2ccccc2 34a_100020603302_100000722297 [1,1,0,0,0,0|1,0,1]=4 3703 B20R2.4783 Oc1ccccc1CCNCC=Cc2ccccc2 270004a_100011207237_100000210105 [1,1,0,0,0,0|1,0,1]=4 3704 B20R2.4783 Oc1ccccc1CCOC/C=C/c2ccccc2 34a_100000210256_100000722297 [1,1,0,0,0,0|0,0,1]=3 3705 B20R2.4783 Oc1ccccc1CCOC/C=C/c2cccnc2 34a_200102594124_100000722297 [1,1,0,0,0,0|1,0,1]=4 3706 B20R2.4783 Oc1ccccc1CCSC/C=C/c2ccccc2 62a_100000722297_100016265936 [1,1,0,0,0,0|0,1,1]=4 3707 B20R2.4783 Oc1ccccc1CCSC/C=C/c2ccccc2 62a_100016265936_100000722297 [1,1,0,0,0,0|0,1,1]=4 3708 B20R2.10810 Br/C(=C\c1ccccc1)/C=NNCc2ccccc2 4a_100000007032_100016988036 [1,1,0,0,0,0|2,0,0]=4 3709 B20R2.10810 C/C(=C\c1ccccc1)/C=NNCc2ccccc2 4a_100000007032_100016997181 [1,1,0,0,0,0|2,0,0]=4 3710 B20R2.10810 C/C(=C\c1ccccc1)/COCCc2ccccc2 34a_200025717232_100000765856 [1,1,0,0,0,0|0,0,1]=3 3711 B20R2.10810 C/C(=C\c1ccccc1)/COCCc2ccccc2 7a_200025717232_100000765856 [1,1,0,0,0,0|0,0,1]=3 3712 B20R2.10810 C/C(=C\c1ccccc1)/COCCc2ccccn2 7a_200025717232_100015183660 [1,1,0,0,0,0|1,0,1]=4 3713 B20R2.10810 C/C(=C\c1ccccc1)/COCCc2cccnc2 7a_200025717232_200011713674 [1,1,0,0,0,0|1,0,1]=4 3714 B20R2.10810 C/C(=C\c1ccccc1)/COCCc2ccncc2 7a_200025717232_100000723409 [1,1,0,0,0,0|1,0,1]=4 3715 B20R2.10810 CC(Cc1ccccc1)NC/C=C/c2ccccc2 34a_100020603302_200011218536 [1,1,0,0,0,0|1,0,1]=4 3716 B20R2.10810 CC(Cc1ccccc1)OC/C=C/c2ccccc2 34a_100000210256_200011218536 [1,1,0,0,0,0|0,0,1]=3 3717 B20R2.10810 CC(Cc1ccccc1)OC/C=C/c2ccccc2 34a_100000748627_100016265936 [1,1,0,0,0,0|0,0,1]=3 3718 B20R2.10810 CC(Cc1ccccc1)OC/C=C/c2ccccc2 7a_100000748627_100016265936 [1,1,0,0,0,0|0,0,1]=3 3719 B20R2.10810 CC(Cc1ccccc1)OC/C=C/c2cccnc2 34a_200102594124_200011218536 [1,1,0,0,0,0|1,0,1]=4 3720 B20R2.10810 CC(Cc1ccccc1)SC/C=C/c2ccccc2 62a_100016265936_200011218536 [1,1,0,0,0,0|0,1,1]=4 3721 B20R2.10810 CC(Cc1ccccc1)SC/C=C/c2ccccc2 62a_200011218536_100016265936 [1,1,0,0,0,0|0,1,1]=4 3722 B20R2.10810 Cl/C(=C/c1ccccc1)/C=NNCc2ccccc2 4a_100000007032_200014065628 [1,1,0,0,0,0|2,0,0]=4 3723 B20R2.10810 O=C(C=C/C=C/c1ccccc1)Cc2ccccc2 1458a_100016289705_100015291786 [1,1,0,0,0,0|1,0,1]=4 3724 B20R2.10810 O=C(C=CCCc1ccccc1)Cc2ccccc2 1458a_100016484021_100015291786 [1,1,0,0,0,0|1,0,1]=4 3725 B20R2.10810 O=C(C=CCCc1ccccc1)Nc2ccccc2 11a_100000106764_100016484021 [1,1,0,0,0,0|2,0,0]=4 3726 B20R2.10810 O=C(C=CCCc1ccccc1)Nc2ccccc2 1626a_100000106764_100016484021 [1,1,0,0,0,0|2,0,0]=4 3727 B20R2.10810 O=C(C=CCCc1ccccc1)Nc2ccccc2 22a_100000106764_100016484021 [1,1,0,0,0,0|2,0,0]=4 3728 B20R2.10810 O=C(COCCc1ccccc1)Cc2ccccc2 7a_100000210268_100000233483 [1,1,0,0,0,0|0,0,2]=4 3729 B20R2.10810 O=C(COCCc1ccccc1)Nc2ccccc2 34a_100000210268_100000182850 [1,1,0,0,0,0|1,0,1]=4 3730 B20R2.10810 O=C(COCCc1ccccc1)Nc2ccccc2 34a_100000246334_100000765856 [1,1,0,0,0,0|1,0,1]=4 3731 B20R2.10810 O=C(COCCc1ccccc1)Nc2ccccc2 7a_100000210268_100000182850 [1,1,0,0,0,0|1,0,1]=4 3732 B20R2.10810 O=C(COCCc1ccccc1)Oc2ccccc2 34a_100000210268_100009813826 [1,1,0,0,0,0|1,0,1]=4 3733 B20R2.10810 O=C(COCCc1ccccc1)Oc2ccccc2 7a_100000210268_100009813826 [1,1,0,0,0,0|1,0,1]=4 3734 B20R2.10829 CC(=CC=NNCc1ccccc1)c2ccccc2 4a_100000007032_200043867958 [1,1,0,0,0,0|2,0,0]=4 3735 B20R2.10829 CC(CNC/C=C/c1ccccc1)c2ccccc2 2230a_100000701038_100016265936 [1,1,0,0,0,0|1,0,1]=4 3736 B20R2.10829 CC(CNC/C=C/c1ccccc1)c2ccccc2 2230a_100020603302_100000756946 [1,1,0,0,0,0|1,0,1]=4 3737 B20R2.10829 CC(CNC/C=C/c1ccccc1)c2ccccc2 270004a_100020603302_100000212034 [1,1,0,0,0,0|1,0,1]=4 3738 B20R2.10829 CC(CNC/C=C/c1ccccc1)c2ccccc2 34a_100000701038_100016265936 [1,1,0,0,0,0|1,0,1]=4 3739 B20R2.10829 CC(CNC/C=C/c1ccccc1)c2ccccc2 34a_100020603302_100000756946 [1,1,0,0,0,0|1,0,1]=4 3740 B20R2.10829 CC(CNCC=Cc1ccccc1)c2ccccc2 270004a_100000701038_100000210105 [1,1,0,0,0,0|1,0,1]=4 3741 B20R2.10829 CC(COC/C=C/c1ccccc1)c2ccccc2 34a_100000210256_100000756946 [1,1,0,0,0,0|0,0,1]=3 3742 B20R2.10829 CC(COC/C=C/c1ccccc1)c2ccccc2 34a_100011215166_100016265936 [1,1,0,0,0,0|0,0,1]=3 3743 B20R2.10829 CC(COC/C=C/c1ccccc1)c2ccccc2 7a_100011215166_100016265936 [1,1,0,0,0,0|0,0,1]=3 3744 B20R2.10829 CC(COC/C=C/c1cccnc1)c2ccccc2 34a_200102594124_100000756946 [1,1,0,0,0,0|1,0,1]=4 3745 B20R2.10829 CC(CSC/C=C/c1ccccc1)c2ccccc2 62a_100000756946_100016265936 [1,1,0,0,0,0|0,1,1]=4 3746 B20R2.10829 CC(CSC/C=C/c1ccccc1)c2ccccc2 62a_100016265936_100000756946 [1,1,0,0,0,0|0,1,1]=4 3747 B20R2.10829 N[C@H](COC/C=C/c1ccccc1)c2ccccc2 34a_100000751927_100016265936 [1,1,0,0,0,0|0,0,1]=3 3748 B20R2.10829 N[C@H](COC/C=C/c1ccccc1)c2ccncc2 34a_100138412524_100016265936 [1,1,0,0,0,0|1,0,1]=4 3749 B20R2.10829 O=C(CCOCCc1ccccc1)c2ccccc2 7a_100000210268_100000750707 [1,1,0,0,0,0|0,0,2]=4 3750 B20R2.10829 O=C(OCOCCc1ccccc1)c2ccccc2 7a_100000210268_100000073877 [1,1,0,0,0,0|1,0,1]=4 3751 B20R2.10829 OC(CNC/C=C/c1ccccc1)c2ccccc2 2230a_100000210709_100016265936 [1,1,0,0,0,0|1,0,1]=4 3752 B20R2.10829 OC(CNC/C=C/c1ccccc1)c2ccccc2 2230a_100020603302_100000185958 [1,1,0,0,0,0|1,0,1]=4 3753 B20R2.10829 OC(CNC/C=C/c1ccccc1)c2ccccc2 34a_100020603302_100000185958 [1,1,0,0,0,0|1,0,1]=4 3754 B20R2.10829 OC(CNCC=Cc1ccccc1)c2ccccc2 270004a_100000210709_100000210105 [1,1,0,0,0,0|1,0,1]=4 3755 B20R2.10829 OC(COC/C=C/c1ccccc1)c2ccccc2 34a_100000210256_100000185958 [1,1,0,0,0,0|0,0,1]=3 3756 B20R2.10829 OC(COC/C=C/c1cccnc1)c2ccccc2 34a_200102594124_100000185958 [1,1,0,0,0,0|1,0,1]=4 3757 B20R2.10829 OC(CSC/C=C/c1ccccc1)c2ccccc2 62a_100000185958_100016265936 [1,1,0,0,0,0|0,1,1]=4 3758 B20R2.10829 OC(CSC/C=C/c1ccccc1)c2ccccc2 62a_100016265936_100000185958 [1,1,0,0,0,0|0,1,1]=4 3759 B20R2.10829 O[C@H](CNC/C=C/c1ccccc1)c2ccccc2 2230a_100020603302_100011933945 [1,1,0,0,0,0|1,0,1]=4 3760 B20R2.10829 O[C@H](CNC/C=C/c1ccccc1)c2ccccc2 34a_100020603302_100011933945 [1,1,0,0,0,0|1,0,1]=4 3761 B20R2.10829 O[C@H](COC/C=C/c1ccccc1)c2ccccc2 34a_100000210256_100011933945 [1,1,0,0,0,0|0,0,1]=3 3762 B20R2.10829 O[C@H](COC/C=C/c1cccnc1)c2ccccc2 34a_200102594124_100011933945 [1,1,0,0,0,0|1,0,1]=4 3763 B20R2.10829 O[C@H](CSC/C=C/c1ccccc1)c2ccccc2 62a_100011933945_100016265936 [1,1,0,0,0,0|0,1,1]=4 3764 B20R2.10829 O[C@H](CSC/C=C/c1ccccc1)c2ccccc2 62a_100016265936_100011933945 [1,1,0,0,0,0|0,1,1]=4 3765 B20R2.15237 Brc1ccc(cc1)C=CC=NNCc2ccccc2 4a_100000007032_100016291818 [1,1,0,0,0,0|2,0,0]=4 3766 B20R2.15237 Brc1ccc(cc1)C=CCNCCc2ccccc2 270004a_100000106460_100016291818 [1,1,0,0,0,0|1,0,1]=4 3767 B20R2.15237 Brc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100000755846_100016265936 [1,1,0,0,0,0|1,0,1]=4 3768 B20R2.15237 Brc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100020603302_100011740612 [1,1,0,0,0,0|1,0,1]=4 3769 B20R2.15237 Brc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100000755846_100016265936 [1,1,0,0,0,0|1,0,1]=4 3770 B20R2.15237 Brc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100020603302_100011740612 [1,1,0,0,0,0|1,0,1]=4 3771 B20R2.15237 Brc1ccc(cc1)CCNCC=Cc2ccccc2 270004a_100000755846_100000210105 [1,1,0,0,0,0|1,0,1]=4 3772 B20R2.15237 Brc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100000210256_100011740612 [1,1,0,0,0,0|0,0,1]=3 3773 B20R2.15237 Brc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100000766406_100016265936 [1,1,0,0,0,0|0,0,1]=3 3774 B20R2.15237 Brc1ccc(cc1)CCOC/C=C/c2ccccc2 7a_100000766406_100016265936 [1,1,0,0,0,0|0,0,1]=3 3775 B20R2.15237 Brc1ccc(cc1)CCOC/C=C/c2cccnc2 34a_200102594124_100011740612 [1,1,0,0,0,0|1,0,1]=4 3776 B20R2.15237 Brc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100011740612_100016265936 [1,1,0,0,0,0|0,1,1]=4 3777 B20R2.15237 Brc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100016265936_100011740612 [1,1,0,0,0,0|0,1,1]=4 3778 B20R2.15237 Brc1ccc(cc1)CNN=CC=Cc2ccccc2 4a_100016993955_100000210105 [1,1,0,0,0,0|2,0,0]=4 3779 B20R2.15237 Brc1ccc(nc1)CCOC/C=C/c2ccccc2 34a_100012357577_100016265936 [1,1,0,0,0,0|1,0,1]=4 3780 B20R2.15237 Cc1ccc(cc1)C=CC=NNCc2ccccc2 4a_100000007032_100016257026 [1,1,0,0,0,0|2,0,0]=4 3781 B20R2.15237 Cc1ccc(cc1)C=CCNCCc2ccccc2 270004a_100000106460_100016257026 [1,1,0,0,0,0|1,0,1]=4 3782 B20R2.15237 Cc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100000705350_100016265936 [1,1,0,0,0,0|1,0,1]=4 3783 B20R2.15237 Cc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100020603302_100011713686 [1,1,0,0,0,0|1,0,1]=4 3784 B20R2.15237 Cc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100000705350_100016265936 [1,1,0,0,0,0|1,0,1]=4 3785 B20R2.15237 Cc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100020603302_100011713686 [1,1,0,0,0,0|1,0,1]=4 3786 B20R2.15237 Cc1ccc(cc1)CCNCC=Cc2ccccc2 270004a_100000705350_100000210105 [1,1,0,0,0,0|1,0,1]=4 3787 B20R2.15237 Cc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100000210256_100011713686 [1,1,0,0,0,0|0,0,1]=3 3788 B20R2.15237 Cc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100000756670_100016265936 [1,1,0,0,0,0|0,0,1]=3 3789 B20R2.15237 Cc1ccc(cc1)CCOC/C=C/c2ccccc2 7a_100000756670_100016265936 [1,1,0,0,0,0|0,0,1]=3 3790 B20R2.15237 Cc1ccc(cc1)CCOC/C=C/c2cccnc2 34a_200102594124_100011713686 [1,1,0,0,0,0|1,0,1]=4 3791 B20R2.15237 Cc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100011713686_100016265936 [1,1,0,0,0,0|0,1,1]=4 3792 B20R2.15237 Cc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100016265936_100011713686 [1,1,0,0,0,0|0,1,1]=4 3793 B20R2.15237 Cc1ccc(cc1)CNN=CC=Cc2ccccc2 4a_100011197965_100000210105 [1,1,0,0,0,0|2,0,0]=4 3794 B20R2.15237 Cc1ccc(cn1)CCOC/C=C/c2ccccc2 34a_100011815783_100016265936 [1,1,0,0,0,0|1,0,1]=4 3795 B20R2.15237 Clc1ccc(cc1)C=CC=NNCc2ccccc2 4a_100000007032_100102525842 [1,1,0,0,0,0|2,0,0]=4 3796 B20R2.15237 Clc1ccc(cc1)C=CCNCCc2ccccc2 270004a_100000106460_100102525842 [1,1,0,0,0,0|1,0,1]=4 3797 B20R2.15237 Clc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100000185265_100016265936 [1,1,0,0,0,0|1,0,1]=4 3798 B20R2.15237 Clc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100020603302_100011713675 [1,1,0,0,0,0|1,0,1]=4 3799 B20R2.15237 Clc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100000185265_100016265936 [1,1,0,0,0,0|1,0,1]=4 3800 B20R2.15237 Clc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100020603302_100011713675 [1,1,0,0,0,0|1,0,1]=4 3801 B20R2.15237 Clc1ccc(cc1)CCNCC=Cc2ccccc2 270004a_100000185265_100000210105 [1,1,0,0,0,0|1,0,1]=4 3802 B20R2.15237 Clc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100000210256_100011713675 [1,1,0,0,0,0|0,0,1]=3 3803 B20R2.15237 Clc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100011219627_100016265936 [1,1,0,0,0,0|0,0,1]=3 3804 B20R2.15237 Clc1ccc(cc1)CCOC/C=C/c2ccccc2 7a_100011219627_100016265936 [1,1,0,0,0,0|0,0,1]=3 3805 B20R2.15237 Clc1ccc(cc1)CCOC/C=C/c2cccnc2 34a_200102594124_100011713675 [1,1,0,0,0,0|1,0,1]=4 3806 B20R2.15237 Clc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100011713675_100016265936 [1,1,0,0,0,0|0,1,1]=4 3807 B20R2.15237 Clc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100016265936_100011713675 [1,1,0,0,0,0|0,1,1]=4 3808 B20R2.15237 Clc1ccc(cc1)CNN=CC=Cc2ccccc2 4a_100000689899_100000210105 [1,1,0,0,0,0|2,0,0]=4 3809 B20R2.15237 Clc1ccc(cn1)CCOC/C=C/c2ccccc2 34a_100009880866_100016265936 [1,1,0,0,0,0|1,0,1]=4 3810 B20R2.15237 Clc1ccc(cn1)CCOC/C=C/c2ccccc2 7a_100009880866_100016265936 [1,1,0,0,0,0|1,0,1]=4 3811 B20R2.15237 Fc1ccc(cc1)C=CC=NNCc2ccccc2 4a_100000007032_100016272083 [1,1,0,0,0,0|2,0,0]=4 3812 B20R2.15237 Fc1ccc(cc1)C=CCNCCc2ccccc2 270004a_100000106460_100016272083 [1,1,0,0,0,0|1,0,1]=4 3813 B20R2.15237 Fc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100000199005_100016265936 [1,1,0,0,0,0|1,0,1]=4 3814 B20R2.15237 Fc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100020603302_100011217392 [1,1,0,0,0,0|1,0,1]=4 3815 B20R2.15237 Fc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100000199005_100016265936 [1,1,0,0,0,0|1,0,1]=4 3816 B20R2.15237 Fc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100020603302_100011217392 [1,1,0,0,0,0|1,0,1]=4 3817 B20R2.15237 Fc1ccc(cc1)CCNCC=Cc2ccccc2 270004a_100000199005_100000210105 [1,1,0,0,0,0|1,0,1]=4 3818 B20R2.15237 Fc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100000210256_100011217392 [1,1,0,0,0,0|0,0,1]=3 3819 B20R2.15237 Fc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100000754732_100016265936 [1,1,0,0,0,0|0,0,1]=3 3820 B20R2.15237 Fc1ccc(cc1)CCOC/C=C/c2ccccc2 7a_100000754732_100016265936 [1,1,0,0,0,0|0,0,1]=3 3821 B20R2.15237 Fc1ccc(cc1)CCOC/C=C/c2cccnc2 34a_200102594124_100011217392 [1,1,0,0,0,0|1,0,1]=4 3822 B20R2.15237 Fc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100011217392_100016265936 [1,1,0,0,0,0|0,1,1]=4 3823 B20R2.15237 Fc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100016265936_100011217392 [1,1,0,0,0,0|0,1,1]=4 3824 B20R2.15237 Fc1ccc(cc1)CNN=CC=Cc2ccccc2 4a_100000689900_100000210105 [1,1,0,0,0,0|2,0,0]=4 3825 B20R2.15237 Ic1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100012291149_100016265936 [1,1,0,0,0,0|0,0,1]=3 3826 B20R2.15237 Ic1ccc(cc1)CCOC/C=C/c2ccccc2 7a_100012291149_100016265936 [1,1,0,0,0,0|0,0,1]=3 3827 B20R2.15237 Ic1ccc(cc1)CNN=CC=Cc2ccccc2 4a_102495363730_100000210105 [1,1,0,0,0,0|2,0,0]=4 3828 B20R2.15237 Nc1ccc(cc1)CCOC/C=C/c2ccccc2 34a_100011204434_100016265936 [1,1,0,0,0,0|0,0,1]=3 3829 B20R2.15237 Oc1ccc(cc1)C=CC=NNCc2ccccc2 4a_100000007032_200011996185 [1,1,0,0,0,0|2,0,0]=4 3830 B20R2.15237 Oc1ccc(cc1)CCNC/C=C/c2ccccc2 2230a_100020603302_100009816426 [1,1,0,0,0,0|1,0,1]=4 3831 B20R2.15237 Oc1ccc(cc1)CCNC/C=C/c2ccccc2 34a_100000743037_100016265936 [1,1,0,0,0,0|1,0,1]=4 3832 B20R2.15237 Oc1ccc(cc1)CCNCC=Cc2ccccc2 270004a_100000743037_100000210105 [1,1,0,0,0,0|1,0,1]=4 3833 B20R2.15237 Oc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100009816426_100016265936 [1,1,0,0,0,0|0,1,1]=4 3834 B20R2.15237 Oc1ccc(cc1)CCSC/C=C/c2ccccc2 62a_100016265936_100009816426 [1,1,0,0,0,0|0,1,1]=4 3835 B20R2.4652 Cc1cccc(c1)CCNC(=O)Nc2ccccc2 2430a_100000106764_100000749837 [0,1,0,0,1,0|2,0,0]=4 3836 B20R2.4652 O=C(CCCc1cccc(c1)Br)Cc2ccccc2 1458a_100000685939_100015291786 [0,1,0,0,1,0|1,0,1]=4 3837 B20R2.4652 O=C(CCCc1cccc(c1)Br)Nc2ccccc2 11a_100000106764_100000685939 [0,1,0,0,1,0|2,0,0]=4 3838 B20R2.4652 O=C(CCCc1cccc(c1)Br)Nc2ccccc2 1626a_100000106764_100000685939 [0,1,0,0,1,0|2,0,0]=4 3839 B20R2.4652 O=C(CCCc1cccc(c1)Br)Nc2ccccc2 22a_100000106764_100000685939 [0,1,0,0,1,0|2,0,0]=4 3840 B20R2.4652 O=C(CCCc1cccc(c1)Br)Nc2ccccc2 527a_100000106764_100000685939 [0,1,0,0,1,0|2,0,0]=4 3841 B20R2.4652 O=C(NCCc1cccc(c1)Br)Nc2ccccc2 2430a_100000106764_100011207229 [0,1,0,0,1,0|2,0,0]=4 3842 B20R2.4652 O=C(NCCc1cccc(c1)Cl)Nc2ccccc2 2430a_100000106764_100000185263 [0,1,0,0,1,0|2,0,0]=4 3843 B20R2.4652 O=C(NCCc1cccc(c1)F)Nc2ccccc2 2430a_100000106764_100000205154 [0,1,0,0,1,0|2,0,0]=4 3844 B20R2.4652 O=C(NCCc1cccc(c1)O)Nc2ccccc2 2430a_100000106764_100000747277 [0,1,0,0,1,0|2,0,0]=4 3845 B20R2.4780 Cc1ccccc1CCNC(=O)Nc2ccccc2 2430a_100000106764_100000685071 [0,1,0,0,1,0|2,0,0]=4 3846 B20R2.4780 O=C(CCCc1ccccc1Cl)Cc2ccccc2 1458a_100000700343_100015291786 [0,1,0,0,1,0|1,0,1]=4 3847 B20R2.4780 O=C(CCCc1ccccc1Cl)Nc2ccccc2 11a_100000106764_100000700343 [0,1,0,0,1,0|2,0,0]=4 3848 B20R2.4780 O=C(CCCc1ccccc1Cl)Nc2ccccc2 1626a_100000106764_100000700343 [0,1,0,0,1,0|2,0,0]=4 3849 B20R2.4780 O=C(CCCc1ccccc1Cl)Nc2ccccc2 22a_100000106764_100000700343 [0,1,0,0,1,0|2,0,0]=4 3850 B20R2.4780 O=C(CCCc1ccccc1Cl)Nc2ccccc2 527a_100000106764_100000700343 [0,1,0,0,1,0|2,0,0]=4 3851 B20R2.4780 O=C(CCCc1ccccc1O)Cc2ccccc2 1458a_100009859317_100015291786 [0,1,0,0,1,0|1,0,1]=4 3852 B20R2.4780 O=C(CCCc1ccccc1O)Nc2ccccc2 22a_100000106764_100009859317 [0,1,0,0,1,0|2,0,0]=4 3853 B20R2.4780 O=C(CCCc1ccccc1O)Nc2ccccc2 527a_100000106764_100009859317 [0,1,0,0,1,0|2,0,0]=4 3854 B20R2.4780 O=C(NCCc1ccccc1Br)Nc2ccccc2 2430a_100000106764_100000747383 [0,1,0,0,1,0|2,0,0]=4 3855 B20R2.4780 O=C(NCCc1ccccc1Cl)Nc2ccccc2 2430a_100000106764_100011207228 [0,1,0,0,1,0|2,0,0]=4 3856 B20R2.4780 O=C(NCCc1ccccc1F)Nc2ccccc2 2430a_100000106764_100000185272 [0,1,0,0,1,0|2,0,0]=4 3857 B20R2.4780 O=C(NCCc1ccccc1O)Nc2ccccc2 2430a_100000106764_100011207237 [0,1,0,0,1,0|2,0,0]=4 3858 B20R2.8696 Cc1ccccc1CC(=O)CCCc2ccccc2 1458a_100000212180_100000211621 [0,1,0,0,1,0|1,0,1]=4 3859 B20R2.8696 Cc1ccccc1CC(=O)CCCc2ccccc2 1458a_100011207963_100000211839 [0,1,0,0,1,0|1,0,1]=4 3860 B20R2.8696 Cc1ccccc1CC(=O)NCCc2ccccc2 11a_100000106460_100000212180 [0,1,0,0,1,0|1,0,1]=4 3861 B20R2.8696 Cc1ccccc1CC(=O)NCCc2ccccc2 1626a_100000106460_100000212180 [0,1,0,0,1,0|1,0,1]=4 3862 B20R2.8696 Cc1ccccc1CC(=O)NCCc2ccccc2 240690a_100000106460_100000212180 [0,1,0,0,1,0|1,0,1]=4 3863 B20R2.8696 Cc1ccccc1CC(=O)NCCc2ccccc2 527a_100000106460_100000212180 [0,1,0,0,1,0|1,0,1]=4 3864 B20R2.8696 Cc1ccccc1NC(=O)CCCc2ccccc2 11a_100015192222_100011207963 [0,1,0,0,1,0|2,0,0]=4 3865 B20R2.8696 Cc1ccccc1NC(=O)CCCc2ccccc2 1626a_100015192222_100011207963 [0,1,0,0,1,0|2,0,0]=4 3866 B20R2.8696 Cc1ccccc1NC(=O)CCCc2ccccc2 22a_100015192222_100011207963 [0,1,0,0,1,0|2,0,0]=4 3867 B20R2.8696 Cc1ccccc1NC(=O)CCCc2ccccc2 527a_100015192222_100011207963 [0,1,0,0,1,0|2,0,0]=4 3868 B20R2.8696 Cc1ccccc1NC(=O)NCCc2ccccc2 2430a_100015192222_100000106460 [0,1,0,0,1,0|2,0,0]=4 3869 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2Br 1458a_100000751119_100000211621 [0,1,0,0,1,0|1,0,1]=4 3870 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2Br 1458a_100011207963_100000184730 [0,1,0,0,1,0|1,0,1]=4 3871 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2Cl 1458a_100000183793_100000211621 [0,1,0,0,1,0|1,0,1]=4 3872 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2Cl 1458a_100011207963_100000187162 [0,1,0,0,1,0|1,0,1]=4 3873 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2F 1458a_100000212012_100000211621 [0,1,0,0,1,0|1,0,1]=4 3874 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2F 1458a_100011207963_100000187165 [0,1,0,0,1,0|1,0,1]=4 3875 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2I 1458a_100000036491_100000211621 [0,1,0,0,1,0|1,0,1]=4 3876 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2I 1458a_100011207963_100011216222 [0,1,0,0,1,0|1,0,1]=4 3877 B20R2.8696 O=C(CCCc1ccccc1)Cc2ccccc2O 1458a_100000743006_100000211621 [0,1,0,0,1,0|1,0,1]=4 3878 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2Br 11a_100000210017_100011207963 [0,1,0,0,1,0|2,0,0]=4 3879 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2Br 1626a_100000210017_100011207963 [0,1,0,0,1,0|2,0,0]=4 3880 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2Cl 11a_100000185783_100011207963 [0,1,0,0,1,0|2,0,0]=4 3881 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2Cl 1626a_100000185783_100011207963 [0,1,0,0,1,0|2,0,0]=4 3882 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2Cl 22a_100000185783_100011207963 [0,1,0,0,1,0|2,0,0]=4 3883 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2Cl 527a_100000185783_100011207963 [0,1,0,0,1,0|2,0,0]=4 3884 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2F 11a_100000210422_100011207963 [0,1,0,0,1,0|2,0,0]=4 3885 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2F 1626a_100000210422_100011207963 [0,1,0,0,1,0|2,0,0]=4 3886 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2F 22a_100000210422_100011207963 [0,1,0,0,1,0|2,0,0]=4 3887 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2F 527a_100000210422_100011207963 [0,1,0,0,1,0|2,0,0]=4 3888 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2I 11a_100000210053_100011207963 [0,1,0,0,1,0|2,0,0]=4 3889 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2I 1626a_100000210053_100011207963 [0,1,0,0,1,0|2,0,0]=4 3890 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2O 22a_100000185747_100011207963 [0,1,0,0,1,0|2,0,0]=4 3891 B20R2.8696 O=C(CCCc1ccccc1)Nc2ccccc2O 527a_100000185747_100011207963 [0,1,0,0,1,0|2,0,0]=4 3892 B20R2.8696 O=C(Cc1ccccc1Br)NCCc2ccccc2 11a_100000106460_100000751119 [0,1,0,0,1,0|1,0,1]=4 3893 B20R2.8696 O=C(Cc1ccccc1Br)NCCc2ccccc2 240690a_100000106460_100000751119 [0,1,0,0,1,0|1,0,1]=4 3894 B20R2.8696 O=C(Cc1ccccc1Br)NCCc2ccccc2 527a_100000106460_100000751119 [0,1,0,0,1,0|1,0,1]=4 3895 B20R2.8696 O=C(Cc1ccccc1Cl)NCCc2ccccc2 11a_100000106460_100000183793 [0,1,0,0,1,0|1,0,1]=4 3896 B20R2.8696 O=C(Cc1ccccc1Cl)NCCc2ccccc2 1626a_100000106460_100000183793 [0,1,0,0,1,0|1,0,1]=4 3897 B20R2.8696 O=C(Cc1ccccc1Cl)NCCc2ccccc2 240690a_100000106460_100000183793 [0,1,0,0,1,0|1,0,1]=4 3898 B20R2.8696 O=C(Cc1ccccc1Cl)NCCc2ccccc2 527a_100000106460_100000183793 [0,1,0,0,1,0|1,0,1]=4 3899 B20R2.8696 O=C(Cc1ccccc1F)NCCc2ccccc2 11a_100000106460_100000212012 [0,1,0,0,1,0|1,0,1]=4 3900 B20R2.8696 O=C(Cc1ccccc1F)NCCc2ccccc2 1626a_100000106460_100000212012 [0,1,0,0,1,0|1,0,1]=4 3901 B20R2.8696 O=C(Cc1ccccc1F)NCCc2ccccc2 240690a_100000106460_100000212012 [0,1,0,0,1,0|1,0,1]=4 3902 B20R2.8696 O=C(Cc1ccccc1F)NCCc2ccccc2 527a_100000106460_100000212012 [0,1,0,0,1,0|1,0,1]=4 3903 B20R2.8696 O=C(Cc1ccccc1I)NCCc2ccccc2 11a_100000106460_100000036491 [0,1,0,0,1,0|1,0,1]=4 3904 B20R2.8696 O=C(Cc1ccccc1I)NCCc2ccccc2 1626a_100000106460_100000036491 [0,1,0,0,1,0|1,0,1]=4 3905 B20R2.8696 O=C(Cc1ccccc1I)NCCc2ccccc2 240690a_100000106460_100000036491 [0,1,0,0,1,0|1,0,1]=4 3906 B20R2.8696 O=C(Cc1ccccc1I)NCCc2ccccc2 527a_100000106460_100000036491 [0,1,0,0,1,0|1,0,1]=4 3907 B20R2.8696 O=C(Cc1ccccc1O)NCCc2ccccc2 240690a_100000106460_100000743006 [0,1,0,0,1,0|1,0,1]=4 3908 B20R2.8696 O=C(Cc1ccccc1O)NCCc2ccccc2 527a_100000106460_100000743006 [0,1,0,0,1,0|1,0,1]=4 3909 B20R2.8696 O=C(NCCc1ccccc1)Nc2ccccc2Br 2430a_100000210017_100000106460 [0,1,0,0,1,0|2,0,0]=4 3910 B20R2.8696 O=C(NCCc1ccccc1)Nc2ccccc2Cl 2430a_100000185783_100000106460 [0,1,0,0,1,0|2,0,0]=4 3911 B20R2.8696 O=C(NCCc1ccccc1)Nc2ccccc2F 2430a_100000210422_100000106460 [0,1,0,0,1,0|2,0,0]=4 3912 B20R2.8696 O=C(NCCc1ccccc1)Nc2ccccc2I 2430a_100000210053_100000106460 [0,1,0,0,1,0|2,0,0]=4 3913 B20R2.8696 O=C(NCCc1ccccc1)Nc2ccccc2O 2430a_100000185747_100000106460 [0,1,0,0,1,0|2,0,0]=4 3914 B20R2.10809 CC(CNC(=O)Nc1ccccc1)c2ccccc2 2430a_100000106764_100000701038 [0,1,0,0,1,0|2,0,0]=4 3915 B20R2.10809 O=C(NCC(O)c1ccccc1)Nc2ccccc2 2430a_100000106764_100000210709 [0,1,0,0,1,0|2,0,0]=4 3916 B20R2.15229 Cc1ccc(cc1)CCCC(=O)Cc2ccccc2 1458a_100000741418_100015291786 [0,1,0,0,1,0|1,0,1]=4 3917 B20R2.15229 Cc1ccc(cc1)CCCC(=O)Nc2ccccc2 11a_100000106764_100000741418 [0,1,0,0,1,0|2,0,0]=4 3918 B20R2.15229 Cc1ccc(cc1)CCCC(=O)Nc2ccccc2 1626a_100000106764_100000741418 [0,1,0,0,1,0|2,0,0]=4 3919 B20R2.15229 Cc1ccc(cc1)CCCC(=O)Nc2ccccc2 22a_100000106764_100000741418 [0,1,0,0,1,0|2,0,0]=4 3920 B20R2.15229 Cc1ccc(cc1)CCCC(=O)Nc2ccccc2 527a_100000106764_100000741418 [0,1,0,0,1,0|2,0,0]=4 3921 B20R2.15229 Cc1ccc(cc1)CCNC(=O)Nc2ccccc2 2430a_100000106764_100000705350 [0,1,0,0,1,0|2,0,0]=4 3922 B20R2.15229 O=C(CCCc1ccc(cc1)Br)Cc2ccccc2 1458a_100011236545_100015291786 [0,1,0,0,1,0|1,0,1]=4 3923 B20R2.15229 O=C(CCCc1ccc(cc1)Br)Nc2ccccc2 11a_100000106764_100011236545 [0,1,0,0,1,0|2,0,0]=4 3924 B20R2.15229 O=C(CCCc1ccc(cc1)Br)Nc2ccccc2 1626a_100000106764_100011236545 [0,1,0,0,1,0|2,0,0]=4 3925 B20R2.15229 O=C(CCCc1ccc(cc1)Br)Nc2ccccc2 22a_100000106764_100011236545 [0,1,0,0,1,0|2,0,0]=4 3926 B20R2.15229 O=C(CCCc1ccc(cc1)Br)Nc2ccccc2 527a_100000106764_100011236545 [0,1,0,0,1,0|2,0,0]=4 3927 B20R2.15229 O=C(CCCc1ccc(cc1)Cl)Cc2ccccc2 1458a_100000741339_100015291786 [0,1,0,0,1,0|1,0,1]=4 3928 B20R2.15229 O=C(CCCc1ccc(cc1)Cl)Nc2ccccc2 11a_100000106764_100000741339 [0,1,0,0,1,0|2,0,0]=4 3929 B20R2.15229 O=C(CCCc1ccc(cc1)Cl)Nc2ccccc2 1626a_100000106764_100000741339 [0,1,0,0,1,0|2,0,0]=4 3930 B20R2.15229 O=C(CCCc1ccc(cc1)Cl)Nc2ccccc2 22a_100000106764_100000741339 [0,1,0,0,1,0|2,0,0]=4 3931 B20R2.15229 O=C(CCCc1ccc(cc1)Cl)Nc2ccccc2 527a_100000106764_100000741339 [0,1,0,0,1,0|2,0,0]=4 3932 B20R2.15229 O=C(CCCc1ccc(cc1)F)Cc2ccccc2 1458a_100011219804_100015291786 [0,1,0,0,1,0|1,0,1]=4 3933 B20R2.15229 O=C(CCCc1ccc(cc1)F)Nc2ccccc2 11a_100000106764_100011219804 [0,1,0,0,1,0|2,0,0]=4 3934 B20R2.15229 O=C(CCCc1ccc(cc1)F)Nc2ccccc2 1626a_100000106764_100011219804 [0,1,0,0,1,0|2,0,0]=4 3935 B20R2.15229 O=C(CCCc1ccc(cc1)F)Nc2ccccc2 22a_100000106764_100011219804 [0,1,0,0,1,0|2,0,0]=4 3936 B20R2.15229 O=C(CCCc1ccc(cc1)F)Nc2ccccc2 527a_100000106764_100011219804 [0,1,0,0,1,0|2,0,0]=4 3937 B20R2.15229 O=C(CCCc1ccc(cc1)I)Cc2ccccc2 1458a_100011236544_100015291786 [0,1,0,0,1,0|1,0,1]=4 3938 B20R2.15229 O=C(CCCc1ccc(cc1)I)Nc2ccccc2 11a_100000106764_100011236544 [0,1,0,0,1,0|2,0,0]=4 3939 B20R2.15229 O=C(CCCc1ccc(cc1)I)Nc2ccccc2 1626a_100000106764_100011236544 [0,1,0,0,1,0|2,0,0]=4 3940 B20R2.15229 O=C(CCCc1ccc(cc1)I)Nc2ccccc2 22a_100000106764_100011236544 [0,1,0,0,1,0|2,0,0]=4 3941 B20R2.15229 O=C(CCCc1ccc(cc1)I)Nc2ccccc2 527a_100000106764_100011236544 [0,1,0,0,1,0|2,0,0]=4 3942 B20R2.15229 O=C(CCCc1ccc(cc1)O)Cc2ccccc2 1458a_100000116853_100015291786 [0,1,0,0,1,0|1,0,1]=4 3943 B20R2.15229 O=C(CCCc1ccc(cc1)O)Nc2ccccc2 22a_100000106764_100000116853 [0,1,0,0,1,0|2,0,0]=4 3944 B20R2.15229 O=C(CCCc1ccc(cc1)O)Nc2ccccc2 527a_100000106764_100000116853 [0,1,0,0,1,0|2,0,0]=4 3945 B20R2.15229 O=C(NCCc1ccc(cc1)Br)Nc2ccccc2 2430a_100000106764_100000755846 [0,1,0,0,1,0|2,0,0]=4 3946 B20R2.15229 O=C(NCCc1ccc(cc1)Cl)Nc2ccccc2 2430a_100000106764_100000185265 [0,1,0,0,1,0|2,0,0]=4 3947 B20R2.15229 O=C(NCCc1ccc(cc1)F)Nc2ccccc2 2430a_100000106764_100000199005 [0,1,0,0,1,0|2,0,0]=4 3948 B20R2.15229 O=C(NCCc1ccc(cc1)O)Nc2ccccc2 2430a_100000106764_100000743037 [0,1,0,0,1,0|2,0,0]=4 3949 B20R2.15829 Cc1ccc(cc1)CC(=O)CCCc2ccccc2 1458a_100000212244_100000211621 [0,1,0,0,1,0|1,0,1]=4 3950 B20R2.15829 Cc1ccc(cc1)CC(=O)CCCc2ccccc2 1458a_100011207963_100000210814 [0,1,0,0,1,0|1,0,1]=4 3951 B20R2.15829 Cc1ccc(cc1)CC(=O)NCCc2ccccc2 11a_100000106460_100000212244 [0,1,0,0,1,0|1,0,1]=4 3952 B20R2.15829 Cc1ccc(cc1)CC(=O)NCCc2ccccc2 240690a_100000106460_100000212244 [0,1,0,0,1,0|1,0,1]=4 3953 B20R2.15829 Cc1ccc(cc1)CC(=O)NCCc2ccccc2 527a_100000106460_100000212244 [0,1,0,0,1,0|1,0,1]=4 3954 B20R2.15829 Cc1ccc(cc1)NC(=O)CCCc2ccccc2 11a_100000124888_100011207963 [0,1,0,0,1,0|2,0,0]=4 3955 B20R2.15829 Cc1ccc(cc1)NC(=O)CCCc2ccccc2 1626a_100000124888_100011207963 [0,1,0,0,1,0|2,0,0]=4 3956 B20R2.15829 Cc1ccc(cc1)NC(=O)CCCc2ccccc2 22a_100000124888_100011207963 [0,1,0,0,1,0|2,0,0]=4 3957 B20R2.15829 Cc1ccc(cc1)NC(=O)CCCc2ccccc2 527a_100000124888_100011207963 [0,1,0,0,1,0|2,0,0]=4 3958 B20R2.15829 Cc1ccc(cc1)NC(=O)NCCc2ccccc2 2430a_100000124888_100000106460 [0,1,0,0,1,0|2,0,0]=4 3959 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)Br 1458a_100000198978_100000211621 [0,1,0,0,1,0|1,0,1]=4 3960 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)Br 1458a_100011207963_100000189115 [0,1,0,0,1,0|1,0,1]=4 3961 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)Cl 1458a_100000211027_100000211621 [0,1,0,0,1,0|1,0,1]=4 3962 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)Cl 1458a_100011207963_100000694040 [0,1,0,0,1,0|1,0,1]=4 3963 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)F 1458a_100000210951_100000211621 [0,1,0,0,1,0|1,0,1]=4 3964 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)F 1458a_100011207963_100000198546 [0,1,0,0,1,0|1,0,1]=4 3965 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)I 1458a_100000688869_100000211621 [0,1,0,0,1,0|1,0,1]=4 3966 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)I 1458a_100011207963_100000189116 [0,1,0,0,1,0|1,0,1]=4 3967 B20R2.15829 O=C(CCCc1ccccc1)Cc2ccc(cc2)O 1458a_100000198540_100000211621 [0,1,0,0,1,0|1,0,1]=4 3968 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)Br 11a_100000210018_100011207963 [0,1,0,0,1,0|2,0,0]=4 3969 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)Br 1626a_100000210018_100011207963 [0,1,0,0,1,0|2,0,0]=4 3970 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)Br 22a_100000210018_100011207963 [0,1,0,0,1,0|2,0,0]=4 3971 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)Br 527a_100000210018_100011207963 [0,1,0,0,1,0|2,0,0]=4 3972 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)Cl 11a_100000210052_100011207963 [0,1,0,0,1,0|2,0,0]=4 3973 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)Cl 1626a_100000210052_100011207963 [0,1,0,0,1,0|2,0,0]=4 3974 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)Cl 22a_100000210052_100011207963 [0,1,0,0,1,0|2,0,0]=4 3975 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)Cl 527a_100000210052_100011207963 [0,1,0,0,1,0|2,0,0]=4 3976 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)F 11a_100000185862_100011207963 [0,1,0,0,1,0|2,0,0]=4 3977 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)F 1626a_100000185862_100011207963 [0,1,0,0,1,0|2,0,0]=4 3978 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)F 22a_100000185862_100011207963 [0,1,0,0,1,0|2,0,0]=4 3979 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)F 527a_100000185862_100011207963 [0,1,0,0,1,0|2,0,0]=4 3980 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)I 11a_100000185761_100011207963 [0,1,0,0,1,0|2,0,0]=4 3981 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)I 1626a_100000185761_100011207963 [0,1,0,0,1,0|2,0,0]=4 3982 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)I 22a_100000185761_100011207963 [0,1,0,0,1,0|2,0,0]=4 3983 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)I 527a_100000185761_100011207963 [0,1,0,0,1,0|2,0,0]=4 3984 B20R2.15829 O=C(CCCc1ccccc1)Nc2ccc(cc2)O 22a_100000185829_100011207963 [0,1,0,0,1,0|2,0,0]=4 3985 B20R2.15829 O=C(Cc1ccc(cc1)Br)NCCc2ccccc2 11a_100000106460_100000198978 [0,1,0,0,1,0|1,0,1]=4 3986 B20R2.15829 O=C(Cc1ccc(cc1)Br)NCCc2ccccc2 240690a_100000106460_100000198978 [0,1,0,0,1,0|1,0,1]=4 3987 B20R2.15829 O=C(Cc1ccc(cc1)Br)NCCc2ccccc2 527a_100000106460_100000198978 [0,1,0,0,1,0|1,0,1]=4 3988 B20R2.15829 O=C(Cc1ccc(cc1)Cl)NCCc2ccccc2 11a_100000106460_100000211027 [0,1,0,0,1,0|1,0,1]=4 3989 B20R2.15829 O=C(Cc1ccc(cc1)Cl)NCCc2ccccc2 240690a_100000106460_100000211027 [0,1,0,0,1,0|1,0,1]=4 3990 B20R2.15829 O=C(Cc1ccc(cc1)Cl)NCCc2ccccc2 527a_100000106460_100000211027 [0,1,0,0,1,0|1,0,1]=4 3991 B20R2.15829 O=C(Cc1ccc(cc1)F)NCCc2ccccc2 11a_100000106460_100000210951 [0,1,0,0,1,0|1,0,1]=4 3992 B20R2.15829 O=C(Cc1ccc(cc1)F)NCCc2ccccc2 1626a_100000106460_100000210951 [0,1,0,0,1,0|1,0,1]=4 3993 B20R2.15829 O=C(Cc1ccc(cc1)F)NCCc2ccccc2 240690a_100000106460_100000210951 [0,1,0,0,1,0|1,0,1]=4 3994 B20R2.15829 O=C(Cc1ccc(cc1)F)NCCc2ccccc2 527a_100000106460_100000210951 [0,1,0,0,1,0|1,0,1]=4 3995 B20R2.15829 O=C(Cc1ccc(cc1)I)NCCc2ccccc2 11a_100000106460_100000688869 [0,1,0,0,1,0|1,0,1]=4 3996 B20R2.15829 O=C(Cc1ccc(cc1)I)NCCc2ccccc2 1626a_100000106460_100000688869 [0,1,0,0,1,0|1,0,1]=4 3997 B20R2.15829 O=C(Cc1ccc(cc1)I)NCCc2ccccc2 240690a_100000106460_100000688869 [0,1,0,0,1,0|1,0,1]=4 3998 B20R2.15829 O=C(Cc1ccc(cc1)I)NCCc2ccccc2 527a_100000106460_100000688869 [0,1,0,0,1,0|1,0,1]=4 3999 B20R2.15829 O=C(Cc1ccc(cc1)O)NCCc2ccccc2 1626a_100000106460_100000198540 [0,1,0,0,1,0|1,0,1]=4 4000 B20R2.15829 O=C(Cc1ccc(cc1)O)NCCc2ccccc2 240690a_100000106460_100000198540 [0,1,0,0,1,0|1,0,1]=4 4001 B20R2.15829 O=C(Cc1ccc(cc1)O)NCCc2ccccc2 527a_100000106460_100000198540 [0,1,0,0,1,0|1,0,1]=4 4002 B20R2.15829 O=C(NCCc1ccccc1)Nc2ccc(cc2)Br 2430a_100000210018_100000106460 [0,1,0,0,1,0|2,0,0]=4 4003 B20R2.15829 O=C(NCCc1ccccc1)Nc2ccc(cc2)Cl 2430a_100000210052_100000106460 [0,1,0,0,1,0|2,0,0]=4 4004 B20R2.15829 O=C(NCCc1ccccc1)Nc2ccc(cc2)F 2430a_100000185862_100000106460 [0,1,0,0,1,0|2,0,0]=4 4005 B20R2.15829 O=C(NCCc1ccccc1)Nc2ccc(cc2)I 2430a_100000185761_100000106460 [0,1,0,0,1,0|2,0,0]=4 4006 B20R2.15829 O=C(NCCc1ccccc1)Nc2ccc(cc2)O 2430a_100000185829_100000106460 [0,1,0,0,1,0|2,0,0]=4 4007 B20R2.21590 C/C(=C\c1ccccc1)/C(=O)CCc2ccccc2 1458a_100016990649_100000765856 [0,1,0,0,1,0|2,0,0]=4 4008 B20R2.21590 CC(CCc1ccccc1)C(=O)Cc2ccccc2 1458a_100011435293_100015291786 [0,1,0,0,1,0|1,0,1]=4 4009 B20R2.21590 CC(CCc1ccccc1)C(=O)Nc2ccccc2 11a_100000106764_100011435293 [0,1,0,0,1,0|2,0,0]=4 4010 B20R2.21590 CC(CCc1ccccc1)C(=O)Nc2ccccc2 1626a_100000106764_100011435293 [0,1,0,0,1,0|2,0,0]=4 4011 B20R2.21590 CC(CCc1ccccc1)C(=O)Nc2ccccc2 22a_100000106764_100011435293 [0,1,0,0,1,0|2,0,0]=4 4012 B20R2.21590 CC(CCc1ccccc1)C(=O)Nc2ccccc2 527a_100000106764_100011435293 [0,1,0,0,1,0|2,0,0]=4 4013 B20R2.21590 CN(CCc1ccccc1)C(=O)Nc2ccccc2 2430a_100000106764_100000207497 [0,1,0,0,1,0|2,0,0]=4 4014 B20R2.21590 O=C(CCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000765856 [0,1,0,0,1,0|2,0,0]=4 4015 B20R2.21590 O=C(CCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000765856 [0,1,0,0,1,0|2,0,0]=4 4016 B20R2.21590 O=C(CCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000765856 [0,1,0,0,1,0|2,0,0]=4 4017 B20R2.21590 O=C(Cc1ccccc1)C(O)CCc2ccccc2 1458a_100000242596_100015291786 [0,1,0,0,1,0|1,0,1]=4 4018 B20R2.21590 O=C(Nc1ccccc1)C(O)CCc2ccccc2 22a_100000106764_100000242596 [0,1,0,0,1,0|2,0,0]=4 4019 B20R2.153664 Cc1cccc(c1)CC(=O)CCCc2ccccc2 1458a_100011206899_100000211621 [0,1,0,0,1,0|1,0,1]=4 4020 B20R2.153664 Cc1cccc(c1)CC(=O)CCCc2ccccc2 1458a_100011207963_100000211840 [0,1,0,0,1,0|1,0,1]=4 4021 B20R2.153664 Cc1cccc(c1)CC(=O)NCCc2ccccc2 11a_100000106460_100011206899 [0,1,0,0,1,0|1,0,1]=4 4022 B20R2.153664 Cc1cccc(c1)CC(=O)NCCc2ccccc2 1626a_100000106460_100011206899 [0,1,0,0,1,0|1,0,1]=4 4023 B20R2.153664 Cc1cccc(c1)CC(=O)NCCc2ccccc2 240690a_100000106460_100011206899 [0,1,0,0,1,0|1,0,1]=4 4024 B20R2.153664 Cc1cccc(c1)CC(=O)NCCc2ccccc2 527a_100000106460_100011206899 [0,1,0,0,1,0|1,0,1]=4 4025 B20R2.153664 Cc1cccc(c1)NC(=O)CCCc2ccccc2 11a_100000188690_100011207963 [0,1,0,0,1,0|2,0,0]=4 4026 B20R2.153664 Cc1cccc(c1)NC(=O)CCCc2ccccc2 1626a_100000188690_100011207963 [0,1,0,0,1,0|2,0,0]=4 4027 B20R2.153664 Cc1cccc(c1)NC(=O)CCCc2ccccc2 22a_100000188690_100011207963 [0,1,0,0,1,0|2,0,0]=4 4028 B20R2.153664 Cc1cccc(c1)NC(=O)CCCc2ccccc2 527a_100000188690_100011207963 [0,1,0,0,1,0|2,0,0]=4 4029 B20R2.153664 Cc1cccc(c1)NC(=O)NCCc2ccccc2 2430a_100000188690_100000106460 [0,1,0,0,1,0|2,0,0]=4 4030 B20R2.153664 Cc1cccc(c1)NC(=O)NCCc2ccccc2 512a_100000188690_100000106460 [0,1,0,0,1,0|2,0,0]=4 4031 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)Br 1458a_100000747190_100000211621 [0,1,0,0,1,0|1,0,1]=4 4032 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)Br 1458a_100011207963_100000211773 [0,1,0,0,1,0|1,0,1]=4 4033 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)Cl 1458a_100000749307_100000211621 [0,1,0,0,1,0|1,0,1]=4 4034 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)Cl 1458a_100011207963_100000181238 [0,1,0,0,1,0|1,0,1]=4 4035 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)F 1458a_100000211661_100000211621 [0,1,0,0,1,0|1,0,1]=4 4036 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)F 1458a_100011207963_100000230114 [0,1,0,0,1,0|1,0,1]=4 4037 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)I 1458a_100000238430_100000211621 [0,1,0,0,1,0|1,0,1]=4 4038 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)I 1458a_100011207963_100011218688 [0,1,0,0,1,0|1,0,1]=4 4039 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)O 1458a_100000745134_100000211621 [0,1,0,0,1,0|1,0,1]=4 4040 B20R2.153664 O=C(CCCc1ccccc1)Cc2cccc(c2)O 1458a_100011207963_100011660834 [0,1,0,0,1,0|1,0,1]=4 4041 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)Br 11a_100000210019_100011207963 [0,1,0,0,1,0|2,0,0]=4 4042 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)Br 1626a_100000210019_100011207963 [0,1,0,0,1,0|2,0,0]=4 4043 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)Br 22a_100000210019_100011207963 [0,1,0,0,1,0|2,0,0]=4 4044 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)Br 527a_100000210019_100011207963 [0,1,0,0,1,0|2,0,0]=4 4045 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)Cl 11a_100000185859_100011207963 [0,1,0,0,1,0|2,0,0]=4 4046 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)Cl 1626a_100000185859_100011207963 [0,1,0,0,1,0|2,0,0]=4 4047 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)Cl 22a_100000185859_100011207963 [0,1,0,0,1,0|2,0,0]=4 4048 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)F 11a_100000210047_100011207963 [0,1,0,0,1,0|2,0,0]=4 4049 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)F 1626a_100000210047_100011207963 [0,1,0,0,1,0|2,0,0]=4 4050 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)F 22a_100000210047_100011207963 [0,1,0,0,1,0|2,0,0]=4 4051 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)F 527a_100000210047_100011207963 [0,1,0,0,1,0|2,0,0]=4 4052 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)I 11a_100000211102_100011207963 [0,1,0,0,1,0|2,0,0]=4 4053 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)I 1626a_100000211102_100011207963 [0,1,0,0,1,0|2,0,0]=4 4054 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)I 22a_100000211102_100011207963 [0,1,0,0,1,0|2,0,0]=4 4055 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)I 527a_100000211102_100011207963 [0,1,0,0,1,0|2,0,0]=4 4056 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)O 1626a_100000210217_100011207963 [0,1,0,0,1,0|2,0,0]=4 4057 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)O 22a_100000210217_100011207963 [0,1,0,0,1,0|2,0,0]=4 4058 B20R2.153664 O=C(CCCc1ccccc1)Nc2cccc(c2)O 527a_100000210217_100011207963 [0,1,0,0,1,0|2,0,0]=4 4059 B20R2.153664 O=C(Cc1cccc(c1)Br)NCCc2ccccc2 11a_100000106460_100000747190 [0,1,0,0,1,0|1,0,1]=4 4060 B20R2.153664 O=C(Cc1cccc(c1)Br)NCCc2ccccc2 240690a_100000106460_100000747190 [0,1,0,0,1,0|1,0,1]=4 4061 B20R2.153664 O=C(Cc1cccc(c1)Br)NCCc2ccccc2 527a_100000106460_100000747190 [0,1,0,0,1,0|1,0,1]=4 4062 B20R2.153664 O=C(Cc1cccc(c1)Cl)NCCc2ccccc2 11a_100000106460_100000749307 [0,1,0,0,1,0|1,0,1]=4 4063 B20R2.153664 O=C(Cc1cccc(c1)Cl)NCCc2ccccc2 1626a_100000106460_100000749307 [0,1,0,0,1,0|1,0,1]=4 4064 B20R2.153664 O=C(Cc1cccc(c1)Cl)NCCc2ccccc2 240690a_100000106460_100000749307 [0,1,0,0,1,0|1,0,1]=4 4065 B20R2.153664 O=C(Cc1cccc(c1)Cl)NCCc2ccccc2 527a_100000106460_100000749307 [0,1,0,0,1,0|1,0,1]=4 4066 B20R2.153664 O=C(Cc1cccc(c1)F)NCCc2ccccc2 11a_100000106460_100000211661 [0,1,0,0,1,0|1,0,1]=4 4067 B20R2.153664 O=C(Cc1cccc(c1)F)NCCc2ccccc2 1626a_100000106460_100000211661 [0,1,0,0,1,0|1,0,1]=4 4068 B20R2.153664 O=C(Cc1cccc(c1)F)NCCc2ccccc2 240690a_100000106460_100000211661 [0,1,0,0,1,0|1,0,1]=4 4069 B20R2.153664 O=C(Cc1cccc(c1)F)NCCc2ccccc2 527a_100000106460_100000211661 [0,1,0,0,1,0|1,0,1]=4 4070 B20R2.153664 O=C(Cc1cccc(c1)I)NCCc2ccccc2 11a_100000106460_100000238430 [0,1,0,0,1,0|1,0,1]=4 4071 B20R2.153664 O=C(Cc1cccc(c1)I)NCCc2ccccc2 1626a_100000106460_100000238430 [0,1,0,0,1,0|1,0,1]=4 4072 B20R2.153664 O=C(Cc1cccc(c1)I)NCCc2ccccc2 240690a_100000106460_100000238430 [0,1,0,0,1,0|1,0,1]=4 4073 B20R2.153664 O=C(Cc1cccc(c1)I)NCCc2ccccc2 527a_100000106460_100000238430 [0,1,0,0,1,0|1,0,1]=4 4074 B20R2.153664 O=C(Cc1cccc(c1)O)NCCc2ccccc2 240690a_100000106460_100000745134 [0,1,0,0,1,0|1,0,1]=4 4075 B20R2.153664 O=C(Cc1cccc(c1)O)NCCc2ccccc2 527a_100000106460_100000745134 [0,1,0,0,1,0|1,0,1]=4 4076 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)Br 2430a_100000210019_100000106460 [0,1,0,0,1,0|2,0,0]=4 4077 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)Br 512a_100000210019_100000106460 [0,1,0,0,1,0|2,0,0]=4 4078 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)Cl 2430a_100000185859_100000106460 [0,1,0,0,1,0|2,0,0]=4 4079 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)F 2430a_100000210047_100000106460 [0,1,0,0,1,0|2,0,0]=4 4080 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)F 512a_100000210047_100000106460 [0,1,0,0,1,0|2,0,0]=4 4081 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)I 2430a_100000211102_100000106460 [0,1,0,0,1,0|2,0,0]=4 4082 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)I 512a_100000211102_100000106460 [0,1,0,0,1,0|2,0,0]=4 4083 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)O 2430a_100000210217_100000106460 [0,1,0,0,1,0|2,0,0]=4 4084 B20R2.153664 O=C(NCCc1ccccc1)Nc2cccc(c2)O 512a_100000210217_100000106460 [0,1,0,0,1,0|2,0,0]=4 4085 B20R2.174731 C=C(C(=O)CCCc1ccccc1)c2ccccc2 1458a_100000065200_100000211621 [0,1,0,0,1,0|1,0,0]=3 4086 B20R2.174731 C=C(C(=O)CCOc1ccccc1)c2ccccc2 1458a_100000065200_100000184471 [0,1,0,0,1,0|2,0,0]=4 4087 B20R2.174731 C=C(C(=O)CCSc1ccccc1)c2ccccc2 1458a_100000065200_100000246102 [0,1,0,0,1,0|2,0,0]=4 4088 B20R2.174731 C=C(C(=O)CSCc1ccccc1)c2ccccc2 1458a_100000065200_200011217039 [0,1,0,0,1,0|2,0,0]=4 4089 B20R2.174731 C=C(C(=O)NCCc1ccccc1)c2ccccc2 1626a_100000106460_100000065200 [0,1,0,0,1,0|1,0,0]=3 4090 B20R2.174731 C=C(C(=O)NCCc1ccccn1)c2ccccc2 1626a_100000211156_100000065200 [0,1,0,0,1,0|2,0,0]=4 4091 B20R2.174731 C=C(C(=O)NCCc1cccnc1)c2ccccc2 1626a_100000736294_100000065200 [0,1,0,0,1,0|2,0,0]=4 4092 B20R2.174731 C=C(C(=O)NCCc1ccncc1)c2ccccc2 1626a_100000742849_100000065200 [0,1,0,0,1,0|2,0,0]=4 4093 B20R2.174731 C=C(C(=O)NNCc1ccccc1)c2ccccc2 22a_100000007032_100000065200 [0,1,0,0,1,0|2,0,0]=4 4094 B20R2.174731 CC(C(=O)CCCc1ccccc1)c2ccccc2 1458a_100011207963_100000230085 [0,1,0,0,1,0|1,0,1]=4 4095 B20R2.174731 CC(OCCc1ccccc1)C(=O)c2ccccc2 7a_100000210268_100000239700 [0,1,0,0,1,0|1,0,1]=4 4096 B20R2.174731 CN(C(=O)CCCc1ccccc1)c2ccccc2 11a_100000210012_100011207963 [0,1,0,0,1,0|2,0,0]=4 4097 B20R2.174731 CN(C(=O)CCCc1ccccc1)c2ccccc2 1626a_100000210012_100011207963 [0,1,0,0,1,0|2,0,0]=4 4098 B20R2.174731 CN(C(=O)CCCc1ccccc1)c2ccccc2 22a_100000210012_100011207963 [0,1,0,0,1,0|2,0,0]=4 4099 B20R2.174731 CN(C(=O)NCCc1ccccc1)c2ccccc2 512a_100000106460_100000210012 [0,1,0,0,1,0|2,0,0]=4 4100 B20R2.174731 C[C@H](C(=O)CCCc1ccccc1)c2ccccc2 1458a_100000751047_100000211621 [0,1,0,0,1,0|1,0,1]=4 4101 B20R2.174731 C[C@H](C(=O)NCCc1ccccc1)c2ccccc2 11a_100000106460_100000751047 [0,1,0,0,1,0|1,0,1]=4 4102 B20R2.174731 C[C@H](C(=O)NCCc1ccccc1)c2ccccc2 1626a_100000106460_100000751047 [0,1,0,0,1,0|1,0,1]=4 4103 B20R2.174731 C[C@H](C(=O)NCCc1ccccc1)c2ccccc2 240690a_100000106460_100000751047 [0,1,0,0,1,0|1,0,1]=4 4104 B20R2.174731 C[C@H](C(=O)NCCc1ccccc1)c2ccccc2 527a_100000106460_100000751047 [0,1,0,0,1,0|1,0,1]=4 4105 B20R2.174731 O=C(CCCc1ccccc1)C(F)c2ccccc2 1458a_100000698975_100000211621 [0,1,0,0,1,0|1,0,1]=4 4106 B20R2.174731 O=C(CCCc1ccccc1)[C@H](O)c2ccccc2 1458a_100000684486_100000211621 [0,1,0,0,1,0|1,0,1]=4 4107 B20R2.174731 O=C(NCCc1ccccc1)C(F)c2ccccc2 11a_100000106460_100000698975 [0,1,0,0,1,0|1,0,1]=4 4108 B20R2.174731 O=C(NCCc1ccccc1)C(F)c2ccccc2 1626a_100000106460_100000698975 [0,1,0,0,1,0|1,0,1]=4 4109 B20R2.174731 O=C(NCCc1ccccc1)C(F)c2ccccc2 240690a_100000106460_100000698975 [0,1,0,0,1,0|1,0,1]=4 4110 B20R2.174731 O=C(NCCc1ccccc1)C(F)c2ccccc2 527a_100000106460_100000698975 [0,1,0,0,1,0|1,0,1]=4 4111 B20R2.174731 O=C(NCCc1ccccc1)[C@H](O)c2ccccc2 240690a_100000106460_100000684486 [0,1,0,0,1,0|1,0,1]=4 4112 B20R2.4449 Cc1ccc(cc1)C=CC(=O)CCc2ccccc2 1458a_100000716854_100000765856 [0,1,0,0,1,0|0,0,0]=2 4113 B20R2.4449 Cc1ccc(cc1)C=CC(=O)CCc2ccccn2 1458a_100000716854_100015183660 [0,1,0,0,1,0|1,0,0]=3 4114 B20R2.4449 Cc1ccc(cc1)C=CC(=O)CCc2cccnc2 1458a_100000716854_200011713674 [0,1,0,0,1,0|1,0,0]=3 4115 B20R2.4449 Cc1ccc(cc1)C=CC(=O)CCc2ccncc2 1458a_100000716854_100000723409 [0,1,0,0,1,0|1,0,0]=3 4116 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000716854 [0,1,0,0,1,0|1,0,0]=3 4117 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000716854 [0,1,0,0,1,0|1,0,0]=3 4118 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100000716854 [0,1,0,0,1,0|1,0,0]=3 4119 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 11a_100000210449_100000716854 [0,1,0,0,1,0|2,0,0]=4 4120 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000716854 [0,1,0,0,1,0|2,0,0]=4 4121 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccccn2 240690a_100000210449_100000716854 [0,1,0,0,1,0|2,0,0]=4 4122 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2 11a_100000210453_100000716854 [0,1,0,0,1,0|2,0,0]=4 4123 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2cccnc2 240690a_100000210453_100000716854 [0,1,0,0,1,0|2,0,0]=4 4124 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 11a_100000210450_100000716854 [0,1,0,0,1,0|2,0,0]=4 4125 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000716854 [0,1,0,0,1,0|2,0,0]=4 4126 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NCc2ccncc2 240690a_100000210450_100000716854 [0,1,0,0,1,0|2,0,0]=4 4127 B20R2.4449 Cc1ccc(cc1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000716854 [0,1,0,0,1,0|2,0,0]=4 4128 B20R2.4449 Cc1ccc(cc1)CCC(=O)C#Cc2ccccc2 1458a_100000736102_100011713686 [0,1,0,0,1,0|0,0,2]=4 4129 B20R2.4449 Cc1ccc(cc1)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100011713686 [0,1,0,0,1,0|0,0,0]=2 4130 B20R2.4449 Cc1ccc(cc1)CCC(=O)C=Cc2ccccn2 1458a_100000740811_100011713686 [0,1,0,0,1,0|1,0,0]=3 4131 B20R2.4449 Cc1ccc(cc1)CCC(=O)C=Cc2cccnc2 1458a_100000735890_100011713686 [0,1,0,0,1,0|1,0,0]=3 4132 B20R2.4449 Cc1ccc(cc1)CCC(=O)C=Cc2ccncc2 1458a_100000682801_100011713686 [0,1,0,0,1,0|1,0,0]=3 4133 B20R2.4449 Cc1ccc(cc1)CCC(=O)CCc2ccccc2 1458a_100000185753_100011713686 [0,1,0,0,1,0|0,0,2]=4 4134 B20R2.4449 Cc1ccc(cc1)CCC(=O)CCc2ccccc2 1458a_100000234883_100000765856 [0,1,0,0,1,0|0,0,2]=4 4135 B20R2.4449 Cc1ccc(cc1)CCC(=O)COc2ccccc2 1458a_100000186222_100011713686 [0,1,0,0,1,0|1,0,1]=4 4136 B20R2.4449 Cc1ccc(cc1)CCC(=O)CSc2ccccc2 1458a_100000211596_100011713686 [0,1,0,0,1,0|1,0,1]=4 4137 B20R2.4449 Cc1ccc(cc1)CCC(=O)NCc2ccccc2 11a_100015324214_100000234883 [0,1,0,0,1,0|1,0,1]=4 4138 B20R2.4449 Cc1ccc(cc1)CCC(=O)NCc2ccccc2 1626a_100015324214_100000234883 [0,1,0,0,1,0|1,0,1]=4 4139 B20R2.4449 Cc1ccc(cc1)CCC(=O)NCc2ccccc2 240690a_100015324214_100000234883 [0,1,0,0,1,0|1,0,1]=4 4140 B20R2.4449 Cc1ccc(cc1)CCC(=O)NCc2ccccc2 527a_100015324214_100000234883 [0,1,0,0,1,0|1,0,1]=4 4141 B20R2.4449 Cc1ccc(cc1)CCC(=O)NNc2ccccc2 22a_100015195140_100000234883 [0,1,0,0,1,0|2,0,0]=4 4142 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 11a_100000174908_100000210462 [0,1,0,0,1,0|1,0,0]=3 4143 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccccc2 1626a_100000174908_100000210462 [0,1,0,0,1,0|1,0,0]=3 4144 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 11a_100000174908_100000740811 [0,1,0,0,1,0|2,0,0]=4 4145 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccccn2 240690a_100000174908_100000740811 [0,1,0,0,1,0|2,0,0]=4 4146 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 11a_100000174908_100000735890 [0,1,0,0,1,0|2,0,0]=4 4147 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2cccnc2 240690a_100000174908_100000735890 [0,1,0,0,1,0|2,0,0]=4 4148 B20R2.4449 Cc1ccc(cc1)CNC(=O)C=Cc2ccncc2 240690a_100000174908_100000682801 [0,1,0,0,1,0|2,0,0]=4 4149 B20R2.4449 Cc1ccc(cc1)CNC(=O)CCc2ccccc2 11a_100000174908_100000185753 [0,1,0,0,1,0|1,0,1]=4 4150 B20R2.4449 Cc1ccc(cc1)CNC(=O)CCc2ccccc2 1626a_100000174908_100000185753 [0,1,0,0,1,0|1,0,1]=4 4151 B20R2.4449 Cc1ccc(cc1)CNC(=O)CCc2ccccc2 240690a_100000174908_100000185753 [0,1,0,0,1,0|1,0,1]=4 4152 B20R2.4449 Cc1ccc(cc1)CNC(=O)CCc2ccccc2 527a_100000174908_100000185753 [0,1,0,0,1,0|1,0,1]=4 4153 B20R2.4449 Cc1ccc(cc1)NCC(=O)CCc2ccccc2 34a_100000124888_100012361361 [0,1,0,0,1,0|1,0,1]=4 4154 B20R2.4449 Cc1ccc(cc1)NCC(=O)OCc2ccccc2 34a_100000124888_100000753625 [0,1,0,0,1,0|1,0,1]=4 4155 B20R2.4449 Cc1ccc(cc1)NNC(=O)C=Cc2ccccc2 22a_100000683527_100000210462 [0,1,0,0,1,0|2,0,0]=4 4156 B20R2.4449 Cc1ccc(cc1)NNC(=O)CCc2ccccc2 22a_100000683527_100000185753 [0,1,0,0,1,0|2,0,0]=4 4157 B20R2.4449 Cc1ccc(cc1)OCC(=O)CCc2ccccc2 1458a_100000182360_100000765856 [0,1,0,0,1,0|1,0,1]=4 4158 B20R2.4449 Cc1ccc(cc1)OCC(=O)CCc2ccccc2 34a_100000210336_100012361361 [0,1,0,0,1,0|1,0,1]=4 4159 B20R2.4449 Cc1ccc(cc1)OCC(=O)CCc2ccccc2 7a_100000210336_100012361361 [0,1,0,0,1,0|1,0,1]=4 4160 B20R2.4449 Cc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000210336_100000753625 [0,1,0,0,1,0|1,0,1]=4 4161 B20R2.4449 Cc1ccc(cc1)OCC(=O)OCc2ccccc2 7a_100000210336_100000753625 [0,1,0,0,1,0|1,0,1]=4 4162 B20R2.4449 Cc1ccc(cc1)SCC(=O)CCc2ccccc2 1458a_100000179497_100000765856 [0,1,0,0,1,0|1,0,1]=4 4163 B20R2.4449 Cc1ccc(cc1)SCC(=O)CCc2ccccc2 62a_100000186775_100012361361 [0,1,0,0,1,0|1,0,1]=4 4164 B20R2.4449 Cc1ccc(cc1)SCC(=O)CCc2ccccc2 62a_100012361361_100000186775 [0,1,0,0,1,0|1,0,1]=4 4165 B20R2.4449 Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000186775_100000753625 [0,1,0,0,1,0|1,0,1]=4 4166 B20R2.4449 Cc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000186775 [0,1,0,0,1,0|1,0,1]=4 4167 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2 11a_100000740942_100000210462 [0,1,0,0,1,0|2,0,0]=4 4168 B20R2.4449 Cc1ccc(cn1)CNC(=O)C=Cc2ccccc2 1626a_100000740942_100000210462 [0,1,0,0,1,0|2,0,0]=4 4169 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2 11a_100015187455_100000210462 [0,1,0,0,1,0|2,0,0]=4 4170 B20R2.4449 Cc1ccc(nc1)CNC(=O)C=Cc2ccccc2 1626a_100015187455_100000210462 [0,1,0,0,1,0|2,0,0]=4 4171 B20R2.4449 Cc1cnc(cn1)C=CC(=O)CCc2ccccc2 6a_100000685221_100000210092 [0,1,0,0,1,0|2,0,0]=4 4172 B20R2.4449 Cc1ncc(cn1)C=CC(=O)CCc2ccccc2 6a_100011202771_100000210092 [0,1,0,0,1,0|2,0,0]=4 4173 B20R2.4449 Nc1ccc(cc1)OCC(=O)CCc2ccccc2 34a_100000185829_100012361361 [0,1,0,0,1,0|1,0,1]=4 4174 B20R2.4449 Nc1ccc(cc1)OCC(=O)OCc2ccccc2 34a_100000185829_100000753625 [0,1,0,0,1,0|1,0,1]=4 4175 B20R2.4449 Nc1ccc(cc1)SCC(=O)CCc2ccccc2 62a_100000185761_100012361361 [0,1,0,0,1,0|1,0,1]=4 4176 B20R2.4449 Nc1ccc(cc1)SCC(=O)CCc2ccccc2 62a_100012361361_100000185761 [0,1,0,0,1,0|1,0,1]=4 4177 B20R2.4449 Nc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000185761_100000753625 [0,1,0,0,1,0|1,0,1]=4 4178 B20R2.4449 Nc1ccc(cc1)SCC(=O)OCc2ccccc2 62a_100000753625_100000185761 [0,1,0,0,1,0|1,0,1]=4 4179 B20R2.4449 O=C(C#Cc1ccc(cc1)Br)CCc2ccccc2 1458a_100012100275_100000765856 [0,1,0,0,1,0|0,0,2]=4 4180 B20R2.4449 O=C(C#Cc1ccc(cc1)Cl)CCc2ccccc2 1458a_100011892723_100000765856 [0,1,0,0,1,0|0,0,2]=4 4181 B20R2.4449 O=C(C#Cc1ccc(cc1)F)CCc2ccccc2 1458a_100000238512_100000765856 [0,1,0,0,1,0|0,0,2]=4 4182 B20R2.4449 O=C(C#Cc1ccccc1)CCc2ccc(cc2)Br 1458a_100000736102_100011740612 [0,1,0,0,1,0|0,0,2]=4 4183 B20R2.4449 O=C(C#Cc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000736102_100011713675 [0,1,0,0,1,0|0,0,2]=4 4184 B20R2.4449 O=C(C#Cc1ccccc1)CCc2ccc(cc2)F 1458a_100000736102_100011217392 [0,1,0,0,1,0|0,0,2]=4 4185 B20R2.4449 O=C(C#Cc1ccccc1)CCc2ccc(cc2)O 1458a_100000736102_100009816426 [0,1,0,0,1,0|0,0,2]=4 4186 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2ccccc2 1458a_100016267368_100000765856 [0,1,0,0,1,0|0,0,0]=2 4187 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2ccccc2 6a_100000186029_100000210092 [0,1,0,0,1,0|0,0,0]=2 4188 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2ccccn2 1458a_100016267368_100015183660 [0,1,0,0,1,0|1,0,0]=3 4189 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2cccnc2 1458a_100016267368_200011713674 [0,1,0,0,1,0|1,0,0]=3 4190 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CCc2ccncc2 1458a_100016267368_100000723409 [0,1,0,0,1,0|1,0,0]=3 4191 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)COc2ccccc2 6a_100000186029_100000150576 [0,1,0,0,1,0|1,0,0]=3 4192 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)CSc2ccccc2 6a_100000186029_100000150717 [0,1,0,0,1,0|1,0,0]=3 4193 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_100016267368 [0,1,0,0,1,0|1,0,0]=3 4194 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccccc2 1626a_100015324214_100016267368 [0,1,0,0,1,0|1,0,0]=3 4195 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccccn2 11a_100000210449_100016267368 [0,1,0,0,1,0|2,0,0]=4 4196 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccccn2 1626a_100000210449_100016267368 [0,1,0,0,1,0|2,0,0]=4 4197 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2cccnc2 11a_100000210453_100016267368 [0,1,0,0,1,0|2,0,0]=4 4198 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccncc2 11a_100000210450_100016267368 [0,1,0,0,1,0|2,0,0]=4 4199 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NCc2ccncc2 1626a_100000210450_100016267368 [0,1,0,0,1,0|2,0,0]=4 4200 B20R2.4449 O=C(C=Cc1ccc(cc1)Br)NNc2ccccc2 22a_100015195140_100016267368 [0,1,0,0,1,0|2,0,0]=4 4201 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)CCc2ccccc2 1458a_100000184863_100000765856 [0,1,0,0,1,0|0,0,0]=2 4202 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)CCc2ccccn2 1458a_100000184863_100015183660 [0,1,0,0,1,0|1,0,0]=3 4203 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)CCc2cccnc2 1458a_100000184863_200011713674 [0,1,0,0,1,0|1,0,0]=3 4204 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)CCc2ccncc2 1458a_100000184863_100000723409 [0,1,0,0,1,0|1,0,0]=3 4205 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2 11a_100015324214_100000184863 [0,1,0,0,1,0|1,0,0]=3 4206 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2 1626a_100015324214_100000184863 [0,1,0,0,1,0|1,0,0]=3 4207 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100000184863 [0,1,0,0,1,0|1,0,0]=3 4208 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccn2 11a_100000210449_100000184863 [0,1,0,0,1,0|2,0,0]=4 4209 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccn2 1626a_100000210449_100000184863 [0,1,0,0,1,0|2,0,0]=4 4210 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccccn2 240690a_100000210449_100000184863 [0,1,0,0,1,0|2,0,0]=4 4211 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2 11a_100000210453_100000184863 [0,1,0,0,1,0|2,0,0]=4 4212 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2cccnc2 240690a_100000210453_100000184863 [0,1,0,0,1,0|2,0,0]=4 4213 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2 11a_100000210450_100000184863 [0,1,0,0,1,0|2,0,0]=4 4214 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2 1626a_100000210450_100000184863 [0,1,0,0,1,0|2,0,0]=4 4215 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NCc2ccncc2 240690a_100000210450_100000184863 [0,1,0,0,1,0|2,0,0]=4 4216 B20R2.4449 O=C(C=Cc1ccc(cc1)Cl)NNc2ccccc2 22a_100015195140_100000184863 [0,1,0,0,1,0|2,0,0]=4 4217 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2ccccc2 1458a_100000182136_100000765856 [0,1,0,0,1,0|0,0,0]=2 4218 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2ccccc2 6a_100000210084_100000210092 [0,1,0,0,1,0|0,0,0]=2 4219 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2ccccn2 1458a_100000182136_100015183660 [0,1,0,0,1,0|1,0,0]=3 4220 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2cccnc2 1458a_100000182136_200011713674 [0,1,0,0,1,0|1,0,0]=3 4221 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CCc2ccncc2 1458a_100000182136_100000723409 [0,1,0,0,1,0|1,0,0]=3 4222 B20R2.4449 O=C(C=Cc1ccc(cc1)F)COc2ccccc2 6a_100000210084_100000150576 [0,1,0,0,1,0|1,0,0]=3 4223 B20R2.4449 O=C(C=Cc1ccc(cc1)F)CSc2ccccc2 6a_100000210084_100000150717 [0,1,0,0,1,0|1,0,0]=3 4224 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2 11a_100015324214_100000182136 [0,1,0,0,1,0|1,0,0]=3 4225 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2 1626a_100015324214_100000182136 [0,1,0,0,1,0|1,0,0]=3 4226 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100000182136 [0,1,0,0,1,0|1,0,0]=3 4227 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccn2 11a_100000210449_100000182136 [0,1,0,0,1,0|2,0,0]=4 4228 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccn2 1626a_100000210449_100000182136 [0,1,0,0,1,0|2,0,0]=4 4229 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccccn2 240690a_100000210449_100000182136 [0,1,0,0,1,0|2,0,0]=4 4230 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2 11a_100000210453_100000182136 [0,1,0,0,1,0|2,0,0]=4 4231 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2cccnc2 240690a_100000210453_100000182136 [0,1,0,0,1,0|2,0,0]=4 4232 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2 11a_100000210450_100000182136 [0,1,0,0,1,0|2,0,0]=4 4233 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2 1626a_100000210450_100000182136 [0,1,0,0,1,0|2,0,0]=4 4234 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NCc2ccncc2 240690a_100000210450_100000182136 [0,1,0,0,1,0|2,0,0]=4 4235 B20R2.4449 O=C(C=Cc1ccc(cc1)F)NNc2ccccc2 22a_100015195140_100000182136 [0,1,0,0,1,0|2,0,0]=4 4236 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2ccccc2 1458a_100102526154_100000765856 [0,1,0,0,1,0|0,0,0]=2 4237 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2ccccc2 6a_100000188517_100000210092 [0,1,0,0,1,0|0,0,0]=2 4238 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2ccccn2 1458a_100102526154_100015183660 [0,1,0,0,1,0|1,0,0]=3 4239 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2cccnc2 1458a_100102526154_200011713674 [0,1,0,0,1,0|1,0,0]=3 4240 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CCc2ccncc2 1458a_100102526154_100000723409 [0,1,0,0,1,0|1,0,0]=3 4241 B20R2.4449 O=C(C=Cc1ccc(cc1)I)COc2ccccc2 6a_100000188517_100000150576 [0,1,0,0,1,0|1,0,0]=3 4242 B20R2.4449 O=C(C=Cc1ccc(cc1)I)CSc2ccccc2 6a_100000188517_100000150717 [0,1,0,0,1,0|1,0,0]=3 4243 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2 11a_100015324214_100102526154 [0,1,0,0,1,0|1,0,0]=3 4244 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2 1626a_100015324214_100102526154 [0,1,0,0,1,0|1,0,0]=3 4245 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccc2 240690a_100015324214_100102526154 [0,1,0,0,1,0|1,0,0]=3 4246 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccn2 11a_100000210449_100102526154 [0,1,0,0,1,0|2,0,0]=4 4247 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccn2 1626a_100000210449_100102526154 [0,1,0,0,1,0|2,0,0]=4 4248 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccccn2 240690a_100000210449_100102526154 [0,1,0,0,1,0|2,0,0]=4 4249 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2 11a_100000210453_100102526154 [0,1,0,0,1,0|2,0,0]=4 4250 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2cccnc2 240690a_100000210453_100102526154 [0,1,0,0,1,0|2,0,0]=4 4251 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2 11a_100000210450_100102526154 [0,1,0,0,1,0|2,0,0]=4 4252 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2 1626a_100000210450_100102526154 [0,1,0,0,1,0|2,0,0]=4 4253 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NCc2ccncc2 240690a_100000210450_100102526154 [0,1,0,0,1,0|2,0,0]=4 4254 B20R2.4449 O=C(C=Cc1ccc(cc1)I)NNc2ccccc2 22a_100015195140_100102526154 [0,1,0,0,1,0|2,0,0]=4 4255 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2ccccc2 240690a_100015324214_100016269017 [0,1,0,0,1,0|1,0,0]=3 4256 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2ccccn2 240690a_100000210449_100016269017 [0,1,0,0,1,0|2,0,0]=4 4257 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2cccnc2 240690a_100000210453_100016269017 [0,1,0,0,1,0|2,0,0]=4 4258 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NCc2ccncc2 240690a_100000210450_100016269017 [0,1,0,0,1,0|2,0,0]=4 4259 B20R2.4449 O=C(C=Cc1ccc(cc1)O)NNc2ccccc2 22a_100015195140_100016269017 [0,1,0,0,1,0|2,0,0]=4 4260 B20R2.4449 O=C(C=Cc1ccc(cn1)Br)CCc2ccccc2 6a_100000754260_100000210092 [0,1,0,0,1,0|1,0,0]=3 4261 B20R2.4449 O=C(C=Cc1ccc(cn1)Br)COc2ccccc2 6a_100000754260_100000150576 [0,1,0,0,1,0|2,0,0]=4 4262 B20R2.4449 O=C(C=Cc1ccc(cn1)Br)CSc2ccccc2 6a_100000754260_100000150717 [0,1,0,0,1,0|2,0,0]=4 4263 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2ccccc2 1458a_100020630499_100000765856 [0,1,0,0,1,0|1,0,0]=3 4264 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2ccccc2 6a_100011934744_100000210092 [0,1,0,0,1,0|1,0,0]=3 4265 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2ccccn2 1458a_100020630499_100015183660 [0,1,0,0,1,0|2,0,0]=4 4266 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2cccnc2 1458a_100020630499_200011713674 [0,1,0,0,1,0|2,0,0]=4 4267 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CCc2ccncc2 1458a_100020630499_100000723409 [0,1,0,0,1,0|2,0,0]=4 4268 B20R2.4449 O=C(C=Cc1ccc(cn1)F)COc2ccccc2 6a_100011934744_100000150576 [0,1,0,0,1,0|2,0,0]=4 4269 B20R2.4449 O=C(C=Cc1ccc(cn1)F)CSc2ccccc2 6a_100011934744_100000150717 [0,1,0,0,1,0|2,0,0]=4 4270 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2 11a_100015324214_100020630499 [0,1,0,0,1,0|2,0,0]=4 4271 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2 1626a_100015324214_100020630499 [0,1,0,0,1,0|2,0,0]=4 4272 B20R2.4449 O=C(C=Cc1ccc(cn1)F)NCc2ccccc2 240690a_100015324214_100020630499 [0,1,0,0,1,0|2,0,0]=4 4273 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)CCc2ccccc2 1458a_100020588214_100000765856 [0,1,0,0,1,0|1,0,0]=3 4274 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)CCc2ccccn2 1458a_100020588214_100015183660 [0,1,0,0,1,0|2,0,0]=4 4275 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)CCc2cccnc2 1458a_100020588214_200011713674 [0,1,0,0,1,0|2,0,0]=4 4276 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)CCc2ccncc2 1458a_100020588214_100000723409 [0,1,0,0,1,0|2,0,0]=4 4277 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2 11a_100015324214_100020588214 [0,1,0,0,1,0|2,0,0]=4 4278 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2 1626a_100015324214_100020588214 [0,1,0,0,1,0|2,0,0]=4 4279 B20R2.4449 O=C(C=Cc1ccc(nc1)Br)NCc2ccccc2 240690a_100015324214_100020588214 [0,1,0,0,1,0|2,0,0]=4 4280 B20R2.4449 O=C(C=Cc1ccccc1)CCc2ccc(cc2)Br 1458a_100000210462_100011740612 [0,1,0,0,1,0|0,0,0]=2 4281 B20R2.4449 O=C(C=Cc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000210462_100011713675 [0,1,0,0,1,0|0,0,0]=2 4282 B20R2.4449 O=C(C=Cc1ccccc1)CCc2ccc(cc2)F 1458a_100000210462_100011217392 [0,1,0,0,1,0|0,0,0]=2 4283 B20R2.4449 O=C(C=Cc1ccccc1)CCc2ccc(cc2)O 1458a_100000210462_100009816426 [0,1,0,0,1,0|0,0,0]=2 4284 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100000210462 [0,1,0,0,1,0|1,0,0]=3 4285 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100000210462 [0,1,0,0,1,0|1,0,0]=3 4286 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100000210462 [0,1,0,0,1,0|1,0,0]=3 4287 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000210462 [0,1,0,0,1,0|1,0,0]=3 4288 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100000210462 [0,1,0,0,1,0|1,0,0]=3 4289 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100000210462 [0,1,0,0,1,0|1,0,0]=3 4290 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100000210462 [0,1,0,0,1,0|1,0,0]=3 4291 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100000210462 [0,1,0,0,1,0|1,0,0]=3 4292 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)Br 11a_100015188789_100000210462 [0,1,0,0,1,0|2,0,0]=4 4293 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)Br 1626a_100015188789_100000210462 [0,1,0,0,1,0|2,0,0]=4 4294 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)Cl 11a_100000697193_100000210462 [0,1,0,0,1,0|2,0,0]=4 4295 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)Cl 1626a_100000697193_100000210462 [0,1,0,0,1,0|2,0,0]=4 4296 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)F 11a_100020620131_100000210462 [0,1,0,0,1,0|2,0,0]=4 4297 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(cn2)F 1626a_100020620131_100000210462 [0,1,0,0,1,0|2,0,0]=4 4298 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)Br 11a_100009817727_100000210462 [0,1,0,0,1,0|2,0,0]=4 4299 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)Cl 11a_100000735879_100000210462 [0,1,0,0,1,0|2,0,0]=4 4300 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)Cl 1626a_100000735879_100000210462 [0,1,0,0,1,0|2,0,0]=4 4301 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)F 11a_100000101913_100000210462 [0,1,0,0,1,0|2,0,0]=4 4302 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)F 1626a_100000101913_100000210462 [0,1,0,0,1,0|2,0,0]=4 4303 B20R2.4449 O=C(C=Cc1ccccc1)NCc2ccc(nc2)O 11a_100000757128_100000210462 [0,1,0,0,1,0|2,0,0]=4 4304 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cc2)Br 22a_100000735608_100000210462 [0,1,0,0,1,0|2,0,0]=4 4305 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cc2)Cl 22a_100000683521_100000210462 [0,1,0,0,1,0|2,0,0]=4 4306 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cc2)F 22a_100000728448_100000210462 [0,1,0,0,1,0|2,0,0]=4 4307 B20R2.4449 O=C(C=Cc1ccccc1)NNc2ccc(cc2)I 22a_100016988836_100000210462 [0,1,0,0,1,0|2,0,0]=4 4308 B20R2.4449 O=C(C=Cc1ccccn1)CCc2ccc(cc2)Br 1458a_100000740811_100011740612 [0,1,0,0,1,0|1,0,0]=3 4309 B20R2.4449 O=C(C=Cc1ccccn1)CCc2ccc(cc2)Cl 1458a_100000740811_100011713675 [0,1,0,0,1,0|1,0,0]=3 4310 B20R2.4449 O=C(C=Cc1ccccn1)CCc2ccc(cc2)F 1458a_100000740811_100011217392 [0,1,0,0,1,0|1,0,0]=3 4311 B20R2.4449 O=C(C=Cc1ccccn1)CCc2ccc(cc2)O 1458a_100000740811_100009816426 [0,1,0,0,1,0|1,0,0]=3 4312 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)Br 11a_100000174875_100000740811 [0,1,0,0,1,0|2,0,0]=4 4313 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)Br 240690a_100000174875_100000740811 [0,1,0,0,1,0|2,0,0]=4 4314 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)Cl 11a_100000174871_100000740811 [0,1,0,0,1,0|2,0,0]=4 4315 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)Cl 240690a_100000174871_100000740811 [0,1,0,0,1,0|2,0,0]=4 4316 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)F 11a_100000174882_100000740811 [0,1,0,0,1,0|2,0,0]=4 4317 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)F 240690a_100000174882_100000740811 [0,1,0,0,1,0|2,0,0]=4 4318 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)I 11a_100016989417_100000740811 [0,1,0,0,1,0|2,0,0]=4 4319 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)I 240690a_100016989417_100000740811 [0,1,0,0,1,0|2,0,0]=4 4320 B20R2.4449 O=C(C=Cc1ccccn1)NCc2ccc(cc2)O 240690a_100000185549_100000740811 [0,1,0,0,1,0|2,0,0]=4 4321 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)Br 1458a_100000735890_100011740612 [0,1,0,0,1,0|1,0,0]=3 4322 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)Cl 1458a_100000735890_100011713675 [0,1,0,0,1,0|1,0,0]=3 4323 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)F 1458a_100000735890_100011217392 [0,1,0,0,1,0|1,0,0]=3 4324 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)O 1458a_100000735890_100009816426 [0,1,0,0,1,0|1,0,0]=3 4325 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Br 11a_100000174875_100000735890 [0,1,0,0,1,0|2,0,0]=4 4326 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Br 240690a_100000174875_100000735890 [0,1,0,0,1,0|2,0,0]=4 4327 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Cl 11a_100000174871_100000735890 [0,1,0,0,1,0|2,0,0]=4 4328 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000735890 [0,1,0,0,1,0|2,0,0]=4 4329 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)F 11a_100000174882_100000735890 [0,1,0,0,1,0|2,0,0]=4 4330 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)F 240690a_100000174882_100000735890 [0,1,0,0,1,0|2,0,0]=4 4331 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)I 11a_100016989417_100000735890 [0,1,0,0,1,0|2,0,0]=4 4332 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)I 240690a_100016989417_100000735890 [0,1,0,0,1,0|2,0,0]=4 4333 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)O 240690a_100000185549_100000735890 [0,1,0,0,1,0|2,0,0]=4 4334 B20R2.4449 O=C(C=Cc1ccncc1)CCc2ccc(cc2)Br 1458a_100000682801_100011740612 [0,1,0,0,1,0|1,0,0]=3 4335 B20R2.4449 O=C(C=Cc1ccncc1)CCc2ccc(cc2)Cl 1458a_100000682801_100011713675 [0,1,0,0,1,0|1,0,0]=3 4336 B20R2.4449 O=C(C=Cc1ccncc1)CCc2ccc(cc2)F 1458a_100000682801_100011217392 [0,1,0,0,1,0|1,0,0]=3 4337 B20R2.4449 O=C(C=Cc1ccncc1)CCc2ccc(cc2)O 1458a_100000682801_100009816426 [0,1,0,0,1,0|1,0,0]=3 4338 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)Br 240690a_100000174875_100000682801 [0,1,0,0,1,0|2,0,0]=4 4339 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000682801 [0,1,0,0,1,0|2,0,0]=4 4340 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)F 240690a_100000174882_100000682801 [0,1,0,0,1,0|2,0,0]=4 4341 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)I 240690a_100016989417_100000682801 [0,1,0,0,1,0|2,0,0]=4 4342 B20R2.4449 O=C(C=Cc1ccncc1)NCc2ccc(cc2)O 240690a_100000185549_100000682801 [0,1,0,0,1,0|2,0,0]=4 4343 B20R2.4449 O=C(C=Cc1cnc(cn1)Cl)CCc2ccccc2 6a_100012001714_100000210092 [0,1,0,0,1,0|2,0,0]=4 4344 B20R2.4449 O=C(C=Cc1cncnc1)CCc2ccc(cc2)Cl 6a_100000749868_100011279170 [0,1,0,0,1,0|2,0,0]=4 4345 B20R2.4449 O=C(C=Cc1cncnc1)CCc2ccc(cc2)F 6a_100000749868_100000743244 [0,1,0,0,1,0|2,0,0]=4 4346 B20R2.4449 O=C(C=Cc1cncnc1)CCc2ccc(cc2)I 6a_100000749868_100000723691 [0,1,0,0,1,0|2,0,0]=4 4347 B20R2.4449 O=C(C=Cc1cncnc1)CCc2ccc(cc2)O 6a_100000749868_100000198047 [0,1,0,0,1,0|2,0,0]=4 4348 B20R2.4449 O=C(CCc1ccc(cc1)Br)COc2ccccc2 1458a_100000186222_100011740612 [0,1,0,0,1,0|1,0,1]=4 4349 B20R2.4449 O=C(CCc1ccc(cc1)Br)CSc2ccccc2 1458a_100000211596_100011740612 [0,1,0,0,1,0|1,0,1]=4 4350 B20R2.4449 O=C(CCc1ccc(cc1)Br)NCc2ccccc2 11a_100015324214_100000217147 [0,1,0,0,1,0|1,0,1]=4 4351 B20R2.4449 O=C(CCc1ccc(cc1)Br)NCc2ccccc2 1626a_100015324214_100000217147 [0,1,0,0,1,0|1,0,1]=4 4352 B20R2.4449 O=C(CCc1ccc(cc1)Br)NCc2ccccc2 240690a_100015324214_100000217147 [0,1,0,0,1,0|1,0,1]=4 4353 B20R2.4449 O=C(CCc1ccc(cc1)Br)NCc2ccccc2 527a_100015324214_100000217147 [0,1,0,0,1,0|1,0,1]=4 4354 B20R2.4449 O=C(CCc1ccc(cc1)Br)NNc2ccccc2 22a_100015195140_100000217147 [0,1,0,0,1,0|2,0,0]=4 4355 B20R2.4449 O=C(CCc1ccc(cc1)Cl)COc2ccccc2 1458a_100000186222_100011713675 [0,1,0,0,1,0|1,0,1]=4 4356 B20R2.4449 O=C(CCc1ccc(cc1)Cl)CSc2ccccc2 1458a_100000211596_100011713675 [0,1,0,0,1,0|1,0,1]=4 4357 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NCc2ccccc2 11a_100015324214_100000235379 [0,1,0,0,1,0|1,0,1]=4 4358 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NCc2ccccc2 1626a_100015324214_100000235379 [0,1,0,0,1,0|1,0,1]=4 4359 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NCc2ccccc2 240690a_100015324214_100000235379 [0,1,0,0,1,0|1,0,1]=4 4360 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NCc2ccccc2 527a_100015324214_100000235379 [0,1,0,0,1,0|1,0,1]=4 4361 B20R2.4449 O=C(CCc1ccc(cc1)Cl)NNc2ccccc2 22a_100015195140_100000235379 [0,1,0,0,1,0|2,0,0]=4 4362 B20R2.4449 O=C(CCc1ccc(cc1)F)COc2ccccc2 1458a_100000186222_100011217392 [0,1,0,0,1,0|1,0,1]=4 4363 B20R2.4449 O=C(CCc1ccc(cc1)F)CSc2ccccc2 1458a_100000211596_100011217392 [0,1,0,0,1,0|1,0,1]=4 4364 B20R2.4449 O=C(CCc1ccc(cc1)F)NCc2ccccc2 11a_100015324214_100000198493 [0,1,0,0,1,0|1,0,1]=4 4365 B20R2.4449 O=C(CCc1ccc(cc1)F)NCc2ccccc2 1626a_100015324214_100000198493 [0,1,0,0,1,0|1,0,1]=4 4366 B20R2.4449 O=C(CCc1ccc(cc1)F)NCc2ccccc2 240690a_100015324214_100000198493 [0,1,0,0,1,0|1,0,1]=4 4367 B20R2.4449 O=C(CCc1ccc(cc1)F)NCc2ccccc2 527a_100015324214_100000198493 [0,1,0,0,1,0|1,0,1]=4 4368 B20R2.4449 O=C(CCc1ccc(cc1)F)NNc2ccccc2 22a_100015195140_100000198493 [0,1,0,0,1,0|2,0,0]=4 4369 B20R2.4449 O=C(CCc1ccc(cc1)I)NCc2ccccc2 11a_100015324214_100011217499 [0,1,0,0,1,0|1,0,1]=4 4370 B20R2.4449 O=C(CCc1ccc(cc1)I)NCc2ccccc2 1626a_100015324214_100011217499 [0,1,0,0,1,0|1,0,1]=4 4371 B20R2.4449 O=C(CCc1ccc(cc1)I)NCc2ccccc2 240690a_100015324214_100011217499 [0,1,0,0,1,0|1,0,1]=4 4372 B20R2.4449 O=C(CCc1ccc(cc1)I)NCc2ccccc2 527a_100015324214_100011217499 [0,1,0,0,1,0|1,0,1]=4 4373 B20R2.4449 O=C(CCc1ccc(cc1)I)NNc2ccccc2 22a_100015195140_100011217499 [0,1,0,0,1,0|2,0,0]=4 4374 B20R2.4449 O=C(CCc1ccc(cc1)O)COc2ccccc2 1458a_100000186222_100009816426 [0,1,0,0,1,0|1,0,1]=4 4375 B20R2.4449 O=C(CCc1ccc(cc1)O)CSc2ccccc2 1458a_100000211596_100009816426 [0,1,0,0,1,0|1,0,1]=4 4376 B20R2.4449 O=C(CCc1ccc(cc1)O)NCc2ccccc2 240690a_100015324214_100000742835 [0,1,0,0,1,0|1,0,1]=4 4377 B20R2.4449 O=C(CCc1ccc(cc1)O)NNc2ccccc2 22a_100015195140_100000742835 [0,1,0,0,1,0|2,0,0]=4 4378 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)Br 1458a_100000185753_100011740612 [0,1,0,0,1,0|0,0,2]=4 4379 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)Br 1458a_100000217147_100000765856 [0,1,0,0,1,0|0,0,2]=4 4380 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000185753_100011713675 [0,1,0,0,1,0|0,0,2]=4 4381 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)Cl 1458a_100000235379_100000765856 [0,1,0,0,1,0|0,0,2]=4 4382 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)F 1458a_100000185753_100011217392 [0,1,0,0,1,0|0,0,2]=4 4383 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)F 1458a_100000198493_100000765856 [0,1,0,0,1,0|0,0,2]=4 4384 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)I 1458a_100011217499_100000765856 [0,1,0,0,1,0|0,0,2]=4 4385 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)O 1458a_100000185753_100009816426 [0,1,0,0,1,0|0,0,2]=4 4386 B20R2.4449 O=C(CCc1ccccc1)CCc2ccc(cc2)O 1458a_100000742835_100000765856 [0,1,0,0,1,0|0,0,2]=4 4387 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)Br 2230a_100000210018_100012361361 [0,1,0,0,1,0|1,0,1]=4 4388 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)Br 34a_100000210018_100012361361 [0,1,0,0,1,0|1,0,1]=4 4389 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)Cl 2230a_100000210052_100012361361 [0,1,0,0,1,0|1,0,1]=4 4390 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)Cl 34a_100000210052_100012361361 [0,1,0,0,1,0|1,0,1]=4 4391 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)F 34a_100000185862_100012361361 [0,1,0,0,1,0|1,0,1]=4 4392 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)I 34a_100000185761_100012361361 [0,1,0,0,1,0|1,0,1]=4 4393 B20R2.4449 O=C(CCc1ccccc1)CNc2ccc(cc2)O 34a_100000185829_100012361361 [0,1,0,0,1,0|1,0,1]=4 4394 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Br 1458a_100000182358_100000765856 [0,1,0,0,1,0|1,0,1]=4 4395 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Br 34a_100000185759_100012361361 [0,1,0,0,1,0|1,0,1]=4 4396 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Br 7a_100000185759_100012361361 [0,1,0,0,1,0|1,0,1]=4 4397 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Cl 1458a_100016990877_100000765856 [0,1,0,0,1,0|1,0,1]=4 4398 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Cl 34a_100000210216_100012361361 [0,1,0,0,1,0|1,0,1]=4 4399 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)Cl 7a_100000210216_100012361361 [0,1,0,0,1,0|1,0,1]=4 4400 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)F 1458a_100000184765_100000765856 [0,1,0,0,1,0|1,0,1]=4 4401 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)F 34a_100000210339_100012361361 [0,1,0,0,1,0|1,0,1]=4 4402 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)I 1458a_100000184369_100000765856 [0,1,0,0,1,0|1,0,1]=4 4403 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)I 34a_100000212066_100012361361 [0,1,0,0,1,0|1,0,1]=4 4404 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)I 7a_100000212066_100012361361 [0,1,0,0,1,0|1,0,1]=4 4405 B20R2.4449 O=C(CCc1ccccc1)COc2ccc(cc2)O 1458a_100000031633_100000765856 [0,1,0,0,1,0|1,0,1]=4 4406 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Br 1458a_100000179496_100000765856 [0,1,0,0,1,0|1,0,1]=4 4407 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Br 62a_100000752885_100012361361 [0,1,0,0,1,0|1,0,1]=4 4408 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Br 62a_100012361361_100000752885 [0,1,0,0,1,0|1,0,1]=4 4409 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Cl 1458a_100000178402_100000765856 [0,1,0,0,1,0|1,0,1]=4 4410 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Cl 62a_100000755918_100012361361 [0,1,0,0,1,0|1,0,1]=4 4411 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)Cl 62a_100012361361_100000755918 [0,1,0,0,1,0|1,0,1]=4 4412 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)F 1458a_100000691584_100000765856 [0,1,0,0,1,0|1,0,1]=4 4413 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)F 62a_100000211213_100012361361 [0,1,0,0,1,0|1,0,1]=4 4414 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)F 62a_100012361361_100000211213 [0,1,0,0,1,0|1,0,1]=4 4415 B20R2.4449 O=C(CCc1ccccc1)CSc2ccc(cc2)O 62a_100012361361_100000185759 [0,1,0,0,1,0|1,0,1]=4 4416 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Br 11a_100000174875_100000185753 [0,1,0,0,1,0|1,0,1]=4 4417 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Br 1626a_100000174875_100000185753 [0,1,0,0,1,0|1,0,1]=4 4418 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Br 240690a_100000174875_100000185753 [0,1,0,0,1,0|1,0,1]=4 4419 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Br 527a_100000174875_100000185753 [0,1,0,0,1,0|1,0,1]=4 4420 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Cl 11a_100000174871_100000185753 [0,1,0,0,1,0|1,0,1]=4 4421 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Cl 1626a_100000174871_100000185753 [0,1,0,0,1,0|1,0,1]=4 4422 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000185753 [0,1,0,0,1,0|1,0,1]=4 4423 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)Cl 527a_100000174871_100000185753 [0,1,0,0,1,0|1,0,1]=4 4424 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)F 11a_100000174882_100000185753 [0,1,0,0,1,0|1,0,1]=4 4425 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)F 1626a_100000174882_100000185753 [0,1,0,0,1,0|1,0,1]=4 4426 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)F 240690a_100000174882_100000185753 [0,1,0,0,1,0|1,0,1]=4 4427 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)F 527a_100000174882_100000185753 [0,1,0,0,1,0|1,0,1]=4 4428 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)I 11a_100016989417_100000185753 [0,1,0,0,1,0|1,0,1]=4 4429 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)I 1626a_100016989417_100000185753 [0,1,0,0,1,0|1,0,1]=4 4430 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)I 240690a_100016989417_100000185753 [0,1,0,0,1,0|1,0,1]=4 4431 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)I 527a_100016989417_100000185753 [0,1,0,0,1,0|1,0,1]=4 4432 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)O 240690a_100000185549_100000185753 [0,1,0,0,1,0|1,0,1]=4 4433 B20R2.4449 O=C(CCc1ccccc1)NCc2ccc(cc2)O 527a_100000185549_100000185753 [0,1,0,0,1,0|1,0,1]=4 4434 B20R2.4449 O=C(CCc1ccccc1)NNc2ccc(cc2)Br 22a_100000735608_100000185753 [0,1,0,0,1,0|2,0,0]=4 4435 B20R2.4449 O=C(CCc1ccccc1)NNc2ccc(cc2)Cl 22a_100000683521_100000185753 [0,1,0,0,1,0|2,0,0]=4 4436 B20R2.4449 O=C(CCc1ccccc1)NNc2ccc(cc2)F 22a_100000728448_100000185753 [0,1,0,0,1,0|2,0,0]=4 4437 B20R2.4449 O=C(CCc1ccccc1)NNc2ccc(cc2)I 22a_100016988836_100000185753 [0,1,0,0,1,0|2,0,0]=4 4438 B20R2.4449 O=C(CNc1ccc(cc1)Br)OCc2ccccc2 2230a_100000210018_100000753625 [0,1,0,0,1,0|1,0,1]=4 4439 B20R2.4449 O=C(CNc1ccc(cc1)Br)OCc2ccccc2 34a_100000210018_100000753625 [0,1,0,0,1,0|1,0,1]=4 4440 B20R2.4449 O=C(CNc1ccc(cc1)Cl)OCc2ccccc2 2230a_100000210052_100000753625 [0,1,0,0,1,0|1,0,1]=4 4441 B20R2.4449 O=C(CNc1ccc(cc1)Cl)OCc2ccccc2 34a_100000210052_100000753625 [0,1,0,0,1,0|1,0,1]=4 4442 B20R2.4449 O=C(CNc1ccc(cc1)F)OCc2ccccc2 34a_100000185862_100000753625 [0,1,0,0,1,0|1,0,1]=4 4443 B20R2.4449 O=C(CNc1ccc(cc1)I)OCc2ccccc2 34a_100000185761_100000753625 [0,1,0,0,1,0|1,0,1]=4 4444 B20R2.4449 O=C(CNc1ccc(cc1)O)OCc2ccccc2 34a_100000185829_100000753625 [0,1,0,0,1,0|1,0,1]=4 4445 B20R2.4449 O=C(COc1ccc(cc1)Br)OCc2ccccc2 34a_100000185759_100000753625 [0,1,0,0,1,0|1,0,1]=4 4446 B20R2.4449 O=C(COc1ccc(cc1)Br)OCc2ccccc2 7a_100000185759_100000753625 [0,1,0,0,1,0|1,0,1]=4 4447 B20R2.4449 O=C(COc1ccc(cc1)Cl)OCc2ccccc2 34a_100000210216_100000753625 [0,1,0,0,1,0|1,0,1]=4 4448 B20R2.4449 O=C(COc1ccc(cc1)Cl)OCc2ccccc2 7a_100000210216_100000753625 [0,1,0,0,1,0|1,0,1]=4 4449 B20R2.4449 O=C(COc1ccc(cc1)F)OCc2ccccc2 34a_100000210339_100000753625 [0,1,0,0,1,0|1,0,1]=4 4450 B20R2.4449 O=C(COc1ccc(cc1)I)OCc2ccccc2 34a_100000212066_100000753625 [0,1,0,0,1,0|1,0,1]=4 4451 B20R2.4449 O=C(COc1ccc(cc1)I)OCc2ccccc2 7a_100000212066_100000753625 [0,1,0,0,1,0|1,0,1]=4 4452 B20R2.4449 O=C(CSc1ccc(cc1)Br)OCc2ccccc2 62a_100000752885_100000753625 [0,1,0,0,1,0|1,0,1]=4 4453 B20R2.4449 O=C(CSc1ccc(cc1)Br)OCc2ccccc2 62a_100000753625_100000752885 [0,1,0,0,1,0|1,0,1]=4 4454 B20R2.4449 O=C(CSc1ccc(cc1)Cl)OCc2ccccc2 62a_100000753625_100000755918 [0,1,0,0,1,0|1,0,1]=4 4455 B20R2.4449 O=C(CSc1ccc(cc1)Cl)OCc2ccccc2 62a_100000755918_100000753625 [0,1,0,0,1,0|1,0,1]=4 4456 B20R2.4449 O=C(CSc1ccc(cc1)F)OCc2ccccc2 62a_100000211213_100000753625 [0,1,0,0,1,0|1,0,1]=4 4457 B20R2.4449 O=C(CSc1ccc(cc1)F)OCc2ccccc2 62a_100000753625_100000211213 [0,1,0,0,1,0|1,0,1]=4 4458 B20R2.4449 O=C(CSc1ccc(cc1)O)OCc2ccccc2 62a_100000753625_100000185759 [0,1,0,0,1,0|1,0,1]=4 4459 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2 11a_100011934566_100000210462 [0,1,0,0,1,0|2,0,0]=4 4460 B20R2.4658 Cc1cc(ccn1)CNC(=O)C=Cc2ccccc2 1626a_100011934566_100000210462 [0,1,0,0,1,0|2,0,0]=4 4461 B20R2.4658 Cc1cccc(c1)C#CC(=O)CCc2ccccc2 1458a_100011892726_100000765856 [0,1,0,0,1,0|0,0,2]=4 4462 B20R2.4658 Cc1cccc(c1)C=CC(=O)CCc2ccccc2 1458a_100000690095_100000765856 [0,1,0,0,1,0|0,0,0]=2 4463 B20R2.4658 Cc1cccc(c1)C=CC(=O)CCc2ccccn2 1458a_100000690095_100015183660 [0,1,0,0,1,0|1,0,0]=3 4464 B20R2.4658 Cc1cccc(c1)C=CC(=O)CCc2cccnc2 1458a_100000690095_200011713674 [0,1,0,0,1,0|1,0,0]=3 4465 B20R2.4658 Cc1cccc(c1)C=CC(=O)CCc2ccncc2 1458a_100000690095_100000723409 [0,1,0,0,1,0|1,0,0]=3 4466 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccc2 11a_100015324214_100000690095 [0,1,0,0,1,0|1,0,0]=3 4467 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccc2 1626a_100015324214_100000690095 [0,1,0,0,1,0|1,0,0]=3 4468 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccc2 240690a_100015324214_100000690095 [0,1,0,0,1,0|1,0,0]=3 4469 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccn2 11a_100000210449_100000690095 [0,1,0,0,1,0|2,0,0]=4 4470 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccn2 1626a_100000210449_100000690095 [0,1,0,0,1,0|2,0,0]=4 4471 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccccn2 240690a_100000210449_100000690095 [0,1,0,0,1,0|2,0,0]=4 4472 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cccnc2 11a_100000210453_100000690095 [0,1,0,0,1,0|2,0,0]=4 4473 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2cccnc2 240690a_100000210453_100000690095 [0,1,0,0,1,0|2,0,0]=4 4474 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccncc2 11a_100000210450_100000690095 [0,1,0,0,1,0|2,0,0]=4 4475 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccncc2 1626a_100000210450_100000690095 [0,1,0,0,1,0|2,0,0]=4 4476 B20R2.4658 Cc1cccc(c1)C=CC(=O)NCc2ccncc2 240690a_100000210450_100000690095 [0,1,0,0,1,0|2,0,0]=4 4477 B20R2.4658 Cc1cccc(c1)C=CC(=O)NNc2ccccc2 22a_100015195140_100000690095 [0,1,0,0,1,0|2,0,0]=4 4478 B20R2.4658 Cc1cccc(c1)CCC(=O)C#Cc2ccccc2 1458a_100000736102_100011713685 [0,1,0,0,1,0|0,0,2]=4 4479 B20R2.4658 Cc1cccc(c1)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100011713685 [0,1,0,0,1,0|0,0,0]=2 4480 B20R2.4658 Cc1cccc(c1)CCC(=O)C=Cc2ccccn2 1458a_100000740811_100011713685 [0,1,0,0,1,0|1,0,0]=3 4481 B20R2.4658 Cc1cccc(c1)CCC(=O)C=Cc2cccnc2 1458a_100000735890_100011713685 [0,1,0,0,1,0|1,0,0]=3 4482 B20R2.4658 Cc1cccc(c1)CCC(=O)C=Cc2ccncc2 1458a_100000682801_100011713685 [0,1,0,0,1,0|1,0,0]=3 4483 B20R2.4658 Cc1cccc(c1)CCC(=O)CCc2ccccc2 1458a_100000185753_100011713685 [0,1,0,0,1,0|0,0,2]=4 4484 B20R2.4658 Cc1cccc(c1)CCC(=O)CCc2ccccc2 1458a_100000234952_100000765856 [0,1,0,0,1,0|0,0,2]=4 4485 B20R2.4658 Cc1cccc(c1)CCC(=O)COc2ccccc2 1458a_100000186222_100011713685 [0,1,0,0,1,0|1,0,1]=4 4486 B20R2.4658 Cc1cccc(c1)CCC(=O)CSc2ccccc2 1458a_100000211596_100011713685 [0,1,0,0,1,0|1,0,1]=4 4487 B20R2.4658 Cc1cccc(c1)CCC(=O)NCc2ccccc2 11a_100015324214_100000234952 [0,1,0,0,1,0|1,0,1]=4 4488 B20R2.4658 Cc1cccc(c1)CCC(=O)NCc2ccccc2 1626a_100015324214_100000234952 [0,1,0,0,1,0|1,0,1]=4 4489 B20R2.4658 Cc1cccc(c1)CCC(=O)NCc2ccccc2 240690a_100015324214_100000234952 [0,1,0,0,1,0|1,0,1]=4 4490 B20R2.4658 Cc1cccc(c1)CCC(=O)NCc2ccccc2 527a_100015324214_100000234952 [0,1,0,0,1,0|1,0,1]=4 4491 B20R2.4658 Cc1cccc(c1)CCC(=O)NNc2ccccc2 22a_100015195140_100000234952 [0,1,0,0,1,0|2,0,0]=4 4492 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2 11a_100000185548_100000210462 [0,1,0,0,1,0|1,0,0]=3 4493 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccccc2 1626a_100000185548_100000210462 [0,1,0,0,1,0|1,0,0]=3 4494 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccccn2 11a_100000185548_100000740811 [0,1,0,0,1,0|2,0,0]=4 4495 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccccn2 240690a_100000185548_100000740811 [0,1,0,0,1,0|2,0,0]=4 4496 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2cccnc2 11a_100000185548_100000735890 [0,1,0,0,1,0|2,0,0]=4 4497 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2cccnc2 240690a_100000185548_100000735890 [0,1,0,0,1,0|2,0,0]=4 4498 B20R2.4658 Cc1cccc(c1)CNC(=O)C=Cc2ccncc2 240690a_100000185548_100000682801 [0,1,0,0,1,0|2,0,0]=4 4499 B20R2.4658 Cc1cccc(c1)CNC(=O)CCc2ccccc2 11a_100000185548_100000185753 [0,1,0,0,1,0|1,0,1]=4 4500 B20R2.4658 Cc1cccc(c1)CNC(=O)CCc2ccccc2 1626a_100000185548_100000185753 [0,1,0,0,1,0|1,0,1]=4 4501 B20R2.4658 Cc1cccc(c1)CNC(=O)CCc2ccccc2 240690a_100000185548_100000185753 [0,1,0,0,1,0|1,0,1]=4 4502 B20R2.4658 Cc1cccc(c1)CNC(=O)CCc2ccccc2 527a_100000185548_100000185753 [0,1,0,0,1,0|1,0,1]=4 4503 B20R2.4658 Cc1cccc(c1)NCC(=O)CCc2ccccc2 2230a_100000188690_100012361361 [0,1,0,0,1,0|1,0,1]=4 4504 B20R2.4658 Cc1cccc(c1)NCC(=O)CCc2ccccc2 34a_100000188690_100012361361 [0,1,0,0,1,0|1,0,1]=4 4505 B20R2.4658 Cc1cccc(c1)NCC(=O)OCc2ccccc2 2230a_100000188690_100000753625 [0,1,0,0,1,0|1,0,1]=4 4506 B20R2.4658 Cc1cccc(c1)NCC(=O)OCc2ccccc2 34a_100000188690_100000753625 [0,1,0,0,1,0|1,0,1]=4 4507 B20R2.4658 Cc1cccc(c1)NNC(=O)C=Cc2ccccc2 22a_100000681630_100000210462 [0,1,0,0,1,0|2,0,0]=4 4508 B20R2.4658 Cc1cccc(c1)NNC(=O)CCc2ccccc2 22a_100000681630_100000185753 [0,1,0,0,1,0|2,0,0]=4 4509 B20R2.4658 Cc1cccc(c1)OCC(=O)CCc2ccccc2 1458a_100000183606_100000765856 [0,1,0,0,1,0|1,0,1]=4 4510 B20R2.4658 Cc1cccc(c1)OCC(=O)CCc2ccccc2 34a_100000210337_100012361361 [0,1,0,0,1,0|1,0,1]=4 4511 B20R2.4658 Cc1cccc(c1)OCC(=O)CCc2ccccc2 7a_100000210337_100012361361 [0,1,0,0,1,0|1,0,1]=4 4512 B20R2.4658 Cc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000210337_100000753625 [0,1,0,0,1,0|1,0,1]=4 4513 B20R2.4658 Cc1cccc(c1)OCC(=O)OCc2ccccc2 7a_100000210337_100000753625 [0,1,0,0,1,0|1,0,1]=4 4514 B20R2.4658 Cc1cccc(c1)SCC(=O)CCc2ccccc2 62a_100011215228_100012361361 [0,1,0,0,1,0|1,0,1]=4 4515 B20R2.4658 Cc1cccc(c1)SCC(=O)CCc2ccccc2 62a_100012361361_100011215228 [0,1,0,0,1,0|1,0,1]=4 4516 B20R2.4658 Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100011215228 [0,1,0,0,1,0|1,0,1]=4 4517 B20R2.4658 Cc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100011215228_100000753625 [0,1,0,0,1,0|1,0,1]=4 4518 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2 11a_100000701342_100000210462 [0,1,0,0,1,0|2,0,0]=4 4519 B20R2.4658 Cc1cccc(n1)CNC(=O)C=Cc2ccccc2 1626a_100000701342_100000210462 [0,1,0,0,1,0|2,0,0]=4 4520 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2 11a_100011934573_100000210462 [0,1,0,0,1,0|2,0,0]=4 4521 B20R2.4658 Cc1ccnc(c1)CNC(=O)C=Cc2ccccc2 1626a_100011934573_100000210462 [0,1,0,0,1,0|2,0,0]=4 4522 B20R2.4658 Cc1cncc(c1)C=CC(=O)CCc2ccccc2 6a_100011998712_100000210092 [0,1,0,0,1,0|1,0,0]=3 4523 B20R2.4658 Cc1cncc(c1)C=CC(=O)COc2ccccc2 6a_100011998712_100000150576 [0,1,0,0,1,0|2,0,0]=4 4524 B20R2.4658 Cc1cncc(c1)C=CC(=O)CSc2ccccc2 6a_100011998712_100000150717 [0,1,0,0,1,0|2,0,0]=4 4525 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2 11a_100000692839_100000210462 [0,1,0,0,1,0|2,0,0]=4 4526 B20R2.4658 Cc1cncc(c1)CNC(=O)C=Cc2ccccc2 1626a_100000692839_100000210462 [0,1,0,0,1,0|2,0,0]=4 4527 B20R2.4658 Cc1cncc(n1)C=CC(=O)CCc2ccccc2 6a_100000100294_100000210092 [0,1,0,0,1,0|2,0,0]=4 4528 B20R2.4658 Nc1cccc(c1)OCC(=O)CCc2ccccc2 34a_100000210217_100012361361 [0,1,0,0,1,0|1,0,1]=4 4529 B20R2.4658 Nc1cccc(c1)OCC(=O)OCc2ccccc2 34a_100000210217_100000753625 [0,1,0,0,1,0|1,0,1]=4 4530 B20R2.4658 Nc1cccc(c1)SCC(=O)CCc2ccccc2 62a_100000210019_100012361361 [0,1,0,0,1,0|1,0,1]=4 4531 B20R2.4658 Nc1cccc(c1)SCC(=O)CCc2ccccc2 62a_100012361361_100000210019 [0,1,0,0,1,0|1,0,1]=4 4532 B20R2.4658 Nc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000210019_100000753625 [0,1,0,0,1,0|1,0,1]=4 4533 B20R2.4658 Nc1cccc(c1)SCC(=O)OCc2ccccc2 62a_100000753625_100000210019 [0,1,0,0,1,0|1,0,1]=4 4534 B20R2.4658 O=C(C#Cc1cccc(c1)Br)CCc2ccccc2 1458a_100012100324_100000765856 [0,1,0,0,1,0|0,0,2]=4 4535 B20R2.4658 O=C(C#Cc1cccc(c1)Cl)CCc2ccccc2 1458a_100011892777_100000765856 [0,1,0,0,1,0|0,0,2]=4 4536 B20R2.4658 O=C(C#Cc1cccc(c1)F)CCc2ccccc2 1458a_100011892744_100000765856 [0,1,0,0,1,0|0,0,2]=4 4537 B20R2.4658 O=C(C#Cc1cccc(c1)O)CCc2ccccc2 1458a_200009909484_100000765856 [0,1,0,0,1,0|0,0,2]=4 4538 B20R2.4658 O=C(C#Cc1ccccc1)CCc2cccc(c2)Br 1458a_100000736102_100011740638 [0,1,0,0,1,0|0,0,2]=4 4539 B20R2.4658 O=C(C#Cc1ccccc1)CCc2cccc(c2)Cl 1458a_100000736102_100011713710 [0,1,0,0,1,0|0,0,2]=4 4540 B20R2.4658 O=C(C#Cc1ccccc1)CCc2cccc(c2)F 1458a_100000736102_100011217235 [0,1,0,0,1,0|0,0,2]=4 4541 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2ccccc2 1458a_100016258244_100000765856 [0,1,0,0,1,0|0,0,0]=2 4542 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2ccccc2 6a_100000210085_100000210092 [0,1,0,0,1,0|0,0,0]=2 4543 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2ccccn2 1458a_100016258244_100015183660 [0,1,0,0,1,0|1,0,0]=3 4544 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2cccnc2 1458a_100016258244_200011713674 [0,1,0,0,1,0|1,0,0]=3 4545 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CCc2ccncc2 1458a_100016258244_100000723409 [0,1,0,0,1,0|1,0,0]=3 4546 B20R2.4658 O=C(C=Cc1cccc(c1)Br)COc2ccccc2 6a_100000210085_100000150576 [0,1,0,0,1,0|1,0,0]=3 4547 B20R2.4658 O=C(C=Cc1cccc(c1)Br)CSc2ccccc2 6a_100000210085_100000150717 [0,1,0,0,1,0|1,0,0]=3 4548 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2 11a_100015324214_100016258244 [0,1,0,0,1,0|1,0,0]=3 4549 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2 1626a_100015324214_100016258244 [0,1,0,0,1,0|1,0,0]=3 4550 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccc2 240690a_100015324214_100016258244 [0,1,0,0,1,0|1,0,0]=3 4551 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccn2 11a_100000210449_100016258244 [0,1,0,0,1,0|2,0,0]=4 4552 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccn2 1626a_100000210449_100016258244 [0,1,0,0,1,0|2,0,0]=4 4553 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccccn2 240690a_100000210449_100016258244 [0,1,0,0,1,0|2,0,0]=4 4554 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2 11a_100000210453_100016258244 [0,1,0,0,1,0|2,0,0]=4 4555 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2cccnc2 240690a_100000210453_100016258244 [0,1,0,0,1,0|2,0,0]=4 4556 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2 11a_100000210450_100016258244 [0,1,0,0,1,0|2,0,0]=4 4557 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2 1626a_100000210450_100016258244 [0,1,0,0,1,0|2,0,0]=4 4558 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NCc2ccncc2 240690a_100000210450_100016258244 [0,1,0,0,1,0|2,0,0]=4 4559 B20R2.4658 O=C(C=Cc1cccc(c1)Br)NNc2ccccc2 22a_100015195140_100016258244 [0,1,0,0,1,0|2,0,0]=4 4560 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)CCc2ccccc2 1458a_100000184502_100000765856 [0,1,0,0,1,0|0,0,0]=2 4561 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)CCc2ccccn2 1458a_100000184502_100015183660 [0,1,0,0,1,0|1,0,0]=3 4562 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)CCc2cccnc2 1458a_100000184502_200011713674 [0,1,0,0,1,0|1,0,0]=3 4563 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)CCc2ccncc2 1458a_100000184502_100000723409 [0,1,0,0,1,0|1,0,0]=3 4564 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2 11a_100015324214_100000184502 [0,1,0,0,1,0|1,0,0]=3 4565 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2 1626a_100015324214_100000184502 [0,1,0,0,1,0|1,0,0]=3 4566 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccc2 240690a_100015324214_100000184502 [0,1,0,0,1,0|1,0,0]=3 4567 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccn2 11a_100000210449_100000184502 [0,1,0,0,1,0|2,0,0]=4 4568 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccn2 1626a_100000210449_100000184502 [0,1,0,0,1,0|2,0,0]=4 4569 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccccn2 240690a_100000210449_100000184502 [0,1,0,0,1,0|2,0,0]=4 4570 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2 11a_100000210453_100000184502 [0,1,0,0,1,0|2,0,0]=4 4571 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2cccnc2 240690a_100000210453_100000184502 [0,1,0,0,1,0|2,0,0]=4 4572 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2 11a_100000210450_100000184502 [0,1,0,0,1,0|2,0,0]=4 4573 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2 1626a_100000210450_100000184502 [0,1,0,0,1,0|2,0,0]=4 4574 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NCc2ccncc2 240690a_100000210450_100000184502 [0,1,0,0,1,0|2,0,0]=4 4575 B20R2.4658 O=C(C=Cc1cccc(c1)Cl)NNc2ccccc2 22a_100015195140_100000184502 [0,1,0,0,1,0|2,0,0]=4 4576 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2ccccc2 1458a_100000718793_100000765856 [0,1,0,0,1,0|0,0,0]=2 4577 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2ccccc2 6a_100000210812_100000210092 [0,1,0,0,1,0|0,0,0]=2 4578 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2ccccn2 1458a_100000718793_100015183660 [0,1,0,0,1,0|1,0,0]=3 4579 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2cccnc2 1458a_100000718793_200011713674 [0,1,0,0,1,0|1,0,0]=3 4580 B20R2.4658 O=C(C=Cc1cccc(c1)F)CCc2ccncc2 1458a_100000718793_100000723409 [0,1,0,0,1,0|1,0,0]=3 4581 B20R2.4658 O=C(C=Cc1cccc(c1)F)COc2ccccc2 6a_100000210812_100000150576 [0,1,0,0,1,0|1,0,0]=3 4582 B20R2.4658 O=C(C=Cc1cccc(c1)F)CSc2ccccc2 6a_100000210812_100000150717 [0,1,0,0,1,0|1,0,0]=3 4583 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccc2 11a_100015324214_100000718793 [0,1,0,0,1,0|1,0,0]=3 4584 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccc2 1626a_100015324214_100000718793 [0,1,0,0,1,0|1,0,0]=3 4585 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccc2 240690a_100015324214_100000718793 [0,1,0,0,1,0|1,0,0]=3 4586 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccn2 11a_100000210449_100000718793 [0,1,0,0,1,0|2,0,0]=4 4587 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccn2 1626a_100000210449_100000718793 [0,1,0,0,1,0|2,0,0]=4 4588 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccccn2 240690a_100000210449_100000718793 [0,1,0,0,1,0|2,0,0]=4 4589 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cccnc2 11a_100000210453_100000718793 [0,1,0,0,1,0|2,0,0]=4 4590 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2cccnc2 240690a_100000210453_100000718793 [0,1,0,0,1,0|2,0,0]=4 4591 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccncc2 11a_100000210450_100000718793 [0,1,0,0,1,0|2,0,0]=4 4592 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccncc2 1626a_100000210450_100000718793 [0,1,0,0,1,0|2,0,0]=4 4593 B20R2.4658 O=C(C=Cc1cccc(c1)F)NCc2ccncc2 240690a_100000210450_100000718793 [0,1,0,0,1,0|2,0,0]=4 4594 B20R2.4658 O=C(C=Cc1cccc(c1)F)NNc2ccccc2 22a_100015195140_100000718793 [0,1,0,0,1,0|2,0,0]=4 4595 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2ccccc2 1458a_100020647043_100000765856 [0,1,0,0,1,0|0,0,0]=2 4596 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2ccccc2 6a_100000014684_100000210092 [0,1,0,0,1,0|0,0,0]=2 4597 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2ccccn2 1458a_100020647043_100015183660 [0,1,0,0,1,0|1,0,0]=3 4598 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2cccnc2 1458a_100020647043_200011713674 [0,1,0,0,1,0|1,0,0]=3 4599 B20R2.4658 O=C(C=Cc1cccc(c1)I)CCc2ccncc2 1458a_100020647043_100000723409 [0,1,0,0,1,0|1,0,0]=3 4600 B20R2.4658 O=C(C=Cc1cccc(c1)I)COc2ccccc2 6a_100000014684_100000150576 [0,1,0,0,1,0|1,0,0]=3 4601 B20R2.4658 O=C(C=Cc1cccc(c1)I)CSc2ccccc2 6a_100000014684_100000150717 [0,1,0,0,1,0|1,0,0]=3 4602 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccc2 11a_100015324214_100020647043 [0,1,0,0,1,0|1,0,0]=3 4603 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccc2 1626a_100015324214_100020647043 [0,1,0,0,1,0|1,0,0]=3 4604 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccc2 240690a_100015324214_100020647043 [0,1,0,0,1,0|1,0,0]=3 4605 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccn2 11a_100000210449_100020647043 [0,1,0,0,1,0|2,0,0]=4 4606 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccn2 1626a_100000210449_100020647043 [0,1,0,0,1,0|2,0,0]=4 4607 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccccn2 240690a_100000210449_100020647043 [0,1,0,0,1,0|2,0,0]=4 4608 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cccnc2 11a_100000210453_100020647043 [0,1,0,0,1,0|2,0,0]=4 4609 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2cccnc2 240690a_100000210453_100020647043 [0,1,0,0,1,0|2,0,0]=4 4610 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccncc2 11a_100000210450_100020647043 [0,1,0,0,1,0|2,0,0]=4 4611 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccncc2 1626a_100000210450_100020647043 [0,1,0,0,1,0|2,0,0]=4 4612 B20R2.4658 O=C(C=Cc1cccc(c1)I)NCc2ccncc2 240690a_100000210450_100020647043 [0,1,0,0,1,0|2,0,0]=4 4613 B20R2.4658 O=C(C=Cc1cccc(c1)I)NNc2ccccc2 22a_100015195140_100020647043 [0,1,0,0,1,0|2,0,0]=4 4614 B20R2.4658 O=C(C=Cc1cccc(c1)O)NNc2ccccc2 22a_100015195140_100102525460 [0,1,0,0,1,0|2,0,0]=4 4615 B20R2.4658 O=C(C=Cc1ccccc1)CCc2cccc(c2)Br 1458a_100000210462_100011740638 [0,1,0,0,1,0|0,0,0]=2 4616 B20R2.4658 O=C(C=Cc1ccccc1)CCc2cccc(c2)Cl 1458a_100000210462_100011713710 [0,1,0,0,1,0|0,0,0]=2 4617 B20R2.4658 O=C(C=Cc1ccccc1)CCc2cccc(c2)F 1458a_100000210462_100011217235 [0,1,0,0,1,0|0,0,0]=2 4618 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cc(ccn2)Br 11a_100009818019_100000210462 [0,1,0,0,1,0|2,0,0]=4 4619 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cc(ccn2)Br 1626a_100009818019_100000210462 [0,1,0,0,1,0|2,0,0]=4 4620 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cc(ccn2)Cl 11a_100000085674_100000210462 [0,1,0,0,1,0|2,0,0]=4 4621 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cc(ccn2)Cl 1626a_100000085674_100000210462 [0,1,0,0,1,0|2,0,0]=4 4622 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(=O)[nH]2 11a_100000696482_100000210462 [0,1,0,0,1,0|2,0,0]=4 4623 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(=O)[nH]2 1626a_100000696482_100000210462 [0,1,0,0,1,0|2,0,0]=4 4624 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100000210462 [0,1,0,0,1,0|1,0,0]=3 4625 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100000210462 [0,1,0,0,1,0|1,0,0]=3 4626 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100000210462 [0,1,0,0,1,0|1,0,0]=3 4627 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100000210462 [0,1,0,0,1,0|1,0,0]=3 4628 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100000210462 [0,1,0,0,1,0|1,0,0]=3 4629 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100000210462 [0,1,0,0,1,0|1,0,0]=3 4630 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100000210462 [0,1,0,0,1,0|1,0,0]=3 4631 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100000210462 [0,1,0,0,1,0|1,0,0]=3 4632 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)Br 11a_100016987751_100000210462 [0,1,0,0,1,0|2,0,0]=4 4633 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)Br 1626a_100016987751_100000210462 [0,1,0,0,1,0|2,0,0]=4 4634 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)Cl 11a_100016990191_100000210462 [0,1,0,0,1,0|2,0,0]=4 4635 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)Cl 1626a_100016990191_100000210462 [0,1,0,0,1,0|2,0,0]=4 4636 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)F 11a_100015188798_100000210462 [0,1,0,0,1,0|2,0,0]=4 4637 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cccc(n2)F 1626a_100015188798_100000210462 [0,1,0,0,1,0|2,0,0]=4 4638 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)Br 11a_100025757509_100000210462 [0,1,0,0,1,0|2,0,0]=4 4639 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)Cl 11a_100015205668_100000210462 [0,1,0,0,1,0|2,0,0]=4 4640 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)Cl 1626a_100015205668_100000210462 [0,1,0,0,1,0|2,0,0]=4 4641 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)F 11a_100015188774_100000210462 [0,1,0,0,1,0|2,0,0]=4 4642 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)F 1626a_100015188774_100000210462 [0,1,0,0,1,0|2,0,0]=4 4643 B20R2.4658 O=C(C=Cc1ccccc1)NCc2ccnc(c2)O 11a_100000748557_100000210462 [0,1,0,0,1,0|2,0,0]=4 4644 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)Br 11a_100011249555_100000210462 [0,1,0,0,1,0|2,0,0]=4 4645 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)Cl 11a_200020614424_100000210462 [0,1,0,0,1,0|2,0,0]=4 4646 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)Cl 1626a_200020614424_100000210462 [0,1,0,0,1,0|2,0,0]=4 4647 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)F 11a_100011962886_100000210462 [0,1,0,0,1,0|2,0,0]=4 4648 B20R2.4658 O=C(C=Cc1ccccc1)NCc2cncc(c2)F 1626a_100011962886_100000210462 [0,1,0,0,1,0|2,0,0]=4 4649 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(c2)Br 22a_100000217339_100000210462 [0,1,0,0,1,0|2,0,0]=4 4650 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(c2)Cl 22a_100000184277_100000210462 [0,1,0,0,1,0|2,0,0]=4 4651 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(c2)F 22a_100000745080_100000210462 [0,1,0,0,1,0|2,0,0]=4 4652 B20R2.4658 O=C(C=Cc1ccccc1)NNc2cccc(c2)I 22a_100020605690_100000210462 [0,1,0,0,1,0|2,0,0]=4 4653 B20R2.4658 O=C(C=Cc1ccccn1)CCc2cccc(c2)Br 1458a_100000740811_100011740638 [0,1,0,0,1,0|1,0,0]=3 4654 B20R2.4658 O=C(C=Cc1ccccn1)CCc2cccc(c2)Cl 1458a_100000740811_100011713710 [0,1,0,0,1,0|1,0,0]=3 4655 B20R2.4658 O=C(C=Cc1ccccn1)CCc2cccc(c2)F 1458a_100000740811_100011217235 [0,1,0,0,1,0|1,0,0]=3 4656 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)Br 11a_100000174977_100000740811 [0,1,0,0,1,0|2,0,0]=4 4657 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)Br 240690a_100000174977_100000740811 [0,1,0,0,1,0|2,0,0]=4 4658 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)Cl 11a_100000174878_100000740811 [0,1,0,0,1,0|2,0,0]=4 4659 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)Cl 240690a_100000174878_100000740811 [0,1,0,0,1,0|2,0,0]=4 4660 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)F 11a_100000174948_100000740811 [0,1,0,0,1,0|2,0,0]=4 4661 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)F 240690a_100000174948_100000740811 [0,1,0,0,1,0|2,0,0]=4 4662 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)I 11a_100000106179_100000740811 [0,1,0,0,1,0|2,0,0]=4 4663 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)I 240690a_100000106179_100000740811 [0,1,0,0,1,0|2,0,0]=4 4664 B20R2.4658 O=C(C=Cc1ccccn1)NCc2cccc(c2)O 240690a_100000743036_100000740811 [0,1,0,0,1,0|2,0,0]=4 4665 B20R2.4658 O=C(C=Cc1cccnc1)CCc2cccc(c2)Br 1458a_100000735890_100011740638 [0,1,0,0,1,0|1,0,0]=3 4666 B20R2.4658 O=C(C=Cc1cccnc1)CCc2cccc(c2)Cl 1458a_100000735890_100011713710 [0,1,0,0,1,0|1,0,0]=3 4667 B20R2.4658 O=C(C=Cc1cccnc1)CCc2cccc(c2)F 1458a_100000735890_100011217235 [0,1,0,0,1,0|1,0,0]=3 4668 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Br 11a_100000174977_100000735890 [0,1,0,0,1,0|2,0,0]=4 4669 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Br 240690a_100000174977_100000735890 [0,1,0,0,1,0|2,0,0]=4 4670 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Cl 11a_100000174878_100000735890 [0,1,0,0,1,0|2,0,0]=4 4671 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)Cl 240690a_100000174878_100000735890 [0,1,0,0,1,0|2,0,0]=4 4672 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)F 11a_100000174948_100000735890 [0,1,0,0,1,0|2,0,0]=4 4673 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)F 240690a_100000174948_100000735890 [0,1,0,0,1,0|2,0,0]=4 4674 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)I 11a_100000106179_100000735890 [0,1,0,0,1,0|2,0,0]=4 4675 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)I 240690a_100000106179_100000735890 [0,1,0,0,1,0|2,0,0]=4 4676 B20R2.4658 O=C(C=Cc1cccnc1)NCc2cccc(c2)O 240690a_100000743036_100000735890 [0,1,0,0,1,0|2,0,0]=4 4677 B20R2.4658 O=C(C=Cc1ccncc1)CCc2cccc(c2)Br 1458a_100000682801_100011740638 [0,1,0,0,1,0|1,0,0]=3 4678 B20R2.4658 O=C(C=Cc1ccncc1)CCc2cccc(c2)Cl 1458a_100000682801_100011713710 [0,1,0,0,1,0|1,0,0]=3 4679 B20R2.4658 O=C(C=Cc1ccncc1)CCc2cccc(c2)F 1458a_100000682801_100011217235 [0,1,0,0,1,0|1,0,0]=3 4680 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)Br 240690a_100000174977_100000682801 [0,1,0,0,1,0|2,0,0]=4 4681 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)Cl 240690a_100000174878_100000682801 [0,1,0,0,1,0|2,0,0]=4 4682 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)F 240690a_100000174948_100000682801 [0,1,0,0,1,0|2,0,0]=4 4683 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)I 240690a_100000106179_100000682801 [0,1,0,0,1,0|2,0,0]=4 4684 B20R2.4658 O=C(C=Cc1ccncc1)NCc2cccc(c2)O 240690a_100000743036_100000682801 [0,1,0,0,1,0|2,0,0]=4 4685 B20R2.4658 O=C(C=Cc1cncc(c1)Br)CCc2ccccc2 6a_100000687066_100000210092 [0,1,0,0,1,0|1,0,0]=3 4686 B20R2.4658 O=C(C=Cc1cncc(c1)Br)COc2ccccc2 6a_100000687066_100000150576 [0,1,0,0,1,0|2,0,0]=4 4687 B20R2.4658 O=C(C=Cc1cncc(c1)Br)CSc2ccccc2 6a_100000687066_100000150717 [0,1,0,0,1,0|2,0,0]=4 4688 B20R2.4658 O=C(C=Cc1cncc(c1)Cl)CCc2ccccc2 6a_100000088910_100000210092 [0,1,0,0,1,0|1,0,0]=3 4689 B20R2.4658 O=C(C=Cc1cncc(c1)Cl)COc2ccccc2 6a_100000088910_100000150576 [0,1,0,0,1,0|2,0,0]=4 4690 B20R2.4658 O=C(C=Cc1cncc(c1)Cl)CSc2ccccc2 6a_100000088910_100000150717 [0,1,0,0,1,0|2,0,0]=4 4691 B20R2.4658 O=C(C=Cc1cncc(c1)F)CCc2ccccc2 6a_100011361476_100000210092 [0,1,0,0,1,0|1,0,0]=3 4692 B20R2.4658 O=C(C=Cc1cncc(c1)F)COc2ccccc2 6a_100011361476_100000150576 [0,1,0,0,1,0|2,0,0]=4 4693 B20R2.4658 O=C(C=Cc1cncc(c1)F)CSc2ccccc2 6a_100011361476_100000150717 [0,1,0,0,1,0|2,0,0]=4 4694 B20R2.4658 O=C(C=Cc1cncnc1)CCc2cccc(c2)Br 6a_100000749868_100011279149 [0,1,0,0,1,0|2,0,0]=4 4695 B20R2.4658 O=C(C=Cc1cncnc1)CCc2cccc(c2)F 6a_100000749868_100000743863 [0,1,0,0,1,0|2,0,0]=4 4696 B20R2.4658 O=C(CCc1cccc(c1)Br)COc2ccccc2 1458a_100000186222_100011740638 [0,1,0,0,1,0|1,0,1]=4 4697 B20R2.4658 O=C(CCc1cccc(c1)Br)CSc2ccccc2 1458a_100000211596_100011740638 [0,1,0,0,1,0|1,0,1]=4 4698 B20R2.4658 O=C(CCc1cccc(c1)Br)NCc2ccccc2 11a_100015324214_100000184314 [0,1,0,0,1,0|1,0,1]=4 4699 B20R2.4658 O=C(CCc1cccc(c1)Br)NCc2ccccc2 1626a_100015324214_100000184314 [0,1,0,0,1,0|1,0,1]=4 4700 B20R2.4658 O=C(CCc1cccc(c1)Br)NCc2ccccc2 240690a_100015324214_100000184314 [0,1,0,0,1,0|1,0,1]=4 4701 B20R2.4658 O=C(CCc1cccc(c1)Br)NCc2ccccc2 527a_100015324214_100000184314 [0,1,0,0,1,0|1,0,1]=4 4702 B20R2.4658 O=C(CCc1cccc(c1)Br)NNc2ccccc2 22a_100015195140_100000184314 [0,1,0,0,1,0|2,0,0]=4 4703 B20R2.4658 O=C(CCc1cccc(c1)Cl)COc2ccccc2 1458a_100000186222_100011713710 [0,1,0,0,1,0|1,0,1]=4 4704 B20R2.4658 O=C(CCc1cccc(c1)Cl)CSc2ccccc2 1458a_100000211596_100011713710 [0,1,0,0,1,0|1,0,1]=4 4705 B20R2.4658 O=C(CCc1cccc(c1)Cl)NCc2ccccc2 11a_100015324214_100000235675 [0,1,0,0,1,0|1,0,1]=4 4706 B20R2.4658 O=C(CCc1cccc(c1)Cl)NCc2ccccc2 1626a_100015324214_100000235675 [0,1,0,0,1,0|1,0,1]=4 4707 B20R2.4658 O=C(CCc1cccc(c1)Cl)NCc2ccccc2 240690a_100015324214_100000235675 [0,1,0,0,1,0|1,0,1]=4 4708 B20R2.4658 O=C(CCc1cccc(c1)Cl)NCc2ccccc2 527a_100015324214_100000235675 [0,1,0,0,1,0|1,0,1]=4 4709 B20R2.4658 O=C(CCc1cccc(c1)Cl)NNc2ccccc2 22a_100015195140_100000235675 [0,1,0,0,1,0|2,0,0]=4 4710 B20R2.4658 O=C(CCc1cccc(c1)F)COc2ccccc2 1458a_100000186222_100011217235 [0,1,0,0,1,0|1,0,1]=4 4711 B20R2.4658 O=C(CCc1cccc(c1)F)CSc2ccccc2 1458a_100000211596_100011217235 [0,1,0,0,1,0|1,0,1]=4 4712 B20R2.4658 O=C(CCc1cccc(c1)F)NCc2ccccc2 11a_100015324214_100000235673 [0,1,0,0,1,0|1,0,1]=4 4713 B20R2.4658 O=C(CCc1cccc(c1)F)NCc2ccccc2 1626a_100015324214_100000235673 [0,1,0,0,1,0|1,0,1]=4 4714 B20R2.4658 O=C(CCc1cccc(c1)F)NCc2ccccc2 240690a_100015324214_100000235673 [0,1,0,0,1,0|1,0,1]=4 4715 B20R2.4658 O=C(CCc1cccc(c1)F)NCc2ccccc2 527a_100015324214_100000235673 [0,1,0,0,1,0|1,0,1]=4 4716 B20R2.4658 O=C(CCc1cccc(c1)F)NNc2ccccc2 22a_100015195140_100000235673 [0,1,0,0,1,0|2,0,0]=4 4717 B20R2.4658 O=C(CCc1cccc(c1)I)NCc2ccccc2 11a_100015324214_100010007846 [0,1,0,0,1,0|1,0,1]=4 4718 B20R2.4658 O=C(CCc1cccc(c1)I)NCc2ccccc2 1626a_100015324214_100010007846 [0,1,0,0,1,0|1,0,1]=4 4719 B20R2.4658 O=C(CCc1cccc(c1)I)NCc2ccccc2 240690a_100015324214_100010007846 [0,1,0,0,1,0|1,0,1]=4 4720 B20R2.4658 O=C(CCc1cccc(c1)I)NCc2ccccc2 527a_100015324214_100010007846 [0,1,0,0,1,0|1,0,1]=4 4721 B20R2.4658 O=C(CCc1cccc(c1)I)NNc2ccccc2 22a_100015195140_100010007846 [0,1,0,0,1,0|2,0,0]=4 4722 B20R2.4658 O=C(CCc1cccc(c1)O)NCc2ccccc2 240690a_100015324214_100011216126 [0,1,0,0,1,0|1,0,1]=4 4723 B20R2.4658 O=C(CCc1cccc(c1)O)NCc2ccccc2 527a_100015324214_100011216126 [0,1,0,0,1,0|1,0,1]=4 4724 B20R2.4658 O=C(CCc1cccc(c1)O)NNc2ccccc2 22a_100015195140_100011216126 [0,1,0,0,1,0|2,0,0]=4 4725 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)Br 1458a_100000184314_100000765856 [0,1,0,0,1,0|0,0,2]=4 4726 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)Br 1458a_100000185753_100011740638 [0,1,0,0,1,0|0,0,2]=4 4727 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)Cl 1458a_100000185753_100011713710 [0,1,0,0,1,0|0,0,2]=4 4728 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)Cl 1458a_100000235675_100000765856 [0,1,0,0,1,0|0,0,2]=4 4729 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)F 1458a_100000185753_100011217235 [0,1,0,0,1,0|0,0,2]=4 4730 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)F 1458a_100000235673_100000765856 [0,1,0,0,1,0|0,0,2]=4 4731 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)I 1458a_100010007846_100000765856 [0,1,0,0,1,0|0,0,2]=4 4732 B20R2.4658 O=C(CCc1ccccc1)CCc2cccc(c2)O 1458a_100011216126_100000765856 [0,1,0,0,1,0|0,0,2]=4 4733 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)Br 34a_100000210019_100012361361 [0,1,0,0,1,0|1,0,1]=4 4734 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)Cl 34a_100000185859_100012361361 [0,1,0,0,1,0|1,0,1]=4 4735 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)F 34a_100000210047_100012361361 [0,1,0,0,1,0|1,0,1]=4 4736 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)I 34a_100000211102_100012361361 [0,1,0,0,1,0|1,0,1]=4 4737 B20R2.4658 O=C(CCc1ccccc1)CNc2cccc(c2)O 34a_100000210217_100012361361 [0,1,0,0,1,0|1,0,1]=4 4738 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Br 1458a_100000182359_100000765856 [0,1,0,0,1,0|1,0,1]=4 4739 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Br 34a_100000210342_100012361361 [0,1,0,0,1,0|1,0,1]=4 4740 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Br 7a_100000210342_100012361361 [0,1,0,0,1,0|1,0,1]=4 4741 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Cl 1458a_100000184978_100000765856 [0,1,0,0,1,0|1,0,1]=4 4742 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Cl 34a_100000210295_100012361361 [0,1,0,0,1,0|1,0,1]=4 4743 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)Cl 7a_100000210295_100012361361 [0,1,0,0,1,0|1,0,1]=4 4744 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)F 1458a_100000182781_100000765856 [0,1,0,0,1,0|1,0,1]=4 4745 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)F 34a_100000210426_100012361361 [0,1,0,0,1,0|1,0,1]=4 4746 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)F 7a_100000210426_100012361361 [0,1,0,0,1,0|1,0,1]=4 4747 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)I 34a_100000211634_100012361361 [0,1,0,0,1,0|1,0,1]=4 4748 B20R2.4658 O=C(CCc1ccccc1)COc2cccc(c2)I 7a_100000211634_100012361361 [0,1,0,0,1,0|1,0,1]=4 4749 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Br 1458a_100000760868_100000765856 [0,1,0,0,1,0|1,0,1]=4 4750 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Br 62a_100000691529_100012361361 [0,1,0,0,1,0|1,0,1]=4 4751 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Br 62a_100012361361_100000691529 [0,1,0,0,1,0|1,0,1]=4 4752 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Cl 62a_100000699651_100012361361 [0,1,0,0,1,0|1,0,1]=4 4753 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)Cl 62a_100012361361_100000699651 [0,1,0,0,1,0|1,0,1]=4 4754 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)F 62a_100000685547_100012361361 [0,1,0,0,1,0|1,0,1]=4 4755 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)F 62a_100012361361_100000685547 [0,1,0,0,1,0|1,0,1]=4 4756 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)O 62a_100012361361_100000211634 [0,1,0,0,1,0|1,0,1]=4 4757 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)[S] 62a_100012361361_114929384022 [0,1,0,0,1,0|1,0,1]=4 4758 B20R2.4658 O=C(CCc1ccccc1)CSc2cccc(c2)[S] 62a_114929384022_100012361361 [0,1,0,0,1,0|1,0,1]=4 4759 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Br 11a_100000174977_100000185753 [0,1,0,0,1,0|1,0,1]=4 4760 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Br 1626a_100000174977_100000185753 [0,1,0,0,1,0|1,0,1]=4 4761 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Br 240690a_100000174977_100000185753 [0,1,0,0,1,0|1,0,1]=4 4762 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Br 527a_100000174977_100000185753 [0,1,0,0,1,0|1,0,1]=4 4763 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Cl 11a_100000174878_100000185753 [0,1,0,0,1,0|1,0,1]=4 4764 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Cl 1626a_100000174878_100000185753 [0,1,0,0,1,0|1,0,1]=4 4765 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Cl 240690a_100000174878_100000185753 [0,1,0,0,1,0|1,0,1]=4 4766 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)Cl 527a_100000174878_100000185753 [0,1,0,0,1,0|1,0,1]=4 4767 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)F 11a_100000174948_100000185753 [0,1,0,0,1,0|1,0,1]=4 4768 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)F 1626a_100000174948_100000185753 [0,1,0,0,1,0|1,0,1]=4 4769 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)F 240690a_100000174948_100000185753 [0,1,0,0,1,0|1,0,1]=4 4770 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)F 527a_100000174948_100000185753 [0,1,0,0,1,0|1,0,1]=4 4771 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)I 11a_100000106179_100000185753 [0,1,0,0,1,0|1,0,1]=4 4772 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)I 1626a_100000106179_100000185753 [0,1,0,0,1,0|1,0,1]=4 4773 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)I 240690a_100000106179_100000185753 [0,1,0,0,1,0|1,0,1]=4 4774 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)I 527a_100000106179_100000185753 [0,1,0,0,1,0|1,0,1]=4 4775 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)O 240690a_100000743036_100000185753 [0,1,0,0,1,0|1,0,1]=4 4776 B20R2.4658 O=C(CCc1ccccc1)NCc2cccc(c2)O 527a_100000743036_100000185753 [0,1,0,0,1,0|1,0,1]=4 4777 B20R2.4658 O=C(CCc1ccccc1)NNc2cccc(c2)Br 22a_100000217339_100000185753 [0,1,0,0,1,0|2,0,0]=4 4778 B20R2.4658 O=C(CCc1ccccc1)NNc2cccc(c2)Cl 22a_100000184277_100000185753 [0,1,0,0,1,0|2,0,0]=4 4779 B20R2.4658 O=C(CCc1ccccc1)NNc2cccc(c2)F 22a_100000745080_100000185753 [0,1,0,0,1,0|2,0,0]=4 4780 B20R2.4658 O=C(CCc1ccccc1)NNc2cccc(c2)I 22a_100020605690_100000185753 [0,1,0,0,1,0|2,0,0]=4 4781 B20R2.4658 O=C(CNc1cccc(c1)Br)OCc2ccccc2 34a_100000210019_100000753625 [0,1,0,0,1,0|1,0,1]=4 4782 B20R2.4658 O=C(CNc1cccc(c1)Cl)OCc2ccccc2 34a_100000185859_100000753625 [0,1,0,0,1,0|1,0,1]=4 4783 B20R2.4658 O=C(CNc1cccc(c1)F)OCc2ccccc2 34a_100000210047_100000753625 [0,1,0,0,1,0|1,0,1]=4 4784 B20R2.4658 O=C(CNc1cccc(c1)I)OCc2ccccc2 34a_100000211102_100000753625 [0,1,0,0,1,0|1,0,1]=4 4785 B20R2.4658 O=C(CNc1cccc(c1)O)OCc2ccccc2 34a_100000210217_100000753625 [0,1,0,0,1,0|1,0,1]=4 4786 B20R2.4658 O=C(COc1cccc(c1)Br)OCc2ccccc2 34a_100000210342_100000753625 [0,1,0,0,1,0|1,0,1]=4 4787 B20R2.4658 O=C(COc1cccc(c1)Br)OCc2ccccc2 7a_100000210342_100000753625 [0,1,0,0,1,0|1,0,1]=4 4788 B20R2.4658 O=C(COc1cccc(c1)Cl)OCc2ccccc2 34a_100000210295_100000753625 [0,1,0,0,1,0|1,0,1]=4 4789 B20R2.4658 O=C(COc1cccc(c1)Cl)OCc2ccccc2 7a_100000210295_100000753625 [0,1,0,0,1,0|1,0,1]=4 4790 B20R2.4658 O=C(COc1cccc(c1)F)OCc2ccccc2 34a_100000210426_100000753625 [0,1,0,0,1,0|1,0,1]=4 4791 B20R2.4658 O=C(COc1cccc(c1)F)OCc2ccccc2 7a_100000210426_100000753625 [0,1,0,0,1,0|1,0,1]=4 4792 B20R2.4658 O=C(COc1cccc(c1)I)OCc2ccccc2 34a_100000211634_100000753625 [0,1,0,0,1,0|1,0,1]=4 4793 B20R2.4658 O=C(COc1cccc(c1)I)OCc2ccccc2 7a_100000211634_100000753625 [0,1,0,0,1,0|1,0,1]=4 4794 B20R2.4658 O=C(CSc1cccc(c1)Br)OCc2ccccc2 62a_100000691529_100000753625 [0,1,0,0,1,0|1,0,1]=4 4795 B20R2.4658 O=C(CSc1cccc(c1)Br)OCc2ccccc2 62a_100000753625_100000691529 [0,1,0,0,1,0|1,0,1]=4 4796 B20R2.4658 O=C(CSc1cccc(c1)Cl)OCc2ccccc2 62a_100000699651_100000753625 [0,1,0,0,1,0|1,0,1]=4 4797 B20R2.4658 O=C(CSc1cccc(c1)Cl)OCc2ccccc2 62a_100000753625_100000699651 [0,1,0,0,1,0|1,0,1]=4 4798 B20R2.4658 O=C(CSc1cccc(c1)F)OCc2ccccc2 62a_100000685547_100000753625 [0,1,0,0,1,0|1,0,1]=4 4799 B20R2.4658 O=C(CSc1cccc(c1)F)OCc2ccccc2 62a_100000753625_100000685547 [0,1,0,0,1,0|1,0,1]=4 4800 B20R2.4658 O=C(CSc1cccc(c1)O)OCc2ccccc2 62a_100000753625_100000211634 [0,1,0,0,1,0|1,0,1]=4 4801 B20R2.4658 O=C(CSc1cccc(c1)[S])OCc2ccccc2 62a_100000753625_114929384022 [0,1,0,0,1,0|1,0,1]=4 4802 B20R2.4658 O=C(CSc1cccc(c1)[S])OCc2ccccc2 62a_114929384022_100000753625 [0,1,0,0,1,0|1,0,1]=4 4803 B20R2.6651 Cc1ccccc1C=CC(=O)NCc2ccccc2 1626a_100015324214_100016266485 [0,1,0,0,1,0|1,0,0]=3 4804 B20R2.6651 Cc1ccccc1C=CC(=O)NCc2ccccn2 1626a_100000210449_100016266485 [0,1,0,0,1,0|2,0,0]=4 4805 B20R2.6651 Cc1ccccc1C=CC(=O)NCc2ccncc2 1626a_100000210450_100016266485 [0,1,0,0,1,0|2,0,0]=4 4806 B20R2.6651 Cc1ccccc1C=CC(=O)NNc2ccccc2 22a_100015195140_100016266485 [0,1,0,0,1,0|2,0,0]=4 4807 B20R2.6651 Cc1ccccc1CCC(=O)C#Cc2ccccc2 1458a_100000736102_100011713688 [0,1,0,0,1,0|0,0,2]=4 4808 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2ccccc2 1458a_100000210462_100011713688 [0,1,0,0,1,0|0,0,0]=2 4809 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2ccccn2 1458a_100000740811_100011713688 [0,1,0,0,1,0|1,0,0]=3 4810 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2cccnc2 1458a_100000735890_100011713688 [0,1,0,0,1,0|1,0,0]=3 4811 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2ccncc2 1458a_100000682801_100011713688 [0,1,0,0,1,0|1,0,0]=3 4812 B20R2.6651 Cc1ccccc1CCC(=O)C=Cc2cncnc2 6a_100000749868_100012183946 [0,1,0,0,1,0|2,0,0]=4 4813 B20R2.6651 Cc1ccccc1CCC(=O)CCc2ccccc2 1458a_100000185753_100011713688 [0,1,0,0,1,0|0,0,2]=4 4814 B20R2.6651 Cc1ccccc1CCC(=O)CCc2ccccc2 1458a_100000748742_100000765856 [0,1,0,0,1,0|0,0,2]=4 4815 B20R2.6651 Cc1ccccc1CCC(=O)COc2ccccc2 1458a_100000186222_100011713688 [0,1,0,0,1,0|1,0,1]=4 4816 B20R2.6651 Cc1ccccc1CCC(=O)CSc2ccccc2 1458a_100000211596_100011713688 [0,1,0,0,1,0|1,0,1]=4 4817 B20R2.6651 Cc1ccccc1CCC(=O)NCc2ccccc2 11a_100015324214_100000748742 [0,1,0,0,1,0|1,0,1]=4 4818 B20R2.6651 Cc1ccccc1CCC(=O)NCc2ccccc2 1626a_100015324214_100000748742 [0,1,0,0,1,0|1,0,1]=4 4819 B20R2.6651 Cc1ccccc1CCC(=O)NCc2ccccc2 240690a_100015324214_100000748742 [0,1,0,0,1,0|1,0,1]=4 4820 B20R2.6651 Cc1ccccc1CCC(=O)NCc2ccccc2 527a_100015324214_100000748742 [0,1,0,0,1,0|1,0,1]=4 4821 B20R2.6651 Cc1ccccc1CCC(=O)NNc2ccccc2 22a_100015195140_100000748742 [0,1,0,0,1,0|2,0,0]=4 4822 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccccc2 11a_100000174972_100000210462 [0,1,0,0,1,0|1,0,0]=3 4823 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccccc2 1626a_100000174972_100000210462 [0,1,0,0,1,0|1,0,0]=3 4824 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccccn2 11a_100000174972_100000740811 [0,1,0,0,1,0|2,0,0]=4 4825 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccccn2 240690a_100000174972_100000740811 [0,1,0,0,1,0|2,0,0]=4 4826 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2cccnc2 11a_100000174972_100000735890 [0,1,0,0,1,0|2,0,0]=4 4827 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2cccnc2 240690a_100000174972_100000735890 [0,1,0,0,1,0|2,0,0]=4 4828 B20R2.6651 Cc1ccccc1CNC(=O)C=Cc2ccncc2 240690a_100000174972_100000682801 [0,1,0,0,1,0|2,0,0]=4 4829 B20R2.6651 Cc1ccccc1CNC(=O)CCc2ccccc2 11a_100000174972_100000185753 [0,1,0,0,1,0|1,0,1]=4 4830 B20R2.6651 Cc1ccccc1CNC(=O)CCc2ccccc2 1626a_100000174972_100000185753 [0,1,0,0,1,0|1,0,1]=4 4831 B20R2.6651 Cc1ccccc1CNC(=O)CCc2ccccc2 240690a_100000174972_100000185753 [0,1,0,0,1,0|1,0,1]=4 4832 B20R2.6651 Cc1ccccc1CNC(=O)CCc2ccccc2 527a_100000174972_100000185753 [0,1,0,0,1,0|1,0,1]=4 4833 B20R2.6651 Cc1ccccc1NCC(=O)CCc2ccccc2 34a_100015192222_100012361361 [0,1,0,0,1,0|1,0,1]=4 4834 B20R2.6651 Cc1ccccc1NCC(=O)OCc2ccccc2 34a_100015192222_100000753625 [0,1,0,0,1,0|1,0,1]=4 4835 B20R2.6651 Cc1ccccc1NNC(=O)C=Cc2ccccc2 22a_100000184220_100000210462 [0,1,0,0,1,0|2,0,0]=4 4836 B20R2.6651 Cc1ccccc1NNC(=O)CCc2ccccc2 22a_100000184220_100000185753 [0,1,0,0,1,0|2,0,0]=4 4837 B20R2.6651 Cc1ccccc1OCC(=O)CCc2ccccc2 1458a_100000182418_100000765856 [0,1,0,0,1,0|1,0,1]=4 4838 B20R2.6651 Cc1ccccc1OCC(=O)CCc2ccccc2 34a_100000210338_100012361361 [0,1,0,0,1,0|1,0,1]=4 4839 B20R2.6651 Cc1ccccc1OCC(=O)CCc2ccccc2 7a_100000210338_100012361361 [0,1,0,0,1,0|1,0,1]=4 4840 B20R2.6651 Cc1ccccc1OCC(=O)OCc2ccccc2 34a_100000210338_100000753625 [0,1,0,0,1,0|1,0,1]=4 4841 B20R2.6651 Cc1ccccc1OCC(=O)OCc2ccccc2 7a_100000210338_100000753625 [0,1,0,0,1,0|1,0,1]=4 4842 B20R2.6651 Cc1ccccc1SCC(=O)CCc2ccccc2 1458a_100000183026_100000765856 [0,1,0,0,1,0|1,0,1]=4 4843 B20R2.6651 Cc1ccccc1SCC(=O)CCc2ccccc2 62a_100000210755_100012361361 [0,1,0,0,1,0|1,0,1]=4 4844 B20R2.6651 Cc1ccccc1SCC(=O)CCc2ccccc2 62a_100012361361_100000210755 [0,1,0,0,1,0|1,0,1]=4 4845 B20R2.6651 Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100000210755_100000753625 [0,1,0,0,1,0|1,0,1]=4 4846 B20R2.6651 Cc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000210755 [0,1,0,0,1,0|1,0,1]=4 4847 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2ccccc2 11a_100011223789_100000210462 [0,1,0,0,1,0|2,0,0]=4 4848 B20R2.6651 Cc1cccnc1CNC(=O)C=Cc2ccccc2 1626a_100011223789_100000210462 [0,1,0,0,1,0|2,0,0]=4 4849 B20R2.6651 Cc1ccncc1CNC(=O)C=Cc2ccccc2 11a_100011997553_100000210462 [0,1,0,0,1,0|2,0,0]=4 4850 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2ccccc2 11a_100000708811_100000210462 [0,1,0,0,1,0|2,0,0]=4 4851 B20R2.6651 Cc1cnccc1CNC(=O)C=Cc2ccccc2 1626a_100000708811_100000210462 [0,1,0,0,1,0|2,0,0]=4 4852 B20R2.6651 Nc1ccccc1OCC(=O)CCc2ccccc2 34a_100000185747_100012361361 [0,1,0,0,1,0|1,0,1]=4 4853 B20R2.6651 Nc1ccccc1OCC(=O)CCc2ccccc2 7a_100000185747_100012361361 [0,1,0,0,1,0|1,0,1]=4 4854 B20R2.6651 Nc1ccccc1OCC(=O)OCc2ccccc2 34a_100000185747_100000753625 [0,1,0,0,1,0|1,0,1]=4 4855 B20R2.6651 Nc1ccccc1OCC(=O)OCc2ccccc2 7a_100000185747_100000753625 [0,1,0,0,1,0|1,0,1]=4 4856 B20R2.6651 Nc1ccccc1SCC(=O)CCc2ccccc2 62a_100000210017_100012361361 [0,1,0,0,1,0|1,0,1]=4 4857 B20R2.6651 Nc1ccccc1SCC(=O)CCc2ccccc2 62a_100012361361_100000210017 [0,1,0,0,1,0|1,0,1]=4 4858 B20R2.6651 Nc1ccccc1SCC(=O)OCc2ccccc2 62a_100000210017_100000753625 [0,1,0,0,1,0|1,0,1]=4 4859 B20R2.6651 Nc1ccccc1SCC(=O)OCc2ccccc2 62a_100000753625_100000210017 [0,1,0,0,1,0|1,0,1]=4 4860 B20R2.6651 O=C(C#Cc1ccccc1)CCc2ccccc2Br 1458a_100000736102_100012161201 [0,1,0,0,1,0|0,0,2]=4 4861 B20R2.6651 O=C(C#Cc1ccccc1)CCc2ccccc2Cl 1458a_100000736102_100011713703 [0,1,0,0,1,0|0,0,2]=4 4862 B20R2.6651 O=C(C#Cc1ccccc1)CCc2ccccc2F 1458a_100000736102_100000720011 [0,1,0,0,1,0|0,0,2]=4 4863 B20R2.6651 O=C(C#Cc1ccccc1)CCc2ccccc2O 1458a_100000736102_100000722297 [0,1,0,0,1,0|0,0,2]=4 4864 B20R2.6651 O=C(C#Cc1ccccc1F)CCc2ccccc2 1458a_100011892747_100000765856 [0,1,0,0,1,0|0,0,2]=4 4865 B20R2.6651 O=C(C=Cc1ccccc1)CCc2ccccc2Br 1458a_100000210462_100012161201 [0,1,0,0,1,0|0,0,0]=2 4866 B20R2.6651 O=C(C=Cc1ccccc1)CCc2ccccc2Cl 1458a_100000210462_100011713703 [0,1,0,0,1,0|0,0,0]=2 4867 B20R2.6651 O=C(C=Cc1ccccc1)CCc2ccccc2F 1458a_100000210462_100000720011 [0,1,0,0,1,0|0,0,0]=2 4868 B20R2.6651 O=C(C=Cc1ccccc1)CCc2ccccc2O 1458a_100000210462_100000722297 [0,1,0,0,1,0|0,0,0]=2 4869 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2Br 11a_100000689332_100000210462 [0,1,0,0,1,0|1,0,0]=3 4870 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100000210462 [0,1,0,0,1,0|1,0,0]=3 4871 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100000210462 [0,1,0,0,1,0|1,0,0]=3 4872 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100000210462 [0,1,0,0,1,0|1,0,0]=3 4873 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2F 11a_100000174869_100000210462 [0,1,0,0,1,0|1,0,0]=3 4874 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2F 1626a_100000174869_100000210462 [0,1,0,0,1,0|1,0,0]=3 4875 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2I 11a_100015347259_100000210462 [0,1,0,0,1,0|1,0,0]=3 4876 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccccc2I 1626a_100015347259_100000210462 [0,1,0,0,1,0|1,0,0]=3 4877 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2Br 11a_100009818023_100000210462 [0,1,0,0,1,0|2,0,0]=4 4878 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2Cl 11a_100015189234_100000210462 [0,1,0,0,1,0|2,0,0]=4 4879 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2Cl 1626a_100015189234_100000210462 [0,1,0,0,1,0|2,0,0]=4 4880 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2F 11a_100000724633_100000210462 [0,1,0,0,1,0|2,0,0]=4 4881 B20R2.6651 O=C(C=Cc1ccccc1)NCc2cccnc2F 1626a_100000724633_100000210462 [0,1,0,0,1,0|2,0,0]=4 4882 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccncc2Br 11a_100020640021_100000210462 [0,1,0,0,1,0|2,0,0]=4 4883 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccncc2F 11a_100011935246_100000210462 [0,1,0,0,1,0|2,0,0]=4 4884 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ccncc2F 1626a_100011935246_100000210462 [0,1,0,0,1,0|2,0,0]=4 4885 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2Br 11a_100020591323_100000210462 [0,1,0,0,1,0|2,0,0]=4 4886 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2Cl 11a_100015189233_100000210462 [0,1,0,0,1,0|2,0,0]=4 4887 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2Cl 1626a_100015189233_100000210462 [0,1,0,0,1,0|2,0,0]=4 4888 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2F 11a_100000690088_100000210462 [0,1,0,0,1,0|2,0,0]=4 4889 B20R2.6651 O=C(C=Cc1ccccc1)NCc2ncccc2F 1626a_100000690088_100000210462 [0,1,0,0,1,0|2,0,0]=4 4890 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccccc2Br 22a_100000241748_100000210462 [0,1,0,0,1,0|2,0,0]=4 4891 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccccc2Cl 22a_100000683529_100000210462 [0,1,0,0,1,0|2,0,0]=4 4892 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccccc2F 22a_100000239246_100000210462 [0,1,0,0,1,0|2,0,0]=4 4893 B20R2.6651 O=C(C=Cc1ccccc1)NNc2ccccc2I 22a_100011218156_100000210462 [0,1,0,0,1,0|2,0,0]=4 4894 B20R2.6651 O=C(C=Cc1ccccc1Br)CCc2ccccc2 1458a_100000719032_100000765856 [0,1,0,0,1,0|0,0,0]=2 4895 B20R2.6651 O=C(C=Cc1ccccc1Br)CCc2ccccn2 1458a_100000719032_100015183660 [0,1,0,0,1,0|1,0,0]=3 4896 B20R2.6651 O=C(C=Cc1ccccc1Br)CCc2cccnc2 1458a_100000719032_200011713674 [0,1,0,0,1,0|1,0,0]=3 4897 B20R2.6651 O=C(C=Cc1ccccc1Br)CCc2ccncc2 1458a_100000719032_100000723409 [0,1,0,0,1,0|1,0,0]=3 4898 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccc2 11a_100015324214_100000719032 [0,1,0,0,1,0|1,0,0]=3 4899 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccc2 1626a_100015324214_100000719032 [0,1,0,0,1,0|1,0,0]=3 4900 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccc2 240690a_100015324214_100000719032 [0,1,0,0,1,0|1,0,0]=3 4901 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccn2 11a_100000210449_100000719032 [0,1,0,0,1,0|2,0,0]=4 4902 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccn2 1626a_100000210449_100000719032 [0,1,0,0,1,0|2,0,0]=4 4903 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccccn2 240690a_100000210449_100000719032 [0,1,0,0,1,0|2,0,0]=4 4904 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cccnc2 11a_100000210453_100000719032 [0,1,0,0,1,0|2,0,0]=4 4905 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2cccnc2 240690a_100000210453_100000719032 [0,1,0,0,1,0|2,0,0]=4 4906 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccncc2 11a_100000210450_100000719032 [0,1,0,0,1,0|2,0,0]=4 4907 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccncc2 1626a_100000210450_100000719032 [0,1,0,0,1,0|2,0,0]=4 4908 B20R2.6651 O=C(C=Cc1ccccc1Br)NCc2ccncc2 240690a_100000210450_100000719032 [0,1,0,0,1,0|2,0,0]=4 4909 B20R2.6651 O=C(C=Cc1ccccc1Br)NNc2ccccc2 22a_100015195140_100000719032 [0,1,0,0,1,0|2,0,0]=4 4910 B20R2.6651 O=C(C=Cc1ccccc1Cl)CCc2ccccc2 1458a_100000720304_100000765856 [0,1,0,0,1,0|0,0,0]=2 4911 B20R2.6651 O=C(C=Cc1ccccc1Cl)CCc2ccccn2 1458a_100000720304_100015183660 [0,1,0,0,1,0|1,0,0]=3 4912 B20R2.6651 O=C(C=Cc1ccccc1Cl)CCc2cccnc2 1458a_100000720304_200011713674 [0,1,0,0,1,0|1,0,0]=3 4913 B20R2.6651 O=C(C=Cc1ccccc1Cl)CCc2ccncc2 1458a_100000720304_100000723409 [0,1,0,0,1,0|1,0,0]=3 4914 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccc2 11a_100015324214_100000720304 [0,1,0,0,1,0|1,0,0]=3 4915 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccc2 1626a_100015324214_100000720304 [0,1,0,0,1,0|1,0,0]=3 4916 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccc2 240690a_100015324214_100000720304 [0,1,0,0,1,0|1,0,0]=3 4917 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccn2 11a_100000210449_100000720304 [0,1,0,0,1,0|2,0,0]=4 4918 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccn2 1626a_100000210449_100000720304 [0,1,0,0,1,0|2,0,0]=4 4919 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccccn2 240690a_100000210449_100000720304 [0,1,0,0,1,0|2,0,0]=4 4920 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cccnc2 11a_100000210453_100000720304 [0,1,0,0,1,0|2,0,0]=4 4921 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2cccnc2 240690a_100000210453_100000720304 [0,1,0,0,1,0|2,0,0]=4 4922 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccncc2 11a_100000210450_100000720304 [0,1,0,0,1,0|2,0,0]=4 4923 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccncc2 1626a_100000210450_100000720304 [0,1,0,0,1,0|2,0,0]=4 4924 B20R2.6651 O=C(C=Cc1ccccc1Cl)NCc2ccncc2 240690a_100000210450_100000720304 [0,1,0,0,1,0|2,0,0]=4 4925 B20R2.6651 O=C(C=Cc1ccccc1Cl)NNc2ccccc2 22a_100015195140_100000720304 [0,1,0,0,1,0|2,0,0]=4 4926 B20R2.6651 O=C(C=Cc1ccccc1F)CCc2ccccc2 1458a_100016256065_100000765856 [0,1,0,0,1,0|0,0,0]=2 4927 B20R2.6651 O=C(C=Cc1ccccc1F)CCc2ccccn2 1458a_100016256065_100015183660 [0,1,0,0,1,0|1,0,0]=3 4928 B20R2.6651 O=C(C=Cc1ccccc1F)CCc2cccnc2 1458a_100016256065_200011713674 [0,1,0,0,1,0|1,0,0]=3 4929 B20R2.6651 O=C(C=Cc1ccccc1F)CCc2ccncc2 1458a_100016256065_100000723409 [0,1,0,0,1,0|1,0,0]=3 4930 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccc2 11a_100015324214_100016256065 [0,1,0,0,1,0|1,0,0]=3 4931 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccc2 1626a_100015324214_100016256065 [0,1,0,0,1,0|1,0,0]=3 4932 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccc2 240690a_100015324214_100016256065 [0,1,0,0,1,0|1,0,0]=3 4933 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccn2 11a_100000210449_100016256065 [0,1,0,0,1,0|2,0,0]=4 4934 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccn2 1626a_100000210449_100016256065 [0,1,0,0,1,0|2,0,0]=4 4935 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccccn2 240690a_100000210449_100016256065 [0,1,0,0,1,0|2,0,0]=4 4936 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cccnc2 11a_100000210453_100016256065 [0,1,0,0,1,0|2,0,0]=4 4937 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2cccnc2 240690a_100000210453_100016256065 [0,1,0,0,1,0|2,0,0]=4 4938 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccncc2 11a_100000210450_100016256065 [0,1,0,0,1,0|2,0,0]=4 4939 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccncc2 1626a_100000210450_100016256065 [0,1,0,0,1,0|2,0,0]=4 4940 B20R2.6651 O=C(C=Cc1ccccc1F)NCc2ccncc2 240690a_100000210450_100016256065 [0,1,0,0,1,0|2,0,0]=4 4941 B20R2.6651 O=C(C=Cc1ccccc1F)NNc2ccccc2 22a_100015195140_100016256065 [0,1,0,0,1,0|2,0,0]=4 4942 B20R2.6651 O=C(C=Cc1ccccc1O)CCc2ccccc2 1458a_100016263591_100000765856 [0,1,0,0,1,0|0,0,0]=2 4943 B20R2.6651 O=C(C=Cc1ccccc1O)CCc2ccccn2 1458a_100016263591_100015183660 [0,1,0,0,1,0|1,0,0]=3 4944 B20R2.6651 O=C(C=Cc1ccccc1O)CCc2cccnc2 1458a_100016263591_200011713674 [0,1,0,0,1,0|1,0,0]=3 4945 B20R2.6651 O=C(C=Cc1ccccc1O)CCc2ccncc2 1458a_100016263591_100000723409 [0,1,0,0,1,0|1,0,0]=3 4946 B20R2.6651 O=C(C=Cc1ccccc1O)NNc2ccccc2 22a_100015195140_100016263591 [0,1,0,0,1,0|2,0,0]=4 4947 B20R2.6651 O=C(C=Cc1ccccn1)CCc2ccccc2Br 1458a_100000740811_100012161201 [0,1,0,0,1,0|1,0,0]=3 4948 B20R2.6651 O=C(C=Cc1ccccn1)CCc2ccccc2Cl 1458a_100000740811_100011713703 [0,1,0,0,1,0|1,0,0]=3 4949 B20R2.6651 O=C(C=Cc1ccccn1)CCc2ccccc2F 1458a_100000740811_100000720011 [0,1,0,0,1,0|1,0,0]=3 4950 B20R2.6651 O=C(C=Cc1ccccn1)CCc2ccccc2O 1458a_100000740811_100000722297 [0,1,0,0,1,0|1,0,0]=3 4951 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2Br 11a_100000689332_100000740811 [0,1,0,0,1,0|2,0,0]=4 4952 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2Br 240690a_100000689332_100000740811 [0,1,0,0,1,0|2,0,0]=4 4953 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2Cl 11a_100000174879_100000740811 [0,1,0,0,1,0|2,0,0]=4 4954 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2Cl 240690a_100000174879_100000740811 [0,1,0,0,1,0|2,0,0]=4 4955 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2F 11a_100000174869_100000740811 [0,1,0,0,1,0|2,0,0]=4 4956 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2F 240690a_100000174869_100000740811 [0,1,0,0,1,0|2,0,0]=4 4957 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2I 11a_100015347259_100000740811 [0,1,0,0,1,0|2,0,0]=4 4958 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2I 240690a_100015347259_100000740811 [0,1,0,0,1,0|2,0,0]=4 4959 B20R2.6651 O=C(C=Cc1ccccn1)NCc2ccccc2O 240690a_100000185550_100000740811 [0,1,0,0,1,0|2,0,0]=4 4960 B20R2.6651 O=C(C=Cc1cccnc1)CCc2ccccc2Br 1458a_100000735890_100012161201 [0,1,0,0,1,0|1,0,0]=3 4961 B20R2.6651 O=C(C=Cc1cccnc1)CCc2ccccc2Cl 1458a_100000735890_100011713703 [0,1,0,0,1,0|1,0,0]=3 4962 B20R2.6651 O=C(C=Cc1cccnc1)CCc2ccccc2F 1458a_100000735890_100000720011 [0,1,0,0,1,0|1,0,0]=3 4963 B20R2.6651 O=C(C=Cc1cccnc1)CCc2ccccc2O 1458a_100000735890_100000722297 [0,1,0,0,1,0|1,0,0]=3 4964 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2Br 11a_100000689332_100000735890 [0,1,0,0,1,0|2,0,0]=4 4965 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2Br 240690a_100000689332_100000735890 [0,1,0,0,1,0|2,0,0]=4 4966 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2Cl 11a_100000174879_100000735890 [0,1,0,0,1,0|2,0,0]=4 4967 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2Cl 240690a_100000174879_100000735890 [0,1,0,0,1,0|2,0,0]=4 4968 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2F 11a_100000174869_100000735890 [0,1,0,0,1,0|2,0,0]=4 4969 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2F 240690a_100000174869_100000735890 [0,1,0,0,1,0|2,0,0]=4 4970 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2I 11a_100015347259_100000735890 [0,1,0,0,1,0|2,0,0]=4 4971 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2I 240690a_100015347259_100000735890 [0,1,0,0,1,0|2,0,0]=4 4972 B20R2.6651 O=C(C=Cc1cccnc1)NCc2ccccc2O 240690a_100000185550_100000735890 [0,1,0,0,1,0|2,0,0]=4 4973 B20R2.6651 O=C(C=Cc1ccncc1)CCc2ccccc2Br 1458a_100000682801_100012161201 [0,1,0,0,1,0|1,0,0]=3 4974 B20R2.6651 O=C(C=Cc1ccncc1)CCc2ccccc2Cl 1458a_100000682801_100011713703 [0,1,0,0,1,0|1,0,0]=3 4975 B20R2.6651 O=C(C=Cc1ccncc1)CCc2ccccc2F 1458a_100000682801_100000720011 [0,1,0,0,1,0|1,0,0]=3 4976 B20R2.6651 O=C(C=Cc1ccncc1)CCc2ccccc2O 1458a_100000682801_100000722297 [0,1,0,0,1,0|1,0,0]=3 4977 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2Br 240690a_100000689332_100000682801 [0,1,0,0,1,0|2,0,0]=4 4978 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2Cl 240690a_100000174879_100000682801 [0,1,0,0,1,0|2,0,0]=4 4979 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2F 240690a_100000174869_100000682801 [0,1,0,0,1,0|2,0,0]=4 4980 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2I 240690a_100015347259_100000682801 [0,1,0,0,1,0|2,0,0]=4 4981 B20R2.6651 O=C(C=Cc1ccncc1)NCc2ccccc2O 240690a_100000185550_100000682801 [0,1,0,0,1,0|2,0,0]=4 4982 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2Br 1458a_100000185753_100012161201 [0,1,0,0,1,0|0,0,2]=4 4983 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2Br 1458a_100000740810_100000765856 [0,1,0,0,1,0|0,0,2]=4 4984 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2Cl 1458a_100000184300_100000765856 [0,1,0,0,1,0|0,0,2]=4 4985 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2Cl 1458a_100000185753_100011713703 [0,1,0,0,1,0|0,0,2]=4 4986 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2F 1458a_100000185753_100000720011 [0,1,0,0,1,0|0,0,2]=4 4987 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2F 1458a_100000189703_100000765856 [0,1,0,0,1,0|0,0,2]=4 4988 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2I 1458a_100000037306_100000765856 [0,1,0,0,1,0|0,0,2]=4 4989 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2O 1458a_100000181328_100000765856 [0,1,0,0,1,0|0,0,2]=4 4990 B20R2.6651 O=C(CCc1ccccc1)CCc2ccccc2O 1458a_100000185753_100000722297 [0,1,0,0,1,0|0,0,2]=4 4991 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2Br 34a_100000210017_100012361361 [0,1,0,0,1,0|1,0,1]=4 4992 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2Cl 34a_100000185783_100012361361 [0,1,0,0,1,0|1,0,1]=4 4993 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2F 34a_100000210422_100012361361 [0,1,0,0,1,0|1,0,1]=4 4994 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2I 34a_100000210053_100012361361 [0,1,0,0,1,0|1,0,1]=4 4995 B20R2.6651 O=C(CCc1ccccc1)CNc2ccccc2O 34a_100000185747_100012361361 [0,1,0,0,1,0|1,0,1]=4 4996 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Br 1458a_100000216496_100000765856 [0,1,0,0,1,0|1,0,1]=4 4997 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Br 34a_100000181306_100012361361 [0,1,0,0,1,0|1,0,1]=4 4998 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Br 7a_100000181306_100012361361 [0,1,0,0,1,0|1,0,1]=4 4999 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Cl 1458a_100000185159_100000765856 [0,1,0,0,1,0|1,0,1]=4 5000 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Cl 34a_100000210172_100012361361 [0,1,0,0,1,0|1,0,1]=4 5001 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2Cl 7a_100000210172_100012361361 [0,1,0,0,1,0|1,0,1]=4 5002 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2F 1458a_100000182486_100000765856 [0,1,0,0,1,0|1,0,1]=4 5003 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2F 34a_100000210171_100012361361 [0,1,0,0,1,0|1,0,1]=4 5004 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2F 7a_100000210171_100012361361 [0,1,0,0,1,0|1,0,1]=4 5005 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2I 34a_100000739446_100012361361 [0,1,0,0,1,0|1,0,1]=4 5006 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2I 7a_100000739446_100012361361 [0,1,0,0,1,0|1,0,1]=4 5007 B20R2.6651 O=C(CCc1ccccc1)COc2ccccc2O 1458a_100000183020_100000765856 [0,1,0,0,1,0|1,0,1]=4 5008 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2Br 62a_100000695589_100012361361 [0,1,0,0,1,0|1,0,1]=4 5009 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2Br 62a_100012361361_100000695589 [0,1,0,0,1,0|1,0,1]=4 5010 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2Cl 62a_100000764095_100012361361 [0,1,0,0,1,0|1,0,1]=4 5011 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2Cl 62a_100012361361_100000764095 [0,1,0,0,1,0|1,0,1]=4 5012 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2F 1458a_100000179528_100000765856 [0,1,0,0,1,0|1,0,1]=4 5013 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2F 62a_100011215700_100012361361 [0,1,0,0,1,0|1,0,1]=4 5014 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2F 62a_100012361361_100011215700 [0,1,0,0,1,0|1,0,1]=4 5015 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2O 1458a_100000695322_100000765856 [0,1,0,0,1,0|1,0,1]=4 5016 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2O 62a_100000739446_100012361361 [0,1,0,0,1,0|1,0,1]=4 5017 B20R2.6651 O=C(CCc1ccccc1)CSc2ccccc2O 62a_100012361361_100000739446 [0,1,0,0,1,0|1,0,1]=4 5018 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Br 11a_100000689332_100000185753 [0,1,0,0,1,0|1,0,1]=4 5019 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Br 1626a_100000689332_100000185753 [0,1,0,0,1,0|1,0,1]=4 5020 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Br 240690a_100000689332_100000185753 [0,1,0,0,1,0|1,0,1]=4 5021 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Br 527a_100000689332_100000185753 [0,1,0,0,1,0|1,0,1]=4 5022 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Cl 11a_100000174879_100000185753 [0,1,0,0,1,0|1,0,1]=4 5023 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Cl 1626a_100000174879_100000185753 [0,1,0,0,1,0|1,0,1]=4 5024 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Cl 240690a_100000174879_100000185753 [0,1,0,0,1,0|1,0,1]=4 5025 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2Cl 527a_100000174879_100000185753 [0,1,0,0,1,0|1,0,1]=4 5026 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2F 11a_100000174869_100000185753 [0,1,0,0,1,0|1,0,1]=4 5027 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2F 1626a_100000174869_100000185753 [0,1,0,0,1,0|1,0,1]=4 5028 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2F 240690a_100000174869_100000185753 [0,1,0,0,1,0|1,0,1]=4 5029 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2F 527a_100000174869_100000185753 [0,1,0,0,1,0|1,0,1]=4 5030 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2I 11a_100015347259_100000185753 [0,1,0,0,1,0|1,0,1]=4 5031 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2I 1626a_100015347259_100000185753 [0,1,0,0,1,0|1,0,1]=4 5032 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2I 240690a_100015347259_100000185753 [0,1,0,0,1,0|1,0,1]=4 5033 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2I 527a_100015347259_100000185753 [0,1,0,0,1,0|1,0,1]=4 5034 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2O 240690a_100000185550_100000185753 [0,1,0,0,1,0|1,0,1]=4 5035 B20R2.6651 O=C(CCc1ccccc1)NCc2ccccc2O 527a_100000185550_100000185753 [0,1,0,0,1,0|1,0,1]=4 5036 B20R2.6651 O=C(CCc1ccccc1)NNc2ccccc2Br 22a_100000241748_100000185753 [0,1,0,0,1,0|2,0,0]=4 5037 B20R2.6651 O=C(CCc1ccccc1)NNc2ccccc2Cl 22a_100000683529_100000185753 [0,1,0,0,1,0|2,0,0]=4 5038 B20R2.6651 O=C(CCc1ccccc1)NNc2ccccc2F 22a_100000239246_100000185753 [0,1,0,0,1,0|2,0,0]=4 5039 B20R2.6651 O=C(CCc1ccccc1)NNc2ccccc2I 22a_100011218156_100000185753 [0,1,0,0,1,0|2,0,0]=4 5040 B20R2.6651 O=C(CCc1ccccc1Br)COc2ccccc2 1458a_100000186222_100012161201 [0,1,0,0,1,0|1,0,1]=4 5041 B20R2.6651 O=C(CCc1ccccc1Br)CSc2ccccc2 1458a_100000211596_100012161201 [0,1,0,0,1,0|1,0,1]=4 5042 B20R2.6651 O=C(CCc1ccccc1Br)NCc2ccccc2 11a_100015324214_100000740810 [0,1,0,0,1,0|1,0,1]=4 5043 B20R2.6651 O=C(CCc1ccccc1Br)NCc2ccccc2 1626a_100015324214_100000740810 [0,1,0,0,1,0|1,0,1]=4 5044 B20R2.6651 O=C(CCc1ccccc1Br)NCc2ccccc2 240690a_100015324214_100000740810 [0,1,0,0,1,0|1,0,1]=4 5045 B20R2.6651 O=C(CCc1ccccc1Br)NCc2ccccc2 527a_100015324214_100000740810 [0,1,0,0,1,0|1,0,1]=4 5046 B20R2.6651 O=C(CCc1ccccc1Br)NNc2ccccc2 22a_100015195140_100000740810 [0,1,0,0,1,0|2,0,0]=4 5047 B20R2.6651 O=C(CCc1ccccc1Cl)COc2ccccc2 1458a_100000186222_100011713703 [0,1,0,0,1,0|1,0,1]=4 5048 B20R2.6651 O=C(CCc1ccccc1Cl)CSc2ccccc2 1458a_100000211596_100011713703 [0,1,0,0,1,0|1,0,1]=4 5049 B20R2.6651 O=C(CCc1ccccc1Cl)NCc2ccccc2 11a_100015324214_100000184300 [0,1,0,0,1,0|1,0,1]=4 5050 B20R2.6651 O=C(CCc1ccccc1Cl)NCc2ccccc2 1626a_100015324214_100000184300 [0,1,0,0,1,0|1,0,1]=4 5051 B20R2.6651 O=C(CCc1ccccc1Cl)NCc2ccccc2 240690a_100015324214_100000184300 [0,1,0,0,1,0|1,0,1]=4 5052 B20R2.6651 O=C(CCc1ccccc1Cl)NCc2ccccc2 527a_100015324214_100000184300 [0,1,0,0,1,0|1,0,1]=4 5053 B20R2.6651 O=C(CCc1ccccc1Cl)NNc2ccccc2 22a_100015195140_100000184300 [0,1,0,0,1,0|2,0,0]=4 5054 B20R2.6651 O=C(CCc1ccccc1F)COc2ccccc2 1458a_100000186222_100000720011 [0,1,0,0,1,0|1,0,1]=4 5055 B20R2.6651 O=C(CCc1ccccc1F)CSc2ccccc2 1458a_100000211596_100000720011 [0,1,0,0,1,0|1,0,1]=4 5056 B20R2.6651 O=C(CCc1ccccc1F)NCc2ccccc2 11a_100015324214_100000189703 [0,1,0,0,1,0|1,0,1]=4 5057 B20R2.6651 O=C(CCc1ccccc1F)NCc2ccccc2 1626a_100015324214_100000189703 [0,1,0,0,1,0|1,0,1]=4 5058 B20R2.6651 O=C(CCc1ccccc1F)NCc2ccccc2 240690a_100015324214_100000189703 [0,1,0,0,1,0|1,0,1]=4 5059 B20R2.6651 O=C(CCc1ccccc1F)NCc2ccccc2 527a_100015324214_100000189703 [0,1,0,0,1,0|1,0,1]=4 5060 B20R2.6651 O=C(CCc1ccccc1F)NNc2ccccc2 22a_100015195140_100000189703 [0,1,0,0,1,0|2,0,0]=4 5061 B20R2.6651 O=C(CCc1ccccc1I)NCc2ccccc2 11a_100015324214_100000037306 [0,1,0,0,1,0|1,0,1]=4 5062 B20R2.6651 O=C(CCc1ccccc1I)NCc2ccccc2 1626a_100015324214_100000037306 [0,1,0,0,1,0|1,0,1]=4 5063 B20R2.6651 O=C(CCc1ccccc1I)NCc2ccccc2 240690a_100015324214_100000037306 [0,1,0,0,1,0|1,0,1]=4 5064 B20R2.6651 O=C(CCc1ccccc1I)NCc2ccccc2 527a_100015324214_100000037306 [0,1,0,0,1,0|1,0,1]=4 5065 B20R2.6651 O=C(CCc1ccccc1I)NNc2ccccc2 22a_100015195140_100000037306 [0,1,0,0,1,0|2,0,0]=4 5066 B20R2.6651 O=C(CCc1ccccc1O)COc2ccccc2 1458a_100000186222_100000722297 [0,1,0,0,1,0|1,0,1]=4 5067 B20R2.6651 O=C(CCc1ccccc1O)CSc2ccccc2 1458a_100000211596_100000722297 [0,1,0,0,1,0|1,0,1]=4 5068 B20R2.6651 O=C(CCc1ccccc1O)NCc2ccccc2 11a_100015324214_100000181328 [0,1,0,0,1,0|1,0,1]=4 5069 B20R2.6651 O=C(CCc1ccccc1O)NCc2ccccc2 240690a_100015324214_100000181328 [0,1,0,0,1,0|1,0,1]=4 5070 B20R2.6651 O=C(CCc1ccccc1O)NCc2ccccc2 527a_100015324214_100000181328 [0,1,0,0,1,0|1,0,1]=4 5071 B20R2.6651 O=C(CCc1ccccc1O)NNc2ccccc2 22a_100015195140_100000181328 [0,1,0,0,1,0|2,0,0]=4 5072 B20R2.6651 O=C(CNc1ccccc1Br)OCc2ccccc2 34a_100000210017_100000753625 [0,1,0,0,1,0|1,0,1]=4 5073 B20R2.6651 O=C(CNc1ccccc1Cl)OCc2ccccc2 34a_100000185783_100000753625 [0,1,0,0,1,0|1,0,1]=4 5074 B20R2.6651 O=C(CNc1ccccc1F)OCc2ccccc2 34a_100000210422_100000753625 [0,1,0,0,1,0|1,0,1]=4 5075 B20R2.6651 O=C(CNc1ccccc1I)OCc2ccccc2 34a_100000210053_100000753625 [0,1,0,0,1,0|1,0,1]=4 5076 B20R2.6651 O=C(CNc1ccccc1O)OCc2ccccc2 34a_100000185747_100000753625 [0,1,0,0,1,0|1,0,1]=4 5077 B20R2.6651 O=C(COc1ccccc1Br)OCc2ccccc2 34a_100000181306_100000753625 [0,1,0,0,1,0|1,0,1]=4 5078 B20R2.6651 O=C(COc1ccccc1Br)OCc2ccccc2 7a_100000181306_100000753625 [0,1,0,0,1,0|1,0,1]=4 5079 B20R2.6651 O=C(COc1ccccc1Cl)OCc2ccccc2 34a_100000210172_100000753625 [0,1,0,0,1,0|1,0,1]=4 5080 B20R2.6651 O=C(COc1ccccc1Cl)OCc2ccccc2 7a_100000210172_100000753625 [0,1,0,0,1,0|1,0,1]=4 5081 B20R2.6651 O=C(COc1ccccc1F)OCc2ccccc2 34a_100000210171_100000753625 [0,1,0,0,1,0|1,0,1]=4 5082 B20R2.6651 O=C(COc1ccccc1F)OCc2ccccc2 7a_100000210171_100000753625 [0,1,0,0,1,0|1,0,1]=4 5083 B20R2.6651 O=C(COc1ccccc1I)OCc2ccccc2 34a_100000739446_100000753625 [0,1,0,0,1,0|1,0,1]=4 5084 B20R2.6651 O=C(COc1ccccc1I)OCc2ccccc2 7a_100000739446_100000753625 [0,1,0,0,1,0|1,0,1]=4 5085 B20R2.6651 O=C(CSc1ccccc1Br)OCc2ccccc2 62a_100000695589_100000753625 [0,1,0,0,1,0|1,0,1]=4 5086 B20R2.6651 O=C(CSc1ccccc1Br)OCc2ccccc2 62a_100000753625_100000695589 [0,1,0,0,1,0|1,0,1]=4 5087 B20R2.6651 O=C(CSc1ccccc1Cl)OCc2ccccc2 62a_100000753625_100000764095 [0,1,0,0,1,0|1,0,1]=4 5088 B20R2.6651 O=C(CSc1ccccc1Cl)OCc2ccccc2 62a_100000764095_100000753625 [0,1,0,0,1,0|1,0,1]=4 5089 B20R2.6651 O=C(CSc1ccccc1F)OCc2ccccc2 62a_100000753625_100011215700 [0,1,0,0,1,0|1,0,1]=4 5090 B20R2.6651 O=C(CSc1ccccc1F)OCc2ccccc2 62a_100011215700_100000753625 [0,1,0,0,1,0|1,0,1]=4 5091 B20R2.6651 O=C(CSc1ccccc1O)OCc2ccccc2 62a_100000739446_100000753625 [0,1,0,0,1,0|1,0,1]=4 5092 B20R2.6651 O=C(CSc1ccccc1O)OCc2ccccc2 62a_100000753625_100000739446 [0,1,0,0,1,0|1,0,1]=4 5093 B20R2.21596 CC(=CC(=O)CCc1ccccc1)c2ccccc2 1458a_100000743005_100000765856 [0,1,0,0,1,0|0,0,0]=2 5094 B20R2.21596 CC(=CC(=O)CCc1ccccn1)c2ccccc2 1458a_100000743005_100015183660 [0,1,0,0,1,0|1,0,0]=3 5095 B20R2.21596 CC(=CC(=O)CCc1cccnc1)c2ccccc2 1458a_100000743005_200011713674 [0,1,0,0,1,0|1,0,0]=3 5096 B20R2.21596 CC(=CC(=O)CCc1ccncc1)c2ccccc2 1458a_100000743005_100000723409 [0,1,0,0,1,0|1,0,0]=3 5097 B20R2.21596 CC(=CC(=O)NCc1ccccc1)c2ccccc2 11a_100015324214_100000743005 [0,1,0,0,1,0|1,0,0]=3 5098 B20R2.21596 CC(=CC(=O)NCc1ccccc1)c2ccccc2 1626a_100015324214_100000743005 [0,1,0,0,1,0|1,0,0]=3 5099 B20R2.21596 CC(=CC(=O)NCc1ccccc1)c2ccccc2 240690a_100015324214_100000743005 [0,1,0,0,1,0|1,0,0]=3 5100 B20R2.21596 CC(=CC(=O)NCc1ccccc1)c2ccccc2 527a_100015324214_100000743005 [0,1,0,0,1,0|1,0,0]=3 5101 B20R2.21596 CC(=CC(=O)NCc1ccccn1)c2ccccc2 11a_100000210449_100000743005 [0,1,0,0,1,0|2,0,0]=4 5102 B20R2.21596 CC(=CC(=O)NCc1ccccn1)c2ccccc2 1626a_100000210449_100000743005 [0,1,0,0,1,0|2,0,0]=4 5103 B20R2.21596 CC(=CC(=O)NCc1ccccn1)c2ccccc2 240690a_100000210449_100000743005 [0,1,0,0,1,0|2,0,0]=4 5104 B20R2.21596 CC(=CC(=O)NCc1ccccn1)c2ccccc2 527a_100000210449_100000743005 [0,1,0,0,1,0|2,0,0]=4 5105 B20R2.21596 CC(=CC(=O)NCc1cccnc1)c2ccccc2 11a_100000210453_100000743005 [0,1,0,0,1,0|2,0,0]=4 5106 B20R2.21596 CC(=CC(=O)NCc1cccnc1)c2ccccc2 240690a_100000210453_100000743005 [0,1,0,0,1,0|2,0,0]=4 5107 B20R2.21596 CC(=CC(=O)NCc1cccnc1)c2ccccc2 527a_100000210453_100000743005 [0,1,0,0,1,0|2,0,0]=4 5108 B20R2.21596 CC(=CC(=O)NCc1ccncc1)c2ccccc2 11a_100000210450_100000743005 [0,1,0,0,1,0|2,0,0]=4 5109 B20R2.21596 CC(=CC(=O)NCc1ccncc1)c2ccccc2 1626a_100000210450_100000743005 [0,1,0,0,1,0|2,0,0]=4 5110 B20R2.21596 CC(=CC(=O)NCc1ccncc1)c2ccccc2 240690a_100000210450_100000743005 [0,1,0,0,1,0|2,0,0]=4 5111 B20R2.21596 CC(=CC(=O)NCc1ccncc1)c2ccccc2 527a_100000210450_100000743005 [0,1,0,0,1,0|2,0,0]=4 5112 B20R2.21596 CC(=CC(=O)NNc1ccccc1)c2ccccc2 22a_100015195140_100000743005 [0,1,0,0,1,0|2,0,0]=4 5113 B20R2.21596 CC(CC(=O)C#Cc1ccccc1)c2ccccc2 1458a_100000736102_100000756946 [0,1,0,0,1,0|0,0,2]=4 5114 B20R2.21596 CC(CC(=O)C=Cc1ccccc1)c2ccccc2 1458a_100000210462_100000756946 [0,1,0,0,1,0|0,0,0]=2 5115 B20R2.21596 CC(CC(=O)C=Cc1ccccn1)c2ccccc2 1458a_100000740811_100000756946 [0,1,0,0,1,0|1,0,0]=3 5116 B20R2.21596 CC(CC(=O)C=Cc1cccnc1)c2ccccc2 1458a_100000735890_100000756946 [0,1,0,0,1,0|1,0,0]=3 5117 B20R2.21596 CC(CC(=O)C=Cc1ccncc1)c2ccccc2 1458a_100000682801_100000756946 [0,1,0,0,1,0|1,0,0]=3 5118 B20R2.21596 CC(CC(=O)CCc1ccccc1)c2ccccc2 1458a_100000183687_100000765856 [0,1,0,0,1,0|0,0,2]=4 5119 B20R2.21596 CC(CC(=O)CCc1ccccc1)c2ccccc2 1458a_100000185753_100000756946 [0,1,0,0,1,0|0,0,2]=4 5120 B20R2.21596 CC(CC(=O)COc1ccccc1)c2ccccc2 1458a_100000186222_100000756946 [0,1,0,0,1,0|1,0,1]=4 5121 B20R2.21596 CC(CC(=O)CSc1ccccc1)c2ccccc2 1458a_100000211596_100000756946 [0,1,0,0,1,0|1,0,1]=4 5122 B20R2.21596 CC(CC(=O)NCc1ccccc1)c2ccccc2 11a_100015324214_100000183687 [0,1,0,0,1,0|1,0,1]=4 5123 B20R2.21596 CC(CC(=O)NCc1ccccc1)c2ccccc2 1626a_100015324214_100000183687 [0,1,0,0,1,0|1,0,1]=4 5124 B20R2.21596 CC(CC(=O)NCc1ccccc1)c2ccccc2 240690a_100015324214_100000183687 [0,1,0,0,1,0|1,0,1]=4 5125 B20R2.21596 CC(CC(=O)NCc1ccccc1)c2ccccc2 527a_100015324214_100000183687 [0,1,0,0,1,0|1,0,1]=4 5126 B20R2.21596 CC(CC(=O)NNc1ccccc1)c2ccccc2 22a_100015195140_100000183687 [0,1,0,0,1,0|2,0,0]=4 5127 B20R2.21596 CC(NC(=O)C=Cc1ccccc1)c2ccccn2 11a_100000181244_100000210462 [0,1,0,0,1,0|2,0,0]=4 5128 B20R2.21596 CC(NC(=O)C=Cc1ccccc1)c2ccccn2 1626a_100000181244_100000210462 [0,1,0,0,1,0|2,0,0]=4 5129 B20R2.21596 CC(NC(=O)C=Cc1ccccc1)c2cccnc2 11a_100000195435_100000210462 [0,1,0,0,1,0|2,0,0]=4 5130 B20R2.21596 CN(CC(=O)CCc1ccccc1)c2ccccc2 1458a_100000745425_100000765856 [0,1,0,0,1,0|1,0,1]=4 5131 B20R2.21596 CN(CC(=O)CCc1ccccc1)c2ccccc2 2230a_100000210012_100012361361 [0,1,0,0,1,0|1,0,1]=4 5132 B20R2.21596 CN(CC(=O)CCc1ccccc1)c2ccccc2 269982a_100000210012_100012361361 [0,1,0,0,1,0|1,0,1]=4 5133 B20R2.21596 CN(CC(=O)CCc1ccccc1)c2ccccc2 34a_100000210012_100012361361 [0,1,0,0,1,0|1,0,1]=4 5134 B20R2.21596 CN(CC(=O)OCc1ccccc1)c2ccccc2 2230a_100000210012_100000753625 [0,1,0,0,1,0|1,0,1]=4 5135 B20R2.21596 CN(CC(=O)OCc1ccccc1)c2ccccc2 269982a_100000210012_100000753625 [0,1,0,0,1,0|1,0,1]=4 5136 B20R2.21596 CN(CC(=O)OCc1ccccc1)c2ccccc2 34a_100000210012_100000753625 [0,1,0,0,1,0|1,0,1]=4 5137 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccccc2 11a_100000751104_100000210462 [0,1,0,0,1,0|1,0,0]=3 5138 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccc1)c2ccccc2 1626a_100000751104_100000210462 [0,1,0,0,1,0|1,0,0]=3 5139 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccccc2 11a_100000751104_100000740811 [0,1,0,0,1,0|2,0,0]=4 5140 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100000751104_100000740811 [0,1,0,0,1,0|2,0,0]=4 5141 B20R2.21596 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccccc2 11a_100000751104_100000735890 [0,1,0,0,1,0|2,0,0]=4 5142 B20R2.21596 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100000751104_100000735890 [0,1,0,0,1,0|2,0,0]=4 5143 B20R2.21596 C[C@@H](NC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100000751104_100000682801 [0,1,0,0,1,0|2,0,0]=4 5144 B20R2.21596 C[C@@H](NC(=O)CCc1ccccc1)c2ccccc2 11a_100000751104_100000185753 [0,1,0,0,1,0|1,0,1]=4 5145 B20R2.21596 C[C@@H](NC(=O)CCc1ccccc1)c2ccccc2 1626a_100000751104_100000185753 [0,1,0,0,1,0|1,0,1]=4 5146 B20R2.21596 C[C@@H](NC(=O)CCc1ccccc1)c2ccccc2 240690a_100000751104_100000185753 [0,1,0,0,1,0|1,0,1]=4 5147 B20R2.21596 C[C@@H](NC(=O)CCc1ccccc1)c2ccccc2 527a_100000751104_100000185753 [0,1,0,0,1,0|1,0,1]=4 5148 B20R2.21596 O=C(C#Cc1ccccc1)CC(O)c2ccccc2 1458a_100000736102_100000185958 [0,1,0,0,1,0|0,0,2]=4 5149 B20R2.21596 O=C(C#Cc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000736102_100011933945 [0,1,0,0,1,0|0,0,2]=4 5150 B20R2.21596 O=C(C=Cc1ccccc1)CC(=O)c2ccccc2 1458a_100000210462_100000211460 [0,1,0,0,1,0|0,0,1]=3 5151 B20R2.21596 O=C(C=Cc1ccccc1)CC(=O)c2ccccn2 1458a_100000210462_100000027445 [0,1,0,0,1,0|1,0,1]=4 5152 B20R2.21596 O=C(C=Cc1ccccc1)CC(=O)c2cccnc2 1458a_100000210462_100015188593 [0,1,0,0,1,0|1,0,1]=4 5153 B20R2.21596 O=C(C=Cc1ccccc1)CC(=O)c2ccncc2 1458a_100000210462_100000027454 [0,1,0,0,1,0|1,0,1]=4 5154 B20R2.21596 O=C(C=Cc1ccccc1)CC(O)c2ccccc2 1458a_100000210462_100000185958 [0,1,0,0,1,0|0,0,0]=2 5155 B20R2.21596 O=C(C=Cc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000210462_100011933945 [0,1,0,0,1,0|0,0,0]=2 5156 B20R2.21596 O=C(C=Cc1ccccn1)CC(=O)c2ccccc2 1458a_100000740811_100000211460 [0,1,0,0,1,0|1,0,1]=4 5157 B20R2.21596 O=C(C=Cc1ccccn1)CC(O)c2ccccc2 1458a_100000740811_100000185958 [0,1,0,0,1,0|1,0,0]=3 5158 B20R2.21596 O=C(C=Cc1ccccn1)C[C@@H](O)c2ccccc2 1458a_100000740811_100011933945 [0,1,0,0,1,0|1,0,0]=3 5159 B20R2.21596 O=C(C=Cc1cccnc1)CC(=O)c2ccccc2 1458a_100000735890_100000211460 [0,1,0,0,1,0|1,0,1]=4 5160 B20R2.21596 O=C(C=Cc1cccnc1)CC(O)c2ccccc2 1458a_100000735890_100000185958 [0,1,0,0,1,0|1,0,0]=3 5161 B20R2.21596 O=C(C=Cc1cccnc1)C[C@@H](O)c2ccccc2 1458a_100000735890_100011933945 [0,1,0,0,1,0|1,0,0]=3 5162 B20R2.21596 O=C(C=Cc1ccncc1)CC(=O)c2ccccc2 1458a_100000682801_100000211460 [0,1,0,0,1,0|1,0,1]=4 5163 B20R2.21596 O=C(C=Cc1ccncc1)CC(O)c2ccccc2 1458a_100000682801_100000185958 [0,1,0,0,1,0|1,0,0]=3 5164 B20R2.21596 O=C(C=Cc1ccncc1)C[C@@H](O)c2ccccc2 1458a_100000682801_100011933945 [0,1,0,0,1,0|1,0,0]=3 5165 B20R2.21596 O=C(CC(=O)c1ccccc1)NCc2ccccc2 1458a_100000185807_100000183539 [0,1,0,0,1,0|1,0,1]=4 5166 B20R2.21596 O=C(CC(=O)c1ccccc1)OCc2ccccc2 1458a_100000185807_100000753625 [0,1,0,0,1,0|0,0,1]=3 5167 B20R2.21596 O=C(CC(O)c1ccccc1)NCc2ccccc2 240690a_100015324214_100000690199 [0,1,0,0,1,0|1,0,1]=4 5168 B20R2.21596 O=C(CC(O)c1ccccc1)NNc2ccccc2 22a_100015195140_100000690199 [0,1,0,0,1,0|2,0,0]=4 5169 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2ccccc2 1458a_100000185753_100000211460 [0,1,0,0,1,0|0,0,1]=3 5170 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2ccccc2 1458a_100000185807_100012361361 [0,1,0,0,1,0|0,0,1]=3 5171 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2ccccn2 1458a_100000185753_100000027445 [0,1,0,0,1,0|1,0,1]=4 5172 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2cccnc2 1458a_100000185753_100015188593 [0,1,0,0,1,0|1,0,1]=4 5173 B20R2.21596 O=C(CCc1ccccc1)CC(=O)c2ccncc2 1458a_100000185753_100000027454 [0,1,0,0,1,0|1,0,1]=4 5174 B20R2.21596 O=C(CCc1ccccc1)CC(O)c2ccccc2 1458a_100000185753_100000185958 [0,1,0,0,1,0|0,0,2]=4 5175 B20R2.21596 O=C(CCc1ccccc1)CC(O)c2ccccc2 1458a_100000690199_100000765856 [0,1,0,0,1,0|0,0,2]=4 5176 B20R2.21596 O=C(CCc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000185753_100011933945 [0,1,0,0,1,0|0,0,2]=4 5177 B20R2.21596 O=C(CCc1ccccn1)CC(=O)c2ccccc2 1458a_100015195070_100000211460 [0,1,0,0,1,0|1,0,1]=4 5178 B20R2.21596 O=C(CCc1cccnc1)CC(=O)c2ccccc2 1458a_100000198484_100000211460 [0,1,0,0,1,0|1,0,1]=4 5179 B20R2.21596 O=C(CCc1ccncc1)CC(=O)c2ccccc2 1458a_100011225043_100000211460 [0,1,0,0,1,0|1,0,1]=4 5180 B20R2.21596 O=C(COc1ccccc1)CC(=O)c2ccccc2 1458a_100000186222_100000211460 [0,1,0,0,1,0|1,0,1]=4 5181 B20R2.21596 O=C(COc1ccccc1)CC(O)c2ccccc2 1458a_100000186222_100000185958 [0,1,0,0,1,0|1,0,1]=4 5182 B20R2.21596 O=C(COc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000186222_100011933945 [0,1,0,0,1,0|1,0,1]=4 5183 B20R2.21596 O=C(COc1ccccc1)NC(=O)c2ccccc2 7a_100000210340_100000010347 [0,1,0,0,1,0|2,0,0]=4 5184 B20R2.21596 O=C(CSc1ccccc1)CC(=O)c2ccccc2 1458a_100000211596_100000211460 [0,1,0,0,1,0|1,0,1]=4 5185 B20R2.21596 O=C(CSc1ccccc1)CC(O)c2ccccc2 1458a_100000211596_100000185958 [0,1,0,0,1,0|1,0,1]=4 5186 B20R2.21596 O=C(CSc1ccccc1)C[C@@H](O)c2ccccc2 1458a_100000211596_100011933945 [0,1,0,0,1,0|1,0,1]=4 5187 B20R2.21596 O=C(CSc1ccccc1)NC(=O)c2ccccc2 62a_100000719477_100000010347 [0,1,0,0,1,0|2,0,0]=4 5188 B20R2.2714576 O=S(=O)(C=Cc1ccccc1)NCc2ccccc2 40a_100015324214_100011098038 [0,1,0,0,1,0|2,0,0]=4 5189 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2cccs2 11a_100000705350_100000182767 [0,1,0,0,1,0|2,0,0]=4 5190 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2cccs2 1626a_100000705350_100000182767 [0,1,0,0,1,0|2,0,0]=4 5191 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2cccs2 240690a_100000705350_100000182767 [0,1,0,0,1,0|2,0,0]=4 5192 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2ccoc2 11a_100000705350_100000238621 [0,1,0,0,1,0|2,0,0]=4 5193 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2ccoc2 1626a_100000705350_100000238621 [0,1,0,0,1,0|2,0,0]=4 5194 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2ccoc2 240690a_100000705350_100000238621 [0,1,0,0,1,0|2,0,0]=4 5195 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2ccsc2 11a_100000705350_100000698588 [0,1,0,0,1,0|2,0,0]=4 5196 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2ccsc2 1626a_100000705350_100000698588 [0,1,0,0,1,0|2,0,0]=4 5197 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2ccsc2 240690a_100000705350_100000698588 [0,1,0,0,1,0|2,0,0]=4 5198 B20R2.4452 Cc1ccc(cc1)CCNC(=O)C=Cc2ccsc2 527a_100000705350_100000698588 [0,1,0,0,1,0|2,0,0]=4 5199 B20R2.4452 O=C(C=Cc1cccs1)CCCc2ccc(cc2)Br 1458a_100000182767_100011713682 [0,1,0,0,1,0|2,0,0]=4 5200 B20R2.4452 O=C(C=Cc1cccs1)CCCc2ccc(cc2)Cl 1458a_100000182767_100000759440 [0,1,0,0,1,0|2,0,0]=4 5201 B20R2.4452 O=C(C=Cc1cccs1)CCCc2ccc(cc2)F 1458a_100000182767_200011713563 [0,1,0,0,1,0|2,0,0]=4 5202 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)Br 11a_100000755846_100000182767 [0,1,0,0,1,0|2,0,0]=4 5203 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)Br 1626a_100000755846_100000182767 [0,1,0,0,1,0|2,0,0]=4 5204 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)Br 240690a_100000755846_100000182767 [0,1,0,0,1,0|2,0,0]=4 5205 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)Cl 11a_100000185265_100000182767 [0,1,0,0,1,0|2,0,0]=4 5206 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)Cl 1626a_100000185265_100000182767 [0,1,0,0,1,0|2,0,0]=4 5207 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000182767 [0,1,0,0,1,0|2,0,0]=4 5208 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)F 11a_100000199005_100000182767 [0,1,0,0,1,0|2,0,0]=4 5209 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)F 1626a_100000199005_100000182767 [0,1,0,0,1,0|2,0,0]=4 5210 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)F 240690a_100000199005_100000182767 [0,1,0,0,1,0|2,0,0]=4 5211 B20R2.4452 O=C(C=Cc1cccs1)NCCc2ccc(cc2)O 240690a_100000743037_100000182767 [0,1,0,0,1,0|2,0,0]=4 5212 B20R2.4452 O=C(C=Cc1ccoc1)CCCc2ccc(cc2)Br 1458a_100000238621_100011713682 [0,1,0,0,1,0|2,0,0]=4 5213 B20R2.4452 O=C(C=Cc1ccoc1)CCCc2ccc(cc2)Cl 1458a_100000238621_100000759440 [0,1,0,0,1,0|2,0,0]=4 5214 B20R2.4452 O=C(C=Cc1ccoc1)CCCc2ccc(cc2)F 1458a_100000238621_200011713563 [0,1,0,0,1,0|2,0,0]=4 5215 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)Br 11a_100000755846_100000238621 [0,1,0,0,1,0|2,0,0]=4 5216 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)Br 1626a_100000755846_100000238621 [0,1,0,0,1,0|2,0,0]=4 5217 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000238621 [0,1,0,0,1,0|2,0,0]=4 5218 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000238621 [0,1,0,0,1,0|2,0,0]=4 5219 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100000238621 [0,1,0,0,1,0|2,0,0]=4 5220 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000238621 [0,1,0,0,1,0|2,0,0]=4 5221 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)F 11a_100000199005_100000238621 [0,1,0,0,1,0|2,0,0]=4 5222 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)F 1626a_100000199005_100000238621 [0,1,0,0,1,0|2,0,0]=4 5223 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)F 240690a_100000199005_100000238621 [0,1,0,0,1,0|2,0,0]=4 5224 B20R2.4452 O=C(C=Cc1ccoc1)NCCc2ccc(cc2)O 240690a_100000743037_100000238621 [0,1,0,0,1,0|2,0,0]=4 5225 B20R2.4452 O=C(C=Cc1ccsc1)CCCc2ccc(cc2)Br 1458a_100000698588_100011713682 [0,1,0,0,1,0|2,0,0]=4 5226 B20R2.4452 O=C(C=Cc1ccsc1)CCCc2ccc(cc2)Cl 1458a_100000698588_100000759440 [0,1,0,0,1,0|2,0,0]=4 5227 B20R2.4452 O=C(C=Cc1ccsc1)CCCc2ccc(cc2)F 1458a_100000698588_200011713563 [0,1,0,0,1,0|2,0,0]=4 5228 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)Br 11a_100000755846_100000698588 [0,1,0,0,1,0|2,0,0]=4 5229 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)Br 1626a_100000755846_100000698588 [0,1,0,0,1,0|2,0,0]=4 5230 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)Br 240690a_100000755846_100000698588 [0,1,0,0,1,0|2,0,0]=4 5231 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)Br 527a_100000755846_100000698588 [0,1,0,0,1,0|2,0,0]=4 5232 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)Cl 11a_100000185265_100000698588 [0,1,0,0,1,0|2,0,0]=4 5233 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100000698588 [0,1,0,0,1,0|2,0,0]=4 5234 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100000698588 [0,1,0,0,1,0|2,0,0]=4 5235 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)Cl 527a_100000185265_100000698588 [0,1,0,0,1,0|2,0,0]=4 5236 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)F 11a_100000199005_100000698588 [0,1,0,0,1,0|2,0,0]=4 5237 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)F 1626a_100000199005_100000698588 [0,1,0,0,1,0|2,0,0]=4 5238 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)F 240690a_100000199005_100000698588 [0,1,0,0,1,0|2,0,0]=4 5239 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)F 527a_100000199005_100000698588 [0,1,0,0,1,0|2,0,0]=4 5240 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)O 240690a_100000743037_100000698588 [0,1,0,0,1,0|2,0,0]=4 5241 B20R2.4452 O=C(C=Cc1ccsc1)NCCc2ccc(cc2)O 527a_100000743037_100000698588 [0,1,0,0,1,0|2,0,0]=4 5242 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2cccs2 11a_100000749837_100000182767 [0,1,0,0,1,0|2,0,0]=4 5243 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2cccs2 1626a_100000749837_100000182767 [0,1,0,0,1,0|2,0,0]=4 5244 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2cccs2 240690a_100000749837_100000182767 [0,1,0,0,1,0|2,0,0]=4 5245 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2ccoc2 11a_100000749837_100000238621 [0,1,0,0,1,0|2,0,0]=4 5246 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2ccoc2 1626a_100000749837_100000238621 [0,1,0,0,1,0|2,0,0]=4 5247 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2ccoc2 240690a_100000749837_100000238621 [0,1,0,0,1,0|2,0,0]=4 5248 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2ccsc2 11a_100000749837_100000698588 [0,1,0,0,1,0|2,0,0]=4 5249 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2ccsc2 1626a_100000749837_100000698588 [0,1,0,0,1,0|2,0,0]=4 5250 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2ccsc2 240690a_100000749837_100000698588 [0,1,0,0,1,0|2,0,0]=4 5251 B20R2.4662 Cc1cccc(c1)CCNC(=O)C=Cc2ccsc2 527a_100000749837_100000698588 [0,1,0,0,1,0|2,0,0]=4 5252 B20R2.4662 O=C(C=Cc1cccs1)CCCc2cccc(c2)Br 1458a_100000182767_100011713683 [0,1,0,0,1,0|2,0,0]=4 5253 B20R2.4662 O=C(C=Cc1cccs1)CCCc2cccc(c2)F 1458a_100000182767_200000698031 [0,1,0,0,1,0|2,0,0]=4 5254 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)Br 11a_100011207229_100000182767 [0,1,0,0,1,0|2,0,0]=4 5255 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)Br 1626a_100011207229_100000182767 [0,1,0,0,1,0|2,0,0]=4 5256 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)Br 240690a_100011207229_100000182767 [0,1,0,0,1,0|2,0,0]=4 5257 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)Cl 11a_100000185263_100000182767 [0,1,0,0,1,0|2,0,0]=4 5258 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)Cl 1626a_100000185263_100000182767 [0,1,0,0,1,0|2,0,0]=4 5259 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)Cl 240690a_100000185263_100000182767 [0,1,0,0,1,0|2,0,0]=4 5260 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)F 11a_100000205154_100000182767 [0,1,0,0,1,0|2,0,0]=4 5261 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)F 1626a_100000205154_100000182767 [0,1,0,0,1,0|2,0,0]=4 5262 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)F 240690a_100000205154_100000182767 [0,1,0,0,1,0|2,0,0]=4 5263 B20R2.4662 O=C(C=Cc1cccs1)NCCc2cccc(c2)O 240690a_100000747277_100000182767 [0,1,0,0,1,0|2,0,0]=4 5264 B20R2.4662 O=C(C=Cc1ccoc1)CCCc2cccc(c2)Br 1458a_100000238621_100011713683 [0,1,0,0,1,0|2,0,0]=4 5265 B20R2.4662 O=C(C=Cc1ccoc1)CCCc2cccc(c2)F 1458a_100000238621_200000698031 [0,1,0,0,1,0|2,0,0]=4 5266 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)Br 11a_100011207229_100000238621 [0,1,0,0,1,0|2,0,0]=4 5267 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)Br 1626a_100011207229_100000238621 [0,1,0,0,1,0|2,0,0]=4 5268 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)Br 240690a_100011207229_100000238621 [0,1,0,0,1,0|2,0,0]=4 5269 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)Cl 11a_100000185263_100000238621 [0,1,0,0,1,0|2,0,0]=4 5270 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)Cl 1626a_100000185263_100000238621 [0,1,0,0,1,0|2,0,0]=4 5271 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000238621 [0,1,0,0,1,0|2,0,0]=4 5272 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)F 11a_100000205154_100000238621 [0,1,0,0,1,0|2,0,0]=4 5273 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)F 1626a_100000205154_100000238621 [0,1,0,0,1,0|2,0,0]=4 5274 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)F 240690a_100000205154_100000238621 [0,1,0,0,1,0|2,0,0]=4 5275 B20R2.4662 O=C(C=Cc1ccoc1)NCCc2cccc(c2)O 240690a_100000747277_100000238621 [0,1,0,0,1,0|2,0,0]=4 5276 B20R2.4662 O=C(C=Cc1ccsc1)CCCc2cccc(c2)Br 1458a_100000698588_100011713683 [0,1,0,0,1,0|2,0,0]=4 5277 B20R2.4662 O=C(C=Cc1ccsc1)CCCc2cccc(c2)F 1458a_100000698588_200000698031 [0,1,0,0,1,0|2,0,0]=4 5278 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)Br 11a_100011207229_100000698588 [0,1,0,0,1,0|2,0,0]=4 5279 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)Br 1626a_100011207229_100000698588 [0,1,0,0,1,0|2,0,0]=4 5280 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)Br 240690a_100011207229_100000698588 [0,1,0,0,1,0|2,0,0]=4 5281 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)Br 527a_100011207229_100000698588 [0,1,0,0,1,0|2,0,0]=4 5282 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)Cl 11a_100000185263_100000698588 [0,1,0,0,1,0|2,0,0]=4 5283 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)Cl 1626a_100000185263_100000698588 [0,1,0,0,1,0|2,0,0]=4 5284 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)Cl 240690a_100000185263_100000698588 [0,1,0,0,1,0|2,0,0]=4 5285 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)Cl 527a_100000185263_100000698588 [0,1,0,0,1,0|2,0,0]=4 5286 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)F 11a_100000205154_100000698588 [0,1,0,0,1,0|2,0,0]=4 5287 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)F 1626a_100000205154_100000698588 [0,1,0,0,1,0|2,0,0]=4 5288 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)F 240690a_100000205154_100000698588 [0,1,0,0,1,0|2,0,0]=4 5289 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)F 527a_100000205154_100000698588 [0,1,0,0,1,0|2,0,0]=4 5290 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)O 240690a_100000747277_100000698588 [0,1,0,0,1,0|2,0,0]=4 5291 B20R2.4662 O=C(C=Cc1ccsc1)NCCc2cccc(c2)O 527a_100000747277_100000698588 [0,1,0,0,1,0|2,0,0]=4 5292 B20R2.4864 Cc1ccsc1C=CC(=O)CCCc2ccccc2 1458a_100000185125_100000211621 [0,1,0,0,1,0|2,0,0]=4 5293 B20R2.4864 Cc1ccsc1C=CC(=O)NCCc2ccccc2 11a_100000106460_100000185125 [0,1,0,0,1,0|2,0,0]=4 5294 B20R2.4864 Cc1ccsc1C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000185125 [0,1,0,0,1,0|2,0,0]=4 5295 B20R2.4864 Cc1ccsc1C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000185125 [0,1,0,0,1,0|2,0,0]=4 5296 B20R2.4864 Cc1ccsc1C=CC(=O)NCCc2ccccc2 527a_100000106460_100000185125 [0,1,0,0,1,0|2,0,0]=4 5297 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2cccs2 11a_100000685071_100000182767 [0,1,0,0,1,0|2,0,0]=4 5298 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2cccs2 1626a_100000685071_100000182767 [0,1,0,0,1,0|2,0,0]=4 5299 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2cccs2 240690a_100000685071_100000182767 [0,1,0,0,1,0|2,0,0]=4 5300 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2ccoc2 11a_100000685071_100000238621 [0,1,0,0,1,0|2,0,0]=4 5301 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2ccoc2 1626a_100000685071_100000238621 [0,1,0,0,1,0|2,0,0]=4 5302 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2ccoc2 240690a_100000685071_100000238621 [0,1,0,0,1,0|2,0,0]=4 5303 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2ccsc2 11a_100000685071_100000698588 [0,1,0,0,1,0|2,0,0]=4 5304 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2ccsc2 1626a_100000685071_100000698588 [0,1,0,0,1,0|2,0,0]=4 5305 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2ccsc2 240690a_100000685071_100000698588 [0,1,0,0,1,0|2,0,0]=4 5306 B20R2.6653 Cc1ccccc1CCNC(=O)C=Cc2ccsc2 527a_100000685071_100000698588 [0,1,0,0,1,0|2,0,0]=4 5307 B20R2.6653 O=C(C=Cc1cccs1)CCCc2ccccc2Br 1458a_100000182767_200011713681 [0,1,0,0,1,0|2,0,0]=4 5308 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2Br 11a_100000747383_100000182767 [0,1,0,0,1,0|2,0,0]=4 5309 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2Br 1626a_100000747383_100000182767 [0,1,0,0,1,0|2,0,0]=4 5310 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2Br 240690a_100000747383_100000182767 [0,1,0,0,1,0|2,0,0]=4 5311 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2Cl 11a_100011207228_100000182767 [0,1,0,0,1,0|2,0,0]=4 5312 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2Cl 1626a_100011207228_100000182767 [0,1,0,0,1,0|2,0,0]=4 5313 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2Cl 240690a_100011207228_100000182767 [0,1,0,0,1,0|2,0,0]=4 5314 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2F 11a_100000185272_100000182767 [0,1,0,0,1,0|2,0,0]=4 5315 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2F 1626a_100000185272_100000182767 [0,1,0,0,1,0|2,0,0]=4 5316 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2F 240690a_100000185272_100000182767 [0,1,0,0,1,0|2,0,0]=4 5317 B20R2.6653 O=C(C=Cc1cccs1)NCCc2ccccc2O 240690a_100011207237_100000182767 [0,1,0,0,1,0|2,0,0]=4 5318 B20R2.6653 O=C(C=Cc1ccoc1)CCCc2ccccc2Br 1458a_100000238621_200011713681 [0,1,0,0,1,0|2,0,0]=4 5319 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2Br 11a_100000747383_100000238621 [0,1,0,0,1,0|2,0,0]=4 5320 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2Br 1626a_100000747383_100000238621 [0,1,0,0,1,0|2,0,0]=4 5321 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2Br 240690a_100000747383_100000238621 [0,1,0,0,1,0|2,0,0]=4 5322 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2Cl 11a_100011207228_100000238621 [0,1,0,0,1,0|2,0,0]=4 5323 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2Cl 1626a_100011207228_100000238621 [0,1,0,0,1,0|2,0,0]=4 5324 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2Cl 240690a_100011207228_100000238621 [0,1,0,0,1,0|2,0,0]=4 5325 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2F 11a_100000185272_100000238621 [0,1,0,0,1,0|2,0,0]=4 5326 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2F 1626a_100000185272_100000238621 [0,1,0,0,1,0|2,0,0]=4 5327 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2F 240690a_100000185272_100000238621 [0,1,0,0,1,0|2,0,0]=4 5328 B20R2.6653 O=C(C=Cc1ccoc1)NCCc2ccccc2O 240690a_100011207237_100000238621 [0,1,0,0,1,0|2,0,0]=4 5329 B20R2.6653 O=C(C=Cc1ccsc1)CCCc2ccccc2Br 1458a_100000698588_200011713681 [0,1,0,0,1,0|2,0,0]=4 5330 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2Br 11a_100000747383_100000698588 [0,1,0,0,1,0|2,0,0]=4 5331 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2Br 1626a_100000747383_100000698588 [0,1,0,0,1,0|2,0,0]=4 5332 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2Br 240690a_100000747383_100000698588 [0,1,0,0,1,0|2,0,0]=4 5333 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2Br 527a_100000747383_100000698588 [0,1,0,0,1,0|2,0,0]=4 5334 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2Cl 11a_100011207228_100000698588 [0,1,0,0,1,0|2,0,0]=4 5335 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2Cl 1626a_100011207228_100000698588 [0,1,0,0,1,0|2,0,0]=4 5336 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2Cl 240690a_100011207228_100000698588 [0,1,0,0,1,0|2,0,0]=4 5337 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2Cl 527a_100011207228_100000698588 [0,1,0,0,1,0|2,0,0]=4 5338 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2F 11a_100000185272_100000698588 [0,1,0,0,1,0|2,0,0]=4 5339 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2F 1626a_100000185272_100000698588 [0,1,0,0,1,0|2,0,0]=4 5340 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2F 240690a_100000185272_100000698588 [0,1,0,0,1,0|2,0,0]=4 5341 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2F 527a_100000185272_100000698588 [0,1,0,0,1,0|2,0,0]=4 5342 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2O 240690a_100011207237_100000698588 [0,1,0,0,1,0|2,0,0]=4 5343 B20R2.6653 O=C(C=Cc1ccsc1)NCCc2ccccc2O 527a_100011207237_100000698588 [0,1,0,0,1,0|2,0,0]=4 5344 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2cccs2 11a_100000207497_100000182767 [0,1,0,0,1,0|2,0,0]=4 5345 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2cccs2 1626a_100000207497_100000182767 [0,1,0,0,1,0|2,0,0]=4 5346 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2cccs2 240690a_100000207497_100000182767 [0,1,0,0,1,0|2,0,0]=4 5347 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2ccoc2 11a_100000207497_100000238621 [0,1,0,0,1,0|2,0,0]=4 5348 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2ccoc2 1626a_100000207497_100000238621 [0,1,0,0,1,0|2,0,0]=4 5349 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2ccoc2 240690a_100000207497_100000238621 [0,1,0,0,1,0|2,0,0]=4 5350 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2ccsc2 11a_100000207497_100000698588 [0,1,0,0,1,0|2,0,0]=4 5351 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2ccsc2 1626a_100000207497_100000698588 [0,1,0,0,1,0|2,0,0]=4 5352 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2ccsc2 240690a_100000207497_100000698588 [0,1,0,0,1,0|2,0,0]=4 5353 B20R2.21576 CN(CCc1ccccc1)C(=O)C=Cc2ccsc2 527a_100000207497_100000698588 [0,1,0,0,1,0|2,0,0]=4 5354 B20R2.21600 CC(CNC(=O)C=Cc1cccs1)c2ccccc2 11a_100000701038_100000182767 [0,1,0,0,1,0|2,0,0]=4 5355 B20R2.21600 CC(CNC(=O)C=Cc1cccs1)c2ccccc2 1626a_100000701038_100000182767 [0,1,0,0,1,0|2,0,0]=4 5356 B20R2.21600 CC(CNC(=O)C=Cc1cccs1)c2ccccc2 240690a_100000701038_100000182767 [0,1,0,0,1,0|2,0,0]=4 5357 B20R2.21600 CC(CNC(=O)C=Cc1ccoc1)c2ccccc2 11a_100000701038_100000238621 [0,1,0,0,1,0|2,0,0]=4 5358 B20R2.21600 CC(CNC(=O)C=Cc1ccoc1)c2ccccc2 1626a_100000701038_100000238621 [0,1,0,0,1,0|2,0,0]=4 5359 B20R2.21600 CC(CNC(=O)C=Cc1ccoc1)c2ccccc2 240690a_100000701038_100000238621 [0,1,0,0,1,0|2,0,0]=4 5360 B20R2.21600 CC(CNC(=O)C=Cc1ccsc1)c2ccccc2 11a_100000701038_100000698588 [0,1,0,0,1,0|2,0,0]=4 5361 B20R2.21600 CC(CNC(=O)C=Cc1ccsc1)c2ccccc2 1626a_100000701038_100000698588 [0,1,0,0,1,0|2,0,0]=4 5362 B20R2.21600 CC(CNC(=O)C=Cc1ccsc1)c2ccccc2 240690a_100000701038_100000698588 [0,1,0,0,1,0|2,0,0]=4 5363 B20R2.21600 CC(CNC(=O)C=Cc1ccsc1)c2ccccc2 527a_100000701038_100000698588 [0,1,0,0,1,0|2,0,0]=4 5364 B20R2.21600 O=C(C=Cc1cccs1)CC[C@@H](O)c2ccccc2 1458a_100000182767_100000729684 [0,1,0,0,1,0|2,0,0]=4 5365 B20R2.21600 O=C(C=Cc1cccs1)NCC(O)c2ccccc2 240690a_100000210709_100000182767 [0,1,0,0,1,0|2,0,0]=4 5366 B20R2.21600 O=C(C=Cc1ccoc1)CC[C@@H](O)c2ccccc2 1458a_100000238621_100000729684 [0,1,0,0,1,0|2,0,0]=4 5367 B20R2.21600 O=C(C=Cc1ccoc1)NCC(O)c2ccccc2 240690a_100000210709_100000238621 [0,1,0,0,1,0|2,0,0]=4 5368 B20R2.21600 O=C(C=Cc1ccsc1)CC[C@@H](O)c2ccccc2 1458a_100000698588_100000729684 [0,1,0,0,1,0|2,0,0]=4 5369 B20R2.21600 O=C(C=Cc1ccsc1)NCC(O)c2ccccc2 240690a_100000210709_100000698588 [0,1,0,0,1,0|2,0,0]=4 5370 B20R2.21600 O=C(C=Cc1ccsc1)NCC(O)c2ccccc2 527a_100000210709_100000698588 [0,1,0,0,1,0|2,0,0]=4 5371 B20R2.67107 Cc1ccc(o1)C=CC(=O)CCCc2ccccc2 1458a_100000183563_100000211621 [0,1,0,0,1,0|2,0,0]=4 5372 B20R2.67107 Cc1ccc(o1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000183563 [0,1,0,0,1,0|2,0,0]=4 5373 B20R2.67107 Cc1ccc(o1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000183563 [0,1,0,0,1,0|2,0,0]=4 5374 B20R2.67107 Cc1ccc(o1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000183563 [0,1,0,0,1,0|2,0,0]=4 5375 B20R2.67107 Cc1ccc(o1)C=CC(=O)NCCc2ccccc2 527a_100000106460_100000183563 [0,1,0,0,1,0|2,0,0]=4 5376 B20R2.67107 Cc1ccc(s1)C=CC(=O)CCCc2ccccc2 1458a_100102558089_100000211621 [0,1,0,0,1,0|2,0,0]=4 5377 B20R2.67107 Cc1ccc(s1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100102558089 [0,1,0,0,1,0|2,0,0]=4 5378 B20R2.67107 Cc1ccc(s1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100102558089 [0,1,0,0,1,0|2,0,0]=4 5379 B20R2.67107 Cc1ccc(s1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100102558089 [0,1,0,0,1,0|2,0,0]=4 5380 B20R2.67107 O=C(C=Cc1cc(cs1)Br)CCCc2ccccc2 1458a_100102601599_100000211621 [0,1,0,0,1,0|2,0,0]=4 5381 B20R2.67107 O=C(C=Cc1cc(cs1)Br)NCCc2ccccc2 11a_100000106460_100102601599 [0,1,0,0,1,0|2,0,0]=4 5382 B20R2.67107 O=C(C=Cc1cc(cs1)Br)NCCc2ccccc2 1626a_100000106460_100102601599 [0,1,0,0,1,0|2,0,0]=4 5383 B20R2.67107 O=C(C=Cc1cc(cs1)Br)NCCc2ccccc2 240690a_100000106460_100102601599 [0,1,0,0,1,0|2,0,0]=4 5384 B20R2.67107 O=C(C=Cc1ccc(o1)Br)CCCc2ccccc2 1458a_100000182240_100000211621 [0,1,0,0,1,0|2,0,0]=4 5385 B20R2.67107 O=C(C=Cc1ccc(o1)Br)NCCc2ccccc2 11a_100000106460_100000182240 [0,1,0,0,1,0|2,0,0]=4 5386 B20R2.67107 O=C(C=Cc1ccc(o1)Br)NCCc2ccccc2 240690a_100000106460_100000182240 [0,1,0,0,1,0|2,0,0]=4 5387 B20R2.67107 O=C(C=Cc1ccc(o1)I)CCCc2ccccc2 1458a_100000679848_100000211621 [0,1,0,0,1,0|2,0,0]=4 5388 B20R2.67107 O=C(C=Cc1ccc(o1)I)NCCc2ccccc2 11a_100000106460_100000679848 [0,1,0,0,1,0|2,0,0]=4 5389 B20R2.67107 O=C(C=Cc1ccc(o1)I)NCCc2ccccc2 1626a_100000106460_100000679848 [0,1,0,0,1,0|2,0,0]=4 5390 B20R2.67107 O=C(C=Cc1ccc(o1)I)NCCc2ccccc2 240690a_100000106460_100000679848 [0,1,0,0,1,0|2,0,0]=4 5391 B20R2.67107 O=C(C=Cc1ccc(s1)Br)CCCc2ccccc2 1458a_100102558031_100000211621 [0,1,0,0,1,0|2,0,0]=4 5392 B20R2.67107 O=C(C=Cc1ccc(s1)Br)NCCc2ccccc2 11a_100000106460_100102558031 [0,1,0,0,1,0|2,0,0]=4 5393 B20R2.67107 O=C(C=Cc1ccc(s1)Br)NCCc2ccccc2 1626a_100000106460_100102558031 [0,1,0,0,1,0|2,0,0]=4 5394 B20R2.67107 O=C(C=Cc1ccc(s1)Br)NCCc2ccccc2 240690a_100000106460_100102558031 [0,1,0,0,1,0|2,0,0]=4 5395 B20R2.67107 O=C(C=Cc1ccc(s1)Cl)CCCc2ccccc2 1458a_100102558157_100000211621 [0,1,0,0,1,0|2,0,0]=4 5396 B20R2.67107 O=C(C=Cc1ccc(s1)Cl)NCCc2ccccc2 11a_100000106460_100102558157 [0,1,0,0,1,0|2,0,0]=4 5397 B20R2.67107 O=C(C=Cc1ccc(s1)Cl)NCCc2ccccc2 1626a_100000106460_100102558157 [0,1,0,0,1,0|2,0,0]=4 5398 B20R2.67107 O=C(C=Cc1ccc(s1)Cl)NCCc2ccccc2 240690a_100000106460_100102558157 [0,1,0,0,1,0|2,0,0]=4 5399 B20R2.174733 CC(=Cc1ccco1)C(=O)CCCc2ccccc2 1458a_100011995979_100000211621 [0,1,0,0,1,0|2,0,0]=4 5400 B20R2.174733 CC(=Cc1ccco1)C(=O)NCCc2ccccc2 11a_100000106460_100011995979 [0,1,0,0,1,0|2,0,0]=4 5401 B20R2.174733 CC(=Cc1ccco1)C(=O)NCCc2ccccc2 1626a_100000106460_100011995979 [0,1,0,0,1,0|2,0,0]=4 5402 B20R2.174733 CC(=Cc1ccco1)C(=O)NCCc2ccccc2 527a_100000106460_100011995979 [0,1,0,0,1,0|2,0,0]=4 5403 B20R2.4406 Cc1ccc(o1)CCNC(=O)C=Cc2ccccc2 11a_100000739271_100000210462 [0,1,0,0,1,0|2,0,0]=4 5404 B20R2.4406 Cc1ccc(o1)CCNC(=O)C=Cc2ccccc2 1626a_100000739271_100000210462 [0,1,0,0,1,0|2,0,0]=4 5405 B20R2.4406 O=C(C=Cc1ccccc1)NCCc2ccc(s2)Br 11a_100000217605_100000210462 [0,1,0,0,1,0|2,0,0]=4 5406 B20R2.4406 O=C(C=Cc1ccccc1)NCCc2ccc(s2)Br 1626a_100000217605_100000210462 [0,1,0,0,1,0|2,0,0]=4 5407 B20R2.4868 Cn1cccc1CCNC(=O)C=Cc2ccccc2 11a_100011251756_100000210462 [0,1,0,0,1,0|2,0,0]=4 5408 B20R2.4868 Cn1cccc1CCNC(=O)C=Cc2ccccc2 1626a_100011251756_100000210462 [0,1,0,0,1,0|2,0,0]=4 5409 B20R2.15572 Cc1ccc(cc1)C=CC(=O)CCCc2cccs2 1458a_100000716854_100010992444 [0,1,0,0,1,0|2,0,0]=4 5410 B20R2.15572 Cc1ccc(cc1)C=CC(=O)CCCn2cccc2 1458a_100000716854_200009814367 [0,1,0,0,1,0|2,0,0]=4 5411 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2ccco2 11a_100000694680_100000716854 [0,1,0,0,1,0|2,0,0]=4 5412 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2ccco2 1626a_100000694680_100000716854 [0,1,0,0,1,0|2,0,0]=4 5413 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2ccco2 240690a_100000694680_100000716854 [0,1,0,0,1,0|2,0,0]=4 5414 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2cccs2 11a_100000203755_100000716854 [0,1,0,0,1,0|2,0,0]=4 5415 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2cccs2 1626a_100000203755_100000716854 [0,1,0,0,1,0|2,0,0]=4 5416 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2cccs2 240690a_100000203755_100000716854 [0,1,0,0,1,0|2,0,0]=4 5417 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2ccsc2 11a_100000692642_100000716854 [0,1,0,0,1,0|2,0,0]=4 5418 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2ccsc2 1626a_100000692642_100000716854 [0,1,0,0,1,0|2,0,0]=4 5419 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCc2ccsc2 240690a_100000692642_100000716854 [0,1,0,0,1,0|2,0,0]=4 5420 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCn2cccc2 11a_100011368172_100000716854 [0,1,0,0,1,0|2,0,0]=4 5421 B20R2.15572 Cc1ccc(cc1)C=CC(=O)NCCn2cccc2 240690a_100011368172_100000716854 [0,1,0,0,1,0|2,0,0]=4 5422 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)CCCc2cccs2 1458a_100016267368_100010992444 [0,1,0,0,1,0|2,0,0]=4 5423 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)CCCn2cccc2 1458a_100016267368_200009814367 [0,1,0,0,1,0|2,0,0]=4 5424 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)NCCc2ccco2 11a_100000694680_100016267368 [0,1,0,0,1,0|2,0,0]=4 5425 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)NCCc2ccco2 1626a_100000694680_100016267368 [0,1,0,0,1,0|2,0,0]=4 5426 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)NCCc2cccs2 11a_100000203755_100016267368 [0,1,0,0,1,0|2,0,0]=4 5427 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)NCCc2cccs2 1626a_100000203755_100016267368 [0,1,0,0,1,0|2,0,0]=4 5428 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)NCCc2ccsc2 11a_100000692642_100016267368 [0,1,0,0,1,0|2,0,0]=4 5429 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)NCCc2ccsc2 1626a_100000692642_100016267368 [0,1,0,0,1,0|2,0,0]=4 5430 B20R2.15572 O=C(C=Cc1ccc(cc1)Br)NCCn2cccc2 11a_100011368172_100016267368 [0,1,0,0,1,0|2,0,0]=4 5431 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)CCCc2cccs2 1458a_100000184863_100010992444 [0,1,0,0,1,0|2,0,0]=4 5432 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)CCCn2cccc2 1458a_100000184863_200009814367 [0,1,0,0,1,0|2,0,0]=4 5433 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccco2 11a_100000694680_100000184863 [0,1,0,0,1,0|2,0,0]=4 5434 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccco2 1626a_100000694680_100000184863 [0,1,0,0,1,0|2,0,0]=4 5435 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccco2 240690a_100000694680_100000184863 [0,1,0,0,1,0|2,0,0]=4 5436 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccs2 11a_100000203755_100000184863 [0,1,0,0,1,0|2,0,0]=4 5437 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccs2 1626a_100000203755_100000184863 [0,1,0,0,1,0|2,0,0]=4 5438 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccs2 240690a_100000203755_100000184863 [0,1,0,0,1,0|2,0,0]=4 5439 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccsc2 11a_100000692642_100000184863 [0,1,0,0,1,0|2,0,0]=4 5440 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccsc2 1626a_100000692642_100000184863 [0,1,0,0,1,0|2,0,0]=4 5441 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccsc2 240690a_100000692642_100000184863 [0,1,0,0,1,0|2,0,0]=4 5442 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCn2cccc2 11a_100011368172_100000184863 [0,1,0,0,1,0|2,0,0]=4 5443 B20R2.15572 O=C(C=Cc1ccc(cc1)Cl)NCCn2cccc2 240690a_100011368172_100000184863 [0,1,0,0,1,0|2,0,0]=4 5444 B20R2.15572 O=C(C=Cc1ccc(cc1)F)CCCc2cccs2 1458a_100000182136_100010992444 [0,1,0,0,1,0|2,0,0]=4 5445 B20R2.15572 O=C(C=Cc1ccc(cc1)F)CCCn2cccc2 1458a_100000182136_200009814367 [0,1,0,0,1,0|2,0,0]=4 5446 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2ccco2 11a_100000694680_100000182136 [0,1,0,0,1,0|2,0,0]=4 5447 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2ccco2 1626a_100000694680_100000182136 [0,1,0,0,1,0|2,0,0]=4 5448 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2ccco2 240690a_100000694680_100000182136 [0,1,0,0,1,0|2,0,0]=4 5449 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2cccs2 11a_100000203755_100000182136 [0,1,0,0,1,0|2,0,0]=4 5450 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2cccs2 1626a_100000203755_100000182136 [0,1,0,0,1,0|2,0,0]=4 5451 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2cccs2 240690a_100000203755_100000182136 [0,1,0,0,1,0|2,0,0]=4 5452 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2ccsc2 11a_100000692642_100000182136 [0,1,0,0,1,0|2,0,0]=4 5453 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2ccsc2 1626a_100000692642_100000182136 [0,1,0,0,1,0|2,0,0]=4 5454 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCc2ccsc2 240690a_100000692642_100000182136 [0,1,0,0,1,0|2,0,0]=4 5455 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCn2cccc2 11a_100011368172_100000182136 [0,1,0,0,1,0|2,0,0]=4 5456 B20R2.15572 O=C(C=Cc1ccc(cc1)F)NCCn2cccc2 240690a_100011368172_100000182136 [0,1,0,0,1,0|2,0,0]=4 5457 B20R2.15572 O=C(C=Cc1ccc(cc1)I)CCCc2cccs2 1458a_100102526154_100010992444 [0,1,0,0,1,0|2,0,0]=4 5458 B20R2.15572 O=C(C=Cc1ccc(cc1)I)CCCn2cccc2 1458a_100102526154_200009814367 [0,1,0,0,1,0|2,0,0]=4 5459 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2ccco2 11a_100000694680_100102526154 [0,1,0,0,1,0|2,0,0]=4 5460 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2ccco2 1626a_100000694680_100102526154 [0,1,0,0,1,0|2,0,0]=4 5461 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2ccco2 240690a_100000694680_100102526154 [0,1,0,0,1,0|2,0,0]=4 5462 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2cccs2 11a_100000203755_100102526154 [0,1,0,0,1,0|2,0,0]=4 5463 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2cccs2 1626a_100000203755_100102526154 [0,1,0,0,1,0|2,0,0]=4 5464 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2cccs2 240690a_100000203755_100102526154 [0,1,0,0,1,0|2,0,0]=4 5465 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2ccsc2 11a_100000692642_100102526154 [0,1,0,0,1,0|2,0,0]=4 5466 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2ccsc2 1626a_100000692642_100102526154 [0,1,0,0,1,0|2,0,0]=4 5467 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCc2ccsc2 240690a_100000692642_100102526154 [0,1,0,0,1,0|2,0,0]=4 5468 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCn2cccc2 11a_100011368172_100102526154 [0,1,0,0,1,0|2,0,0]=4 5469 B20R2.15572 O=C(C=Cc1ccc(cc1)I)NCCn2cccc2 240690a_100011368172_100102526154 [0,1,0,0,1,0|2,0,0]=4 5470 B20R2.15572 O=C(C=Cc1ccc(cc1)O)NCCc2ccco2 240690a_100000694680_100016269017 [0,1,0,0,1,0|2,0,0]=4 5471 B20R2.15572 O=C(C=Cc1ccc(cc1)O)NCCc2cccs2 240690a_100000203755_100016269017 [0,1,0,0,1,0|2,0,0]=4 5472 B20R2.15572 O=C(C=Cc1ccc(cc1)O)NCCc2ccsc2 240690a_100000692642_100016269017 [0,1,0,0,1,0|2,0,0]=4 5473 B20R2.15572 O=C(C=Cc1ccc(cc1)O)NCCn2cccc2 240690a_100011368172_100016269017 [0,1,0,0,1,0|2,0,0]=4 5474 B20R2.21575 CC(Cc1cccs1)NC(=O)C=Cc2ccccc2 11a_100000751415_100000210462 [0,1,0,0,1,0|2,0,0]=4 5475 B20R2.21575 CC(Cc1cccs1)NC(=O)C=Cc2ccccc2 1626a_100000751415_100000210462 [0,1,0,0,1,0|2,0,0]=4 5476 B20R2.21575 CC(Cc1ccsc1)NC(=O)C=Cc2ccccc2 11a_100000743546_100000210462 [0,1,0,0,1,0|2,0,0]=4 5477 B20R2.21575 CC(Cc1ccsc1)NC(=O)C=Cc2ccccc2 1626a_100000743546_100000210462 [0,1,0,0,1,0|2,0,0]=4 5478 B20R2.96469 Cc1ccccc1C=CC(=O)NCCc2ccco2 1626a_100000694680_100016266485 [0,1,0,0,1,0|2,0,0]=4 5479 B20R2.96469 Cc1ccccc1C=CC(=O)NCCc2cccs2 1626a_100000203755_100016266485 [0,1,0,0,1,0|2,0,0]=4 5480 B20R2.96469 Cc1ccccc1C=CC(=O)NCCc2ccsc2 1626a_100000692642_100016266485 [0,1,0,0,1,0|2,0,0]=4 5481 B20R2.96469 O=C(C=Cc1ccccc1Br)CCCc2cccs2 1458a_100000719032_100010992444 [0,1,0,0,1,0|2,0,0]=4 5482 B20R2.96469 O=C(C=Cc1ccccc1Br)CCCn2cccc2 1458a_100000719032_200009814367 [0,1,0,0,1,0|2,0,0]=4 5483 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2ccco2 11a_100000694680_100000719032 [0,1,0,0,1,0|2,0,0]=4 5484 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2ccco2 1626a_100000694680_100000719032 [0,1,0,0,1,0|2,0,0]=4 5485 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2ccco2 240690a_100000694680_100000719032 [0,1,0,0,1,0|2,0,0]=4 5486 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2cccs2 11a_100000203755_100000719032 [0,1,0,0,1,0|2,0,0]=4 5487 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2cccs2 1626a_100000203755_100000719032 [0,1,0,0,1,0|2,0,0]=4 5488 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2cccs2 240690a_100000203755_100000719032 [0,1,0,0,1,0|2,0,0]=4 5489 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2ccsc2 11a_100000692642_100000719032 [0,1,0,0,1,0|2,0,0]=4 5490 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2ccsc2 1626a_100000692642_100000719032 [0,1,0,0,1,0|2,0,0]=4 5491 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCc2ccsc2 240690a_100000692642_100000719032 [0,1,0,0,1,0|2,0,0]=4 5492 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCn2cccc2 11a_100011368172_100000719032 [0,1,0,0,1,0|2,0,0]=4 5493 B20R2.96469 O=C(C=Cc1ccccc1Br)NCCn2cccc2 240690a_100011368172_100000719032 [0,1,0,0,1,0|2,0,0]=4 5494 B20R2.96469 O=C(C=Cc1ccccc1Cl)CCCc2cccs2 1458a_100000720304_100010992444 [0,1,0,0,1,0|2,0,0]=4 5495 B20R2.96469 O=C(C=Cc1ccccc1Cl)CCCn2cccc2 1458a_100000720304_200009814367 [0,1,0,0,1,0|2,0,0]=4 5496 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2ccco2 11a_100000694680_100000720304 [0,1,0,0,1,0|2,0,0]=4 5497 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2ccco2 1626a_100000694680_100000720304 [0,1,0,0,1,0|2,0,0]=4 5498 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2ccco2 240690a_100000694680_100000720304 [0,1,0,0,1,0|2,0,0]=4 5499 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2cccs2 11a_100000203755_100000720304 [0,1,0,0,1,0|2,0,0]=4 5500 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2cccs2 1626a_100000203755_100000720304 [0,1,0,0,1,0|2,0,0]=4 5501 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2cccs2 240690a_100000203755_100000720304 [0,1,0,0,1,0|2,0,0]=4 5502 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2ccsc2 11a_100000692642_100000720304 [0,1,0,0,1,0|2,0,0]=4 5503 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2ccsc2 1626a_100000692642_100000720304 [0,1,0,0,1,0|2,0,0]=4 5504 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCc2ccsc2 240690a_100000692642_100000720304 [0,1,0,0,1,0|2,0,0]=4 5505 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCn2cccc2 11a_100011368172_100000720304 [0,1,0,0,1,0|2,0,0]=4 5506 B20R2.96469 O=C(C=Cc1ccccc1Cl)NCCn2cccc2 240690a_100011368172_100000720304 [0,1,0,0,1,0|2,0,0]=4 5507 B20R2.96469 O=C(C=Cc1ccccc1F)CCCc2cccs2 1458a_100016256065_100010992444 [0,1,0,0,1,0|2,0,0]=4 5508 B20R2.96469 O=C(C=Cc1ccccc1F)CCCn2cccc2 1458a_100016256065_200009814367 [0,1,0,0,1,0|2,0,0]=4 5509 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2ccco2 11a_100000694680_100016256065 [0,1,0,0,1,0|2,0,0]=4 5510 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2ccco2 1626a_100000694680_100016256065 [0,1,0,0,1,0|2,0,0]=4 5511 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2ccco2 240690a_100000694680_100016256065 [0,1,0,0,1,0|2,0,0]=4 5512 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2cccs2 11a_100000203755_100016256065 [0,1,0,0,1,0|2,0,0]=4 5513 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2cccs2 1626a_100000203755_100016256065 [0,1,0,0,1,0|2,0,0]=4 5514 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2cccs2 240690a_100000203755_100016256065 [0,1,0,0,1,0|2,0,0]=4 5515 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2ccsc2 11a_100000692642_100016256065 [0,1,0,0,1,0|2,0,0]=4 5516 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2ccsc2 1626a_100000692642_100016256065 [0,1,0,0,1,0|2,0,0]=4 5517 B20R2.96469 O=C(C=Cc1ccccc1F)NCCc2ccsc2 240690a_100000692642_100016256065 [0,1,0,0,1,0|2,0,0]=4 5518 B20R2.96469 O=C(C=Cc1ccccc1F)NCCn2cccc2 11a_100011368172_100016256065 [0,1,0,0,1,0|2,0,0]=4 5519 B20R2.96469 O=C(C=Cc1ccccc1F)NCCn2cccc2 240690a_100011368172_100016256065 [0,1,0,0,1,0|2,0,0]=4 5520 B20R2.96469 O=C(C=Cc1ccccc1O)CCCc2cccs2 1458a_100016263591_100010992444 [0,1,0,0,1,0|2,0,0]=4 5521 B20R2.96469 O=C(C=Cc1ccccc1O)CCCn2cccc2 1458a_100016263591_200009814367 [0,1,0,0,1,0|2,0,0]=4 5522 B20R2.153376 Cc1cccc(c1)C=CC(=O)CCCc2cccs2 1458a_100000690095_100010992444 [0,1,0,0,1,0|2,0,0]=4 5523 B20R2.153376 Cc1cccc(c1)C=CC(=O)CCCn2cccc2 1458a_100000690095_200009814367 [0,1,0,0,1,0|2,0,0]=4 5524 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2ccco2 11a_100000694680_100000690095 [0,1,0,0,1,0|2,0,0]=4 5525 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2ccco2 1626a_100000694680_100000690095 [0,1,0,0,1,0|2,0,0]=4 5526 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2ccco2 240690a_100000694680_100000690095 [0,1,0,0,1,0|2,0,0]=4 5527 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2cccs2 11a_100000203755_100000690095 [0,1,0,0,1,0|2,0,0]=4 5528 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2cccs2 1626a_100000203755_100000690095 [0,1,0,0,1,0|2,0,0]=4 5529 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2cccs2 240690a_100000203755_100000690095 [0,1,0,0,1,0|2,0,0]=4 5530 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2ccsc2 11a_100000692642_100000690095 [0,1,0,0,1,0|2,0,0]=4 5531 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2ccsc2 1626a_100000692642_100000690095 [0,1,0,0,1,0|2,0,0]=4 5532 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCc2ccsc2 240690a_100000692642_100000690095 [0,1,0,0,1,0|2,0,0]=4 5533 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCn2cccc2 11a_100011368172_100000690095 [0,1,0,0,1,0|2,0,0]=4 5534 B20R2.153376 Cc1cccc(c1)C=CC(=O)NCCn2cccc2 240690a_100011368172_100000690095 [0,1,0,0,1,0|2,0,0]=4 5535 B20R2.153376 O=C(C=Cc1cccc(c1)Br)CCCc2cccs2 1458a_100016258244_100010992444 [0,1,0,0,1,0|2,0,0]=4 5536 B20R2.153376 O=C(C=Cc1cccc(c1)Br)CCCn2cccc2 1458a_100016258244_200009814367 [0,1,0,0,1,0|2,0,0]=4 5537 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2ccco2 11a_100000694680_100016258244 [0,1,0,0,1,0|2,0,0]=4 5538 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2ccco2 1626a_100000694680_100016258244 [0,1,0,0,1,0|2,0,0]=4 5539 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2ccco2 240690a_100000694680_100016258244 [0,1,0,0,1,0|2,0,0]=4 5540 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2cccs2 11a_100000203755_100016258244 [0,1,0,0,1,0|2,0,0]=4 5541 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2cccs2 1626a_100000203755_100016258244 [0,1,0,0,1,0|2,0,0]=4 5542 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2cccs2 240690a_100000203755_100016258244 [0,1,0,0,1,0|2,0,0]=4 5543 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2ccsc2 11a_100000692642_100016258244 [0,1,0,0,1,0|2,0,0]=4 5544 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2ccsc2 1626a_100000692642_100016258244 [0,1,0,0,1,0|2,0,0]=4 5545 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCc2ccsc2 240690a_100000692642_100016258244 [0,1,0,0,1,0|2,0,0]=4 5546 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCn2cccc2 11a_100011368172_100016258244 [0,1,0,0,1,0|2,0,0]=4 5547 B20R2.153376 O=C(C=Cc1cccc(c1)Br)NCCn2cccc2 240690a_100011368172_100016258244 [0,1,0,0,1,0|2,0,0]=4 5548 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)CCCc2cccs2 1458a_100000184502_100010992444 [0,1,0,0,1,0|2,0,0]=4 5549 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)CCCn2cccc2 1458a_100000184502_200009814367 [0,1,0,0,1,0|2,0,0]=4 5550 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2ccco2 11a_100000694680_100000184502 [0,1,0,0,1,0|2,0,0]=4 5551 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2ccco2 1626a_100000694680_100000184502 [0,1,0,0,1,0|2,0,0]=4 5552 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2ccco2 240690a_100000694680_100000184502 [0,1,0,0,1,0|2,0,0]=4 5553 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2cccs2 11a_100000203755_100000184502 [0,1,0,0,1,0|2,0,0]=4 5554 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2cccs2 1626a_100000203755_100000184502 [0,1,0,0,1,0|2,0,0]=4 5555 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2cccs2 240690a_100000203755_100000184502 [0,1,0,0,1,0|2,0,0]=4 5556 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2ccsc2 11a_100000692642_100000184502 [0,1,0,0,1,0|2,0,0]=4 5557 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2ccsc2 1626a_100000692642_100000184502 [0,1,0,0,1,0|2,0,0]=4 5558 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCc2ccsc2 240690a_100000692642_100000184502 [0,1,0,0,1,0|2,0,0]=4 5559 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCn2cccc2 11a_100011368172_100000184502 [0,1,0,0,1,0|2,0,0]=4 5560 B20R2.153376 O=C(C=Cc1cccc(c1)Cl)NCCn2cccc2 240690a_100011368172_100000184502 [0,1,0,0,1,0|2,0,0]=4 5561 B20R2.153376 O=C(C=Cc1cccc(c1)F)CCCc2cccs2 1458a_100000718793_100010992444 [0,1,0,0,1,0|2,0,0]=4 5562 B20R2.153376 O=C(C=Cc1cccc(c1)F)CCCn2cccc2 1458a_100000718793_200009814367 [0,1,0,0,1,0|2,0,0]=4 5563 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2ccco2 11a_100000694680_100000718793 [0,1,0,0,1,0|2,0,0]=4 5564 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2ccco2 1626a_100000694680_100000718793 [0,1,0,0,1,0|2,0,0]=4 5565 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2ccco2 240690a_100000694680_100000718793 [0,1,0,0,1,0|2,0,0]=4 5566 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2cccs2 11a_100000203755_100000718793 [0,1,0,0,1,0|2,0,0]=4 5567 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2cccs2 1626a_100000203755_100000718793 [0,1,0,0,1,0|2,0,0]=4 5568 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2cccs2 240690a_100000203755_100000718793 [0,1,0,0,1,0|2,0,0]=4 5569 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2ccsc2 11a_100000692642_100000718793 [0,1,0,0,1,0|2,0,0]=4 5570 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2ccsc2 1626a_100000692642_100000718793 [0,1,0,0,1,0|2,0,0]=4 5571 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCc2ccsc2 240690a_100000692642_100000718793 [0,1,0,0,1,0|2,0,0]=4 5572 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCn2cccc2 11a_100011368172_100000718793 [0,1,0,0,1,0|2,0,0]=4 5573 B20R2.153376 O=C(C=Cc1cccc(c1)F)NCCn2cccc2 240690a_100011368172_100000718793 [0,1,0,0,1,0|2,0,0]=4 5574 B20R2.153376 O=C(C=Cc1cccc(c1)I)CCCc2cccs2 1458a_100020647043_100010992444 [0,1,0,0,1,0|2,0,0]=4 5575 B20R2.153376 O=C(C=Cc1cccc(c1)I)CCCn2cccc2 1458a_100020647043_200009814367 [0,1,0,0,1,0|2,0,0]=4 5576 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2ccco2 11a_100000694680_100020647043 [0,1,0,0,1,0|2,0,0]=4 5577 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2ccco2 1626a_100000694680_100020647043 [0,1,0,0,1,0|2,0,0]=4 5578 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2ccco2 240690a_100000694680_100020647043 [0,1,0,0,1,0|2,0,0]=4 5579 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2cccs2 11a_100000203755_100020647043 [0,1,0,0,1,0|2,0,0]=4 5580 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2cccs2 1626a_100000203755_100020647043 [0,1,0,0,1,0|2,0,0]=4 5581 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2cccs2 240690a_100000203755_100020647043 [0,1,0,0,1,0|2,0,0]=4 5582 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2ccsc2 11a_100000692642_100020647043 [0,1,0,0,1,0|2,0,0]=4 5583 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2ccsc2 1626a_100000692642_100020647043 [0,1,0,0,1,0|2,0,0]=4 5584 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCc2ccsc2 240690a_100000692642_100020647043 [0,1,0,0,1,0|2,0,0]=4 5585 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCn2cccc2 11a_100011368172_100020647043 [0,1,0,0,1,0|2,0,0]=4 5586 B20R2.153376 O=C(C=Cc1cccc(c1)I)NCCn2cccc2 240690a_100011368172_100020647043 [0,1,0,0,1,0|2,0,0]=4 5587 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)CCCc2cccs2 1458a_100016990649_100010992444 [0,1,0,0,1,0|2,0,0]=4 5588 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)CCCn2cccc2 1458a_100016990649_200009814367 [0,1,0,0,1,0|2,0,0]=4 5589 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2ccco2 11a_100000694680_100016990649 [0,1,0,0,1,0|2,0,0]=4 5590 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2ccco2 1626a_100000694680_100016990649 [0,1,0,0,1,0|2,0,0]=4 5591 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2ccco2 527a_100000694680_100016990649 [0,1,0,0,1,0|2,0,0]=4 5592 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2cccs2 11a_100000203755_100016990649 [0,1,0,0,1,0|2,0,0]=4 5593 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2cccs2 1626a_100000203755_100016990649 [0,1,0,0,1,0|2,0,0]=4 5594 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2cccs2 527a_100000203755_100016990649 [0,1,0,0,1,0|2,0,0]=4 5595 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2ccsc2 11a_100000692642_100016990649 [0,1,0,0,1,0|2,0,0]=4 5596 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2ccsc2 1626a_100000692642_100016990649 [0,1,0,0,1,0|2,0,0]=4 5597 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCc2ccsc2 527a_100000692642_100016990649 [0,1,0,0,1,0|2,0,0]=4 5598 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCn2cccc2 11a_100011368172_100016990649 [0,1,0,0,1,0|2,0,0]=4 5599 B20R2.174740 C/C(=C\c1ccccc1)/C(=O)NCCn2cccc2 527a_100011368172_100016990649 [0,1,0,0,1,0|2,0,0]=4 5600 B20R2.174740 O=C(CCCc1cccs1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100010992444 [0,1,0,0,1,0|2,0,0]=4 5601 B20R2.174740 O=C(CCCc1cccs1)/C(=C\c2ccccc2)/F 1458a_100020889036_100010992444 [0,1,0,0,1,0|2,0,0]=4 5602 B20R2.174740 O=C(CCCn1cccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200009814367 [0,1,0,0,1,0|2,0,0]=4 5603 B20R2.174740 O=C(CCCn1cccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_200009814367 [0,1,0,0,1,0|2,0,0]=4 5604 B20R2.174740 O=C(NCCc1ccco1)/C(=C/c2ccccc2)/Cl 11a_100000694680_200020598536 [0,1,0,0,1,0|2,0,0]=4 5605 B20R2.174740 O=C(NCCc1ccco1)/C(=C/c2ccccc2)/Cl 1626a_100000694680_200020598536 [0,1,0,0,1,0|2,0,0]=4 5606 B20R2.174740 O=C(NCCc1ccco1)/C(=C/c2ccccc2)/Cl 240690a_100000694680_200020598536 [0,1,0,0,1,0|2,0,0]=4 5607 B20R2.174740 O=C(NCCc1ccco1)/C(=C/c2ccccc2)/Cl 527a_100000694680_200020598536 [0,1,0,0,1,0|2,0,0]=4 5608 B20R2.174740 O=C(NCCc1ccco1)/C(=C\c2ccccc2)/F 11a_100000694680_100020889036 [0,1,0,0,1,0|2,0,0]=4 5609 B20R2.174740 O=C(NCCc1ccco1)/C(=C\c2ccccc2)/F 527a_100000694680_100020889036 [0,1,0,0,1,0|2,0,0]=4 5610 B20R2.174740 O=C(NCCc1cccs1)/C(=C/c2ccccc2)/Cl 11a_100000203755_200020598536 [0,1,0,0,1,0|2,0,0]=4 5611 B20R2.174740 O=C(NCCc1cccs1)/C(=C/c2ccccc2)/Cl 1626a_100000203755_200020598536 [0,1,0,0,1,0|2,0,0]=4 5612 B20R2.174740 O=C(NCCc1cccs1)/C(=C/c2ccccc2)/Cl 240690a_100000203755_200020598536 [0,1,0,0,1,0|2,0,0]=4 5613 B20R2.174740 O=C(NCCc1cccs1)/C(=C/c2ccccc2)/Cl 527a_100000203755_200020598536 [0,1,0,0,1,0|2,0,0]=4 5614 B20R2.174740 O=C(NCCc1cccs1)/C(=C\c2ccccc2)/F 11a_100000203755_100020889036 [0,1,0,0,1,0|2,0,0]=4 5615 B20R2.174740 O=C(NCCc1cccs1)/C(=C\c2ccccc2)/F 527a_100000203755_100020889036 [0,1,0,0,1,0|2,0,0]=4 5616 B20R2.174740 O=C(NCCc1ccsc1)/C(=C/c2ccccc2)/Cl 11a_100000692642_200020598536 [0,1,0,0,1,0|2,0,0]=4 5617 B20R2.174740 O=C(NCCc1ccsc1)/C(=C/c2ccccc2)/Cl 1626a_100000692642_200020598536 [0,1,0,0,1,0|2,0,0]=4 5618 B20R2.174740 O=C(NCCc1ccsc1)/C(=C/c2ccccc2)/Cl 240690a_100000692642_200020598536 [0,1,0,0,1,0|2,0,0]=4 5619 B20R2.174740 O=C(NCCc1ccsc1)/C(=C/c2ccccc2)/Cl 527a_100000692642_200020598536 [0,1,0,0,1,0|2,0,0]=4 5620 B20R2.174740 O=C(NCCc1ccsc1)/C(=C\c2ccccc2)/F 11a_100000692642_100020889036 [0,1,0,0,1,0|2,0,0]=4 5621 B20R2.174740 O=C(NCCc1ccsc1)/C(=C\c2ccccc2)/F 527a_100000692642_100020889036 [0,1,0,0,1,0|2,0,0]=4 5622 B20R2.174740 O=C(NCCn1cccc1)/C(=C/c2ccccc2)/Cl 11a_100011368172_200020598536 [0,1,0,0,1,0|2,0,0]=4 5623 B20R2.174740 O=C(NCCn1cccc1)/C(=C/c2ccccc2)/Cl 240690a_100011368172_200020598536 [0,1,0,0,1,0|2,0,0]=4 5624 B20R2.174740 O=C(NCCn1cccc1)/C(=C/c2ccccc2)/Cl 527a_100011368172_200020598536 [0,1,0,0,1,0|2,0,0]=4 5625 B20R2.174740 O=C(NCCn1cccc1)/C(=C\c2ccccc2)/F 11a_100011368172_100020889036 [0,1,0,0,1,0|2,0,0]=4 5626 B20R2.174740 O=C(NCCn1cccc1)/C(=C\c2ccccc2)/F 527a_100011368172_100020889036 [0,1,0,0,1,0|2,0,0]=4 5627 B20R2.174746 CC(=CC(=O)CCCc1cccs1)c2ccccc2 1458a_100000743005_100010992444 [0,1,0,0,1,0|2,0,0]=4 5628 B20R2.174746 CC(=CC(=O)CCCn1cccc1)c2ccccc2 1458a_100000743005_200009814367 [0,1,0,0,1,0|2,0,0]=4 5629 B20R2.174746 CC(=CC(=O)NCCc1ccco1)c2ccccc2 11a_100000694680_100000743005 [0,1,0,0,1,0|2,0,0]=4 5630 B20R2.174746 CC(=CC(=O)NCCc1ccco1)c2ccccc2 1626a_100000694680_100000743005 [0,1,0,0,1,0|2,0,0]=4 5631 B20R2.174746 CC(=CC(=O)NCCc1ccco1)c2ccccc2 240690a_100000694680_100000743005 [0,1,0,0,1,0|2,0,0]=4 5632 B20R2.174746 CC(=CC(=O)NCCc1ccco1)c2ccccc2 527a_100000694680_100000743005 [0,1,0,0,1,0|2,0,0]=4 5633 B20R2.174746 CC(=CC(=O)NCCc1cccs1)c2ccccc2 11a_100000203755_100000743005 [0,1,0,0,1,0|2,0,0]=4 5634 B20R2.174746 CC(=CC(=O)NCCc1cccs1)c2ccccc2 1626a_100000203755_100000743005 [0,1,0,0,1,0|2,0,0]=4 5635 B20R2.174746 CC(=CC(=O)NCCc1cccs1)c2ccccc2 240690a_100000203755_100000743005 [0,1,0,0,1,0|2,0,0]=4 5636 B20R2.174746 CC(=CC(=O)NCCc1cccs1)c2ccccc2 527a_100000203755_100000743005 [0,1,0,0,1,0|2,0,0]=4 5637 B20R2.174746 CC(=CC(=O)NCCc1ccsc1)c2ccccc2 11a_100000692642_100000743005 [0,1,0,0,1,0|2,0,0]=4 5638 B20R2.174746 CC(=CC(=O)NCCc1ccsc1)c2ccccc2 1626a_100000692642_100000743005 [0,1,0,0,1,0|2,0,0]=4 5639 B20R2.174746 CC(=CC(=O)NCCc1ccsc1)c2ccccc2 240690a_100000692642_100000743005 [0,1,0,0,1,0|2,0,0]=4 5640 B20R2.174746 CC(=CC(=O)NCCc1ccsc1)c2ccccc2 527a_100000692642_100000743005 [0,1,0,0,1,0|2,0,0]=4 5641 B20R2.174746 CC(=CC(=O)NCCn1cccc1)c2ccccc2 11a_100011368172_100000743005 [0,1,0,0,1,0|2,0,0]=4 5642 B20R2.174746 CC(=CC(=O)NCCn1cccc1)c2ccccc2 240690a_100011368172_100000743005 [0,1,0,0,1,0|2,0,0]=4 5643 B20R2.174746 CC(=CC(=O)NCCn1cccc1)c2ccccc2 527a_100011368172_100000743005 [0,1,0,0,1,0|2,0,0]=4 5644 B22R2.4392 Cc1ccc(cc1)CCCNC(=O)C=Cc2ccccc2 11a_100011236272_100000210462 [0,1,0,0,0,1|1,0,0]=3 5645 B22R2.4392 Cc1ccc(cc1)CCCNC(=O)C=Cc2ccccc2 1626a_100011236272_100000210462 [0,1,0,0,0,1|1,0,0]=3 5646 B22R2.4392 Cc1ccc(cc1)CCCNC(=O)C=Cc2ccccn2 11a_100011236272_100000740811 [0,1,0,0,0,1|2,0,0]=4 5647 B22R2.4392 Cc1ccc(cc1)CCCNC(=O)C=Cc2ccccn2 240690a_100011236272_100000740811 [0,1,0,0,0,1|2,0,0]=4 5648 B22R2.4392 Cc1ccc(cc1)CCCNC(=O)C=Cc2cccnc2 11a_100011236272_100000735890 [0,1,0,0,0,1|2,0,0]=4 5649 B22R2.4392 Cc1ccc(cc1)CCCNC(=O)C=Cc2cccnc2 240690a_100011236272_100000735890 [0,1,0,0,0,1|2,0,0]=4 5650 B22R2.4392 Cc1ccc(cc1)CCCNC(=O)C=Cc2ccncc2 240690a_100011236272_100000682801 [0,1,0,0,0,1|2,0,0]=4 5651 B22R2.4392 Cc1ccc(cc1)CCOCC(=O)CCc2ccccc2 34a_100000756670_100012361361 [0,1,0,0,0,1|0,0,2]=4 5652 B22R2.4392 Cc1ccc(cc1)CCOCC(=O)CCc2ccccc2 7a_100000756670_100012361361 [0,1,0,0,0,1|0,0,2]=4 5653 B22R2.4392 Cc1ccc(cc1)CCOCC(=O)NCc2ccccc2 34a_100000756670_100000183539 [0,1,0,0,0,1|1,0,1]=4 5654 B22R2.4392 Cc1ccc(cc1)CCOCC(=O)NCc2ccccc2 7a_100000756670_100000183539 [0,1,0,0,0,1|1,0,1]=4 5655 B22R2.4392 Cc1ccc(cc1)CCOCC(=O)OCc2ccccc2 34a_100000756670_100000753625 [0,1,0,0,0,1|1,0,1]=4 5656 B22R2.4392 Cc1ccc(cc1)CCOCC(=O)OCc2ccccc2 7a_100000756670_100000753625 [0,1,0,0,0,1|1,0,1]=4 5657 B22R2.4392 Cc1ccc(cc1)OCCNC(=O)C=Cc2ccccc2 11a_100020666663_100000210462 [0,1,0,0,0,1|1,0,0]=3 5658 B22R2.4392 Cc1ccc(cc1)OCCNC(=O)C=Cc2ccccc2 1626a_100020666663_100000210462 [0,1,0,0,0,1|1,0,0]=3 5659 B22R2.4392 Cc1ccc(cc1)OCCNC(=O)C=Cc2ccccn2 11a_100020666663_100000740811 [0,1,0,0,0,1|2,0,0]=4 5660 B22R2.4392 Cc1ccc(cc1)OCCNC(=O)C=Cc2ccccn2 240690a_100020666663_100000740811 [0,1,0,0,0,1|2,0,0]=4 5661 B22R2.4392 Cc1ccc(cc1)OCCNC(=O)C=Cc2cccnc2 11a_100020666663_100000735890 [0,1,0,0,0,1|2,0,0]=4 5662 B22R2.4392 Cc1ccc(cc1)OCCNC(=O)C=Cc2cccnc2 240690a_100020666663_100000735890 [0,1,0,0,0,1|2,0,0]=4 5663 B22R2.4392 Cc1ccc(cc1)OCCNC(=O)C=Cc2ccncc2 240690a_100020666663_100000682801 [0,1,0,0,0,1|2,0,0]=4 5664 B22R2.4392 Cc1ccc(cc1)SCCNC(=O)C=Cc2ccccc2 11a_100000739754_100000210462 [0,1,0,0,0,1|1,0,0]=3 5665 B22R2.4392 Cc1ccc(cc1)SCCNC(=O)C=Cc2ccccn2 11a_100000739754_100000740811 [0,1,0,0,0,1|2,0,0]=4 5666 B22R2.4392 Cc1ccc(cc1)SCCNC(=O)C=Cc2ccccn2 240690a_100000739754_100000740811 [0,1,0,0,0,1|2,0,0]=4 5667 B22R2.4392 Cc1ccc(cc1)SCCNC(=O)C=Cc2cccnc2 11a_100000739754_100000735890 [0,1,0,0,0,1|2,0,0]=4 5668 B22R2.4392 Cc1ccc(cc1)SCCNC(=O)C=Cc2cccnc2 240690a_100000739754_100000735890 [0,1,0,0,0,1|2,0,0]=4 5669 B22R2.4392 Cc1ccc(cc1)SCCNC(=O)C=Cc2ccncc2 240690a_100000739754_100000682801 [0,1,0,0,0,1|2,0,0]=4 5670 B22R2.4392 Nc1ccc(cc1)CCOCC(=O)CCc2ccccc2 34a_100011204434_100012361361 [0,1,0,0,0,1|0,0,2]=4 5671 B22R2.4392 Nc1ccc(cc1)CCOCC(=O)NCc2ccccc2 34a_100011204434_100000183539 [0,1,0,0,0,1|1,0,1]=4 5672 B22R2.4392 Nc1ccc(cc1)CCOCC(=O)OCc2ccccc2 34a_100011204434_100000753625 [0,1,0,0,0,1|1,0,1]=4 5673 B22R2.4392 O=C(C=Cc1ccccc1)CCCCc2ccc(cc2)Br 1458a_100000210462_200012094861 [0,1,0,0,0,1|1,0,0]=3 5674 B22R2.4392 O=C(C=Cc1ccccc1)CCCCc2ccc(cc2)F 1458a_100000210462_100012093538 [0,1,0,0,0,1|1,0,0]=3 5675 B22R2.4392 O=C(C=Cc1ccccc1)CCCOc2ccc(cc2)Br 1458a_100000210462_100011259224 [0,1,0,0,0,1|1,0,0]=3 5676 B22R2.4392 O=C(C=Cc1ccccc1)CCCOc2ccc(cc2)F 1458a_100000210462_100000181347 [0,1,0,0,0,1|1,0,0]=3 5677 B22R2.4392 O=C(C=Cc1ccccc1)NCC#Cc2ccc(cc2)Cl 11a_100011352944_100000210462 [0,1,0,0,0,1|1,0,1]=4 5678 B22R2.4392 O=C(C=Cc1ccccc1)NCC#Cc2ccc(cc2)Cl 1626a_100011352944_100000210462 [0,1,0,0,0,1|1,0,1]=4 5679 B22R2.4392 O=C(C=Cc1ccccc1)NCCCc2ccc(cc2)Br 11a_100011297623_100000210462 [0,1,0,0,0,1|1,0,0]=3 5680 B22R2.4392 O=C(C=Cc1ccccc1)NCCCc2ccc(cc2)Br 1626a_100011297623_100000210462 [0,1,0,0,0,1|1,0,0]=3 5681 B22R2.4392 O=C(C=Cc1ccccc1)NCCCc2ccc(cc2)Cl 11a_100000748451_100000210462 [0,1,0,0,0,1|1,0,0]=3 5682 B22R2.4392 O=C(C=Cc1ccccc1)NCCCc2ccc(cc2)Cl 1626a_100000748451_100000210462 [0,1,0,0,0,1|1,0,0]=3 5683 B22R2.4392 O=C(C=Cc1ccccc1)NCCCc2ccc(cc2)F 11a_100025745824_100000210462 [0,1,0,0,0,1|1,0,0]=3 5684 B22R2.4392 O=C(C=Cc1ccccc1)NCCCc2ccc(cc2)F 1626a_100025745824_100000210462 [0,1,0,0,0,1|1,0,0]=3 5685 B22R2.4392 O=C(C=Cc1ccccc1)NCCOc2ccc(cc2)Br 11a_100000746992_100000210462 [0,1,0,0,0,1|1,0,0]=3 5686 B22R2.4392 O=C(C=Cc1ccccc1)NCCOc2ccc(cc2)Br 1626a_100000746992_100000210462 [0,1,0,0,0,1|1,0,0]=3 5687 B22R2.4392 O=C(C=Cc1ccccc1)NCCOc2ccc(cc2)Cl 11a_100000697975_100000210462 [0,1,0,0,0,1|1,0,0]=3 5688 B22R2.4392 O=C(C=Cc1ccccc1)NCCOc2ccc(cc2)Cl 1626a_100000697975_100000210462 [0,1,0,0,0,1|1,0,0]=3 5689 B22R2.4392 O=C(C=Cc1ccccc1)NCCOc2ccc(cc2)F 11a_100000737420_100000210462 [0,1,0,0,0,1|1,0,0]=3 5690 B22R2.4392 O=C(C=Cc1ccccc1)NCCOc2ccc(cc2)F 1626a_100000737420_100000210462 [0,1,0,0,0,1|1,0,0]=3 5691 B22R2.4392 O=C(C=Cc1ccccc1)NCCSc2ccc(cc2)Cl 11a_100000174974_100000210462 [0,1,0,0,0,1|1,0,0]=3 5692 B22R2.4392 O=C(C=Cc1ccccn1)CCCCc2ccc(cc2)Br 1458a_100000740811_200012094861 [0,1,0,0,0,1|2,0,0]=4 5693 B22R2.4392 O=C(C=Cc1ccccn1)CCCCc2ccc(cc2)F 1458a_100000740811_100012093538 [0,1,0,0,0,1|2,0,0]=4 5694 B22R2.4392 O=C(C=Cc1ccccn1)CCCOc2ccc(cc2)Br 1458a_100000740811_100011259224 [0,1,0,0,0,1|2,0,0]=4 5695 B22R2.4392 O=C(C=Cc1ccccn1)CCCOc2ccc(cc2)F 1458a_100000740811_100000181347 [0,1,0,0,0,1|2,0,0]=4 5696 B22R2.4392 O=C(C=Cc1ccccn1)NCCCc2ccc(cc2)Br 11a_100011297623_100000740811 [0,1,0,0,0,1|2,0,0]=4 5697 B22R2.4392 O=C(C=Cc1ccccn1)NCCCc2ccc(cc2)Br 240690a_100011297623_100000740811 [0,1,0,0,0,1|2,0,0]=4 5698 B22R2.4392 O=C(C=Cc1ccccn1)NCCCc2ccc(cc2)Cl 11a_100000748451_100000740811 [0,1,0,0,0,1|2,0,0]=4 5699 B22R2.4392 O=C(C=Cc1ccccn1)NCCCc2ccc(cc2)Cl 240690a_100000748451_100000740811 [0,1,0,0,0,1|2,0,0]=4 5700 B22R2.4392 O=C(C=Cc1ccccn1)NCCCc2ccc(cc2)F 11a_100025745824_100000740811 [0,1,0,0,0,1|2,0,0]=4 5701 B22R2.4392 O=C(C=Cc1ccccn1)NCCCc2ccc(cc2)F 240690a_100025745824_100000740811 [0,1,0,0,0,1|2,0,0]=4 5702 B22R2.4392 O=C(C=Cc1ccccn1)NCCOc2ccc(cc2)Br 11a_100000746992_100000740811 [0,1,0,0,0,1|2,0,0]=4 5703 B22R2.4392 O=C(C=Cc1ccccn1)NCCOc2ccc(cc2)Br 240690a_100000746992_100000740811 [0,1,0,0,0,1|2,0,0]=4 5704 B22R2.4392 O=C(C=Cc1ccccn1)NCCOc2ccc(cc2)Cl 11a_100000697975_100000740811 [0,1,0,0,0,1|2,0,0]=4 5705 B22R2.4392 O=C(C=Cc1ccccn1)NCCOc2ccc(cc2)Cl 240690a_100000697975_100000740811 [0,1,0,0,0,1|2,0,0]=4 5706 B22R2.4392 O=C(C=Cc1ccccn1)NCCOc2ccc(cc2)F 11a_100000737420_100000740811 [0,1,0,0,0,1|2,0,0]=4 5707 B22R2.4392 O=C(C=Cc1ccccn1)NCCOc2ccc(cc2)F 240690a_100000737420_100000740811 [0,1,0,0,0,1|2,0,0]=4 5708 B22R2.4392 O=C(C=Cc1ccccn1)NCCSc2ccc(cc2)Br 240690a_100000184645_100000740811 [0,1,0,0,0,1|2,0,0]=4 5709 B22R2.4392 O=C(C=Cc1ccccn1)NCCSc2ccc(cc2)Cl 11a_100000174974_100000740811 [0,1,0,0,0,1|2,0,0]=4 5710 B22R2.4392 O=C(C=Cc1ccccn1)NCCSc2ccc(cc2)Cl 240690a_100000174974_100000740811 [0,1,0,0,0,1|2,0,0]=4 5711 B22R2.4392 O=C(C=Cc1cccnc1)CCCCc2ccc(cc2)Br 1458a_100000735890_200012094861 [0,1,0,0,0,1|2,0,0]=4 5712 B22R2.4392 O=C(C=Cc1cccnc1)CCCCc2ccc(cc2)F 1458a_100000735890_100012093538 [0,1,0,0,0,1|2,0,0]=4 5713 B22R2.4392 O=C(C=Cc1cccnc1)CCCOc2ccc(cc2)Br 1458a_100000735890_100011259224 [0,1,0,0,0,1|2,0,0]=4 5714 B22R2.4392 O=C(C=Cc1cccnc1)CCCOc2ccc(cc2)F 1458a_100000735890_100000181347 [0,1,0,0,0,1|2,0,0]=4 5715 B22R2.4392 O=C(C=Cc1cccnc1)NCCCc2ccc(cc2)Br 11a_100011297623_100000735890 [0,1,0,0,0,1|2,0,0]=4 5716 B22R2.4392 O=C(C=Cc1cccnc1)NCCCc2ccc(cc2)Br 240690a_100011297623_100000735890 [0,1,0,0,0,1|2,0,0]=4 5717 B22R2.4392 O=C(C=Cc1cccnc1)NCCCc2ccc(cc2)Cl 11a_100000748451_100000735890 [0,1,0,0,0,1|2,0,0]=4 5718 B22R2.4392 O=C(C=Cc1cccnc1)NCCCc2ccc(cc2)Cl 240690a_100000748451_100000735890 [0,1,0,0,0,1|2,0,0]=4 5719 B22R2.4392 O=C(C=Cc1cccnc1)NCCCc2ccc(cc2)F 11a_100025745824_100000735890 [0,1,0,0,0,1|2,0,0]=4 5720 B22R2.4392 O=C(C=Cc1cccnc1)NCCCc2ccc(cc2)F 240690a_100025745824_100000735890 [0,1,0,0,0,1|2,0,0]=4 5721 B22R2.4392 O=C(C=Cc1cccnc1)NCCOc2ccc(cc2)Br 11a_100000746992_100000735890 [0,1,0,0,0,1|2,0,0]=4 5722 B22R2.4392 O=C(C=Cc1cccnc1)NCCOc2ccc(cc2)Br 240690a_100000746992_100000735890 [0,1,0,0,0,1|2,0,0]=4 5723 B22R2.4392 O=C(C=Cc1cccnc1)NCCOc2ccc(cc2)Cl 11a_100000697975_100000735890 [0,1,0,0,0,1|2,0,0]=4 5724 B22R2.4392 O=C(C=Cc1cccnc1)NCCOc2ccc(cc2)Cl 240690a_100000697975_100000735890 [0,1,0,0,0,1|2,0,0]=4 5725 B22R2.4392 O=C(C=Cc1cccnc1)NCCOc2ccc(cc2)F 11a_100000737420_100000735890 [0,1,0,0,0,1|2,0,0]=4 5726 B22R2.4392 O=C(C=Cc1cccnc1)NCCOc2ccc(cc2)F 240690a_100000737420_100000735890 [0,1,0,0,0,1|2,0,0]=4 5727 B22R2.4392 O=C(C=Cc1cccnc1)NCCSc2ccc(cc2)Br 240690a_100000184645_100000735890 [0,1,0,0,0,1|2,0,0]=4 5728 B22R2.4392 O=C(C=Cc1cccnc1)NCCSc2ccc(cc2)Cl 11a_100000174974_100000735890 [0,1,0,0,0,1|2,0,0]=4 5729 B22R2.4392 O=C(C=Cc1cccnc1)NCCSc2ccc(cc2)Cl 240690a_100000174974_100000735890 [0,1,0,0,0,1|2,0,0]=4 5730 B22R2.4392 O=C(C=Cc1ccncc1)CCCCc2ccc(cc2)Br 1458a_100000682801_200012094861 [0,1,0,0,0,1|2,0,0]=4 5731 B22R2.4392 O=C(C=Cc1ccncc1)CCCCc2ccc(cc2)F 1458a_100000682801_100012093538 [0,1,0,0,0,1|2,0,0]=4 5732 B22R2.4392 O=C(C=Cc1ccncc1)CCCOc2ccc(cc2)Br 1458a_100000682801_100011259224 [0,1,0,0,0,1|2,0,0]=4 5733 B22R2.4392 O=C(C=Cc1ccncc1)CCCOc2ccc(cc2)F 1458a_100000682801_100000181347 [0,1,0,0,0,1|2,0,0]=4 5734 B22R2.4392 O=C(C=Cc1ccncc1)NCCCc2ccc(cc2)Br 240690a_100011297623_100000682801 [0,1,0,0,0,1|2,0,0]=4 5735 B22R2.4392 O=C(C=Cc1ccncc1)NCCCc2ccc(cc2)Cl 240690a_100000748451_100000682801 [0,1,0,0,0,1|2,0,0]=4 5736 B22R2.4392 O=C(C=Cc1ccncc1)NCCCc2ccc(cc2)F 240690a_100025745824_100000682801 [0,1,0,0,0,1|2,0,0]=4 5737 B22R2.4392 O=C(C=Cc1ccncc1)NCCOc2ccc(cc2)Br 240690a_100000746992_100000682801 [0,1,0,0,0,1|2,0,0]=4 5738 B22R2.4392 O=C(C=Cc1ccncc1)NCCOc2ccc(cc2)Cl 240690a_100000697975_100000682801 [0,1,0,0,0,1|2,0,0]=4 5739 B22R2.4392 O=C(C=Cc1ccncc1)NCCOc2ccc(cc2)F 240690a_100000737420_100000682801 [0,1,0,0,0,1|2,0,0]=4 5740 B22R2.4392 O=C(C=Cc1ccncc1)NCCSc2ccc(cc2)Br 240690a_100000184645_100000682801 [0,1,0,0,0,1|2,0,0]=4 5741 B22R2.4392 O=C(C=Cc1ccncc1)NCCSc2ccc(cc2)Cl 240690a_100000174974_100000682801 [0,1,0,0,0,1|2,0,0]=4 5742 B22R2.4392 O=C(CCc1ccccc1)COCCc2ccc(cc2)Br 34a_100000766406_100012361361 [0,1,0,0,0,1|0,0,2]=4 5743 B22R2.4392 O=C(CCc1ccccc1)COCCc2ccc(cc2)Br 7a_100000766406_100012361361 [0,1,0,0,0,1|0,0,2]=4 5744 B22R2.4392 O=C(CCc1ccccc1)COCCc2ccc(cc2)Cl 34a_100011219627_100012361361 [0,1,0,0,0,1|0,0,2]=4 5745 B22R2.4392 O=C(CCc1ccccc1)COCCc2ccc(cc2)Cl 7a_100011219627_100012361361 [0,1,0,0,0,1|0,0,2]=4 5746 B22R2.4392 O=C(CCc1ccccc1)COCCc2ccc(cc2)F 34a_100000754732_100012361361 [0,1,0,0,0,1|0,0,2]=4 5747 B22R2.4392 O=C(CCc1ccccc1)COCCc2ccc(cc2)F 7a_100000754732_100012361361 [0,1,0,0,0,1|0,0,2]=4 5748 B22R2.4392 O=C(CCc1ccccc1)COCCc2ccc(cc2)I 34a_100012291149_100012361361 [0,1,0,0,0,1|0,0,2]=4 5749 B22R2.4392 O=C(CCc1ccccc1)COCCc2ccc(cc2)I 7a_100012291149_100012361361 [0,1,0,0,0,1|0,0,2]=4 5750 B22R2.4392 O=C(COCCc1ccc(cc1)Br)NCc2ccccc2 34a_100000766406_100000183539 [0,1,0,0,0,1|1,0,1]=4 5751 B22R2.4392 O=C(COCCc1ccc(cc1)Br)NCc2ccccc2 7a_100000766406_100000183539 [0,1,0,0,0,1|1,0,1]=4 5752 B22R2.4392 O=C(COCCc1ccc(cc1)Br)OCc2ccccc2 34a_100000766406_100000753625 [0,1,0,0,0,1|1,0,1]=4 5753 B22R2.4392 O=C(COCCc1ccc(cc1)Br)OCc2ccccc2 7a_100000766406_100000753625 [0,1,0,0,0,1|1,0,1]=4 5754 B22R2.4392 O=C(COCCc1ccc(cc1)Cl)NCc2ccccc2 34a_100011219627_100000183539 [0,1,0,0,0,1|1,0,1]=4 5755 B22R2.4392 O=C(COCCc1ccc(cc1)Cl)NCc2ccccc2 7a_100011219627_100000183539 [0,1,0,0,0,1|1,0,1]=4 5756 B22R2.4392 O=C(COCCc1ccc(cc1)Cl)OCc2ccccc2 34a_100011219627_100000753625 [0,1,0,0,0,1|1,0,1]=4 5757 B22R2.4392 O=C(COCCc1ccc(cc1)Cl)OCc2ccccc2 7a_100011219627_100000753625 [0,1,0,0,0,1|1,0,1]=4 5758 B22R2.4392 O=C(COCCc1ccc(cc1)F)NCc2ccccc2 34a_100000754732_100000183539 [0,1,0,0,0,1|1,0,1]=4 5759 B22R2.4392 O=C(COCCc1ccc(cc1)F)NCc2ccccc2 7a_100000754732_100000183539 [0,1,0,0,0,1|1,0,1]=4 5760 B22R2.4392 O=C(COCCc1ccc(cc1)F)OCc2ccccc2 34a_100000754732_100000753625 [0,1,0,0,0,1|1,0,1]=4 5761 B22R2.4392 O=C(COCCc1ccc(cc1)F)OCc2ccccc2 7a_100000754732_100000753625 [0,1,0,0,0,1|1,0,1]=4 5762 B22R2.4392 O=C(COCCc1ccc(cc1)I)NCc2ccccc2 34a_100012291149_100000183539 [0,1,0,0,0,1|1,0,1]=4 5763 B22R2.4392 O=C(COCCc1ccc(cc1)I)NCc2ccccc2 7a_100012291149_100000183539 [0,1,0,0,0,1|1,0,1]=4 5764 B22R2.4392 O=C(COCCc1ccc(cc1)I)OCc2ccccc2 34a_100012291149_100000753625 [0,1,0,0,0,1|1,0,1]=4 5765 B22R2.4392 O=C(COCCc1ccc(cc1)I)OCc2ccccc2 7a_100012291149_100000753625 [0,1,0,0,0,1|1,0,1]=4 5766 B22R2.4541 Cc1cccc(c1)CCCNC(=O)C=Cc2ccccc2 11a_103496528808_100000210462 [0,1,0,0,0,1|1,0,0]=3 5767 B22R2.4541 Cc1cccc(c1)CCCNC(=O)C=Cc2ccccc2 1626a_103496528808_100000210462 [0,1,0,0,0,1|1,0,0]=3 5768 B22R2.4541 Cc1cccc(c1)CCCNC(=O)C=Cc2ccccn2 11a_103496528808_100000740811 [0,1,0,0,0,1|2,0,0]=4 5769 B22R2.4541 Cc1cccc(c1)CCCNC(=O)C=Cc2ccccn2 240690a_103496528808_100000740811 [0,1,0,0,0,1|2,0,0]=4 5770 B22R2.4541 Cc1cccc(c1)CCCNC(=O)C=Cc2cccnc2 11a_103496528808_100000735890 [0,1,0,0,0,1|2,0,0]=4 5771 B22R2.4541 Cc1cccc(c1)CCCNC(=O)C=Cc2cccnc2 240690a_103496528808_100000735890 [0,1,0,0,0,1|2,0,0]=4 5772 B22R2.4541 Cc1cccc(c1)CCCNC(=O)C=Cc2ccncc2 240690a_103496528808_100000682801 [0,1,0,0,0,1|2,0,0]=4 5773 B22R2.4541 Cc1cccc(c1)CCOCC(=O)CCc2ccccc2 34a_100011217157_100012361361 [0,1,0,0,0,1|0,0,2]=4 5774 B22R2.4541 Cc1cccc(c1)CCOCC(=O)CCc2ccccc2 7a_100011217157_100012361361 [0,1,0,0,0,1|0,0,2]=4 5775 B22R2.4541 Cc1cccc(c1)CCOCC(=O)NCc2ccccc2 34a_100011217157_100000183539 [0,1,0,0,0,1|1,0,1]=4 5776 B22R2.4541 Cc1cccc(c1)CCOCC(=O)NCc2ccccc2 7a_100011217157_100000183539 [0,1,0,0,0,1|1,0,1]=4 5777 B22R2.4541 Cc1cccc(c1)CCOCC(=O)OCc2ccccc2 34a_100011217157_100000753625 [0,1,0,0,0,1|1,0,1]=4 5778 B22R2.4541 Cc1cccc(c1)CCOCC(=O)OCc2ccccc2 7a_100011217157_100000753625 [0,1,0,0,0,1|1,0,1]=4 5779 B22R2.4541 Cc1cccc(c1)OCCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000212303 [0,1,0,0,0,1|1,0,0]=3 5780 B22R2.4541 Cc1cccc(c1)OCCCC(=O)C=Cc2ccccn2 1458a_100000740811_100000212303 [0,1,0,0,0,1|2,0,0]=4 5781 B22R2.4541 Cc1cccc(c1)OCCCC(=O)C=Cc2cccnc2 1458a_100000735890_100000212303 [0,1,0,0,0,1|2,0,0]=4 5782 B22R2.4541 Cc1cccc(c1)OCCCC(=O)C=Cc2ccncc2 1458a_100000682801_100000212303 [0,1,0,0,0,1|2,0,0]=4 5783 B22R2.4541 Cc1cccc(c1)OCCNC(=O)C=Cc2ccccc2 11a_100015185188_100000210462 [0,1,0,0,0,1|1,0,0]=3 5784 B22R2.4541 Cc1cccc(c1)OCCNC(=O)C=Cc2ccccc2 1626a_100015185188_100000210462 [0,1,0,0,0,1|1,0,0]=3 5785 B22R2.4541 Cc1cccc(c1)OCCNC(=O)C=Cc2ccccn2 11a_100015185188_100000740811 [0,1,0,0,0,1|2,0,0]=4 5786 B22R2.4541 Cc1cccc(c1)OCCNC(=O)C=Cc2ccccn2 240690a_100015185188_100000740811 [0,1,0,0,0,1|2,0,0]=4 5787 B22R2.4541 Cc1cccc(c1)OCCNC(=O)C=Cc2cccnc2 11a_100015185188_100000735890 [0,1,0,0,0,1|2,0,0]=4 5788 B22R2.4541 Cc1cccc(c1)OCCNC(=O)C=Cc2cccnc2 240690a_100015185188_100000735890 [0,1,0,0,0,1|2,0,0]=4 5789 B22R2.4541 Cc1cccc(c1)OCCNC(=O)C=Cc2ccncc2 240690a_100015185188_100000682801 [0,1,0,0,0,1|2,0,0]=4 5790 B22R2.4541 Nc1cccc(c1)CCOCC(=O)CCc2ccccc2 34a_100011996697_100012361361 [0,1,0,0,0,1|0,0,2]=4 5791 B22R2.4541 Nc1cccc(c1)CCOCC(=O)NCc2ccccc2 34a_100011996697_100000183539 [0,1,0,0,0,1|1,0,1]=4 5792 B22R2.4541 Nc1cccc(c1)CCOCC(=O)OCc2ccccc2 34a_100011996697_100000753625 [0,1,0,0,0,1|1,0,1]=4 5793 B22R2.4541 O=C(C=Cc1ccccc1)CCCOc2cccc(c2)Cl 1458a_100000210462_100000742658 [0,1,0,0,0,1|1,0,0]=3 5794 B22R2.4541 O=C(C=Cc1ccccc1)NCCCc2cccc(c2)Br 11a_100000753791_100000210462 [0,1,0,0,0,1|1,0,0]=3 5795 B22R2.4541 O=C(C=Cc1ccccc1)NCCCc2cccc(c2)Br 1626a_100000753791_100000210462 [0,1,0,0,0,1|1,0,0]=3 5796 B22R2.4541 O=C(C=Cc1ccccc1)NCCCc2cccc(c2)Cl 11a_100000704586_100000210462 [0,1,0,0,0,1|1,0,0]=3 5797 B22R2.4541 O=C(C=Cc1ccccc1)NCCCc2cccc(c2)Cl 1626a_100000704586_100000210462 [0,1,0,0,0,1|1,0,0]=3 5798 B22R2.4541 O=C(C=Cc1ccccc1)NCCCc2cccc(c2)F 11a_100000754185_100000210462 [0,1,0,0,0,1|1,0,0]=3 5799 B22R2.4541 O=C(C=Cc1ccccc1)NCCCc2cccc(c2)F 1626a_100000754185_100000210462 [0,1,0,0,0,1|1,0,0]=3 5800 B22R2.4541 O=C(C=Cc1ccccc1)NCCOc2cccc(c2)Br 11a_100000743521_100000210462 [0,1,0,0,0,1|1,0,0]=3 5801 B22R2.4541 O=C(C=Cc1ccccc1)NCCOc2cccc(c2)Br 1626a_100000743521_100000210462 [0,1,0,0,0,1|1,0,0]=3 5802 B22R2.4541 O=C(C=Cc1ccccc1)NCCOc2cccc(c2)Cl 11a_100000740232_100000210462 [0,1,0,0,0,1|1,0,0]=3 5803 B22R2.4541 O=C(C=Cc1ccccc1)NCCOc2cccc(c2)Cl 1626a_100000740232_100000210462 [0,1,0,0,0,1|1,0,0]=3 5804 B22R2.4541 O=C(C=Cc1ccccc1)NCCOc2cccc(c2)F 11a_100000738948_100000210462 [0,1,0,0,0,1|1,0,0]=3 5805 B22R2.4541 O=C(C=Cc1ccccc1)NCCOc2cccc(c2)F 1626a_100000738948_100000210462 [0,1,0,0,0,1|1,0,0]=3 5806 B22R2.4541 O=C(C=Cc1ccccn1)CCCOc2cccc(c2)Cl 1458a_100000740811_100000742658 [0,1,0,0,0,1|2,0,0]=4 5807 B22R2.4541 O=C(C=Cc1ccccn1)NCCCc2cccc(c2)Br 11a_100000753791_100000740811 [0,1,0,0,0,1|2,0,0]=4 5808 B22R2.4541 O=C(C=Cc1ccccn1)NCCCc2cccc(c2)Br 240690a_100000753791_100000740811 [0,1,0,0,0,1|2,0,0]=4 5809 B22R2.4541 O=C(C=Cc1ccccn1)NCCCc2cccc(c2)Cl 11a_100000704586_100000740811 [0,1,0,0,0,1|2,0,0]=4 5810 B22R2.4541 O=C(C=Cc1ccccn1)NCCCc2cccc(c2)Cl 240690a_100000704586_100000740811 [0,1,0,0,0,1|2,0,0]=4 5811 B22R2.4541 O=C(C=Cc1ccccn1)NCCCc2cccc(c2)F 11a_100000754185_100000740811 [0,1,0,0,0,1|2,0,0]=4 5812 B22R2.4541 O=C(C=Cc1ccccn1)NCCCc2cccc(c2)F 240690a_100000754185_100000740811 [0,1,0,0,0,1|2,0,0]=4 5813 B22R2.4541 O=C(C=Cc1ccccn1)NCCOc2cccc(c2)Br 11a_100000743521_100000740811 [0,1,0,0,0,1|2,0,0]=4 5814 B22R2.4541 O=C(C=Cc1ccccn1)NCCOc2cccc(c2)Br 240690a_100000743521_100000740811 [0,1,0,0,0,1|2,0,0]=4 5815 B22R2.4541 O=C(C=Cc1ccccn1)NCCOc2cccc(c2)Cl 11a_100000740232_100000740811 [0,1,0,0,0,1|2,0,0]=4 5816 B22R2.4541 O=C(C=Cc1ccccn1)NCCOc2cccc(c2)Cl 240690a_100000740232_100000740811 [0,1,0,0,0,1|2,0,0]=4 5817 B22R2.4541 O=C(C=Cc1ccccn1)NCCOc2cccc(c2)F 11a_100000738948_100000740811 [0,1,0,0,0,1|2,0,0]=4 5818 B22R2.4541 O=C(C=Cc1ccccn1)NCCOc2cccc(c2)F 240690a_100000738948_100000740811 [0,1,0,0,0,1|2,0,0]=4 5819 B22R2.4541 O=C(C=Cc1cccnc1)CCCOc2cccc(c2)Cl 1458a_100000735890_100000742658 [0,1,0,0,0,1|2,0,0]=4 5820 B22R2.4541 O=C(C=Cc1cccnc1)NCCCc2cccc(c2)Br 11a_100000753791_100000735890 [0,1,0,0,0,1|2,0,0]=4 5821 B22R2.4541 O=C(C=Cc1cccnc1)NCCCc2cccc(c2)Br 240690a_100000753791_100000735890 [0,1,0,0,0,1|2,0,0]=4 5822 B22R2.4541 O=C(C=Cc1cccnc1)NCCCc2cccc(c2)Cl 11a_100000704586_100000735890 [0,1,0,0,0,1|2,0,0]=4 5823 B22R2.4541 O=C(C=Cc1cccnc1)NCCCc2cccc(c2)Cl 240690a_100000704586_100000735890 [0,1,0,0,0,1|2,0,0]=4 5824 B22R2.4541 O=C(C=Cc1cccnc1)NCCCc2cccc(c2)F 11a_100000754185_100000735890 [0,1,0,0,0,1|2,0,0]=4 5825 B22R2.4541 O=C(C=Cc1cccnc1)NCCCc2cccc(c2)F 240690a_100000754185_100000735890 [0,1,0,0,0,1|2,0,0]=4 5826 B22R2.4541 O=C(C=Cc1cccnc1)NCCOc2cccc(c2)Br 11a_100000743521_100000735890 [0,1,0,0,0,1|2,0,0]=4 5827 B22R2.4541 O=C(C=Cc1cccnc1)NCCOc2cccc(c2)Br 240690a_100000743521_100000735890 [0,1,0,0,0,1|2,0,0]=4 5828 B22R2.4541 O=C(C=Cc1cccnc1)NCCOc2cccc(c2)Cl 11a_100000740232_100000735890 [0,1,0,0,0,1|2,0,0]=4 5829 B22R2.4541 O=C(C=Cc1cccnc1)NCCOc2cccc(c2)Cl 240690a_100000740232_100000735890 [0,1,0,0,0,1|2,0,0]=4 5830 B22R2.4541 O=C(C=Cc1cccnc1)NCCOc2cccc(c2)F 11a_100000738948_100000735890 [0,1,0,0,0,1|2,0,0]=4 5831 B22R2.4541 O=C(C=Cc1cccnc1)NCCOc2cccc(c2)F 240690a_100000738948_100000735890 [0,1,0,0,0,1|2,0,0]=4 5832 B22R2.4541 O=C(C=Cc1ccncc1)CCCOc2cccc(c2)Cl 1458a_100000682801_100000742658 [0,1,0,0,0,1|2,0,0]=4 5833 B22R2.4541 O=C(C=Cc1ccncc1)NCCCc2cccc(c2)Br 240690a_100000753791_100000682801 [0,1,0,0,0,1|2,0,0]=4 5834 B22R2.4541 O=C(C=Cc1ccncc1)NCCCc2cccc(c2)Cl 240690a_100000704586_100000682801 [0,1,0,0,0,1|2,0,0]=4 5835 B22R2.4541 O=C(C=Cc1ccncc1)NCCCc2cccc(c2)F 240690a_100000754185_100000682801 [0,1,0,0,0,1|2,0,0]=4 5836 B22R2.4541 O=C(C=Cc1ccncc1)NCCOc2cccc(c2)Br 240690a_100000743521_100000682801 [0,1,0,0,0,1|2,0,0]=4 5837 B22R2.4541 O=C(C=Cc1ccncc1)NCCOc2cccc(c2)Cl 240690a_100000740232_100000682801 [0,1,0,0,0,1|2,0,0]=4 5838 B22R2.4541 O=C(C=Cc1ccncc1)NCCOc2cccc(c2)F 240690a_100000738948_100000682801 [0,1,0,0,0,1|2,0,0]=4 5839 B22R2.4541 O=C(CCc1ccccc1)COCCc2cccc(c2)Br 34a_100011217444_100012361361 [0,1,0,0,0,1|0,0,2]=4 5840 B22R2.4541 O=C(CCc1ccccc1)COCCc2cccc(c2)Br 7a_100011217444_100012361361 [0,1,0,0,0,1|0,0,2]=4 5841 B22R2.4541 O=C(CCc1ccccc1)COCCc2cccc(c2)Cl 34a_100000754733_100012361361 [0,1,0,0,0,1|0,0,2]=4 5842 B22R2.4541 O=C(CCc1ccccc1)COCCc2cccc(c2)Cl 7a_100000754733_100012361361 [0,1,0,0,0,1|0,0,2]=4 5843 B22R2.4541 O=C(CCc1ccccc1)COCCc2cccc(c2)F 34a_100000763591_100012361361 [0,1,0,0,0,1|0,0,2]=4 5844 B22R2.4541 O=C(CCc1ccccc1)COCCc2cccc(c2)F 7a_100000763591_100012361361 [0,1,0,0,0,1|0,0,2]=4 5845 B22R2.4541 O=C(COCCc1cccc(c1)Br)NCc2ccccc2 34a_100011217444_100000183539 [0,1,0,0,0,1|1,0,1]=4 5846 B22R2.4541 O=C(COCCc1cccc(c1)Br)NCc2ccccc2 7a_100011217444_100000183539 [0,1,0,0,0,1|1,0,1]=4 5847 B22R2.4541 O=C(COCCc1cccc(c1)Br)OCc2ccccc2 34a_100011217444_100000753625 [0,1,0,0,0,1|1,0,1]=4 5848 B22R2.4541 O=C(COCCc1cccc(c1)Br)OCc2ccccc2 7a_100011217444_100000753625 [0,1,0,0,0,1|1,0,1]=4 5849 B22R2.4541 O=C(COCCc1cccc(c1)Cl)NCc2ccccc2 34a_100000754733_100000183539 [0,1,0,0,0,1|1,0,1]=4 5850 B22R2.4541 O=C(COCCc1cccc(c1)Cl)NCc2ccccc2 7a_100000754733_100000183539 [0,1,0,0,0,1|1,0,1]=4 5851 B22R2.4541 O=C(COCCc1cccc(c1)Cl)OCc2ccccc2 34a_100000754733_100000753625 [0,1,0,0,0,1|1,0,1]=4 5852 B22R2.4541 O=C(COCCc1cccc(c1)Cl)OCc2ccccc2 7a_100000754733_100000753625 [0,1,0,0,0,1|1,0,1]=4 5853 B22R2.4541 O=C(COCCc1cccc(c1)F)NCc2ccccc2 34a_100000763591_100000183539 [0,1,0,0,0,1|1,0,1]=4 5854 B22R2.4541 O=C(COCCc1cccc(c1)F)NCc2ccccc2 7a_100000763591_100000183539 [0,1,0,0,0,1|1,0,1]=4 5855 B22R2.4541 O=C(COCCc1cccc(c1)F)OCc2ccccc2 34a_100000763591_100000753625 [0,1,0,0,0,1|1,0,1]=4 5856 B22R2.4541 O=C(COCCc1cccc(c1)F)OCc2ccccc2 7a_100000763591_100000753625 [0,1,0,0,0,1|1,0,1]=4 5857 B22R2.9164 Cc1ccccc1CCOCC(=O)CCc2ccccc2 34a_100011220023_100012361361 [0,1,0,0,0,1|0,0,2]=4 5858 B22R2.9164 Cc1ccccc1CCOCC(=O)CCc2ccccc2 7a_100011220023_100012361361 [0,1,0,0,0,1|0,0,2]=4 5859 B22R2.9164 Cc1ccccc1CCOCC(=O)NCc2ccccc2 34a_100011220023_100000183539 [0,1,0,0,0,1|1,0,1]=4 5860 B22R2.9164 Cc1ccccc1CCOCC(=O)NCc2ccccc2 7a_100011220023_100000183539 [0,1,0,0,0,1|1,0,1]=4 5861 B22R2.9164 Cc1ccccc1CCOCC(=O)OCc2ccccc2 34a_100011220023_100000753625 [0,1,0,0,0,1|1,0,1]=4 5862 B22R2.9164 Cc1ccccc1CCOCC(=O)OCc2ccccc2 7a_100011220023_100000753625 [0,1,0,0,0,1|1,0,1]=4 5863 B22R2.9164 Cc1ccccc1OCCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000742659 [0,1,0,0,0,1|1,0,0]=3 5864 B22R2.9164 Cc1ccccc1OCCCC(=O)C=Cc2ccccn2 1458a_100000740811_100000742659 [0,1,0,0,0,1|2,0,0]=4 5865 B22R2.9164 Cc1ccccc1OCCCC(=O)C=Cc2cccnc2 1458a_100000735890_100000742659 [0,1,0,0,0,1|2,0,0]=4 5866 B22R2.9164 Cc1ccccc1OCCCC(=O)C=Cc2ccncc2 1458a_100000682801_100000742659 [0,1,0,0,0,1|2,0,0]=4 5867 B22R2.9164 Cc1ccccc1OCCNC(=O)C=Cc2ccccc2 11a_100000743344_100000210462 [0,1,0,0,0,1|1,0,0]=3 5868 B22R2.9164 Cc1ccccc1OCCNC(=O)C=Cc2ccccc2 1626a_100000743344_100000210462 [0,1,0,0,0,1|1,0,0]=3 5869 B22R2.9164 Cc1ccccc1OCCNC(=O)C=Cc2ccccn2 11a_100000743344_100000740811 [0,1,0,0,0,1|2,0,0]=4 5870 B22R2.9164 Cc1ccccc1OCCNC(=O)C=Cc2ccccn2 240690a_100000743344_100000740811 [0,1,0,0,0,1|2,0,0]=4 5871 B22R2.9164 Cc1ccccc1OCCNC(=O)C=Cc2cccnc2 11a_100000743344_100000735890 [0,1,0,0,0,1|2,0,0]=4 5872 B22R2.9164 Cc1ccccc1OCCNC(=O)C=Cc2cccnc2 240690a_100000743344_100000735890 [0,1,0,0,0,1|2,0,0]=4 5873 B22R2.9164 Cc1ccccc1OCCNC(=O)C=Cc2ccncc2 240690a_100000743344_100000682801 [0,1,0,0,0,1|2,0,0]=4 5874 B22R2.9164 Nc1ccccc1CCOCC(=O)CCc2ccccc2 34a_100011215289_100012361361 [0,1,0,0,0,1|0,0,2]=4 5875 B22R2.9164 Nc1ccccc1CCOCC(=O)NCc2ccccc2 34a_100011215289_100000183539 [0,1,0,0,0,1|1,0,1]=4 5876 B22R2.9164 Nc1ccccc1CCOCC(=O)OCc2ccccc2 34a_100011215289_100000753625 [0,1,0,0,0,1|1,0,1]=4 5877 B22R2.9164 O=C(C=Cc1ccccc1)CCCOc2ccccc2Br 1458a_100000210462_200011259276 [0,1,0,0,0,1|1,0,0]=3 5878 B22R2.9164 O=C(C=Cc1ccccc1)CCCOc2ccccc2F 1458a_100000210462_100011203253 [0,1,0,0,0,1|1,0,0]=3 5879 B22R2.9164 O=C(C=Cc1ccccc1)CCCSc2ccccc2Cl 1458a_100000210462_100000750589 [0,1,0,0,0,1|1,0,0]=3 5880 B22R2.9164 O=C(C=Cc1ccccc1)NCCCc2ccccc2F 11a_100000724733_100000210462 [0,1,0,0,0,1|1,0,0]=3 5881 B22R2.9164 O=C(C=Cc1ccccc1)NCCCc2ccccc2F 1626a_100000724733_100000210462 [0,1,0,0,0,1|1,0,0]=3 5882 B22R2.9164 O=C(C=Cc1ccccc1)NCCOc2ccccc2Br 11a_100000744007_100000210462 [0,1,0,0,0,1|1,0,0]=3 5883 B22R2.9164 O=C(C=Cc1ccccc1)NCCOc2ccccc2Br 1626a_100000744007_100000210462 [0,1,0,0,0,1|1,0,0]=3 5884 B22R2.9164 O=C(C=Cc1ccccc1)NCCOc2ccccc2Cl 11a_100000174932_100000210462 [0,1,0,0,0,1|1,0,0]=3 5885 B22R2.9164 O=C(C=Cc1ccccc1)NCCOc2ccccc2Cl 1626a_100000174932_100000210462 [0,1,0,0,0,1|1,0,0]=3 5886 B22R2.9164 O=C(C=Cc1ccccc1)NCCOc2ccccc2F 11a_100000683764_100000210462 [0,1,0,0,0,1|1,0,0]=3 5887 B22R2.9164 O=C(C=Cc1ccccc1)NCCOc2ccccc2F 1626a_100000683764_100000210462 [0,1,0,0,0,1|1,0,0]=3 5888 B22R2.9164 O=C(C=Cc1ccccn1)CCCOc2ccccc2Br 1458a_100000740811_200011259276 [0,1,0,0,0,1|2,0,0]=4 5889 B22R2.9164 O=C(C=Cc1ccccn1)CCCOc2ccccc2F 1458a_100000740811_100011203253 [0,1,0,0,0,1|2,0,0]=4 5890 B22R2.9164 O=C(C=Cc1ccccn1)CCCSc2ccccc2Cl 1458a_100000740811_100000750589 [0,1,0,0,0,1|2,0,0]=4 5891 B22R2.9164 O=C(C=Cc1ccccn1)NCCCc2ccccc2F 11a_100000724733_100000740811 [0,1,0,0,0,1|2,0,0]=4 5892 B22R2.9164 O=C(C=Cc1ccccn1)NCCCc2ccccc2F 240690a_100000724733_100000740811 [0,1,0,0,0,1|2,0,0]=4 5893 B22R2.9164 O=C(C=Cc1ccccn1)NCCOc2ccccc2Br 11a_100000744007_100000740811 [0,1,0,0,0,1|2,0,0]=4 5894 B22R2.9164 O=C(C=Cc1ccccn1)NCCOc2ccccc2Br 240690a_100000744007_100000740811 [0,1,0,0,0,1|2,0,0]=4 5895 B22R2.9164 O=C(C=Cc1ccccn1)NCCOc2ccccc2Cl 11a_100000174932_100000740811 [0,1,0,0,0,1|2,0,0]=4 5896 B22R2.9164 O=C(C=Cc1ccccn1)NCCOc2ccccc2Cl 240690a_100000174932_100000740811 [0,1,0,0,0,1|2,0,0]=4 5897 B22R2.9164 O=C(C=Cc1ccccn1)NCCOc2ccccc2F 11a_100000683764_100000740811 [0,1,0,0,0,1|2,0,0]=4 5898 B22R2.9164 O=C(C=Cc1ccccn1)NCCOc2ccccc2F 240690a_100000683764_100000740811 [0,1,0,0,0,1|2,0,0]=4 5899 B22R2.9164 O=C(C=Cc1cccnc1)CCCOc2ccccc2Br 1458a_100000735890_200011259276 [0,1,0,0,0,1|2,0,0]=4 5900 B22R2.9164 O=C(C=Cc1cccnc1)CCCOc2ccccc2F 1458a_100000735890_100011203253 [0,1,0,0,0,1|2,0,0]=4 5901 B22R2.9164 O=C(C=Cc1cccnc1)CCCSc2ccccc2Cl 1458a_100000735890_100000750589 [0,1,0,0,0,1|2,0,0]=4 5902 B22R2.9164 O=C(C=Cc1cccnc1)NCCCc2ccccc2F 11a_100000724733_100000735890 [0,1,0,0,0,1|2,0,0]=4 5903 B22R2.9164 O=C(C=Cc1cccnc1)NCCCc2ccccc2F 240690a_100000724733_100000735890 [0,1,0,0,0,1|2,0,0]=4 5904 B22R2.9164 O=C(C=Cc1cccnc1)NCCOc2ccccc2Br 11a_100000744007_100000735890 [0,1,0,0,0,1|2,0,0]=4 5905 B22R2.9164 O=C(C=Cc1cccnc1)NCCOc2ccccc2Br 240690a_100000744007_100000735890 [0,1,0,0,0,1|2,0,0]=4 5906 B22R2.9164 O=C(C=Cc1cccnc1)NCCOc2ccccc2Cl 11a_100000174932_100000735890 [0,1,0,0,0,1|2,0,0]=4 5907 B22R2.9164 O=C(C=Cc1cccnc1)NCCOc2ccccc2Cl 240690a_100000174932_100000735890 [0,1,0,0,0,1|2,0,0]=4 5908 B22R2.9164 O=C(C=Cc1cccnc1)NCCOc2ccccc2F 11a_100000683764_100000735890 [0,1,0,0,0,1|2,0,0]=4 5909 B22R2.9164 O=C(C=Cc1cccnc1)NCCOc2ccccc2F 240690a_100000683764_100000735890 [0,1,0,0,0,1|2,0,0]=4 5910 B22R2.9164 O=C(C=Cc1ccncc1)CCCOc2ccccc2Br 1458a_100000682801_200011259276 [0,1,0,0,0,1|2,0,0]=4 5911 B22R2.9164 O=C(C=Cc1ccncc1)CCCOc2ccccc2F 1458a_100000682801_100011203253 [0,1,0,0,0,1|2,0,0]=4 5912 B22R2.9164 O=C(C=Cc1ccncc1)CCCSc2ccccc2Cl 1458a_100000682801_100000750589 [0,1,0,0,0,1|2,0,0]=4 5913 B22R2.9164 O=C(C=Cc1ccncc1)NCCCc2ccccc2F 240690a_100000724733_100000682801 [0,1,0,0,0,1|2,0,0]=4 5914 B22R2.9164 O=C(C=Cc1ccncc1)NCCOc2ccccc2Br 240690a_100000744007_100000682801 [0,1,0,0,0,1|2,0,0]=4 5915 B22R2.9164 O=C(C=Cc1ccncc1)NCCOc2ccccc2Cl 240690a_100000174932_100000682801 [0,1,0,0,0,1|2,0,0]=4 5916 B22R2.9164 O=C(C=Cc1ccncc1)NCCOc2ccccc2F 240690a_100000683764_100000682801 [0,1,0,0,0,1|2,0,0]=4 5917 B22R2.9164 O=C(CCc1ccccc1)COCCc2ccccc2Br 34a_100000731337_100012361361 [0,1,0,0,0,1|0,0,2]=4 5918 B22R2.9164 O=C(CCc1ccccc1)COCCc2ccccc2Br 7a_100000731337_100012361361 [0,1,0,0,0,1|0,0,2]=4 5919 B22R2.9164 O=C(CCc1ccccc1)COCCc2ccccc2Cl 34a_100011215284_100012361361 [0,1,0,0,0,1|0,0,2]=4 5920 B22R2.9164 O=C(CCc1ccccc1)COCCc2ccccc2Cl 7a_100011215284_100012361361 [0,1,0,0,0,1|0,0,2]=4 5921 B22R2.9164 O=C(CCc1ccccc1)COCCc2ccccc2F 34a_100000753711_100012361361 [0,1,0,0,0,1|0,0,2]=4 5922 B22R2.9164 O=C(CCc1ccccc1)COCCc2ccccc2F 7a_100000753711_100012361361 [0,1,0,0,0,1|0,0,2]=4 5923 B22R2.9164 O=C(CCc1ccccc1)COCCc2ccccc2I 34a_100010255290_100012361361 [0,1,0,0,0,1|0,0,2]=4 5924 B22R2.9164 O=C(CCc1ccccc1)COCCc2ccccc2I 7a_100010255290_100012361361 [0,1,0,0,0,1|0,0,2]=4 5925 B22R2.9164 O=C(COCCc1ccccc1Br)NCc2ccccc2 34a_100000731337_100000183539 [0,1,0,0,0,1|1,0,1]=4 5926 B22R2.9164 O=C(COCCc1ccccc1Br)NCc2ccccc2 7a_100000731337_100000183539 [0,1,0,0,0,1|1,0,1]=4 5927 B22R2.9164 O=C(COCCc1ccccc1Br)OCc2ccccc2 34a_100000731337_100000753625 [0,1,0,0,0,1|1,0,1]=4 5928 B22R2.9164 O=C(COCCc1ccccc1Br)OCc2ccccc2 7a_100000731337_100000753625 [0,1,0,0,0,1|1,0,1]=4 5929 B22R2.9164 O=C(COCCc1ccccc1Cl)NCc2ccccc2 34a_100011215284_100000183539 [0,1,0,0,0,1|1,0,1]=4 5930 B22R2.9164 O=C(COCCc1ccccc1Cl)NCc2ccccc2 7a_100011215284_100000183539 [0,1,0,0,0,1|1,0,1]=4 5931 B22R2.9164 O=C(COCCc1ccccc1Cl)OCc2ccccc2 34a_100011215284_100000753625 [0,1,0,0,0,1|1,0,1]=4 5932 B22R2.9164 O=C(COCCc1ccccc1Cl)OCc2ccccc2 7a_100011215284_100000753625 [0,1,0,0,0,1|1,0,1]=4 5933 B22R2.9164 O=C(COCCc1ccccc1F)NCc2ccccc2 34a_100000753711_100000183539 [0,1,0,0,0,1|1,0,1]=4 5934 B22R2.9164 O=C(COCCc1ccccc1F)NCc2ccccc2 7a_100000753711_100000183539 [0,1,0,0,0,1|1,0,1]=4 5935 B22R2.9164 O=C(COCCc1ccccc1F)OCc2ccccc2 34a_100000753711_100000753625 [0,1,0,0,0,1|1,0,1]=4 5936 B22R2.9164 O=C(COCCc1ccccc1F)OCc2ccccc2 7a_100000753711_100000753625 [0,1,0,0,0,1|1,0,1]=4 5937 B22R2.9164 O=C(COCCc1ccccc1I)NCc2ccccc2 34a_100010255290_100000183539 [0,1,0,0,0,1|1,0,1]=4 5938 B22R2.9164 O=C(COCCc1ccccc1I)NCc2ccccc2 7a_100010255290_100000183539 [0,1,0,0,0,1|1,0,1]=4 5939 B22R2.9164 O=C(COCCc1ccccc1I)OCc2ccccc2 34a_100010255290_100000753625 [0,1,0,0,0,1|1,0,1]=4 5940 B22R2.9164 O=C(COCCc1ccccc1I)OCc2ccccc2 7a_100010255290_100000753625 [0,1,0,0,0,1|1,0,1]=4 5941 B22R2.23174 CC(=NNCCc1ccccc1)C=Cc2ccc(cc2)Br 4a_100000740470_200016259395 [0,1,0,0,0,1|2,0,0]=4 5942 B22R2.23174 CC(=NNCCc1ccccc1)C=Cc2ccc(cc2)Cl 4a_100000740470_100016256711 [0,1,0,0,0,1|2,0,0]=4 5943 B22R2.23174 CC(=NNCCc1ccccc1)C=Cc2ccc(cc2)O 4a_100000740470_100000189429 [0,1,0,0,0,1|2,0,0]=4 5944 B22R2.23174 Cc1ccc(cc1)C=CC(=O)CCCCc2ccccc2 1458a_100000716854_100000701786 [0,1,0,0,0,1|1,0,0]=3 5945 B22R2.23174 Cc1ccc(cc1)C=CC(=O)CCCCc2ccncc2 1458a_100000716854_100020630000 [0,1,0,0,0,1|2,0,0]=4 5946 B22R2.23174 Cc1ccc(cc1)C=CC(=O)CCCOc2ccccc2 1458a_100000716854_100000199009 [0,1,0,0,0,1|1,0,0]=3 5947 B22R2.23174 Cc1ccc(cc1)C=CC(=O)CCCSc2ccccc2 1458a_100000716854_200011203293 [0,1,0,0,0,1|1,0,0]=3 5948 B22R2.23174 Cc1ccc(cc1)C=CC(=O)CCOCc2ccccc2 1458a_100000716854_100000234347 [0,1,0,0,0,1|1,0,0]=3 5949 B22R2.23174 Cc1ccc(cc1)C=CC(=O)CCSCc2ccccc2 1458a_100000716854_200011297719 [0,1,0,0,0,1|1,0,0]=3 5950 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NC/C=C/c2ccccc2 11a_100020603302_100000716854 [0,1,0,0,0,1|1,0,1]=4 5951 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NC/C=C/c2ccccc2 1626a_100020603302_100000716854 [0,1,0,0,0,1|1,0,1]=4 5952 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NC/C=C/c2ccccc2 240690a_100020603302_100000716854 [0,1,0,0,0,1|1,0,1]=4 5953 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCC#Cc2ccccc2 11a_100000735379_100000716854 [0,1,0,0,0,1|1,0,1]=4 5954 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCC#Cc2ccccc2 1626a_100000735379_100000716854 [0,1,0,0,0,1|1,0,1]=4 5955 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCC#Cc2ccccc2 240690a_100000735379_100000716854 [0,1,0,0,0,1|1,0,1]=4 5956 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2ccccc2 11a_100000211184_100000716854 [0,1,0,0,0,1|1,0,0]=3 5957 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2ccccc2 1626a_100000211184_100000716854 [0,1,0,0,0,1|1,0,0]=3 5958 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2ccccc2 240690a_100000211184_100000716854 [0,1,0,0,0,1|1,0,0]=3 5959 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2ccccn2 11a_100000689020_100000716854 [0,1,0,0,0,1|2,0,0]=4 5960 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2ccccn2 1626a_100000689020_100000716854 [0,1,0,0,0,1|2,0,0]=4 5961 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2ccccn2 240690a_100000689020_100000716854 [0,1,0,0,0,1|2,0,0]=4 5962 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2cccnc2 11a_100011532358_100000716854 [0,1,0,0,0,1|2,0,0]=4 5963 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2cccnc2 240690a_100011532358_100000716854 [0,1,0,0,0,1|2,0,0]=4 5964 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2ccncc2 1626a_100011275580_100000716854 [0,1,0,0,0,1|2,0,0]=4 5965 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCCc2ccncc2 240690a_100011275580_100000716854 [0,1,0,0,0,1|2,0,0]=4 5966 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2ccccc2 11a_100000174943_100000716854 [0,1,0,0,0,1|1,0,0]=3 5967 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2ccccc2 1626a_100000174943_100000716854 [0,1,0,0,0,1|1,0,0]=3 5968 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2ccccc2 240690a_100000174943_100000716854 [0,1,0,0,0,1|1,0,0]=3 5969 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2ccccn2 11a_106741647558_100000716854 [0,1,0,0,0,1|2,0,0]=4 5970 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2ccccn2 1626a_106741647558_100000716854 [0,1,0,0,0,1|2,0,0]=4 5971 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2ccccn2 240690a_106741647558_100000716854 [0,1,0,0,0,1|2,0,0]=4 5972 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2cccnc2 11a_100000754688_100000716854 [0,1,0,0,0,1|2,0,0]=4 5973 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2cccnc2 240690a_100000754688_100000716854 [0,1,0,0,0,1|2,0,0]=4 5974 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2ccncc2 11a_100025717301_100000716854 [0,1,0,0,0,1|2,0,0]=4 5975 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCOc2ccncc2 240690a_100025717301_100000716854 [0,1,0,0,0,1|2,0,0]=4 5976 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NCCSc2ccccc2 240690a_100000189519_100000716854 [0,1,0,0,0,1|1,0,0]=3 5977 B22R2.23174 Cc1ccc(cc1)C=CC(=O)NNCCc2ccccc2 22a_100000740470_100000716854 [0,1,0,0,0,1|1,0,0]=3 5978 B22R2.23174 Cc1ccc(cc1)CNC(=O)COCCc2ccccc2 34a_100000210268_100000183211 [0,1,0,0,0,1|1,0,1]=4 5979 B22R2.23174 Cc1ccc(cc1)CNC(=O)COCCc2ccccc2 7a_100000210268_100000183211 [0,1,0,0,0,1|1,0,1]=4 5980 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCCCc2ccccc2 1458a_100016267368_100000701786 [0,1,0,0,0,1|1,0,0]=3 5981 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCCCc2ccccc2 6a_100000186029_200011485782 [0,1,0,0,0,1|1,0,0]=3 5982 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCCCc2cccnc2 6a_100000186029_100012242803 [0,1,0,0,0,1|2,0,0]=4 5983 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCCCc2ccncc2 1458a_100016267368_100020630000 [0,1,0,0,0,1|2,0,0]=4 5984 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCCOc2ccccc2 1458a_100016267368_100000199009 [0,1,0,0,0,1|1,0,0]=3 5985 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCCSc2ccccc2 1458a_100016267368_200011203293 [0,1,0,0,0,1|1,0,0]=3 5986 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCOCc2ccccc2 1458a_100016267368_100000234347 [0,1,0,0,0,1|1,0,0]=3 5987 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCOCc2ccccc2 6a_100000186029_100011219826 [0,1,0,0,0,1|1,0,0]=3 5988 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)CCSCc2ccccc2 1458a_100016267368_200011297719 [0,1,0,0,0,1|1,0,0]=3 5989 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NC/C=C/c2ccccc2 11a_100020603302_100016267368 [0,1,0,0,0,1|1,0,1]=4 5990 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NC/C=C/c2ccccc2 1626a_100020603302_100016267368 [0,1,0,0,0,1|1,0,1]=4 5991 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCC#Cc2ccccc2 11a_100000735379_100016267368 [0,1,0,0,0,1|1,0,1]=4 5992 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCC#Cc2ccccc2 1626a_100000735379_100016267368 [0,1,0,0,0,1|1,0,1]=4 5993 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCCc2ccccc2 11a_100000211184_100016267368 [0,1,0,0,0,1|1,0,0]=3 5994 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCCc2ccccc2 1626a_100000211184_100016267368 [0,1,0,0,0,1|1,0,0]=3 5995 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCCc2ccccn2 11a_100000689020_100016267368 [0,1,0,0,0,1|2,0,0]=4 5996 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCCc2ccccn2 1626a_100000689020_100016267368 [0,1,0,0,0,1|2,0,0]=4 5997 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCCc2cccnc2 11a_100011532358_100016267368 [0,1,0,0,0,1|2,0,0]=4 5998 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCCc2ccncc2 1626a_100011275580_100016267368 [0,1,0,0,0,1|2,0,0]=4 5999 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCOc2ccccc2 11a_100000174943_100016267368 [0,1,0,0,0,1|1,0,0]=3 6000 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCOc2ccccc2 1626a_100000174943_100016267368 [0,1,0,0,0,1|1,0,0]=3 6001 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCOc2ccccn2 11a_106741647558_100016267368 [0,1,0,0,0,1|2,0,0]=4 6002 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCOc2ccccn2 1626a_106741647558_100016267368 [0,1,0,0,0,1|2,0,0]=4 6003 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCOc2cccnc2 11a_100000754688_100016267368 [0,1,0,0,0,1|2,0,0]=4 6004 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NCCOc2ccncc2 11a_100025717301_100016267368 [0,1,0,0,0,1|2,0,0]=4 6005 B22R2.23174 O=C(C=Cc1ccc(cc1)Br)NNCCc2ccccc2 22a_100000740470_100016267368 [0,1,0,0,0,1|1,0,0]=3 6006 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)CCCCc2ccccc2 1458a_100000184863_100000701786 [0,1,0,0,0,1|1,0,0]=3 6007 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)CCCCc2ccncc2 1458a_100000184863_100020630000 [0,1,0,0,0,1|2,0,0]=4 6008 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)CCCOc2ccccc2 1458a_100000184863_100000199009 [0,1,0,0,0,1|1,0,0]=3 6009 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)CCCSc2ccccc2 1458a_100000184863_200011203293 [0,1,0,0,0,1|1,0,0]=3 6010 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)CCOCc2ccccc2 1458a_100000184863_100000234347 [0,1,0,0,0,1|1,0,0]=3 6011 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)CCSCc2ccccc2 1458a_100000184863_200011297719 [0,1,0,0,0,1|1,0,0]=3 6012 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NC/C=C/c2ccccc2 11a_100020603302_100000184863 [0,1,0,0,0,1|1,0,1]=4 6013 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NC/C=C/c2ccccc2 1626a_100020603302_100000184863 [0,1,0,0,0,1|1,0,1]=4 6014 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NC/C=C/c2ccccc2 240690a_100020603302_100000184863 [0,1,0,0,0,1|1,0,1]=4 6015 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCC#Cc2ccccc2 11a_100000735379_100000184863 [0,1,0,0,0,1|1,0,1]=4 6016 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCC#Cc2ccccc2 1626a_100000735379_100000184863 [0,1,0,0,0,1|1,0,1]=4 6017 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCC#Cc2ccccc2 240690a_100000735379_100000184863 [0,1,0,0,0,1|1,0,1]=4 6018 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2ccccc2 11a_100000211184_100000184863 [0,1,0,0,0,1|1,0,0]=3 6019 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2ccccc2 1626a_100000211184_100000184863 [0,1,0,0,0,1|1,0,0]=3 6020 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2ccccc2 240690a_100000211184_100000184863 [0,1,0,0,0,1|1,0,0]=3 6021 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2ccccn2 11a_100000689020_100000184863 [0,1,0,0,0,1|2,0,0]=4 6022 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2ccccn2 1626a_100000689020_100000184863 [0,1,0,0,0,1|2,0,0]=4 6023 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2ccccn2 240690a_100000689020_100000184863 [0,1,0,0,0,1|2,0,0]=4 6024 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2cccnc2 11a_100011532358_100000184863 [0,1,0,0,0,1|2,0,0]=4 6025 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2cccnc2 240690a_100011532358_100000184863 [0,1,0,0,0,1|2,0,0]=4 6026 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2ccncc2 1626a_100011275580_100000184863 [0,1,0,0,0,1|2,0,0]=4 6027 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCCc2ccncc2 240690a_100011275580_100000184863 [0,1,0,0,0,1|2,0,0]=4 6028 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2ccccc2 11a_100000174943_100000184863 [0,1,0,0,0,1|1,0,0]=3 6029 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2ccccc2 1626a_100000174943_100000184863 [0,1,0,0,0,1|1,0,0]=3 6030 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2ccccc2 240690a_100000174943_100000184863 [0,1,0,0,0,1|1,0,0]=3 6031 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2ccccn2 11a_106741647558_100000184863 [0,1,0,0,0,1|2,0,0]=4 6032 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2ccccn2 1626a_106741647558_100000184863 [0,1,0,0,0,1|2,0,0]=4 6033 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2ccccn2 240690a_106741647558_100000184863 [0,1,0,0,0,1|2,0,0]=4 6034 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2cccnc2 11a_100000754688_100000184863 [0,1,0,0,0,1|2,0,0]=4 6035 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2cccnc2 240690a_100000754688_100000184863 [0,1,0,0,0,1|2,0,0]=4 6036 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2ccncc2 11a_100025717301_100000184863 [0,1,0,0,0,1|2,0,0]=4 6037 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCOc2ccncc2 240690a_100025717301_100000184863 [0,1,0,0,0,1|2,0,0]=4 6038 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NCCSc2ccccc2 240690a_100000189519_100000184863 [0,1,0,0,0,1|1,0,0]=3 6039 B22R2.23174 O=C(C=Cc1ccc(cc1)Cl)NNCCc2ccccc2 22a_100000740470_100000184863 [0,1,0,0,0,1|1,0,0]=3 6040 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCCCc2ccccc2 1458a_100000182136_100000701786 [0,1,0,0,0,1|1,0,0]=3 6041 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCCCc2ccccc2 6a_100000210084_200011485782 [0,1,0,0,0,1|1,0,0]=3 6042 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCCCc2cccnc2 6a_100000210084_100012242803 [0,1,0,0,0,1|2,0,0]=4 6043 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCCCc2ccncc2 1458a_100000182136_100020630000 [0,1,0,0,0,1|2,0,0]=4 6044 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCCOc2ccccc2 1458a_100000182136_100000199009 [0,1,0,0,0,1|1,0,0]=3 6045 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCCSc2ccccc2 1458a_100000182136_200011203293 [0,1,0,0,0,1|1,0,0]=3 6046 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCOCc2ccccc2 1458a_100000182136_100000234347 [0,1,0,0,0,1|1,0,0]=3 6047 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCOCc2ccccc2 6a_100000210084_100011219826 [0,1,0,0,0,1|1,0,0]=3 6048 B22R2.23174 O=C(C=Cc1ccc(cc1)F)CCSCc2ccccc2 1458a_100000182136_200011297719 [0,1,0,0,0,1|1,0,0]=3 6049 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NC/C=C/c2ccccc2 11a_100020603302_100000182136 [0,1,0,0,0,1|1,0,1]=4 6050 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NC/C=C/c2ccccc2 1626a_100020603302_100000182136 [0,1,0,0,0,1|1,0,1]=4 6051 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NC/C=C/c2ccccc2 240690a_100020603302_100000182136 [0,1,0,0,0,1|1,0,1]=4 6052 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCC#Cc2ccccc2 11a_100000735379_100000182136 [0,1,0,0,0,1|1,0,1]=4 6053 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCC#Cc2ccccc2 1626a_100000735379_100000182136 [0,1,0,0,0,1|1,0,1]=4 6054 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCC#Cc2ccccc2 240690a_100000735379_100000182136 [0,1,0,0,0,1|1,0,1]=4 6055 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2ccccc2 11a_100000211184_100000182136 [0,1,0,0,0,1|1,0,0]=3 6056 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2ccccc2 1626a_100000211184_100000182136 [0,1,0,0,0,1|1,0,0]=3 6057 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2ccccc2 240690a_100000211184_100000182136 [0,1,0,0,0,1|1,0,0]=3 6058 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2ccccn2 11a_100000689020_100000182136 [0,1,0,0,0,1|2,0,0]=4 6059 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2ccccn2 1626a_100000689020_100000182136 [0,1,0,0,0,1|2,0,0]=4 6060 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2ccccn2 240690a_100000689020_100000182136 [0,1,0,0,0,1|2,0,0]=4 6061 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2cccnc2 11a_100011532358_100000182136 [0,1,0,0,0,1|2,0,0]=4 6062 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2cccnc2 240690a_100011532358_100000182136 [0,1,0,0,0,1|2,0,0]=4 6063 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2ccncc2 1626a_100011275580_100000182136 [0,1,0,0,0,1|2,0,0]=4 6064 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCCc2ccncc2 240690a_100011275580_100000182136 [0,1,0,0,0,1|2,0,0]=4 6065 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2ccccc2 11a_100000174943_100000182136 [0,1,0,0,0,1|1,0,0]=3 6066 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2ccccc2 1626a_100000174943_100000182136 [0,1,0,0,0,1|1,0,0]=3 6067 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2ccccc2 240690a_100000174943_100000182136 [0,1,0,0,0,1|1,0,0]=3 6068 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2ccccn2 11a_106741647558_100000182136 [0,1,0,0,0,1|2,0,0]=4 6069 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2ccccn2 1626a_106741647558_100000182136 [0,1,0,0,0,1|2,0,0]=4 6070 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2ccccn2 240690a_106741647558_100000182136 [0,1,0,0,0,1|2,0,0]=4 6071 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2cccnc2 11a_100000754688_100000182136 [0,1,0,0,0,1|2,0,0]=4 6072 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2cccnc2 240690a_100000754688_100000182136 [0,1,0,0,0,1|2,0,0]=4 6073 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2ccncc2 11a_100025717301_100000182136 [0,1,0,0,0,1|2,0,0]=4 6074 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCOc2ccncc2 240690a_100025717301_100000182136 [0,1,0,0,0,1|2,0,0]=4 6075 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NCCSc2ccccc2 240690a_100000189519_100000182136 [0,1,0,0,0,1|1,0,0]=3 6076 B22R2.23174 O=C(C=Cc1ccc(cc1)F)NNCCc2ccccc2 22a_100000740470_100000182136 [0,1,0,0,0,1|1,0,0]=3 6077 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCCCc2ccccc2 1458a_100102526154_100000701786 [0,1,0,0,0,1|1,0,0]=3 6078 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCCCc2ccccc2 6a_100000188517_200011485782 [0,1,0,0,0,1|1,0,0]=3 6079 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCCCc2cccnc2 6a_100000188517_100012242803 [0,1,0,0,0,1|2,0,0]=4 6080 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCCCc2ccncc2 1458a_100102526154_100020630000 [0,1,0,0,0,1|2,0,0]=4 6081 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCCOc2ccccc2 1458a_100102526154_100000199009 [0,1,0,0,0,1|1,0,0]=3 6082 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCCSc2ccccc2 1458a_100102526154_200011203293 [0,1,0,0,0,1|1,0,0]=3 6083 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCOCc2ccccc2 1458a_100102526154_100000234347 [0,1,0,0,0,1|1,0,0]=3 6084 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCOCc2ccccc2 6a_100000188517_100011219826 [0,1,0,0,0,1|1,0,0]=3 6085 B22R2.23174 O=C(C=Cc1ccc(cc1)I)CCSCc2ccccc2 1458a_100102526154_200011297719 [0,1,0,0,0,1|1,0,0]=3 6086 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NC/C=C/c2ccccc2 11a_100020603302_100102526154 [0,1,0,0,0,1|1,0,1]=4 6087 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NC/C=C/c2ccccc2 1626a_100020603302_100102526154 [0,1,0,0,0,1|1,0,1]=4 6088 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NC/C=C/c2ccccc2 240690a_100020603302_100102526154 [0,1,0,0,0,1|1,0,1]=4 6089 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCC#Cc2ccccc2 11a_100000735379_100102526154 [0,1,0,0,0,1|1,0,1]=4 6090 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCC#Cc2ccccc2 1626a_100000735379_100102526154 [0,1,0,0,0,1|1,0,1]=4 6091 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCC#Cc2ccccc2 240690a_100000735379_100102526154 [0,1,0,0,0,1|1,0,1]=4 6092 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2ccccc2 11a_100000211184_100102526154 [0,1,0,0,0,1|1,0,0]=3 6093 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2ccccc2 1626a_100000211184_100102526154 [0,1,0,0,0,1|1,0,0]=3 6094 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2ccccc2 240690a_100000211184_100102526154 [0,1,0,0,0,1|1,0,0]=3 6095 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2ccccn2 11a_100000689020_100102526154 [0,1,0,0,0,1|2,0,0]=4 6096 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2ccccn2 1626a_100000689020_100102526154 [0,1,0,0,0,1|2,0,0]=4 6097 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2ccccn2 240690a_100000689020_100102526154 [0,1,0,0,0,1|2,0,0]=4 6098 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2cccnc2 11a_100011532358_100102526154 [0,1,0,0,0,1|2,0,0]=4 6099 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2cccnc2 240690a_100011532358_100102526154 [0,1,0,0,0,1|2,0,0]=4 6100 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2ccncc2 1626a_100011275580_100102526154 [0,1,0,0,0,1|2,0,0]=4 6101 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCCc2ccncc2 240690a_100011275580_100102526154 [0,1,0,0,0,1|2,0,0]=4 6102 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2ccccc2 11a_100000174943_100102526154 [0,1,0,0,0,1|1,0,0]=3 6103 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2ccccc2 1626a_100000174943_100102526154 [0,1,0,0,0,1|1,0,0]=3 6104 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2ccccc2 240690a_100000174943_100102526154 [0,1,0,0,0,1|1,0,0]=3 6105 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2ccccn2 11a_106741647558_100102526154 [0,1,0,0,0,1|2,0,0]=4 6106 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2ccccn2 1626a_106741647558_100102526154 [0,1,0,0,0,1|2,0,0]=4 6107 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2ccccn2 240690a_106741647558_100102526154 [0,1,0,0,0,1|2,0,0]=4 6108 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2cccnc2 11a_100000754688_100102526154 [0,1,0,0,0,1|2,0,0]=4 6109 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2cccnc2 240690a_100000754688_100102526154 [0,1,0,0,0,1|2,0,0]=4 6110 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2ccncc2 11a_100025717301_100102526154 [0,1,0,0,0,1|2,0,0]=4 6111 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCOc2ccncc2 240690a_100025717301_100102526154 [0,1,0,0,0,1|2,0,0]=4 6112 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NCCSc2ccccc2 240690a_100000189519_100102526154 [0,1,0,0,0,1|1,0,0]=3 6113 B22R2.23174 O=C(C=Cc1ccc(cc1)I)NNCCc2ccccc2 22a_100000740470_100102526154 [0,1,0,0,0,1|1,0,0]=3 6114 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NC/C=C/c2ccccc2 240690a_100020603302_100016269017 [0,1,0,0,0,1|1,0,1]=4 6115 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCC#Cc2ccccc2 240690a_100000735379_100016269017 [0,1,0,0,0,1|1,0,1]=4 6116 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCCc2ccccc2 240690a_100000211184_100016269017 [0,1,0,0,0,1|1,0,0]=3 6117 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCCc2ccccn2 240690a_100000689020_100016269017 [0,1,0,0,0,1|2,0,0]=4 6118 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCCc2cccnc2 240690a_100011532358_100016269017 [0,1,0,0,0,1|2,0,0]=4 6119 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCCc2ccncc2 240690a_100011275580_100016269017 [0,1,0,0,0,1|2,0,0]=4 6120 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCOc2ccccc2 240690a_100000174943_100016269017 [0,1,0,0,0,1|1,0,0]=3 6121 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCOc2ccccn2 240690a_106741647558_100016269017 [0,1,0,0,0,1|2,0,0]=4 6122 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCOc2cccnc2 240690a_100000754688_100016269017 [0,1,0,0,0,1|2,0,0]=4 6123 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCOc2ccncc2 240690a_100025717301_100016269017 [0,1,0,0,0,1|2,0,0]=4 6124 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NCCSc2ccccc2 240690a_100000189519_100016269017 [0,1,0,0,0,1|1,0,0]=3 6125 B22R2.23174 O=C(C=Cc1ccc(cc1)O)NNCCc2ccccc2 22a_100000740470_100016269017 [0,1,0,0,0,1|1,0,0]=3 6126 B22R2.23174 O=C(C=Cc1ccc(cn1)Br)CCCCc2ccccc2 6a_100000754260_200011485782 [0,1,0,0,0,1|2,0,0]=4 6127 B22R2.23174 O=C(C=Cc1ccc(cn1)Br)CCOCc2ccccc2 6a_100000754260_100011219826 [0,1,0,0,0,1|2,0,0]=4 6128 B22R2.23174 O=C(C=Cc1ccc(cn1)F)CCCCc2ccccc2 1458a_100020630499_100000701786 [0,1,0,0,0,1|2,0,0]=4 6129 B22R2.23174 O=C(C=Cc1ccc(cn1)F)CCCCc2ccccc2 6a_100011934744_200011485782 [0,1,0,0,0,1|2,0,0]=4 6130 B22R2.23174 O=C(C=Cc1ccc(cn1)F)CCCOc2ccccc2 1458a_100020630499_100000199009 [0,1,0,0,0,1|2,0,0]=4 6131 B22R2.23174 O=C(C=Cc1ccc(cn1)F)CCCSc2ccccc2 1458a_100020630499_200011203293 [0,1,0,0,0,1|2,0,0]=4 6132 B22R2.23174 O=C(C=Cc1ccc(cn1)F)CCOCc2ccccc2 1458a_100020630499_100000234347 [0,1,0,0,0,1|2,0,0]=4 6133 B22R2.23174 O=C(C=Cc1ccc(cn1)F)CCOCc2ccccc2 6a_100011934744_100011219826 [0,1,0,0,0,1|2,0,0]=4 6134 B22R2.23174 O=C(C=Cc1ccc(cn1)F)CCSCc2ccccc2 1458a_100020630499_200011297719 [0,1,0,0,0,1|2,0,0]=4 6135 B22R2.23174 O=C(C=Cc1ccc(cn1)F)NCCCc2ccccc2 11a_100000211184_100020630499 [0,1,0,0,0,1|2,0,0]=4 6136 B22R2.23174 O=C(C=Cc1ccc(cn1)F)NCCCc2ccccc2 1626a_100000211184_100020630499 [0,1,0,0,0,1|2,0,0]=4 6137 B22R2.23174 O=C(C=Cc1ccc(cn1)F)NCCCc2ccccc2 240690a_100000211184_100020630499 [0,1,0,0,0,1|2,0,0]=4 6138 B22R2.23174 O=C(C=Cc1ccc(cn1)F)NCCOc2ccccc2 11a_100000174943_100020630499 [0,1,0,0,0,1|2,0,0]=4 6139 B22R2.23174 O=C(C=Cc1ccc(cn1)F)NCCOc2ccccc2 1626a_100000174943_100020630499 [0,1,0,0,0,1|2,0,0]=4 6140 B22R2.23174 O=C(C=Cc1ccc(cn1)F)NCCOc2ccccc2 240690a_100000174943_100020630499 [0,1,0,0,0,1|2,0,0]=4 6141 B22R2.23174 O=C(C=Cc1ccc(cn1)F)NCCSc2ccccc2 240690a_100000189519_100020630499 [0,1,0,0,0,1|2,0,0]=4 6142 B22R2.23174 O=C(C=Cc1ccc(cn1)F)NNCCc2ccccc2 22a_100000740470_100020630499 [0,1,0,0,0,1|2,0,0]=4 6143 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)CCCCc2ccccc2 1458a_100020588214_100000701786 [0,1,0,0,0,1|2,0,0]=4 6144 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)CCCOc2ccccc2 1458a_100020588214_100000199009 [0,1,0,0,0,1|2,0,0]=4 6145 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)CCCSc2ccccc2 1458a_100020588214_200011203293 [0,1,0,0,0,1|2,0,0]=4 6146 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)CCOCc2ccccc2 1458a_100020588214_100000234347 [0,1,0,0,0,1|2,0,0]=4 6147 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)CCSCc2ccccc2 1458a_100020588214_200011297719 [0,1,0,0,0,1|2,0,0]=4 6148 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)NCCCc2ccccc2 11a_100000211184_100020588214 [0,1,0,0,0,1|2,0,0]=4 6149 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)NCCCc2ccccc2 1626a_100000211184_100020588214 [0,1,0,0,0,1|2,0,0]=4 6150 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)NCCCc2ccccc2 240690a_100000211184_100020588214 [0,1,0,0,0,1|2,0,0]=4 6151 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)NCCOc2ccccc2 11a_100000174943_100020588214 [0,1,0,0,0,1|2,0,0]=4 6152 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)NCCOc2ccccc2 1626a_100000174943_100020588214 [0,1,0,0,0,1|2,0,0]=4 6153 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)NCCOc2ccccc2 240690a_100000174943_100020588214 [0,1,0,0,0,1|2,0,0]=4 6154 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)NCCSc2ccccc2 240690a_100000189519_100020588214 [0,1,0,0,0,1|2,0,0]=4 6155 B22R2.23174 O=C(C=Cc1ccc(nc1)Br)NNCCc2ccccc2 22a_100000740470_100020588214 [0,1,0,0,0,1|2,0,0]=4 6156 B22R2.23174 O=C(COCCc1ccccc1)NCc2ccc(cc2)Cl 34a_100000210268_100000183476 [0,1,0,0,0,1|1,0,1]=4 6157 B22R2.23174 O=C(COCCc1ccccc1)NCc2ccc(cc2)Cl 7a_100000210268_100000183476 [0,1,0,0,0,1|1,0,1]=4 6158 B22R2.23174 O=C(COCCc1ccccc1)NCc2ccc(cc2)F 34a_100000210268_100000182461 [0,1,0,0,0,1|1,0,1]=4 6159 B22R2.23174 O=C(COCCc1ccccc1)NCc2ccc(cc2)F 7a_100000210268_100000182461 [0,1,0,0,0,1|1,0,1]=4 6160 B22R2.34114 CC(CCc1ccccc1)NC(=O)C=Cc2ccccc2 11a_100000210798_100000210462 [0,1,0,0,0,1|1,0,0]=3 6161 B22R2.34114 CC(CCc1ccccc1)NC(=O)C=Cc2ccccc2 1626a_100000210798_100000210462 [0,1,0,0,0,1|1,0,0]=3 6162 B22R2.34114 CC(CCc1ccccc1)NC(=O)C=Cc2ccccn2 11a_100000210798_100000740811 [0,1,0,0,0,1|2,0,0]=4 6163 B22R2.34114 CC(CCc1ccccc1)NC(=O)C=Cc2ccccn2 240690a_100000210798_100000740811 [0,1,0,0,0,1|2,0,0]=4 6164 B22R2.34114 CC(CCc1ccccc1)NC(=O)C=Cc2cccnc2 11a_100000210798_100000735890 [0,1,0,0,0,1|2,0,0]=4 6165 B22R2.34114 CC(CCc1ccccc1)NC(=O)C=Cc2cccnc2 240690a_100000210798_100000735890 [0,1,0,0,0,1|2,0,0]=4 6166 B22R2.34114 CC(CCc1ccccc1)NC(=O)C=Cc2ccncc2 240690a_100000210798_100000682801 [0,1,0,0,0,1|2,0,0]=4 6167 B22R2.34114 CC(COc1ccccc1)NC(=O)C=Cc2ccccc2 11a_100000746794_100000210462 [0,1,0,0,0,1|1,0,0]=3 6168 B22R2.34114 CC(COc1ccccc1)NC(=O)C=Cc2ccccc2 1626a_100000746794_100000210462 [0,1,0,0,0,1|1,0,0]=3 6169 B22R2.34114 CC(COc1ccccc1)NC(=O)C=Cc2ccccn2 11a_100000746794_100000740811 [0,1,0,0,0,1|2,0,0]=4 6170 B22R2.34114 CC(COc1ccccc1)NC(=O)C=Cc2ccccn2 240690a_100000746794_100000740811 [0,1,0,0,0,1|2,0,0]=4 6171 B22R2.34114 CC(COc1ccccc1)NC(=O)C=Cc2cccnc2 11a_100000746794_100000735890 [0,1,0,0,0,1|2,0,0]=4 6172 B22R2.34114 CC(COc1ccccc1)NC(=O)C=Cc2cccnc2 240690a_100000746794_100000735890 [0,1,0,0,0,1|2,0,0]=4 6173 B22R2.34114 CC(COc1ccccc1)NC(=O)C=Cc2ccncc2 240690a_100000746794_100000682801 [0,1,0,0,0,1|2,0,0]=4 6174 B22R2.34114 CC(OC(=O)OCc1ccccc1)SCc2ccccc2 62a_100000211182_200015597219 [0,1,0,0,0,1|1,0,1]=4 6175 B22R2.34114 CC(OC(=O)OCc1ccccc1)SCc2ccccc2 62a_200015597219_100015291786 [0,1,0,0,0,1|1,0,1]=4 6176 B22R2.34114 O=C(C=Cc1ccccc1)CC(=O)CCc2ccccc2 1458a_100000210462_100012361361 [0,1,0,0,0,1|1,0,0]=3 6177 B22R2.34114 O=C(C=Cc1ccccc1)CC(=O)NCc2ccccc2 1458a_100000210462_100000183539 [0,1,0,0,0,1|1,0,1]=4 6178 B22R2.34114 O=C(C=Cc1ccccc1)CC(=O)OCc2ccccc2 1458a_100000210462_100000753625 [0,1,0,0,0,1|1,0,1]=4 6179 B22R2.34114 O=C(C=Cc1ccccn1)CC(=O)CCc2ccccc2 1458a_100000740811_100012361361 [0,1,0,0,0,1|2,0,0]=4 6180 B22R2.34114 O=C(C=Cc1cccnc1)CC(=O)CCc2ccccc2 1458a_100000735890_100012361361 [0,1,0,0,0,1|2,0,0]=4 6181 B22R2.34114 O=C(C=Cc1ccncc1)CC(=O)CCc2ccccc2 1458a_100000682801_100012361361 [0,1,0,0,0,1|2,0,0]=4 6182 B22R2.34137 CC(CNC(=O)C=Cc1ccccc1)Oc2ccccc2 11a_100000755676_100000210462 [0,1,0,0,0,1|1,0,0]=3 6183 B22R2.34137 CC(CNC(=O)C=Cc1ccccc1)Oc2ccccc2 1626a_100000755676_100000210462 [0,1,0,0,0,1|1,0,0]=3 6184 B22R2.34137 CC(CNC(=O)C=Cc1ccccc1)Oc2cccnc2 11a_200011219418_100000210462 [0,1,0,0,0,1|2,0,0]=4 6185 B22R2.34137 CC(CNC(=O)C=Cc1ccccc1)Oc2cccnc2 1626a_200011219418_100000210462 [0,1,0,0,0,1|2,0,0]=4 6186 B22R2.34137 CC(CNC(=O)C=Cc1ccccn1)Oc2ccccc2 11a_100000755676_100000740811 [0,1,0,0,0,1|2,0,0]=4 6187 B22R2.34137 CC(CNC(=O)C=Cc1ccccn1)Oc2ccccc2 240690a_100000755676_100000740811 [0,1,0,0,0,1|2,0,0]=4 6188 B22R2.34137 CC(CNC(=O)C=Cc1cccnc1)Oc2ccccc2 11a_100000755676_100000735890 [0,1,0,0,0,1|2,0,0]=4 6189 B22R2.34137 CC(CNC(=O)C=Cc1cccnc1)Oc2ccccc2 240690a_100000755676_100000735890 [0,1,0,0,0,1|2,0,0]=4 6190 B22R2.34137 CC(CNC(=O)C=Cc1ccncc1)Oc2ccccc2 240690a_100000755676_100000682801 [0,1,0,0,0,1|2,0,0]=4 6191 B22R2.34137 CC(Cc1ccccc1)OCC(=O)CCc2ccccc2 34a_100000748627_100012361361 [0,1,0,0,0,1|0,0,2]=4 6192 B22R2.34137 CC(Cc1ccccc1)OCC(=O)CCc2ccccc2 7a_100000748627_100012361361 [0,1,0,0,0,1|0,0,2]=4 6193 B22R2.34137 CC(Cc1ccccc1)OCC(=O)NCc2ccccc2 34a_100000748627_100000183539 [0,1,0,0,0,1|1,0,1]=4 6194 B22R2.34137 CC(Cc1ccccc1)OCC(=O)NCc2ccccc2 7a_100000748627_100000183539 [0,1,0,0,0,1|1,0,1]=4 6195 B22R2.34137 CC(Cc1ccccc1)OCC(=O)OCc2ccccc2 34a_100000748627_100000753625 [0,1,0,0,0,1|1,0,1]=4 6196 B22R2.34137 CC(Cc1ccccc1)OCC(=O)OCc2ccccc2 7a_100000748627_100000753625 [0,1,0,0,0,1|1,0,1]=4 6197 B22R2.34137 CN(CCC(=O)C=Cc1ccccc1)Cc2ccccc2 1458a_100000210462_100015196923 [0,1,0,0,0,1|1,0,0]=3 6198 B22R2.34137 CN(CCC(=O)C=Cc1ccccn1)Cc2ccccc2 1458a_100000740811_100015196923 [0,1,0,0,0,1|2,0,0]=4 6199 B22R2.34137 CN(CCC(=O)C=Cc1cccnc1)Cc2ccccc2 1458a_100000735890_100015196923 [0,1,0,0,0,1|2,0,0]=4 6200 B22R2.34137 CN(CCC(=O)C=Cc1ccncc1)Cc2ccccc2 1458a_100000682801_100015196923 [0,1,0,0,0,1|2,0,0]=4 6201 B22R2.34137 O=C(/C=C/c1ccccc1)NCC(=O)Nc2ccccc2 11a_100000106764_100000183125 [0,1,0,0,0,1|1,0,1]=4 6202 B22R2.34137 O=C(/C=C/c1ccccc1)NCC(=O)Nc2ccccc2 22a_100000106764_100000183125 [0,1,0,0,0,1|1,0,1]=4 6203 B22R2.34137 O=C(/C=C/c1ccccc1)NCC(=O)Nc2ccccc2 527a_100000106764_100000183125 [0,1,0,0,0,1|1,0,1]=4 6204 B22R2.34137 O=C(C=Cc1ccccc1)CCC(=O)Nc2ccccc2 1458a_100000210462_100000242058 [0,1,0,0,0,1|1,0,1]=4 6205 B22R2.34137 O=C(C=Cc1ccccc1)CCC(=O)Oc2ccccc2 1458a_100000210462_200000035796 [0,1,0,0,0,1|1,0,1]=4 6206 B22R2.34137 O=C(C=Cc1ccccc1)NCC(=O)Nc2ccccc2 11a_100000742222_100000210462 [0,1,0,0,0,1|1,0,1]=4 6207 B22R2.34137 O=C(C=Cc1ccccc1)NCC(=O)Nc2ccccc2 1626a_100000742222_100000210462 [0,1,0,0,0,1|1,0,1]=4 6208 B22R2.34137 O=C(C=Cc1ccccc1)NNC(=O)Cc2ccccc2 22a_100000182964_100000210462 [0,1,0,0,0,1|1,0,1]=4 6209 B22R2.34137 O=C(C=Cc1ccccn1)NCC(O)Cc2ccccc2 240690a_100000752270_100000740811 [0,1,0,0,0,1|2,0,0]=4 6210 B22R2.34137 O=C(C=Cc1cccnc1)NCC(O)Cc2ccccc2 240690a_100000752270_100000735890 [0,1,0,0,0,1|2,0,0]=4 6211 B22R2.34137 O=C(C=Cc1ccncc1)NCC(O)Cc2ccccc2 240690a_100000752270_100000682801 [0,1,0,0,0,1|2,0,0]=4 6212 B22R2.34137 O=C(CNC(=O)/C=C/c1ccccc1)Cc2ccccc2 1458a_100000183125_100015291786 [0,1,0,0,0,1|1,0,0]=3 6213 B22R2.34137 O=C(CNC(=O)/C=C/c1ccccc1)Cc2ccccn2 1458a_100000183125_100000721315 [0,1,0,0,0,1|2,0,0]=4 6214 B22R2.34137 O=C(CNC(=O)/C=C/c1ccccc1)Cc2cccnc2 1458a_100000183125_100000733263 [0,1,0,0,0,1|2,0,0]=4 6215 B22R2.34137 O=C(CNC(=O)/C=C/c1ccccc1)Cc2ccncc2 1458a_100000183125_100000705612 [0,1,0,0,0,1|2,0,0]=4 6216 B22R2.202375 CC(=NNCCc1ccccc1)C=Cc2ccccc2Cl 4a_100000740470_200016284137 [0,1,0,0,0,1|2,0,0]=4 6217 B22R2.202375 Cc1ccccc1C=CC(=O)NC/C=C/c2ccccc2 1626a_100020603302_100016266485 [0,1,0,0,0,1|1,0,1]=4 6218 B22R2.202375 Cc1ccccc1C=CC(=O)NCC#Cc2ccccc2 1626a_100000735379_100016266485 [0,1,0,0,0,1|1,0,1]=4 6219 B22R2.202375 Cc1ccccc1C=CC(=O)NCCCc2ccccc2 1626a_100000211184_100016266485 [0,1,0,0,0,1|1,0,0]=3 6220 B22R2.202375 Cc1ccccc1C=CC(=O)NCCCc2ccccn2 1626a_100000689020_100016266485 [0,1,0,0,0,1|2,0,0]=4 6221 B22R2.202375 Cc1ccccc1C=CC(=O)NCCCc2ccncc2 1626a_100011275580_100016266485 [0,1,0,0,0,1|2,0,0]=4 6222 B22R2.202375 Cc1ccccc1C=CC(=O)NCCOc2ccccc2 1626a_100000174943_100016266485 [0,1,0,0,0,1|1,0,0]=3 6223 B22R2.202375 Cc1ccccc1C=CC(=O)NCCOc2ccccn2 1626a_106741647558_100016266485 [0,1,0,0,0,1|2,0,0]=4 6224 B22R2.202375 Cc1ccccc1C=CC(=O)NNCCc2ccccc2 22a_100000740470_100016266485 [0,1,0,0,0,1|1,0,0]=3 6225 B22R2.202375 Cc1ccccc1CNC(=O)COCCc2ccccc2 34a_100000210268_100000230231 [0,1,0,0,0,1|1,0,1]=4 6226 B22R2.202375 Cc1ccccc1CNC(=O)COCCc2ccccc2 7a_100000210268_100000230231 [0,1,0,0,0,1|1,0,1]=4 6227 B22R2.202375 O=C(C=Cc1ccccc1Br)CCCCc2ccccc2 1458a_100000719032_100000701786 [0,1,0,0,0,1|1,0,0]=3 6228 B22R2.202375 O=C(C=Cc1ccccc1Br)CCCCc2ccncc2 1458a_100000719032_100020630000 [0,1,0,0,0,1|2,0,0]=4 6229 B22R2.202375 O=C(C=Cc1ccccc1Br)CCCOc2ccccc2 1458a_100000719032_100000199009 [0,1,0,0,0,1|1,0,0]=3 6230 B22R2.202375 O=C(C=Cc1ccccc1Br)CCCSc2ccccc2 1458a_100000719032_200011203293 [0,1,0,0,0,1|1,0,0]=3 6231 B22R2.202375 O=C(C=Cc1ccccc1Br)CCOCc2ccccc2 1458a_100000719032_100000234347 [0,1,0,0,0,1|1,0,0]=3 6232 B22R2.202375 O=C(C=Cc1ccccc1Br)CCSCc2ccccc2 1458a_100000719032_200011297719 [0,1,0,0,0,1|1,0,0]=3 6233 B22R2.202375 O=C(C=Cc1ccccc1Br)NC/C=C/c2ccccc2 11a_100020603302_100000719032 [0,1,0,0,0,1|1,0,1]=4 6234 B22R2.202375 O=C(C=Cc1ccccc1Br)NC/C=C/c2ccccc2 1626a_100020603302_100000719032 [0,1,0,0,0,1|1,0,1]=4 6235 B22R2.202375 O=C(C=Cc1ccccc1Br)NC/C=C/c2ccccc2 240690a_100020603302_100000719032 [0,1,0,0,0,1|1,0,1]=4 6236 B22R2.202375 O=C(C=Cc1ccccc1Br)NCC#Cc2ccccc2 11a_100000735379_100000719032 [0,1,0,0,0,1|1,0,1]=4 6237 B22R2.202375 O=C(C=Cc1ccccc1Br)NCC#Cc2ccccc2 1626a_100000735379_100000719032 [0,1,0,0,0,1|1,0,1]=4 6238 B22R2.202375 O=C(C=Cc1ccccc1Br)NCC#Cc2ccccc2 240690a_100000735379_100000719032 [0,1,0,0,0,1|1,0,1]=4 6239 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2ccccc2 11a_100000211184_100000719032 [0,1,0,0,0,1|1,0,0]=3 6240 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2ccccc2 1626a_100000211184_100000719032 [0,1,0,0,0,1|1,0,0]=3 6241 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2ccccc2 240690a_100000211184_100000719032 [0,1,0,0,0,1|1,0,0]=3 6242 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2ccccn2 11a_100000689020_100000719032 [0,1,0,0,0,1|2,0,0]=4 6243 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2ccccn2 1626a_100000689020_100000719032 [0,1,0,0,0,1|2,0,0]=4 6244 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2ccccn2 240690a_100000689020_100000719032 [0,1,0,0,0,1|2,0,0]=4 6245 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2cccnc2 11a_100011532358_100000719032 [0,1,0,0,0,1|2,0,0]=4 6246 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2cccnc2 240690a_100011532358_100000719032 [0,1,0,0,0,1|2,0,0]=4 6247 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2ccncc2 1626a_100011275580_100000719032 [0,1,0,0,0,1|2,0,0]=4 6248 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCCc2ccncc2 240690a_100011275580_100000719032 [0,1,0,0,0,1|2,0,0]=4 6249 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2ccccc2 11a_100000174943_100000719032 [0,1,0,0,0,1|1,0,0]=3 6250 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2ccccc2 1626a_100000174943_100000719032 [0,1,0,0,0,1|1,0,0]=3 6251 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2ccccc2 240690a_100000174943_100000719032 [0,1,0,0,0,1|1,0,0]=3 6252 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2ccccn2 11a_106741647558_100000719032 [0,1,0,0,0,1|2,0,0]=4 6253 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2ccccn2 1626a_106741647558_100000719032 [0,1,0,0,0,1|2,0,0]=4 6254 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2ccccn2 240690a_106741647558_100000719032 [0,1,0,0,0,1|2,0,0]=4 6255 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2cccnc2 11a_100000754688_100000719032 [0,1,0,0,0,1|2,0,0]=4 6256 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2cccnc2 240690a_100000754688_100000719032 [0,1,0,0,0,1|2,0,0]=4 6257 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2ccncc2 11a_100025717301_100000719032 [0,1,0,0,0,1|2,0,0]=4 6258 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCOc2ccncc2 240690a_100025717301_100000719032 [0,1,0,0,0,1|2,0,0]=4 6259 B22R2.202375 O=C(C=Cc1ccccc1Br)NCCSc2ccccc2 240690a_100000189519_100000719032 [0,1,0,0,0,1|1,0,0]=3 6260 B22R2.202375 O=C(C=Cc1ccccc1Br)NNCCc2ccccc2 22a_100000740470_100000719032 [0,1,0,0,0,1|1,0,0]=3 6261 B22R2.202375 O=C(C=Cc1ccccc1Cl)CCCCc2ccccc2 1458a_100000720304_100000701786 [0,1,0,0,0,1|1,0,0]=3 6262 B22R2.202375 O=C(C=Cc1ccccc1Cl)CCCCc2ccncc2 1458a_100000720304_100020630000 [0,1,0,0,0,1|2,0,0]=4 6263 B22R2.202375 O=C(C=Cc1ccccc1Cl)CCCOc2ccccc2 1458a_100000720304_100000199009 [0,1,0,0,0,1|1,0,0]=3 6264 B22R2.202375 O=C(C=Cc1ccccc1Cl)CCCSc2ccccc2 1458a_100000720304_200011203293 [0,1,0,0,0,1|1,0,0]=3 6265 B22R2.202375 O=C(C=Cc1ccccc1Cl)CCOCc2ccccc2 1458a_100000720304_100000234347 [0,1,0,0,0,1|1,0,0]=3 6266 B22R2.202375 O=C(C=Cc1ccccc1Cl)CCSCc2ccccc2 1458a_100000720304_200011297719 [0,1,0,0,0,1|1,0,0]=3 6267 B22R2.202375 O=C(C=Cc1ccccc1Cl)NC/C=C/c2ccccc2 11a_100020603302_100000720304 [0,1,0,0,0,1|1,0,1]=4 6268 B22R2.202375 O=C(C=Cc1ccccc1Cl)NC/C=C/c2ccccc2 1626a_100020603302_100000720304 [0,1,0,0,0,1|1,0,1]=4 6269 B22R2.202375 O=C(C=Cc1ccccc1Cl)NC/C=C/c2ccccc2 240690a_100020603302_100000720304 [0,1,0,0,0,1|1,0,1]=4 6270 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCC#Cc2ccccc2 11a_100000735379_100000720304 [0,1,0,0,0,1|1,0,1]=4 6271 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCC#Cc2ccccc2 1626a_100000735379_100000720304 [0,1,0,0,0,1|1,0,1]=4 6272 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCC#Cc2ccccc2 240690a_100000735379_100000720304 [0,1,0,0,0,1|1,0,1]=4 6273 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2ccccc2 11a_100000211184_100000720304 [0,1,0,0,0,1|1,0,0]=3 6274 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2ccccc2 1626a_100000211184_100000720304 [0,1,0,0,0,1|1,0,0]=3 6275 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2ccccc2 240690a_100000211184_100000720304 [0,1,0,0,0,1|1,0,0]=3 6276 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2ccccn2 11a_100000689020_100000720304 [0,1,0,0,0,1|2,0,0]=4 6277 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2ccccn2 1626a_100000689020_100000720304 [0,1,0,0,0,1|2,0,0]=4 6278 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2ccccn2 240690a_100000689020_100000720304 [0,1,0,0,0,1|2,0,0]=4 6279 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2cccnc2 11a_100011532358_100000720304 [0,1,0,0,0,1|2,0,0]=4 6280 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2cccnc2 240690a_100011532358_100000720304 [0,1,0,0,0,1|2,0,0]=4 6281 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2ccncc2 1626a_100011275580_100000720304 [0,1,0,0,0,1|2,0,0]=4 6282 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCCc2ccncc2 240690a_100011275580_100000720304 [0,1,0,0,0,1|2,0,0]=4 6283 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2ccccc2 11a_100000174943_100000720304 [0,1,0,0,0,1|1,0,0]=3 6284 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2ccccc2 1626a_100000174943_100000720304 [0,1,0,0,0,1|1,0,0]=3 6285 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2ccccc2 240690a_100000174943_100000720304 [0,1,0,0,0,1|1,0,0]=3 6286 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2ccccn2 11a_106741647558_100000720304 [0,1,0,0,0,1|2,0,0]=4 6287 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2ccccn2 1626a_106741647558_100000720304 [0,1,0,0,0,1|2,0,0]=4 6288 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2ccccn2 240690a_106741647558_100000720304 [0,1,0,0,0,1|2,0,0]=4 6289 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2cccnc2 11a_100000754688_100000720304 [0,1,0,0,0,1|2,0,0]=4 6290 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2cccnc2 240690a_100000754688_100000720304 [0,1,0,0,0,1|2,0,0]=4 6291 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2ccncc2 11a_100025717301_100000720304 [0,1,0,0,0,1|2,0,0]=4 6292 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCOc2ccncc2 240690a_100025717301_100000720304 [0,1,0,0,0,1|2,0,0]=4 6293 B22R2.202375 O=C(C=Cc1ccccc1Cl)NCCSc2ccccc2 240690a_100000189519_100000720304 [0,1,0,0,0,1|1,0,0]=3 6294 B22R2.202375 O=C(C=Cc1ccccc1Cl)NNCCc2ccccc2 22a_100000740470_100000720304 [0,1,0,0,0,1|1,0,0]=3 6295 B22R2.202375 O=C(C=Cc1ccccc1F)CCCCc2ccccc2 1458a_100016256065_100000701786 [0,1,0,0,0,1|1,0,0]=3 6296 B22R2.202375 O=C(C=Cc1ccccc1F)CCCCc2ccncc2 1458a_100016256065_100020630000 [0,1,0,0,0,1|2,0,0]=4 6297 B22R2.202375 O=C(C=Cc1ccccc1F)CCCOc2ccccc2 1458a_100016256065_100000199009 [0,1,0,0,0,1|1,0,0]=3 6298 B22R2.202375 O=C(C=Cc1ccccc1F)CCCSc2ccccc2 1458a_100016256065_200011203293 [0,1,0,0,0,1|1,0,0]=3 6299 B22R2.202375 O=C(C=Cc1ccccc1F)CCOCc2ccccc2 1458a_100016256065_100000234347 [0,1,0,0,0,1|1,0,0]=3 6300 B22R2.202375 O=C(C=Cc1ccccc1F)CCSCc2ccccc2 1458a_100016256065_200011297719 [0,1,0,0,0,1|1,0,0]=3 6301 B22R2.202375 O=C(C=Cc1ccccc1F)NC/C=C/c2ccccc2 11a_100020603302_100016256065 [0,1,0,0,0,1|1,0,1]=4 6302 B22R2.202375 O=C(C=Cc1ccccc1F)NC/C=C/c2ccccc2 1626a_100020603302_100016256065 [0,1,0,0,0,1|1,0,1]=4 6303 B22R2.202375 O=C(C=Cc1ccccc1F)NC/C=C/c2ccccc2 240690a_100020603302_100016256065 [0,1,0,0,0,1|1,0,1]=4 6304 B22R2.202375 O=C(C=Cc1ccccc1F)NCC#Cc2ccccc2 11a_100000735379_100016256065 [0,1,0,0,0,1|1,0,1]=4 6305 B22R2.202375 O=C(C=Cc1ccccc1F)NCC#Cc2ccccc2 1626a_100000735379_100016256065 [0,1,0,0,0,1|1,0,1]=4 6306 B22R2.202375 O=C(C=Cc1ccccc1F)NCC#Cc2ccccc2 240690a_100000735379_100016256065 [0,1,0,0,0,1|1,0,1]=4 6307 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2ccccc2 11a_100000211184_100016256065 [0,1,0,0,0,1|1,0,0]=3 6308 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2ccccc2 1626a_100000211184_100016256065 [0,1,0,0,0,1|1,0,0]=3 6309 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2ccccc2 240690a_100000211184_100016256065 [0,1,0,0,0,1|1,0,0]=3 6310 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2ccccn2 11a_100000689020_100016256065 [0,1,0,0,0,1|2,0,0]=4 6311 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2ccccn2 1626a_100000689020_100016256065 [0,1,0,0,0,1|2,0,0]=4 6312 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2ccccn2 240690a_100000689020_100016256065 [0,1,0,0,0,1|2,0,0]=4 6313 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2cccnc2 11a_100011532358_100016256065 [0,1,0,0,0,1|2,0,0]=4 6314 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2cccnc2 240690a_100011532358_100016256065 [0,1,0,0,0,1|2,0,0]=4 6315 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2ccncc2 1626a_100011275580_100016256065 [0,1,0,0,0,1|2,0,0]=4 6316 B22R2.202375 O=C(C=Cc1ccccc1F)NCCCc2ccncc2 240690a_100011275580_100016256065 [0,1,0,0,0,1|2,0,0]=4 6317 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2ccccc2 11a_100000174943_100016256065 [0,1,0,0,0,1|1,0,0]=3 6318 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2ccccc2 1626a_100000174943_100016256065 [0,1,0,0,0,1|1,0,0]=3 6319 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2ccccc2 240690a_100000174943_100016256065 [0,1,0,0,0,1|1,0,0]=3 6320 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2ccccn2 11a_106741647558_100016256065 [0,1,0,0,0,1|2,0,0]=4 6321 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2ccccn2 1626a_106741647558_100016256065 [0,1,0,0,0,1|2,0,0]=4 6322 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2ccccn2 240690a_106741647558_100016256065 [0,1,0,0,0,1|2,0,0]=4 6323 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2cccnc2 11a_100000754688_100016256065 [0,1,0,0,0,1|2,0,0]=4 6324 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2cccnc2 240690a_100000754688_100016256065 [0,1,0,0,0,1|2,0,0]=4 6325 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2ccncc2 11a_100025717301_100016256065 [0,1,0,0,0,1|2,0,0]=4 6326 B22R2.202375 O=C(C=Cc1ccccc1F)NCCOc2ccncc2 240690a_100025717301_100016256065 [0,1,0,0,0,1|2,0,0]=4 6327 B22R2.202375 O=C(C=Cc1ccccc1F)NCCSc2ccccc2 240690a_100000189519_100016256065 [0,1,0,0,0,1|1,0,0]=3 6328 B22R2.202375 O=C(C=Cc1ccccc1F)NNCCc2ccccc2 22a_100000740470_100016256065 [0,1,0,0,0,1|1,0,0]=3 6329 B22R2.202375 O=C(C=Cc1ccccc1O)CCCCc2ccccc2 1458a_100016263591_100000701786 [0,1,0,0,0,1|1,0,0]=3 6330 B22R2.202375 O=C(C=Cc1ccccc1O)CCCCc2ccncc2 1458a_100016263591_100020630000 [0,1,0,0,0,1|2,0,0]=4 6331 B22R2.202375 O=C(C=Cc1ccccc1O)CCCOc2ccccc2 1458a_100016263591_100000199009 [0,1,0,0,0,1|1,0,0]=3 6332 B22R2.202375 O=C(C=Cc1ccccc1O)CCCSc2ccccc2 1458a_100016263591_200011203293 [0,1,0,0,0,1|1,0,0]=3 6333 B22R2.202375 O=C(C=Cc1ccccc1O)CCOCc2ccccc2 1458a_100016263591_100000234347 [0,1,0,0,0,1|1,0,0]=3 6334 B22R2.202375 O=C(C=Cc1ccccc1O)CCSCc2ccccc2 1458a_100016263591_200011297719 [0,1,0,0,0,1|1,0,0]=3 6335 B22R2.202375 O=C(C=Cc1ccccc1O)NNCCc2ccccc2 22a_100000740470_100016263591 [0,1,0,0,0,1|1,0,0]=3 6336 B22R2.202375 O=C(COCCc1ccccc1)NCc2ccccc2F 34a_100000210268_100000190583 [0,1,0,0,0,1|1,0,1]=4 6337 B22R2.202375 O=C(COCCc1ccccc1)NCc2ccccc2F 7a_100000210268_100000190583 [0,1,0,0,0,1|1,0,1]=4 6338 B22R2.304425 CC(=NNCCc1ccccc1)C=Cc2cccc(c2)Br 4a_100000740470_200016266566 [0,1,0,0,0,1|2,0,0]=4 6339 B22R2.304425 CC(=NNCCc1ccccc1)C=Cc2cccc(c2)Cl 4a_100000740470_200016280735 [0,1,0,0,0,1|2,0,0]=4 6340 B22R2.304425 Cc1cccc(c1)C=CC(=O)CCCCc2ccccc2 1458a_100000690095_100000701786 [0,1,0,0,0,1|1,0,0]=3 6341 B22R2.304425 Cc1cccc(c1)C=CC(=O)CCCCc2ccncc2 1458a_100000690095_100020630000 [0,1,0,0,0,1|2,0,0]=4 6342 B22R2.304425 Cc1cccc(c1)C=CC(=O)CCCOc2ccccc2 1458a_100000690095_100000199009 [0,1,0,0,0,1|1,0,0]=3 6343 B22R2.304425 Cc1cccc(c1)C=CC(=O)CCCSc2ccccc2 1458a_100000690095_200011203293 [0,1,0,0,0,1|1,0,0]=3 6344 B22R2.304425 Cc1cccc(c1)C=CC(=O)CCOCc2ccccc2 1458a_100000690095_100000234347 [0,1,0,0,0,1|1,0,0]=3 6345 B22R2.304425 Cc1cccc(c1)C=CC(=O)CCSCc2ccccc2 1458a_100000690095_200011297719 [0,1,0,0,0,1|1,0,0]=3 6346 B22R2.304425 Cc1cccc(c1)C=CC(=O)NC/C=C/c2ccccc2 11a_100020603302_100000690095 [0,1,0,0,0,1|1,0,1]=4 6347 B22R2.304425 Cc1cccc(c1)C=CC(=O)NC/C=C/c2ccccc2 1626a_100020603302_100000690095 [0,1,0,0,0,1|1,0,1]=4 6348 B22R2.304425 Cc1cccc(c1)C=CC(=O)NC/C=C/c2ccccc2 240690a_100020603302_100000690095 [0,1,0,0,0,1|1,0,1]=4 6349 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCC#Cc2ccccc2 11a_100000735379_100000690095 [0,1,0,0,0,1|1,0,1]=4 6350 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCC#Cc2ccccc2 1626a_100000735379_100000690095 [0,1,0,0,0,1|1,0,1]=4 6351 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCC#Cc2ccccc2 240690a_100000735379_100000690095 [0,1,0,0,0,1|1,0,1]=4 6352 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2ccccc2 11a_100000211184_100000690095 [0,1,0,0,0,1|1,0,0]=3 6353 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2ccccc2 1626a_100000211184_100000690095 [0,1,0,0,0,1|1,0,0]=3 6354 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2ccccc2 240690a_100000211184_100000690095 [0,1,0,0,0,1|1,0,0]=3 6355 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2ccccn2 11a_100000689020_100000690095 [0,1,0,0,0,1|2,0,0]=4 6356 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2ccccn2 1626a_100000689020_100000690095 [0,1,0,0,0,1|2,0,0]=4 6357 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2ccccn2 240690a_100000689020_100000690095 [0,1,0,0,0,1|2,0,0]=4 6358 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2cccnc2 11a_100011532358_100000690095 [0,1,0,0,0,1|2,0,0]=4 6359 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2cccnc2 240690a_100011532358_100000690095 [0,1,0,0,0,1|2,0,0]=4 6360 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2ccncc2 1626a_100011275580_100000690095 [0,1,0,0,0,1|2,0,0]=4 6361 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCCc2ccncc2 240690a_100011275580_100000690095 [0,1,0,0,0,1|2,0,0]=4 6362 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2ccccc2 11a_100000174943_100000690095 [0,1,0,0,0,1|1,0,0]=3 6363 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2ccccc2 1626a_100000174943_100000690095 [0,1,0,0,0,1|1,0,0]=3 6364 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2ccccc2 240690a_100000174943_100000690095 [0,1,0,0,0,1|1,0,0]=3 6365 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2ccccn2 11a_106741647558_100000690095 [0,1,0,0,0,1|2,0,0]=4 6366 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2ccccn2 1626a_106741647558_100000690095 [0,1,0,0,0,1|2,0,0]=4 6367 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2ccccn2 240690a_106741647558_100000690095 [0,1,0,0,0,1|2,0,0]=4 6368 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2cccnc2 11a_100000754688_100000690095 [0,1,0,0,0,1|2,0,0]=4 6369 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2cccnc2 240690a_100000754688_100000690095 [0,1,0,0,0,1|2,0,0]=4 6370 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2ccncc2 11a_100025717301_100000690095 [0,1,0,0,0,1|2,0,0]=4 6371 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCOc2ccncc2 240690a_100025717301_100000690095 [0,1,0,0,0,1|2,0,0]=4 6372 B22R2.304425 Cc1cccc(c1)C=CC(=O)NCCSc2ccccc2 240690a_100000189519_100000690095 [0,1,0,0,0,1|1,0,0]=3 6373 B22R2.304425 Cc1cccc(c1)C=CC(=O)NNCCc2ccccc2 22a_100000740470_100000690095 [0,1,0,0,0,1|1,0,0]=3 6374 B22R2.304425 Cc1cccc(c1)CNC(=O)COCCc2ccccc2 34a_100000210268_100000754571 [0,1,0,0,0,1|1,0,1]=4 6375 B22R2.304425 Cc1cccc(c1)CNC(=O)COCCc2ccccc2 7a_100000210268_100000754571 [0,1,0,0,0,1|1,0,1]=4 6376 B22R2.304425 Cc1cncc(c1)C=CC(=O)CCCCc2ccccc2 6a_100011998712_200011485782 [0,1,0,0,0,1|2,0,0]=4 6377 B22R2.304425 Cc1cncc(c1)C=CC(=O)CCOCc2ccccc2 6a_100011998712_100011219826 [0,1,0,0,0,1|2,0,0]=4 6378 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCCCc2ccccc2 1458a_100016258244_100000701786 [0,1,0,0,0,1|1,0,0]=3 6379 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCCCc2ccccc2 6a_100000210085_200011485782 [0,1,0,0,0,1|1,0,0]=3 6380 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCCCc2cccnc2 6a_100000210085_100012242803 [0,1,0,0,0,1|2,0,0]=4 6381 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCCCc2ccncc2 1458a_100016258244_100020630000 [0,1,0,0,0,1|2,0,0]=4 6382 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCCOc2ccccc2 1458a_100016258244_100000199009 [0,1,0,0,0,1|1,0,0]=3 6383 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCCSc2ccccc2 1458a_100016258244_200011203293 [0,1,0,0,0,1|1,0,0]=3 6384 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCOCc2ccccc2 1458a_100016258244_100000234347 [0,1,0,0,0,1|1,0,0]=3 6385 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCOCc2ccccc2 6a_100000210085_100011219826 [0,1,0,0,0,1|1,0,0]=3 6386 B22R2.304425 O=C(C=Cc1cccc(c1)Br)CCSCc2ccccc2 1458a_100016258244_200011297719 [0,1,0,0,0,1|1,0,0]=3 6387 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NC/C=C/c2ccccc2 11a_100020603302_100016258244 [0,1,0,0,0,1|1,0,1]=4 6388 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NC/C=C/c2ccccc2 1626a_100020603302_100016258244 [0,1,0,0,0,1|1,0,1]=4 6389 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NC/C=C/c2ccccc2 240690a_100020603302_100016258244 [0,1,0,0,0,1|1,0,1]=4 6390 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCC#Cc2ccccc2 11a_100000735379_100016258244 [0,1,0,0,0,1|1,0,1]=4 6391 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCC#Cc2ccccc2 1626a_100000735379_100016258244 [0,1,0,0,0,1|1,0,1]=4 6392 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCC#Cc2ccccc2 240690a_100000735379_100016258244 [0,1,0,0,0,1|1,0,1]=4 6393 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2ccccc2 11a_100000211184_100016258244 [0,1,0,0,0,1|1,0,0]=3 6394 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2ccccc2 1626a_100000211184_100016258244 [0,1,0,0,0,1|1,0,0]=3 6395 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2ccccc2 240690a_100000211184_100016258244 [0,1,0,0,0,1|1,0,0]=3 6396 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2ccccn2 11a_100000689020_100016258244 [0,1,0,0,0,1|2,0,0]=4 6397 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2ccccn2 1626a_100000689020_100016258244 [0,1,0,0,0,1|2,0,0]=4 6398 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2ccccn2 240690a_100000689020_100016258244 [0,1,0,0,0,1|2,0,0]=4 6399 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2cccnc2 11a_100011532358_100016258244 [0,1,0,0,0,1|2,0,0]=4 6400 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2cccnc2 240690a_100011532358_100016258244 [0,1,0,0,0,1|2,0,0]=4 6401 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2ccncc2 1626a_100011275580_100016258244 [0,1,0,0,0,1|2,0,0]=4 6402 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCCc2ccncc2 240690a_100011275580_100016258244 [0,1,0,0,0,1|2,0,0]=4 6403 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2ccccc2 11a_100000174943_100016258244 [0,1,0,0,0,1|1,0,0]=3 6404 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2ccccc2 1626a_100000174943_100016258244 [0,1,0,0,0,1|1,0,0]=3 6405 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2ccccc2 240690a_100000174943_100016258244 [0,1,0,0,0,1|1,0,0]=3 6406 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2ccccn2 11a_106741647558_100016258244 [0,1,0,0,0,1|2,0,0]=4 6407 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2ccccn2 1626a_106741647558_100016258244 [0,1,0,0,0,1|2,0,0]=4 6408 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2ccccn2 240690a_106741647558_100016258244 [0,1,0,0,0,1|2,0,0]=4 6409 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2cccnc2 11a_100000754688_100016258244 [0,1,0,0,0,1|2,0,0]=4 6410 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2cccnc2 240690a_100000754688_100016258244 [0,1,0,0,0,1|2,0,0]=4 6411 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2ccncc2 11a_100025717301_100016258244 [0,1,0,0,0,1|2,0,0]=4 6412 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCOc2ccncc2 240690a_100025717301_100016258244 [0,1,0,0,0,1|2,0,0]=4 6413 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NCCSc2ccccc2 240690a_100000189519_100016258244 [0,1,0,0,0,1|1,0,0]=3 6414 B22R2.304425 O=C(C=Cc1cccc(c1)Br)NNCCc2ccccc2 22a_100000740470_100016258244 [0,1,0,0,0,1|1,0,0]=3 6415 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)CCCCc2ccccc2 1458a_100000184502_100000701786 [0,1,0,0,0,1|1,0,0]=3 6416 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)CCCCc2ccncc2 1458a_100000184502_100020630000 [0,1,0,0,0,1|2,0,0]=4 6417 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)CCCOc2ccccc2 1458a_100000184502_100000199009 [0,1,0,0,0,1|1,0,0]=3 6418 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)CCCSc2ccccc2 1458a_100000184502_200011203293 [0,1,0,0,0,1|1,0,0]=3 6419 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)CCOCc2ccccc2 1458a_100000184502_100000234347 [0,1,0,0,0,1|1,0,0]=3 6420 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)CCSCc2ccccc2 1458a_100000184502_200011297719 [0,1,0,0,0,1|1,0,0]=3 6421 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NC/C=C/c2ccccc2 11a_100020603302_100000184502 [0,1,0,0,0,1|1,0,1]=4 6422 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NC/C=C/c2ccccc2 1626a_100020603302_100000184502 [0,1,0,0,0,1|1,0,1]=4 6423 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NC/C=C/c2ccccc2 240690a_100020603302_100000184502 [0,1,0,0,0,1|1,0,1]=4 6424 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCC#Cc2ccccc2 11a_100000735379_100000184502 [0,1,0,0,0,1|1,0,1]=4 6425 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCC#Cc2ccccc2 1626a_100000735379_100000184502 [0,1,0,0,0,1|1,0,1]=4 6426 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCC#Cc2ccccc2 240690a_100000735379_100000184502 [0,1,0,0,0,1|1,0,1]=4 6427 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2ccccc2 11a_100000211184_100000184502 [0,1,0,0,0,1|1,0,0]=3 6428 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2ccccc2 1626a_100000211184_100000184502 [0,1,0,0,0,1|1,0,0]=3 6429 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2ccccc2 240690a_100000211184_100000184502 [0,1,0,0,0,1|1,0,0]=3 6430 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2ccccn2 11a_100000689020_100000184502 [0,1,0,0,0,1|2,0,0]=4 6431 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2ccccn2 1626a_100000689020_100000184502 [0,1,0,0,0,1|2,0,0]=4 6432 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2ccccn2 240690a_100000689020_100000184502 [0,1,0,0,0,1|2,0,0]=4 6433 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2cccnc2 11a_100011532358_100000184502 [0,1,0,0,0,1|2,0,0]=4 6434 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2cccnc2 240690a_100011532358_100000184502 [0,1,0,0,0,1|2,0,0]=4 6435 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2ccncc2 1626a_100011275580_100000184502 [0,1,0,0,0,1|2,0,0]=4 6436 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCCc2ccncc2 240690a_100011275580_100000184502 [0,1,0,0,0,1|2,0,0]=4 6437 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2ccccc2 11a_100000174943_100000184502 [0,1,0,0,0,1|1,0,0]=3 6438 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2ccccc2 1626a_100000174943_100000184502 [0,1,0,0,0,1|1,0,0]=3 6439 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2ccccc2 240690a_100000174943_100000184502 [0,1,0,0,0,1|1,0,0]=3 6440 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2ccccn2 11a_106741647558_100000184502 [0,1,0,0,0,1|2,0,0]=4 6441 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2ccccn2 1626a_106741647558_100000184502 [0,1,0,0,0,1|2,0,0]=4 6442 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2ccccn2 240690a_106741647558_100000184502 [0,1,0,0,0,1|2,0,0]=4 6443 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2cccnc2 11a_100000754688_100000184502 [0,1,0,0,0,1|2,0,0]=4 6444 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2cccnc2 240690a_100000754688_100000184502 [0,1,0,0,0,1|2,0,0]=4 6445 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2ccncc2 11a_100025717301_100000184502 [0,1,0,0,0,1|2,0,0]=4 6446 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCOc2ccncc2 240690a_100025717301_100000184502 [0,1,0,0,0,1|2,0,0]=4 6447 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NCCSc2ccccc2 240690a_100000189519_100000184502 [0,1,0,0,0,1|1,0,0]=3 6448 B22R2.304425 O=C(C=Cc1cccc(c1)Cl)NNCCc2ccccc2 22a_100000740470_100000184502 [0,1,0,0,0,1|1,0,0]=3 6449 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCCCc2ccccc2 1458a_100000718793_100000701786 [0,1,0,0,0,1|1,0,0]=3 6450 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCCCc2ccccc2 6a_100000210812_200011485782 [0,1,0,0,0,1|1,0,0]=3 6451 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCCCc2cccnc2 6a_100000210812_100012242803 [0,1,0,0,0,1|2,0,0]=4 6452 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCCCc2ccncc2 1458a_100000718793_100020630000 [0,1,0,0,0,1|2,0,0]=4 6453 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCCOc2ccccc2 1458a_100000718793_100000199009 [0,1,0,0,0,1|1,0,0]=3 6454 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCCSc2ccccc2 1458a_100000718793_200011203293 [0,1,0,0,0,1|1,0,0]=3 6455 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCOCc2ccccc2 1458a_100000718793_100000234347 [0,1,0,0,0,1|1,0,0]=3 6456 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCOCc2ccccc2 6a_100000210812_100011219826 [0,1,0,0,0,1|1,0,0]=3 6457 B22R2.304425 O=C(C=Cc1cccc(c1)F)CCSCc2ccccc2 1458a_100000718793_200011297719 [0,1,0,0,0,1|1,0,0]=3 6458 B22R2.304425 O=C(C=Cc1cccc(c1)F)NC/C=C/c2ccccc2 11a_100020603302_100000718793 [0,1,0,0,0,1|1,0,1]=4 6459 B22R2.304425 O=C(C=Cc1cccc(c1)F)NC/C=C/c2ccccc2 1626a_100020603302_100000718793 [0,1,0,0,0,1|1,0,1]=4 6460 B22R2.304425 O=C(C=Cc1cccc(c1)F)NC/C=C/c2ccccc2 240690a_100020603302_100000718793 [0,1,0,0,0,1|1,0,1]=4 6461 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCC#Cc2ccccc2 11a_100000735379_100000718793 [0,1,0,0,0,1|1,0,1]=4 6462 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCC#Cc2ccccc2 1626a_100000735379_100000718793 [0,1,0,0,0,1|1,0,1]=4 6463 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCC#Cc2ccccc2 240690a_100000735379_100000718793 [0,1,0,0,0,1|1,0,1]=4 6464 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2ccccc2 11a_100000211184_100000718793 [0,1,0,0,0,1|1,0,0]=3 6465 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2ccccc2 1626a_100000211184_100000718793 [0,1,0,0,0,1|1,0,0]=3 6466 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2ccccc2 240690a_100000211184_100000718793 [0,1,0,0,0,1|1,0,0]=3 6467 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2ccccn2 11a_100000689020_100000718793 [0,1,0,0,0,1|2,0,0]=4 6468 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2ccccn2 1626a_100000689020_100000718793 [0,1,0,0,0,1|2,0,0]=4 6469 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2ccccn2 240690a_100000689020_100000718793 [0,1,0,0,0,1|2,0,0]=4 6470 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2cccnc2 11a_100011532358_100000718793 [0,1,0,0,0,1|2,0,0]=4 6471 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2cccnc2 240690a_100011532358_100000718793 [0,1,0,0,0,1|2,0,0]=4 6472 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2ccncc2 1626a_100011275580_100000718793 [0,1,0,0,0,1|2,0,0]=4 6473 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCCc2ccncc2 240690a_100011275580_100000718793 [0,1,0,0,0,1|2,0,0]=4 6474 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2ccccc2 11a_100000174943_100000718793 [0,1,0,0,0,1|1,0,0]=3 6475 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2ccccc2 1626a_100000174943_100000718793 [0,1,0,0,0,1|1,0,0]=3 6476 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2ccccc2 240690a_100000174943_100000718793 [0,1,0,0,0,1|1,0,0]=3 6477 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2ccccn2 11a_106741647558_100000718793 [0,1,0,0,0,1|2,0,0]=4 6478 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2ccccn2 1626a_106741647558_100000718793 [0,1,0,0,0,1|2,0,0]=4 6479 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2ccccn2 240690a_106741647558_100000718793 [0,1,0,0,0,1|2,0,0]=4 6480 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2cccnc2 11a_100000754688_100000718793 [0,1,0,0,0,1|2,0,0]=4 6481 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2cccnc2 240690a_100000754688_100000718793 [0,1,0,0,0,1|2,0,0]=4 6482 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2ccncc2 11a_100025717301_100000718793 [0,1,0,0,0,1|2,0,0]=4 6483 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCOc2ccncc2 240690a_100025717301_100000718793 [0,1,0,0,0,1|2,0,0]=4 6484 B22R2.304425 O=C(C=Cc1cccc(c1)F)NCCSc2ccccc2 240690a_100000189519_100000718793 [0,1,0,0,0,1|1,0,0]=3 6485 B22R2.304425 O=C(C=Cc1cccc(c1)F)NNCCc2ccccc2 22a_100000740470_100000718793 [0,1,0,0,0,1|1,0,0]=3 6486 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCCCc2ccccc2 1458a_100020647043_100000701786 [0,1,0,0,0,1|1,0,0]=3 6487 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCCCc2ccccc2 6a_100000014684_200011485782 [0,1,0,0,0,1|1,0,0]=3 6488 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCCCc2cccnc2 6a_100000014684_100012242803 [0,1,0,0,0,1|2,0,0]=4 6489 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCCCc2ccncc2 1458a_100020647043_100020630000 [0,1,0,0,0,1|2,0,0]=4 6490 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCCOc2ccccc2 1458a_100020647043_100000199009 [0,1,0,0,0,1|1,0,0]=3 6491 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCCSc2ccccc2 1458a_100020647043_200011203293 [0,1,0,0,0,1|1,0,0]=3 6492 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCOCc2ccccc2 1458a_100020647043_100000234347 [0,1,0,0,0,1|1,0,0]=3 6493 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCOCc2ccccc2 6a_100000014684_100011219826 [0,1,0,0,0,1|1,0,0]=3 6494 B22R2.304425 O=C(C=Cc1cccc(c1)I)CCSCc2ccccc2 1458a_100020647043_200011297719 [0,1,0,0,0,1|1,0,0]=3 6495 B22R2.304425 O=C(C=Cc1cccc(c1)I)NC/C=C/c2ccccc2 11a_100020603302_100020647043 [0,1,0,0,0,1|1,0,1]=4 6496 B22R2.304425 O=C(C=Cc1cccc(c1)I)NC/C=C/c2ccccc2 1626a_100020603302_100020647043 [0,1,0,0,0,1|1,0,1]=4 6497 B22R2.304425 O=C(C=Cc1cccc(c1)I)NC/C=C/c2ccccc2 240690a_100020603302_100020647043 [0,1,0,0,0,1|1,0,1]=4 6498 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCC#Cc2ccccc2 11a_100000735379_100020647043 [0,1,0,0,0,1|1,0,1]=4 6499 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCC#Cc2ccccc2 1626a_100000735379_100020647043 [0,1,0,0,0,1|1,0,1]=4 6500 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCC#Cc2ccccc2 240690a_100000735379_100020647043 [0,1,0,0,0,1|1,0,1]=4 6501 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2ccccc2 11a_100000211184_100020647043 [0,1,0,0,0,1|1,0,0]=3 6502 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2ccccc2 1626a_100000211184_100020647043 [0,1,0,0,0,1|1,0,0]=3 6503 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2ccccc2 240690a_100000211184_100020647043 [0,1,0,0,0,1|1,0,0]=3 6504 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2ccccn2 11a_100000689020_100020647043 [0,1,0,0,0,1|2,0,0]=4 6505 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2ccccn2 1626a_100000689020_100020647043 [0,1,0,0,0,1|2,0,0]=4 6506 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2ccccn2 240690a_100000689020_100020647043 [0,1,0,0,0,1|2,0,0]=4 6507 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2cccnc2 11a_100011532358_100020647043 [0,1,0,0,0,1|2,0,0]=4 6508 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2cccnc2 240690a_100011532358_100020647043 [0,1,0,0,0,1|2,0,0]=4 6509 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2ccncc2 1626a_100011275580_100020647043 [0,1,0,0,0,1|2,0,0]=4 6510 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCCc2ccncc2 240690a_100011275580_100020647043 [0,1,0,0,0,1|2,0,0]=4 6511 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2ccccc2 11a_100000174943_100020647043 [0,1,0,0,0,1|1,0,0]=3 6512 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2ccccc2 1626a_100000174943_100020647043 [0,1,0,0,0,1|1,0,0]=3 6513 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2ccccc2 240690a_100000174943_100020647043 [0,1,0,0,0,1|1,0,0]=3 6514 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2ccccn2 11a_106741647558_100020647043 [0,1,0,0,0,1|2,0,0]=4 6515 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2ccccn2 1626a_106741647558_100020647043 [0,1,0,0,0,1|2,0,0]=4 6516 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2ccccn2 240690a_106741647558_100020647043 [0,1,0,0,0,1|2,0,0]=4 6517 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2cccnc2 11a_100000754688_100020647043 [0,1,0,0,0,1|2,0,0]=4 6518 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2cccnc2 240690a_100000754688_100020647043 [0,1,0,0,0,1|2,0,0]=4 6519 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2ccncc2 11a_100025717301_100020647043 [0,1,0,0,0,1|2,0,0]=4 6520 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCOc2ccncc2 240690a_100025717301_100020647043 [0,1,0,0,0,1|2,0,0]=4 6521 B22R2.304425 O=C(C=Cc1cccc(c1)I)NCCSc2ccccc2 240690a_100000189519_100020647043 [0,1,0,0,0,1|1,0,0]=3 6522 B22R2.304425 O=C(C=Cc1cccc(c1)I)NNCCc2ccccc2 22a_100000740470_100020647043 [0,1,0,0,0,1|1,0,0]=3 6523 B22R2.304425 O=C(C=Cc1cccc(c1)O)NNCCc2ccccc2 22a_100000740470_100102525460 [0,1,0,0,0,1|1,0,0]=3 6524 B22R2.304425 O=C(C=Cc1cncc(c1)Br)CCCCc2ccccc2 6a_100000687066_200011485782 [0,1,0,0,0,1|2,0,0]=4 6525 B22R2.304425 O=C(C=Cc1cncc(c1)Br)CCOCc2ccccc2 6a_100000687066_100011219826 [0,1,0,0,0,1|2,0,0]=4 6526 B22R2.304425 O=C(C=Cc1cncc(c1)Cl)CCCCc2ccccc2 6a_100000088910_200011485782 [0,1,0,0,0,1|2,0,0]=4 6527 B22R2.304425 O=C(C=Cc1cncc(c1)Cl)CCOCc2ccccc2 6a_100000088910_100011219826 [0,1,0,0,0,1|2,0,0]=4 6528 B22R2.304425 O=C(C=Cc1cncc(c1)F)CCCCc2ccccc2 6a_100011361476_200011485782 [0,1,0,0,0,1|2,0,0]=4 6529 B22R2.304425 O=C(C=Cc1cncc(c1)F)CCOCc2ccccc2 6a_100011361476_100011219826 [0,1,0,0,0,1|2,0,0]=4 6530 B22R2.304425 O=C(COCCc1ccccc1)NCc2cccc(c2)Br 34a_100000210268_100011263252 [0,1,0,0,0,1|1,0,1]=4 6531 B22R2.304425 O=C(COCCc1ccccc1)NCc2cccc(c2)Br 7a_100000210268_100011263252 [0,1,0,0,0,1|1,0,1]=4 6532 B22R2.304425 O=C(COCCc1ccccc1)NCc2cccc(c2)Cl 34a_100000210268_100000181154 [0,1,0,0,0,1|1,0,1]=4 6533 B22R2.304425 O=C(COCCc1ccccc1)NCc2cccc(c2)Cl 7a_100000210268_100000181154 [0,1,0,0,0,1|1,0,1]=4 6534 B22R2.304425 O=C(COCCc1ccccc1)NCc2cccc(c2)F 34a_100000210268_100000738998 [0,1,0,0,0,1|1,0,1]=4 6535 B22R2.304425 O=C(COCCc1ccccc1)NCc2cccc(c2)F 7a_100000210268_100000738998 [0,1,0,0,0,1|1,0,1]=4 6536 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)CCCCc2ccccc2 1458a_100016990649_100000701786 [0,1,0,0,0,1|1,0,0]=3 6537 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)CCCCc2ccncc2 1458a_100016990649_100020630000 [0,1,0,0,0,1|2,0,0]=4 6538 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)CCCOc2ccccc2 1458a_100016990649_100000199009 [0,1,0,0,0,1|1,0,0]=3 6539 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)CCCSc2ccccc2 1458a_100016990649_200011203293 [0,1,0,0,0,1|1,0,0]=3 6540 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)CCOCc2ccccc2 1458a_100016990649_100000234347 [0,1,0,0,0,1|1,0,0]=3 6541 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)CCSCc2ccccc2 1458a_100016990649_200011297719 [0,1,0,0,0,1|1,0,0]=3 6542 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NC/C=C/c2ccccc2 11a_100020603302_100016990649 [0,1,0,0,0,1|1,0,1]=4 6543 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NC/C=C/c2ccccc2 1626a_100020603302_100016990649 [0,1,0,0,0,1|1,0,1]=4 6544 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NC/C=C/c2ccccc2 527a_100020603302_100016990649 [0,1,0,0,0,1|1,0,1]=4 6545 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCC#Cc2ccccc2 11a_100000735379_100016990649 [0,1,0,0,0,1|1,0,1]=4 6546 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCC#Cc2ccccc2 1626a_100000735379_100016990649 [0,1,0,0,0,1|1,0,1]=4 6547 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCC#Cc2ccccc2 527a_100000735379_100016990649 [0,1,0,0,0,1|1,0,1]=4 6548 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2ccccc2 11a_100000211184_100016990649 [0,1,0,0,0,1|1,0,0]=3 6549 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2ccccc2 1626a_100000211184_100016990649 [0,1,0,0,0,1|1,0,0]=3 6550 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2ccccc2 527a_100000211184_100016990649 [0,1,0,0,0,1|1,0,0]=3 6551 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2ccccn2 11a_100000689020_100016990649 [0,1,0,0,0,1|2,0,0]=4 6552 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2ccccn2 1626a_100000689020_100016990649 [0,1,0,0,0,1|2,0,0]=4 6553 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2ccccn2 527a_100000689020_100016990649 [0,1,0,0,0,1|2,0,0]=4 6554 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2cccnc2 11a_100011532358_100016990649 [0,1,0,0,0,1|2,0,0]=4 6555 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2ccncc2 1626a_100011275580_100016990649 [0,1,0,0,0,1|2,0,0]=4 6556 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCCc2ccncc2 527a_100011275580_100016990649 [0,1,0,0,0,1|2,0,0]=4 6557 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2ccccc2 11a_100000174943_100016990649 [0,1,0,0,0,1|1,0,0]=3 6558 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2ccccc2 1626a_100000174943_100016990649 [0,1,0,0,0,1|1,0,0]=3 6559 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2ccccc2 527a_100000174943_100016990649 [0,1,0,0,0,1|1,0,0]=3 6560 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2ccccn2 11a_106741647558_100016990649 [0,1,0,0,0,1|2,0,0]=4 6561 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2ccccn2 1626a_106741647558_100016990649 [0,1,0,0,0,1|2,0,0]=4 6562 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2ccccn2 527a_106741647558_100016990649 [0,1,0,0,0,1|2,0,0]=4 6563 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2cccnc2 11a_100000754688_100016990649 [0,1,0,0,0,1|2,0,0]=4 6564 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2cccnc2 527a_100000754688_100016990649 [0,1,0,0,0,1|2,0,0]=4 6565 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2ccncc2 11a_100025717301_100016990649 [0,1,0,0,0,1|2,0,0]=4 6566 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCOc2ccncc2 527a_100025717301_100016990649 [0,1,0,0,0,1|2,0,0]=4 6567 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NCCSc2ccccc2 527a_100000189519_100016990649 [0,1,0,0,0,1|1,0,0]=3 6568 B22R2.359951 C/C(=C\c1ccccc1)/C(=O)NNCCc2ccccc2 22a_100000740470_100016990649 [0,1,0,0,0,1|1,0,0]=3 6569 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)CCCCc2ccccc2 1458a_100025712827_100000701786 [0,1,0,0,0,1|2,0,0]=4 6570 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)CCCOc2ccccc2 1458a_100025712827_100000199009 [0,1,0,0,0,1|2,0,0]=4 6571 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)CCCSc2ccccc2 1458a_100025712827_200011203293 [0,1,0,0,0,1|2,0,0]=4 6572 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)CCOCc2ccccc2 1458a_100025712827_100000234347 [0,1,0,0,0,1|2,0,0]=4 6573 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)CCSCc2ccccc2 1458a_100025712827_200011297719 [0,1,0,0,0,1|2,0,0]=4 6574 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)NCCCc2ccccc2 11a_100000211184_100025712827 [0,1,0,0,0,1|2,0,0]=4 6575 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)NCCCc2ccccc2 1626a_100000211184_100025712827 [0,1,0,0,0,1|2,0,0]=4 6576 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)NCCCc2ccccc2 527a_100000211184_100025712827 [0,1,0,0,0,1|2,0,0]=4 6577 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)NCCOc2ccccc2 11a_100000174943_100025712827 [0,1,0,0,0,1|2,0,0]=4 6578 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)NCCOc2ccccc2 1626a_100000174943_100025712827 [0,1,0,0,0,1|2,0,0]=4 6579 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)NCCOc2ccccc2 527a_100000174943_100025712827 [0,1,0,0,0,1|2,0,0]=4 6580 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)NCCSc2ccccc2 527a_100000189519_100025712827 [0,1,0,0,0,1|2,0,0]=4 6581 B22R2.359951 C/C(=C\c1ccccn1)/C(=O)NNCCc2ccccc2 22a_100000740470_100025712827 [0,1,0,0,0,1|2,0,0]=4 6582 B22R2.359951 C=C(Cc1ccccc1)C(=O)NCCCc2ccccc2 11a_100000211184_100000066491 [0,1,0,0,0,1|1,0,1]=4 6583 B22R2.359951 C=C(Cc1ccccc1)C(=O)NCCCc2ccccc2 1626a_100000211184_100000066491 [0,1,0,0,0,1|1,0,1]=4 6584 B22R2.359951 C=C(Cc1ccccc1)C(=O)NCCOc2ccccc2 11a_100000174943_100000066491 [0,1,0,0,0,1|1,0,1]=4 6585 B22R2.359951 C=C(Cc1ccccc1)C(=O)NCCOc2ccccc2 1626a_100000174943_100000066491 [0,1,0,0,0,1|1,0,1]=4 6586 B22R2.359951 C=C(Cc1ccccc1)C(=O)NNCCc2ccccc2 22a_100000740470_100000066491 [0,1,0,0,0,1|1,0,1]=4 6587 B22R2.359951 CN(Cc1ccccc1)C(=O)COCCc2ccccc2 34a_100000210268_100000182870 [0,1,0,0,0,1|1,0,1]=4 6588 B22R2.359951 CN(Cc1ccccc1)C(=O)COCCc2ccccc2 7a_100000210268_100000182870 [0,1,0,0,0,1|1,0,1]=4 6589 B22R2.359951 O=C(CCCCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000701786 [0,1,0,0,0,1|1,0,0]=3 6590 B22R2.359951 O=C(CCCCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000701786 [0,1,0,0,0,1|1,0,0]=3 6591 B22R2.359951 O=C(CCCCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000701786 [0,1,0,0,0,1|2,0,0]=4 6592 B22R2.359951 O=C(CCCCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000701786 [0,1,0,0,0,1|2,0,0]=4 6593 B22R2.359951 O=C(CCCCc1ccncc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100020630000 [0,1,0,0,0,1|2,0,0]=4 6594 B22R2.359951 O=C(CCCCc1ccncc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100020630000 [0,1,0,0,0,1|2,0,0]=4 6595 B22R2.359951 O=C(CCCOc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000199009 [0,1,0,0,0,1|1,0,0]=3 6596 B22R2.359951 O=C(CCCOc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000199009 [0,1,0,0,0,1|1,0,0]=3 6597 B22R2.359951 O=C(CCCOc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000199009 [0,1,0,0,0,1|2,0,0]=4 6598 B22R2.359951 O=C(CCCOc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000199009 [0,1,0,0,0,1|2,0,0]=4 6599 B22R2.359951 O=C(CCCSc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200011203293 [0,1,0,0,0,1|1,0,0]=3 6600 B22R2.359951 O=C(CCCSc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_200011203293 [0,1,0,0,0,1|1,0,0]=3 6601 B22R2.359951 O=C(CCCSc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_200011203293 [0,1,0,0,0,1|2,0,0]=4 6602 B22R2.359951 O=C(CCCSc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_200011203293 [0,1,0,0,0,1|2,0,0]=4 6603 B22R2.359951 O=C(CCOCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000234347 [0,1,0,0,0,1|1,0,0]=3 6604 B22R2.359951 O=C(CCOCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000234347 [0,1,0,0,0,1|1,0,0]=3 6605 B22R2.359951 O=C(CCOCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000234347 [0,1,0,0,0,1|2,0,0]=4 6606 B22R2.359951 O=C(CCOCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000234347 [0,1,0,0,0,1|2,0,0]=4 6607 B22R2.359951 O=C(CCSCc1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200011297719 [0,1,0,0,0,1|1,0,0]=3 6608 B22R2.359951 O=C(CCSCc1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_200011297719 [0,1,0,0,0,1|1,0,0]=3 6609 B22R2.359951 O=C(CCSCc1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_200011297719 [0,1,0,0,0,1|2,0,0]=4 6610 B22R2.359951 O=C(CCSCc1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_200011297719 [0,1,0,0,0,1|2,0,0]=4 6611 B22R2.359951 O=C(NC/C=C/c1ccccc1)/C(=C/c2ccccc2)/Cl 11a_100020603302_200020598536 [0,1,0,0,0,1|1,0,1]=4 6612 B22R2.359951 O=C(NC/C=C/c1ccccc1)/C(=C/c2ccccc2)/Cl 1626a_100020603302_200020598536 [0,1,0,0,0,1|1,0,1]=4 6613 B22R2.359951 O=C(NC/C=C/c1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100020603302_200020598536 [0,1,0,0,0,1|1,0,1]=4 6614 B22R2.359951 O=C(NC/C=C/c1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100020603302_200020598536 [0,1,0,0,0,1|1,0,1]=4 6615 B22R2.359951 O=C(NC/C=C/c1ccccc1)/C(=C\c2ccccc2)/F 11a_100020603302_100020889036 [0,1,0,0,0,1|1,0,1]=4 6616 B22R2.359951 O=C(NC/C=C/c1ccccc1)/C(=C\c2ccccc2)/F 527a_100020603302_100020889036 [0,1,0,0,0,1|1,0,1]=4 6617 B22R2.359951 O=C(NCC#Cc1ccccc1)/C(=C/c2ccccc2)/Cl 11a_100000735379_200020598536 [0,1,0,0,0,1|1,0,1]=4 6618 B22R2.359951 O=C(NCC#Cc1ccccc1)/C(=C/c2ccccc2)/Cl 1626a_100000735379_200020598536 [0,1,0,0,0,1|1,0,1]=4 6619 B22R2.359951 O=C(NCC#Cc1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100000735379_200020598536 [0,1,0,0,0,1|1,0,1]=4 6620 B22R2.359951 O=C(NCC#Cc1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100000735379_200020598536 [0,1,0,0,0,1|1,0,1]=4 6621 B22R2.359951 O=C(NCC#Cc1ccccc1)/C(=C\c2ccccc2)/F 11a_100000735379_100020889036 [0,1,0,0,0,1|1,0,1]=4 6622 B22R2.359951 O=C(NCC#Cc1ccccc1)/C(=C\c2ccccc2)/F 527a_100000735379_100020889036 [0,1,0,0,0,1|1,0,1]=4 6623 B22R2.359951 O=C(NCCCc1ccccc1)/C(=C/c2ccccc2)/Cl 11a_100000211184_200020598536 [0,1,0,0,0,1|1,0,0]=3 6624 B22R2.359951 O=C(NCCCc1ccccc1)/C(=C/c2ccccc2)/Cl 1626a_100000211184_200020598536 [0,1,0,0,0,1|1,0,0]=3 6625 B22R2.359951 O=C(NCCCc1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100000211184_200020598536 [0,1,0,0,0,1|1,0,0]=3 6626 B22R2.359951 O=C(NCCCc1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100000211184_200020598536 [0,1,0,0,0,1|1,0,0]=3 6627 B22R2.359951 O=C(NCCCc1ccccc1)/C(=C\c2ccccc2)/F 11a_100000211184_100020889036 [0,1,0,0,0,1|1,0,0]=3 6628 B22R2.359951 O=C(NCCCc1ccccc1)/C(=C\c2ccccc2)/F 527a_100000211184_100020889036 [0,1,0,0,0,1|1,0,0]=3 6629 B22R2.359951 O=C(NCCCc1ccccc1)C(=Cc2cccnc2)F 11a_100000211184_100000731744 [0,1,0,0,0,1|2,0,0]=4 6630 B22R2.359951 O=C(NCCCc1ccccc1)C(=Cc2cccnc2)F 240690a_100000211184_100000731744 [0,1,0,0,0,1|2,0,0]=4 6631 B22R2.359951 O=C(NCCCc1ccccc1)C(=Cc2cccnc2)F 527a_100000211184_100000731744 [0,1,0,0,0,1|2,0,0]=4 6632 B22R2.359951 O=C(NCCCc1ccccc1)C(=O)Nc2ccccc2 240690a_100000211184_100000738435 [0,1,0,0,0,1|2,0,0]=4 6633 B22R2.359951 O=C(NCCCc1ccccn1)/C(=C/c2ccccc2)/Cl 11a_100000689020_200020598536 [0,1,0,0,0,1|2,0,0]=4 6634 B22R2.359951 O=C(NCCCc1ccccn1)/C(=C/c2ccccc2)/Cl 1626a_100000689020_200020598536 [0,1,0,0,0,1|2,0,0]=4 6635 B22R2.359951 O=C(NCCCc1ccccn1)/C(=C/c2ccccc2)/Cl 240690a_100000689020_200020598536 [0,1,0,0,0,1|2,0,0]=4 6636 B22R2.359951 O=C(NCCCc1ccccn1)/C(=C/c2ccccc2)/Cl 527a_100000689020_200020598536 [0,1,0,0,0,1|2,0,0]=4 6637 B22R2.359951 O=C(NCCCc1ccccn1)/C(=C\c2ccccc2)/F 11a_100000689020_100020889036 [0,1,0,0,0,1|2,0,0]=4 6638 B22R2.359951 O=C(NCCCc1ccccn1)/C(=C\c2ccccc2)/F 527a_100000689020_100020889036 [0,1,0,0,0,1|2,0,0]=4 6639 B22R2.359951 O=C(NCCCc1cccnc1)/C(=C/c2ccccc2)/Cl 11a_100011532358_200020598536 [0,1,0,0,0,1|2,0,0]=4 6640 B22R2.359951 O=C(NCCCc1cccnc1)/C(=C/c2ccccc2)/Cl 240690a_100011532358_200020598536 [0,1,0,0,0,1|2,0,0]=4 6641 B22R2.359951 O=C(NCCCc1cccnc1)/C(=C\c2ccccc2)/F 11a_100011532358_100020889036 [0,1,0,0,0,1|2,0,0]=4 6642 B22R2.359951 O=C(NCCCc1ccncc1)/C(=C/c2ccccc2)/Cl 1626a_100011275580_200020598536 [0,1,0,0,0,1|2,0,0]=4 6643 B22R2.359951 O=C(NCCCc1ccncc1)/C(=C/c2ccccc2)/Cl 240690a_100011275580_200020598536 [0,1,0,0,0,1|2,0,0]=4 6644 B22R2.359951 O=C(NCCCc1ccncc1)/C(=C/c2ccccc2)/Cl 527a_100011275580_200020598536 [0,1,0,0,0,1|2,0,0]=4 6645 B22R2.359951 O=C(NCCCc1ccncc1)/C(=C\c2ccccc2)/F 527a_100011275580_100020889036 [0,1,0,0,0,1|2,0,0]=4 6646 B22R2.359951 O=C(NCCOc1ccccc1)/C(=C/c2ccccc2)/Cl 11a_100000174943_200020598536 [0,1,0,0,0,1|1,0,0]=3 6647 B22R2.359951 O=C(NCCOc1ccccc1)/C(=C/c2ccccc2)/Cl 1626a_100000174943_200020598536 [0,1,0,0,0,1|1,0,0]=3 6648 B22R2.359951 O=C(NCCOc1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100000174943_200020598536 [0,1,0,0,0,1|1,0,0]=3 6649 B22R2.359951 O=C(NCCOc1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100000174943_200020598536 [0,1,0,0,0,1|1,0,0]=3 6650 B22R2.359951 O=C(NCCOc1ccccc1)/C(=C\c2ccccc2)/F 11a_100000174943_100020889036 [0,1,0,0,0,1|1,0,0]=3 6651 B22R2.359951 O=C(NCCOc1ccccc1)/C(=C\c2ccccc2)/F 527a_100000174943_100020889036 [0,1,0,0,0,1|1,0,0]=3 6652 B22R2.359951 O=C(NCCOc1ccccc1)C(=Cc2cccnc2)F 11a_100000174943_100000731744 [0,1,0,0,0,1|2,0,0]=4 6653 B22R2.359951 O=C(NCCOc1ccccc1)C(=Cc2cccnc2)F 240690a_100000174943_100000731744 [0,1,0,0,0,1|2,0,0]=4 6654 B22R2.359951 O=C(NCCOc1ccccc1)C(=Cc2cccnc2)F 527a_100000174943_100000731744 [0,1,0,0,0,1|2,0,0]=4 6655 B22R2.359951 O=C(NCCOc1ccccc1)C(=O)Nc2ccccc2 240690a_100000174943_100000738435 [0,1,0,0,0,1|2,0,0]=4 6656 B22R2.359951 O=C(NCCOc1ccccn1)/C(=C/c2ccccc2)/Cl 11a_106741647558_200020598536 [0,1,0,0,0,1|2,0,0]=4 6657 B22R2.359951 O=C(NCCOc1ccccn1)/C(=C/c2ccccc2)/Cl 1626a_106741647558_200020598536 [0,1,0,0,0,1|2,0,0]=4 6658 B22R2.359951 O=C(NCCOc1ccccn1)/C(=C/c2ccccc2)/Cl 240690a_106741647558_200020598536 [0,1,0,0,0,1|2,0,0]=4 6659 B22R2.359951 O=C(NCCOc1ccccn1)/C(=C/c2ccccc2)/Cl 527a_106741647558_200020598536 [0,1,0,0,0,1|2,0,0]=4 6660 B22R2.359951 O=C(NCCOc1ccccn1)/C(=C\c2ccccc2)/F 11a_106741647558_100020889036 [0,1,0,0,0,1|2,0,0]=4 6661 B22R2.359951 O=C(NCCOc1ccccn1)/C(=C\c2ccccc2)/F 527a_106741647558_100020889036 [0,1,0,0,0,1|2,0,0]=4 6662 B22R2.359951 O=C(NCCOc1cccnc1)/C(=C/c2ccccc2)/Cl 11a_100000754688_200020598536 [0,1,0,0,0,1|2,0,0]=4 6663 B22R2.359951 O=C(NCCOc1cccnc1)/C(=C/c2ccccc2)/Cl 240690a_100000754688_200020598536 [0,1,0,0,0,1|2,0,0]=4 6664 B22R2.359951 O=C(NCCOc1cccnc1)/C(=C/c2ccccc2)/Cl 527a_100000754688_200020598536 [0,1,0,0,0,1|2,0,0]=4 6665 B22R2.359951 O=C(NCCOc1cccnc1)/C(=C\c2ccccc2)/F 11a_100000754688_100020889036 [0,1,0,0,0,1|2,0,0]=4 6666 B22R2.359951 O=C(NCCOc1cccnc1)/C(=C\c2ccccc2)/F 527a_100000754688_100020889036 [0,1,0,0,0,1|2,0,0]=4 6667 B22R2.359951 O=C(NCCOc1ccncc1)/C(=C/c2ccccc2)/Cl 11a_100025717301_200020598536 [0,1,0,0,0,1|2,0,0]=4 6668 B22R2.359951 O=C(NCCOc1ccncc1)/C(=C/c2ccccc2)/Cl 240690a_100025717301_200020598536 [0,1,0,0,0,1|2,0,0]=4 6669 B22R2.359951 O=C(NCCOc1ccncc1)/C(=C/c2ccccc2)/Cl 527a_100025717301_200020598536 [0,1,0,0,0,1|2,0,0]=4 6670 B22R2.359951 O=C(NCCOc1ccncc1)/C(=C\c2ccccc2)/F 11a_100025717301_100020889036 [0,1,0,0,0,1|2,0,0]=4 6671 B22R2.359951 O=C(NCCOc1ccncc1)/C(=C\c2ccccc2)/F 527a_100025717301_100020889036 [0,1,0,0,0,1|2,0,0]=4 6672 B22R2.359951 O=C(NCCSc1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100000189519_200020598536 [0,1,0,0,0,1|1,0,0]=3 6673 B22R2.359951 O=C(NCCSc1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100000189519_200020598536 [0,1,0,0,0,1|1,0,0]=3 6674 B22R2.359951 O=C(NCCSc1ccccc1)/C(=C\c2ccccc2)/F 527a_100000189519_100020889036 [0,1,0,0,0,1|1,0,0]=3 6675 B22R2.359951 O=C(NCCSc1ccccc1)C(=Cc2cccnc2)F 240690a_100000189519_100000731744 [0,1,0,0,0,1|2,0,0]=4 6676 B22R2.359951 O=C(NCCSc1ccccc1)C(=Cc2cccnc2)F 527a_100000189519_100000731744 [0,1,0,0,0,1|2,0,0]=4 6677 B22R2.359951 O=C(NCCSc1ccccc1)C(=O)Nc2ccccc2 240690a_100000189519_100000738435 [0,1,0,0,0,1|2,0,0]=4 6678 B22R2.359951 O=C(NNCCc1ccccc1)/C(=C/c2ccccc2)/Cl 22a_100000740470_200020598536 [0,1,0,0,0,1|1,0,0]=3 6679 B22R2.359951 O=C(NNCCc1ccccc1)/C(=C\c2ccccc2)/F 22a_100000740470_100020889036 [0,1,0,0,0,1|1,0,0]=3 6680 B22R2.359951 O=C(NNCCc1ccccc1)C(=Cc2cccnc2)F 22a_100000740470_100000731744 [0,1,0,0,0,1|2,0,0]=4 6681 B22R2.359951 O=C(NNCCc1ccccc1)C(=O)Nc2ccccc2 22a_100000740470_100000738435 [0,1,0,0,0,1|2,0,0]=4 6682 B22R2.359957 CC(=CC(=O)CCCCc1ccccc1)c2ccccc2 1458a_100000743005_100000701786 [0,1,0,0,0,1|1,0,0]=3 6683 B22R2.359957 CC(=CC(=O)CCCCc1ccncc1)c2ccccc2 1458a_100000743005_100020630000 [0,1,0,0,0,1|2,0,0]=4 6684 B22R2.359957 CC(=CC(=O)CCCOc1ccccc1)c2ccccc2 1458a_100000743005_100000199009 [0,1,0,0,0,1|1,0,0]=3 6685 B22R2.359957 CC(=CC(=O)CCCSc1ccccc1)c2ccccc2 1458a_100000743005_200011203293 [0,1,0,0,0,1|1,0,0]=3 6686 B22R2.359957 CC(=CC(=O)CCOCc1ccccc1)c2ccccc2 1458a_100000743005_100000234347 [0,1,0,0,0,1|1,0,0]=3 6687 B22R2.359957 CC(=CC(=O)CCSCc1ccccc1)c2ccccc2 1458a_100000743005_200011297719 [0,1,0,0,0,1|1,0,0]=3 6688 B22R2.359957 CC(=CC(=O)NC/C=C/c1ccccc1)c2ccccc2 11a_100020603302_100000743005 [0,1,0,0,0,1|1,0,1]=4 6689 B22R2.359957 CC(=CC(=O)NC/C=C/c1ccccc1)c2ccccc2 1626a_100020603302_100000743005 [0,1,0,0,0,1|1,0,1]=4 6690 B22R2.359957 CC(=CC(=O)NC/C=C/c1ccccc1)c2ccccc2 240690a_100020603302_100000743005 [0,1,0,0,0,1|1,0,1]=4 6691 B22R2.359957 CC(=CC(=O)NC/C=C/c1ccccc1)c2ccccc2 527a_100020603302_100000743005 [0,1,0,0,0,1|1,0,1]=4 6692 B22R2.359957 CC(=CC(=O)NCC#Cc1ccccc1)c2ccccc2 11a_100000735379_100000743005 [0,1,0,0,0,1|1,0,1]=4 6693 B22R2.359957 CC(=CC(=O)NCC#Cc1ccccc1)c2ccccc2 1626a_100000735379_100000743005 [0,1,0,0,0,1|1,0,1]=4 6694 B22R2.359957 CC(=CC(=O)NCC#Cc1ccccc1)c2ccccc2 240690a_100000735379_100000743005 [0,1,0,0,0,1|1,0,1]=4 6695 B22R2.359957 CC(=CC(=O)NCC#Cc1ccccc1)c2ccccc2 527a_100000735379_100000743005 [0,1,0,0,0,1|1,0,1]=4 6696 B22R2.359957 CC(=CC(=O)NCCCc1ccccc1)c2ccccc2 11a_100000211184_100000743005 [0,1,0,0,0,1|1,0,0]=3 6697 B22R2.359957 CC(=CC(=O)NCCCc1ccccc1)c2ccccc2 1626a_100000211184_100000743005 [0,1,0,0,0,1|1,0,0]=3 6698 B22R2.359957 CC(=CC(=O)NCCCc1ccccc1)c2ccccc2 240690a_100000211184_100000743005 [0,1,0,0,0,1|1,0,0]=3 6699 B22R2.359957 CC(=CC(=O)NCCCc1ccccc1)c2ccccc2 527a_100000211184_100000743005 [0,1,0,0,0,1|1,0,0]=3 6700 B22R2.359957 CC(=CC(=O)NCCCc1ccccn1)c2ccccc2 11a_100000689020_100000743005 [0,1,0,0,0,1|2,0,0]=4 6701 B22R2.359957 CC(=CC(=O)NCCCc1ccccn1)c2ccccc2 1626a_100000689020_100000743005 [0,1,0,0,0,1|2,0,0]=4 6702 B22R2.359957 CC(=CC(=O)NCCCc1ccccn1)c2ccccc2 240690a_100000689020_100000743005 [0,1,0,0,0,1|2,0,0]=4 6703 B22R2.359957 CC(=CC(=O)NCCCc1ccccn1)c2ccccc2 527a_100000689020_100000743005 [0,1,0,0,0,1|2,0,0]=4 6704 B22R2.359957 CC(=CC(=O)NCCCc1cccnc1)c2ccccc2 11a_100011532358_100000743005 [0,1,0,0,0,1|2,0,0]=4 6705 B22R2.359957 CC(=CC(=O)NCCCc1cccnc1)c2ccccc2 240690a_100011532358_100000743005 [0,1,0,0,0,1|2,0,0]=4 6706 B22R2.359957 CC(=CC(=O)NCCCc1ccncc1)c2ccccc2 1626a_100011275580_100000743005 [0,1,0,0,0,1|2,0,0]=4 6707 B22R2.359957 CC(=CC(=O)NCCCc1ccncc1)c2ccccc2 240690a_100011275580_100000743005 [0,1,0,0,0,1|2,0,0]=4 6708 B22R2.359957 CC(=CC(=O)NCCCc1ccncc1)c2ccccc2 527a_100011275580_100000743005 [0,1,0,0,0,1|2,0,0]=4 6709 B22R2.359957 CC(=CC(=O)NCCOc1ccccc1)c2ccccc2 11a_100000174943_100000743005 [0,1,0,0,0,1|1,0,0]=3 6710 B22R2.359957 CC(=CC(=O)NCCOc1ccccc1)c2ccccc2 1626a_100000174943_100000743005 [0,1,0,0,0,1|1,0,0]=3 6711 B22R2.359957 CC(=CC(=O)NCCOc1ccccc1)c2ccccc2 240690a_100000174943_100000743005 [0,1,0,0,0,1|1,0,0]=3 6712 B22R2.359957 CC(=CC(=O)NCCOc1ccccc1)c2ccccc2 527a_100000174943_100000743005 [0,1,0,0,0,1|1,0,0]=3 6713 B22R2.359957 CC(=CC(=O)NCCOc1ccccn1)c2ccccc2 11a_106741647558_100000743005 [0,1,0,0,0,1|2,0,0]=4 6714 B22R2.359957 CC(=CC(=O)NCCOc1ccccn1)c2ccccc2 1626a_106741647558_100000743005 [0,1,0,0,0,1|2,0,0]=4 6715 B22R2.359957 CC(=CC(=O)NCCOc1ccccn1)c2ccccc2 240690a_106741647558_100000743005 [0,1,0,0,0,1|2,0,0]=4 6716 B22R2.359957 CC(=CC(=O)NCCOc1ccccn1)c2ccccc2 527a_106741647558_100000743005 [0,1,0,0,0,1|2,0,0]=4 6717 B22R2.359957 CC(=CC(=O)NCCOc1cccnc1)c2ccccc2 11a_100000754688_100000743005 [0,1,0,0,0,1|2,0,0]=4 6718 B22R2.359957 CC(=CC(=O)NCCOc1cccnc1)c2ccccc2 240690a_100000754688_100000743005 [0,1,0,0,0,1|2,0,0]=4 6719 B22R2.359957 CC(=CC(=O)NCCOc1cccnc1)c2ccccc2 527a_100000754688_100000743005 [0,1,0,0,0,1|2,0,0]=4 6720 B22R2.359957 CC(=CC(=O)NCCOc1ccncc1)c2ccccc2 11a_100025717301_100000743005 [0,1,0,0,0,1|2,0,0]=4 6721 B22R2.359957 CC(=CC(=O)NCCOc1ccncc1)c2ccccc2 240690a_100025717301_100000743005 [0,1,0,0,0,1|2,0,0]=4 6722 B22R2.359957 CC(=CC(=O)NCCOc1ccncc1)c2ccccc2 527a_100025717301_100000743005 [0,1,0,0,0,1|2,0,0]=4 6723 B22R2.359957 CC(=CC(=O)NCCSc1ccccc1)c2ccccc2 240690a_100000189519_100000743005 [0,1,0,0,0,1|1,0,0]=3 6724 B22R2.359957 CC(=CC(=O)NCCSc1ccccc1)c2ccccc2 527a_100000189519_100000743005 [0,1,0,0,0,1|1,0,0]=3 6725 B22R2.359957 CC(=CC(=O)NNCCc1ccccc1)c2ccccc2 22a_100000740470_100000743005 [0,1,0,0,0,1|1,0,0]=3 6726 B22R2.359957 CC(NC(=O)COCCc1ccccc1)c2ccccc2 34a_100000210268_200000243715 [0,1,0,0,0,1|1,0,1]=4 6727 B22R2.359957 CC(NC(=O)COCCc1ccccc1)c2ccccc2 7a_100000210268_200000243715 [0,1,0,0,0,1|1,0,1]=4 6728 B22R2.359957 C[C@H](NC(=O)COCCc1ccccc1)c2ccccc2 34a_100000210268_100011939912 [0,1,0,0,0,1|1,0,1]=4 6729 B22R2.359957 C[C@H](NC(=O)COCCc1ccccc1)c2ccccc2 7a_100000210268_100011939912 [0,1,0,0,0,1|1,0,1]=4 6730 B22R2.359957 O=C(C=CCCc1ccccc1)CC(=O)c2ccccc2 1458a_100016484021_100000211460 [0,1,0,0,0,1|1,0,1]=4 6731 B22R2.359957 O=C(CC(=O)c1ccccc1)NCCCc2ccccc2 1458a_100000185807_100000182878 [0,1,0,0,0,1|1,0,1]=4 6732 B22R2.359957 O=C(CC(=O)c1ccccc1)NCCOc2ccccc2 1458a_100000185807_100000181728 [0,1,0,0,0,1|1,0,1]=4 6733 B22R2.359957 O=C(CCCCc1ccccc1)CC(=O)c2ccccc2 1458a_100011215911_100000211460 [0,1,0,0,0,1|1,0,1]=4 6734 B22R2.359957 O=C(CCCOc1ccccc1)CC(=O)c2ccccc2 1458a_100000212059_100000211460 [0,1,0,0,0,1|1,0,1]=4 6735 B22R2.359957 O=C(CCCSc1ccccc1)CC(=O)c2ccccc2 1458a_100000182835_100000211460 [0,1,0,0,0,1|1,0,1]=4 6736 B22R2.359957 O=C(CCOCc1ccccc1)CC(=O)c2ccccc2 1458a_100000743319_100000211460 [0,1,0,0,0,1|1,0,1]=4 6737 B22R2.359957 O=C(CCSCc1ccccc1)CC(=O)c2ccccc2 1458a_100000173759_100000211460 [0,1,0,0,0,1|1,0,1]=4 6738 B22R2.359957 O=C(COCCc1ccccc1)NC(=O)c2ccccc2 7a_100000210268_100000010347 [0,1,0,0,0,1|1,0,0]=3 6739 B22R2.359957 O=C(CSCCc1ccccc1)NC(=O)c2ccccc2 62a_100000765856_100000010347 [0,1,0,0,0,1|1,1,0]=4 6740 B22R2.360000 CC(CCCc1ccccc1)C(=O)C=Cc2ccccc2 1458a_100000210462_200010759516 [0,1,0,0,0,1|1,0,0]=3 6741 B22R2.360000 CC(CCCc1ccccc1)C(=O)C=Cc2ccccn2 1458a_100000740811_200010759516 [0,1,0,0,0,1|2,0,0]=4 6742 B22R2.360000 CC(CCCc1ccccc1)C(=O)C=Cc2cccnc2 1458a_100000735890_200010759516 [0,1,0,0,0,1|2,0,0]=4 6743 B22R2.360000 CC(CCCc1ccccc1)C(=O)C=Cc2ccncc2 1458a_100000682801_200010759516 [0,1,0,0,0,1|2,0,0]=4 6744 B22R2.360000 CC(OCCc1ccccc1)C(=O)NCc2ccccc2 34a_100000210268_200011934207 [0,1,0,0,0,1|1,0,1]=4 6745 B22R2.360000 CC(OCCc1ccccc1)C(=O)NCc2ccccc2 7a_100000210268_100000183842 [0,1,0,0,0,1|1,0,1]=4 6746 B22R2.360000 CN(CCCc1ccccc1)C(=O)C=Cc2ccccc2 11a_100000693637_100000210462 [0,1,0,0,0,1|1,0,0]=3 6747 B22R2.360000 CN(CCCc1ccccc1)C(=O)C=Cc2ccccc2 1626a_100000693637_100000210462 [0,1,0,0,0,1|1,0,0]=3 6748 B22R2.360000 CN(CCCc1ccccc1)C(=O)C=Cc2ccccn2 11a_100000693637_100000740811 [0,1,0,0,0,1|2,0,0]=4 6749 B22R2.360000 CN(CCCc1ccccc1)C(=O)C=Cc2ccccn2 240690a_100000693637_100000740811 [0,1,0,0,0,1|2,0,0]=4 6750 B22R2.360000 CN(CCCc1ccccc1)C(=O)C=Cc2cccnc2 11a_100000693637_100000735890 [0,1,0,0,0,1|2,0,0]=4 6751 B22R2.360000 CN(CCCc1ccccc1)C(=O)C=Cc2cccnc2 240690a_100000693637_100000735890 [0,1,0,0,0,1|2,0,0]=4 6752 B22R2.360000 CN(CCCc1ccccc1)C(=O)C=Cc2ccncc2 240690a_100000693637_100000682801 [0,1,0,0,0,1|2,0,0]=4 6753 B22R2.360000 CN(CCOc1ccccc1)C(=O)C=Cc2ccccc2 11a_100000184383_100000210462 [0,1,0,0,0,1|1,0,0]=3 6754 B22R2.360000 CN(CCOc1ccccc1)C(=O)C=Cc2ccccc2 1626a_100000184383_100000210462 [0,1,0,0,0,1|1,0,0]=3 6755 B22R2.360000 CN(CCOc1ccccc1)C(=O)C=Cc2ccccn2 11a_100000184383_100000740811 [0,1,0,0,0,1|2,0,0]=4 6756 B22R2.360000 CN(CCOc1ccccc1)C(=O)C=Cc2ccccn2 240690a_100000184383_100000740811 [0,1,0,0,0,1|2,0,0]=4 6757 B22R2.360000 CN(CCOc1ccccc1)C(=O)C=Cc2cccnc2 11a_100000184383_100000735890 [0,1,0,0,0,1|2,0,0]=4 6758 B22R2.360000 CN(CCOc1ccccc1)C(=O)C=Cc2cccnc2 240690a_100000184383_100000735890 [0,1,0,0,0,1|2,0,0]=4 6759 B22R2.360000 CN(CCOc1ccccc1)C(=O)C=Cc2ccncc2 240690a_100000184383_100000682801 [0,1,0,0,0,1|2,0,0]=4 6760 B22R2.360000 C[C@H](OCCc1ccccc1)C(=O)OCc2ccccc2 7a_100016105899_100000765856 [0,1,0,0,0,1|1,0,1]=4 6761 B22R2.360000 O=C(OCc1ccccc1)C(F)OCCc2ccccc2 34a_100000210268_100000036447 [0,1,0,0,0,1|1,0,1]=4 6762 B22R2.360000 O=C(OCc1ccccc1)C(F)OCCc2ccccc2 7a_100000210268_100000036447 [0,1,0,0,0,1|1,0,1]=4 6763 B22R2.360256 CC(COCC(=O)CCc1ccccc1)c2ccccc2 34a_100011215166_100012361361 [0,1,0,0,0,1|0,0,2]=4 6764 B22R2.360256 CC(COCC(=O)CCc1ccccc1)c2ccccc2 7a_100011215166_100012361361 [0,1,0,0,0,1|0,0,2]=4 6765 B22R2.360256 CC(COCC(=O)NCc1ccccc1)c2ccccc2 34a_100011215166_100000183539 [0,1,0,0,0,1|1,0,1]=4 6766 B22R2.360256 CC(COCC(=O)NCc1ccccc1)c2ccccc2 7a_100011215166_100000183539 [0,1,0,0,0,1|1,0,1]=4 6767 B22R2.360256 CC(COCC(=O)OCc1ccccc1)c2ccccc2 34a_100011215166_100000753625 [0,1,0,0,0,1|1,0,1]=4 6768 B22R2.360256 CC(COCC(=O)OCc1ccccc1)c2ccccc2 7a_100011215166_100000753625 [0,1,0,0,0,1|1,0,1]=4 6769 B22R2.360256 CN(CCNC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100000231046_100000740811 [0,1,0,0,0,1|2,0,0]=4 6770 B22R2.360256 CN(CCNC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100000231046_100000735890 [0,1,0,0,0,1|2,0,0]=4 6771 B22R2.360256 CN(CCNC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100000231046_100000682801 [0,1,0,0,0,1|2,0,0]=4 6772 B22R2.360256 N[C@H](COCC(=O)CCc1ccccc1)c2ccccc2 34a_100000751927_100012361361 [0,1,0,0,0,1|0,0,2]=4 6773 B22R2.360256 N[C@H](COCC(=O)NCc1ccccc1)c2ccccc2 34a_100000751927_100000183539 [0,1,0,0,0,1|1,0,1]=4 6774 B22R2.360256 N[C@H](COCC(=O)OCc1ccccc1)c2ccccc2 34a_100000751927_100000753625 [0,1,0,0,0,1|1,0,1]=4 6775 B22R2.360256 O=C(C=Cc1ccccc1)CCCC(=O)c2ccccc2 1458a_100000210462_100000211006 [0,1,0,0,0,1|1,0,0]=3 6776 B22R2.360256 O=C(C=Cc1ccccc1)CCNC(=O)c2ccccc2 1458a_100000210462_200011215302 [0,1,0,0,0,1|1,0,1]=4 6777 B22R2.360256 O=C(C=Cc1ccccc1)CCOC(=O)c2ccccc2 1458a_100000210462_100000184176 [0,1,0,0,0,1|1,0,1]=4 6778 B22R2.360256 O=C(C=Cc1ccccn1)CCCC(=O)c2ccccc2 1458a_100000740811_100000211006 [0,1,0,0,0,1|2,0,0]=4 6779 B22R2.360256 O=C(C=Cc1ccccn1)NCCC(O)c2ccccc2 240690a_100000763605_100000740811 [0,1,0,0,0,1|2,0,0]=4 6780 B22R2.360256 O=C(C=Cc1cccnc1)CCCC(=O)c2ccccc2 1458a_100000735890_100000211006 [0,1,0,0,0,1|2,0,0]=4 6781 B22R2.360256 O=C(C=Cc1cccnc1)NCCC(O)c2ccccc2 240690a_100000763605_100000735890 [0,1,0,0,0,1|2,0,0]=4 6782 B22R2.360256 O=C(C=Cc1ccncc1)CCCC(=O)c2ccccc2 1458a_100000682801_100000211006 [0,1,0,0,0,1|2,0,0]=4 6783 B22R2.360256 O=C(C=Cc1ccncc1)NCCC(O)c2ccccc2 240690a_100000763605_100000682801 [0,1,0,0,0,1|2,0,0]=4 6784 B22R2.4040741 O=S(=O)(C=Cc1ccccc1)NCCCc2ccccc2 40a_100000211184_100011098038 [0,1,0,0,0,1|2,0,0]=4 6785 B22R2.4040741 O=S(=O)(C=Cc1ccccc1)NCCOc2ccccc2 40a_100000174943_100011098038 [0,1,0,0,0,1|2,0,0]=4 6786 B22R2.4040741 O=S(=O)(C=Cc1ccccc1)NCCSc2ccccc2 40a_100000189519_100011098038 [0,1,0,0,0,1|2,0,0]=4 6787 B22R2.4040741 O=S(=O)(C=Cc1ccccc1)NNCCc2ccccc2 40a_100000740470_100011098038 [0,1,0,0,0,1|2,0,0]=4 6788 B22R2.4388 Cc1ccc(cc1)C=NNC(=O)CCCc2ccccc2 4a_100011246310_100000211033 [0,1,0,0,0,1|2,0,0]=4 6789 B22R2.4388 Cc1ccc(cc1)CCCC(=O)C/C=C/c2ccccc2 1458a_100000741418_100016265936 [0,1,0,0,0,1|1,0,0]=3 6790 B22R2.4388 Cc1ccc(cc1)CCNC(=O)C/C=C/c2ccccc2 11a_100000705350_100011219626 [0,1,0,0,0,1|1,0,0]=3 6791 B22R2.4388 Cc1ccc(cc1)CCNC(=O)C/C=C/c2ccccc2 1626a_100000705350_100011219626 [0,1,0,0,0,1|1,0,0]=3 6792 B22R2.4388 Cc1ccc(cc1)CCNC(=O)C/C=C/c2ccccc2 240690a_100000705350_100011219626 [0,1,0,0,0,1|1,0,0]=3 6793 B22R2.4388 Cc1ccc(cc1)CCNC(=O)C=CSc2ccccc2 11a_100000705350_100016262050 [0,1,0,0,0,1|1,0,0]=3 6794 B22R2.4388 Cc1ccc(cc1)CCNC(=O)C=CSc2ccccc2 1626a_100000705350_100016262050 [0,1,0,0,0,1|1,0,0]=3 6795 B22R2.4388 Cc1ccc(cc1)CCNC(=O)C=CSc2ccccc2 240690a_100000705350_100016262050 [0,1,0,0,0,1|1,0,0]=3 6796 B22R2.4388 Cc1ccc(cc1)CNCC(=O)OCCc2ccccc2 2230a_100000174908_200000077782 [0,1,0,0,0,1|0,0,2]=4 6797 B22R2.4388 Cc1ccc(cc1)CNCC(=O)OCCc2ccccc2 34a_100000174908_200000077782 [0,1,0,0,0,1|0,0,2]=4 6798 B22R2.4388 Cc1ccc(cc1)CNNC(=O)C/C=C/c2ccccc2 22a_100011197965_100011219626 [0,1,0,0,0,1|2,0,0]=4 6799 B22R2.4388 Cc1ccc(cc1)CNNC(=O)C=CSc2ccccc2 22a_100011197965_100016262050 [0,1,0,0,0,1|2,0,0]=4 6800 B22R2.4388 Cc1ccc(cc1)COCC(=O)OCCc2ccccc2 34a_100011215236_200000077782 [0,1,0,0,0,1|0,0,2]=4 6801 B22R2.4388 Cc1ccc(cc1)COCC(=O)OCCc2ccccc2 7a_100011215236_200000077782 [0,1,0,0,0,1|0,0,2]=4 6802 B22R2.4388 Cc1ccc(cc1)CSCC(=O)OCCc2ccccc2 62a_100000210814_200000077782 [0,1,0,0,0,1|0,0,2]=4 6803 B22R2.4388 Cc1ccc(cc1)CSCC(=O)OCCc2ccccc2 62a_200000077782_100000210814 [0,1,0,0,0,1|0,0,2]=4 6804 B22R2.4388 Cc1ccc(cc1)OCCC(=O)C/C=C/c2ccccc2 1458a_100000182323_100016265936 [0,1,0,0,0,1|2,0,0]=4 6805 B22R2.4388 Cc1ccc(cc1)OCCC(=O)C/C=C/c2ccccc2 1458a_100011219626_100000183172 [0,1,0,0,0,1|2,0,0]=4 6806 B22R2.4388 Cc1ccc(cc1)OCCC(=O)C=CSc2ccccc2 1458a_100016262050_100000183172 [0,1,0,0,0,1|2,0,0]=4 6807 B22R2.4388 Cc1ccc(cc1)SCCC(=O)C/C=C/c2ccccc2 1458a_100000182377_100016265936 [0,1,0,0,0,1|2,0,0]=4 6808 B22R2.4388 Nc1ccc(cc1)COCC(=O)OCCc2ccccc2 34a_100011215238_200000077782 [0,1,0,0,0,1|0,0,2]=4 6809 B22R2.4388 O=C(C/C=C/c1ccccc1)CCCc2ccc(cc2)Br 1458a_100011219626_100011713682 [0,1,0,0,0,1|1,0,0]=3 6810 B22R2.4388 O=C(C/C=C/c1ccccc1)CCCc2ccc(cc2)Br 1458a_100011236545_100016265936 [0,1,0,0,0,1|1,0,0]=3 6811 B22R2.4388 O=C(C/C=C/c1ccccc1)CCCc2ccc(cc2)Cl 1458a_100000741339_100016265936 [0,1,0,0,0,1|1,0,0]=3 6812 B22R2.4388 O=C(C/C=C/c1ccccc1)CCCc2ccc(cc2)Cl 1458a_100011219626_100000759440 [0,1,0,0,0,1|1,0,0]=3 6813 B22R2.4388 O=C(C/C=C/c1ccccc1)CCCc2ccc(cc2)F 1458a_100011219626_200011713563 [0,1,0,0,0,1|1,0,0]=3 6814 B22R2.4388 O=C(C/C=C/c1ccccc1)CCCc2ccc(cc2)F 1458a_100011219804_100016265936 [0,1,0,0,0,1|1,0,0]=3 6815 B22R2.4388 O=C(C/C=C/c1ccccc1)CCCc2ccc(cc2)I 1458a_100011236544_100016265936 [0,1,0,0,0,1|1,0,0]=3 6816 B22R2.4388 O=C(C/C=C/c1ccccc1)CCCc2ccc(cc2)O 1458a_100000116853_100016265936 [0,1,0,0,0,1|1,0,0]=3 6817 B22R2.4388 O=C(C/C=C/c1ccccc1)CCOc2ccc(cc2)Br 1458a_100000738328_100016265936 [0,1,0,0,0,1|2,0,0]=4 6818 B22R2.4388 O=C(C/C=C/c1ccccc1)CCOc2ccc(cc2)Br 1458a_100011219626_100000183278 [0,1,0,0,0,1|2,0,0]=4 6819 B22R2.4388 O=C(C/C=C/c1ccccc1)CCOc2ccc(cc2)Cl 1458a_100000186438_100016265936 [0,1,0,0,0,1|2,0,0]=4 6820 B22R2.4388 O=C(C/C=C/c1ccccc1)CCOc2ccc(cc2)Cl 1458a_100011219626_100000184122 [0,1,0,0,0,1|2,0,0]=4 6821 B22R2.4388 O=C(C/C=C/c1ccccc1)CCOc2ccc(cc2)F 1458a_100000737396_100016265936 [0,1,0,0,0,1|2,0,0]=4 6822 B22R2.4388 O=C(C/C=C/c1ccccc1)CCOc2ccc(cc2)F 1458a_100011219626_100000184936 [0,1,0,0,0,1|2,0,0]=4 6823 B22R2.4388 O=C(C/C=C/c1ccccc1)CCSc2ccc(cc2)Br 1458a_100000208627_100016265936 [0,1,0,0,0,1|2,0,0]=4 6824 B22R2.4388 O=C(C/C=C/c1ccccc1)CCSc2ccc(cc2)Cl 1458a_100000182369_100016265936 [0,1,0,0,0,1|2,0,0]=4 6825 B22R2.4388 O=C(C/C=C/c1ccccc1)CCSc2ccc(cc2)F 1458a_100000199091_100016265936 [0,1,0,0,0,1|2,0,0]=4 6826 B22R2.4388 O=C(C/C=C/c1ccccc1)COCc2ccc(cc2)Br 1458a_200012349173_100016265936 [0,1,0,0,0,1|2,0,0]=4 6827 B22R2.4388 O=C(C/C=C/c1ccccc1)CSCc2ccc(cc2)Br 1458a_100000150267_100016265936 [0,1,0,0,0,1|2,0,0]=4 6828 B22R2.4388 O=C(C/C=C/c1ccccc1)CSCc2ccc(cc2)Cl 1458a_100000150262_100016265936 [0,1,0,0,0,1|2,0,0]=4 6829 B22R2.4388 O=C(C/C=C/c1ccccc1)CSCc2ccc(cc2)F 1458a_100000150272_100016265936 [0,1,0,0,0,1|2,0,0]=4 6830 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)Br 11a_100000755846_100011219626 [0,1,0,0,0,1|1,0,0]=3 6831 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)Br 1626a_100000755846_100011219626 [0,1,0,0,0,1|1,0,0]=3 6832 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)Br 240690a_100000755846_100011219626 [0,1,0,0,0,1|1,0,0]=3 6833 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)Cl 11a_100000185265_100011219626 [0,1,0,0,0,1|1,0,0]=3 6834 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100011219626 [0,1,0,0,0,1|1,0,0]=3 6835 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100011219626 [0,1,0,0,0,1|1,0,0]=3 6836 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)F 11a_100000199005_100011219626 [0,1,0,0,0,1|1,0,0]=3 6837 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)F 1626a_100000199005_100011219626 [0,1,0,0,0,1|1,0,0]=3 6838 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)F 240690a_100000199005_100011219626 [0,1,0,0,0,1|1,0,0]=3 6839 B22R2.4388 O=C(C/C=C/c1ccccc1)NCCc2ccc(cc2)O 240690a_100000743037_100011219626 [0,1,0,0,0,1|1,0,0]=3 6840 B22R2.4388 O=C(C/C=C/c1ccccc1)NNCc2ccc(cc2)Br 22a_100016993955_100011219626 [0,1,0,0,0,1|2,0,0]=4 6841 B22R2.4388 O=C(C/C=C/c1ccccc1)NNCc2ccc(cc2)Cl 22a_100000689899_100011219626 [0,1,0,0,0,1|2,0,0]=4 6842 B22R2.4388 O=C(C/C=C/c1ccccc1)NNCc2ccc(cc2)F 22a_100000689900_100011219626 [0,1,0,0,0,1|2,0,0]=4 6843 B22R2.4388 O=C(C/C=C/c1ccccc1)NNCc2ccc(cc2)I 22a_102495363730_100011219626 [0,1,0,0,0,1|2,0,0]=4 6844 B22R2.4388 O=C(C=CSc1ccccc1)CCCc2ccc(cc2)Br 1458a_100016262050_100011713682 [0,1,0,0,0,1|1,0,0]=3 6845 B22R2.4388 O=C(C=CSc1ccccc1)CCCc2ccc(cc2)Cl 1458a_100016262050_100000759440 [0,1,0,0,0,1|1,0,0]=3 6846 B22R2.4388 O=C(C=CSc1ccccc1)CCCc2ccc(cc2)F 1458a_100016262050_200011713563 [0,1,0,0,0,1|1,0,0]=3 6847 B22R2.4388 O=C(C=CSc1ccccc1)CCOc2ccc(cc2)Br 1458a_100016262050_100000183278 [0,1,0,0,0,1|2,0,0]=4 6848 B22R2.4388 O=C(C=CSc1ccccc1)CCOc2ccc(cc2)Cl 1458a_100016262050_100000184122 [0,1,0,0,0,1|2,0,0]=4 6849 B22R2.4388 O=C(C=CSc1ccccc1)CCOc2ccc(cc2)F 1458a_100016262050_100000184936 [0,1,0,0,0,1|2,0,0]=4 6850 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)Br 11a_100000755846_100016262050 [0,1,0,0,0,1|1,0,0]=3 6851 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)Br 1626a_100000755846_100016262050 [0,1,0,0,0,1|1,0,0]=3 6852 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)Br 240690a_100000755846_100016262050 [0,1,0,0,0,1|1,0,0]=3 6853 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)Cl 11a_100000185265_100016262050 [0,1,0,0,0,1|1,0,0]=3 6854 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)Cl 1626a_100000185265_100016262050 [0,1,0,0,0,1|1,0,0]=3 6855 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)Cl 240690a_100000185265_100016262050 [0,1,0,0,0,1|1,0,0]=3 6856 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)F 11a_100000199005_100016262050 [0,1,0,0,0,1|1,0,0]=3 6857 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)F 1626a_100000199005_100016262050 [0,1,0,0,0,1|1,0,0]=3 6858 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)F 240690a_100000199005_100016262050 [0,1,0,0,0,1|1,0,0]=3 6859 B22R2.4388 O=C(C=CSc1ccccc1)NCCc2ccc(cc2)O 240690a_100000743037_100016262050 [0,1,0,0,0,1|1,0,0]=3 6860 B22R2.4388 O=C(C=CSc1ccccc1)NNCc2ccc(cc2)Br 22a_100016993955_100016262050 [0,1,0,0,0,1|2,0,0]=4 6861 B22R2.4388 O=C(C=CSc1ccccc1)NNCc2ccc(cc2)Cl 22a_100000689899_100016262050 [0,1,0,0,0,1|2,0,0]=4 6862 B22R2.4388 O=C(C=CSc1ccccc1)NNCc2ccc(cc2)F 22a_100000689900_100016262050 [0,1,0,0,0,1|2,0,0]=4 6863 B22R2.4388 O=C(C=CSc1ccccc1)NNCc2ccc(cc2)I 22a_102495363730_100016262050 [0,1,0,0,0,1|2,0,0]=4 6864 B22R2.4388 O=C(CCCc1ccccc1)NN=Cc2ccc(cc2)Br 4a_100011246310_100000186029 [0,1,0,0,0,1|2,0,0]=4 6865 B22R2.4388 O=C(CCCc1ccccc1)NN=Cc2ccc(cc2)Cl 4a_100011246310_100000189385 [0,1,0,0,0,1|2,0,0]=4 6866 B22R2.4388 O=C(CCCc1ccccc1)NN=Cc2ccc(cc2)F 4a_100011246310_100000210084 [0,1,0,0,0,1|2,0,0]=4 6867 B22R2.4388 O=C(CCCc1ccccc1)NN=Cc2ccc(cc2)I 4a_100011246310_100000188517 [0,1,0,0,0,1|2,0,0]=4 6868 B22R2.4388 O=C(CCCc1ccccc1)NN=Cc2ccc(cc2)O 4a_100011246310_100000185832 [0,1,0,0,0,1|2,0,0]=4 6869 B22R2.4388 O=C(CNCc1ccc(cc1)Br)OCCc2ccccc2 2230a_100000174875_200000077782 [0,1,0,0,0,1|0,0,2]=4 6870 B22R2.4388 O=C(CNCc1ccc(cc1)Br)OCCc2ccccc2 34a_100000174875_200000077782 [0,1,0,0,0,1|0,0,2]=4 6871 B22R2.4388 O=C(CNCc1ccc(cc1)Cl)OCCc2ccccc2 2230a_100000174871_200000077782 [0,1,0,0,0,1|0,0,2]=4 6872 B22R2.4388 O=C(CNCc1ccc(cc1)Cl)OCCc2ccccc2 34a_100000174871_200000077782 [0,1,0,0,0,1|0,0,2]=4 6873 B22R2.4388 O=C(CNCc1ccc(cc1)F)OCCc2ccccc2 2230a_100000174882_200000077782 [0,1,0,0,0,1|0,0,2]=4 6874 B22R2.4388 O=C(CNCc1ccc(cc1)F)OCCc2ccccc2 34a_100000174882_200000077782 [0,1,0,0,0,1|0,0,2]=4 6875 B22R2.4388 O=C(CNCc1ccc(cc1)I)OCCc2ccccc2 2230a_100016989417_200000077782 [0,1,0,0,0,1|0,0,2]=4 6876 B22R2.4388 O=C(CNCc1ccc(cc1)I)OCCc2ccccc2 34a_100016989417_200000077782 [0,1,0,0,0,1|0,0,2]=4 6877 B22R2.4388 O=C(CNCc1ccc(cc1)O)OCCc2ccccc2 34a_100000185549_200000077782 [0,1,0,0,0,1|0,0,2]=4 6878 B22R2.4388 O=C(COCc1ccc(cc1)Br)OCCc2ccccc2 34a_100000695286_200000077782 [0,1,0,0,0,1|0,0,2]=4 6879 B22R2.4388 O=C(COCc1ccc(cc1)Cl)OCCc2ccccc2 34a_100000211118_200000077782 [0,1,0,0,0,1|0,0,2]=4 6880 B22R2.4388 O=C(COCc1ccc(cc1)Cl)OCCc2ccccc2 7a_100000211118_200000077782 [0,1,0,0,0,1|0,0,2]=4 6881 B22R2.4388 O=C(COCc1ccc(cc1)F)OCCc2ccccc2 34a_100000210977_200000077782 [0,1,0,0,0,1|0,0,2]=4 6882 B22R2.4388 O=C(COCc1ccc(cc1)F)OCCc2ccccc2 7a_100000210977_200000077782 [0,1,0,0,0,1|0,0,2]=4 6883 B22R2.4388 O=C(COCc1ccc(cc1)I)OCCc2ccccc2 34a_100000690907_200000077782 [0,1,0,0,0,1|0,0,2]=4 6884 B22R2.4388 O=C(COCc1ccc(cc1)I)OCCc2ccccc2 7a_100000690907_200000077782 [0,1,0,0,0,1|0,0,2]=4 6885 B22R2.4388 O=C(CSCc1ccc(cc1)Br)OCCc2ccccc2 62a_100000189115_200000077782 [0,1,0,0,0,1|0,0,2]=4 6886 B22R2.4388 O=C(CSCc1ccc(cc1)Br)OCCc2ccccc2 62a_200000077782_100000189115 [0,1,0,0,0,1|0,0,2]=4 6887 B22R2.4388 O=C(CSCc1ccc(cc1)Cl)OCCc2ccccc2 62a_100000187161_200000077782 [0,1,0,0,0,1|0,0,2]=4 6888 B22R2.4388 O=C(CSCc1ccc(cc1)Cl)OCCc2ccccc2 62a_200000077782_100000187161 [0,1,0,0,0,1|0,0,2]=4 6889 B22R2.4388 O=C(CSCc1ccc(cc1)F)OCCc2ccccc2 62a_100000198546_200000077782 [0,1,0,0,0,1|0,0,2]=4 6890 B22R2.4388 O=C(CSCc1ccc(cc1)F)OCCc2ccccc2 62a_200000077782_100000187164 [0,1,0,0,0,1|0,0,2]=4 6891 B22R2.4388 O=C(CSCc1ccc(cc1)I)OCCc2ccccc2 62a_100000189116_200000077782 [0,1,0,0,0,1|0,0,2]=4 6892 B22R2.4388 O=C(CSCc1ccc(cc1)I)OCCc2ccccc2 62a_200000077782_100000189116 [0,1,0,0,0,1|0,0,2]=4 6893 B22R2.4535 Cc1cccc(c1)C=NNC(=O)CCCc2ccccc2 4a_100011246310_100000211157 [0,1,0,0,0,1|2,0,0]=4 6894 B22R2.4535 Cc1cccc(c1)CCNC(=O)C/C=C/c2ccccc2 11a_100000749837_100011219626 [0,1,0,0,0,1|1,0,0]=3 6895 B22R2.4535 Cc1cccc(c1)CCNC(=O)C/C=C/c2ccccc2 1626a_100000749837_100011219626 [0,1,0,0,0,1|1,0,0]=3 6896 B22R2.4535 Cc1cccc(c1)CCNC(=O)C/C=C/c2ccccc2 240690a_100000749837_100011219626 [0,1,0,0,0,1|1,0,0]=3 6897 B22R2.4535 Cc1cccc(c1)CCNC(=O)C=CSc2ccccc2 11a_100000749837_100016262050 [0,1,0,0,0,1|1,0,0]=3 6898 B22R2.4535 Cc1cccc(c1)CCNC(=O)C=CSc2ccccc2 1626a_100000749837_100016262050 [0,1,0,0,0,1|1,0,0]=3 6899 B22R2.4535 Cc1cccc(c1)CCNC(=O)C=CSc2ccccc2 240690a_100000749837_100016262050 [0,1,0,0,0,1|1,0,0]=3 6900 B22R2.4535 Cc1cccc(c1)CNCC(=O)OCCc2ccccc2 2230a_100000185548_200000077782 [0,1,0,0,0,1|0,0,2]=4 6901 B22R2.4535 Cc1cccc(c1)CNCC(=O)OCCc2ccccc2 34a_100000185548_200000077782 [0,1,0,0,0,1|0,0,2]=4 6902 B22R2.4535 Cc1cccc(c1)CNNC(=O)C/C=C/c2ccccc2 22a_100000689898_100011219626 [0,1,0,0,0,1|2,0,0]=4 6903 B22R2.4535 Cc1cccc(c1)CNNC(=O)C=CSc2ccccc2 22a_100000689898_100016262050 [0,1,0,0,0,1|2,0,0]=4 6904 B22R2.4535 Cc1cccc(c1)COCC(=O)OCCc2ccccc2 34a_100011217746_200000077782 [0,1,0,0,0,1|0,0,2]=4 6905 B22R2.4535 Cc1cccc(c1)COCC(=O)OCCc2ccccc2 7a_100011217746_200000077782 [0,1,0,0,0,1|0,0,2]=4 6906 B22R2.4535 Cc1cccc(c1)CSCC(=O)OCCc2ccccc2 62a_100000211840_200000077782 [0,1,0,0,0,1|0,0,2]=4 6907 B22R2.4535 Cc1cccc(c1)CSCC(=O)OCCc2ccccc2 62a_200000077782_100000211840 [0,1,0,0,0,1|0,0,2]=4 6908 B22R2.4535 Cc1cccc(c1)OCCC(=O)C/C=C/c2ccccc2 1458a_100000182325_100016265936 [0,1,0,0,0,1|2,0,0]=4 6909 B22R2.4535 Cc1cccc(n1)CCNC(=O)C/C=C/c2ccccc2 11a_100011824523_100011219626 [0,1,0,0,0,1|2,0,0]=4 6910 B22R2.4535 Cc1cccc(n1)CCNC(=O)C/C=C/c2ccccc2 1626a_100011824523_100011219626 [0,1,0,0,0,1|2,0,0]=4 6911 B22R2.4535 Cc1cccc(n1)CCNC(=O)C/C=C/c2ccccc2 240690a_100011824523_100011219626 [0,1,0,0,0,1|2,0,0]=4 6912 B22R2.4535 Cc1cccc(n1)CCNC(=O)C=CSc2ccccc2 11a_100011824523_100016262050 [0,1,0,0,0,1|2,0,0]=4 6913 B22R2.4535 Cc1cccc(n1)CCNC(=O)C=CSc2ccccc2 1626a_100011824523_100016262050 [0,1,0,0,0,1|2,0,0]=4 6914 B22R2.4535 Cc1cccc(n1)CCNC(=O)C=CSc2ccccc2 240690a_100011824523_100016262050 [0,1,0,0,0,1|2,0,0]=4 6915 B22R2.4535 Nc1cccc(c1)COCC(=O)OCCc2ccccc2 34a_100000211919_200000077782 [0,1,0,0,0,1|0,0,2]=4 6916 B22R2.4535 O=C(C/C=C/c1ccccc1)CCCc2cccc(c2)Br 1458a_100000685939_100016265936 [0,1,0,0,0,1|1,0,0]=3 6917 B22R2.4535 O=C(C/C=C/c1ccccc1)CCCc2cccc(c2)Br 1458a_100011219626_100011713683 [0,1,0,0,0,1|1,0,0]=3 6918 B22R2.4535 O=C(C/C=C/c1ccccc1)CCCc2cccc(c2)F 1458a_100011219626_200000698031 [0,1,0,0,0,1|1,0,0]=3 6919 B22R2.4535 O=C(C/C=C/c1ccccc1)CCOc2cccc(c2)Br 1458a_100000183437_100016265936 [0,1,0,0,0,1|2,0,0]=4 6920 B22R2.4535 O=C(C/C=C/c1ccccc1)CCOc2cccc(c2)Br 1458a_100011219626_100000183150 [0,1,0,0,0,1|2,0,0]=4 6921 B22R2.4535 O=C(C/C=C/c1ccccc1)CCOc2cccc(c2)Cl 1458a_100000738917_100016265936 [0,1,0,0,0,1|2,0,0]=4 6922 B22R2.4535 O=C(C/C=C/c1ccccc1)CCOc2cccc(c2)Cl 1458a_100011219626_100000181161 [0,1,0,0,0,1|2,0,0]=4 6923 B22R2.4535 O=C(C/C=C/c1ccccc1)CCOc2cccc(c2)F 1458a_100000737089_100016265936 [0,1,0,0,0,1|2,0,0]=4 6924 B22R2.4535 O=C(C/C=C/c1ccccc1)CCOc2cccc(c2)F 1458a_100011219626_100000739188 [0,1,0,0,0,1|2,0,0]=4 6925 B22R2.4535 O=C(C/C=C/c1ccccc1)CSCc2cccc(c2)Cl 1458a_100000150269_100016265936 [0,1,0,0,0,1|2,0,0]=4 6926 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)Br 11a_100011207229_100011219626 [0,1,0,0,0,1|1,0,0]=3 6927 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)Br 1626a_100011207229_100011219626 [0,1,0,0,0,1|1,0,0]=3 6928 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)Br 240690a_100011207229_100011219626 [0,1,0,0,0,1|1,0,0]=3 6929 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)Cl 11a_100000185263_100011219626 [0,1,0,0,0,1|1,0,0]=3 6930 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)Cl 1626a_100000185263_100011219626 [0,1,0,0,0,1|1,0,0]=3 6931 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)Cl 240690a_100000185263_100011219626 [0,1,0,0,0,1|1,0,0]=3 6932 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)F 11a_100000205154_100011219626 [0,1,0,0,0,1|1,0,0]=3 6933 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)F 1626a_100000205154_100011219626 [0,1,0,0,0,1|1,0,0]=3 6934 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)F 240690a_100000205154_100011219626 [0,1,0,0,0,1|1,0,0]=3 6935 B22R2.4535 O=C(C/C=C/c1ccccc1)NCCc2cccc(c2)O 240690a_100000747277_100011219626 [0,1,0,0,0,1|1,0,0]=3 6936 B22R2.4535 O=C(C/C=C/c1ccccc1)NNCc2cccc(c2)Br 22a_100000686200_100011219626 [0,1,0,0,0,1|2,0,0]=4 6937 B22R2.4535 O=C(C/C=C/c1ccccc1)NNCc2cccc(c2)Cl 22a_100000685877_100011219626 [0,1,0,0,0,1|2,0,0]=4 6938 B22R2.4535 O=C(C/C=C/c1ccccc1)NNCc2cccc(c2)F 22a_100016993953_100011219626 [0,1,0,0,0,1|2,0,0]=4 6939 B22R2.4535 O=C(C/C=C/c1ccccc1)NNCc2cccc(c2)O 22a_100000008902_100011219626 [0,1,0,0,0,1|2,0,0]=4 6940 B22R2.4535 O=C(C=CSc1ccccc1)CCCc2cccc(c2)Br 1458a_100016262050_100011713683 [0,1,0,0,0,1|1,0,0]=3 6941 B22R2.4535 O=C(C=CSc1ccccc1)CCCc2cccc(c2)F 1458a_100016262050_200000698031 [0,1,0,0,0,1|1,0,0]=3 6942 B22R2.4535 O=C(C=CSc1ccccc1)CCOc2cccc(c2)Br 1458a_100016262050_100000183150 [0,1,0,0,0,1|2,0,0]=4 6943 B22R2.4535 O=C(C=CSc1ccccc1)CCOc2cccc(c2)Cl 1458a_100016262050_100000181161 [0,1,0,0,0,1|2,0,0]=4 6944 B22R2.4535 O=C(C=CSc1ccccc1)CCOc2cccc(c2)F 1458a_100016262050_100000739188 [0,1,0,0,0,1|2,0,0]=4 6945 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)Br 11a_100011207229_100016262050 [0,1,0,0,0,1|1,0,0]=3 6946 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)Br 1626a_100011207229_100016262050 [0,1,0,0,0,1|1,0,0]=3 6947 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)Br 240690a_100011207229_100016262050 [0,1,0,0,0,1|1,0,0]=3 6948 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)Cl 11a_100000185263_100016262050 [0,1,0,0,0,1|1,0,0]=3 6949 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)Cl 1626a_100000185263_100016262050 [0,1,0,0,0,1|1,0,0]=3 6950 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)Cl 240690a_100000185263_100016262050 [0,1,0,0,0,1|1,0,0]=3 6951 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)F 11a_100000205154_100016262050 [0,1,0,0,0,1|1,0,0]=3 6952 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)F 1626a_100000205154_100016262050 [0,1,0,0,0,1|1,0,0]=3 6953 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)F 240690a_100000205154_100016262050 [0,1,0,0,0,1|1,0,0]=3 6954 B22R2.4535 O=C(C=CSc1ccccc1)NCCc2cccc(c2)O 240690a_100000747277_100016262050 [0,1,0,0,0,1|1,0,0]=3 6955 B22R2.4535 O=C(C=CSc1ccccc1)NNCc2cccc(c2)Br 22a_100000686200_100016262050 [0,1,0,0,0,1|2,0,0]=4 6956 B22R2.4535 O=C(C=CSc1ccccc1)NNCc2cccc(c2)Cl 22a_100000685877_100016262050 [0,1,0,0,0,1|2,0,0]=4 6957 B22R2.4535 O=C(C=CSc1ccccc1)NNCc2cccc(c2)F 22a_100016993953_100016262050 [0,1,0,0,0,1|2,0,0]=4 6958 B22R2.4535 O=C(C=CSc1ccccc1)NNCc2cccc(c2)O 22a_100000008902_100016262050 [0,1,0,0,0,1|2,0,0]=4 6959 B22R2.4535 O=C(CCCc1ccccc1)NN=Cc2cccc(c2)Br 4a_100011246310_100000210085 [0,1,0,0,0,1|2,0,0]=4 6960 B22R2.4535 O=C(CCCc1ccccc1)NN=Cc2cccc(c2)Cl 4a_100011246310_100000210801 [0,1,0,0,0,1|2,0,0]=4 6961 B22R2.4535 O=C(CCCc1ccccc1)NN=Cc2cccc(c2)F 4a_100011246310_100000210812 [0,1,0,0,0,1|2,0,0]=4 6962 B22R2.4535 O=C(CCCc1ccccc1)NN=Cc2cccc(c2)I 4a_100011246310_100000014684 [0,1,0,0,0,1|2,0,0]=4 6963 B22R2.4535 O=C(CCCc1ccccc1)NN=Cc2cccc(c2)O 4a_100011246310_100000188321 [0,1,0,0,0,1|2,0,0]=4 6964 B22R2.4535 O=C(CNCc1cccc(c1)Br)OCCc2ccccc2 2230a_100000174977_200000077782 [0,1,0,0,0,1|0,0,2]=4 6965 B22R2.4535 O=C(CNCc1cccc(c1)Br)OCCc2ccccc2 34a_100000174977_200000077782 [0,1,0,0,0,1|0,0,2]=4 6966 B22R2.4535 O=C(CNCc1cccc(c1)Cl)OCCc2ccccc2 2230a_100000174878_200000077782 [0,1,0,0,0,1|0,0,2]=4 6967 B22R2.4535 O=C(CNCc1cccc(c1)Cl)OCCc2ccccc2 34a_100000174878_200000077782 [0,1,0,0,0,1|0,0,2]=4 6968 B22R2.4535 O=C(CNCc1cccc(c1)F)OCCc2ccccc2 2230a_100000174948_200000077782 [0,1,0,0,0,1|0,0,2]=4 6969 B22R2.4535 O=C(CNCc1cccc(c1)F)OCCc2ccccc2 34a_100000174948_200000077782 [0,1,0,0,0,1|0,0,2]=4 6970 B22R2.4535 O=C(CNCc1cccc(c1)I)OCCc2ccccc2 2230a_100000106179_200000077782 [0,1,0,0,0,1|0,0,2]=4 6971 B22R2.4535 O=C(CNCc1cccc(c1)I)OCCc2ccccc2 34a_100000106179_200000077782 [0,1,0,0,0,1|0,0,2]=4 6972 B22R2.4535 O=C(CNCc1cccc(c1)O)OCCc2ccccc2 2230a_100000743036_200000077782 [0,1,0,0,0,1|0,0,2]=4 6973 B22R2.4535 O=C(CNCc1cccc(c1)O)OCCc2ccccc2 34a_100000743036_200000077782 [0,1,0,0,0,1|0,0,2]=4 6974 B22R2.4535 O=C(COCc1cccc(c1)Br)OCCc2ccccc2 34a_100000687537_200000077782 [0,1,0,0,0,1|0,0,2]=4 6975 B22R2.4535 O=C(COCc1cccc(c1)Br)OCCc2ccccc2 7a_100000687537_200000077782 [0,1,0,0,0,1|0,0,2]=4 6976 B22R2.4535 O=C(COCc1cccc(c1)Cl)OCCc2ccccc2 34a_100000241301_200000077782 [0,1,0,0,0,1|0,0,2]=4 6977 B22R2.4535 O=C(COCc1cccc(c1)Cl)OCCc2ccccc2 7a_100000241301_200000077782 [0,1,0,0,0,1|0,0,2]=4 6978 B22R2.4535 O=C(COCc1cccc(c1)F)OCCc2ccccc2 34a_100000210976_200000077782 [0,1,0,0,0,1|0,0,2]=4 6979 B22R2.4535 O=C(COCc1cccc(c1)F)OCCc2ccccc2 7a_100000210976_200000077782 [0,1,0,0,0,1|0,0,2]=4 6980 B22R2.4535 O=C(COCc1cccc(c1)I)OCCc2ccccc2 34a_100011215336_200000077782 [0,1,0,0,0,1|0,0,2]=4 6981 B22R2.4535 O=C(COCc1cccc(c1)I)OCCc2ccccc2 7a_100011215336_200000077782 [0,1,0,0,0,1|0,0,2]=4 6982 B22R2.4535 O=C(CSCc1cccc(c1)Br)OCCc2ccccc2 62a_100000211773_200000077782 [0,1,0,0,0,1|0,0,2]=4 6983 B22R2.4535 O=C(CSCc1cccc(c1)Br)OCCc2ccccc2 62a_200000077782_100000211773 [0,1,0,0,0,1|0,0,2]=4 6984 B22R2.4535 O=C(CSCc1cccc(c1)Cl)OCCc2ccccc2 62a_100000187163_200000077782 [0,1,0,0,0,1|0,0,2]=4 6985 B22R2.4535 O=C(CSCc1cccc(c1)Cl)OCCc2ccccc2 62a_200000077782_100000187163 [0,1,0,0,0,1|0,0,2]=4 6986 B22R2.4535 O=C(CSCc1cccc(c1)F)OCCc2ccccc2 62a_100000230114_200000077782 [0,1,0,0,0,1|0,0,2]=4 6987 B22R2.4535 O=C(CSCc1cccc(c1)F)OCCc2ccccc2 62a_200000077782_100000230114 [0,1,0,0,0,1|0,0,2]=4 6988 B22R2.4535 O=C(CSCc1cccc(c1)I)OCCc2ccccc2 62a_100011218688_200000077782 [0,1,0,0,0,1|0,0,2]=4 6989 B22R2.4535 O=C(CSCc1cccc(c1)I)OCCc2ccccc2 62a_200000077782_100011218688 [0,1,0,0,0,1|0,0,2]=4 6990 B22R2.4535 O=C(CSCc1cccc(c1)O)OCCc2ccccc2 62a_100011660834_200000077782 [0,1,0,0,0,1|0,0,2]=4 6991 B22R2.4535 O=C(CSCc1cccc(c1)O)OCCc2ccccc2 62a_200000077782_100011660834 [0,1,0,0,0,1|0,0,2]=4 6992 B22R2.9161 Cc1ccccc1C=NNC(=O)CCCc2ccccc2 4a_100011246310_100000211143 [0,1,0,0,0,1|2,0,0]=4 6993 B22R2.9161 Cc1ccccc1CCNC(=O)C/C=C/c2ccccc2 11a_100000685071_100011219626 [0,1,0,0,0,1|1,0,0]=3 6994 B22R2.9161 Cc1ccccc1CCNC(=O)C/C=C/c2ccccc2 1626a_100000685071_100011219626 [0,1,0,0,0,1|1,0,0]=3 6995 B22R2.9161 Cc1ccccc1CCNC(=O)C/C=C/c2ccccc2 240690a_100000685071_100011219626 [0,1,0,0,0,1|1,0,0]=3 6996 B22R2.9161 Cc1ccccc1CCNC(=O)C=CSc2ccccc2 11a_100000685071_100016262050 [0,1,0,0,0,1|1,0,0]=3 6997 B22R2.9161 Cc1ccccc1CCNC(=O)C=CSc2ccccc2 1626a_100000685071_100016262050 [0,1,0,0,0,1|1,0,0]=3 6998 B22R2.9161 Cc1ccccc1CCNC(=O)C=CSc2ccccc2 240690a_100000685071_100016262050 [0,1,0,0,0,1|1,0,0]=3 6999 B22R2.9161 Cc1ccccc1CNCC(=O)OCCc2ccccc2 34a_100000174972_200000077782 [0,1,0,0,0,1|0,0,2]=4 7000 B22R2.9161 Cc1ccccc1CNNC(=O)C/C=C/c2ccccc2 22a_100000737298_100011219626 [0,1,0,0,0,1|2,0,0]=4 7001 B22R2.9161 Cc1ccccc1CNNC(=O)C=CSc2ccccc2 22a_100000737298_100016262050 [0,1,0,0,0,1|2,0,0]=4 7002 B22R2.9161 Cc1ccccc1COCC(=O)OCCc2ccccc2 34a_100000698903_200000077782 [0,1,0,0,0,1|0,0,2]=4 7003 B22R2.9161 Cc1ccccc1COCC(=O)OCCc2ccccc2 7a_100000698903_200000077782 [0,1,0,0,0,1|0,0,2]=4 7004 B22R2.9161 Cc1ccccc1CSCC(=O)C/C=C/c2ccccc2 1458a_100000150258_100016265936 [0,1,0,0,0,1|2,0,0]=4 7005 B22R2.9161 Cc1ccccc1CSCC(=O)OCCc2ccccc2 62a_100000211839_200000077782 [0,1,0,0,0,1|0,0,2]=4 7006 B22R2.9161 Cc1ccccc1CSCC(=O)OCCc2ccccc2 62a_200000077782_100000211839 [0,1,0,0,0,1|0,0,2]=4 7007 B22R2.9161 Cc1ccccc1OCCC(=O)C/C=C/c2ccccc2 1458a_100000182324_100016265936 [0,1,0,0,0,1|2,0,0]=4 7008 B22R2.9161 Cc1ccccc1OCCC(=O)C/C=C/c2ccccc2 1458a_100011219626_100000184434 [0,1,0,0,0,1|2,0,0]=4 7009 B22R2.9161 Cc1ccccc1OCCC(=O)C=CSc2ccccc2 1458a_100016262050_100000184434 [0,1,0,0,0,1|2,0,0]=4 7010 B22R2.9161 Nc1ccccc1COCC(=O)OCCc2ccccc2 34a_100000212039_200000077782 [0,1,0,0,0,1|0,0,2]=4 7011 B22R2.9161 O=C(C/C=C/c1ccccc1)CCCc2ccccc2Br 1458a_100011219626_200011713681 [0,1,0,0,0,1|1,0,0]=3 7012 B22R2.9161 O=C(C/C=C/c1ccccc1)CCCc2ccccc2Cl 1458a_100000700343_100016265936 [0,1,0,0,0,1|1,0,0]=3 7013 B22R2.9161 O=C(C/C=C/c1ccccc1)CCCc2ccccc2O 1458a_100009859317_100016265936 [0,1,0,0,0,1|1,0,0]=3 7014 B22R2.9161 O=C(C/C=C/c1ccccc1)CCOc2ccccc2Br 1458a_100000740817_100016265936 [0,1,0,0,0,1|2,0,0]=4 7015 B22R2.9161 O=C(C/C=C/c1ccccc1)CCOc2ccccc2Br 1458a_100011219626_100000695877 [0,1,0,0,0,1|2,0,0]=4 7016 B22R2.9161 O=C(C/C=C/c1ccccc1)CCOc2ccccc2Cl 1458a_100000240438_100016265936 [0,1,0,0,0,1|2,0,0]=4 7017 B22R2.9161 O=C(C/C=C/c1ccccc1)CCOc2ccccc2F 1458a_100000184057_100016265936 [0,1,0,0,0,1|2,0,0]=4 7018 B22R2.9161 O=C(C/C=C/c1ccccc1)CCOc2ccccc2F 1458a_100011219626_100000183290 [0,1,0,0,0,1|2,0,0]=4 7019 B22R2.9161 O=C(C/C=C/c1ccccc1)CCSc2ccccc2F 1458a_100000208832_100016265936 [0,1,0,0,0,1|2,0,0]=4 7020 B22R2.9161 O=C(C/C=C/c1ccccc1)CSCc2ccccc2Cl 1458a_100000150270_100016265936 [0,1,0,0,0,1|2,0,0]=4 7021 B22R2.9161 O=C(C/C=C/c1ccccc1)CSCc2ccccc2F 1458a_100000150260_100016265936 [0,1,0,0,0,1|2,0,0]=4 7022 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2Br 11a_100000747383_100011219626 [0,1,0,0,0,1|1,0,0]=3 7023 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2Br 1626a_100000747383_100011219626 [0,1,0,0,0,1|1,0,0]=3 7024 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2Br 240690a_100000747383_100011219626 [0,1,0,0,0,1|1,0,0]=3 7025 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2Cl 11a_100011207228_100011219626 [0,1,0,0,0,1|1,0,0]=3 7026 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2Cl 1626a_100011207228_100011219626 [0,1,0,0,0,1|1,0,0]=3 7027 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2Cl 240690a_100011207228_100011219626 [0,1,0,0,0,1|1,0,0]=3 7028 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2F 11a_100000185272_100011219626 [0,1,0,0,0,1|1,0,0]=3 7029 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2F 1626a_100000185272_100011219626 [0,1,0,0,0,1|1,0,0]=3 7030 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2F 240690a_100000185272_100011219626 [0,1,0,0,0,1|1,0,0]=3 7031 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCc2ccccc2O 240690a_100011207237_100011219626 [0,1,0,0,0,1|1,0,0]=3 7032 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCn2ccccc2=O 1626a_100000687133_100011219626 [0,1,0,0,0,1|2,0,0]=4 7033 B22R2.9161 O=C(C/C=C/c1ccccc1)NCCn2ccccc2=O 240690a_100000687133_100011219626 [0,1,0,0,0,1|2,0,0]=4 7034 B22R2.9161 O=C(C/C=C/c1ccccc1)NNCc2ccccc2Br 22a_200016993956_100011219626 [0,1,0,0,0,1|2,0,0]=4 7035 B22R2.9161 O=C(C/C=C/c1ccccc1)NNCc2ccccc2Cl 22a_100015187261_100011219626 [0,1,0,0,0,1|2,0,0]=4 7036 B22R2.9161 O=C(C/C=C/c1ccccc1)NNCc2ccccc2F 22a_100015200773_100011219626 [0,1,0,0,0,1|2,0,0]=4 7037 B22R2.9161 O=C(C=CSc1ccccc1)CCCc2ccccc2Br 1458a_100016262050_200011713681 [0,1,0,0,0,1|1,0,0]=3 7038 B22R2.9161 O=C(C=CSc1ccccc1)CCOc2ccccc2Br 1458a_100016262050_100000695877 [0,1,0,0,0,1|2,0,0]=4 7039 B22R2.9161 O=C(C=CSc1ccccc1)CCOc2ccccc2F 1458a_100016262050_100000183290 [0,1,0,0,0,1|2,0,0]=4 7040 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2Br 11a_100000747383_100016262050 [0,1,0,0,0,1|1,0,0]=3 7041 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2Br 1626a_100000747383_100016262050 [0,1,0,0,0,1|1,0,0]=3 7042 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2Br 240690a_100000747383_100016262050 [0,1,0,0,0,1|1,0,0]=3 7043 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2Cl 11a_100011207228_100016262050 [0,1,0,0,0,1|1,0,0]=3 7044 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2Cl 1626a_100011207228_100016262050 [0,1,0,0,0,1|1,0,0]=3 7045 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2Cl 240690a_100011207228_100016262050 [0,1,0,0,0,1|1,0,0]=3 7046 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2F 11a_100000185272_100016262050 [0,1,0,0,0,1|1,0,0]=3 7047 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2F 1626a_100000185272_100016262050 [0,1,0,0,0,1|1,0,0]=3 7048 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2F 240690a_100000185272_100016262050 [0,1,0,0,0,1|1,0,0]=3 7049 B22R2.9161 O=C(C=CSc1ccccc1)NCCc2ccccc2O 240690a_100011207237_100016262050 [0,1,0,0,0,1|1,0,0]=3 7050 B22R2.9161 O=C(C=CSc1ccccc1)NCCn2ccccc2=O 1626a_100000687133_100016262050 [0,1,0,0,0,1|2,0,0]=4 7051 B22R2.9161 O=C(C=CSc1ccccc1)NCCn2ccccc2=O 240690a_100000687133_100016262050 [0,1,0,0,0,1|2,0,0]=4 7052 B22R2.9161 O=C(C=CSc1ccccc1)NNCc2ccccc2Br 22a_200016993956_100016262050 [0,1,0,0,0,1|2,0,0]=4 7053 B22R2.9161 O=C(C=CSc1ccccc1)NNCc2ccccc2Cl 22a_100015187261_100016262050 [0,1,0,0,0,1|2,0,0]=4 7054 B22R2.9161 O=C(C=CSc1ccccc1)NNCc2ccccc2F 22a_100015200773_100016262050 [0,1,0,0,0,1|2,0,0]=4 7055 B22R2.9161 O=C(CCCc1ccccc1)NN=Cc2ccccc2Br 4a_100011246310_100000211189 [0,1,0,0,0,1|2,0,0]=4 7056 B22R2.9161 O=C(CCCc1ccccc1)NN=Cc2ccccc2Cl 4a_100011246310_100000210073 [0,1,0,0,0,1|2,0,0]=4 7057 B22R2.9161 O=C(CCCc1ccccc1)NN=Cc2ccccc2F 4a_100011246310_100000210811 [0,1,0,0,0,1|2,0,0]=4 7058 B22R2.9161 O=C(CCCc1ccccc1)NN=Cc2ccccc2I 4a_100011246310_100000010305 [0,1,0,0,0,1|2,0,0]=4 7059 B22R2.9161 O=C(CCCc1ccccc1)NN=Cc2ccccc2O 4a_100011246310_100000185834 [0,1,0,0,0,1|2,0,0]=4 7060 B22R2.9161 O=C(CNCc1ccccc1Br)OCCc2ccccc2 2230a_100000689332_200000077782 [0,1,0,0,0,1|0,0,2]=4 7061 B22R2.9161 O=C(CNCc1ccccc1Br)OCCc2ccccc2 34a_100000689332_200000077782 [0,1,0,0,0,1|0,0,2]=4 7062 B22R2.9161 O=C(CNCc1ccccc1Cl)OCCc2ccccc2 2230a_100000174879_200000077782 [0,1,0,0,0,1|0,0,2]=4 7063 B22R2.9161 O=C(CNCc1ccccc1Cl)OCCc2ccccc2 34a_100000174879_200000077782 [0,1,0,0,0,1|0,0,2]=4 7064 B22R2.9161 O=C(CNCc1ccccc1F)OCCc2ccccc2 34a_100000174869_200000077782 [0,1,0,0,0,1|0,0,2]=4 7065 B22R2.9161 O=C(CNCc1ccccc1O)OCCc2ccccc2 34a_100000185550_200000077782 [0,1,0,0,0,1|0,0,2]=4 7066 B22R2.9161 O=C(COCc1ccccc1Br)OCCc2ccccc2 34a_100000756307_200000077782 [0,1,0,0,0,1|0,0,2]=4 7067 B22R2.9161 O=C(COCc1ccccc1Br)OCCc2ccccc2 7a_100000756307_200000077782 [0,1,0,0,0,1|0,0,2]=4 7068 B22R2.9161 O=C(COCc1ccccc1Cl)OCCc2ccccc2 34a_100000210847_200000077782 [0,1,0,0,0,1|0,0,2]=4 7069 B22R2.9161 O=C(COCc1ccccc1Cl)OCCc2ccccc2 7a_100000210847_200000077782 [0,1,0,0,0,1|0,0,2]=4 7070 B22R2.9161 O=C(COCc1ccccc1F)OCCc2ccccc2 34a_100000211962_200000077782 [0,1,0,0,0,1|0,0,2]=4 7071 B22R2.9161 O=C(COCc1ccccc1F)OCCc2ccccc2 7a_100000211962_200000077782 [0,1,0,0,0,1|0,0,2]=4 7072 B22R2.9161 O=C(COCc1ccccc1I)OCCc2ccccc2 34a_100000187465_200000077782 [0,1,0,0,0,1|0,0,2]=4 7073 B22R2.9161 O=C(COCc1ccccc1I)OCCc2ccccc2 7a_100000187465_200000077782 [0,1,0,0,0,1|0,0,2]=4 7074 B22R2.9161 O=C(CSCc1ccccc1Br)OCCc2ccccc2 62a_100000184730_200000077782 [0,1,0,0,0,1|0,0,2]=4 7075 B22R2.9161 O=C(CSCc1ccccc1Br)OCCc2ccccc2 62a_200000077782_100000184730 [0,1,0,0,0,1|0,0,2]=4 7076 B22R2.9161 O=C(CSCc1ccccc1Cl)OCCc2ccccc2 62a_100000187162_200000077782 [0,1,0,0,0,1|0,0,2]=4 7077 B22R2.9161 O=C(CSCc1ccccc1Cl)OCCc2ccccc2 62a_200000077782_100000187162 [0,1,0,0,0,1|0,0,2]=4 7078 B22R2.9161 O=C(CSCc1ccccc1F)OCCc2ccccc2 62a_100000211605_200000077782 [0,1,0,0,0,1|0,0,2]=4 7079 B22R2.9161 O=C(CSCc1ccccc1F)OCCc2ccccc2 62a_200000077782_100000211605 [0,1,0,0,0,1|0,0,2]=4 7080 B22R2.9161 O=C(CSCc1ccccc1I)OCCc2ccccc2 62a_100011216222_200000077782 [0,1,0,0,0,1|0,0,2]=4 7081 B22R2.9161 O=C(CSCc1ccccc1I)OCCc2ccccc2 62a_200000077782_100011216222 [0,1,0,0,0,1|0,0,2]=4 7082 B22R2.360001 CC(=NNC(=O)CCCc1ccccc1)c2ccccc2 4a_100011246310_100000185851 [0,1,0,0,0,1|2,0,0]=4 7083 B22R2.360001 CC(CNC(=O)C/C=C/c1ccccc1)c2ccccc2 11a_100000701038_100011219626 [0,1,0,0,0,1|1,0,0]=3 7084 B22R2.360001 CC(CNC(=O)C/C=C/c1ccccc1)c2ccccc2 1626a_100000701038_100011219626 [0,1,0,0,0,1|1,0,0]=3 7085 B22R2.360001 CC(CNC(=O)C/C=C/c1ccccc1)c2ccccc2 240690a_100000701038_100011219626 [0,1,0,0,0,1|1,0,0]=3 7086 B22R2.360001 CC(CNC(=O)C=CSc1ccccc1)c2ccccc2 11a_100000701038_100016262050 [0,1,0,0,0,1|1,0,0]=3 7087 B22R2.360001 CC(CNC(=O)C=CSc1ccccc1)c2ccccc2 1626a_100000701038_100016262050 [0,1,0,0,0,1|1,0,0]=3 7088 B22R2.360001 CC(CNC(=O)C=CSc1ccccc1)c2ccccc2 240690a_100000701038_100016262050 [0,1,0,0,0,1|1,0,0]=3 7089 B22R2.360001 CC(SCC(=O)OCCc1ccccc1)c2ccccc2 62a_100000230085_200000077782 [0,1,0,0,0,1|0,0,2]=4 7090 B22R2.360001 CC(SCC(=O)OCCc1ccccc1)c2ccccc2 62a_200000077782_100000230085 [0,1,0,0,0,1|0,0,2]=4 7091 B22R2.360001 C[C@@H](NCC(=O)OCCc1ccccc1)c2ccccc2 2230a_100000751104_200000077782 [0,1,0,0,0,1|0,0,2]=4 7092 B22R2.360001 C[C@@H](OCC(=O)OCCc1ccccc1)c2ccccc2 34a_100000761318_200000077782 [0,1,0,0,0,1|0,0,2]=4 7093 B22R2.360001 C[C@@H](OCC(=O)OCCc1ccccc1)c2ccccc2 7a_100000761318_200000077782 [0,1,0,0,0,1|0,0,2]=4 7094 B22R2.360001 O=C(C/C=C/c1ccccc1)CCC(=O)c2ccccc2 1458a_100011219626_100000750707 [0,1,0,0,0,1|1,0,1]=4 7095 B22R2.360001 O=C(C/C=C/c1ccccc1)CC[C@@H](O)c2ccccc2 1458a_100011219626_100000729684 [0,1,0,0,0,1|1,0,0]=3 7096 B22R2.360001 O=C(C/C=C/c1ccccc1)NCC(O)c2ccccc2 240690a_100000210709_100011219626 [0,1,0,0,0,1|1,0,0]=3 7097 B22R2.360001 O=C(C/C=C/c1ccccc1)NCC(O)c2ccccn2 240690a_100000691469_100011219626 [0,1,0,0,0,1|2,0,0]=4 7098 B22R2.360001 O=C(C/C=C/c1ccccc1)NCC(O)c2cccnc2 240690a_100020605170_100011219626 [0,1,0,0,0,1|2,0,0]=4 7099 B22R2.360001 O=C(C=CSc1ccccc1)CCC(=O)c2ccccc2 1458a_100016262050_100000750707 [0,1,0,0,0,1|1,0,1]=4 7100 B22R2.360001 O=C(C=CSc1ccccc1)CC[C@@H](O)c2ccccc2 1458a_100016262050_100000729684 [0,1,0,0,0,1|1,0,0]=3 7101 B22R2.360001 O=C(C=CSc1ccccc1)NCC(O)c2ccccc2 240690a_100000210709_100016262050 [0,1,0,0,0,1|1,0,0]=3 7102 B22R2.360001 O=C(C=CSc1ccccc1)NCC(O)c2ccccn2 240690a_100000691469_100016262050 [0,1,0,0,0,1|2,0,0]=4 7103 B22R2.360001 O=C(C=CSc1ccccc1)NCC(O)c2cccnc2 240690a_100020605170_100016262050 [0,1,0,0,0,1|2,0,0]=4 7104 B22R2.360001 O=C(CCCc1ccccc1)CCC(=O)c2ccccc2 1458a_100011207963_100000750707 [0,1,0,0,0,1|1,0,1]=4 7105 B22R2.360001 O=C(CCCc1ccccc1)CNC(=O)c2ccccc2 1458a_100000182045_100000211621 [0,1,0,0,0,1|1,0,1]=4 7106 B22R2.360001 O=C(CCCc1ccccc1)COC(=O)c2ccccc2 1458a_100011207963_100000073877 [0,1,0,0,0,1|1,0,1]=4 7107 B22R2.360001 O=C(CCCc1ccccc1)CSC(=S)c2ccccc2 1458a_100000043459_100000211621 [0,1,0,0,0,1|1,0,1]=4 7108 B22R2.360001 O=C(CCCc1ccccc1)NNC(=O)c2ccccc2 22a_100000184135_100011207963 [0,1,0,0,0,1|2,0,0]=4 7109 B22R2.360001 O=C(CCCc1ccccc1)NNC(=O)c2ccccc2 22a_100011246310_100000185807 [0,1,0,0,0,1|2,0,0]=4 7110 B22R2.360001 O=C(CNC(=O)c1ccccc1)NCCc2ccccc2 11a_100000106460_100000182045 [0,1,0,0,0,1|1,0,1]=4 7111 B22R2.360001 O=C(CNC(=O)c1ccccc1)NCCc2ccccc2 11a_100000747479_100000185807 [0,1,0,0,0,1|1,0,1]=4 7112 B22R2.360001 O=C(CNC(=O)c1ccccc1)NCCc2ccccc2 1626a_100000106460_100000182045 [0,1,0,0,0,1|1,0,1]=4 7113 B22R2.360001 O=C(CNC(=O)c1ccccc1)NCCc2ccccc2 1626a_100000747479_100000185807 [0,1,0,0,0,1|1,0,1]=4 7114 B22R2.360001 O=C(CNC(=O)c1ccccc1)NCCc2ccccc2 240690a_100000106460_100000182045 [0,1,0,0,0,1|1,0,1]=4 7115 B22R2.360001 O=C(CNC(=O)c1ccccc1)NCCc2ccccc2 240690a_100000747479_100000185807 [0,1,0,0,0,1|1,0,1]=4 7116 B22R2.360001 O=C(CNC(=O)c1ccccc1)NCCc2ccccc2 527a_100000106460_100000182045 [0,1,0,0,0,1|1,0,1]=4 7117 B22R2.360001 O=C(CNC(=O)c1ccccc1)NCCc2ccccc2 527a_100000747479_100000185807 [0,1,0,0,0,1|1,0,1]=4 7118 B22R2.360001 O=C(CSC(=S)c1ccccc1)NCCc2ccccc2 1626a_100000106460_100000043459 [0,1,0,0,0,1|1,0,1]=4 7119 B22R2.360001 O=C(CSC(=S)c1ccccc1)NCCc2ccccc2 240690a_100000106460_100000043459 [0,1,0,0,0,1|1,0,1]=4 7120 B22R2.360001 O=C(CSC(=S)c1ccccc1)NCCc2ccccc2 527a_100000106460_100000043459 [0,1,0,0,0,1|1,0,1]=4 7121 B22R2.360001 O=C(NCCc1ccccc1)NNC(=O)c2ccccc2 273464a_100000106460_100000184135 [0,1,0,0,0,1|2,0,0]=4 7122 B22R2.360001 O=C(NCCc1ccccc1)NNC(=O)c2ccccc2 512a_100000184135_100000106460 [0,1,0,0,0,1|2,0,0]=4 7123 B22R2.360004 CC(Cc1ccccn1)NC(=O)C/C=C/c2ccccc2 11a_100000238496_100011219626 [0,1,0,0,0,1|2,0,0]=4 7124 B22R2.360004 CC(Cc1ccccn1)NC(=O)C/C=C/c2ccccc2 1626a_100000238496_100011219626 [0,1,0,0,0,1|2,0,0]=4 7125 B22R2.360004 CC(Cc1ccccn1)NC(=O)C/C=C/c2ccccc2 240690a_100000238496_100011219626 [0,1,0,0,0,1|2,0,0]=4 7126 B22R2.360004 CC(Cc1ccccn1)NC(=O)C=CSc2ccccc2 11a_100000238496_100016262050 [0,1,0,0,0,1|2,0,0]=4 7127 B22R2.360004 CC(Cc1ccccn1)NC(=O)C=CSc2ccccc2 1626a_100000238496_100016262050 [0,1,0,0,0,1|2,0,0]=4 7128 B22R2.360004 CC(Cc1ccccn1)NC(=O)C=CSc2ccccc2 240690a_100000238496_100016262050 [0,1,0,0,0,1|2,0,0]=4 7129 B22R2.360004 CC(Cc1cccnc1)NC(=O)C/C=C/c2ccccc2 11a_100011207255_100011219626 [0,1,0,0,0,1|2,0,0]=4 7130 B22R2.360004 CC(Cc1cccnc1)NC(=O)C/C=C/c2ccccc2 1626a_100011207255_100011219626 [0,1,0,0,0,1|2,0,0]=4 7131 B22R2.360004 CC(Cc1cccnc1)NC(=O)C/C=C/c2ccccc2 240690a_100011207255_100011219626 [0,1,0,0,0,1|2,0,0]=4 7132 B22R2.360004 CC(Cc1cccnc1)NC(=O)C=CSc2ccccc2 11a_100011207255_100016262050 [0,1,0,0,0,1|2,0,0]=4 7133 B22R2.360004 CC(Cc1cccnc1)NC(=O)C=CSc2ccccc2 1626a_100011207255_100016262050 [0,1,0,0,0,1|2,0,0]=4 7134 B22R2.360004 CC(Cc1cccnc1)NC(=O)C=CSc2ccccc2 240690a_100011207255_100016262050 [0,1,0,0,0,1|2,0,0]=4 7135 B22R2.360004 CN(CC(=O)C/C=C/c1ccccc1)Cc2ccccc2 1458a_100000745601_100016265936 [0,1,0,0,0,1|2,0,0]=4 7136 B22R2.360004 CN(CC(=O)OCCc1ccccc1)Cc2ccccc2 2230a_100000186898_200000077782 [0,1,0,0,0,1|0,0,2]=4 7137 B22R2.360004 CN(CC(=O)OCCc1ccccc1)Cc2ccccc2 269982a_100000186898_200000077782 [0,1,0,0,0,1|0,0,2]=4 7138 B22R2.360004 O=C(C/C=C/c1ccccc1)CC(=O)Cc2ccccc2 1458a_100011219626_100000233483 [0,1,0,0,0,1|1,0,1]=4 7139 B22R2.360004 O=C(C=CSc1ccccc1)CC(=O)Cc2ccccc2 1458a_100016262050_100000233483 [0,1,0,0,0,1|1,0,1]=4 7140 B22R2.360004 O=C(CC(=O)OCCc1ccccc1)C[n+]2ccccc2 1458a_200000086051_200000077782 [0,1,0,0,0,1|1,0,1]=4 7141 B22R2.360004 O=C(CC(=O)OCCc1ccccc1)Cc2ccccn2 1458a_100000233486_200000077782 [0,1,0,0,0,1|1,0,1]=4 7142 B22R2.360004 O=C(CC(=O)OCCc1ccccc1)Cc2cccnc2 1458a_100000737805_200000077782 [0,1,0,0,0,1|1,0,1]=4 7143 B22R2.360004 O=C(CC(=O)Oc1ccccc1)NCCc2ccccc2 240690a_100000106460_200000075362 [0,1,0,0,0,1|1,0,1]=4 7144 B22R2.360004 O=C(CCCc1ccccc1)CC(=O)Cc2ccccc2 1458a_100011207963_100000233483 [0,1,0,0,0,1|1,0,1]=4 7145 B22R2.360004 O=C(CCCc1ccccc1)CC(=O)Nc2ccccc2 1458a_100011207963_100000182850 [0,1,0,0,0,1|1,0,1]=4 7146 B22R2.360004 O=C(CCCc1ccccc1)CC(=O)Oc2ccccc2 1458a_100011207963_100009813826 [0,1,0,0,0,1|1,0,1]=4 7147 B22R2.200483 O=C(COc1cccccc1=O)OCCc2ccccc2 34a_100000036025_200000077782 [0,1,0,0,0,1|1,0,1]=4 7148 B22R2.200483 O=C(COc1cccccc1=O)OCCc2ccccc2 7a_100000036025_200000077782 [0,1,0,0,0,1|1,0,1]=4 7149 B22R2.3509 CCc1cccc(c1)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000199093 [0,2,0,0,0,0|2,0,0]=4 7150 B22R2.3509 COc1cccc(c1)CCNC(=O)C=Cc2ccccc2 11a_100000740386_100000210462 [0,2,0,0,0,0|1,0,0]=3 7151 B22R2.3509 COc1cccc(c1)CCNC(=O)C=Cc2ccccc2 1626a_100000740386_100000210462 [0,2,0,0,0,0|1,0,0]=3 7152 B22R2.3509 COc1cccc(c1)CCNC(=O)C=Cc2ccccn2 11a_100000740386_100000740811 [0,2,0,0,0,0|2,0,0]=4 7153 B22R2.3509 COc1cccc(c1)CCNC(=O)C=Cc2ccccn2 240690a_100000740386_100000740811 [0,2,0,0,0,0|2,0,0]=4 7154 B22R2.3509 COc1cccc(c1)CCNC(=O)C=Cc2cccnc2 11a_100000740386_100000735890 [0,2,0,0,0,0|2,0,0]=4 7155 B22R2.3509 COc1cccc(c1)CCNC(=O)C=Cc2cccnc2 240690a_100000740386_100000735890 [0,2,0,0,0,0|2,0,0]=4 7156 B22R2.3509 COc1cccc(c1)CCNC(=O)C=Cc2ccncc2 240690a_100000740386_100000682801 [0,2,0,0,0,0|2,0,0]=4 7157 B22R2.3509 COc1cccc(c1)CNNC(=O)C=Cc2ccccc2 22a_100015185960_100000210462 [0,2,0,0,0,0|2,0,0]=4 7158 B22R2.3509 COc1cccc(c1)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000691273 [0,2,0,0,0,0|2,0,0]=4 7159 B22R2.3509 N#Cc1cccc(c1)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000742621 [0,2,0,0,0,0|2,0,0]=4 7160 B22R2.4351 Cc1cc(cc(c1)OCCC(=O)C=Cc2ccccc2)C 1458a_100000210462_100000185327 [0,2,0,0,0,0|2,0,0]=4 7161 B22R2.4351 O=C(C=Cc1ccccc1)NCCc2cc(cc(c2)Cl)Cl 11a_100000746052_100000210462 [0,2,0,0,0,0|1,0,0]=3 7162 B22R2.4351 O=C(C=Cc1ccccc1)NCCc2cc(cc(c2)Cl)Cl 1626a_100000746052_100000210462 [0,2,0,0,0,0|1,0,0]=3 7163 B22R2.4351 O=C(C=Cc1ccccc1)NCCc2cc(cc(c2)F)F 11a_100000748410_100000210462 [0,2,0,0,0,0|1,0,0]=3 7164 B22R2.4351 O=C(C=Cc1ccccc1)NCCc2cc(cc(c2)F)F 1626a_100000748410_100000210462 [0,2,0,0,0,0|1,0,0]=3 7165 B22R2.4351 O=C(C=Cc1ccccc1)NNCc2cc(cc(c2)Cl)F 22a_100102677951_100000210462 [0,2,0,0,0,0|2,0,0]=4 7166 B22R2.4351 O=C(C=Cc1ccccc1)NNCc2cc(cc(c2)F)F 22a_100015201309_100000210462 [0,2,0,0,0,0|2,0,0]=4 7167 B22R2.4351 O=C(C=Cc1ccccn1)NCCc2cc(cc(c2)Cl)Cl 11a_100000746052_100000740811 [0,2,0,0,0,0|2,0,0]=4 7168 B22R2.4351 O=C(C=Cc1ccccn1)NCCc2cc(cc(c2)Cl)Cl 240690a_100000746052_100000740811 [0,2,0,0,0,0|2,0,0]=4 7169 B22R2.4351 O=C(C=Cc1ccccn1)NCCc2cc(cc(c2)F)F 11a_100000748410_100000740811 [0,2,0,0,0,0|2,0,0]=4 7170 B22R2.4351 O=C(C=Cc1ccccn1)NCCc2cc(cc(c2)F)F 240690a_100000748410_100000740811 [0,2,0,0,0,0|2,0,0]=4 7171 B22R2.4351 O=C(C=Cc1cccnc1)NCCc2cc(cc(c2)Cl)Cl 11a_100000746052_100000735890 [0,2,0,0,0,0|2,0,0]=4 7172 B22R2.4351 O=C(C=Cc1cccnc1)NCCc2cc(cc(c2)Cl)Cl 240690a_100000746052_100000735890 [0,2,0,0,0,0|2,0,0]=4 7173 B22R2.4351 O=C(C=Cc1cccnc1)NCCc2cc(cc(c2)F)F 11a_100000748410_100000735890 [0,2,0,0,0,0|2,0,0]=4 7174 B22R2.4351 O=C(C=Cc1cccnc1)NCCc2cc(cc(c2)F)F 240690a_100000748410_100000735890 [0,2,0,0,0,0|2,0,0]=4 7175 B22R2.4351 O=C(C=Cc1ccncc1)NCCc2cc(cc(c2)Cl)Cl 240690a_100000746052_100000682801 [0,2,0,0,0,0|2,0,0]=4 7176 B22R2.4351 O=C(C=Cc1ccncc1)NCCc2cc(cc(c2)F)F 240690a_100000748410_100000682801 [0,2,0,0,0,0|2,0,0]=4 7177 B22R2.4532 CC(=CC(=O)CCCc1cccc(c1)Br)c2ccccc2 1458a_100000743005_100011713683 [0,2,0,0,0,0|1,0,0]=3 7178 B22R2.4532 CC(=CC(=O)CCCc1cccc(c1)F)c2ccccc2 1458a_100000743005_200000698031 [0,2,0,0,0,0|1,0,0]=3 7179 B22R2.4532 CC(=CC(=O)CCOc1cccc(c1)Br)c2ccccc2 1458a_100000743005_100000183150 [0,2,0,0,0,0|2,0,0]=4 7180 B22R2.4532 CC(=CC(=O)CCOc1cccc(c1)Cl)c2ccccc2 1458a_100000743005_100000181161 [0,2,0,0,0,0|2,0,0]=4 7181 B22R2.4532 CC(=CC(=O)CCOc1cccc(c1)F)c2ccccc2 1458a_100000743005_100000739188 [0,2,0,0,0,0|2,0,0]=4 7182 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)Br)c2ccccc2 11a_100011207229_100000743005 [0,2,0,0,0,0|1,0,0]=3 7183 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)Br)c2ccccc2 1626a_100011207229_100000743005 [0,2,0,0,0,0|1,0,0]=3 7184 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)Br)c2ccccc2 240690a_100011207229_100000743005 [0,2,0,0,0,0|1,0,0]=3 7185 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)Br)c2ccccc2 527a_100011207229_100000743005 [0,2,0,0,0,0|1,0,0]=3 7186 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)C)c2ccccc2 11a_100000749837_100000743005 [0,2,0,0,0,0|1,0,0]=3 7187 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)C)c2ccccc2 1626a_100000749837_100000743005 [0,2,0,0,0,0|1,0,0]=3 7188 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)C)c2ccccc2 240690a_100000749837_100000743005 [0,2,0,0,0,0|1,0,0]=3 7189 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)C)c2ccccc2 527a_100000749837_100000743005 [0,2,0,0,0,0|1,0,0]=3 7190 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)Cl)c2ccccc2 11a_100000185263_100000743005 [0,2,0,0,0,0|1,0,0]=3 7191 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)Cl)c2ccccc2 1626a_100000185263_100000743005 [0,2,0,0,0,0|1,0,0]=3 7192 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)Cl)c2ccccc2 240690a_100000185263_100000743005 [0,2,0,0,0,0|1,0,0]=3 7193 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)Cl)c2ccccc2 527a_100000185263_100000743005 [0,2,0,0,0,0|1,0,0]=3 7194 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)F)c2ccccc2 11a_100000205154_100000743005 [0,2,0,0,0,0|1,0,0]=3 7195 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)F)c2ccccc2 1626a_100000205154_100000743005 [0,2,0,0,0,0|1,0,0]=3 7196 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)F)c2ccccc2 240690a_100000205154_100000743005 [0,2,0,0,0,0|1,0,0]=3 7197 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)F)c2ccccc2 527a_100000205154_100000743005 [0,2,0,0,0,0|1,0,0]=3 7198 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)O)c2ccccc2 240690a_100000747277_100000743005 [0,2,0,0,0,0|1,0,0]=3 7199 B22R2.4532 CC(=CC(=O)NCCc1cccc(c1)O)c2ccccc2 527a_100000747277_100000743005 [0,2,0,0,0,0|1,0,0]=3 7200 B22R2.4532 CC(=CC(=O)NCCc1cccc(n1)C)c2ccccc2 11a_100011824523_100000743005 [0,2,0,0,0,0|2,0,0]=4 7201 B22R2.4532 CC(=CC(=O)NCCc1cccc(n1)C)c2ccccc2 1626a_100011824523_100000743005 [0,2,0,0,0,0|2,0,0]=4 7202 B22R2.4532 CC(=CC(=O)NCCc1cccc(n1)C)c2ccccc2 240690a_100011824523_100000743005 [0,2,0,0,0,0|2,0,0]=4 7203 B22R2.4532 CC(=CC(=O)NCCc1cccc(n1)C)c2ccccc2 527a_100011824523_100000743005 [0,2,0,0,0,0|2,0,0]=4 7204 B22R2.4532 CC(=CC(=O)NNCc1cccc(c1)Br)c2ccccc2 22a_100000686200_100000743005 [0,2,0,0,0,0|2,0,0]=4 7205 B22R2.4532 CC(=CC(=O)NNCc1cccc(c1)C)c2ccccc2 22a_100000689898_100000743005 [0,2,0,0,0,0|2,0,0]=4 7206 B22R2.4532 CC(=CC(=O)NNCc1cccc(c1)Cl)c2ccccc2 22a_100000685877_100000743005 [0,2,0,0,0,0|2,0,0]=4 7207 B22R2.4532 CC(=CC(=O)NNCc1cccc(c1)F)c2ccccc2 22a_100016993953_100000743005 [0,2,0,0,0,0|2,0,0]=4 7208 B22R2.4532 CC(=CC(=O)NNCc1cccc(c1)O)c2ccccc2 22a_100000008902_100000743005 [0,2,0,0,0,0|2,0,0]=4 7209 B22R2.4532 O=C(CC(=O)c1ccccc1)NCCc2cccc(c2)Cl 1458a_100000185807_100000230230 [0,2,0,0,0,0|1,0,1]=4 7210 B22R2.4532 O=C(CCCc1cccc(c1)Br)CC(=O)c2ccccc2 1458a_100000685939_100000211460 [0,2,0,0,0,0|1,0,1]=4 7211 B22R2.4534 Cc1cccc(c1)C=CC(=O)CCCc2cccc(c2)Br 1458a_100000690095_100011713683 [0,2,0,0,0,0|1,0,0]=3 7212 B22R2.4534 Cc1cccc(c1)C=CC(=O)CCCc2cccc(c2)F 1458a_100000690095_200000698031 [0,2,0,0,0,0|1,0,0]=3 7213 B22R2.4534 Cc1cccc(c1)C=CC(=O)CCOc2cccc(c2)Br 1458a_100000690095_100000183150 [0,2,0,0,0,0|2,0,0]=4 7214 B22R2.4534 Cc1cccc(c1)C=CC(=O)CCOc2cccc(c2)Cl 1458a_100000690095_100000181161 [0,2,0,0,0,0|2,0,0]=4 7215 B22R2.4534 Cc1cccc(c1)C=CC(=O)CCOc2cccc(c2)F 1458a_100000690095_100000739188 [0,2,0,0,0,0|2,0,0]=4 7216 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)Br 11a_100011207229_100000690095 [0,2,0,0,0,0|1,0,0]=3 7217 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)Br 1626a_100011207229_100000690095 [0,2,0,0,0,0|1,0,0]=3 7218 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)Br 240690a_100011207229_100000690095 [0,2,0,0,0,0|1,0,0]=3 7219 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)C 11a_100000749837_100000690095 [0,2,0,0,0,0|1,0,0]=3 7220 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)C 1626a_100000749837_100000690095 [0,2,0,0,0,0|1,0,0]=3 7221 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)C 240690a_100000749837_100000690095 [0,2,0,0,0,0|1,0,0]=3 7222 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)Cl 11a_100000185263_100000690095 [0,2,0,0,0,0|1,0,0]=3 7223 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)Cl 1626a_100000185263_100000690095 [0,2,0,0,0,0|1,0,0]=3 7224 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)Cl 240690a_100000185263_100000690095 [0,2,0,0,0,0|1,0,0]=3 7225 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)F 11a_100000205154_100000690095 [0,2,0,0,0,0|1,0,0]=3 7226 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)F 1626a_100000205154_100000690095 [0,2,0,0,0,0|1,0,0]=3 7227 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)F 240690a_100000205154_100000690095 [0,2,0,0,0,0|1,0,0]=3 7228 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(c2)O 240690a_100000747277_100000690095 [0,2,0,0,0,0|1,0,0]=3 7229 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(n2)C 11a_100011824523_100000690095 [0,2,0,0,0,0|2,0,0]=4 7230 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(n2)C 1626a_100011824523_100000690095 [0,2,0,0,0,0|2,0,0]=4 7231 B22R2.4534 Cc1cccc(c1)C=CC(=O)NCCc2cccc(n2)C 240690a_100011824523_100000690095 [0,2,0,0,0,0|2,0,0]=4 7232 B22R2.4534 Cc1cccc(c1)C=CC(=O)NNCc2cccc(c2)Br 22a_100000686200_100000690095 [0,2,0,0,0,0|2,0,0]=4 7233 B22R2.4534 Cc1cccc(c1)C=CC(=O)NNCc2cccc(c2)C 22a_100000689898_100000690095 [0,2,0,0,0,0|2,0,0]=4 7234 B22R2.4534 Cc1cccc(c1)C=CC(=O)NNCc2cccc(c2)Cl 22a_100000685877_100000690095 [0,2,0,0,0,0|2,0,0]=4 7235 B22R2.4534 Cc1cccc(c1)C=CC(=O)NNCc2cccc(c2)F 22a_100016993953_100000690095 [0,2,0,0,0,0|2,0,0]=4 7236 B22R2.4534 Cc1cccc(c1)C=CC(=O)NNCc2cccc(c2)O 22a_100000008902_100000690095 [0,2,0,0,0,0|2,0,0]=4 7237 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)Br 11a_100000749837_100016258244 [0,2,0,0,0,0|1,0,0]=3 7238 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)Br 1626a_100000749837_100016258244 [0,2,0,0,0,0|1,0,0]=3 7239 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)Br 240690a_100000749837_100016258244 [0,2,0,0,0,0|1,0,0]=3 7240 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)Cl 11a_100000749837_100000184502 [0,2,0,0,0,0|1,0,0]=3 7241 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)Cl 1626a_100000749837_100000184502 [0,2,0,0,0,0|1,0,0]=3 7242 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)Cl 240690a_100000749837_100000184502 [0,2,0,0,0,0|1,0,0]=3 7243 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)F 11a_100000749837_100000718793 [0,2,0,0,0,0|1,0,0]=3 7244 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)F 1626a_100000749837_100000718793 [0,2,0,0,0,0|1,0,0]=3 7245 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)F 240690a_100000749837_100000718793 [0,2,0,0,0,0|1,0,0]=3 7246 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)I 11a_100000749837_100020647043 [0,2,0,0,0,0|1,0,0]=3 7247 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)I 1626a_100000749837_100020647043 [0,2,0,0,0,0|1,0,0]=3 7248 B22R2.4534 Cc1cccc(c1)CCNC(=O)C=Cc2cccc(c2)I 240690a_100000749837_100020647043 [0,2,0,0,0,0|1,0,0]=3 7249 B22R2.4534 Cc1cccc(c1)CNNC(=O)C=Cc2cccc(c2)Br 22a_100000689898_100016258244 [0,2,0,0,0,0|2,0,0]=4 7250 B22R2.4534 Cc1cccc(c1)CNNC(=O)C=Cc2cccc(c2)Cl 22a_100000689898_100000184502 [0,2,0,0,0,0|2,0,0]=4 7251 B22R2.4534 Cc1cccc(c1)CNNC(=O)C=Cc2cccc(c2)F 22a_100000689898_100000718793 [0,2,0,0,0,0|2,0,0]=4 7252 B22R2.4534 Cc1cccc(c1)CNNC(=O)C=Cc2cccc(c2)I 22a_100000689898_100020647043 [0,2,0,0,0,0|2,0,0]=4 7253 B22R2.4534 Cc1cccc(c1)CNNC(=O)C=Cc2cccc(c2)O 22a_100000689898_100102525460 [0,2,0,0,0,0|2,0,0]=4 7254 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)Br 11a_100011824523_100016258244 [0,2,0,0,0,0|2,0,0]=4 7255 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)Br 1626a_100011824523_100016258244 [0,2,0,0,0,0|2,0,0]=4 7256 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)Br 240690a_100011824523_100016258244 [0,2,0,0,0,0|2,0,0]=4 7257 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)Cl 11a_100011824523_100000184502 [0,2,0,0,0,0|2,0,0]=4 7258 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)Cl 1626a_100011824523_100000184502 [0,2,0,0,0,0|2,0,0]=4 7259 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)Cl 240690a_100011824523_100000184502 [0,2,0,0,0,0|2,0,0]=4 7260 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)F 11a_100011824523_100000718793 [0,2,0,0,0,0|2,0,0]=4 7261 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)F 1626a_100011824523_100000718793 [0,2,0,0,0,0|2,0,0]=4 7262 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)F 240690a_100011824523_100000718793 [0,2,0,0,0,0|2,0,0]=4 7263 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)I 11a_100011824523_100020647043 [0,2,0,0,0,0|2,0,0]=4 7264 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)I 1626a_100011824523_100020647043 [0,2,0,0,0,0|2,0,0]=4 7265 B22R2.4534 Cc1cccc(n1)CCNC(=O)C=Cc2cccc(c2)I 240690a_100011824523_100020647043 [0,2,0,0,0,0|2,0,0]=4 7266 B22R2.4534 O=C(C=Cc1cccc(c1)Br)CCCc2cccc(c2)Br 1458a_100016258244_100011713683 [0,2,0,0,0,0|1,0,0]=3 7267 B22R2.4534 O=C(C=Cc1cccc(c1)Br)CCCc2cccc(c2)F 1458a_100016258244_200000698031 [0,2,0,0,0,0|1,0,0]=3 7268 B22R2.4534 O=C(C=Cc1cccc(c1)Br)CCOc2cccc(c2)Br 1458a_100016258244_100000183150 [0,2,0,0,0,0|2,0,0]=4 7269 B22R2.4534 O=C(C=Cc1cccc(c1)Br)CCOc2cccc(c2)Cl 1458a_100016258244_100000181161 [0,2,0,0,0,0|2,0,0]=4 7270 B22R2.4534 O=C(C=Cc1cccc(c1)Br)CCOc2cccc(c2)F 1458a_100016258244_100000739188 [0,2,0,0,0,0|2,0,0]=4 7271 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)Br 11a_100011207229_100016258244 [0,2,0,0,0,0|1,0,0]=3 7272 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)Br 1626a_100011207229_100016258244 [0,2,0,0,0,0|1,0,0]=3 7273 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)Br 240690a_100011207229_100016258244 [0,2,0,0,0,0|1,0,0]=3 7274 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)Cl 11a_100000185263_100016258244 [0,2,0,0,0,0|1,0,0]=3 7275 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)Cl 1626a_100000185263_100016258244 [0,2,0,0,0,0|1,0,0]=3 7276 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)Cl 240690a_100000185263_100016258244 [0,2,0,0,0,0|1,0,0]=3 7277 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)F 11a_100000205154_100016258244 [0,2,0,0,0,0|1,0,0]=3 7278 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)F 1626a_100000205154_100016258244 [0,2,0,0,0,0|1,0,0]=3 7279 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)F 240690a_100000205154_100016258244 [0,2,0,0,0,0|1,0,0]=3 7280 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NCCc2cccc(c2)O 240690a_100000747277_100016258244 [0,2,0,0,0,0|1,0,0]=3 7281 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NNCc2cccc(c2)Br 22a_100000686200_100016258244 [0,2,0,0,0,0|2,0,0]=4 7282 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NNCc2cccc(c2)Cl 22a_100000685877_100016258244 [0,2,0,0,0,0|2,0,0]=4 7283 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NNCc2cccc(c2)F 22a_100016993953_100016258244 [0,2,0,0,0,0|2,0,0]=4 7284 B22R2.4534 O=C(C=Cc1cccc(c1)Br)NNCc2cccc(c2)O 22a_100000008902_100016258244 [0,2,0,0,0,0|2,0,0]=4 7285 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)CCCc2cccc(c2)Br 1458a_100000184502_100011713683 [0,2,0,0,0,0|1,0,0]=3 7286 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)CCCc2cccc(c2)F 1458a_100000184502_200000698031 [0,2,0,0,0,0|1,0,0]=3 7287 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)CCOc2cccc(c2)Br 1458a_100000184502_100000183150 [0,2,0,0,0,0|2,0,0]=4 7288 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)CCOc2cccc(c2)Cl 1458a_100000184502_100000181161 [0,2,0,0,0,0|2,0,0]=4 7289 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)CCOc2cccc(c2)F 1458a_100000184502_100000739188 [0,2,0,0,0,0|2,0,0]=4 7290 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)Br 11a_100011207229_100000184502 [0,2,0,0,0,0|1,0,0]=3 7291 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)Br 1626a_100011207229_100000184502 [0,2,0,0,0,0|1,0,0]=3 7292 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)Br 240690a_100011207229_100000184502 [0,2,0,0,0,0|1,0,0]=3 7293 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)Cl 11a_100000185263_100000184502 [0,2,0,0,0,0|1,0,0]=3 7294 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)Cl 1626a_100000185263_100000184502 [0,2,0,0,0,0|1,0,0]=3 7295 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)Cl 240690a_100000185263_100000184502 [0,2,0,0,0,0|1,0,0]=3 7296 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)F 11a_100000205154_100000184502 [0,2,0,0,0,0|1,0,0]=3 7297 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)F 1626a_100000205154_100000184502 [0,2,0,0,0,0|1,0,0]=3 7298 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)F 240690a_100000205154_100000184502 [0,2,0,0,0,0|1,0,0]=3 7299 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NCCc2cccc(c2)O 240690a_100000747277_100000184502 [0,2,0,0,0,0|1,0,0]=3 7300 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NNCc2cccc(c2)Br 22a_100000686200_100000184502 [0,2,0,0,0,0|2,0,0]=4 7301 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NNCc2cccc(c2)Cl 22a_100000685877_100000184502 [0,2,0,0,0,0|2,0,0]=4 7302 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NNCc2cccc(c2)F 22a_100016993953_100000184502 [0,2,0,0,0,0|2,0,0]=4 7303 B22R2.4534 O=C(C=Cc1cccc(c1)Cl)NNCc2cccc(c2)O 22a_100000008902_100000184502 [0,2,0,0,0,0|2,0,0]=4 7304 B22R2.4534 O=C(C=Cc1cccc(c1)F)CCCc2cccc(c2)Br 1458a_100000718793_100011713683 [0,2,0,0,0,0|1,0,0]=3 7305 B22R2.4534 O=C(C=Cc1cccc(c1)F)CCCc2cccc(c2)F 1458a_100000718793_200000698031 [0,2,0,0,0,0|1,0,0]=3 7306 B22R2.4534 O=C(C=Cc1cccc(c1)F)CCOc2cccc(c2)Br 1458a_100000718793_100000183150 [0,2,0,0,0,0|2,0,0]=4 7307 B22R2.4534 O=C(C=Cc1cccc(c1)F)CCOc2cccc(c2)Cl 1458a_100000718793_100000181161 [0,2,0,0,0,0|2,0,0]=4 7308 B22R2.4534 O=C(C=Cc1cccc(c1)F)CCOc2cccc(c2)F 1458a_100000718793_100000739188 [0,2,0,0,0,0|2,0,0]=4 7309 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)Br 11a_100011207229_100000718793 [0,2,0,0,0,0|1,0,0]=3 7310 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)Br 1626a_100011207229_100000718793 [0,2,0,0,0,0|1,0,0]=3 7311 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)Br 240690a_100011207229_100000718793 [0,2,0,0,0,0|1,0,0]=3 7312 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)Cl 11a_100000185263_100000718793 [0,2,0,0,0,0|1,0,0]=3 7313 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)Cl 1626a_100000185263_100000718793 [0,2,0,0,0,0|1,0,0]=3 7314 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)Cl 240690a_100000185263_100000718793 [0,2,0,0,0,0|1,0,0]=3 7315 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)F 11a_100000205154_100000718793 [0,2,0,0,0,0|1,0,0]=3 7316 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)F 1626a_100000205154_100000718793 [0,2,0,0,0,0|1,0,0]=3 7317 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)F 240690a_100000205154_100000718793 [0,2,0,0,0,0|1,0,0]=3 7318 B22R2.4534 O=C(C=Cc1cccc(c1)F)NCCc2cccc(c2)O 240690a_100000747277_100000718793 [0,2,0,0,0,0|1,0,0]=3 7319 B22R2.4534 O=C(C=Cc1cccc(c1)F)NNCc2cccc(c2)Br 22a_100000686200_100000718793 [0,2,0,0,0,0|2,0,0]=4 7320 B22R2.4534 O=C(C=Cc1cccc(c1)F)NNCc2cccc(c2)Cl 22a_100000685877_100000718793 [0,2,0,0,0,0|2,0,0]=4 7321 B22R2.4534 O=C(C=Cc1cccc(c1)F)NNCc2cccc(c2)F 22a_100016993953_100000718793 [0,2,0,0,0,0|2,0,0]=4 7322 B22R2.4534 O=C(C=Cc1cccc(c1)F)NNCc2cccc(c2)O 22a_100000008902_100000718793 [0,2,0,0,0,0|2,0,0]=4 7323 B22R2.4534 O=C(C=Cc1cccc(c1)I)CCCc2cccc(c2)Br 1458a_100020647043_100011713683 [0,2,0,0,0,0|1,0,0]=3 7324 B22R2.4534 O=C(C=Cc1cccc(c1)I)CCCc2cccc(c2)F 1458a_100020647043_200000698031 [0,2,0,0,0,0|1,0,0]=3 7325 B22R2.4534 O=C(C=Cc1cccc(c1)I)CCOc2cccc(c2)Br 1458a_100020647043_100000183150 [0,2,0,0,0,0|2,0,0]=4 7326 B22R2.4534 O=C(C=Cc1cccc(c1)I)CCOc2cccc(c2)Cl 1458a_100020647043_100000181161 [0,2,0,0,0,0|2,0,0]=4 7327 B22R2.4534 O=C(C=Cc1cccc(c1)I)CCOc2cccc(c2)F 1458a_100020647043_100000739188 [0,2,0,0,0,0|2,0,0]=4 7328 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)Br 11a_100011207229_100020647043 [0,2,0,0,0,0|1,0,0]=3 7329 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)Br 1626a_100011207229_100020647043 [0,2,0,0,0,0|1,0,0]=3 7330 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)Br 240690a_100011207229_100020647043 [0,2,0,0,0,0|1,0,0]=3 7331 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)Cl 11a_100000185263_100020647043 [0,2,0,0,0,0|1,0,0]=3 7332 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)Cl 1626a_100000185263_100020647043 [0,2,0,0,0,0|1,0,0]=3 7333 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)Cl 240690a_100000185263_100020647043 [0,2,0,0,0,0|1,0,0]=3 7334 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)F 11a_100000205154_100020647043 [0,2,0,0,0,0|1,0,0]=3 7335 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)F 1626a_100000205154_100020647043 [0,2,0,0,0,0|1,0,0]=3 7336 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)F 240690a_100000205154_100020647043 [0,2,0,0,0,0|1,0,0]=3 7337 B22R2.4534 O=C(C=Cc1cccc(c1)I)NCCc2cccc(c2)O 240690a_100000747277_100020647043 [0,2,0,0,0,0|1,0,0]=3 7338 B22R2.4534 O=C(C=Cc1cccc(c1)I)NNCc2cccc(c2)Br 22a_100000686200_100020647043 [0,2,0,0,0,0|2,0,0]=4 7339 B22R2.4534 O=C(C=Cc1cccc(c1)I)NNCc2cccc(c2)Cl 22a_100000685877_100020647043 [0,2,0,0,0,0|2,0,0]=4 7340 B22R2.4534 O=C(C=Cc1cccc(c1)I)NNCc2cccc(c2)F 22a_100016993953_100020647043 [0,2,0,0,0,0|2,0,0]=4 7341 B22R2.4534 O=C(C=Cc1cccc(c1)I)NNCc2cccc(c2)O 22a_100000008902_100020647043 [0,2,0,0,0,0|2,0,0]=4 7342 B22R2.4534 O=C(C=Cc1cccc(c1)O)NNCc2cccc(c2)Br 22a_100000686200_100102525460 [0,2,0,0,0,0|2,0,0]=4 7343 B22R2.4534 O=C(C=Cc1cccc(c1)O)NNCc2cccc(c2)Cl 22a_100000685877_100102525460 [0,2,0,0,0,0|2,0,0]=4 7344 B22R2.4534 O=C(C=Cc1cccc(c1)O)NNCc2cccc(c2)F 22a_100016993953_100102525460 [0,2,0,0,0,0|2,0,0]=4 7345 B22R2.4534 O=C(C=Cc1cccc(c1)O)NNCc2cccc(c2)O 22a_100000008902_100102525460 [0,2,0,0,0,0|2,0,0]=4 7346 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)CCCc2cccc(c2)Br 1458a_100016990649_100011713683 [0,2,0,0,0,0|1,0,0]=3 7347 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)CCCc2cccc(c2)F 1458a_100016990649_200000698031 [0,2,0,0,0,0|1,0,0]=3 7348 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)CCOc2cccc(c2)Br 1458a_100016990649_100000183150 [0,2,0,0,0,0|2,0,0]=4 7349 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)CCOc2cccc(c2)Cl 1458a_100016990649_100000181161 [0,2,0,0,0,0|2,0,0]=4 7350 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)CCOc2cccc(c2)F 1458a_100016990649_100000739188 [0,2,0,0,0,0|2,0,0]=4 7351 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)Br 11a_100011207229_100016990649 [0,2,0,0,0,0|1,0,0]=3 7352 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)Br 1626a_100011207229_100016990649 [0,2,0,0,0,0|1,0,0]=3 7353 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)Br 527a_100011207229_100016990649 [0,2,0,0,0,0|1,0,0]=3 7354 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)C 11a_100000749837_100016990649 [0,2,0,0,0,0|1,0,0]=3 7355 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)C 1626a_100000749837_100016990649 [0,2,0,0,0,0|1,0,0]=3 7356 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)C 527a_100000749837_100016990649 [0,2,0,0,0,0|1,0,0]=3 7357 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)Cl 11a_100000185263_100016990649 [0,2,0,0,0,0|1,0,0]=3 7358 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)Cl 1626a_100000185263_100016990649 [0,2,0,0,0,0|1,0,0]=3 7359 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)Cl 527a_100000185263_100016990649 [0,2,0,0,0,0|1,0,0]=3 7360 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)F 11a_100000205154_100016990649 [0,2,0,0,0,0|1,0,0]=3 7361 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)F 1626a_100000205154_100016990649 [0,2,0,0,0,0|1,0,0]=3 7362 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)F 527a_100000205154_100016990649 [0,2,0,0,0,0|1,0,0]=3 7363 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(c2)O 527a_100000747277_100016990649 [0,2,0,0,0,0|1,0,0]=3 7364 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(n2)C 11a_100011824523_100016990649 [0,2,0,0,0,0|2,0,0]=4 7365 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(n2)C 1626a_100011824523_100016990649 [0,2,0,0,0,0|2,0,0]=4 7366 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NCCc2cccc(n2)C 527a_100011824523_100016990649 [0,2,0,0,0,0|2,0,0]=4 7367 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NNCc2cccc(c2)Br 22a_100000686200_100016990649 [0,2,0,0,0,0|2,0,0]=4 7368 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NNCc2cccc(c2)C 22a_100000689898_100016990649 [0,2,0,0,0,0|2,0,0]=4 7369 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NNCc2cccc(c2)Cl 22a_100000685877_100016990649 [0,2,0,0,0,0|2,0,0]=4 7370 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NNCc2cccc(c2)F 22a_100016993953_100016990649 [0,2,0,0,0,0|2,0,0]=4 7371 B22R2.4545 C/C(=C\c1ccccc1)/C(=O)NNCc2cccc(c2)O 22a_100000008902_100016990649 [0,2,0,0,0,0|2,0,0]=4 7372 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)CCCc2cccc(c2)Br 1458a_100025712827_100011713683 [0,2,0,0,0,0|2,0,0]=4 7373 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)CCCc2cccc(c2)F 1458a_100025712827_200000698031 [0,2,0,0,0,0|2,0,0]=4 7374 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)Br 11a_100011207229_100025712827 [0,2,0,0,0,0|2,0,0]=4 7375 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)Br 1626a_100011207229_100025712827 [0,2,0,0,0,0|2,0,0]=4 7376 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)Br 527a_100011207229_100025712827 [0,2,0,0,0,0|2,0,0]=4 7377 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)C 11a_100000749837_100025712827 [0,2,0,0,0,0|2,0,0]=4 7378 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)C 1626a_100000749837_100025712827 [0,2,0,0,0,0|2,0,0]=4 7379 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)C 527a_100000749837_100025712827 [0,2,0,0,0,0|2,0,0]=4 7380 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)Cl 11a_100000185263_100025712827 [0,2,0,0,0,0|2,0,0]=4 7381 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)Cl 1626a_100000185263_100025712827 [0,2,0,0,0,0|2,0,0]=4 7382 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)Cl 527a_100000185263_100025712827 [0,2,0,0,0,0|2,0,0]=4 7383 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)F 11a_100000205154_100025712827 [0,2,0,0,0,0|2,0,0]=4 7384 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)F 1626a_100000205154_100025712827 [0,2,0,0,0,0|2,0,0]=4 7385 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)F 527a_100000205154_100025712827 [0,2,0,0,0,0|2,0,0]=4 7386 B22R2.4545 C/C(=C\c1ccccn1)/C(=O)NCCc2cccc(c2)O 527a_100000747277_100025712827 [0,2,0,0,0,0|2,0,0]=4 7387 B22R2.4545 C=C(Cc1ccccc1)C(=O)NCCc2cccc(c2)Br 11a_100011207229_100000066491 [0,2,0,0,0,0|1,0,1]=4 7388 B22R2.4545 C=C(Cc1ccccc1)C(=O)NCCc2cccc(c2)Br 1626a_100011207229_100000066491 [0,2,0,0,0,0|1,0,1]=4 7389 B22R2.4545 C=C(Cc1ccccc1)C(=O)NCCc2cccc(c2)C 11a_100000749837_100000066491 [0,2,0,0,0,0|1,0,1]=4 7390 B22R2.4545 C=C(Cc1ccccc1)C(=O)NCCc2cccc(c2)C 1626a_100000749837_100000066491 [0,2,0,0,0,0|1,0,1]=4 7391 B22R2.4545 C=C(Cc1ccccc1)C(=O)NCCc2cccc(c2)Cl 11a_100000185263_100000066491 [0,2,0,0,0,0|1,0,1]=4 7392 B22R2.4545 C=C(Cc1ccccc1)C(=O)NCCc2cccc(c2)Cl 1626a_100000185263_100000066491 [0,2,0,0,0,0|1,0,1]=4 7393 B22R2.4545 C=C(Cc1ccccc1)C(=O)NCCc2cccc(c2)F 11a_100000205154_100000066491 [0,2,0,0,0,0|1,0,1]=4 7394 B22R2.4545 C=C(Cc1ccccc1)C(=O)NCCc2cccc(c2)F 1626a_100000205154_100000066491 [0,2,0,0,0,0|1,0,1]=4 7395 B22R2.4545 Cc1cccc(c1)CCNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000749837_200020598536 [0,2,0,0,0,0|1,0,0]=3 7396 B22R2.4545 Cc1cccc(c1)CCNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000749837_200020598536 [0,2,0,0,0,0|1,0,0]=3 7397 B22R2.4545 Cc1cccc(c1)CCNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000749837_200020598536 [0,2,0,0,0,0|1,0,0]=3 7398 B22R2.4545 Cc1cccc(c1)CCNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000749837_200020598536 [0,2,0,0,0,0|1,0,0]=3 7399 B22R2.4545 Cc1cccc(c1)CCNC(=O)/C(=C\c2ccccc2)/F 11a_100000749837_100020889036 [0,2,0,0,0,0|1,0,0]=3 7400 B22R2.4545 Cc1cccc(c1)CCNC(=O)/C(=C\c2ccccc2)/F 527a_100000749837_100020889036 [0,2,0,0,0,0|1,0,0]=3 7401 B22R2.4545 Cc1cccc(c1)CCNC(=O)C(=Cc2cccnc2)F 11a_100000749837_100000731744 [0,2,0,0,0,0|2,0,0]=4 7402 B22R2.4545 Cc1cccc(c1)CCNC(=O)C(=Cc2cccnc2)F 240690a_100000749837_100000731744 [0,2,0,0,0,0|2,0,0]=4 7403 B22R2.4545 Cc1cccc(c1)CCNC(=O)C(=Cc2cccnc2)F 527a_100000749837_100000731744 [0,2,0,0,0,0|2,0,0]=4 7404 B22R2.4545 Cc1cccc(c1)CCNC(=O)C(=O)Nc2ccccc2 240690a_100000749837_100000738435 [0,2,0,0,0,0|2,0,0]=4 7405 B22R2.4545 Cc1cccc(c1)CNNC(=O)/C(=C/c2ccccc2)/Cl 22a_100000689898_200020598536 [0,2,0,0,0,0|2,0,0]=4 7406 B22R2.4545 Cc1cccc(c1)CNNC(=O)/C(=C\c2ccccc2)/F 22a_100000689898_100020889036 [0,2,0,0,0,0|2,0,0]=4 7407 B22R2.4545 Cc1cccc(n1)CCNC(=O)/C(=C/c2ccccc2)/Cl 11a_100011824523_200020598536 [0,2,0,0,0,0|2,0,0]=4 7408 B22R2.4545 Cc1cccc(n1)CCNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100011824523_200020598536 [0,2,0,0,0,0|2,0,0]=4 7409 B22R2.4545 Cc1cccc(n1)CCNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100011824523_200020598536 [0,2,0,0,0,0|2,0,0]=4 7410 B22R2.4545 Cc1cccc(n1)CCNC(=O)/C(=C/c2ccccc2)/Cl 527a_100011824523_200020598536 [0,2,0,0,0,0|2,0,0]=4 7411 B22R2.4545 Cc1cccc(n1)CCNC(=O)/C(=C\c2ccccc2)/F 11a_100011824523_100020889036 [0,2,0,0,0,0|2,0,0]=4 7412 B22R2.4545 Cc1cccc(n1)CCNC(=O)/C(=C\c2ccccc2)/F 527a_100011824523_100020889036 [0,2,0,0,0,0|2,0,0]=4 7413 B22R2.4545 O=C(CCCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011713683 [0,2,0,0,0,0|1,0,0]=3 7414 B22R2.4545 O=C(CCCc1cccc(c1)Br)/C(=C\c2ccccc2)/F 1458a_100020889036_100011713683 [0,2,0,0,0,0|1,0,0]=3 7415 B22R2.4545 O=C(CCCc1cccc(c1)Br)C(=Cc2cccnc2)F 1458a_100000731744_100011713683 [0,2,0,0,0,0|2,0,0]=4 7416 B22R2.4545 O=C(CCCc1cccc(c1)Br)C(=O)Nc2ccccc2 1458a_100000738435_100011713683 [0,2,0,0,0,0|2,0,0]=4 7417 B22R2.4545 O=C(CCCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200000698031 [0,2,0,0,0,0|1,0,0]=3 7418 B22R2.4545 O=C(CCCc1cccc(c1)F)/C(=C\c2ccccc2)/F 1458a_100020889036_200000698031 [0,2,0,0,0,0|1,0,0]=3 7419 B22R2.4545 O=C(CCCc1cccc(c1)F)C(=Cc2cccnc2)F 1458a_100000731744_200000698031 [0,2,0,0,0,0|2,0,0]=4 7420 B22R2.4545 O=C(CCCc1cccc(c1)F)C(=O)Nc2ccccc2 1458a_100000738435_200000698031 [0,2,0,0,0,0|2,0,0]=4 7421 B22R2.4545 O=C(CCOc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000183150 [0,2,0,0,0,0|2,0,0]=4 7422 B22R2.4545 O=C(CCOc1cccc(c1)Br)/C(=C\c2ccccc2)/F 1458a_100020889036_100000183150 [0,2,0,0,0,0|2,0,0]=4 7423 B22R2.4545 O=C(CCOc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000181161 [0,2,0,0,0,0|2,0,0]=4 7424 B22R2.4545 O=C(CCOc1cccc(c1)Cl)/C(=C\c2ccccc2)/F 1458a_100020889036_100000181161 [0,2,0,0,0,0|2,0,0]=4 7425 B22R2.4545 O=C(CCOc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000739188 [0,2,0,0,0,0|2,0,0]=4 7426 B22R2.4545 O=C(CCOc1cccc(c1)F)/C(=C\c2ccccc2)/F 1458a_100020889036_100000739188 [0,2,0,0,0,0|2,0,0]=4 7427 B22R2.4545 O=C(NCCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 11a_100011207229_200020598536 [0,2,0,0,0,0|1,0,0]=3 7428 B22R2.4545 O=C(NCCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 1626a_100011207229_200020598536 [0,2,0,0,0,0|1,0,0]=3 7429 B22R2.4545 O=C(NCCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 240690a_100011207229_200020598536 [0,2,0,0,0,0|1,0,0]=3 7430 B22R2.4545 O=C(NCCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 527a_100011207229_200020598536 [0,2,0,0,0,0|1,0,0]=3 7431 B22R2.4545 O=C(NCCc1cccc(c1)Br)/C(=C\c2ccccc2)/F 11a_100011207229_100020889036 [0,2,0,0,0,0|1,0,0]=3 7432 B22R2.4545 O=C(NCCc1cccc(c1)Br)/C(=C\c2ccccc2)/F 527a_100011207229_100020889036 [0,2,0,0,0,0|1,0,0]=3 7433 B22R2.4545 O=C(NCCc1cccc(c1)Br)C(=Cc2cccnc2)F 11a_100011207229_100000731744 [0,2,0,0,0,0|2,0,0]=4 7434 B22R2.4545 O=C(NCCc1cccc(c1)Br)C(=Cc2cccnc2)F 240690a_100011207229_100000731744 [0,2,0,0,0,0|2,0,0]=4 7435 B22R2.4545 O=C(NCCc1cccc(c1)Br)C(=Cc2cccnc2)F 527a_100011207229_100000731744 [0,2,0,0,0,0|2,0,0]=4 7436 B22R2.4545 O=C(NCCc1cccc(c1)Br)C(=O)Nc2ccccc2 240690a_100011207229_100000738435 [0,2,0,0,0,0|2,0,0]=4 7437 B22R2.4545 O=C(NCCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 11a_100000185263_200020598536 [0,2,0,0,0,0|1,0,0]=3 7438 B22R2.4545 O=C(NCCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100000185263_200020598536 [0,2,0,0,0,0|1,0,0]=3 7439 B22R2.4545 O=C(NCCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100000185263_200020598536 [0,2,0,0,0,0|1,0,0]=3 7440 B22R2.4545 O=C(NCCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 527a_100000185263_200020598536 [0,2,0,0,0,0|1,0,0]=3 7441 B22R2.4545 O=C(NCCc1cccc(c1)Cl)/C(=C\c2ccccc2)/F 11a_100000185263_100020889036 [0,2,0,0,0,0|1,0,0]=3 7442 B22R2.4545 O=C(NCCc1cccc(c1)Cl)/C(=C\c2ccccc2)/F 527a_100000185263_100020889036 [0,2,0,0,0,0|1,0,0]=3 7443 B22R2.4545 O=C(NCCc1cccc(c1)Cl)C(=Cc2cccnc2)F 11a_100000185263_100000731744 [0,2,0,0,0,0|2,0,0]=4 7444 B22R2.4545 O=C(NCCc1cccc(c1)Cl)C(=Cc2cccnc2)F 240690a_100000185263_100000731744 [0,2,0,0,0,0|2,0,0]=4 7445 B22R2.4545 O=C(NCCc1cccc(c1)Cl)C(=Cc2cccnc2)F 527a_100000185263_100000731744 [0,2,0,0,0,0|2,0,0]=4 7446 B22R2.4545 O=C(NCCc1cccc(c1)Cl)C(=O)Nc2ccccc2 240690a_100000185263_100000738435 [0,2,0,0,0,0|2,0,0]=4 7447 B22R2.4545 O=C(NCCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 11a_100000205154_200020598536 [0,2,0,0,0,0|1,0,0]=3 7448 B22R2.4545 O=C(NCCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 1626a_100000205154_200020598536 [0,2,0,0,0,0|1,0,0]=3 7449 B22R2.4545 O=C(NCCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 240690a_100000205154_200020598536 [0,2,0,0,0,0|1,0,0]=3 7450 B22R2.4545 O=C(NCCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 527a_100000205154_200020598536 [0,2,0,0,0,0|1,0,0]=3 7451 B22R2.4545 O=C(NCCc1cccc(c1)F)/C(=C\c2ccccc2)/F 11a_100000205154_100020889036 [0,2,0,0,0,0|1,0,0]=3 7452 B22R2.4545 O=C(NCCc1cccc(c1)F)/C(=C\c2ccccc2)/F 527a_100000205154_100020889036 [0,2,0,0,0,0|1,0,0]=3 7453 B22R2.4545 O=C(NCCc1cccc(c1)F)C(=Cc2cccnc2)F 11a_100000205154_100000731744 [0,2,0,0,0,0|2,0,0]=4 7454 B22R2.4545 O=C(NCCc1cccc(c1)F)C(=Cc2cccnc2)F 240690a_100000205154_100000731744 [0,2,0,0,0,0|2,0,0]=4 7455 B22R2.4545 O=C(NCCc1cccc(c1)F)C(=Cc2cccnc2)F 527a_100000205154_100000731744 [0,2,0,0,0,0|2,0,0]=4 7456 B22R2.4545 O=C(NCCc1cccc(c1)F)C(=O)Nc2ccccc2 240690a_100000205154_100000738435 [0,2,0,0,0,0|2,0,0]=4 7457 B22R2.4545 O=C(NCCc1cccc(c1)O)/C(=C/c2ccccc2)/Cl 240690a_100000747277_200020598536 [0,2,0,0,0,0|1,0,0]=3 7458 B22R2.4545 O=C(NCCc1cccc(c1)O)/C(=C/c2ccccc2)/Cl 527a_100000747277_200020598536 [0,2,0,0,0,0|1,0,0]=3 7459 B22R2.4545 O=C(NCCc1cccc(c1)O)/C(=C\c2ccccc2)/F 527a_100000747277_100020889036 [0,2,0,0,0,0|1,0,0]=3 7460 B22R2.4545 O=C(NCCc1cccc(c1)O)C(=Cc2cccnc2)F 240690a_100000747277_100000731744 [0,2,0,0,0,0|2,0,0]=4 7461 B22R2.4545 O=C(NCCc1cccc(c1)O)C(=Cc2cccnc2)F 527a_100000747277_100000731744 [0,2,0,0,0,0|2,0,0]=4 7462 B22R2.4545 O=C(NCCc1cccc(c1)O)C(=O)Nc2ccccc2 240690a_100000747277_100000738435 [0,2,0,0,0,0|2,0,0]=4 7463 B22R2.4545 O=C(NNCc1cccc(c1)Br)/C(=C/c2ccccc2)/Cl 22a_100000686200_200020598536 [0,2,0,0,0,0|2,0,0]=4 7464 B22R2.4545 O=C(NNCc1cccc(c1)Br)/C(=C\c2ccccc2)/F 22a_100000686200_100020889036 [0,2,0,0,0,0|2,0,0]=4 7465 B22R2.4545 O=C(NNCc1cccc(c1)Cl)/C(=C/c2ccccc2)/Cl 22a_100000685877_200020598536 [0,2,0,0,0,0|2,0,0]=4 7466 B22R2.4545 O=C(NNCc1cccc(c1)Cl)/C(=C\c2ccccc2)/F 22a_100000685877_100020889036 [0,2,0,0,0,0|2,0,0]=4 7467 B22R2.4545 O=C(NNCc1cccc(c1)F)/C(=C/c2ccccc2)/Cl 22a_100016993953_200020598536 [0,2,0,0,0,0|2,0,0]=4 7468 B22R2.4545 O=C(NNCc1cccc(c1)F)/C(=C\c2ccccc2)/F 22a_100016993953_100020889036 [0,2,0,0,0,0|2,0,0]=4 7469 B22R2.4545 O=C(NNCc1cccc(c1)O)/C(=C/c2ccccc2)/Cl 22a_100000008902_200020598536 [0,2,0,0,0,0|2,0,0]=4 7470 B22R2.4545 O=C(NNCc1cccc(c1)O)/C(=C\c2ccccc2)/F 22a_100000008902_100020889036 [0,2,0,0,0,0|2,0,0]=4 7471 B22R2.4572 Cc1c(cccc1CCNC(=O)C=Cc2ccccc2)Br 11a_100161000114_100000210462 [0,2,0,0,0,0|1,0,0]=3 7472 B22R2.4572 Cc1c(cccc1CCNC(=O)C=Cc2ccccc2)Br 1626a_100161000114_100000210462 [0,2,0,0,0,0|1,0,0]=3 7473 B22R2.4572 Cc1c(cccc1CCNC(=O)C=Cc2ccccn2)Br 11a_100161000114_100000740811 [0,2,0,0,0,0|2,0,0]=4 7474 B22R2.4572 Cc1c(cccc1CCNC(=O)C=Cc2ccccn2)Br 240690a_100161000114_100000740811 [0,2,0,0,0,0|2,0,0]=4 7475 B22R2.4572 Cc1c(cccc1CCNC(=O)C=Cc2cccnc2)Br 11a_100161000114_100000735890 [0,2,0,0,0,0|2,0,0]=4 7476 B22R2.4572 Cc1c(cccc1CCNC(=O)C=Cc2cccnc2)Br 240690a_100161000114_100000735890 [0,2,0,0,0,0|2,0,0]=4 7477 B22R2.4572 Cc1c(cccc1CCNC(=O)C=Cc2ccncc2)Br 240690a_100161000114_100000682801 [0,2,0,0,0,0|2,0,0]=4 7478 B22R2.4572 O=C(C=Cc1ccccc1)NCCc2cccc(c2Cl)Cl 11a_100000741019_100000210462 [0,2,0,0,0,0|1,0,0]=3 7479 B22R2.4572 O=C(C=Cc1ccccc1)NCCc2cccc(c2Cl)Cl 1626a_100000741019_100000210462 [0,2,0,0,0,0|1,0,0]=3 7480 B22R2.4572 O=C(C=Cc1ccccn1)NCCc2cccc(c2Cl)Cl 11a_100000741019_100000740811 [0,2,0,0,0,0|2,0,0]=4 7481 B22R2.4572 O=C(C=Cc1ccccn1)NCCc2cccc(c2Cl)Cl 240690a_100000741019_100000740811 [0,2,0,0,0,0|2,0,0]=4 7482 B22R2.4572 O=C(C=Cc1cccnc1)NCCc2cccc(c2Cl)Cl 11a_100000741019_100000735890 [0,2,0,0,0,0|2,0,0]=4 7483 B22R2.4572 O=C(C=Cc1cccnc1)NCCc2cccc(c2Cl)Cl 240690a_100000741019_100000735890 [0,2,0,0,0,0|2,0,0]=4 7484 B22R2.4572 O=C(C=Cc1ccncc1)NCCc2cccc(c2Cl)Cl 240690a_100000741019_100000682801 [0,2,0,0,0,0|2,0,0]=4 7485 B22R2.4657 Cc1ccc(c(c1)CCNC(=O)C=Cc2ccccc2)C 11a_200011485678_100000210462 [0,2,0,0,0,0|1,0,0]=3 7486 B22R2.4657 Cc1ccc(c(c1)CCNC(=O)C=Cc2ccccc2)C 1626a_200011485678_100000210462 [0,2,0,0,0,0|1,0,0]=3 7487 B22R2.4657 Cc1ccc(c(c1)CCNC(=O)C=Cc2ccccn2)C 11a_200011485678_100000740811 [0,2,0,0,0,0|2,0,0]=4 7488 B22R2.4657 Cc1ccc(c(c1)CCNC(=O)C=Cc2ccccn2)C 240690a_200011485678_100000740811 [0,2,0,0,0,0|2,0,0]=4 7489 B22R2.4657 Cc1ccc(c(c1)CCNC(=O)C=Cc2cccnc2)C 11a_200011485678_100000735890 [0,2,0,0,0,0|2,0,0]=4 7490 B22R2.4657 Cc1ccc(c(c1)CCNC(=O)C=Cc2cccnc2)C 240690a_200011485678_100000735890 [0,2,0,0,0,0|2,0,0]=4 7491 B22R2.4657 Cc1ccc(c(c1)CCNC(=O)C=Cc2ccncc2)C 240690a_200011485678_100000682801 [0,2,0,0,0,0|2,0,0]=4 7492 B22R2.4657 Cc1ccc(c(c1)OCCC(=O)C=Cc2ccccc2)Cl 1458a_100000210462_100011277402 [0,2,0,0,0,0|2,0,0]=4 7493 B22R2.4657 O=C(C=Cc1ccccc1)CCOc2cc(ccc2Cl)Cl 1458a_100000210462_100000198575 [0,2,0,0,0,0|2,0,0]=4 7494 B22R2.4657 O=C(C=Cc1ccccc1)CCSc2cc(ccc2Cl)Cl 1458a_100000210462_100000180180 [0,2,0,0,0,0|2,0,0]=4 7495 B22R2.4657 O=C(C=Cc1ccccc1)NCCc2cc(ccc2Cl)Cl 11a_100000705354_100000210462 [0,2,0,0,0,0|1,0,0]=3 7496 B22R2.4657 O=C(C=Cc1ccccc1)NCCc2cc(ccc2Cl)Cl 1626a_100000705354_100000210462 [0,2,0,0,0,0|1,0,0]=3 7497 B22R2.4657 O=C(C=Cc1ccccc1)NCCc2cc(ccc2F)Cl 11a_200011997525_100000210462 [0,2,0,0,0,0|1,0,0]=3 7498 B22R2.4657 O=C(C=Cc1ccccc1)NCCc2cc(ccc2F)Cl 1626a_200011997525_100000210462 [0,2,0,0,0,0|1,0,0]=3 7499 B22R2.4657 O=C(C=Cc1ccccc1)NNCc2cc(ccc2Cl)Cl 22a_100000726884_100000210462 [0,2,0,0,0,0|2,0,0]=4 7500 B22R2.4657 O=C(C=Cc1ccccc1)NNCc2cc(ccc2F)Cl 22a_100020639595_100000210462 [0,2,0,0,0,0|2,0,0]=4 7501 B22R2.4657 O=C(C=Cc1ccccn1)NCCc2cc(ccc2Cl)Cl 11a_100000705354_100000740811 [0,2,0,0,0,0|2,0,0]=4 7502 B22R2.4657 O=C(C=Cc1ccccn1)NCCc2cc(ccc2Cl)Cl 240690a_100000705354_100000740811 [0,2,0,0,0,0|2,0,0]=4 7503 B22R2.4657 O=C(C=Cc1ccccn1)NCCc2cc(ccc2F)Cl 11a_200011997525_100000740811 [0,2,0,0,0,0|2,0,0]=4 7504 B22R2.4657 O=C(C=Cc1ccccn1)NCCc2cc(ccc2F)Cl 240690a_200011997525_100000740811 [0,2,0,0,0,0|2,0,0]=4 7505 B22R2.4657 O=C(C=Cc1cccnc1)NCCc2cc(ccc2Cl)Cl 11a_100000705354_100000735890 [0,2,0,0,0,0|2,0,0]=4 7506 B22R2.4657 O=C(C=Cc1cccnc1)NCCc2cc(ccc2Cl)Cl 240690a_100000705354_100000735890 [0,2,0,0,0,0|2,0,0]=4 7507 B22R2.4657 O=C(C=Cc1cccnc1)NCCc2cc(ccc2F)Cl 11a_200011997525_100000735890 [0,2,0,0,0,0|2,0,0]=4 7508 B22R2.4657 O=C(C=Cc1cccnc1)NCCc2cc(ccc2F)Cl 240690a_200011997525_100000735890 [0,2,0,0,0,0|2,0,0]=4 7509 B22R2.4657 O=C(C=Cc1ccncc1)NCCc2cc(ccc2Cl)Cl 240690a_100000705354_100000682801 [0,2,0,0,0,0|2,0,0]=4 7510 B22R2.4657 O=C(C=Cc1ccncc1)NCCc2cc(ccc2F)Cl 240690a_200011997525_100000682801 [0,2,0,0,0,0|2,0,0]=4 7511 B22R2.22837 Cc1ccc(cc1C)CCNC(=O)C=Cc2ccccc2 11a_100020591374_100000210462 [0,2,0,0,0,0|1,0,0]=3 7512 B22R2.22837 Cc1ccc(cc1C)CCNC(=O)C=Cc2ccccc2 1626a_100020591374_100000210462 [0,2,0,0,0,0|1,0,0]=3 7513 B22R2.22837 Cc1ccc(cc1C)CCNC(=O)C=Cc2ccccn2 11a_100020591374_100000740811 [0,2,0,0,0,0|2,0,0]=4 7514 B22R2.22837 Cc1ccc(cc1C)CCNC(=O)C=Cc2ccccn2 240690a_100020591374_100000740811 [0,2,0,0,0,0|2,0,0]=4 7515 B22R2.22837 Cc1ccc(cc1C)CCNC(=O)C=Cc2cccnc2 11a_100020591374_100000735890 [0,2,0,0,0,0|2,0,0]=4 7516 B22R2.22837 Cc1ccc(cc1C)CCNC(=O)C=Cc2cccnc2 240690a_100020591374_100000735890 [0,2,0,0,0,0|2,0,0]=4 7517 B22R2.22837 Cc1ccc(cc1C)CCNC(=O)C=Cc2ccncc2 240690a_100020591374_100000682801 [0,2,0,0,0,0|2,0,0]=4 7518 B22R2.22837 Cc1ccc(cc1C)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_200011210794 [0,2,0,0,0,0|2,0,0]=4 7519 B22R2.22837 O=C(C=Cc1ccccc1)CCOc2ccc(c(c2)Cl)F 1458a_100000210462_100011936913 [0,2,0,0,0,0|2,0,0]=4 7520 B22R2.22837 O=C(C=Cc1ccccc1)NCCc2ccc(c(c2)Cl)Cl 11a_100011207230_100000210462 [0,2,0,0,0,0|1,0,0]=3 7521 B22R2.22837 O=C(C=Cc1ccccc1)NCCc2ccc(c(c2)Cl)Cl 1626a_100011207230_100000210462 [0,2,0,0,0,0|1,0,0]=3 7522 B22R2.22837 O=C(C=Cc1ccccc1)NCCc2ccc(c(c2)Cl)F 11a_200011997520_100000210462 [0,2,0,0,0,0|1,0,0]=3 7523 B22R2.22837 O=C(C=Cc1ccccc1)NCCc2ccc(c(c2)Cl)F 1626a_200011997520_100000210462 [0,2,0,0,0,0|1,0,0]=3 7524 B22R2.22837 O=C(C=Cc1ccccc1)NCCc2ccc(c(c2)F)F 11a_200000706328_100000210462 [0,2,0,0,0,0|1,0,0]=3 7525 B22R2.22837 O=C(C=Cc1ccccc1)NCCc2ccc(c(c2)F)F 1626a_200000706328_100000210462 [0,2,0,0,0,0|1,0,0]=3 7526 B22R2.22837 O=C(C=Cc1ccccc1)NNCc2ccc(c(c2)Cl)Cl 22a_100015201915_100000210462 [0,2,0,0,0,0|2,0,0]=4 7527 B22R2.22837 O=C(C=Cc1ccccc1)NNCc2ccc(c(c2)Cl)F 22a_114901603628_100000210462 [0,2,0,0,0,0|2,0,0]=4 7528 B22R2.22837 O=C(C=Cc1ccccn1)NCCc2ccc(c(c2)Cl)Cl 11a_100011207230_100000740811 [0,2,0,0,0,0|2,0,0]=4 7529 B22R2.22837 O=C(C=Cc1ccccn1)NCCc2ccc(c(c2)Cl)Cl 240690a_100011207230_100000740811 [0,2,0,0,0,0|2,0,0]=4 7530 B22R2.22837 O=C(C=Cc1ccccn1)NCCc2ccc(c(c2)Cl)F 11a_200011997520_100000740811 [0,2,0,0,0,0|2,0,0]=4 7531 B22R2.22837 O=C(C=Cc1ccccn1)NCCc2ccc(c(c2)Cl)F 240690a_200011997520_100000740811 [0,2,0,0,0,0|2,0,0]=4 7532 B22R2.22837 O=C(C=Cc1ccccn1)NCCc2ccc(c(c2)F)F 11a_200000706328_100000740811 [0,2,0,0,0,0|2,0,0]=4 7533 B22R2.22837 O=C(C=Cc1ccccn1)NCCc2ccc(c(c2)F)F 240690a_200000706328_100000740811 [0,2,0,0,0,0|2,0,0]=4 7534 B22R2.22837 O=C(C=Cc1ccccn1)NCCc2ccc(c(c2)O)O 240690a_100000210387_100000740811 [0,2,0,0,0,0|2,0,0]=4 7535 B22R2.22837 O=C(C=Cc1cccnc1)NCCc2ccc(c(c2)Cl)Cl 11a_100011207230_100000735890 [0,2,0,0,0,0|2,0,0]=4 7536 B22R2.22837 O=C(C=Cc1cccnc1)NCCc2ccc(c(c2)Cl)Cl 240690a_100011207230_100000735890 [0,2,0,0,0,0|2,0,0]=4 7537 B22R2.22837 O=C(C=Cc1cccnc1)NCCc2ccc(c(c2)Cl)F 11a_200011997520_100000735890 [0,2,0,0,0,0|2,0,0]=4 7538 B22R2.22837 O=C(C=Cc1cccnc1)NCCc2ccc(c(c2)Cl)F 240690a_200011997520_100000735890 [0,2,0,0,0,0|2,0,0]=4 7539 B22R2.22837 O=C(C=Cc1cccnc1)NCCc2ccc(c(c2)F)F 11a_200000706328_100000735890 [0,2,0,0,0,0|2,0,0]=4 7540 B22R2.22837 O=C(C=Cc1cccnc1)NCCc2ccc(c(c2)F)F 240690a_200000706328_100000735890 [0,2,0,0,0,0|2,0,0]=4 7541 B22R2.22837 O=C(C=Cc1cccnc1)NCCc2ccc(c(c2)O)O 240690a_100000210387_100000735890 [0,2,0,0,0,0|2,0,0]=4 7542 B22R2.22837 O=C(C=Cc1ccncc1)NCCc2ccc(c(c2)Cl)Cl 240690a_100011207230_100000682801 [0,2,0,0,0,0|2,0,0]=4 7543 B22R2.22837 O=C(C=Cc1ccncc1)NCCc2ccc(c(c2)Cl)F 240690a_200011997520_100000682801 [0,2,0,0,0,0|2,0,0]=4 7544 B22R2.22837 O=C(C=Cc1ccncc1)NCCc2ccc(c(c2)F)F 240690a_200000706328_100000682801 [0,2,0,0,0,0|2,0,0]=4 7545 B22R2.22837 O=C(C=Cc1ccncc1)NCCc2ccc(c(c2)O)O 240690a_100000210387_100000682801 [0,2,0,0,0,0|2,0,0]=4 7546 B22R2.23173 Cc1ccc(cc1)C=CC(=O)CCCc2cccc(c2)Br 1458a_100000716854_100011713683 [0,2,0,0,0,0|1,0,0]=3 7547 B22R2.23173 Cc1ccc(cc1)C=CC(=O)CCCc2cccc(c2)F 1458a_100000716854_200000698031 [0,2,0,0,0,0|1,0,0]=3 7548 B22R2.23173 Cc1ccc(cc1)C=CC(=O)CCOc2cccc(c2)Br 1458a_100000716854_100000183150 [0,2,0,0,0,0|2,0,0]=4 7549 B22R2.23173 Cc1ccc(cc1)C=CC(=O)CCOc2cccc(c2)Cl 1458a_100000716854_100000181161 [0,2,0,0,0,0|2,0,0]=4 7550 B22R2.23173 Cc1ccc(cc1)C=CC(=O)CCOc2cccc(c2)F 1458a_100000716854_100000739188 [0,2,0,0,0,0|2,0,0]=4 7551 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)Br 11a_100011207229_100000716854 [0,2,0,0,0,0|1,0,0]=3 7552 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)Br 1626a_100011207229_100000716854 [0,2,0,0,0,0|1,0,0]=3 7553 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)Br 240690a_100011207229_100000716854 [0,2,0,0,0,0|1,0,0]=3 7554 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)C 11a_100000749837_100000716854 [0,2,0,0,0,0|1,0,0]=3 7555 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)C 1626a_100000749837_100000716854 [0,2,0,0,0,0|1,0,0]=3 7556 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)C 240690a_100000749837_100000716854 [0,2,0,0,0,0|1,0,0]=3 7557 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)Cl 11a_100000185263_100000716854 [0,2,0,0,0,0|1,0,0]=3 7558 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)Cl 1626a_100000185263_100000716854 [0,2,0,0,0,0|1,0,0]=3 7559 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)Cl 240690a_100000185263_100000716854 [0,2,0,0,0,0|1,0,0]=3 7560 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)F 11a_100000205154_100000716854 [0,2,0,0,0,0|1,0,0]=3 7561 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)F 1626a_100000205154_100000716854 [0,2,0,0,0,0|1,0,0]=3 7562 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)F 240690a_100000205154_100000716854 [0,2,0,0,0,0|1,0,0]=3 7563 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(c2)O 240690a_100000747277_100000716854 [0,2,0,0,0,0|1,0,0]=3 7564 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(n2)C 11a_100011824523_100000716854 [0,2,0,0,0,0|2,0,0]=4 7565 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(n2)C 1626a_100011824523_100000716854 [0,2,0,0,0,0|2,0,0]=4 7566 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NCCc2cccc(n2)C 240690a_100011824523_100000716854 [0,2,0,0,0,0|2,0,0]=4 7567 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NNCc2cccc(c2)Br 22a_100000686200_100000716854 [0,2,0,0,0,0|2,0,0]=4 7568 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NNCc2cccc(c2)C 22a_100000689898_100000716854 [0,2,0,0,0,0|2,0,0]=4 7569 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NNCc2cccc(c2)Cl 22a_100000685877_100000716854 [0,2,0,0,0,0|2,0,0]=4 7570 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NNCc2cccc(c2)F 22a_100016993953_100000716854 [0,2,0,0,0,0|2,0,0]=4 7571 B22R2.23173 Cc1ccc(cc1)C=CC(=O)NNCc2cccc(c2)O 22a_100000008902_100000716854 [0,2,0,0,0,0|2,0,0]=4 7572 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)Br 11a_100000749837_100016267368 [0,2,0,0,0,0|1,0,0]=3 7573 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)Br 1626a_100000749837_100016267368 [0,2,0,0,0,0|1,0,0]=3 7574 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)Cl 11a_100000749837_100000184863 [0,2,0,0,0,0|1,0,0]=3 7575 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000749837_100000184863 [0,2,0,0,0,0|1,0,0]=3 7576 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000749837_100000184863 [0,2,0,0,0,0|1,0,0]=3 7577 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)F 11a_100000749837_100000182136 [0,2,0,0,0,0|1,0,0]=3 7578 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)F 1626a_100000749837_100000182136 [0,2,0,0,0,0|1,0,0]=3 7579 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)F 240690a_100000749837_100000182136 [0,2,0,0,0,0|1,0,0]=3 7580 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)I 11a_100000749837_100102526154 [0,2,0,0,0,0|1,0,0]=3 7581 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)I 1626a_100000749837_100102526154 [0,2,0,0,0,0|1,0,0]=3 7582 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)I 240690a_100000749837_100102526154 [0,2,0,0,0,0|1,0,0]=3 7583 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cc2)O 240690a_100000749837_100016269017 [0,2,0,0,0,0|1,0,0]=3 7584 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cn2)F 11a_100000749837_100020630499 [0,2,0,0,0,0|2,0,0]=4 7585 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cn2)F 1626a_100000749837_100020630499 [0,2,0,0,0,0|2,0,0]=4 7586 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(cn2)F 240690a_100000749837_100020630499 [0,2,0,0,0,0|2,0,0]=4 7587 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(nc2)Br 11a_100000749837_100020588214 [0,2,0,0,0,0|2,0,0]=4 7588 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(nc2)Br 1626a_100000749837_100020588214 [0,2,0,0,0,0|2,0,0]=4 7589 B22R2.23173 Cc1cccc(c1)CCNC(=O)C=Cc2ccc(nc2)Br 240690a_100000749837_100020588214 [0,2,0,0,0,0|2,0,0]=4 7590 B22R2.23173 Cc1cccc(c1)CNNC(=O)C=Cc2ccc(cc2)Br 22a_100000689898_100016267368 [0,2,0,0,0,0|2,0,0]=4 7591 B22R2.23173 Cc1cccc(c1)CNNC(=O)C=Cc2ccc(cc2)Cl 22a_100000689898_100000184863 [0,2,0,0,0,0|2,0,0]=4 7592 B22R2.23173 Cc1cccc(c1)CNNC(=O)C=Cc2ccc(cc2)F 22a_100000689898_100000182136 [0,2,0,0,0,0|2,0,0]=4 7593 B22R2.23173 Cc1cccc(c1)CNNC(=O)C=Cc2ccc(cc2)I 22a_100000689898_100102526154 [0,2,0,0,0,0|2,0,0]=4 7594 B22R2.23173 Cc1cccc(c1)CNNC(=O)C=Cc2ccc(cc2)O 22a_100000689898_100016269017 [0,2,0,0,0,0|2,0,0]=4 7595 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)Br 11a_100011824523_100016267368 [0,2,0,0,0,0|2,0,0]=4 7596 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)Br 1626a_100011824523_100016267368 [0,2,0,0,0,0|2,0,0]=4 7597 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)Cl 11a_100011824523_100000184863 [0,2,0,0,0,0|2,0,0]=4 7598 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)Cl 1626a_100011824523_100000184863 [0,2,0,0,0,0|2,0,0]=4 7599 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)Cl 240690a_100011824523_100000184863 [0,2,0,0,0,0|2,0,0]=4 7600 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)F 11a_100011824523_100000182136 [0,2,0,0,0,0|2,0,0]=4 7601 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)F 1626a_100011824523_100000182136 [0,2,0,0,0,0|2,0,0]=4 7602 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)F 240690a_100011824523_100000182136 [0,2,0,0,0,0|2,0,0]=4 7603 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)I 11a_100011824523_100102526154 [0,2,0,0,0,0|2,0,0]=4 7604 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)I 1626a_100011824523_100102526154 [0,2,0,0,0,0|2,0,0]=4 7605 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)I 240690a_100011824523_100102526154 [0,2,0,0,0,0|2,0,0]=4 7606 B22R2.23173 Cc1cccc(n1)CCNC(=O)C=Cc2ccc(cc2)O 240690a_100011824523_100016269017 [0,2,0,0,0,0|2,0,0]=4 7607 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)CCCc2cccc(c2)Br 1458a_100016267368_100011713683 [0,2,0,0,0,0|1,0,0]=3 7608 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)CCCc2cccc(c2)F 1458a_100016267368_200000698031 [0,2,0,0,0,0|1,0,0]=3 7609 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)CCOc2cccc(c2)Br 1458a_100016267368_100000183150 [0,2,0,0,0,0|2,0,0]=4 7610 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)CCOc2cccc(c2)Cl 1458a_100016267368_100000181161 [0,2,0,0,0,0|2,0,0]=4 7611 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)CCOc2cccc(c2)F 1458a_100016267368_100000739188 [0,2,0,0,0,0|2,0,0]=4 7612 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NCCc2cccc(c2)Br 11a_100011207229_100016267368 [0,2,0,0,0,0|1,0,0]=3 7613 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NCCc2cccc(c2)Br 1626a_100011207229_100016267368 [0,2,0,0,0,0|1,0,0]=3 7614 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NCCc2cccc(c2)Cl 11a_100000185263_100016267368 [0,2,0,0,0,0|1,0,0]=3 7615 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NCCc2cccc(c2)Cl 1626a_100000185263_100016267368 [0,2,0,0,0,0|1,0,0]=3 7616 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NCCc2cccc(c2)F 11a_100000205154_100016267368 [0,2,0,0,0,0|1,0,0]=3 7617 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NCCc2cccc(c2)F 1626a_100000205154_100016267368 [0,2,0,0,0,0|1,0,0]=3 7618 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NNCc2cccc(c2)Br 22a_100000686200_100016267368 [0,2,0,0,0,0|2,0,0]=4 7619 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NNCc2cccc(c2)Cl 22a_100000685877_100016267368 [0,2,0,0,0,0|2,0,0]=4 7620 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NNCc2cccc(c2)F 22a_100016993953_100016267368 [0,2,0,0,0,0|2,0,0]=4 7621 B22R2.23173 O=C(C=Cc1ccc(cc1)Br)NNCc2cccc(c2)O 22a_100000008902_100016267368 [0,2,0,0,0,0|2,0,0]=4 7622 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)CCCc2cccc(c2)Br 1458a_100000184863_100011713683 [0,2,0,0,0,0|1,0,0]=3 7623 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)CCCc2cccc(c2)F 1458a_100000184863_200000698031 [0,2,0,0,0,0|1,0,0]=3 7624 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)CCOc2cccc(c2)Br 1458a_100000184863_100000183150 [0,2,0,0,0,0|2,0,0]=4 7625 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)CCOc2cccc(c2)Cl 1458a_100000184863_100000181161 [0,2,0,0,0,0|2,0,0]=4 7626 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)CCOc2cccc(c2)F 1458a_100000184863_100000739188 [0,2,0,0,0,0|2,0,0]=4 7627 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)Br 11a_100011207229_100000184863 [0,2,0,0,0,0|1,0,0]=3 7628 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)Br 1626a_100011207229_100000184863 [0,2,0,0,0,0|1,0,0]=3 7629 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)Br 240690a_100011207229_100000184863 [0,2,0,0,0,0|1,0,0]=3 7630 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)Cl 11a_100000185263_100000184863 [0,2,0,0,0,0|1,0,0]=3 7631 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)Cl 1626a_100000185263_100000184863 [0,2,0,0,0,0|1,0,0]=3 7632 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)Cl 240690a_100000185263_100000184863 [0,2,0,0,0,0|1,0,0]=3 7633 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)F 11a_100000205154_100000184863 [0,2,0,0,0,0|1,0,0]=3 7634 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)F 1626a_100000205154_100000184863 [0,2,0,0,0,0|1,0,0]=3 7635 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)F 240690a_100000205154_100000184863 [0,2,0,0,0,0|1,0,0]=3 7636 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NCCc2cccc(c2)O 240690a_100000747277_100000184863 [0,2,0,0,0,0|1,0,0]=3 7637 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NNCc2cccc(c2)Br 22a_100000686200_100000184863 [0,2,0,0,0,0|2,0,0]=4 7638 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NNCc2cccc(c2)Cl 22a_100000685877_100000184863 [0,2,0,0,0,0|2,0,0]=4 7639 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NNCc2cccc(c2)F 22a_100016993953_100000184863 [0,2,0,0,0,0|2,0,0]=4 7640 B22R2.23173 O=C(C=Cc1ccc(cc1)Cl)NNCc2cccc(c2)O 22a_100000008902_100000184863 [0,2,0,0,0,0|2,0,0]=4 7641 B22R2.23173 O=C(C=Cc1ccc(cc1)F)CCCc2cccc(c2)Br 1458a_100000182136_100011713683 [0,2,0,0,0,0|1,0,0]=3 7642 B22R2.23173 O=C(C=Cc1ccc(cc1)F)CCCc2cccc(c2)F 1458a_100000182136_200000698031 [0,2,0,0,0,0|1,0,0]=3 7643 B22R2.23173 O=C(C=Cc1ccc(cc1)F)CCOc2cccc(c2)Br 1458a_100000182136_100000183150 [0,2,0,0,0,0|2,0,0]=4 7644 B22R2.23173 O=C(C=Cc1ccc(cc1)F)CCOc2cccc(c2)Cl 1458a_100000182136_100000181161 [0,2,0,0,0,0|2,0,0]=4 7645 B22R2.23173 O=C(C=Cc1ccc(cc1)F)CCOc2cccc(c2)F 1458a_100000182136_100000739188 [0,2,0,0,0,0|2,0,0]=4 7646 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)Br 11a_100011207229_100000182136 [0,2,0,0,0,0|1,0,0]=3 7647 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)Br 1626a_100011207229_100000182136 [0,2,0,0,0,0|1,0,0]=3 7648 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)Br 240690a_100011207229_100000182136 [0,2,0,0,0,0|1,0,0]=3 7649 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)Cl 11a_100000185263_100000182136 [0,2,0,0,0,0|1,0,0]=3 7650 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)Cl 1626a_100000185263_100000182136 [0,2,0,0,0,0|1,0,0]=3 7651 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)Cl 240690a_100000185263_100000182136 [0,2,0,0,0,0|1,0,0]=3 7652 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)F 11a_100000205154_100000182136 [0,2,0,0,0,0|1,0,0]=3 7653 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)F 1626a_100000205154_100000182136 [0,2,0,0,0,0|1,0,0]=3 7654 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)F 240690a_100000205154_100000182136 [0,2,0,0,0,0|1,0,0]=3 7655 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NCCc2cccc(c2)O 240690a_100000747277_100000182136 [0,2,0,0,0,0|1,0,0]=3 7656 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NNCc2cccc(c2)Br 22a_100000686200_100000182136 [0,2,0,0,0,0|2,0,0]=4 7657 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NNCc2cccc(c2)Cl 22a_100000685877_100000182136 [0,2,0,0,0,0|2,0,0]=4 7658 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NNCc2cccc(c2)F 22a_100016993953_100000182136 [0,2,0,0,0,0|2,0,0]=4 7659 B22R2.23173 O=C(C=Cc1ccc(cc1)F)NNCc2cccc(c2)O 22a_100000008902_100000182136 [0,2,0,0,0,0|2,0,0]=4 7660 B22R2.23173 O=C(C=Cc1ccc(cc1)I)CCCc2cccc(c2)Br 1458a_100102526154_100011713683 [0,2,0,0,0,0|1,0,0]=3 7661 B22R2.23173 O=C(C=Cc1ccc(cc1)I)CCCc2cccc(c2)F 1458a_100102526154_200000698031 [0,2,0,0,0,0|1,0,0]=3 7662 B22R2.23173 O=C(C=Cc1ccc(cc1)I)CCOc2cccc(c2)Br 1458a_100102526154_100000183150 [0,2,0,0,0,0|2,0,0]=4 7663 B22R2.23173 O=C(C=Cc1ccc(cc1)I)CCOc2cccc(c2)Cl 1458a_100102526154_100000181161 [0,2,0,0,0,0|2,0,0]=4 7664 B22R2.23173 O=C(C=Cc1ccc(cc1)I)CCOc2cccc(c2)F 1458a_100102526154_100000739188 [0,2,0,0,0,0|2,0,0]=4 7665 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)Br 11a_100011207229_100102526154 [0,2,0,0,0,0|1,0,0]=3 7666 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)Br 1626a_100011207229_100102526154 [0,2,0,0,0,0|1,0,0]=3 7667 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)Br 240690a_100011207229_100102526154 [0,2,0,0,0,0|1,0,0]=3 7668 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)Cl 11a_100000185263_100102526154 [0,2,0,0,0,0|1,0,0]=3 7669 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)Cl 1626a_100000185263_100102526154 [0,2,0,0,0,0|1,0,0]=3 7670 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)Cl 240690a_100000185263_100102526154 [0,2,0,0,0,0|1,0,0]=3 7671 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)F 11a_100000205154_100102526154 [0,2,0,0,0,0|1,0,0]=3 7672 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)F 1626a_100000205154_100102526154 [0,2,0,0,0,0|1,0,0]=3 7673 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)F 240690a_100000205154_100102526154 [0,2,0,0,0,0|1,0,0]=3 7674 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NCCc2cccc(c2)O 240690a_100000747277_100102526154 [0,2,0,0,0,0|1,0,0]=3 7675 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NNCc2cccc(c2)Br 22a_100000686200_100102526154 [0,2,0,0,0,0|2,0,0]=4 7676 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NNCc2cccc(c2)Cl 22a_100000685877_100102526154 [0,2,0,0,0,0|2,0,0]=4 7677 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NNCc2cccc(c2)F 22a_100016993953_100102526154 [0,2,0,0,0,0|2,0,0]=4 7678 B22R2.23173 O=C(C=Cc1ccc(cc1)I)NNCc2cccc(c2)O 22a_100000008902_100102526154 [0,2,0,0,0,0|2,0,0]=4 7679 B22R2.23173 O=C(C=Cc1ccc(cc1)O)NCCc2cccc(c2)Br 240690a_100011207229_100016269017 [0,2,0,0,0,0|1,0,0]=3 7680 B22R2.23173 O=C(C=Cc1ccc(cc1)O)NCCc2cccc(c2)Cl 240690a_100000185263_100016269017 [0,2,0,0,0,0|1,0,0]=3 7681 B22R2.23173 O=C(C=Cc1ccc(cc1)O)NCCc2cccc(c2)F 240690a_100000205154_100016269017 [0,2,0,0,0,0|1,0,0]=3 7682 B22R2.23173 O=C(C=Cc1ccc(cc1)O)NCCc2cccc(c2)O 240690a_100000747277_100016269017 [0,2,0,0,0,0|1,0,0]=3 7683 B22R2.23173 O=C(C=Cc1ccc(cc1)O)NNCc2cccc(c2)Br 22a_100000686200_100016269017 [0,2,0,0,0,0|2,0,0]=4 7684 B22R2.23173 O=C(C=Cc1ccc(cc1)O)NNCc2cccc(c2)Cl 22a_100000685877_100016269017 [0,2,0,0,0,0|2,0,0]=4 7685 B22R2.23173 O=C(C=Cc1ccc(cc1)O)NNCc2cccc(c2)F 22a_100016993953_100016269017 [0,2,0,0,0,0|2,0,0]=4 7686 B22R2.23173 O=C(C=Cc1ccc(cc1)O)NNCc2cccc(c2)O 22a_100000008902_100016269017 [0,2,0,0,0,0|2,0,0]=4 7687 B22R2.23173 O=C(C=Cc1ccc(cn1)F)CCCc2cccc(c2)Br 1458a_100020630499_100011713683 [0,2,0,0,0,0|2,0,0]=4 7688 B22R2.23173 O=C(C=Cc1ccc(cn1)F)CCCc2cccc(c2)F 1458a_100020630499_200000698031 [0,2,0,0,0,0|2,0,0]=4 7689 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)Br 11a_100011207229_100020630499 [0,2,0,0,0,0|2,0,0]=4 7690 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)Br 1626a_100011207229_100020630499 [0,2,0,0,0,0|2,0,0]=4 7691 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)Br 240690a_100011207229_100020630499 [0,2,0,0,0,0|2,0,0]=4 7692 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)Cl 11a_100000185263_100020630499 [0,2,0,0,0,0|2,0,0]=4 7693 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)Cl 1626a_100000185263_100020630499 [0,2,0,0,0,0|2,0,0]=4 7694 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)Cl 240690a_100000185263_100020630499 [0,2,0,0,0,0|2,0,0]=4 7695 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)F 11a_100000205154_100020630499 [0,2,0,0,0,0|2,0,0]=4 7696 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)F 1626a_100000205154_100020630499 [0,2,0,0,0,0|2,0,0]=4 7697 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)F 240690a_100000205154_100020630499 [0,2,0,0,0,0|2,0,0]=4 7698 B22R2.23173 O=C(C=Cc1ccc(cn1)F)NCCc2cccc(c2)O 240690a_100000747277_100020630499 [0,2,0,0,0,0|2,0,0]=4 7699 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)CCCc2cccc(c2)Br 1458a_100020588214_100011713683 [0,2,0,0,0,0|2,0,0]=4 7700 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)CCCc2cccc(c2)F 1458a_100020588214_200000698031 [0,2,0,0,0,0|2,0,0]=4 7701 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)Br 11a_100011207229_100020588214 [0,2,0,0,0,0|2,0,0]=4 7702 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)Br 1626a_100011207229_100020588214 [0,2,0,0,0,0|2,0,0]=4 7703 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)Br 240690a_100011207229_100020588214 [0,2,0,0,0,0|2,0,0]=4 7704 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)Cl 11a_100000185263_100020588214 [0,2,0,0,0,0|2,0,0]=4 7705 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)Cl 1626a_100000185263_100020588214 [0,2,0,0,0,0|2,0,0]=4 7706 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)Cl 240690a_100000185263_100020588214 [0,2,0,0,0,0|2,0,0]=4 7707 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)F 11a_100000205154_100020588214 [0,2,0,0,0,0|2,0,0]=4 7708 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)F 1626a_100000205154_100020588214 [0,2,0,0,0,0|2,0,0]=4 7709 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)F 240690a_100000205154_100020588214 [0,2,0,0,0,0|2,0,0]=4 7710 B22R2.23173 O=C(C=Cc1ccc(nc1)Br)NCCc2cccc(c2)O 240690a_100000747277_100020588214 [0,2,0,0,0,0|2,0,0]=4 7711 B22R2.139569 Cc1cccc(c1)CCNS(=O)(=O)C=Cc2ccccc2 40a_100000749837_100011098038 [0,2,0,0,0,0|2,0,0]=4 7712 B22R2.139569 O=S(=O)(C=Cc1ccccc1)NCCc2cccc(c2)Br 40a_100011207229_100011098038 [0,2,0,0,0,0|2,0,0]=4 7713 B22R2.139569 O=S(=O)(C=Cc1ccccc1)NCCc2cccc(c2)Cl 40a_100000185263_100011098038 [0,2,0,0,0,0|2,0,0]=4 7714 B22R2.139569 O=S(=O)(C=Cc1ccccc1)NCCc2cccc(c2)F 40a_100000205154_100011098038 [0,2,0,0,0,0|2,0,0]=4 7715 B22R2.139569 O=S(=O)(C=Cc1ccccc1)NCCc2cccc(c2)O 40a_100000747277_100011098038 [0,2,0,0,0,0|2,0,0]=4 7716 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2Br 11a_100000749837_100000719032 [0,2,0,0,0,0|1,0,0]=3 7717 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2Br 1626a_100000749837_100000719032 [0,2,0,0,0,0|1,0,0]=3 7718 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2Br 240690a_100000749837_100000719032 [0,2,0,0,0,0|1,0,0]=3 7719 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2C 1626a_100000749837_100016266485 [0,2,0,0,0,0|1,0,0]=3 7720 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2Cl 11a_100000749837_100000720304 [0,2,0,0,0,0|1,0,0]=3 7721 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2Cl 1626a_100000749837_100000720304 [0,2,0,0,0,0|1,0,0]=3 7722 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2Cl 240690a_100000749837_100000720304 [0,2,0,0,0,0|1,0,0]=3 7723 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2F 11a_100000749837_100016256065 [0,2,0,0,0,0|1,0,0]=3 7724 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2F 1626a_100000749837_100016256065 [0,2,0,0,0,0|1,0,0]=3 7725 B22R2.140031 Cc1cccc(c1)CCNC(=O)C=Cc2ccccc2F 240690a_100000749837_100016256065 [0,2,0,0,0,0|1,0,0]=3 7726 B22R2.140031 Cc1cccc(c1)CNNC(=O)C=Cc2ccccc2Br 22a_100000689898_100000719032 [0,2,0,0,0,0|2,0,0]=4 7727 B22R2.140031 Cc1cccc(c1)CNNC(=O)C=Cc2ccccc2C 22a_100000689898_100016266485 [0,2,0,0,0,0|2,0,0]=4 7728 B22R2.140031 Cc1cccc(c1)CNNC(=O)C=Cc2ccccc2Cl 22a_100000689898_100000720304 [0,2,0,0,0,0|2,0,0]=4 7729 B22R2.140031 Cc1cccc(c1)CNNC(=O)C=Cc2ccccc2F 22a_100000689898_100016256065 [0,2,0,0,0,0|2,0,0]=4 7730 B22R2.140031 Cc1cccc(c1)CNNC(=O)C=Cc2ccccc2O 22a_100000689898_100016263591 [0,2,0,0,0,0|2,0,0]=4 7731 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2Br 11a_100011824523_100000719032 [0,2,0,0,0,0|2,0,0]=4 7732 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2Br 1626a_100011824523_100000719032 [0,2,0,0,0,0|2,0,0]=4 7733 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2Br 240690a_100011824523_100000719032 [0,2,0,0,0,0|2,0,0]=4 7734 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2C 1626a_100011824523_100016266485 [0,2,0,0,0,0|2,0,0]=4 7735 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2Cl 11a_100011824523_100000720304 [0,2,0,0,0,0|2,0,0]=4 7736 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2Cl 1626a_100011824523_100000720304 [0,2,0,0,0,0|2,0,0]=4 7737 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2Cl 240690a_100011824523_100000720304 [0,2,0,0,0,0|2,0,0]=4 7738 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2F 11a_100011824523_100016256065 [0,2,0,0,0,0|2,0,0]=4 7739 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2F 1626a_100011824523_100016256065 [0,2,0,0,0,0|2,0,0]=4 7740 B22R2.140031 Cc1cccc(n1)CCNC(=O)C=Cc2ccccc2F 240690a_100011824523_100016256065 [0,2,0,0,0,0|2,0,0]=4 7741 B22R2.140031 Cc1ccccc1C=CC(=O)NCCc2cccc(c2)Br 1626a_100011207229_100016266485 [0,2,0,0,0,0|1,0,0]=3 7742 B22R2.140031 Cc1ccccc1C=CC(=O)NCCc2cccc(c2)Cl 1626a_100000185263_100016266485 [0,2,0,0,0,0|1,0,0]=3 7743 B22R2.140031 Cc1ccccc1C=CC(=O)NCCc2cccc(c2)F 1626a_100000205154_100016266485 [0,2,0,0,0,0|1,0,0]=3 7744 B22R2.140031 Cc1ccccc1C=CC(=O)NNCc2cccc(c2)Br 22a_100000686200_100016266485 [0,2,0,0,0,0|2,0,0]=4 7745 B22R2.140031 Cc1ccccc1C=CC(=O)NNCc2cccc(c2)Cl 22a_100000685877_100016266485 [0,2,0,0,0,0|2,0,0]=4 7746 B22R2.140031 Cc1ccccc1C=CC(=O)NNCc2cccc(c2)F 22a_100016993953_100016266485 [0,2,0,0,0,0|2,0,0]=4 7747 B22R2.140031 Cc1ccccc1C=CC(=O)NNCc2cccc(c2)O 22a_100000008902_100016266485 [0,2,0,0,0,0|2,0,0]=4 7748 B22R2.140031 O=C(C=Cc1ccccc1Br)CCCc2cccc(c2)Br 1458a_100000719032_100011713683 [0,2,0,0,0,0|1,0,0]=3 7749 B22R2.140031 O=C(C=Cc1ccccc1Br)CCCc2cccc(c2)F 1458a_100000719032_200000698031 [0,2,0,0,0,0|1,0,0]=3 7750 B22R2.140031 O=C(C=Cc1ccccc1Br)CCOc2cccc(c2)Br 1458a_100000719032_100000183150 [0,2,0,0,0,0|2,0,0]=4 7751 B22R2.140031 O=C(C=Cc1ccccc1Br)CCOc2cccc(c2)Cl 1458a_100000719032_100000181161 [0,2,0,0,0,0|2,0,0]=4 7752 B22R2.140031 O=C(C=Cc1ccccc1Br)CCOc2cccc(c2)F 1458a_100000719032_100000739188 [0,2,0,0,0,0|2,0,0]=4 7753 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)Br 11a_100011207229_100000719032 [0,2,0,0,0,0|1,0,0]=3 7754 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)Br 1626a_100011207229_100000719032 [0,2,0,0,0,0|1,0,0]=3 7755 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)Br 240690a_100011207229_100000719032 [0,2,0,0,0,0|1,0,0]=3 7756 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)Cl 11a_100000185263_100000719032 [0,2,0,0,0,0|1,0,0]=3 7757 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)Cl 1626a_100000185263_100000719032 [0,2,0,0,0,0|1,0,0]=3 7758 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)Cl 240690a_100000185263_100000719032 [0,2,0,0,0,0|1,0,0]=3 7759 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)F 11a_100000205154_100000719032 [0,2,0,0,0,0|1,0,0]=3 7760 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)F 1626a_100000205154_100000719032 [0,2,0,0,0,0|1,0,0]=3 7761 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)F 240690a_100000205154_100000719032 [0,2,0,0,0,0|1,0,0]=3 7762 B22R2.140031 O=C(C=Cc1ccccc1Br)NCCc2cccc(c2)O 240690a_100000747277_100000719032 [0,2,0,0,0,0|1,0,0]=3 7763 B22R2.140031 O=C(C=Cc1ccccc1Br)NNCc2cccc(c2)Br 22a_100000686200_100000719032 [0,2,0,0,0,0|2,0,0]=4 7764 B22R2.140031 O=C(C=Cc1ccccc1Br)NNCc2cccc(c2)Cl 22a_100000685877_100000719032 [0,2,0,0,0,0|2,0,0]=4 7765 B22R2.140031 O=C(C=Cc1ccccc1Br)NNCc2cccc(c2)F 22a_100016993953_100000719032 [0,2,0,0,0,0|2,0,0]=4 7766 B22R2.140031 O=C(C=Cc1ccccc1Br)NNCc2cccc(c2)O 22a_100000008902_100000719032 [0,2,0,0,0,0|2,0,0]=4 7767 B22R2.140031 O=C(C=Cc1ccccc1Cl)CCCc2cccc(c2)Br 1458a_100000720304_100011713683 [0,2,0,0,0,0|1,0,0]=3 7768 B22R2.140031 O=C(C=Cc1ccccc1Cl)CCCc2cccc(c2)F 1458a_100000720304_200000698031 [0,2,0,0,0,0|1,0,0]=3 7769 B22R2.140031 O=C(C=Cc1ccccc1Cl)CCOc2cccc(c2)Br 1458a_100000720304_100000183150 [0,2,0,0,0,0|2,0,0]=4 7770 B22R2.140031 O=C(C=Cc1ccccc1Cl)CCOc2cccc(c2)Cl 1458a_100000720304_100000181161 [0,2,0,0,0,0|2,0,0]=4 7771 B22R2.140031 O=C(C=Cc1ccccc1Cl)CCOc2cccc(c2)F 1458a_100000720304_100000739188 [0,2,0,0,0,0|2,0,0]=4 7772 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)Br 11a_100011207229_100000720304 [0,2,0,0,0,0|1,0,0]=3 7773 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)Br 1626a_100011207229_100000720304 [0,2,0,0,0,0|1,0,0]=3 7774 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)Br 240690a_100011207229_100000720304 [0,2,0,0,0,0|1,0,0]=3 7775 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)Cl 11a_100000185263_100000720304 [0,2,0,0,0,0|1,0,0]=3 7776 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)Cl 1626a_100000185263_100000720304 [0,2,0,0,0,0|1,0,0]=3 7777 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)Cl 240690a_100000185263_100000720304 [0,2,0,0,0,0|1,0,0]=3 7778 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)F 11a_100000205154_100000720304 [0,2,0,0,0,0|1,0,0]=3 7779 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)F 1626a_100000205154_100000720304 [0,2,0,0,0,0|1,0,0]=3 7780 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)F 240690a_100000205154_100000720304 [0,2,0,0,0,0|1,0,0]=3 7781 B22R2.140031 O=C(C=Cc1ccccc1Cl)NCCc2cccc(c2)O 240690a_100000747277_100000720304 [0,2,0,0,0,0|1,0,0]=3 7782 B22R2.140031 O=C(C=Cc1ccccc1Cl)NNCc2cccc(c2)Br 22a_100000686200_100000720304 [0,2,0,0,0,0|2,0,0]=4 7783 B22R2.140031 O=C(C=Cc1ccccc1Cl)NNCc2cccc(c2)Cl 22a_100000685877_100000720304 [0,2,0,0,0,0|2,0,0]=4 7784 B22R2.140031 O=C(C=Cc1ccccc1Cl)NNCc2cccc(c2)F 22a_100016993953_100000720304 [0,2,0,0,0,0|2,0,0]=4 7785 B22R2.140031 O=C(C=Cc1ccccc1Cl)NNCc2cccc(c2)O 22a_100000008902_100000720304 [0,2,0,0,0,0|2,0,0]=4 7786 B22R2.140031 O=C(C=Cc1ccccc1F)CCCc2cccc(c2)Br 1458a_100016256065_100011713683 [0,2,0,0,0,0|1,0,0]=3 7787 B22R2.140031 O=C(C=Cc1ccccc1F)CCCc2cccc(c2)F 1458a_100016256065_200000698031 [0,2,0,0,0,0|1,0,0]=3 7788 B22R2.140031 O=C(C=Cc1ccccc1F)CCOc2cccc(c2)Br 1458a_100016256065_100000183150 [0,2,0,0,0,0|2,0,0]=4 7789 B22R2.140031 O=C(C=Cc1ccccc1F)CCOc2cccc(c2)Cl 1458a_100016256065_100000181161 [0,2,0,0,0,0|2,0,0]=4 7790 B22R2.140031 O=C(C=Cc1ccccc1F)CCOc2cccc(c2)F 1458a_100016256065_100000739188 [0,2,0,0,0,0|2,0,0]=4 7791 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)Br 11a_100011207229_100016256065 [0,2,0,0,0,0|1,0,0]=3 7792 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)Br 1626a_100011207229_100016256065 [0,2,0,0,0,0|1,0,0]=3 7793 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)Br 240690a_100011207229_100016256065 [0,2,0,0,0,0|1,0,0]=3 7794 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)Cl 11a_100000185263_100016256065 [0,2,0,0,0,0|1,0,0]=3 7795 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)Cl 1626a_100000185263_100016256065 [0,2,0,0,0,0|1,0,0]=3 7796 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)Cl 240690a_100000185263_100016256065 [0,2,0,0,0,0|1,0,0]=3 7797 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)F 11a_100000205154_100016256065 [0,2,0,0,0,0|1,0,0]=3 7798 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)F 1626a_100000205154_100016256065 [0,2,0,0,0,0|1,0,0]=3 7799 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)F 240690a_100000205154_100016256065 [0,2,0,0,0,0|1,0,0]=3 7800 B22R2.140031 O=C(C=Cc1ccccc1F)NCCc2cccc(c2)O 240690a_100000747277_100016256065 [0,2,0,0,0,0|1,0,0]=3 7801 B22R2.140031 O=C(C=Cc1ccccc1F)NNCc2cccc(c2)Br 22a_100000686200_100016256065 [0,2,0,0,0,0|2,0,0]=4 7802 B22R2.140031 O=C(C=Cc1ccccc1F)NNCc2cccc(c2)Cl 22a_100000685877_100016256065 [0,2,0,0,0,0|2,0,0]=4 7803 B22R2.140031 O=C(C=Cc1ccccc1F)NNCc2cccc(c2)F 22a_100016993953_100016256065 [0,2,0,0,0,0|2,0,0]=4 7804 B22R2.140031 O=C(C=Cc1ccccc1F)NNCc2cccc(c2)O 22a_100000008902_100016256065 [0,2,0,0,0,0|2,0,0]=4 7805 B22R2.140031 O=C(C=Cc1ccccc1O)CCCc2cccc(c2)Br 1458a_100016263591_100011713683 [0,2,0,0,0,0|1,0,0]=3 7806 B22R2.140031 O=C(C=Cc1ccccc1O)CCCc2cccc(c2)F 1458a_100016263591_200000698031 [0,2,0,0,0,0|1,0,0]=3 7807 B22R2.140031 O=C(C=Cc1ccccc1O)CCOc2cccc(c2)Br 1458a_100016263591_100000183150 [0,2,0,0,0,0|2,0,0]=4 7808 B22R2.140031 O=C(C=Cc1ccccc1O)CCOc2cccc(c2)Cl 1458a_100016263591_100000181161 [0,2,0,0,0,0|2,0,0]=4 7809 B22R2.140031 O=C(C=Cc1ccccc1O)CCOc2cccc(c2)F 1458a_100016263591_100000739188 [0,2,0,0,0,0|2,0,0]=4 7810 B22R2.140031 O=C(C=Cc1ccccc1O)NNCc2cccc(c2)Br 22a_100000686200_100016263591 [0,2,0,0,0,0|2,0,0]=4 7811 B22R2.140031 O=C(C=Cc1ccccc1O)NNCc2cccc(c2)Cl 22a_100000685877_100016263591 [0,2,0,0,0,0|2,0,0]=4 7812 B22R2.140031 O=C(C=Cc1ccccc1O)NNCc2cccc(c2)F 22a_100016993953_100016263591 [0,2,0,0,0,0|2,0,0]=4 7813 B22R2.140031 O=C(C=Cc1ccccc1O)NNCc2cccc(c2)O 22a_100000008902_100016263591 [0,2,0,0,0,0|2,0,0]=4 7814 B22R2.304027 O=C(C=Cc1ccccn1)NCC(O)c2cccc(c2)O 240690a_100020657549_100000740811 [0,2,0,0,0,0|2,0,0]=4 7815 B22R2.304027 O=C(C=Cc1cccnc1)NCC(O)c2cccc(c2)O 240690a_100020657549_100000735890 [0,2,0,0,0,0|2,0,0]=4 7816 B22R2.304027 O=C(C=Cc1ccncc1)NCC(O)c2cccc(c2)O 240690a_100020657549_100000682801 [0,2,0,0,0,0|2,0,0]=4 7817 B22R2.304917 CN(CCc1cccc(c1)Cl)C(=O)C=Cc2ccccc2 11a_106726388433_100000210462 [0,2,0,0,0,0|1,0,0]=3 7818 B22R2.304917 CN(CCc1cccc(c1)Cl)C(=O)C=Cc2ccccc2 1626a_106726388433_100000210462 [0,2,0,0,0,0|1,0,0]=3 7819 B22R2.304917 CN(CCc1cccc(c1)Cl)C(=O)C=Cc2ccccn2 11a_106726388433_100000740811 [0,2,0,0,0,0|2,0,0]=4 7820 B22R2.304917 CN(CCc1cccc(c1)Cl)C(=O)C=Cc2ccccn2 240690a_106726388433_100000740811 [0,2,0,0,0,0|2,0,0]=4 7821 B22R2.304917 CN(CCc1cccc(c1)Cl)C(=O)C=Cc2cccnc2 11a_106726388433_100000735890 [0,2,0,0,0,0|2,0,0]=4 7822 B22R2.304917 CN(CCc1cccc(c1)Cl)C(=O)C=Cc2cccnc2 240690a_106726388433_100000735890 [0,2,0,0,0,0|2,0,0]=4 7823 B22R2.304917 CN(CCc1cccc(c1)Cl)C(=O)C=Cc2ccncc2 240690a_106726388433_100000682801 [0,2,0,0,0,0|2,0,0]=4 7824 B22R2.304917 CN(CCc1cccc(c1)F)C(=O)C=Cc2ccccc2 11a_106726388868_100000210462 [0,2,0,0,0,0|1,0,0]=3 7825 B22R2.304917 CN(CCc1cccc(c1)F)C(=O)C=Cc2ccccc2 1626a_106726388868_100000210462 [0,2,0,0,0,0|1,0,0]=3 7826 B22R2.304917 CN(CCc1cccc(c1)F)C(=O)C=Cc2ccccn2 11a_106726388868_100000740811 [0,2,0,0,0,0|2,0,0]=4 7827 B22R2.304917 CN(CCc1cccc(c1)F)C(=O)C=Cc2ccccn2 240690a_106726388868_100000740811 [0,2,0,0,0,0|2,0,0]=4 7828 B22R2.304917 CN(CCc1cccc(c1)F)C(=O)C=Cc2cccnc2 11a_106726388868_100000735890 [0,2,0,0,0,0|2,0,0]=4 7829 B22R2.304917 CN(CCc1cccc(c1)F)C(=O)C=Cc2cccnc2 240690a_106726388868_100000735890 [0,2,0,0,0,0|2,0,0]=4 7830 B22R2.304917 CN(CCc1cccc(c1)F)C(=O)C=Cc2ccncc2 240690a_106726388868_100000682801 [0,2,0,0,0,0|2,0,0]=4 7831 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)Br 11a_100000207497_100016258244 [0,2,0,0,0,0|1,0,0]=3 7832 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)Br 1626a_100000207497_100016258244 [0,2,0,0,0,0|1,0,0]=3 7833 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)Br 240690a_100000207497_100016258244 [0,2,0,0,0,0|1,0,0]=3 7834 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)Cl 11a_100000207497_100000184502 [0,2,0,0,0,0|1,0,0]=3 7835 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)Cl 1626a_100000207497_100000184502 [0,2,0,0,0,0|1,0,0]=3 7836 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)Cl 240690a_100000207497_100000184502 [0,2,0,0,0,0|1,0,0]=3 7837 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)F 11a_100000207497_100000718793 [0,2,0,0,0,0|1,0,0]=3 7838 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)F 1626a_100000207497_100000718793 [0,2,0,0,0,0|1,0,0]=3 7839 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)F 240690a_100000207497_100000718793 [0,2,0,0,0,0|1,0,0]=3 7840 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)I 11a_100000207497_100020647043 [0,2,0,0,0,0|1,0,0]=3 7841 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)I 1626a_100000207497_100020647043 [0,2,0,0,0,0|1,0,0]=3 7842 B22R2.304917 CN(CCc1ccccc1)C(=O)C=Cc2cccc(c2)I 240690a_100000207497_100020647043 [0,2,0,0,0,0|1,0,0]=3 7843 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)Br 11a_100000737206_100016258244 [0,2,0,0,0,0|2,0,0]=4 7844 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)Br 1626a_100000737206_100016258244 [0,2,0,0,0,0|2,0,0]=4 7845 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)Br 240690a_100000737206_100016258244 [0,2,0,0,0,0|2,0,0]=4 7846 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)Cl 11a_100000737206_100000184502 [0,2,0,0,0,0|2,0,0]=4 7847 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)Cl 1626a_100000737206_100000184502 [0,2,0,0,0,0|2,0,0]=4 7848 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)Cl 240690a_100000737206_100000184502 [0,2,0,0,0,0|2,0,0]=4 7849 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)F 11a_100000737206_100000718793 [0,2,0,0,0,0|2,0,0]=4 7850 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)F 1626a_100000737206_100000718793 [0,2,0,0,0,0|2,0,0]=4 7851 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)F 240690a_100000737206_100000718793 [0,2,0,0,0,0|2,0,0]=4 7852 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)I 11a_100000737206_100020647043 [0,2,0,0,0,0|2,0,0]=4 7853 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)I 1626a_100000737206_100020647043 [0,2,0,0,0,0|2,0,0]=4 7854 B22R2.304917 CN(CCc1ccccn1)C(=O)C=Cc2cccc(c2)I 240690a_100000737206_100020647043 [0,2,0,0,0,0|2,0,0]=4 7855 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)Br 11a_100000763209_100016258244 [0,2,0,0,0,0|2,0,0]=4 7856 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)Br 1626a_100000763209_100016258244 [0,2,0,0,0,0|2,0,0]=4 7857 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)Br 240690a_100000763209_100016258244 [0,2,0,0,0,0|2,0,0]=4 7858 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)Cl 11a_100000763209_100000184502 [0,2,0,0,0,0|2,0,0]=4 7859 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)Cl 1626a_100000763209_100000184502 [0,2,0,0,0,0|2,0,0]=4 7860 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)Cl 240690a_100000763209_100000184502 [0,2,0,0,0,0|2,0,0]=4 7861 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)F 11a_100000763209_100000718793 [0,2,0,0,0,0|2,0,0]=4 7862 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)F 1626a_100000763209_100000718793 [0,2,0,0,0,0|2,0,0]=4 7863 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)F 240690a_100000763209_100000718793 [0,2,0,0,0,0|2,0,0]=4 7864 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)I 11a_100000763209_100020647043 [0,2,0,0,0,0|2,0,0]=4 7865 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)I 1626a_100000763209_100020647043 [0,2,0,0,0,0|2,0,0]=4 7866 B22R2.304917 CN(CCc1cccnc1)C(=O)C=Cc2cccc(c2)I 240690a_100000763209_100020647043 [0,2,0,0,0,0|2,0,0]=4 7867 B22R2.304917 CN(CCc1ccncc1)C(=O)C=Cc2cccc(c2)Br 11a_100000742850_100016258244 [0,2,0,0,0,0|2,0,0]=4 7868 B22R2.304917 CN(CCc1ccncc1)C(=O)C=Cc2cccc(c2)Br 240690a_100000742850_100016258244 [0,2,0,0,0,0|2,0,0]=4 7869 B22R2.304917 CN(CCc1ccncc1)C(=O)C=Cc2cccc(c2)Cl 11a_100000742850_100000184502 [0,2,0,0,0,0|2,0,0]=4 7870 B22R2.304917 CN(CCc1ccncc1)C(=O)C=Cc2cccc(c2)Cl 240690a_100000742850_100000184502 [0,2,0,0,0,0|2,0,0]=4 7871 B22R2.304917 CN(CCc1ccncc1)C(=O)C=Cc2cccc(c2)F 11a_100000742850_100000718793 [0,2,0,0,0,0|2,0,0]=4 7872 B22R2.304917 CN(CCc1ccncc1)C(=O)C=Cc2cccc(c2)F 240690a_100000742850_100000718793 [0,2,0,0,0,0|2,0,0]=4 7873 B22R2.304917 CN(CCc1ccncc1)C(=O)C=Cc2cccc(c2)I 11a_100000742850_100020647043 [0,2,0,0,0,0|2,0,0]=4 7874 B22R2.304917 CN(CCc1ccncc1)C(=O)C=Cc2cccc(c2)I 240690a_100000742850_100020647043 [0,2,0,0,0,0|2,0,0]=4 7875 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2ccccc2 11a_100000207497_100000690095 [0,2,0,0,0,0|1,0,0]=3 7876 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2ccccc2 1626a_100000207497_100000690095 [0,2,0,0,0,0|1,0,0]=3 7877 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2ccccc2 240690a_100000207497_100000690095 [0,2,0,0,0,0|1,0,0]=3 7878 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2ccccn2 11a_100000737206_100000690095 [0,2,0,0,0,0|2,0,0]=4 7879 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2ccccn2 1626a_100000737206_100000690095 [0,2,0,0,0,0|2,0,0]=4 7880 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2ccccn2 240690a_100000737206_100000690095 [0,2,0,0,0,0|2,0,0]=4 7881 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2cccnc2 11a_100000763209_100000690095 [0,2,0,0,0,0|2,0,0]=4 7882 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2cccnc2 1626a_100000763209_100000690095 [0,2,0,0,0,0|2,0,0]=4 7883 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2cccnc2 240690a_100000763209_100000690095 [0,2,0,0,0,0|2,0,0]=4 7884 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2ccncc2 11a_100000742850_100000690095 [0,2,0,0,0,0|2,0,0]=4 7885 B22R2.304917 Cc1cccc(c1)C=CC(=O)N(C)CCc2ccncc2 240690a_100000742850_100000690095 [0,2,0,0,0,0|2,0,0]=4 7886 B22R2.304917 Cc1cccc(c1)CCN(C)C(=O)C=Cc2ccccc2 11a_114849113767_100000210462 [0,2,0,0,0,0|1,0,0]=3 7887 B22R2.304917 Cc1cccc(c1)CCN(C)C(=O)C=Cc2ccccc2 1626a_114849113767_100000210462 [0,2,0,0,0,0|1,0,0]=3 7888 B22R2.304917 Cc1cccc(c1)CCN(C)C(=O)C=Cc2ccccn2 11a_114849113767_100000740811 [0,2,0,0,0,0|2,0,0]=4 7889 B22R2.304917 Cc1cccc(c1)CCN(C)C(=O)C=Cc2ccccn2 240690a_114849113767_100000740811 [0,2,0,0,0,0|2,0,0]=4 7890 B22R2.304917 Cc1cccc(c1)CCN(C)C(=O)C=Cc2cccnc2 11a_114849113767_100000735890 [0,2,0,0,0,0|2,0,0]=4 7891 B22R2.304917 Cc1cccc(c1)CCN(C)C(=O)C=Cc2cccnc2 240690a_114849113767_100000735890 [0,2,0,0,0,0|2,0,0]=4 7892 B22R2.304917 Cc1cccc(c1)CCN(C)C(=O)C=Cc2ccncc2 240690a_114849113767_100000682801 [0,2,0,0,0,0|2,0,0]=4 7893 B22R2.3735 C#Cc1ccccc1NCC(=O)OCCc2ccccc2 34a_100011470550_200000077782 [0,2,0,0,0,0|1,0,1]=4 7894 B22R2.3735 C#Cc1ccccc1OCC(=O)OCCc2ccccc2 34a_200011470546_200000077782 [0,2,0,0,0,0|1,0,1]=4 7895 B22R2.3735 C#Cc1ccccc1OCC(=O)OCCc2ccccc2 7a_200011470546_200000077782 [0,2,0,0,0,0|1,0,1]=4 7896 B22R2.3735 C=Cc1ccccc1NCC(=O)OCCc2ccccc2 34a_100012022501_200000077782 [0,2,0,0,0,0|1,0,1]=4 7897 B22R2.3735 C=Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_100011218376_200000077782 [0,2,0,0,0,0|1,0,1]=4 7898 B22R2.3735 C=Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100011218376 [0,2,0,0,0,0|1,0,1]=4 7899 B22R2.3735 CCc1ccccc1NCC(=O)OCCc2ccccc2 2230a_100000212081_200000077782 [0,2,0,0,0,0|1,0,1]=4 7900 B22R2.3735 CCc1ccccc1NCC(=O)OCCc2ccccc2 34a_100000212081_200000077782 [0,2,0,0,0,0|1,0,1]=4 7901 B22R2.3735 CCc1ccccc1NCC(=O)OCCc2ccccc2 7a_100000212081_200000077782 [0,2,0,0,0,0|1,0,1]=4 7902 B22R2.3735 CCc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000210936_200000077782 [0,2,0,0,0,0|1,0,1]=4 7903 B22R2.3735 CCc1ccccc1OCC(=O)OCCc2ccccc2 7a_100000210936_200000077782 [0,2,0,0,0,0|1,0,1]=4 7904 B22R2.3735 CCc1ccccc1SCC(=O)OCCc2ccccc2 62a_100011215823_200000077782 [0,2,0,0,0,0|1,0,1]=4 7905 B22R2.3735 CCc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100011215823 [0,2,0,0,0,0|1,0,1]=4 7906 B22R2.3735 CNc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000033821_200000077782 [0,2,0,0,0,0|1,0,1]=4 7907 B22R2.3735 CNc1ccccc1SCC(=O)OCCc2ccccc2 62a_100020606079_200000077782 [0,2,0,0,0,0|1,0,1]=4 7908 B22R2.3735 CNc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100020606079 [0,2,0,0,0,0|1,0,1]=4 7909 B22R2.3735 COc1ccccc1C=CC(=O)CCCc2ccccc2 1458a_100000182468_100000211621 [0,2,0,0,0,0|1,0,0]=3 7910 B22R2.3735 COc1ccccc1C=CC(=O)CCOc2ccccc2 1458a_100000182468_100000184471 [0,2,0,0,0,0|2,0,0]=4 7911 B22R2.3735 COc1ccccc1C=CC(=O)CCSc2ccccc2 1458a_100000182468_100000246102 [0,2,0,0,0,0|2,0,0]=4 7912 B22R2.3735 COc1ccccc1C=CC(=O)CSCc2ccccc2 1458a_100000182468_200011217039 [0,2,0,0,0,0|2,0,0]=4 7913 B22R2.3735 COc1ccccc1C=CC(=O)NCCc2ccccc2 11a_100000106460_100000182468 [0,2,0,0,0,0|1,0,0]=3 7914 B22R2.3735 COc1ccccc1C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000182468 [0,2,0,0,0,0|1,0,0]=3 7915 B22R2.3735 COc1ccccc1C=CC(=O)NCCc2ccccn2 11a_100000211156_100000182468 [0,2,0,0,0,0|2,0,0]=4 7916 B22R2.3735 COc1ccccc1C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000182468 [0,2,0,0,0,0|2,0,0]=4 7917 B22R2.3735 COc1ccccc1C=CC(=O)NCCc2cccnc2 11a_100000736294_100000182468 [0,2,0,0,0,0|2,0,0]=4 7918 B22R2.3735 COc1ccccc1C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000182468 [0,2,0,0,0,0|2,0,0]=4 7919 B22R2.3735 COc1ccccc1C=CC(=O)NCCc2ccncc2 11a_100000742849_100000182468 [0,2,0,0,0,0|2,0,0]=4 7920 B22R2.3735 COc1ccccc1C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000182468 [0,2,0,0,0,0|2,0,0]=4 7921 B22R2.3735 COc1ccccc1C=CC(=O)NNCc2ccccc2 22a_100000007032_100000182468 [0,2,0,0,0,0|2,0,0]=4 7922 B22R2.3735 COc1ccccc1NCC(=O)OCCc2ccccc2 34a_100000210025_200000077782 [0,2,0,0,0,0|1,0,1]=4 7923 B22R2.3735 COc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000210385_200000077782 [0,2,0,0,0,0|1,0,1]=4 7924 B22R2.3735 COc1ccccc1SCC(=O)OCCc2ccccc2 62a_100000210334_200000077782 [0,2,0,0,0,0|1,0,1]=4 7925 B22R2.3735 COc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000210334 [0,2,0,0,0,0|1,0,1]=4 7926 B22R2.3735 COc1ncccc1C=CC(=O)CCCc2ccccc2 1458a_100102601226_100000211621 [0,2,0,0,0,0|2,0,0]=4 7927 B22R2.3735 COc1ncccc1C=CC(=O)NCCc2ccccc2 11a_100000106460_100102601226 [0,2,0,0,0,0|2,0,0]=4 7928 B22R2.3735 COc1ncccc1C=CC(=O)NCCc2ccccc2 1626a_100000106460_100102601226 [0,2,0,0,0,0|2,0,0]=4 7929 B22R2.3735 CSc1ccccc1NCC(=O)OCCc2ccccc2 34a_100000211160_200000077782 [0,2,0,0,0,0|1,0,1]=4 7930 B22R2.3735 CSc1ccccc1OCC(=O)OCCc2ccccc2 34a_100011216402_200000077782 [0,2,0,0,0,0|1,0,1]=4 7931 B22R2.3735 CSc1ccccc1SCC(=O)OCCc2ccccc2 62a_100011217816_200000077782 [0,2,0,0,0,0|1,0,1]=4 7932 B22R2.3735 CSc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100011217816 [0,2,0,0,0,0|1,0,1]=4 7933 B22R2.3735 N#Cc1ccccc1C=CC(=O)CCCc2ccccc2 1458a_100016294624_100000211621 [0,2,0,0,0,0|1,0,0]=3 7934 B22R2.3735 N#Cc1ccccc1C=CC(=O)CCOc2ccccc2 1458a_100016294624_100000184471 [0,2,0,0,0,0|2,0,0]=4 7935 B22R2.3735 N#Cc1ccccc1C=CC(=O)CCSc2ccccc2 1458a_100016294624_100000246102 [0,2,0,0,0,0|2,0,0]=4 7936 B22R2.3735 N#Cc1ccccc1C=CC(=O)CSCc2ccccc2 1458a_100016294624_200011217039 [0,2,0,0,0,0|2,0,0]=4 7937 B22R2.3735 N#Cc1ccccc1C=CC(=O)NCCc2ccccc2 11a_100000106460_100016294624 [0,2,0,0,0,0|1,0,0]=3 7938 B22R2.3735 N#Cc1ccccc1C=CC(=O)NCCc2ccccn2 11a_100000211156_100016294624 [0,2,0,0,0,0|2,0,0]=4 7939 B22R2.3735 N#Cc1ccccc1C=CC(=O)NCCc2cccnc2 11a_100000736294_100016294624 [0,2,0,0,0,0|2,0,0]=4 7940 B22R2.3735 N#Cc1ccccc1C=CC(=O)NCCc2ccncc2 11a_100000742849_100016294624 [0,2,0,0,0,0|2,0,0]=4 7941 B22R2.3735 N#Cc1ccccc1C=CC(=O)NNCc2ccccc2 22a_100000007032_100016294624 [0,2,0,0,0,0|2,0,0]=4 7942 B22R2.3735 N#Cc1ccccc1NCC(=O)OCCc2ccccc2 34a_100000211148_200000077782 [0,2,0,0,0,0|1,0,1]=4 7943 B22R2.3735 N#Cc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000211048_200000077782 [0,2,0,0,0,0|1,0,1]=4 7944 B22R2.3735 N#Cc1ccccc1OCC(=O)OCCc2ccccc2 7a_100000211048_200000077782 [0,2,0,0,0,0|1,0,1]=4 7945 B22R2.3735 N#Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000188569 [0,2,0,0,0,0|1,0,1]=4 7946 B22R2.3735 NCc1ccccc1OCC(=O)OCCc2ccccc2 34a_100000185550_200000077782 [0,2,0,0,0,0|1,0,1]=4 7947 B22R2.3735 NCc1ccccc1SCC(=O)OCCc2ccccc2 62a_100000689332_200000077782 [0,2,0,0,0,0|1,0,1]=4 7948 B22R2.3735 NCc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000689332 [0,2,0,0,0,0|1,0,1]=4 7949 B22R2.3735 NNc1ccccc1SCC(=O)OCCc2ccccc2 62a_100000241748_200000077782 [0,2,0,0,0,0|1,0,1]=4 7950 B22R2.3735 NNc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000241748 [0,2,0,0,0,0|1,0,1]=4 7951 B22R2.3735 O=C(CNc1ccccc1CO)OCCc2ccccc2 34a_100000212039_200000077782 [0,2,0,0,0,0|1,0,1]=4 7952 B22R2.3735 O=C(COc1ccccc1CO)OCCc2ccccc2 34a_100011216872_200000077782 [0,2,0,0,0,0|1,0,1]=4 7953 B22R2.3735 O=C(CSc1ccccc1CO)OCCc2ccccc2 62a_100000187465_200000077782 [0,2,0,0,0,0|1,0,1]=4 7954 B22R2.3735 O=C(CSc1ccccc1CO)OCCc2ccccc2 62a_200000077782_100000187465 [0,2,0,0,0,0|1,0,1]=4 7955 B22R2.3735 O=Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_100000210073_200000077782 [0,2,0,0,0,0|1,0,1]=4 7956 B22R2.3735 O=Cc1ccccc1SCC(=O)OCCc2ccccc2 62a_200000077782_100000210073 [0,2,0,0,0,0|1,0,1]=4 7957 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2Br 11a_100000238496_100000719032 [0,2,0,0,0,0|2,0,0]=4 7958 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2Br 1626a_100000238496_100000719032 [0,2,0,0,0,0|2,0,0]=4 7959 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2Br 240690a_100000238496_100000719032 [0,2,0,0,0,0|2,0,0]=4 7960 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2Cl 11a_100000238496_100000720304 [0,2,0,0,0,0|2,0,0]=4 7961 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2Cl 1626a_100000238496_100000720304 [0,2,0,0,0,0|2,0,0]=4 7962 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2Cl 240690a_100000238496_100000720304 [0,2,0,0,0,0|2,0,0]=4 7963 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2F 11a_100000238496_100016256065 [0,2,0,0,0,0|2,0,0]=4 7964 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2F 1626a_100000238496_100016256065 [0,2,0,0,0,0|2,0,0]=4 7965 B22R2.4633 CC(Cc1ccccn1)NC(=O)C=Cc2ccccc2F 240690a_100000238496_100016256065 [0,2,0,0,0,0|2,0,0]=4 7966 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2Br 11a_100011207255_100000719032 [0,2,0,0,0,0|2,0,0]=4 7967 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2Br 1626a_100011207255_100000719032 [0,2,0,0,0,0|2,0,0]=4 7968 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2Br 240690a_100011207255_100000719032 [0,2,0,0,0,0|2,0,0]=4 7969 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2Cl 11a_100011207255_100000720304 [0,2,0,0,0,0|2,0,0]=4 7970 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2Cl 1626a_100011207255_100000720304 [0,2,0,0,0,0|2,0,0]=4 7971 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2Cl 240690a_100011207255_100000720304 [0,2,0,0,0,0|2,0,0]=4 7972 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2F 11a_100011207255_100016256065 [0,2,0,0,0,0|2,0,0]=4 7973 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2F 1626a_100011207255_100016256065 [0,2,0,0,0,0|2,0,0]=4 7974 B22R2.4633 CC(Cc1cccnc1)NC(=O)C=Cc2ccccc2F 240690a_100011207255_100016256065 [0,2,0,0,0,0|2,0,0]=4 7975 B22R2.4633 Cc1ccccc1C=CC(=O)NC(C)Cc2ccccn2 1626a_100000238496_100016266485 [0,2,0,0,0,0|2,0,0]=4 7976 B22R2.4633 Cc1ccccc1C=CC(=O)NC(C)Cc2cccnc2 1626a_100011207255_100016266485 [0,2,0,0,0,0|2,0,0]=4 7977 B22R2.4633 O=C(C=Cc1ccccc1Br)CC(=O)Cc2ccccc2 1458a_100000719032_100000233483 [0,2,0,0,0,0|1,0,1]=4 7978 B22R2.4633 O=C(C=Cc1ccccc1Cl)CC(=O)Cc2ccccc2 1458a_100000720304_100000233483 [0,2,0,0,0,0|1,0,1]=4 7979 B22R2.4633 O=C(C=Cc1ccccc1F)CC(=O)Cc2ccccc2 1458a_100016256065_100000233483 [0,2,0,0,0,0|1,0,1]=4 7980 B22R2.4633 O=C(C=Cc1ccccc1O)CC(=O)Cc2ccccc2 1458a_100016263591_100000233483 [0,2,0,0,0,0|1,0,1]=4 7981 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2Br 11a_100000207497_100000719032 [0,2,0,0,0,0|1,0,0]=3 7982 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2Br 1626a_100000207497_100000719032 [0,2,0,0,0,0|1,0,0]=3 7983 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2Br 240690a_100000207497_100000719032 [0,2,0,0,0,0|1,0,0]=3 7984 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2Cl 11a_100000207497_100000720304 [0,2,0,0,0,0|1,0,0]=3 7985 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2Cl 1626a_100000207497_100000720304 [0,2,0,0,0,0|1,0,0]=3 7986 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2Cl 240690a_100000207497_100000720304 [0,2,0,0,0,0|1,0,0]=3 7987 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2F 11a_100000207497_100016256065 [0,2,0,0,0,0|1,0,0]=3 7988 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2F 1626a_100000207497_100016256065 [0,2,0,0,0,0|1,0,0]=3 7989 B22R2.11140 CN(CCc1ccccc1)C(=O)C=Cc2ccccc2F 240690a_100000207497_100016256065 [0,2,0,0,0,0|1,0,0]=3 7990 B22R2.11140 CN(CCc1ccccc1F)C(=O)C=Cc2ccccc2 11a_100000232559_100000210462 [0,2,0,0,0,0|1,0,0]=3 7991 B22R2.11140 CN(CCc1ccccc1F)C(=O)C=Cc2ccccc2 1626a_100000232559_100000210462 [0,2,0,0,0,0|1,0,0]=3 7992 B22R2.11140 CN(CCc1ccccc1F)C(=O)C=Cc2ccccn2 11a_100000232559_100000740811 [0,2,0,0,0,0|2,0,0]=4 7993 B22R2.11140 CN(CCc1ccccc1F)C(=O)C=Cc2ccccn2 240690a_100000232559_100000740811 [0,2,0,0,0,0|2,0,0]=4 7994 B22R2.11140 CN(CCc1ccccc1F)C(=O)C=Cc2cccnc2 11a_100000232559_100000735890 [0,2,0,0,0,0|2,0,0]=4 7995 B22R2.11140 CN(CCc1ccccc1F)C(=O)C=Cc2cccnc2 240690a_100000232559_100000735890 [0,2,0,0,0,0|2,0,0]=4 7996 B22R2.11140 CN(CCc1ccccc1F)C(=O)C=Cc2ccncc2 240690a_100000232559_100000682801 [0,2,0,0,0,0|2,0,0]=4 7997 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2Br 11a_100000737206_100000719032 [0,2,0,0,0,0|2,0,0]=4 7998 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2Br 1626a_100000737206_100000719032 [0,2,0,0,0,0|2,0,0]=4 7999 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2Br 240690a_100000737206_100000719032 [0,2,0,0,0,0|2,0,0]=4 8000 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2Cl 11a_100000737206_100000720304 [0,2,0,0,0,0|2,0,0]=4 8001 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2Cl 1626a_100000737206_100000720304 [0,2,0,0,0,0|2,0,0]=4 8002 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2Cl 240690a_100000737206_100000720304 [0,2,0,0,0,0|2,0,0]=4 8003 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2F 11a_100000737206_100016256065 [0,2,0,0,0,0|2,0,0]=4 8004 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2F 1626a_100000737206_100016256065 [0,2,0,0,0,0|2,0,0]=4 8005 B22R2.11140 CN(CCc1ccccn1)C(=O)C=Cc2ccccc2F 240690a_100000737206_100016256065 [0,2,0,0,0,0|2,0,0]=4 8006 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2Br 11a_100000763209_100000719032 [0,2,0,0,0,0|2,0,0]=4 8007 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2Br 1626a_100000763209_100000719032 [0,2,0,0,0,0|2,0,0]=4 8008 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2Br 240690a_100000763209_100000719032 [0,2,0,0,0,0|2,0,0]=4 8009 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2Cl 11a_100000763209_100000720304 [0,2,0,0,0,0|2,0,0]=4 8010 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2Cl 1626a_100000763209_100000720304 [0,2,0,0,0,0|2,0,0]=4 8011 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2Cl 240690a_100000763209_100000720304 [0,2,0,0,0,0|2,0,0]=4 8012 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2F 11a_100000763209_100016256065 [0,2,0,0,0,0|2,0,0]=4 8013 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2F 1626a_100000763209_100016256065 [0,2,0,0,0,0|2,0,0]=4 8014 B22R2.11140 CN(CCc1cccnc1)C(=O)C=Cc2ccccc2F 240690a_100000763209_100016256065 [0,2,0,0,0,0|2,0,0]=4 8015 B22R2.11140 CN(CCc1ccncc1)C(=O)C=Cc2ccccc2Br 11a_100000742850_100000719032 [0,2,0,0,0,0|2,0,0]=4 8016 B22R2.11140 CN(CCc1ccncc1)C(=O)C=Cc2ccccc2Br 240690a_100000742850_100000719032 [0,2,0,0,0,0|2,0,0]=4 8017 B22R2.11140 CN(CCc1ccncc1)C(=O)C=Cc2ccccc2Cl 11a_100000742850_100000720304 [0,2,0,0,0,0|2,0,0]=4 8018 B22R2.11140 CN(CCc1ccncc1)C(=O)C=Cc2ccccc2Cl 240690a_100000742850_100000720304 [0,2,0,0,0,0|2,0,0]=4 8019 B22R2.11140 CN(CCc1ccncc1)C(=O)C=Cc2ccccc2F 11a_100000742850_100016256065 [0,2,0,0,0,0|2,0,0]=4 8020 B22R2.11140 CN(CCc1ccncc1)C(=O)C=Cc2ccccc2F 240690a_100000742850_100016256065 [0,2,0,0,0,0|2,0,0]=4 8021 B22R2.11140 Cc1ccccc1C=CC(=O)N(C)CCc2ccccc2 1626a_100000207497_100016266485 [0,2,0,0,0,0|1,0,0]=3 8022 B22R2.11140 Cc1ccccc1C=CC(=O)N(C)CCc2ccccn2 1626a_100000737206_100016266485 [0,2,0,0,0,0|2,0,0]=4 8023 B22R2.11140 Cc1ccccc1C=CC(=O)N(C)CCc2cccnc2 1626a_100000763209_100016266485 [0,2,0,0,0,0|2,0,0]=4 8024 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1Br)c2ccccc2 11a_100000701038_100000719032 [0,2,0,0,0,0|1,0,0]=3 8025 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1Br)c2ccccc2 1626a_100000701038_100000719032 [0,2,0,0,0,0|1,0,0]=3 8026 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1Br)c2ccccc2 240690a_100000701038_100000719032 [0,2,0,0,0,0|1,0,0]=3 8027 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1Cl)c2ccccc2 11a_100000701038_100000720304 [0,2,0,0,0,0|1,0,0]=3 8028 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1Cl)c2ccccc2 1626a_100000701038_100000720304 [0,2,0,0,0,0|1,0,0]=3 8029 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1Cl)c2ccccc2 240690a_100000701038_100000720304 [0,2,0,0,0,0|1,0,0]=3 8030 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1F)c2ccccc2 11a_100000701038_100016256065 [0,2,0,0,0,0|1,0,0]=3 8031 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1F)c2ccccc2 1626a_100000701038_100016256065 [0,2,0,0,0,0|1,0,0]=3 8032 B22R2.11147 CC(CNC(=O)C=Cc1ccccc1F)c2ccccc2 240690a_100000701038_100016256065 [0,2,0,0,0,0|1,0,0]=3 8033 B22R2.11147 Cc1ccccc1C=CC(=O)NCC(C)c2ccccc2 1626a_100000701038_100016266485 [0,2,0,0,0,0|1,0,0]=3 8034 B22R2.11147 O=C(C=Cc1ccccc1Br)CCC(=O)c2ccccc2 1458a_100000719032_100000750707 [0,2,0,0,0,0|1,0,1]=4 8035 B22R2.11147 O=C(C=Cc1ccccc1Br)CC[C@@H](O)c2ccccc2 1458a_100000719032_100000729684 [0,2,0,0,0,0|1,0,0]=3 8036 B22R2.11147 O=C(C=Cc1ccccc1Br)NCC(O)c2ccccc2 240690a_100000210709_100000719032 [0,2,0,0,0,0|1,0,0]=3 8037 B22R2.11147 O=C(C=Cc1ccccc1Br)NCC(O)c2ccccn2 240690a_100000691469_100000719032 [0,2,0,0,0,0|2,0,0]=4 8038 B22R2.11147 O=C(C=Cc1ccccc1Br)NCC(O)c2cccnc2 240690a_100020605170_100000719032 [0,2,0,0,0,0|2,0,0]=4 8039 B22R2.11147 O=C(C=Cc1ccccc1Cl)CCC(=O)c2ccccc2 1458a_100000720304_100000750707 [0,2,0,0,0,0|1,0,1]=4 8040 B22R2.11147 O=C(C=Cc1ccccc1Cl)CC[C@@H](O)c2ccccc2 1458a_100000720304_100000729684 [0,2,0,0,0,0|1,0,0]=3 8041 B22R2.11147 O=C(C=Cc1ccccc1Cl)NCC(O)c2ccccc2 240690a_100000210709_100000720304 [0,2,0,0,0,0|1,0,0]=3 8042 B22R2.11147 O=C(C=Cc1ccccc1Cl)NCC(O)c2ccccn2 240690a_100000691469_100000720304 [0,2,0,0,0,0|2,0,0]=4 8043 B22R2.11147 O=C(C=Cc1ccccc1Cl)NCC(O)c2cccnc2 240690a_100020605170_100000720304 [0,2,0,0,0,0|2,0,0]=4 8044 B22R2.11147 O=C(C=Cc1ccccc1F)CCC(=O)c2ccccc2 1458a_100016256065_100000750707 [0,2,0,0,0,0|1,0,1]=4 8045 B22R2.11147 O=C(C=Cc1ccccc1F)CC[C@@H](O)c2ccccc2 1458a_100016256065_100000729684 [0,2,0,0,0,0|1,0,0]=3 8046 B22R2.11147 O=C(C=Cc1ccccc1F)NCC(O)c2ccccc2 240690a_100000210709_100016256065 [0,2,0,0,0,0|1,0,0]=3 8047 B22R2.11147 O=C(C=Cc1ccccc1F)NCC(O)c2ccccn2 240690a_100000691469_100016256065 [0,2,0,0,0,0|2,0,0]=4 8048 B22R2.11147 O=C(C=Cc1ccccc1F)NCC(O)c2cccnc2 240690a_100020605170_100016256065 [0,2,0,0,0,0|2,0,0]=4 8049 B22R2.11147 O=C(C=Cc1ccccc1O)CCC(=O)c2ccccc2 1458a_100016263591_100000750707 [0,2,0,0,0,0|1,0,1]=4 8050 B22R2.11147 O=C(C=Cc1ccccc1O)CC[C@@H](O)c2ccccc2 1458a_100016263591_100000729684 [0,2,0,0,0,0|1,0,0]=3 8051 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2Br 11a_100000705350_100000719032 [0,2,0,0,0,0|1,0,0]=3 8052 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2Br 1626a_100000705350_100000719032 [0,2,0,0,0,0|1,0,0]=3 8053 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2Br 240690a_100000705350_100000719032 [0,2,0,0,0,0|1,0,0]=3 8054 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2C 1626a_100000705350_100016266485 [0,2,0,0,0,0|1,0,0]=3 8055 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2Cl 11a_100000705350_100000720304 [0,2,0,0,0,0|1,0,0]=3 8056 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2Cl 1626a_100000705350_100000720304 [0,2,0,0,0,0|1,0,0]=3 8057 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2Cl 240690a_100000705350_100000720304 [0,2,0,0,0,0|1,0,0]=3 8058 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2F 11a_100000705350_100016256065 [0,2,0,0,0,0|1,0,0]=3 8059 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2F 1626a_100000705350_100016256065 [0,2,0,0,0,0|1,0,0]=3 8060 B22R2.130366 Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2F 240690a_100000705350_100016256065 [0,2,0,0,0,0|1,0,0]=3 8061 B22R2.130366 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccc2Br 22a_100011197965_100000719032 [0,2,0,0,0,0|2,0,0]=4 8062 B22R2.130366 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccc2C 22a_100011197965_100016266485 [0,2,0,0,0,0|2,0,0]=4 8063 B22R2.130366 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccc2Cl 22a_100011197965_100000720304 [0,2,0,0,0,0|2,0,0]=4 8064 B22R2.130366 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccc2F 22a_100011197965_100016256065 [0,2,0,0,0,0|2,0,0]=4 8065 B22R2.130366 Cc1ccc(cc1)CNNC(=O)C=Cc2ccccc2O 22a_100011197965_100016263591 [0,2,0,0,0,0|2,0,0]=4 8066 B22R2.130366 Cc1ccc(cc1)OCCC(=O)C=Cc2ccccc2Br 1458a_100000719032_100000183172 [0,2,0,0,0,0|2,0,0]=4 8067 B22R2.130366 Cc1ccc(cc1)OCCC(=O)C=Cc2ccccc2Cl 1458a_100000720304_100000183172 [0,2,0,0,0,0|2,0,0]=4 8068 B22R2.130366 Cc1ccc(cc1)OCCC(=O)C=Cc2ccccc2F 1458a_100016256065_100000183172 [0,2,0,0,0,0|2,0,0]=4 8069 B22R2.130366 Cc1ccc(cc1)OCCC(=O)C=Cc2ccccc2O 1458a_100016263591_100000183172 [0,2,0,0,0,0|2,0,0]=4 8070 B22R2.130366 Cc1ccccc1C=CC(=O)NCCc2ccc(cc2)Br 1626a_100000755846_100016266485 [0,2,0,0,0,0|1,0,0]=3 8071 B22R2.130366 Cc1ccccc1C=CC(=O)NCCc2ccc(cc2)Cl 1626a_100000185265_100016266485 [0,2,0,0,0,0|1,0,0]=3 8072 B22R2.130366 Cc1ccccc1C=CC(=O)NCCc2ccc(cc2)F 1626a_100000199005_100016266485 [0,2,0,0,0,0|1,0,0]=3 8073 B22R2.130366 Cc1ccccc1C=CC(=O)NNCc2ccc(cc2)Br 22a_100016993955_100016266485 [0,2,0,0,0,0|2,0,0]=4 8074 B22R2.130366 Cc1ccccc1C=CC(=O)NNCc2ccc(cc2)Cl 22a_100000689899_100016266485 [0,2,0,0,0,0|2,0,0]=4 8075 B22R2.130366 Cc1ccccc1C=CC(=O)NNCc2ccc(cc2)F 22a_100000689900_100016266485 [0,2,0,0,0,0|2,0,0]=4 8076 B22R2.130366 Cc1ccccc1C=CC(=O)NNCc2ccc(cc2)I 22a_102495363730_100016266485 [0,2,0,0,0,0|2,0,0]=4 8077 B22R2.130366 O=C(C=Cc1ccccc1Br)CCCc2ccc(cc2)Br 1458a_100000719032_100011713682 [0,2,0,0,0,0|1,0,0]=3 8078 B22R2.130366 O=C(C=Cc1ccccc1Br)CCCc2ccc(cc2)Cl 1458a_100000719032_100000759440 [0,2,0,0,0,0|1,0,0]=3 8079 B22R2.130366 O=C(C=Cc1ccccc1Br)CCCc2ccc(cc2)F 1458a_100000719032_200011713563 [0,2,0,0,0,0|1,0,0]=3 8080 B22R2.130366 O=C(C=Cc1ccccc1Br)CCOc2ccc(cc2)Br 1458a_100000719032_100000183278 [0,2,0,0,0,0|2,0,0]=4 8081 B22R2.130366 O=C(C=Cc1ccccc1Br)CCOc2ccc(cc2)Cl 1458a_100000719032_100000184122 [0,2,0,0,0,0|2,0,0]=4 8082 B22R2.130366 O=C(C=Cc1ccccc1Br)CCOc2ccc(cc2)F 1458a_100000719032_100000184936 [0,2,0,0,0,0|2,0,0]=4 8083 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)Br 11a_100000755846_100000719032 [0,2,0,0,0,0|1,0,0]=3 8084 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)Br 1626a_100000755846_100000719032 [0,2,0,0,0,0|1,0,0]=3 8085 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)Br 240690a_100000755846_100000719032 [0,2,0,0,0,0|1,0,0]=3 8086 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)Cl 11a_100000185265_100000719032 [0,2,0,0,0,0|1,0,0]=3 8087 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)Cl 1626a_100000185265_100000719032 [0,2,0,0,0,0|1,0,0]=3 8088 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)Cl 240690a_100000185265_100000719032 [0,2,0,0,0,0|1,0,0]=3 8089 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)F 11a_100000199005_100000719032 [0,2,0,0,0,0|1,0,0]=3 8090 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)F 1626a_100000199005_100000719032 [0,2,0,0,0,0|1,0,0]=3 8091 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)F 240690a_100000199005_100000719032 [0,2,0,0,0,0|1,0,0]=3 8092 B22R2.130366 O=C(C=Cc1ccccc1Br)NCCc2ccc(cc2)O 240690a_100000743037_100000719032 [0,2,0,0,0,0|1,0,0]=3 8093 B22R2.130366 O=C(C=Cc1ccccc1Br)NNCc2ccc(cc2)Br 22a_100016993955_100000719032 [0,2,0,0,0,0|2,0,0]=4 8094 B22R2.130366 O=C(C=Cc1ccccc1Br)NNCc2ccc(cc2)Cl 22a_100000689899_100000719032 [0,2,0,0,0,0|2,0,0]=4 8095 B22R2.130366 O=C(C=Cc1ccccc1Br)NNCc2ccc(cc2)F 22a_100000689900_100000719032 [0,2,0,0,0,0|2,0,0]=4 8096 B22R2.130366 O=C(C=Cc1ccccc1Br)NNCc2ccc(cc2)I 22a_102495363730_100000719032 [0,2,0,0,0,0|2,0,0]=4 8097 B22R2.130366 O=C(C=Cc1ccccc1Cl)CCCc2ccc(cc2)Br 1458a_100000720304_100011713682 [0,2,0,0,0,0|1,0,0]=3 8098 B22R2.130366 O=C(C=Cc1ccccc1Cl)CCCc2ccc(cc2)Cl 1458a_100000720304_100000759440 [0,2,0,0,0,0|1,0,0]=3 8099 B22R2.130366 O=C(C=Cc1ccccc1Cl)CCCc2ccc(cc2)F 1458a_100000720304_200011713563 [0,2,0,0,0,0|1,0,0]=3 8100 B22R2.130366 O=C(C=Cc1ccccc1Cl)CCOc2ccc(cc2)Br 1458a_100000720304_100000183278 [0,2,0,0,0,0|2,0,0]=4 8101 B22R2.130366 O=C(C=Cc1ccccc1Cl)CCOc2ccc(cc2)Cl 1458a_100000720304_100000184122 [0,2,0,0,0,0|2,0,0]=4 8102 B22R2.130366 O=C(C=Cc1ccccc1Cl)CCOc2ccc(cc2)F 1458a_100000720304_100000184936 [0,2,0,0,0,0|2,0,0]=4 8103 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)Br 11a_100000755846_100000720304 [0,2,0,0,0,0|1,0,0]=3 8104 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)Br 1626a_100000755846_100000720304 [0,2,0,0,0,0|1,0,0]=3 8105 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)Br 240690a_100000755846_100000720304 [0,2,0,0,0,0|1,0,0]=3 8106 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)Cl 11a_100000185265_100000720304 [0,2,0,0,0,0|1,0,0]=3 8107 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)Cl 1626a_100000185265_100000720304 [0,2,0,0,0,0|1,0,0]=3 8108 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)Cl 240690a_100000185265_100000720304 [0,2,0,0,0,0|1,0,0]=3 8109 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)F 11a_100000199005_100000720304 [0,2,0,0,0,0|1,0,0]=3 8110 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)F 1626a_100000199005_100000720304 [0,2,0,0,0,0|1,0,0]=3 8111 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)F 240690a_100000199005_100000720304 [0,2,0,0,0,0|1,0,0]=3 8112 B22R2.130366 O=C(C=Cc1ccccc1Cl)NCCc2ccc(cc2)O 240690a_100000743037_100000720304 [0,2,0,0,0,0|1,0,0]=3 8113 B22R2.130366 O=C(C=Cc1ccccc1Cl)NNCc2ccc(cc2)Br 22a_100016993955_100000720304 [0,2,0,0,0,0|2,0,0]=4 8114 B22R2.130366 O=C(C=Cc1ccccc1Cl)NNCc2ccc(cc2)Cl 22a_100000689899_100000720304 [0,2,0,0,0,0|2,0,0]=4 8115 B22R2.130366 O=C(C=Cc1ccccc1Cl)NNCc2ccc(cc2)F 22a_100000689900_100000720304 [0,2,0,0,0,0|2,0,0]=4 8116 B22R2.130366 O=C(C=Cc1ccccc1Cl)NNCc2ccc(cc2)I 22a_102495363730_100000720304 [0,2,0,0,0,0|2,0,0]=4 8117 B22R2.130366 O=C(C=Cc1ccccc1F)CCCc2ccc(cc2)Br 1458a_100016256065_100011713682 [0,2,0,0,0,0|1,0,0]=3 8118 B22R2.130366 O=C(C=Cc1ccccc1F)CCCc2ccc(cc2)Cl 1458a_100016256065_100000759440 [0,2,0,0,0,0|1,0,0]=3 8119 B22R2.130366 O=C(C=Cc1ccccc1F)CCCc2ccc(cc2)F 1458a_100016256065_200011713563 [0,2,0,0,0,0|1,0,0]=3 8120 B22R2.130366 O=C(C=Cc1ccccc1F)CCOc2ccc(cc2)Br 1458a_100016256065_100000183278 [0,2,0,0,0,0|2,0,0]=4 8121 B22R2.130366 O=C(C=Cc1ccccc1F)CCOc2ccc(cc2)Cl 1458a_100016256065_100000184122 [0,2,0,0,0,0|2,0,0]=4 8122 B22R2.130366 O=C(C=Cc1ccccc1F)CCOc2ccc(cc2)F 1458a_100016256065_100000184936 [0,2,0,0,0,0|2,0,0]=4 8123 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)Br 11a_100000755846_100016256065 [0,2,0,0,0,0|1,0,0]=3 8124 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)Br 1626a_100000755846_100016256065 [0,2,0,0,0,0|1,0,0]=3 8125 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)Br 240690a_100000755846_100016256065 [0,2,0,0,0,0|1,0,0]=3 8126 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)Cl 11a_100000185265_100016256065 [0,2,0,0,0,0|1,0,0]=3 8127 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)Cl 1626a_100000185265_100016256065 [0,2,0,0,0,0|1,0,0]=3 8128 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)Cl 240690a_100000185265_100016256065 [0,2,0,0,0,0|1,0,0]=3 8129 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)F 11a_100000199005_100016256065 [0,2,0,0,0,0|1,0,0]=3 8130 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)F 1626a_100000199005_100016256065 [0,2,0,0,0,0|1,0,0]=3 8131 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)F 240690a_100000199005_100016256065 [0,2,0,0,0,0|1,0,0]=3 8132 B22R2.130366 O=C(C=Cc1ccccc1F)NCCc2ccc(cc2)O 240690a_100000743037_100016256065 [0,2,0,0,0,0|1,0,0]=3 8133 B22R2.130366 O=C(C=Cc1ccccc1F)NNCc2ccc(cc2)Br 22a_100016993955_100016256065 [0,2,0,0,0,0|2,0,0]=4 8134 B22R2.130366 O=C(C=Cc1ccccc1F)NNCc2ccc(cc2)Cl 22a_100000689899_100016256065 [0,2,0,0,0,0|2,0,0]=4 8135 B22R2.130366 O=C(C=Cc1ccccc1F)NNCc2ccc(cc2)F 22a_100000689900_100016256065 [0,2,0,0,0,0|2,0,0]=4 8136 B22R2.130366 O=C(C=Cc1ccccc1F)NNCc2ccc(cc2)I 22a_102495363730_100016256065 [0,2,0,0,0,0|2,0,0]=4 8137 B22R2.130366 O=C(C=Cc1ccccc1O)CCCc2ccc(cc2)Br 1458a_100016263591_100011713682 [0,2,0,0,0,0|1,0,0]=3 8138 B22R2.130366 O=C(C=Cc1ccccc1O)CCCc2ccc(cc2)Cl 1458a_100016263591_100000759440 [0,2,0,0,0,0|1,0,0]=3 8139 B22R2.130366 O=C(C=Cc1ccccc1O)CCCc2ccc(cc2)F 1458a_100016263591_200011713563 [0,2,0,0,0,0|1,0,0]=3 8140 B22R2.130366 O=C(C=Cc1ccccc1O)CCOc2ccc(cc2)Br 1458a_100016263591_100000183278 [0,2,0,0,0,0|2,0,0]=4 8141 B22R2.130366 O=C(C=Cc1ccccc1O)CCOc2ccc(cc2)Cl 1458a_100016263591_100000184122 [0,2,0,0,0,0|2,0,0]=4 8142 B22R2.130366 O=C(C=Cc1ccccc1O)CCOc2ccc(cc2)F 1458a_100016263591_100000184936 [0,2,0,0,0,0|2,0,0]=4 8143 B22R2.130366 O=C(C=Cc1ccccc1O)NNCc2ccc(cc2)Br 22a_100016993955_100016263591 [0,2,0,0,0,0|2,0,0]=4 8144 B22R2.130366 O=C(C=Cc1ccccc1O)NNCc2ccc(cc2)Cl 22a_100000689899_100016263591 [0,2,0,0,0,0|2,0,0]=4 8145 B22R2.130366 O=C(C=Cc1ccccc1O)NNCc2ccc(cc2)F 22a_100000689900_100016263591 [0,2,0,0,0,0|2,0,0]=4 8146 B22R2.130366 O=C(C=Cc1ccccc1O)NNCc2ccc(cc2)I 22a_102495363730_100016263591 [0,2,0,0,0,0|2,0,0]=4 8147 B22R2.140611 Cc1c(cccc1C=CC(=O)CCCc2ccccc2)F 1458a_100102526135_100000211621 [0,2,0,0,0,0|1,0,0]=3 8148 B22R2.140611 Cc1c(cccc1C=CC(=O)CCOc2ccccc2)F 1458a_100102526135_100000184471 [0,2,0,0,0,0|2,0,0]=4 8149 B22R2.140611 Cc1c(cccc1C=CC(=O)CCSc2ccccc2)F 1458a_100102526135_100000246102 [0,2,0,0,0,0|2,0,0]=4 8150 B22R2.140611 Cc1c(cccc1C=CC(=O)CSCc2ccccc2)F 1458a_100102526135_200011217039 [0,2,0,0,0,0|2,0,0]=4 8151 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccccc2)F 11a_100000106460_100102526135 [0,2,0,0,0,0|1,0,0]=3 8152 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccccc2)F 1626a_100000106460_100102526135 [0,2,0,0,0,0|1,0,0]=3 8153 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccccc2)F 240690a_100000106460_100102526135 [0,2,0,0,0,0|1,0,0]=3 8154 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccccn2)F 11a_100000211156_100102526135 [0,2,0,0,0,0|2,0,0]=4 8155 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccccn2)F 1626a_100000211156_100102526135 [0,2,0,0,0,0|2,0,0]=4 8156 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccccn2)F 240690a_100000211156_100102526135 [0,2,0,0,0,0|2,0,0]=4 8157 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2cccnc2)F 11a_100000736294_100102526135 [0,2,0,0,0,0|2,0,0]=4 8158 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2cccnc2)F 1626a_100000736294_100102526135 [0,2,0,0,0,0|2,0,0]=4 8159 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2cccnc2)F 240690a_100000736294_100102526135 [0,2,0,0,0,0|2,0,0]=4 8160 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccncc2)F 11a_100000742849_100102526135 [0,2,0,0,0,0|2,0,0]=4 8161 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccncc2)F 1626a_100000742849_100102526135 [0,2,0,0,0,0|2,0,0]=4 8162 B22R2.140611 Cc1c(cccc1C=CC(=O)NCCc2ccncc2)F 240690a_100000742849_100102526135 [0,2,0,0,0,0|2,0,0]=4 8163 B22R2.140611 Cc1c(cccc1C=CC(=O)NNCc2ccccc2)F 22a_100000007032_100102526135 [0,2,0,0,0,0|2,0,0]=4 8164 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)Br 34a_100000750434_200000077782 [0,2,0,0,0,0|1,0,1]=4 8165 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)Cl 2230a_100000210441_200000077782 [0,2,0,0,0,0|1,0,1]=4 8166 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)Cl 34a_100000210441_200000077782 [0,2,0,0,0,0|1,0,1]=4 8167 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)Cl 7a_100000210441_200000077782 [0,2,0,0,0,0|1,0,1]=4 8168 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)F 34a_100000745574_200000077782 [0,2,0,0,0,0|1,0,1]=4 8169 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)F 7a_100000745574_200000077782 [0,2,0,0,0,0|1,0,1]=4 8170 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)I 34a_100000761887_200000077782 [0,2,0,0,0,0|1,0,1]=4 8171 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)O 34a_100011216573_200000077782 [0,2,0,0,0,0|1,0,1]=4 8172 B22R2.140611 Cc1c(cccc1NCC(=O)OCCc2ccccc2)O 7a_100011216573_200000077782 [0,2,0,0,0,0|1,0,1]=4 8173 B22R2.140611 Cc1c(cccc1OCC(=O)OCCc2ccccc2)Br 34a_100012002258_200000077782 [0,2,0,0,0,0|1,0,1]=4 8174 B22R2.140611 Cc1c(cccc1OCC(=O)OCCc2ccccc2)Br 7a_100012002258_200000077782 [0,2,0,0,0,0|1,0,1]=4 8175 B22R2.140611 Cc1c(cccc1OCC(=O)OCCc2ccccc2)Cl 34a_100011265684_200000077782 [0,2,0,0,0,0|1,0,1]=4 8176 B22R2.140611 Cc1c(cccc1OCC(=O)OCCc2ccccc2)Cl 7a_100011265684_200000077782 [0,2,0,0,0,0|1,0,1]=4 8177 B22R2.140611 Cc1c(cccc1OCC(=O)OCCc2ccccc2)F 34a_100011217231_200000077782 [0,2,0,0,0,0|1,0,1]=4 8178 B22R2.140611 Cc1c(cccc1OCC(=O)OCCc2ccccc2)F 7a_100011217231_200000077782 [0,2,0,0,0,0|1,0,1]=4 8179 B22R2.140611 Cc1c(cccc1OCC(=O)OCCc2ccccc2)N 34a_100011216573_200000077782 [0,2,0,0,0,0|1,0,1]=4 8180 B22R2.140611 Cc1c(cccc1OCC(=O)OCCc2ccccc2)N 7a_100011216573_200000077782 [0,2,0,0,0,0|1,0,1]=4 8181 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)Br 62a_100012353703_200000077782 [0,2,0,0,0,0|1,0,1]=4 8182 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100012353703 [0,2,0,0,0,0|1,0,1]=4 8183 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)Cl 62a_100000726075_200000077782 [0,2,0,0,0,0|1,0,1]=4 8184 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100000726075 [0,2,0,0,0,0|1,0,1]=4 8185 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)F 62a_100011216893_200000077782 [0,2,0,0,0,0|1,0,1]=4 8186 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)F 62a_200000077782_100011216893 [0,2,0,0,0,0|1,0,1]=4 8187 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)N 62a_100000761887_200000077782 [0,2,0,0,0,0|1,0,1]=4 8188 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)N 62a_200000077782_100000761887 [0,2,0,0,0,0|1,0,1]=4 8189 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)O 62a_100012002258_200000077782 [0,2,0,0,0,0|1,0,1]=4 8190 B22R2.140611 Cc1c(cccc1SCC(=O)OCCc2ccccc2)O 62a_200000077782_100012002258 [0,2,0,0,0,0|1,0,1]=4 8191 B22R2.140611 Cc1cccc(c1Br)NCC(=O)OCCc2ccccc2 34a_100000684715_200000077782 [0,2,0,0,0,0|1,0,1]=4 8192 B22R2.140611 Cc1cccc(c1Br)OCC(=O)OCCc2ccccc2 34a_100000686692_200000077782 [0,2,0,0,0,0|1,0,1]=4 8193 B22R2.140611 Cc1cccc(c1Br)OCC(=O)OCCc2ccccc2 7a_100000686692_200000077782 [0,2,0,0,0,0|1,0,1]=4 8194 B22R2.140611 Cc1cccc(c1Br)SCC(=O)OCCc2ccccc2 62a_100012362457_200000077782 [0,2,0,0,0,0|1,0,1]=4 8195 B22R2.140611 Cc1cccc(c1Br)SCC(=O)OCCc2ccccc2 62a_200000077782_100012362457 [0,2,0,0,0,0|1,0,1]=4 8196 B22R2.140611 Cc1cccc(c1C)NCC(=O)OCCc2ccccc2 2230a_100000210026_200000077782 [0,2,0,0,0,0|1,0,1]=4 8197 B22R2.140611 Cc1cccc(c1C)NCC(=O)OCCc2ccccc2 34a_100000210026_200000077782 [0,2,0,0,0,0|1,0,1]=4 8198 B22R2.140611 Cc1cccc(c1C)NCC(=O)OCCc2ccccc2 7a_100000210026_200000077782 [0,2,0,0,0,0|1,0,1]=4 8199 B22R2.140611 Cc1cccc(c1C)OCC(=O)OCCc2ccccc2 34a_100000185855_200000077782 [0,2,0,0,0,0|1,0,1]=4 8200 B22R2.140611 Cc1cccc(c1C)OCC(=O)OCCc2ccccc2 7a_100000185855_200000077782 [0,2,0,0,0,0|1,0,1]=4 8201 B22R2.140611 Cc1cccc(c1C)SCC(=O)OCCc2ccccc2 62a_100011214922_200000077782 [0,2,0,0,0,0|1,0,1]=4 8202 B22R2.140611 Cc1cccc(c1C)SCC(=O)OCCc2ccccc2 62a_200000077782_100011214922 [0,2,0,0,0,0|1,0,1]=4 8203 B22R2.140611 Cc1cccc(c1Cl)NCC(=O)OCCc2ccccc2 34a_100000765562_200000077782 [0,2,0,0,0,0|1,0,1]=4 8204 B22R2.140611 Cc1cccc(c1Cl)NCC(=O)OCCc2ccccc2 7a_100000765562_200000077782 [0,2,0,0,0,0|1,0,1]=4 8205 B22R2.140611 Cc1cccc(c1Cl)OCC(=O)OCCc2ccccc2 34a_100000695629_200000077782 [0,2,0,0,0,0|1,0,1]=4 8206 B22R2.140611 Cc1cccc(c1Cl)OCC(=O)OCCc2ccccc2 7a_100000695629_200000077782 [0,2,0,0,0,0|1,0,1]=4 8207 B22R2.140611 Cc1cccc(c1Cl)SCC(=O)OCCc2ccccc2 62a_200000077782_200012352035 [0,2,0,0,0,0|1,0,1]=4 8208 B22R2.140611 Cc1cccc(c1Cl)SCC(=O)OCCc2ccccc2 62a_200012352035_200000077782 [0,2,0,0,0,0|1,0,1]=4 8209 B22R2.140611 Cc1cccc(c1F)NCC(=O)OCCc2ccccc2 2230a_100000697159_200000077782 [0,2,0,0,0,0|1,0,1]=4 8210 B22R2.140611 Cc1cccc(c1F)NCC(=O)OCCc2ccccc2 34a_100000697159_200000077782 [0,2,0,0,0,0|1,0,1]=4 8211 B22R2.140611 Cc1cccc(c1F)NCC(=O)OCCc2ccccc2 7a_100000697159_200000077782 [0,2,0,0,0,0|1,0,1]=4 8212 B22R2.140611 Cc1cccc(c1F)OCC(=O)OCCc2ccccc2 34a_100000751311_200000077782 [0,2,0,0,0,0|1,0,1]=4 8213 B22R2.140611 Cc1cccc(c1F)OCC(=O)OCCc2ccccc2 7a_100000751311_200000077782 [0,2,0,0,0,0|1,0,1]=4 8214 B22R2.140611 Cc1cccc(c1F)SCC(=O)OCCc2ccccc2 62a_100000717567_200000077782 [0,2,0,0,0,0|1,0,1]=4 8215 B22R2.140611 Cc1cccc(c1F)SCC(=O)OCCc2ccccc2 62a_200000077782_100000717567 [0,2,0,0,0,0|1,0,1]=4 8216 B22R2.140611 Cc1cccc(c1I)NCC(=O)OCCc2ccccc2 34a_100000761888_200000077782 [0,2,0,0,0,0|1,0,1]=4 8217 B22R2.140611 Cc1cccc(c1I)OCC(=O)OCCc2ccccc2 34a_100010083724_200000077782 [0,2,0,0,0,0|1,0,1]=4 8218 B22R2.140611 Cc1cccc(c1I)OCC(=O)OCCc2ccccc2 7a_100010083724_200000077782 [0,2,0,0,0,0|1,0,1]=4 8219 B22R2.140611 Cc1cccc(c1N)OCC(=O)OCCc2ccccc2 34a_100000743429_200000077782 [0,2,0,0,0,0|1,0,1]=4 8220 B22R2.140611 Cc1cccc(c1N)OCC(=O)OCCc2ccccc2 7a_100000743429_200000077782 [0,2,0,0,0,0|1,0,1]=4 8221 B22R2.140611 Cc1cccc(c1N)SCC(=O)OCCc2ccccc2 62a_100011834072_200000077782 [0,2,0,0,0,0|1,0,1]=4 8222 B22R2.140611 Cc1cccc(c1N)SCC(=O)OCCc2ccccc2 62a_200000077782_100011834072 [0,2,0,0,0,0|1,0,1]=4 8223 B22R2.140611 Cc1cccc(c1O)NCC(=O)OCCc2ccccc2 34a_100000756359_200000077782 [0,2,0,0,0,0|1,0,1]=4 8224 B22R2.140611 Cc1cccc(c1O)SCC(=O)OCCc2ccccc2 62a_100009817157_200000077782 [0,2,0,0,0,0|1,0,1]=4 8225 B22R2.140611 Cc1cccc(c1O)SCC(=O)OCCc2ccccc2 62a_200000077782_100009817157 [0,2,0,0,0,0|1,0,1]=4 8226 B22R2.140611 Nc1c(cccc1OCC(=O)OCCc2ccccc2)Br 34a_100011934926_200000077782 [0,2,0,0,0,0|1,0,1]=4 8227 B22R2.140611 Nc1c(cccc1OCC(=O)OCCc2ccccc2)Br 7a_100011934926_200000077782 [0,2,0,0,0,0|1,0,1]=4 8228 B22R2.140611 Nc1c(cccc1OCC(=O)OCCc2ccccc2)Cl 34a_100012022510_200000077782 [0,2,0,0,0,0|1,0,1]=4 8229 B22R2.140611 Nc1c(cccc1OCC(=O)OCCc2ccccc2)Cl 7a_100012022510_200000077782 [0,2,0,0,0,0|1,0,1]=4 8230 B22R2.140611 Nc1c(cccc1OCC(=O)OCCc2ccccc2)F 34a_100020591140_200000077782 [0,2,0,0,0,0|1,0,1]=4 8231 B22R2.140611 Nc1c(cccc1OCC(=O)OCCc2ccccc2)F 7a_100020591140_200000077782 [0,2,0,0,0,0|1,0,1]=4 8232 B22R2.140611 Nc1c(cccc1OCC(=O)OCCc2ccccc2)I 34a_200000049512_200000077782 [0,2,0,0,0,0|1,0,1]=4 8233 B22R2.140611 Nc1c(cccc1OCC(=O)OCCc2ccccc2)I 7a_200000049512_200000077782 [0,2,0,0,0,0|1,0,1]=4 8234 B22R2.140611 Nc1c(cccc1SCC(=O)OCCc2ccccc2)Br 62a_100010146558_200000077782 [0,2,0,0,0,0|1,0,1]=4 8235 B22R2.140611 Nc1c(cccc1SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100010146558 [0,2,0,0,0,0|1,0,1]=4 8236 B22R2.140611 Nc1c(cccc1SCC(=O)OCCc2ccccc2)Cl 62a_100010190421_200000077782 [0,2,0,0,0,0|1,0,1]=4 8237 B22R2.140611 Nc1c(cccc1SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100010190421 [0,2,0,0,0,0|1,0,1]=4 8238 B22R2.140611 Nc1c(cccc1SCC(=O)OCCc2ccccc2)F 62a_100000042321_200000077782 [0,2,0,0,0,0|1,0,1]=4 8239 B22R2.140611 Nc1c(cccc1SCC(=O)OCCc2ccccc2)F 62a_200000077782_100000042321 [0,2,0,0,0,0|1,0,1]=4 8240 B22R2.140611 Nc1c(cccc1SCC(=O)OCCc2ccccc2)O 62a_200000077782_100011934926 [0,2,0,0,0,0|1,0,1]=4 8241 B22R2.140611 Nc1cccc(c1Br)OCC(=O)OCCc2ccccc2 34a_100012183704_200000077782 [0,2,0,0,0,0|1,0,1]=4 8242 B22R2.140611 Nc1cccc(c1Br)OCC(=O)OCCc2ccccc2 7a_100012183704_200000077782 [0,2,0,0,0,0|1,0,1]=4 8243 B22R2.140611 Nc1cccc(c1Cl)OCC(=O)OCCc2ccccc2 34a_100012002038_200000077782 [0,2,0,0,0,0|1,0,1]=4 8244 B22R2.140611 Nc1cccc(c1Cl)OCC(=O)OCCc2ccccc2 7a_100012002038_200000077782 [0,2,0,0,0,0|1,0,1]=4 8245 B22R2.140611 Nc1cccc(c1F)SCC(=O)OCCc2ccccc2 62a_100011935091_200000077782 [0,2,0,0,0,0|1,0,1]=4 8246 B22R2.140611 Nc1cccc(c1F)SCC(=O)OCCc2ccccc2 62a_200000077782_100011935091 [0,2,0,0,0,0|1,0,1]=4 8247 B22R2.140611 Nc1cccc(c1N)OCC(=O)OCCc2ccccc2 34a_100000033209_200000077782 [0,2,0,0,0,0|1,0,1]=4 8248 B22R2.140611 Nc1cccc(c1N)SCC(=O)OCCc2ccccc2 62a_100015191791_200000077782 [0,2,0,0,0,0|1,0,1]=4 8249 B22R2.140611 Nc1cccc(c1O)SCC(=O)OCCc2ccccc2 62a_100011934915_200000077782 [0,2,0,0,0,0|1,0,1]=4 8250 B22R2.140611 Nc1cccc(c1O)SCC(=O)OCCc2ccccc2 62a_200000077782_100010084371 [0,2,0,0,0,0|1,0,1]=4 8251 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)CCCc2ccccc2 1458a_100000184505_100000211621 [0,2,0,0,0,0|1,0,0]=3 8252 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)CCOc2ccccc2 1458a_100000184505_100000184471 [0,2,0,0,0,0|2,0,0]=4 8253 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)CCSc2ccccc2 1458a_100000184505_100000246102 [0,2,0,0,0,0|2,0,0]=4 8254 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)CSCc2ccccc2 1458a_100000184505_200011217039 [0,2,0,0,0,0|2,0,0]=4 8255 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccccc2 11a_100000106460_100000184505 [0,2,0,0,0,0|1,0,0]=3 8256 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccccc2 1626a_100000106460_100000184505 [0,2,0,0,0,0|1,0,0]=3 8257 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccccc2 240690a_100000106460_100000184505 [0,2,0,0,0,0|1,0,0]=3 8258 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccccn2 11a_100000211156_100000184505 [0,2,0,0,0,0|2,0,0]=4 8259 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccccn2 1626a_100000211156_100000184505 [0,2,0,0,0,0|2,0,0]=4 8260 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccccn2 240690a_100000211156_100000184505 [0,2,0,0,0,0|2,0,0]=4 8261 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2cccnc2 11a_100000736294_100000184505 [0,2,0,0,0,0|2,0,0]=4 8262 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2cccnc2 1626a_100000736294_100000184505 [0,2,0,0,0,0|2,0,0]=4 8263 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2cccnc2 240690a_100000736294_100000184505 [0,2,0,0,0,0|2,0,0]=4 8264 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccncc2 11a_100000742849_100000184505 [0,2,0,0,0,0|2,0,0]=4 8265 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccncc2 1626a_100000742849_100000184505 [0,2,0,0,0,0|2,0,0]=4 8266 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NCCc2ccncc2 240690a_100000742849_100000184505 [0,2,0,0,0,0|2,0,0]=4 8267 B22R2.140611 O=C(C=Cc1cccc(c1Cl)Cl)NNCc2ccccc2 22a_100000007032_100000184505 [0,2,0,0,0,0|2,0,0]=4 8268 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)CCCc2ccccc2 1458a_100012351547_100000211621 [0,2,0,0,0,0|1,0,0]=3 8269 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)CCOc2ccccc2 1458a_100012351547_100000184471 [0,2,0,0,0,0|2,0,0]=4 8270 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)CCSc2ccccc2 1458a_100012351547_100000246102 [0,2,0,0,0,0|2,0,0]=4 8271 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)CSCc2ccccc2 1458a_100012351547_200011217039 [0,2,0,0,0,0|2,0,0]=4 8272 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccccc2 11a_100000106460_100012351547 [0,2,0,0,0,0|1,0,0]=3 8273 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccccc2 1626a_100000106460_100012351547 [0,2,0,0,0,0|1,0,0]=3 8274 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccccc2 240690a_100000106460_100012351547 [0,2,0,0,0,0|1,0,0]=3 8275 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccccn2 11a_100000211156_100012351547 [0,2,0,0,0,0|2,0,0]=4 8276 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccccn2 1626a_100000211156_100012351547 [0,2,0,0,0,0|2,0,0]=4 8277 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccccn2 240690a_100000211156_100012351547 [0,2,0,0,0,0|2,0,0]=4 8278 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2cccnc2 11a_100000736294_100012351547 [0,2,0,0,0,0|2,0,0]=4 8279 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2cccnc2 1626a_100000736294_100012351547 [0,2,0,0,0,0|2,0,0]=4 8280 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2cccnc2 240690a_100000736294_100012351547 [0,2,0,0,0,0|2,0,0]=4 8281 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccncc2 11a_100000742849_100012351547 [0,2,0,0,0,0|2,0,0]=4 8282 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccncc2 1626a_100000742849_100012351547 [0,2,0,0,0,0|2,0,0]=4 8283 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NCCc2ccncc2 240690a_100000742849_100012351547 [0,2,0,0,0,0|2,0,0]=4 8284 B22R2.140611 O=C(C=Cc1cccc(c1F)Br)NNCc2ccccc2 22a_100000007032_100012351547 [0,2,0,0,0,0|2,0,0]=4 8285 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)CCCc2ccccc2 1458a_100011217667_100000211621 [0,2,0,0,0,0|1,0,0]=3 8286 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)CCOc2ccccc2 1458a_100011217667_100000184471 [0,2,0,0,0,0|2,0,0]=4 8287 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)CCSc2ccccc2 1458a_100011217667_100000246102 [0,2,0,0,0,0|2,0,0]=4 8288 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)CSCc2ccccc2 1458a_100011217667_200011217039 [0,2,0,0,0,0|2,0,0]=4 8289 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccccc2 11a_100000106460_100011217667 [0,2,0,0,0,0|1,0,0]=3 8290 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccccc2 1626a_100000106460_100011217667 [0,2,0,0,0,0|1,0,0]=3 8291 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccccc2 240690a_100000106460_100011217667 [0,2,0,0,0,0|1,0,0]=3 8292 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccccn2 11a_100000211156_100011217667 [0,2,0,0,0,0|2,0,0]=4 8293 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccccn2 1626a_100000211156_100011217667 [0,2,0,0,0,0|2,0,0]=4 8294 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccccn2 240690a_100000211156_100011217667 [0,2,0,0,0,0|2,0,0]=4 8295 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2cccnc2 11a_100000736294_100011217667 [0,2,0,0,0,0|2,0,0]=4 8296 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2cccnc2 1626a_100000736294_100011217667 [0,2,0,0,0,0|2,0,0]=4 8297 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2cccnc2 240690a_100000736294_100011217667 [0,2,0,0,0,0|2,0,0]=4 8298 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccncc2 11a_100000742849_100011217667 [0,2,0,0,0,0|2,0,0]=4 8299 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccncc2 1626a_100000742849_100011217667 [0,2,0,0,0,0|2,0,0]=4 8300 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NCCc2ccncc2 240690a_100000742849_100011217667 [0,2,0,0,0,0|2,0,0]=4 8301 B22R2.140611 O=C(C=Cc1cccc(c1F)Cl)NNCc2ccccc2 22a_100000007032_100011217667 [0,2,0,0,0,0|2,0,0]=4 8302 B22R2.140611 O=C(C=Cc1cccc(c1F)F)CCCc2ccccc2 1458a_100102526107_100000211621 [0,2,0,0,0,0|1,0,0]=3 8303 B22R2.140611 O=C(C=Cc1cccc(c1F)F)CCOc2ccccc2 1458a_100102526107_100000184471 [0,2,0,0,0,0|2,0,0]=4 8304 B22R2.140611 O=C(C=Cc1cccc(c1F)F)CCSc2ccccc2 1458a_100102526107_100000246102 [0,2,0,0,0,0|2,0,0]=4 8305 B22R2.140611 O=C(C=Cc1cccc(c1F)F)COCc2ccccc2 6a_100000753312_100011215004 [0,2,0,0,0,0|2,0,0]=4 8306 B22R2.140611 O=C(C=Cc1cccc(c1F)F)CSCc2ccccc2 1458a_100102526107_200011217039 [0,2,0,0,0,0|2,0,0]=4 8307 B22R2.140611 O=C(C=Cc1cccc(c1F)F)CSCc2ccccc2 6a_100000753312_100000172147 [0,2,0,0,0,0|2,0,0]=4 8308 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccccc2 11a_100000106460_100102526107 [0,2,0,0,0,0|1,0,0]=3 8309 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccccc2 1626a_100000106460_100102526107 [0,2,0,0,0,0|1,0,0]=3 8310 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccccc2 240690a_100000106460_100102526107 [0,2,0,0,0,0|1,0,0]=3 8311 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccccn2 11a_100000211156_100102526107 [0,2,0,0,0,0|2,0,0]=4 8312 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccccn2 1626a_100000211156_100102526107 [0,2,0,0,0,0|2,0,0]=4 8313 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccccn2 240690a_100000211156_100102526107 [0,2,0,0,0,0|2,0,0]=4 8314 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2cccnc2 11a_100000736294_100102526107 [0,2,0,0,0,0|2,0,0]=4 8315 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2cccnc2 1626a_100000736294_100102526107 [0,2,0,0,0,0|2,0,0]=4 8316 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2cccnc2 240690a_100000736294_100102526107 [0,2,0,0,0,0|2,0,0]=4 8317 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccncc2 11a_100000742849_100102526107 [0,2,0,0,0,0|2,0,0]=4 8318 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccncc2 1626a_100000742849_100102526107 [0,2,0,0,0,0|2,0,0]=4 8319 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NCCc2ccncc2 240690a_100000742849_100102526107 [0,2,0,0,0,0|2,0,0]=4 8320 B22R2.140611 O=C(C=Cc1cccc(c1F)F)NNCc2ccccc2 22a_100000007032_100102526107 [0,2,0,0,0,0|2,0,0]=4 8321 B22R2.140611 O=C(C=Cc1cccc(c1F)I)COCc2ccccc2 6a_100010202174_100011215004 [0,2,0,0,0,0|2,0,0]=4 8322 B22R2.140611 O=C(C=Cc1cccc(c1F)I)CSCc2ccccc2 6a_100010202174_100000172147 [0,2,0,0,0,0|2,0,0]=4 8323 B22R2.140611 O=C(C=Cc1cccc(c1I)F)COCc2ccccc2 6a_100010186293_100011215004 [0,2,0,0,0,0|2,0,0]=4 8324 B22R2.140611 O=C(C=Cc1cccc(c1I)F)CSCc2ccccc2 6a_100010186293_100000172147 [0,2,0,0,0,0|2,0,0]=4 8325 B22R2.140611 O=C(CNc1cccc(c1Br)Cl)OCCc2ccccc2 34a_100000687072_200000077782 [0,2,0,0,0,0|1,0,1]=4 8326 B22R2.140611 O=C(CNc1cccc(c1Br)F)OCCc2ccccc2 34a_100011934729_200000077782 [0,2,0,0,0,0|1,0,1]=4 8327 B22R2.140611 O=C(CNc1cccc(c1Br)O)OCCc2ccccc2 34a_100012183704_200000077782 [0,2,0,0,0,0|1,0,1]=4 8328 B22R2.140611 O=C(CNc1cccc(c1Br)O)OCCc2ccccc2 7a_100012183704_200000077782 [0,2,0,0,0,0|1,0,1]=4 8329 B22R2.140611 O=C(CNc1cccc(c1Cl)Br)OCCc2ccccc2 34a_100000687075_200000077782 [0,2,0,0,0,0|1,0,1]=4 8330 B22R2.140611 O=C(CNc1cccc(c1Cl)Cl)OCCc2ccccc2 34a_100000185733_200000077782 [0,2,0,0,0,0|1,0,1]=4 8331 B22R2.140611 O=C(CNc1cccc(c1Cl)F)OCCc2ccccc2 34a_100000692321_200000077782 [0,2,0,0,0,0|1,0,1]=4 8332 B22R2.140611 O=C(CNc1cccc(c1Cl)O)OCCc2ccccc2 34a_100012002038_200000077782 [0,2,0,0,0,0|1,0,1]=4 8333 B22R2.140611 O=C(CNc1cccc(c1Cl)O)OCCc2ccccc2 7a_100012002038_200000077782 [0,2,0,0,0,0|1,0,1]=4 8334 B22R2.140611 O=C(CNc1cccc(c1F)Br)OCCc2ccccc2 2230a_100011935091_200000077782 [0,2,0,0,0,0|1,0,1]=4 8335 B22R2.140611 O=C(CNc1cccc(c1F)Br)OCCc2ccccc2 34a_100011935091_200000077782 [0,2,0,0,0,0|1,0,1]=4 8336 B22R2.140611 O=C(CNc1cccc(c1F)Cl)OCCc2ccccc2 2230a_100000199060_200000077782 [0,2,0,0,0,0|1,0,1]=4 8337 B22R2.140611 O=C(CNc1cccc(c1F)Cl)OCCc2ccccc2 34a_100000199060_200000077782 [0,2,0,0,0,0|1,0,1]=4 8338 B22R2.140611 O=C(CNc1cccc(c1F)F)OCCc2ccccc2 34a_100000743855_200000077782 [0,2,0,0,0,0|1,0,1]=4 8339 B22R2.140611 O=C(CNc1cccc(c1I)Br)OCCc2ccccc2 34a_100020590159_200000077782 [0,2,0,0,0,0|1,0,1]=4 8340 B22R2.140611 O=C(CNc1cccc(c1I)Cl)OCCc2ccccc2 34a_100000049713_200000077782 [0,2,0,0,0,0|1,0,1]=4 8341 B22R2.140611 O=C(CNc1cccc(c1I)F)OCCc2ccccc2 34a_100000690935_200000077782 [0,2,0,0,0,0|1,0,1]=4 8342 B22R2.140611 O=C(CNc1cccc(c1O)Br)OCCc2ccccc2 34a_100011934915_200000077782 [0,2,0,0,0,0|1,0,1]=4 8343 B22R2.140611 O=C(CNc1cccc(c1O)Cl)OCCc2ccccc2 34a_100000754742_200000077782 [0,2,0,0,0,0|1,0,1]=4 8344 B22R2.140611 O=C(CNc1cccc(c1O)F)OCCc2ccccc2 34a_100011934987_200000077782 [0,2,0,0,0,0|1,0,1]=4 8345 B22R2.140611 O=C(COc1cccc(c1Br)Br)OCCc2ccccc2 34a_100010187966_200000077782 [0,2,0,0,0,0|1,0,1]=4 8346 B22R2.140611 O=C(COc1cccc(c1Br)Br)OCCc2ccccc2 7a_100010187966_200000077782 [0,2,0,0,0,0|1,0,1]=4 8347 B22R2.140611 O=C(COc1cccc(c1Br)Cl)OCCc2ccccc2 34a_100012348804_200000077782 [0,2,0,0,0,0|1,0,1]=4 8348 B22R2.140611 O=C(COc1cccc(c1Br)Cl)OCCc2ccccc2 7a_100012348804_200000077782 [0,2,0,0,0,0|1,0,1]=4 8349 B22R2.140611 O=C(COc1cccc(c1Br)F)OCCc2ccccc2 34a_100009820682_200000077782 [0,2,0,0,0,0|1,0,1]=4 8350 B22R2.140611 O=C(COc1cccc(c1Br)F)OCCc2ccccc2 7a_100009820682_200000077782 [0,2,0,0,0,0|1,0,1]=4 8351 B22R2.140611 O=C(COc1cccc(c1Br)I)OCCc2ccccc2 34a_100010187914_200000077782 [0,2,0,0,0,0|1,0,1]=4 8352 B22R2.140611 O=C(COc1cccc(c1Br)I)OCCc2ccccc2 7a_100010187914_200000077782 [0,2,0,0,0,0|1,0,1]=4 8353 B22R2.140611 O=C(COc1cccc(c1Cl)Br)OCCc2ccccc2 34a_100010187913_200000077782 [0,2,0,0,0,0|1,0,1]=4 8354 B22R2.140611 O=C(COc1cccc(c1Cl)Br)OCCc2ccccc2 7a_100010187913_200000077782 [0,2,0,0,0,0|1,0,1]=4 8355 B22R2.140611 O=C(COc1cccc(c1Cl)Cl)OCCc2ccccc2 34a_100000211076_200000077782 [0,2,0,0,0,0|1,0,1]=4 8356 B22R2.140611 O=C(COc1cccc(c1Cl)Cl)OCCc2ccccc2 7a_100000211076_200000077782 [0,2,0,0,0,0|1,0,1]=4 8357 B22R2.140611 O=C(COc1cccc(c1Cl)F)OCCc2ccccc2 34a_100000087408_200000077782 [0,2,0,0,0,0|1,0,1]=4 8358 B22R2.140611 O=C(COc1cccc(c1Cl)F)OCCc2ccccc2 7a_100000087408_200000077782 [0,2,0,0,0,0|1,0,1]=4 8359 B22R2.140611 O=C(COc1cccc(c1Cl)I)OCCc2ccccc2 34a_100000049636_200000077782 [0,2,0,0,0,0|1,0,1]=4 8360 B22R2.140611 O=C(COc1cccc(c1Cl)I)OCCc2ccccc2 7a_100000049636_200000077782 [0,2,0,0,0,0|1,0,1]=4 8361 B22R2.140611 O=C(COc1cccc(c1F)Br)OCCc2ccccc2 34a_100009817021_200000077782 [0,2,0,0,0,0|1,0,1]=4 8362 B22R2.140611 O=C(COc1cccc(c1F)Br)OCCc2ccccc2 7a_100009817021_200000077782 [0,2,0,0,0,0|1,0,1]=4 8363 B22R2.140611 O=C(COc1cccc(c1F)Cl)OCCc2ccccc2 34a_100000687438_200000077782 [0,2,0,0,0,0|1,0,1]=4 8364 B22R2.140611 O=C(COc1cccc(c1F)Cl)OCCc2ccccc2 7a_100000687438_200000077782 [0,2,0,0,0,0|1,0,1]=4 8365 B22R2.140611 O=C(COc1cccc(c1F)F)OCCc2ccccc2 34a_100000751161_200000077782 [0,2,0,0,0,0|1,0,1]=4 8366 B22R2.140611 O=C(COc1cccc(c1F)F)OCCc2ccccc2 7a_100000751161_200000077782 [0,2,0,0,0,0|1,0,1]=4 8367 B22R2.140611 O=C(COc1cccc(c1I)Br)OCCc2ccccc2 34a_100010187912_200000077782 [0,2,0,0,0,0|1,0,1]=4 8368 B22R2.140611 O=C(COc1cccc(c1I)Br)OCCc2ccccc2 7a_100010187912_200000077782 [0,2,0,0,0,0|1,0,1]=4 8369 B22R2.140611 O=C(COc1cccc(c1I)Cl)OCCc2ccccc2 34a_100000050174_200000077782 [0,2,0,0,0,0|1,0,1]=4 8370 B22R2.140611 O=C(COc1cccc(c1I)Cl)OCCc2ccccc2 7a_100000050174_200000077782 [0,2,0,0,0,0|1,0,1]=4 8371 B22R2.140611 O=C(COc1cccc(c1I)F)OCCc2ccccc2 34a_100000690913_200000077782 [0,2,0,0,0,0|1,0,1]=4 8372 B22R2.140611 O=C(COc1cccc(c1I)F)OCCc2ccccc2 7a_100000690913_200000077782 [0,2,0,0,0,0|1,0,1]=4 8373 B22R2.140611 O=C(CSc1cccc(c1Br)Br)OCCc2ccccc2 62a_100010175083_200000077782 [0,2,0,0,0,0|1,0,1]=4 8374 B22R2.140611 O=C(CSc1cccc(c1Br)Br)OCCc2ccccc2 62a_200000077782_100010175083 [0,2,0,0,0,0|1,0,1]=4 8375 B22R2.140611 O=C(CSc1cccc(c1Br)Cl)OCCc2ccccc2 62a_100014021842_200000077782 [0,2,0,0,0,0|1,0,1]=4 8376 B22R2.140611 O=C(CSc1cccc(c1Br)Cl)OCCc2ccccc2 62a_200000077782_100014021842 [0,2,0,0,0,0|1,0,1]=4 8377 B22R2.140611 O=C(CSc1cccc(c1Br)F)OCCc2ccccc2 62a_100010202630_200000077782 [0,2,0,0,0,0|1,0,1]=4 8378 B22R2.140611 O=C(CSc1cccc(c1Br)F)OCCc2ccccc2 62a_200000077782_100010202630 [0,2,0,0,0,0|1,0,1]=4 8379 B22R2.140611 O=C(CSc1cccc(c1Br)O)OCCc2ccccc2 62a_100010187914_200000077782 [0,2,0,0,0,0|1,0,1]=4 8380 B22R2.140611 O=C(CSc1cccc(c1Br)O)OCCc2ccccc2 62a_200000077782_100010187914 [0,2,0,0,0,0|1,0,1]=4 8381 B22R2.140611 O=C(CSc1cccc(c1Cl)Br)OCCc2ccccc2 62a_100010142854_200000077782 [0,2,0,0,0,0|1,0,1]=4 8382 B22R2.140611 O=C(CSc1cccc(c1Cl)Br)OCCc2ccccc2 62a_200000077782_100010142854 [0,2,0,0,0,0|1,0,1]=4 8383 B22R2.140611 O=C(CSc1cccc(c1Cl)Cl)OCCc2ccccc2 62a_100011215384_200000077782 [0,2,0,0,0,0|1,0,1]=4 8384 B22R2.140611 O=C(CSc1cccc(c1Cl)Cl)OCCc2ccccc2 62a_200000077782_100011215384 [0,2,0,0,0,0|1,0,1]=4 8385 B22R2.140611 O=C(CSc1cccc(c1Cl)F)OCCc2ccccc2 62a_200000077782_200010234923 [0,2,0,0,0,0|1,0,1]=4 8386 B22R2.140611 O=C(CSc1cccc(c1Cl)F)OCCc2ccccc2 62a_200010234923_200000077782 [0,2,0,0,0,0|1,0,1]=4 8387 B22R2.140611 O=C(CSc1cccc(c1Cl)O)OCCc2ccccc2 62a_200000077782_100000049636 [0,2,0,0,0,0|1,0,1]=4 8388 B22R2.140611 O=C(CSc1cccc(c1F)Br)OCCc2ccccc2 62a_100000702267_200000077782 [0,2,0,0,0,0|1,0,1]=4 8389 B22R2.140611 O=C(CSc1cccc(c1F)Br)OCCc2ccccc2 62a_200000077782_100000702267 [0,2,0,0,0,0|1,0,1]=4 8390 B22R2.140611 O=C(CSc1cccc(c1F)Cl)OCCc2ccccc2 62a_100011217346_200000077782 [0,2,0,0,0,0|1,0,1]=4 8391 B22R2.140611 O=C(CSc1cccc(c1F)Cl)OCCc2ccccc2 62a_200000077782_100011217346 [0,2,0,0,0,0|1,0,1]=4 8392 B22R2.140611 O=C(CSc1cccc(c1F)F)OCCc2ccccc2 62a_100000694657_200000077782 [0,2,0,0,0,0|1,0,1]=4 8393 B22R2.140611 O=C(CSc1cccc(c1F)F)OCCc2ccccc2 62a_200000077782_100000694657 [0,2,0,0,0,0|1,0,1]=4 8394 B22R2.140611 O=C(CSc1cccc(c1F)O)OCCc2ccccc2 62a_100009817021_200000077782 [0,2,0,0,0,0|1,0,1]=4 8395 B22R2.140611 O=C(CSc1cccc(c1F)O)OCCc2ccccc2 62a_200000077782_100009817021 [0,2,0,0,0,0|1,0,1]=4 8396 B22R2.140611 O=C(CSc1cccc(c1O)Br)OCCc2ccccc2 62a_100010084509_200000077782 [0,2,0,0,0,0|1,0,1]=4 8397 B22R2.140611 O=C(CSc1cccc(c1O)Br)OCCc2ccccc2 62a_200000077782_100010084509 [0,2,0,0,0,0|1,0,1]=4 8398 B22R2.140611 O=C(CSc1cccc(c1O)Cl)OCCc2ccccc2 62a_100010202889_200000077782 [0,2,0,0,0,0|1,0,1]=4 8399 B22R2.140611 O=C(CSc1cccc(c1O)Cl)OCCc2ccccc2 62a_200000077782_100010202889 [0,2,0,0,0,0|1,0,1]=4 8400 B22R2.140611 O=C(CSc1cccc(c1O)F)OCCc2ccccc2 62a_100009813666_200000077782 [0,2,0,0,0,0|1,0,1]=4 8401 B22R2.140611 O=C(CSc1cccc(c1O)F)OCCc2ccccc2 62a_200000077782_100009813666 [0,2,0,0,0,0|1,0,1]=4 8402 B22R2.140611 O=C(CSc1cccc(c1O)O)OCCc2ccccc2 62a_200000077782_100009815950 [0,2,0,0,0,0|1,0,1]=4 8403 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)CCCc2ccccc2 1458a_100000693296_100000211621 [0,2,0,0,0,0|1,0,0]=3 8404 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)CCOc2ccccc2 1458a_100000693296_100000184471 [0,2,0,0,0,0|2,0,0]=4 8405 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)CCSc2ccccc2 1458a_100000693296_100000246102 [0,2,0,0,0,0|2,0,0]=4 8406 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)CSCc2ccccc2 1458a_100000693296_200011217039 [0,2,0,0,0,0|2,0,0]=4 8407 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccccc2 11a_100000106460_100000693296 [0,2,0,0,0,0|1,0,0]=3 8408 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccccc2 1626a_100000106460_100000693296 [0,2,0,0,0,0|1,0,0]=3 8409 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccccc2 240690a_100000106460_100000693296 [0,2,0,0,0,0|1,0,0]=3 8410 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccccc2 527a_100000106460_100000693296 [0,2,0,0,0,0|1,0,0]=3 8411 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccccn2 11a_100000211156_100000693296 [0,2,0,0,0,0|2,0,0]=4 8412 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccccn2 1626a_100000211156_100000693296 [0,2,0,0,0,0|2,0,0]=4 8413 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccccn2 240690a_100000211156_100000693296 [0,2,0,0,0,0|2,0,0]=4 8414 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccccn2 527a_100000211156_100000693296 [0,2,0,0,0,0|2,0,0]=4 8415 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2cccnc2 11a_100000736294_100000693296 [0,2,0,0,0,0|2,0,0]=4 8416 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2cccnc2 1626a_100000736294_100000693296 [0,2,0,0,0,0|2,0,0]=4 8417 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2cccnc2 240690a_100000736294_100000693296 [0,2,0,0,0,0|2,0,0]=4 8418 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2cccnc2 527a_100000736294_100000693296 [0,2,0,0,0,0|2,0,0]=4 8419 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccncc2 11a_100000742849_100000693296 [0,2,0,0,0,0|2,0,0]=4 8420 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccncc2 1626a_100000742849_100000693296 [0,2,0,0,0,0|2,0,0]=4 8421 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccncc2 240690a_100000742849_100000693296 [0,2,0,0,0,0|2,0,0]=4 8422 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NCCc2ccncc2 527a_100000742849_100000693296 [0,2,0,0,0,0|2,0,0]=4 8423 B22R2.144010 CC(=Cc1ccccc1Cl)C(=O)NNCc2ccccc2 22a_100000007032_100000693296 [0,2,0,0,0,0|2,0,0]=4 8424 B22R2.144010 Cc1ccccc1NC(=O)C(=O)CCCc2ccccc2 1458a_200011297352_100000211621 [0,2,0,0,0,0|2,0,0]=4 8425 B22R2.144010 Cc1ccccc1NC(=O)C(=O)NCCc2ccccc2 240690a_100000106460_200011297352 [0,2,0,0,0,0|2,0,0]=4 8426 B22R2.144010 O=C(CCCc1ccccc1)C(=O)Nc2ccccc2F 1458a_200011297310_100000211621 [0,2,0,0,0,0|2,0,0]=4 8427 B22R2.144010 O=C(NCCc1ccccc1)C(=O)Nc2ccccc2Cl 240690a_100000106460_200011297307 [0,2,0,0,0,0|2,0,0]=4 8428 B22R2.144010 O=C(NCCc1ccccc1)C(=O)Nc2ccccc2F 240690a_100000106460_200011297310 [0,2,0,0,0,0|2,0,0]=4 8429 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2Br 2230a_100020606079_200000077782 [0,2,0,0,0,0|1,0,1]=4 8430 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2Br 269982a_100020606079_200000077782 [0,2,0,0,0,0|1,0,1]=4 8431 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2Br 34a_100020606079_200000077782 [0,2,0,0,0,0|1,0,1]=4 8432 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2Cl 2230a_100000219374_200000077782 [0,2,0,0,0,0|1,0,1]=4 8433 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2Cl 269982a_100000219374_200000077782 [0,2,0,0,0,0|1,0,1]=4 8434 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2Cl 34a_100000219374_200000077782 [0,2,0,0,0,0|1,0,1]=4 8435 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2F 2230a_100000220357_200000077782 [0,2,0,0,0,0|1,0,1]=4 8436 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2F 269982a_100000220357_200000077782 [0,2,0,0,0,0|1,0,1]=4 8437 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2F 34a_100000220357_200000077782 [0,2,0,0,0,0|1,0,1]=4 8438 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2F 38a_100000220357_200000077782 [0,2,0,0,0,0|1,0,1]=4 8439 B22R2.144737 CN(CC(=O)OCCc1ccccc1)c2ccccc2O 269982a_100000033821_200000077782 [0,2,0,0,0,0|1,0,1]=4 8440 B22R2.144737 Cc1ccccc1C(=O)CC(=O)CCCc2ccccc2 1458a_100011207963_100000741374 [0,2,0,0,0,0|1,0,1]=4 8441 B22R2.144737 Cc1ccccc1C(=O)CC(=O)NCCc2ccccc2 1458a_100000212026_100000183012 [0,2,0,0,0,0|1,0,1]=4 8442 B22R2.144737 Cc1ccccc1C(=O)CC(=O)OCCc2ccccc2 1458a_100000212026_200000077782 [0,2,0,0,0,0|0,0,1]=3 8443 B22R2.144737 Cc1ccccc1N(C)CC(=O)OCCc2ccccc2 2230a_100000219699_200000077782 [0,2,0,0,0,0|1,0,1]=4 8444 B22R2.144737 Cc1ccccc1N(C)CC(=O)OCCc2ccccc2 269982a_100000219699_200000077782 [0,2,0,0,0,0|1,0,1]=4 8445 B22R2.144737 Cc1ccccc1N(C)CC(=O)OCCc2ccccc2 34a_100000219699_200000077782 [0,2,0,0,0,0|1,0,1]=4 8446 B22R2.144737 O=C(CC(=O)c1ccccc1Br)NCCc2ccccc2 1458a_100000188424_100000183012 [0,2,0,0,0,0|1,0,1]=4 8447 B22R2.144737 O=C(CC(=O)c1ccccc1Br)OCCc2ccccc2 1458a_100000188424_200000077782 [0,2,0,0,0,0|0,0,1]=3 8448 B22R2.144737 O=C(CC(=O)c1ccccc1Cl)NCCc2ccccc2 1458a_100000185844_100000183012 [0,2,0,0,0,0|1,0,1]=4 8449 B22R2.144737 O=C(CC(=O)c1ccccc1Cl)OCCc2ccccc2 1458a_100000185844_200000077782 [0,2,0,0,0,0|0,0,1]=3 8450 B22R2.144737 O=C(CC(=O)c1ccccc1F)NCCc2ccccc2 1458a_100000188656_100000183012 [0,2,0,0,0,0|1,0,1]=4 8451 B22R2.144737 O=C(CC(=O)c1ccccc1F)OCCc2ccccc2 1458a_100000188656_200000077782 [0,2,0,0,0,0|0,0,1]=3 8452 B22R2.144737 O=C(CC(=O)c1ccccc1I)NCCc2ccccc2 1458a_100000187884_100000183012 [0,2,0,0,0,0|1,0,1]=4 8453 B22R2.144737 O=C(CC(=O)c1ccccc1I)OCCc2ccccc2 1458a_100000187884_200000077782 [0,2,0,0,0,0|0,0,1]=3 8454 B22R2.144737 O=C(CC(=O)c1ccccc1O)NCCc2ccccc2 1458a_100015234032_100000183012 [0,2,0,0,0,0|1,0,1]=4 8455 B22R2.144737 O=C(CC(=O)c1ccccc1O)OCCc2ccccc2 1458a_100015234032_200000077782 [0,2,0,0,0,0|0,0,1]=3 8456 B22R2.144737 O=C(CC(=O)c1ccccc1[O-])NCCc2ccccc2 1458a_100009911694_100000183012 [0,2,0,0,0,0|1,0,1]=4 8457 B22R2.144737 O=C(CC(=O)c1ccccc1[O-])OCCc2ccccc2 1458a_100009911694_200000077782 [0,2,0,0,0,0|0,0,1]=3 8458 B22R2.144737 O=C(CCCc1ccccc1)CC(=O)c2ccccc2Br 1458a_100011207963_100000199116 [0,2,0,0,0,0|1,0,1]=4 8459 B22R2.144737 O=C(CCCc1ccccc1)CC(=O)c2ccccc2Cl 1458a_100011207963_100000211432 [0,2,0,0,0,0|1,0,1]=4 8460 B22R2.144737 O=C(CCCc1ccccc1)CC(=O)c2ccccc2F 1458a_100011207963_100000204681 [0,2,0,0,0,0|1,0,1]=4 8461 B22R2.144737 O=C(CCCc1ccccc1)CC(=O)c2ccccc2O 1458a_100011207963_100000188908 [0,2,0,0,0,0|1,0,1]=4 8462 B22R2.146085 Cc1cc(ccc1C=CC(=O)NCCc2ccccc2)F 11a_100000106460_100016280397 [0,2,0,0,0,0|1,0,0]=3 8463 B22R2.146085 Cc1cc(ccc1C=CC(=O)NCCc2ccccc2)F 1626a_100000106460_100016280397 [0,2,0,0,0,0|1,0,0]=3 8464 B22R2.146085 Cc1cc(ccc1C=CC(=O)NCCc2ccccn2)F 11a_100000211156_100016280397 [0,2,0,0,0,0|2,0,0]=4 8465 B22R2.146085 Cc1cc(ccc1C=CC(=O)NCCc2ccccn2)F 1626a_100000211156_100016280397 [0,2,0,0,0,0|2,0,0]=4 8466 B22R2.146085 Cc1cc(ccc1C=CC(=O)NCCc2cccnc2)F 11a_100000736294_100016280397 [0,2,0,0,0,0|2,0,0]=4 8467 B22R2.146085 Cc1cc(ccc1C=CC(=O)NCCc2cccnc2)F 1626a_100000736294_100016280397 [0,2,0,0,0,0|2,0,0]=4 8468 B22R2.146085 Cc1cc(ccc1C=CC(=O)NCCc2ccncc2)F 11a_100000742849_100016280397 [0,2,0,0,0,0|2,0,0]=4 8469 B22R2.146085 Cc1cc(ccc1C=CC(=O)NCCc2ccncc2)F 1626a_100000742849_100016280397 [0,2,0,0,0,0|2,0,0]=4 8470 B22R2.146085 Cc1cc(ccc1C=CC(=O)NNCc2ccccc2)F 22a_100000007032_100016280397 [0,2,0,0,0,0|2,0,0]=4 8471 B22R2.146085 Cc1cc(ccc1C=CC(=O)NNCc2ccccc2)O 22a_100000007032_200132309679 [0,2,0,0,0,0|2,0,0]=4 8472 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)Br 34a_100000211769_200000077782 [0,2,0,0,0,0|1,0,1]=4 8473 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)Br 7a_100000211769_200000077782 [0,2,0,0,0,0|1,0,1]=4 8474 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)Cl 34a_100000210418_200000077782 [0,2,0,0,0,0|1,0,1]=4 8475 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)Cl 7a_100000210418_200000077782 [0,2,0,0,0,0|1,0,1]=4 8476 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)F 34a_100000211637_200000077782 [0,2,0,0,0,0|1,0,1]=4 8477 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)F 7a_100000211637_200000077782 [0,2,0,0,0,0|1,0,1]=4 8478 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)I 34a_100000184554_200000077782 [0,2,0,0,0,0|1,0,1]=4 8479 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)I 7a_100000184554_200000077782 [0,2,0,0,0,0|1,0,1]=4 8480 B22R2.146085 Cc1cc(ccc1NCC(=O)OCCc2ccccc2)O 34a_100000756630_200000077782 [0,2,0,0,0,0|1,0,1]=4 8481 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)Br 34a_100000186361_200000077782 [0,2,0,0,0,0|1,0,1]=4 8482 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)Br 7a_100000186361_200000077782 [0,2,0,0,0,0|1,0,1]=4 8483 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)Cl 34a_100000211091_200000077782 [0,2,0,0,0,0|1,0,1]=4 8484 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)Cl 7a_100000211091_200000077782 [0,2,0,0,0,0|1,0,1]=4 8485 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)F 34a_100000764316_200000077782 [0,2,0,0,0,0|1,0,1]=4 8486 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)F 7a_100000764316_200000077782 [0,2,0,0,0,0|1,0,1]=4 8487 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)I 34a_100011218673_200000077782 [0,2,0,0,0,0|1,0,1]=4 8488 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)I 7a_100011218673_200000077782 [0,2,0,0,0,0|1,0,1]=4 8489 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)N 34a_100011218179_200000077782 [0,2,0,0,0,0|1,0,1]=4 8490 B22R2.146085 Cc1cc(ccc1OCC(=O)OCCc2ccccc2)N 7a_100011218179_200000077782 [0,2,0,0,0,0|1,0,1]=4 8491 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)Br 62a_100000701812_200000077782 [0,2,0,0,0,0|1,0,1]=4 8492 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100000701812 [0,2,0,0,0,0|1,0,1]=4 8493 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)Cl 62a_100011219607_200000077782 [0,2,0,0,0,0|1,0,1]=4 8494 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100011219607 [0,2,0,0,0,0|1,0,1]=4 8495 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)F 62a_100011205405_200000077782 [0,2,0,0,0,0|1,0,1]=4 8496 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)F 62a_200000077782_100011205405 [0,2,0,0,0,0|1,0,1]=4 8497 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)N 62a_100000210723_200000077782 [0,2,0,0,0,0|1,0,1]=4 8498 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)N 62a_200000077782_100000210723 [0,2,0,0,0,0|1,0,1]=4 8499 B22R2.146085 Cc1cc(ccc1SCC(=O)OCCc2ccccc2)O 62a_200000077782_100000690111 [0,2,0,0,0,0|1,0,1]=4 8500 B22R2.146085 Cc1ccc(c(c1)Br)NCC(=O)OCCc2ccccc2 34a_100000210942_200000077782 [0,2,0,0,0,0|1,0,1]=4 8501 B22R2.146085 Cc1ccc(c(c1)Br)OCC(=O)OCCc2ccccc2 34a_100000210800_200000077782 [0,2,0,0,0,0|1,0,1]=4 8502 B22R2.146085 Cc1ccc(c(c1)Br)OCC(=O)OCCc2ccccc2 7a_100000210800_200000077782 [0,2,0,0,0,0|1,0,1]=4 8503 B22R2.146085 Cc1ccc(c(c1)Br)SCC(=O)OCCc2ccccc2 62a_100009813563_200000077782 [0,2,0,0,0,0|1,0,1]=4 8504 B22R2.146085 Cc1ccc(c(c1)Br)SCC(=O)OCCc2ccccc2 62a_200000077782_100009813563 [0,2,0,0,0,0|1,0,1]=4 8505 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000238256 [0,2,0,0,0,0|1,0,0]=3 8506 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000238256 [0,2,0,0,0,0|1,0,0]=3 8507 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000238256 [0,2,0,0,0,0|2,0,0]=4 8508 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000238256 [0,2,0,0,0,0|2,0,0]=4 8509 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000238256 [0,2,0,0,0,0|2,0,0]=4 8510 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000238256 [0,2,0,0,0,0|2,0,0]=4 8511 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000238256 [0,2,0,0,0,0|2,0,0]=4 8512 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000238256 [0,2,0,0,0,0|2,0,0]=4 8513 B22R2.146085 Cc1ccc(c(c1)C)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000238256 [0,2,0,0,0,0|2,0,0]=4 8514 B22R2.146085 Cc1ccc(c(c1)C)NCC(=O)OCCc2ccccc2 34a_100000736561_200000077782 [0,2,0,0,0,0|1,0,1]=4 8515 B22R2.146085 Cc1ccc(c(c1)C)NCC(=O)OCCc2ccccc2 7a_100000736561_200000077782 [0,2,0,0,0,0|1,0,1]=4 8516 B22R2.146085 Cc1ccc(c(c1)C)OCC(=O)OCCc2ccccc2 34a_100000211776_200000077782 [0,2,0,0,0,0|1,0,1]=4 8517 B22R2.146085 Cc1ccc(c(c1)C)OCC(=O)OCCc2ccccc2 7a_100000211776_200000077782 [0,2,0,0,0,0|1,0,1]=4 8518 B22R2.146085 Cc1ccc(c(c1)C)SCC(=O)OCCc2ccccc2 62a_100011217332_200000077782 [0,2,0,0,0,0|1,0,1]=4 8519 B22R2.146085 Cc1ccc(c(c1)C)SCC(=O)OCCc2ccccc2 62a_200000077782_100011217332 [0,2,0,0,0,0|1,0,1]=4 8520 B22R2.146085 Cc1ccc(c(c1)Cl)NCC(=O)OCCc2ccccc2 34a_100000210522_200000077782 [0,2,0,0,0,0|1,0,1]=4 8521 B22R2.146085 Cc1ccc(c(c1)Cl)OCC(=O)OCCc2ccccc2 34a_100000749699_200000077782 [0,2,0,0,0,0|1,0,1]=4 8522 B22R2.146085 Cc1ccc(c(c1)Cl)OCC(=O)OCCc2ccccc2 7a_100000749699_200000077782 [0,2,0,0,0,0|1,0,1]=4 8523 B22R2.146085 Cc1ccc(c(c1)Cl)SCC(=O)OCCc2ccccc2 62a_100011263221_200000077782 [0,2,0,0,0,0|1,0,1]=4 8524 B22R2.146085 Cc1ccc(c(c1)Cl)SCC(=O)OCCc2ccccc2 62a_200000077782_100011263221 [0,2,0,0,0,0|1,0,1]=4 8525 B22R2.146085 Cc1ccc(c(c1)F)C=CC(=O)COCc2ccccc2 6a_100011217368_100011215004 [0,2,0,0,0,0|2,0,0]=4 8526 B22R2.146085 Cc1ccc(c(c1)F)C=CC(=O)CSCc2ccccc2 6a_100011217368_100000172147 [0,2,0,0,0,0|2,0,0]=4 8527 B22R2.146085 Cc1ccc(c(c1)F)NCC(=O)OCCc2ccccc2 34a_100000211023_200000077782 [0,2,0,0,0,0|1,0,1]=4 8528 B22R2.146085 Cc1ccc(c(c1)F)OCC(=O)OCCc2ccccc2 34a_100011216688_200000077782 [0,2,0,0,0,0|1,0,1]=4 8529 B22R2.146085 Cc1ccc(c(c1)F)OCC(=O)OCCc2ccccc2 7a_100011216688_200000077782 [0,2,0,0,0,0|1,0,1]=4 8530 B22R2.146085 Cc1ccc(c(c1)F)SCC(=O)OCCc2ccccc2 62a_100011216119_200000077782 [0,2,0,0,0,0|1,0,1]=4 8531 B22R2.146085 Cc1ccc(c(c1)F)SCC(=O)OCCc2ccccc2 62a_200000077782_100011216119 [0,2,0,0,0,0|1,0,1]=4 8532 B22R2.146085 Cc1ccc(c(c1)I)C=CC(=O)COCc2ccccc2 6a_100010150104_100011215004 [0,2,0,0,0,0|2,0,0]=4 8533 B22R2.146085 Cc1ccc(c(c1)I)C=CC(=O)CSCc2ccccc2 6a_100010150104_100000172147 [0,2,0,0,0,0|2,0,0]=4 8534 B22R2.146085 Cc1ccc(c(c1)I)NCC(=O)OCCc2ccccc2 34a_100011356834_200000077782 [0,2,0,0,0,0|1,0,1]=4 8535 B22R2.146085 Cc1ccc(c(c1)I)OCC(=O)OCCc2ccccc2 34a_100000765521_200000077782 [0,2,0,0,0,0|1,0,1]=4 8536 B22R2.146085 Cc1ccc(c(c1)I)OCC(=O)OCCc2ccccc2 7a_100000765521_200000077782 [0,2,0,0,0,0|1,0,1]=4 8537 B22R2.146085 Cc1ccc(c(c1)N)OCC(=O)OCCc2ccccc2 34a_100011215204_200000077782 [0,2,0,0,0,0|1,0,1]=4 8538 B22R2.146085 Cc1ccc(c(c1)N)OCC(=O)OCCc2ccccc2 7a_100011215204_200000077782 [0,2,0,0,0,0|1,0,1]=4 8539 B22R2.146085 Cc1ccc(c(c1)N)SCC(=O)OCCc2ccccc2 62a_100011216686_200000077782 [0,2,0,0,0,0|1,0,1]=4 8540 B22R2.146085 Cc1ccc(c(c1)N)SCC(=O)OCCc2ccccc2 62a_200000077782_100011216686 [0,2,0,0,0,0|1,0,1]=4 8541 B22R2.146085 Cc1ccc(c(c1)O)NCC(=O)OCCc2ccccc2 34a_100000211527_200000077782 [0,2,0,0,0,0|1,0,1]=4 8542 B22R2.146085 Cc1ccc(c(c1)O)SCC(=O)OCCc2ccccc2 62a_100012002257_200000077782 [0,2,0,0,0,0|1,0,1]=4 8543 B22R2.146085 Cc1ccc(c(c1)O)SCC(=O)OCCc2ccccc2 62a_200000077782_100012002257 [0,2,0,0,0,0|1,0,1]=4 8544 B22R2.146085 Nc1cc(ccc1OCC(=O)OCCc2ccccc2)Br 34a_100000752626_200000077782 [0,2,0,0,0,0|1,0,1]=4 8545 B22R2.146085 Nc1cc(ccc1OCC(=O)OCCc2ccccc2)Br 7a_100000752626_200000077782 [0,2,0,0,0,0|1,0,1]=4 8546 B22R2.146085 Nc1cc(ccc1OCC(=O)OCCc2ccccc2)Cl 34a_100000210500_200000077782 [0,2,0,0,0,0|1,0,1]=4 8547 B22R2.146085 Nc1cc(ccc1OCC(=O)OCCc2ccccc2)Cl 7a_100000210500_200000077782 [0,2,0,0,0,0|1,0,1]=4 8548 B22R2.146085 Nc1cc(ccc1OCC(=O)OCCc2ccccc2)F 34a_100000759472_200000077782 [0,2,0,0,0,0|1,0,1]=4 8549 B22R2.146085 Nc1cc(ccc1OCC(=O)OCCc2ccccc2)F 7a_100000759472_200000077782 [0,2,0,0,0,0|1,0,1]=4 8550 B22R2.146085 Nc1cc(ccc1OCC(=O)OCCc2ccccc2)I 34a_100000753495_200000077782 [0,2,0,0,0,0|1,0,1]=4 8551 B22R2.146085 Nc1cc(ccc1OCC(=O)OCCc2ccccc2)I 7a_100000753495_200000077782 [0,2,0,0,0,0|1,0,1]=4 8552 B22R2.146085 Nc1cc(ccc1SCC(=O)OCCc2ccccc2)Br 62a_100000743836_200000077782 [0,2,0,0,0,0|1,0,1]=4 8553 B22R2.146085 Nc1cc(ccc1SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100000743836 [0,2,0,0,0,0|1,0,1]=4 8554 B22R2.146085 Nc1cc(ccc1SCC(=O)OCCc2ccccc2)Cl 62a_100000761886_200000077782 [0,2,0,0,0,0|1,0,1]=4 8555 B22R2.146085 Nc1cc(ccc1SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100000761886 [0,2,0,0,0,0|1,0,1]=4 8556 B22R2.146085 Nc1cc(ccc1SCC(=O)OCCc2ccccc2)F 62a_100000687223_200000077782 [0,2,0,0,0,0|1,0,1]=4 8557 B22R2.146085 Nc1cc(ccc1SCC(=O)OCCc2ccccc2)F 62a_200000077782_100000687223 [0,2,0,0,0,0|1,0,1]=4 8558 B22R2.146085 Nc1cc(ccc1SCC(=O)OCCc2ccccc2)O 62a_100011999798_200000077782 [0,2,0,0,0,0|1,0,1]=4 8559 B22R2.146085 Nc1cc(ccc1SCC(=O)OCCc2ccccc2)O 62a_200000077782_100011999798 [0,2,0,0,0,0|1,0,1]=4 8560 B22R2.146085 Nc1ccc(c(c1)Br)OCC(=O)OCCc2ccccc2 34a_100011534360_200000077782 [0,2,0,0,0,0|1,0,1]=4 8561 B22R2.146085 Nc1ccc(c(c1)Br)OCC(=O)OCCc2ccccc2 7a_100011534360_200000077782 [0,2,0,0,0,0|1,0,1]=4 8562 B22R2.146085 Nc1ccc(c(c1)Br)SCC(=O)OCCc2ccccc2 62a_100000750458_200000077782 [0,2,0,0,0,0|1,0,1]=4 8563 B22R2.146085 Nc1ccc(c(c1)Br)SCC(=O)OCCc2ccccc2 62a_200000077782_100000750458 [0,2,0,0,0,0|1,0,1]=4 8564 B22R2.146085 Nc1ccc(c(c1)Cl)OCC(=O)OCCc2ccccc2 34a_100000744943_200000077782 [0,2,0,0,0,0|1,0,1]=4 8565 B22R2.146085 Nc1ccc(c(c1)Cl)OCC(=O)OCCc2ccccc2 7a_100000744943_200000077782 [0,2,0,0,0,0|1,0,1]=4 8566 B22R2.146085 Nc1ccc(c(c1)Cl)SCC(=O)OCCc2ccccc2 62a_100000761885_200000077782 [0,2,0,0,0,0|1,0,1]=4 8567 B22R2.146085 Nc1ccc(c(c1)Cl)SCC(=O)OCCc2ccccc2 62a_200000077782_100000761885 [0,2,0,0,0,0|1,0,1]=4 8568 B22R2.146085 Nc1ccc(c(c1)F)OCC(=O)OCCc2ccccc2 34a_100011220035_200000077782 [0,2,0,0,0,0|1,0,1]=4 8569 B22R2.146085 Nc1ccc(c(c1)F)OCC(=O)OCCc2ccccc2 7a_100011220035_200000077782 [0,2,0,0,0,0|1,0,1]=4 8570 B22R2.146085 Nc1ccc(c(c1)F)SCC(=O)OCCc2ccccc2 62a_100011356925_200000077782 [0,2,0,0,0,0|1,0,1]=4 8571 B22R2.146085 Nc1ccc(c(c1)F)SCC(=O)OCCc2ccccc2 62a_200000077782_100011356925 [0,2,0,0,0,0|1,0,1]=4 8572 B22R2.146085 Nc1ccc(c(c1)N)OCC(=O)OCCc2ccccc2 34a_100000725306_200000077782 [0,2,0,0,0,0|1,0,1]=4 8573 B22R2.146085 Nc1ccc(c(c1)N)SCC(=O)OCCc2ccccc2 62a_200000077782_200012175722 [0,2,0,0,0,0|1,0,1]=4 8574 B22R2.146085 Nc1ccc(c(c1)N)SCC(=O)OCCc2ccccc2 62a_200012175722_200000077782 [0,2,0,0,0,0|1,0,1]=4 8575 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)CCCc2ccccc2 1458a_200102591336_100000211621 [0,2,0,0,0,0|1,0,0]=3 8576 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)CCOc2ccccc2 1458a_200102591336_100000184471 [0,2,0,0,0,0|2,0,0]=4 8577 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)CCSc2ccccc2 1458a_200102591336_100000246102 [0,2,0,0,0,0|2,0,0]=4 8578 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)CSCc2ccccc2 1458a_200102591336_200011217039 [0,2,0,0,0,0|2,0,0]=4 8579 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccccc2 11a_100000106460_200102591336 [0,2,0,0,0,0|1,0,0]=3 8580 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccccc2 1626a_100000106460_200102591336 [0,2,0,0,0,0|1,0,0]=3 8581 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccccc2 240690a_100000106460_200102591336 [0,2,0,0,0,0|1,0,0]=3 8582 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccccn2 11a_100000211156_200102591336 [0,2,0,0,0,0|2,0,0]=4 8583 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccccn2 1626a_100000211156_200102591336 [0,2,0,0,0,0|2,0,0]=4 8584 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccccn2 240690a_100000211156_200102591336 [0,2,0,0,0,0|2,0,0]=4 8585 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2cccnc2 11a_100000736294_200102591336 [0,2,0,0,0,0|2,0,0]=4 8586 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2cccnc2 1626a_100000736294_200102591336 [0,2,0,0,0,0|2,0,0]=4 8587 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2cccnc2 240690a_100000736294_200102591336 [0,2,0,0,0,0|2,0,0]=4 8588 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccncc2 11a_100000742849_200102591336 [0,2,0,0,0,0|2,0,0]=4 8589 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccncc2 1626a_100000742849_200102591336 [0,2,0,0,0,0|2,0,0]=4 8590 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NCCc2ccncc2 240690a_100000742849_200102591336 [0,2,0,0,0,0|2,0,0]=4 8591 B22R2.146085 O=C(C=Cc1ccc(cc1Br)F)NNCc2ccccc2 22a_100000007032_200102591336 [0,2,0,0,0,0|2,0,0]=4 8592 B22R2.146085 O=C(C=Cc1ccc(cc1Br)I)COCc2ccccc2 6a_100010185650_100011215004 [0,2,0,0,0,0|2,0,0]=4 8593 B22R2.146085 O=C(C=Cc1ccc(cc1Br)I)CSCc2ccccc2 6a_100010185650_100000172147 [0,2,0,0,0,0|2,0,0]=4 8594 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)CCCc2ccccc2 1458a_100102525105_100000211621 [0,2,0,0,0,0|1,0,0]=3 8595 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)CCOc2ccccc2 1458a_100102525105_100000184471 [0,2,0,0,0,0|2,0,0]=4 8596 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)CCSc2ccccc2 1458a_100102525105_100000246102 [0,2,0,0,0,0|2,0,0]=4 8597 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)CSCc2ccccc2 1458a_100102525105_200011217039 [0,2,0,0,0,0|2,0,0]=4 8598 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccccc2 11a_100000106460_100102525105 [0,2,0,0,0,0|1,0,0]=3 8599 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccccc2 1626a_100000106460_100102525105 [0,2,0,0,0,0|1,0,0]=3 8600 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccccc2 240690a_100000106460_100102525105 [0,2,0,0,0,0|1,0,0]=3 8601 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccccn2 11a_100000211156_100102525105 [0,2,0,0,0,0|2,0,0]=4 8602 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccccn2 1626a_100000211156_100102525105 [0,2,0,0,0,0|2,0,0]=4 8603 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccccn2 240690a_100000211156_100102525105 [0,2,0,0,0,0|2,0,0]=4 8604 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2cccnc2 11a_100000736294_100102525105 [0,2,0,0,0,0|2,0,0]=4 8605 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2cccnc2 1626a_100000736294_100102525105 [0,2,0,0,0,0|2,0,0]=4 8606 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2cccnc2 240690a_100000736294_100102525105 [0,2,0,0,0,0|2,0,0]=4 8607 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccncc2 11a_100000742849_100102525105 [0,2,0,0,0,0|2,0,0]=4 8608 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccncc2 1626a_100000742849_100102525105 [0,2,0,0,0,0|2,0,0]=4 8609 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NCCc2ccncc2 240690a_100000742849_100102525105 [0,2,0,0,0,0|2,0,0]=4 8610 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Br)NNCc2ccccc2 22a_100000007032_100102525105 [0,2,0,0,0,0|2,0,0]=4 8611 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)CCCc2ccccc2 1458a_100016270030_100000211621 [0,2,0,0,0,0|1,0,0]=3 8612 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)CCOc2ccccc2 1458a_100016270030_100000184471 [0,2,0,0,0,0|2,0,0]=4 8613 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)CCSc2ccccc2 1458a_100016270030_100000246102 [0,2,0,0,0,0|2,0,0]=4 8614 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)CSCc2ccccc2 1458a_100016270030_200011217039 [0,2,0,0,0,0|2,0,0]=4 8615 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccccc2 11a_100000106460_100016270030 [0,2,0,0,0,0|1,0,0]=3 8616 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccccc2 1626a_100000106460_100016270030 [0,2,0,0,0,0|1,0,0]=3 8617 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccccc2 240690a_100000106460_100016270030 [0,2,0,0,0,0|1,0,0]=3 8618 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccccn2 11a_100000211156_100016270030 [0,2,0,0,0,0|2,0,0]=4 8619 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccccn2 1626a_100000211156_100016270030 [0,2,0,0,0,0|2,0,0]=4 8620 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccccn2 240690a_100000211156_100016270030 [0,2,0,0,0,0|2,0,0]=4 8621 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2cccnc2 11a_100000736294_100016270030 [0,2,0,0,0,0|2,0,0]=4 8622 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2cccnc2 1626a_100000736294_100016270030 [0,2,0,0,0,0|2,0,0]=4 8623 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2cccnc2 240690a_100000736294_100016270030 [0,2,0,0,0,0|2,0,0]=4 8624 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccncc2 11a_100000742849_100016270030 [0,2,0,0,0,0|2,0,0]=4 8625 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccncc2 1626a_100000742849_100016270030 [0,2,0,0,0,0|2,0,0]=4 8626 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NCCc2ccncc2 240690a_100000742849_100016270030 [0,2,0,0,0,0|2,0,0]=4 8627 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)Cl)NNCc2ccccc2 22a_100000007032_100016270030 [0,2,0,0,0,0|2,0,0]=4 8628 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)CCCc2ccccc2 1458a_200102525072_100000211621 [0,2,0,0,0,0|1,0,0]=3 8629 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)CCOc2ccccc2 1458a_200102525072_100000184471 [0,2,0,0,0,0|2,0,0]=4 8630 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)CCSc2ccccc2 1458a_200102525072_100000246102 [0,2,0,0,0,0|2,0,0]=4 8631 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)CSCc2ccccc2 1458a_200102525072_200011217039 [0,2,0,0,0,0|2,0,0]=4 8632 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccccc2 11a_100000106460_200102525072 [0,2,0,0,0,0|1,0,0]=3 8633 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccccc2 1626a_100000106460_200102525072 [0,2,0,0,0,0|1,0,0]=3 8634 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccccc2 240690a_100000106460_200102525072 [0,2,0,0,0,0|1,0,0]=3 8635 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccccn2 11a_100000211156_200102525072 [0,2,0,0,0,0|2,0,0]=4 8636 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccccn2 1626a_100000211156_200102525072 [0,2,0,0,0,0|2,0,0]=4 8637 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccccn2 240690a_100000211156_200102525072 [0,2,0,0,0,0|2,0,0]=4 8638 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2cccnc2 11a_100000736294_200102525072 [0,2,0,0,0,0|2,0,0]=4 8639 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2cccnc2 1626a_100000736294_200102525072 [0,2,0,0,0,0|2,0,0]=4 8640 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2cccnc2 240690a_100000736294_200102525072 [0,2,0,0,0,0|2,0,0]=4 8641 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccncc2 11a_100000742849_200102525072 [0,2,0,0,0,0|2,0,0]=4 8642 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccncc2 1626a_100000742849_200102525072 [0,2,0,0,0,0|2,0,0]=4 8643 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NCCc2ccncc2 240690a_100000742849_200102525072 [0,2,0,0,0,0|2,0,0]=4 8644 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)F)NNCc2ccccc2 22a_100000007032_200102525072 [0,2,0,0,0,0|2,0,0]=4 8645 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)I)COCc2ccccc2 6a_100000727542_100011215004 [0,2,0,0,0,0|2,0,0]=4 8646 B22R2.146085 O=C(C=Cc1ccc(cc1Cl)I)CSCc2ccccc2 6a_100000727542_100000172147 [0,2,0,0,0,0|2,0,0]=4 8647 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)CCCc2ccccc2 1458a_100011214948_100000211621 [0,2,0,0,0,0|1,0,0]=3 8648 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)CCOc2ccccc2 1458a_100011214948_100000184471 [0,2,0,0,0,0|2,0,0]=4 8649 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)CCSc2ccccc2 1458a_100011214948_100000246102 [0,2,0,0,0,0|2,0,0]=4 8650 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)COCc2ccccc2 6a_100000211676_100011215004 [0,2,0,0,0,0|2,0,0]=4 8651 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)CSCc2ccccc2 1458a_100011214948_200011217039 [0,2,0,0,0,0|2,0,0]=4 8652 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)CSCc2ccccc2 6a_100000211676_100000172147 [0,2,0,0,0,0|2,0,0]=4 8653 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccccc2 11a_100000106460_100011214948 [0,2,0,0,0,0|1,0,0]=3 8654 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccccc2 1626a_100000106460_100011214948 [0,2,0,0,0,0|1,0,0]=3 8655 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccccc2 240690a_100000106460_100011214948 [0,2,0,0,0,0|1,0,0]=3 8656 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccccn2 11a_100000211156_100011214948 [0,2,0,0,0,0|2,0,0]=4 8657 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccccn2 1626a_100000211156_100011214948 [0,2,0,0,0,0|2,0,0]=4 8658 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccccn2 240690a_100000211156_100011214948 [0,2,0,0,0,0|2,0,0]=4 8659 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2cccnc2 11a_100000736294_100011214948 [0,2,0,0,0,0|2,0,0]=4 8660 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2cccnc2 1626a_100000736294_100011214948 [0,2,0,0,0,0|2,0,0]=4 8661 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2cccnc2 240690a_100000736294_100011214948 [0,2,0,0,0,0|2,0,0]=4 8662 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccncc2 11a_100000742849_100011214948 [0,2,0,0,0,0|2,0,0]=4 8663 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccncc2 1626a_100000742849_100011214948 [0,2,0,0,0,0|2,0,0]=4 8664 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NCCc2ccncc2 240690a_100000742849_100011214948 [0,2,0,0,0,0|2,0,0]=4 8665 B22R2.146085 O=C(C=Cc1ccc(cc1F)Br)NNCc2ccccc2 22a_100000007032_100011214948 [0,2,0,0,0,0|2,0,0]=4 8666 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)CCCc2ccccc2 1458a_100102561868_100000211621 [0,2,0,0,0,0|1,0,0]=3 8667 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)CCOc2ccccc2 1458a_100102561868_100000184471 [0,2,0,0,0,0|2,0,0]=4 8668 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)CCSc2ccccc2 1458a_100102561868_100000246102 [0,2,0,0,0,0|2,0,0]=4 8669 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)CSCc2ccccc2 1458a_100102561868_200011217039 [0,2,0,0,0,0|2,0,0]=4 8670 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccccc2 11a_100000106460_100102561868 [0,2,0,0,0,0|1,0,0]=3 8671 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccccc2 1626a_100000106460_100102561868 [0,2,0,0,0,0|1,0,0]=3 8672 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccccc2 240690a_100000106460_100102561868 [0,2,0,0,0,0|1,0,0]=3 8673 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccccn2 11a_100000211156_100102561868 [0,2,0,0,0,0|2,0,0]=4 8674 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccccn2 1626a_100000211156_100102561868 [0,2,0,0,0,0|2,0,0]=4 8675 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccccn2 240690a_100000211156_100102561868 [0,2,0,0,0,0|2,0,0]=4 8676 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2cccnc2 11a_100000736294_100102561868 [0,2,0,0,0,0|2,0,0]=4 8677 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2cccnc2 1626a_100000736294_100102561868 [0,2,0,0,0,0|2,0,0]=4 8678 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2cccnc2 240690a_100000736294_100102561868 [0,2,0,0,0,0|2,0,0]=4 8679 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccncc2 11a_100000742849_100102561868 [0,2,0,0,0,0|2,0,0]=4 8680 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccncc2 1626a_100000742849_100102561868 [0,2,0,0,0,0|2,0,0]=4 8681 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NCCc2ccncc2 240690a_100000742849_100102561868 [0,2,0,0,0,0|2,0,0]=4 8682 B22R2.146085 O=C(C=Cc1ccc(cc1F)Cl)NNCc2ccccc2 22a_100000007032_100102561868 [0,2,0,0,0,0|2,0,0]=4 8683 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)CCCc2ccccc2 1458a_100011195072_100000211621 [0,2,0,0,0,0|1,0,0]=3 8684 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)CCOc2ccccc2 1458a_100011195072_100000184471 [0,2,0,0,0,0|2,0,0]=4 8685 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)CCSc2ccccc2 1458a_100011195072_100000246102 [0,2,0,0,0,0|2,0,0]=4 8686 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)COCc2ccccc2 6a_100000211964_100011215004 [0,2,0,0,0,0|2,0,0]=4 8687 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)CSCc2ccccc2 1458a_100011195072_200011217039 [0,2,0,0,0,0|2,0,0]=4 8688 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)CSCc2ccccc2 6a_100000211964_100000172147 [0,2,0,0,0,0|2,0,0]=4 8689 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccccc2 11a_100000106460_100011195072 [0,2,0,0,0,0|1,0,0]=3 8690 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccccc2 1626a_100000106460_100011195072 [0,2,0,0,0,0|1,0,0]=3 8691 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccccc2 240690a_100000106460_100011195072 [0,2,0,0,0,0|1,0,0]=3 8692 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccccn2 11a_100000211156_100011195072 [0,2,0,0,0,0|2,0,0]=4 8693 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccccn2 1626a_100000211156_100011195072 [0,2,0,0,0,0|2,0,0]=4 8694 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccccn2 240690a_100000211156_100011195072 [0,2,0,0,0,0|2,0,0]=4 8695 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2cccnc2 11a_100000736294_100011195072 [0,2,0,0,0,0|2,0,0]=4 8696 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2cccnc2 1626a_100000736294_100011195072 [0,2,0,0,0,0|2,0,0]=4 8697 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2cccnc2 240690a_100000736294_100011195072 [0,2,0,0,0,0|2,0,0]=4 8698 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccncc2 11a_100000742849_100011195072 [0,2,0,0,0,0|2,0,0]=4 8699 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccncc2 1626a_100000742849_100011195072 [0,2,0,0,0,0|2,0,0]=4 8700 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NCCc2ccncc2 240690a_100000742849_100011195072 [0,2,0,0,0,0|2,0,0]=4 8701 B22R2.146085 O=C(C=Cc1ccc(cc1F)F)NNCc2ccccc2 22a_100000007032_100011195072 [0,2,0,0,0,0|2,0,0]=4 8702 B22R2.146085 O=C(C=Cc1ccc(cc1F)I)COCc2ccccc2 6a_100000050965_100011215004 [0,2,0,0,0,0|2,0,0]=4 8703 B22R2.146085 O=C(C=Cc1ccc(cc1F)I)CSCc2ccccc2 6a_100000050965_100000172147 [0,2,0,0,0,0|2,0,0]=4 8704 B22R2.146085 O=C(C=Cc1ccc(cc1I)Br)COCc2ccccc2 6a_100010146562_100011215004 [0,2,0,0,0,0|2,0,0]=4 8705 B22R2.146085 O=C(C=Cc1ccc(cc1I)Br)CSCc2ccccc2 6a_100010146562_100000172147 [0,2,0,0,0,0|2,0,0]=4 8706 B22R2.146085 O=C(C=Cc1ccc(cc1I)F)COCc2ccccc2 6a_100010254405_100011215004 [0,2,0,0,0,0|2,0,0]=4 8707 B22R2.146085 O=C(C=Cc1ccc(cc1I)F)CSCc2ccccc2 6a_100010254405_100000172147 [0,2,0,0,0,0|2,0,0]=4 8708 B22R2.146085 O=C(C=Cc1ccc(cc1I)O)COCc2ccccc2 6a_100000051608_100011215004 [0,2,0,0,0,0|2,0,0]=4 8709 B22R2.146085 O=C(C=Cc1ccc(cc1I)O)CSCc2ccccc2 6a_100000051608_100000172147 [0,2,0,0,0,0|2,0,0]=4 8710 B22R2.146085 O=C(C=Cc1ccc(cc1O)I)COCc2ccccc2 6a_100000050530_100011215004 [0,2,0,0,0,0|2,0,0]=4 8711 B22R2.146085 O=C(C=Cc1ccc(cc1O)I)CSCc2ccccc2 6a_100000050530_100000172147 [0,2,0,0,0,0|2,0,0]=4 8712 B22R2.146085 O=C(CNc1ccc(cc1Br)Br)OCCc2ccccc2 34a_100000211012_200000077782 [0,2,0,0,0,0|1,0,1]=4 8713 B22R2.146085 O=C(CNc1ccc(cc1Br)Cl)OCCc2ccccc2 34a_100000752454_200000077782 [0,2,0,0,0,0|1,0,1]=4 8714 B22R2.146085 O=C(CNc1ccc(cc1Br)F)OCCc2ccccc2 34a_100000738039_200000077782 [0,2,0,0,0,0|1,0,1]=4 8715 B22R2.146085 O=C(CNc1ccc(cc1Br)O)OCCc2ccccc2 34a_100012001276_200000077782 [0,2,0,0,0,0|1,0,1]=4 8716 B22R2.146085 O=C(CNc1ccc(cc1Cl)Br)OCCc2ccccc2 34a_100000211467_200000077782 [0,2,0,0,0,0|1,0,1]=4 8717 B22R2.146085 O=C(CNc1ccc(cc1Cl)Cl)OCCc2ccccc2 34a_100000185861_200000077782 [0,2,0,0,0,0|1,0,1]=4 8718 B22R2.146085 O=C(CNc1ccc(cc1Cl)F)OCCc2ccccc2 34a_100000212003_200000077782 [0,2,0,0,0,0|1,0,1]=4 8719 B22R2.146085 O=C(CNc1ccc(cc1Cl)I)OCCc2ccccc2 34a_100011218065_200000077782 [0,2,0,0,0,0|1,0,1]=4 8720 B22R2.146085 O=C(CNc1ccc(cc1Cl)O)OCCc2ccccc2 34a_100011215599_200000077782 [0,2,0,0,0,0|1,0,1]=4 8721 B22R2.146085 O=C(CNc1ccc(cc1F)Br)OCCc2ccccc2 34a_100000210722_200000077782 [0,2,0,0,0,0|1,0,1]=4 8722 B22R2.146085 O=C(CNc1ccc(cc1F)Cl)OCCc2ccccc2 34a_100000211020_200000077782 [0,2,0,0,0,0|1,0,1]=4 8723 B22R2.146085 O=C(CNc1ccc(cc1F)F)OCCc2ccccc2 34a_100000210720_200000077782 [0,2,0,0,0,0|1,0,1]=4 8724 B22R2.146085 O=C(CNc1ccc(cc1F)I)OCCc2ccccc2 34a_100011215594_200000077782 [0,2,0,0,0,0|1,0,1]=4 8725 B22R2.146085 O=C(CNc1ccc(cc1F)O)OCCc2ccccc2 34a_100000759473_200000077782 [0,2,0,0,0,0|1,0,1]=4 8726 B22R2.146085 O=C(CNc1ccc(cc1I)Br)OCCc2ccccc2 34a_100000187925_200000077782 [0,2,0,0,0,0|1,0,1]=4 8727 B22R2.146085 O=C(CNc1ccc(cc1I)Cl)OCCc2ccccc2 34a_100000761889_200000077782 [0,2,0,0,0,0|1,0,1]=4 8728 B22R2.146085 O=C(CNc1ccc(cc1I)F)OCCc2ccccc2 34a_100000760547_200000077782 [0,2,0,0,0,0|1,0,1]=4 8729 B22R2.146085 O=C(CNc1ccc(cc1I)O)OCCc2ccccc2 34a_100010084370_200000077782 [0,2,0,0,0,0|1,0,1]=4 8730 B22R2.146085 O=C(CNc1ccc(cc1O)Br)OCCc2ccccc2 34a_100000739049_200000077782 [0,2,0,0,0,0|1,0,1]=4 8731 B22R2.146085 O=C(CNc1ccc(cc1O)Cl)OCCc2ccccc2 34a_100000185728_200000077782 [0,2,0,0,0,0|1,0,1]=4 8732 B22R2.146085 O=C(CNc1ccc(cc1O)F)OCCc2ccccc2 34a_100000753323_200000077782 [0,2,0,0,0,0|1,0,1]=4 8733 B22R2.146085 O=C(CNc1ccc(cc1O)O)OCCc2ccccc2 34a_100000106777_200000077782 [0,2,0,0,0,0|1,0,1]=4 8734 B22R2.146085 O=C(COc1ccc(cc1Br)Br)OCCc2ccccc2 34a_100000188717_200000077782 [0,2,0,0,0,0|1,0,1]=4 8735 B22R2.146085 O=C(COc1ccc(cc1Br)Br)OCCc2ccccc2 7a_100000188717_200000077782 [0,2,0,0,0,0|1,0,1]=4 8736 B22R2.146085 O=C(COc1ccc(cc1Br)Cl)OCCc2ccccc2 34a_100000211998_200000077782 [0,2,0,0,0,0|1,0,1]=4 8737 B22R2.146085 O=C(COc1ccc(cc1Br)Cl)OCCc2ccccc2 7a_100000211998_200000077782 [0,2,0,0,0,0|1,0,1]=4 8738 B22R2.146085 O=C(COc1ccc(cc1Br)F)OCCc2ccccc2 34a_100000211999_200000077782 [0,2,0,0,0,0|1,0,1]=4 8739 B22R2.146085 O=C(COc1ccc(cc1Br)F)OCCc2ccccc2 7a_100000211999_200000077782 [0,2,0,0,0,0|1,0,1]=4 8740 B22R2.146085 O=C(COc1ccc(cc1Br)I)OCCc2ccccc2 34a_100012361655_200000077782 [0,2,0,0,0,0|1,0,1]=4 8741 B22R2.146085 O=C(COc1ccc(cc1Br)I)OCCc2ccccc2 7a_100012361655_200000077782 [0,2,0,0,0,0|1,0,1]=4 8742 B22R2.146085 O=C(COc1ccc(cc1Cl)Br)OCCc2ccccc2 34a_100000186472_200000077782 [0,2,0,0,0,0|1,0,1]=4 8743 B22R2.146085 O=C(COc1ccc(cc1Cl)Br)OCCc2ccccc2 7a_100000186472_200000077782 [0,2,0,0,0,0|1,0,1]=4 8744 B22R2.146085 O=C(COc1ccc(cc1Cl)Cl)OCCc2ccccc2 34a_100015191787_200000077782 [0,2,0,0,0,0|1,0,1]=4 8745 B22R2.146085 O=C(COc1ccc(cc1Cl)Cl)OCCc2ccccc2 7a_100015191787_200000077782 [0,2,0,0,0,0|1,0,1]=4 8746 B22R2.146085 O=C(COc1ccc(cc1Cl)F)OCCc2ccccc2 34a_100000212004_200000077782 [0,2,0,0,0,0|1,0,1]=4 8747 B22R2.146085 O=C(COc1ccc(cc1Cl)F)OCCc2ccccc2 7a_100000212004_200000077782 [0,2,0,0,0,0|1,0,1]=4 8748 B22R2.146085 O=C(COc1ccc(cc1Cl)I)OCCc2ccccc2 34a_100012360047_200000077782 [0,2,0,0,0,0|1,0,1]=4 8749 B22R2.146085 O=C(COc1ccc(cc1Cl)I)OCCc2ccccc2 7a_100012360047_200000077782 [0,2,0,0,0,0|1,0,1]=4 8750 B22R2.146085 O=C(COc1ccc(cc1F)Br)OCCc2ccccc2 34a_100000185481_200000077782 [0,2,0,0,0,0|1,0,1]=4 8751 B22R2.146085 O=C(COc1ccc(cc1F)Br)OCCc2ccccc2 7a_100000185481_200000077782 [0,2,0,0,0,0|1,0,1]=4 8752 B22R2.146085 O=C(COc1ccc(cc1F)Cl)OCCc2ccccc2 34a_100000230166_200000077782 [0,2,0,0,0,0|1,0,1]=4 8753 B22R2.146085 O=C(COc1ccc(cc1F)Cl)OCCc2ccccc2 7a_100000230166_200000077782 [0,2,0,0,0,0|1,0,1]=4 8754 B22R2.146085 O=C(COc1ccc(cc1F)F)OCCc2ccccc2 34a_100000230127_200000077782 [0,2,0,0,0,0|1,0,1]=4 8755 B22R2.146085 O=C(COc1ccc(cc1F)F)OCCc2ccccc2 7a_100000230127_200000077782 [0,2,0,0,0,0|1,0,1]=4 8756 B22R2.146085 O=C(COc1ccc(cc1F)I)OCCc2ccccc2 34a_100011356965_200000077782 [0,2,0,0,0,0|1,0,1]=4 8757 B22R2.146085 O=C(COc1ccc(cc1F)I)OCCc2ccccc2 7a_100011356965_200000077782 [0,2,0,0,0,0|1,0,1]=4 8758 B22R2.146085 O=C(COc1ccc(cc1I)Br)OCCc2ccccc2 34a_100012355227_200000077782 [0,2,0,0,0,0|1,0,1]=4 8759 B22R2.146085 O=C(COc1ccc(cc1I)Br)OCCc2ccccc2 7a_100012355227_200000077782 [0,2,0,0,0,0|1,0,1]=4 8760 B22R2.146085 O=C(COc1ccc(cc1I)Cl)OCCc2ccccc2 34a_100011356953_200000077782 [0,2,0,0,0,0|1,0,1]=4 8761 B22R2.146085 O=C(COc1ccc(cc1I)Cl)OCCc2ccccc2 7a_100011356953_200000077782 [0,2,0,0,0,0|1,0,1]=4 8762 B22R2.146085 O=C(COc1ccc(cc1I)F)OCCc2ccccc2 34a_100012355409_200000077782 [0,2,0,0,0,0|1,0,1]=4 8763 B22R2.146085 O=C(COc1ccc(cc1I)F)OCCc2ccccc2 7a_100012355409_200000077782 [0,2,0,0,0,0|1,0,1]=4 8764 B22R2.146085 O=C(COc1ccc(cc1I)I)OCCc2ccccc2 7a_100010001573_200000077782 [0,2,0,0,0,0|1,0,1]=4 8765 B22R2.146085 O=C(CSc1ccc(cc1Br)Br)OCCc2ccccc2 62a_100011484698_200000077782 [0,2,0,0,0,0|1,0,1]=4 8766 B22R2.146085 O=C(CSc1ccc(cc1Br)Br)OCCc2ccccc2 62a_200000077782_100011484698 [0,2,0,0,0,0|1,0,1]=4 8767 B22R2.146085 O=C(CSc1ccc(cc1Br)Cl)OCCc2ccccc2 62a_100011219703_200000077782 [0,2,0,0,0,0|1,0,1]=4 8768 B22R2.146085 O=C(CSc1ccc(cc1Br)Cl)OCCc2ccccc2 62a_200000077782_100011219703 [0,2,0,0,0,0|1,0,1]=4 8769 B22R2.146085 O=C(CSc1ccc(cc1Br)F)OCCc2ccccc2 62a_100011217111_200000077782 [0,2,0,0,0,0|1,0,1]=4 8770 B22R2.146085 O=C(CSc1ccc(cc1Br)F)OCCc2ccccc2 62a_200000077782_100011217111 [0,2,0,0,0,0|1,0,1]=4 8771 B22R2.146085 O=C(CSc1ccc(cc1Br)O)OCCc2ccccc2 62a_100000701344_200000077782 [0,2,0,0,0,0|1,0,1]=4 8772 B22R2.146085 O=C(CSc1ccc(cc1Br)O)OCCc2ccccc2 62a_200000077782_100000701344 [0,2,0,0,0,0|1,0,1]=4 8773 B22R2.146085 O=C(CSc1ccc(cc1Cl)Br)OCCc2ccccc2 62a_100011216062_200000077782 [0,2,0,0,0,0|1,0,1]=4 8774 B22R2.146085 O=C(CSc1ccc(cc1Cl)Br)OCCc2ccccc2 62a_200000077782_100011216062 [0,2,0,0,0,0|1,0,1]=4 8775 B22R2.146085 O=C(CSc1ccc(cc1Cl)Cl)OCCc2ccccc2 62a_100000699841_200000077782 [0,2,0,0,0,0|1,0,1]=4 8776 B22R2.146085 O=C(CSc1ccc(cc1Cl)Cl)OCCc2ccccc2 62a_200000077782_100000699841 [0,2,0,0,0,0|1,0,1]=4 8777 B22R2.146085 O=C(CSc1ccc(cc1Cl)F)OCCc2ccccc2 62a_100000733362_200000077782 [0,2,0,0,0,0|1,0,1]=4 8778 B22R2.146085 O=C(CSc1ccc(cc1Cl)F)OCCc2ccccc2 62a_200000077782_100000733362 [0,2,0,0,0,0|1,0,1]=4 8779 B22R2.146085 O=C(CSc1ccc(cc1Cl)O)OCCc2ccccc2 62a_100000047559_200000077782 [0,2,0,0,0,0|1,0,1]=4 8780 B22R2.146085 O=C(CSc1ccc(cc1Cl)O)OCCc2ccccc2 62a_200000077782_100000047559 [0,2,0,0,0,0|1,0,1]=4 8781 B22R2.146085 O=C(CSc1ccc(cc1F)Br)OCCc2ccccc2 62a_100009814013_200000077782 [0,2,0,0,0,0|1,0,1]=4 8782 B22R2.146085 O=C(CSc1ccc(cc1F)Br)OCCc2ccccc2 62a_200000077782_100009814013 [0,2,0,0,0,0|1,0,1]=4 8783 B22R2.146085 O=C(CSc1ccc(cc1F)Cl)OCCc2ccccc2 62a_100011216042_200000077782 [0,2,0,0,0,0|1,0,1]=4 8784 B22R2.146085 O=C(CSc1ccc(cc1F)Cl)OCCc2ccccc2 62a_200000077782_100011216042 [0,2,0,0,0,0|1,0,1]=4 8785 B22R2.146085 O=C(CSc1ccc(cc1F)F)OCCc2ccccc2 62a_100000750030_200000077782 [0,2,0,0,0,0|1,0,1]=4 8786 B22R2.146085 O=C(CSc1ccc(cc1F)F)OCCc2ccccc2 62a_200000077782_100000750030 [0,2,0,0,0,0|1,0,1]=4 8787 B22R2.146085 O=C(CSc1ccc(cc1F)O)OCCc2ccccc2 62a_100000755031_200000077782 [0,2,0,0,0,0|1,0,1]=4 8788 B22R2.146085 O=C(CSc1ccc(cc1F)O)OCCc2ccccc2 62a_200000077782_100000755031 [0,2,0,0,0,0|1,0,1]=4 8789 B22R2.146085 O=C(CSc1ccc(cc1O)Br)OCCc2ccccc2 62a_100012344904_200000077782 [0,2,0,0,0,0|1,0,1]=4 8790 B22R2.146085 O=C(CSc1ccc(cc1O)Br)OCCc2ccccc2 62a_200000077782_100012344904 [0,2,0,0,0,0|1,0,1]=4 8791 B22R2.146085 O=C(CSc1ccc(cc1O)Cl)OCCc2ccccc2 62a_100000050036_200000077782 [0,2,0,0,0,0|1,0,1]=4 8792 B22R2.146085 O=C(CSc1ccc(cc1O)Cl)OCCc2ccccc2 62a_200000077782_100000050036 [0,2,0,0,0,0|1,0,1]=4 8793 B22R2.146085 O=C(CSc1ccc(cc1O)F)OCCc2ccccc2 62a_100000690578_200000077782 [0,2,0,0,0,0|1,0,1]=4 8794 B22R2.146085 O=C(CSc1ccc(cc1O)F)OCCc2ccccc2 62a_200000077782_100000690578 [0,2,0,0,0,0|1,0,1]=4 8795 B22R2.146085 O=C(CSc1ccc(cc1O)O)OCCc2ccccc2 62a_200000077782_100009813921 [0,2,0,0,0,0|1,0,1]=4 8796 B22R2.201042 Cc1cccc(c1NCC(=O)OCCc2ccccc2)Br 34a_100011834072_200000077782 [0,2,0,0,0,0|1,0,1]=4 8797 B22R2.201042 Cc1cccc(c1NCC(=O)OCCc2ccccc2)C 34a_100000185769_200000077782 [0,2,0,0,0,0|1,0,1]=4 8798 B22R2.201042 Cc1cccc(c1NCC(=O)OCCc2ccccc2)Cl 34a_100000756524_200000077782 [0,2,0,0,0,0|1,0,1]=4 8799 B22R2.201042 Cc1cccc(c1NCC(=O)OCCc2ccccc2)F 34a_100000766463_200000077782 [0,2,0,0,0,0|1,0,1]=4 8800 B22R2.201042 Cc1cccc(c1NCC(=O)OCCc2ccccc2)O 34a_100000743429_200000077782 [0,2,0,0,0,0|1,0,1]=4 8801 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)Br 34a_100009817157_200000077782 [0,2,0,0,0,0|1,0,1]=4 8802 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)Br 7a_100009817157_200000077782 [0,2,0,0,0,0|1,0,1]=4 8803 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)C 34a_100000210341_200000077782 [0,2,0,0,0,0|1,0,1]=4 8804 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)C 7a_100000210341_200000077782 [0,2,0,0,0,0|1,0,1]=4 8805 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)Cl 34a_100000033731_200000077782 [0,2,0,0,0,0|1,0,1]=4 8806 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)Cl 7a_100000033731_200000077782 [0,2,0,0,0,0|1,0,1]=4 8807 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)F 34a_100011659162_200000077782 [0,2,0,0,0,0|1,0,1]=4 8808 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)F 7a_100011659162_200000077782 [0,2,0,0,0,0|1,0,1]=4 8809 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)N 34a_100000756359_200000077782 [0,2,0,0,0,0|1,0,1]=4 8810 B22R2.201042 Cc1cccc(c1OCC(=O)OCCc2ccccc2)N 7a_100000756359_200000077782 [0,2,0,0,0,0|1,0,1]=4 8811 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)Br 62a_100010141302_200000077782 [0,2,0,0,0,0|1,0,1]=4 8812 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100010141302 [0,2,0,0,0,0|1,0,1]=4 8813 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)C 62a_100000033847_200000077782 [0,2,0,0,0,0|1,0,1]=4 8814 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)C 62a_200000077782_100000033847 [0,2,0,0,0,0|1,0,1]=4 8815 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)Cl 62a_100000043165_200000077782 [0,2,0,0,0,0|1,0,1]=4 8816 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100000043165 [0,2,0,0,0,0|1,0,1]=4 8817 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)F 62a_100011218421_200000077782 [0,2,0,0,0,0|1,0,1]=4 8818 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)F 62a_200000077782_100011218421 [0,2,0,0,0,0|1,0,1]=4 8819 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)N 62a_100000684715_200000077782 [0,2,0,0,0,0|1,0,1]=4 8820 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)N 62a_200000077782_100000684715 [0,2,0,0,0,0|1,0,1]=4 8821 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)O 62a_100000686692_200000077782 [0,2,0,0,0,0|1,0,1]=4 8822 B22R2.201042 Cc1cccc(c1SCC(=O)OCCc2ccccc2)O 62a_200000077782_100000686692 [0,2,0,0,0,0|1,0,1]=4 8823 B22R2.201042 Nc1cccc(c1OCC(=O)OCCc2ccccc2)Br 34a_100011934915_200000077782 [0,2,0,0,0,0|1,0,1]=4 8824 B22R2.201042 Nc1cccc(c1OCC(=O)OCCc2ccccc2)Cl 34a_100000754742_200000077782 [0,2,0,0,0,0|1,0,1]=4 8825 B22R2.201042 Nc1cccc(c1OCC(=O)OCCc2ccccc2)F 34a_100011934987_200000077782 [0,2,0,0,0,0|1,0,1]=4 8826 B22R2.201042 Nc1cccc(c1OCC(=O)OCCc2ccccc2)I 34a_100010084371_200000077782 [0,2,0,0,0,0|1,0,1]=4 8827 B22R2.201042 Nc1cccc(c1OCC(=O)OCCc2ccccc2)N 34a_200016994477_200000077782 [0,2,0,0,0,0|1,0,1]=4 8828 B22R2.201042 Nc1cccc(c1SCC(=O)OCCc2ccccc2)Br 62a_100020590159_200000077782 [0,2,0,0,0,0|1,0,1]=4 8829 B22R2.201042 Nc1cccc(c1SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100020590159 [0,2,0,0,0,0|1,0,1]=4 8830 B22R2.201042 Nc1cccc(c1SCC(=O)OCCc2ccccc2)Cl 62a_100000049713_200000077782 [0,2,0,0,0,0|1,0,1]=4 8831 B22R2.201042 Nc1cccc(c1SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100000049713 [0,2,0,0,0,0|1,0,1]=4 8832 B22R2.201042 Nc1cccc(c1SCC(=O)OCCc2ccccc2)F 62a_100000690935_200000077782 [0,2,0,0,0,0|1,0,1]=4 8833 B22R2.201042 Nc1cccc(c1SCC(=O)OCCc2ccccc2)F 62a_200000077782_100000690935 [0,2,0,0,0,0|1,0,1]=4 8834 B22R2.201042 Nc1cccc(c1SCC(=O)OCCc2ccccc2)O 62a_100012183704_200000077782 [0,2,0,0,0,0|1,0,1]=4 8835 B22R2.201042 Nc1cccc(c1SCC(=O)OCCc2ccccc2)O 62a_200000077782_100012183704 [0,2,0,0,0,0|1,0,1]=4 8836 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)CCCc2ccccc2 1458a_100000185082_100000211621 [0,2,0,0,0,0|1,0,0]=3 8837 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)CCOc2ccccc2 1458a_100000185082_100000184471 [0,2,0,0,0,0|2,0,0]=4 8838 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)CCSc2ccccc2 1458a_100000185082_100000246102 [0,2,0,0,0,0|2,0,0]=4 8839 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)CSCc2ccccc2 1458a_100000185082_200011217039 [0,2,0,0,0,0|2,0,0]=4 8840 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccccc2 11a_100000106460_100000185082 [0,2,0,0,0,0|1,0,0]=3 8841 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccccc2 1626a_100000106460_100000185082 [0,2,0,0,0,0|1,0,0]=3 8842 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccccc2 240690a_100000106460_100000185082 [0,2,0,0,0,0|1,0,0]=3 8843 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccccn2 11a_100000211156_100000185082 [0,2,0,0,0,0|2,0,0]=4 8844 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccccn2 1626a_100000211156_100000185082 [0,2,0,0,0,0|2,0,0]=4 8845 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccccn2 240690a_100000211156_100000185082 [0,2,0,0,0,0|2,0,0]=4 8846 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2cccnc2 11a_100000736294_100000185082 [0,2,0,0,0,0|2,0,0]=4 8847 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2cccnc2 1626a_100000736294_100000185082 [0,2,0,0,0,0|2,0,0]=4 8848 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2cccnc2 240690a_100000736294_100000185082 [0,2,0,0,0,0|2,0,0]=4 8849 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccncc2 11a_100000742849_100000185082 [0,2,0,0,0,0|2,0,0]=4 8850 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccncc2 1626a_100000742849_100000185082 [0,2,0,0,0,0|2,0,0]=4 8851 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NCCc2ccncc2 240690a_100000742849_100000185082 [0,2,0,0,0,0|2,0,0]=4 8852 B22R2.201042 O=C(C=Cc1c(cccc1Cl)Cl)NNCc2ccccc2 22a_100000007032_100000185082 [0,2,0,0,0,0|2,0,0]=4 8853 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)CCCc2ccccc2 1458a_100016278423_100000211621 [0,2,0,0,0,0|1,0,0]=3 8854 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)CCOc2ccccc2 1458a_100016278423_100000184471 [0,2,0,0,0,0|2,0,0]=4 8855 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)CCSc2ccccc2 1458a_100016278423_100000246102 [0,2,0,0,0,0|2,0,0]=4 8856 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)CSCc2ccccc2 1458a_100016278423_200011217039 [0,2,0,0,0,0|2,0,0]=4 8857 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccccc2 11a_100000106460_100016278423 [0,2,0,0,0,0|1,0,0]=3 8858 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccccc2 1626a_100000106460_100016278423 [0,2,0,0,0,0|1,0,0]=3 8859 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccccc2 240690a_100000106460_100016278423 [0,2,0,0,0,0|1,0,0]=3 8860 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccccn2 11a_100000211156_100016278423 [0,2,0,0,0,0|2,0,0]=4 8861 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccccn2 1626a_100000211156_100016278423 [0,2,0,0,0,0|2,0,0]=4 8862 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccccn2 240690a_100000211156_100016278423 [0,2,0,0,0,0|2,0,0]=4 8863 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2cccnc2 11a_100000736294_100016278423 [0,2,0,0,0,0|2,0,0]=4 8864 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2cccnc2 1626a_100000736294_100016278423 [0,2,0,0,0,0|2,0,0]=4 8865 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2cccnc2 240690a_100000736294_100016278423 [0,2,0,0,0,0|2,0,0]=4 8866 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccncc2 11a_100000742849_100016278423 [0,2,0,0,0,0|2,0,0]=4 8867 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccncc2 1626a_100000742849_100016278423 [0,2,0,0,0,0|2,0,0]=4 8868 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NCCc2ccncc2 240690a_100000742849_100016278423 [0,2,0,0,0,0|2,0,0]=4 8869 B22R2.201042 O=C(C=Cc1c(cccc1Cl)F)NNCc2ccccc2 22a_100000007032_100016278423 [0,2,0,0,0,0|2,0,0]=4 8870 B22R2.201042 O=C(C=Cc1c(cccc1F)F)CCCc2ccccc2 1458a_100000738813_100000211621 [0,2,0,0,0,0|1,0,0]=3 8871 B22R2.201042 O=C(C=Cc1c(cccc1F)F)CCOc2ccccc2 1458a_100000738813_100000184471 [0,2,0,0,0,0|2,0,0]=4 8872 B22R2.201042 O=C(C=Cc1c(cccc1F)F)CCSc2ccccc2 1458a_100000738813_100000246102 [0,2,0,0,0,0|2,0,0]=4 8873 B22R2.201042 O=C(C=Cc1c(cccc1F)F)CSCc2ccccc2 1458a_100000738813_200011217039 [0,2,0,0,0,0|2,0,0]=4 8874 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccccc2 11a_100000106460_100000738813 [0,2,0,0,0,0|1,0,0]=3 8875 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccccc2 1626a_100000106460_100000738813 [0,2,0,0,0,0|1,0,0]=3 8876 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccccc2 240690a_100000106460_100000738813 [0,2,0,0,0,0|1,0,0]=3 8877 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccccn2 11a_100000211156_100000738813 [0,2,0,0,0,0|2,0,0]=4 8878 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccccn2 1626a_100000211156_100000738813 [0,2,0,0,0,0|2,0,0]=4 8879 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccccn2 240690a_100000211156_100000738813 [0,2,0,0,0,0|2,0,0]=4 8880 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2cccnc2 11a_100000736294_100000738813 [0,2,0,0,0,0|2,0,0]=4 8881 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2cccnc2 1626a_100000736294_100000738813 [0,2,0,0,0,0|2,0,0]=4 8882 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2cccnc2 240690a_100000736294_100000738813 [0,2,0,0,0,0|2,0,0]=4 8883 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccncc2 11a_100000742849_100000738813 [0,2,0,0,0,0|2,0,0]=4 8884 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccncc2 1626a_100000742849_100000738813 [0,2,0,0,0,0|2,0,0]=4 8885 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NCCc2ccncc2 240690a_100000742849_100000738813 [0,2,0,0,0,0|2,0,0]=4 8886 B22R2.201042 O=C(C=Cc1c(cccc1F)F)NNCc2ccccc2 22a_100000007032_100000738813 [0,2,0,0,0,0|2,0,0]=4 8887 B22R2.201042 O=C(C=Cc1c(cccc1I)F)COCc2ccccc2 6a_100010178011_100011215004 [0,2,0,0,0,0|2,0,0]=4 8888 B22R2.201042 O=C(C=Cc1c(cccc1I)F)CSCc2ccccc2 6a_100010178011_100000172147 [0,2,0,0,0,0|2,0,0]=4 8889 B22R2.201042 O=C(CNc1c(cccc1Br)Br)OCCc2ccccc2 34a_100000690995_200000077782 [0,2,0,0,0,0|1,0,1]=4 8890 B22R2.201042 O=C(CNc1c(cccc1Br)Cl)OCCc2ccccc2 34a_100102946385_200000077782 [0,2,0,0,0,0|1,0,1]=4 8891 B22R2.201042 O=C(CNc1c(cccc1Br)F)OCCc2ccccc2 34a_100000684712_200000077782 [0,2,0,0,0,0|1,0,1]=4 8892 B22R2.201042 O=C(CNc1c(cccc1Br)O)OCCc2ccccc2 34a_100011934926_200000077782 [0,2,0,0,0,0|1,0,1]=4 8893 B22R2.201042 O=C(CNc1c(cccc1Cl)Cl)OCCc2ccccc2 34a_100000210028_200000077782 [0,2,0,0,0,0|1,0,1]=4 8894 B22R2.201042 O=C(CNc1c(cccc1Cl)F)OCCc2ccccc2 34a_100000760031_200000077782 [0,2,0,0,0,0|1,0,1]=4 8895 B22R2.201042 O=C(CNc1c(cccc1Cl)O)OCCc2ccccc2 34a_100012022510_200000077782 [0,2,0,0,0,0|1,0,1]=4 8896 B22R2.201042 O=C(CNc1c(cccc1F)F)OCCc2ccccc2 2230a_100000210704_200000077782 [0,2,0,0,0,0|1,0,1]=4 8897 B22R2.201042 O=C(CNc1c(cccc1F)F)OCCc2ccccc2 34a_100000210704_200000077782 [0,2,0,0,0,0|1,0,1]=4 8898 B22R2.201042 O=C(CNc1c(cccc1F)O)OCCc2ccccc2 34a_100020591140_200000077782 [0,2,0,0,0,0|1,0,1]=4 8899 B22R2.201042 O=C(CNc1c(cccc1I)F)OCCc2ccccc2 34a_100000042321_200000077782 [0,2,0,0,0,0|1,0,1]=4 8900 B22R2.201042 O=C(COc1c(cccc1Br)Br)OCCc2ccccc2 34a_100000736428_200000077782 [0,2,0,0,0,0|1,0,1]=4 8901 B22R2.201042 O=C(COc1c(cccc1Br)Br)OCCc2ccccc2 7a_100000736428_200000077782 [0,2,0,0,0,0|1,0,1]=4 8902 B22R2.201042 O=C(COc1c(cccc1Br)Cl)OCCc2ccccc2 34a_100010214474_200000077782 [0,2,0,0,0,0|1,0,1]=4 8903 B22R2.201042 O=C(COc1c(cccc1Br)Cl)OCCc2ccccc2 7a_100010214474_200000077782 [0,2,0,0,0,0|1,0,1]=4 8904 B22R2.201042 O=C(COc1c(cccc1Br)F)OCCc2ccccc2 34a_100009813666_200000077782 [0,2,0,0,0,0|1,0,1]=4 8905 B22R2.201042 O=C(COc1c(cccc1Br)F)OCCc2ccccc2 7a_100009813666_200000077782 [0,2,0,0,0,0|1,0,1]=4 8906 B22R2.201042 O=C(COc1c(cccc1Cl)Cl)OCCc2ccccc2 34a_100000211709_200000077782 [0,2,0,0,0,0|1,0,1]=4 8907 B22R2.201042 O=C(COc1c(cccc1Cl)Cl)OCCc2ccccc2 7a_100000211709_200000077782 [0,2,0,0,0,0|1,0,1]=4 8908 B22R2.201042 O=C(COc1c(cccc1Cl)F)OCCc2ccccc2 34a_100000694953_200000077782 [0,2,0,0,0,0|1,0,1]=4 8909 B22R2.201042 O=C(COc1c(cccc1Cl)F)OCCc2ccccc2 7a_100000694953_200000077782 [0,2,0,0,0,0|1,0,1]=4 8910 B22R2.201042 O=C(COc1c(cccc1F)F)OCCc2ccccc2 34a_100000230165_200000077782 [0,2,0,0,0,0|1,0,1]=4 8911 B22R2.201042 O=C(COc1c(cccc1F)F)OCCc2ccccc2 7a_100000230165_200000077782 [0,2,0,0,0,0|1,0,1]=4 8912 B22R2.201042 O=C(COc1c(cccc1I)Br)OCCc2ccccc2 34a_100010084509_200000077782 [0,2,0,0,0,0|1,0,1]=4 8913 B22R2.201042 O=C(COc1c(cccc1I)Br)OCCc2ccccc2 7a_100010084509_200000077782 [0,2,0,0,0,0|1,0,1]=4 8914 B22R2.201042 O=C(COc1c(cccc1I)Cl)OCCc2ccccc2 34a_100010202889_200000077782 [0,2,0,0,0,0|1,0,1]=4 8915 B22R2.201042 O=C(COc1c(cccc1I)Cl)OCCc2ccccc2 7a_100010202889_200000077782 [0,2,0,0,0,0|1,0,1]=4 8916 B22R2.201042 O=C(COc1c(cccc1I)F)OCCc2ccccc2 34a_100010186298_200000077782 [0,2,0,0,0,0|1,0,1]=4 8917 B22R2.201042 O=C(COc1c(cccc1I)F)OCCc2ccccc2 7a_100010186298_200000077782 [0,2,0,0,0,0|1,0,1]=4 8918 B22R2.201042 O=C(CSc1c(cccc1Br)Br)OCCc2ccccc2 62a_100009994525_200000077782 [0,2,0,0,0,0|1,0,1]=4 8919 B22R2.201042 O=C(CSc1c(cccc1Br)Br)OCCc2ccccc2 62a_200000077782_100009994525 [0,2,0,0,0,0|1,0,1]=4 8920 B22R2.201042 O=C(CSc1c(cccc1Br)Cl)OCCc2ccccc2 62a_100010214488_200000077782 [0,2,0,0,0,0|1,0,1]=4 8921 B22R2.201042 O=C(CSc1c(cccc1Br)Cl)OCCc2ccccc2 62a_200000077782_100010214488 [0,2,0,0,0,0|1,0,1]=4 8922 B22R2.201042 O=C(CSc1c(cccc1Br)F)OCCc2ccccc2 62a_100011219512_200000077782 [0,2,0,0,0,0|1,0,1]=4 8923 B22R2.201042 O=C(CSc1c(cccc1Br)F)OCCc2ccccc2 62a_200000077782_100011219512 [0,2,0,0,0,0|1,0,1]=4 8924 B22R2.201042 O=C(CSc1c(cccc1Br)O)OCCc2ccccc2 62a_100010187912_200000077782 [0,2,0,0,0,0|1,0,1]=4 8925 B22R2.201042 O=C(CSc1c(cccc1Br)O)OCCc2ccccc2 62a_200000077782_100010187912 [0,2,0,0,0,0|1,0,1]=4 8926 B22R2.201042 O=C(CSc1c(cccc1Cl)Cl)OCCc2ccccc2 62a_100000034237_200000077782 [0,2,0,0,0,0|1,0,1]=4 8927 B22R2.201042 O=C(CSc1c(cccc1Cl)Cl)OCCc2ccccc2 62a_200000077782_100000034237 [0,2,0,0,0,0|1,0,1]=4 8928 B22R2.201042 O=C(CSc1c(cccc1Cl)F)OCCc2ccccc2 62a_100000050007_200000077782 [0,2,0,0,0,0|1,0,1]=4 8929 B22R2.201042 O=C(CSc1c(cccc1Cl)F)OCCc2ccccc2 62a_200000077782_100000050007 [0,2,0,0,0,0|1,0,1]=4 8930 B22R2.201042 O=C(CSc1c(cccc1Cl)O)OCCc2ccccc2 62a_200000077782_100000050174 [0,2,0,0,0,0|1,0,1]=4 8931 B22R2.201042 O=C(CSc1c(cccc1F)F)OCCc2ccccc2 62a_100000693133_200000077782 [0,2,0,0,0,0|1,0,1]=4 8932 B22R2.201042 O=C(CSc1c(cccc1F)F)OCCc2ccccc2 62a_200000077782_100000693133 [0,2,0,0,0,0|1,0,1]=4 8933 B22R2.201042 O=C(CSc1c(cccc1F)O)OCCc2ccccc2 62a_100009820682_200000077782 [0,2,0,0,0,0|1,0,1]=4 8934 B22R2.201042 O=C(CSc1c(cccc1F)O)OCCc2ccccc2 62a_200000077782_100009820682 [0,2,0,0,0,0|1,0,1]=4 8935 B22R2.201042 O=C(CSc1c(cccc1O)O)OCCc2ccccc2 62a_200000077782_100010205330 [0,2,0,0,0,0|1,0,1]=4 8936 B22R2.201763 Cc1ccccc1C=CC(=O)NCCc2ccccc2Br 1626a_100000747383_100016266485 [0,2,0,0,0,0|1,0,0]=3 8937 B22R2.201763 Cc1ccccc1C=CC(=O)NCCc2ccccc2C 1626a_100000685071_100016266485 [0,2,0,0,0,0|1,0,0]=3 8938 B22R2.201763 Cc1ccccc1C=CC(=O)NCCc2ccccc2Cl 1626a_100011207228_100016266485 [0,2,0,0,0,0|1,0,0]=3 8939 B22R2.201763 Cc1ccccc1C=CC(=O)NCCc2ccccc2F 1626a_100000185272_100016266485 [0,2,0,0,0,0|1,0,0]=3 8940 B22R2.201763 Cc1ccccc1C=CC(=O)NCCn2ccccc2=O 1626a_100000687133_100016266485 [0,2,0,0,0,0|2,0,0]=4 8941 B22R2.201763 Cc1ccccc1C=CC(=O)NNCc2ccccc2Br 22a_200016993956_100016266485 [0,2,0,0,0,0|2,0,0]=4 8942 B22R2.201763 Cc1ccccc1C=CC(=O)NNCc2ccccc2C 22a_100000737298_100016266485 [0,2,0,0,0,0|2,0,0]=4 8943 B22R2.201763 Cc1ccccc1C=CC(=O)NNCc2ccccc2Cl 22a_100015187261_100016266485 [0,2,0,0,0,0|2,0,0]=4 8944 B22R2.201763 Cc1ccccc1C=CC(=O)NNCc2ccccc2F 22a_100015200773_100016266485 [0,2,0,0,0,0|2,0,0]=4 8945 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2Br 11a_100000685071_100000719032 [0,2,0,0,0,0|1,0,0]=3 8946 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2Br 1626a_100000685071_100000719032 [0,2,0,0,0,0|1,0,0]=3 8947 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2Br 240690a_100000685071_100000719032 [0,2,0,0,0,0|1,0,0]=3 8948 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2Cl 11a_100000685071_100000720304 [0,2,0,0,0,0|1,0,0]=3 8949 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2Cl 1626a_100000685071_100000720304 [0,2,0,0,0,0|1,0,0]=3 8950 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2Cl 240690a_100000685071_100000720304 [0,2,0,0,0,0|1,0,0]=3 8951 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2F 11a_100000685071_100016256065 [0,2,0,0,0,0|1,0,0]=3 8952 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2F 1626a_100000685071_100016256065 [0,2,0,0,0,0|1,0,0]=3 8953 B22R2.201763 Cc1ccccc1CCNC(=O)C=Cc2ccccc2F 240690a_100000685071_100016256065 [0,2,0,0,0,0|1,0,0]=3 8954 B22R2.201763 Cc1ccccc1CNNC(=O)C=Cc2ccccc2Br 22a_100000737298_100000719032 [0,2,0,0,0,0|2,0,0]=4 8955 B22R2.201763 Cc1ccccc1CNNC(=O)C=Cc2ccccc2Cl 22a_100000737298_100000720304 [0,2,0,0,0,0|2,0,0]=4 8956 B22R2.201763 Cc1ccccc1CNNC(=O)C=Cc2ccccc2F 22a_100000737298_100016256065 [0,2,0,0,0,0|2,0,0]=4 8957 B22R2.201763 Cc1ccccc1CNNC(=O)C=Cc2ccccc2O 22a_100000737298_100016263591 [0,2,0,0,0,0|2,0,0]=4 8958 B22R2.201763 Cc1ccccc1OCCC(=O)C=Cc2ccccc2Br 1458a_100000719032_100000184434 [0,2,0,0,0,0|2,0,0]=4 8959 B22R2.201763 Cc1ccccc1OCCC(=O)C=Cc2ccccc2Cl 1458a_100000720304_100000184434 [0,2,0,0,0,0|2,0,0]=4 8960 B22R2.201763 Cc1ccccc1OCCC(=O)C=Cc2ccccc2F 1458a_100016256065_100000184434 [0,2,0,0,0,0|2,0,0]=4 8961 B22R2.201763 Cc1ccccc1OCCC(=O)C=Cc2ccccc2O 1458a_100016263591_100000184434 [0,2,0,0,0,0|2,0,0]=4 8962 B22R2.201763 O=C(C=Cc1ccccc1Br)CCCc2ccccc2Br 1458a_100000719032_200011713681 [0,2,0,0,0,0|1,0,0]=3 8963 B22R2.201763 O=C(C=Cc1ccccc1Br)CCOc2ccccc2Br 1458a_100000719032_100000695877 [0,2,0,0,0,0|2,0,0]=4 8964 B22R2.201763 O=C(C=Cc1ccccc1Br)CCOc2ccccc2F 1458a_100000719032_100000183290 [0,2,0,0,0,0|2,0,0]=4 8965 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2Br 11a_100000747383_100000719032 [0,2,0,0,0,0|1,0,0]=3 8966 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2Br 1626a_100000747383_100000719032 [0,2,0,0,0,0|1,0,0]=3 8967 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2Br 240690a_100000747383_100000719032 [0,2,0,0,0,0|1,0,0]=3 8968 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2Cl 11a_100011207228_100000719032 [0,2,0,0,0,0|1,0,0]=3 8969 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2Cl 1626a_100011207228_100000719032 [0,2,0,0,0,0|1,0,0]=3 8970 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2Cl 240690a_100011207228_100000719032 [0,2,0,0,0,0|1,0,0]=3 8971 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2F 11a_100000185272_100000719032 [0,2,0,0,0,0|1,0,0]=3 8972 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2F 1626a_100000185272_100000719032 [0,2,0,0,0,0|1,0,0]=3 8973 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2F 240690a_100000185272_100000719032 [0,2,0,0,0,0|1,0,0]=3 8974 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCc2ccccc2O 240690a_100011207237_100000719032 [0,2,0,0,0,0|1,0,0]=3 8975 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCn2ccccc2=O 1626a_100000687133_100000719032 [0,2,0,0,0,0|2,0,0]=4 8976 B22R2.201763 O=C(C=Cc1ccccc1Br)NCCn2ccccc2=O 240690a_100000687133_100000719032 [0,2,0,0,0,0|2,0,0]=4 8977 B22R2.201763 O=C(C=Cc1ccccc1Br)NNCc2ccccc2Br 22a_200016993956_100000719032 [0,2,0,0,0,0|2,0,0]=4 8978 B22R2.201763 O=C(C=Cc1ccccc1Br)NNCc2ccccc2Cl 22a_100015187261_100000719032 [0,2,0,0,0,0|2,0,0]=4 8979 B22R2.201763 O=C(C=Cc1ccccc1Br)NNCc2ccccc2F 22a_100015200773_100000719032 [0,2,0,0,0,0|2,0,0]=4 8980 B22R2.201763 O=C(C=Cc1ccccc1Cl)CCCc2ccccc2Br 1458a_100000720304_200011713681 [0,2,0,0,0,0|1,0,0]=3 8981 B22R2.201763 O=C(C=Cc1ccccc1Cl)CCOc2ccccc2Br 1458a_100000720304_100000695877 [0,2,0,0,0,0|2,0,0]=4 8982 B22R2.201763 O=C(C=Cc1ccccc1Cl)CCOc2ccccc2F 1458a_100000720304_100000183290 [0,2,0,0,0,0|2,0,0]=4 8983 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2Br 11a_100000747383_100000720304 [0,2,0,0,0,0|1,0,0]=3 8984 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2Br 1626a_100000747383_100000720304 [0,2,0,0,0,0|1,0,0]=3 8985 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2Br 240690a_100000747383_100000720304 [0,2,0,0,0,0|1,0,0]=3 8986 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2Cl 11a_100011207228_100000720304 [0,2,0,0,0,0|1,0,0]=3 8987 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2Cl 1626a_100011207228_100000720304 [0,2,0,0,0,0|1,0,0]=3 8988 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2Cl 240690a_100011207228_100000720304 [0,2,0,0,0,0|1,0,0]=3 8989 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2F 11a_100000185272_100000720304 [0,2,0,0,0,0|1,0,0]=3 8990 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2F 1626a_100000185272_100000720304 [0,2,0,0,0,0|1,0,0]=3 8991 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2F 240690a_100000185272_100000720304 [0,2,0,0,0,0|1,0,0]=3 8992 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCc2ccccc2O 240690a_100011207237_100000720304 [0,2,0,0,0,0|1,0,0]=3 8993 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCn2ccccc2=O 1626a_100000687133_100000720304 [0,2,0,0,0,0|2,0,0]=4 8994 B22R2.201763 O=C(C=Cc1ccccc1Cl)NCCn2ccccc2=O 240690a_100000687133_100000720304 [0,2,0,0,0,0|2,0,0]=4 8995 B22R2.201763 O=C(C=Cc1ccccc1Cl)NNCc2ccccc2Br 22a_200016993956_100000720304 [0,2,0,0,0,0|2,0,0]=4 8996 B22R2.201763 O=C(C=Cc1ccccc1Cl)NNCc2ccccc2Cl 22a_100015187261_100000720304 [0,2,0,0,0,0|2,0,0]=4 8997 B22R2.201763 O=C(C=Cc1ccccc1Cl)NNCc2ccccc2F 22a_100015200773_100000720304 [0,2,0,0,0,0|2,0,0]=4 8998 B22R2.201763 O=C(C=Cc1ccccc1F)CCCc2ccccc2Br 1458a_100016256065_200011713681 [0,2,0,0,0,0|1,0,0]=3 8999 B22R2.201763 O=C(C=Cc1ccccc1F)CCOc2ccccc2Br 1458a_100016256065_100000695877 [0,2,0,0,0,0|2,0,0]=4 9000 B22R2.201763 O=C(C=Cc1ccccc1F)CCOc2ccccc2F 1458a_100016256065_100000183290 [0,2,0,0,0,0|2,0,0]=4 9001 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2Br 11a_100000747383_100016256065 [0,2,0,0,0,0|1,0,0]=3 9002 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2Br 1626a_100000747383_100016256065 [0,2,0,0,0,0|1,0,0]=3 9003 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2Br 240690a_100000747383_100016256065 [0,2,0,0,0,0|1,0,0]=3 9004 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2Cl 11a_100011207228_100016256065 [0,2,0,0,0,0|1,0,0]=3 9005 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2Cl 1626a_100011207228_100016256065 [0,2,0,0,0,0|1,0,0]=3 9006 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2Cl 240690a_100011207228_100016256065 [0,2,0,0,0,0|1,0,0]=3 9007 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2F 11a_100000185272_100016256065 [0,2,0,0,0,0|1,0,0]=3 9008 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2F 1626a_100000185272_100016256065 [0,2,0,0,0,0|1,0,0]=3 9009 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2F 240690a_100000185272_100016256065 [0,2,0,0,0,0|1,0,0]=3 9010 B22R2.201763 O=C(C=Cc1ccccc1F)NCCc2ccccc2O 240690a_100011207237_100016256065 [0,2,0,0,0,0|1,0,0]=3 9011 B22R2.201763 O=C(C=Cc1ccccc1F)NCCn2ccccc2=O 1626a_100000687133_100016256065 [0,2,0,0,0,0|2,0,0]=4 9012 B22R2.201763 O=C(C=Cc1ccccc1F)NCCn2ccccc2=O 240690a_100000687133_100016256065 [0,2,0,0,0,0|2,0,0]=4 9013 B22R2.201763 O=C(C=Cc1ccccc1F)NNCc2ccccc2Br 22a_200016993956_100016256065 [0,2,0,0,0,0|2,0,0]=4 9014 B22R2.201763 O=C(C=Cc1ccccc1F)NNCc2ccccc2Cl 22a_100015187261_100016256065 [0,2,0,0,0,0|2,0,0]=4 9015 B22R2.201763 O=C(C=Cc1ccccc1F)NNCc2ccccc2F 22a_100015200773_100016256065 [0,2,0,0,0,0|2,0,0]=4 9016 B22R2.201763 O=C(C=Cc1ccccc1O)CCCc2ccccc2Br 1458a_100016263591_200011713681 [0,2,0,0,0,0|1,0,0]=3 9017 B22R2.201763 O=C(C=Cc1ccccc1O)CCOc2ccccc2Br 1458a_100016263591_100000695877 [0,2,0,0,0,0|2,0,0]=4 9018 B22R2.201763 O=C(C=Cc1ccccc1O)CCOc2ccccc2F 1458a_100016263591_100000183290 [0,2,0,0,0,0|2,0,0]=4 9019 B22R2.201763 O=C(C=Cc1ccccc1O)NNCc2ccccc2Br 22a_200016993956_100016263591 [0,2,0,0,0,0|2,0,0]=4 9020 B22R2.201763 O=C(C=Cc1ccccc1O)NNCc2ccccc2Cl 22a_100015187261_100016263591 [0,2,0,0,0,0|2,0,0]=4 9021 B22R2.201763 O=C(C=Cc1ccccc1O)NNCc2ccccc2F 22a_100015200773_100016263591 [0,2,0,0,0,0|2,0,0]=4 9022 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)CCCc2ccccc2)F 1458a_100102526132_100000211621 [0,2,0,0,0,0|1,0,0]=3 9023 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)CCOc2ccccc2)F 1458a_100102526132_100000184471 [0,2,0,0,0,0|2,0,0]=4 9024 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)CCSc2ccccc2)F 1458a_100102526132_100000246102 [0,2,0,0,0,0|2,0,0]=4 9025 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)COCc2ccccc2)F 6a_100000756917_100011215004 [0,2,0,0,0,0|2,0,0]=4 9026 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)COCc2ccccc2)I 6a_100010150105_100011215004 [0,2,0,0,0,0|2,0,0]=4 9027 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)CSCc2ccccc2)F 1458a_100102526132_200011217039 [0,2,0,0,0,0|2,0,0]=4 9028 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)CSCc2ccccc2)F 6a_100000756917_100000172147 [0,2,0,0,0,0|2,0,0]=4 9029 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)CSCc2ccccc2)I 6a_100010150105_100000172147 [0,2,0,0,0,0|2,0,0]=4 9030 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccccc2)C 1626a_100000106460_200016256798 [0,2,0,0,0,0|1,0,0]=3 9031 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccccc2)F 11a_100000106460_100102526132 [0,2,0,0,0,0|1,0,0]=3 9032 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccccc2)F 1626a_100000106460_100102526132 [0,2,0,0,0,0|1,0,0]=3 9033 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccccc2)F 240690a_100000106460_100102526132 [0,2,0,0,0,0|1,0,0]=3 9034 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccccn2)C 1626a_100000211156_200016256798 [0,2,0,0,0,0|2,0,0]=4 9035 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccccn2)F 11a_100000211156_100102526132 [0,2,0,0,0,0|2,0,0]=4 9036 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccccn2)F 1626a_100000211156_100102526132 [0,2,0,0,0,0|2,0,0]=4 9037 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccccn2)F 240690a_100000211156_100102526132 [0,2,0,0,0,0|2,0,0]=4 9038 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2cccnc2)C 1626a_100000736294_200016256798 [0,2,0,0,0,0|2,0,0]=4 9039 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2cccnc2)F 11a_100000736294_100102526132 [0,2,0,0,0,0|2,0,0]=4 9040 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2cccnc2)F 1626a_100000736294_100102526132 [0,2,0,0,0,0|2,0,0]=4 9041 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2cccnc2)F 240690a_100000736294_100102526132 [0,2,0,0,0,0|2,0,0]=4 9042 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccncc2)C 1626a_100000742849_200016256798 [0,2,0,0,0,0|2,0,0]=4 9043 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccncc2)F 11a_100000742849_100102526132 [0,2,0,0,0,0|2,0,0]=4 9044 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccncc2)F 1626a_100000742849_100102526132 [0,2,0,0,0,0|2,0,0]=4 9045 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NCCc2ccncc2)F 240690a_100000742849_100102526132 [0,2,0,0,0,0|2,0,0]=4 9046 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NNCc2ccccc2)C 22a_100000007032_200016256798 [0,2,0,0,0,0|2,0,0]=4 9047 B22R2.308786 Cc1ccc(c(c1)C=CC(=O)NNCc2ccccc2)F 22a_100000007032_100102526132 [0,2,0,0,0,0|2,0,0]=4 9048 B22R2.308786 Cc1ccc(c(c1)NCC(=O)OCCc2ccccc2)Br 34a_100000745044_200000077782 [0,2,0,0,0,0|1,0,1]=4 9049 B22R2.308786 Cc1ccc(c(c1)NCC(=O)OCCc2ccccc2)C 2230a_100000185781_200000077782 [0,2,0,0,0,0|1,0,1]=4 9050 B22R2.308786 Cc1ccc(c(c1)NCC(=O)OCCc2ccccc2)C 34a_100000185781_200000077782 [0,2,0,0,0,0|1,0,1]=4 9051 B22R2.308786 Cc1ccc(c(c1)NCC(=O)OCCc2ccccc2)C 7a_100000185781_200000077782 [0,2,0,0,0,0|1,0,1]=4 9052 B22R2.308786 Cc1ccc(c(c1)NCC(=O)OCCc2ccccc2)Cl 34a_100011215360_200000077782 [0,2,0,0,0,0|1,0,1]=4 9053 B22R2.308786 Cc1ccc(c(c1)NCC(=O)OCCc2ccccc2)F 34a_100000211285_200000077782 [0,2,0,0,0,0|1,0,1]=4 9054 B22R2.308786 Cc1ccc(c(c1)NCC(=O)OCCc2ccccc2)I 34a_100011216686_200000077782 [0,2,0,0,0,0|1,0,1]=4 9055 B22R2.308786 Cc1ccc(c(c1)NCC(=O)OCCc2ccccc2)O 34a_100011215204_200000077782 [0,2,0,0,0,0|1,0,1]=4 9056 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)Br 34a_100012002257_200000077782 [0,2,0,0,0,0|1,0,1]=4 9057 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)Br 7a_100012002257_200000077782 [0,2,0,0,0,0|1,0,1]=4 9058 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)C 34a_100000210931_200000077782 [0,2,0,0,0,0|1,0,1]=4 9059 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)C 7a_100000210931_200000077782 [0,2,0,0,0,0|1,0,1]=4 9060 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)Cl 34a_100000211493_200000077782 [0,2,0,0,0,0|1,0,1]=4 9061 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)Cl 7a_100000211493_200000077782 [0,2,0,0,0,0|1,0,1]=4 9062 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)F 34a_100000759540_200000077782 [0,2,0,0,0,0|1,0,1]=4 9063 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)F 7a_100000759540_200000077782 [0,2,0,0,0,0|1,0,1]=4 9064 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)N 34a_100000211527_200000077782 [0,2,0,0,0,0|1,0,1]=4 9065 B22R2.308786 Cc1ccc(c(c1)OCC(=O)OCCc2ccccc2)N 7a_100000211527_200000077782 [0,2,0,0,0,0|1,0,1]=4 9066 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)Br 62a_100012353751_200000077782 [0,2,0,0,0,0|1,0,1]=4 9067 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100012353751 [0,2,0,0,0,0|1,0,1]=4 9068 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)C 62a_100000210833_200000077782 [0,2,0,0,0,0|1,0,1]=4 9069 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)C 62a_200000077782_100000210833 [0,2,0,0,0,0|1,0,1]=4 9070 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)Cl 62a_100012356289_200000077782 [0,2,0,0,0,0|1,0,1]=4 9071 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100012356289 [0,2,0,0,0,0|1,0,1]=4 9072 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)F 62a_100000736223_200000077782 [0,2,0,0,0,0|1,0,1]=4 9073 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)F 62a_200000077782_100000736223 [0,2,0,0,0,0|1,0,1]=4 9074 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)N 62a_100011356834_200000077782 [0,2,0,0,0,0|1,0,1]=4 9075 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)N 62a_200000077782_100011356834 [0,2,0,0,0,0|1,0,1]=4 9076 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)O 62a_100000765521_200000077782 [0,2,0,0,0,0|1,0,1]=4 9077 B22R2.308786 Cc1ccc(c(c1)SCC(=O)OCCc2ccccc2)O 62a_200000077782_100000765521 [0,2,0,0,0,0|1,0,1]=4 9078 B22R2.308786 Cc1ccc(cc1C=CC(=O)NCCc2ccccc2)F 11a_100000106460_100102526137 [0,2,0,0,0,0|1,0,0]=3 9079 B22R2.308786 Cc1ccc(cc1C=CC(=O)NCCc2ccccc2)F 1626a_100000106460_100102526137 [0,2,0,0,0,0|1,0,0]=3 9080 B22R2.308786 Cc1ccc(cc1C=CC(=O)NCCc2ccccn2)F 11a_100000211156_100102526137 [0,2,0,0,0,0|2,0,0]=4 9081 B22R2.308786 Cc1ccc(cc1C=CC(=O)NCCc2ccccn2)F 1626a_100000211156_100102526137 [0,2,0,0,0,0|2,0,0]=4 9082 B22R2.308786 Cc1ccc(cc1C=CC(=O)NCCc2cccnc2)F 11a_100000736294_100102526137 [0,2,0,0,0,0|2,0,0]=4 9083 B22R2.308786 Cc1ccc(cc1C=CC(=O)NCCc2cccnc2)F 1626a_100000736294_100102526137 [0,2,0,0,0,0|2,0,0]=4 9084 B22R2.308786 Cc1ccc(cc1C=CC(=O)NCCc2ccncc2)F 11a_100000742849_100102526137 [0,2,0,0,0,0|2,0,0]=4 9085 B22R2.308786 Cc1ccc(cc1C=CC(=O)NCCc2ccncc2)F 1626a_100000742849_100102526137 [0,2,0,0,0,0|2,0,0]=4 9086 B22R2.308786 Cc1ccc(cc1C=CC(=O)NNCc2ccccc2)F 22a_100000007032_100102526137 [0,2,0,0,0,0|2,0,0]=4 9087 B22R2.308786 Cc1ccc(cc1NCC(=O)OCCc2ccccc2)Br 34a_100000741167_200000077782 [0,2,0,0,0,0|1,0,1]=4 9088 B22R2.308786 Cc1ccc(cc1NCC(=O)OCCc2ccccc2)Br 7a_100000741167_200000077782 [0,2,0,0,0,0|1,0,1]=4 9089 B22R2.308786 Cc1ccc(cc1NCC(=O)OCCc2ccccc2)Cl 34a_100000211374_200000077782 [0,2,0,0,0,0|1,0,1]=4 9090 B22R2.308786 Cc1ccc(cc1NCC(=O)OCCc2ccccc2)Cl 7a_100000211374_200000077782 [0,2,0,0,0,0|1,0,1]=4 9091 B22R2.308786 Cc1ccc(cc1NCC(=O)OCCc2ccccc2)F 34a_100000211107_200000077782 [0,2,0,0,0,0|1,0,1]=4 9092 B22R2.308786 Cc1ccc(cc1NCC(=O)OCCc2ccccc2)F 7a_100000211107_200000077782 [0,2,0,0,0,0|1,0,1]=4 9093 B22R2.308786 Cc1ccc(cc1NCC(=O)OCCc2ccccc2)I 7a_100000761890_200000077782 [0,2,0,0,0,0|1,0,1]=4 9094 B22R2.308786 Cc1ccc(cc1NCC(=O)OCCc2ccccc2)O 34a_100011216113_200000077782 [0,2,0,0,0,0|1,0,1]=4 9095 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)Br 34a_100000685420_200000077782 [0,2,0,0,0,0|1,0,1]=4 9096 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)Br 7a_100000685420_200000077782 [0,2,0,0,0,0|1,0,1]=4 9097 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)Cl 34a_100000756515_200000077782 [0,2,0,0,0,0|1,0,1]=4 9098 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)Cl 7a_100000756515_200000077782 [0,2,0,0,0,0|1,0,1]=4 9099 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)F 34a_100000690566_200000077782 [0,2,0,0,0,0|1,0,1]=4 9100 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)F 7a_100000690566_200000077782 [0,2,0,0,0,0|1,0,1]=4 9101 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)I 7a_100000766334_200000077782 [0,2,0,0,0,0|1,0,1]=4 9102 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)N 34a_100000759471_200000077782 [0,2,0,0,0,0|1,0,1]=4 9103 B22R2.308786 Cc1ccc(cc1OCC(=O)OCCc2ccccc2)N 7a_100000759471_200000077782 [0,2,0,0,0,0|1,0,1]=4 9104 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)Br 62a_100011344865_200000077782 [0,2,0,0,0,0|1,0,1]=4 9105 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100011344865 [0,2,0,0,0,0|1,0,1]=4 9106 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)Cl 62a_100011263213_200000077782 [0,2,0,0,0,0|1,0,1]=4 9107 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100011263213 [0,2,0,0,0,0|1,0,1]=4 9108 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)F 62a_100011218078_200000077782 [0,2,0,0,0,0|1,0,1]=4 9109 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)F 62a_200000077782_100011218078 [0,2,0,0,0,0|1,0,1]=4 9110 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)N 62a_100000736455_200000077782 [0,2,0,0,0,0|1,0,1]=4 9111 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)N 62a_200000077782_100000736455 [0,2,0,0,0,0|1,0,1]=4 9112 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)O 62a_100011380479_200000077782 [0,2,0,0,0,0|1,0,1]=4 9113 B22R2.308786 Cc1ccc(cc1SCC(=O)OCCc2ccccc2)O 62a_200000077782_100011380479 [0,2,0,0,0,0|1,0,1]=4 9114 B22R2.308786 Nc1ccc(c(c1)OCC(=O)OCCc2ccccc2)Cl 34a_100011934209_200000077782 [0,2,0,0,0,0|1,0,1]=4 9115 B22R2.308786 Nc1ccc(c(c1)OCC(=O)OCCc2ccccc2)F 34a_100012017398_200000077782 [0,2,0,0,0,0|1,0,1]=4 9116 B22R2.308786 Nc1ccc(c(c1)OCC(=O)OCCc2ccccc2)F 7a_100012017398_200000077782 [0,2,0,0,0,0|1,0,1]=4 9117 B22R2.308786 Nc1ccc(c(c1)OCC(=O)OCCc2ccccc2)N 34a_100025717382_200000077782 [0,2,0,0,0,0|1,0,1]=4 9118 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)Br 62a_100000750459_200000077782 [0,2,0,0,0,0|1,0,1]=4 9119 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100000750459 [0,2,0,0,0,0|1,0,1]=4 9120 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)Cl 62a_100012360549_200000077782 [0,2,0,0,0,0|1,0,1]=4 9121 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100012360549 [0,2,0,0,0,0|1,0,1]=4 9122 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)F 62a_100000760356_200000077782 [0,2,0,0,0,0|1,0,1]=4 9123 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)F 62a_200000077782_100000760356 [0,2,0,0,0,0|1,0,1]=4 9124 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)N 62a_100011534242_200000077782 [0,2,0,0,0,0|1,0,1]=4 9125 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)N 62a_200000077782_100011534242 [0,2,0,0,0,0|1,0,1]=4 9126 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)O 62a_100011534360_200000077782 [0,2,0,0,0,0|1,0,1]=4 9127 B22R2.308786 Nc1ccc(c(c1)SCC(=O)OCCc2ccccc2)O 62a_200000077782_100011534360 [0,2,0,0,0,0|1,0,1]=4 9128 B22R2.308786 Nc1ccc(cc1OCC(=O)OCCc2ccccc2)Br 34a_100000739049_200000077782 [0,2,0,0,0,0|1,0,1]=4 9129 B22R2.308786 Nc1ccc(cc1OCC(=O)OCCc2ccccc2)Br 7a_100000739049_200000077782 [0,2,0,0,0,0|1,0,1]=4 9130 B22R2.308786 Nc1ccc(cc1OCC(=O)OCCc2ccccc2)Cl 34a_100000185728_200000077782 [0,2,0,0,0,0|1,0,1]=4 9131 B22R2.308786 Nc1ccc(cc1OCC(=O)OCCc2ccccc2)Cl 7a_100000185728_200000077782 [0,2,0,0,0,0|1,0,1]=4 9132 B22R2.308786 Nc1ccc(cc1OCC(=O)OCCc2ccccc2)F 34a_100000753323_200000077782 [0,2,0,0,0,0|1,0,1]=4 9133 B22R2.308786 Nc1ccc(cc1OCC(=O)OCCc2ccccc2)F 7a_100000753323_200000077782 [0,2,0,0,0,0|1,0,1]=4 9134 B22R2.308786 Nc1ccc(cc1OCC(=O)OCCc2ccccc2)I 34a_100000057187_200000077782 [0,2,0,0,0,0|1,0,1]=4 9135 B22R2.308786 Nc1ccc(cc1OCC(=O)OCCc2ccccc2)I 7a_100000057187_200000077782 [0,2,0,0,0,0|1,0,1]=4 9136 B22R2.308786 Nc1ccc(cc1SCC(=O)OCCc2ccccc2)Br 62a_100000187925_200000077782 [0,2,0,0,0,0|1,0,1]=4 9137 B22R2.308786 Nc1ccc(cc1SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100000187925 [0,2,0,0,0,0|1,0,1]=4 9138 B22R2.308786 Nc1ccc(cc1SCC(=O)OCCc2ccccc2)Cl 62a_100000761889_200000077782 [0,2,0,0,0,0|1,0,1]=4 9139 B22R2.308786 Nc1ccc(cc1SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100000761889 [0,2,0,0,0,0|1,0,1]=4 9140 B22R2.308786 Nc1ccc(cc1SCC(=O)OCCc2ccccc2)F 62a_100000760547_200000077782 [0,2,0,0,0,0|1,0,1]=4 9141 B22R2.308786 Nc1ccc(cc1SCC(=O)OCCc2ccccc2)F 62a_200000077782_100000760547 [0,2,0,0,0,0|1,0,1]=4 9142 B22R2.308786 Nc1ccc(cc1SCC(=O)OCCc2ccccc2)O 62a_100012001276_200000077782 [0,2,0,0,0,0|1,0,1]=4 9143 B22R2.308786 Nc1ccc(cc1SCC(=O)OCCc2ccccc2)O 62a_200000077782_100012001276 [0,2,0,0,0,0|1,0,1]=4 9144 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)CCCc2ccccc2 1458a_100102525183_100000211621 [0,2,0,0,0,0|1,0,0]=3 9145 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)CCOc2ccccc2 1458a_100102525183_100000184471 [0,2,0,0,0,0|2,0,0]=4 9146 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)CCSc2ccccc2 1458a_100102525183_100000246102 [0,2,0,0,0,0|2,0,0]=4 9147 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)CSCc2ccccc2 1458a_100102525183_200011217039 [0,2,0,0,0,0|2,0,0]=4 9148 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccccc2 11a_100000106460_100102525183 [0,2,0,0,0,0|1,0,0]=3 9149 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccccc2 1626a_100000106460_100102525183 [0,2,0,0,0,0|1,0,0]=3 9150 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccccc2 240690a_100000106460_100102525183 [0,2,0,0,0,0|1,0,0]=3 9151 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccccn2 11a_100000211156_100102525183 [0,2,0,0,0,0|2,0,0]=4 9152 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccccn2 1626a_100000211156_100102525183 [0,2,0,0,0,0|2,0,0]=4 9153 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccccn2 240690a_100000211156_100102525183 [0,2,0,0,0,0|2,0,0]=4 9154 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2cccnc2 11a_100000736294_100102525183 [0,2,0,0,0,0|2,0,0]=4 9155 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2cccnc2 1626a_100000736294_100102525183 [0,2,0,0,0,0|2,0,0]=4 9156 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2cccnc2 240690a_100000736294_100102525183 [0,2,0,0,0,0|2,0,0]=4 9157 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccncc2 11a_100000742849_100102525183 [0,2,0,0,0,0|2,0,0]=4 9158 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccncc2 1626a_100000742849_100102525183 [0,2,0,0,0,0|2,0,0]=4 9159 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NCCc2ccncc2 240690a_100000742849_100102525183 [0,2,0,0,0,0|2,0,0]=4 9160 B22R2.308786 O=C(C=Cc1cc(ccc1Br)F)NNCc2ccccc2 22a_100000007032_100102525183 [0,2,0,0,0,0|2,0,0]=4 9161 B22R2.308786 O=C(C=Cc1cc(ccc1Br)I)COCc2ccccc2 6a_100010185652_100011215004 [0,2,0,0,0,0|2,0,0]=4 9162 B22R2.308786 O=C(C=Cc1cc(ccc1Br)I)CSCc2ccccc2 6a_100010185652_100000172147 [0,2,0,0,0,0|2,0,0]=4 9163 B22R2.308786 O=C(C=Cc1cc(ccc1Br)O)NCCc2ccccc2 240690a_100000106460_200159324452 [0,2,0,0,0,0|1,0,0]=3 9164 B22R2.308786 O=C(C=Cc1cc(ccc1Br)O)NCCc2ccccn2 240690a_100000211156_200159324452 [0,2,0,0,0,0|2,0,0]=4 9165 B22R2.308786 O=C(C=Cc1cc(ccc1Br)O)NCCc2cccnc2 240690a_100000736294_200159324452 [0,2,0,0,0,0|2,0,0]=4 9166 B22R2.308786 O=C(C=Cc1cc(ccc1Br)O)NCCc2ccncc2 240690a_100000742849_200159324452 [0,2,0,0,0,0|2,0,0]=4 9167 B22R2.308786 O=C(C=Cc1cc(ccc1Br)O)NNCc2ccccc2 22a_100000007032_200159324452 [0,2,0,0,0,0|2,0,0]=4 9168 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)CCCc2ccccc2 1458a_100000234794_100000211621 [0,2,0,0,0,0|1,0,0]=3 9169 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)CCOc2ccccc2 1458a_100000234794_100000184471 [0,2,0,0,0,0|2,0,0]=4 9170 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)CCSc2ccccc2 1458a_100000234794_100000246102 [0,2,0,0,0,0|2,0,0]=4 9171 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)CSCc2ccccc2 1458a_100000234794_200011217039 [0,2,0,0,0,0|2,0,0]=4 9172 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccccc2 11a_100000106460_100000234794 [0,2,0,0,0,0|1,0,0]=3 9173 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccccc2 1626a_100000106460_100000234794 [0,2,0,0,0,0|1,0,0]=3 9174 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccccc2 240690a_100000106460_100000234794 [0,2,0,0,0,0|1,0,0]=3 9175 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccccn2 11a_100000211156_100000234794 [0,2,0,0,0,0|2,0,0]=4 9176 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccccn2 1626a_100000211156_100000234794 [0,2,0,0,0,0|2,0,0]=4 9177 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccccn2 240690a_100000211156_100000234794 [0,2,0,0,0,0|2,0,0]=4 9178 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2cccnc2 11a_100000736294_100000234794 [0,2,0,0,0,0|2,0,0]=4 9179 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2cccnc2 1626a_100000736294_100000234794 [0,2,0,0,0,0|2,0,0]=4 9180 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2cccnc2 240690a_100000736294_100000234794 [0,2,0,0,0,0|2,0,0]=4 9181 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccncc2 11a_100000742849_100000234794 [0,2,0,0,0,0|2,0,0]=4 9182 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccncc2 1626a_100000742849_100000234794 [0,2,0,0,0,0|2,0,0]=4 9183 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NCCc2ccncc2 240690a_100000742849_100000234794 [0,2,0,0,0,0|2,0,0]=4 9184 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)Cl)NNCc2ccccc2 22a_100000007032_100000234794 [0,2,0,0,0,0|2,0,0]=4 9185 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)I)COCc2ccccc2 6a_100010254384_100011215004 [0,2,0,0,0,0|2,0,0]=4 9186 B22R2.308786 O=C(C=Cc1cc(ccc1Cl)I)CSCc2ccccc2 6a_100010254384_100000172147 [0,2,0,0,0,0|2,0,0]=4 9187 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)CCCc2ccccc2 1458a_100000718207_100000211621 [0,2,0,0,0,0|1,0,0]=3 9188 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)CCOc2ccccc2 1458a_100000718207_100000184471 [0,2,0,0,0,0|2,0,0]=4 9189 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)CCSc2ccccc2 1458a_100000718207_100000246102 [0,2,0,0,0,0|2,0,0]=4 9190 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)COCc2ccccc2 6a_100000211465_100011215004 [0,2,0,0,0,0|2,0,0]=4 9191 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)CSCc2ccccc2 1458a_100000718207_200011217039 [0,2,0,0,0,0|2,0,0]=4 9192 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)CSCc2ccccc2 6a_100000211465_100000172147 [0,2,0,0,0,0|2,0,0]=4 9193 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccccc2 11a_100000106460_100000718207 [0,2,0,0,0,0|1,0,0]=3 9194 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccccc2 1626a_100000106460_100000718207 [0,2,0,0,0,0|1,0,0]=3 9195 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccccc2 240690a_100000106460_100000718207 [0,2,0,0,0,0|1,0,0]=3 9196 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccccn2 11a_100000211156_100000718207 [0,2,0,0,0,0|2,0,0]=4 9197 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccccn2 1626a_100000211156_100000718207 [0,2,0,0,0,0|2,0,0]=4 9198 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccccn2 240690a_100000211156_100000718207 [0,2,0,0,0,0|2,0,0]=4 9199 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2cccnc2 11a_100000736294_100000718207 [0,2,0,0,0,0|2,0,0]=4 9200 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2cccnc2 1626a_100000736294_100000718207 [0,2,0,0,0,0|2,0,0]=4 9201 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2cccnc2 240690a_100000736294_100000718207 [0,2,0,0,0,0|2,0,0]=4 9202 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccncc2 11a_100000742849_100000718207 [0,2,0,0,0,0|2,0,0]=4 9203 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccncc2 1626a_100000742849_100000718207 [0,2,0,0,0,0|2,0,0]=4 9204 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NCCc2ccncc2 240690a_100000742849_100000718207 [0,2,0,0,0,0|2,0,0]=4 9205 B22R2.308786 O=C(C=Cc1cc(ccc1F)Br)NNCc2ccccc2 22a_100000007032_100000718207 [0,2,0,0,0,0|2,0,0]=4 9206 B22R2.308786 O=C(C=Cc1cc(ccc1F)Cl)COCc2ccccc2 6a_100000745245_100011215004 [0,2,0,0,0,0|2,0,0]=4 9207 B22R2.308786 O=C(C=Cc1cc(ccc1F)Cl)CSCc2ccccc2 6a_100000745245_100000172147 [0,2,0,0,0,0|2,0,0]=4 9208 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)CCCc2ccccc2 1458a_100000744626_100000211621 [0,2,0,0,0,0|1,0,0]=3 9209 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)CCOc2ccccc2 1458a_100000744626_100000184471 [0,2,0,0,0,0|2,0,0]=4 9210 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)CCSc2ccccc2 1458a_100000744626_100000246102 [0,2,0,0,0,0|2,0,0]=4 9211 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)COCc2ccccc2 6a_100000740046_100011215004 [0,2,0,0,0,0|2,0,0]=4 9212 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)CSCc2ccccc2 1458a_100000744626_200011217039 [0,2,0,0,0,0|2,0,0]=4 9213 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)CSCc2ccccc2 6a_100000740046_100000172147 [0,2,0,0,0,0|2,0,0]=4 9214 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccccc2 11a_100000106460_100000744626 [0,2,0,0,0,0|1,0,0]=3 9215 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccccc2 1626a_100000106460_100000744626 [0,2,0,0,0,0|1,0,0]=3 9216 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccccc2 240690a_100000106460_100000744626 [0,2,0,0,0,0|1,0,0]=3 9217 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccccn2 11a_100000211156_100000744626 [0,2,0,0,0,0|2,0,0]=4 9218 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccccn2 1626a_100000211156_100000744626 [0,2,0,0,0,0|2,0,0]=4 9219 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccccn2 240690a_100000211156_100000744626 [0,2,0,0,0,0|2,0,0]=4 9220 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2cccnc2 11a_100000736294_100000744626 [0,2,0,0,0,0|2,0,0]=4 9221 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2cccnc2 1626a_100000736294_100000744626 [0,2,0,0,0,0|2,0,0]=4 9222 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2cccnc2 240690a_100000736294_100000744626 [0,2,0,0,0,0|2,0,0]=4 9223 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccncc2 11a_100000742849_100000744626 [0,2,0,0,0,0|2,0,0]=4 9224 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccncc2 1626a_100000742849_100000744626 [0,2,0,0,0,0|2,0,0]=4 9225 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NCCc2ccncc2 240690a_100000742849_100000744626 [0,2,0,0,0,0|2,0,0]=4 9226 B22R2.308786 O=C(C=Cc1cc(ccc1F)F)NNCc2ccccc2 22a_100000007032_100000744626 [0,2,0,0,0,0|2,0,0]=4 9227 B22R2.308786 O=C(C=Cc1cc(ccc1F)I)COCc2ccccc2 6a_100000050626_100011215004 [0,2,0,0,0,0|2,0,0]=4 9228 B22R2.308786 O=C(C=Cc1cc(ccc1F)I)CSCc2ccccc2 6a_100000050626_100000172147 [0,2,0,0,0,0|2,0,0]=4 9229 B22R2.308786 O=C(C=Cc1cc(ccc1I)Br)COCc2ccccc2 6a_100010185651_100011215004 [0,2,0,0,0,0|2,0,0]=4 9230 B22R2.308786 O=C(C=Cc1cc(ccc1I)Br)CSCc2ccccc2 6a_100010185651_100000172147 [0,2,0,0,0,0|2,0,0]=4 9231 B22R2.308786 O=C(C=Cc1cc(ccc1I)Cl)COCc2ccccc2 6a_100010254386_100011215004 [0,2,0,0,0,0|2,0,0]=4 9232 B22R2.308786 O=C(C=Cc1cc(ccc1I)Cl)CSCc2ccccc2 6a_100010254386_100000172147 [0,2,0,0,0,0|2,0,0]=4 9233 B22R2.308786 O=C(C=Cc1cc(ccc1I)F)COCc2ccccc2 6a_100010186294_100011215004 [0,2,0,0,0,0|2,0,0]=4 9234 B22R2.308786 O=C(C=Cc1cc(ccc1I)F)CSCc2ccccc2 6a_100010186294_100000172147 [0,2,0,0,0,0|2,0,0]=4 9235 B22R2.308786 O=C(C=Cc1cc(ccc1I)O)COCc2ccccc2 6a_100000069132_100011215004 [0,2,0,0,0,0|2,0,0]=4 9236 B22R2.308786 O=C(C=Cc1cc(ccc1I)O)CSCc2ccccc2 6a_100000069132_100000172147 [0,2,0,0,0,0|2,0,0]=4 9237 B22R2.308786 O=C(C=Cc1cc(ccc1O)I)COCc2ccccc2 6a_100011215628_100011215004 [0,2,0,0,0,0|2,0,0]=4 9238 B22R2.308786 O=C(C=Cc1cc(ccc1O)I)CSCc2ccccc2 6a_100011215628_100000172147 [0,2,0,0,0,0|2,0,0]=4 9239 B22R2.308786 O=C(CNc1cc(ccc1Br)Br)OCCc2ccccc2 34a_100000737762_200000077782 [0,2,0,0,0,0|1,0,1]=4 9240 B22R2.308786 O=C(CNc1cc(ccc1Br)Cl)OCCc2ccccc2 34a_100000687073_200000077782 [0,2,0,0,0,0|1,0,1]=4 9241 B22R2.308786 O=C(CNc1cc(ccc1Br)F)OCCc2ccccc2 34a_100000687223_200000077782 [0,2,0,0,0,0|1,0,1]=4 9242 B22R2.308786 O=C(CNc1cc(ccc1Br)O)OCCc2ccccc2 34a_100011999798_200000077782 [0,2,0,0,0,0|1,0,1]=4 9243 B22R2.308786 O=C(CNc1cc(ccc1Cl)Br)OCCc2ccccc2 34a_100000750497_200000077782 [0,2,0,0,0,0|1,0,1]=4 9244 B22R2.308786 O=C(CNc1cc(ccc1Cl)Cl)OCCc2ccccc2 34a_100000184485_200000077782 [0,2,0,0,0,0|1,0,1]=4 9245 B22R2.308786 O=C(CNc1cc(ccc1Cl)F)OCCc2ccccc2 34a_100000751338_200000077782 [0,2,0,0,0,0|1,0,1]=4 9246 B22R2.308786 O=C(CNc1cc(ccc1Cl)I)OCCc2ccccc2 34a_200000761891_200000077782 [0,2,0,0,0,0|1,0,1]=4 9247 B22R2.308786 O=C(CNc1cc(ccc1Cl)O)OCCc2ccccc2 34a_100011934297_200000077782 [0,2,0,0,0,0|1,0,1]=4 9248 B22R2.308786 O=C(CNc1cc(ccc1F)Br)OCCc2ccccc2 34a_100000740924_200000077782 [0,2,0,0,0,0|1,0,1]=4 9249 B22R2.308786 O=C(CNc1cc(ccc1F)Cl)OCCc2ccccc2 34a_100000212115_200000077782 [0,2,0,0,0,0|1,0,1]=4 9250 B22R2.308786 O=C(CNc1cc(ccc1F)F)OCCc2ccccc2 34a_100000210742_200000077782 [0,2,0,0,0,0|1,0,1]=4 9251 B22R2.308786 O=C(CNc1cc(ccc1F)I)OCCc2ccccc2 34a_100011464823_200000077782 [0,2,0,0,0,0|1,0,1]=4 9252 B22R2.308786 O=C(CNc1cc(ccc1F)O)OCCc2ccccc2 34a_100012017239_200000077782 [0,2,0,0,0,0|1,0,1]=4 9253 B22R2.308786 O=C(CNc1cc(ccc1I)Br)OCCc2ccccc2 34a_100000743836_200000077782 [0,2,0,0,0,0|1,0,1]=4 9254 B22R2.308786 O=C(CNc1cc(ccc1I)Cl)OCCc2ccccc2 34a_100000761886_200000077782 [0,2,0,0,0,0|1,0,1]=4 9255 B22R2.308786 O=C(CNc1cc(ccc1I)F)OCCc2ccccc2 34a_100011218093_200000077782 [0,2,0,0,0,0|1,0,1]=4 9256 B22R2.308786 O=C(CNc1cc(ccc1O)Br)OCCc2ccccc2 34a_100000752626_200000077782 [0,2,0,0,0,0|1,0,1]=4 9257 B22R2.308786 O=C(CNc1cc(ccc1O)Cl)OCCc2ccccc2 34a_100000210500_200000077782 [0,2,0,0,0,0|1,0,1]=4 9258 B22R2.308786 O=C(CNc1cc(ccc1O)F)OCCc2ccccc2 34a_100000759472_200000077782 [0,2,0,0,0,0|1,0,1]=4 9259 B22R2.308786 O=C(COc1cc(ccc1Br)Br)OCCc2ccccc2 34a_100011220040_200000077782 [0,2,0,0,0,0|1,0,1]=4 9260 B22R2.308786 O=C(COc1cc(ccc1Br)Br)OCCc2ccccc2 7a_100011220040_200000077782 [0,2,0,0,0,0|1,0,1]=4 9261 B22R2.308786 O=C(COc1cc(ccc1Br)Cl)OCCc2ccccc2 34a_100012339455_200000077782 [0,2,0,0,0,0|1,0,1]=4 9262 B22R2.308786 O=C(COc1cc(ccc1Br)Cl)OCCc2ccccc2 7a_100012339455_200000077782 [0,2,0,0,0,0|1,0,1]=4 9263 B22R2.308786 O=C(COc1cc(ccc1Br)F)OCCc2ccccc2 34a_100000690578_200000077782 [0,2,0,0,0,0|1,0,1]=4 9264 B22R2.308786 O=C(COc1cc(ccc1Br)F)OCCc2ccccc2 7a_100000690578_200000077782 [0,2,0,0,0,0|1,0,1]=4 9265 B22R2.308786 O=C(COc1cc(ccc1Br)I)OCCc2ccccc2 34a_100012356990_200000077782 [0,2,0,0,0,0|1,0,1]=4 9266 B22R2.308786 O=C(COc1cc(ccc1Br)I)OCCc2ccccc2 7a_100012356990_200000077782 [0,2,0,0,0,0|1,0,1]=4 9267 B22R2.308786 O=C(COc1cc(ccc1Cl)Br)OCCc2ccccc2 34a_100000738945_200000077782 [0,2,0,0,0,0|1,0,1]=4 9268 B22R2.308786 O=C(COc1cc(ccc1Cl)Br)OCCc2ccccc2 7a_100000738945_200000077782 [0,2,0,0,0,0|1,0,1]=4 9269 B22R2.308786 O=C(COc1cc(ccc1Cl)Cl)OCCc2ccccc2 34a_100000211422_200000077782 [0,2,0,0,0,0|1,0,1]=4 9270 B22R2.308786 O=C(COc1cc(ccc1Cl)Cl)OCCc2ccccc2 7a_100000211422_200000077782 [0,2,0,0,0,0|1,0,1]=4 9271 B22R2.308786 O=C(COc1cc(ccc1Cl)F)OCCc2ccccc2 34a_100000692107_200000077782 [0,2,0,0,0,0|1,0,1]=4 9272 B22R2.308786 O=C(COc1cc(ccc1Cl)F)OCCc2ccccc2 7a_100000692107_200000077782 [0,2,0,0,0,0|1,0,1]=4 9273 B22R2.308786 O=C(COc1cc(ccc1Cl)I)OCCc2ccccc2 34a_100011356854_200000077782 [0,2,0,0,0,0|1,0,1]=4 9274 B22R2.308786 O=C(COc1cc(ccc1Cl)I)OCCc2ccccc2 7a_100011356854_200000077782 [0,2,0,0,0,0|1,0,1]=4 9275 B22R2.308786 O=C(COc1cc(ccc1F)Br)OCCc2ccccc2 34a_100000686035_200000077782 [0,2,0,0,0,0|1,0,1]=4 9276 B22R2.308786 O=C(COc1cc(ccc1F)Br)OCCc2ccccc2 7a_100000686035_200000077782 [0,2,0,0,0,0|1,0,1]=4 9277 B22R2.308786 O=C(COc1cc(ccc1F)Cl)OCCc2ccccc2 34a_100000757397_200000077782 [0,2,0,0,0,0|1,0,1]=4 9278 B22R2.308786 O=C(COc1cc(ccc1F)Cl)OCCc2ccccc2 7a_100000757397_200000077782 [0,2,0,0,0,0|1,0,1]=4 9279 B22R2.308786 O=C(COc1cc(ccc1F)F)OCCc2ccccc2 34a_100000752141_200000077782 [0,2,0,0,0,0|1,0,1]=4 9280 B22R2.308786 O=C(COc1cc(ccc1F)F)OCCc2ccccc2 7a_100000752141_200000077782 [0,2,0,0,0,0|1,0,1]=4 9281 B22R2.308786 O=C(COc1cc(ccc1F)I)OCCc2ccccc2 34a_100009958187_200000077782 [0,2,0,0,0,0|1,0,1]=4 9282 B22R2.308786 O=C(COc1cc(ccc1F)I)OCCc2ccccc2 7a_100009958187_200000077782 [0,2,0,0,0,0|1,0,1]=4 9283 B22R2.308786 O=C(COc1cc(ccc1I)Br)OCCc2ccccc2 34a_100012344904_200000077782 [0,2,0,0,0,0|1,0,1]=4 9284 B22R2.308786 O=C(COc1cc(ccc1I)Br)OCCc2ccccc2 7a_100012344904_200000077782 [0,2,0,0,0,0|1,0,1]=4 9285 B22R2.308786 O=C(COc1cc(ccc1I)Cl)OCCc2ccccc2 34a_100000050036_200000077782 [0,2,0,0,0,0|1,0,1]=4 9286 B22R2.308786 O=C(COc1cc(ccc1I)Cl)OCCc2ccccc2 7a_100000050036_200000077782 [0,2,0,0,0,0|1,0,1]=4 9287 B22R2.308786 O=C(COc1cc(ccc1I)F)OCCc2ccccc2 34a_100010084537_200000077782 [0,2,0,0,0,0|1,0,1]=4 9288 B22R2.308786 O=C(COc1cc(ccc1I)F)OCCc2ccccc2 7a_100010084537_200000077782 [0,2,0,0,0,0|1,0,1]=4 9289 B22R2.308786 O=C(CSc1cc(ccc1Br)Br)OCCc2ccccc2 62a_100011483371_200000077782 [0,2,0,0,0,0|1,0,1]=4 9290 B22R2.308786 O=C(CSc1cc(ccc1Br)Br)OCCc2ccccc2 62a_200000077782_100011483371 [0,2,0,0,0,0|1,0,1]=4 9291 B22R2.308786 O=C(CSc1cc(ccc1Br)Cl)OCCc2ccccc2 62a_100012339723_200000077782 [0,2,0,0,0,0|1,0,1]=4 9292 B22R2.308786 O=C(CSc1cc(ccc1Br)Cl)OCCc2ccccc2 62a_200000077782_100012339723 [0,2,0,0,0,0|1,0,1]=4 9293 B22R2.308786 O=C(CSc1cc(ccc1Br)F)OCCc2ccccc2 62a_100011217576_200000077782 [0,2,0,0,0,0|1,0,1]=4 9294 B22R2.308786 O=C(CSc1cc(ccc1Br)F)OCCc2ccccc2 62a_200000077782_100011217576 [0,2,0,0,0,0|1,0,1]=4 9295 B22R2.308786 O=C(CSc1cc(ccc1Br)O)OCCc2ccccc2 62a_100012339312_200000077782 [0,2,0,0,0,0|1,0,1]=4 9296 B22R2.308786 O=C(CSc1cc(ccc1Br)O)OCCc2ccccc2 62a_200000077782_100012339312 [0,2,0,0,0,0|1,0,1]=4 9297 B22R2.308786 O=C(CSc1cc(ccc1Cl)Br)OCCc2ccccc2 62a_100011772130_200000077782 [0,2,0,0,0,0|1,0,1]=4 9298 B22R2.308786 O=C(CSc1cc(ccc1Cl)Br)OCCc2ccccc2 62a_200000077782_100011772130 [0,2,0,0,0,0|1,0,1]=4 9299 B22R2.308786 O=C(CSc1cc(ccc1Cl)Cl)OCCc2ccccc2 62a_100000707729_200000077782 [0,2,0,0,0,0|1,0,1]=4 9300 B22R2.308786 O=C(CSc1cc(ccc1Cl)Cl)OCCc2ccccc2 62a_200000077782_100000707729 [0,2,0,0,0,0|1,0,1]=4 9301 B22R2.308786 O=C(CSc1cc(ccc1Cl)F)OCCc2ccccc2 62a_100011217299_200000077782 [0,2,0,0,0,0|1,0,1]=4 9302 B22R2.308786 O=C(CSc1cc(ccc1Cl)F)OCCc2ccccc2 62a_200000077782_100011217299 [0,2,0,0,0,0|1,0,1]=4 9303 B22R2.308786 O=C(CSc1cc(ccc1Cl)O)OCCc2ccccc2 62a_100000049588_200000077782 [0,2,0,0,0,0|1,0,1]=4 9304 B22R2.308786 O=C(CSc1cc(ccc1Cl)O)OCCc2ccccc2 62a_200000077782_100000049588 [0,2,0,0,0,0|1,0,1]=4 9305 B22R2.308786 O=C(CSc1cc(ccc1F)Br)OCCc2ccccc2 62a_100011217312_200000077782 [0,2,0,0,0,0|1,0,1]=4 9306 B22R2.308786 O=C(CSc1cc(ccc1F)Br)OCCc2ccccc2 62a_200000077782_100011217312 [0,2,0,0,0,0|1,0,1]=4 9307 B22R2.308786 O=C(CSc1cc(ccc1F)Cl)OCCc2ccccc2 62a_100011218116_200000077782 [0,2,0,0,0,0|1,0,1]=4 9308 B22R2.308786 O=C(CSc1cc(ccc1F)Cl)OCCc2ccccc2 62a_200000077782_100011218116 [0,2,0,0,0,0|1,0,1]=4 9309 B22R2.308786 O=C(CSc1cc(ccc1F)F)OCCc2ccccc2 62a_100011219198_200000077782 [0,2,0,0,0,0|1,0,1]=4 9310 B22R2.308786 O=C(CSc1cc(ccc1F)F)OCCc2ccccc2 62a_200000077782_100011219198 [0,2,0,0,0,0|1,0,1]=4 9311 B22R2.308786 O=C(CSc1cc(ccc1F)O)OCCc2ccccc2 62a_100000693481_200000077782 [0,2,0,0,0,0|1,0,1]=4 9312 B22R2.308786 O=C(CSc1cc(ccc1F)O)OCCc2ccccc2 62a_200000077782_100000693481 [0,2,0,0,0,0|1,0,1]=4 9313 B22R2.308786 O=C(CSc1cc(ccc1O)Br)OCCc2ccccc2 62a_100012355227_200000077782 [0,2,0,0,0,0|1,0,1]=4 9314 B22R2.308786 O=C(CSc1cc(ccc1O)Br)OCCc2ccccc2 62a_200000077782_100012355227 [0,2,0,0,0,0|1,0,1]=4 9315 B22R2.308786 O=C(CSc1cc(ccc1O)Cl)OCCc2ccccc2 62a_100011356953_200000077782 [0,2,0,0,0,0|1,0,1]=4 9316 B22R2.308786 O=C(CSc1cc(ccc1O)Cl)OCCc2ccccc2 62a_200000077782_100011356953 [0,2,0,0,0,0|1,0,1]=4 9317 B22R2.308786 O=C(CSc1cc(ccc1O)F)OCCc2ccccc2 62a_100000211999_200000077782 [0,2,0,0,0,0|1,0,1]=4 9318 B22R2.308786 O=C(CSc1cc(ccc1O)F)OCCc2ccccc2 62a_200000077782_100000211999 [0,2,0,0,0,0|1,0,1]=4 9319 B22R2.308786 O=C(CSc1cc(ccc1O)O)OCCc2ccccc2 62a_200000077782_100009813629 [0,2,0,0,0,0|1,0,1]=4 9320 B22R2.3743 CCc1ccccc1CCNC(=O)C=Cc2ccccc2 11a_100011663701_100000210462 [0,2,0,0,0,0|1,0,0]=3 9321 B22R2.3743 CCc1ccccc1CCNC(=O)C=Cc2ccccc2 1626a_100011663701_100000210462 [0,2,0,0,0,0|1,0,0]=3 9322 B22R2.3743 CCc1ccccc1CCNC(=O)C=Cc2ccccn2 11a_100011663701_100000740811 [0,2,0,0,0,0|2,0,0]=4 9323 B22R2.3743 CCc1ccccc1CCNC(=O)C=Cc2ccccn2 240690a_100011663701_100000740811 [0,2,0,0,0,0|2,0,0]=4 9324 B22R2.3743 CCc1ccccc1CCNC(=O)C=Cc2cccnc2 11a_100011663701_100000735890 [0,2,0,0,0,0|2,0,0]=4 9325 B22R2.3743 CCc1ccccc1CCNC(=O)C=Cc2cccnc2 240690a_100011663701_100000735890 [0,2,0,0,0,0|2,0,0]=4 9326 B22R2.3743 CCc1ccccc1CCNC(=O)C=Cc2ccncc2 240690a_100011663701_100000682801 [0,2,0,0,0,0|2,0,0]=4 9327 B22R2.3743 COc1ccccc1CCNC(=O)C=Cc2ccccc2 11a_100000211851_100000210462 [0,2,0,0,0,0|1,0,0]=3 9328 B22R2.3743 COc1ccccc1CCNC(=O)C=Cc2ccccc2 1626a_100000211851_100000210462 [0,2,0,0,0,0|1,0,0]=3 9329 B22R2.3743 COc1ccccc1CCNC(=O)C=Cc2ccccn2 11a_100000211851_100000740811 [0,2,0,0,0,0|2,0,0]=4 9330 B22R2.3743 COc1ccccc1CCNC(=O)C=Cc2ccccn2 240690a_100000211851_100000740811 [0,2,0,0,0,0|2,0,0]=4 9331 B22R2.3743 COc1ccccc1CCNC(=O)C=Cc2cccnc2 11a_100000211851_100000735890 [0,2,0,0,0,0|2,0,0]=4 9332 B22R2.3743 COc1ccccc1CCNC(=O)C=Cc2cccnc2 240690a_100000211851_100000735890 [0,2,0,0,0,0|2,0,0]=4 9333 B22R2.3743 COc1ccccc1CCNC(=O)C=Cc2ccncc2 240690a_100000211851_100000682801 [0,2,0,0,0,0|2,0,0]=4 9334 B22R2.3743 COc1ccccc1CNNC(=O)C=Cc2ccccc2 22a_100020605366_100000210462 [0,2,0,0,0,0|2,0,0]=4 9335 B22R2.3743 COc1ccccc1OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000188471 [0,2,0,0,0,0|2,0,0]=4 9336 B22R2.3743 N#Cc1ccccc1OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000743737 [0,2,0,0,0,0|2,0,0]=4 9337 B22R2.3743 O=C(C=Cc1ccccc1)NCCc2ccccc2[Pd]Cl 11a_106741704370_100000210462 [0,2,0,0,0,0|1,0,0]=3 9338 B22R2.3743 O=C(C=Cc1ccccc1)NCCc2ccccc2[Pd]Cl 1626a_106741704370_100000210462 [0,2,0,0,0,0|1,0,0]=3 9339 B22R2.3743 O=C(C=Cc1ccccn1)NCCc2ccccc2[Pd]Cl 11a_106741704370_100000740811 [0,2,0,0,0,0|2,0,0]=4 9340 B22R2.3743 O=C(C=Cc1ccccn1)NCCc2ccccc2[Pd]Cl 240690a_106741704370_100000740811 [0,2,0,0,0,0|2,0,0]=4 9341 B22R2.3743 O=C(C=Cc1cccnc1)NCCc2ccccc2[Pd]Cl 11a_106741704370_100000735890 [0,2,0,0,0,0|2,0,0]=4 9342 B22R2.3743 O=C(C=Cc1cccnc1)NCCc2ccccc2[Pd]Cl 240690a_106741704370_100000735890 [0,2,0,0,0,0|2,0,0]=4 9343 B22R2.3743 O=C(C=Cc1ccncc1)NCCc2ccccc2[Pd]Cl 240690a_106741704370_100000682801 [0,2,0,0,0,0|2,0,0]=4 9344 B22R2.3743 O=Cc1ccccc1OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100009990610 [0,2,0,0,0,0|2,0,0]=4 9345 B22R2.9160 CC(=CC(=O)CCCc1ccccc1Br)c2ccccc2 1458a_100000743005_200011713681 [0,2,0,0,0,0|1,0,0]=3 9346 B22R2.9160 CC(=CC(=O)CCOc1ccccc1Br)c2ccccc2 1458a_100000743005_100000695877 [0,2,0,0,0,0|2,0,0]=4 9347 B22R2.9160 CC(=CC(=O)CCOc1ccccc1C)c2ccccc2 1458a_100000743005_100000184434 [0,2,0,0,0,0|2,0,0]=4 9348 B22R2.9160 CC(=CC(=O)CCOc1ccccc1F)c2ccccc2 1458a_100000743005_100000183290 [0,2,0,0,0,0|2,0,0]=4 9349 B22R2.9160 CC(=CC(=O)NCCc1ccccc1Br)c2ccccc2 11a_100000747383_100000743005 [0,2,0,0,0,0|1,0,0]=3 9350 B22R2.9160 CC(=CC(=O)NCCc1ccccc1Br)c2ccccc2 1626a_100000747383_100000743005 [0,2,0,0,0,0|1,0,0]=3 9351 B22R2.9160 CC(=CC(=O)NCCc1ccccc1Br)c2ccccc2 240690a_100000747383_100000743005 [0,2,0,0,0,0|1,0,0]=3 9352 B22R2.9160 CC(=CC(=O)NCCc1ccccc1Br)c2ccccc2 527a_100000747383_100000743005 [0,2,0,0,0,0|1,0,0]=3 9353 B22R2.9160 CC(=CC(=O)NCCc1ccccc1C)c2ccccc2 11a_100000685071_100000743005 [0,2,0,0,0,0|1,0,0]=3 9354 B22R2.9160 CC(=CC(=O)NCCc1ccccc1C)c2ccccc2 1626a_100000685071_100000743005 [0,2,0,0,0,0|1,0,0]=3 9355 B22R2.9160 CC(=CC(=O)NCCc1ccccc1C)c2ccccc2 240690a_100000685071_100000743005 [0,2,0,0,0,0|1,0,0]=3 9356 B22R2.9160 CC(=CC(=O)NCCc1ccccc1C)c2ccccc2 527a_100000685071_100000743005 [0,2,0,0,0,0|1,0,0]=3 9357 B22R2.9160 CC(=CC(=O)NCCc1ccccc1Cl)c2ccccc2 11a_100011207228_100000743005 [0,2,0,0,0,0|1,0,0]=3 9358 B22R2.9160 CC(=CC(=O)NCCc1ccccc1Cl)c2ccccc2 1626a_100011207228_100000743005 [0,2,0,0,0,0|1,0,0]=3 9359 B22R2.9160 CC(=CC(=O)NCCc1ccccc1Cl)c2ccccc2 240690a_100011207228_100000743005 [0,2,0,0,0,0|1,0,0]=3 9360 B22R2.9160 CC(=CC(=O)NCCc1ccccc1Cl)c2ccccc2 527a_100011207228_100000743005 [0,2,0,0,0,0|1,0,0]=3 9361 B22R2.9160 CC(=CC(=O)NCCc1ccccc1F)c2ccccc2 11a_100000185272_100000743005 [0,2,0,0,0,0|1,0,0]=3 9362 B22R2.9160 CC(=CC(=O)NCCc1ccccc1F)c2ccccc2 1626a_100000185272_100000743005 [0,2,0,0,0,0|1,0,0]=3 9363 B22R2.9160 CC(=CC(=O)NCCc1ccccc1F)c2ccccc2 240690a_100000185272_100000743005 [0,2,0,0,0,0|1,0,0]=3 9364 B22R2.9160 CC(=CC(=O)NCCc1ccccc1F)c2ccccc2 527a_100000185272_100000743005 [0,2,0,0,0,0|1,0,0]=3 9365 B22R2.9160 CC(=CC(=O)NCCc1ccccc1O)c2ccccc2 240690a_100011207237_100000743005 [0,2,0,0,0,0|1,0,0]=3 9366 B22R2.9160 CC(=CC(=O)NCCc1ccccc1O)c2ccccc2 527a_100011207237_100000743005 [0,2,0,0,0,0|1,0,0]=3 9367 B22R2.9160 CC(=CC(=O)NCCn1ccccc1=O)c2ccccc2 1626a_100000687133_100000743005 [0,2,0,0,0,0|2,0,0]=4 9368 B22R2.9160 CC(=CC(=O)NCCn1ccccc1=O)c2ccccc2 240690a_100000687133_100000743005 [0,2,0,0,0,0|2,0,0]=4 9369 B22R2.9160 CC(=CC(=O)NCCn1ccccc1=O)c2ccccc2 527a_100000687133_100000743005 [0,2,0,0,0,0|2,0,0]=4 9370 B22R2.9160 CC(=CC(=O)NNCc1ccccc1Br)c2ccccc2 22a_200016993956_100000743005 [0,2,0,0,0,0|2,0,0]=4 9371 B22R2.9160 CC(=CC(=O)NNCc1ccccc1C)c2ccccc2 22a_100000737298_100000743005 [0,2,0,0,0,0|2,0,0]=4 9372 B22R2.9160 CC(=CC(=O)NNCc1ccccc1Cl)c2ccccc2 22a_100015187261_100000743005 [0,2,0,0,0,0|2,0,0]=4 9373 B22R2.9160 CC(=CC(=O)NNCc1ccccc1F)c2ccccc2 22a_100015200773_100000743005 [0,2,0,0,0,0|2,0,0]=4 9374 B22R2.9160 Cc1ccccc1CCNC(=O)CC(=O)c2ccccc2 1458a_100000185807_100000230229 [0,2,0,0,0,0|1,0,1]=4 9375 B22R2.9160 O=C(CCCc1ccccc1Cl)CC(=O)c2ccccc2 1458a_100000700343_100000211460 [0,2,0,0,0,0|1,0,1]=4 9376 B22R2.9160 O=C(CCCc1ccccc1O)CC(=O)c2ccccc2 1458a_100009859317_100000211460 [0,2,0,0,0,0|1,0,1]=4 9377 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)CCCc2ccccc2Br 1458a_100016990649_200011713681 [0,2,0,0,0,0|1,0,0]=3 9378 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)CCOc2ccccc2Br 1458a_100016990649_100000695877 [0,2,0,0,0,0|2,0,0]=4 9379 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)CCOc2ccccc2C 1458a_100016990649_100000184434 [0,2,0,0,0,0|2,0,0]=4 9380 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)CCOc2ccccc2F 1458a_100016990649_100000183290 [0,2,0,0,0,0|2,0,0]=4 9381 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2Br 11a_100000747383_100016990649 [0,2,0,0,0,0|1,0,0]=3 9382 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2Br 1626a_100000747383_100016990649 [0,2,0,0,0,0|1,0,0]=3 9383 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2Br 527a_100000747383_100016990649 [0,2,0,0,0,0|1,0,0]=3 9384 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2C 11a_100000685071_100016990649 [0,2,0,0,0,0|1,0,0]=3 9385 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2C 1626a_100000685071_100016990649 [0,2,0,0,0,0|1,0,0]=3 9386 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2C 527a_100000685071_100016990649 [0,2,0,0,0,0|1,0,0]=3 9387 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2Cl 11a_100011207228_100016990649 [0,2,0,0,0,0|1,0,0]=3 9388 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2Cl 1626a_100011207228_100016990649 [0,2,0,0,0,0|1,0,0]=3 9389 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2Cl 527a_100011207228_100016990649 [0,2,0,0,0,0|1,0,0]=3 9390 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2F 11a_100000185272_100016990649 [0,2,0,0,0,0|1,0,0]=3 9391 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2F 1626a_100000185272_100016990649 [0,2,0,0,0,0|1,0,0]=3 9392 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2F 527a_100000185272_100016990649 [0,2,0,0,0,0|1,0,0]=3 9393 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCc2ccccc2O 527a_100011207237_100016990649 [0,2,0,0,0,0|1,0,0]=3 9394 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCn2ccccc2=O 1626a_100000687133_100016990649 [0,2,0,0,0,0|2,0,0]=4 9395 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NCCn2ccccc2=O 527a_100000687133_100016990649 [0,2,0,0,0,0|2,0,0]=4 9396 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NNCc2ccccc2Br 22a_200016993956_100016990649 [0,2,0,0,0,0|2,0,0]=4 9397 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NNCc2ccccc2C 22a_100000737298_100016990649 [0,2,0,0,0,0|2,0,0]=4 9398 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NNCc2ccccc2Cl 22a_100015187261_100016990649 [0,2,0,0,0,0|2,0,0]=4 9399 B22R2.9166 C/C(=C\c1ccccc1)/C(=O)NNCc2ccccc2F 22a_100015200773_100016990649 [0,2,0,0,0,0|2,0,0]=4 9400 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)CCCc2ccccc2Br 1458a_100025712827_200011713681 [0,2,0,0,0,0|2,0,0]=4 9401 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2Br 11a_100000747383_100025712827 [0,2,0,0,0,0|2,0,0]=4 9402 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2Br 1626a_100000747383_100025712827 [0,2,0,0,0,0|2,0,0]=4 9403 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2Br 527a_100000747383_100025712827 [0,2,0,0,0,0|2,0,0]=4 9404 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2C 11a_100000685071_100025712827 [0,2,0,0,0,0|2,0,0]=4 9405 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2C 1626a_100000685071_100025712827 [0,2,0,0,0,0|2,0,0]=4 9406 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2C 527a_100000685071_100025712827 [0,2,0,0,0,0|2,0,0]=4 9407 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2Cl 11a_100011207228_100025712827 [0,2,0,0,0,0|2,0,0]=4 9408 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2Cl 1626a_100011207228_100025712827 [0,2,0,0,0,0|2,0,0]=4 9409 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2Cl 527a_100011207228_100025712827 [0,2,0,0,0,0|2,0,0]=4 9410 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2F 11a_100000185272_100025712827 [0,2,0,0,0,0|2,0,0]=4 9411 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2F 1626a_100000185272_100025712827 [0,2,0,0,0,0|2,0,0]=4 9412 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2F 527a_100000185272_100025712827 [0,2,0,0,0,0|2,0,0]=4 9413 B22R2.9166 C/C(=C\c1ccccn1)/C(=O)NCCc2ccccc2O 527a_100011207237_100025712827 [0,2,0,0,0,0|2,0,0]=4 9414 B22R2.9166 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2Br 11a_100000747383_100000066491 [0,2,0,0,0,0|1,0,1]=4 9415 B22R2.9166 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2Br 1626a_100000747383_100000066491 [0,2,0,0,0,0|1,0,1]=4 9416 B22R2.9166 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2C 11a_100000685071_100000066491 [0,2,0,0,0,0|1,0,1]=4 9417 B22R2.9166 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2C 1626a_100000685071_100000066491 [0,2,0,0,0,0|1,0,1]=4 9418 B22R2.9166 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2Cl 11a_100011207228_100000066491 [0,2,0,0,0,0|1,0,1]=4 9419 B22R2.9166 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2Cl 1626a_100011207228_100000066491 [0,2,0,0,0,0|1,0,1]=4 9420 B22R2.9166 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2F 11a_100000185272_100000066491 [0,2,0,0,0,0|1,0,1]=4 9421 B22R2.9166 C=C(Cc1ccccc1)C(=O)NCCc2ccccc2F 1626a_100000185272_100000066491 [0,2,0,0,0,0|1,0,1]=4 9422 B22R2.9166 Cc1ccccc1CCNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000685071_200020598536 [0,2,0,0,0,0|1,0,0]=3 9423 B22R2.9166 Cc1ccccc1CCNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000685071_200020598536 [0,2,0,0,0,0|1,0,0]=3 9424 B22R2.9166 Cc1ccccc1CCNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000685071_200020598536 [0,2,0,0,0,0|1,0,0]=3 9425 B22R2.9166 Cc1ccccc1CCNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000685071_200020598536 [0,2,0,0,0,0|1,0,0]=3 9426 B22R2.9166 Cc1ccccc1CCNC(=O)/C(=C\c2ccccc2)/F 11a_100000685071_100020889036 [0,2,0,0,0,0|1,0,0]=3 9427 B22R2.9166 Cc1ccccc1CCNC(=O)/C(=C\c2ccccc2)/F 527a_100000685071_100020889036 [0,2,0,0,0,0|1,0,0]=3 9428 B22R2.9166 Cc1ccccc1CCNC(=O)C(=Cc2cccnc2)F 11a_100000685071_100000731744 [0,2,0,0,0,0|2,0,0]=4 9429 B22R2.9166 Cc1ccccc1CCNC(=O)C(=Cc2cccnc2)F 240690a_100000685071_100000731744 [0,2,0,0,0,0|2,0,0]=4 9430 B22R2.9166 Cc1ccccc1CCNC(=O)C(=Cc2cccnc2)F 527a_100000685071_100000731744 [0,2,0,0,0,0|2,0,0]=4 9431 B22R2.9166 Cc1ccccc1CCNC(=O)C(=O)Nc2ccccc2 240690a_100000685071_100000738435 [0,2,0,0,0,0|2,0,0]=4 9432 B22R2.9166 Cc1ccccc1CNNC(=O)/C(=C/c2ccccc2)/Cl 22a_100000737298_200020598536 [0,2,0,0,0,0|2,0,0]=4 9433 B22R2.9166 Cc1ccccc1CNNC(=O)/C(=C\c2ccccc2)/F 22a_100000737298_100020889036 [0,2,0,0,0,0|2,0,0]=4 9434 B22R2.9166 Cc1ccccc1OCCC(=O)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000184434 [0,2,0,0,0,0|2,0,0]=4 9435 B22R2.9166 Cc1ccccc1OCCC(=O)/C(=C\c2ccccc2)/F 1458a_100020889036_100000184434 [0,2,0,0,0,0|2,0,0]=4 9436 B22R2.9166 O=C(CCCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200011713681 [0,2,0,0,0,0|1,0,0]=3 9437 B22R2.9166 O=C(CCCc1ccccc1Br)/C(=C\c2ccccc2)/F 1458a_100020889036_200011713681 [0,2,0,0,0,0|1,0,0]=3 9438 B22R2.9166 O=C(CCCc1ccccc1Br)C(=Cc2cccnc2)F 1458a_100000731744_200011713681 [0,2,0,0,0,0|2,0,0]=4 9439 B22R2.9166 O=C(CCCc1ccccc1Br)C(=O)Nc2ccccc2 1458a_100000738435_200011713681 [0,2,0,0,0,0|2,0,0]=4 9440 B22R2.9166 O=C(CCOc1ccccc1Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000695877 [0,2,0,0,0,0|2,0,0]=4 9441 B22R2.9166 O=C(CCOc1ccccc1Br)/C(=C\c2ccccc2)/F 1458a_100020889036_100000695877 [0,2,0,0,0,0|2,0,0]=4 9442 B22R2.9166 O=C(CCOc1ccccc1F)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000183290 [0,2,0,0,0,0|2,0,0]=4 9443 B22R2.9166 O=C(CCOc1ccccc1F)/C(=C\c2ccccc2)/F 1458a_100020889036_100000183290 [0,2,0,0,0,0|2,0,0]=4 9444 B22R2.9166 O=C(NCCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 11a_100000747383_200020598536 [0,2,0,0,0,0|1,0,0]=3 9445 B22R2.9166 O=C(NCCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 1626a_100000747383_200020598536 [0,2,0,0,0,0|1,0,0]=3 9446 B22R2.9166 O=C(NCCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 240690a_100000747383_200020598536 [0,2,0,0,0,0|1,0,0]=3 9447 B22R2.9166 O=C(NCCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 527a_100000747383_200020598536 [0,2,0,0,0,0|1,0,0]=3 9448 B22R2.9166 O=C(NCCc1ccccc1Br)/C(=C\c2ccccc2)/F 11a_100000747383_100020889036 [0,2,0,0,0,0|1,0,0]=3 9449 B22R2.9166 O=C(NCCc1ccccc1Br)/C(=C\c2ccccc2)/F 527a_100000747383_100020889036 [0,2,0,0,0,0|1,0,0]=3 9450 B22R2.9166 O=C(NCCc1ccccc1Br)C(=Cc2cccnc2)F 11a_100000747383_100000731744 [0,2,0,0,0,0|2,0,0]=4 9451 B22R2.9166 O=C(NCCc1ccccc1Br)C(=Cc2cccnc2)F 240690a_100000747383_100000731744 [0,2,0,0,0,0|2,0,0]=4 9452 B22R2.9166 O=C(NCCc1ccccc1Br)C(=Cc2cccnc2)F 527a_100000747383_100000731744 [0,2,0,0,0,0|2,0,0]=4 9453 B22R2.9166 O=C(NCCc1ccccc1Br)C(=O)Nc2ccccc2 240690a_100000747383_100000738435 [0,2,0,0,0,0|2,0,0]=4 9454 B22R2.9166 O=C(NCCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 11a_100011207228_200020598536 [0,2,0,0,0,0|1,0,0]=3 9455 B22R2.9166 O=C(NCCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 1626a_100011207228_200020598536 [0,2,0,0,0,0|1,0,0]=3 9456 B22R2.9166 O=C(NCCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 240690a_100011207228_200020598536 [0,2,0,0,0,0|1,0,0]=3 9457 B22R2.9166 O=C(NCCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 527a_100011207228_200020598536 [0,2,0,0,0,0|1,0,0]=3 9458 B22R2.9166 O=C(NCCc1ccccc1Cl)/C(=C\c2ccccc2)/F 11a_100011207228_100020889036 [0,2,0,0,0,0|1,0,0]=3 9459 B22R2.9166 O=C(NCCc1ccccc1Cl)/C(=C\c2ccccc2)/F 527a_100011207228_100020889036 [0,2,0,0,0,0|1,0,0]=3 9460 B22R2.9166 O=C(NCCc1ccccc1Cl)C(=Cc2cccnc2)F 11a_100011207228_100000731744 [0,2,0,0,0,0|2,0,0]=4 9461 B22R2.9166 O=C(NCCc1ccccc1Cl)C(=Cc2cccnc2)F 240690a_100011207228_100000731744 [0,2,0,0,0,0|2,0,0]=4 9462 B22R2.9166 O=C(NCCc1ccccc1Cl)C(=Cc2cccnc2)F 527a_100011207228_100000731744 [0,2,0,0,0,0|2,0,0]=4 9463 B22R2.9166 O=C(NCCc1ccccc1Cl)C(=O)Nc2ccccc2 240690a_100011207228_100000738435 [0,2,0,0,0,0|2,0,0]=4 9464 B22R2.9166 O=C(NCCc1ccccc1F)/C(=C/c2ccccc2)/Cl 11a_100000185272_200020598536 [0,2,0,0,0,0|1,0,0]=3 9465 B22R2.9166 O=C(NCCc1ccccc1F)/C(=C/c2ccccc2)/Cl 1626a_100000185272_200020598536 [0,2,0,0,0,0|1,0,0]=3 9466 B22R2.9166 O=C(NCCc1ccccc1F)/C(=C/c2ccccc2)/Cl 240690a_100000185272_200020598536 [0,2,0,0,0,0|1,0,0]=3 9467 B22R2.9166 O=C(NCCc1ccccc1F)/C(=C/c2ccccc2)/Cl 527a_100000185272_200020598536 [0,2,0,0,0,0|1,0,0]=3 9468 B22R2.9166 O=C(NCCc1ccccc1F)/C(=C\c2ccccc2)/F 11a_100000185272_100020889036 [0,2,0,0,0,0|1,0,0]=3 9469 B22R2.9166 O=C(NCCc1ccccc1F)/C(=C\c2ccccc2)/F 527a_100000185272_100020889036 [0,2,0,0,0,0|1,0,0]=3 9470 B22R2.9166 O=C(NCCc1ccccc1F)C(=Cc2cccnc2)F 11a_100000185272_100000731744 [0,2,0,0,0,0|2,0,0]=4 9471 B22R2.9166 O=C(NCCc1ccccc1F)C(=Cc2cccnc2)F 240690a_100000185272_100000731744 [0,2,0,0,0,0|2,0,0]=4 9472 B22R2.9166 O=C(NCCc1ccccc1F)C(=Cc2cccnc2)F 527a_100000185272_100000731744 [0,2,0,0,0,0|2,0,0]=4 9473 B22R2.9166 O=C(NCCc1ccccc1F)C(=O)Nc2ccccc2 240690a_100000185272_100000738435 [0,2,0,0,0,0|2,0,0]=4 9474 B22R2.9166 O=C(NCCc1ccccc1O)/C(=C/c2ccccc2)/Cl 240690a_100011207237_200020598536 [0,2,0,0,0,0|1,0,0]=3 9475 B22R2.9166 O=C(NCCc1ccccc1O)/C(=C/c2ccccc2)/Cl 527a_100011207237_200020598536 [0,2,0,0,0,0|1,0,0]=3 9476 B22R2.9166 O=C(NCCc1ccccc1O)/C(=C\c2ccccc2)/F 527a_100011207237_100020889036 [0,2,0,0,0,0|1,0,0]=3 9477 B22R2.9166 O=C(NCCc1ccccc1O)C(=Cc2cccnc2)F 240690a_100011207237_100000731744 [0,2,0,0,0,0|2,0,0]=4 9478 B22R2.9166 O=C(NCCc1ccccc1O)C(=Cc2cccnc2)F 527a_100011207237_100000731744 [0,2,0,0,0,0|2,0,0]=4 9479 B22R2.9166 O=C(NCCc1ccccc1O)C(=O)Nc2ccccc2 240690a_100011207237_100000738435 [0,2,0,0,0,0|2,0,0]=4 9480 B22R2.9166 O=C(NCCn1ccccc1=O)/C(=C/c2ccccc2)/Cl 1626a_100000687133_200020598536 [0,2,0,0,0,0|2,0,0]=4 9481 B22R2.9166 O=C(NCCn1ccccc1=O)/C(=C/c2ccccc2)/Cl 240690a_100000687133_200020598536 [0,2,0,0,0,0|2,0,0]=4 9482 B22R2.9166 O=C(NCCn1ccccc1=O)/C(=C/c2ccccc2)/Cl 527a_100000687133_200020598536 [0,2,0,0,0,0|2,0,0]=4 9483 B22R2.9166 O=C(NCCn1ccccc1=O)/C(=C\c2ccccc2)/F 527a_100000687133_100020889036 [0,2,0,0,0,0|2,0,0]=4 9484 B22R2.9166 O=C(NNCc1ccccc1Br)/C(=C/c2ccccc2)/Cl 22a_200016993956_200020598536 [0,2,0,0,0,0|2,0,0]=4 9485 B22R2.9166 O=C(NNCc1ccccc1Br)/C(=C\c2ccccc2)/F 22a_200016993956_100020889036 [0,2,0,0,0,0|2,0,0]=4 9486 B22R2.9166 O=C(NNCc1ccccc1Cl)/C(=C/c2ccccc2)/Cl 22a_100015187261_200020598536 [0,2,0,0,0,0|2,0,0]=4 9487 B22R2.9166 O=C(NNCc1ccccc1Cl)/C(=C\c2ccccc2)/F 22a_100015187261_100020889036 [0,2,0,0,0,0|2,0,0]=4 9488 B22R2.9166 O=C(NNCc1ccccc1F)/C(=C/c2ccccc2)/Cl 22a_100015200773_200020598536 [0,2,0,0,0,0|2,0,0]=4 9489 B22R2.9166 O=C(NNCc1ccccc1F)/C(=C\c2ccccc2)/F 22a_100015200773_100020889036 [0,2,0,0,0,0|2,0,0]=4 9490 B22R2.143621 O=C(C=Cc1ccccc1)CCC(=O)c2ccccc2F 1458a_100000210462_100000086012 [0,2,0,0,0,0|1,0,1]=4 9491 B22R2.143621 O=C(C=Cc1ccccn1)NCC(O)c2ccccc2Br 240690a_100011236429_100000740811 [0,2,0,0,0,0|2,0,0]=4 9492 B22R2.143621 O=C(C=Cc1ccccn1)NCC(O)c2ccccc2Cl 240690a_200000759403_100000740811 [0,2,0,0,0,0|2,0,0]=4 9493 B22R2.143621 O=C(C=Cc1cccnc1)NCC(O)c2ccccc2Br 240690a_100011236429_100000735890 [0,2,0,0,0,0|2,0,0]=4 9494 B22R2.143621 O=C(C=Cc1cccnc1)NCC(O)c2ccccc2Cl 240690a_200000759403_100000735890 [0,2,0,0,0,0|2,0,0]=4 9495 B22R2.143621 O=C(C=Cc1ccncc1)NCC(O)c2ccccc2Br 240690a_100011236429_100000682801 [0,2,0,0,0,0|2,0,0]=4 9496 B22R2.143621 O=C(C=Cc1ccncc1)NCC(O)c2ccccc2Cl 240690a_200000759403_100000682801 [0,2,0,0,0,0|2,0,0]=4 9497 B22R2.144001 Cc1ccccc1CC(=O)CC(=O)C=Cc2ccccc2 1458a_100000210462_100011223134 [0,2,0,0,0,0|1,0,1]=4 9498 B22R2.144001 O=C(C=Cc1ccccc1)CC(=O)Cc2ccccc2Br 1458a_100000210462_100000700504 [0,2,0,0,0,0|1,0,1]=4 9499 B22R2.146087 Cc1ccc(c(c1)C)CCNC(=O)C=Cc2ccccc2 11a_100000745621_100000210462 [0,2,0,0,0,0|1,0,0]=3 9500 B22R2.146087 Cc1ccc(c(c1)C)CCNC(=O)C=Cc2ccccc2 1626a_100000745621_100000210462 [0,2,0,0,0,0|1,0,0]=3 9501 B22R2.146087 Cc1ccc(c(c1)C)CCNC(=O)C=Cc2ccccn2 11a_100000745621_100000740811 [0,2,0,0,0,0|2,0,0]=4 9502 B22R2.146087 Cc1ccc(c(c1)C)CCNC(=O)C=Cc2ccccn2 240690a_100000745621_100000740811 [0,2,0,0,0,0|2,0,0]=4 9503 B22R2.146087 Cc1ccc(c(c1)C)CCNC(=O)C=Cc2cccnc2 11a_100000745621_100000735890 [0,2,0,0,0,0|2,0,0]=4 9504 B22R2.146087 Cc1ccc(c(c1)C)CCNC(=O)C=Cc2cccnc2 240690a_100000745621_100000735890 [0,2,0,0,0,0|2,0,0]=4 9505 B22R2.146087 Cc1ccc(c(c1)C)CCNC(=O)C=Cc2ccncc2 240690a_100000745621_100000682801 [0,2,0,0,0,0|2,0,0]=4 9506 B22R2.146087 Cc1ccc(c(c1)C)CNNC(=O)C=Cc2ccccc2 22a_102495363735_100000210462 [0,2,0,0,0,0|2,0,0]=4 9507 B22R2.146087 Cc1ccc(c(c1)C)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100011210784 [0,2,0,0,0,0|2,0,0]=4 9508 B22R2.146087 O=C(C=Cc1ccccc1)CCOc2ccc(cc2Br)Cl 1458a_100000210462_100000199037 [0,2,0,0,0,0|2,0,0]=4 9509 B22R2.146087 O=C(C=Cc1ccccc1)CCOc2ccc(cc2Cl)Cl 1458a_100000210462_100000184432 [0,2,0,0,0,0|2,0,0]=4 9510 B22R2.146087 O=C(C=Cc1ccccc1)NCCc2ccc(cc2Cl)Cl 11a_100000210994_100000210462 [0,2,0,0,0,0|1,0,0]=3 9511 B22R2.146087 O=C(C=Cc1ccccc1)NCCc2ccc(cc2Cl)Cl 1626a_100000210994_100000210462 [0,2,0,0,0,0|1,0,0]=3 9512 B22R2.146087 O=C(C=Cc1ccccc1)NCCc2ccc(cc2F)Cl 11a_103496529009_100000210462 [0,2,0,0,0,0|1,0,0]=3 9513 B22R2.146087 O=C(C=Cc1ccccc1)NCCc2ccc(cc2F)Cl 1626a_103496529009_100000210462 [0,2,0,0,0,0|1,0,0]=3 9514 B22R2.146087 O=C(C=Cc1ccccc1)NCCc2ccc(cc2F)F 11a_100000754870_100000210462 [0,2,0,0,0,0|1,0,0]=3 9515 B22R2.146087 O=C(C=Cc1ccccc1)NCCc2ccc(cc2F)F 1626a_100000754870_100000210462 [0,2,0,0,0,0|1,0,0]=3 9516 B22R2.146087 O=C(C=Cc1ccccc1)NNCc2ccc(cc2Cl)Cl 22a_100000738016_100000210462 [0,2,0,0,0,0|2,0,0]=4 9517 B22R2.146087 O=C(C=Cc1ccccc1)NNCc2ccc(cc2Cl)F 22a_100025702793_100000210462 [0,2,0,0,0,0|2,0,0]=4 9518 B22R2.146087 O=C(C=Cc1ccccc1)NNCc2ccc(cc2F)F 22a_100000750357_100000210462 [0,2,0,0,0,0|2,0,0]=4 9519 B22R2.146087 O=C(C=Cc1ccccn1)NCCc2ccc(cc2Cl)Cl 11a_100000210994_100000740811 [0,2,0,0,0,0|2,0,0]=4 9520 B22R2.146087 O=C(C=Cc1ccccn1)NCCc2ccc(cc2Cl)Cl 240690a_100000210994_100000740811 [0,2,0,0,0,0|2,0,0]=4 9521 B22R2.146087 O=C(C=Cc1ccccn1)NCCc2ccc(cc2F)Cl 11a_103496529009_100000740811 [0,2,0,0,0,0|2,0,0]=4 9522 B22R2.146087 O=C(C=Cc1ccccn1)NCCc2ccc(cc2F)Cl 240690a_103496529009_100000740811 [0,2,0,0,0,0|2,0,0]=4 9523 B22R2.146087 O=C(C=Cc1ccccn1)NCCc2ccc(cc2F)F 11a_100000754870_100000740811 [0,2,0,0,0,0|2,0,0]=4 9524 B22R2.146087 O=C(C=Cc1ccccn1)NCCc2ccc(cc2F)F 240690a_100000754870_100000740811 [0,2,0,0,0,0|2,0,0]=4 9525 B22R2.146087 O=C(C=Cc1cccnc1)NCCc2ccc(cc2Cl)Cl 11a_100000210994_100000735890 [0,2,0,0,0,0|2,0,0]=4 9526 B22R2.146087 O=C(C=Cc1cccnc1)NCCc2ccc(cc2Cl)Cl 240690a_100000210994_100000735890 [0,2,0,0,0,0|2,0,0]=4 9527 B22R2.146087 O=C(C=Cc1cccnc1)NCCc2ccc(cc2F)Cl 11a_103496529009_100000735890 [0,2,0,0,0,0|2,0,0]=4 9528 B22R2.146087 O=C(C=Cc1cccnc1)NCCc2ccc(cc2F)Cl 240690a_103496529009_100000735890 [0,2,0,0,0,0|2,0,0]=4 9529 B22R2.146087 O=C(C=Cc1cccnc1)NCCc2ccc(cc2F)F 11a_100000754870_100000735890 [0,2,0,0,0,0|2,0,0]=4 9530 B22R2.146087 O=C(C=Cc1cccnc1)NCCc2ccc(cc2F)F 240690a_100000754870_100000735890 [0,2,0,0,0,0|2,0,0]=4 9531 B22R2.146087 O=C(C=Cc1ccncc1)NCCc2ccc(cc2Cl)Cl 240690a_100000210994_100000682801 [0,2,0,0,0,0|2,0,0]=4 9532 B22R2.146087 O=C(C=Cc1ccncc1)NCCc2ccc(cc2F)Cl 240690a_103496529009_100000682801 [0,2,0,0,0,0|2,0,0]=4 9533 B22R2.146087 O=C(C=Cc1ccncc1)NCCc2ccc(cc2F)F 240690a_100000754870_100000682801 [0,2,0,0,0,0|2,0,0]=4 9534 B22R2.200584 Cc1cccc(c1OCCC(=O)C=Cc2ccccc2)C 1458a_100000210462_100000184555 [0,2,0,0,0,0|2,0,0]=4 9535 B22R2.200584 O=C(C=Cc1ccccc1)CCOc2c(cccc2Cl)Cl 1458a_100000210462_100000184560 [0,2,0,0,0,0|2,0,0]=4 9536 B22R2.200584 O=C(C=Cc1ccccc1)NCCc2c(cccc2Cl)Cl 11a_100032004868_100000210462 [0,2,0,0,0,0|1,0,0]=3 9537 B22R2.200584 O=C(C=Cc1ccccc1)NCCc2c(cccc2Cl)Cl 1626a_100032004868_100000210462 [0,2,0,0,0,0|1,0,0]=3 9538 B22R2.200584 O=C(C=Cc1ccccc1)NCCc2c(cccc2Cl)F 11a_100000688150_100000210462 [0,2,0,0,0,0|1,0,0]=3 9539 B22R2.200584 O=C(C=Cc1ccccc1)NCCc2c(cccc2Cl)F 1626a_100000688150_100000210462 [0,2,0,0,0,0|1,0,0]=3 9540 B22R2.200584 O=C(C=Cc1ccccc1)NNCc2c(cccc2F)F 22a_102495363734_100000210462 [0,2,0,0,0,0|2,0,0]=4 9541 B22R2.200584 O=C(C=Cc1ccccn1)NCCc2c(cccc2Cl)Cl 11a_100032004868_100000740811 [0,2,0,0,0,0|2,0,0]=4 9542 B22R2.200584 O=C(C=Cc1ccccn1)NCCc2c(cccc2Cl)Cl 240690a_100032004868_100000740811 [0,2,0,0,0,0|2,0,0]=4 9543 B22R2.200584 O=C(C=Cc1ccccn1)NCCc2c(cccc2Cl)F 11a_100000688150_100000740811 [0,2,0,0,0,0|2,0,0]=4 9544 B22R2.200584 O=C(C=Cc1ccccn1)NCCc2c(cccc2Cl)F 240690a_100000688150_100000740811 [0,2,0,0,0,0|2,0,0]=4 9545 B22R2.200584 O=C(C=Cc1cccnc1)NCCc2c(cccc2Cl)Cl 11a_100032004868_100000735890 [0,2,0,0,0,0|2,0,0]=4 9546 B22R2.200584 O=C(C=Cc1cccnc1)NCCc2c(cccc2Cl)Cl 240690a_100032004868_100000735890 [0,2,0,0,0,0|2,0,0]=4 9547 B22R2.200584 O=C(C=Cc1cccnc1)NCCc2c(cccc2Cl)F 11a_100000688150_100000735890 [0,2,0,0,0,0|2,0,0]=4 9548 B22R2.200584 O=C(C=Cc1cccnc1)NCCc2c(cccc2Cl)F 240690a_100000688150_100000735890 [0,2,0,0,0,0|2,0,0]=4 9549 B22R2.200584 O=C(C=Cc1ccncc1)NCCc2c(cccc2Cl)Cl 240690a_100032004868_100000682801 [0,2,0,0,0,0|2,0,0]=4 9550 B22R2.200584 O=C(C=Cc1ccncc1)NCCc2c(cccc2Cl)F 240690a_100000688150_100000682801 [0,2,0,0,0,0|2,0,0]=4 9551 B22R2.201491 Cc1ccccc1CCNS(=O)(=O)C=Cc2ccccc2 40a_100000685071_100011098038 [0,2,0,0,0,0|2,0,0]=4 9552 B22R2.201491 O=S(=O)(C=Cc1ccccc1)NCCc2ccccc2Br 40a_100000747383_100011098038 [0,2,0,0,0,0|2,0,0]=4 9553 B22R2.201491 O=S(=O)(C=Cc1ccccc1)NCCc2ccccc2Cl 40a_100011207228_100011098038 [0,2,0,0,0,0|2,0,0]=4 9554 B22R2.201491 O=S(=O)(C=Cc1ccccc1)NCCc2ccccc2F 40a_100000185272_100011098038 [0,2,0,0,0,0|2,0,0]=4 9555 B22R2.201491 O=S(=O)(C=Cc1ccccc1)NCCc2ccccc2O 40a_100011207237_100011098038 [0,2,0,0,0,0|2,0,0]=4 9556 B22R2.524341 Cc1ccc(cc1)C=CC(=O)CCCc2ccccc2Br 1458a_100000716854_200011713681 [0,2,0,0,0,0|1,0,0]=3 9557 B22R2.524341 Cc1ccc(cc1)C=CC(=O)CCOc2ccccc2Br 1458a_100000716854_100000695877 [0,2,0,0,0,0|2,0,0]=4 9558 B22R2.524341 Cc1ccc(cc1)C=CC(=O)CCOc2ccccc2C 1458a_100000716854_100000184434 [0,2,0,0,0,0|2,0,0]=4 9559 B22R2.524341 Cc1ccc(cc1)C=CC(=O)CCOc2ccccc2F 1458a_100000716854_100000183290 [0,2,0,0,0,0|2,0,0]=4 9560 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2Br 11a_100000747383_100000716854 [0,2,0,0,0,0|1,0,0]=3 9561 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2Br 1626a_100000747383_100000716854 [0,2,0,0,0,0|1,0,0]=3 9562 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2Br 240690a_100000747383_100000716854 [0,2,0,0,0,0|1,0,0]=3 9563 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2C 11a_100000685071_100000716854 [0,2,0,0,0,0|1,0,0]=3 9564 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2C 1626a_100000685071_100000716854 [0,2,0,0,0,0|1,0,0]=3 9565 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2C 240690a_100000685071_100000716854 [0,2,0,0,0,0|1,0,0]=3 9566 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2Cl 11a_100011207228_100000716854 [0,2,0,0,0,0|1,0,0]=3 9567 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2Cl 1626a_100011207228_100000716854 [0,2,0,0,0,0|1,0,0]=3 9568 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2Cl 240690a_100011207228_100000716854 [0,2,0,0,0,0|1,0,0]=3 9569 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2F 11a_100000185272_100000716854 [0,2,0,0,0,0|1,0,0]=3 9570 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2F 1626a_100000185272_100000716854 [0,2,0,0,0,0|1,0,0]=3 9571 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2F 240690a_100000185272_100000716854 [0,2,0,0,0,0|1,0,0]=3 9572 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2O 240690a_100011207237_100000716854 [0,2,0,0,0,0|1,0,0]=3 9573 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCn2ccccc2=O 1626a_100000687133_100000716854 [0,2,0,0,0,0|2,0,0]=4 9574 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NCCn2ccccc2=O 240690a_100000687133_100000716854 [0,2,0,0,0,0|2,0,0]=4 9575 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NNCc2ccccc2Br 22a_200016993956_100000716854 [0,2,0,0,0,0|2,0,0]=4 9576 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NNCc2ccccc2C 22a_100000737298_100000716854 [0,2,0,0,0,0|2,0,0]=4 9577 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NNCc2ccccc2Cl 22a_100015187261_100000716854 [0,2,0,0,0,0|2,0,0]=4 9578 B22R2.524341 Cc1ccc(cc1)C=CC(=O)NNCc2ccccc2F 22a_100015200773_100000716854 [0,2,0,0,0,0|2,0,0]=4 9579 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)Br 11a_100000685071_100016267368 [0,2,0,0,0,0|1,0,0]=3 9580 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)Br 1626a_100000685071_100016267368 [0,2,0,0,0,0|1,0,0]=3 9581 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)Cl 11a_100000685071_100000184863 [0,2,0,0,0,0|1,0,0]=3 9582 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000685071_100000184863 [0,2,0,0,0,0|1,0,0]=3 9583 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000685071_100000184863 [0,2,0,0,0,0|1,0,0]=3 9584 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)F 11a_100000685071_100000182136 [0,2,0,0,0,0|1,0,0]=3 9585 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)F 1626a_100000685071_100000182136 [0,2,0,0,0,0|1,0,0]=3 9586 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)F 240690a_100000685071_100000182136 [0,2,0,0,0,0|1,0,0]=3 9587 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)I 11a_100000685071_100102526154 [0,2,0,0,0,0|1,0,0]=3 9588 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)I 1626a_100000685071_100102526154 [0,2,0,0,0,0|1,0,0]=3 9589 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)I 240690a_100000685071_100102526154 [0,2,0,0,0,0|1,0,0]=3 9590 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cc2)O 240690a_100000685071_100016269017 [0,2,0,0,0,0|1,0,0]=3 9591 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cn2)F 11a_100000685071_100020630499 [0,2,0,0,0,0|2,0,0]=4 9592 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cn2)F 1626a_100000685071_100020630499 [0,2,0,0,0,0|2,0,0]=4 9593 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(cn2)F 240690a_100000685071_100020630499 [0,2,0,0,0,0|2,0,0]=4 9594 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(nc2)Br 11a_100000685071_100020588214 [0,2,0,0,0,0|2,0,0]=4 9595 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(nc2)Br 1626a_100000685071_100020588214 [0,2,0,0,0,0|2,0,0]=4 9596 B22R2.524341 Cc1ccccc1CCNC(=O)C=Cc2ccc(nc2)Br 240690a_100000685071_100020588214 [0,2,0,0,0,0|2,0,0]=4 9597 B22R2.524341 Cc1ccccc1CNNC(=O)C=Cc2ccc(cc2)Br 22a_100000737298_100016267368 [0,2,0,0,0,0|2,0,0]=4 9598 B22R2.524341 Cc1ccccc1CNNC(=O)C=Cc2ccc(cc2)Cl 22a_100000737298_100000184863 [0,2,0,0,0,0|2,0,0]=4 9599 B22R2.524341 Cc1ccccc1CNNC(=O)C=Cc2ccc(cc2)F 22a_100000737298_100000182136 [0,2,0,0,0,0|2,0,0]=4 9600 B22R2.524341 Cc1ccccc1CNNC(=O)C=Cc2ccc(cc2)I 22a_100000737298_100102526154 [0,2,0,0,0,0|2,0,0]=4 9601 B22R2.524341 Cc1ccccc1CNNC(=O)C=Cc2ccc(cc2)O 22a_100000737298_100016269017 [0,2,0,0,0,0|2,0,0]=4 9602 B22R2.524341 Cc1ccccc1OCCC(=O)C=Cc2ccc(cc2)Br 1458a_100016267368_100000184434 [0,2,0,0,0,0|2,0,0]=4 9603 B22R2.524341 Cc1ccccc1OCCC(=O)C=Cc2ccc(cc2)Br 6a_100000186029_100000066840 [0,2,0,0,0,0|2,0,0]=4 9604 B22R2.524341 Cc1ccccc1OCCC(=O)C=Cc2ccc(cc2)Cl 1458a_100000184863_100000184434 [0,2,0,0,0,0|2,0,0]=4 9605 B22R2.524341 Cc1ccccc1OCCC(=O)C=Cc2ccc(cc2)F 1458a_100000182136_100000184434 [0,2,0,0,0,0|2,0,0]=4 9606 B22R2.524341 Cc1ccccc1OCCC(=O)C=Cc2ccc(cc2)F 6a_100000210084_100000066840 [0,2,0,0,0,0|2,0,0]=4 9607 B22R2.524341 Cc1ccccc1OCCC(=O)C=Cc2ccc(cc2)I 1458a_100102526154_100000184434 [0,2,0,0,0,0|2,0,0]=4 9608 B22R2.524341 Cc1ccccc1OCCC(=O)C=Cc2ccc(cc2)I 6a_100000188517_100000066840 [0,2,0,0,0,0|2,0,0]=4 9609 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)CCCc2ccccc2Br 1458a_100016267368_200011713681 [0,2,0,0,0,0|1,0,0]=3 9610 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)CCOc2ccccc2Br 1458a_100016267368_100000695877 [0,2,0,0,0,0|2,0,0]=4 9611 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)CCOc2ccccc2F 1458a_100016267368_100000183290 [0,2,0,0,0,0|2,0,0]=4 9612 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2Br 11a_100000747383_100016267368 [0,2,0,0,0,0|1,0,0]=3 9613 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2Br 1626a_100000747383_100016267368 [0,2,0,0,0,0|1,0,0]=3 9614 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2Cl 11a_100011207228_100016267368 [0,2,0,0,0,0|1,0,0]=3 9615 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2Cl 1626a_100011207228_100016267368 [0,2,0,0,0,0|1,0,0]=3 9616 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2F 11a_100000185272_100016267368 [0,2,0,0,0,0|1,0,0]=3 9617 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NCCc2ccccc2F 1626a_100000185272_100016267368 [0,2,0,0,0,0|1,0,0]=3 9618 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NCCn2ccccc2=O 1626a_100000687133_100016267368 [0,2,0,0,0,0|2,0,0]=4 9619 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NNCc2ccccc2Br 22a_200016993956_100016267368 [0,2,0,0,0,0|2,0,0]=4 9620 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NNCc2ccccc2Cl 22a_100015187261_100016267368 [0,2,0,0,0,0|2,0,0]=4 9621 B22R2.524341 O=C(C=Cc1ccc(cc1)Br)NNCc2ccccc2F 22a_100015200773_100016267368 [0,2,0,0,0,0|2,0,0]=4 9622 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)CCCc2ccccc2Br 1458a_100000184863_200011713681 [0,2,0,0,0,0|1,0,0]=3 9623 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)CCOc2ccccc2Br 1458a_100000184863_100000695877 [0,2,0,0,0,0|2,0,0]=4 9624 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)CCOc2ccccc2F 1458a_100000184863_100000183290 [0,2,0,0,0,0|2,0,0]=4 9625 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2Br 11a_100000747383_100000184863 [0,2,0,0,0,0|1,0,0]=3 9626 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2Br 1626a_100000747383_100000184863 [0,2,0,0,0,0|1,0,0]=3 9627 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2Br 240690a_100000747383_100000184863 [0,2,0,0,0,0|1,0,0]=3 9628 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2Cl 11a_100011207228_100000184863 [0,2,0,0,0,0|1,0,0]=3 9629 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2Cl 1626a_100011207228_100000184863 [0,2,0,0,0,0|1,0,0]=3 9630 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2Cl 240690a_100011207228_100000184863 [0,2,0,0,0,0|1,0,0]=3 9631 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2F 11a_100000185272_100000184863 [0,2,0,0,0,0|1,0,0]=3 9632 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2F 1626a_100000185272_100000184863 [0,2,0,0,0,0|1,0,0]=3 9633 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2F 240690a_100000185272_100000184863 [0,2,0,0,0,0|1,0,0]=3 9634 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccccc2O 240690a_100011207237_100000184863 [0,2,0,0,0,0|1,0,0]=3 9635 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCn2ccccc2=O 1626a_100000687133_100000184863 [0,2,0,0,0,0|2,0,0]=4 9636 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NCCn2ccccc2=O 240690a_100000687133_100000184863 [0,2,0,0,0,0|2,0,0]=4 9637 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccccc2Br 22a_200016993956_100000184863 [0,2,0,0,0,0|2,0,0]=4 9638 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccccc2Cl 22a_100015187261_100000184863 [0,2,0,0,0,0|2,0,0]=4 9639 B22R2.524341 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccccc2F 22a_100015200773_100000184863 [0,2,0,0,0,0|2,0,0]=4 9640 B22R2.524341 O=C(C=Cc1ccc(cc1)F)CCCc2ccccc2Br 1458a_100000182136_200011713681 [0,2,0,0,0,0|1,0,0]=3 9641 B22R2.524341 O=C(C=Cc1ccc(cc1)F)CCOc2ccccc2Br 1458a_100000182136_100000695877 [0,2,0,0,0,0|2,0,0]=4 9642 B22R2.524341 O=C(C=Cc1ccc(cc1)F)CCOc2ccccc2F 1458a_100000182136_100000183290 [0,2,0,0,0,0|2,0,0]=4 9643 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2Br 11a_100000747383_100000182136 [0,2,0,0,0,0|1,0,0]=3 9644 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2Br 1626a_100000747383_100000182136 [0,2,0,0,0,0|1,0,0]=3 9645 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2Br 240690a_100000747383_100000182136 [0,2,0,0,0,0|1,0,0]=3 9646 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2Cl 11a_100011207228_100000182136 [0,2,0,0,0,0|1,0,0]=3 9647 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2Cl 1626a_100011207228_100000182136 [0,2,0,0,0,0|1,0,0]=3 9648 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2Cl 240690a_100011207228_100000182136 [0,2,0,0,0,0|1,0,0]=3 9649 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2F 11a_100000185272_100000182136 [0,2,0,0,0,0|1,0,0]=3 9650 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2F 1626a_100000185272_100000182136 [0,2,0,0,0,0|1,0,0]=3 9651 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2F 240690a_100000185272_100000182136 [0,2,0,0,0,0|1,0,0]=3 9652 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCc2ccccc2O 240690a_100011207237_100000182136 [0,2,0,0,0,0|1,0,0]=3 9653 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCn2ccccc2=O 1626a_100000687133_100000182136 [0,2,0,0,0,0|2,0,0]=4 9654 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NCCn2ccccc2=O 240690a_100000687133_100000182136 [0,2,0,0,0,0|2,0,0]=4 9655 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NNCc2ccccc2Br 22a_200016993956_100000182136 [0,2,0,0,0,0|2,0,0]=4 9656 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NNCc2ccccc2Cl 22a_100015187261_100000182136 [0,2,0,0,0,0|2,0,0]=4 9657 B22R2.524341 O=C(C=Cc1ccc(cc1)F)NNCc2ccccc2F 22a_100015200773_100000182136 [0,2,0,0,0,0|2,0,0]=4 9658 B22R2.524341 O=C(C=Cc1ccc(cc1)I)CCCc2ccccc2Br 1458a_100102526154_200011713681 [0,2,0,0,0,0|1,0,0]=3 9659 B22R2.524341 O=C(C=Cc1ccc(cc1)I)CCOc2ccccc2Br 1458a_100102526154_100000695877 [0,2,0,0,0,0|2,0,0]=4 9660 B22R2.524341 O=C(C=Cc1ccc(cc1)I)CCOc2ccccc2F 1458a_100102526154_100000183290 [0,2,0,0,0,0|2,0,0]=4 9661 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2Br 11a_100000747383_100102526154 [0,2,0,0,0,0|1,0,0]=3 9662 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2Br 1626a_100000747383_100102526154 [0,2,0,0,0,0|1,0,0]=3 9663 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2Br 240690a_100000747383_100102526154 [0,2,0,0,0,0|1,0,0]=3 9664 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2Cl 11a_100011207228_100102526154 [0,2,0,0,0,0|1,0,0]=3 9665 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2Cl 1626a_100011207228_100102526154 [0,2,0,0,0,0|1,0,0]=3 9666 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2Cl 240690a_100011207228_100102526154 [0,2,0,0,0,0|1,0,0]=3 9667 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2F 11a_100000185272_100102526154 [0,2,0,0,0,0|1,0,0]=3 9668 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2F 1626a_100000185272_100102526154 [0,2,0,0,0,0|1,0,0]=3 9669 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2F 240690a_100000185272_100102526154 [0,2,0,0,0,0|1,0,0]=3 9670 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCc2ccccc2O 240690a_100011207237_100102526154 [0,2,0,0,0,0|1,0,0]=3 9671 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCn2ccccc2=O 1626a_100000687133_100102526154 [0,2,0,0,0,0|2,0,0]=4 9672 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NCCn2ccccc2=O 240690a_100000687133_100102526154 [0,2,0,0,0,0|2,0,0]=4 9673 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NNCc2ccccc2Br 22a_200016993956_100102526154 [0,2,0,0,0,0|2,0,0]=4 9674 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NNCc2ccccc2Cl 22a_100015187261_100102526154 [0,2,0,0,0,0|2,0,0]=4 9675 B22R2.524341 O=C(C=Cc1ccc(cc1)I)NNCc2ccccc2F 22a_100015200773_100102526154 [0,2,0,0,0,0|2,0,0]=4 9676 B22R2.524341 O=C(C=Cc1ccc(cc1)O)NCCc2ccccc2Br 240690a_100000747383_100016269017 [0,2,0,0,0,0|1,0,0]=3 9677 B22R2.524341 O=C(C=Cc1ccc(cc1)O)NCCc2ccccc2Cl 240690a_100011207228_100016269017 [0,2,0,0,0,0|1,0,0]=3 9678 B22R2.524341 O=C(C=Cc1ccc(cc1)O)NCCc2ccccc2F 240690a_100000185272_100016269017 [0,2,0,0,0,0|1,0,0]=3 9679 B22R2.524341 O=C(C=Cc1ccc(cc1)O)NCCc2ccccc2O 240690a_100011207237_100016269017 [0,2,0,0,0,0|1,0,0]=3 9680 B22R2.524341 O=C(C=Cc1ccc(cc1)O)NCCn2ccccc2=O 240690a_100000687133_100016269017 [0,2,0,0,0,0|2,0,0]=4 9681 B22R2.524341 O=C(C=Cc1ccc(cc1)O)NNCc2ccccc2Br 22a_200016993956_100016269017 [0,2,0,0,0,0|2,0,0]=4 9682 B22R2.524341 O=C(C=Cc1ccc(cc1)O)NNCc2ccccc2Cl 22a_100015187261_100016269017 [0,2,0,0,0,0|2,0,0]=4 9683 B22R2.524341 O=C(C=Cc1ccc(cc1)O)NNCc2ccccc2F 22a_100015200773_100016269017 [0,2,0,0,0,0|2,0,0]=4 9684 B22R2.524341 O=C(C=Cc1ccc(cn1)F)CCCc2ccccc2Br 1458a_100020630499_200011713681 [0,2,0,0,0,0|2,0,0]=4 9685 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2Br 11a_100000747383_100020630499 [0,2,0,0,0,0|2,0,0]=4 9686 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2Br 1626a_100000747383_100020630499 [0,2,0,0,0,0|2,0,0]=4 9687 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2Br 240690a_100000747383_100020630499 [0,2,0,0,0,0|2,0,0]=4 9688 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2Cl 11a_100011207228_100020630499 [0,2,0,0,0,0|2,0,0]=4 9689 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2Cl 1626a_100011207228_100020630499 [0,2,0,0,0,0|2,0,0]=4 9690 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2Cl 240690a_100011207228_100020630499 [0,2,0,0,0,0|2,0,0]=4 9691 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2F 11a_100000185272_100020630499 [0,2,0,0,0,0|2,0,0]=4 9692 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2F 1626a_100000185272_100020630499 [0,2,0,0,0,0|2,0,0]=4 9693 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2F 240690a_100000185272_100020630499 [0,2,0,0,0,0|2,0,0]=4 9694 B22R2.524341 O=C(C=Cc1ccc(cn1)F)NCCc2ccccc2O 240690a_100011207237_100020630499 [0,2,0,0,0,0|2,0,0]=4 9695 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)CCCc2ccccc2Br 1458a_100020588214_200011713681 [0,2,0,0,0,0|2,0,0]=4 9696 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2Br 11a_100000747383_100020588214 [0,2,0,0,0,0|2,0,0]=4 9697 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2Br 1626a_100000747383_100020588214 [0,2,0,0,0,0|2,0,0]=4 9698 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2Br 240690a_100000747383_100020588214 [0,2,0,0,0,0|2,0,0]=4 9699 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2Cl 11a_100011207228_100020588214 [0,2,0,0,0,0|2,0,0]=4 9700 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2Cl 1626a_100011207228_100020588214 [0,2,0,0,0,0|2,0,0]=4 9701 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2Cl 240690a_100011207228_100020588214 [0,2,0,0,0,0|2,0,0]=4 9702 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2F 11a_100000185272_100020588214 [0,2,0,0,0,0|2,0,0]=4 9703 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2F 1626a_100000185272_100020588214 [0,2,0,0,0,0|2,0,0]=4 9704 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2F 240690a_100000185272_100020588214 [0,2,0,0,0,0|2,0,0]=4 9705 B22R2.524341 O=C(C=Cc1ccc(nc1)Br)NCCc2ccccc2O 240690a_100011207237_100020588214 [0,2,0,0,0,0|2,0,0]=4 9706 B22R2.6115346 Cc1cccc(c1)C=CC(=O)CCCc2ccccc2Br 1458a_100000690095_200011713681 [0,2,0,0,0,0|1,0,0]=3 9707 B22R2.6115346 Cc1cccc(c1)C=CC(=O)CCOc2ccccc2Br 1458a_100000690095_100000695877 [0,2,0,0,0,0|2,0,0]=4 9708 B22R2.6115346 Cc1cccc(c1)C=CC(=O)CCOc2ccccc2C 1458a_100000690095_100000184434 [0,2,0,0,0,0|2,0,0]=4 9709 B22R2.6115346 Cc1cccc(c1)C=CC(=O)CCOc2ccccc2F 1458a_100000690095_100000183290 [0,2,0,0,0,0|2,0,0]=4 9710 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2Br 11a_100000747383_100000690095 [0,2,0,0,0,0|1,0,0]=3 9711 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2Br 1626a_100000747383_100000690095 [0,2,0,0,0,0|1,0,0]=3 9712 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2Br 240690a_100000747383_100000690095 [0,2,0,0,0,0|1,0,0]=3 9713 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2C 11a_100000685071_100000690095 [0,2,0,0,0,0|1,0,0]=3 9714 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2C 1626a_100000685071_100000690095 [0,2,0,0,0,0|1,0,0]=3 9715 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2C 240690a_100000685071_100000690095 [0,2,0,0,0,0|1,0,0]=3 9716 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2Cl 11a_100011207228_100000690095 [0,2,0,0,0,0|1,0,0]=3 9717 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2Cl 1626a_100011207228_100000690095 [0,2,0,0,0,0|1,0,0]=3 9718 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2Cl 240690a_100011207228_100000690095 [0,2,0,0,0,0|1,0,0]=3 9719 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2F 11a_100000185272_100000690095 [0,2,0,0,0,0|1,0,0]=3 9720 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2F 1626a_100000185272_100000690095 [0,2,0,0,0,0|1,0,0]=3 9721 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2F 240690a_100000185272_100000690095 [0,2,0,0,0,0|1,0,0]=3 9722 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCc2ccccc2O 240690a_100011207237_100000690095 [0,2,0,0,0,0|1,0,0]=3 9723 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCn2ccccc2=O 1626a_100000687133_100000690095 [0,2,0,0,0,0|2,0,0]=4 9724 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NCCn2ccccc2=O 240690a_100000687133_100000690095 [0,2,0,0,0,0|2,0,0]=4 9725 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NNCc2ccccc2Br 22a_200016993956_100000690095 [0,2,0,0,0,0|2,0,0]=4 9726 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NNCc2ccccc2C 22a_100000737298_100000690095 [0,2,0,0,0,0|2,0,0]=4 9727 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NNCc2ccccc2Cl 22a_100015187261_100000690095 [0,2,0,0,0,0|2,0,0]=4 9728 B22R2.6115346 Cc1cccc(c1)C=CC(=O)NNCc2ccccc2F 22a_100015200773_100000690095 [0,2,0,0,0,0|2,0,0]=4 9729 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)Br 11a_100000685071_100016258244 [0,2,0,0,0,0|1,0,0]=3 9730 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)Br 1626a_100000685071_100016258244 [0,2,0,0,0,0|1,0,0]=3 9731 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)Br 240690a_100000685071_100016258244 [0,2,0,0,0,0|1,0,0]=3 9732 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)Cl 11a_100000685071_100000184502 [0,2,0,0,0,0|1,0,0]=3 9733 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)Cl 1626a_100000685071_100000184502 [0,2,0,0,0,0|1,0,0]=3 9734 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)Cl 240690a_100000685071_100000184502 [0,2,0,0,0,0|1,0,0]=3 9735 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)F 11a_100000685071_100000718793 [0,2,0,0,0,0|1,0,0]=3 9736 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)F 1626a_100000685071_100000718793 [0,2,0,0,0,0|1,0,0]=3 9737 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)F 240690a_100000685071_100000718793 [0,2,0,0,0,0|1,0,0]=3 9738 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)I 11a_100000685071_100020647043 [0,2,0,0,0,0|1,0,0]=3 9739 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)I 1626a_100000685071_100020647043 [0,2,0,0,0,0|1,0,0]=3 9740 B22R2.6115346 Cc1ccccc1CCNC(=O)C=Cc2cccc(c2)I 240690a_100000685071_100020647043 [0,2,0,0,0,0|1,0,0]=3 9741 B22R2.6115346 Cc1ccccc1CNNC(=O)C=Cc2cccc(c2)Br 22a_100000737298_100016258244 [0,2,0,0,0,0|2,0,0]=4 9742 B22R2.6115346 Cc1ccccc1CNNC(=O)C=Cc2cccc(c2)Cl 22a_100000737298_100000184502 [0,2,0,0,0,0|2,0,0]=4 9743 B22R2.6115346 Cc1ccccc1CNNC(=O)C=Cc2cccc(c2)F 22a_100000737298_100000718793 [0,2,0,0,0,0|2,0,0]=4 9744 B22R2.6115346 Cc1ccccc1CNNC(=O)C=Cc2cccc(c2)I 22a_100000737298_100020647043 [0,2,0,0,0,0|2,0,0]=4 9745 B22R2.6115346 Cc1ccccc1CNNC(=O)C=Cc2cccc(c2)O 22a_100000737298_100102525460 [0,2,0,0,0,0|2,0,0]=4 9746 B22R2.6115346 Cc1ccccc1OCCC(=O)C=Cc2cccc(c2)Br 1458a_100016258244_100000184434 [0,2,0,0,0,0|2,0,0]=4 9747 B22R2.6115346 Cc1ccccc1OCCC(=O)C=Cc2cccc(c2)Br 6a_100000210085_100000066840 [0,2,0,0,0,0|2,0,0]=4 9748 B22R2.6115346 Cc1ccccc1OCCC(=O)C=Cc2cccc(c2)Cl 1458a_100000184502_100000184434 [0,2,0,0,0,0|2,0,0]=4 9749 B22R2.6115346 Cc1ccccc1OCCC(=O)C=Cc2cccc(c2)F 1458a_100000718793_100000184434 [0,2,0,0,0,0|2,0,0]=4 9750 B22R2.6115346 Cc1ccccc1OCCC(=O)C=Cc2cccc(c2)F 6a_100000210812_100000066840 [0,2,0,0,0,0|2,0,0]=4 9751 B22R2.6115346 Cc1ccccc1OCCC(=O)C=Cc2cccc(c2)I 1458a_100020647043_100000184434 [0,2,0,0,0,0|2,0,0]=4 9752 B22R2.6115346 Cc1ccccc1OCCC(=O)C=Cc2cccc(c2)I 6a_100000014684_100000066840 [0,2,0,0,0,0|2,0,0]=4 9753 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)CCCc2ccccc2Br 1458a_100016258244_200011713681 [0,2,0,0,0,0|1,0,0]=3 9754 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)CCOc2ccccc2Br 1458a_100016258244_100000695877 [0,2,0,0,0,0|2,0,0]=4 9755 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)CCOc2ccccc2F 1458a_100016258244_100000183290 [0,2,0,0,0,0|2,0,0]=4 9756 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2Br 11a_100000747383_100016258244 [0,2,0,0,0,0|1,0,0]=3 9757 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2Br 1626a_100000747383_100016258244 [0,2,0,0,0,0|1,0,0]=3 9758 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2Br 240690a_100000747383_100016258244 [0,2,0,0,0,0|1,0,0]=3 9759 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2Cl 11a_100011207228_100016258244 [0,2,0,0,0,0|1,0,0]=3 9760 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2Cl 1626a_100011207228_100016258244 [0,2,0,0,0,0|1,0,0]=3 9761 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2Cl 240690a_100011207228_100016258244 [0,2,0,0,0,0|1,0,0]=3 9762 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2F 11a_100000185272_100016258244 [0,2,0,0,0,0|1,0,0]=3 9763 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2F 1626a_100000185272_100016258244 [0,2,0,0,0,0|1,0,0]=3 9764 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2F 240690a_100000185272_100016258244 [0,2,0,0,0,0|1,0,0]=3 9765 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCc2ccccc2O 240690a_100011207237_100016258244 [0,2,0,0,0,0|1,0,0]=3 9766 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCn2ccccc2=O 1626a_100000687133_100016258244 [0,2,0,0,0,0|2,0,0]=4 9767 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NCCn2ccccc2=O 240690a_100000687133_100016258244 [0,2,0,0,0,0|2,0,0]=4 9768 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NNCc2ccccc2Br 22a_200016993956_100016258244 [0,2,0,0,0,0|2,0,0]=4 9769 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NNCc2ccccc2Cl 22a_100015187261_100016258244 [0,2,0,0,0,0|2,0,0]=4 9770 B22R2.6115346 O=C(C=Cc1cccc(c1)Br)NNCc2ccccc2F 22a_100015200773_100016258244 [0,2,0,0,0,0|2,0,0]=4 9771 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)CCCc2ccccc2Br 1458a_100000184502_200011713681 [0,2,0,0,0,0|1,0,0]=3 9772 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)CCOc2ccccc2Br 1458a_100000184502_100000695877 [0,2,0,0,0,0|2,0,0]=4 9773 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)CCOc2ccccc2F 1458a_100000184502_100000183290 [0,2,0,0,0,0|2,0,0]=4 9774 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2Br 11a_100000747383_100000184502 [0,2,0,0,0,0|1,0,0]=3 9775 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2Br 1626a_100000747383_100000184502 [0,2,0,0,0,0|1,0,0]=3 9776 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2Br 240690a_100000747383_100000184502 [0,2,0,0,0,0|1,0,0]=3 9777 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2Cl 11a_100011207228_100000184502 [0,2,0,0,0,0|1,0,0]=3 9778 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2Cl 1626a_100011207228_100000184502 [0,2,0,0,0,0|1,0,0]=3 9779 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2Cl 240690a_100011207228_100000184502 [0,2,0,0,0,0|1,0,0]=3 9780 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2F 11a_100000185272_100000184502 [0,2,0,0,0,0|1,0,0]=3 9781 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2F 1626a_100000185272_100000184502 [0,2,0,0,0,0|1,0,0]=3 9782 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2F 240690a_100000185272_100000184502 [0,2,0,0,0,0|1,0,0]=3 9783 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCc2ccccc2O 240690a_100011207237_100000184502 [0,2,0,0,0,0|1,0,0]=3 9784 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCn2ccccc2=O 1626a_100000687133_100000184502 [0,2,0,0,0,0|2,0,0]=4 9785 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NCCn2ccccc2=O 240690a_100000687133_100000184502 [0,2,0,0,0,0|2,0,0]=4 9786 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NNCc2ccccc2Br 22a_200016993956_100000184502 [0,2,0,0,0,0|2,0,0]=4 9787 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NNCc2ccccc2Cl 22a_100015187261_100000184502 [0,2,0,0,0,0|2,0,0]=4 9788 B22R2.6115346 O=C(C=Cc1cccc(c1)Cl)NNCc2ccccc2F 22a_100015200773_100000184502 [0,2,0,0,0,0|2,0,0]=4 9789 B22R2.6115346 O=C(C=Cc1cccc(c1)F)CCCc2ccccc2Br 1458a_100000718793_200011713681 [0,2,0,0,0,0|1,0,0]=3 9790 B22R2.6115346 O=C(C=Cc1cccc(c1)F)CCOc2ccccc2Br 1458a_100000718793_100000695877 [0,2,0,0,0,0|2,0,0]=4 9791 B22R2.6115346 O=C(C=Cc1cccc(c1)F)CCOc2ccccc2F 1458a_100000718793_100000183290 [0,2,0,0,0,0|2,0,0]=4 9792 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2Br 11a_100000747383_100000718793 [0,2,0,0,0,0|1,0,0]=3 9793 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2Br 1626a_100000747383_100000718793 [0,2,0,0,0,0|1,0,0]=3 9794 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2Br 240690a_100000747383_100000718793 [0,2,0,0,0,0|1,0,0]=3 9795 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2Cl 11a_100011207228_100000718793 [0,2,0,0,0,0|1,0,0]=3 9796 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2Cl 1626a_100011207228_100000718793 [0,2,0,0,0,0|1,0,0]=3 9797 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2Cl 240690a_100011207228_100000718793 [0,2,0,0,0,0|1,0,0]=3 9798 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2F 11a_100000185272_100000718793 [0,2,0,0,0,0|1,0,0]=3 9799 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2F 1626a_100000185272_100000718793 [0,2,0,0,0,0|1,0,0]=3 9800 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2F 240690a_100000185272_100000718793 [0,2,0,0,0,0|1,0,0]=3 9801 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCc2ccccc2O 240690a_100011207237_100000718793 [0,2,0,0,0,0|1,0,0]=3 9802 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCn2ccccc2=O 1626a_100000687133_100000718793 [0,2,0,0,0,0|2,0,0]=4 9803 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NCCn2ccccc2=O 240690a_100000687133_100000718793 [0,2,0,0,0,0|2,0,0]=4 9804 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NNCc2ccccc2Br 22a_200016993956_100000718793 [0,2,0,0,0,0|2,0,0]=4 9805 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NNCc2ccccc2Cl 22a_100015187261_100000718793 [0,2,0,0,0,0|2,0,0]=4 9806 B22R2.6115346 O=C(C=Cc1cccc(c1)F)NNCc2ccccc2F 22a_100015200773_100000718793 [0,2,0,0,0,0|2,0,0]=4 9807 B22R2.6115346 O=C(C=Cc1cccc(c1)I)CCCc2ccccc2Br 1458a_100020647043_200011713681 [0,2,0,0,0,0|1,0,0]=3 9808 B22R2.6115346 O=C(C=Cc1cccc(c1)I)CCOc2ccccc2Br 1458a_100020647043_100000695877 [0,2,0,0,0,0|2,0,0]=4 9809 B22R2.6115346 O=C(C=Cc1cccc(c1)I)CCOc2ccccc2F 1458a_100020647043_100000183290 [0,2,0,0,0,0|2,0,0]=4 9810 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2Br 11a_100000747383_100020647043 [0,2,0,0,0,0|1,0,0]=3 9811 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2Br 1626a_100000747383_100020647043 [0,2,0,0,0,0|1,0,0]=3 9812 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2Br 240690a_100000747383_100020647043 [0,2,0,0,0,0|1,0,0]=3 9813 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2Cl 11a_100011207228_100020647043 [0,2,0,0,0,0|1,0,0]=3 9814 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2Cl 1626a_100011207228_100020647043 [0,2,0,0,0,0|1,0,0]=3 9815 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2Cl 240690a_100011207228_100020647043 [0,2,0,0,0,0|1,0,0]=3 9816 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2F 11a_100000185272_100020647043 [0,2,0,0,0,0|1,0,0]=3 9817 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2F 1626a_100000185272_100020647043 [0,2,0,0,0,0|1,0,0]=3 9818 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2F 240690a_100000185272_100020647043 [0,2,0,0,0,0|1,0,0]=3 9819 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCc2ccccc2O 240690a_100011207237_100020647043 [0,2,0,0,0,0|1,0,0]=3 9820 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCn2ccccc2=O 1626a_100000687133_100020647043 [0,2,0,0,0,0|2,0,0]=4 9821 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NCCn2ccccc2=O 240690a_100000687133_100020647043 [0,2,0,0,0,0|2,0,0]=4 9822 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NNCc2ccccc2Br 22a_200016993956_100020647043 [0,2,0,0,0,0|2,0,0]=4 9823 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NNCc2ccccc2Cl 22a_100015187261_100020647043 [0,2,0,0,0,0|2,0,0]=4 9824 B22R2.6115346 O=C(C=Cc1cccc(c1)I)NNCc2ccccc2F 22a_100015200773_100020647043 [0,2,0,0,0,0|2,0,0]=4 9825 B22R2.6115346 O=C(C=Cc1cccc(c1)O)NNCc2ccccc2Br 22a_200016993956_100102525460 [0,2,0,0,0,0|2,0,0]=4 9826 B22R2.6115346 O=C(C=Cc1cccc(c1)O)NNCc2ccccc2Cl 22a_100015187261_100102525460 [0,2,0,0,0,0|2,0,0]=4 9827 B22R2.6115346 O=C(C=Cc1cccc(c1)O)NNCc2ccccc2F 22a_100015200773_100102525460 [0,2,0,0,0,0|2,0,0]=4 9828 B22R2.6513 C#Cc1ccc(cc1)NCC(=O)OCCc2ccccc2 34a_100011215031_200000077782 [0,2,0,0,0,0|1,0,1]=4 9829 B22R2.6513 C=Cc1ccc(cc1)NCC(=O)OCCc2ccccc2 34a_100011218248_200000077782 [0,2,0,0,0,0|1,0,1]=4 9830 B22R2.6513 C=Cc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000189437_200000077782 [0,2,0,0,0,0|1,0,1]=4 9831 B22R2.6513 C=Cc1ccc(cc1)OCC(=O)OCCc2ccccc2 7a_100000189437_200000077782 [0,2,0,0,0,0|1,0,1]=4 9832 B22R2.6513 C=Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100000748128_200000077782 [0,2,0,0,0,0|1,0,1]=4 9833 B22R2.6513 C=Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000748128 [0,2,0,0,0,0|1,0,1]=4 9834 B22R2.6513 CCc1ccc(cc1)C=CC(=O)CCCc2ccccc2 1458a_100000187855_100000211621 [0,2,0,0,0,0|1,0,0]=3 9835 B22R2.6513 CCc1ccc(cc1)C=CC(=O)CCOc2ccccc2 1458a_100000187855_100000184471 [0,2,0,0,0,0|2,0,0]=4 9836 B22R2.6513 CCc1ccc(cc1)C=CC(=O)CCSc2ccccc2 1458a_100000187855_100000246102 [0,2,0,0,0,0|2,0,0]=4 9837 B22R2.6513 CCc1ccc(cc1)C=CC(=O)CSCc2ccccc2 1458a_100000187855_200011217039 [0,2,0,0,0,0|2,0,0]=4 9838 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000187855 [0,2,0,0,0,0|1,0,0]=3 9839 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000187855 [0,2,0,0,0,0|1,0,0]=3 9840 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000187855 [0,2,0,0,0,0|1,0,0]=3 9841 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000187855 [0,2,0,0,0,0|2,0,0]=4 9842 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000187855 [0,2,0,0,0,0|2,0,0]=4 9843 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100000187855 [0,2,0,0,0,0|2,0,0]=4 9844 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000187855 [0,2,0,0,0,0|2,0,0]=4 9845 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000187855 [0,2,0,0,0,0|2,0,0]=4 9846 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100000187855 [0,2,0,0,0,0|2,0,0]=4 9847 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000187855 [0,2,0,0,0,0|2,0,0]=4 9848 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000187855 [0,2,0,0,0,0|2,0,0]=4 9849 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100000187855 [0,2,0,0,0,0|2,0,0]=4 9850 B22R2.6513 CCc1ccc(cc1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000187855 [0,2,0,0,0,0|2,0,0]=4 9851 B22R2.6513 CCc1ccc(cc1)NCC(=O)OCCc2ccccc2 2230a_100000211069_200000077782 [0,2,0,0,0,0|1,0,1]=4 9852 B22R2.6513 CCc1ccc(cc1)NCC(=O)OCCc2ccccc2 34a_100000211069_200000077782 [0,2,0,0,0,0|1,0,1]=4 9853 B22R2.6513 CCc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000211359_200000077782 [0,2,0,0,0,0|1,0,1]=4 9854 B22R2.6513 CCc1ccc(cc1)OCC(=O)OCCc2ccccc2 7a_100000211359_200000077782 [0,2,0,0,0,0|1,0,1]=4 9855 B22R2.6513 CCc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100011215824_200000077782 [0,2,0,0,0,0|1,0,1]=4 9856 B22R2.6513 CCc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100011215824 [0,2,0,0,0,0|1,0,1]=4 9857 B22R2.6513 CNc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000182112_200000077782 [0,2,0,0,0,0|1,0,1]=4 9858 B22R2.6513 CNc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100000743151_200000077782 [0,2,0,0,0,0|1,0,1]=4 9859 B22R2.6513 CNc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000743151 [0,2,0,0,0,0|1,0,1]=4 9860 B22R2.6513 COc1ccc(cc1)C=CC(=O)CCCc2ccccc2 1458a_100000184205_100000211621 [0,2,0,0,0,0|1,0,0]=3 9861 B22R2.6513 COc1ccc(cc1)C=CC(=O)CCOc2ccccc2 1458a_100000184205_100000184471 [0,2,0,0,0,0|2,0,0]=4 9862 B22R2.6513 COc1ccc(cc1)C=CC(=O)CCSc2ccccc2 1458a_100000184205_100000246102 [0,2,0,0,0,0|2,0,0]=4 9863 B22R2.6513 COc1ccc(cc1)C=CC(=O)CSCc2ccccc2 1458a_100000184205_200011217039 [0,2,0,0,0,0|2,0,0]=4 9864 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000184205 [0,2,0,0,0,0|1,0,0]=3 9865 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000184205 [0,2,0,0,0,0|1,0,0]=3 9866 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccccc2 527a_100000106460_100000184205 [0,2,0,0,0,0|1,0,0]=3 9867 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000184205 [0,2,0,0,0,0|2,0,0]=4 9868 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000184205 [0,2,0,0,0,0|2,0,0]=4 9869 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccccn2 527a_100000211156_100000184205 [0,2,0,0,0,0|2,0,0]=4 9870 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000184205 [0,2,0,0,0,0|2,0,0]=4 9871 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000184205 [0,2,0,0,0,0|2,0,0]=4 9872 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2cccnc2 527a_100000736294_100000184205 [0,2,0,0,0,0|2,0,0]=4 9873 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000184205 [0,2,0,0,0,0|2,0,0]=4 9874 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000184205 [0,2,0,0,0,0|2,0,0]=4 9875 B22R2.6513 COc1ccc(cc1)C=CC(=O)NCCc2ccncc2 527a_100000742849_100000184205 [0,2,0,0,0,0|2,0,0]=4 9876 B22R2.6513 COc1ccc(cc1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000184205 [0,2,0,0,0,0|2,0,0]=4 9877 B22R2.6513 COc1ccc(cc1)NCC(=O)OCCc2ccccc2 34a_100000184247_200000077782 [0,2,0,0,0,0|1,0,1]=4 9878 B22R2.6513 COc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000210503_200000077782 [0,2,0,0,0,0|1,0,1]=4 9879 B22R2.6513 COc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000171711 [0,2,0,0,0,0|1,0,1]=4 9880 B22R2.6513 CSc1ccc(cc1)C=CC(=O)CCCc2ccccc2 1458a_100102526083_100000211621 [0,2,0,0,0,0|1,0,0]=3 9881 B22R2.6513 CSc1ccc(cc1)C=CC(=O)CCOc2ccccc2 1458a_100102526083_100000184471 [0,2,0,0,0,0|2,0,0]=4 9882 B22R2.6513 CSc1ccc(cc1)C=CC(=O)CCSc2ccccc2 1458a_100102526083_100000246102 [0,2,0,0,0,0|2,0,0]=4 9883 B22R2.6513 CSc1ccc(cc1)C=CC(=O)CSCc2ccccc2 1458a_100102526083_200011217039 [0,2,0,0,0,0|2,0,0]=4 9884 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100102526083 [0,2,0,0,0,0|1,0,0]=3 9885 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100102526083 [0,2,0,0,0,0|1,0,0]=3 9886 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100102526083 [0,2,0,0,0,0|1,0,0]=3 9887 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100102526083 [0,2,0,0,0,0|2,0,0]=4 9888 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100102526083 [0,2,0,0,0,0|2,0,0]=4 9889 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100102526083 [0,2,0,0,0,0|2,0,0]=4 9890 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100102526083 [0,2,0,0,0,0|2,0,0]=4 9891 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100102526083 [0,2,0,0,0,0|2,0,0]=4 9892 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100102526083 [0,2,0,0,0,0|2,0,0]=4 9893 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100102526083 [0,2,0,0,0,0|2,0,0]=4 9894 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100102526083 [0,2,0,0,0,0|2,0,0]=4 9895 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100102526083 [0,2,0,0,0,0|2,0,0]=4 9896 B22R2.6513 CSc1ccc(cc1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100102526083 [0,2,0,0,0,0|2,0,0]=4 9897 B22R2.6513 CSc1ccc(cc1)NCC(=O)OCCc2ccccc2 34a_100000212337_200000077782 [0,2,0,0,0,0|1,0,1]=4 9898 B22R2.6513 CSc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000211864_200000077782 [0,2,0,0,0,0|1,0,1]=4 9899 B22R2.6513 CSc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100011263217_200000077782 [0,2,0,0,0,0|1,0,1]=4 9900 B22R2.6513 CSc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100011263217 [0,2,0,0,0,0|1,0,1]=4 9901 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)CCCc2ccccc2 1458a_100000185084_100000211621 [0,2,0,0,0,0|1,0,0]=3 9902 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)CCOc2ccccc2 1458a_100000185084_100000184471 [0,2,0,0,0,0|2,0,0]=4 9903 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)CCSc2ccccc2 1458a_100000185084_100000246102 [0,2,0,0,0,0|2,0,0]=4 9904 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)CSCc2ccccc2 1458a_100000185084_200011217039 [0,2,0,0,0,0|2,0,0]=4 9905 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000185084 [0,2,0,0,0,0|1,0,0]=3 9906 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000185084 [0,2,0,0,0,0|1,0,0]=3 9907 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000185084 [0,2,0,0,0,0|1,0,0]=3 9908 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000185084 [0,2,0,0,0,0|2,0,0]=4 9909 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000185084 [0,2,0,0,0,0|2,0,0]=4 9910 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100000185084 [0,2,0,0,0,0|2,0,0]=4 9911 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000185084 [0,2,0,0,0,0|2,0,0]=4 9912 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000185084 [0,2,0,0,0,0|2,0,0]=4 9913 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100000185084 [0,2,0,0,0,0|2,0,0]=4 9914 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000185084 [0,2,0,0,0,0|2,0,0]=4 9915 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000185084 [0,2,0,0,0,0|2,0,0]=4 9916 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100000185084 [0,2,0,0,0,0|2,0,0]=4 9917 B22R2.6513 N#Cc1ccc(cc1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000185084 [0,2,0,0,0,0|2,0,0]=4 9918 B22R2.6513 N#Cc1ccc(cc1)NCC(=O)OCCc2ccccc2 34a_100000185469_200000077782 [0,2,0,0,0,0|1,0,1]=4 9919 B22R2.6513 N#Cc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000210344_200000077782 [0,2,0,0,0,0|1,0,1]=4 9920 B22R2.6513 N#Cc1ccc(cc1)OCC(=O)OCCc2ccccc2 7a_100000210344_200000077782 [0,2,0,0,0,0|1,0,1]=4 9921 B22R2.6513 N#Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000184291 [0,2,0,0,0,0|1,0,1]=4 9922 B22R2.6513 NCc1ccc(cc1)OCC(=O)OCCc2ccccc2 34a_100000185549_200000077782 [0,2,0,0,0,0|1,0,1]=4 9923 B22R2.6513 NCc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100016989417_200000077782 [0,2,0,0,0,0|1,0,1]=4 9924 B22R2.6513 NCc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100016989417 [0,2,0,0,0,0|1,0,1]=4 9925 B22R2.6513 NNc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100016988836_200000077782 [0,2,0,0,0,0|1,0,1]=4 9926 B22R2.6513 NNc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100016988836 [0,2,0,0,0,0|1,0,1]=4 9927 B22R2.6513 O=C(CNc1ccc(cc1)CO)OCCc2ccccc2 2230a_100011215238_200000077782 [0,2,0,0,0,0|1,0,1]=4 9928 B22R2.6513 O=C(CNc1ccc(cc1)CO)OCCc2ccccc2 34a_100011215238_200000077782 [0,2,0,0,0,0|1,0,1]=4 9929 B22R2.6513 O=C(COc1ccc(cc1)CO)OCCc2ccccc2 34a_100000211755_200000077782 [0,2,0,0,0,0|1,0,1]=4 9930 B22R2.6513 O=C(CSc1ccc(cc1)CF)OCCc2ccccc2 62a_100010268989_200000077782 [0,2,0,0,0,0|1,0,1]=4 9931 B22R2.6513 O=C(CSc1ccc(cc1)CF)OCCc2ccccc2 62a_200000077782_100010268989 [0,2,0,0,0,0|1,0,1]=4 9932 B22R2.6513 O=C(CSc1ccc(cc1)CO)OCCc2ccccc2 62a_100000690907_200000077782 [0,2,0,0,0,0|1,0,1]=4 9933 B22R2.6513 O=C(CSc1ccc(cc1)CO)OCCc2ccccc2 62a_200000077782_100000690907 [0,2,0,0,0,0|1,0,1]=4 9934 B22R2.6513 O=Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_100000188517_200000077782 [0,2,0,0,0,0|1,0,1]=4 9935 B22R2.6513 O=Cc1ccc(cc1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000188517 [0,2,0,0,0,0|1,0,1]=4 9936 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)Br 11a_100000238496_100016267368 [0,2,0,0,0,0|2,0,0]=4 9937 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)Br 1626a_100000238496_100016267368 [0,2,0,0,0,0|2,0,0]=4 9938 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)Cl 11a_100000238496_100000184863 [0,2,0,0,0,0|2,0,0]=4 9939 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)Cl 1626a_100000238496_100000184863 [0,2,0,0,0,0|2,0,0]=4 9940 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)Cl 240690a_100000238496_100000184863 [0,2,0,0,0,0|2,0,0]=4 9941 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)F 11a_100000238496_100000182136 [0,2,0,0,0,0|2,0,0]=4 9942 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)F 1626a_100000238496_100000182136 [0,2,0,0,0,0|2,0,0]=4 9943 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)F 240690a_100000238496_100000182136 [0,2,0,0,0,0|2,0,0]=4 9944 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)I 11a_100000238496_100102526154 [0,2,0,0,0,0|2,0,0]=4 9945 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)I 1626a_100000238496_100102526154 [0,2,0,0,0,0|2,0,0]=4 9946 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)I 240690a_100000238496_100102526154 [0,2,0,0,0,0|2,0,0]=4 9947 B22R2.22610 CC(Cc1ccccn1)NC(=O)C=Cc2ccc(cc2)O 240690a_100000238496_100016269017 [0,2,0,0,0,0|2,0,0]=4 9948 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)Br 11a_100011207255_100016267368 [0,2,0,0,0,0|2,0,0]=4 9949 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)Br 1626a_100011207255_100016267368 [0,2,0,0,0,0|2,0,0]=4 9950 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)Cl 11a_100011207255_100000184863 [0,2,0,0,0,0|2,0,0]=4 9951 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)Cl 1626a_100011207255_100000184863 [0,2,0,0,0,0|2,0,0]=4 9952 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)Cl 240690a_100011207255_100000184863 [0,2,0,0,0,0|2,0,0]=4 9953 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)F 11a_100011207255_100000182136 [0,2,0,0,0,0|2,0,0]=4 9954 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)F 1626a_100011207255_100000182136 [0,2,0,0,0,0|2,0,0]=4 9955 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)F 240690a_100011207255_100000182136 [0,2,0,0,0,0|2,0,0]=4 9956 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)I 11a_100011207255_100102526154 [0,2,0,0,0,0|2,0,0]=4 9957 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)I 1626a_100011207255_100102526154 [0,2,0,0,0,0|2,0,0]=4 9958 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)I 240690a_100011207255_100102526154 [0,2,0,0,0,0|2,0,0]=4 9959 B22R2.22610 CC(Cc1cccnc1)NC(=O)C=Cc2ccc(cc2)O 240690a_100011207255_100016269017 [0,2,0,0,0,0|2,0,0]=4 9960 B22R2.22610 CN(CC(=O)C=Cc1ccc(cc1)Br)Cc2ccccc2 6a_100000186029_100000180320 [0,2,0,0,0,0|2,0,0]=4 9961 B22R2.22610 CN(CC(=O)C=Cc1ccc(cc1)F)Cc2ccccc2 6a_100000210084_100000180320 [0,2,0,0,0,0|2,0,0]=4 9962 B22R2.22610 CN(CC(=O)C=Cc1ccc(cc1)I)Cc2ccccc2 6a_100000188517_100000180320 [0,2,0,0,0,0|2,0,0]=4 9963 B22R2.22610 Cc1ccc(cc1)C=CC(=O)CC(=O)Cc2ccccc2 1458a_100000716854_100000233483 [0,2,0,0,0,0|1,0,1]=4 9964 B22R2.22610 Cc1ccc(cc1)C=CC(=O)NC(C)Cc2ccccn2 11a_100000238496_100000716854 [0,2,0,0,0,0|2,0,0]=4 9965 B22R2.22610 Cc1ccc(cc1)C=CC(=O)NC(C)Cc2ccccn2 1626a_100000238496_100000716854 [0,2,0,0,0,0|2,0,0]=4 9966 B22R2.22610 Cc1ccc(cc1)C=CC(=O)NC(C)Cc2ccccn2 240690a_100000238496_100000716854 [0,2,0,0,0,0|2,0,0]=4 9967 B22R2.22610 Cc1ccc(cc1)C=CC(=O)NC(C)Cc2cccnc2 11a_100011207255_100000716854 [0,2,0,0,0,0|2,0,0]=4 9968 B22R2.22610 Cc1ccc(cc1)C=CC(=O)NC(C)Cc2cccnc2 1626a_100011207255_100000716854 [0,2,0,0,0,0|2,0,0]=4 9969 B22R2.22610 Cc1ccc(cc1)C=CC(=O)NC(C)Cc2cccnc2 240690a_100011207255_100000716854 [0,2,0,0,0,0|2,0,0]=4 9970 B22R2.22610 O=C(C=Cc1ccc(cc1)Br)CC(=O)Cc2ccccc2 1458a_100016267368_100000233483 [0,2,0,0,0,0|1,0,1]=4 9971 B22R2.22610 O=C(C=Cc1ccc(cc1)Cl)CC(=O)Cc2ccccc2 1458a_100000184863_100000233483 [0,2,0,0,0,0|1,0,1]=4 9972 B22R2.22610 O=C(C=Cc1ccc(cc1)F)CC(=O)Cc2ccccc2 1458a_100000182136_100000233483 [0,2,0,0,0,0|1,0,1]=4 9973 B22R2.22610 O=C(C=Cc1ccc(cc1)I)CC(=O)Cc2ccccc2 1458a_100102526154_100000233483 [0,2,0,0,0,0|1,0,1]=4 9974 B22R2.22612 Cc1ccc(cc1)C=CC(=O)CCCc2ccc(cc2)Br 1458a_100000716854_100011713682 [0,2,0,0,0,0|1,0,0]=3 9975 B22R2.22612 Cc1ccc(cc1)C=CC(=O)CCCc2ccc(cc2)Cl 1458a_100000716854_100000759440 [0,2,0,0,0,0|1,0,0]=3 9976 B22R2.22612 Cc1ccc(cc1)C=CC(=O)CCCc2ccc(cc2)F 1458a_100000716854_200011713563 [0,2,0,0,0,0|1,0,0]=3 9977 B22R2.22612 Cc1ccc(cc1)C=CC(=O)CCOc2ccc(cc2)Br 1458a_100000716854_100000183278 [0,2,0,0,0,0|2,0,0]=4 9978 B22R2.22612 Cc1ccc(cc1)C=CC(=O)CCOc2ccc(cc2)C 1458a_100000716854_100000183172 [0,2,0,0,0,0|2,0,0]=4 9979 B22R2.22612 Cc1ccc(cc1)C=CC(=O)CCOc2ccc(cc2)Cl 1458a_100000716854_100000184122 [0,2,0,0,0,0|2,0,0]=4 9980 B22R2.22612 Cc1ccc(cc1)C=CC(=O)CCOc2ccc(cc2)F 1458a_100000716854_100000184936 [0,2,0,0,0,0|2,0,0]=4 9981 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)Br 11a_100000755846_100000716854 [0,2,0,0,0,0|1,0,0]=3 9982 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)Br 1626a_100000755846_100000716854 [0,2,0,0,0,0|1,0,0]=3 9983 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)Br 240690a_100000755846_100000716854 [0,2,0,0,0,0|1,0,0]=3 9984 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)C 11a_100000705350_100000716854 [0,2,0,0,0,0|1,0,0]=3 9985 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)C 1626a_100000705350_100000716854 [0,2,0,0,0,0|1,0,0]=3 9986 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)C 240690a_100000705350_100000716854 [0,2,0,0,0,0|1,0,0]=3 9987 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)Cl 11a_100000185265_100000716854 [0,2,0,0,0,0|1,0,0]=3 9988 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)Cl 1626a_100000185265_100000716854 [0,2,0,0,0,0|1,0,0]=3 9989 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)Cl 240690a_100000185265_100000716854 [0,2,0,0,0,0|1,0,0]=3 9990 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)F 11a_100000199005_100000716854 [0,2,0,0,0,0|1,0,0]=3 9991 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)F 1626a_100000199005_100000716854 [0,2,0,0,0,0|1,0,0]=3 9992 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)F 240690a_100000199005_100000716854 [0,2,0,0,0,0|1,0,0]=3 9993 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NCCc2ccc(cc2)O 240690a_100000743037_100000716854 [0,2,0,0,0,0|1,0,0]=3 9994 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NNCc2ccc(cc2)Br 22a_100016993955_100000716854 [0,2,0,0,0,0|2,0,0]=4 9995 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NNCc2ccc(cc2)C 22a_100011197965_100000716854 [0,2,0,0,0,0|2,0,0]=4 9996 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NNCc2ccc(cc2)Cl 22a_100000689899_100000716854 [0,2,0,0,0,0|2,0,0]=4 9997 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NNCc2ccc(cc2)F 22a_100000689900_100000716854 [0,2,0,0,0,0|2,0,0]=4 9998 B22R2.22612 Cc1ccc(cc1)C=CC(=O)NNCc2ccc(cc2)I 22a_102495363730_100000716854 [0,2,0,0,0,0|2,0,0]=4 9999 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)Br 11a_100000705350_100016267368 [0,2,0,0,0,0|1,0,0]=3 10000 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)Br 1626a_100000705350_100016267368 [0,2,0,0,0,0|1,0,0]=3 10001 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)Cl 11a_100000705350_100000184863 [0,2,0,0,0,0|1,0,0]=3 10002 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)Cl 1626a_100000705350_100000184863 [0,2,0,0,0,0|1,0,0]=3 10003 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)Cl 240690a_100000705350_100000184863 [0,2,0,0,0,0|1,0,0]=3 10004 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)F 11a_100000705350_100000182136 [0,2,0,0,0,0|1,0,0]=3 10005 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)F 1626a_100000705350_100000182136 [0,2,0,0,0,0|1,0,0]=3 10006 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)F 240690a_100000705350_100000182136 [0,2,0,0,0,0|1,0,0]=3 10007 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)I 11a_100000705350_100102526154 [0,2,0,0,0,0|1,0,0]=3 10008 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)I 1626a_100000705350_100102526154 [0,2,0,0,0,0|1,0,0]=3 10009 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)I 240690a_100000705350_100102526154 [0,2,0,0,0,0|1,0,0]=3 10010 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cc2)O 240690a_100000705350_100016269017 [0,2,0,0,0,0|1,0,0]=3 10011 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cn2)F 11a_100000705350_100020630499 [0,2,0,0,0,0|2,0,0]=4 10012 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cn2)F 1626a_100000705350_100020630499 [0,2,0,0,0,0|2,0,0]=4 10013 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(cn2)F 240690a_100000705350_100020630499 [0,2,0,0,0,0|2,0,0]=4 10014 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(nc2)Br 11a_100000705350_100020588214 [0,2,0,0,0,0|2,0,0]=4 10015 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(nc2)Br 1626a_100000705350_100020588214 [0,2,0,0,0,0|2,0,0]=4 10016 B22R2.22612 Cc1ccc(cc1)CCNC(=O)C=Cc2ccc(nc2)Br 240690a_100000705350_100020588214 [0,2,0,0,0,0|2,0,0]=4 10017 B22R2.22612 Cc1ccc(cc1)CNNC(=O)C=Cc2ccc(cc2)Br 22a_100011197965_100016267368 [0,2,0,0,0,0|2,0,0]=4 10018 B22R2.22612 Cc1ccc(cc1)CNNC(=O)C=Cc2ccc(cc2)Cl 22a_100011197965_100000184863 [0,2,0,0,0,0|2,0,0]=4 10019 B22R2.22612 Cc1ccc(cc1)CNNC(=O)C=Cc2ccc(cc2)F 22a_100011197965_100000182136 [0,2,0,0,0,0|2,0,0]=4 10020 B22R2.22612 Cc1ccc(cc1)CNNC(=O)C=Cc2ccc(cc2)I 22a_100011197965_100102526154 [0,2,0,0,0,0|2,0,0]=4 10021 B22R2.22612 Cc1ccc(cc1)CNNC(=O)C=Cc2ccc(cc2)O 22a_100011197965_100016269017 [0,2,0,0,0,0|2,0,0]=4 10022 B22R2.22612 Cc1ccc(cc1)OCCC(=O)C=Cc2ccc(cc2)Br 1458a_100016267368_100000183172 [0,2,0,0,0,0|2,0,0]=4 10023 B22R2.22612 Cc1ccc(cc1)OCCC(=O)C=Cc2ccc(cc2)Cl 1458a_100000184863_100000183172 [0,2,0,0,0,0|2,0,0]=4 10024 B22R2.22612 Cc1ccc(cc1)OCCC(=O)C=Cc2ccc(cc2)F 1458a_100000182136_100000183172 [0,2,0,0,0,0|2,0,0]=4 10025 B22R2.22612 Cc1ccc(cc1)OCCC(=O)C=Cc2ccc(cc2)I 1458a_100102526154_100000183172 [0,2,0,0,0,0|2,0,0]=4 10026 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)CCCc2ccc(cc2)Br 1458a_100016267368_100011713682 [0,2,0,0,0,0|1,0,0]=3 10027 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)CCCc2ccc(cc2)Cl 1458a_100016267368_100000759440 [0,2,0,0,0,0|1,0,0]=3 10028 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)CCCc2ccc(cc2)F 1458a_100016267368_200011713563 [0,2,0,0,0,0|1,0,0]=3 10029 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)CCOc2ccc(cc2)Br 1458a_100016267368_100000183278 [0,2,0,0,0,0|2,0,0]=4 10030 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)CCOc2ccc(cc2)Cl 1458a_100016267368_100000184122 [0,2,0,0,0,0|2,0,0]=4 10031 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)CCOc2ccc(cc2)F 1458a_100016267368_100000184936 [0,2,0,0,0,0|2,0,0]=4 10032 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)CCSc2ccc(cc2)F 6a_100000186029_100000208766 [0,2,0,0,0,0|2,0,0]=4 10033 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NCCc2ccc(cc2)Br 11a_100000755846_100016267368 [0,2,0,0,0,0|1,0,0]=3 10034 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NCCc2ccc(cc2)Br 1626a_100000755846_100016267368 [0,2,0,0,0,0|1,0,0]=3 10035 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NCCc2ccc(cc2)Cl 11a_100000185265_100016267368 [0,2,0,0,0,0|1,0,0]=3 10036 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NCCc2ccc(cc2)Cl 1626a_100000185265_100016267368 [0,2,0,0,0,0|1,0,0]=3 10037 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NCCc2ccc(cc2)F 11a_100000199005_100016267368 [0,2,0,0,0,0|1,0,0]=3 10038 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NCCc2ccc(cc2)F 1626a_100000199005_100016267368 [0,2,0,0,0,0|1,0,0]=3 10039 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NNCc2ccc(cc2)Br 22a_100016993955_100016267368 [0,2,0,0,0,0|2,0,0]=4 10040 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NNCc2ccc(cc2)Cl 22a_100000689899_100016267368 [0,2,0,0,0,0|2,0,0]=4 10041 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NNCc2ccc(cc2)F 22a_100000689900_100016267368 [0,2,0,0,0,0|2,0,0]=4 10042 B22R2.22612 O=C(C=Cc1ccc(cc1)Br)NNCc2ccc(cc2)I 22a_102495363730_100016267368 [0,2,0,0,0,0|2,0,0]=4 10043 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)CCCc2ccc(cc2)Br 1458a_100000184863_100011713682 [0,2,0,0,0,0|1,0,0]=3 10044 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)CCCc2ccc(cc2)Cl 1458a_100000184863_100000759440 [0,2,0,0,0,0|1,0,0]=3 10045 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)CCCc2ccc(cc2)F 1458a_100000184863_200011713563 [0,2,0,0,0,0|1,0,0]=3 10046 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)CCOc2ccc(cc2)Br 1458a_100000184863_100000183278 [0,2,0,0,0,0|2,0,0]=4 10047 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)CCOc2ccc(cc2)Cl 1458a_100000184863_100000184122 [0,2,0,0,0,0|2,0,0]=4 10048 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)CCOc2ccc(cc2)F 1458a_100000184863_100000184936 [0,2,0,0,0,0|2,0,0]=4 10049 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)Br 11a_100000755846_100000184863 [0,2,0,0,0,0|1,0,0]=3 10050 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)Br 1626a_100000755846_100000184863 [0,2,0,0,0,0|1,0,0]=3 10051 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)Br 240690a_100000755846_100000184863 [0,2,0,0,0,0|1,0,0]=3 10052 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)Cl 11a_100000185265_100000184863 [0,2,0,0,0,0|1,0,0]=3 10053 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)Cl 1626a_100000185265_100000184863 [0,2,0,0,0,0|1,0,0]=3 10054 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)Cl 240690a_100000185265_100000184863 [0,2,0,0,0,0|1,0,0]=3 10055 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)F 11a_100000199005_100000184863 [0,2,0,0,0,0|1,0,0]=3 10056 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)F 1626a_100000199005_100000184863 [0,2,0,0,0,0|1,0,0]=3 10057 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)F 240690a_100000199005_100000184863 [0,2,0,0,0,0|1,0,0]=3 10058 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NCCc2ccc(cc2)O 240690a_100000743037_100000184863 [0,2,0,0,0,0|1,0,0]=3 10059 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccc(cc2)Br 22a_100016993955_100000184863 [0,2,0,0,0,0|2,0,0]=4 10060 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccc(cc2)Cl 22a_100000689899_100000184863 [0,2,0,0,0,0|2,0,0]=4 10061 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccc(cc2)F 22a_100000689900_100000184863 [0,2,0,0,0,0|2,0,0]=4 10062 B22R2.22612 O=C(C=Cc1ccc(cc1)Cl)NNCc2ccc(cc2)I 22a_102495363730_100000184863 [0,2,0,0,0,0|2,0,0]=4 10063 B22R2.22612 O=C(C=Cc1ccc(cc1)F)CCCc2ccc(cc2)Br 1458a_100000182136_100011713682 [0,2,0,0,0,0|1,0,0]=3 10064 B22R2.22612 O=C(C=Cc1ccc(cc1)F)CCCc2ccc(cc2)Cl 1458a_100000182136_100000759440 [0,2,0,0,0,0|1,0,0]=3 10065 B22R2.22612 O=C(C=Cc1ccc(cc1)F)CCCc2ccc(cc2)F 1458a_100000182136_200011713563 [0,2,0,0,0,0|1,0,0]=3 10066 B22R2.22612 O=C(C=Cc1ccc(cc1)F)CCOc2ccc(cc2)Br 1458a_100000182136_100000183278 [0,2,0,0,0,0|2,0,0]=4 10067 B22R2.22612 O=C(C=Cc1ccc(cc1)F)CCOc2ccc(cc2)Cl 1458a_100000182136_100000184122 [0,2,0,0,0,0|2,0,0]=4 10068 B22R2.22612 O=C(C=Cc1ccc(cc1)F)CCOc2ccc(cc2)F 1458a_100000182136_100000184936 [0,2,0,0,0,0|2,0,0]=4 10069 B22R2.22612 O=C(C=Cc1ccc(cc1)F)CCSc2ccc(cc2)F 6a_100000210084_100000208766 [0,2,0,0,0,0|2,0,0]=4 10070 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)Br 11a_100000755846_100000182136 [0,2,0,0,0,0|1,0,0]=3 10071 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)Br 1626a_100000755846_100000182136 [0,2,0,0,0,0|1,0,0]=3 10072 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)Br 240690a_100000755846_100000182136 [0,2,0,0,0,0|1,0,0]=3 10073 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)Cl 11a_100000185265_100000182136 [0,2,0,0,0,0|1,0,0]=3 10074 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)Cl 1626a_100000185265_100000182136 [0,2,0,0,0,0|1,0,0]=3 10075 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)Cl 240690a_100000185265_100000182136 [0,2,0,0,0,0|1,0,0]=3 10076 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)F 11a_100000199005_100000182136 [0,2,0,0,0,0|1,0,0]=3 10077 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)F 1626a_100000199005_100000182136 [0,2,0,0,0,0|1,0,0]=3 10078 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)F 240690a_100000199005_100000182136 [0,2,0,0,0,0|1,0,0]=3 10079 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NCCc2ccc(cc2)O 240690a_100000743037_100000182136 [0,2,0,0,0,0|1,0,0]=3 10080 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NNCc2ccc(cc2)Br 22a_100016993955_100000182136 [0,2,0,0,0,0|2,0,0]=4 10081 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NNCc2ccc(cc2)Cl 22a_100000689899_100000182136 [0,2,0,0,0,0|2,0,0]=4 10082 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NNCc2ccc(cc2)F 22a_100000689900_100000182136 [0,2,0,0,0,0|2,0,0]=4 10083 B22R2.22612 O=C(C=Cc1ccc(cc1)F)NNCc2ccc(cc2)I 22a_102495363730_100000182136 [0,2,0,0,0,0|2,0,0]=4 10084 B22R2.22612 O=C(C=Cc1ccc(cc1)I)CCCc2ccc(cc2)Br 1458a_100102526154_100011713682 [0,2,0,0,0,0|1,0,0]=3 10085 B22R2.22612 O=C(C=Cc1ccc(cc1)I)CCCc2ccc(cc2)Cl 1458a_100102526154_100000759440 [0,2,0,0,0,0|1,0,0]=3 10086 B22R2.22612 O=C(C=Cc1ccc(cc1)I)CCCc2ccc(cc2)F 1458a_100102526154_200011713563 [0,2,0,0,0,0|1,0,0]=3 10087 B22R2.22612 O=C(C=Cc1ccc(cc1)I)CCOc2ccc(cc2)Br 1458a_100102526154_100000183278 [0,2,0,0,0,0|2,0,0]=4 10088 B22R2.22612 O=C(C=Cc1ccc(cc1)I)CCOc2ccc(cc2)Cl 1458a_100102526154_100000184122 [0,2,0,0,0,0|2,0,0]=4 10089 B22R2.22612 O=C(C=Cc1ccc(cc1)I)CCOc2ccc(cc2)F 1458a_100102526154_100000184936 [0,2,0,0,0,0|2,0,0]=4 10090 B22R2.22612 O=C(C=Cc1ccc(cc1)I)CCSc2ccc(cc2)F 6a_100000188517_100000208766 [0,2,0,0,0,0|2,0,0]=4 10091 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)Br 11a_100000755846_100102526154 [0,2,0,0,0,0|1,0,0]=3 10092 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)Br 1626a_100000755846_100102526154 [0,2,0,0,0,0|1,0,0]=3 10093 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)Br 240690a_100000755846_100102526154 [0,2,0,0,0,0|1,0,0]=3 10094 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)Cl 11a_100000185265_100102526154 [0,2,0,0,0,0|1,0,0]=3 10095 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)Cl 1626a_100000185265_100102526154 [0,2,0,0,0,0|1,0,0]=3 10096 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)Cl 240690a_100000185265_100102526154 [0,2,0,0,0,0|1,0,0]=3 10097 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)F 11a_100000199005_100102526154 [0,2,0,0,0,0|1,0,0]=3 10098 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)F 1626a_100000199005_100102526154 [0,2,0,0,0,0|1,0,0]=3 10099 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)F 240690a_100000199005_100102526154 [0,2,0,0,0,0|1,0,0]=3 10100 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NCCc2ccc(cc2)O 240690a_100000743037_100102526154 [0,2,0,0,0,0|1,0,0]=3 10101 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NNCc2ccc(cc2)Br 22a_100016993955_100102526154 [0,2,0,0,0,0|2,0,0]=4 10102 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NNCc2ccc(cc2)Cl 22a_100000689899_100102526154 [0,2,0,0,0,0|2,0,0]=4 10103 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NNCc2ccc(cc2)F 22a_100000689900_100102526154 [0,2,0,0,0,0|2,0,0]=4 10104 B22R2.22612 O=C(C=Cc1ccc(cc1)I)NNCc2ccc(cc2)I 22a_102495363730_100102526154 [0,2,0,0,0,0|2,0,0]=4 10105 B22R2.22612 O=C(C=Cc1ccc(cc1)O)NCCc2ccc(cc2)Br 240690a_100000755846_100016269017 [0,2,0,0,0,0|1,0,0]=3 10106 B22R2.22612 O=C(C=Cc1ccc(cc1)O)NCCc2ccc(cc2)Cl 240690a_100000185265_100016269017 [0,2,0,0,0,0|1,0,0]=3 10107 B22R2.22612 O=C(C=Cc1ccc(cc1)O)NCCc2ccc(cc2)F 240690a_100000199005_100016269017 [0,2,0,0,0,0|1,0,0]=3 10108 B22R2.22612 O=C(C=Cc1ccc(cc1)O)NCCc2ccc(cc2)O 240690a_100000743037_100016269017 [0,2,0,0,0,0|1,0,0]=3 10109 B22R2.22612 O=C(C=Cc1ccc(cc1)O)NNCc2ccc(cc2)Br 22a_100016993955_100016269017 [0,2,0,0,0,0|2,0,0]=4 10110 B22R2.22612 O=C(C=Cc1ccc(cc1)O)NNCc2ccc(cc2)Cl 22a_100000689899_100016269017 [0,2,0,0,0,0|2,0,0]=4 10111 B22R2.22612 O=C(C=Cc1ccc(cc1)O)NNCc2ccc(cc2)F 22a_100000689900_100016269017 [0,2,0,0,0,0|2,0,0]=4 10112 B22R2.22612 O=C(C=Cc1ccc(cc1)O)NNCc2ccc(cc2)I 22a_102495363730_100016269017 [0,2,0,0,0,0|2,0,0]=4 10113 B22R2.22612 O=C(C=Cc1ccc(cn1)F)CCCc2ccc(cc2)Br 1458a_100020630499_100011713682 [0,2,0,0,0,0|2,0,0]=4 10114 B22R2.22612 O=C(C=Cc1ccc(cn1)F)CCCc2ccc(cc2)Cl 1458a_100020630499_100000759440 [0,2,0,0,0,0|2,0,0]=4 10115 B22R2.22612 O=C(C=Cc1ccc(cn1)F)CCCc2ccc(cc2)F 1458a_100020630499_200011713563 [0,2,0,0,0,0|2,0,0]=4 10116 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)Br 11a_100000755846_100020630499 [0,2,0,0,0,0|2,0,0]=4 10117 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)Br 1626a_100000755846_100020630499 [0,2,0,0,0,0|2,0,0]=4 10118 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)Br 240690a_100000755846_100020630499 [0,2,0,0,0,0|2,0,0]=4 10119 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)Cl 11a_100000185265_100020630499 [0,2,0,0,0,0|2,0,0]=4 10120 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)Cl 1626a_100000185265_100020630499 [0,2,0,0,0,0|2,0,0]=4 10121 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)Cl 240690a_100000185265_100020630499 [0,2,0,0,0,0|2,0,0]=4 10122 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)F 11a_100000199005_100020630499 [0,2,0,0,0,0|2,0,0]=4 10123 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)F 1626a_100000199005_100020630499 [0,2,0,0,0,0|2,0,0]=4 10124 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)F 240690a_100000199005_100020630499 [0,2,0,0,0,0|2,0,0]=4 10125 B22R2.22612 O=C(C=Cc1ccc(cn1)F)NCCc2ccc(cc2)O 240690a_100000743037_100020630499 [0,2,0,0,0,0|2,0,0]=4 10126 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)CCCc2ccc(cc2)Br 1458a_100020588214_100011713682 [0,2,0,0,0,0|2,0,0]=4 10127 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)CCCc2ccc(cc2)Cl 1458a_100020588214_100000759440 [0,2,0,0,0,0|2,0,0]=4 10128 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)CCCc2ccc(cc2)F 1458a_100020588214_200011713563 [0,2,0,0,0,0|2,0,0]=4 10129 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)Br 11a_100000755846_100020588214 [0,2,0,0,0,0|2,0,0]=4 10130 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)Br 1626a_100000755846_100020588214 [0,2,0,0,0,0|2,0,0]=4 10131 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)Br 240690a_100000755846_100020588214 [0,2,0,0,0,0|2,0,0]=4 10132 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)Cl 11a_100000185265_100020588214 [0,2,0,0,0,0|2,0,0]=4 10133 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)Cl 1626a_100000185265_100020588214 [0,2,0,0,0,0|2,0,0]=4 10134 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)Cl 240690a_100000185265_100020588214 [0,2,0,0,0,0|2,0,0]=4 10135 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)F 11a_100000199005_100020588214 [0,2,0,0,0,0|2,0,0]=4 10136 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)F 1626a_100000199005_100020588214 [0,2,0,0,0,0|2,0,0]=4 10137 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)F 240690a_100000199005_100020588214 [0,2,0,0,0,0|2,0,0]=4 10138 B22R2.22612 O=C(C=Cc1ccc(nc1)Br)NCCc2ccc(cc2)O 240690a_100000743037_100020588214 [0,2,0,0,0,0|2,0,0]=4 10139 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)Br 2230a_100000219623_200000077782 [0,2,0,0,0,0|1,0,1]=4 10140 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)Br 269982a_100000219623_200000077782 [0,2,0,0,0,0|1,0,1]=4 10141 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)Br 34a_100000219623_200000077782 [0,2,0,0,0,0|1,0,1]=4 10142 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)Cl 2230a_100020629279_200000077782 [0,2,0,0,0,0|1,0,1]=4 10143 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)Cl 269982a_100020629279_200000077782 [0,2,0,0,0,0|1,0,1]=4 10144 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)Cl 34a_100020629279_200000077782 [0,2,0,0,0,0|1,0,1]=4 10145 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)F 2230a_100000219829_200000077782 [0,2,0,0,0,0|1,0,1]=4 10146 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)F 269982a_100000219829_200000077782 [0,2,0,0,0,0|1,0,1]=4 10147 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)F 34a_100000219829_200000077782 [0,2,0,0,0,0|1,0,1]=4 10148 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)I 2230a_100000743151_200000077782 [0,2,0,0,0,0|1,0,1]=4 10149 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)I 269982a_100000743151_200000077782 [0,2,0,0,0,0|1,0,1]=4 10150 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)I 34a_100000743151_200000077782 [0,2,0,0,0,0|1,0,1]=4 10151 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)O 269982a_100000182112_200000077782 [0,2,0,0,0,0|1,0,1]=4 10152 B22R2.23085 CN(CC(=O)OCCc1ccccc1)c2ccc(cc2)O 34a_100000182112_200000077782 [0,2,0,0,0,0|1,0,1]=4 10153 B22R2.23085 Cc1ccc(cc1)C(=O)CC(=O)CCCc2ccccc2 1458a_100011207963_100000211441 [0,2,0,0,0,0|1,0,1]=4 10154 B22R2.23085 Cc1ccc(cc1)C(=O)CC(=O)NCCc2ccccc2 1458a_100000188618_100000183012 [0,2,0,0,0,0|1,0,1]=4 10155 B22R2.23085 Cc1ccc(cc1)C(=O)CC(=O)OCCc2ccccc2 1458a_100000188618_200000077782 [0,2,0,0,0,0|0,0,1]=3 10156 B22R2.23085 Cc1ccc(cc1)N(C)CC(=O)OCCc2ccccc2 2230a_100000219977_200000077782 [0,2,0,0,0,0|1,0,1]=4 10157 B22R2.23085 Cc1ccc(cc1)N(C)CC(=O)OCCc2ccccc2 269982a_100000219977_200000077782 [0,2,0,0,0,0|1,0,1]=4 10158 B22R2.23085 Cc1ccc(cc1)N(C)CC(=O)OCCc2ccccc2 34a_100000219977_200000077782 [0,2,0,0,0,0|1,0,1]=4 10159 B22R2.23085 O=C(CC(=O)c1ccc(cc1)Br)NCCc2ccccc2 1458a_100000185839_100000183012 [0,2,0,0,0,0|1,0,1]=4 10160 B22R2.23085 O=C(CC(=O)c1ccc(cc1)Br)OCCc2ccccc2 1458a_100000185839_200000077782 [0,2,0,0,0,0|0,0,1]=3 10161 B22R2.23085 O=C(CC(=O)c1ccc(cc1)Cl)NCCc2ccccc2 1458a_100000210187_100000183012 [0,2,0,0,0,0|1,0,1]=4 10162 B22R2.23085 O=C(CC(=O)c1ccc(cc1)Cl)OCCc2ccccc2 1458a_100000210187_200000077782 [0,2,0,0,0,0|0,0,1]=3 10163 B22R2.23085 O=C(CC(=O)c1ccc(cc1)F)NCCc2ccccc2 1458a_100000187176_100000183012 [0,2,0,0,0,0|1,0,1]=4 10164 B22R2.23085 O=C(CC(=O)c1ccc(cc1)F)OCCc2ccccc2 1458a_100000187176_200000077782 [0,2,0,0,0,0|0,0,1]=3 10165 B22R2.23085 O=C(CC(=O)c1ccc(cc1)I)NCCc2ccccc2 1458a_100000187904_100000183012 [0,2,0,0,0,0|1,0,1]=4 10166 B22R2.23085 O=C(CC(=O)c1ccc(cc1)I)OCCc2ccccc2 1458a_100000187904_200000077782 [0,2,0,0,0,0|0,0,1]=3 10167 B22R2.23085 O=C(CC(=O)c1ccc(cc1)O)NCCc2ccccc2 1458a_100000212099_100000183012 [0,2,0,0,0,0|1,0,1]=4 10168 B22R2.23085 O=C(CC(=O)c1ccc(cc1)O)OCCc2ccccc2 1458a_100000212099_200000077782 [0,2,0,0,0,0|0,0,1]=3 10169 B22R2.23085 O=C(CCCc1ccccc1)CC(=O)c2ccc(cc2)Br 1458a_100011207963_100000188085 [0,2,0,0,0,0|1,0,1]=4 10170 B22R2.23085 O=C(CCCc1ccccc1)CC(=O)c2ccc(cc2)Cl 1458a_100011207963_100000211071 [0,2,0,0,0,0|1,0,1]=4 10171 B22R2.23085 O=C(CCCc1ccccc1)CC(=O)c2ccc(cc2)F 1458a_100011207963_100000211279 [0,2,0,0,0,0|1,0,1]=4 10172 B22R2.23085 O=C(CCCc1ccccc1)CC(=O)c2ccc(cc2)I 1458a_100011207963_100011216261 [0,2,0,0,0,0|1,0,1]=4 10173 B22R2.23085 O=C(CCCc1ccccc1)CC(=O)c2ccc(cc2)O 1458a_100011207963_100009814261 [0,2,0,0,0,0|1,0,1]=4 10174 B22R2.23584 CN(CCc1ccc(cc1)Br)C(=O)C=Cc2ccccc2 11a_100000752880_100000210462 [0,2,0,0,0,0|1,0,0]=3 10175 B22R2.23584 CN(CCc1ccc(cc1)Br)C(=O)C=Cc2ccccc2 1626a_100000752880_100000210462 [0,2,0,0,0,0|1,0,0]=3 10176 B22R2.23584 CN(CCc1ccc(cc1)Br)C(=O)C=Cc2ccccn2 11a_100000752880_100000740811 [0,2,0,0,0,0|2,0,0]=4 10177 B22R2.23584 CN(CCc1ccc(cc1)Br)C(=O)C=Cc2ccccn2 240690a_100000752880_100000740811 [0,2,0,0,0,0|2,0,0]=4 10178 B22R2.23584 CN(CCc1ccc(cc1)Br)C(=O)C=Cc2cccnc2 11a_100000752880_100000735890 [0,2,0,0,0,0|2,0,0]=4 10179 B22R2.23584 CN(CCc1ccc(cc1)Br)C(=O)C=Cc2cccnc2 240690a_100000752880_100000735890 [0,2,0,0,0,0|2,0,0]=4 10180 B22R2.23584 CN(CCc1ccc(cc1)Br)C(=O)C=Cc2ccncc2 240690a_100000752880_100000682801 [0,2,0,0,0,0|2,0,0]=4 10181 B22R2.23584 CN(CCc1ccc(cc1)Cl)C(=O)C=Cc2ccccc2 11a_100000698262_100000210462 [0,2,0,0,0,0|1,0,0]=3 10182 B22R2.23584 CN(CCc1ccc(cc1)Cl)C(=O)C=Cc2ccccc2 1626a_100000698262_100000210462 [0,2,0,0,0,0|1,0,0]=3 10183 B22R2.23584 CN(CCc1ccc(cc1)Cl)C(=O)C=Cc2ccccn2 11a_100000698262_100000740811 [0,2,0,0,0,0|2,0,0]=4 10184 B22R2.23584 CN(CCc1ccc(cc1)Cl)C(=O)C=Cc2ccccn2 240690a_100000698262_100000740811 [0,2,0,0,0,0|2,0,0]=4 10185 B22R2.23584 CN(CCc1ccc(cc1)Cl)C(=O)C=Cc2cccnc2 11a_100000698262_100000735890 [0,2,0,0,0,0|2,0,0]=4 10186 B22R2.23584 CN(CCc1ccc(cc1)Cl)C(=O)C=Cc2cccnc2 240690a_100000698262_100000735890 [0,2,0,0,0,0|2,0,0]=4 10187 B22R2.23584 CN(CCc1ccc(cc1)Cl)C(=O)C=Cc2ccncc2 240690a_100000698262_100000682801 [0,2,0,0,0,0|2,0,0]=4 10188 B22R2.23584 CN(CCc1ccc(cc1)F)C(=O)C=Cc2ccccc2 11a_100102946585_100000210462 [0,2,0,0,0,0|1,0,0]=3 10189 B22R2.23584 CN(CCc1ccc(cc1)F)C(=O)C=Cc2ccccc2 1626a_100102946585_100000210462 [0,2,0,0,0,0|1,0,0]=3 10190 B22R2.23584 CN(CCc1ccc(cc1)F)C(=O)C=Cc2ccccn2 11a_100102946585_100000740811 [0,2,0,0,0,0|2,0,0]=4 10191 B22R2.23584 CN(CCc1ccc(cc1)F)C(=O)C=Cc2ccccn2 240690a_100102946585_100000740811 [0,2,0,0,0,0|2,0,0]=4 10192 B22R2.23584 CN(CCc1ccc(cc1)F)C(=O)C=Cc2cccnc2 11a_100102946585_100000735890 [0,2,0,0,0,0|2,0,0]=4 10193 B22R2.23584 CN(CCc1ccc(cc1)F)C(=O)C=Cc2cccnc2 240690a_100102946585_100000735890 [0,2,0,0,0,0|2,0,0]=4 10194 B22R2.23584 CN(CCc1ccc(cc1)F)C(=O)C=Cc2ccncc2 240690a_100102946585_100000682801 [0,2,0,0,0,0|2,0,0]=4 10195 B22R2.23584 CN(CCc1ccc(cc1)O)C(=O)C=Cc2ccccn2 240690a_100016989440_100000740811 [0,2,0,0,0,0|2,0,0]=4 10196 B22R2.23584 CN(CCc1ccc(cc1)O)C(=O)C=Cc2cccnc2 240690a_100016989440_100000735890 [0,2,0,0,0,0|2,0,0]=4 10197 B22R2.23584 CN(CCc1ccc(cc1)O)C(=O)C=Cc2ccncc2 240690a_100016989440_100000682801 [0,2,0,0,0,0|2,0,0]=4 10198 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)Br 11a_100000207497_100016267368 [0,2,0,0,0,0|1,0,0]=3 10199 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)Br 1626a_100000207497_100016267368 [0,2,0,0,0,0|1,0,0]=3 10200 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)Cl 11a_100000207497_100000184863 [0,2,0,0,0,0|1,0,0]=3 10201 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)Cl 1626a_100000207497_100000184863 [0,2,0,0,0,0|1,0,0]=3 10202 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)Cl 240690a_100000207497_100000184863 [0,2,0,0,0,0|1,0,0]=3 10203 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)F 11a_100000207497_100000182136 [0,2,0,0,0,0|1,0,0]=3 10204 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)F 1626a_100000207497_100000182136 [0,2,0,0,0,0|1,0,0]=3 10205 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)F 240690a_100000207497_100000182136 [0,2,0,0,0,0|1,0,0]=3 10206 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)I 11a_100000207497_100102526154 [0,2,0,0,0,0|1,0,0]=3 10207 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)I 1626a_100000207497_100102526154 [0,2,0,0,0,0|1,0,0]=3 10208 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)I 240690a_100000207497_100102526154 [0,2,0,0,0,0|1,0,0]=3 10209 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cc2)O 240690a_100000207497_100016269017 [0,2,0,0,0,0|1,0,0]=3 10210 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cn2)F 11a_100000207497_100020630499 [0,2,0,0,0,0|2,0,0]=4 10211 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cn2)F 1626a_100000207497_100020630499 [0,2,0,0,0,0|2,0,0]=4 10212 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(cn2)F 240690a_100000207497_100020630499 [0,2,0,0,0,0|2,0,0]=4 10213 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(nc2)Br 11a_100000207497_100020588214 [0,2,0,0,0,0|2,0,0]=4 10214 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(nc2)Br 1626a_100000207497_100020588214 [0,2,0,0,0,0|2,0,0]=4 10215 B22R2.23584 CN(CCc1ccccc1)C(=O)C=Cc2ccc(nc2)Br 240690a_100000207497_100020588214 [0,2,0,0,0,0|2,0,0]=4 10216 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)Br 11a_100000737206_100016267368 [0,2,0,0,0,0|2,0,0]=4 10217 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)Br 1626a_100000737206_100016267368 [0,2,0,0,0,0|2,0,0]=4 10218 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)Cl 11a_100000737206_100000184863 [0,2,0,0,0,0|2,0,0]=4 10219 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)Cl 1626a_100000737206_100000184863 [0,2,0,0,0,0|2,0,0]=4 10220 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)Cl 240690a_100000737206_100000184863 [0,2,0,0,0,0|2,0,0]=4 10221 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)F 11a_100000737206_100000182136 [0,2,0,0,0,0|2,0,0]=4 10222 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)F 1626a_100000737206_100000182136 [0,2,0,0,0,0|2,0,0]=4 10223 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)F 240690a_100000737206_100000182136 [0,2,0,0,0,0|2,0,0]=4 10224 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)I 11a_100000737206_100102526154 [0,2,0,0,0,0|2,0,0]=4 10225 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)I 1626a_100000737206_100102526154 [0,2,0,0,0,0|2,0,0]=4 10226 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)I 240690a_100000737206_100102526154 [0,2,0,0,0,0|2,0,0]=4 10227 B22R2.23584 CN(CCc1ccccn1)C(=O)C=Cc2ccc(cc2)O 240690a_100000737206_100016269017 [0,2,0,0,0,0|2,0,0]=4 10228 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)Br 11a_100000763209_100016267368 [0,2,0,0,0,0|2,0,0]=4 10229 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)Br 1626a_100000763209_100016267368 [0,2,0,0,0,0|2,0,0]=4 10230 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)Cl 11a_100000763209_100000184863 [0,2,0,0,0,0|2,0,0]=4 10231 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)Cl 1626a_100000763209_100000184863 [0,2,0,0,0,0|2,0,0]=4 10232 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)Cl 240690a_100000763209_100000184863 [0,2,0,0,0,0|2,0,0]=4 10233 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)F 11a_100000763209_100000182136 [0,2,0,0,0,0|2,0,0]=4 10234 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)F 1626a_100000763209_100000182136 [0,2,0,0,0,0|2,0,0]=4 10235 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)F 240690a_100000763209_100000182136 [0,2,0,0,0,0|2,0,0]=4 10236 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)I 11a_100000763209_100102526154 [0,2,0,0,0,0|2,0,0]=4 10237 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)I 1626a_100000763209_100102526154 [0,2,0,0,0,0|2,0,0]=4 10238 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)I 240690a_100000763209_100102526154 [0,2,0,0,0,0|2,0,0]=4 10239 B22R2.23584 CN(CCc1cccnc1)C(=O)C=Cc2ccc(cc2)O 240690a_100000763209_100016269017 [0,2,0,0,0,0|2,0,0]=4 10240 B22R2.23584 CN(CCc1ccncc1)C(=O)C=Cc2ccc(cc2)Br 11a_100000742850_100016267368 [0,2,0,0,0,0|2,0,0]=4 10241 B22R2.23584 CN(CCc1ccncc1)C(=O)C=Cc2ccc(cc2)Cl 11a_100000742850_100000184863 [0,2,0,0,0,0|2,0,0]=4 10242 B22R2.23584 CN(CCc1ccncc1)C(=O)C=Cc2ccc(cc2)Cl 240690a_100000742850_100000184863 [0,2,0,0,0,0|2,0,0]=4 10243 B22R2.23584 CN(CCc1ccncc1)C(=O)C=Cc2ccc(cc2)F 11a_100000742850_100000182136 [0,2,0,0,0,0|2,0,0]=4 10244 B22R2.23584 CN(CCc1ccncc1)C(=O)C=Cc2ccc(cc2)F 240690a_100000742850_100000182136 [0,2,0,0,0,0|2,0,0]=4 10245 B22R2.23584 CN(CCc1ccncc1)C(=O)C=Cc2ccc(cc2)I 11a_100000742850_100102526154 [0,2,0,0,0,0|2,0,0]=4 10246 B22R2.23584 CN(CCc1ccncc1)C(=O)C=Cc2ccc(cc2)I 240690a_100000742850_100102526154 [0,2,0,0,0,0|2,0,0]=4 10247 B22R2.23584 CN(CCc1ccncc1)C(=O)C=Cc2ccc(cc2)O 240690a_100000742850_100016269017 [0,2,0,0,0,0|2,0,0]=4 10248 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2ccccc2 11a_100000207497_100000716854 [0,2,0,0,0,0|1,0,0]=3 10249 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2ccccc2 1626a_100000207497_100000716854 [0,2,0,0,0,0|1,0,0]=3 10250 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2ccccc2 240690a_100000207497_100000716854 [0,2,0,0,0,0|1,0,0]=3 10251 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2ccccn2 11a_100000737206_100000716854 [0,2,0,0,0,0|2,0,0]=4 10252 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2ccccn2 1626a_100000737206_100000716854 [0,2,0,0,0,0|2,0,0]=4 10253 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2ccccn2 240690a_100000737206_100000716854 [0,2,0,0,0,0|2,0,0]=4 10254 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2cccnc2 11a_100000763209_100000716854 [0,2,0,0,0,0|2,0,0]=4 10255 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2cccnc2 1626a_100000763209_100000716854 [0,2,0,0,0,0|2,0,0]=4 10256 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2cccnc2 240690a_100000763209_100000716854 [0,2,0,0,0,0|2,0,0]=4 10257 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2ccncc2 11a_100000742850_100000716854 [0,2,0,0,0,0|2,0,0]=4 10258 B22R2.23584 Cc1ccc(cc1)C=CC(=O)N(C)CCc2ccncc2 240690a_100000742850_100000716854 [0,2,0,0,0,0|2,0,0]=4 10259 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)Br)c2ccccc2 11a_100000701038_100016267368 [0,2,0,0,0,0|1,0,0]=3 10260 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)Br)c2ccccc2 1626a_100000701038_100016267368 [0,2,0,0,0,0|1,0,0]=3 10261 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)Cl)c2ccccc2 11a_100000701038_100000184863 [0,2,0,0,0,0|1,0,0]=3 10262 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)Cl)c2ccccc2 1626a_100000701038_100000184863 [0,2,0,0,0,0|1,0,0]=3 10263 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)Cl)c2ccccc2 240690a_100000701038_100000184863 [0,2,0,0,0,0|1,0,0]=3 10264 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)F)c2ccccc2 11a_100000701038_100000182136 [0,2,0,0,0,0|1,0,0]=3 10265 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)F)c2ccccc2 1626a_100000701038_100000182136 [0,2,0,0,0,0|1,0,0]=3 10266 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)F)c2ccccc2 240690a_100000701038_100000182136 [0,2,0,0,0,0|1,0,0]=3 10267 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)I)c2ccccc2 11a_100000701038_100102526154 [0,2,0,0,0,0|1,0,0]=3 10268 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)I)c2ccccc2 1626a_100000701038_100102526154 [0,2,0,0,0,0|1,0,0]=3 10269 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)I)c2ccccc2 240690a_100000701038_100102526154 [0,2,0,0,0,0|1,0,0]=3 10270 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cc1)O)c2ccccc2 240690a_100000701038_100016269017 [0,2,0,0,0,0|1,0,0]=3 10271 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cn1)F)c2ccccc2 11a_100000701038_100020630499 [0,2,0,0,0,0|2,0,0]=4 10272 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cn1)F)c2ccccc2 1626a_100000701038_100020630499 [0,2,0,0,0,0|2,0,0]=4 10273 B22R2.23595 CC(CNC(=O)C=Cc1ccc(cn1)F)c2ccccc2 240690a_100000701038_100020630499 [0,2,0,0,0,0|2,0,0]=4 10274 B22R2.23595 CC(CNC(=O)C=Cc1ccc(nc1)Br)c2ccccc2 11a_100000701038_100020588214 [0,2,0,0,0,0|2,0,0]=4 10275 B22R2.23595 CC(CNC(=O)C=Cc1ccc(nc1)Br)c2ccccc2 1626a_100000701038_100020588214 [0,2,0,0,0,0|2,0,0]=4 10276 B22R2.23595 CC(CNC(=O)C=Cc1ccc(nc1)Br)c2ccccc2 240690a_100000701038_100020588214 [0,2,0,0,0,0|2,0,0]=4 10277 B22R2.23595 Cc1ccc(cc1)C=CC(=O)CCC(=O)c2ccccc2 1458a_100000716854_100000750707 [0,2,0,0,0,0|1,0,1]=4 10278 B22R2.23595 Cc1ccc(cc1)C=CC(=O)CC[C@@H](O)c2ccccc2 1458a_100000716854_100000729684 [0,2,0,0,0,0|1,0,0]=3 10279 B22R2.23595 Cc1ccc(cc1)C=CC(=O)NCC(C)c2ccccc2 11a_100000701038_100000716854 [0,2,0,0,0,0|1,0,0]=3 10280 B22R2.23595 Cc1ccc(cc1)C=CC(=O)NCC(C)c2ccccc2 1626a_100000701038_100000716854 [0,2,0,0,0,0|1,0,0]=3 10281 B22R2.23595 Cc1ccc(cc1)C=CC(=O)NCC(C)c2ccccc2 240690a_100000701038_100000716854 [0,2,0,0,0,0|1,0,0]=3 10282 B22R2.23595 Cc1ccc(cc1)C=CC(=O)NCC(O)c2ccccc2 240690a_100000210709_100000716854 [0,2,0,0,0,0|1,0,0]=3 10283 B22R2.23595 Cc1ccc(cc1)C=CC(=O)NCC(O)c2ccccn2 240690a_100000691469_100000716854 [0,2,0,0,0,0|2,0,0]=4 10284 B22R2.23595 Cc1ccc(cc1)C=CC(=O)NCC(O)c2cccnc2 240690a_100020605170_100000716854 [0,2,0,0,0,0|2,0,0]=4 10285 B22R2.23595 O=C(C=Cc1ccc(cc1)Br)CCC(=O)c2ccccc2 1458a_100016267368_100000750707 [0,2,0,0,0,0|1,0,1]=4 10286 B22R2.23595 O=C(C=Cc1ccc(cc1)Br)CCC(=O)c2ccccc2 6a_100000186029_200011219833 [0,2,0,0,0,0|1,0,1]=4 10287 B22R2.23595 O=C(C=Cc1ccc(cc1)Br)CC[C@@H](O)c2ccccc2 1458a_100016267368_100000729684 [0,2,0,0,0,0|1,0,0]=3 10288 B22R2.23595 O=C(C=Cc1ccc(cc1)Cl)CCC(=O)c2ccccc2 1458a_100000184863_100000750707 [0,2,0,0,0,0|1,0,1]=4 10289 B22R2.23595 O=C(C=Cc1ccc(cc1)Cl)CC[C@@H](O)c2ccccc2 1458a_100000184863_100000729684 [0,2,0,0,0,0|1,0,0]=3 10290 B22R2.23595 O=C(C=Cc1ccc(cc1)Cl)NCC(O)c2ccccc2 240690a_100000210709_100000184863 [0,2,0,0,0,0|1,0,0]=3 10291 B22R2.23595 O=C(C=Cc1ccc(cc1)Cl)NCC(O)c2ccccn2 240690a_100000691469_100000184863 [0,2,0,0,0,0|2,0,0]=4 10292 B22R2.23595 O=C(C=Cc1ccc(cc1)Cl)NCC(O)c2cccnc2 240690a_100020605170_100000184863 [0,2,0,0,0,0|2,0,0]=4 10293 B22R2.23595 O=C(C=Cc1ccc(cc1)F)CCC(=O)c2ccccc2 1458a_100000182136_100000750707 [0,2,0,0,0,0|1,0,1]=4 10294 B22R2.23595 O=C(C=Cc1ccc(cc1)F)CCC(=O)c2ccccc2 6a_100000210084_200011219833 [0,2,0,0,0,0|1,0,1]=4 10295 B22R2.23595 O=C(C=Cc1ccc(cc1)F)CC[C@@H](O)c2ccccc2 1458a_100000182136_100000729684 [0,2,0,0,0,0|1,0,0]=3 10296 B22R2.23595 O=C(C=Cc1ccc(cc1)F)NCC(O)c2ccccc2 240690a_100000210709_100000182136 [0,2,0,0,0,0|1,0,0]=3 10297 B22R2.23595 O=C(C=Cc1ccc(cc1)F)NCC(O)c2ccccn2 240690a_100000691469_100000182136 [0,2,0,0,0,0|2,0,0]=4 10298 B22R2.23595 O=C(C=Cc1ccc(cc1)F)NCC(O)c2cccnc2 240690a_100020605170_100000182136 [0,2,0,0,0,0|2,0,0]=4 10299 B22R2.23595 O=C(C=Cc1ccc(cc1)I)CCC(=O)c2ccccc2 1458a_100102526154_100000750707 [0,2,0,0,0,0|1,0,1]=4 10300 B22R2.23595 O=C(C=Cc1ccc(cc1)I)CCC(=O)c2ccccc2 6a_100000188517_200011219833 [0,2,0,0,0,0|1,0,1]=4 10301 B22R2.23595 O=C(C=Cc1ccc(cc1)I)CC[C@@H](O)c2ccccc2 1458a_100102526154_100000729684 [0,2,0,0,0,0|1,0,0]=3 10302 B22R2.23595 O=C(C=Cc1ccc(cc1)I)NCC(O)c2ccccc2 240690a_100000210709_100102526154 [0,2,0,0,0,0|1,0,0]=3 10303 B22R2.23595 O=C(C=Cc1ccc(cc1)I)NCC(O)c2ccccn2 240690a_100000691469_100102526154 [0,2,0,0,0,0|2,0,0]=4 10304 B22R2.23595 O=C(C=Cc1ccc(cc1)I)NCC(O)c2cccnc2 240690a_100020605170_100102526154 [0,2,0,0,0,0|2,0,0]=4 10305 B22R2.23595 O=C(C=Cc1ccc(cc1)O)NCC(O)c2ccccc2 240690a_100000210709_100016269017 [0,2,0,0,0,0|1,0,0]=3 10306 B22R2.23595 O=C(C=Cc1ccc(cc1)O)NCC(O)c2ccccn2 240690a_100000691469_100016269017 [0,2,0,0,0,0|2,0,0]=4 10307 B22R2.23595 O=C(C=Cc1ccc(cc1)O)NCC(O)c2cccnc2 240690a_100020605170_100016269017 [0,2,0,0,0,0|2,0,0]=4 10308 B22R2.23595 O=C(C=Cc1ccc(cn1)F)CC[C@@H](O)c2ccccc2 1458a_100020630499_100000729684 [0,2,0,0,0,0|2,0,0]=4 10309 B22R2.23595 O=C(C=Cc1ccc(cn1)F)NCC(O)c2ccccc2 240690a_100000210709_100020630499 [0,2,0,0,0,0|2,0,0]=4 10310 B22R2.23595 O=C(C=Cc1ccc(nc1)Br)CC[C@@H](O)c2ccccc2 1458a_100020588214_100000729684 [0,2,0,0,0,0|2,0,0]=4 10311 B22R2.23595 O=C(C=Cc1ccc(nc1)Br)NCC(O)c2ccccc2 240690a_100000210709_100020588214 [0,2,0,0,0,0|2,0,0]=4 10312 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)CCCc2ccccc2 1458a_100053117043_100000211621 [0,2,0,0,0,0|1,0,0]=3 10313 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)CCOc2ccccc2 1458a_100053117043_100000184471 [0,2,0,0,0,0|2,0,0]=4 10314 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)CCSc2ccccc2 1458a_100053117043_100000246102 [0,2,0,0,0,0|2,0,0]=4 10315 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)CSCc2ccccc2 1458a_100053117043_200011217039 [0,2,0,0,0,0|2,0,0]=4 10316 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccccc2 11a_100000106460_100053117043 [0,2,0,0,0,0|1,0,0]=3 10317 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccccc2 1626a_100000106460_100053117043 [0,2,0,0,0,0|1,0,0]=3 10318 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccccc2 240690a_100000106460_100053117043 [0,2,0,0,0,0|1,0,0]=3 10319 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccccc2 527a_100000106460_100053117043 [0,2,0,0,0,0|1,0,0]=3 10320 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccccn2 11a_100000211156_100053117043 [0,2,0,0,0,0|2,0,0]=4 10321 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccccn2 1626a_100000211156_100053117043 [0,2,0,0,0,0|2,0,0]=4 10322 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccccn2 240690a_100000211156_100053117043 [0,2,0,0,0,0|2,0,0]=4 10323 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccccn2 527a_100000211156_100053117043 [0,2,0,0,0,0|2,0,0]=4 10324 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2cccnc2 11a_100000736294_100053117043 [0,2,0,0,0,0|2,0,0]=4 10325 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2cccnc2 1626a_100000736294_100053117043 [0,2,0,0,0,0|2,0,0]=4 10326 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2cccnc2 240690a_100000736294_100053117043 [0,2,0,0,0,0|2,0,0]=4 10327 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2cccnc2 527a_100000736294_100053117043 [0,2,0,0,0,0|2,0,0]=4 10328 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccncc2 11a_100000742849_100053117043 [0,2,0,0,0,0|2,0,0]=4 10329 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccncc2 1626a_100000742849_100053117043 [0,2,0,0,0,0|2,0,0]=4 10330 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccncc2 240690a_100000742849_100053117043 [0,2,0,0,0,0|2,0,0]=4 10331 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NCCc2ccncc2 527a_100000742849_100053117043 [0,2,0,0,0,0|2,0,0]=4 10332 B22R2.23733 C/C(=C\c1ccc(cc1)F)/C(=O)NNCc2ccccc2 22a_100000007032_100053117043 [0,2,0,0,0,0|2,0,0]=4 10333 B22R2.23733 Cc1ccc(cc1)NC(=O)C(=O)CCCc2ccccc2 1458a_100000189662_100000211621 [0,2,0,0,0,0|2,0,0]=4 10334 B22R2.23733 Cc1ccc(cc1)NC(=O)C(=O)NCCc2ccccc2 1626a_100000106460_100000189662 [0,2,0,0,0,0|2,0,0]=4 10335 B22R2.23733 Cc1ccc(cc1)NC(=O)C(=O)NCCc2ccccc2 240690a_100000106460_100000189662 [0,2,0,0,0,0|2,0,0]=4 10336 B22R2.23733 Cc1ccc(cc1)SC(=O)C(=O)NCCc2ccccc2 11a_100000106460_100009913200 [0,2,0,0,0,0|2,0,0]=4 10337 B22R2.23733 Cc1ccc(cc1)SC(=O)C(=O)NCCc2ccccc2 1626a_100000106460_100009913200 [0,2,0,0,0,0|2,0,0]=4 10338 B22R2.23733 Cc1ccc(cc1)SC(=O)C(=O)NCCc2ccccc2 240690a_100000106460_100009913200 [0,2,0,0,0,0|2,0,0]=4 10339 B22R2.23733 Cc1ccc(cc1)SC(=O)C(=O)NCCc2ccccc2 527a_100000106460_100009913200 [0,2,0,0,0,0|2,0,0]=4 10340 B22R2.23733 O=C(NCCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 1626a_100000106460_100000199041 [0,2,0,0,0,0|2,0,0]=4 10341 B22R2.23733 O=C(NCCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 240690a_100000106460_100000199041 [0,2,0,0,0,0|2,0,0]=4 10342 B22R2.23733 O=C(NCCc1ccccc1)C(=O)Nc2ccc(cc2)F 1626a_100000106460_100011297306 [0,2,0,0,0,0|2,0,0]=4 10343 B22R2.23733 O=C(NCCc1ccccc1)C(=O)Nc2ccc(cc2)F 240690a_100000106460_100011297306 [0,2,0,0,0,0|2,0,0]=4 10344 B22R2.518356 Cc1cc(ccc1Br)NCC(=O)OCCc2ccccc2 2230a_100000210723_200000077782 [0,2,0,0,0,0|1,0,1]=4 10345 B22R2.518356 Cc1cc(ccc1Br)NCC(=O)OCCc2ccccc2 34a_100000210723_200000077782 [0,2,0,0,0,0|1,0,1]=4 10346 B22R2.518356 Cc1cc(ccc1Br)NCC(=O)OCCc2ccccc2 7a_100000210723_200000077782 [0,2,0,0,0,0|1,0,1]=4 10347 B22R2.518356 Cc1cc(ccc1Br)OCC(=O)OCCc2ccccc2 34a_100000690111_200000077782 [0,2,0,0,0,0|1,0,1]=4 10348 B22R2.518356 Cc1cc(ccc1Br)OCC(=O)OCCc2ccccc2 7a_100000690111_200000077782 [0,2,0,0,0,0|1,0,1]=4 10349 B22R2.518356 Cc1cc(ccc1Br)SCC(=O)OCCc2ccccc2 62a_100009813585_200000077782 [0,2,0,0,0,0|1,0,1]=4 10350 B22R2.518356 Cc1cc(ccc1Br)SCC(=O)OCCc2ccccc2 62a_200000077782_100009813585 [0,2,0,0,0,0|1,0,1]=4 10351 B22R2.518356 Cc1cc(ccc1Cl)C=CC(=O)COCc2ccccc2 6a_100000698814_100011215004 [0,2,0,0,0,0|2,0,0]=4 10352 B22R2.518356 Cc1cc(ccc1Cl)C=CC(=O)CSCc2ccccc2 6a_100000698814_100000172147 [0,2,0,0,0,0|2,0,0]=4 10353 B22R2.518356 Cc1cc(ccc1Cl)NCC(=O)OCCc2ccccc2 2230a_100000187808_200000077782 [0,2,0,0,0,0|1,0,1]=4 10354 B22R2.518356 Cc1cc(ccc1Cl)NCC(=O)OCCc2ccccc2 34a_100000187808_200000077782 [0,2,0,0,0,0|1,0,1]=4 10355 B22R2.518356 Cc1cc(ccc1Cl)NCC(=O)OCCc2ccccc2 7a_100000187808_200000077782 [0,2,0,0,0,0|1,0,1]=4 10356 B22R2.518356 Cc1cc(ccc1Cl)OCC(=O)OCCc2ccccc2 34a_100000211092_200000077782 [0,2,0,0,0,0|1,0,1]=4 10357 B22R2.518356 Cc1cc(ccc1Cl)OCC(=O)OCCc2ccccc2 7a_100000211092_200000077782 [0,2,0,0,0,0|1,0,1]=4 10358 B22R2.518356 Cc1cc(ccc1Cl)SCC(=O)OCCc2ccccc2 62a_100000049509_200000077782 [0,2,0,0,0,0|1,0,1]=4 10359 B22R2.518356 Cc1cc(ccc1Cl)SCC(=O)OCCc2ccccc2 62a_200000077782_100000049509 [0,2,0,0,0,0|1,0,1]=4 10360 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)CCCc2ccccc2 1458a_100016261966_100000211621 [0,2,0,0,0,0|1,0,0]=3 10361 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)CCOc2ccccc2 1458a_100016261966_100000184471 [0,2,0,0,0,0|2,0,0]=4 10362 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)CCSc2ccccc2 1458a_100016261966_100000246102 [0,2,0,0,0,0|2,0,0]=4 10363 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)COCc2ccccc2 6a_100000748208_100011215004 [0,2,0,0,0,0|2,0,0]=4 10364 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)CSCc2ccccc2 1458a_100016261966_200011217039 [0,2,0,0,0,0|2,0,0]=4 10365 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)CSCc2ccccc2 6a_100000748208_100000172147 [0,2,0,0,0,0|2,0,0]=4 10366 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccccc2 11a_100000106460_100016261966 [0,2,0,0,0,0|1,0,0]=3 10367 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100016261966 [0,2,0,0,0,0|1,0,0]=3 10368 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100016261966 [0,2,0,0,0,0|1,0,0]=3 10369 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccccn2 11a_100000211156_100016261966 [0,2,0,0,0,0|2,0,0]=4 10370 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100016261966 [0,2,0,0,0,0|2,0,0]=4 10371 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100016261966 [0,2,0,0,0,0|2,0,0]=4 10372 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2cccnc2 11a_100000736294_100016261966 [0,2,0,0,0,0|2,0,0]=4 10373 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100016261966 [0,2,0,0,0,0|2,0,0]=4 10374 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100016261966 [0,2,0,0,0,0|2,0,0]=4 10375 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccncc2 11a_100000742849_100016261966 [0,2,0,0,0,0|2,0,0]=4 10376 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100016261966 [0,2,0,0,0,0|2,0,0]=4 10377 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100016261966 [0,2,0,0,0,0|2,0,0]=4 10378 B22R2.518356 Cc1cc(ccc1F)C=CC(=O)NNCc2ccccc2 22a_100000007032_100016261966 [0,2,0,0,0,0|2,0,0]=4 10379 B22R2.518356 Cc1cc(ccc1F)NCC(=O)OCCc2ccccc2 2230a_100000750164_200000077782 [0,2,0,0,0,0|1,0,1]=4 10380 B22R2.518356 Cc1cc(ccc1F)NCC(=O)OCCc2ccccc2 34a_100000750164_200000077782 [0,2,0,0,0,0|1,0,1]=4 10381 B22R2.518356 Cc1cc(ccc1F)NCC(=O)OCCc2ccccc2 7a_100000750164_200000077782 [0,2,0,0,0,0|1,0,1]=4 10382 B22R2.518356 Cc1cc(ccc1F)OCC(=O)OCCc2ccccc2 34a_100000751312_200000077782 [0,2,0,0,0,0|1,0,1]=4 10383 B22R2.518356 Cc1cc(ccc1F)OCC(=O)OCCc2ccccc2 7a_100000751312_200000077782 [0,2,0,0,0,0|1,0,1]=4 10384 B22R2.518356 Cc1cc(ccc1F)SCC(=O)OCCc2ccccc2 62a_100011218330_200000077782 [0,2,0,0,0,0|1,0,1]=4 10385 B22R2.518356 Cc1cc(ccc1F)SCC(=O)OCCc2ccccc2 62a_200000077782_100011218330 [0,2,0,0,0,0|1,0,1]=4 10386 B22R2.518356 Cc1cc(ccc1I)NCC(=O)OCCc2ccccc2 34a_100000198070_200000077782 [0,2,0,0,0,0|1,0,1]=4 10387 B22R2.518356 Cc1cc(ccc1I)NCC(=O)OCCc2ccccc2 7a_100000198070_200000077782 [0,2,0,0,0,0|1,0,1]=4 10388 B22R2.518356 Cc1cc(ccc1I)OCC(=O)OCCc2ccccc2 34a_100000729255_200000077782 [0,2,0,0,0,0|1,0,1]=4 10389 B22R2.518356 Cc1cc(ccc1I)OCC(=O)OCCc2ccccc2 7a_100000729255_200000077782 [0,2,0,0,0,0|1,0,1]=4 10390 B22R2.518356 Cc1cc(ccc1N)OCC(=O)OCCc2ccccc2 34a_100000756630_200000077782 [0,2,0,0,0,0|1,0,1]=4 10391 B22R2.518356 Cc1cc(ccc1N)OCC(=O)OCCc2ccccc2 7a_100000756630_200000077782 [0,2,0,0,0,0|1,0,1]=4 10392 B22R2.518356 Cc1cc(ccc1N)SCC(=O)OCCc2ccccc2 62a_100000211769_200000077782 [0,2,0,0,0,0|1,0,1]=4 10393 B22R2.518356 Cc1cc(ccc1N)SCC(=O)OCCc2ccccc2 62a_200000077782_100000211769 [0,2,0,0,0,0|1,0,1]=4 10394 B22R2.518356 Cc1cc(ccc1O)NCC(=O)OCCc2ccccc2 34a_100011218179_200000077782 [0,2,0,0,0,0|1,0,1]=4 10395 B22R2.518356 Cc1cc(ccc1O)NCC(=O)OCCc2ccccc2 7a_100011218179_200000077782 [0,2,0,0,0,0|1,0,1]=4 10396 B22R2.518356 Cc1cc(ccc1O)SCC(=O)OCCc2ccccc2 62a_200000077782_100000186361 [0,2,0,0,0,0|1,0,1]=4 10397 B22R2.518356 Cc1ccc(cc1Br)NCC(=O)OCCc2ccccc2 2230a_100000736455_200000077782 [0,2,0,0,0,0|1,0,1]=4 10398 B22R2.518356 Cc1ccc(cc1Br)NCC(=O)OCCc2ccccc2 34a_100000736455_200000077782 [0,2,0,0,0,0|1,0,1]=4 10399 B22R2.518356 Cc1ccc(cc1Br)NCC(=O)OCCc2ccccc2 7a_100000736455_200000077782 [0,2,0,0,0,0|1,0,1]=4 10400 B22R2.518356 Cc1ccc(cc1Br)OCC(=O)OCCc2ccccc2 34a_100011380479_200000077782 [0,2,0,0,0,0|1,0,1]=4 10401 B22R2.518356 Cc1ccc(cc1Br)OCC(=O)OCCc2ccccc2 7a_100011380479_200000077782 [0,2,0,0,0,0|1,0,1]=4 10402 B22R2.518356 Cc1ccc(cc1Br)SCC(=O)OCCc2ccccc2 62a_100011847877_200000077782 [0,2,0,0,0,0|1,0,1]=4 10403 B22R2.518356 Cc1ccc(cc1Br)SCC(=O)OCCc2ccccc2 62a_200000077782_100011847877 [0,2,0,0,0,0|1,0,1]=4 10404 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)CCCc2ccccc2 1458a_100011338269_100000211621 [0,2,0,0,0,0|1,0,0]=3 10405 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)CCOc2ccccc2 1458a_100011338269_100000184471 [0,2,0,0,0,0|2,0,0]=4 10406 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)CCSc2ccccc2 1458a_100011338269_100000246102 [0,2,0,0,0,0|2,0,0]=4 10407 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)COCc2ccccc2 6a_100000229942_100011215004 [0,2,0,0,0,0|2,0,0]=4 10408 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)CSCc2ccccc2 1458a_100011338269_200011217039 [0,2,0,0,0,0|2,0,0]=4 10409 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)CSCc2ccccc2 6a_100000229942_100000172147 [0,2,0,0,0,0|2,0,0]=4 10410 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccccc2 11a_100000106460_100011338269 [0,2,0,0,0,0|1,0,0]=3 10411 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100011338269 [0,2,0,0,0,0|1,0,0]=3 10412 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100011338269 [0,2,0,0,0,0|1,0,0]=3 10413 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccccn2 11a_100000211156_100011338269 [0,2,0,0,0,0|2,0,0]=4 10414 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100011338269 [0,2,0,0,0,0|2,0,0]=4 10415 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100011338269 [0,2,0,0,0,0|2,0,0]=4 10416 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2cccnc2 11a_100000736294_100011338269 [0,2,0,0,0,0|2,0,0]=4 10417 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100011338269 [0,2,0,0,0,0|2,0,0]=4 10418 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100011338269 [0,2,0,0,0,0|2,0,0]=4 10419 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccncc2 11a_100000742849_100011338269 [0,2,0,0,0,0|2,0,0]=4 10420 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100011338269 [0,2,0,0,0,0|2,0,0]=4 10421 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100011338269 [0,2,0,0,0,0|2,0,0]=4 10422 B22R2.518356 Cc1ccc(cc1C)C=CC(=O)NNCc2ccccc2 22a_100000007032_100011338269 [0,2,0,0,0,0|2,0,0]=4 10423 B22R2.518356 Cc1ccc(cc1C)NCC(=O)OCCc2ccccc2 2230a_100000724040_200000077782 [0,2,0,0,0,0|1,0,1]=4 10424 B22R2.518356 Cc1ccc(cc1C)NCC(=O)OCCc2ccccc2 34a_100000724040_200000077782 [0,2,0,0,0,0|1,0,1]=4 10425 B22R2.518356 Cc1ccc(cc1C)NCC(=O)OCCc2ccccc2 7a_100000724040_200000077782 [0,2,0,0,0,0|1,0,1]=4 10426 B22R2.518356 Cc1ccc(cc1C)OCC(=O)OCCc2ccccc2 34a_100000210932_200000077782 [0,2,0,0,0,0|1,0,1]=4 10427 B22R2.518356 Cc1ccc(cc1C)OCC(=O)OCCc2ccccc2 7a_100000210932_200000077782 [0,2,0,0,0,0|1,0,1]=4 10428 B22R2.518356 Cc1ccc(cc1C)SCC(=O)OCCc2ccccc2 62a_100011215607_200000077782 [0,2,0,0,0,0|1,0,1]=4 10429 B22R2.518356 Cc1ccc(cc1C)SCC(=O)OCCc2ccccc2 62a_200000077782_100011215607 [0,2,0,0,0,0|1,0,1]=4 10430 B22R2.518356 Cc1ccc(cc1Cl)C=CC(=O)COCc2ccccc2 6a_100000760539_100011215004 [0,2,0,0,0,0|2,0,0]=4 10431 B22R2.518356 Cc1ccc(cc1Cl)C=CC(=O)CSCc2ccccc2 6a_100000760539_100000172147 [0,2,0,0,0,0|2,0,0]=4 10432 B22R2.518356 Cc1ccc(cc1Cl)NCC(=O)OCCc2ccccc2 2230a_100000188892_200000077782 [0,2,0,0,0,0|1,0,1]=4 10433 B22R2.518356 Cc1ccc(cc1Cl)NCC(=O)OCCc2ccccc2 34a_100000188892_200000077782 [0,2,0,0,0,0|1,0,1]=4 10434 B22R2.518356 Cc1ccc(cc1Cl)NCC(=O)OCCc2ccccc2 7a_100000188892_200000077782 [0,2,0,0,0,0|1,0,1]=4 10435 B22R2.518356 Cc1ccc(cc1Cl)OCC(=O)OCCc2ccccc2 34a_100011265682_200000077782 [0,2,0,0,0,0|1,0,1]=4 10436 B22R2.518356 Cc1ccc(cc1Cl)OCC(=O)OCCc2ccccc2 7a_100011265682_200000077782 [0,2,0,0,0,0|1,0,1]=4 10437 B22R2.518356 Cc1ccc(cc1Cl)SCC(=O)OCCc2ccccc2 62a_100011216363_200000077782 [0,2,0,0,0,0|1,0,1]=4 10438 B22R2.518356 Cc1ccc(cc1Cl)SCC(=O)OCCc2ccccc2 62a_200000077782_100011216363 [0,2,0,0,0,0|1,0,1]=4 10439 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)CCCc2ccccc2 1458a_100102526211_100000211621 [0,2,0,0,0,0|1,0,0]=3 10440 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)CCOc2ccccc2 1458a_100102526211_100000184471 [0,2,0,0,0,0|2,0,0]=4 10441 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)CCSc2ccccc2 1458a_100102526211_100000246102 [0,2,0,0,0,0|2,0,0]=4 10442 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)COCc2ccccc2 6a_100000753222_100011215004 [0,2,0,0,0,0|2,0,0]=4 10443 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)CSCc2ccccc2 1458a_100102526211_200011217039 [0,2,0,0,0,0|2,0,0]=4 10444 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)CSCc2ccccc2 6a_100000753222_100000172147 [0,2,0,0,0,0|2,0,0]=4 10445 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccccc2 11a_100000106460_100102526211 [0,2,0,0,0,0|1,0,0]=3 10446 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100102526211 [0,2,0,0,0,0|1,0,0]=3 10447 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100102526211 [0,2,0,0,0,0|1,0,0]=3 10448 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccccn2 11a_100000211156_100102526211 [0,2,0,0,0,0|2,0,0]=4 10449 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100102526211 [0,2,0,0,0,0|2,0,0]=4 10450 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100102526211 [0,2,0,0,0,0|2,0,0]=4 10451 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2cccnc2 11a_100000736294_100102526211 [0,2,0,0,0,0|2,0,0]=4 10452 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100102526211 [0,2,0,0,0,0|2,0,0]=4 10453 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100102526211 [0,2,0,0,0,0|2,0,0]=4 10454 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccncc2 11a_100000742849_100102526211 [0,2,0,0,0,0|2,0,0]=4 10455 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100102526211 [0,2,0,0,0,0|2,0,0]=4 10456 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100102526211 [0,2,0,0,0,0|2,0,0]=4 10457 B22R2.518356 Cc1ccc(cc1F)C=CC(=O)NNCc2ccccc2 22a_100000007032_100102526211 [0,2,0,0,0,0|2,0,0]=4 10458 B22R2.518356 Cc1ccc(cc1F)NCC(=O)OCCc2ccccc2 2230a_100000210958_200000077782 [0,2,0,0,0,0|1,0,1]=4 10459 B22R2.518356 Cc1ccc(cc1F)NCC(=O)OCCc2ccccc2 34a_100000210958_200000077782 [0,2,0,0,0,0|1,0,1]=4 10460 B22R2.518356 Cc1ccc(cc1F)NCC(=O)OCCc2ccccc2 7a_100000210958_200000077782 [0,2,0,0,0,0|1,0,1]=4 10461 B22R2.518356 Cc1ccc(cc1F)OCC(=O)OCCc2ccccc2 34a_100000722560_200000077782 [0,2,0,0,0,0|1,0,1]=4 10462 B22R2.518356 Cc1ccc(cc1F)OCC(=O)OCCc2ccccc2 7a_100000722560_200000077782 [0,2,0,0,0,0|1,0,1]=4 10463 B22R2.518356 Cc1ccc(cc1F)SCC(=O)OCCc2ccccc2 62a_100000720648_200000077782 [0,2,0,0,0,0|1,0,1]=4 10464 B22R2.518356 Cc1ccc(cc1F)SCC(=O)OCCc2ccccc2 62a_200000077782_100000720648 [0,2,0,0,0,0|1,0,1]=4 10465 B22R2.518356 Cc1ccc(cc1I)C=CC(=O)COCc2ccccc2 6a_100010197721_100011215004 [0,2,0,0,0,0|2,0,0]=4 10466 B22R2.518356 Cc1ccc(cc1I)C=CC(=O)CSCc2ccccc2 6a_100010197721_100000172147 [0,2,0,0,0,0|2,0,0]=4 10467 B22R2.518356 Cc1ccc(cc1I)NCC(=O)OCCc2ccccc2 34a_100000184131_200000077782 [0,2,0,0,0,0|1,0,1]=4 10468 B22R2.518356 Cc1ccc(cc1I)NCC(=O)OCCc2ccccc2 7a_100000184131_200000077782 [0,2,0,0,0,0|1,0,1]=4 10469 B22R2.518356 Cc1ccc(cc1N)OCC(=O)OCCc2ccccc2 34a_100011216113_200000077782 [0,2,0,0,0,0|1,0,1]=4 10470 B22R2.518356 Cc1ccc(cc1N)OCC(=O)OCCc2ccccc2 7a_100011216113_200000077782 [0,2,0,0,0,0|1,0,1]=4 10471 B22R2.518356 Cc1ccc(cc1N)SCC(=O)OCCc2ccccc2 62a_100000761890_200000077782 [0,2,0,0,0,0|1,0,1]=4 10472 B22R2.518356 Cc1ccc(cc1N)SCC(=O)OCCc2ccccc2 62a_200000077782_100000761890 [0,2,0,0,0,0|1,0,1]=4 10473 B22R2.518356 Cc1ccc(cc1O)NCC(=O)OCCc2ccccc2 34a_100000759471_200000077782 [0,2,0,0,0,0|1,0,1]=4 10474 B22R2.518356 Cc1ccc(cc1O)NCC(=O)OCCc2ccccc2 7a_100000759471_200000077782 [0,2,0,0,0,0|1,0,1]=4 10475 B22R2.518356 Cc1ccc(cc1O)SCC(=O)OCCc2ccccc2 62a_100000685420_200000077782 [0,2,0,0,0,0|1,0,1]=4 10476 B22R2.518356 Cc1ccc(cc1O)SCC(=O)OCCc2ccccc2 62a_200000077782_100000685420 [0,2,0,0,0,0|1,0,1]=4 10477 B22R2.518356 Nc1cc(ccc1Br)OCC(=O)OCCc2ccccc2 34a_100011999798_200000077782 [0,2,0,0,0,0|1,0,1]=4 10478 B22R2.518356 Nc1cc(ccc1Br)OCC(=O)OCCc2ccccc2 7a_100011999798_200000077782 [0,2,0,0,0,0|1,0,1]=4 10479 B22R2.518356 Nc1cc(ccc1Br)SCC(=O)OCCc2ccccc2 62a_100000750456_200000077782 [0,2,0,0,0,0|1,0,1]=4 10480 B22R2.518356 Nc1cc(ccc1Br)SCC(=O)OCCc2ccccc2 62a_200000077782_100000750456 [0,2,0,0,0,0|1,0,1]=4 10481 B22R2.518356 Nc1cc(ccc1Cl)OCC(=O)OCCc2ccccc2 34a_100011934297_200000077782 [0,2,0,0,0,0|1,0,1]=4 10482 B22R2.518356 Nc1cc(ccc1Cl)SCC(=O)OCCc2ccccc2 62a_200000077782_200000761891 [0,2,0,0,0,0|1,0,1]=4 10483 B22R2.518356 Nc1cc(ccc1Cl)SCC(=O)OCCc2ccccc2 62a_200000761891_200000077782 [0,2,0,0,0,0|1,0,1]=4 10484 B22R2.518356 Nc1cc(ccc1F)OCC(=O)OCCc2ccccc2 34a_100012017239_200000077782 [0,2,0,0,0,0|1,0,1]=4 10485 B22R2.518356 Nc1cc(ccc1F)OCC(=O)OCCc2ccccc2 7a_100012017239_200000077782 [0,2,0,0,0,0|1,0,1]=4 10486 B22R2.518356 Nc1cc(ccc1F)SCC(=O)OCCc2ccccc2 62a_100000740924_200000077782 [0,2,0,0,0,0|1,0,1]=4 10487 B22R2.518356 Nc1cc(ccc1F)SCC(=O)OCCc2ccccc2 62a_200000077782_100000740924 [0,2,0,0,0,0|1,0,1]=4 10488 B22R2.518356 Nc1cc(ccc1O)SCC(=O)OCCc2ccccc2 62a_100000752626_200000077782 [0,2,0,0,0,0|1,0,1]=4 10489 B22R2.518356 Nc1cc(ccc1O)SCC(=O)OCCc2ccccc2 62a_200000077782_100000752626 [0,2,0,0,0,0|1,0,1]=4 10490 B22R2.518356 Nc1ccc(cc1Br)OCC(=O)OCCc2ccccc2 34a_100012001276_200000077782 [0,2,0,0,0,0|1,0,1]=4 10491 B22R2.518356 Nc1ccc(cc1Br)OCC(=O)OCCc2ccccc2 7a_100012001276_200000077782 [0,2,0,0,0,0|1,0,1]=4 10492 B22R2.518356 Nc1ccc(cc1Br)SCC(=O)OCCc2ccccc2 62a_100000750455_200000077782 [0,2,0,0,0,0|1,0,1]=4 10493 B22R2.518356 Nc1ccc(cc1Br)SCC(=O)OCCc2ccccc2 62a_200000077782_100000750455 [0,2,0,0,0,0|1,0,1]=4 10494 B22R2.518356 Nc1ccc(cc1Cl)OCC(=O)OCCc2ccccc2 34a_100011215599_200000077782 [0,2,0,0,0,0|1,0,1]=4 10495 B22R2.518356 Nc1ccc(cc1Cl)OCC(=O)OCCc2ccccc2 7a_100011215599_200000077782 [0,2,0,0,0,0|1,0,1]=4 10496 B22R2.518356 Nc1ccc(cc1Cl)SCC(=O)OCCc2ccccc2 62a_100011218065_200000077782 [0,2,0,0,0,0|1,0,1]=4 10497 B22R2.518356 Nc1ccc(cc1Cl)SCC(=O)OCCc2ccccc2 62a_200000077782_100011218065 [0,2,0,0,0,0|1,0,1]=4 10498 B22R2.518356 Nc1ccc(cc1F)OCC(=O)OCCc2ccccc2 34a_100000759473_200000077782 [0,2,0,0,0,0|1,0,1]=4 10499 B22R2.518356 Nc1ccc(cc1F)OCC(=O)OCCc2ccccc2 7a_100000759473_200000077782 [0,2,0,0,0,0|1,0,1]=4 10500 B22R2.518356 Nc1ccc(cc1F)SCC(=O)OCCc2ccccc2 62a_100011215594_200000077782 [0,2,0,0,0,0|1,0,1]=4 10501 B22R2.518356 Nc1ccc(cc1F)SCC(=O)OCCc2ccccc2 62a_200000077782_100011215594 [0,2,0,0,0,0|1,0,1]=4 10502 B22R2.518356 Nc1ccc(cc1I)OCC(=O)OCCc2ccccc2 34a_100010084370_200000077782 [0,2,0,0,0,0|1,0,1]=4 10503 B22R2.518356 Nc1ccc(cc1I)OCC(=O)OCCc2ccccc2 7a_100010084370_200000077782 [0,2,0,0,0,0|1,0,1]=4 10504 B22R2.518356 Nc1ccc(cc1N)OCC(=O)OCCc2ccccc2 34a_100025771000_200000077782 [0,2,0,0,0,0|1,0,1]=4 10505 B22R2.518356 Nc1ccc(cc1N)SCC(=O)OCCc2ccccc2 62a_100000741789_200000077782 [0,2,0,0,0,0|1,0,1]=4 10506 B22R2.518356 Nc1ccc(cc1N)SCC(=O)OCCc2ccccc2 62a_200000077782_100011534411 [0,2,0,0,0,0|1,0,1]=4 10507 B22R2.518356 Nc1ccc(cc1O)SCC(=O)OCCc2ccccc2 62a_100000739049_200000077782 [0,2,0,0,0,0|1,0,1]=4 10508 B22R2.518356 Nc1ccc(cc1O)SCC(=O)OCCc2ccccc2 62a_200000077782_100000739049 [0,2,0,0,0,0|1,0,1]=4 10509 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)CCCc2ccccc2 1458a_100102889548_100000211621 [0,2,0,0,0,0|1,0,0]=3 10510 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)CCOc2ccccc2 1458a_100102889548_100000184471 [0,2,0,0,0,0|2,0,0]=4 10511 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)CCSc2ccccc2 1458a_100102889548_100000246102 [0,2,0,0,0,0|2,0,0]=4 10512 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)COCc2ccccc2 6a_100000693810_100011215004 [0,2,0,0,0,0|2,0,0]=4 10513 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)CSCc2ccccc2 1458a_100102889548_200011217039 [0,2,0,0,0,0|2,0,0]=4 10514 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)CSCc2ccccc2 6a_100000693810_100000172147 [0,2,0,0,0,0|2,0,0]=4 10515 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccccc2 11a_100000106460_100102889548 [0,2,0,0,0,0|1,0,0]=3 10516 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccccc2 1626a_100000106460_100102889548 [0,2,0,0,0,0|1,0,0]=3 10517 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccccc2 240690a_100000106460_100102889548 [0,2,0,0,0,0|1,0,0]=3 10518 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccccn2 11a_100000211156_100102889548 [0,2,0,0,0,0|2,0,0]=4 10519 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccccn2 1626a_100000211156_100102889548 [0,2,0,0,0,0|2,0,0]=4 10520 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccccn2 240690a_100000211156_100102889548 [0,2,0,0,0,0|2,0,0]=4 10521 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2cccnc2 11a_100000736294_100102889548 [0,2,0,0,0,0|2,0,0]=4 10522 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2cccnc2 1626a_100000736294_100102889548 [0,2,0,0,0,0|2,0,0]=4 10523 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2cccnc2 240690a_100000736294_100102889548 [0,2,0,0,0,0|2,0,0]=4 10524 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccncc2 11a_100000742849_100102889548 [0,2,0,0,0,0|2,0,0]=4 10525 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccncc2 1626a_100000742849_100102889548 [0,2,0,0,0,0|2,0,0]=4 10526 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NCCc2ccncc2 240690a_100000742849_100102889548 [0,2,0,0,0,0|2,0,0]=4 10527 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)Cl)NNCc2ccccc2 22a_100000007032_100102889548 [0,2,0,0,0,0|2,0,0]=4 10528 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)CCCc2ccccc2 1458a_100011195070_100000211621 [0,2,0,0,0,0|1,0,0]=3 10529 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)CCOc2ccccc2 1458a_100011195070_100000184471 [0,2,0,0,0,0|2,0,0]=4 10530 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)CCSc2ccccc2 1458a_100011195070_100000246102 [0,2,0,0,0,0|2,0,0]=4 10531 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)COCc2ccccc2 6a_100000211747_100011215004 [0,2,0,0,0,0|2,0,0]=4 10532 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)CSCc2ccccc2 1458a_100011195070_200011217039 [0,2,0,0,0,0|2,0,0]=4 10533 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)CSCc2ccccc2 6a_100000211747_100000172147 [0,2,0,0,0,0|2,0,0]=4 10534 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccccc2 11a_100000106460_100011195070 [0,2,0,0,0,0|1,0,0]=3 10535 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccccc2 1626a_100000106460_100011195070 [0,2,0,0,0,0|1,0,0]=3 10536 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccccc2 240690a_100000106460_100011195070 [0,2,0,0,0,0|1,0,0]=3 10537 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccccn2 11a_100000211156_100011195070 [0,2,0,0,0,0|2,0,0]=4 10538 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccccn2 1626a_100000211156_100011195070 [0,2,0,0,0,0|2,0,0]=4 10539 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccccn2 240690a_100000211156_100011195070 [0,2,0,0,0,0|2,0,0]=4 10540 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2cccnc2 11a_100000736294_100011195070 [0,2,0,0,0,0|2,0,0]=4 10541 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2cccnc2 1626a_100000736294_100011195070 [0,2,0,0,0,0|2,0,0]=4 10542 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2cccnc2 240690a_100000736294_100011195070 [0,2,0,0,0,0|2,0,0]=4 10543 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccncc2 11a_100000742849_100011195070 [0,2,0,0,0,0|2,0,0]=4 10544 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccncc2 1626a_100000742849_100011195070 [0,2,0,0,0,0|2,0,0]=4 10545 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NCCc2ccncc2 240690a_100000742849_100011195070 [0,2,0,0,0,0|2,0,0]=4 10546 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)F)NNCc2ccccc2 22a_100000007032_100011195070 [0,2,0,0,0,0|2,0,0]=4 10547 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)CCCc2ccccc2 1458a_200103079279_100000211621 [0,2,0,0,0,0|1,0,0]=3 10548 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)CCOc2ccccc2 1458a_200103079279_100000184471 [0,2,0,0,0,0|2,0,0]=4 10549 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)CCSc2ccccc2 1458a_200103079279_100000246102 [0,2,0,0,0,0|2,0,0]=4 10550 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)CSCc2ccccc2 1458a_200103079279_200011217039 [0,2,0,0,0,0|2,0,0]=4 10551 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)NCCc2ccccc2 240690a_100000106460_200103079279 [0,2,0,0,0,0|1,0,0]=3 10552 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)NCCc2ccccn2 240690a_100000211156_200103079279 [0,2,0,0,0,0|2,0,0]=4 10553 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)NCCc2cccnc2 240690a_100000736294_200103079279 [0,2,0,0,0,0|2,0,0]=4 10554 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)NCCc2ccncc2 240690a_100000742849_200103079279 [0,2,0,0,0,0|2,0,0]=4 10555 B22R2.518356 O=C(C=Cc1ccc(c(c1)Br)O)NNCc2ccccc2 22a_100000007032_200103079279 [0,2,0,0,0,0|2,0,0]=4 10556 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCCc2ccccc2 1458a_100000716972_100000211621 [0,2,0,0,0,0|1,0,0]=3 10557 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCOc2ccccc2 1458a_100000716972_100000184471 [0,2,0,0,0,0|2,0,0]=4 10558 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCSc2ccccc2 1458a_100000716972_100000246102 [0,2,0,0,0,0|2,0,0]=4 10559 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)COCc2ccccc2 6a_100000188533_100011215004 [0,2,0,0,0,0|2,0,0]=4 10560 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)CSCc2ccccc2 1458a_100000716972_200011217039 [0,2,0,0,0,0|2,0,0]=4 10561 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)CSCc2ccccc2 6a_100000188533_100000172147 [0,2,0,0,0,0|2,0,0]=4 10562 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccccc2 11a_100000106460_100000716972 [0,2,0,0,0,0|1,0,0]=3 10563 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccccc2 1626a_100000106460_100000716972 [0,2,0,0,0,0|1,0,0]=3 10564 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccccc2 240690a_100000106460_100000716972 [0,2,0,0,0,0|1,0,0]=3 10565 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccccn2 11a_100000211156_100000716972 [0,2,0,0,0,0|2,0,0]=4 10566 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccccn2 1626a_100000211156_100000716972 [0,2,0,0,0,0|2,0,0]=4 10567 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccccn2 240690a_100000211156_100000716972 [0,2,0,0,0,0|2,0,0]=4 10568 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2cccnc2 11a_100000736294_100000716972 [0,2,0,0,0,0|2,0,0]=4 10569 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2cccnc2 1626a_100000736294_100000716972 [0,2,0,0,0,0|2,0,0]=4 10570 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2cccnc2 240690a_100000736294_100000716972 [0,2,0,0,0,0|2,0,0]=4 10571 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccncc2 11a_100000742849_100000716972 [0,2,0,0,0,0|2,0,0]=4 10572 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccncc2 1626a_100000742849_100000716972 [0,2,0,0,0,0|2,0,0]=4 10573 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NCCc2ccncc2 240690a_100000742849_100000716972 [0,2,0,0,0,0|2,0,0]=4 10574 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)Cl)NNCc2ccccc2 22a_100000007032_100000716972 [0,2,0,0,0,0|2,0,0]=4 10575 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)CCCc2ccccc2 1458a_100102525453_100000211621 [0,2,0,0,0,0|1,0,0]=3 10576 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)CCOc2ccccc2 1458a_100102525453_100000184471 [0,2,0,0,0,0|2,0,0]=4 10577 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)CCSc2ccccc2 1458a_100102525453_100000246102 [0,2,0,0,0,0|2,0,0]=4 10578 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)COCc2ccccc2 6a_100000742290_100011215004 [0,2,0,0,0,0|2,0,0]=4 10579 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)CSCc2ccccc2 1458a_100102525453_200011217039 [0,2,0,0,0,0|2,0,0]=4 10580 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)CSCc2ccccc2 6a_100000742290_100000172147 [0,2,0,0,0,0|2,0,0]=4 10581 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccccc2 11a_100000106460_100102525453 [0,2,0,0,0,0|1,0,0]=3 10582 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccccc2 1626a_100000106460_100102525453 [0,2,0,0,0,0|1,0,0]=3 10583 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccccc2 240690a_100000106460_100102525453 [0,2,0,0,0,0|1,0,0]=3 10584 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccccn2 11a_100000211156_100102525453 [0,2,0,0,0,0|2,0,0]=4 10585 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccccn2 1626a_100000211156_100102525453 [0,2,0,0,0,0|2,0,0]=4 10586 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccccn2 240690a_100000211156_100102525453 [0,2,0,0,0,0|2,0,0]=4 10587 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2cccnc2 11a_100000736294_100102525453 [0,2,0,0,0,0|2,0,0]=4 10588 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2cccnc2 1626a_100000736294_100102525453 [0,2,0,0,0,0|2,0,0]=4 10589 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2cccnc2 240690a_100000736294_100102525453 [0,2,0,0,0,0|2,0,0]=4 10590 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccncc2 11a_100000742849_100102525453 [0,2,0,0,0,0|2,0,0]=4 10591 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccncc2 1626a_100000742849_100102525453 [0,2,0,0,0,0|2,0,0]=4 10592 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NCCc2ccncc2 240690a_100000742849_100102525453 [0,2,0,0,0,0|2,0,0]=4 10593 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)F)NNCc2ccccc2 22a_100000007032_100102525453 [0,2,0,0,0,0|2,0,0]=4 10594 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)CCCc2ccccc2 1458a_200103117615_100000211621 [0,2,0,0,0,0|1,0,0]=3 10595 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)CCOc2ccccc2 1458a_200103117615_100000184471 [0,2,0,0,0,0|2,0,0]=4 10596 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)CCSc2ccccc2 1458a_200103117615_100000246102 [0,2,0,0,0,0|2,0,0]=4 10597 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)COCc2ccccc2 6a_100000186751_100011215004 [0,2,0,0,0,0|2,0,0]=4 10598 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)CSCc2ccccc2 1458a_200103117615_200011217039 [0,2,0,0,0,0|2,0,0]=4 10599 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)CSCc2ccccc2 6a_100000186751_100000172147 [0,2,0,0,0,0|2,0,0]=4 10600 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)NCCc2ccccc2 240690a_100000106460_200103117615 [0,2,0,0,0,0|1,0,0]=3 10601 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)NCCc2ccccn2 240690a_100000211156_200103117615 [0,2,0,0,0,0|2,0,0]=4 10602 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)NCCc2cccnc2 240690a_100000736294_200103117615 [0,2,0,0,0,0|2,0,0]=4 10603 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)NCCc2ccncc2 240690a_100000742849_200103117615 [0,2,0,0,0,0|2,0,0]=4 10604 B22R2.518356 O=C(C=Cc1ccc(c(c1)Cl)O)NNCc2ccccc2 22a_100000007032_200103117615 [0,2,0,0,0,0|2,0,0]=4 10605 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)CCCc2ccccc2 1458a_100102601611_100000211621 [0,2,0,0,0,0|1,0,0]=3 10606 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)CCOc2ccccc2 1458a_100102601611_100000184471 [0,2,0,0,0,0|2,0,0]=4 10607 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)CCSc2ccccc2 1458a_100102601611_100000246102 [0,2,0,0,0,0|2,0,0]=4 10608 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)COCc2ccccc2 6a_100000686674_100011215004 [0,2,0,0,0,0|2,0,0]=4 10609 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)CSCc2ccccc2 1458a_100102601611_200011217039 [0,2,0,0,0,0|2,0,0]=4 10610 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)CSCc2ccccc2 6a_100000686674_100000172147 [0,2,0,0,0,0|2,0,0]=4 10611 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccccc2 11a_100000106460_100102601611 [0,2,0,0,0,0|1,0,0]=3 10612 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccccc2 1626a_100000106460_100102601611 [0,2,0,0,0,0|1,0,0]=3 10613 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccccc2 240690a_100000106460_100102601611 [0,2,0,0,0,0|1,0,0]=3 10614 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccccn2 11a_100000211156_100102601611 [0,2,0,0,0,0|2,0,0]=4 10615 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccccn2 1626a_100000211156_100102601611 [0,2,0,0,0,0|2,0,0]=4 10616 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccccn2 240690a_100000211156_100102601611 [0,2,0,0,0,0|2,0,0]=4 10617 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2cccnc2 11a_100000736294_100102601611 [0,2,0,0,0,0|2,0,0]=4 10618 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2cccnc2 1626a_100000736294_100102601611 [0,2,0,0,0,0|2,0,0]=4 10619 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2cccnc2 240690a_100000736294_100102601611 [0,2,0,0,0,0|2,0,0]=4 10620 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccncc2 11a_100000742849_100102601611 [0,2,0,0,0,0|2,0,0]=4 10621 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccncc2 1626a_100000742849_100102601611 [0,2,0,0,0,0|2,0,0]=4 10622 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NCCc2ccncc2 240690a_100000742849_100102601611 [0,2,0,0,0,0|2,0,0]=4 10623 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Br)NNCc2ccccc2 22a_100000007032_100102601611 [0,2,0,0,0,0|2,0,0]=4 10624 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)CCCc2ccccc2 1458a_100020610926_100000211621 [0,2,0,0,0,0|1,0,0]=3 10625 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)CCOc2ccccc2 1458a_100020610926_100000184471 [0,2,0,0,0,0|2,0,0]=4 10626 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)CCSc2ccccc2 1458a_100020610926_100000246102 [0,2,0,0,0,0|2,0,0]=4 10627 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)COCc2ccccc2 6a_100000745630_100011215004 [0,2,0,0,0,0|2,0,0]=4 10628 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)CSCc2ccccc2 1458a_100020610926_200011217039 [0,2,0,0,0,0|2,0,0]=4 10629 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)CSCc2ccccc2 6a_100000745630_100000172147 [0,2,0,0,0,0|2,0,0]=4 10630 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccccc2 11a_100000106460_100020610926 [0,2,0,0,0,0|1,0,0]=3 10631 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccccc2 1626a_100000106460_100020610926 [0,2,0,0,0,0|1,0,0]=3 10632 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccccc2 240690a_100000106460_100020610926 [0,2,0,0,0,0|1,0,0]=3 10633 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccccn2 11a_100000211156_100020610926 [0,2,0,0,0,0|2,0,0]=4 10634 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccccn2 1626a_100000211156_100020610926 [0,2,0,0,0,0|2,0,0]=4 10635 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccccn2 240690a_100000211156_100020610926 [0,2,0,0,0,0|2,0,0]=4 10636 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2cccnc2 11a_100000736294_100020610926 [0,2,0,0,0,0|2,0,0]=4 10637 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2cccnc2 1626a_100000736294_100020610926 [0,2,0,0,0,0|2,0,0]=4 10638 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2cccnc2 240690a_100000736294_100020610926 [0,2,0,0,0,0|2,0,0]=4 10639 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccncc2 11a_100000742849_100020610926 [0,2,0,0,0,0|2,0,0]=4 10640 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccncc2 1626a_100000742849_100020610926 [0,2,0,0,0,0|2,0,0]=4 10641 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NCCc2ccncc2 240690a_100000742849_100020610926 [0,2,0,0,0,0|2,0,0]=4 10642 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)Cl)NNCc2ccccc2 22a_100000007032_100020610926 [0,2,0,0,0,0|2,0,0]=4 10643 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)CCCc2ccccc2 1458a_100011195075_100000211621 [0,2,0,0,0,0|1,0,0]=3 10644 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)CCOc2ccccc2 1458a_100011195075_100000184471 [0,2,0,0,0,0|2,0,0]=4 10645 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)CCSc2ccccc2 1458a_100011195075_100000246102 [0,2,0,0,0,0|2,0,0]=4 10646 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)COCc2ccccc2 6a_100000211062_100011215004 [0,2,0,0,0,0|2,0,0]=4 10647 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)CSCc2ccccc2 1458a_100011195075_200011217039 [0,2,0,0,0,0|2,0,0]=4 10648 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)CSCc2ccccc2 6a_100000211062_100000172147 [0,2,0,0,0,0|2,0,0]=4 10649 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccccc2 11a_100000106460_100011195075 [0,2,0,0,0,0|1,0,0]=3 10650 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccccc2 1626a_100000106460_100011195075 [0,2,0,0,0,0|1,0,0]=3 10651 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccccc2 240690a_100000106460_100011195075 [0,2,0,0,0,0|1,0,0]=3 10652 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccccn2 11a_100000211156_100011195075 [0,2,0,0,0,0|2,0,0]=4 10653 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccccn2 1626a_100000211156_100011195075 [0,2,0,0,0,0|2,0,0]=4 10654 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccccn2 240690a_100000211156_100011195075 [0,2,0,0,0,0|2,0,0]=4 10655 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2cccnc2 11a_100000736294_100011195075 [0,2,0,0,0,0|2,0,0]=4 10656 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2cccnc2 1626a_100000736294_100011195075 [0,2,0,0,0,0|2,0,0]=4 10657 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2cccnc2 240690a_100000736294_100011195075 [0,2,0,0,0,0|2,0,0]=4 10658 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccncc2 11a_100000742849_100011195075 [0,2,0,0,0,0|2,0,0]=4 10659 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccncc2 1626a_100000742849_100011195075 [0,2,0,0,0,0|2,0,0]=4 10660 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NCCc2ccncc2 240690a_100000742849_100011195075 [0,2,0,0,0,0|2,0,0]=4 10661 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)F)NNCc2ccccc2 22a_100000007032_100011195075 [0,2,0,0,0,0|2,0,0]=4 10662 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)I)COCc2ccccc2 6a_100000050832_100011215004 [0,2,0,0,0,0|2,0,0]=4 10663 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)I)CSCc2ccccc2 6a_100000050832_100000172147 [0,2,0,0,0,0|2,0,0]=4 10664 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)O)COCc2ccccc2 6a_100000742332_100011215004 [0,2,0,0,0,0|2,0,0]=4 10665 B22R2.518356 O=C(C=Cc1ccc(c(c1)F)O)CSCc2ccccc2 6a_100000742332_100000172147 [0,2,0,0,0,0|2,0,0]=4 10666 B22R2.518356 O=C(C=Cc1ccc(c(c1)I)Br)COCc2ccccc2 6a_100010146563_100011215004 [0,2,0,0,0,0|2,0,0]=4 10667 B22R2.518356 O=C(C=Cc1ccc(c(c1)I)Br)CSCc2ccccc2 6a_100010146563_100000172147 [0,2,0,0,0,0|2,0,0]=4 10668 B22R2.518356 O=C(C=Cc1ccc(c(c1)I)Cl)COCc2ccccc2 6a_100010209939_100011215004 [0,2,0,0,0,0|2,0,0]=4 10669 B22R2.518356 O=C(C=Cc1ccc(c(c1)I)Cl)CSCc2ccccc2 6a_100010209939_100000172147 [0,2,0,0,0,0|2,0,0]=4 10670 B22R2.518356 O=C(C=Cc1ccc(c(c1)I)F)COCc2ccccc2 6a_100010188209_100011215004 [0,2,0,0,0,0|2,0,0]=4 10671 B22R2.518356 O=C(C=Cc1ccc(c(c1)I)F)CSCc2ccccc2 6a_100010188209_100000172147 [0,2,0,0,0,0|2,0,0]=4 10672 B22R2.518356 O=C(C=Cc1ccc(c(c1)I)O)COCc2ccccc2 6a_100000186752_100011215004 [0,2,0,0,0,0|2,0,0]=4 10673 B22R2.518356 O=C(C=Cc1ccc(c(c1)I)O)CSCc2ccccc2 6a_100000186752_100000172147 [0,2,0,0,0,0|2,0,0]=4 10674 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)Cl)COCc2ccccc2 6a_100009876013_100011215004 [0,2,0,0,0,0|2,0,0]=4 10675 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)Cl)CSCc2ccccc2 6a_100009876013_100000172147 [0,2,0,0,0,0|2,0,0]=4 10676 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)F)COCc2ccccc2 6a_100000102368_100011215004 [0,2,0,0,0,0|2,0,0]=4 10677 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)F)CSCc2ccccc2 6a_100000102368_100000172147 [0,2,0,0,0,0|2,0,0]=4 10678 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)I)COCc2ccccc2 6a_100000041418_100011215004 [0,2,0,0,0,0|2,0,0]=4 10679 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)I)CSCc2ccccc2 6a_100000041418_100000172147 [0,2,0,0,0,0|2,0,0]=4 10680 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)O)NCCc2ccccc2 240690a_100000106460_100011195073 [0,2,0,0,0,0|1,0,0]=3 10681 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)O)NCCc2ccccn2 240690a_100000211156_100011195073 [0,2,0,0,0,0|2,0,0]=4 10682 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)O)NCCc2cccnc2 240690a_100000736294_100011195073 [0,2,0,0,0,0|2,0,0]=4 10683 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)O)NCCc2ccncc2 240690a_100000742849_100011195073 [0,2,0,0,0,0|2,0,0]=4 10684 B22R2.518356 O=C(C=Cc1ccc(c(c1)O)O)NNCc2ccccc2 22a_100000007032_100011195073 [0,2,0,0,0,0|2,0,0]=4 10685 B22R2.518356 O=C(CNc1ccc(c(c1)Br)Br)OCCc2ccccc2 2230a_100011306057_200000077782 [0,2,0,0,0,0|1,0,1]=4 10686 B22R2.518356 O=C(CNc1ccc(c(c1)Br)Br)OCCc2ccccc2 34a_100011306057_200000077782 [0,2,0,0,0,0|1,0,1]=4 10687 B22R2.518356 O=C(CNc1ccc(c(c1)Br)Br)OCCc2ccccc2 7a_100011306057_200000077782 [0,2,0,0,0,0|1,0,1]=4 10688 B22R2.518356 O=C(CNc1ccc(c(c1)Br)Cl)OCCc2ccccc2 2230a_100000686031_200000077782 [0,2,0,0,0,0|1,0,1]=4 10689 B22R2.518356 O=C(CNc1ccc(c(c1)Br)Cl)OCCc2ccccc2 34a_100000686031_200000077782 [0,2,0,0,0,0|1,0,1]=4 10690 B22R2.518356 O=C(CNc1ccc(c(c1)Br)F)OCCc2ccccc2 2230a_100000760356_200000077782 [0,2,0,0,0,0|1,0,1]=4 10691 B22R2.518356 O=C(CNc1ccc(c(c1)Br)F)OCCc2ccccc2 34a_100000760356_200000077782 [0,2,0,0,0,0|1,0,1]=4 10692 B22R2.518356 O=C(CNc1ccc(c(c1)Br)F)OCCc2ccccc2 7a_100000760356_200000077782 [0,2,0,0,0,0|1,0,1]=4 10693 B22R2.518356 O=C(CNc1ccc(c(c1)Br)I)OCCc2ccccc2 34a_100000750458_200000077782 [0,2,0,0,0,0|1,0,1]=4 10694 B22R2.518356 O=C(CNc1ccc(c(c1)Br)O)OCCc2ccccc2 34a_100011534360_200000077782 [0,2,0,0,0,0|1,0,1]=4 10695 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)Br)OCCc2ccccc2 2230a_100000687081_200000077782 [0,2,0,0,0,0|1,0,1]=4 10696 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)Br)OCCc2ccccc2 34a_100000687081_200000077782 [0,2,0,0,0,0|1,0,1]=4 10697 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)Br)OCCc2ccccc2 7a_100000687081_200000077782 [0,2,0,0,0,0|1,0,1]=4 10698 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)Cl)OCCc2ccccc2 2230a_100000184108_200000077782 [0,2,0,0,0,0|1,0,1]=4 10699 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)Cl)OCCc2ccccc2 34a_100000184108_200000077782 [0,2,0,0,0,0|1,0,1]=4 10700 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)F)OCCc2ccccc2 2230a_100000211060_200000077782 [0,2,0,0,0,0|1,0,1]=4 10701 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)F)OCCc2ccccc2 34a_100000211060_200000077782 [0,2,0,0,0,0|1,0,1]=4 10702 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)F)OCCc2ccccc2 7a_100000211060_200000077782 [0,2,0,0,0,0|1,0,1]=4 10703 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)I)OCCc2ccccc2 34a_100000761885_200000077782 [0,2,0,0,0,0|1,0,1]=4 10704 B22R2.518356 O=C(CNc1ccc(c(c1)Cl)O)OCCc2ccccc2 34a_100000744943_200000077782 [0,2,0,0,0,0|1,0,1]=4 10705 B22R2.518356 O=C(CNc1ccc(c(c1)F)Br)OCCc2ccccc2 2230a_100000759894_200000077782 [0,2,0,0,0,0|1,0,1]=4 10706 B22R2.518356 O=C(CNc1ccc(c(c1)F)Br)OCCc2ccccc2 34a_100000759894_200000077782 [0,2,0,0,0,0|1,0,1]=4 10707 B22R2.518356 O=C(CNc1ccc(c(c1)F)Br)OCCc2ccccc2 7a_100000759894_200000077782 [0,2,0,0,0,0|1,0,1]=4 10708 B22R2.518356 O=C(CNc1ccc(c(c1)F)Cl)OCCc2ccccc2 2230a_100000739366_200000077782 [0,2,0,0,0,0|1,0,1]=4 10709 B22R2.518356 O=C(CNc1ccc(c(c1)F)Cl)OCCc2ccccc2 34a_100000739366_200000077782 [0,2,0,0,0,0|1,0,1]=4 10710 B22R2.518356 O=C(CNc1ccc(c(c1)F)Cl)OCCc2ccccc2 7a_100000739366_200000077782 [0,2,0,0,0,0|1,0,1]=4 10711 B22R2.518356 O=C(CNc1ccc(c(c1)F)F)OCCc2ccccc2 2230a_100000210724_200000077782 [0,2,0,0,0,0|1,0,1]=4 10712 B22R2.518356 O=C(CNc1ccc(c(c1)F)F)OCCc2ccccc2 34a_100000210724_200000077782 [0,2,0,0,0,0|1,0,1]=4 10713 B22R2.518356 O=C(CNc1ccc(c(c1)F)F)OCCc2ccccc2 7a_100000210724_200000077782 [0,2,0,0,0,0|1,0,1]=4 10714 B22R2.518356 O=C(CNc1ccc(c(c1)F)I)OCCc2ccccc2 34a_100011356925_200000077782 [0,2,0,0,0,0|1,0,1]=4 10715 B22R2.518356 O=C(CNc1ccc(c(c1)F)I)OCCc2ccccc2 7a_100011356925_200000077782 [0,2,0,0,0,0|1,0,1]=4 10716 B22R2.518356 O=C(CNc1ccc(c(c1)F)O)OCCc2ccccc2 34a_100011220035_200000077782 [0,2,0,0,0,0|1,0,1]=4 10717 B22R2.518356 O=C(CNc1ccc(c(c1)F)O)OCCc2ccccc2 7a_100011220035_200000077782 [0,2,0,0,0,0|1,0,1]=4 10718 B22R2.518356 O=C(CNc1ccc(c(c1)I)Br)OCCc2ccccc2 34a_100000750459_200000077782 [0,2,0,0,0,0|1,0,1]=4 10719 B22R2.518356 O=C(CNc1ccc(c(c1)I)Cl)OCCc2ccccc2 34a_100012360549_200000077782 [0,2,0,0,0,0|1,0,1]=4 10720 B22R2.518356 O=C(CNc1ccc(c(c1)I)F)OCCc2ccccc2 34a_114828291077_200000077782 [0,2,0,0,0,0|1,0,1]=4 10721 B22R2.518356 O=C(CNc1ccc(c(c1)I)F)OCCc2ccccc2 7a_114828291077_200000077782 [0,2,0,0,0,0|1,0,1]=4 10722 B22R2.518356 O=C(CNc1ccc(c(c1)O)Cl)OCCc2ccccc2 34a_100011934209_200000077782 [0,2,0,0,0,0|1,0,1]=4 10723 B22R2.518356 O=C(CNc1ccc(c(c1)O)F)OCCc2ccccc2 34a_100012017398_200000077782 [0,2,0,0,0,0|1,0,1]=4 10724 B22R2.518356 O=C(CNc1ccc(c(c1)O)F)OCCc2ccccc2 7a_100012017398_200000077782 [0,2,0,0,0,0|1,0,1]=4 10725 B22R2.518356 O=C(CNc1ccc(c(c1)O)O)OCCc2ccccc2 34a_100102946323_200000077782 [0,2,0,0,0,0|1,0,1]=4 10726 B22R2.518356 O=C(COc1ccc(c(c1)Br)Cl)OCCc2ccccc2 34a_100011933957_200000077782 [0,2,0,0,0,0|1,0,1]=4 10727 B22R2.518356 O=C(COc1ccc(c(c1)Br)Cl)OCCc2ccccc2 7a_100011933957_200000077782 [0,2,0,0,0,0|1,0,1]=4 10728 B22R2.518356 O=C(COc1ccc(c(c1)Br)F)OCCc2ccccc2 34a_100000693481_200000077782 [0,2,0,0,0,0|1,0,1]=4 10729 B22R2.518356 O=C(COc1ccc(c(c1)Br)F)OCCc2ccccc2 7a_100000693481_200000077782 [0,2,0,0,0,0|1,0,1]=4 10730 B22R2.518356 O=C(COc1ccc(c(c1)Br)I)OCCc2ccccc2 34a_100000701344_200000077782 [0,2,0,0,0,0|1,0,1]=4 10731 B22R2.518356 O=C(COc1ccc(c(c1)Br)I)OCCc2ccccc2 7a_100000701344_200000077782 [0,2,0,0,0,0|1,0,1]=4 10732 B22R2.518356 O=C(COc1ccc(c(c1)Cl)Br)OCCc2ccccc2 34a_100011215161_200000077782 [0,2,0,0,0,0|1,0,1]=4 10733 B22R2.518356 O=C(COc1ccc(c(c1)Cl)Br)OCCc2ccccc2 7a_100011215161_200000077782 [0,2,0,0,0,0|1,0,1]=4 10734 B22R2.518356 O=C(COc1ccc(c(c1)Cl)Cl)OCCc2ccccc2 34a_100000211054_200000077782 [0,2,0,0,0,0|1,0,1]=4 10735 B22R2.518356 O=C(COc1ccc(c(c1)Cl)Cl)OCCc2ccccc2 7a_100000211054_200000077782 [0,2,0,0,0,0|1,0,1]=4 10736 B22R2.518356 O=C(COc1ccc(c(c1)Cl)F)OCCc2ccccc2 34a_100000211030_200000077782 [0,2,0,0,0,0|1,0,1]=4 10737 B22R2.518356 O=C(COc1ccc(c(c1)Cl)F)OCCc2ccccc2 7a_100000211030_200000077782 [0,2,0,0,0,0|1,0,1]=4 10738 B22R2.518356 O=C(COc1ccc(c(c1)Cl)I)OCCc2ccccc2 34a_100000047559_200000077782 [0,2,0,0,0,0|1,0,1]=4 10739 B22R2.518356 O=C(COc1ccc(c(c1)Cl)I)OCCc2ccccc2 7a_100000047559_200000077782 [0,2,0,0,0,0|1,0,1]=4 10740 B22R2.518356 O=C(COc1ccc(c(c1)F)Br)OCCc2ccccc2 34a_100000755031_200000077782 [0,2,0,0,0,0|1,0,1]=4 10741 B22R2.518356 O=C(COc1ccc(c(c1)F)Br)OCCc2ccccc2 7a_100000755031_200000077782 [0,2,0,0,0,0|1,0,1]=4 10742 B22R2.518356 O=C(COc1ccc(c(c1)F)Cl)OCCc2ccccc2 34a_100000691581_200000077782 [0,2,0,0,0,0|1,0,1]=4 10743 B22R2.518356 O=C(COc1ccc(c(c1)F)Cl)OCCc2ccccc2 7a_100000691581_200000077782 [0,2,0,0,0,0|1,0,1]=4 10744 B22R2.518356 O=C(COc1ccc(c(c1)F)F)OCCc2ccccc2 34a_100000181275_200000077782 [0,2,0,0,0,0|1,0,1]=4 10745 B22R2.518356 O=C(COc1ccc(c(c1)F)F)OCCc2ccccc2 7a_100000181275_200000077782 [0,2,0,0,0,0|1,0,1]=4 10746 B22R2.518356 O=C(COc1ccc(c(c1)F)I)OCCc2ccccc2 34a_100009990212_200000077782 [0,2,0,0,0,0|1,0,1]=4 10747 B22R2.518356 O=C(COc1ccc(c(c1)F)I)OCCc2ccccc2 7a_100009990212_200000077782 [0,2,0,0,0,0|1,0,1]=4 10748 B22R2.518356 O=C(COc1ccc(c(c1)I)Br)OCCc2ccccc2 34a_100012339312_200000077782 [0,2,0,0,0,0|1,0,1]=4 10749 B22R2.518356 O=C(COc1ccc(c(c1)I)Br)OCCc2ccccc2 7a_100012339312_200000077782 [0,2,0,0,0,0|1,0,1]=4 10750 B22R2.518356 O=C(COc1ccc(c(c1)I)Cl)OCCc2ccccc2 34a_100000049588_200000077782 [0,2,0,0,0,0|1,0,1]=4 10751 B22R2.518356 O=C(COc1ccc(c(c1)I)Cl)OCCc2ccccc2 7a_100000049588_200000077782 [0,2,0,0,0,0|1,0,1]=4 10752 B22R2.518356 O=C(CSc1ccc(c(c1)Br)Br)OCCc2ccccc2 62a_100012356285_200000077782 [0,2,0,0,0,0|1,0,1]=4 10753 B22R2.518356 O=C(CSc1ccc(c(c1)Br)Br)OCCc2ccccc2 62a_200000077782_100012356285 [0,2,0,0,0,0|1,0,1]=4 10754 B22R2.518356 O=C(CSc1ccc(c(c1)Br)Cl)OCCc2ccccc2 62a_100012353702_200000077782 [0,2,0,0,0,0|1,0,1]=4 10755 B22R2.518356 O=C(CSc1ccc(c(c1)Br)Cl)OCCc2ccccc2 62a_200000077782_100012353702 [0,2,0,0,0,0|1,0,1]=4 10756 B22R2.518356 O=C(CSc1ccc(c(c1)Br)F)OCCc2ccccc2 62a_100012047266_200000077782 [0,2,0,0,0,0|1,0,1]=4 10757 B22R2.518356 O=C(CSc1ccc(c(c1)Br)F)OCCc2ccccc2 62a_200000077782_100012047266 [0,2,0,0,0,0|1,0,1]=4 10758 B22R2.518356 O=C(CSc1ccc(c(c1)Br)O)OCCc2ccccc2 62a_100012361655_200000077782 [0,2,0,0,0,0|1,0,1]=4 10759 B22R2.518356 O=C(CSc1ccc(c(c1)Br)O)OCCc2ccccc2 62a_200000077782_100012361655 [0,2,0,0,0,0|1,0,1]=4 10760 B22R2.518356 O=C(CSc1ccc(c(c1)Cl)Br)OCCc2ccccc2 62a_100012047281_200000077782 [0,2,0,0,0,0|1,0,1]=4 10761 B22R2.518356 O=C(CSc1ccc(c(c1)Cl)Br)OCCc2ccccc2 62a_200000077782_100012047281 [0,2,0,0,0,0|1,0,1]=4 10762 B22R2.518356 O=C(CSc1ccc(c(c1)Cl)Cl)OCCc2ccccc2 62a_100011214914_200000077782 [0,2,0,0,0,0|1,0,1]=4 10763 B22R2.518356 O=C(CSc1ccc(c(c1)Cl)Cl)OCCc2ccccc2 62a_200000077782_100011214914 [0,2,0,0,0,0|1,0,1]=4 10764 B22R2.518356 O=C(CSc1ccc(c(c1)Cl)F)OCCc2ccccc2 62a_100011215976_200000077782 [0,2,0,0,0,0|1,0,1]=4 10765 B22R2.518356 O=C(CSc1ccc(c(c1)Cl)F)OCCc2ccccc2 62a_200000077782_100011215976 [0,2,0,0,0,0|1,0,1]=4 10766 B22R2.518356 O=C(CSc1ccc(c(c1)Cl)O)OCCc2ccccc2 62a_100012360047_200000077782 [0,2,0,0,0,0|1,0,1]=4 10767 B22R2.518356 O=C(CSc1ccc(c(c1)Cl)O)OCCc2ccccc2 62a_200000077782_100012360047 [0,2,0,0,0,0|1,0,1]=4 10768 B22R2.518356 O=C(CSc1ccc(c(c1)F)Br)OCCc2ccccc2 62a_100000685389_200000077782 [0,2,0,0,0,0|1,0,1]=4 10769 B22R2.518356 O=C(CSc1ccc(c(c1)F)Br)OCCc2ccccc2 62a_200000077782_100000685389 [0,2,0,0,0,0|1,0,1]=4 10770 B22R2.518356 O=C(CSc1ccc(c(c1)F)Cl)OCCc2ccccc2 62a_100011216805_200000077782 [0,2,0,0,0,0|1,0,1]=4 10771 B22R2.518356 O=C(CSc1ccc(c(c1)F)Cl)OCCc2ccccc2 62a_200000077782_100011216805 [0,2,0,0,0,0|1,0,1]=4 10772 B22R2.518356 O=C(CSc1ccc(c(c1)F)F)OCCc2ccccc2 62a_100000703953_200000077782 [0,2,0,0,0,0|1,0,1]=4 10773 B22R2.518356 O=C(CSc1ccc(c(c1)F)F)OCCc2ccccc2 62a_200000077782_100000703953 [0,2,0,0,0,0|1,0,1]=4 10774 B22R2.518356 O=C(CSc1ccc(c(c1)F)O)OCCc2ccccc2 62a_100000185481_200000077782 [0,2,0,0,0,0|1,0,1]=4 10775 B22R2.518356 O=C(CSc1ccc(c(c1)F)O)OCCc2ccccc2 62a_200000077782_100000185481 [0,2,0,0,0,0|1,0,1]=4 10776 B22R2.518356 O=C(CSc1ccc(c(c1)O)Br)OCCc2ccccc2 62a_100012356990_200000077782 [0,2,0,0,0,0|1,0,1]=4 10777 B22R2.518356 O=C(CSc1ccc(c(c1)O)Br)OCCc2ccccc2 62a_200000077782_100012356990 [0,2,0,0,0,0|1,0,1]=4 10778 B22R2.518356 O=C(CSc1ccc(c(c1)O)Cl)OCCc2ccccc2 62a_100011356854_200000077782 [0,2,0,0,0,0|1,0,1]=4 10779 B22R2.518356 O=C(CSc1ccc(c(c1)O)Cl)OCCc2ccccc2 62a_200000077782_100011356854 [0,2,0,0,0,0|1,0,1]=4 10780 B22R2.518356 O=C(CSc1ccc(c(c1)O)F)OCCc2ccccc2 62a_100000686035_200000077782 [0,2,0,0,0,0|1,0,1]=4 10781 B22R2.518356 O=C(CSc1ccc(c(c1)O)F)OCCc2ccccc2 62a_200000077782_100000686035 [0,2,0,0,0,0|1,0,1]=4 10782 B22R2.518356 O=C(CSc1ccc(c(c1)O)O)OCCc2ccccc2 62a_200000077782_100009813601 [0,2,0,0,0,0|1,0,1]=4 10783 B22R2.77 CCc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 11a_100025712186_100000210462 [0,2,0,0,0,0|1,0,0]=3 10784 B22R2.77 CCc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 1626a_100025712186_100000210462 [0,2,0,0,0,0|1,0,0]=3 10785 B22R2.77 CCc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 11a_100025712186_100000740811 [0,2,0,0,0,0|2,0,0]=4 10786 B22R2.77 CCc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 240690a_100025712186_100000740811 [0,2,0,0,0,0|2,0,0]=4 10787 B22R2.77 CCc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 11a_100025712186_100000735890 [0,2,0,0,0,0|2,0,0]=4 10788 B22R2.77 CCc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 240690a_100025712186_100000735890 [0,2,0,0,0,0|2,0,0]=4 10789 B22R2.77 CCc1ccc(cc1)CCNC(=O)C=Cc2ccncc2 240690a_100025712186_100000682801 [0,2,0,0,0,0|2,0,0]=4 10790 B22R2.77 COc1ccc(cc1)CCCC(=O)C=Cc2ccccc2 1458a_100000210462_100011740616 [0,2,0,0,0,0|1,0,0]=3 10791 B22R2.77 COc1ccc(cc1)CCCC(=O)C=Cc2ccccn2 1458a_100000740811_100011740616 [0,2,0,0,0,0|2,0,0]=4 10792 B22R2.77 COc1ccc(cc1)CCCC(=O)C=Cc2cccnc2 1458a_100000735890_100011740616 [0,2,0,0,0,0|2,0,0]=4 10793 B22R2.77 COc1ccc(cc1)CCCC(=O)C=Cc2ccncc2 1458a_100000682801_100011740616 [0,2,0,0,0,0|2,0,0]=4 10794 B22R2.77 COc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 11a_100000210796_100000210462 [0,2,0,0,0,0|1,0,0]=3 10795 B22R2.77 COc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 1626a_100000210796_100000210462 [0,2,0,0,0,0|1,0,0]=3 10796 B22R2.77 COc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 11a_100000210796_100000740811 [0,2,0,0,0,0|2,0,0]=4 10797 B22R2.77 COc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 240690a_100000210796_100000740811 [0,2,0,0,0,0|2,0,0]=4 10798 B22R2.77 COc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 11a_100000210796_100000735890 [0,2,0,0,0,0|2,0,0]=4 10799 B22R2.77 COc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 240690a_100000210796_100000735890 [0,2,0,0,0,0|2,0,0]=4 10800 B22R2.77 COc1ccc(cc1)CCNC(=O)C=Cc2ccncc2 240690a_100000210796_100000682801 [0,2,0,0,0,0|2,0,0]=4 10801 B22R2.77 COc1ccc(cc1)CNNC(=O)C=Cc2ccccc2 22a_100000741578_100000210462 [0,2,0,0,0,0|2,0,0]=4 10802 B22R2.77 COc1ccc(cc1)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000183225 [0,2,0,0,0,0|2,0,0]=4 10803 B22R2.77 COc1ccc(cn1)CCNC(=O)C=Cc2ccccc2 11a_100011998949_100000210462 [0,2,0,0,0,0|2,0,0]=4 10804 B22R2.77 COc1ccc(cn1)CCNC(=O)C=Cc2ccccc2 1626a_100011998949_100000210462 [0,2,0,0,0,0|2,0,0]=4 10805 B22R2.77 CSc1ccc(cc1)CNNC(=O)C=Cc2ccccc2 22a_102495366275_100000210462 [0,2,0,0,0,0|2,0,0]=4 10806 B22R2.77 N#Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 11a_100015189369_100000210462 [0,2,0,0,0,0|1,0,0]=3 10807 B22R2.77 N#Cc1ccc(cc1)CCNC(=O)C=Cc2ccccc2 1626a_100015189369_100000210462 [0,2,0,0,0,0|1,0,0]=3 10808 B22R2.77 N#Cc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 11a_100015189369_100000740811 [0,2,0,0,0,0|2,0,0]=4 10809 B22R2.77 N#Cc1ccc(cc1)CCNC(=O)C=Cc2ccccn2 240690a_100015189369_100000740811 [0,2,0,0,0,0|2,0,0]=4 10810 B22R2.77 N#Cc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 11a_100015189369_100000735890 [0,2,0,0,0,0|2,0,0]=4 10811 B22R2.77 N#Cc1ccc(cc1)CCNC(=O)C=Cc2cccnc2 240690a_100015189369_100000735890 [0,2,0,0,0,0|2,0,0]=4 10812 B22R2.77 N#Cc1ccc(cc1)CCNC(=O)C=Cc2ccncc2 240690a_100015189369_100000682801 [0,2,0,0,0,0|2,0,0]=4 10813 B22R2.77 N#Cc1ccc(cc1)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000184558 [0,2,0,0,0,0|2,0,0]=4 10814 B22R2.77 O=C(C=Cc1ccccc1)NNCc2ccc(cc2)CO 22a_202495334029_100000210462 [0,2,0,0,0,0|2,0,0]=4 10815 B22R2.77 O=Cc1ccc(cc1)OCCC(=O)C=Cc2ccccc2 1458a_100000210462_100000040479 [0,2,0,0,0,0|2,0,0]=4 10816 B22R2.4385 CC(=CC(=O)CCCc1ccc(cc1)Br)c2ccccc2 1458a_100000743005_100011713682 [0,2,0,0,0,0|1,0,0]=3 10817 B22R2.4385 CC(=CC(=O)CCCc1ccc(cc1)Cl)c2ccccc2 1458a_100000743005_100000759440 [0,2,0,0,0,0|1,0,0]=3 10818 B22R2.4385 CC(=CC(=O)CCCc1ccc(cc1)F)c2ccccc2 1458a_100000743005_200011713563 [0,2,0,0,0,0|1,0,0]=3 10819 B22R2.4385 CC(=CC(=O)CCOc1ccc(cc1)Br)c2ccccc2 1458a_100000743005_100000183278 [0,2,0,0,0,0|2,0,0]=4 10820 B22R2.4385 CC(=CC(=O)CCOc1ccc(cc1)C)c2ccccc2 1458a_100000743005_100000183172 [0,2,0,0,0,0|2,0,0]=4 10821 B22R2.4385 CC(=CC(=O)CCOc1ccc(cc1)Cl)c2ccccc2 1458a_100000743005_100000184122 [0,2,0,0,0,0|2,0,0]=4 10822 B22R2.4385 CC(=CC(=O)CCOc1ccc(cc1)F)c2ccccc2 1458a_100000743005_100000184936 [0,2,0,0,0,0|2,0,0]=4 10823 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)Br)c2ccccc2 11a_100000755846_100000743005 [0,2,0,0,0,0|1,0,0]=3 10824 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)Br)c2ccccc2 1626a_100000755846_100000743005 [0,2,0,0,0,0|1,0,0]=3 10825 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)Br)c2ccccc2 240690a_100000755846_100000743005 [0,2,0,0,0,0|1,0,0]=3 10826 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)Br)c2ccccc2 527a_100000755846_100000743005 [0,2,0,0,0,0|1,0,0]=3 10827 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)C)c2ccccc2 11a_100000705350_100000743005 [0,2,0,0,0,0|1,0,0]=3 10828 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)C)c2ccccc2 1626a_100000705350_100000743005 [0,2,0,0,0,0|1,0,0]=3 10829 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)C)c2ccccc2 240690a_100000705350_100000743005 [0,2,0,0,0,0|1,0,0]=3 10830 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)C)c2ccccc2 527a_100000705350_100000743005 [0,2,0,0,0,0|1,0,0]=3 10831 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)Cl)c2ccccc2 11a_100000185265_100000743005 [0,2,0,0,0,0|1,0,0]=3 10832 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)Cl)c2ccccc2 1626a_100000185265_100000743005 [0,2,0,0,0,0|1,0,0]=3 10833 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)Cl)c2ccccc2 240690a_100000185265_100000743005 [0,2,0,0,0,0|1,0,0]=3 10834 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)Cl)c2ccccc2 527a_100000185265_100000743005 [0,2,0,0,0,0|1,0,0]=3 10835 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)F)c2ccccc2 11a_100000199005_100000743005 [0,2,0,0,0,0|1,0,0]=3 10836 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)F)c2ccccc2 1626a_100000199005_100000743005 [0,2,0,0,0,0|1,0,0]=3 10837 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)F)c2ccccc2 240690a_100000199005_100000743005 [0,2,0,0,0,0|1,0,0]=3 10838 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)F)c2ccccc2 527a_100000199005_100000743005 [0,2,0,0,0,0|1,0,0]=3 10839 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)O)c2ccccc2 240690a_100000743037_100000743005 [0,2,0,0,0,0|1,0,0]=3 10840 B22R2.4385 CC(=CC(=O)NCCc1ccc(cc1)O)c2ccccc2 527a_100000743037_100000743005 [0,2,0,0,0,0|1,0,0]=3 10841 B22R2.4385 CC(=CC(=O)NNCc1ccc(cc1)Br)c2ccccc2 22a_100016993955_100000743005 [0,2,0,0,0,0|2,0,0]=4 10842 B22R2.4385 CC(=CC(=O)NNCc1ccc(cc1)C)c2ccccc2 22a_100011197965_100000743005 [0,2,0,0,0,0|2,0,0]=4 10843 B22R2.4385 CC(=CC(=O)NNCc1ccc(cc1)Cl)c2ccccc2 22a_100000689899_100000743005 [0,2,0,0,0,0|2,0,0]=4 10844 B22R2.4385 CC(=CC(=O)NNCc1ccc(cc1)F)c2ccccc2 22a_100000689900_100000743005 [0,2,0,0,0,0|2,0,0]=4 10845 B22R2.4385 CC(=CC(=O)NNCc1ccc(cc1)I)c2ccccc2 22a_102495363730_100000743005 [0,2,0,0,0,0|2,0,0]=4 10846 B22R2.4385 Cc1ccc(cc1)CCCC(=O)CC(=O)c2ccccc2 1458a_100000741418_100000211460 [0,2,0,0,0,0|1,0,1]=4 10847 B22R2.4385 O=C(CC(=O)c1ccccc1)NCCc2ccc(cc2)Cl 1458a_100000185807_200000183373 [0,2,0,0,0,0|1,0,1]=4 10848 B22R2.4385 O=C(CCCc1ccc(cc1)Br)CC(=O)c2ccccc2 1458a_100011236545_100000211460 [0,2,0,0,0,0|1,0,1]=4 10849 B22R2.4385 O=C(CCCc1ccc(cc1)Cl)CC(=O)c2ccccc2 1458a_100000741339_100000211460 [0,2,0,0,0,0|1,0,1]=4 10850 B22R2.4385 O=C(CCCc1ccc(cc1)F)CC(=O)c2ccccc2 1458a_100011219804_100000211460 [0,2,0,0,0,0|1,0,1]=4 10851 B22R2.4385 O=C(CCCc1ccc(cc1)I)CC(=O)c2ccccc2 1458a_100011236544_100000211460 [0,2,0,0,0,0|1,0,1]=4 10852 B22R2.4385 O=C(CCCc1ccc(cc1)O)CC(=O)c2ccccc2 1458a_100000116853_100000211460 [0,2,0,0,0,0|1,0,1]=4 10853 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)Br 11a_100000705350_100016258244 [0,2,0,0,0,0|1,0,0]=3 10854 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)Br 1626a_100000705350_100016258244 [0,2,0,0,0,0|1,0,0]=3 10855 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)Br 240690a_100000705350_100016258244 [0,2,0,0,0,0|1,0,0]=3 10856 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)C 11a_100000705350_100000690095 [0,2,0,0,0,0|1,0,0]=3 10857 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)C 1626a_100000705350_100000690095 [0,2,0,0,0,0|1,0,0]=3 10858 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)C 240690a_100000705350_100000690095 [0,2,0,0,0,0|1,0,0]=3 10859 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)Cl 11a_100000705350_100000184502 [0,2,0,0,0,0|1,0,0]=3 10860 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)Cl 1626a_100000705350_100000184502 [0,2,0,0,0,0|1,0,0]=3 10861 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)Cl 240690a_100000705350_100000184502 [0,2,0,0,0,0|1,0,0]=3 10862 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)F 11a_100000705350_100000718793 [0,2,0,0,0,0|1,0,0]=3 10863 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)F 1626a_100000705350_100000718793 [0,2,0,0,0,0|1,0,0]=3 10864 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)F 240690a_100000705350_100000718793 [0,2,0,0,0,0|1,0,0]=3 10865 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)I 11a_100000705350_100020647043 [0,2,0,0,0,0|1,0,0]=3 10866 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)I 1626a_100000705350_100020647043 [0,2,0,0,0,0|1,0,0]=3 10867 B22R2.4387 Cc1ccc(cc1)CCNC(=O)C=Cc2cccc(c2)I 240690a_100000705350_100020647043 [0,2,0,0,0,0|1,0,0]=3 10868 B22R2.4387 Cc1ccc(cc1)CNNC(=O)C=Cc2cccc(c2)Br 22a_100011197965_100016258244 [0,2,0,0,0,0|2,0,0]=4 10869 B22R2.4387 Cc1ccc(cc1)CNNC(=O)C=Cc2cccc(c2)C 22a_100011197965_100000690095 [0,2,0,0,0,0|2,0,0]=4 10870 B22R2.4387 Cc1ccc(cc1)CNNC(=O)C=Cc2cccc(c2)Cl 22a_100011197965_100000184502 [0,2,0,0,0,0|2,0,0]=4 10871 B22R2.4387 Cc1ccc(cc1)CNNC(=O)C=Cc2cccc(c2)F 22a_100011197965_100000718793 [0,2,0,0,0,0|2,0,0]=4 10872 B22R2.4387 Cc1ccc(cc1)CNNC(=O)C=Cc2cccc(c2)I 22a_100011197965_100020647043 [0,2,0,0,0,0|2,0,0]=4 10873 B22R2.4387 Cc1ccc(cc1)CNNC(=O)C=Cc2cccc(c2)O 22a_100011197965_100102525460 [0,2,0,0,0,0|2,0,0]=4 10874 B22R2.4387 Cc1ccc(cc1)OCCC(=O)C=Cc2cccc(c2)Br 1458a_100016258244_100000183172 [0,2,0,0,0,0|2,0,0]=4 10875 B22R2.4387 Cc1ccc(cc1)OCCC(=O)C=Cc2cccc(c2)C 1458a_100000690095_100000183172 [0,2,0,0,0,0|2,0,0]=4 10876 B22R2.4387 Cc1ccc(cc1)OCCC(=O)C=Cc2cccc(c2)Cl 1458a_100000184502_100000183172 [0,2,0,0,0,0|2,0,0]=4 10877 B22R2.4387 Cc1ccc(cc1)OCCC(=O)C=Cc2cccc(c2)F 1458a_100000718793_100000183172 [0,2,0,0,0,0|2,0,0]=4 10878 B22R2.4387 Cc1ccc(cc1)OCCC(=O)C=Cc2cccc(c2)I 1458a_100020647043_100000183172 [0,2,0,0,0,0|2,0,0]=4 10879 B22R2.4387 Cc1cccc(c1)C=CC(=O)CCCc2ccc(cc2)Br 1458a_100000690095_100011713682 [0,2,0,0,0,0|1,0,0]=3 10880 B22R2.4387 Cc1cccc(c1)C=CC(=O)CCCc2ccc(cc2)Cl 1458a_100000690095_100000759440 [0,2,0,0,0,0|1,0,0]=3 10881 B22R2.4387 Cc1cccc(c1)C=CC(=O)CCCc2ccc(cc2)F 1458a_100000690095_200011713563 [0,2,0,0,0,0|1,0,0]=3 10882 B22R2.4387 Cc1cccc(c1)C=CC(=O)CCOc2ccc(cc2)Br 1458a_100000690095_100000183278 [0,2,0,0,0,0|2,0,0]=4 10883 B22R2.4387 Cc1cccc(c1)C=CC(=O)CCOc2ccc(cc2)Cl 1458a_100000690095_100000184122 [0,2,0,0,0,0|2,0,0]=4 10884 B22R2.4387 Cc1cccc(c1)C=CC(=O)CCOc2ccc(cc2)F 1458a_100000690095_100000184936 [0,2,0,0,0,0|2,0,0]=4 10885 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)Br 11a_100000755846_100000690095 [0,2,0,0,0,0|1,0,0]=3 10886 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)Br 1626a_100000755846_100000690095 [0,2,0,0,0,0|1,0,0]=3 10887 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)Br 240690a_100000755846_100000690095 [0,2,0,0,0,0|1,0,0]=3 10888 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)Cl 11a_100000185265_100000690095 [0,2,0,0,0,0|1,0,0]=3 10889 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)Cl 1626a_100000185265_100000690095 [0,2,0,0,0,0|1,0,0]=3 10890 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)Cl 240690a_100000185265_100000690095 [0,2,0,0,0,0|1,0,0]=3 10891 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)F 11a_100000199005_100000690095 [0,2,0,0,0,0|1,0,0]=3 10892 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)F 1626a_100000199005_100000690095 [0,2,0,0,0,0|1,0,0]=3 10893 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)F 240690a_100000199005_100000690095 [0,2,0,0,0,0|1,0,0]=3 10894 B22R2.4387 Cc1cccc(c1)C=CC(=O)NCCc2ccc(cc2)O 240690a_100000743037_100000690095 [0,2,0,0,0,0|1,0,0]=3 10895 B22R2.4387 Cc1cccc(c1)C=CC(=O)NNCc2ccc(cc2)Br 22a_100016993955_100000690095 [0,2,0,0,0,0|2,0,0]=4 10896 B22R2.4387 Cc1cccc(c1)C=CC(=O)NNCc2ccc(cc2)Cl 22a_100000689899_100000690095 [0,2,0,0,0,0|2,0,0]=4 10897 B22R2.4387 Cc1cccc(c1)C=CC(=O)NNCc2ccc(cc2)F 22a_100000689900_100000690095 [0,2,0,0,0,0|2,0,0]=4 10898 B22R2.4387 Cc1cccc(c1)C=CC(=O)NNCc2ccc(cc2)I 22a_102495363730_100000690095 [0,2,0,0,0,0|2,0,0]=4 10899 B22R2.4387 O=C(C=Cc1cccc(c1)Br)CCCc2ccc(cc2)Br 1458a_100016258244_100011713682 [0,2,0,0,0,0|1,0,0]=3 10900 B22R2.4387 O=C(C=Cc1cccc(c1)Br)CCCc2ccc(cc2)Cl 1458a_100016258244_100000759440 [0,2,0,0,0,0|1,0,0]=3 10901 B22R2.4387 O=C(C=Cc1cccc(c1)Br)CCCc2ccc(cc2)F 1458a_100016258244_200011713563 [0,2,0,0,0,0|1,0,0]=3 10902 B22R2.4387 O=C(C=Cc1cccc(c1)Br)CCOc2ccc(cc2)Br 1458a_100016258244_100000183278 [0,2,0,0,0,0|2,0,0]=4 10903 B22R2.4387 O=C(C=Cc1cccc(c1)Br)CCOc2ccc(cc2)Cl 1458a_100016258244_100000184122 [0,2,0,0,0,0|2,0,0]=4 10904 B22R2.4387 O=C(C=Cc1cccc(c1)Br)CCOc2ccc(cc2)F 1458a_100016258244_100000184936 [0,2,0,0,0,0|2,0,0]=4 10905 B22R2.4387 O=C(C=Cc1cccc(c1)Br)CCSc2ccc(cc2)F 6a_100000210085_100000208766 [0,2,0,0,0,0|2,0,0]=4 10906 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)Br 11a_100000755846_100016258244 [0,2,0,0,0,0|1,0,0]=3 10907 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)Br 1626a_100000755846_100016258244 [0,2,0,0,0,0|1,0,0]=3 10908 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)Br 240690a_100000755846_100016258244 [0,2,0,0,0,0|1,0,0]=3 10909 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)Cl 11a_100000185265_100016258244 [0,2,0,0,0,0|1,0,0]=3 10910 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)Cl 1626a_100000185265_100016258244 [0,2,0,0,0,0|1,0,0]=3 10911 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)Cl 240690a_100000185265_100016258244 [0,2,0,0,0,0|1,0,0]=3 10912 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)F 11a_100000199005_100016258244 [0,2,0,0,0,0|1,0,0]=3 10913 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)F 1626a_100000199005_100016258244 [0,2,0,0,0,0|1,0,0]=3 10914 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)F 240690a_100000199005_100016258244 [0,2,0,0,0,0|1,0,0]=3 10915 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NCCc2ccc(cc2)O 240690a_100000743037_100016258244 [0,2,0,0,0,0|1,0,0]=3 10916 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NNCc2ccc(cc2)Br 22a_100016993955_100016258244 [0,2,0,0,0,0|2,0,0]=4 10917 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NNCc2ccc(cc2)Cl 22a_100000689899_100016258244 [0,2,0,0,0,0|2,0,0]=4 10918 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NNCc2ccc(cc2)F 22a_100000689900_100016258244 [0,2,0,0,0,0|2,0,0]=4 10919 B22R2.4387 O=C(C=Cc1cccc(c1)Br)NNCc2ccc(cc2)I 22a_102495363730_100016258244 [0,2,0,0,0,0|2,0,0]=4 10920 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)CCCc2ccc(cc2)Br 1458a_100000184502_100011713682 [0,2,0,0,0,0|1,0,0]=3 10921 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)CCCc2ccc(cc2)Cl 1458a_100000184502_100000759440 [0,2,0,0,0,0|1,0,0]=3 10922 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)CCCc2ccc(cc2)F 1458a_100000184502_200011713563 [0,2,0,0,0,0|1,0,0]=3 10923 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)CCOc2ccc(cc2)Br 1458a_100000184502_100000183278 [0,2,0,0,0,0|2,0,0]=4 10924 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)CCOc2ccc(cc2)Cl 1458a_100000184502_100000184122 [0,2,0,0,0,0|2,0,0]=4 10925 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)CCOc2ccc(cc2)F 1458a_100000184502_100000184936 [0,2,0,0,0,0|2,0,0]=4 10926 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)Br 11a_100000755846_100000184502 [0,2,0,0,0,0|1,0,0]=3 10927 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)Br 1626a_100000755846_100000184502 [0,2,0,0,0,0|1,0,0]=3 10928 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)Br 240690a_100000755846_100000184502 [0,2,0,0,0,0|1,0,0]=3 10929 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)Cl 11a_100000185265_100000184502 [0,2,0,0,0,0|1,0,0]=3 10930 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)Cl 1626a_100000185265_100000184502 [0,2,0,0,0,0|1,0,0]=3 10931 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)Cl 240690a_100000185265_100000184502 [0,2,0,0,0,0|1,0,0]=3 10932 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)F 11a_100000199005_100000184502 [0,2,0,0,0,0|1,0,0]=3 10933 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)F 1626a_100000199005_100000184502 [0,2,0,0,0,0|1,0,0]=3 10934 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)F 240690a_100000199005_100000184502 [0,2,0,0,0,0|1,0,0]=3 10935 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NCCc2ccc(cc2)O 240690a_100000743037_100000184502 [0,2,0,0,0,0|1,0,0]=3 10936 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NNCc2ccc(cc2)Br 22a_100016993955_100000184502 [0,2,0,0,0,0|2,0,0]=4 10937 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NNCc2ccc(cc2)Cl 22a_100000689899_100000184502 [0,2,0,0,0,0|2,0,0]=4 10938 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NNCc2ccc(cc2)F 22a_100000689900_100000184502 [0,2,0,0,0,0|2,0,0]=4 10939 B22R2.4387 O=C(C=Cc1cccc(c1)Cl)NNCc2ccc(cc2)I 22a_102495363730_100000184502 [0,2,0,0,0,0|2,0,0]=4 10940 B22R2.4387 O=C(C=Cc1cccc(c1)F)CCCc2ccc(cc2)Br 1458a_100000718793_100011713682 [0,2,0,0,0,0|1,0,0]=3 10941 B22R2.4387 O=C(C=Cc1cccc(c1)F)CCCc2ccc(cc2)Cl 1458a_100000718793_100000759440 [0,2,0,0,0,0|1,0,0]=3 10942 B22R2.4387 O=C(C=Cc1cccc(c1)F)CCCc2ccc(cc2)F 1458a_100000718793_200011713563 [0,2,0,0,0,0|1,0,0]=3 10943 B22R2.4387 O=C(C=Cc1cccc(c1)F)CCOc2ccc(cc2)Br 1458a_100000718793_100000183278 [0,2,0,0,0,0|2,0,0]=4 10944 B22R2.4387 O=C(C=Cc1cccc(c1)F)CCOc2ccc(cc2)Cl 1458a_100000718793_100000184122 [0,2,0,0,0,0|2,0,0]=4 10945 B22R2.4387 O=C(C=Cc1cccc(c1)F)CCOc2ccc(cc2)F 1458a_100000718793_100000184936 [0,2,0,0,0,0|2,0,0]=4 10946 B22R2.4387 O=C(C=Cc1cccc(c1)F)CCSc2ccc(cc2)F 6a_100000210812_100000208766 [0,2,0,0,0,0|2,0,0]=4 10947 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)Br 11a_100000755846_100000718793 [0,2,0,0,0,0|1,0,0]=3 10948 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)Br 1626a_100000755846_100000718793 [0,2,0,0,0,0|1,0,0]=3 10949 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)Br 240690a_100000755846_100000718793 [0,2,0,0,0,0|1,0,0]=3 10950 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)Cl 11a_100000185265_100000718793 [0,2,0,0,0,0|1,0,0]=3 10951 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)Cl 1626a_100000185265_100000718793 [0,2,0,0,0,0|1,0,0]=3 10952 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)Cl 240690a_100000185265_100000718793 [0,2,0,0,0,0|1,0,0]=3 10953 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)F 11a_100000199005_100000718793 [0,2,0,0,0,0|1,0,0]=3 10954 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)F 1626a_100000199005_100000718793 [0,2,0,0,0,0|1,0,0]=3 10955 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)F 240690a_100000199005_100000718793 [0,2,0,0,0,0|1,0,0]=3 10956 B22R2.4387 O=C(C=Cc1cccc(c1)F)NCCc2ccc(cc2)O 240690a_100000743037_100000718793 [0,2,0,0,0,0|1,0,0]=3 10957 B22R2.4387 O=C(C=Cc1cccc(c1)F)NNCc2ccc(cc2)Br 22a_100016993955_100000718793 [0,2,0,0,0,0|2,0,0]=4 10958 B22R2.4387 O=C(C=Cc1cccc(c1)F)NNCc2ccc(cc2)Cl 22a_100000689899_100000718793 [0,2,0,0,0,0|2,0,0]=4 10959 B22R2.4387 O=C(C=Cc1cccc(c1)F)NNCc2ccc(cc2)F 22a_100000689900_100000718793 [0,2,0,0,0,0|2,0,0]=4 10960 B22R2.4387 O=C(C=Cc1cccc(c1)F)NNCc2ccc(cc2)I 22a_102495363730_100000718793 [0,2,0,0,0,0|2,0,0]=4 10961 B22R2.4387 O=C(C=Cc1cccc(c1)I)CCCc2ccc(cc2)Br 1458a_100020647043_100011713682 [0,2,0,0,0,0|1,0,0]=3 10962 B22R2.4387 O=C(C=Cc1cccc(c1)I)CCCc2ccc(cc2)Cl 1458a_100020647043_100000759440 [0,2,0,0,0,0|1,0,0]=3 10963 B22R2.4387 O=C(C=Cc1cccc(c1)I)CCCc2ccc(cc2)F 1458a_100020647043_200011713563 [0,2,0,0,0,0|1,0,0]=3 10964 B22R2.4387 O=C(C=Cc1cccc(c1)I)CCOc2ccc(cc2)Br 1458a_100020647043_100000183278 [0,2,0,0,0,0|2,0,0]=4 10965 B22R2.4387 O=C(C=Cc1cccc(c1)I)CCOc2ccc(cc2)Cl 1458a_100020647043_100000184122 [0,2,0,0,0,0|2,0,0]=4 10966 B22R2.4387 O=C(C=Cc1cccc(c1)I)CCOc2ccc(cc2)F 1458a_100020647043_100000184936 [0,2,0,0,0,0|2,0,0]=4 10967 B22R2.4387 O=C(C=Cc1cccc(c1)I)CCSc2ccc(cc2)F 6a_100000014684_100000208766 [0,2,0,0,0,0|2,0,0]=4 10968 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)Br 11a_100000755846_100020647043 [0,2,0,0,0,0|1,0,0]=3 10969 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)Br 1626a_100000755846_100020647043 [0,2,0,0,0,0|1,0,0]=3 10970 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)Br 240690a_100000755846_100020647043 [0,2,0,0,0,0|1,0,0]=3 10971 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)Cl 11a_100000185265_100020647043 [0,2,0,0,0,0|1,0,0]=3 10972 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)Cl 1626a_100000185265_100020647043 [0,2,0,0,0,0|1,0,0]=3 10973 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)Cl 240690a_100000185265_100020647043 [0,2,0,0,0,0|1,0,0]=3 10974 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)F 11a_100000199005_100020647043 [0,2,0,0,0,0|1,0,0]=3 10975 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)F 1626a_100000199005_100020647043 [0,2,0,0,0,0|1,0,0]=3 10976 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)F 240690a_100000199005_100020647043 [0,2,0,0,0,0|1,0,0]=3 10977 B22R2.4387 O=C(C=Cc1cccc(c1)I)NCCc2ccc(cc2)O 240690a_100000743037_100020647043 [0,2,0,0,0,0|1,0,0]=3 10978 B22R2.4387 O=C(C=Cc1cccc(c1)I)NNCc2ccc(cc2)Br 22a_100016993955_100020647043 [0,2,0,0,0,0|2,0,0]=4 10979 B22R2.4387 O=C(C=Cc1cccc(c1)I)NNCc2ccc(cc2)Cl 22a_100000689899_100020647043 [0,2,0,0,0,0|2,0,0]=4 10980 B22R2.4387 O=C(C=Cc1cccc(c1)I)NNCc2ccc(cc2)F 22a_100000689900_100020647043 [0,2,0,0,0,0|2,0,0]=4 10981 B22R2.4387 O=C(C=Cc1cccc(c1)I)NNCc2ccc(cc2)I 22a_102495363730_100020647043 [0,2,0,0,0,0|2,0,0]=4 10982 B22R2.4387 O=C(C=Cc1cccc(c1)O)NNCc2ccc(cc2)Br 22a_100016993955_100102525460 [0,2,0,0,0,0|2,0,0]=4 10983 B22R2.4387 O=C(C=Cc1cccc(c1)O)NNCc2ccc(cc2)Cl 22a_100000689899_100102525460 [0,2,0,0,0,0|2,0,0]=4 10984 B22R2.4387 O=C(C=Cc1cccc(c1)O)NNCc2ccc(cc2)F 22a_100000689900_100102525460 [0,2,0,0,0,0|2,0,0]=4 10985 B22R2.4387 O=C(C=Cc1cccc(c1)O)NNCc2ccc(cc2)I 22a_102495363730_100102525460 [0,2,0,0,0,0|2,0,0]=4 10986 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)CCCc2ccc(cc2)Br 1458a_100016990649_100011713682 [0,2,0,0,0,0|1,0,0]=3 10987 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)CCCc2ccc(cc2)Cl 1458a_100016990649_100000759440 [0,2,0,0,0,0|1,0,0]=3 10988 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)CCCc2ccc(cc2)F 1458a_100016990649_200011713563 [0,2,0,0,0,0|1,0,0]=3 10989 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)CCOc2ccc(cc2)Br 1458a_100016990649_100000183278 [0,2,0,0,0,0|2,0,0]=4 10990 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)CCOc2ccc(cc2)C 1458a_100016990649_100000183172 [0,2,0,0,0,0|2,0,0]=4 10991 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)CCOc2ccc(cc2)Cl 1458a_100016990649_100000184122 [0,2,0,0,0,0|2,0,0]=4 10992 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)CCOc2ccc(cc2)F 1458a_100016990649_100000184936 [0,2,0,0,0,0|2,0,0]=4 10993 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)Br 11a_100000755846_100016990649 [0,2,0,0,0,0|1,0,0]=3 10994 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)Br 1626a_100000755846_100016990649 [0,2,0,0,0,0|1,0,0]=3 10995 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)Br 527a_100000755846_100016990649 [0,2,0,0,0,0|1,0,0]=3 10996 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)C 11a_100000705350_100016990649 [0,2,0,0,0,0|1,0,0]=3 10997 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)C 1626a_100000705350_100016990649 [0,2,0,0,0,0|1,0,0]=3 10998 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)C 527a_100000705350_100016990649 [0,2,0,0,0,0|1,0,0]=3 10999 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)Cl 11a_100000185265_100016990649 [0,2,0,0,0,0|1,0,0]=3 11000 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)Cl 1626a_100000185265_100016990649 [0,2,0,0,0,0|1,0,0]=3 11001 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)Cl 527a_100000185265_100016990649 [0,2,0,0,0,0|1,0,0]=3 11002 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)F 11a_100000199005_100016990649 [0,2,0,0,0,0|1,0,0]=3 11003 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)F 1626a_100000199005_100016990649 [0,2,0,0,0,0|1,0,0]=3 11004 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)F 527a_100000199005_100016990649 [0,2,0,0,0,0|1,0,0]=3 11005 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NCCc2ccc(cc2)O 527a_100000743037_100016990649 [0,2,0,0,0,0|1,0,0]=3 11006 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NNCc2ccc(cc2)Br 22a_100016993955_100016990649 [0,2,0,0,0,0|2,0,0]=4 11007 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NNCc2ccc(cc2)C 22a_100011197965_100016990649 [0,2,0,0,0,0|2,0,0]=4 11008 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NNCc2ccc(cc2)Cl 22a_100000689899_100016990649 [0,2,0,0,0,0|2,0,0]=4 11009 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NNCc2ccc(cc2)F 22a_100000689900_100016990649 [0,2,0,0,0,0|2,0,0]=4 11010 B22R2.4396 C/C(=C\c1ccccc1)/C(=O)NNCc2ccc(cc2)I 22a_102495363730_100016990649 [0,2,0,0,0,0|2,0,0]=4 11011 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)CCCc2ccc(cc2)Br 1458a_100025712827_100011713682 [0,2,0,0,0,0|2,0,0]=4 11012 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)CCCc2ccc(cc2)Cl 1458a_100025712827_100000759440 [0,2,0,0,0,0|2,0,0]=4 11013 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)CCCc2ccc(cc2)F 1458a_100025712827_200011713563 [0,2,0,0,0,0|2,0,0]=4 11014 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)Br 11a_100000755846_100025712827 [0,2,0,0,0,0|2,0,0]=4 11015 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)Br 1626a_100000755846_100025712827 [0,2,0,0,0,0|2,0,0]=4 11016 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)Br 527a_100000755846_100025712827 [0,2,0,0,0,0|2,0,0]=4 11017 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)C 11a_100000705350_100025712827 [0,2,0,0,0,0|2,0,0]=4 11018 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)C 1626a_100000705350_100025712827 [0,2,0,0,0,0|2,0,0]=4 11019 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)C 527a_100000705350_100025712827 [0,2,0,0,0,0|2,0,0]=4 11020 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)Cl 11a_100000185265_100025712827 [0,2,0,0,0,0|2,0,0]=4 11021 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)Cl 1626a_100000185265_100025712827 [0,2,0,0,0,0|2,0,0]=4 11022 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)Cl 527a_100000185265_100025712827 [0,2,0,0,0,0|2,0,0]=4 11023 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)F 11a_100000199005_100025712827 [0,2,0,0,0,0|2,0,0]=4 11024 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)F 1626a_100000199005_100025712827 [0,2,0,0,0,0|2,0,0]=4 11025 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)F 527a_100000199005_100025712827 [0,2,0,0,0,0|2,0,0]=4 11026 B22R2.4396 C/C(=C\c1ccccn1)/C(=O)NCCc2ccc(cc2)O 527a_100000743037_100025712827 [0,2,0,0,0,0|2,0,0]=4 11027 B22R2.4396 C=C(Cc1ccccc1)C(=O)NCCc2ccc(cc2)Br 11a_100000755846_100000066491 [0,2,0,0,0,0|1,0,1]=4 11028 B22R2.4396 C=C(Cc1ccccc1)C(=O)NCCc2ccc(cc2)Br 1626a_100000755846_100000066491 [0,2,0,0,0,0|1,0,1]=4 11029 B22R2.4396 C=C(Cc1ccccc1)C(=O)NCCc2ccc(cc2)C 11a_100000705350_100000066491 [0,2,0,0,0,0|1,0,1]=4 11030 B22R2.4396 C=C(Cc1ccccc1)C(=O)NCCc2ccc(cc2)C 1626a_100000705350_100000066491 [0,2,0,0,0,0|1,0,1]=4 11031 B22R2.4396 C=C(Cc1ccccc1)C(=O)NCCc2ccc(cc2)Cl 11a_100000185265_100000066491 [0,2,0,0,0,0|1,0,1]=4 11032 B22R2.4396 C=C(Cc1ccccc1)C(=O)NCCc2ccc(cc2)Cl 1626a_100000185265_100000066491 [0,2,0,0,0,0|1,0,1]=4 11033 B22R2.4396 C=C(Cc1ccccc1)C(=O)NCCc2ccc(cc2)F 11a_100000199005_100000066491 [0,2,0,0,0,0|1,0,1]=4 11034 B22R2.4396 C=C(Cc1ccccc1)C(=O)NCCc2ccc(cc2)F 1626a_100000199005_100000066491 [0,2,0,0,0,0|1,0,1]=4 11035 B22R2.4396 Cc1ccc(cc1)CCNC(=O)/C(=C/c2ccccc2)/Cl 11a_100000705350_200020598536 [0,2,0,0,0,0|1,0,0]=3 11036 B22R2.4396 Cc1ccc(cc1)CCNC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000705350_200020598536 [0,2,0,0,0,0|1,0,0]=3 11037 B22R2.4396 Cc1ccc(cc1)CCNC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000705350_200020598536 [0,2,0,0,0,0|1,0,0]=3 11038 B22R2.4396 Cc1ccc(cc1)CCNC(=O)/C(=C/c2ccccc2)/Cl 527a_100000705350_200020598536 [0,2,0,0,0,0|1,0,0]=3 11039 B22R2.4396 Cc1ccc(cc1)CCNC(=O)/C(=C\c2ccccc2)/F 11a_100000705350_100020889036 [0,2,0,0,0,0|1,0,0]=3 11040 B22R2.4396 Cc1ccc(cc1)CCNC(=O)/C(=C\c2ccccc2)/F 527a_100000705350_100020889036 [0,2,0,0,0,0|1,0,0]=3 11041 B22R2.4396 Cc1ccc(cc1)CCNC(=O)C(=Cc2cccnc2)F 11a_100000705350_100000731744 [0,2,0,0,0,0|2,0,0]=4 11042 B22R2.4396 Cc1ccc(cc1)CCNC(=O)C(=Cc2cccnc2)F 240690a_100000705350_100000731744 [0,2,0,0,0,0|2,0,0]=4 11043 B22R2.4396 Cc1ccc(cc1)CCNC(=O)C(=Cc2cccnc2)F 527a_100000705350_100000731744 [0,2,0,0,0,0|2,0,0]=4 11044 B22R2.4396 Cc1ccc(cc1)CCNC(=O)C(=O)Nc2ccccc2 240690a_100000705350_100000738435 [0,2,0,0,0,0|2,0,0]=4 11045 B22R2.4396 Cc1ccc(cc1)CNNC(=O)/C(=C/c2ccccc2)/Cl 22a_100011197965_200020598536 [0,2,0,0,0,0|2,0,0]=4 11046 B22R2.4396 Cc1ccc(cc1)CNNC(=O)/C(=C\c2ccccc2)/F 22a_100011197965_100020889036 [0,2,0,0,0,0|2,0,0]=4 11047 B22R2.4396 Cc1ccc(cc1)OCCC(=O)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000183172 [0,2,0,0,0,0|2,0,0]=4 11048 B22R2.4396 Cc1ccc(cc1)OCCC(=O)/C(=C\c2ccccc2)/F 1458a_100020889036_100000183172 [0,2,0,0,0,0|2,0,0]=4 11049 B22R2.4396 O=C(CCCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100011713682 [0,2,0,0,0,0|1,0,0]=3 11050 B22R2.4396 O=C(CCCc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 1458a_100020889036_100011713682 [0,2,0,0,0,0|1,0,0]=3 11051 B22R2.4396 O=C(CCCc1ccc(cc1)Br)C(=Cc2cccnc2)F 1458a_100000731744_100011713682 [0,2,0,0,0,0|2,0,0]=4 11052 B22R2.4396 O=C(CCCc1ccc(cc1)Br)C(=O)Nc2ccccc2 1458a_100000738435_100011713682 [0,2,0,0,0,0|2,0,0]=4 11053 B22R2.4396 O=C(CCCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000759440 [0,2,0,0,0,0|1,0,0]=3 11054 B22R2.4396 O=C(CCCc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 1458a_100020889036_100000759440 [0,2,0,0,0,0|1,0,0]=3 11055 B22R2.4396 O=C(CCCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 1458a_100000731744_100000759440 [0,2,0,0,0,0|2,0,0]=4 11056 B22R2.4396 O=C(CCCc1ccc(cc1)Cl)C(=O)Nc2ccccc2 1458a_100000738435_100000759440 [0,2,0,0,0,0|2,0,0]=4 11057 B22R2.4396 O=C(CCCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 1458a_200020598536_200011713563 [0,2,0,0,0,0|1,0,0]=3 11058 B22R2.4396 O=C(CCCc1ccc(cc1)F)/C(=C\c2ccccc2)/F 1458a_100020889036_200011713563 [0,2,0,0,0,0|1,0,0]=3 11059 B22R2.4396 O=C(CCCc1ccc(cc1)F)C(=Cc2cccnc2)F 1458a_100000731744_200011713563 [0,2,0,0,0,0|2,0,0]=4 11060 B22R2.4396 O=C(CCCc1ccc(cc1)F)C(=O)Nc2ccccc2 1458a_100000738435_200011713563 [0,2,0,0,0,0|2,0,0]=4 11061 B22R2.4396 O=C(CCOc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000183278 [0,2,0,0,0,0|2,0,0]=4 11062 B22R2.4396 O=C(CCOc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 1458a_100020889036_100000183278 [0,2,0,0,0,0|2,0,0]=4 11063 B22R2.4396 O=C(CCOc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000184122 [0,2,0,0,0,0|2,0,0]=4 11064 B22R2.4396 O=C(CCOc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 1458a_100020889036_100000184122 [0,2,0,0,0,0|2,0,0]=4 11065 B22R2.4396 O=C(CCOc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000184936 [0,2,0,0,0,0|2,0,0]=4 11066 B22R2.4396 O=C(CCOc1ccc(cc1)F)/C(=C\c2ccccc2)/F 1458a_100020889036_100000184936 [0,2,0,0,0,0|2,0,0]=4 11067 B22R2.4396 O=C(NCCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 11a_100000755846_200020598536 [0,2,0,0,0,0|1,0,0]=3 11068 B22R2.4396 O=C(NCCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 1626a_100000755846_200020598536 [0,2,0,0,0,0|1,0,0]=3 11069 B22R2.4396 O=C(NCCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 240690a_100000755846_200020598536 [0,2,0,0,0,0|1,0,0]=3 11070 B22R2.4396 O=C(NCCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 527a_100000755846_200020598536 [0,2,0,0,0,0|1,0,0]=3 11071 B22R2.4396 O=C(NCCc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 11a_100000755846_100020889036 [0,2,0,0,0,0|1,0,0]=3 11072 B22R2.4396 O=C(NCCc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 527a_100000755846_100020889036 [0,2,0,0,0,0|1,0,0]=3 11073 B22R2.4396 O=C(NCCc1ccc(cc1)Br)C(=Cc2cccnc2)F 11a_100000755846_100000731744 [0,2,0,0,0,0|2,0,0]=4 11074 B22R2.4396 O=C(NCCc1ccc(cc1)Br)C(=Cc2cccnc2)F 240690a_100000755846_100000731744 [0,2,0,0,0,0|2,0,0]=4 11075 B22R2.4396 O=C(NCCc1ccc(cc1)Br)C(=Cc2cccnc2)F 527a_100000755846_100000731744 [0,2,0,0,0,0|2,0,0]=4 11076 B22R2.4396 O=C(NCCc1ccc(cc1)Br)C(=O)Nc2ccccc2 240690a_100000755846_100000738435 [0,2,0,0,0,0|2,0,0]=4 11077 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 11a_100000185265_200020598536 [0,2,0,0,0,0|1,0,0]=3 11078 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 1626a_100000185265_200020598536 [0,2,0,0,0,0|1,0,0]=3 11079 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 240690a_100000185265_200020598536 [0,2,0,0,0,0|1,0,0]=3 11080 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 527a_100000185265_200020598536 [0,2,0,0,0,0|1,0,0]=3 11081 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 11a_100000185265_100020889036 [0,2,0,0,0,0|1,0,0]=3 11082 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 527a_100000185265_100020889036 [0,2,0,0,0,0|1,0,0]=3 11083 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 11a_100000185265_100000731744 [0,2,0,0,0,0|2,0,0]=4 11084 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 240690a_100000185265_100000731744 [0,2,0,0,0,0|2,0,0]=4 11085 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 527a_100000185265_100000731744 [0,2,0,0,0,0|2,0,0]=4 11086 B22R2.4396 O=C(NCCc1ccc(cc1)Cl)C(=O)Nc2ccccc2 240690a_100000185265_100000738435 [0,2,0,0,0,0|2,0,0]=4 11087 B22R2.4396 O=C(NCCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 11a_100000199005_200020598536 [0,2,0,0,0,0|1,0,0]=3 11088 B22R2.4396 O=C(NCCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 1626a_100000199005_200020598536 [0,2,0,0,0,0|1,0,0]=3 11089 B22R2.4396 O=C(NCCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 240690a_100000199005_200020598536 [0,2,0,0,0,0|1,0,0]=3 11090 B22R2.4396 O=C(NCCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 527a_100000199005_200020598536 [0,2,0,0,0,0|1,0,0]=3 11091 B22R2.4396 O=C(NCCc1ccc(cc1)F)/C(=C\c2ccccc2)/F 11a_100000199005_100020889036 [0,2,0,0,0,0|1,0,0]=3 11092 B22R2.4396 O=C(NCCc1ccc(cc1)F)/C(=C\c2ccccc2)/F 527a_100000199005_100020889036 [0,2,0,0,0,0|1,0,0]=3 11093 B22R2.4396 O=C(NCCc1ccc(cc1)F)C(=Cc2cccnc2)F 11a_100000199005_100000731744 [0,2,0,0,0,0|2,0,0]=4 11094 B22R2.4396 O=C(NCCc1ccc(cc1)F)C(=Cc2cccnc2)F 240690a_100000199005_100000731744 [0,2,0,0,0,0|2,0,0]=4 11095 B22R2.4396 O=C(NCCc1ccc(cc1)F)C(=Cc2cccnc2)F 527a_100000199005_100000731744 [0,2,0,0,0,0|2,0,0]=4 11096 B22R2.4396 O=C(NCCc1ccc(cc1)F)C(=O)Nc2ccccc2 240690a_100000199005_100000738435 [0,2,0,0,0,0|2,0,0]=4 11097 B22R2.4396 O=C(NCCc1ccc(cc1)O)/C(=C/c2ccccc2)/Cl 240690a_100000743037_200020598536 [0,2,0,0,0,0|1,0,0]=3 11098 B22R2.4396 O=C(NCCc1ccc(cc1)O)/C(=C/c2ccccc2)/Cl 527a_100000743037_200020598536 [0,2,0,0,0,0|1,0,0]=3 11099 B22R2.4396 O=C(NCCc1ccc(cc1)O)/C(=C\c2ccccc2)/F 527a_100000743037_100020889036 [0,2,0,0,0,0|1,0,0]=3 11100 B22R2.4396 O=C(NCCc1ccc(cc1)O)C(=Cc2cccnc2)F 240690a_100000743037_100000731744 [0,2,0,0,0,0|2,0,0]=4 11101 B22R2.4396 O=C(NCCc1ccc(cc1)O)C(=Cc2cccnc2)F 527a_100000743037_100000731744 [0,2,0,0,0,0|2,0,0]=4 11102 B22R2.4396 O=C(NCCc1ccc(cc1)O)C(=O)Nc2ccccc2 240690a_100000743037_100000738435 [0,2,0,0,0,0|2,0,0]=4 11103 B22R2.4396 O=C(NNCc1ccc(cc1)Br)/C(=C/c2ccccc2)/Cl 22a_100016993955_200020598536 [0,2,0,0,0,0|2,0,0]=4 11104 B22R2.4396 O=C(NNCc1ccc(cc1)Br)/C(=C\c2ccccc2)/F 22a_100016993955_100020889036 [0,2,0,0,0,0|2,0,0]=4 11105 B22R2.4396 O=C(NNCc1ccc(cc1)Cl)/C(=C/c2ccccc2)/Cl 22a_100000689899_200020598536 [0,2,0,0,0,0|2,0,0]=4 11106 B22R2.4396 O=C(NNCc1ccc(cc1)Cl)/C(=C\c2ccccc2)/F 22a_100000689899_100020889036 [0,2,0,0,0,0|2,0,0]=4 11107 B22R2.4396 O=C(NNCc1ccc(cc1)F)/C(=C/c2ccccc2)/Cl 22a_100000689900_200020598536 [0,2,0,0,0,0|2,0,0]=4 11108 B22R2.4396 O=C(NNCc1ccc(cc1)F)/C(=C\c2ccccc2)/F 22a_100000689900_100020889036 [0,2,0,0,0,0|2,0,0]=4 11109 B22R2.4396 O=C(NNCc1ccc(cc1)I)/C(=C/c2ccccc2)/Cl 22a_102495363730_200020598536 [0,2,0,0,0,0|2,0,0]=4 11110 B22R2.4396 O=C(NNCc1ccc(cc1)I)/C(=C\c2ccccc2)/F 22a_102495363730_100020889036 [0,2,0,0,0,0|2,0,0]=4 11111 B22R2.22797 CC(CNC(=O)C=Cc1ccccn1)c2ccc(cc2)O 240690a_200015188644_100000740811 [0,2,0,0,0,0|2,0,0]=4 11112 B22R2.22797 CC(CNC(=O)C=Cc1cccnc1)c2ccc(cc2)O 240690a_200015188644_100000735890 [0,2,0,0,0,0|2,0,0]=4 11113 B22R2.22797 CC(CNC(=O)C=Cc1ccncc1)c2ccc(cc2)O 240690a_200015188644_100000682801 [0,2,0,0,0,0|2,0,0]=4 11114 B22R2.22797 Cc1ccc(cc1)C(=O)CCC(=O)C=Cc2ccccc2 1458a_100000210462_100000701375 [0,2,0,0,0,0|1,0,1]=4 11115 B22R2.22797 Cc1ccc(cc1)C(O)CNC(=O)C=Cc2ccccn2 240690a_200020610344_100000740811 [0,2,0,0,0,0|2,0,0]=4 11116 B22R2.22797 Cc1ccc(cc1)C(O)CNC(=O)C=Cc2cccnc2 240690a_200020610344_100000735890 [0,2,0,0,0,0|2,0,0]=4 11117 B22R2.22797 Cc1ccc(cc1)C(O)CNC(=O)C=Cc2ccncc2 240690a_200020610344_100000682801 [0,2,0,0,0,0|2,0,0]=4 11118 B22R2.22797 O=C(C=Cc1ccccc1)CCC(=O)c2ccc(cc2)F 1458a_100000210462_100000211231 [0,2,0,0,0,0|1,0,1]=4 11119 B22R2.22797 O=C(C=Cc1ccccc1)NCC(O)c2ccc(cc2)Cl 11a_100000736658_100000210462 [0,2,0,0,0,0|1,0,0]=3 11120 B22R2.22797 O=C(C=Cc1ccccn1)NCC(O)c2ccc(cc2)Br 240690a_100020626992_100000740811 [0,2,0,0,0,0|2,0,0]=4 11121 B22R2.22797 O=C(C=Cc1ccccn1)NCC(O)c2ccc(cc2)Cl 11a_100000736658_100000740811 [0,2,0,0,0,0|2,0,0]=4 11122 B22R2.22797 O=C(C=Cc1ccccn1)NCC(O)c2ccc(cc2)Cl 240690a_100000736658_100000740811 [0,2,0,0,0,0|2,0,0]=4 11123 B22R2.22797 O=C(C=Cc1ccccn1)NCC(O)c2ccc(cc2)O 240690a_100000067596_100000740811 [0,2,0,0,0,0|2,0,0]=4 11124 B22R2.22797 O=C(C=Cc1cccnc1)NCC(O)c2ccc(cc2)Br 240690a_100020626992_100000735890 [0,2,0,0,0,0|2,0,0]=4 11125 B22R2.22797 O=C(C=Cc1cccnc1)NCC(O)c2ccc(cc2)Cl 11a_100000736658_100000735890 [0,2,0,0,0,0|2,0,0]=4 11126 B22R2.22797 O=C(C=Cc1cccnc1)NCC(O)c2ccc(cc2)Cl 240690a_100000736658_100000735890 [0,2,0,0,0,0|2,0,0]=4 11127 B22R2.22797 O=C(C=Cc1cccnc1)NCC(O)c2ccc(cc2)O 240690a_100000067596_100000735890 [0,2,0,0,0,0|2,0,0]=4 11128 B22R2.22797 O=C(C=Cc1ccncc1)NCC(O)c2ccc(cc2)Br 240690a_100020626992_100000682801 [0,2,0,0,0,0|2,0,0]=4 11129 B22R2.22797 O=C(C=Cc1ccncc1)NCC(O)c2ccc(cc2)Cl 240690a_100000736658_100000682801 [0,2,0,0,0,0|2,0,0]=4 11130 B22R2.22797 O=C(C=Cc1ccncc1)NCC(O)c2ccc(cc2)O 240690a_100000067596_100000682801 [0,2,0,0,0,0|2,0,0]=4 11131 B22R2.23723 CC(CC(=O)C=Cc1ccccc1)Oc2ccc(cc2)F 1458a_100000210462_100010228477 [0,2,0,0,0,0|2,0,0]=4 11132 B22R2.23723 CC(Cc1ccc(cc1)O)NC(=O)C=Cc2ccccn2 240690a_100102634573_100000740811 [0,2,0,0,0,0|2,0,0]=4 11133 B22R2.23723 CC(Cc1ccc(cc1)O)NC(=O)C=Cc2cccnc2 240690a_100102634573_100000735890 [0,2,0,0,0,0|2,0,0]=4 11134 B22R2.23723 CC(Cc1ccc(cc1)O)NC(=O)C=Cc2ccncc2 240690a_100102634573_100000682801 [0,2,0,0,0,0|2,0,0]=4 11135 B22R2.530918 Cc1ccc(cc1)CCNS(=O)(=O)C=Cc2ccccc2 40a_100000705350_100011098038 [0,2,0,0,0,0|2,0,0]=4 11136 B22R2.530918 O=S(=O)(C=Cc1ccccc1)NCCc2ccc(cc2)Br 40a_100000755846_100011098038 [0,2,0,0,0,0|2,0,0]=4 11137 B22R2.530918 O=S(=O)(C=Cc1ccccc1)NCCc2ccc(cc2)Cl 40a_100000185265_100011098038 [0,2,0,0,0,0|2,0,0]=4 11138 B22R2.530918 O=S(=O)(C=Cc1ccccc1)NCCc2ccc(cc2)F 40a_100000199005_100011098038 [0,2,0,0,0,0|2,0,0]=4 11139 B22R2.34108 CC(=CC(=O)N(C)CCc1ccccc1)c2ccccc2 11a_100000207497_100000743005 [0,2,0,0,0,0|1,0,0]=3 11140 B22R2.34108 CC(=CC(=O)N(C)CCc1ccccc1)c2ccccc2 1626a_100000207497_100000743005 [0,2,0,0,0,0|1,0,0]=3 11141 B22R2.34108 CC(=CC(=O)N(C)CCc1ccccc1)c2ccccc2 240690a_100000207497_100000743005 [0,2,0,0,0,0|1,0,0]=3 11142 B22R2.34108 CC(=CC(=O)N(C)CCc1ccccc1)c2ccccc2 527a_100000207497_100000743005 [0,2,0,0,0,0|1,0,0]=3 11143 B22R2.34108 CC(=CC(=O)N(C)CCc1ccccn1)c2ccccc2 11a_100000737206_100000743005 [0,2,0,0,0,0|2,0,0]=4 11144 B22R2.34108 CC(=CC(=O)N(C)CCc1ccccn1)c2ccccc2 1626a_100000737206_100000743005 [0,2,0,0,0,0|2,0,0]=4 11145 B22R2.34108 CC(=CC(=O)N(C)CCc1ccccn1)c2ccccc2 240690a_100000737206_100000743005 [0,2,0,0,0,0|2,0,0]=4 11146 B22R2.34108 CC(=CC(=O)N(C)CCc1ccccn1)c2ccccc2 527a_100000737206_100000743005 [0,2,0,0,0,0|2,0,0]=4 11147 B22R2.34108 CC(=CC(=O)N(C)CCc1cccnc1)c2ccccc2 11a_100000763209_100000743005 [0,2,0,0,0,0|2,0,0]=4 11148 B22R2.34108 CC(=CC(=O)N(C)CCc1cccnc1)c2ccccc2 1626a_100000763209_100000743005 [0,2,0,0,0,0|2,0,0]=4 11149 B22R2.34108 CC(=CC(=O)N(C)CCc1cccnc1)c2ccccc2 240690a_100000763209_100000743005 [0,2,0,0,0,0|2,0,0]=4 11150 B22R2.34108 CC(=CC(=O)N(C)CCc1cccnc1)c2ccccc2 527a_100000763209_100000743005 [0,2,0,0,0,0|2,0,0]=4 11151 B22R2.34108 CC(=CC(=O)N(C)CCc1ccncc1)c2ccccc2 11a_100000742850_100000743005 [0,2,0,0,0,0|2,0,0]=4 11152 B22R2.34108 CC(=CC(=O)N(C)CCc1ccncc1)c2ccccc2 240690a_100000742850_100000743005 [0,2,0,0,0,0|2,0,0]=4 11153 B22R2.34108 CC(=CC(=O)N(C)CCc1ccncc1)c2ccccc2 527a_100000742850_100000743005 [0,2,0,0,0,0|2,0,0]=4 11154 B22R2.34108 CC(CCc1ccccc1)C(=O)CC(=O)c2ccccc2 1458a_100011435293_100000211460 [0,2,0,0,0,0|1,0,1]=4 11155 B22R2.34108 CN(CC(O)c1ccccc1)C(=O)C=Cc2ccccn2 240690a_100000227976_100000740811 [0,2,0,0,0,0|2,0,0]=4 11156 B22R2.34108 CN(CC(O)c1ccccc1)C(=O)C=Cc2cccnc2 240690a_100000227976_100000735890 [0,2,0,0,0,0|2,0,0]=4 11157 B22R2.34108 CN(CC(O)c1ccccc1)C(=O)C=Cc2ccncc2 240690a_100000227976_100000682801 [0,2,0,0,0,0|2,0,0]=4 11158 B22R2.34108 O=C(CC(=O)C(O)CCc1ccccc1)c2ccccc2 1458a_100000242596_100000211460 [0,2,0,0,0,0|1,0,1]=4 11159 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2ccccc2 11a_100000207497_100016990649 [0,2,0,0,0,0|1,0,0]=3 11160 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2ccccc2 1626a_100000207497_100016990649 [0,2,0,0,0,0|1,0,0]=3 11161 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2ccccc2 527a_100000207497_100016990649 [0,2,0,0,0,0|1,0,0]=3 11162 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2ccccn2 11a_100000737206_100016990649 [0,2,0,0,0,0|2,0,0]=4 11163 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2ccccn2 1626a_100000737206_100016990649 [0,2,0,0,0,0|2,0,0]=4 11164 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2ccccn2 527a_100000737206_100016990649 [0,2,0,0,0,0|2,0,0]=4 11165 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2cccnc2 11a_100000763209_100016990649 [0,2,0,0,0,0|2,0,0]=4 11166 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2cccnc2 1626a_100000763209_100016990649 [0,2,0,0,0,0|2,0,0]=4 11167 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2cccnc2 527a_100000763209_100016990649 [0,2,0,0,0,0|2,0,0]=4 11168 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2ccncc2 11a_100000742850_100016990649 [0,2,0,0,0,0|2,0,0]=4 11169 B22R2.34136 C/C(=C\c1ccccc1)/C(=O)N(C)CCc2ccncc2 527a_100000742850_100016990649 [0,2,0,0,0,0|2,0,0]=4 11170 B22R2.34136 C/C(=C\c1ccccn1)/C(=O)N(C)CCc2ccccc2 11a_100000207497_100025712827 [0,2,0,0,0,0|2,0,0]=4 11171 B22R2.34136 C/C(=C\c1ccccn1)/C(=O)N(C)CCc2ccccc2 1626a_100000207497_100025712827 [0,2,0,0,0,0|2,0,0]=4 11172 B22R2.34136 C/C(=C\c1ccccn1)/C(=O)N(C)CCc2ccccc2 527a_100000207497_100025712827 [0,2,0,0,0,0|2,0,0]=4 11173 B22R2.34136 C=C(Cc1ccccc1)C(=O)N(C)CCc2ccccc2 11a_100000207497_100000066491 [0,2,0,0,0,0|1,0,1]=4 11174 B22R2.34136 C=C(Cc1ccccc1)C(=O)N(C)CCc2ccccc2 1626a_100000207497_100000066491 [0,2,0,0,0,0|1,0,1]=4 11175 B22R2.34136 CC(Cc1ccccn1)N(C)C(=O)C=Cc2ccccc2 11a_200011351704_100000210462 [0,2,0,0,0,0|2,0,0]=4 11176 B22R2.34136 CC(Cc1ccccn1)N(C)C(=O)C=Cc2ccccc2 1626a_200011351704_100000210462 [0,2,0,0,0,0|2,0,0]=4 11177 B22R2.34136 CN(CCc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 11a_100000207497_200020598536 [0,2,0,0,0,0|1,0,0]=3 11178 B22R2.34136 CN(CCc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 1626a_100000207497_200020598536 [0,2,0,0,0,0|1,0,0]=3 11179 B22R2.34136 CN(CCc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 240690a_100000207497_200020598536 [0,2,0,0,0,0|1,0,0]=3 11180 B22R2.34136 CN(CCc1ccccc1)C(=O)/C(=C/c2ccccc2)/Cl 527a_100000207497_200020598536 [0,2,0,0,0,0|1,0,0]=3 11181 B22R2.34136 CN(CCc1ccccc1)C(=O)/C(=C\c2ccccc2)/F 11a_100000207497_100020889036 [0,2,0,0,0,0|1,0,0]=3 11182 B22R2.34136 CN(CCc1ccccc1)C(=O)/C(=C\c2ccccc2)/F 527a_100000207497_100020889036 [0,2,0,0,0,0|1,0,0]=3 11183 B22R2.34136 CN(CCc1ccccc1)C(=O)C(=Cc2cccnc2)F 11a_100000207497_100000731744 [0,2,0,0,0,0|2,0,0]=4 11184 B22R2.34136 CN(CCc1ccccc1)C(=O)C(=Cc2cccnc2)F 240690a_100000207497_100000731744 [0,2,0,0,0,0|2,0,0]=4 11185 B22R2.34136 CN(CCc1ccccc1)C(=O)C(=Cc2cccnc2)F 527a_100000207497_100000731744 [0,2,0,0,0,0|2,0,0]=4 11186 B22R2.34136 CN(CCc1ccccc1)C(=O)C(=O)Nc2ccccc2 240690a_100000207497_100000738435 [0,2,0,0,0,0|2,0,0]=4 11187 B22R2.34136 CN(CCc1ccccn1)C(=O)/C(=C/c2ccccc2)/Cl 11a_100000737206_200020598536 [0,2,0,0,0,0|2,0,0]=4 11188 B22R2.34136 CN(CCc1ccccn1)C(=O)/C(=C/c2ccccc2)/Cl 1626a_100000737206_200020598536 [0,2,0,0,0,0|2,0,0]=4 11189 B22R2.34136 CN(CCc1ccccn1)C(=O)/C(=C/c2ccccc2)/Cl 240690a_100000737206_200020598536 [0,2,0,0,0,0|2,0,0]=4 11190 B22R2.34136 CN(CCc1ccccn1)C(=O)/C(=C/c2ccccc2)/Cl 527a_100000737206_200020598536 [0,2,0,0,0,0|2,0,0]=4 11191 B22R2.34136 CN(CCc1ccccn1)C(=O)/C(=C\c2ccccc2)/F 11a_100000737206_100020889036 [0,2,0,0,0,0|2,0,0]=4 11192 B22R2.34136 CN(CCc1ccccn1)C(=O)/C(=C\c2ccccc2)/F 527a_100000737206_100020889036 [0,2,0,0,0,0|2,0,0]=4 11193 B22R2.34136 CN(CCc1cccnc1)C(=O)/C(=C/c2ccccc2)/Cl 11a_100000763209_200020598536 [0,2,0,0,0,0|2,0,0]=4 11194 B22R2.34136 CN(CCc1cccnc1)C(=O)/C(=C/c2ccccc2)/Cl 1626a_100000763209_200020598536 [0,2,0,0,0,0|2,0,0]=4 11195 B22R2.34136 CN(CCc1cccnc1)C(=O)/C(=C/c2ccccc2)/Cl 240690a_100000763209_200020598536 [0,2,0,0,0,0|2,0,0]=4 11196 B22R2.34136 CN(CCc1cccnc1)C(=O)/C(=C/c2ccccc2)/Cl 527a_100000763209_200020598536 [0,2,0,0,0,0|2,0,0]=4 11197 B22R2.34136 CN(CCc1cccnc1)C(=O)/C(=C\c2ccccc2)/F 11a_100000763209_100020889036 [0,2,0,0,0,0|2,0,0]=4 11198 B22R2.34136 CN(CCc1cccnc1)C(=O)/C(=C\c2ccccc2)/F 527a_100000763209_100020889036 [0,2,0,0,0,0|2,0,0]=4 11199 B22R2.34136 CN(CCc1ccncc1)C(=O)/C(=C/c2ccccc2)/Cl 11a_100000742850_200020598536 [0,2,0,0,0,0|2,0,0]=4 11200 B22R2.34136 CN(CCc1ccncc1)C(=O)/C(=C/c2ccccc2)/Cl 240690a_100000742850_200020598536 [0,2,0,0,0,0|2,0,0]=4 11201 B22R2.34136 CN(CCc1ccncc1)C(=O)/C(=C/c2ccccc2)/Cl 527a_100000742850_200020598536 [0,2,0,0,0,0|2,0,0]=4 11202 B22R2.34136 CN(CCc1ccncc1)C(=O)/C(=C\c2ccccc2)/F 11a_100000742850_100020889036 [0,2,0,0,0,0|2,0,0]=4 11203 B22R2.34136 CN(CCc1ccncc1)C(=O)/C(=C\c2ccccc2)/F 527a_100000742850_100020889036 [0,2,0,0,0,0|2,0,0]=4 11204 B22R2.121575 CCN(CCc1ccccc1)C(=O)C=Cc2ccccc2 11a_100000741020_100000210462 [0,2,0,0,0,0|1,0,0]=3 11205 B22R2.121575 CCN(CCc1ccccc1)C(=O)C=Cc2ccccc2 1626a_100000741020_100000210462 [0,2,0,0,0,0|1,0,0]=3 11206 B22R2.121575 CCN(CCc1ccccc1)C(=O)C=Cc2ccccn2 11a_100000741020_100000740811 [0,2,0,0,0,0|2,0,0]=4 11207 B22R2.121575 CCN(CCc1ccccc1)C(=O)C=Cc2ccccn2 240690a_100000741020_100000740811 [0,2,0,0,0,0|2,0,0]=4 11208 B22R2.121575 CCN(CCc1ccccc1)C(=O)C=Cc2cccnc2 11a_100000741020_100000735890 [0,2,0,0,0,0|2,0,0]=4 11209 B22R2.121575 CCN(CCc1ccccc1)C(=O)C=Cc2cccnc2 240690a_100000741020_100000735890 [0,2,0,0,0,0|2,0,0]=4 11210 B22R2.121575 CCN(CCc1ccccc1)C(=O)C=Cc2ccncc2 240690a_100000741020_100000682801 [0,2,0,0,0,0|2,0,0]=4 11211 B22R2.121575 CCN(CCc1ccccn1)C(=O)C=Cc2ccccc2 11a_100000227201_100000210462 [0,2,0,0,0,0|2,0,0]=4 11212 B22R2.121575 CCN(CCc1ccccn1)C(=O)C=Cc2ccccc2 1626a_100000227201_100000210462 [0,2,0,0,0,0|2,0,0]=4 11213 B22R2.2629293 CN(CCc1ccccc1)S(=O)(=O)C=Cc2ccccc2 40a_100000207497_100011098038 [0,2,0,0,0,0|2,0,0]=4 11214 B22R2.15465 C/C(=C\c1ccccc1)/C(=O)CCC(=O)c2ccccc2 1458a_100016990649_100000750707 [0,2,0,0,0,0|1,0,1]=4 11215 B22R2.15465 C/C(=C\c1ccccc1)/C(=O)CC[C@@H](O)c2ccccc2 1458a_100016990649_100000729684 [0,2,0,0,0,0|1,0,0]=3 11216 B22R2.15465 C/C(=C\c1ccccc1)/C(=O)NCC(C)c2ccccc2 11a_100000701038_100016990649 [0,2,0,0,0,0|1,0,0]=3 11217 B22R2.15465 C/C(=C\c1ccccc1)/C(=O)NCC(C)c2ccccc2 1626a_100000701038_100016990649 [0,2,0,0,0,0|1,0,0]=3 11218 B22R2.15465 C/C(=C\c1ccccc1)/C(=O)NCC(C)c2ccccc2 527a_100000701038_100016990649 [0,2,0,0,0,0|1,0,0]=3 11219 B22R2.15465 C/C(=C\c1ccccc1)/C(=O)NCC(O)c2ccccc2 527a_100000210709_100016990649 [0,2,0,0,0,0|1,0,0]=3 11220 B22R2.15465 C/C(=C\c1ccccc1)/C(=O)NCC(O)c2ccccn2 527a_100000691469_100016990649 [0,2,0,0,0,0|2,0,0]=4 11221 B22R2.15465 C/C(=C\c1ccccc1)/C(=O)NCC(O)c2cccnc2 527a_100020605170_100016990649 [0,2,0,0,0,0|2,0,0]=4 11222 B22R2.15465 C/C(=C\c1ccccn1)/C(=O)CC[C@@H](O)c2ccccc2 1458a_100025712827_100000729684 [0,2,0,0,0,0|2,0,0]=4 11223 B22R2.15465 C/C(=C\c1ccccn1)/C(=O)NCC(C)c2ccccc2 11a_100000701038_100025712827 [0,2,0,0,0,0|2,0,0]=4 11224 B22R2.15465 C/C(=C\c1ccccn1)/C(=O)NCC(C)c2ccccc2 1626a_100000701038_100025712827 [0,2,0,0,0,0|2,0,0]=4 11225 B22R2.15465 C/C(=C\c1ccccn1)/C(=O)NCC(C)c2ccccc2 527a_100000701038_100025712827 [0,2,0,0,0,0|2,0,0]=4 11226 B22R2.15465 C/C(=C\c1ccccn1)/C(=O)NCC(O)c2ccccc2 527a_100000210709_100025712827 [0,2,0,0,0,0|2,0,0]=4 11227 B22R2.15465 C=C(Cc1ccccc1)C(=O)NCC(C)c2ccccc2 11a_100000701038_100000066491 [0,2,0,0,0,0|1,0,1]=4 11228 B22R2.15465 C=C(Cc1ccccc1)C(=O)NCC(C)c2ccccc2 1626a_100000701038_100000066491 [0,2,0,0,0,0|1,0,1]=4 11229 B22R2.15465 CC(CNC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 11a_100000701038_200020598536 [0,2,0,0,0,0|1,0,0]=3 11230 B22R2.15465 CC(CNC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 1626a_100000701038_200020598536 [0,2,0,0,0,0|1,0,0]=3 11231 B22R2.15465 CC(CNC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 240690a_100000701038_200020598536 [0,2,0,0,0,0|1,0,0]=3 11232 B22R2.15465 CC(CNC(=O)/C(=C/c1ccccc1)/Cl)c2ccccc2 527a_100000701038_200020598536 [0,2,0,0,0,0|1,0,0]=3 11233 B22R2.15465 CC(CNC(=O)/C(=C\c1ccccc1)/F)c2ccccc2 11a_100000701038_100020889036 [0,2,0,0,0,0|1,0,0]=3 11234 B22R2.15465 CC(CNC(=O)/C(=C\c1ccccc1)/F)c2ccccc2 527a_100000701038_100020889036 [0,2,0,0,0,0|1,0,0]=3 11235 B22R2.15465 CC(CNC(=O)C(=Cc1cccnc1)F)c2ccccc2 11a_100000701038_100000731744 [0,2,0,0,0,0|2,0,0]=4 11236 B22R2.15465 CC(CNC(=O)C(=Cc1cccnc1)F)c2ccccc2 240690a_100000701038_100000731744 [0,2,0,0,0,0|2,0,0]=4 11237 B22R2.15465 CC(CNC(=O)C(=Cc1cccnc1)F)c2ccccc2 527a_100000701038_100000731744 [0,2,0,0,0,0|2,0,0]=4 11238 B22R2.15465 CC(CNC(=O)C(=O)Nc1ccccc1)c2ccccc2 240690a_100000701038_100000738435 [0,2,0,0,0,0|2,0,0]=4 11239 B22R2.15465 O=C(CCC(=O)c1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000750707 [0,2,0,0,0,0|1,0,1]=4 11240 B22R2.15465 O=C(CCC(=O)c1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000750707 [0,2,0,0,0,0|1,0,1]=4 11241 B22R2.15465 O=C(CC[C@@H](O)c1ccccc1)/C(=C/c2ccccc2)/Cl 1458a_200020598536_100000729684 [0,2,0,0,0,0|1,0,0]=3 11242 B22R2.15465 O=C(CC[C@@H](O)c1ccccc1)/C(=C\c2ccccc2)/F 1458a_100020889036_100000729684 [0,2,0,0,0,0|1,0,0]=3 11243 B22R2.15465 O=C(CC[C@@H](O)c1ccccc1)C(=Cc2cccnc2)F 1458a_100000731744_100000729684 [0,2,0,0,0,0|2,0,0]=4 11244 B22R2.15465 O=C(CC[C@@H](O)c1ccccc1)C(=O)Nc2ccccc2 1458a_100000738435_100000729684 [0,2,0,0,0,0|2,0,0]=4 11245 B22R2.15465 O=C(NCC(O)c1ccccc1)/C(=C/c2ccccc2)/Cl 240690a_100000210709_200020598536 [0,2,0,0,0,0|1,0,0]=3 11246 B22R2.15465 O=C(NCC(O)c1ccccc1)/C(=C/c2ccccc2)/Cl 527a_100000210709_200020598536 [0,2,0,0,0,0|1,0,0]=3 11247 B22R2.15465 O=C(NCC(O)c1ccccc1)/C(=C\c2ccccc2)/F 527a_100000210709_100020889036 [0,2,0,0,0,0|1,0,0]=3 11248 B22R2.15465 O=C(NCC(O)c1ccccc1)C(=Cc2cccnc2)F 240690a_100000210709_100000731744 [0,2,0,0,0,0|2,0,0]=4 11249 B22R2.15465 O=C(NCC(O)c1ccccc1)C(=Cc2cccnc2)F 527a_100000210709_100000731744 [0,2,0,0,0,0|2,0,0]=4 11250 B22R2.15465 O=C(NCC(O)c1ccccc1)C(=O)Nc2ccccc2 240690a_100000210709_100000738435 [0,2,0,0,0,0|2,0,0]=4 11251 B22R2.15465 O=C(NCC(O)c1ccccn1)/C(=C/c2ccccc2)/Cl 240690a_100000691469_200020598536 [0,2,0,0,0,0|2,0,0]=4 11252 B22R2.15465 O=C(NCC(O)c1ccccn1)/C(=C/c2ccccc2)/Cl 527a_100000691469_200020598536 [0,2,0,0,0,0|2,0,0]=4 11253 B22R2.15465 O=C(NCC(O)c1ccccn1)/C(=C\c2ccccc2)/F 527a_100000691469_100020889036 [0,2,0,0,0,0|2,0,0]=4 11254 B22R2.15465 O=C(NCC(O)c1cccnc1)/C(=C/c2ccccc2)/Cl 240690a_100020605170_200020598536 [0,2,0,0,0,0|2,0,0]=4 11255 B22R2.15465 O=C(NCC(O)c1cccnc1)/C(=C/c2ccccc2)/Cl 527a_100020605170_200020598536 [0,2,0,0,0,0|2,0,0]=4 11256 B22R2.15465 O=C(NCC(O)c1cccnc1)/C(=C\c2ccccc2)/F 527a_100020605170_100020889036 [0,2,0,0,0,0|2,0,0]=4 11257 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)Br)c2ccccc2 11a_100000701038_100016258244 [0,2,0,0,0,0|1,0,0]=3 11258 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)Br)c2ccccc2 1626a_100000701038_100016258244 [0,2,0,0,0,0|1,0,0]=3 11259 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)Br)c2ccccc2 240690a_100000701038_100016258244 [0,2,0,0,0,0|1,0,0]=3 11260 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)Cl)c2ccccc2 11a_100000701038_100000184502 [0,2,0,0,0,0|1,0,0]=3 11261 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)Cl)c2ccccc2 1626a_100000701038_100000184502 [0,2,0,0,0,0|1,0,0]=3 11262 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)Cl)c2ccccc2 240690a_100000701038_100000184502 [0,2,0,0,0,0|1,0,0]=3 11263 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)F)c2ccccc2 11a_100000701038_100000718793 [0,2,0,0,0,0|1,0,0]=3 11264 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)F)c2ccccc2 1626a_100000701038_100000718793 [0,2,0,0,0,0|1,0,0]=3 11265 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)F)c2ccccc2 240690a_100000701038_100000718793 [0,2,0,0,0,0|1,0,0]=3 11266 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)I)c2ccccc2 11a_100000701038_100020647043 [0,2,0,0,0,0|1,0,0]=3 11267 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)I)c2ccccc2 1626a_100000701038_100020647043 [0,2,0,0,0,0|1,0,0]=3 11268 B22R2.304928 CC(CNC(=O)C=Cc1cccc(c1)I)c2ccccc2 240690a_100000701038_100020647043 [0,2,0,0,0,0|1,0,0]=3 11269 B22R2.304928 Cc1cccc(c1)C=CC(=O)CCC(=O)c2ccccc2 1458a_100000690095_100000750707 [0,2,0,0,0,0|1,0,1]=4 11270 B22R2.304928 Cc1cccc(c1)C=CC(=O)CC[C@@H](O)c2ccccc2 1458a_100000690095_100000729684 [0,2,0,0,0,0|1,0,0]=3 11271 B22R2.304928 Cc1cccc(c1)C=CC(=O)NCC(C)c2ccccc2 11a_100000701038_100000690095 [0,2,0,0,0,0|1,0,0]=3 11272 B22R2.304928 Cc1cccc(c1)C=CC(=O)NCC(C)c2ccccc2 1626a_100000701038_100000690095 [0,2,0,0,0,0|1,0,0]=3 11273 B22R2.304928 Cc1cccc(c1)C=CC(=O)NCC(C)c2ccccc2 240690a_100000701038_100000690095 [0,2,0,0,0,0|1,0,0]=3 11274 B22R2.304928 Cc1cccc(c1)C=CC(=O)NCC(O)c2ccccc2 240690a_100000210709_100000690095 [0,2,0,0,0,0|1,0,0]=3 11275 B22R2.304928 Cc1cccc(c1)C=CC(=O)NCC(O)c2ccccn2 240690a_100000691469_100000690095 [0,2,0,0,0,0|2,0,0]=4 11276 B22R2.304928 Cc1cccc(c1)C=CC(=O)NCC(O)c2cccnc2 240690a_100020605170_100000690095 [0,2,0,0,0,0|2,0,0]=4 11277 B22R2.304928 O=C(C=Cc1cccc(c1)Br)CCC(=O)c2ccccc2 1458a_100016258244_100000750707 [0,2,0,0,0,0|1,0,1]=4 11278 B22R2.304928 O=C(C=Cc1cccc(c1)Br)CCC(=O)c2ccccc2 6a_100000210085_200011219833 [0,2,0,0,0,0|1,0,1]=4 11279 B22R2.304928 O=C(C=Cc1cccc(c1)Br)CC[C@@H](O)c2ccccc2 1458a_100016258244_100000729684 [0,2,0,0,0,0|1,0,0]=3 11280 B22R2.304928 O=C(C=Cc1cccc(c1)Br)NCC(O)c2ccccc2 240690a_100000210709_100016258244 [0,2,0,0,0,0|1,0,0]=3 11281 B22R2.304928 O=C(C=Cc1cccc(c1)Br)NCC(O)c2ccccn2 240690a_100000691469_100016258244 [0,2,0,0,0,0|2,0,0]=4 11282 B22R2.304928 O=C(C=Cc1cccc(c1)Br)NCC(O)c2cccnc2 240690a_100020605170_100016258244 [0,2,0,0,0,0|2,0,0]=4 11283 B22R2.304928 O=C(C=Cc1cccc(c1)Cl)CCC(=O)c2ccccc2 1458a_100000184502_100000750707 [0,2,0,0,0,0|1,0,1]=4 11284 B22R2.304928 O=C(C=Cc1cccc(c1)Cl)CC[C@@H](O)c2ccccc2 1458a_100000184502_100000729684 [0,2,0,0,0,0|1,0,0]=3 11285 B22R2.304928 O=C(C=Cc1cccc(c1)Cl)NCC(O)c2ccccc2 240690a_100000210709_100000184502 [0,2,0,0,0,0|1,0,0]=3 11286 B22R2.304928 O=C(C=Cc1cccc(c1)Cl)NCC(O)c2ccccn2 240690a_100000691469_100000184502 [0,2,0,0,0,0|2,0,0]=4 11287 B22R2.304928 O=C(C=Cc1cccc(c1)Cl)NCC(O)c2cccnc2 240690a_100020605170_100000184502 [0,2,0,0,0,0|2,0,0]=4 11288 B22R2.304928 O=C(C=Cc1cccc(c1)F)CCC(=O)c2ccccc2 1458a_100000718793_100000750707 [0,2,0,0,0,0|1,0,1]=4 11289 B22R2.304928 O=C(C=Cc1cccc(c1)F)CCC(=O)c2ccccc2 6a_100000210812_200011219833 [0,2,0,0,0,0|1,0,1]=4 11290 B22R2.304928 O=C(C=Cc1cccc(c1)F)CC[C@@H](O)c2ccccc2 1458a_100000718793_100000729684 [0,2,0,0,0,0|1,0,0]=3 11291 B22R2.304928 O=C(C=Cc1cccc(c1)F)NCC(O)c2ccccc2 240690a_100000210709_100000718793 [0,2,0,0,0,0|1,0,0]=3 11292 B22R2.304928 O=C(C=Cc1cccc(c1)F)NCC(O)c2ccccn2 240690a_100000691469_100000718793 [0,2,0,0,0,0|2,0,0]=4 11293 B22R2.304928 O=C(C=Cc1cccc(c1)F)NCC(O)c2cccnc2 240690a_100020605170_100000718793 [0,2,0,0,0,0|2,0,0]=4 11294 B22R2.304928 O=C(C=Cc1cccc(c1)I)CCC(=O)c2ccccc2 1458a_100020647043_100000750707 [0,2,0,0,0,0|1,0,1]=4 11295 B22R2.304928 O=C(C=Cc1cccc(c1)I)CCC(=O)c2ccccc2 6a_100000014684_200011219833 [0,2,0,0,0,0|1,0,1]=4 11296 B22R2.304928 O=C(C=Cc1cccc(c1)I)CC[C@@H](O)c2ccccc2 1458a_100020647043_100000729684 [0,2,0,0,0,0|1,0,0]=3 11297 B22R2.304928 O=C(C=Cc1cccc(c1)I)NCC(O)c2ccccc2 240690a_100000210709_100020647043 [0,2,0,0,0,0|1,0,0]=3 11298 B22R2.304928 O=C(C=Cc1cccc(c1)I)NCC(O)c2ccccn2 240690a_100000691469_100020647043 [0,2,0,0,0,0|2,0,0]=4 11299 B22R2.304928 O=C(C=Cc1cccc(c1)I)NCC(O)c2cccnc2 240690a_100020605170_100020647043 [0,2,0,0,0,0|2,0,0]=4 11300 B22R2.359924 CC(=CC(=O)CCC(=O)c1ccccc1)c2ccccc2 1458a_100000743005_100000750707 [0,2,0,0,0,0|1,0,1]=4 11301 B22R2.359924 CC(=CC(=O)CC[C@@H](O)c1ccccc1)c2ccccc2 1458a_100000743005_100000729684 [0,2,0,0,0,0|1,0,0]=3 11302 B22R2.359924 CC(=CC(=O)NCC(C)c1ccccc1)c2ccccc2 11a_100000701038_100000743005 [0,2,0,0,0,0|1,0,0]=3 11303 B22R2.359924 CC(=CC(=O)NCC(C)c1ccccc1)c2ccccc2 1626a_100000701038_100000743005 [0,2,0,0,0,0|1,0,0]=3 11304 B22R2.359924 CC(=CC(=O)NCC(C)c1ccccc1)c2ccccc2 240690a_100000701038_100000743005 [0,2,0,0,0,0|1,0,0]=3 11305 B22R2.359924 CC(=CC(=O)NCC(C)c1ccccc1)c2ccccc2 527a_100000701038_100000743005 [0,2,0,0,0,0|1,0,0]=3 11306 B22R2.359924 CC(=CC(=O)NCC(O)c1ccccc1)c2ccccc2 240690a_100000210709_100000743005 [0,2,0,0,0,0|1,0,0]=3 11307 B22R2.359924 CC(=CC(=O)NCC(O)c1ccccc1)c2ccccc2 527a_100000210709_100000743005 [0,2,0,0,0,0|1,0,0]=3 11308 B22R2.359924 CC(=CC(=O)NCC(O)c1ccccn1)c2ccccc2 240690a_100000691469_100000743005 [0,2,0,0,0,0|2,0,0]=4 11309 B22R2.359924 CC(=CC(=O)NCC(O)c1ccccn1)c2ccccc2 527a_100000691469_100000743005 [0,2,0,0,0,0|2,0,0]=4 11310 B22R2.359924 CC(=CC(=O)NCC(O)c1cccnc1)c2ccccc2 240690a_100020605170_100000743005 [0,2,0,0,0,0|2,0,0]=4 11311 B22R2.359924 CC(=CC(=O)NCC(O)c1cccnc1)c2ccccc2 527a_100020605170_100000743005 [0,2,0,0,0,0|2,0,0]=4 11312 B22R2.360702 CC(CNS(=O)(=O)C=Cc1ccccc1)c2ccccc2 40a_100000701038_100011098038 [0,2,0,0,0,0|2,0,0]=4 11313 B22R2.360702 O=S(=O)(C=Cc1ccccc1)NCC(O)c2ccccc2 40a_100000210709_100011098038 [0,2,0,0,0,0|2,0,0]=4 11314 B22R2.2629517 CC(C)(CNC(=O)C=Cc1ccccc1)c2ccccc2 11a_100011211644_100000210462 [0,2,0,0,0,0|1,0,0]=3 11315 B22R2.2629517 CC(C)(CNC(=O)C=Cc1ccccc1)c2ccccc2 1626a_100011211644_100000210462 [0,2,0,0,0,0|1,0,0]=3 11316 B22R2.2629517 CC(C)(CNC(=O)C=Cc1ccccn1)c2ccccc2 11a_100011211644_100000740811 [0,2,0,0,0,0|2,0,0]=4 11317 B22R2.2629517 CC(C)(CNC(=O)C=Cc1ccccn1)c2ccccc2 240690a_100011211644_100000740811 [0,2,0,0,0,0|2,0,0]=4 11318 B22R2.2629517 CC(C)(CNC(=O)C=Cc1cccnc1)c2ccccc2 11a_100011211644_100000735890 [0,2,0,0,0,0|2,0,0]=4 11319 B22R2.2629517 CC(C)(CNC(=O)C=Cc1cccnc1)c2ccccc2 240690a_100011211644_100000735890 [0,2,0,0,0,0|2,0,0]=4 11320 B22R2.2629517 CC(C)(CNC(=O)C=Cc1ccncc1)c2ccccc2 240690a_100011211644_100000682801 [0,2,0,0,0,0|2,0,0]=4 11321 B22R2.2629517 O=C(C=Cc1ccccc1)CCS(=O)(=O)c2ccccc2 1458a_100000210462_100000229977 [0,2,0,0,0,0|2,0,0]=4 11322 B22R2.2629517 O=C(C=Cc1ccccc1)NCC(F)(F)c2ccccc2 11a_100000717977_100000210462 [0,2,0,0,0,0|1,0,0]=3 11323 B22R2.2629517 O=C(C=Cc1ccccc1)NCC(F)(F)c2ccccc2 1626a_100000717977_100000210462 [0,2,0,0,0,0|1,0,0]=3 11324 B22R2.2629517 O=C(C=Cc1ccccn1)NCC(F)(F)c2ccccc2 11a_100000717977_100000740811 [0,2,0,0,0,0|2,0,0]=4 11325 B22R2.2629517 O=C(C=Cc1ccccn1)NCC(F)(F)c2ccccc2 240690a_100000717977_100000740811 [0,2,0,0,0,0|2,0,0]=4 11326 B22R2.2629517 O=C(C=Cc1cccnc1)NCC(F)(F)c2ccccc2 11a_100000717977_100000735890 [0,2,0,0,0,0|2,0,0]=4 11327 B22R2.2629517 O=C(C=Cc1cccnc1)NCC(F)(F)c2ccccc2 240690a_100000717977_100000735890 [0,2,0,0,0,0|2,0,0]=4 11328 B22R2.2629517 O=C(C=Cc1ccncc1)NCC(F)(F)c2ccccc2 240690a_100000717977_100000682801 [0,2,0,0,0,0|2,0,0]=4 11329 B22R2.15443 C/C(=C\c1ccccc1)/C(=O)CC(=O)Cc2ccccc2 1458a_100016990649_100000233483 [0,2,0,0,0,0|1,0,1]=4 11330 B22R2.15443 C/C(=C\c1ccccc1)/C(=O)NC(C)Cc2ccccn2 11a_100000238496_100016990649 [0,2,0,0,0,0|2,0,0]=4 11331 B22R2.15443 C/C(=C\c1ccccc1)/C(=O)NC(C)Cc2ccccn2 1626a_100000238496_100016990649 [0,2,0,0,0,0|2,0,0]=4 11332 B22R2.15443 C/C(=C\c1ccccc1)/C(=O)NC(C)Cc2ccccn2 527a_100000238496_100016990649 [0,2,0,0,0,0|2,0,0]=4 11333 B22R2.15443 C/C(=C\c1ccccc1)/C(=O)NC(C)Cc2cccnc2 11a_100011207255_100016990649 [0,2,0,0,0,0|2,0,0]=4 11334 B22R2.15443 C/C(=C\c1ccccc1)/C(=O)NC(C)Cc2cccnc2 1626a_100011207255_100016990649 [0,2,0,0,0,0|2,0,0]=4 11335 B22R2.15443 C/C(=C\c1ccccc1)/C(=O)NC(C)Cc2cccnc2 527a_100011207255_100016990649 [0,2,0,0,0,0|2,0,0]=4 11336 B22R2.15443 CC(Cc1ccccn1)NC(=O)/C(=C/c2ccccc2)/Cl 11a_100000238496_200020598536 [0,2,0,0,0,0|2,0,0]=4 11337 B22R2.15443 CC(Cc1ccccn1)NC(=O)/C(=C/c2ccccc2)/Cl 1626a_100000238496_200020598536 [0,2,0,0,0,0|2,0,0]=4 11338 B22R2.15443 CC(Cc1ccccn1)NC(=O)/C(=C/c2ccccc2)/Cl 240690a_100000238496_200020598536 [0,2,0,0,0,0|2,0,0]=4 11339 B22R2.15443 CC(Cc1ccccn1)NC(=O)/C(=C/c2ccccc2)/Cl 527a_100000238496_200020598536 [0,2,0,0,0,0|2,0,0]=4 11340 B22R2.15443 CC(Cc1ccccn1)NC(=O)/C(=C\c2ccccc2)/F 11a_100000238496_100020889036 [0,2,0,0,0,0|2,0,0]=4 11341 B22R2.15443 CC(Cc1ccccn1)NC(=O)/C(=C\c2ccccc2)/F 527a_100000238496_100020889036 [0,2,0,0,0,0|2,0,0]=4 11342 B22R2.15443 CC(Cc1cccnc1)NC(=O)/C(=C/c2ccccc2)/Cl 11a_100011207255_200020598536 [0,2,0,0,0,0|2,0,0]=4 11343 B22R2.15443 CC(Cc1cccnc1)NC(=O)/C(=C/c2ccccc2)/Cl 1626a_100011207255_200020598536 [0,2,0,0,0,0|2,0,0]=4 11344 B22R2.15443 CC(Cc1cccnc1)NC(=O)/C(=C/c2ccccc2)/Cl 240690a_100011207255_200020598536 [0,2,0,0,0,0|2,0,0]=4 11345 B22R2.15443 CC(Cc1cccnc1)NC(=O)/C(=C/c2ccccc2)/Cl 527a_100011207255_200020598536 [0,2,0,0,0,0|2,0,0]=4 11346 B22R2.15443 CC(Cc1cccnc1)NC(=O)/C(=C\c2ccccc2)/F 11a_100011207255_100020889036 [0,2,0,0,0,0|2,0,0]=4 11347 B22R2.15443 CC(Cc1cccnc1)NC(=O)/C(=C\c2ccccc2)/F 527a_100011207255_100020889036 [0,2,0,0,0,0|2,0,0]=4 11348 B22R2.15443 O=C(CC(=O)/C(=C/c1ccccc1)/Cl)Cc2ccccc2 1458a_200020598536_100000233483 [0,2,0,0,0,0|1,0,1]=4 11349 B22R2.15443 O=C(CC(=O)/C(=C\c1ccccc1)/F)Cc2ccccc2 1458a_100020889036_100000233483 [0,2,0,0,0,0|1,0,1]=4 11350 B22R2.17679 N#CC(Cc1ccccc1)NC(=O)C=Cc2ccccc2 11a_100000746547_100000210462 [0,2,0,0,0,0|1,0,0]=3 11351 B22R2.17679 N#CC(Cc1ccccc1)NC(=O)C=Cc2ccccc2 1626a_100000746547_100000210462 [0,2,0,0,0,0|1,0,0]=3 11352 B22R2.17679 N#CC(Cc1ccccc1)NC(=O)C=Cc2ccccn2 11a_100000746547_100000740811 [0,2,0,0,0,0|2,0,0]=4 11353 B22R2.17679 N#CC(Cc1ccccc1)NC(=O)C=Cc2ccccn2 240690a_100000746547_100000740811 [0,2,0,0,0,0|2,0,0]=4 11354 B22R2.17679 N#CC(Cc1ccccc1)NC(=O)C=Cc2cccnc2 11a_100000746547_100000735890 [0,2,0,0,0,0|2,0,0]=4 11355 B22R2.17679 N#CC(Cc1ccccc1)NC(=O)C=Cc2cccnc2 240690a_100000746547_100000735890 [0,2,0,0,0,0|2,0,0]=4 11356 B22R2.17679 N#CC(Cc1ccccc1)NC(=O)C=Cc2ccncc2 240690a_100000746547_100000682801 [0,2,0,0,0,0|2,0,0]=4 11357 B22R2.17679 O=C(C=Cc1ccccn1)NC(CO)Cc2ccccc2 240690a_100000739027_100000740811 [0,2,0,0,0,0|2,0,0]=4 11358 B22R2.17679 O=C(C=Cc1cccnc1)NC(CO)Cc2ccccc2 240690a_100000739027_100000735890 [0,2,0,0,0,0|2,0,0]=4 11359 B22R2.17679 O=C(C=Cc1ccncc1)NC(CO)Cc2ccccc2 240690a_100000739027_100000682801 [0,2,0,0,0,0|2,0,0]=4 11360 B22R2.34113 O=C(C=Cc1ccccc1)NS(=O)(=O)Cc2ccccc2 2740a_100000198533_100000210462 [0,2,0,0,0,0|2,0,0]=4 11361 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)Br 11a_100000238496_100016258244 [0,2,0,0,0,0|2,0,0]=4 11362 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)Br 1626a_100000238496_100016258244 [0,2,0,0,0,0|2,0,0]=4 11363 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)Br 240690a_100000238496_100016258244 [0,2,0,0,0,0|2,0,0]=4 11364 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)Cl 11a_100000238496_100000184502 [0,2,0,0,0,0|2,0,0]=4 11365 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)Cl 1626a_100000238496_100000184502 [0,2,0,0,0,0|2,0,0]=4 11366 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)Cl 240690a_100000238496_100000184502 [0,2,0,0,0,0|2,0,0]=4 11367 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)F 11a_100000238496_100000718793 [0,2,0,0,0,0|2,0,0]=4 11368 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)F 1626a_100000238496_100000718793 [0,2,0,0,0,0|2,0,0]=4 11369 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)F 240690a_100000238496_100000718793 [0,2,0,0,0,0|2,0,0]=4 11370 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)I 11a_100000238496_100020647043 [0,2,0,0,0,0|2,0,0]=4 11371 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)I 1626a_100000238496_100020647043 [0,2,0,0,0,0|2,0,0]=4 11372 B22R2.303774 CC(Cc1ccccn1)NC(=O)C=Cc2cccc(c2)I 240690a_100000238496_100020647043 [0,2,0,0,0,0|2,0,0]=4 11373 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)Br 11a_100011207255_100016258244 [0,2,0,0,0,0|2,0,0]=4 11374 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)Br 1626a_100011207255_100016258244 [0,2,0,0,0,0|2,0,0]=4 11375 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)Br 240690a_100011207255_100016258244 [0,2,0,0,0,0|2,0,0]=4 11376 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)Cl 11a_100011207255_100000184502 [0,2,0,0,0,0|2,0,0]=4 11377 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)Cl 1626a_100011207255_100000184502 [0,2,0,0,0,0|2,0,0]=4 11378 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)Cl 240690a_100011207255_100000184502 [0,2,0,0,0,0|2,0,0]=4 11379 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)F 11a_100011207255_100000718793 [0,2,0,0,0,0|2,0,0]=4 11380 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)F 1626a_100011207255_100000718793 [0,2,0,0,0,0|2,0,0]=4 11381 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)F 240690a_100011207255_100000718793 [0,2,0,0,0,0|2,0,0]=4 11382 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)I 11a_100011207255_100020647043 [0,2,0,0,0,0|2,0,0]=4 11383 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)I 1626a_100011207255_100020647043 [0,2,0,0,0,0|2,0,0]=4 11384 B22R2.303774 CC(Cc1cccnc1)NC(=O)C=Cc2cccc(c2)I 240690a_100011207255_100020647043 [0,2,0,0,0,0|2,0,0]=4 11385 B22R2.303774 CN(CC(=O)C=Cc1cccc(c1)Br)Cc2ccccc2 6a_100000210085_100000180320 [0,2,0,0,0,0|2,0,0]=4 11386 B22R2.303774 CN(CC(=O)C=Cc1cccc(c1)F)Cc2ccccc2 6a_100000210812_100000180320 [0,2,0,0,0,0|2,0,0]=4 11387 B22R2.303774 CN(CC(=O)C=Cc1cccc(c1)I)Cc2ccccc2 6a_100000014684_100000180320 [0,2,0,0,0,0|2,0,0]=4 11388 B22R2.303774 Cc1cccc(c1)C=CC(=O)CC(=O)Cc2ccccc2 1458a_100000690095_100000233483 [0,2,0,0,0,0|1,0,1]=4 11389 B22R2.303774 Cc1cccc(c1)C=CC(=O)NC(C)Cc2ccccn2 11a_100000238496_100000690095 [0,2,0,0,0,0|2,0,0]=4 11390 B22R2.303774 Cc1cccc(c1)C=CC(=O)NC(C)Cc2ccccn2 1626a_100000238496_100000690095 [0,2,0,0,0,0|2,0,0]=4 11391 B22R2.303774 Cc1cccc(c1)C=CC(=O)NC(C)Cc2ccccn2 240690a_100000238496_100000690095 [0,2,0,0,0,0|2,0,0]=4 11392 B22R2.303774 Cc1cccc(c1)C=CC(=O)NC(C)Cc2cccnc2 11a_100011207255_100000690095 [0,2,0,0,0,0|2,0,0]=4 11393 B22R2.303774 Cc1cccc(c1)C=CC(=O)NC(C)Cc2cccnc2 1626a_100011207255_100000690095 [0,2,0,0,0,0|2,0,0]=4 11394 B22R2.303774 Cc1cccc(c1)C=CC(=O)NC(C)Cc2cccnc2 240690a_100011207255_100000690095 [0,2,0,0,0,0|2,0,0]=4 11395 B22R2.303774 O=C(C=Cc1cccc(c1)Br)CC(=O)Cc2ccccc2 1458a_100016258244_100000233483 [0,2,0,0,0,0|1,0,1]=4 11396 B22R2.303774 O=C(C=Cc1cccc(c1)Cl)CC(=O)Cc2ccccc2 1458a_100000184502_100000233483 [0,2,0,0,0,0|1,0,1]=4 11397 B22R2.303774 O=C(C=Cc1cccc(c1)F)CC(=O)Cc2ccccc2 1458a_100000718793_100000233483 [0,2,0,0,0,0|1,0,1]=4 11398 B22R2.303774 O=C(C=Cc1cccc(c1)I)CC(=O)Cc2ccccc2 1458a_100020647043_100000233483 [0,2,0,0,0,0|1,0,1]=4 11399 B22R2.360822 CC(=CC(=O)CC(=O)Cc1ccccc1)c2ccccc2 1458a_100000743005_100000233483 [0,2,0,0,0,0|1,0,1]=4 11400 B22R2.360822 CC(=CC(=O)NC(C)Cc1ccccn1)c2ccccc2 11a_100000238496_100000743005 [0,2,0,0,0,0|2,0,0]=4 11401 B22R2.360822 CC(=CC(=O)NC(C)Cc1ccccn1)c2ccccc2 1626a_100000238496_100000743005 [0,2,0,0,0,0|2,0,0]=4 11402 B22R2.360822 CC(=CC(=O)NC(C)Cc1ccccn1)c2ccccc2 240690a_100000238496_100000743005 [0,2,0,0,0,0|2,0,0]=4 11403 B22R2.360822 CC(=CC(=O)NC(C)Cc1ccccn1)c2ccccc2 527a_100000238496_100000743005 [0,2,0,0,0,0|2,0,0]=4 11404 B22R2.360822 CC(=CC(=O)NC(C)Cc1cccnc1)c2ccccc2 11a_100011207255_100000743005 [0,2,0,0,0,0|2,0,0]=4 11405 B22R2.360822 CC(=CC(=O)NC(C)Cc1cccnc1)c2ccccc2 1626a_100011207255_100000743005 [0,2,0,0,0,0|2,0,0]=4 11406 B22R2.360822 CC(=CC(=O)NC(C)Cc1cccnc1)c2ccccc2 240690a_100011207255_100000743005 [0,2,0,0,0,0|2,0,0]=4 11407 B22R2.360822 CC(=CC(=O)NC(C)Cc1cccnc1)c2ccccc2 527a_100011207255_100000743005 [0,2,0,0,0,0|2,0,0]=4 11408 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CCCc2ccccc2)C 1458a_100016257640_100000211621 [0,2,0,0,0,0|1,0,0]=3 11409 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CCCc2ccccc2)F 1458a_100102526130_100000211621 [0,2,0,0,0,0|1,0,0]=3 11410 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CCOc2ccccc2)C 1458a_100016257640_100000184471 [0,2,0,0,0,0|2,0,0]=4 11411 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CCOc2ccccc2)F 1458a_100102526130_100000184471 [0,2,0,0,0,0|2,0,0]=4 11412 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CCSc2ccccc2)C 1458a_100016257640_100000246102 [0,2,0,0,0,0|2,0,0]=4 11413 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CCSc2ccccc2)F 1458a_100102526130_100000246102 [0,2,0,0,0,0|2,0,0]=4 11414 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)COCc2ccccc2)Br 6a_100000686105_100011215004 [0,2,0,0,0,0|2,0,0]=4 11415 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)COCc2ccccc2)C 6a_100000745632_100011215004 [0,2,0,0,0,0|2,0,0]=4 11416 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)COCc2ccccc2)Cl 6a_100000684525_100011215004 [0,2,0,0,0,0|2,0,0]=4 11417 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)COCc2ccccc2)F 6a_100011217087_100011215004 [0,2,0,0,0,0|2,0,0]=4 11418 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)COCc2ccccc2)O 6a_100009853434_100011215004 [0,2,0,0,0,0|2,0,0]=4 11419 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CSCc2ccccc2)Br 6a_100000686105_100000172147 [0,2,0,0,0,0|2,0,0]=4 11420 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CSCc2ccccc2)C 1458a_100016257640_200011217039 [0,2,0,0,0,0|2,0,0]=4 11421 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CSCc2ccccc2)C 6a_100000745632_100000172147 [0,2,0,0,0,0|2,0,0]=4 11422 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CSCc2ccccc2)Cl 6a_100000684525_100000172147 [0,2,0,0,0,0|2,0,0]=4 11423 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CSCc2ccccc2)F 1458a_100102526130_200011217039 [0,2,0,0,0,0|2,0,0]=4 11424 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CSCc2ccccc2)F 6a_100011217087_100000172147 [0,2,0,0,0,0|2,0,0]=4 11425 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)CSCc2ccccc2)O 6a_100009853434_100000172147 [0,2,0,0,0,0|2,0,0]=4 11426 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccc2)C 11a_100000106460_100016257640 [0,2,0,0,0,0|1,0,0]=3 11427 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccc2)C 1626a_100000106460_100016257640 [0,2,0,0,0,0|1,0,0]=3 11428 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccc2)C 240690a_100000106460_100016257640 [0,2,0,0,0,0|1,0,0]=3 11429 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccc2)F 11a_100000106460_100102526130 [0,2,0,0,0,0|1,0,0]=3 11430 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccc2)F 1626a_100000106460_100102526130 [0,2,0,0,0,0|1,0,0]=3 11431 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccc2)F 240690a_100000106460_100102526130 [0,2,0,0,0,0|1,0,0]=3 11432 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccn2)C 11a_100000211156_100016257640 [0,2,0,0,0,0|2,0,0]=4 11433 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccn2)C 1626a_100000211156_100016257640 [0,2,0,0,0,0|2,0,0]=4 11434 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccn2)C 240690a_100000211156_100016257640 [0,2,0,0,0,0|2,0,0]=4 11435 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccn2)F 11a_100000211156_100102526130 [0,2,0,0,0,0|2,0,0]=4 11436 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccn2)F 1626a_100000211156_100102526130 [0,2,0,0,0,0|2,0,0]=4 11437 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccccn2)F 240690a_100000211156_100102526130 [0,2,0,0,0,0|2,0,0]=4 11438 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2cccnc2)C 11a_100000736294_100016257640 [0,2,0,0,0,0|2,0,0]=4 11439 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2cccnc2)C 1626a_100000736294_100016257640 [0,2,0,0,0,0|2,0,0]=4 11440 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2cccnc2)C 240690a_100000736294_100016257640 [0,2,0,0,0,0|2,0,0]=4 11441 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2cccnc2)F 11a_100000736294_100102526130 [0,2,0,0,0,0|2,0,0]=4 11442 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2cccnc2)F 1626a_100000736294_100102526130 [0,2,0,0,0,0|2,0,0]=4 11443 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2cccnc2)F 240690a_100000736294_100102526130 [0,2,0,0,0,0|2,0,0]=4 11444 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccncc2)C 11a_100000742849_100016257640 [0,2,0,0,0,0|2,0,0]=4 11445 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccncc2)C 1626a_100000742849_100016257640 [0,2,0,0,0,0|2,0,0]=4 11446 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccncc2)C 240690a_100000742849_100016257640 [0,2,0,0,0,0|2,0,0]=4 11447 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccncc2)F 11a_100000742849_100102526130 [0,2,0,0,0,0|2,0,0]=4 11448 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccncc2)F 1626a_100000742849_100102526130 [0,2,0,0,0,0|2,0,0]=4 11449 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NCCc2ccncc2)F 240690a_100000742849_100102526130 [0,2,0,0,0,0|2,0,0]=4 11450 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NNCc2ccccc2)C 22a_100000007032_100016257640 [0,2,0,0,0,0|2,0,0]=4 11451 B22R2.127453 Cc1cc(cc(c1)C=CC(=O)NNCc2ccccc2)F 22a_100000007032_100102526130 [0,2,0,0,0,0|2,0,0]=4 11452 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)Br 34a_100000695972_200000077782 [0,2,0,0,0,0|1,0,1]=4 11453 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)Br 7a_100000695972_200000077782 [0,2,0,0,0,0|1,0,1]=4 11454 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)C 2230a_100000210930_200000077782 [0,2,0,0,0,0|1,0,1]=4 11455 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)C 34a_100000210930_200000077782 [0,2,0,0,0,0|1,0,1]=4 11456 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)C 7a_100000210930_200000077782 [0,2,0,0,0,0|1,0,1]=4 11457 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)Cl 2230a_100012022512_200000077782 [0,2,0,0,0,0|1,0,1]=4 11458 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)Cl 34a_100012022512_200000077782 [0,2,0,0,0,0|1,0,1]=4 11459 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)Cl 7a_100012022512_200000077782 [0,2,0,0,0,0|1,0,1]=4 11460 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)F 2230a_100000742734_200000077782 [0,2,0,0,0,0|1,0,1]=4 11461 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)F 34a_100000742734_200000077782 [0,2,0,0,0,0|1,0,1]=4 11462 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)F 7a_100000742734_200000077782 [0,2,0,0,0,0|1,0,1]=4 11463 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)O 34a_100011995906_200000077782 [0,2,0,0,0,0|1,0,1]=4 11464 B22R2.127453 Cc1cc(cc(c1)NCC(=O)OCCc2ccccc2)O 7a_100011995906_200000077782 [0,2,0,0,0,0|1,0,1]=4 11465 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)Br 34a_100011999630_200000077782 [0,2,0,0,0,0|1,0,1]=4 11466 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)Br 7a_100011999630_200000077782 [0,2,0,0,0,0|1,0,1]=4 11467 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)C 34a_100000210933_200000077782 [0,2,0,0,0,0|1,0,1]=4 11468 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)C 7a_100000210933_200000077782 [0,2,0,0,0,0|1,0,1]=4 11469 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)Cl 34a_100000087485_200000077782 [0,2,0,0,0,0|1,0,1]=4 11470 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)Cl 7a_100000087485_200000077782 [0,2,0,0,0,0|1,0,1]=4 11471 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)F 34a_100011830401_200000077782 [0,2,0,0,0,0|1,0,1]=4 11472 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)F 7a_100011830401_200000077782 [0,2,0,0,0,0|1,0,1]=4 11473 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)N 34a_100011995906_200000077782 [0,2,0,0,0,0|1,0,1]=4 11474 B22R2.127453 Cc1cc(cc(c1)OCC(=O)OCCc2ccccc2)N 7a_100011995906_200000077782 [0,2,0,0,0,0|1,0,1]=4 11475 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)C 62a_100011215608_200000077782 [0,2,0,0,0,0|1,0,1]=4 11476 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)C 62a_200000077782_100011215608 [0,2,0,0,0,0|1,0,1]=4 11477 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)Cl 62a_100010172791_200000077782 [0,2,0,0,0,0|1,0,1]=4 11478 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100010172791 [0,2,0,0,0,0|1,0,1]=4 11479 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)F 62a_100011356977_200000077782 [0,2,0,0,0,0|1,0,1]=4 11480 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)F 62a_200000077782_100011356977 [0,2,0,0,0,0|1,0,1]=4 11481 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)N 62a_100000695972_200000077782 [0,2,0,0,0,0|1,0,1]=4 11482 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)N 62a_200000077782_100000695972 [0,2,0,0,0,0|1,0,1]=4 11483 B22R2.127453 Cc1cc(cc(c1)SCC(=O)OCCc2ccccc2)O 62a_200000077782_100011999630 [0,2,0,0,0,0|1,0,1]=4 11484 B22R2.127453 Nc1cc(cc(c1)OCC(=O)OCCc2ccccc2)Cl 34a_100000123917_200000077782 [0,2,0,0,0,0|1,0,1]=4 11485 B22R2.127453 Nc1cc(cc(c1)OCC(=O)OCCc2ccccc2)Cl 7a_100000123917_200000077782 [0,2,0,0,0,0|1,0,1]=4 11486 B22R2.127453 Nc1cc(cc(c1)SCC(=O)OCCc2ccccc2)Br 62a_100009814763_200000077782 [0,2,0,0,0,0|1,0,1]=4 11487 B22R2.127453 Nc1cc(cc(c1)SCC(=O)OCCc2ccccc2)Br 62a_200000077782_100009814763 [0,2,0,0,0,0|1,0,1]=4 11488 B22R2.127453 Nc1cc(cc(c1)SCC(=O)OCCc2ccccc2)Cl 62a_100010147676_200000077782 [0,2,0,0,0,0|1,0,1]=4 11489 B22R2.127453 Nc1cc(cc(c1)SCC(=O)OCCc2ccccc2)Cl 62a_200000077782_100010147676 [0,2,0,0,0,0|1,0,1]=4 11490 B22R2.127453 Nc1cc(cc(c1)SCC(=O)OCCc2ccccc2)F 62a_100011356972_200000077782 [0,2,0,0,0,0|1,0,1]=4 11491 B22R2.127453 Nc1cc(cc(c1)SCC(=O)OCCc2ccccc2)F 62a_200000077782_100011356972 [0,2,0,0,0,0|1,0,1]=4 11492 B22R2.127453 Nc1cc(cc(c1)SCC(=O)OCCc2ccccc2)N 62a_100011999608_200000077782 [0,2,0,0,0,0|1,0,1]=4 11493 B22R2.127453 Nc1cc(cc(c1)SCC(=O)OCCc2ccccc2)N 62a_200000077782_100011999608 [0,2,0,0,0,0|1,0,1]=4 11494 B22R2.127453 O=C(C=Cc1cc(cc(c1)Br)Br)COCc2ccccc2 6a_100000719502_100011215004 [0,2,0,0,0,0|2,0,0]=4 11495 B22R2.127453 O=C(C=Cc1cc(cc(c1)Br)Br)CSCc2ccccc2 6a_100000719502_100000172147 [0,2,0,0,0,0|2,0,0]=4 11496 B22R2.127453 O=C(C=Cc1cc(cc(c1)Br)Cl)COCc2ccccc2 6a_100011934515_100011215004 [0,2,0,0,0,0|2,0,0]=4 11497 B22R2.127453 O=C(C=Cc1cc(cc(c1)Br)Cl)CSCc2ccccc2 6a_100011934515_100000172147 [0,2,0,0,0,0|2,0,0]=4 11498 B22R2.127453 O=C(C=Cc1cc(cc(c1)Br)F)COCc2ccccc2 6a_100011794424_100011215004 [0,2,0,0,0,0|2,0,0]=4 11499 B22R2.127453 O=C(C=Cc1cc(cc(c1)Br)F)CSCc2ccccc2 6a_100011794424_100000172147 [0,2,0,0,0,0|2,0,0]=4 11500 B22R2.127453 O=C(C=Cc1cc(cc(c1)Br)O)COCc2ccccc2 6a_100010176088_100011215004 [0,2,0,0,0,0|2,0,0]=4 11501 B22R2.127453 O=C(C=Cc1cc(cc(c1)Br)O)CSCc2ccccc2 6a_100010176088_100000172147 [0,2,0,0,0,0|2,0,0]=4 11502 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)CCCc2ccccc2 1458a_100000234795_100000211621 [0,2,0,0,0,0|1,0,0]=3 11503 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)CCOc2ccccc2 1458a_100000234795_100000184471 [0,2,0,0,0,0|2,0,0]=4 11504 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)CCSc2ccccc2 1458a_100000234795_100000246102 [0,2,0,0,0,0|2,0,0]=4 11505 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)COCc2ccccc2 6a_100000741761_100011215004 [0,2,0,0,0,0|2,0,0]=4 11506 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)CSCc2ccccc2 1458a_100000234795_200011217039 [0,2,0,0,0,0|2,0,0]=4 11507 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)CSCc2ccccc2 6a_100000741761_100000172147 [0,2,0,0,0,0|2,0,0]=4 11508 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccccc2 11a_100000106460_100000234795 [0,2,0,0,0,0|1,0,0]=3 11509 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccccc2 1626a_100000106460_100000234795 [0,2,0,0,0,0|1,0,0]=3 11510 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccccc2 240690a_100000106460_100000234795 [0,2,0,0,0,0|1,0,0]=3 11511 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccccn2 11a_100000211156_100000234795 [0,2,0,0,0,0|2,0,0]=4 11512 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccccn2 1626a_100000211156_100000234795 [0,2,0,0,0,0|2,0,0]=4 11513 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccccn2 240690a_100000211156_100000234795 [0,2,0,0,0,0|2,0,0]=4 11514 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2cccnc2 11a_100000736294_100000234795 [0,2,0,0,0,0|2,0,0]=4 11515 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2cccnc2 1626a_100000736294_100000234795 [0,2,0,0,0,0|2,0,0]=4 11516 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2cccnc2 240690a_100000736294_100000234795 [0,2,0,0,0,0|2,0,0]=4 11517 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccncc2 11a_100000742849_100000234795 [0,2,0,0,0,0|2,0,0]=4 11518 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccncc2 1626a_100000742849_100000234795 [0,2,0,0,0,0|2,0,0]=4 11519 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NCCc2ccncc2 240690a_100000742849_100000234795 [0,2,0,0,0,0|2,0,0]=4 11520 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)Cl)NNCc2ccccc2 22a_100000007032_100000234795 [0,2,0,0,0,0|2,0,0]=4 11521 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)CCCc2ccccc2 1458a_100012349021_100000211621 [0,2,0,0,0,0|1,0,0]=3 11522 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)CCOc2ccccc2 1458a_100012349021_100000184471 [0,2,0,0,0,0|2,0,0]=4 11523 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)CCSc2ccccc2 1458a_100012349021_100000246102 [0,2,0,0,0,0|2,0,0]=4 11524 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)COCc2ccccc2 6a_100000703917_100011215004 [0,2,0,0,0,0|2,0,0]=4 11525 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)CSCc2ccccc2 1458a_100012349021_200011217039 [0,2,0,0,0,0|2,0,0]=4 11526 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)CSCc2ccccc2 6a_100000703917_100000172147 [0,2,0,0,0,0|2,0,0]=4 11527 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccccc2 11a_100000106460_100012349021 [0,2,0,0,0,0|1,0,0]=3 11528 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccccc2 1626a_100000106460_100012349021 [0,2,0,0,0,0|1,0,0]=3 11529 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccccc2 240690a_100000106460_100012349021 [0,2,0,0,0,0|1,0,0]=3 11530 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccccn2 11a_100000211156_100012349021 [0,2,0,0,0,0|2,0,0]=4 11531 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccccn2 1626a_100000211156_100012349021 [0,2,0,0,0,0|2,0,0]=4 11532 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccccn2 240690a_100000211156_100012349021 [0,2,0,0,0,0|2,0,0]=4 11533 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2cccnc2 11a_100000736294_100012349021 [0,2,0,0,0,0|2,0,0]=4 11534 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2cccnc2 1626a_100000736294_100012349021 [0,2,0,0,0,0|2,0,0]=4 11535 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2cccnc2 240690a_100000736294_100012349021 [0,2,0,0,0,0|2,0,0]=4 11536 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccncc2 11a_100000742849_100012349021 [0,2,0,0,0,0|2,0,0]=4 11537 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccncc2 1626a_100000742849_100012349021 [0,2,0,0,0,0|2,0,0]=4 11538 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NCCc2ccncc2 240690a_100000742849_100012349021 [0,2,0,0,0,0|2,0,0]=4 11539 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)F)NNCc2ccccc2 22a_100000007032_100012349021 [0,2,0,0,0,0|2,0,0]=4 11540 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)O)COCc2ccccc2 6a_100000050827_100011215004 [0,2,0,0,0,0|2,0,0]=4 11541 B22R2.127453 O=C(C=Cc1cc(cc(c1)Cl)O)CSCc2ccccc2 6a_100000050827_100000172147 [0,2,0,0,0,0|2,0,0]=4 11542 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)CCCc2ccccc2 1458a_100015207409_100000211621 [0,2,0,0,0,0|1,0,0]=3 11543 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)CCOc2ccccc2 1458a_100015207409_100000184471 [0,2,0,0,0,0|2,0,0]=4 11544 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)CCSc2ccccc2 1458a_100015207409_100000246102 [0,2,0,0,0,0|2,0,0]=4 11545 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)COCc2ccccc2 6a_100000743029_100011215004 [0,2,0,0,0,0|2,0,0]=4 11546 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)CSCc2ccccc2 1458a_100015207409_200011217039 [0,2,0,0,0,0|2,0,0]=4 11547 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)CSCc2ccccc2 6a_100000743029_100000172147 [0,2,0,0,0,0|2,0,0]=4 11548 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccccc2 11a_100000106460_100015207409 [0,2,0,0,0,0|1,0,0]=3 11549 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccccc2 1626a_100000106460_100015207409 [0,2,0,0,0,0|1,0,0]=3 11550 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccccc2 240690a_100000106460_100015207409 [0,2,0,0,0,0|1,0,0]=3 11551 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccccn2 11a_100000211156_100015207409 [0,2,0,0,0,0|2,0,0]=4 11552 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccccn2 1626a_100000211156_100015207409 [0,2,0,0,0,0|2,0,0]=4 11553 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccccn2 240690a_100000211156_100015207409 [0,2,0,0,0,0|2,0,0]=4 11554 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2cccnc2 11a_100000736294_100015207409 [0,2,0,0,0,0|2,0,0]=4 11555 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2cccnc2 1626a_100000736294_100015207409 [0,2,0,0,0,0|2,0,0]=4 11556 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2cccnc2 240690a_100000736294_100015207409 [0,2,0,0,0,0|2,0,0]=4 11557 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccncc2 11a_100000742849_100015207409 [0,2,0,0,0,0|2,0,0]=4 11558 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccncc2 1626a_100000742849_100015207409 [0,2,0,0,0,0|2,0,0]=4 11559 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NCCc2ccncc2 240690a_100000742849_100015207409 [0,2,0,0,0,0|2,0,0]=4 11560 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)F)NNCc2ccccc2 22a_100000007032_100015207409 [0,2,0,0,0,0|2,0,0]=4 11561 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)O)COCc2ccccc2 6a_100000703664_100011215004 [0,2,0,0,0,0|2,0,0]=4 11562 B22R2.127453 O=C(C=Cc1cc(cc(c1)F)O)CSCc2ccccc2 6a_100000703664_100000172147 [0,2,0,0,0,0|2,0,0]=4 11563 B22R2.127453 O=C(C=Cc1cc(cc(c1)I)Br)COCc2ccccc2 6a_100010185649_100011215004 [0,2,0,0,0,0|2,0,0]=4 11564 B22R2.127453 O=C(C=Cc1cc(cc(c1)I)Br)CSCc2ccccc2 6a_100010185649_100000172147 [0,2,0,0,0,0|2,0,0]=4 11565 B22R2.127453 O=C(C=Cc1cc(cc(c1)I)F)COCc2ccccc2 6a_100010185655_100011215004 [0,2,0,0,0,0|2,0,0]=4 11566 B22R2.127453 O=C(C=Cc1cc(cc(c1)I)F)CSCc2ccccc2 6a_100010185655_100000172147 [0,2,0,0,0,0|2,0,0]=4 11567 B22R2.127453 O=C(C=Cc1cc(cc(c1)I)I)COCc2ccccc2 6a_100010185653_100011215004 [0,2,0,0,0,0|2,0,0]=4 11568 B22R2.127453 O=C(C=Cc1cc(cc(c1)I)I)CSCc2ccccc2 6a_100010185653_100000172147 [0,2,0,0,0,0|2,0,0]=4 11569 B22R2.127453 O=C(C=Cc1cc(cc(c1)O)O)COCc2ccccc2 6a_100000043415_100011215004 [0,2,0,0,0,0|2,0,0]=4 11570 B22R2.127453 O=C(C=Cc1cc(cc(c1)O)O)CSCc2ccccc2 6a_100000043415_100000172147 [0,2,0,0,0,0|2,0,0]=4 11571 B22R2.127453 O=C(C=Cc1cc(cc(c1)O)O)NNCc2ccccc2 22a_100000007032_200016280741 [0,2,0,0,0,0|2,0,0]=4 11572 B22R2.127453 O=C(CNc1cc(cc(c1)Br)Br)OCCc2ccccc2 34a_100012047176_200000077782 [0,2,0,0,0,0|1,0,1]=4 11573 B22R2.127453 O=C(CNc1cc(cc(c1)Br)Br)OCCc2ccccc2 7a_100012047176_200000077782 [0,2,0,0,0,0|1,0,1]=4 11574 B22R2.127453 O=C(CNc1cc(cc(c1)Br)Cl)OCCc2ccccc2 34a_100011934539_200000077782 [0,2,0,0,0,0|1,0,1]=4 11575 B22R2.127453 O=C(CNc1cc(cc(c1)Br)Cl)OCCc2ccccc2 7a_100011934539_200000077782 [0,2,0,0,0,0|1,0,1]=4 11576 B22R2.127453 O=C(CNc1cc(cc(c1)Br)F)OCCc2ccccc2 34a_100000705686_200000077782 [0,2,0,0,0,0|1,0,1]=4 11577 B22R2.127453 O=C(CNc1cc(cc(c1)Br)F)OCCc2ccccc2 7a_100000705686_200000077782 [0,2,0,0,0,0|1,0,1]=4 11578 B22R2.127453 O=C(CNc1cc(cc(c1)Cl)Cl)OCCc2ccccc2 34a_100000210456_200000077782 [0,2,0,0,0,0|1,0,1]=4 11579 B22R2.127453 O=C(CNc1cc(cc(c1)Cl)Cl)OCCc2ccccc2 7a_100000210456_200000077782 [0,2,0,0,0,0|1,0,1]=4 11580 B22R2.127453 O=C(CNc1cc(cc(c1)Cl)F)OCCc2ccccc2 34a_100000686136_200000077782 [0,2,0,0,0,0|1,0,1]=4 11581 B22R2.127453 O=C(CNc1cc(cc(c1)Cl)F)OCCc2ccccc2 7a_100000686136_200000077782 [0,2,0,0,0,0|1,0,1]=4 11582 B22R2.127453 O=C(CNc1cc(cc(c1)Cl)O)OCCc2ccccc2 34a_100000123917_200000077782 [0,2,0,0,0,0|1,0,1]=4 11583 B22R2.127453 O=C(CNc1cc(cc(c1)Cl)O)OCCc2ccccc2 7a_100000123917_200000077782 [0,2,0,0,0,0|1,0,1]=4 11584 B22R2.127453 O=C(CNc1cc(cc(c1)F)F)OCCc2ccccc2 34a_100000233717_200000077782 [0,2,0,0,0,0|1,0,1]=4 11585 B22R2.127453 O=C(CNc1cc(cc(c1)F)F)OCCc2ccccc2 7a_100000233717_200000077782 [0,2,0,0,0,0|1,0,1]=4 11586 B22R2.127453 O=C(CNc1cc(cc(c1)I)Br)OCCc2ccccc2 7a_100009814763_200000077782 [0,2,0,0,0,0|1,0,1]=4 11587 B22R2.127453 O=C(CNc1cc(cc(c1)I)Cl)OCCc2ccccc2 7a_100010147676_200000077782 [0,2,0,0,0,0|1,0,1]=4 11588 B22R2.127453 O=C(CNc1cc(cc(c1)I)F)OCCc2ccccc2 34a_100011356972_200000077782 [0,2,0,0,0,0|1,0,1]=4 11589 B22R2.127453 O=C(CNc1cc(cc(c1)I)F)OCCc2ccccc2 7a_100011356972_200000077782 [0,2,0,0,0,0|1,0,1]=4 11590 B22R2.127453 O=C(CNc1cc(cc(c1)I)I)OCCc2ccccc2 7a_200000696836_200000077782 [0,2,0,0,0,0|1,0,1]=4 11591 B22R2.127453 O=C(CNc1cc(cc(c1)O)O)OCCc2ccccc2 34a_100000043371_200000077782 [0,2,0,0,0,0|1,0,1]=4 11592 B22R2.127453 O=C(COc1cc(cc(c1)Br)Br)OCCc2ccccc2 34a_100010167048_200000077782 [0,2,0,0,0,0|1,0,1]=4 11593 B22R2.127453 O=C(COc1cc(cc(c1)Br)Br)OCCc2ccccc2 7a_100010167048_200000077782 [0,2,0,0,0,0|1,0,1]=4 11594 B22R2.127453 O=C(COc1cc(cc(c1)Br)Cl)OCCc2ccccc2 34a_100010185897_200000077782 [0,2,0,0,0,0|1,0,1]=4 11595 B22R2.127453 O=C(COc1cc(cc(c1)Br)Cl)OCCc2ccccc2 7a_100010185897_200000077782 [0,2,0,0,0,0|1,0,1]=4 11596 B22R2.127453 O=C(COc1cc(cc(c1)Br)F)OCCc2ccccc2 34a_100000688818_200000077782 [0,2,0,0,0,0|1,0,1]=4 11597 B22R2.127453 O=C(COc1cc(cc(c1)Br)F)OCCc2ccccc2 7a_100000688818_200000077782 [0,2,0,0,0,0|1,0,1]=4 11598 B22R2.127453 O=C(COc1cc(cc(c1)Cl)Cl)OCCc2ccccc2 34a_100000181315_200000077782 [0,2,0,0,0,0|1,0,1]=4 11599 B22R2.127453 O=C(COc1cc(cc(c1)Cl)Cl)OCCc2ccccc2 7a_100000181315_200000077782 [0,2,0,0,0,0|1,0,1]=4 11600 B22R2.127453 O=C(COc1cc(cc(c1)Cl)F)OCCc2ccccc2 34a_100011219751_200000077782 [0,2,0,0,0,0|1,0,1]=4 11601 B22R2.127453 O=C(COc1cc(cc(c1)Cl)F)OCCc2ccccc2 7a_100011219751_200000077782 [0,2,0,0,0,0|1,0,1]=4 11602 B22R2.127453 O=C(COc1cc(cc(c1)F)F)OCCc2ccccc2 34a_100000747503_200000077782 [0,2,0,0,0,0|1,0,1]=4 11603 B22R2.127453 O=C(COc1cc(cc(c1)F)F)OCCc2ccccc2 7a_100000747503_200000077782 [0,2,0,0,0,0|1,0,1]=4 11604 B22R2.127453 O=C(COc1cc(cc(c1)I)Br)OCCc2ccccc2 34a_100010068917_200000077782 [0,2,0,0,0,0|1,0,1]=4 11605 B22R2.127453 O=C(COc1cc(cc(c1)I)Br)OCCc2ccccc2 7a_100010068917_200000077782 [0,2,0,0,0,0|1,0,1]=4 11606 B22R2.127453 O=C(COc1cc(cc(c1)I)Cl)OCCc2ccccc2 34a_100010068924_200000077782 [0,2,0,0,0,0|1,0,1]=4 11607 B22R2.127453 O=C(COc1cc(cc(c1)I)Cl)OCCc2ccccc2 7a_100010068924_200000077782 [0,2,0,0,0,0|1,0,1]=4 11608 B22R2.127453 O=C(COc1cc(cc(c1)I)F)OCCc2ccccc2 34a_100000717995_200000077782 [0,2,0,0,0,0|1,0,1]=4 11609 B22R2.127453 O=C(COc1cc(cc(c1)I)F)OCCc2ccccc2 7a_100000717995_200000077782 [0,2,0,0,0,0|1,0,1]=4 11610 B22R2.127453 O=C(CSc1cc(cc(c1)Br)Br)OCCc2ccccc2 62a_100009814770_200000077782 [0,2,0,0,0,0|1,0,1]=4 11611 B22R2.127453 O=C(CSc1cc(cc(c1)Br)Br)OCCc2ccccc2 62a_200000077782_100009814770 [0,2,0,0,0,0|1,0,1]=4 11612 B22R2.127453 O=C(CSc1cc(cc(c1)Br)Cl)OCCc2ccccc2 62a_100009814755_200000077782 [0,2,0,0,0,0|1,0,1]=4 11613 B22R2.127453 O=C(CSc1cc(cc(c1)Br)Cl)OCCc2ccccc2 62a_200000077782_100009814755 [0,2,0,0,0,0|1,0,1]=4 11614 B22R2.127453 O=C(CSc1cc(cc(c1)Br)F)OCCc2ccccc2 62a_100009814764_200000077782 [0,2,0,0,0,0|1,0,1]=4 11615 B22R2.127453 O=C(CSc1cc(cc(c1)Br)F)OCCc2ccccc2 62a_200000077782_100009814764 [0,2,0,0,0,0|1,0,1]=4 11616 B22R2.127453 O=C(CSc1cc(cc(c1)Br)O)OCCc2ccccc2 62a_100010068917_200000077782 [0,2,0,0,0,0|1,0,1]=4 11617 B22R2.127453 O=C(CSc1cc(cc(c1)Br)O)OCCc2ccccc2 62a_200000077782_100010068917 [0,2,0,0,0,0|1,0,1]=4 11618 B22R2.127453 O=C(CSc1cc(cc(c1)Cl)Cl)OCCc2ccccc2 62a_100000747138_200000077782 [0,2,0,0,0,0|1,0,1]=4 11619 B22R2.127453 O=C(CSc1cc(cc(c1)Cl)Cl)OCCc2ccccc2 62a_200000077782_100000747138 [0,2,0,0,0,0|1,0,1]=4 11620 B22R2.127453 O=C(CSc1cc(cc(c1)Cl)F)OCCc2ccccc2 62a_100013859453_200000077782 [0,2,0,0,0,0|1,0,1]=4 11621 B22R2.127453 O=C(CSc1cc(cc(c1)Cl)F)OCCc2ccccc2 62a_200000077782_100013859453 [0,2,0,0,0,0|1,0,1]=4 11622 B22R2.127453 O=C(CSc1cc(cc(c1)Cl)O)OCCc2ccccc2 62a_100010068924_200000077782 [0,2,0,0,0,0|1,0,1]=4 11623 B22R2.127453 O=C(CSc1cc(cc(c1)Cl)O)OCCc2ccccc2 62a_200000077782_100010068924 [0,2,0,0,0,0|1,0,1]=4 11624 B22R2.127453 O=C(CSc1cc(cc(c1)F)F)OCCc2ccccc2 62a_100000233788_200000077782 [0,2,0,0,0,0|1,0,1]=4 11625 B22R2.127453 O=C(CSc1cc(cc(c1)F)F)OCCc2ccccc2 62a_200000077782_100000233788 [0,2,0,0,0,0|1,0,1]=4 11626 B22R2.127453 O=C(CSc1cc(cc(c1)F)O)OCCc2ccccc2 62a_100000688818_200000077782 [0,2,0,0,0,0|1,0,1]=4 11627 B22R2.127453 O=C(CSc1cc(cc(c1)F)O)OCCc2ccccc2 62a_200000077782_100000688818 [0,2,0,0,0,0|1,0,1]=4 11628 B22R2.127453 O=C(CSc1cc(cc(c1)O)O)OCCc2ccccc2 62a_200000077782_100009868816 [0,2,0,0,0,0|1,0,1]=4 11629 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)Br 2230a_100000219648_200000077782 [0,2,0,0,0,0|1,0,1]=4 11630 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)Br 269982a_100000219648_200000077782 [0,2,0,0,0,0|1,0,1]=4 11631 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)Br 34a_100000219648_200000077782 [0,2,0,0,0,0|1,0,1]=4 11632 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)Cl 2230a_100000220044_200000077782 [0,2,0,0,0,0|1,0,1]=4 11633 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)Cl 269982a_100000220044_200000077782 [0,2,0,0,0,0|1,0,1]=4 11634 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)Cl 34a_100000220044_200000077782 [0,2,0,0,0,0|1,0,1]=4 11635 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)F 2230a_100020633736_200000077782 [0,2,0,0,0,0|1,0,1]=4 11636 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)F 269982a_100020633736_200000077782 [0,2,0,0,0,0|1,0,1]=4 11637 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)F 34a_100020633736_200000077782 [0,2,0,0,0,0|1,0,1]=4 11638 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)I 2230a_100000221217_200000077782 [0,2,0,0,0,0|1,0,1]=4 11639 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)I 269982a_100000221217_200000077782 [0,2,0,0,0,0|1,0,1]=4 11640 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)I 34a_100000221217_200000077782 [0,2,0,0,0,0|1,0,1]=4 11641 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)O 2230a_100000756613_200000077782 [0,2,0,0,0,0|1,0,1]=4 11642 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)O 269982a_100000756613_200000077782 [0,2,0,0,0,0|1,0,1]=4 11643 B22R2.304301 CN(CC(=O)OCCc1ccccc1)c2cccc(c2)O 34a_100000756613_200000077782 [0,2,0,0,0,0|1,0,1]=4 11644 B22R2.304301 Cc1cccc(c1)C(=O)CC(=O)CCCc2ccccc2 1458a_100011207963_100000739480 [0,2,0,0,0,0|1,0,1]=4 11645 B22R2.304301 Cc1cccc(c1)C(=O)CC(=O)NCCc2ccccc2 1458a_100000189346_100000183012 [0,2,0,0,0,0|1,0,1]=4 11646 B22R2.304301 Cc1cccc(c1)C(=O)CC(=O)OCCc2ccccc2 1458a_100000189346_200000077782 [0,2,0,0,0,0|0,0,1]=3 11647 B22R2.304301 Cc1cccc(c1)N(C)CC(=O)OCCc2ccccc2 2230a_100000219674_200000077782 [0,2,0,0,0,0|1,0,1]=4 11648 B22R2.304301 Cc1cccc(c1)N(C)CC(=O)OCCc2ccccc2 269982a_100000219674_200000077782 [0,2,0,0,0,0|1,0,1]=4 11649 B22R2.304301 Cc1cccc(c1)N(C)CC(=O)OCCc2ccccc2 34a_100000219674_200000077782 [0,2,0,0,0,0|1,0,1]=4 11650 B22R2.304301 O=C(CC(=O)c1cccc(c1)Br)NCCc2ccccc2 1458a_100000210664_100000183012 [0,2,0,0,0,0|1,0,1]=4 11651 B22R2.304301 O=C(CC(=O)c1cccc(c1)Br)OCCc2ccccc2 1458a_100000210664_200000077782 [0,2,0,0,0,0|0,0,1]=3 11652 B22R2.304301 O=C(CC(=O)c1cccc(c1)Cl)NCCc2ccccc2 1458a_100000210390_100000183012 [0,2,0,0,0,0|1,0,1]=4 11653 B22R2.304301 O=C(CC(=O)c1cccc(c1)Cl)OCCc2ccccc2 1458a_100000210390_200000077782 [0,2,0,0,0,0|0,0,1]=3 11654 B22R2.304301 O=C(CC(=O)c1cccc(c1)F)NCCc2ccccc2 1458a_100000210950_100000183012 [0,2,0,0,0,0|1,0,1]=4 11655 B22R2.304301 O=C(CC(=O)c1cccc(c1)F)OCCc2ccccc2 1458a_100000210950_200000077782 [0,2,0,0,0,0|0,0,1]=3 11656 B22R2.304301 O=C(CC(=O)c1cccc(c1)I)NCCc2ccccc2 1458a_100000184098_100000183012 [0,2,0,0,0,0|1,0,1]=4 11657 B22R2.304301 O=C(CC(=O)c1cccc(c1)I)OCCc2ccccc2 1458a_100000184098_200000077782 [0,2,0,0,0,0|0,0,1]=3 11658 B22R2.304301 O=C(CC(=O)c1cccc(c1)O)NCCc2ccccc2 1458a_100000183914_100000183012 [0,2,0,0,0,0|1,0,1]=4 11659 B22R2.304301 O=C(CC(=O)c1cccc(c1)O)OCCc2ccccc2 1458a_100000183914_200000077782 [0,2,0,0,0,0|0,0,1]=3 11660 B22R2.304301 O=C(CCCc1ccccc1)CC(=O)c2cccc(c2)Br 1458a_100011207963_100000212080 [0,2,0,0,0,0|1,0,1]=4 11661 B22R2.304301 O=C(CCCc1ccccc1)CC(=O)c2cccc(c2)Cl 1458a_100011207963_100000211444 [0,2,0,0,0,0|1,0,1]=4 11662 B22R2.304301 O=C(CCCc1ccccc1)CC(=O)c2cccc(c2)F 1458a_100011207963_100000215616 [0,2,0,0,0,0|1,0,1]=4 11663 B22R2.304301 O=C(CCCc1ccccc1)CC(=O)c2cccc(c2)O 1458a_100011207963_100009813753 [0,2,0,0,0,0|1,0,1]=4 11664 B22R2.305086 O=C(CCCc1ccccc1)C(=O)Nc2cccc(c2)Cl 1458a_200011297299_100000211621 [0,2,0,0,0,0|2,0,0]=4 11665 B22R2.305086 O=C(CCCc1ccccc1)C(=O)Nc2cccc(c2)F 1458a_200011297300_100000211621 [0,2,0,0,0,0|2,0,0]=4 11666 B22R2.305086 O=C(NCCc1ccccc1)C(=O)Nc2cccc(c2)Cl 240690a_100000106460_200011297299 [0,2,0,0,0,0|2,0,0]=4 11667 B22R2.305086 O=C(NCCc1ccccc1)C(=O)Nc2cccc(c2)F 240690a_100000106460_200011297300 [0,2,0,0,0,0|2,0,0]=4 11668 B22R2.659280 C#Cc1cccc(c1)NCC(=O)OCCc2ccccc2 2230a_100000735509_200000077782 [0,2,0,0,0,0|1,0,1]=4 11669 B22R2.659280 C#Cc1cccc(c1)NCC(=O)OCCc2ccccc2 34a_100000735509_200000077782 [0,2,0,0,0,0|1,0,1]=4 11670 B22R2.659280 C#Cc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100011216014_200000077782 [0,2,0,0,0,0|1,0,1]=4 11671 B22R2.659280 C#Cc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100011216014_200000077782 [0,2,0,0,0,0|1,0,1]=4 11672 B22R2.659280 C=Cc1cccc(c1)NCC(=O)OCCc2ccccc2 34a_100011827668_200000077782 [0,2,0,0,0,0|1,0,1]=4 11673 B22R2.659280 C=Cc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100011309434_200000077782 [0,2,0,0,0,0|1,0,1]=4 11674 B22R2.659280 C=Cc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100011309434_200000077782 [0,2,0,0,0,0|1,0,1]=4 11675 B22R2.659280 C=Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100011215241_200000077782 [0,2,0,0,0,0|1,0,1]=4 11676 B22R2.659280 C=Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100011215241 [0,2,0,0,0,0|1,0,1]=4 11677 B22R2.659280 CCc1cccc(c1)NCC(=O)OCCc2ccccc2 2230a_100000211250_200000077782 [0,2,0,0,0,0|1,0,1]=4 11678 B22R2.659280 CCc1cccc(c1)NCC(=O)OCCc2ccccc2 34a_100000211250_200000077782 [0,2,0,0,0,0|1,0,1]=4 11679 B22R2.659280 CCc1cccc(c1)NCC(=O)OCCc2ccccc2 7a_100000211250_200000077782 [0,2,0,0,0,0|1,0,1]=4 11680 B22R2.659280 CCc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000211550_200000077782 [0,2,0,0,0,0|1,0,1]=4 11681 B22R2.659280 CCc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100000211550_200000077782 [0,2,0,0,0,0|1,0,1]=4 11682 B22R2.659280 CCc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100011263222_200000077782 [0,2,0,0,0,0|1,0,1]=4 11683 B22R2.659280 CCc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100011263222 [0,2,0,0,0,0|1,0,1]=4 11684 B22R2.659280 CNc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000756613_200000077782 [0,2,0,0,0,0|1,0,1]=4 11685 B22R2.659280 CNc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100000756613_200000077782 [0,2,0,0,0,0|1,0,1]=4 11686 B22R2.659280 CNc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100000219648_200000077782 [0,2,0,0,0,0|1,0,1]=4 11687 B22R2.659280 CNc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000219648 [0,2,0,0,0,0|1,0,1]=4 11688 B22R2.659280 COc1cccc(c1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000211917 [0,2,0,0,0,0|2,0,0]=4 11689 B22R2.659280 COc1cccc(c1)NCC(=O)OCCc2ccccc2 34a_100000210024_200000077782 [0,2,0,0,0,0|1,0,1]=4 11690 B22R2.659280 COc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000211255_200000077782 [0,2,0,0,0,0|1,0,1]=4 11691 B22R2.659280 COc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100000211255_200000077782 [0,2,0,0,0,0|1,0,1]=4 11692 B22R2.659280 COc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000170001 [0,2,0,0,0,0|1,0,1]=4 11693 B22R2.659280 CSc1cccc(c1)NCC(=O)OCCc2ccccc2 2230a_100000210049_200000077782 [0,2,0,0,0,0|1,0,1]=4 11694 B22R2.659280 CSc1cccc(c1)NCC(=O)OCCc2ccccc2 34a_100000210049_200000077782 [0,2,0,0,0,0|1,0,1]=4 11695 B22R2.659280 CSc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100011265683_200000077782 [0,2,0,0,0,0|1,0,1]=4 11696 B22R2.659280 CSc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100011265683_200000077782 [0,2,0,0,0,0|1,0,1]=4 11697 B22R2.659280 CSc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100011215954_200000077782 [0,2,0,0,0,0|1,0,1]=4 11698 B22R2.659280 CSc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100011215954 [0,2,0,0,0,0|1,0,1]=4 11699 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)CCCc2ccccc2 1458a_100000738773_100000211621 [0,2,0,0,0,0|1,0,0]=3 11700 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)CCOc2ccccc2 1458a_100000738773_100000184471 [0,2,0,0,0,0|2,0,0]=4 11701 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)CCSc2ccccc2 1458a_100000738773_100000246102 [0,2,0,0,0,0|2,0,0]=4 11702 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)CSCc2ccccc2 1458a_100000738773_200011217039 [0,2,0,0,0,0|2,0,0]=4 11703 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 11a_100000106460_100000738773 [0,2,0,0,0,0|1,0,0]=3 11704 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 1626a_100000106460_100000738773 [0,2,0,0,0,0|1,0,0]=3 11705 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccccc2 240690a_100000106460_100000738773 [0,2,0,0,0,0|1,0,0]=3 11706 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 11a_100000211156_100000738773 [0,2,0,0,0,0|2,0,0]=4 11707 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 1626a_100000211156_100000738773 [0,2,0,0,0,0|2,0,0]=4 11708 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccccn2 240690a_100000211156_100000738773 [0,2,0,0,0,0|2,0,0]=4 11709 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 11a_100000736294_100000738773 [0,2,0,0,0,0|2,0,0]=4 11710 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 1626a_100000736294_100000738773 [0,2,0,0,0,0|2,0,0]=4 11711 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2cccnc2 240690a_100000736294_100000738773 [0,2,0,0,0,0|2,0,0]=4 11712 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 11a_100000742849_100000738773 [0,2,0,0,0,0|2,0,0]=4 11713 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 1626a_100000742849_100000738773 [0,2,0,0,0,0|2,0,0]=4 11714 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NCCc2ccncc2 240690a_100000742849_100000738773 [0,2,0,0,0,0|2,0,0]=4 11715 B22R2.659280 N#Cc1cccc(c1)C=CC(=O)NNCc2ccccc2 22a_100000007032_100000738773 [0,2,0,0,0,0|2,0,0]=4 11716 B22R2.659280 N#Cc1cccc(c1)NCC(=O)OCCc2ccccc2 34a_100000210922_200000077782 [0,2,0,0,0,0|1,0,1]=4 11717 B22R2.659280 N#Cc1cccc(c1)NCC(=O)OCCc2ccccc2 7a_100000210922_200000077782 [0,2,0,0,0,0|1,0,1]=4 11718 B22R2.659280 N#Cc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000184713_200000077782 [0,2,0,0,0,0|1,0,1]=4 11719 B22R2.659280 N#Cc1cccc(c1)OCC(=O)OCCc2ccccc2 7a_100000184713_200000077782 [0,2,0,0,0,0|1,0,1]=4 11720 B22R2.659280 N#Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000189340 [0,2,0,0,0,0|1,0,1]=4 11721 B22R2.659280 NCc1cccc(c1)OCC(=O)OCCc2ccccc2 34a_100000743036_200000077782 [0,2,0,0,0,0|1,0,1]=4 11722 B22R2.659280 NCc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100000106179_200000077782 [0,2,0,0,0,0|1,0,1]=4 11723 B22R2.659280 NCc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000106179 [0,2,0,0,0,0|1,0,1]=4 11724 B22R2.659280 NNc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100000217339_200000077782 [0,2,0,0,0,0|1,0,1]=4 11725 B22R2.659280 NNc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000217339 [0,2,0,0,0,0|1,0,1]=4 11726 B22R2.659280 O=C(CNc1cccc(c1)CF)OCCc2ccccc2 2230a_100000126320_200000077782 [0,2,0,0,0,0|1,0,1]=4 11727 B22R2.659280 O=C(CNc1cccc(c1)CF)OCCc2ccccc2 34a_100000126320_200000077782 [0,2,0,0,0,0|1,0,1]=4 11728 B22R2.659280 O=C(CNc1cccc(c1)CF)OCCc2ccccc2 7a_100000126320_200000077782 [0,2,0,0,0,0|1,0,1]=4 11729 B22R2.659280 O=C(CNc1cccc(c1)CO)OCCc2ccccc2 2230a_100000211919_200000077782 [0,2,0,0,0,0|1,0,1]=4 11730 B22R2.659280 O=C(CNc1cccc(c1)CO)OCCc2ccccc2 34a_100000211919_200000077782 [0,2,0,0,0,0|1,0,1]=4 11731 B22R2.659280 O=C(COc1cccc(c1)CBr)OCCc2ccccc2 34a_100011660834_200000077782 [0,2,0,0,0,0|1,0,1]=4 11732 B22R2.659280 O=C(COc1cccc(c1)CBr)OCCc2ccccc2 7a_100011660834_200000077782 [0,2,0,0,0,0|1,0,1]=4 11733 B22R2.659280 O=C(COc1cccc(c1)CCl)OCCc2ccccc2 34a_100000084143_200000077782 [0,2,0,0,0,0|1,0,1]=4 11734 B22R2.659280 O=C(COc1cccc(c1)CCl)OCCc2ccccc2 7a_100000084143_200000077782 [0,2,0,0,0,0|1,0,1]=4 11735 B22R2.659280 O=C(COc1cccc(c1)CO)OCCc2ccccc2 34a_100011214949_200000077782 [0,2,0,0,0,0|1,0,1]=4 11736 B22R2.659280 O=C(COc1cccc(c1)CO)OCCc2ccccc2 7a_100011214949_200000077782 [0,2,0,0,0,0|1,0,1]=4 11737 B22R2.659280 O=C(CSc1cccc(c1)CF)OCCc2ccccc2 62a_100010878472_200000077782 [0,2,0,0,0,0|1,0,1]=4 11738 B22R2.659280 O=C(CSc1cccc(c1)CF)OCCc2ccccc2 62a_200000077782_100010878472 [0,2,0,0,0,0|1,0,1]=4 11739 B22R2.659280 O=C(CSc1cccc(c1)CO)OCCc2ccccc2 62a_100000687537_200000077782 [0,2,0,0,0,0|1,0,1]=4 11740 B22R2.659280 O=C(CSc1cccc(c1)CO)OCCc2ccccc2 62a_200000077782_100000687537 [0,2,0,0,0,0|1,0,1]=4 11741 B22R2.659280 O=Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_100000014684_200000077782 [0,2,0,0,0,0|1,0,1]=4 11742 B22R2.659280 O=Cc1cccc(c1)SCC(=O)OCCc2ccccc2 62a_200000077782_100000014684 [0,2,0,0,0,0|1,0,1]=4 11743 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)CCCc2ccccc2 1458a_100000162679_100000211621 [0,2,0,0,0,0|1,0,0]=3 11744 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)CCOc2ccccc2 1458a_100000162679_100000184471 [0,2,0,0,0,0|2,0,0]=4 11745 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)CCSc2ccccc2 1458a_100000162679_100000246102 [0,2,0,0,0,0|2,0,0]=4 11746 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)CSCc2ccccc2 1458a_100000162679_200011217039 [0,2,0,0,0,0|2,0,0]=4 11747 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)NCCc2ccccc2 527a_100000106460_100000162679 [0,2,0,0,0,0|1,0,0]=3 11748 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)NCCc2ccccn2 527a_100000211156_100000162679 [0,2,0,0,0,0|2,0,0]=4 11749 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)NCCc2cccnc2 527a_100000736294_100000162679 [0,2,0,0,0,0|2,0,0]=4 11750 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)NCCc2ccncc2 527a_100000742849_100000162679 [0,2,0,0,0,0|2,0,0]=4 11751 B22R2.17689 N#CC(=Cc1ccccc1)C(=O)NNCc2ccccc2 22a_100000007032_100000162679 [0,2,0,0,0,0|2,0,0]=4 11752 B22R2.359999 CC(C(=O)CCCc1ccccc1)C(=O)c2ccccc2 1458a_100011207963_100000239700 [0,2,0,0,0,0|1,0,1]=4 11753 B22R2.359999 CC(C(=O)NCCc1ccccc1)C(=O)c2ccccc2 1458a_100000185807_100000230280 [0,2,0,0,0,0|1,0,1]=4 11754 B22R2.359999 CN(C(=O)C(=O)CCCc1ccccc1)c2ccccc2 1458a_100011297159_100000211621 [0,2,0,0,0,0|2,0,0]=4 11755 B22R2.359999 CN(C(=O)C(=O)NCCc1ccccc1)c2ccccc2 1626a_100000106460_100011297159 [0,2,0,0,0,0|2,0,0]=4 11756 B22R2.359999 CN(C(=O)C(=O)NCCc1ccccc1)c2ccccc2 240690a_100000106460_100011297159 [0,2,0,0,0,0|2,0,0]=4 11757 B22R2.15496 CCN(CC(=O)OCCc1ccccc1)c2ccccc2 2230a_100000210013_200000077782 [0,2,0,0,0,0|1,0,1]=4 11758 B22R2.15496 CCN(CC(=O)OCCc1ccccc1)c2ccccc2 269982a_100000210013_200000077782 [0,2,0,0,0,0|1,0,1]=4 11759 B22R2.15496 CCN(CC(=O)OCCc1ccccc1)c2ccccc2 34a_100000210013_200000077782 [0,2,0,0,0,0|1,0,1]=4 11760 B20R2.18233 C=Cc1ccccc1C(=O)CCCc2ccccc2 1458a_100011830265_100000211621 [0,0,1,1,0,0|1,0,0]=3 11761 B20R2.18233 C=Cc1ccccc1C(=O)CCOc2ccccc2 1458a_100011830265_100000184471 [0,0,1,1,0,0|2,0,0]=4 11762 B20R2.18233 C=Cc1ccccc1C(=O)CCSc2ccccc2 1458a_100011830265_100000246102 [0,0,1,1,0,0|2,0,0]=4 11763 B20R2.18233 C=Cc1ccccc1C(=O)CSCc2ccccc2 1458a_100011830265_200011217039 [0,0,1,1,0,0|2,0,0]=4 11764 B20R2.18233 C=Cc1ccccc1C(=O)NCCc2ccccc2 1626a_100000106460_100011830265 [0,0,1,1,0,0|1,0,0]=3 11765 B20R2.18233 C=Cc1ccccc1C(=O)NCCc2ccccn2 1626a_100000211156_100011830265 [0,0,1,1,0,0|2,0,0]=4 11766 B20R2.18233 C=Cc1ccccc1C(=O)NCCc2cccnc2 1626a_100000736294_100011830265 [0,0,1,1,0,0|2,0,0]=4 11767 B20R2.18233 C=Cc1ccccc1C(=O)NCCc2ccncc2 1626a_100000742849_100011830265 [0,0,1,1,0,0|2,0,0]=4 11768 B20R2.18233 C=Cc1ccccc1C(=O)NNCc2ccccc2 22a_100000007032_100011830265 [0,0,1,1,0,0|2,0,0]=4 11769 B20R2.18233 COc1ccccc1C(=O)OCCc2ccccc2 7a_100020586055_200000210301 [0,0,1,1,0,0|1,0,1]=4 11770 B20R2.18233 [13CH3]Oc1ccccc1C(=O)OCCc2ccccc2 7a_100020586055_200025704644 [0,0,1,1,0,0|1,0,1]=4 11771 B20R2.3478 C=Cc1cccc(c1)C(=O)CCCc2ccccc2 1458a_100011215009_100000211621 [0,0,1,1,0,0|1,0,0]=3 11772 B20R2.3478 C=Cc1cccc(c1)C(=O)CCOc2ccccc2 1458a_100011215009_100000184471 [0,0,1,1,0,0|2,0,0]=4 11773 B20R2.3478 C=Cc1cccc(c1)C(=O)CCSc2ccccc2 1458a_100011215009_100000246102 [0,0,1,1,0,0|2,0,0]=4 11774 B20R2.3478 C=Cc1cccc(c1)C(=O)CSCc2ccccc2 1458a_100011215009_200011217039 [0,0,1,1,0,0|2,0,0]=4 11775 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccccc2 11a_100000106460_100011215009 [0,0,1,1,0,0|1,0,0]=3 11776 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccccc2 1626a_100000106460_100011215009 [0,0,1,1,0,0|1,0,0]=3 11777 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccccc2 240690a_100000106460_100011215009 [0,0,1,1,0,0|1,0,0]=3 11778 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccccc2 527a_100000106460_100011215009 [0,0,1,1,0,0|1,0,0]=3 11779 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccccn2 11a_100000211156_100011215009 [0,0,1,1,0,0|2,0,0]=4 11780 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccccn2 1626a_100000211156_100011215009 [0,0,1,1,0,0|2,0,0]=4 11781 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccccn2 240690a_100000211156_100011215009 [0,0,1,1,0,0|2,0,0]=4 11782 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccccn2 527a_100000211156_100011215009 [0,0,1,1,0,0|2,0,0]=4 11783 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2cccnc2 11a_100000736294_100011215009 [0,0,1,1,0,0|2,0,0]=4 11784 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2cccnc2 1626a_100000736294_100011215009 [0,0,1,1,0,0|2,0,0]=4 11785 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2cccnc2 240690a_100000736294_100011215009 [0,0,1,1,0,0|2,0,0]=4 11786 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2cccnc2 527a_100000736294_100011215009 [0,0,1,1,0,0|2,0,0]=4 11787 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccncc2 11a_100000742849_100011215009 [0,0,1,1,0,0|2,0,0]=4 11788 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccncc2 1626a_100000742849_100011215009 [0,0,1,1,0,0|2,0,0]=4 11789 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccncc2 240690a_100000742849_100011215009 [0,0,1,1,0,0|2,0,0]=4 11790 B20R2.3478 C=Cc1cccc(c1)C(=O)NCCc2ccncc2 527a_100000742849_100011215009 [0,0,1,1,0,0|2,0,0]=4 11791 B20R2.3478 C=Cc1cccc(c1)C(=O)NNCc2ccccc2 22a_100000007032_100011215009 [0,0,1,1,0,0|2,0,0]=4 11792 B20R3.2718 c1ccc(cc1)Cn2nccc2c3ccccc3 271570a_100010221185_100000210277 [1,0,0,1,0,0|2,0,0]=4 11793 B20R3.2720 c1ccc(cc1)CNc2cccc3c2cccc3 207a_100000185869_100015611070 [1,0,0,1,0,0|2,0,0]=4 11794 B20R3.2720 c1ccc(cc1)CNc2cccc3c2cccc3 34a_100000185869_100015291786 [1,0,0,1,0,0|2,0,0]=4 11795 B20R3.2720 c1ccc(cc1)COc2cccc3c2cccc3 34a_100000210388_100015291786 [1,0,0,1,0,0|2,0,0]=4 11796 B20R3.2720 c1ccc(cc1)COc2cccc3c2cccc3 7a_100000210388_100000211182 [1,0,0,1,0,0|2,0,0]=4 11797 B20R3.2720 c1ccc(cc1)CSc2cccc3c2cccc3 62a_100000211182_100000210605 [1,0,0,1,0,0|2,0,0]=4 11798 B20R3.2720 c1ccc(cc1)NCc2cccc3c2cccc3 207a_100000106764_100000210074 [1,0,0,1,0,0|2,0,0]=4 11799 B20R3.2720 c1ccc(cc1)NCc2cccc3c2cccc3 270302a_100000106764_100000210074 [1,0,0,1,0,0|2,0,0]=4 11800 B20R3.2720 c1ccc(cc1)NCc2cccc3c2cccc3 34a_100000106764_100011261445 [1,0,0,1,0,0|2,0,0]=4 11801 B20R3.2720 c1ccc(cc1)OCc2cccc3c2cccc3 34a_100000210340_100011261445 [1,0,0,1,0,0|2,0,0]=4 11802 B20R3.2720 c1ccc(cc1)OCc2cccc3c2cccc3 7a_100000210340_100011261445 [1,0,0,1,0,0|2,0,0]=4 11803 B20R3.2720 c1ccc(cc1)SCc2cccc3c2cccc3 62a_100000719477_100000188474 [1,0,0,1,0,0|2,0,0]=4 11804 B20R3.2720 c1ccc(cc1)SCc2cccc3c2cccc3 62a_100011261445_100000041952 [1,0,0,1,0,0|2,0,0]=4 11805 B20R3.2725 c1ccc(cc1)CCOc2csc3c2cccc3 34a_100000077758_100000765856 [1,0,0,1,0,0|1,0,0]=3 11806 B20R3.2725 c1ccc(cc1)CCOc2csc3c2cccc3 7a_100000077758_100000765856 [1,0,0,1,0,0|1,0,0]=3 11807 B20R3.2725 c1ccc(cc1)CCSc2coc3c2cccc3 62a_100000765856_100009812202 [1,0,0,1,0,0|1,1,0]=4 11808 B20R3.2725 c1ccc(cc1)CCSc2csc3c2cccc3 62a_100000765856_100009813928 [1,0,0,1,0,0|1,1,0]=4 11809 B20R3.2725 c1ccc(nc1)CCOc2csc3c2cccc3 7a_100000077758_100015183660 [1,0,0,1,0,0|2,0,0]=4 11810 B20R3.2725 c1ccc2c(csc2c1)OCCc3ccncc3 7a_100000077758_100000723409 [1,0,0,1,0,0|2,0,0]=4 11811 B20R3.2725 c1cncc(c1)CCOc2csc3c2cccc3 7a_100000077758_200011713674 [1,0,0,1,0,0|2,0,0]=4 11812 B20R3.30199 C(=C/c1ccccc1)\CSC2Cc3c2cccc3 62a_100009813401_100016265936 [1,0,0,1,0,0|0,1,1]=4 11813 B20R3.30199 C(=C/c1ccccc1)\CSC2Cc3c2cccc3 62a_100016265936_100009813401 [1,0,0,1,0,0|0,1,1]=4 11814 B20R3.500 O=C(Cc1ccccc1)C2CCc3c2cccc3 1458a_100000750891_100015291786 [0,0,0,1,1,0|1,0,1]=4 11815 B20R3.500 O=C(Nc1ccccc1)C2CCc3c2cccc3 11a_100000106764_100000750891 [0,0,0,1,1,0|2,0,0]=4 11816 B20R3.500 O=C(Nc1ccccc1)C2CCc3c2cccc3 1626a_100000106764_100000750891 [0,0,0,1,1,0|2,0,0]=4 11817 B20R3.500 O=C(Nc1ccccc1)C2CCc3c2cccc3 22a_100000106764_100000750891 [0,0,0,1,1,0|2,0,0]=4 11818 B20R3.500 O=C(Nc1ccccc1)C2CCc3c2cccc3 527a_100000106764_100000750891 [0,0,0,1,1,0|2,0,0]=4 11819 B20R3.16073 O=C(Cc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 1458a_100009815801_100015291786 [0,0,0,1,1,0|1,0,1]=4 11820 B20R3.16073 O=C(Nc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 11a_100000106764_100009815801 [0,0,0,1,1,0|2,0,0]=4 11821 B20R3.16073 O=C(Nc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 22a_100000106764_100009815801 [0,0,0,1,1,0|2,0,0]=4 11822 B20R3.16073 O=C(Nc1ccccc1)[C@@H]2C[C@H]2c3ccccc3 527a_100000106764_100009815801 [0,0,0,1,1,0|2,0,0]=4 11823 B20R3.30260 c1ccc(cc1)CCSc2cc3ccccc3[nH]2 62a_100000765856_100010232065 [0,0,0,1,1,0|1,1,0]=4 11824 B20R3.30260 c1ccc(cc1)CCSc2cc3ccccc3o2 62a_100000765856_100010159458 [0,0,0,1,1,0|0,1,1]=4 11825 B20R3.30260 c1ccc(cc1)CCSc2cc3ccccc3s2 62a_100000765856_100009816949 [0,0,0,1,1,0|0,2,0]=4 11826 B20R3.26404 O=C(CCc1ccccc1)C2Cc3c2cccc3 1458a_200000238571_100000765856 [0,0,0,1,1,0|0,0,2]=4 11827 B20R3.26404 O=C(NCc1ccccc1)C2Cc3c2cccc3 11a_100015324214_200000238571 [0,0,0,1,1,0|1,0,1]=4 11828 B20R3.26404 O=C(NCc1ccccc1)C2Cc3c2cccc3 1626a_100015324214_200000238571 [0,0,0,1,1,0|1,0,1]=4 11829 B20R3.26404 O=C(NCc1ccccc1)C2Cc3c2cccc3 240690a_100015324214_200000238571 [0,0,0,1,1,0|1,0,1]=4 11830 B20R3.26404 O=C(NCc1ccccc1)C2Cc3c2cccc3 527a_100015324214_200000238571 [0,0,0,1,1,0|1,0,1]=4 11831 B20R3.26404 O=C(NNc1ccccc1)C2Cc3c2cccc3 22a_100015195140_200000238571 [0,0,0,1,1,0|2,0,0]=4 11832 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3c2 207a_100000211940_100015611070 [0,0,0,1,1,0|2,0,0]=4 11833 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3c2 270302a_100000211940_100015611070 [0,0,0,1,1,0|2,0,0]=4 11834 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3c2 34a_100000211940_100015291786 [0,0,0,1,1,0|2,0,0]=4 11835 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3c2 7a_100000211940_100000211182 [0,0,0,1,1,0|2,0,0]=4 11836 B20R3.30190 c1ccc(cc1)CNc2ccc3ccccc3n2 27a_100015324214_100011291633 [0,0,0,1,1,0|2,0,0]=4 11837 B20R3.30190 c1ccc(cc1)COc2ccc3ccccc3c2 34a_100000185828_100015291786 [0,0,0,1,1,0|1,0,0]=3 11838 B20R3.30190 c1ccc(cc1)COc2ccc3ccccc3c2 7a_100000185828_100000211182 [0,0,0,1,1,0|1,0,0]=3 11839 B20R3.30190 c1ccc(cc1)COc2ccc3cccnc3c2 34a_100011216045_100015291786 [0,0,0,1,1,0|2,0,0]=4 11840 B20R3.30190 c1ccc(cc1)COc2ccc3ccncc3c2 7a_100000752006_100000211182 [0,0,0,1,1,0|2,0,0]=4 11841 B20R3.30190 c1ccc(cc1)COc2ccc3cnccc3c2 34a_100000046372_100015291786 [0,0,0,1,1,0|2,0,0]=4 11842 B20R3.30190 c1ccc(cc1)COc2ccc3cnccc3c2 7a_100000046372_100000211182 [0,0,0,1,1,0|2,0,0]=4 11843 B20R3.30190 c1ccc(cc1)COc2ccc3ncccc3c2 34a_100011215586_100015291786 [0,0,0,1,1,0|2,0,0]=4 11844 B20R3.30190 c1ccc(cc1)COc2ccc3ncccc3c2 7a_100011215586_100000211182 [0,0,0,1,1,0|2,0,0]=4 11845 B20R3.30190 c1ccc(cc1)COc2cnc3ccccc3c2 34a_100011934006_100015291786 [0,0,0,1,1,0|2,0,0]=4 11846 B20R3.30190 c1ccc(cc1)COc2cnc3ccccc3c2 7a_100011934006_100000211182 [0,0,0,1,1,0|2,0,0]=4 11847 B20R3.30190 c1ccc(cc1)CSc2ccc3ccccc3c2 62a_100000211182_100000233703 [0,0,0,1,1,0|1,1,0]=4 11848 B20R3.30190 c1ccc(cc1)CSc2ccc3ccccc3n2 62a_100000211182_100011291633 [0,0,0,1,1,0|1,1,0]=4 11849 B20R3.30190 c1ccc(cc1)CSc2ccc3ccccc3n2 62a_100011291633_100015291786 [0,0,0,1,1,0|1,1,0]=4 11850 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3c2 207a_100000106764_100000211584 [0,0,0,1,1,0|2,0,0]=4 11851 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3c2 270302a_100000106764_100000211584 [0,0,0,1,1,0|2,0,0]=4 11852 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3c2 34a_100000106764_100011216711 [0,0,0,1,1,0|2,0,0]=4 11853 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3n2 207a_100000106764_100000759686 [0,0,0,1,1,0|2,0,0]=4 11854 B20R3.30190 c1ccc(cc1)NCc2ccc3ccccc3n2 34a_100000106764_100000737579 [0,0,0,1,1,0|2,0,0]=4 11855 B20R3.30190 c1ccc(cc1)OCc2ccc3ccccc3c2 34a_100000210340_100011216711 [0,0,0,1,1,0|2,0,0]=4 11856 B20R3.30190 c1ccc(cc1)OCc2ccc3ccccc3c2 7a_100000210340_100011216711 [0,0,0,1,1,0|2,0,0]=4 11857 B20R3.30190 c1ccc(cc1)OCc2ccc3ccccc3n2 34a_100000210340_100000737579 [0,0,0,1,1,0|2,0,0]=4 11858 B20R3.30190 c1ccc(cc1)OCc2ccc3ccccc3n2 7a_100000210340_100000737579 [0,0,0,1,1,0|2,0,0]=4 11859 B20R3.30190 c1ccc(cc1)SCc2ccc3ccccc3c2 62a_100000719477_100011216711 [0,0,0,1,1,0|2,0,0]=4 11860 B20R3.30190 c1ccc(cc1)SCc2ccc3ccccc3c2 62a_100011216711_100000041952 [0,0,0,1,1,0|2,0,0]=4 11861 B20R3.30190 c1ccc(cc1)SCc2ccc3ccccc3n2 62a_100000719477_100000737579 [0,0,0,1,1,0|2,0,0]=4 11862 B20R3.30190 c1ccc(cc1)SCc2ccc3ccccc3n2 62a_100000737579_100000041952 [0,0,0,1,1,0|2,0,0]=4 11863 B20R3.30190 c1ccc(nc1)COc2ccc3ccccc3c2 34a_100000185828_100000721315 [0,0,0,1,1,0|2,0,0]=4 11864 B20R3.30190 c1ccc(nc1)COc2ccc3ccccc3c2 7a_100000185828_100000721315 [0,0,0,1,1,0|2,0,0]=4 11865 B20R3.30190 c1ccc2cc(ccc2c1)OCc3ccncc3 7a_100000185828_100015193705 [0,0,0,1,1,0|2,0,0]=4 11866 B20R3.30190 c1cncc(c1)COc2ccc3ccccc3c2 34a_100000185828_100000733263 [0,0,0,1,1,0|2,0,0]=4 11867 B20R3.30190 c1cncc(c1)COc2ccc3ccccc3c2 7a_100000185828_100000741622 [0,0,0,1,1,0|2,0,0]=4 11868 B20R3.30162 c1ccc(cc1)CCOc2ccc3[nH]ccc3c2 34a_100000756620_100000765856 [0,0,0,1,1,0|2,0,0]=4 11869 B20R3.30162 c1ccc(cc1)CCOc2ccc3cc[nH]c3c2 34a_100000036713_100000765856 [0,0,0,1,1,0|2,0,0]=4 11870 B20R3.30162 c1ccc(cc1)CCOc2ccc3ccoc3c2 34a_100000089557_100000765856 [0,0,0,1,1,0|2,0,0]=4 11871 B20R3.30162 c1ccc(cc1)CCOc2ccc3ccoc3c2 7a_100000089557_100000765856 [0,0,0,1,1,0|2,0,0]=4 11872 B20R3.30162 c1ccc(cc1)CCOc2ccc3occc3c2 34a_100000070125_100000765856 [0,0,0,1,1,0|2,0,0]=4 11873 B20R3.30162 c1ccc(cc1)CCOc2ccc3occc3c2 7a_100000070125_100000765856 [0,0,0,1,1,0|2,0,0]=4 11874 B20R3.30162 c1ccc(cc1)CCOc2ccc3sccc3c2 34a_100012180905_100000765856 [0,0,0,1,1,0|2,0,0]=4 11875 B20R3.30162 c1ccc(cc1)CCOc2ccc3sccc3c2 7a_100012180905_100000765856 [0,0,0,1,1,0|2,0,0]=4 11876 B20R3.105088 c1ccc2cc(ccc2c1)OCCn3cccc3 7a_100000185828_200000035178 [0,0,0,1,1,0|2,0,0]=4 11877 B20R3.105088 c1csc(c1)CCOc2ccc3ccccc3c2 34a_100000185828_100000748579 [0,0,0,1,1,0|2,0,0]=4 11878 B20R3.105088 c1csc(c1)CCOc2ccc3ccccc3c2 7a_100000185828_100000748579 [0,0,0,1,1,0|2,0,0]=4 11879 B22R3.32540 Brc1ccc2ccccc2c1CNCc3ccccc3 207a_100015324214_100010090029 [0,0,0,1,0,1|2,0,0]=4 11880 B22R3.32540 Brc1ccc2ccccc2c1CNCc3ccccc3 270004a_100015324214_100010090029 [0,0,0,1,0,1|2,0,0]=4 11881 B22R3.32540 Brc1ccc2ccccc2c1NCCc3ccccc3 34a_100009817101_100000765856 [0,0,0,1,0,1|2,0,0]=4 11882 B22R3.32540 Brc1ccc2ccccc2c1OCCc3ccccc3 34a_100009996032_100000765856 [0,0,0,1,0,1|1,0,0]=3 11883 B22R3.32540 Brc1ccc2ccccc2c1OCCc3ccccc3 7a_100009996032_100000765856 [0,0,0,1,0,1|1,0,0]=3 11884 B22R3.32540 Brc1ccc2ccccc2c1OCCc3ccccn3 7a_100009996032_100015183660 [0,0,0,1,0,1|2,0,0]=4 11885 B22R3.32540 Brc1ccc2ccccc2c1OCCc3cccnc3 7a_100009996032_200011713674 [0,0,0,1,0,1|2,0,0]=4 11886 B22R3.32540 Brc1ccc2ccccc2c1OCCc3ccncc3 7a_100009996032_100000723409 [0,0,0,1,0,1|2,0,0]=4 11887 B22R3.32540 Brc1ccc2ccccc2c1SCCc3ccccc3 62a_100000765856_100010090040 [0,0,0,1,0,1|1,1,0]=4 11888 B22R3.32540 Brc1ccc2ccccc2c1SCCc3ccccc3 62a_100010090040_100011218657 [0,0,0,1,0,1|1,1,0]=4 11889 B22R3.32540 Brc1ccc2cccnc2c1OCCc3ccccc3 34a_100009816563_100000765856 [0,0,0,1,0,1|2,0,0]=4 11890 B22R3.32540 Cc1ccc2ccccc2c1CNCc3ccccc3 207a_100015324214_100011361466 [0,0,0,1,0,1|2,0,0]=4 11891 B22R3.32540 Cc1ccc2ccccc2c1CNCc3ccccc3 2230a_100015324214_100000689653 [0,0,0,1,0,1|2,0,0]=4 11892 B22R3.32540 Cc1ccc2ccccc2c1CNCc3ccccc3 270004a_100015324214_100011361466 [0,0,0,1,0,1|2,0,0]=4 11893 B22R3.32540 Cc1ccc2ccccc2c1CNCc3ccccc3 34a_100015324214_100000689653 [0,0,0,1,0,1|2,0,0]=4 11894 B22R3.32540 Cc1ccc2ccccc2c1COCc3ccccc3 34a_100000210790_100000689653 [0,0,0,1,0,1|2,0,0]=4 11895 B22R3.32540 Cc1ccc2ccccc2c1COCc3ccccc3 7a_100000210790_100000689653 [0,0,0,1,0,1|2,0,0]=4 11896 B22R3.32540 Cc1ccc2ccccc2c1CSCc3ccccc3 62a_100000211182_100000689653 [0,0,0,1,0,1|2,0,0]=4 11897 B22R3.32540 Cc1ccc2ccccc2c1CSCc3ccccc3 62a_100000689653_100015291786 [0,0,0,1,0,1|2,0,0]=4 11898 B22R3.32540 Cc1ccc2ccccc2c1NCCc3ccccc3 34a_100000688109_100000765856 [0,0,0,1,0,1|2,0,0]=4 11899 B22R3.32540 Cc1ccc2ccccc2c1OCCc3ccccc3 34a_100000039261_100000765856 [0,0,0,1,0,1|1,0,0]=3 11900 B22R3.32540 Cc1ccc2ccccc2c1OCCc3ccccc3 7a_100000039261_100000765856 [0,0,0,1,0,1|1,0,0]=3 11901 B22R3.32540 Cc1ccc2ccccc2c1OCCc3ccccn3 7a_100000039261_100015183660 [0,0,0,1,0,1|2,0,0]=4 11902 B22R3.32540 Cc1ccc2ccccc2c1OCCc3cccnc3 7a_100000039261_200011713674 [0,0,0,1,0,1|2,0,0]=4 11903 B22R3.32540 Cc1ccc2ccccc2c1OCCc3ccncc3 7a_100000039261_100000723409 [0,0,0,1,0,1|2,0,0]=4 11904 B22R3.32540 Cc1ccc2ccccc2c1SCCc3ccccc3 62a_100000759710_100011218657 [0,0,0,1,0,1|1,1,0]=4 11905 B22R3.32540 Cc1ccc2ccccc2c1SCCc3ccccc3 62a_100000765856_100000759710 [0,0,0,1,0,1|1,1,0]=4 11906 B22R3.32540 Clc1ccc2ccccc2c1NCCc3ccccc3 34a_200009860907_100000765856 [0,0,0,1,0,1|2,0,0]=4 11907 B22R3.32540 Clc1ccc2cccnc2c1OCCc3ccccc3 34a_100000700379_100000765856 [0,0,0,1,0,1|2,0,0]=4 11908 B22R3.32540 Clc1ccc2cccnc2c1OCCc3ccccc3 7a_100000700379_100000765856 [0,0,0,1,0,1|2,0,0]=4 11909 B22R3.32540 Nc1ccc2ccccc2c1OCCc3ccccc3 34a_100000007060_100000765856 [0,0,0,1,0,1|1,0,0]=3 11910 B22R3.32540 Nc1ccc2ccccc2c1SCCc3ccccc3 62a_100000705303_100011218657 [0,0,0,1,0,1|1,1,0]=4 11911 B22R3.32540 Nc1ccc2ccccc2c1SCCc3ccccc3 62a_100000765856_100000705303 [0,0,0,1,0,1|1,1,0]=4 11912 B22R3.32540 Oc1ccc2ccccc2c1NCCc3ccccc3 34a_100000007056_100000765856 [0,0,0,1,0,1|1,0,1]=4 11913 B22R3.32540 Oc1ccc2ccccc2c1SCCc3ccccc3 62a_100000765856_100000183829 [0,0,0,1,0,1|0,1,1]=4 11914 B22R3.63876 O=C(C=Cc1ccccc1)N2C[C@@H]2Cc3ccccc3 11a_100016998360_100000210462 [0,0,0,1,0,1|1,0,0]=3 11915 B22R3.63876 O=C(C=Cc1ccccc1)N2C[C@@H]2Cc3ccccc3 1626a_100016998360_100000210462 [0,0,0,1,0,1|1,0,0]=3 11916 B22R3.63876 O=C(C=Cc1ccccn1)N2C[C@@H]2Cc3ccccc3 11a_100016998360_100000740811 [0,0,0,1,0,1|2,0,0]=4 11917 B22R3.63876 O=C(C=Cc1ccccn1)N2C[C@@H]2Cc3ccccc3 240690a_100016998360_100000740811 [0,0,0,1,0,1|2,0,0]=4 11918 B22R3.63876 O=C(C=Cc1cccnc1)N2C[C@@H]2Cc3ccccc3 11a_100016998360_100000735890 [0,0,0,1,0,1|2,0,0]=4 11919 B22R3.63876 O=C(C=Cc1cccnc1)N2C[C@@H]2Cc3ccccc3 240690a_100016998360_100000735890 [0,0,0,1,0,1|2,0,0]=4 11920 B22R3.63876 O=C(C=Cc1ccncc1)N2C[C@@H]2Cc3ccccc3 240690a_100016998360_100000682801 [0,0,0,1,0,1|2,0,0]=4 11921 B22R3.63878 O=C(C=Cc1ccccc1)N2CCC2c3ccccc3 11a_100000739605_100000210462 [0,0,0,1,0,1|1,0,0]=3 11922 B22R3.63878 O=C(C=Cc1ccccc1)N2CCC2c3ccccc3 1626a_100000739605_100000210462 [0,0,0,1,0,1|1,0,0]=3 11923 B22R3.63878 O=C(C=Cc1ccccn1)N2CCC2c3ccccc3 11a_100000739605_100000740811 [0,0,0,1,0,1|2,0,0]=4 11924 B22R3.63878 O=C(C=Cc1ccccn1)N2CCC2c3ccccc3 240690a_100000739605_100000740811 [0,0,0,1,0,1|2,0,0]=4 11925 B22R3.63878 O=C(C=Cc1cccnc1)N2CCC2c3ccccc3 11a_100000739605_100000735890 [0,0,0,1,0,1|2,0,0]=4 11926 B22R3.63878 O=C(C=Cc1cccnc1)N2CCC2c3ccccc3 240690a_100000739605_100000735890 [0,0,0,1,0,1|2,0,0]=4 11927 B22R3.63878 O=C(C=Cc1ccncc1)N2CCC2c3ccccc3 240690a_100000739605_100000682801 [0,0,0,1,0,1|2,0,0]=4 11928 B22R3.63902 O=C(C=Cc1ccccc1)N[C@H]2C[C@@H]2c3ccccc3 11a_100020588832_100000210462 [0,0,0,1,0,1|1,0,0]=3 11929 B22R3.63902 O=C(C=Cc1ccccc1)N[C@H]2C[C@@H]2c3ccccc3 1626a_100020588832_100000210462 [0,0,0,1,0,1|1,0,0]=3 11930 B22R3.63902 O=C(C=Cc1ccccn1)N[C@H]2C[C@@H]2c3ccccc3 11a_100020588832_100000740811 [0,0,0,1,0,1|2,0,0]=4 11931 B22R3.63902 O=C(C=Cc1ccccn1)N[C@H]2C[C@@H]2c3ccccc3 240690a_100020588832_100000740811 [0,0,0,1,0,1|2,0,0]=4 11932 B22R3.63902 O=C(C=Cc1cccnc1)N[C@H]2C[C@@H]2c3ccccc3 11a_100020588832_100000735890 [0,0,0,1,0,1|2,0,0]=4 11933 B22R3.63902 O=C(C=Cc1cccnc1)N[C@H]2C[C@@H]2c3ccccc3 240690a_100020588832_100000735890 [0,0,0,1,0,1|2,0,0]=4 11934 B22R3.63902 O=C(C=Cc1ccncc1)N[C@H]2C[C@@H]2c3ccccc3 240690a_100020588832_100000682801 [0,0,0,1,0,1|2,0,0]=4 11935 B22R3.63943 O=C(CCc1ccccc1)C2OCCc3c2cccc3 1458a_100000026751_100000765856 [0,0,0,1,0,1|0,0,2]=4 11936 B22R3.63943 O=C(NCc1ccccc1)C2OCCc3c2cccc3 11a_100015324214_100000026751 [0,0,0,1,0,1|1,0,1]=4 11937 B22R3.63943 O=C(NCc1ccccc1)C2OCCc3c2cccc3 1626a_100015324214_100000026751 [0,0,0,1,0,1|1,0,1]=4 11938 B22R3.63943 O=C(NCc1ccccc1)C2OCCc3c2cccc3 240690a_100015324214_100000026751 [0,0,0,1,0,1|1,0,1]=4 11939 B22R3.63943 O=C(NCc1ccccc1)C2OCCc3c2cccc3 527a_100015324214_100000026751 [0,0,0,1,0,1|1,0,1]=4 11940 B22R3.63943 O=C(NNc1ccccc1)C2OCCc3c2cccc3 22a_100015195140_100000026751 [0,0,0,1,0,1|2,0,0]=4 11941 B22R3.63949 O=C(C=Cc1ccccc1)NC2COc3c2cccc3 11a_100000747519_100000210462 [0,0,0,1,0,1|1,0,0]=3 11942 B22R3.63949 O=C(C=Cc1ccccc1)NC2COc3c2cccc3 1626a_100000747519_100000210462 [0,0,0,1,0,1|1,0,0]=3 11943 B22R3.63949 O=C(C=Cc1ccccc1)N[C@H]2CCc3c2cccc3 11a_100016989578_100000210462 [0,0,0,1,0,1|1,0,0]=3 11944 B22R3.63949 O=C(C=Cc1ccccc1)N[C@H]2CCc3c2cccc3 1626a_100016989578_100000210462 [0,0,0,1,0,1|1,0,0]=3 11945 B22R3.63949 O=C(C=Cc1ccccn1)NC2COc3c2cccc3 11a_100000747519_100000740811 [0,0,0,1,0,1|2,0,0]=4 11946 B22R3.63949 O=C(C=Cc1ccccn1)NC2COc3c2cccc3 240690a_100000747519_100000740811 [0,0,0,1,0,1|2,0,0]=4 11947 B22R3.63949 O=C(C=Cc1ccccn1)N[C@H]2CCc3c2cccc3 11a_100016989578_100000740811 [0,0,0,1,0,1|2,0,0]=4 11948 B22R3.63949 O=C(C=Cc1ccccn1)N[C@H]2CCc3c2cccc3 240690a_100016989578_100000740811 [0,0,0,1,0,1|2,0,0]=4 11949 B22R3.63949 O=C(C=Cc1cccnc1)NC2COc3c2cccc3 11a_100000747519_100000735890 [0,0,0,1,0,1|2,0,0]=4 11950 B22R3.63949 O=C(C=Cc1cccnc1)NC2COc3c2cccc3 240690a_100000747519_100000735890 [0,0,0,1,0,1|2,0,0]=4 11951 B22R3.63949 O=C(C=Cc1cccnc1)N[C@H]2CCc3c2cccc3 11a_100016989578_100000735890 [0,0,0,1,0,1|2,0,0]=4 11952 B22R3.63949 O=C(C=Cc1cccnc1)N[C@H]2CCc3c2cccc3 240690a_100016989578_100000735890 [0,0,0,1,0,1|2,0,0]=4 11953 B22R3.63949 O=C(C=Cc1ccncc1)NC2COc3c2cccc3 240690a_100000747519_100000682801 [0,0,0,1,0,1|2,0,0]=4 11954 B22R3.63949 O=C(C=Cc1ccncc1)N[C@H]2CCc3c2cccc3 240690a_100016989578_100000682801 [0,0,0,1,0,1|2,0,0]=4 11955 B22R3.74239 C(#Cc1ccccc1)COc2ccc3ccccc3c2 34a_100000185828_100011352542 [0,0,0,1,0,1|1,0,1]=4 11956 B22R3.74239 C(#Cc1ccccc1)COc2ccc3ccccc3c2 7a_100000185828_100011352542 [0,0,0,1,0,1|1,0,1]=4 11957 B22R3.74239 C(=C/c1ccccc1)\COc2ccc3ccccc3c2 34a_100000185828_100016265936 [0,0,0,1,0,1|1,0,1]=4 11958 B22R3.74239 C(=C/c1ccccc1)\COc2ccc3ccccc3c2 7a_100000185828_100016265936 [0,0,0,1,0,1|1,0,1]=4 11959 B22R3.74239 c1ccc(cc1)CCCNc2ccc3ccccc3c2 34a_100000211940_100000211621 [0,0,0,1,0,1|2,0,0]=4 11960 B22R3.74239 c1ccc(cc1)CCCNc2ccc3ccccc3c2 7a_100000211940_100000211621 [0,0,0,1,0,1|2,0,0]=4 11961 B22R3.74239 c1ccc(cc1)CCCNc2ccc3ccccc3n2 27a_100000211184_100011291633 [0,0,0,1,0,1|2,0,0]=4 11962 B22R3.74239 c1ccc(cc1)CCCOc2ccc3ccccc3c2 34a_100000185828_100000211621 [0,0,0,1,0,1|1,0,0]=3 11963 B22R3.74239 c1ccc(cc1)CCCOc2ccc3ccccc3c2 7a_100000185828_100000211621 [0,0,0,1,0,1|1,0,0]=3 11964 B22R3.74239 c1ccc(cc1)CCCOc2ccc3cccnc3c2 34a_100011216045_100000211621 [0,0,0,1,0,1|2,0,0]=4 11965 B22R3.74239 c1ccc(cc1)CCCOc2ccc3ccncc3c2 7a_100000752006_100000211621 [0,0,0,1,0,1|2,0,0]=4 11966 B22R3.74239 c1ccc(cc1)CCCOc2ccc3cnccc3c2 34a_100000046372_100000211621 [0,0,0,1,0,1|2,0,0]=4 11967 B22R3.74239 c1ccc(cc1)CCCOc2ccc3cnccc3c2 7a_100000046372_100000211621 [0,0,0,1,0,1|2,0,0]=4 11968 B22R3.74239 c1ccc(cc1)CCCOc2ccc3ncccc3c2 34a_100011215586_100000211621 [0,0,0,1,0,1|2,0,0]=4 11969 B22R3.74239 c1ccc(cc1)CCCOc2ccc3ncccc3c2 7a_100011215586_100000211621 [0,0,0,1,0,1|2,0,0]=4 11970 B22R3.74239 c1ccc(cc1)CCCOc2cnc3ccccc3c2 34a_100011934006_100000211621 [0,0,0,1,0,1|2,0,0]=4 11971 B22R3.74239 c1ccc(cc1)CCCOc2cnc3ccccc3c2 7a_100011934006_100000211621 [0,0,0,1,0,1|2,0,0]=4 11972 B22R3.74239 c1ccc(cc1)CCCSc2ccc3ccccc3c2 62a_100000211621_100000233703 [0,0,0,1,0,1|1,1,0]=4 11973 B22R3.74239 c1ccc(cc1)CCCSc2ccc3ccccc3n2 62a_100000211621_100011291633 [0,0,0,1,0,1|1,1,0]=4 11974 B22R3.74239 c1ccc(cc1)CCCSc2ccc3ccccc3n2 62a_100011291633_100000211621 [0,0,0,1,0,1|1,1,0]=4 11975 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3c2 207a_100000106460_100000211584 [0,0,0,1,0,1|2,0,0]=4 11976 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3c2 2230a_100000106460_100011216711 [0,0,0,1,0,1|2,0,0]=4 11977 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3c2 2230a_100000739491_100000765856 [0,0,0,1,0,1|2,0,0]=4 11978 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3c2 270004a_100000106460_100000211584 [0,0,0,1,0,1|2,0,0]=4 11979 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3c2 34a_100000106460_100011216711 [0,0,0,1,0,1|2,0,0]=4 11980 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3c2 34a_100000739491_100000765856 [0,0,0,1,0,1|2,0,0]=4 11981 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3n2 207a_100000106460_100000759686 [0,0,0,1,0,1|2,0,0]=4 11982 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3n2 2230a_100000106460_100000737579 [0,0,0,1,0,1|2,0,0]=4 11983 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3n2 270004a_100000106460_100000759686 [0,0,0,1,0,1|2,0,0]=4 11984 B22R3.74239 c1ccc(cc1)CCNCc2ccc3ccccc3n2 34a_100000106460_100000737579 [0,0,0,1,0,1|2,0,0]=4 11985 B22R3.74239 c1ccc(cc1)CCOCc2cc3ccccc3cn2 34a_100000210268_100009869231 [0,0,0,1,0,1|2,0,0]=4 11986 B22R3.74239 c1ccc(cc1)CCOCc2cc3ccccc3cn2 7a_100000210268_100009869231 [0,0,0,1,0,1|2,0,0]=4 11987 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ccccc3c2 34a_100000210268_100011216711 [0,0,0,1,0,1|1,0,0]=3 11988 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ccccc3c2 34a_100011215330_100000765856 [0,0,0,1,0,1|1,0,0]=3 11989 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ccccc3c2 7a_100000210268_100011216711 [0,0,0,1,0,1|1,0,0]=3 11990 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ccccc3c2 7a_100011215330_100000765856 [0,0,0,1,0,1|1,0,0]=3 11991 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ccccc3n2 34a_100000210268_100000737579 [0,0,0,1,0,1|1,0,0]=3 11992 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ccccc3n2 7a_100000210268_100000737579 [0,0,0,1,0,1|1,0,0]=3 11993 B22R3.74239 c1ccc(cc1)CCOCc2ccc3cnccc3c2 34a_100000210268_100020605334 [0,0,0,1,0,1|2,0,0]=4 11994 B22R3.74239 c1ccc(cc1)CCOCc2ccc3cnccc3c2 7a_100000210268_100020605334 [0,0,0,1,0,1|2,0,0]=4 11995 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ncccc3c2 34a_100000210268_100000703657 [0,0,0,1,0,1|2,0,0]=4 11996 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ncccc3c2 34a_100011315636_100000765856 [0,0,0,1,0,1|2,0,0]=4 11997 B22R3.74239 c1ccc(cc1)CCOCc2ccc3ncccc3c2 7a_100000210268_100000703657 [0,0,0,1,0,1|2,0,0]=4 11998 B22R3.74239 c1ccc(cc1)CCOCc2cnc3ccccc3c2 34a_100011258773_100000765856 [0,0,0,1,0,1|2,0,0]=4 11999 B22R3.74239 c1ccc(cc1)CCOCc2cnc3ccccc3n2 7a_100000210268_200000751123 [0,0,0,1,0,1|2,0,0]=4 12000 B22R3.74239 c1ccc(cc1)CCOCc2ncc3ccccc3n2 34a_100000210268_100009868571 [0,0,0,1,0,1|2,0,0]=4 12001 B22R3.74239 c1ccc(cc1)CCOCc2ncc3ccccc3n2 7a_100000210268_100009868571 [0,0,0,1,0,1|2,0,0]=4 12002 B22R3.74239 c1ccc(cc1)CCSCc2ccc3ccccc3c2 62a_100000765856_100011216711 [0,0,0,1,0,1|1,1,0]=4 12003 B22R3.74239 c1ccc(cc1)CCSCc2ccc3ccccc3c2 62a_100011216711_100011218657 [0,0,0,1,0,1|1,1,0]=4 12004 B22R3.74239 c1ccc(cc1)CCSCc2ccc3ccccc3n2 62a_100000737579_100011218657 [0,0,0,1,0,1|1,1,0]=4 12005 B22R3.74239 c1ccc(cc1)CCSCc2ccc3ccccc3n2 62a_100000765856_100000737579 [0,0,0,1,0,1|1,1,0]=4 12006 B22R3.74239 c1ccc(cc1)CNCCc2ccc3ccccc3c2 207a_100000746582_100015611070 [0,0,0,1,0,1|2,0,0]=4 12007 B22R3.74239 c1ccc(cc1)CNCCc2ccc3ccccc3c2 2230a_100000746582_100015291786 [0,0,0,1,0,1|2,0,0]=4 12008 B22R3.74239 c1ccc(cc1)CNCCc2ccc3ccccc3c2 270004a_100000746582_100015611070 [0,0,0,1,0,1|2,0,0]=4 12009 B22R3.74239 c1ccc(cc1)CNCCc2ccc3ccccc3c2 34a_100000746582_100015291786 [0,0,0,1,0,1|2,0,0]=4 12010 B22R3.74239 c1ccc(cc1)CNCCc2ccc3ccccc3n2 207a_100011238595_100015611070 [0,0,0,1,0,1|2,0,0]=4 12011 B22R3.74239 c1ccc(cc1)CNCCc2ccc3ccccc3n2 270004a_100011238595_100015611070 [0,0,0,1,0,1|2,0,0]=4 12012 B22R3.74239 c1ccc(cc1)COCCc2ccc3ccccc3c2 34a_100000755654_100015291786 [0,0,0,1,0,1|2,0,0]=4 12013 B22R3.74239 c1ccc(cc1)COCCc2ccc3ccccc3c2 7a_100000755654_100000211182 [0,0,0,1,0,1|2,0,0]=4 12014 B22R3.74239 c1ccc(cc1)COCCc2ccc3ccccc3n2 34a_100011996444_100015291786 [0,0,0,1,0,1|2,0,0]=4 12015 B22R3.74239 c1ccc(cc1)COCNc2ccc3ccccc3c2 34a_100000211940_100000763385 [0,0,0,1,0,1|2,0,0]=4 12016 B22R3.74239 c1ccc(cc1)COCOc2ccc3ccccc3c2 34a_100000185828_100000763385 [0,0,0,1,0,1|1,0,0]=3 12017 B22R3.74239 c1ccc(cc1)COCOc2ccc3cccnc3c2 34a_100011216045_100000763385 [0,0,0,1,0,1|2,0,0]=4 12018 B22R3.74239 c1ccc(cc1)COCOc2ccc3cnccc3c2 34a_100000046372_100000763385 [0,0,0,1,0,1|2,0,0]=4 12019 B22R3.74239 c1ccc(cc1)COCOc2ccc3ncccc3c2 34a_100011215586_100000763385 [0,0,0,1,0,1|2,0,0]=4 12020 B22R3.74239 c1ccc(cc1)COCOc2cnc3ccccc3c2 34a_100011934006_100000763385 [0,0,0,1,0,1|2,0,0]=4 12021 B22R3.74239 c1ccc(cc1)COCSc2ccc3ccccc3c2 62a_100000763385_100000233703 [0,0,0,1,0,1|1,1,0]=4 12022 B22R3.74239 c1ccc(cc1)COCSc2ccc3ccccc3n2 62a_100000763385_100011291633 [0,0,0,1,0,1|1,1,0]=4 12023 B22R3.74239 c1ccc(cc1)COCSc2ccc3ccccc3n2 62a_100011291633_100000763385 [0,0,0,1,0,1|1,1,0]=4 12024 B22R3.74239 c1ccc(cc1)CSCNc2ccc3ccccc3c2 34a_100000211940_200011217039 [0,0,0,1,0,1|2,0,0]=4 12025 B22R3.74239 c1ccc(cc1)CSCOc2ccc3ccccc3c2 34a_100000185828_200011217039 [0,0,0,1,0,1|1,0,0]=3 12026 B22R3.74239 c1ccc(cc1)CSCOc2ccc3cccnc3c2 34a_100011216045_200011217039 [0,0,0,1,0,1|2,0,0]=4 12027 B22R3.74239 c1ccc(cc1)CSCOc2ccc3cnccc3c2 34a_100000046372_200011217039 [0,0,0,1,0,1|2,0,0]=4 12028 B22R3.74239 c1ccc(cc1)CSCOc2ccc3ncccc3c2 34a_100011215586_200011217039 [0,0,0,1,0,1|2,0,0]=4 12029 B22R3.74239 c1ccc(cc1)CSCOc2cnc3ccccc3c2 34a_100011934006_200011217039 [0,0,0,1,0,1|2,0,0]=4 12030 B22R3.74239 c1ccc(cc1)CSCSc2ccc3ccccc3c2 62a_200011217039_100000233703 [0,0,0,1,0,1|1,1,0]=4 12031 B22R3.74239 c1ccc(cc1)CSCSc2ccc3ccccc3n2 62a_100011291633_200011217039 [0,0,0,1,0,1|1,1,0]=4 12032 B22R3.74239 c1ccc(cc1)CSCSc2ccc3ccccc3n2 62a_200011217039_100011291633 [0,0,0,1,0,1|1,1,0]=4 12033 B22R3.74239 c1ccc(cc1)OCCNc2ccc3ccccc3c2 34a_100000211940_100000184471 [0,0,0,1,0,1|2,0,0]=4 12034 B22R3.74239 c1ccc(cc1)OCCNc2ccc3ccccc3c2 7a_100000211940_100000184471 [0,0,0,1,0,1|2,0,0]=4 12035 B22R3.74239 c1ccc(cc1)OCCNc2ccc3ccccc3n2 27a_100000174943_100011291633 [0,0,0,1,0,1|2,0,0]=4 12036 B22R3.74239 c1ccc(cc1)OCCOc2ccc3ccccc3c2 34a_100000185828_100000184471 [0,0,0,1,0,1|1,0,0]=3 12037 B22R3.74239 c1ccc(cc1)OCCOc2ccc3ccccc3c2 7a_100000185828_100000184471 [0,0,0,1,0,1|1,0,0]=3 12038 B22R3.74239 c1ccc(cc1)OCCOc2ccc3cccnc3c2 34a_100011216045_100000184471 [0,0,0,1,0,1|2,0,0]=4 12039 B22R3.74239 c1ccc(cc1)OCCOc2ccc3ccncc3c2 7a_100000752006_100000184471 [0,0,0,1,0,1|2,0,0]=4 12040 B22R3.74239 c1ccc(cc1)OCCOc2ccc3cnccc3c2 34a_100000046372_100000184471 [0,0,0,1,0,1|2,0,0]=4 12041 B22R3.74239 c1ccc(cc1)OCCOc2ccc3cnccc3c2 7a_100000046372_100000184471 [0,0,0,1,0,1|2,0,0]=4 12042 B22R3.74239 c1ccc(cc1)OCCOc2ccc3ncccc3c2 34a_100011215586_100000184471 [0,0,0,1,0,1|2,0,0]=4 12043 B22R3.74239 c1ccc(cc1)OCCOc2ccc3ncccc3c2 7a_100011215586_100000184471 [0,0,0,1,0,1|2,0,0]=4 12044 B22R3.74239 c1ccc(cc1)OCCOc2cnc3ccccc3c2 34a_100011934006_100000184471 [0,0,0,1,0,1|2,0,0]=4 12045 B22R3.74239 c1ccc(cc1)OCCOc2cnc3ccccc3c2 7a_100011934006_100000184471 [0,0,0,1,0,1|2,0,0]=4 12046 B22R3.74239 c1ccc(cc1)OCCSc2ccc3ccccc3c2 62a_100000184471_100000233703 [0,0,0,1,0,1|1,1,0]=4 12047 B22R3.74239 c1ccc(cc1)OCCSc2ccc3ccccc3n2 62a_100000184471_100011291633 [0,0,0,1,0,1|1,1,0]=4 12048 B22R3.74239 c1ccc(cc1)OCCSc2ccc3ccccc3n2 62a_100011291633_100000184471 [0,0,0,1,0,1|1,1,0]=4 12049 B22R3.74239 c1ccc(cc1)SCCNc2ccc3ccccc3c2 34a_100000211940_100000246102 [0,0,0,1,0,1|2,0,0]=4 12050 B22R3.74239 c1ccc(cc1)SCCNc2ccc3ccccc3c2 7a_100000211940_100000246102 [0,0,0,1,0,1|2,0,0]=4 12051 B22R3.74239 c1ccc(cc1)SCCNc2ccc3ccccc3n2 27a_100000189519_100011291633 [0,0,0,1,0,1|2,0,0]=4 12052 B22R3.74239 c1ccc(cc1)SCCOc2ccc3ccccc3c2 34a_100000185828_100000246102 [0,0,0,1,0,1|1,0,0]=3 12053 B22R3.74239 c1ccc(cc1)SCCOc2ccc3ccccc3c2 7a_100000185828_100000246102 [0,0,0,1,0,1|1,0,0]=3 12054 B22R3.74239 c1ccc(cc1)SCCOc2ccc3cccnc3c2 34a_100011216045_100000246102 [0,0,0,1,0,1|2,0,0]=4 12055 B22R3.74239 c1ccc(cc1)SCCOc2ccc3ccncc3c2 7a_100000752006_100000246102 [0,0,0,1,0,1|2,0,0]=4 12056 B22R3.74239 c1ccc(cc1)SCCOc2ccc3cnccc3c2 34a_100000046372_100000246102 [0,0,0,1,0,1|2,0,0]=4 12057 B22R3.74239 c1ccc(cc1)SCCOc2ccc3cnccc3c2 7a_100000046372_100000246102 [0,0,0,1,0,1|2,0,0]=4 12058 B22R3.74239 c1ccc(cc1)SCCOc2ccc3ncccc3c2 34a_100011215586_100000246102 [0,0,0,1,0,1|2,0,0]=4 12059 B22R3.74239 c1ccc(cc1)SCCOc2ccc3ncccc3c2 7a_100011215586_100000246102 [0,0,0,1,0,1|2,0,0]=4 12060 B22R3.74239 c1ccc(cc1)SCCOc2cnc3ccccc3c2 34a_100011934006_100000246102 [0,0,0,1,0,1|2,0,0]=4 12061 B22R3.74239 c1ccc(cc1)SCCOc2cnc3ccccc3c2 7a_100011934006_100000246102 [0,0,0,1,0,1|2,0,0]=4 12062 B22R3.74239 c1ccc(cc1)SCCSc2ccc3ccccc3c2 62a_100000246102_100000233703 [0,0,0,1,0,1|1,1,0]=4 12063 B22R3.74239 c1ccc(cc1)SCCSc2ccc3ccccc3n2 62a_100000246102_100011291633 [0,0,0,1,0,1|1,1,0]=4 12064 B22R3.74239 c1ccc(cc1)SCCSc2ccc3ccccc3n2 62a_100011291633_100000246102 [0,0,0,1,0,1|1,1,0]=4 12065 B22R3.74239 c1ccc(nc1)CCOCc2ccc3ccccc3c2 34a_100000210271_100011216711 [0,0,0,1,0,1|2,0,0]=4 12066 B22R3.74239 c1ccc(nc1)CCOCc2ccc3ccccc3c2 7a_100011215330_100015183660 [0,0,0,1,0,1|2,0,0]=4 12067 B22R3.74239 c1ccc(nc1)CCOCc2ccc3ccccc3n2 34a_100000210271_100000737579 [0,0,0,1,0,1|2,0,0]=4 12068 B22R3.74239 c1ccc2cc(ccc2c1)COCCc3ccncc3 34a_100011216225_100011216711 [0,0,0,1,0,1|2,0,0]=4 12069 B22R3.74239 c1ccc2cc(ccc2c1)COCCc3ccncc3 7a_100011215330_100000723409 [0,0,0,1,0,1|2,0,0]=4 12070 B22R3.74239 c1ccc2nc(ccc2c1)COCCc3ccncc3 34a_100011216225_100000737579 [0,0,0,1,0,1|2,0,0]=4 12071 B22R3.74239 c1cncc(c1)CCOCc2ccc3ccccc3c2 34a_100011217484_100011216711 [0,0,0,1,0,1|2,0,0]=4 12072 B22R3.74239 c1cncc(c1)CCOCc2ccc3ccccc3c2 7a_100011215330_200011713674 [0,0,0,1,0,1|2,0,0]=4 12073 B22R3.74239 c1cncc(c1)CCOCc2ccc3ccccc3n2 34a_100011217484_100000737579 [0,0,0,1,0,1|2,0,0]=4 12074 B22R3.3708 c1ccc(cc1)CCNc2nc(cs2)c3ccccc3 27a_100000106460_100011830410 [0,0,0,1,0,1|2,0,0]=4 12075 B22R3.3708 c1ccc(cc1)CCNc2ncc(o2)c3ccccc3 27a_100000106460_100000729704 [0,0,0,1,0,1|1,0,1]=4 12076 B22R3.3708 c1ccc(cc1)CCNc2ncc(s2)c3ccccc3 27a_100000106460_100000685549 [0,0,0,1,0,1|1,1,0]=4 12077 B22R3.3708 c1ccc(cc1)CCSc2c[nH]c(n2)c3ccccc3 62a_100000765856_200010210587 [0,0,0,1,0,1|1,1,0]=4 12078 B22R3.3708 c1ccc(cc1)CCSc2c[nH]c(n2)c3ccccc3 62a_200010210587_100011218657 [0,0,0,1,0,1|1,1,0]=4 12079 B22R3.3708 c1ccc(cc1)CCSc2ccc(s2)c3ccccc3 62a_100000765856_100009814279 [0,0,0,1,0,1|0,2,0]=4 12080 B22R3.3708 c1ccc(cc1)CCSc2ccc(s2)c3ccccc3 62a_100009814279_100011218657 [0,0,0,1,0,1|0,2,0]=4 12081 B22R3.3708 c1ccc(cc1)CCSc2cnc(o2)c3ccccc3 62a_100000765856_100009814072 [0,0,0,1,0,1|0,1,1]=4 12082 B22R3.3708 c1ccc(cc1)CCSc2cnc(s2)c3ccccc3 62a_100000726391_100011218657 [0,0,0,1,0,1|0,2,0]=4 12083 B22R3.3708 c1ccc(cc1)CCSc2cnc(s2)c3ccccc3 62a_100000765856_100000726391 [0,0,0,1,0,1|0,2,0]=4 12084 B22R3.3708 c1ccc(cc1)CCSc2coc(n2)c3ccccc3 62a_100000765856_100010163736 [0,0,0,1,0,1|1,1,0]=4 12085 B22R3.3708 c1ccc(cc1)CCSc2coc(n2)c3ccccc3 62a_100010163736_100011218657 [0,0,0,1,0,1|1,1,0]=4 12086 B22R3.3708 c1ccc(cc1)CCSc2nc(cs2)c3ccccc3 62a_100000765856_100011830410 [0,0,0,1,0,1|1,1,0]=4 12087 B22R3.3708 c1ccc(cc1)CCSc2nc(cs2)c3ccccc3 62a_100011830410_100011218657 [0,0,0,1,0,1|1,1,0]=4 12088 B22R3.3708 c1ccc(cc1)CCSc2ncc(o2)c3ccccc3 62a_100000765856_100000729704 [0,0,0,1,0,1|0,1,1]=4 12089 B22R3.3708 c1ccc(cc1)CCSc2ncc(s2)c3ccccc3 62a_100000685549_100011218657 [0,0,0,1,0,1|0,2,0]=4 12090 B22R3.3708 c1ccc(cc1)CCSc2ncc(s2)c3ccccc3 62a_100000765856_100000685549 [0,0,0,1,0,1|0,2,0]=4 12091 B22R3.12759 O=C1CN([C@H](CO1)c2ccccc2)Cc3ccccc3 2230a_100000005368_100015291786 [0,0,0,1,0,1|0,0,2]=4 12092 B22R3.12759 O=C1CN([C@H](CO1)c2ccccc2)Cc3ccccc3 269982a_100000005368_100000211182 [0,0,0,1,0,1|0,0,2]=4 12093 B22R3.12759 O=C1CN([C@H](CO1)c2ccccc2)Cc3ccccc3 270004a_100000005368_100015611070 [0,0,0,1,0,1|0,0,2]=4 12094 B22R3.36295 O=C(C/C=C/c1ccccc1)C2=CCc3c2cccc3 1458a_100000037392_100016265936 [0,0,0,1,0,1|1,0,1]=4 12095 B22R3.36295 O=C(C/C=C/c1ccccc1)C2CCc3c2cccc3 1458a_100000750891_100016265936 [0,0,0,1,0,1|1,0,0]=3 12096 B22R3.36295 O=C(CCCc1ccccc1)C2=CCc3c2cccc3 1458a_100000037392_100000211621 [0,0,0,1,0,1|1,0,0]=3 12097 B22R3.36295 O=C(CCCc1ccccc1)C2C=Cc3c2cccc3 1458a_200009832160_100000211621 [0,0,0,1,0,1|1,0,0]=3 12098 B22R3.36295 O=C(CCOc1ccccc1)C2=CCc3c2cccc3 1458a_100000037392_100000184471 [0,0,0,1,0,1|2,0,0]=4 12099 B22R3.36295 O=C(CCOc1ccccc1)C2C=Cc3c2cccc3 1458a_200009832160_100000184471 [0,0,0,1,0,1|2,0,0]=4 12100 B22R3.36295 O=C(CCSc1ccccc1)C2=CCc3c2cccc3 1458a_100000037392_100000246102 [0,0,0,1,0,1|2,0,0]=4 12101 B22R3.36295 O=C(CCSc1ccccc1)C2C=Cc3c2cccc3 1458a_200009832160_100000246102 [0,0,0,1,0,1|2,0,0]=4 12102 B22R3.36295 O=C(CNCc1ccccc1)c2c[nH]c3c2cccc3 2230a_100015324214_100000183220 [0,0,0,1,0,1|2,0,0]=4 12103 B22R3.36295 O=C(CNCc1ccccc1)c2csc3c2cccc3 2230a_100015324214_100000689783 [0,0,0,1,0,1|2,0,0]=4 12104 B22R3.36295 O=C(COCc1ccccc1)c2c[nH]c3c2cccc3 7a_100000210790_100000183220 [0,0,0,1,0,1|2,0,0]=4 12105 B22R3.36295 O=C(COCc1ccccc1)c2csc3c2cccc3 7a_100000210790_100000689783 [0,0,0,1,0,1|2,0,0]=4 12106 B22R3.36295 O=C(CSCc1ccccc1)C2=CCc3c2cccc3 1458a_100000037392_200011217039 [0,0,0,1,0,1|2,0,0]=4 12107 B22R3.36295 O=C(CSCc1ccccc1)C2C=Cc3c2cccc3 1458a_200009832160_200011217039 [0,0,0,1,0,1|2,0,0]=4 12108 B22R3.36295 O=C(CSCc1ccccc1)c2c[nH]c3c2cccc3 62a_100000211182_100000183220 [0,0,0,1,0,1|2,0,0]=4 12109 B22R3.36295 O=C(CSCc1ccccc1)c2coc3c2cccc3 62a_100000233777_100015291786 [0,0,0,1,0,1|2,0,0]=4 12110 B22R3.36295 O=C(CSCc1ccccc1)c2csc3c2cccc3 62a_100000689783_100015291786 [0,0,0,1,0,1|2,0,0]=4 12111 B22R3.36295 O=C(NCCc1ccccc1)C2=CCc3c2cccc3 11a_100000106460_100000037392 [0,0,0,1,0,1|1,0,0]=3 12112 B22R3.36295 O=C(NCCc1ccccc1)C2=CCc3c2cccc3 1626a_100000106460_100000037392 [0,0,0,1,0,1|1,0,0]=3 12113 B22R3.36295 O=C(NCCc1ccccc1)C2=CCc3c2cccc3 240690a_100000106460_100000037392 [0,0,0,1,0,1|1,0,0]=3 12114 B22R3.36295 O=C(NCCc1ccccc1)C2C=Cc3c2cccc3 1626a_100000106460_200009832160 [0,0,0,1,0,1|1,0,0]=3 12115 B22R3.36295 O=C(NCCc1ccccc1)C2C=Cc3c2cccc3 240690a_100000106460_200009832160 [0,0,0,1,0,1|1,0,0]=3 12116 B22R3.36295 O=C(NCCc1ccccc1)C2C=Cc3c2cccc3 527a_100000106460_200009832160 [0,0,0,1,0,1|1,0,0]=3 12117 B22R3.36295 O=C(NCCc1ccccn1)C2=CCc3c2cccc3 11a_100000211156_100000037392 [0,0,0,1,0,1|2,0,0]=4 12118 B22R3.36295 O=C(NCCc1ccccn1)C2=CCc3c2cccc3 1626a_100000211156_100000037392 [0,0,0,1,0,1|2,0,0]=4 12119 B22R3.36295 O=C(NCCc1ccccn1)C2=CCc3c2cccc3 240690a_100000211156_100000037392 [0,0,0,1,0,1|2,0,0]=4 12120 B22R3.36295 O=C(NCCc1ccccn1)C2C=Cc3c2cccc3 1626a_100000211156_200009832160 [0,0,0,1,0,1|2,0,0]=4 12121 B22R3.36295 O=C(NCCc1ccccn1)C2C=Cc3c2cccc3 240690a_100000211156_200009832160 [0,0,0,1,0,1|2,0,0]=4 12122 B22R3.36295 O=C(NCCc1ccccn1)C2C=Cc3c2cccc3 527a_100000211156_200009832160 [0,0,0,1,0,1|2,0,0]=4 12123 B22R3.36295 O=C(NCCc1cccnc1)C2=CCc3c2cccc3 11a_100000736294_100000037392 [0,0,0,1,0,1|2,0,0]=4 12124 B22R3.36295 O=C(NCCc1cccnc1)C2=CCc3c2cccc3 1626a_100000736294_100000037392 [0,0,0,1,0,1|2,0,0]=4 12125 B22R3.36295 O=C(NCCc1cccnc1)C2=CCc3c2cccc3 240690a_100000736294_100000037392 [0,0,0,1,0,1|2,0,0]=4 12126 B22R3.36295 O=C(NCCc1cccnc1)C2C=Cc3c2cccc3 1626a_100000736294_200009832160 [0,0,0,1,0,1|2,0,0]=4 12127 B22R3.36295 O=C(NCCc1cccnc1)C2C=Cc3c2cccc3 240690a_100000736294_200009832160 [0,0,0,1,0,1|2,0,0]=4 12128 B22R3.36295 O=C(NCCc1cccnc1)C2C=Cc3c2cccc3 527a_100000736294_200009832160 [0,0,0,1,0,1|2,0,0]=4 12129 B22R3.36295 O=C(NCCc1ccncc1)C2=CCc3c2cccc3 11a_100000742849_100000037392 [0,0,0,1,0,1|2,0,0]=4 12130 B22R3.36295 O=C(NCCc1ccncc1)C2=CCc3c2cccc3 1626a_100000742849_100000037392 [0,0,0,1,0,1|2,0,0]=4 12131 B22R3.36295 O=C(NCCc1ccncc1)C2=CCc3c2cccc3 240690a_100000742849_100000037392 [0,0,0,1,0,1|2,0,0]=4 12132 B22R3.36295 O=C(NCCc1ccncc1)C2C=Cc3c2cccc3 1626a_100000742849_200009832160 [0,0,0,1,0,1|2,0,0]=4 12133 B22R3.36295 O=C(NCCc1ccncc1)C2C=Cc3c2cccc3 240690a_100000742849_200009832160 [0,0,0,1,0,1|2,0,0]=4 12134 B22R3.36295 O=C(NCCc1ccncc1)C2C=Cc3c2cccc3 527a_100000742849_200009832160 [0,0,0,1,0,1|2,0,0]=4 12135 B22R3.36295 O=C(NNCc1ccccc1)C2=CCc3c2cccc3 22a_100000007032_100000037392 [0,0,0,1,0,1|2,0,0]=4 12136 B22R3.789400 O=C(C/C=C/c1ccccc1)C2CC2c3cccnc3 1458a_100000746292_100016265936 [0,0,0,1,0,1|2,0,0]=4 12137 B22R3.789400 O=C(C/C=C/c1ccccc1)[C@@H]2C[C@H]2c3ccccc3 1458a_100009815801_100016265936 [0,0,0,1,0,1|1,0,0]=3 12138 B22R3.708960 Brc1cccc(c1)CCNc2ccc3ccccc3c2 34a_100000211940_100011740638 [0,1,0,1,0,0|2,0,0]=4 12139 B22R3.708960 Brc1cccc(c1)CCNc2ccc3ccccc3c2 7a_100000211940_100011740638 [0,1,0,1,0,0|2,0,0]=4 12140 B22R3.708960 Brc1cccc(c1)CCNc2ccc3ccccc3n2 27a_100011207229_100011291633 [0,1,0,1,0,0|2,0,0]=4 12141 B22R3.708960 Brc1cccc(c1)CCOc2ccc3ccccc3c2 34a_100000185828_100011740638 [0,1,0,1,0,0|1,0,0]=3 12142 B22R3.708960 Brc1cccc(c1)CCOc2ccc3ccccc3c2 7a_100000185828_100011740638 [0,1,0,1,0,0|1,0,0]=3 12143 B22R3.708960 Brc1cccc(c1)CCOc2ccc3cccnc3c2 34a_100011216045_100011740638 [0,1,0,1,0,0|2,0,0]=4 12144 B22R3.708960 Brc1cccc(c1)CCOc2ccc3ccncc3c2 7a_100000752006_100011740638 [0,1,0,1,0,0|2,0,0]=4 12145 B22R3.708960 Brc1cccc(c1)CCOc2ccc3cnccc3c2 34a_100000046372_100011740638 [0,1,0,1,0,0|2,0,0]=4 12146 B22R3.708960 Brc1cccc(c1)CCOc2ccc3cnccc3c2 7a_100000046372_100011740638 [0,1,0,1,0,0|2,0,0]=4 12147 B22R3.708960 Brc1cccc(c1)CCOc2ccc3ncccc3c2 34a_100011215586_100011740638 [0,1,0,1,0,0|2,0,0]=4 12148 B22R3.708960 Brc1cccc(c1)CCOc2ccc3ncccc3c2 7a_100011215586_100011740638 [0,1,0,1,0,0|2,0,0]=4 12149 B22R3.708960 Brc1cccc(c1)CCOc2cnc3ccccc3c2 34a_100011934006_100011740638 [0,1,0,1,0,0|2,0,0]=4 12150 B22R3.708960 Brc1cccc(c1)CCOc2cnc3ccccc3c2 7a_100011934006_100011740638 [0,1,0,1,0,0|2,0,0]=4 12151 B22R3.708960 Brc1cccc(c1)CCSc2ccc3ccccc3c2 62a_100011740638_100000233703 [0,1,0,1,0,0|1,1,0]=4 12152 B22R3.708960 Brc1cccc(c1)CCSc2ccc3ccccc3n2 62a_100011291633_100011740638 [0,1,0,1,0,0|1,1,0]=4 12153 B22R3.708960 Brc1cccc(c1)CCSc2ccc3ccccc3n2 62a_100011740638_100011291633 [0,1,0,1,0,0|1,1,0]=4 12154 B22R3.708960 Cc1cccc(c1)CCNc2ccc3ccccc3c2 34a_100000211940_100011713685 [0,1,0,1,0,0|2,0,0]=4 12155 B22R3.708960 Cc1cccc(c1)CCNc2ccc3ccccc3c2 7a_100000211940_100011713685 [0,1,0,1,0,0|2,0,0]=4 12156 B22R3.708960 Cc1cccc(c1)CCNc2ccc3ccccc3n2 27a_100000749837_100011291633 [0,1,0,1,0,0|2,0,0]=4 12157 B22R3.708960 Cc1cccc(c1)CCOc2ccc3ccccc3c2 34a_100000185828_100011713685 [0,1,0,1,0,0|1,0,0]=3 12158 B22R3.708960 Cc1cccc(c1)CCOc2ccc3ccccc3c2 7a_100000185828_100011713685 [0,1,0,1,0,0|1,0,0]=3 12159 B22R3.708960 Cc1cccc(c1)CCOc2ccc3cccnc3c2 34a_100011216045_100011713685 [0,1,0,1,0,0|2,0,0]=4 12160 B22R3.708960 Cc1cccc(c1)CCOc2ccc3ccncc3c2 7a_100000752006_100011713685 [0,1,0,1,0,0|2,0,0]=4 12161 B22R3.708960 Cc1cccc(c1)CCOc2ccc3cnccc3c2 34a_100000046372_100011713685 [0,1,0,1,0,0|2,0,0]=4 12162 B22R3.708960 Cc1cccc(c1)CCOc2ccc3cnccc3c2 7a_100000046372_100011713685 [0,1,0,1,0,0|2,0,0]=4 12163 B22R3.708960 Cc1cccc(c1)CCOc2ccc3ncccc3c2 34a_100011215586_100011713685 [0,1,0,1,0,0|2,0,0]=4 12164 B22R3.708960 Cc1cccc(c1)CCOc2ccc3ncccc3c2 7a_100011215586_100011713685 [0,1,0,1,0,0|2,0,0]=4 12165 B22R3.708960 Cc1cccc(c1)CCOc2cnc3ccccc3c2 34a_100011934006_100011713685 [0,1,0,1,0,0|2,0,0]=4 12166 B22R3.708960 Cc1cccc(c1)CCOc2cnc3ccccc3c2 7a_100011934006_100011713685 [0,1,0,1,0,0|2,0,0]=4 12167 B22R3.708960 Cc1cccc(c1)CCSc2ccc3ccccc3c2 62a_100011713685_100000233703 [0,1,0,1,0,0|1,1,0]=4 12168 B22R3.708960 Cc1cccc(c1)CCSc2ccc3ccccc3n2 62a_100011291633_100011713685 [0,1,0,1,0,0|1,1,0]=4 12169 B22R3.708960 Cc1cccc(c1)CCSc2ccc3ccccc3n2 62a_100011713685_100011291633 [0,1,0,1,0,0|1,1,0]=4 12170 B22R3.708960 Clc1cccc(c1)CCNc2ccc3ccccc3c2 34a_100000211940_100011713710 [0,1,0,1,0,0|2,0,0]=4 12171 B22R3.708960 Clc1cccc(c1)CCNc2ccc3ccccc3c2 7a_100000211940_100011713710 [0,1,0,1,0,0|2,0,0]=4 12172 B22R3.708960 Clc1cccc(c1)CCNc2ccc3ccccc3n2 27a_100000185263_100011291633 [0,1,0,1,0,0|2,0,0]=4 12173 B22R3.708960 Clc1cccc(c1)CCOc2ccc3ccccc3c2 34a_100000185828_100011713710 [0,1,0,1,0,0|1,0,0]=3 12174 B22R3.708960 Clc1cccc(c1)CCOc2ccc3ccccc3c2 7a_100000185828_100011713710 [0,1,0,1,0,0|1,0,0]=3 12175 B22R3.708960 Clc1cccc(c1)CCOc2ccc3cccnc3c2 34a_100011216045_100011713710 [0,1,0,1,0,0|2,0,0]=4 12176 B22R3.708960 Clc1cccc(c1)CCOc2ccc3ccncc3c2 7a_100000752006_100011713710 [0,1,0,1,0,0|2,0,0]=4 12177 B22R3.708960 Clc1cccc(c1)CCOc2ccc3cnccc3c2 34a_100000046372_100011713710 [0,1,0,1,0,0|2,0,0]=4 12178 B22R3.708960 Clc1cccc(c1)CCOc2ccc3cnccc3c2 7a_100000046372_100011713710 [0,1,0,1,0,0|2,0,0]=4 12179 B22R3.708960 Clc1cccc(c1)CCOc2ccc3ncccc3c2 34a_100011215586_100011713710 [0,1,0,1,0,0|2,0,0]=4 12180 B22R3.708960 Clc1cccc(c1)CCOc2ccc3ncccc3c2 7a_100011215586_100011713710 [0,1,0,1,0,0|2,0,0]=4 12181 B22R3.708960 Clc1cccc(c1)CCOc2cnc3ccccc3c2 34a_100011934006_100011713710 [0,1,0,1,0,0|2,0,0]=4 12182 B22R3.708960 Clc1cccc(c1)CCOc2cnc3ccccc3c2 7a_100011934006_100011713710 [0,1,0,1,0,0|2,0,0]=4 12183 B22R3.708960 Clc1cccc(c1)CCSc2ccc3ccccc3c2 62a_100011713710_100000233703 [0,1,0,1,0,0|1,1,0]=4 12184 B22R3.708960 Clc1cccc(c1)CCSc2ccc3ccccc3n2 62a_100011291633_100011713710 [0,1,0,1,0,0|1,1,0]=4 12185 B22R3.708960 Clc1cccc(c1)CCSc2ccc3ccccc3n2 62a_100011713710_100011291633 [0,1,0,1,0,0|1,1,0]=4 12186 B22R3.708960 Fc1cccc(c1)CCNc2ccc3ccccc3c2 34a_100000211940_100011217235 [0,1,0,1,0,0|2,0,0]=4 12187 B22R3.708960 Fc1cccc(c1)CCNc2ccc3ccccc3c2 7a_100000211940_100011217235 [0,1,0,1,0,0|2,0,0]=4 12188 B22R3.708960 Fc1cccc(c1)CCNc2ccc3ccccc3n2 27a_100000205154_100011291633 [0,1,0,1,0,0|2,0,0]=4 12189 B22R3.708960 Fc1cccc(c1)CCOc2ccc3ccccc3c2 34a_100000185828_100011217235 [0,1,0,1,0,0|1,0,0]=3 12190 B22R3.708960 Fc1cccc(c1)CCOc2ccc3ccccc3c2 7a_100000185828_100011217235 [0,1,0,1,0,0|1,0,0]=3 12191 B22R3.708960 Fc1cccc(c1)CCOc2ccc3cccnc3c2 34a_100011216045_100011217235 [0,1,0,1,0,0|2,0,0]=4 12192 B22R3.708960 Fc1cccc(c1)CCOc2ccc3ccncc3c2 7a_100000752006_100011217235 [0,1,0,1,0,0|2,0,0]=4 12193 B22R3.708960 Fc1cccc(c1)CCOc2ccc3cnccc3c2 34a_100000046372_100011217235 [0,1,0,1,0,0|2,0,0]=4 12194 B22R3.708960 Fc1cccc(c1)CCOc2ccc3cnccc3c2 7a_100000046372_100011217235 [0,1,0,1,0,0|2,0,0]=4 12195 B22R3.708960 Fc1cccc(c1)CCOc2ccc3ncccc3c2 34a_100011215586_100011217235 [0,1,0,1,0,0|2,0,0]=4 12196 B22R3.708960 Fc1cccc(c1)CCOc2ccc3ncccc3c2 7a_100011215586_100011217235 [0,1,0,1,0,0|2,0,0]=4 12197 B22R3.708960 Fc1cccc(c1)CCOc2cnc3ccccc3c2 34a_100011934006_100011217235 [0,1,0,1,0,0|2,0,0]=4 12198 B22R3.708960 Fc1cccc(c1)CCOc2cnc3ccccc3c2 7a_100011934006_100011217235 [0,1,0,1,0,0|2,0,0]=4 12199 B22R3.708960 Fc1cccc(c1)CCSc2ccc3ccccc3c2 62a_100011217235_100000233703 [0,1,0,1,0,0|1,1,0]=4 12200 B22R3.708960 Fc1cccc(c1)CCSc2ccc3ccccc3n2 62a_100011217235_100011291633 [0,1,0,1,0,0|1,1,0]=4 12201 B22R3.708960 Fc1cccc(c1)CCSc2ccc3ccccc3n2 62a_100011291633_100011217235 [0,1,0,1,0,0|1,1,0]=4 12202 B22R3.708960 Oc1cccc(c1)CCNc2ccc3ccccc3n2 27a_100000747277_100011291633 [0,1,0,1,0,0|2,0,0]=4 12203 B22R3.607737 Brc1ccnc2c1ccc(c2)OCCc3ccccc3 34a_100010204257_100000765856 [0,1,0,1,0,0|2,0,0]=4 12204 B22R3.607737 Brc1ccnc2c1ccc(c2)OCCc3ccccc3 7a_100010204257_100000765856 [0,1,0,1,0,0|2,0,0]=4 12205 B22R3.607737 Cc1ccnc2c1ccc(c2)OCCc3ccccc3 34a_200009854145_100000765856 [0,1,0,1,0,0|2,0,0]=4 12206 B22R3.607737 Cc1ccnc2c1ccc(c2)OCCc3ccccc3 7a_200009854145_100000765856 [0,1,0,1,0,0|2,0,0]=4 12207 B22R3.607737 Clc1ccnc2c1ccc(c2)OCCc3ccccc3 34a_100000045489_100000765856 [0,1,0,1,0,0|2,0,0]=4 12208 B22R3.607737 Clc1ccnc2c1ccc(c2)OCCc3ccccc3 7a_100000045489_100000765856 [0,1,0,1,0,0|2,0,0]=4 12209 B22R3.607737 Clc1nccc2c1ccc(c2)OCCc3ccccc3 34a_100009867704_100000765856 [0,1,0,1,0,0|2,0,0]=4 12210 B22R3.607737 Clc1nccc2c1ccc(c2)OCCc3ccccc3 7a_100009867704_100000765856 [0,1,0,1,0,0|2,0,0]=4 12211 B22R3.607737 Fc1cccc2c1ncc(c2)OCCc3ccccc3 34a_100012184956_100000765856 [0,1,0,1,0,0|2,0,0]=4 12212 B22R3.607737 Fc1cccc2c1ncc(c2)OCCc3ccccc3 7a_100012184956_100000765856 [0,1,0,1,0,0|2,0,0]=4 12213 B22R3.607737 Nc1cccc2c1ccc(c2)OCCc3ccccc3 34a_100000034668_100000765856 [0,1,0,1,0,0|1,0,0]=3 12214 B22R3.607737 Nc1cccc2c1ccc(c2)OCCc3ccccc3 7a_100000034668_100000765856 [0,1,0,1,0,0|1,0,0]=3 12215 B22R3.607737 Nc1cccc2c1ccc(c2)OCCc3ccccn3 7a_100000034668_100015183660 [0,1,0,1,0,0|2,0,0]=4 12216 B22R3.607737 Nc1cccc2c1ccc(c2)OCCc3cccnc3 7a_100000034668_200011713674 [0,1,0,1,0,0|2,0,0]=4 12217 B22R3.607737 Nc1cccc2c1ccc(c2)OCCc3ccncc3 7a_100000034668_100000723409 [0,1,0,1,0,0|2,0,0]=4 12218 B22R3.607737 Nc1cccc2c1ccc(c2)SCCc3ccccc3 62a_100000765856_100010090037 [0,1,0,1,0,0|1,1,0]=4 12219 B22R3.607737 Nc1cccc2c1ccc(c2)SCCc3ccccc3 62a_100010090037_100011218657 [0,1,0,1,0,0|1,1,0]=4 12220 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCc3ccccc3 34a_100009857879_100000765856 [0,1,0,1,0,0|2,0,0]=4 12221 B22R3.607737 O=c1[nH]ccc2c1ccc(c2)OCCc3ccccc3 7a_100009857879_100000765856 [0,1,0,1,0,0|2,0,0]=4 12222 B22R3.607737 O=c1ccoc2c1ccc(c2)OCCc3ccccc3 34a_200000065989_100000765856 [0,1,0,1,0,0|2,0,0]=4 12223 B22R3.607737 O=c1ccoc2c1ccc(c2)OCCc3ccccc3 7a_200000065989_100000765856 [0,1,0,1,0,0|2,0,0]=4 12224 B22R3.607737 Oc1cccc2c1ccc(c2)NCCc3ccccc3 34a_100000035793_100000765856 [0,1,0,1,0,0|2,0,0]=4 12225 B22R3.607737 Oc1cccc2c1ccc(c2)NCCc3ccccc3 7a_100000035793_100000765856 [0,1,0,1,0,0|2,0,0]=4 12226 B22R3.607737 Oc1cccc2c1ccc(c2)SCCc3ccccc3 62a_100000765856_100010202202 [0,1,0,1,0,0|1,1,0]=4 12227 B22R3.12500697 CC(OCCc1ccccc1)c2cc3ccccc3o2 34a_100000198572_100000765856 [0,1,0,1,0,0|1,0,1]=4 12228 B22R3.12500697 CC(OCCc1ccccc1)c2cc3ccccc3o2 7a_100000198572_100000765856 [0,1,0,1,0,0|1,0,1]=4 12229 B22R3.12500697 O=C(CCCc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_100000211621 [0,1,0,1,0,0|1,0,0]=3 12230 B22R3.12500697 O=C(CCOc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_100000184471 [0,1,0,1,0,0|2,0,0]=4 12231 B22R3.12500697 O=C(CCSc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_100000246102 [0,1,0,1,0,0|2,0,0]=4 12232 B22R3.12500697 O=C(CNCc1ccccc1)c2cc3ccccc3s2 2230a_100015324214_100012351422 [0,1,0,1,0,0|2,0,0]=4 12233 B22R3.12500697 O=C(COCc1ccccc1)c2cc3ccccc3s2 7a_100000210790_100012351422 [0,1,0,1,0,0|2,0,0]=4 12234 B22R3.12500697 O=C(CSCc1ccccc1)C2=Cc3ccccc3C2 1458a_100009862756_200011217039 [0,1,0,1,0,0|2,0,0]=4 12235 B22R3.12500697 O=C(CSCc1ccccc1)c2cc3ccccc3o2 62a_100000211182_100000209828 [0,1,0,1,0,0|2,0,0]=4 12236 B22R3.12500697 O=C(CSCc1ccccc1)c2cc3ccccc3s2 62a_100012351422_100015291786 [0,1,0,1,0,0|2,0,0]=4 12237 B22R3.12500697 O=C(NCCc1ccccc1)C2=Cc3ccccc3C2 11a_100000106460_100009862756 [0,1,0,1,0,0|1,0,0]=3 12238 B22R3.12500697 O=C(NCCc1ccccc1)C2=Cc3ccccc3C2 1626a_100000106460_100009862756 [0,1,0,1,0,0|1,0,0]=3 12239 B22R3.12500697 O=C(NCCc1ccccc1)C2=Cc3ccccc3C2 240690a_100000106460_100009862756 [0,1,0,1,0,0|1,0,0]=3 12240 B22R3.12500697 O=C(NCCc1ccccn1)C2=Cc3ccccc3C2 11a_100000211156_100009862756 [0,1,0,1,0,0|2,0,0]=4 12241 B22R3.12500697 O=C(NCCc1ccccn1)C2=Cc3ccccc3C2 1626a_100000211156_100009862756 [0,1,0,1,0,0|2,0,0]=4 12242 B22R3.12500697 O=C(NCCc1ccccn1)C2=Cc3ccccc3C2 240690a_100000211156_100009862756 [0,1,0,1,0,0|2,0,0]=4 12243 B22R3.12500697 O=C(NCCc1cccnc1)C2=Cc3ccccc3C2 11a_100000736294_100009862756 [0,1,0,1,0,0|2,0,0]=4 12244 B22R3.12500697 O=C(NCCc1cccnc1)C2=Cc3ccccc3C2 1626a_100000736294_100009862756 [0,1,0,1,0,0|2,0,0]=4 12245 B22R3.12500697 O=C(NCCc1cccnc1)C2=Cc3ccccc3C2 240690a_100000736294_100009862756 [0,1,0,1,0,0|2,0,0]=4 12246 B22R3.12500697 O=C(NCCc1ccncc1)C2=Cc3ccccc3C2 11a_100000742849_100009862756 [0,1,0,1,0,0|2,0,0]=4 12247 B22R3.12500697 O=C(NCCc1ccncc1)C2=Cc3ccccc3C2 1626a_100000742849_100009862756 [0,1,0,1,0,0|2,0,0]=4 12248 B22R3.12500697 O=C(NCCc1ccncc1)C2=Cc3ccccc3C2 240690a_100000742849_100009862756 [0,1,0,1,0,0|2,0,0]=4 12249 B22R3.12500697 O=C(NNCc1ccccc1)C2=Cc3ccccc3C2 22a_100000007032_100009862756 [0,1,0,1,0,0|2,0,0]=4 12250 B22R3.63903 CN(CCc1ccccc1)c2ccc3ccccc3c2 2230a_100000181211_100000765856 [0,1,0,1,0,0|2,0,0]=4 12251 B22R3.63903 CN(CCc1ccccc1)c2ccc3ccccc3c2 269982a_100000181211_100000765856 [0,1,0,1,0,0|2,0,0]=4 12252 B22R3.63903 CN(CCc1ccccc1)c2ccc3ccccc3c2 34a_100000181211_100000765856 [0,1,0,1,0,0|2,0,0]=4 12253 B22R3.63903 CN(CCc1ccccc1)c2ccc3ccccc3n2 27a_100000207497_100011291633 [0,1,0,1,0,0|2,0,0]=4 12254 B22R3.63903 O=C(C=Cc1ccccc1)N2CCc3ccccc3C2 11a_100000188457_100000210462 [0,1,0,1,0,0|1,0,0]=3 12255 B22R3.63903 O=C(C=Cc1ccccc1)N2CCc3ccccc3C2 1626a_100000188457_100000210462 [0,1,0,1,0,0|1,0,0]=3 12256 B22R3.63903 O=C(C=Cc1ccccc1)N2CCc3cccnc3C2 11a_100015206102_100000210462 [0,1,0,1,0,0|2,0,0]=4 12257 B22R3.63903 O=C(C=Cc1ccccc1)N2CCc3cccnc3C2 1626a_100015206102_100000210462 [0,1,0,1,0,0|2,0,0]=4 12258 B22R3.63903 O=C(C=Cc1ccccc1)N2CCc3ccncc3C2 11a_100015190008_100000210462 [0,1,0,1,0,0|2,0,0]=4 12259 B22R3.63903 O=C(C=Cc1ccccc1)N2CCc3cnccc3C2 11a_100020645890_100000210462 [0,1,0,1,0,0|2,0,0]=4 12260 B22R3.63903 O=C(C=Cc1ccccc1)N2CCc3ncccc3C2 11a_100000699647_100000210462 [0,1,0,1,0,0|2,0,0]=4 12261 B22R3.63903 O=C(C=Cc1ccccn1)N2CCc3ccccc3C2 11a_100000188457_100000740811 [0,1,0,1,0,0|2,0,0]=4 12262 B22R3.63903 O=C(C=Cc1ccccn1)N2CCc3ccccc3C2 240690a_100000188457_100000740811 [0,1,0,1,0,0|2,0,0]=4 12263 B22R3.63903 O=C(C=Cc1cccnc1)N2CCc3ccccc3C2 11a_100000188457_100000735890 [0,1,0,1,0,0|2,0,0]=4 12264 B22R3.63903 O=C(C=Cc1cccnc1)N2CCc3ccccc3C2 240690a_100000188457_100000735890 [0,1,0,1,0,0|2,0,0]=4 12265 B22R3.63903 O=C(C=Cc1ccncc1)N2CCc3ccccc3C2 240690a_100000188457_100000682801 [0,1,0,1,0,0|2,0,0]=4 12266 B22R3.63903 O=C(CCc1ccccc1)c2ccc3ccccc3c2 1458a_100000210637_100000765856 [0,1,0,1,0,0|2,0,0]=4 12267 B22R3.252500 Brc1ccccc1CCNc2ccc3ccccc3c2 34a_100000211940_100012161201 [0,1,0,1,0,0|2,0,0]=4 12268 B22R3.252500 Brc1ccccc1CCNc2ccc3ccccc3c2 7a_100000211940_100012161201 [0,1,0,1,0,0|2,0,0]=4 12269 B22R3.252500 Brc1ccccc1CCNc2ccc3ccccc3n2 27a_100000747383_100011291633 [0,1,0,1,0,0|2,0,0]=4 12270 B22R3.252500 Brc1ccccc1CCOc2ccc3ccccc3c2 34a_100000185828_100012161201 [0,1,0,1,0,0|1,0,0]=3 12271 B22R3.252500 Brc1ccccc1CCOc2ccc3ccccc3c2 7a_100000185828_100012161201 [0,1,0,1,0,0|1,0,0]=3 12272 B22R3.252500 Brc1ccccc1CCOc2ccc3cccnc3c2 34a_100011216045_100012161201 [0,1,0,1,0,0|2,0,0]=4 12273 B22R3.252500 Brc1ccccc1CCOc2ccc3ccncc3c2 7a_100000752006_100012161201 [0,1,0,1,0,0|2,0,0]=4 12274 B22R3.252500 Brc1ccccc1CCOc2ccc3cnccc3c2 34a_100000046372_100012161201 [0,1,0,1,0,0|2,0,0]=4 12275 B22R3.252500 Brc1ccccc1CCOc2ccc3cnccc3c2 7a_100000046372_100012161201 [0,1,0,1,0,0|2,0,0]=4 12276 B22R3.252500 Brc1ccccc1CCOc2ccc3ncccc3c2 34a_100011215586_100012161201 [0,1,0,1,0,0|2,0,0]=4 12277 B22R3.252500 Brc1ccccc1CCOc2ccc3ncccc3c2 7a_100011215586_100012161201 [0,1,0,1,0,0|2,0,0]=4 12278 B22R3.252500 Brc1ccccc1CCOc2cnc3ccccc3c2 34a_100011934006_100012161201 [0,1,0,1,0,0|2,0,0]=4 12279 B22R3.252500 Brc1ccccc1CCOc2cnc3ccccc3c2 7a_100011934006_100012161201 [0,1,0,1,0,0|2,0,0]=4 12280 B22R3.252500 Brc1ccccc1CCSc2ccc3ccccc3c2 62a_100012161201_100000233703 [0,1,0,1,0,0|1,1,0]=4 12281 B22R3.252500 Brc1ccccc1CCSc2ccc3ccccc3n2 62a_100011291633_100012161201 [0,1,0,1,0,0|1,1,0]=4 12282 B22R3.252500 Brc1ccccc1CCSc2ccc3ccccc3n2 62a_100012161201_100011291633 [0,1,0,1,0,0|1,1,0]=4 12283 B22R3.252500 Cc1ccccc1CCNc2ccc3ccccc3c2 34a_100000211940_100011713688 [0,1,0,1,0,0|2,0,0]=4 12284 B22R3.252500 Cc1ccccc1CCNc2ccc3ccccc3c2 7a_100000211940_100011713688 [0,1,0,1,0,0|2,0,0]=4 12285 B22R3.252500 Cc1ccccc1CCNc2ccc3ccccc3n2 27a_100000685071_100011291633 [0,1,0,1,0,0|2,0,0]=4 12286 B22R3.252500 Cc1ccccc1CCOc2ccc3ccccc3c2 34a_100000185828_100011713688 [0,1,0,1,0,0|1,0,0]=3 12287 B22R3.252500 Cc1ccccc1CCOc2ccc3ccccc3c2 7a_100000185828_100011713688 [0,1,0,1,0,0|1,0,0]=3 12288 B22R3.252500 Cc1ccccc1CCOc2ccc3cccnc3c2 34a_100011216045_100011713688 [0,1,0,1,0,0|2,0,0]=4 12289 B22R3.252500 Cc1ccccc1CCOc2ccc3ccncc3c2 7a_100000752006_100011713688 [0,1,0,1,0,0|2,0,0]=4 12290 B22R3.252500 Cc1ccccc1CCOc2ccc3cnccc3c2 34a_100000046372_100011713688 [0,1,0,1,0,0|2,0,0]=4 12291 B22R3.252500 Cc1ccccc1CCOc2ccc3cnccc3c2 7a_100000046372_100011713688 [0,1,0,1,0,0|2,0,0]=4 12292 B22R3.252500 Cc1ccccc1CCOc2ccc3ncccc3c2 34a_100011215586_100011713688 [0,1,0,1,0,0|2,0,0]=4 12293 B22R3.252500 Cc1ccccc1CCOc2ccc3ncccc3c2 7a_100011215586_100011713688 [0,1,0,1,0,0|2,0,0]=4 12294 B22R3.252500 Cc1ccccc1CCOc2cnc3ccccc3c2 34a_100011934006_100011713688 [0,1,0,1,0,0|2,0,0]=4 12295 B22R3.252500 Cc1ccccc1CCOc2cnc3ccccc3c2 7a_100011934006_100011713688 [0,1,0,1,0,0|2,0,0]=4 12296 B22R3.252500 Cc1ccccc1CCSc2ccc3ccccc3c2 62a_100011713688_100000233703 [0,1,0,1,0,0|1,1,0]=4 12297 B22R3.252500 Cc1ccccc1CCSc2ccc3ccccc3n2 62a_100011291633_100011713688 [0,1,0,1,0,0|1,1,0]=4 12298 B22R3.252500 Cc1ccccc1CCSc2ccc3ccccc3n2 62a_100011713688_100011291633 [0,1,0,1,0,0|1,1,0]=4 12299 B22R3.252500 Clc1ccccc1CCNc2ccc3ccccc3c2 34a_100000211940_100011713703 [0,1,0,1,0,0|2,0,0]=4 12300 B22R3.252500 Clc1ccccc1CCNc2ccc3ccccc3c2 7a_100000211940_100011713703 [0,1,0,1,0,0|2,0,0]=4 12301 B22R3.252500 Clc1ccccc1CCNc2ccc3ccccc3n2 27a_100011207228_100011291633 [0,1,0,1,0,0|2,0,0]=4 12302 B22R3.252500 Clc1ccccc1CCOc2ccc3ccccc3c2 34a_100000185828_100011713703 [0,1,0,1,0,0|1,0,0]=3 12303 B22R3.252500 Clc1ccccc1CCOc2ccc3ccccc3c2 7a_100000185828_100011713703 [0,1,0,1,0,0|1,0,0]=3 12304 B22R3.252500 Clc1ccccc1CCOc2ccc3cccnc3c2 34a_100011216045_100011713703 [0,1,0,1,0,0|2,0,0]=4 12305 B22R3.252500 Clc1ccccc1CCOc2ccc3ccncc3c2 7a_100000752006_100011713703 [0,1,0,1,0,0|2,0,0]=4 12306 B22R3.252500 Clc1ccccc1CCOc2ccc3cnccc3c2 34a_100000046372_100011713703 [0,1,0,1,0,0|2,0,0]=4 12307 B22R3.252500 Clc1ccccc1CCOc2ccc3cnccc3c2 7a_100000046372_100011713703 [0,1,0,1,0,0|2,0,0]=4 12308 B22R3.252500 Clc1ccccc1CCOc2ccc3ncccc3c2 34a_100011215586_100011713703 [0,1,0,1,0,0|2,0,0]=4 12309 B22R3.252500 Clc1ccccc1CCOc2ccc3ncccc3c2 7a_100011215586_100011713703 [0,1,0,1,0,0|2,0,0]=4 12310 B22R3.252500 Clc1ccccc1CCOc2cnc3ccccc3c2 34a_100011934006_100011713703 [0,1,0,1,0,0|2,0,0]=4 12311 B22R3.252500 Clc1ccccc1CCOc2cnc3ccccc3c2 7a_100011934006_100011713703 [0,1,0,1,0,0|2,0,0]=4 12312 B22R3.252500 Clc1ccccc1CCSc2ccc3ccccc3c2 62a_100011713703_100000233703 [0,1,0,1,0,0|1,1,0]=4 12313 B22R3.252500 Clc1ccccc1CCSc2ccc3ccccc3n2 62a_100011291633_100011713703 [0,1,0,1,0,0|1,1,0]=4 12314 B22R3.252500 Clc1ccccc1CCSc2ccc3ccccc3n2 62a_100011713703_100011291633 [0,1,0,1,0,0|1,1,0]=4 12315 B22R3.252500 Fc1ccccc1CCNc2ccc3ccccc3c2 34a_100000211940_100000720011 [0,1,0,1,0,0|2,0,0]=4 12316 B22R3.252500 Fc1ccccc1CCNc2ccc3ccccc3c2 7a_100000211940_100000720011 [0,1,0,1,0,0|2,0,0]=4 12317 B22R3.252500 Fc1ccccc1CCNc2ccc3ccccc3n2 27a_100000185272_100011291633 [0,1,0,1,0,0|2,0,0]=4 12318 B22R3.252500 Fc1ccccc1CCOc2ccc3ccccc3c2 34a_100000185828_100000720011 [0,1,0,1,0,0|1,0,0]=3 12319 B22R3.252500 Fc1ccccc1CCOc2ccc3ccccc3c2 7a_100000185828_100000720011 [0,1,0,1,0,0|1,0,0]=3 12320 B22R3.252500 Fc1ccccc1CCOc2ccc3cccnc3c2 34a_100011216045_100000720011 [0,1,0,1,0,0|2,0,0]=4 12321 B22R3.252500 Fc1ccccc1CCOc2ccc3ccncc3c2 7a_100000752006_100000720011 [0,1,0,1,0,0|2,0,0]=4 12322 B22R3.252500 Fc1ccccc1CCOc2ccc3cnccc3c2 34a_100000046372_100000720011 [0,1,0,1,0,0|2,0,0]=4 12323 B22R3.252500 Fc1ccccc1CCOc2ccc3cnccc3c2 7a_100000046372_100000720011 [0,1,0,1,0,0|2,0,0]=4 12324 B22R3.252500 Fc1ccccc1CCOc2ccc3ncccc3c2 34a_100011215586_100000720011 [0,1,0,1,0,0|2,0,0]=4 12325 B22R3.252500 Fc1ccccc1CCOc2ccc3ncccc3c2 7a_100011215586_100000720011 [0,1,0,1,0,0|2,0,0]=4 12326 B22R3.252500 Fc1ccccc1CCOc2cnc3ccccc3c2 34a_100011934006_100000720011 [0,1,0,1,0,0|2,0,0]=4 12327 B22R3.252500 Fc1ccccc1CCOc2cnc3ccccc3c2 7a_100011934006_100000720011 [0,1,0,1,0,0|2,0,0]=4 12328 B22R3.252500 Fc1ccccc1CCSc2ccc3ccccc3c2 62a_100011713696_100000233703 [0,1,0,1,0,0|1,1,0]=4 12329 B22R3.252500 Fc1ccccc1CCSc2ccc3ccccc3n2 62a_100011291633_100011713696 [0,1,0,1,0,0|1,1,0]=4 12330 B22R3.252500 Fc1ccccc1CCSc2ccc3ccccc3n2 62a_100011713696_100011291633 [0,1,0,1,0,0|1,1,0]=4 12331 B22R3.252500 Oc1ccccc1CCNc2ccc3ccccc3c2 34a_100000211940_100000722297 [0,1,0,1,0,0|2,0,0]=4 12332 B22R3.252500 Oc1ccccc1CCNc2ccc3ccccc3c2 7a_100000211940_100000722297 [0,1,0,1,0,0|2,0,0]=4 12333 B22R3.252500 Oc1ccccc1CCNc2ccc3ccccc3n2 27a_100011207237_100011291633 [0,1,0,1,0,0|2,0,0]=4 12334 B22R3.252500 Oc1ccccc1CCOc2ccc3ccccc3c2 34a_100000185828_100000722297 [0,1,0,1,0,0|1,0,0]=3 12335 B22R3.252500 Oc1ccccc1CCOc2ccc3ccccc3c2 7a_100000185828_100000722297 [0,1,0,1,0,0|1,0,0]=3 12336 B22R3.252500 Oc1ccccc1CCOc2ccc3cccnc3c2 34a_100011216045_100000722297 [0,1,0,1,0,0|2,0,0]=4 12337 B22R3.252500 Oc1ccccc1CCOc2ccc3ccncc3c2 7a_100000752006_100000722297 [0,1,0,1,0,0|2,0,0]=4 12338 B22R3.252500 Oc1ccccc1CCOc2ccc3cnccc3c2 34a_100000046372_100000722297 [0,1,0,1,0,0|2,0,0]=4 12339 B22R3.252500 Oc1ccccc1CCOc2ccc3cnccc3c2 7a_100000046372_100000722297 [0,1,0,1,0,0|2,0,0]=4 12340 B22R3.252500 Oc1ccccc1CCOc2ccc3ncccc3c2 34a_100011215586_100000722297 [0,1,0,1,0,0|2,0,0]=4 12341 B22R3.252500 Oc1ccccc1CCOc2ccc3ncccc3c2 7a_100011215586_100000722297 [0,1,0,1,0,0|2,0,0]=4 12342 B22R3.252500 Oc1ccccc1CCOc2cnc3ccccc3c2 34a_100011934006_100000722297 [0,1,0,1,0,0|2,0,0]=4 12343 B22R3.252500 Oc1ccccc1CCOc2cnc3ccccc3c2 7a_100011934006_100000722297 [0,1,0,1,0,0|2,0,0]=4 12344 B22R3.252500 Oc1ccccc1CCSc2ccc3ccccc3c2 62a_100000722297_100000233703 [0,1,0,1,0,0|1,1,0]=4 12345 B22R3.252500 Oc1ccccc1CCSc2ccc3ccccc3n2 62a_100000722297_100011291633 [0,1,0,1,0,0|1,1,0]=4 12346 B22R3.252500 Oc1ccccc1CCSc2ccc3ccccc3n2 62a_100011291633_100000722297 [0,1,0,1,0,0|1,1,0]=4 12347 B22R3.2802807 O=C(C=Cc1ccccc1)NC2Cc3ccccc3C2 11a_100000753258_100000210462 [0,1,0,1,0,0|1,0,0]=3 12348 B22R3.2802807 O=C(C=Cc1ccccc1)NC2Cc3ccccc3C2 1626a_100000753258_100000210462 [0,1,0,1,0,0|1,0,0]=3 12349 B22R3.2802807 O=C(C=Cc1ccccn1)NC2Cc3ccccc3C2 11a_100000753258_100000740811 [0,1,0,1,0,0|2,0,0]=4 12350 B22R3.2802807 O=C(C=Cc1ccccn1)NC2Cc3ccccc3C2 240690a_100000753258_100000740811 [0,1,0,1,0,0|2,0,0]=4 12351 B22R3.2802807 O=C(C=Cc1cccnc1)NC2Cc3ccccc3C2 11a_100000753258_100000735890 [0,1,0,1,0,0|2,0,0]=4 12352 B22R3.2802807 O=C(C=Cc1cccnc1)NC2Cc3ccccc3C2 240690a_100000753258_100000735890 [0,1,0,1,0,0|2,0,0]=4 12353 B22R3.2802807 O=C(C=Cc1ccncc1)NC2Cc3ccccc3C2 240690a_100000753258_100000682801 [0,1,0,1,0,0|2,0,0]=4 12354 B22R3.242343 Brc1ccc2ccc(cc2c1)NCCc3ccccc3 34a_100010090036_100000765856 [0,1,0,1,0,0|2,0,0]=4 12355 B22R3.242343 Brc1ccc2ccc(cc2c1)NCCc3ccccc3 7a_100010090036_100000765856 [0,1,0,1,0,0|2,0,0]=4 12356 B22R3.242343 Brc1ccc2ccc(cc2c1)OCCc3ccccc3 34a_100009816537_100000765856 [0,1,0,1,0,0|1,0,0]=3 12357 B22R3.242343 Brc1ccc2ccc(cc2c1)OCCc3ccccc3 7a_100009816537_100000765856 [0,1,0,1,0,0|1,0,0]=3 12358 B22R3.242343 Brc1ccc2ccc(cc2c1)OCCc3ccccn3 7a_100009816537_100015183660 [0,1,0,1,0,0|2,0,0]=4 12359 B22R3.242343 Brc1ccc2ccc(cc2c1)OCCc3cccnc3 7a_100009816537_200011713674 [0,1,0,1,0,0|2,0,0]=4 12360 B22R3.242343 Brc1ccc2ccc(cc2c1)OCCc3ccncc3 7a_100009816537_100000723409 [0,1,0,1,0,0|2,0,0]=4 12361 B22R3.242343 Brc1ccc2ncc(cc2c1)OCCc3ccccc3 34a_100000703654_100000765856 [0,1,0,1,0,0|2,0,0]=4 12362 B22R3.242343 Brc1ccc2ncc(cc2c1)OCCc3ccccc3 7a_100000703654_100000765856 [0,1,0,1,0,0|2,0,0]=4 12363 B22R3.242343 Brc1cnc2ccc(cc2c1)OCCc3ccccc3 34a_100010137430_100000765856 [0,1,0,1,0,0|2,0,0]=4 12364 B22R3.242343 Brc1cnc2ccc(cc2c1)OCCc3ccccc3 7a_100010137430_100000765856 [0,1,0,1,0,0|2,0,0]=4 12365 B22R3.242343 Cc1ccc2ccc(cc2c1)OCCc3ccccc3 34a_100000091598_100000765856 [0,1,0,1,0,0|1,0,0]=3 12366 B22R3.242343 Cc1ccc2ccc(cc2c1)OCCc3ccccc3 7a_100000091598_100000765856 [0,1,0,1,0,0|1,0,0]=3 12367 B22R3.242343 Cc1ccc2ccc(cc2c1)OCCc3ccccn3 7a_100000091598_100015183660 [0,1,0,1,0,0|2,0,0]=4 12368 B22R3.242343 Cc1ccc2ccc(cc2c1)OCCc3cccnc3 7a_100000091598_200011713674 [0,1,0,1,0,0|2,0,0]=4 12369 B22R3.242343 Cc1ccc2ccc(cc2c1)OCCc3ccncc3 7a_100000091598_100000723409 [0,1,0,1,0,0|2,0,0]=4 12370 B22R3.242343 Cc1ccc2ccc(cc2n1)OCCc3ccccc3 34a_100009867695_100000765856 [0,1,0,1,0,0|2,0,0]=4 12371 B22R3.242343 Cc1ccc2ccc(cc2n1)OCCc3ccccc3 7a_100009867695_100000765856 [0,1,0,1,0,0|2,0,0]=4 12372 B22R3.242343 Clc1ccc2ccc(cc2n1)OCCc3ccccc3 34a_100000079174_100000765856 [0,1,0,1,0,0|2,0,0]=4 12373 B22R3.242343 Clc1ccc2ccc(cc2n1)OCCc3ccccc3 7a_100000079174_100000765856 [0,1,0,1,0,0|2,0,0]=4 12374 B22R3.242343 Clc1cnc2ccc(cc2c1)OCCc3ccccc3 34a_100009869629_100000765856 [0,1,0,1,0,0|2,0,0]=4 12375 B22R3.242343 Clc1cnc2ccc(cc2c1)OCCc3ccccc3 7a_100009869629_100000765856 [0,1,0,1,0,0|2,0,0]=4 12376 B22R3.242343 Fc1ccc2cnc(cc2c1)OCCc3ccccc3 34a_200000101709_100000765856 [0,1,0,1,0,0|2,0,0]=4 12377 B22R3.242343 Fc1cnc2ccc(cc2c1)OCCc3ccccc3 34a_100009845357_100000765856 [0,1,0,1,0,0|2,0,0]=4 12378 B22R3.242343 Fc1cnc2ccc(cc2c1)OCCc3ccccc3 7a_100009845357_100000765856 [0,1,0,1,0,0|2,0,0]=4 12379 B22R3.242343 Nc1ccc2ccc(cc2c1)OCCc3ccccc3 34a_100015378740_100000765856 [0,1,0,1,0,0|1,0,0]=3 12380 B22R3.242343 Nc1ccc2ccc(cc2c1)OCCc3ccccc3 7a_100015378740_100000765856 [0,1,0,1,0,0|1,0,0]=3 12381 B22R3.242343 Nc1ccc2ccc(cc2c1)OCCc3ccccn3 7a_100015378740_100015183660 [0,1,0,1,0,0|2,0,0]=4 12382 B22R3.242343 Nc1ccc2ccc(cc2c1)OCCc3cccnc3 7a_100015378740_200011713674 [0,1,0,1,0,0|2,0,0]=4 12383 B22R3.242343 Nc1ccc2ccc(cc2c1)OCCc3ccncc3 7a_100015378740_100000723409 [0,1,0,1,0,0|2,0,0]=4 12384 B22R3.242343 Nc1ccc2ccc(cc2c1)SCCc3ccccc3 62a_100000765856_100010090036 [0,1,0,1,0,0|1,1,0]=4 12385 B22R3.242343 Nc1ccc2ccc(cc2c1)SCCc3ccccc3 62a_100010090036_100011218657 [0,1,0,1,0,0|1,1,0]=4 12386 B22R3.242343 O=c1ccc2ccc(cc2o1)OCCc3ccccc3 34a_100000185914_100000765856 [0,1,0,1,0,0|2,0,0]=4 12387 B22R3.242343 O=c1ccc2ccc(cc2o1)OCCc3ccccc3 7a_100000185914_100000765856 [0,1,0,1,0,0|2,0,0]=4 12388 B22R3.242343 Oc1ccc2ccc(cc2c1)NCCc3ccccc3 34a_100015378740_100000765856 [0,1,0,1,0,0|2,0,0]=4 12389 B22R3.242343 Oc1ccc2ccc(cc2c1)NCCc3ccccc3 7a_100015378740_100000765856 [0,1,0,1,0,0|2,0,0]=4 12390 B22R3.242343 Oc1ccc2ccc(cc2c1)SCCc3ccccc3 62a_100000765856_100009816537 [0,1,0,1,0,0|1,1,0]=4 12391 B22R3.242343 Oc1ccc2ccc(nc2c1)SCCc3ccccc3 62a_100000765856_100000079174 [0,1,0,1,0,0|1,1,0]=4 12392 B22R3.46963 Brc1ccc(cc1)CCNc2ccc3ccccc3c2 34a_100000211940_100011740612 [0,1,0,1,0,0|2,0,0]=4 12393 B22R3.46963 Brc1ccc(cc1)CCNc2ccc3ccccc3c2 7a_100000211940_100011740612 [0,1,0,1,0,0|2,0,0]=4 12394 B22R3.46963 Brc1ccc(cc1)CCNc2ccc3ccccc3n2 27a_100000755846_100011291633 [0,1,0,1,0,0|2,0,0]=4 12395 B22R3.46963 Brc1ccc(cc1)CCOc2ccc3ccccc3c2 34a_100000185828_100011740612 [0,1,0,1,0,0|1,0,0]=3 12396 B22R3.46963 Brc1ccc(cc1)CCOc2ccc3ccccc3c2 7a_100000185828_100011740612 [0,1,0,1,0,0|1,0,0]=3 12397 B22R3.46963 Brc1ccc(cc1)CCOc2ccc3cccnc3c2 34a_100011216045_100011740612 [0,1,0,1,0,0|2,0,0]=4 12398 B22R3.46963 Brc1ccc(cc1)CCOc2ccc3ccncc3c2 7a_100000752006_100011740612 [0,1,0,1,0,0|2,0,0]=4 12399 B22R3.46963 Brc1ccc(cc1)CCOc2ccc3cnccc3c2 34a_100000046372_100011740612 [0,1,0,1,0,0|2,0,0]=4 12400 B22R3.46963 Brc1ccc(cc1)CCOc2ccc3cnccc3c2 7a_100000046372_100011740612 [0,1,0,1,0,0|2,0,0]=4 12401 B22R3.46963 Brc1ccc(cc1)CCOc2ccc3ncccc3c2 34a_100011215586_100011740612 [0,1,0,1,0,0|2,0,0]=4 12402 B22R3.46963 Brc1ccc(cc1)CCOc2ccc3ncccc3c2 7a_100011215586_100011740612 [0,1,0,1,0,0|2,0,0]=4 12403 B22R3.46963 Brc1ccc(cc1)CCOc2cnc3ccccc3c2 34a_100011934006_100011740612 [0,1,0,1,0,0|2,0,0]=4 12404 B22R3.46963 Brc1ccc(cc1)CCOc2cnc3ccccc3c2 7a_100011934006_100011740612 [0,1,0,1,0,0|2,0,0]=4 12405 B22R3.46963 Brc1ccc(cc1)CCSc2ccc3ccccc3c2 62a_100011740612_100000233703 [0,1,0,1,0,0|1,1,0]=4 12406 B22R3.46963 Brc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011291633_100011740612 [0,1,0,1,0,0|1,1,0]=4 12407 B22R3.46963 Brc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011740612_100011291633 [0,1,0,1,0,0|1,1,0]=4 12408 B22R3.46963 Cc1ccc(cc1)CCNc2ccc3ccccc3c2 34a_100000211940_100011713686 [0,1,0,1,0,0|2,0,0]=4 12409 B22R3.46963 Cc1ccc(cc1)CCNc2ccc3ccccc3c2 7a_100000211940_100011713686 [0,1,0,1,0,0|2,0,0]=4 12410 B22R3.46963 Cc1ccc(cc1)CCNc2ccc3ccccc3n2 27a_100000705350_100011291633 [0,1,0,1,0,0|2,0,0]=4 12411 B22R3.46963 Cc1ccc(cc1)CCOc2ccc3ccccc3c2 34a_100000185828_100011713686 [0,1,0,1,0,0|1,0,0]=3 12412 B22R3.46963 Cc1ccc(cc1)CCOc2ccc3ccccc3c2 7a_100000185828_100011713686 [0,1,0,1,0,0|1,0,0]=3 12413 B22R3.46963 Cc1ccc(cc1)CCOc2ccc3cccnc3c2 34a_100011216045_100011713686 [0,1,0,1,0,0|2,0,0]=4 12414 B22R3.46963 Cc1ccc(cc1)CCOc2ccc3ccncc3c2 7a_100000752006_100011713686 [0,1,0,1,0,0|2,0,0]=4 12415 B22R3.46963 Cc1ccc(cc1)CCOc2ccc3cnccc3c2 34a_100000046372_100011713686 [0,1,0,1,0,0|2,0,0]=4 12416 B22R3.46963 Cc1ccc(cc1)CCOc2ccc3cnccc3c2 7a_100000046372_100011713686 [0,1,0,1,0,0|2,0,0]=4 12417 B22R3.46963 Cc1ccc(cc1)CCOc2ccc3ncccc3c2 34a_100011215586_100011713686 [0,1,0,1,0,0|2,0,0]=4 12418 B22R3.46963 Cc1ccc(cc1)CCOc2ccc3ncccc3c2 7a_100011215586_100011713686 [0,1,0,1,0,0|2,0,0]=4 12419 B22R3.46963 Cc1ccc(cc1)CCOc2cnc3ccccc3c2 34a_100011934006_100011713686 [0,1,0,1,0,0|2,0,0]=4 12420 B22R3.46963 Cc1ccc(cc1)CCOc2cnc3ccccc3c2 7a_100011934006_100011713686 [0,1,0,1,0,0|2,0,0]=4 12421 B22R3.46963 Cc1ccc(cc1)CCSc2ccc3ccccc3c2 62a_100011713686_100000233703 [0,1,0,1,0,0|1,1,0]=4 12422 B22R3.46963 Cc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011291633_100011713686 [0,1,0,1,0,0|1,1,0]=4 12423 B22R3.46963 Cc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011713686_100011291633 [0,1,0,1,0,0|1,1,0]=4 12424 B22R3.46963 Clc1ccc(cc1)CCNc2ccc3ccccc3c2 34a_100000211940_100011713675 [0,1,0,1,0,0|2,0,0]=4 12425 B22R3.46963 Clc1ccc(cc1)CCNc2ccc3ccccc3c2 7a_100000211940_100011713675 [0,1,0,1,0,0|2,0,0]=4 12426 B22R3.46963 Clc1ccc(cc1)CCNc2ccc3ccccc3n2 27a_100000185265_100011291633 [0,1,0,1,0,0|2,0,0]=4 12427 B22R3.46963 Clc1ccc(cc1)CCOc2ccc3ccccc3c2 34a_100000185828_100011713675 [0,1,0,1,0,0|1,0,0]=3 12428 B22R3.46963 Clc1ccc(cc1)CCOc2ccc3ccccc3c2 7a_100000185828_100011713675 [0,1,0,1,0,0|1,0,0]=3 12429 B22R3.46963 Clc1ccc(cc1)CCOc2ccc3cccnc3c2 34a_100011216045_100011713675 [0,1,0,1,0,0|2,0,0]=4 12430 B22R3.46963 Clc1ccc(cc1)CCOc2ccc3ccncc3c2 7a_100000752006_100011713675 [0,1,0,1,0,0|2,0,0]=4 12431 B22R3.46963 Clc1ccc(cc1)CCOc2ccc3cnccc3c2 34a_100000046372_100011713675 [0,1,0,1,0,0|2,0,0]=4 12432 B22R3.46963 Clc1ccc(cc1)CCOc2ccc3cnccc3c2 7a_100000046372_100011713675 [0,1,0,1,0,0|2,0,0]=4 12433 B22R3.46963 Clc1ccc(cc1)CCOc2ccc3ncccc3c2 34a_100011215586_100011713675 [0,1,0,1,0,0|2,0,0]=4 12434 B22R3.46963 Clc1ccc(cc1)CCOc2ccc3ncccc3c2 7a_100011215586_100011713675 [0,1,0,1,0,0|2,0,0]=4 12435 B22R3.46963 Clc1ccc(cc1)CCOc2cnc3ccccc3c2 34a_100011934006_100011713675 [0,1,0,1,0,0|2,0,0]=4 12436 B22R3.46963 Clc1ccc(cc1)CCOc2cnc3ccccc3c2 7a_100011934006_100011713675 [0,1,0,1,0,0|2,0,0]=4 12437 B22R3.46963 Clc1ccc(cc1)CCSc2ccc3ccccc3c2 62a_100011713675_100000233703 [0,1,0,1,0,0|1,1,0]=4 12438 B22R3.46963 Clc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011291633_100011713675 [0,1,0,1,0,0|1,1,0]=4 12439 B22R3.46963 Clc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011713675_100011291633 [0,1,0,1,0,0|1,1,0]=4 12440 B22R3.46963 Fc1ccc(cc1)CCNc2ccc3ccccc3c2 34a_100000211940_100011217392 [0,1,0,1,0,0|2,0,0]=4 12441 B22R3.46963 Fc1ccc(cc1)CCNc2ccc3ccccc3c2 7a_100000211940_100011217392 [0,1,0,1,0,0|2,0,0]=4 12442 B22R3.46963 Fc1ccc(cc1)CCNc2ccc3ccccc3n2 27a_100000199005_100011291633 [0,1,0,1,0,0|2,0,0]=4 12443 B22R3.46963 Fc1ccc(cc1)CCOc2ccc3ccccc3c2 34a_100000185828_100011217392 [0,1,0,1,0,0|1,0,0]=3 12444 B22R3.46963 Fc1ccc(cc1)CCOc2ccc3ccccc3c2 7a_100000185828_100011217392 [0,1,0,1,0,0|1,0,0]=3 12445 B22R3.46963 Fc1ccc(cc1)CCOc2ccc3cccnc3c2 34a_100011216045_100011217392 [0,1,0,1,0,0|2,0,0]=4 12446 B22R3.46963 Fc1ccc(cc1)CCOc2ccc3ccncc3c2 7a_100000752006_100011217392 [0,1,0,1,0,0|2,0,0]=4 12447 B22R3.46963 Fc1ccc(cc1)CCOc2ccc3cnccc3c2 34a_100000046372_100011217392 [0,1,0,1,0,0|2,0,0]=4 12448 B22R3.46963 Fc1ccc(cc1)CCOc2ccc3cnccc3c2 7a_100000046372_100011217392 [0,1,0,1,0,0|2,0,0]=4 12449 B22R3.46963 Fc1ccc(cc1)CCOc2ccc3ncccc3c2 34a_100011215586_100011217392 [0,1,0,1,0,0|2,0,0]=4 12450 B22R3.46963 Fc1ccc(cc1)CCOc2ccc3ncccc3c2 7a_100011215586_100011217392 [0,1,0,1,0,0|2,0,0]=4 12451 B22R3.46963 Fc1ccc(cc1)CCOc2cnc3ccccc3c2 34a_100011934006_100011217392 [0,1,0,1,0,0|2,0,0]=4 12452 B22R3.46963 Fc1ccc(cc1)CCOc2cnc3ccccc3c2 7a_100011934006_100011217392 [0,1,0,1,0,0|2,0,0]=4 12453 B22R3.46963 Fc1ccc(cc1)CCSc2ccc3ccccc3c2 62a_100011217392_100000233703 [0,1,0,1,0,0|1,1,0]=4 12454 B22R3.46963 Fc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011217392_100011291633 [0,1,0,1,0,0|1,1,0]=4 12455 B22R3.46963 Fc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011291633_100011217392 [0,1,0,1,0,0|1,1,0]=4 12456 B22R3.46963 Oc1ccc(cc1)CCNc2ccc3ccccc3c2 7a_100000211940_100009816426 [0,1,0,1,0,0|2,0,0]=4 12457 B22R3.46963 Oc1ccc(cc1)CCNc2ccc3ccccc3n2 27a_100000743037_100011291633 [0,1,0,1,0,0|2,0,0]=4 12458 B22R3.46963 Oc1ccc(cc1)CCOc2ccc3ccccc3c2 7a_100000185828_100009816426 [0,1,0,1,0,0|1,0,0]=3 12459 B22R3.46963 Oc1ccc(cc1)CCOc2ccc3ccncc3c2 7a_100000752006_100009816426 [0,1,0,1,0,0|2,0,0]=4 12460 B22R3.46963 Oc1ccc(cc1)CCOc2ccc3cnccc3c2 7a_100000046372_100009816426 [0,1,0,1,0,0|2,0,0]=4 12461 B22R3.46963 Oc1ccc(cc1)CCOc2ccc3ncccc3c2 7a_100011215586_100009816426 [0,1,0,1,0,0|2,0,0]=4 12462 B22R3.46963 Oc1ccc(cc1)CCOc2cnc3ccccc3c2 7a_100011934006_100009816426 [0,1,0,1,0,0|2,0,0]=4 12463 B22R3.46963 Oc1ccc(cc1)CCSc2ccc3ccccc3c2 62a_100009816426_100000233703 [0,1,0,1,0,0|1,1,0]=4 12464 B22R3.46963 Oc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100009816426_100011291633 [0,1,0,1,0,0|1,1,0]=4 12465 B22R3.46963 Oc1ccc(cc1)CCSc2ccc3ccccc3n2 62a_100011291633_100009816426 [0,1,0,1,0,0|1,1,0]=4 12466 B22R3.63887 O=C(C=Cc1ccccc1)N2CC(C2)c3cccnc3 11a_100015183634_100000210462 [0,1,0,1,0,0|2,0,0]=4 12467 B22R3.32809 CC(Cc1c(ccc2c1cccc2)Br)c3ccccc3 271570a_100000062452_100010090040 [0,1,0,1,0,0|2,0,0]=4 12468 B22R3.32809 CC(Cc1c(ccc2c1cccc2)N)c3ccccc3 271570a_100000062452_100000705303 [0,1,0,1,0,0|2,0,0]=4 12469 B22R3.32809 CC(Cc1c(ccc2c1cccc2)O)c3ccccc3 271570a_100000062452_100000183829 [0,1,0,1,0,0|1,0,1]=4 12470 B22R3.32809 Cc1ccc2ccccc2c1CC(C)c3ccccc3 271570a_100000062452_100000759710 [0,1,0,1,0,0|2,0,0]=4 12471 B22R3.212251 CC(CNc1ccc2ccccc2c1)c3ccccc3 34a_100000211940_100000756946 [0,1,0,1,0,0|2,0,0]=4 12472 B22R3.212251 CC(CNc1ccc2ccccc2c1)c3ccccc3 7a_100000211940_100000756946 [0,1,0,1,0,0|2,0,0]=4 12473 B22R3.212251 CC(CNc1ccc2ccccc2n1)c3ccccc3 27a_100000701038_100011291633 [0,1,0,1,0,0|2,0,0]=4 12474 B22R3.212251 CC(COc1ccc2ccccc2c1)c3ccccc3 34a_100000185828_100000756946 [0,1,0,1,0,0|1,0,0]=3 12475 B22R3.212251 CC(COc1ccc2ccccc2c1)c3ccccc3 7a_100000185828_100000756946 [0,1,0,1,0,0|1,0,0]=3 12476 B22R3.212251 CC(COc1ccc2cccnc2c1)c3ccccc3 34a_100011216045_100000756946 [0,1,0,1,0,0|2,0,0]=4 12477 B22R3.212251 CC(COc1ccc2ccncc2c1)c3ccccc3 7a_100000752006_100000756946 [0,1,0,1,0,0|2,0,0]=4 12478 B22R3.212251 CC(COc1ccc2cnccc2c1)c3ccccc3 34a_100000046372_100000756946 [0,1,0,1,0,0|2,0,0]=4 12479 B22R3.212251 CC(COc1ccc2cnccc2c1)c3ccccc3 7a_100000046372_100000756946 [0,1,0,1,0,0|2,0,0]=4 12480 B22R3.212251 CC(COc1ccc2ncccc2c1)c3ccccc3 34a_100011215586_100000756946 [0,1,0,1,0,0|2,0,0]=4 12481 B22R3.212251 CC(COc1ccc2ncccc2c1)c3ccccc3 7a_100011215586_100000756946 [0,1,0,1,0,0|2,0,0]=4 12482 B22R3.212251 CC(COc1cnc2ccccc2c1)c3ccccc3 34a_100011934006_100000756946 [0,1,0,1,0,0|2,0,0]=4 12483 B22R3.212251 CC(COc1cnc2ccccc2c1)c3ccccc3 7a_100011934006_100000756946 [0,1,0,1,0,0|2,0,0]=4 12484 B22R3.212251 CC(CSc1ccc2ccccc2c1)c3ccccc3 62a_100000756946_100000233703 [0,1,0,1,0,0|1,1,0]=4 12485 B22R3.212251 CC(CSc1ccc2ccccc2n1)c3ccccc3 62a_100000756946_100011291633 [0,1,0,1,0,0|1,1,0]=4 12486 B22R3.212251 CC(CSc1ccc2ccccc2n1)c3ccccc3 62a_100011291633_100000756946 [0,1,0,1,0,0|1,1,0]=4 12487 B22R3.212251 O=C(COc1ccc2ccccc2c1)c3ccccc3 7a_100000185828_100000211460 [0,1,0,1,0,0|1,0,1]=4 12488 B22R3.212251 OC(CNc1ccc2ccccc2c1)c3ccccc3 34a_100000211940_100000185958 [0,1,0,1,0,0|2,0,0]=4 12489 B22R3.212251 OC(CNc1ccc2ccccc2c1)c3ccccc3 7a_100000211940_100000185958 [0,1,0,1,0,0|2,0,0]=4 12490 B22R3.212251 OC(CNc1ccc2ccccc2n1)c3ccccc3 27a_100000210709_100011291633 [0,1,0,1,0,0|2,0,0]=4 12491 B22R3.212251 OC(COc1ccc2ccccc2c1)c3ccccc3 34a_100000185828_100000185958 [0,1,0,1,0,0|1,0,0]=3 12492 B22R3.212251 OC(COc1ccc2ccccc2c1)c3ccccc3 7a_100000185828_100000185958 [0,1,0,1,0,0|1,0,0]=3 12493 B22R3.212251 OC(COc1ccc2cccnc2c1)c3ccccc3 34a_100011216045_100000185958 [0,1,0,1,0,0|2,0,0]=4 12494 B22R3.212251 OC(COc1ccc2ccncc2c1)c3ccccc3 7a_100000752006_100000185958 [0,1,0,1,0,0|2,0,0]=4 12495 B22R3.212251 OC(COc1ccc2cnccc2c1)c3ccccc3 34a_100000046372_100000185958 [0,1,0,1,0,0|2,0,0]=4 12496 B22R3.212251 OC(COc1ccc2cnccc2c1)c3ccccc3 7a_100000046372_100000185958 [0,1,0,1,0,0|2,0,0]=4 12497 B22R3.212251 OC(COc1ccc2ncccc2c1)c3ccccc3 34a_100011215586_100000185958 [0,1,0,1,0,0|2,0,0]=4 12498 B22R3.212251 OC(COc1ccc2ncccc2c1)c3ccccc3 7a_100011215586_100000185958 [0,1,0,1,0,0|2,0,0]=4 12499 B22R3.212251 OC(COc1cnc2ccccc2c1)c3ccccc3 34a_100011934006_100000185958 [0,1,0,1,0,0|2,0,0]=4 12500 B22R3.212251 OC(COc1cnc2ccccc2c1)c3ccccc3 7a_100011934006_100000185958 [0,1,0,1,0,0|2,0,0]=4 12501 B22R3.212251 OC(CSc1ccc2ccccc2c1)c3ccccc3 62a_100000185958_100000233703 [0,1,0,1,0,0|1,1,0]=4 12502 B22R3.212251 OC(CSc1ccc2ccccc2n1)c3ccccc3 62a_100000185958_100011291633 [0,1,0,1,0,0|1,1,0]=4 12503 B22R3.212251 OC(CSc1ccc2ccccc2n1)c3ccccc3 62a_100011291633_100000185958 [0,1,0,1,0,0|1,1,0]=4 12504 B22R3.212251 O[C@H](CNc1ccc2ccccc2c1)c3ccccc3 34a_100000211940_100011933945 [0,1,0,1,0,0|2,0,0]=4 12505 B22R3.212251 O[C@H](CNc1ccc2ccccc2c1)c3ccccc3 7a_100000211940_100011933945 [0,1,0,1,0,0|2,0,0]=4 12506 B22R3.212251 O[C@H](COc1ccc2ccccc2c1)c3ccccc3 34a_100000185828_100011933945 [0,1,0,1,0,0|1,0,0]=3 12507 B22R3.212251 O[C@H](COc1ccc2ccccc2c1)c3ccccc3 7a_100000185828_100011933945 [0,1,0,1,0,0|1,0,0]=3 12508 B22R3.212251 O[C@H](COc1ccc2cccnc2c1)c3ccccc3 34a_100011216045_100011933945 [0,1,0,1,0,0|2,0,0]=4 12509 B22R3.212251 O[C@H](COc1ccc2ccncc2c1)c3ccccc3 7a_100000752006_100011933945 [0,1,0,1,0,0|2,0,0]=4 12510 B22R3.212251 O[C@H](COc1ccc2cnccc2c1)c3ccccc3 34a_100000046372_100011933945 [0,1,0,1,0,0|2,0,0]=4 12511 B22R3.212251 O[C@H](COc1ccc2cnccc2c1)c3ccccc3 7a_100000046372_100011933945 [0,1,0,1,0,0|2,0,0]=4 12512 B22R3.212251 O[C@H](COc1ccc2ncccc2c1)c3ccccc3 34a_100011215586_100011933945 [0,1,0,1,0,0|2,0,0]=4 12513 B22R3.212251 O[C@H](COc1ccc2ncccc2c1)c3ccccc3 7a_100011215586_100011933945 [0,1,0,1,0,0|2,0,0]=4 12514 B22R3.212251 O[C@H](COc1cnc2ccccc2c1)c3ccccc3 34a_100011934006_100011933945 [0,1,0,1,0,0|2,0,0]=4 12515 B22R3.212251 O[C@H](COc1cnc2ccccc2c1)c3ccccc3 7a_100011934006_100011933945 [0,1,0,1,0,0|2,0,0]=4 12516 B22R3.212251 O[C@H](CSc1ccc2ccccc2c1)c3ccccc3 62a_100011933945_100000233703 [0,1,0,1,0,0|1,1,0]=4 12517 B22R3.212251 O[C@H](CSc1ccc2ccccc2n1)c3ccccc3 62a_100011291633_100011933945 [0,1,0,1,0,0|1,1,0]=4 12518 B22R3.212251 O[C@H](CSc1ccc2ccccc2n1)c3ccccc3 62a_100011933945_100011291633 [0,1,0,1,0,0|1,1,0]=4 12519 B22R3.7294291 O=C1CC(c2c1cccc2)C(=O)C=Cc3ccccc3 1458a_100000210462_100010208147 [0,1,0,1,0,0|1,0,1]=4 12520 B22R3.791519 CC(Cc1ccccc1)Nc2ccc3ccccc3c2 34a_100000211940_200011218536 [0,1,0,1,0,0|2,0,0]=4 12521 B22R3.791519 CC(Cc1ccccc1)Nc2ccc3ccccc3c2 7a_100000211940_200011218536 [0,1,0,1,0,0|2,0,0]=4 12522 B22R3.791519 CC(Cc1ccccc1)Oc2ccc3ccccc3c2 34a_100000185828_200011218536 [0,1,0,1,0,0|1,0,0]=3 12523 B22R3.791519 CC(Cc1ccccc1)Oc2ccc3ccccc3c2 7a_100000185828_200011218536 [0,1,0,1,0,0|1,0,0]=3 12524 B22R3.791519 CC(Cc1ccccc1)Oc2ccc3cccnc3c2 34a_100011216045_200011218536 [0,1,0,1,0,0|2,0,0]=4 12525 B22R3.791519 CC(Cc1ccccc1)Oc2ccc3ccncc3c2 7a_100000752006_200011218536 [0,1,0,1,0,0|2,0,0]=4 12526 B22R3.791519 CC(Cc1ccccc1)Oc2ccc3cnccc3c2 34a_100000046372_200011218536 [0,1,0,1,0,0|2,0,0]=4 12527 B22R3.791519 CC(Cc1ccccc1)Oc2ccc3cnccc3c2 7a_100000046372_200011218536 [0,1,0,1,0,0|2,0,0]=4 12528 B22R3.791519 CC(Cc1ccccc1)Oc2ccc3ncccc3c2 34a_100011215586_200011218536 [0,1,0,1,0,0|2,0,0]=4 12529 B22R3.791519 CC(Cc1ccccc1)Oc2ccc3ncccc3c2 7a_100011215586_200011218536 [0,1,0,1,0,0|2,0,0]=4 12530 B22R3.791519 CC(Cc1ccccc1)Oc2cnc3ccccc3c2 34a_100011934006_200011218536 [0,1,0,1,0,0|2,0,0]=4 12531 B22R3.791519 CC(Cc1ccccc1)Oc2cnc3ccccc3c2 7a_100011934006_200011218536 [0,1,0,1,0,0|2,0,0]=4 12532 B22R3.791519 CC(Cc1ccccc1)Sc2ccc3ccccc3c2 62a_200011218536_100000233703 [0,1,0,1,0,0|1,1,0]=4 12533 B22R3.791519 CC(Cc1ccccc1)Sc2ccc3ccccc3n2 62a_100011291633_200011218536 [0,1,0,1,0,0|1,1,0]=4 12534 B22R3.791519 CC(Cc1ccccc1)Sc2ccc3ccccc3n2 62a_200011218536_100011291633 [0,1,0,1,0,0|1,1,0]=4 12535 B22R3.242710 Brc1ccc2cc(ccc2c1)NCCc3ccccc3 34a_100000185457_100000765856 [0,1,0,1,0,0|2,0,0]=4 12536 B22R3.242710 Brc1ccc2cc(ccc2c1)NCCc3ccccc3 7a_100000185457_100000765856 [0,1,0,1,0,0|2,0,0]=4 12537 B22R3.242710 Brc1ccc2cc(ccc2c1)OCCc3ccccc3 34a_100000185455_100000765856 [0,1,0,1,0,0|1,0,0]=3 12538 B22R3.242710 Brc1ccc2cc(ccc2c1)OCCc3ccccc3 7a_100000185455_100000765856 [0,1,0,1,0,0|1,0,0]=3 12539 B22R3.242710 Brc1ccc2cc(ccc2c1)OCCc3ccccn3 7a_100000185455_100015183660 [0,1,0,1,0,0|2,0,0]=4 12540 B22R3.242710 Brc1ccc2cc(ccc2c1)OCCc3cccnc3 7a_100000185455_200011713674 [0,1,0,1,0,0|2,0,0]=4 12541 B22R3.242710 Brc1ccc2cc(ccc2c1)OCCc3ccncc3 7a_100000185455_100000723409 [0,1,0,1,0,0|2,0,0]=4 12542 B22R3.242710 Brc1ccc2cc(ccc2c1)SCCc3ccccc3 62a_100000765856_100012344972 [0,1,0,1,0,0|1,1,0]=4 12543 B22R3.242710 Brc1ccc2cc(ccc2c1)SCCc3ccccc3 62a_100012344972_100011218657 [0,1,0,1,0,0|1,1,0]=4 12544 B22R3.242710 Brc1cnc2cc(ccc2c1)OCCc3ccccc3 34a_200010153753_100000765856 [0,1,0,1,0,0|2,0,0]=4 12545 B22R3.242710 Brc1cnc2cc(ccc2c1)OCCc3ccccc3 7a_200010153753_100000765856 [0,1,0,1,0,0|2,0,0]=4 12546 B22R3.242710 Cc1ccc2cc(ccc2c1)OCCc3ccccc3 34a_100000074090_100000765856 [0,1,0,1,0,0|1,0,0]=3 12547 B22R3.242710 Cc1ccc2cc(ccc2c1)OCCc3ccccc3 7a_100000074090_100000765856 [0,1,0,1,0,0|1,0,0]=3 12548 B22R3.242710 Cc1ccc2cc(ccc2c1)OCCc3ccccn3 7a_100000074090_100015183660 [0,1,0,1,0,0|2,0,0]=4 12549 B22R3.242710 Cc1ccc2cc(ccc2c1)OCCc3cccnc3 7a_100000074090_200011713674 [0,1,0,1,0,0|2,0,0]=4 12550 B22R3.242710 Cc1ccc2cc(ccc2c1)OCCc3ccncc3 7a_100000074090_100000723409 [0,1,0,1,0,0|2,0,0]=4 12551 B22R3.242710 Cc1ccc2cc(ccc2n1)OCCc3ccccc3 34a_100000037634_100000765856 [0,1,0,1,0,0|2,0,0]=4 12552 B22R3.242710 Cc1ccc2cc(ccc2n1)OCCc3ccccc3 7a_100000037634_100000765856 [0,1,0,1,0,0|2,0,0]=4 12553 B22R3.242710 Cc1ccc2nc(ccc2c1)NCCc3ccccc3 27a_100000106460_100011865911 [0,1,0,1,0,0|2,0,0]=4 12554 B22R3.242710 Cc1ccc2nc(ccc2c1)SCCc3ccccc3 62a_100000765856_100011865911 [0,1,0,1,0,0|1,1,0]=4 12555 B22R3.242710 Cc1ccc2nc(ccc2c1)SCCc3ccccc3 62a_200000181977_100011218657 [0,1,0,1,0,0|1,1,0]=4 12556 B22R3.242710 Clc1ccc2cc(ccc2c1)OCCc3ccccc3 34a_100000074905_100000765856 [0,1,0,1,0,0|1,0,0]=3 12557 B22R3.242710 Clc1ccc2cc(ccc2c1)OCCc3ccccc3 7a_100000074905_100000765856 [0,1,0,1,0,0|1,0,0]=3 12558 B22R3.242710 Clc1ccc2cc(ccc2c1)OCCc3ccccn3 7a_100000074905_100015183660 [0,1,0,1,0,0|2,0,0]=4 12559 B22R3.242710 Clc1ccc2cc(ccc2c1)OCCc3cccnc3 7a_100000074905_200011713674 [0,1,0,1,0,0|2,0,0]=4 12560 B22R3.242710 Clc1ccc2cc(ccc2c1)OCCc3ccncc3 7a_100000074905_100000723409 [0,1,0,1,0,0|2,0,0]=4 12561 B22R3.242710 Clc1ccc2cc(ccc2n1)OCCc3ccccc3 34a_100009849208_100000765856 [0,1,0,1,0,0|2,0,0]=4 12562 B22R3.242710 Clc1ccc2cc(ccc2n1)OCCc3ccccc3 7a_100009849208_100000765856 [0,1,0,1,0,0|2,0,0]=4 12563 B22R3.242710 Fc1ccc2cc(ccc2c1)OCCc3ccccc3 34a_100009847029_100000765856 [0,1,0,1,0,0|1,0,0]=3 12564 B22R3.242710 Fc1ccc2cc(ccc2c1)OCCc3ccccc3 7a_100009847029_100000765856 [0,1,0,1,0,0|1,0,0]=3 12565 B22R3.242710 Fc1ccc2cc(ccc2c1)OCCc3ccccn3 7a_100009847029_100015183660 [0,1,0,1,0,0|2,0,0]=4 12566 B22R3.242710 Fc1ccc2cc(ccc2c1)OCCc3cccnc3 7a_100009847029_200011713674 [0,1,0,1,0,0|2,0,0]=4 12567 B22R3.242710 Fc1ccc2cc(ccc2c1)OCCc3ccncc3 7a_100009847029_100000723409 [0,1,0,1,0,0|2,0,0]=4 12568 B22R3.242710 Fc1ccc2cc(ccc2c1)SCCc3ccccc3 62a_100000765856_100009817052 [0,1,0,1,0,0|1,1,0]=4 12569 B22R3.242710 Fc1ccc2cc(ccc2c1)SCCc3ccccc3 62a_100009817052_100011218657 [0,1,0,1,0,0|1,1,0]=4 12570 B22R3.242710 Fc1ccc2cc(cnc2c1)OCCc3ccccc3 34a_100012184162_100000765856 [0,1,0,1,0,0|2,0,0]=4 12571 B22R3.242710 Fc1ccc2cc(cnc2c1)OCCc3ccccc3 7a_100012184162_100000765856 [0,1,0,1,0,0|2,0,0]=4 12572 B22R3.242710 Fc1ccc2nc(ccc2c1)NCCc3ccccc3 27a_100000106460_100011998705 [0,1,0,1,0,0|2,0,0]=4 12573 B22R3.242710 Fc1ccc2nc(ccc2c1)SCCc3ccccc3 62a_100000765856_100011998705 [0,1,0,1,0,0|1,1,0]=4 12574 B22R3.242710 Fc1ccc2nc(ccc2c1)SCCc3ccccc3 62a_200012355665_100011218657 [0,1,0,1,0,0|1,1,0]=4 12575 B22R3.242710 Nc1ccc2cc(ccc2c1)SCCc3ccccc3 62a_100000185457_100011218657 [0,1,0,1,0,0|1,1,0]=4 12576 B22R3.242710 Nc1ccc2cc(ccc2c1)SCCc3ccccc3 62a_100000765856_100000185457 [0,1,0,1,0,0|1,1,0]=4 12577 B22R3.242710 O=c1ccc2cc(ccc2o1)OCCc3ccccc3 34a_100000066265_100000765856 [0,1,0,1,0,0|2,0,0]=4 12578 B22R3.242710 O=c1ccc2cc(ccc2o1)OCCc3ccccc3 7a_100000066265_100000765856 [0,1,0,1,0,0|2,0,0]=4 12579 B22R3.242710 Oc1ccc2cc(ccc2c1)SCCc3ccccc3 62a_100000765856_100000185455 [0,1,0,1,0,0|1,1,0]=4 12580 B22R3.242710 Oc1ccc2nc(ccc2c1)SCCc3ccccc3 62a_100000765856_100009849208 [0,1,0,1,0,0|1,1,0]=4 12581 B22R3.10328152 Brc1cccc2c1cc(cc2)OCCc3ccccc3 34a_100010169565_100000765856 [0,1,0,1,0,0|1,0,0]=3 12582 B22R3.10328152 Brc1cccc2c1cc(cc2)OCCc3ccccc3 7a_100010169565_100000765856 [0,1,0,1,0,0|1,0,0]=3 12583 B22R3.10328152 Brc1cccc2c1cc(cc2)OCCc3ccccn3 7a_100010169565_100015183660 [0,1,0,1,0,0|2,0,0]=4 12584 B22R3.10328152 Brc1cccc2c1cc(cc2)OCCc3cccnc3 7a_100010169565_200011713674 [0,1,0,1,0,0|2,0,0]=4 12585 B22R3.10328152 Brc1cccc2c1cc(cc2)OCCc3ccncc3 7a_100010169565_100000723409 [0,1,0,1,0,0|2,0,0]=4 12586 B22R3.10328152 Brc1ccnc2c1cc(cc2)OCCc3ccccc3 34a_100010204251_100000765856 [0,1,0,1,0,0|2,0,0]=4 12587 B22R3.10328152 Brc1ccnc2c1cc(cc2)OCCc3ccccc3 7a_100010204251_100000765856 [0,1,0,1,0,0|2,0,0]=4 12588 B22R3.10328152 Cc1cccc2c1cc(cc2)OCCc3ccccc3 34a_200000091600_100000765856 [0,1,0,1,0,0|1,0,0]=3 12589 B22R3.10328152 Cc1cccc2c1cc(cc2)OCCc3ccccc3 7a_200000091600_100000765856 [0,1,0,1,0,0|1,0,0]=3 12590 B22R3.10328152 Cc1cccc2c1cc(cc2)OCCc3ccccn3 7a_200000091600_100015183660 [0,1,0,1,0,0|2,0,0]=4 12591 B22R3.10328152 Cc1cccc2c1cc(cc2)OCCc3cccnc3 7a_200000091600_200011713674 [0,1,0,1,0,0|2,0,0]=4 12592 B22R3.10328152 Cc1cccc2c1cc(cc2)OCCc3ccncc3 7a_200000091600_100000723409 [0,1,0,1,0,0|2,0,0]=4 12593 B22R3.10328152 Cc1cccc2c1cc(cc2)SCCc3ccccc3 62a_100000765856_100010089936 [0,1,0,1,0,0|1,1,0]=4 12594 B22R3.10328152 Cc1cccc2c1nc(cc2)NCCc3ccccc3 27a_100000106460_100012002297 [0,1,0,1,0,0|2,0,0]=4 12595 B22R3.10328152 Cc1cccc2c1nc(cc2)SCCc3ccccc3 62a_100000765856_100012002297 [0,1,0,1,0,0|1,1,0]=4 12596 B22R3.10328152 Clc1ccnc2c1cc(cc2)OCCc3ccccc3 34a_100000075933_100000765856 [0,1,0,1,0,0|2,0,0]=4 12597 B22R3.10328152 Clc1ccnc2c1cc(cc2)OCCc3ccccc3 7a_100000075933_100000765856 [0,1,0,1,0,0|2,0,0]=4 12598 B22R3.10328152 Clc1nccc2c1cc(cc2)OCCc3ccccc3 34a_200009844553_100000765856 [0,1,0,1,0,0|2,0,0]=4 12599 B22R3.10328152 Clc1nccc2c1cc(cc2)OCCc3ccccc3 7a_200009844553_100000765856 [0,1,0,1,0,0|2,0,0]=4 12600 B22R3.10328152 Fc1cccc2c1cc(cc2)OCCc3ccccc3 34a_100000091619_100000765856 [0,1,0,1,0,0|1,0,0]=3 12601 B22R3.10328152 Fc1cccc2c1cc(cc2)OCCc3ccccc3 7a_100000091619_100000765856 [0,1,0,1,0,0|1,0,0]=3 12602 B22R3.10328152 Fc1cccc2c1cc(cc2)OCCc3ccccn3 7a_100000091619_100015183660 [0,1,0,1,0,0|2,0,0]=4 12603 B22R3.10328152 Fc1cccc2c1cc(cc2)OCCc3cccnc3 7a_100000091619_200011713674 [0,1,0,1,0,0|2,0,0]=4 12604 B22R3.10328152 Fc1cccc2c1cc(cc2)OCCc3ccncc3 7a_100000091619_100000723409 [0,1,0,1,0,0|2,0,0]=4 12605 B22R3.10328152 Fc1cccc2c1nc(cc2)SCCc3ccccc3 62a_100000765856_100012017632 [0,1,0,1,0,0|1,1,0]=4 12606 B22R3.10328152 Nc1cccc2c1cc(cc2)OCCc3ccccc3 34a_100000034012_100000765856 [0,1,0,1,0,0|1,0,0]=3 12607 B22R3.10328152 Nc1cccc2c1cc(cc2)OCCc3ccccc3 7a_100000034012_100000765856 [0,1,0,1,0,0|1,0,0]=3 12608 B22R3.10328152 Nc1cccc2c1cc(cc2)OCCc3ccccn3 7a_100000034012_100015183660 [0,1,0,1,0,0|2,0,0]=4 12609 B22R3.10328152 Nc1cccc2c1cc(cc2)OCCc3cccnc3 7a_100000034012_200011713674 [0,1,0,1,0,0|2,0,0]=4 12610 B22R3.10328152 Nc1cccc2c1cc(cc2)OCCc3ccncc3 7a_100000034012_100000723409 [0,1,0,1,0,0|2,0,0]=4 12611 B22R3.10328152 Nc1cccc2c1cc(cc2)SCCc3ccccc3 62a_100000765856_100010090012 [0,1,0,1,0,0|1,1,0]=4 12612 B22R3.10328152 Nc1cccc2c1cc(cc2)SCCc3ccccc3 62a_100010090012_100011218657 [0,1,0,1,0,0|1,1,0]=4 12613 B22R3.10328152 Oc1cccc2c1cc(cc2)NCCc3ccccc3 34a_100132313934_100000765856 [0,1,0,1,0,0|2,0,0]=4 12614 B22R3.10328152 Oc1cccc2c1cc(cc2)SCCc3ccccc3 62a_100000765856_100010089991 [0,1,0,1,0,0|1,1,0]=4 12615 B22R3.10328152 Oc1cccc2c1nc(cc2)NCCc3ccccc3 27a_100000106460_100010153751 [0,1,0,1,0,0|2,0,0]=4 12616 B22R3.10328152 Oc1cccc2c1nc(cc2)SCCc3ccccc3 62a_100000765856_100000013812 [0,1,0,1,0,0|1,1,0]=4 12617 B22R3.28886 Brc1cc2ccccc2cc1NCCc3ccccc3 34a_100009991566_100000765856 [0,1,0,1,0,0|2,0,0]=4 12618 B22R3.28886 Brc1cc2ccccc2cc1NCCc3ccccc3 7a_100009991566_100000765856 [0,1,0,1,0,0|2,0,0]=4 12619 B22R3.28886 Brc1cc2ccccc2cc1OCCc3ccccc3 34a_100009817189_100000765856 [0,1,0,1,0,0|1,0,0]=3 12620 B22R3.28886 Brc1cc2ccccc2cc1OCCc3ccccc3 7a_100009817189_100000765856 [0,1,0,1,0,0|1,0,0]=3 12621 B22R3.28886 Brc1cc2ccccc2cc1OCCc3ccccn3 7a_100009817189_100015183660 [0,1,0,1,0,0|2,0,0]=4 12622 B22R3.28886 Brc1cc2ccccc2cc1OCCc3cccnc3 7a_100009817189_200011713674 [0,1,0,1,0,0|2,0,0]=4 12623 B22R3.28886 Brc1cc2ccccc2cc1OCCc3ccncc3 7a_100009817189_100000723409 [0,1,0,1,0,0|2,0,0]=4 12624 B22R3.28886 Brc1cc2ccccc2cc1SCCc3ccccc3 62a_100000765856_200010169544 [0,1,0,1,0,0|1,1,0]=4 12625 B22R3.28886 Brc1cc2ccccc2cc1SCCc3ccccc3 62a_200010169544_100011218657 [0,1,0,1,0,0|1,1,0]=4 12626 B22R3.28886 Brc1cc2ccccc2nc1SCCc3ccccc3 62a_100000765856_100010072790 [0,1,0,1,0,0|1,1,0]=4 12627 B22R3.28886 Brc1cc2ccccc2nc1SCCc3ccccc3 62a_100010072790_100011218657 [0,1,0,1,0,0|1,1,0]=4 12628 B22R3.28886 Brc1cc2ncccc2cc1OCCc3ccccc3 34a_200010153759_100000765856 [0,1,0,1,0,0|2,0,0]=4 12629 B22R3.28886 Brc1cc2ncccc2cc1OCCc3ccccc3 7a_200010153759_100000765856 [0,1,0,1,0,0|2,0,0]=4 12630 B22R3.28886 Cc1cc2ccccc2cc1OCCc3ccccc3 34a_100000091601_100000765856 [0,1,0,1,0,0|1,0,0]=3 12631 B22R3.28886 Cc1cc2ccccc2cc1OCCc3ccccc3 7a_100000091601_100000765856 [0,1,0,1,0,0|1,0,0]=3 12632 B22R3.28886 Cc1cc2ccccc2cc1OCCc3ccccn3 7a_100000091601_100015183660 [0,1,0,1,0,0|2,0,0]=4 12633 B22R3.28886 Cc1cc2ccccc2cc1OCCc3cccnc3 7a_100000091601_200011713674 [0,1,0,1,0,0|2,0,0]=4 12634 B22R3.28886 Cc1cc2ccccc2cc1OCCc3ccncc3 7a_100000091601_100000723409 [0,1,0,1,0,0|2,0,0]=4 12635 B22R3.28886 Cc1cc2ccccc2nc1NCCc3ccccc3 27a_100000106460_100000751756 [0,1,0,1,0,0|2,0,0]=4 12636 B22R3.28886 Cc1cc2ccccc2nc1SCCc3ccccc3 62a_100000765856_100000751756 [0,1,0,1,0,0|1,1,0]=4 12637 B22R3.28886 Cc1nc2ccccc2cc1OCCc3ccccc3 34a_200000079175_100000765856 [0,1,0,1,0,0|2,0,0]=4 12638 B22R3.28886 Cc1nc2ccccc2cc1OCCc3ccccc3 7a_200000079175_100000765856 [0,1,0,1,0,0|2,0,0]=4 12639 B22R3.28886 Clc1cc2ccccc2cc1SCCc3ccccc3 62a_100000765856_100010152806 [0,1,0,1,0,0|1,1,0]=4 12640 B22R3.28886 Clc1cc2ccccc2cc1SCCc3ccccc3 62a_100010152806_100011218657 [0,1,0,1,0,0|1,1,0]=4 12641 B22R3.28886 Clc1nc2ccccc2cc1OCCc3ccccc3 34a_200000100762_100000765856 [0,1,0,1,0,0|2,0,0]=4 12642 B22R3.28886 Clc1nc2ccccc2cc1OCCc3ccccc3 7a_200000100762_100000765856 [0,1,0,1,0,0|2,0,0]=4 12643 B22R3.28886 Nc1cc2ccccc2cc1OCCc3ccccc3 34a_106744474703_100000765856 [0,1,0,1,0,0|1,0,0]=3 12644 B22R3.28886 Nc1cc2ccccc2cc1OCCc3ccccc3 7a_106744474703_100000765856 [0,1,0,1,0,0|1,0,0]=3 12645 B22R3.28886 Nc1cc2ccccc2cc1OCCc3ccccn3 7a_106744474703_100015183660 [0,1,0,1,0,0|2,0,0]=4 12646 B22R3.28886 Nc1cc2ccccc2cc1OCCc3cccnc3 7a_106744474703_200011713674 [0,1,0,1,0,0|2,0,0]=4 12647 B22R3.28886 Nc1cc2ccccc2cc1OCCc3ccncc3 7a_106744474703_100000723409 [0,1,0,1,0,0|2,0,0]=4 12648 B22R3.28886 Nc1cc2ccccc2cc1SCCc3ccccc3 62a_100000765856_100009991566 [0,1,0,1,0,0|1,1,0]=4 12649 B22R3.28886 Nc1cc2ccccc2cc1SCCc3ccccc3 62a_100009991566_100011218657 [0,1,0,1,0,0|1,1,0]=4 12650 B22R3.28886 O=c1oc2ccccc2cc1OCCc3ccccc3 7a_100000061252_100000765856 [0,1,0,1,0,0|2,0,0]=4 12651 B22R3.28886 Oc1cc2ccccc2cc1SCCc3ccccc3 62a_100000765856_100009817189 [0,1,0,1,0,0|1,1,0]=4 12652 B22R3.28886 Oc1cc2ccccc2nc1SCCc3ccccc3 62a_100000765856_200000100762 [0,1,0,1,0,0|1,1,0]=4 12653 B22R3.36412 O=C(Cc1ccccc1)C(=O)N2CCc3c2cccc3 1458a_200011297316_100015291786 [0,1,0,1,0,0|1,0,1]=4 12654 B22R3.36412 O=C(Nc1ccccc1)C(=O)N2CCc3c2cccc3 22a_100000106764_200011297316 [0,1,0,1,0,0|2,0,0]=4 12655 B22R3.36412 O=C(Nc1ccccc1)C(=O)N2CCc3c2cccc3 527a_100000106764_200011297316 [0,1,0,1,0,0|2,0,0]=4 12656 B22R3.81055 O=C(CC(=O)C1CCc2c1cccc2)c3ccccc3 1458a_100000750891_100000211460 [0,1,0,1,0,0|1,0,1]=4 12657 B22R3.81055 O=C(CC(=O)N1CCc2c1cccc2)c3ccccc3 1458a_100000185807_100000183021 [0,1,0,1,0,0|1,0,1]=4 12658 B22R3.673125 Brc1cc(cc2c1cccc2)NCCc3ccccc3 34a_100010089974_100000765856 [0,1,0,1,0,0|2,0,0]=4 12659 B22R3.673125 Brc1cc(cc2c1cccc2)NCCc3ccccc3 7a_100010089974_100000765856 [0,1,0,1,0,0|2,0,0]=4 12660 B22R3.673125 Brc1cc(cc2c1cccc2)OCCc3ccccc3 34a_100010001680_100000765856 [0,1,0,1,0,0|1,0,0]=3 12661 B22R3.673125 Brc1cc(cc2c1cccc2)OCCc3ccccc3 7a_100010001680_100000765856 [0,1,0,1,0,0|1,0,0]=3 12662 B22R3.673125 Brc1cc(cc2c1cccc2)OCCc3ccccn3 7a_100010001680_100015183660 [0,1,0,1,0,0|2,0,0]=4 12663 B22R3.673125 Brc1cc(cc2c1cccc2)OCCc3cccnc3 7a_100010001680_200011713674 [0,1,0,1,0,0|2,0,0]=4 12664 B22R3.673125 Brc1cc(cc2c1cccc2)OCCc3ccncc3 7a_100010001680_100000723409 [0,1,0,1,0,0|2,0,0]=4 12665 B22R3.673125 Brc1cc(cc2c1cncc2)OCCc3ccccc3 34a_100011009069_100000765856 [0,1,0,1,0,0|2,0,0]=4 12666 B22R3.673125 Brc1cc(cc2c1cncc2)OCCc3ccccc3 7a_100011009069_100000765856 [0,1,0,1,0,0|2,0,0]=4 12667 B22R3.673125 Cc1cc(nc2c1cccc2)NCCc3ccccc3 27a_100000106460_100000184993 [0,1,0,1,0,0|2,0,0]=4 12668 B22R3.673125 Cc1cc(nc2c1cccc2)SCCc3ccccc3 62a_100000765856_100000184993 [0,1,0,1,0,0|1,1,0]=4 12669 B22R3.673125 Cc1cc(nc2c1cccc2)SCCc3ccccc3 62a_100012354972_100011218657 [0,1,0,1,0,0|1,1,0]=4 12670 B22R3.673125 Clc1cc(cc2c1nccc2)OCCc3ccccc3 34a_100000097192_100000765856 [0,1,0,1,0,0|2,0,0]=4 12671 B22R3.673125 Clc1cc(cc2c1nccc2)OCCc3ccccc3 7a_100000097192_100000765856 [0,1,0,1,0,0|2,0,0]=4 12672 B22R3.673125 Fc1cc(cc2c1nccc2)OCCc3ccccc3 34a_100009888031_100000765856 [0,1,0,1,0,0|2,0,0]=4 12673 B22R3.673125 Fc1cc(cc2c1nccc2)OCCc3ccccc3 7a_100009888031_100000765856 [0,1,0,1,0,0|2,0,0]=4 12674 B22R3.673125 Nc1cc(cc2c1cccc2)SCCc3ccccc3 62a_100000765856_100010171453 [0,1,0,1,0,0|1,1,0]=4 12675 B22R3.673125 Nc1cc(cc2c1cccc2)SCCc3ccccc3 62a_100010171453_100011218657 [0,1,0,1,0,0|1,1,0]=4 12676 B22R3.673125 Nc1cc(cc2c1nccc2)OCCc3ccccc3 34a_100000083691_100000765856 [0,1,0,1,0,0|2,0,0]=4 12677 B22R3.673125 Nc1cc(nc2c1cccc2)SCCc3ccccc3 62a_100010197925_100011218657 [0,1,0,1,0,0|1,1,0]=4 12678 B22R3.673125 O=c1cc([nH]c2c1cccc2)SCCc3ccccc3 62a_100000765856_100000090176 [0,1,0,1,0,0|1,1,0]=4 12679 B22R3.673125 O=c1cc(nc2n1cccc2)OCCc3ccccc3 34a_100000751361_100000765856 [0,1,0,1,0,0|2,0,0]=4 12680 B22R3.673125 Oc1cc(cc2c1cccc2)SCCc3ccccc3 62a_100000765856_100010089979 [0,1,0,1,0,0|1,1,0]=4 12681 B22R3.5251059 O=C(CC(=O)[C@@H]1C[C@H]1c2ccccc2)c3ccccc3 1458a_100009815801_100000211460 [0,1,0,1,0,0|1,0,1]=4 12682 B22R3.60807 O=Cc1ccc2ccccc2c1SCc3ccccc3 62a_100000211182_100009813496 [0,1,0,1,0,0|2,0,0]=4 12683 B22R3.60807 O=Cc1ccc2ccccc2c1SCc3ccccc3 62a_100009813496_100015291786 [0,1,0,1,0,0|2,0,0]=4 12684 B22R3.60807 O=Nc1ccc2ccccc2c1OCc3ccccc3 34a_100000212301_100015291786 [0,1,0,1,0,0|2,0,0]=4 12685 B22R3.5644443 Brc1c(ccc2c1cccc2)NCCc3ccccc3 34a_100000705303_100000765856 [0,1,0,1,0,0|2,0,0]=4 12686 B22R3.5644443 Brc1c(ccc2c1cccc2)OCCc3ccccc3 34a_100000183829_100000765856 [0,1,0,1,0,0|1,0,0]=3 12687 B22R3.5644443 Brc1c(ccc2c1cccc2)OCCc3ccccc3 7a_100000183829_100000765856 [0,1,0,1,0,0|1,0,0]=3 12688 B22R3.5644443 Brc1c(ccc2c1cccc2)OCCc3ccccn3 7a_100000183829_100015183660 [0,1,0,1,0,0|2,0,0]=4 12689 B22R3.5644443 Brc1c(ccc2c1cccc2)OCCc3cccnc3 7a_100000183829_200011713674 [0,1,0,1,0,0|2,0,0]=4 12690 B22R3.5644443 Brc1c(ccc2c1cccc2)OCCc3ccncc3 7a_100000183829_100000723409 [0,1,0,1,0,0|2,0,0]=4 12691 B22R3.5644443 Brc1c(ccc2c1cccc2)SCCc3ccccc3 62a_100000765856_200010089984 [0,1,0,1,0,0|1,1,0]=4 12692 B22R3.5644443 Brc1c(ccc2c1cccc2)SCCc3ccccc3 62a_200010089984_100011218657 [0,1,0,1,0,0|1,1,0]=4 12693 B22R3.5644443 Brc1c(ccc2c1cncc2)OCCc3ccccc3 34a_200010115057_100000765856 [0,1,0,1,0,0|2,0,0]=4 12694 B22R3.5644443 Brc1c(ccc2c1cncc2)OCCc3ccccc3 7a_200010115057_100000765856 [0,1,0,1,0,0|2,0,0]=4 12695 B22R3.5644443 Brc1c(ccc2c1nccc2)OCCc3ccccc3 34a_100010173343_100000765856 [0,1,0,1,0,0|2,0,0]=4 12696 B22R3.5644443 Brc1c(ccc2c1nccc2)OCCc3ccccc3 7a_100010173343_100000765856 [0,1,0,1,0,0|2,0,0]=4 12697 B22R3.5644443 Cc1c(ccc2c1cccc2)OCCc3ccccc3 34a_100009830054_100000765856 [0,1,0,1,0,0|1,0,0]=3 12698 B22R3.5644443 Cc1c(ccc2c1cccc2)OCCc3ccccc3 7a_100009830054_100000765856 [0,1,0,1,0,0|1,0,0]=3 12699 B22R3.5644443 Cc1c(ccc2c1cccc2)OCCc3ccccn3 7a_100009830054_100015183660 [0,1,0,1,0,0|2,0,0]=4 12700 B22R3.5644443 Cc1c(ccc2c1cccc2)OCCc3cccnc3 7a_100009830054_200011713674 [0,1,0,1,0,0|2,0,0]=4 12701 B22R3.5644443 Cc1c(ccc2c1cccc2)OCCc3ccncc3 7a_100009830054_100000723409 [0,1,0,1,0,0|2,0,0]=4 12702 B22R3.5644443 Cc1c(ccc2c1cccc2)SCCc3ccccc3 62a_100000765856_100010221197 [0,1,0,1,0,0|1,1,0]=4 12703 B22R3.5644443 Cc1c(ccc2c1cccc2)SCCc3ccccc3 62a_100010221197_100011218657 [0,1,0,1,0,0|1,1,0]=4 12704 B22R3.5644443 Clc1c(ccc2c1cccc2)NCCc3ccccc3 34a_100000075557_100000765856 [0,1,0,1,0,0|2,0,0]=4 12705 B22R3.5644443 Clc1c(ccc2c1cccc2)OCCc3ccccc3 34a_100000029778_100000765856 [0,1,0,1,0,0|1,0,0]=3 12706 B22R3.5644443 Clc1c(ccc2c1cccc2)OCCc3ccccc3 7a_100000029778_100000765856 [0,1,0,1,0,0|1,0,0]=3 12707 B22R3.5644443 Clc1c(ccc2c1cccc2)OCCc3ccccn3 7a_100000029778_100015183660 [0,1,0,1,0,0|2,0,0]=4 12708 B22R3.5644443 Clc1c(ccc2c1cccc2)OCCc3cccnc3 7a_100000029778_200011713674 [0,1,0,1,0,0|2,0,0]=4 12709 B22R3.5644443 Clc1c(ccc2c1cccc2)OCCc3ccncc3 7a_100000029778_100000723409 [0,1,0,1,0,0|2,0,0]=4 12710 B22R3.5644443 Clc1c(ccc2c1ccnc2)OCCc3ccccc3 34a_100009824633_100000765856 [0,1,0,1,0,0|2,0,0]=4 12711 B22R3.5644443 Clc1c(ccc2c1ccnc2)OCCc3ccccc3 7a_100009824633_100000765856 [0,1,0,1,0,0|2,0,0]=4 12712 B22R3.5644443 Fc1c(ccc2c1cccc2)SCCc3ccccc3 62a_100000765856_100009832041 [0,1,0,1,0,0|1,1,0]=4 12713 B22R3.5644443 Fc1c(ccc2c1cccc2)SCCc3ccccc3 62a_100009832041_100011218657 [0,1,0,1,0,0|1,1,0]=4 12714 B22R3.5644443 Ic1c(ccc2c1cccc2)OCCc3ccccc3 34a_100000041551_100000765856 [0,1,0,1,0,0|1,0,0]=3 12715 B22R3.5644443 Ic1c(ccc2c1cccc2)OCCc3ccccc3 7a_100000041551_100000765856 [0,1,0,1,0,0|1,0,0]=3 12716 B22R3.5644443 Ic1c(ccc2c1cccc2)OCCc3ccccn3 7a_100000041551_100015183660 [0,1,0,1,0,0|2,0,0]=4 12717 B22R3.5644443 Ic1c(ccc2c1cccc2)OCCc3cccnc3 7a_100000041551_200011713674 [0,1,0,1,0,0|2,0,0]=4 12718 B22R3.5644443 Ic1c(ccc2c1cccc2)OCCc3ccncc3 7a_100000041551_100000723409 [0,1,0,1,0,0|2,0,0]=4 12719 B22R3.5644443 Nc1c(ccc2c1cccc2)OCCc3ccccc3 34a_100000007056_100000765856 [0,1,0,1,0,0|1,0,0]=3 12720 B22R3.5644443 Nc1c(ccc2c1cccc2)OCCc3ccccc3 7a_100000007056_100000765856 [0,1,0,1,0,0|1,0,0]=3 12721 B22R3.5644443 Nc1c(ccc2c1cccc2)OCCc3ccccn3 7a_100000007056_100015183660 [0,1,0,1,0,0|2,0,0]=4 12722 B22R3.5644443 Nc1c(ccc2c1cccc2)OCCc3cccnc3 7a_100000007056_200011713674 [0,1,0,1,0,0|2,0,0]=4 12723 B22R3.5644443 Nc1c(ccc2c1cccc2)OCCc3ccncc3 7a_100000007056_100000723409 [0,1,0,1,0,0|2,0,0]=4 12724 B22R3.5644443 Nc1c(ccc2c1cccc2)SCCc3ccccc3 62a_100009817101_100011218657 [0,1,0,1,0,0|1,1,0]=4 12725 B22R3.5644443 O=c1c(c[nH]c2c1cccc2)SCCc3ccccc3 62a_100000765856_100012348052 [0,1,0,1,0,0|1,1,0]=4 12726 B22R3.5644443 O=c1c(coc2c1cccc2)SCCc3ccccc3 62a_100000765856_100009813851 [0,1,0,1,0,0|1,1,0]=4 12727 B22R3.5644443 Oc1c(ccc2c1cccc2)NCCc3ccccc3 34a_100000007060_100000765856 [0,1,0,1,0,0|1,0,1]=4 12728 B22R3.5644443 Oc1c(ccc2c1cccc2)SCCc3ccccc3 62a_100000765856_100009996032 [0,1,0,1,0,0|0,1,1]=4 12729 B22R4.1440994 c1ccc2c(c1)CC2Nc3ccc4ccccc4c3 7a_100000211940_100009813401 [0,0,0,2,0,0|2,0,0]=4 12730 B22R4.1440994 c1ccc2c(c1)CC2Oc3ccc4ccccc4c3 7a_100000185828_100009813401 [0,0,0,2,0,0|1,0,0]=3 12731 B22R4.1440994 c1ccc2c(c1)CC2Oc3ccc4ccncc4c3 7a_100000752006_100009813401 [0,0,0,2,0,0|2,0,0]=4 12732 B22R4.1440994 c1ccc2c(c1)CC2Oc3ccc4cnccc4c3 7a_100000046372_100009813401 [0,0,0,2,0,0|2,0,0]=4 12733 B22R4.1440994 c1ccc2c(c1)CC2Oc3ccc4ncccc4c3 7a_100011215586_100009813401 [0,0,0,2,0,0|2,0,0]=4 12734 B22R4.1440994 c1ccc2c(c1)CC2Oc3cnc4ccccc4c3 7a_100011934006_100009813401 [0,0,0,2,0,0|2,0,0]=4 12735 B22R4.1440994 c1ccc2c(c1)CC2Sc3ccc4ccccc4c3 62a_100009813401_100000233703 [0,0,0,2,0,0|1,1,0]=4 12736 B22R4.1440994 c1ccc2c(c1)CC2Sc3ccc4ccccc4n3 62a_100009813401_100011291633 [0,0,0,2,0,0|1,1,0]=4 12737 B22R4.1440994 c1ccc2c(c1)CC2Sc3ccc4ccccc4n3 62a_100011291633_100009813401 [0,0,0,2,0,0|1,1,0]=4 12738 B18R1.42737 C=CC=CC(=O)CC(=O)OCCc1ccccc1 1458a_100016291481_200000077782 [0,0,1,0,1,0|1,0,1]=4 12739 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 2230a_100015324214_100016265936 [1,0,0,0,1,0|1,0,1]=4 12740 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 2230a_100020603302_100015291786 [1,0,0,0,1,0|1,0,1]=4 12741 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 270004a_100020603302_100015611070 [1,0,0,0,1,0|1,0,1]=4 12742 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 34a_100015324214_100016265936 [1,0,0,0,1,0|1,0,1]=4 12743 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 34a_100020603302_100015291786 [1,0,0,0,1,0|1,0,1]=4 12744 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 34a_100000210256_100015291786 [1,0,0,0,1,0|0,0,1]=3 12745 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 34a_100000210790_100016265936 [1,0,0,0,1,0|0,0,1]=3 12746 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 7a_100000210790_100016265936 [1,0,0,0,1,0|0,0,1]=3 12747 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccn2 34a_100000210256_100000721315 [1,0,0,0,1,0|1,0,1]=4 12748 B18R2.2525 C(=C/c1ccccc1)\COCc2cccnc2 34a_100000210256_100000733263 [1,0,0,0,1,0|1,0,1]=4 12749 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccc2 62a_100000211182_100016265936 [1,0,0,0,1,0|0,1,1]=4 12750 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccc2 62a_100016265936_100015291786 [1,0,0,0,1,0|0,1,1]=4 12751 B18R2.2525 C(=C/c1cccnc1)\COCc2ccccc2 34a_200102594124_100015291786 [1,0,0,0,1,0|1,0,1]=4 12752 B18R2.2525 C(=Cc1ccccc1)C=NNc2ccccc2 4a_100015195140_100000210105 [1,0,0,0,1,0|2,0,0]=4 12753 B18R2.2525 C(=Cc1ccccc1)CNCc2ccccc2 270004a_100015324214_100000210105 [1,0,0,0,1,0|1,0,1]=4 12754 B18R2.2525 C(=Cc1ccccc1)COCc2ccccc2 271570a_200011106559_100000210277 [1,0,0,0,1,0|0,0,1]=3 12755 B18R2.2525 C(=Cc1ccccn1)COCc2ccccc2 271570a_200011106559_100011216584 [1,0,0,0,1,0|1,0,1]=4 12756 B18R2.2525 C(=Cc1cccnc1)COCc2ccccc2 271570a_200011106559_100000752921 [1,0,0,0,1,0|1,0,1]=4 12757 B18R2.2525 C(=Cc1ccncc1)COCc2ccccc2 271570a_200011106559_100000035832 [1,0,0,0,1,0|1,0,1]=4 12758 B18R2.2525 C(=NNCCc1ccccc1)c2ccccc2 4a_100000740470_100015611070 [1,0,0,0,1,0|2,0,0]=4 12759 B18R2.2525 C(=NNc1ccccc1)CCc2ccccc2 4a_100015195140_100000198083 [1,0,0,0,1,0|2,0,0]=4 12760 B18R2.2525 c1ccc(cc1)CCOCCc2ccccc2 34a_100000210268_100000765856 [1,0,0,0,1,0|0,0,2]=4 12761 B18R2.2525 c1ccc(cc1)CCOCCc2ccccc2 7a_100000210268_100000765856 [1,0,0,0,1,0|0,0,2]=4 12762 B18R2.2526 C(=C/c1ccccc1)\COCCc2cccs2 34a_100000210256_100000748579 [1,0,0,0,1,0|1,0,1]=4 12763 B18R2.2526 C(=C/c1ccccc1)\COCCc2cccs2 34a_100011216825_100016265936 [1,0,0,0,1,0|1,0,1]=4 12764 B18R2.2526 C(=C/c1ccccc1)\COCCc2cccs2 7a_100011216825_100016265936 [1,0,0,0,1,0|1,0,1]=4 12765 B18R2.2526 C(=C/c1ccccc1)\COCCc2ccsc2 34a_100000748821_100016265936 [1,0,0,0,1,0|1,0,1]=4 12766 B18R2.2526 C(=C/c1ccccc1)\COCCn2cccc2 34a_100000179382_100016265936 [1,0,0,0,1,0|1,0,1]=4 12767 B18R2.2429 O=C(CCc1ccccc1)C[n+]2ccccc2 1458a_200000086051_100000765856 [0,0,0,0,2,0|1,0,1]=4 12768 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccc2 1458a_100000185753_100015291786 [0,0,0,0,2,0|0,0,1]=3 12769 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccn2 1458a_100000185753_100000721315 [0,0,0,0,2,0|1,0,1]=4 12770 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccn2 1458a_100000233486_100000765856 [0,0,0,0,2,0|1,0,1]=4 12771 B18R2.2429 O=C(CCc1ccccc1)Cc2cccnc2 1458a_100000185753_100000733263 [0,0,0,0,2,0|1,0,1]=4 12772 B18R2.2429 O=C(CCc1ccccc1)Cc2cccnc2 1458a_100000737805_100000765856 [0,0,0,0,2,0|1,0,1]=4 12773 B18R2.2429 O=C(CCc1ccccc1)Cc2ccncc2 1458a_100000185753_100000705612 [0,0,0,0,2,0|1,0,1]=4 12774 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 11a_100000106764_100000185753 [0,0,0,0,2,0|1,0,0]=3 12775 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 1626a_100000106764_100000185753 [0,0,0,0,2,0|1,0,0]=3 12776 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 22a_100000106764_100000185753 [0,0,0,0,2,0|1,0,0]=3 12777 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 527a_100000106764_100000185753 [0,0,0,0,2,0|1,0,0]=3 12778 B18R2.2429 O=C(CCc1ccccn1)Cc2ccccc2 1458a_100015195070_100015291786 [0,0,0,0,2,0|1,0,1]=4 12779 B18R2.2429 O=C(CCc1ccccn1)Nc2ccccc2 11a_100000106764_100015195070 [0,0,0,0,2,0|2,0,0]=4 12780 B18R2.2429 O=C(CCc1ccccn1)Nc2ccccc2 22a_100000106764_100015195070 [0,0,0,0,2,0|2,0,0]=4 12781 B18R2.2429 O=C(CCc1ccccn1)Nc2ccccc2 527a_100000106764_100015195070 [0,0,0,0,2,0|2,0,0]=4 12782 B18R2.2429 O=C(CCc1cccnc1)Cc2ccccc2 1458a_100000198484_100015291786 [0,0,0,0,2,0|1,0,1]=4 12783 B18R2.2429 O=C(CCc1cccnc1)Nc2ccccc2 11a_100000106764_100000198484 [0,0,0,0,2,0|2,0,0]=4 12784 B18R2.2429 O=C(CCc1cccnc1)Nc2ccccc2 1626a_100000106764_100000198484 [0,0,0,0,2,0|2,0,0]=4 12785 B18R2.2429 O=C(CCc1cccnc1)Nc2ccccc2 22a_100000106764_100000198484 [0,0,0,0,2,0|2,0,0]=4 12786 B18R2.2429 O=C(CCc1cccnc1)Nc2ccccc2 527a_100000106764_100000198484 [0,0,0,0,2,0|2,0,0]=4 12787 B18R2.2429 O=C(CCc1ccncc1)Cc2ccccc2 1458a_100011225043_100015291786 [0,0,0,0,2,0|1,0,1]=4 12788 B18R2.2429 O=C(CCc1ccncc1)Nc2ccccc2 11a_100000106764_100011225043 [0,0,0,0,2,0|2,0,0]=4 12789 B18R2.2429 O=C(CCc1ccncc1)Nc2ccccc2 22a_100000106764_100011225043 [0,0,0,0,2,0|2,0,0]=4 12790 B18R2.2429 O=C(CCc1ccncc1)Nc2ccccc2 527a_100000106764_100011225043 [0,0,0,0,2,0|2,0,0]=4 12791 B18R2.2429 O=C(CNc1ccccc1)Nc2ccccc2 34a_100000106764_100000182850 [0,0,0,0,2,0|2,0,0]=4 12792 B18R2.2429 O=C(CNc1ccccc1)Oc2ccccc2 34a_100000106764_100009813826 [0,0,0,0,2,0|2,0,0]=4 12793 B18R2.2429 O=C(COc1ccccc1)Cc2ccccc2 1458a_100000186222_100015291786 [0,0,0,0,2,0|1,0,1]=4 12794 B18R2.2429 O=C(COc1ccccc1)Cc2ccccc2 7a_100000210340_100000233483 [0,0,0,0,2,0|1,0,1]=4 12795 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 11a_100000106764_100000186222 [0,0,0,0,2,0|2,0,0]=4 12796 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 1626a_100000106764_100000186222 [0,0,0,0,2,0|2,0,0]=4 12797 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 22a_100000106764_100000186222 [0,0,0,0,2,0|2,0,0]=4 12798 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 34a_100000210340_100000182850 [0,0,0,0,2,0|2,0,0]=4 12799 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 527a_100000106764_100000186222 [0,0,0,0,2,0|2,0,0]=4 12800 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 7a_100000210340_100000182850 [0,0,0,0,2,0|2,0,0]=4 12801 B18R2.2429 O=C(COc1ccccc1)Oc2ccccc2 34a_100000210340_100009813826 [0,0,0,0,2,0|2,0,0]=4 12802 B18R2.2429 O=C(COc1ccccc1)Oc2ccccc2 7a_100000210340_100009813826 [0,0,0,0,2,0|2,0,0]=4 12803 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 1458a_100000211596_100015291786 [0,0,0,0,2,0|1,0,1]=4 12804 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 62a_100000233483_100000041952 [0,0,0,0,2,0|1,0,1]=4 12805 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 62a_100000719477_100000233483 [0,0,0,0,2,0|1,0,1]=4 12806 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 11a_100000106764_100000211596 [0,0,0,0,2,0|2,0,0]=4 12807 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 1626a_100000106764_100000211596 [0,0,0,0,2,0|2,0,0]=4 12808 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 22a_100000106764_100000211596 [0,0,0,0,2,0|2,0,0]=4 12809 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 527a_100000106764_100000211596 [0,0,0,0,2,0|2,0,0]=4 12810 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 62a_100000719477_100000182850 [0,0,0,0,2,0|2,0,0]=4 12811 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 62a_100012148978_100000041952 [0,0,0,0,2,0|2,0,0]=4 12812 B18R2.2429 O=C(CSc1ccccc1)Oc2ccccc2 62a_100000719477_100009813826 [0,0,0,0,2,0|2,0,0]=4 12813 B18R2.2429 O=C(CSc1ccccc1)Oc2ccccc2 62a_100009813826_100000041952 [0,0,0,0,2,0|2,0,0]=4 12814 B18R2.2429 O=C(NCc1ccccc1)Nc2ccccc2 2430a_100000106764_100015324214 [0,0,0,0,2,0|2,0,0]=4 12815 B18R2.7189 CC(OCCc1ccccc1)c2ccccc2 34a_100000210268_100000211855 [0,0,0,0,2,0|1,0,1]=4 12816 B18R2.7189 CC(OCCc1ccccc1)c2ccccc2 7a_100000210268_100000230085 [0,0,0,0,2,0|1,0,1]=4 12817 B18R2.7189 C[C@@H](OCCc1ccccc1)c2ccccc2 34a_100000761318_100000765856 [0,0,0,0,2,0|1,0,1]=4 12818 B18R2.7189 C[C@@H](OCCc1ccccc1)c2ccccc2 7a_100000761318_100000765856 [0,0,0,0,2,0|1,0,1]=4 12819 B18R2.7189 O=C(CCCc1ccccc1)c2ccccc2 1458a_100000185807_100000211621 [0,0,0,0,2,0|1,0,0]=3 12820 B18R2.7189 O=C(CCOc1ccccc1)c2ccccc2 1458a_100000185807_100000184471 [0,0,0,0,2,0|2,0,0]=4 12821 B18R2.7189 O=C(CCOc1ccccc1)c2ccccc2 7a_100000210340_100000750707 [0,0,0,0,2,0|2,0,0]=4 12822 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 1458a_100000185807_100000246102 [0,0,0,0,2,0|2,0,0]=4 12823 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 62a_100000719477_100000750707 [0,0,0,0,2,0|2,0,0]=4 12824 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 62a_100000750707_100000041952 [0,0,0,0,2,0|2,0,0]=4 12825 B18R2.7189 O=C(COCc1ccccc1)c2ccccc2 7a_100000210790_100000211460 [0,0,0,0,2,0|2,0,0]=4 12826 B18R2.7189 O=C(CSCc1ccccc1)c2ccccc2 1458a_100000185807_200011217039 [0,0,0,0,2,0|2,0,0]=4 12827 B18R2.7189 O=C(CSCc1ccccc1)c2ccccc2 62a_100000211182_100000211460 [0,0,0,0,2,0|2,0,0]=4 12828 B18R2.7189 O=C(CSCc1ccccc1)c2ccccc2 62a_100000211460_100015291786 [0,0,0,0,2,0|2,0,0]=4 12829 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 11a_100000106460_100000185807 [0,0,0,0,2,0|1,0,0]=3 12830 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 1626a_100000106460_100000185807 [0,0,0,0,2,0|1,0,0]=3 12831 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 240690a_100000106460_100000185807 [0,0,0,0,2,0|1,0,0]=3 12832 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 527a_100000106460_100000185807 [0,0,0,0,2,0|1,0,0]=3 12833 B18R2.7189 O=C(NCCc1ccccn1)c2ccccc2 11a_100000211156_100000185807 [0,0,0,0,2,0|2,0,0]=4 12834 B18R2.7189 O=C(NCCc1ccccn1)c2ccccc2 1626a_100000211156_100000185807 [0,0,0,0,2,0|2,0,0]=4 12835 B18R2.7189 O=C(NCCc1ccccn1)c2ccccc2 240690a_100000211156_100000185807 [0,0,0,0,2,0|2,0,0]=4 12836 B18R2.7189 O=C(NCCc1ccccn1)c2ccccc2 527a_100000211156_100000185807 [0,0,0,0,2,0|2,0,0]=4 12837 B18R2.7189 O=C(NCCc1cccnc1)c2ccccc2 11a_100000736294_100000185807 [0,0,0,0,2,0|2,0,0]=4 12838 B18R2.7189 O=C(NCCc1cccnc1)c2ccccc2 1626a_100000736294_100000185807 [0,0,0,0,2,0|2,0,0]=4 12839 B18R2.7189 O=C(NCCc1cccnc1)c2ccccc2 240690a_100000736294_100000185807 [0,0,0,0,2,0|2,0,0]=4 12840 B18R2.7189 O=C(NCCc1cccnc1)c2ccccc2 527a_100000736294_100000185807 [0,0,0,0,2,0|2,0,0]=4 12841 B18R2.7189 O=C(NCCc1ccncc1)c2ccccc2 11a_100000742849_100000185807 [0,0,0,0,2,0|2,0,0]=4 12842 B18R2.7189 O=C(NCCc1ccncc1)c2ccccc2 1626a_100000742849_100000185807 [0,0,0,0,2,0|2,0,0]=4 12843 B18R2.7189 O=C(NCCc1ccncc1)c2ccccc2 240690a_100000742849_100000185807 [0,0,0,0,2,0|2,0,0]=4 12844 B18R2.7189 O=C(NCCc1ccncc1)c2ccccc2 527a_100000742849_100000185807 [0,0,0,0,2,0|2,0,0]=4 12845 B18R2.7189 O=C(NNCc1ccccc1)c2ccccc2 22a_100000007032_100000185807 [0,0,0,0,2,0|2,0,0]=4 12846 B18R2.7189 O=C(OCOc1ccccc1)c2ccccc2 7a_100000210340_100000073877 [0,0,0,0,2,0|1,0,0]=3 12847 B18R2.7189 O=C(OCOc1cccnc1)c2ccccc2 7a_100000210849_100000073877 [0,0,0,0,2,0|2,0,0]=4 12848 B18R2.7189 O=C(OCSc1ccccc1)c2ccccc2 62a_100000073877_100000041952 [0,0,0,0,2,0|1,0,0]=3 12849 B18R2.7189 O=C(OCSc1ccccc1)c2ccccc2 62a_100000719477_100000073877 [0,0,0,0,2,0|1,0,0]=3 12850 B18R2.7189 O=C(OCSc1ccccn1)c2ccccc2 62a_100000073877_100011216584 [0,0,0,0,2,0|2,0,0]=4 12851 B18R2.7189 O=C(OCSc1ccccn1)c2ccccc2 62a_100011216584_100000073877 [0,0,0,0,2,0|2,0,0]=4 12852 B18R2.7189 O=C(OCSc1cccnc1)c2ccccc2 62a_100000073877_100000210063 [0,0,0,0,2,0|2,0,0]=4 12853 B18R2.7189 O=C(OCSc1cccnc1)c2ccccc2 62a_100000210063_100000073877 [0,0,0,0,2,0|2,0,0]=4 12854 B18R2.7189 O=C(OCSc1ccncc1)c2ccccc2 62a_100000073877_100000728582 [0,0,0,0,2,0|2,0,0]=4 12855 B18R2.7189 O=C(OCSc1ccncc1)c2ccccc2 62a_100000728582_100000073877 [0,0,0,0,2,0|2,0,0]=4 12856 B18R2.11744 O=C(C=Cc1c[nH]cn1)CCc2ccccc2 1458a_100102678534_100000765856 [0,0,0,0,2,0|2,0,0]=4 12857 B18R2.11744 O=C(C=Cc1ccccc1)CCc2c[nH]cn2 1458a_100000210462_100020628418 [0,0,0,0,2,0|2,0,0]=4 12858 B18R2.11744 O=C(C=Cc1ccccc1)CCc2cccs2 1458a_100000210462_100000748579 [0,0,0,0,2,0|1,0,0]=3 12859 B18R2.11744 O=C(C=Cc1ccccc1)CCc2cn[nH]c2 1458a_100000210462_100000743252 [0,0,0,0,2,0|2,0,0]=4 12860 B18R2.11744 O=C(C=Cc1ccccc1)CCn2cccc2 1458a_100000210462_200000035178 [0,0,0,0,2,0|1,0,0]=3 12861 B18R2.11744 O=C(C=Cc1ccccc1)CCn2cccn2 1458a_100000210462_100000685285 [0,0,0,0,2,0|2,0,0]=4 12862 B18R2.11744 O=C(C=Cc1ccccc1)CCn2ccnc2 1458a_100000210462_100000702546 [0,0,0,0,2,0|2,0,0]=4 12863 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccc[nH]2 11a_100000764082_100000210462 [0,0,0,0,2,0|2,0,0]=4 12864 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccco2 11a_100000185738_100000210462 [0,0,0,0,2,0|2,0,0]=4 12865 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccco2 1626a_100000185738_100000210462 [0,0,0,0,2,0|2,0,0]=4 12866 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cccs2 11a_100000211653_100000210462 [0,0,0,0,2,0|2,0,0]=4 12867 B18R2.11744 O=C(C=Cc1ccccc1)NCc2cccs2 1626a_100000211653_100000210462 [0,0,0,0,2,0|2,0,0]=4 12868 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccoc2 11a_100015206860_100000210462 [0,0,0,0,2,0|2,0,0]=4 12869 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccoc2 1626a_100015206860_100000210462 [0,0,0,0,2,0|2,0,0]=4 12870 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccsc2 11a_100000186416_100000210462 [0,0,0,0,2,0|2,0,0]=4 12871 B18R2.11744 O=C(C=Cc1ccccc1)NCc2ccsc2 1626a_100000186416_100000210462 [0,0,0,0,2,0|2,0,0]=4 12872 B18R2.11744 O=C(C=Cc1ccccn1)CCc2cccs2 1458a_100000740811_100000748579 [0,0,0,0,2,0|2,0,0]=4 12873 B18R2.11744 O=C(C=Cc1ccccn1)CCn2cccc2 1458a_100000740811_200000035178 [0,0,0,0,2,0|2,0,0]=4 12874 B18R2.11744 O=C(C=Cc1cccnc1)CCc2cccs2 1458a_100000735890_100000748579 [0,0,0,0,2,0|2,0,0]=4 12875 B18R2.11744 O=C(C=Cc1cccnc1)CCn2cccc2 1458a_100000735890_200000035178 [0,0,0,0,2,0|2,0,0]=4 12876 B18R2.11744 O=C(C=Cc1cccs1)CCc2ccccc2 1458a_100000182767_100000765856 [0,0,0,0,2,0|1,0,0]=3 12877 B18R2.11744 O=C(C=Cc1cccs1)CCc2ccccn2 1458a_100000182767_100015183660 [0,0,0,0,2,0|2,0,0]=4 12878 B18R2.11744 O=C(C=Cc1cccs1)CCc2cccnc2 1458a_100000182767_200011713674 [0,0,0,0,2,0|2,0,0]=4 12879 B18R2.11744 O=C(C=Cc1cccs1)CCc2ccncc2 1458a_100000182767_100000723409 [0,0,0,0,2,0|2,0,0]=4 12880 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccc2 11a_100015324214_100000182767 [0,0,0,0,2,0|2,0,0]=4 12881 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccc2 1626a_100015324214_100000182767 [0,0,0,0,2,0|2,0,0]=4 12882 B18R2.11744 O=C(C=Cc1cccs1)NCc2ccccc2 240690a_100015324214_100000182767 [0,0,0,0,2,0|2,0,0]=4 12883 B18R2.11744 O=C(C=Cc1ccncc1)CCc2cccs2 1458a_100000682801_100000748579 [0,0,0,0,2,0|2,0,0]=4 12884 B18R2.11744 O=C(C=Cc1ccncc1)CCn2cccc2 1458a_100000682801_200000035178 [0,0,0,0,2,0|2,0,0]=4 12885 B18R2.11744 O=C(C=Cc1ccoc1)CCc2ccccc2 1458a_100000238621_100000765856 [0,0,0,0,2,0|1,0,0]=3 12886 B18R2.11744 O=C(C=Cc1ccoc1)CCc2ccccn2 1458a_100000238621_100015183660 [0,0,0,0,2,0|2,0,0]=4 12887 B18R2.11744 O=C(C=Cc1ccoc1)CCc2cccnc2 1458a_100000238621_200011713674 [0,0,0,0,2,0|2,0,0]=4 12888 B18R2.11744 O=C(C=Cc1ccoc1)CCc2ccncc2 1458a_100000238621_100000723409 [0,0,0,0,2,0|2,0,0]=4 12889 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccc2 11a_100015324214_100000238621 [0,0,0,0,2,0|2,0,0]=4 12890 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccc2 1626a_100015324214_100000238621 [0,0,0,0,2,0|2,0,0]=4 12891 B18R2.11744 O=C(C=Cc1ccoc1)NCc2ccccc2 240690a_100015324214_100000238621 [0,0,0,0,2,0|2,0,0]=4 12892 B18R2.11744 O=C(C=Cc1ccsc1)CCc2ccccc2 1458a_100000698588_100000765856 [0,0,0,0,2,0|1,0,0]=3 12893 B18R2.11744 O=C(C=Cc1ccsc1)CCc2ccccn2 1458a_100000698588_100015183660 [0,0,0,0,2,0|2,0,0]=4 12894 B18R2.11744 O=C(C=Cc1ccsc1)CCc2cccnc2 1458a_100000698588_200011713674 [0,0,0,0,2,0|2,0,0]=4 12895 B18R2.11744 O=C(C=Cc1ccsc1)CCc2ccncc2 1458a_100000698588_100000723409 [0,0,0,0,2,0|2,0,0]=4 12896 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccc2 11a_100015324214_100000698588 [0,0,0,0,2,0|2,0,0]=4 12897 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccc2 1626a_100015324214_100000698588 [0,0,0,0,2,0|2,0,0]=4 12898 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccc2 240690a_100015324214_100000698588 [0,0,0,0,2,0|2,0,0]=4 12899 B18R2.11744 O=C(C=Cc1ccsc1)NCc2ccccc2 527a_100015324214_100000698588 [0,0,0,0,2,0|2,0,0]=4 12900 B18R2.11744 O=C(C=Cc1cscn1)CCc2ccccc2 1458a_200000747928_100000765856 [0,0,0,0,2,0|2,0,0]=4 12901 B18R2.11744 O=C(C=Cc1nccs1)CCc2ccccc2 1458a_100102558208_100000765856 [0,0,0,0,2,0|2,0,0]=4 12902 B18R2.11744 O=C(C=Cc1nccs1)CCc2ccccc2 6a_100000750902_100000210092 [0,0,0,0,2,0|2,0,0]=4 12903 B20R2.2703 C(#Cc1ccccc1)COC/C=C/c2ccccc2 34a_100000210256_100011352542 [1,0,0,0,0,1|0,0,2]=4 12904 B20R2.2703 C(#Cc1ccccc1)COC/C=C/c2ccccc2 34a_100011217464_100016265936 [1,0,0,0,0,1|0,0,2]=4 12905 B20R2.2703 C(#Cc1ccccc1)COC/C=C/c2ccccc2 7a_100011217464_100016265936 [1,0,0,0,0,1|0,0,2]=4 12906 B20R2.2703 C(=C/c1ccccc1)\CNCCCc2ccccc2 2230a_100000211184_100016265936 [1,0,0,0,0,1|1,0,1]=4 12907 B20R2.2703 C(=C/c1ccccc1)\CNCCCc2ccccc2 2230a_100020603302_100000211621 [1,0,0,0,0,1|1,0,1]=4 12908 B20R2.2703 C(=C/c1ccccc1)\CNCCCc2ccccc2 34a_100000211184_100016265936 [1,0,0,0,0,1|1,0,1]=4 12909 B20R2.2703 C(=C/c1ccccc1)\CNCCCc2ccccc2 34a_100020603302_100000211621 [1,0,0,0,0,1|1,0,1]=4 12910 B20R2.2703 C(=C/c1ccccc1)\CNCCOc2ccccc2 2230a_100000174943_100016265936 [1,0,0,0,0,1|1,0,1]=4 12911 B20R2.2703 C(=C/c1ccccc1)\CNCCOc2ccccc2 2230a_100020603302_100000184471 [1,0,0,0,0,1|1,0,1]=4 12912 B20R2.2703 C(=C/c1ccccc1)\CNCCOc2ccccc2 270004a_100020603302_100000758736 [1,0,0,0,0,1|1,0,1]=4 12913 B20R2.2703 C(=C/c1ccccc1)\CNCCOc2ccccc2 34a_100000174943_100016265936 [1,0,0,0,0,1|1,0,1]=4 12914 B20R2.2703 C(=C/c1ccccc1)\CNCCOc2ccccc2 34a_100020603302_100000184471 [1,0,0,0,0,1|1,0,1]=4 12915 B20R2.2703 C(=C/c1ccccc1)\CNCCSc2ccccc2 2230a_100000189519_100016265936 [1,0,0,0,0,1|1,0,1]=4 12916 B20R2.2703 C(=C/c1ccccc1)\CNCCSc2ccccc2 2230a_100020603302_100000246102 [1,0,0,0,0,1|1,0,1]=4 12917 B20R2.2703 C(=C/c1ccccc1)\CNCCSc2ccccc2 34a_100020603302_100000246102 [1,0,0,0,0,1|1,0,1]=4 12918 B20R2.2703 C(=C/c1ccccc1)\CNCOCc2ccccc2 2230a_100020603302_100000763385 [1,0,0,0,0,1|1,0,1]=4 12919 B20R2.2703 C(=C/c1ccccc1)\CNCOCc2ccccc2 34a_100020603302_100000763385 [1,0,0,0,0,1|1,0,1]=4 12920 B20R2.2703 C(=C/c1ccccc1)\CNCSCc2ccccc2 2230a_100020603302_200011217039 [1,0,0,0,0,1|1,0,1]=4 12921 B20R2.2703 C(=C/c1ccccc1)\CNCSCc2ccccc2 34a_100020603302_200011217039 [1,0,0,0,0,1|1,0,1]=4 12922 B20R2.2703 C(=C/c1ccccc1)\COC/C=C/c2ccccc2 34a_100000210256_100016265936 [1,0,0,0,0,1|0,0,2]=4 12923 B20R2.2703 C(=C/c1ccccc1)\COCCCc2ccccc2 34a_100000210256_100000211621 [1,0,0,0,0,1|0,0,1]=3 12924 B20R2.2703 C(=C/c1ccccc1)\COCCCc2ccccc2 34a_100000210828_100016265936 [1,0,0,0,0,1|0,0,1]=3 12925 B20R2.2703 C(=C/c1ccccc1)\COCCCc2ccccc2 7a_100000210828_100016265936 [1,0,0,0,0,1|0,0,1]=3 12926 B20R2.2703 C(=C/c1ccccc1)\COCCCc2ccccn2 34a_100011215068_100016265936 [1,0,0,0,0,1|1,0,1]=4 12927 B20R2.2703 C(=C/c1ccccc1)\COCCCc2cccnc2 34a_100000211284_100016265936 [1,0,0,0,0,1|1,0,1]=4 12928 B20R2.2703 C(=C/c1ccccc1)\COCCCc2ccncc2 34a_100000210659_100016265936 [1,0,0,0,0,1|1,0,1]=4 12929 B20R2.2703 C(=C/c1ccccc1)\COCCNc2ccccc2 34a_100000211345_100016265936 [1,0,0,0,0,1|0,0,1]=3 12930 B20R2.2703 C(=C/c1ccccc1)\COCCNc2ccncc2 34a_200011243140_100016265936 [1,0,0,0,0,1|1,0,1]=4 12931 B20R2.2703 C(=C/c1ccccc1)\COCCOc2ccccc2 34a_100000210256_100000184471 [1,0,0,0,0,1|0,0,1]=3 12932 B20R2.2703 C(=C/c1ccccc1)\COCCOc2ccccc2 34a_100000210260_100016265936 [1,0,0,0,0,1|0,0,1]=3 12933 B20R2.2703 C(=C/c1ccccc1)\COCCOc2ccccc2 7a_100000210260_100016265936 [1,0,0,0,0,1|0,0,1]=3 12934 B20R2.2703 C(=C/c1ccccc1)\COCCSc2ccccc2 34a_100000210256_100000246102 [1,0,0,0,0,1|0,0,1]=3 12935 B20R2.2703 C(=C/c1ccccc1)\COCCSc2ccccc2 7a_100000230494_100016265936 [1,0,0,0,0,1|0,0,1]=3 12936 B20R2.2703 C(=C/c1ccccc1)\COCCSc2ccccn2 7a_100000156319_100016265936 [1,0,0,0,0,1|1,0,1]=4 12937 B20R2.2703 C(=C/c1ccccc1)\COCOCc2ccccc2 34a_100000210256_100000763385 [1,0,0,0,0,1|0,0,1]=3 12938 B20R2.2703 C(=C/c1ccccc1)\COCSCc2ccccc2 34a_100000210256_200011217039 [1,0,0,0,0,1|0,0,1]=3 12939 B20R2.2703 C(=C/c1ccccc1)\CSCCCc2ccccc2 62a_100000211621_100016265936 [1,0,0,0,0,1|0,1,1]=4 12940 B20R2.2703 C(=C/c1ccccc1)\CSCCCc2ccccc2 62a_100016265936_100000211621 [1,0,0,0,0,1|0,1,1]=4 12941 B20R2.2703 C(=C/c1ccccc1)\CSCCOc2ccccc2 62a_100000184471_100016265936 [1,0,0,0,0,1|0,1,1]=4 12942 B20R2.2703 C(=C/c1ccccc1)\CSCCOc2ccccc2 62a_100016265936_100000184471 [1,0,0,0,0,1|0,1,1]=4 12943 B20R2.2703 C(=C/c1ccccc1)\CSCCSc2ccccc2 62a_100000246102_100016265936 [1,0,0,0,0,1|0,1,1]=4 12944 B20R2.2703 C(=C/c1ccccc1)\CSCCSc2ccccc2 62a_100016265936_100000246102 [1,0,0,0,0,1|0,1,1]=4 12945 B20R2.2703 C(=C/c1ccccc1)\CSCOCc2ccccc2 62a_100000763385_100016265936 [1,0,0,0,0,1|0,1,1]=4 12946 B20R2.2703 C(=C/c1ccccc1)\CSCOCc2ccccc2 62a_100016265936_100000763385 [1,0,0,0,0,1|0,1,1]=4 12947 B20R2.2703 C(=C/c1ccccc1)\CSCSCc2ccccc2 62a_100016265936_200011217039 [1,0,0,0,0,1|0,1,1]=4 12948 B20R2.2703 C(=C/c1ccccc1)\CSCSCc2ccccc2 62a_200011217039_100016265936 [1,0,0,0,0,1|0,1,1]=4 12949 B20R2.2703 C(=C/c1cccnc1)\COCCCc2ccccc2 34a_200102594124_100000211621 [1,0,0,0,0,1|1,0,1]=4 12950 B20R2.2703 C(=C/c1cccnc1)\COCCOc2ccccc2 34a_200102594124_100000184471 [1,0,0,0,0,1|1,0,1]=4 12951 B20R2.2703 C(=C/c1cccnc1)\COCCSc2ccccc2 34a_200102594124_100000246102 [1,0,0,0,0,1|1,0,1]=4 12952 B20R2.2703 C(=C/c1cccnc1)\COCOCc2ccccc2 34a_200102594124_100000763385 [1,0,0,0,0,1|1,0,1]=4 12953 B20R2.2703 C(=C/c1cccnc1)\COCSCc2ccccc2 34a_200102594124_200011217039 [1,0,0,0,0,1|1,0,1]=4 12954 B20R2.2703 C(=Cc1ccccc1)C=NNCCc2ccccc2 4a_100000740470_100000210105 [1,0,0,0,0,1|1,0,0]=3 12955 B20R2.2703 C(=Cc1ccccc1)CNCCCc2ccccc2 270004a_100000211184_100000210105 [1,0,0,0,0,1|1,0,1]=4 12956 B20R2.2703 C(=Cc1ccccc1)CNCCOc2ccccc2 270004a_100000174943_100000210105 [1,0,0,0,0,1|1,0,1]=4 12957 B20R2.2703 C(=Cc1ccccc1)CNCCSc2ccccc2 270004a_100000189519_100000210105 [1,0,0,0,0,1|1,0,1]=4 12958 B20R2.2703 C(=Cc1ccncc1)C=NNCCc2ccccc2 4a_100000740470_100000703957 [1,0,0,0,0,1|2,0,0]=4 12959 B20R2.174710 O=C(C=Cc1ccco1)NNCCc2ccccc2 22a_100000740470_100000720202 [0,0,0,0,1,1|2,0,0]=4 12960 B20R2.174710 O=C(C=Cc1cccs1)CCCCc2ccccc2 1458a_100000182767_100000701786 [0,0,0,0,1,1|2,0,0]=4 12961 B20R2.174710 O=C(C=Cc1cccs1)CCCOc2ccccc2 1458a_100000182767_100000199009 [0,0,0,0,1,1|2,0,0]=4 12962 B20R2.174710 O=C(C=Cc1cccs1)CCCSc2ccccc2 1458a_100000182767_200011203293 [0,0,0,0,1,1|2,0,0]=4 12963 B20R2.174710 O=C(C=Cc1cccs1)CCOCc2ccccc2 1458a_100000182767_100000234347 [0,0,0,0,1,1|2,0,0]=4 12964 B20R2.174710 O=C(C=Cc1cccs1)CCSCc2ccccc2 1458a_100000182767_200011297719 [0,0,0,0,1,1|2,0,0]=4 12965 B20R2.174710 O=C(C=Cc1cccs1)NCCCc2ccccc2 11a_100000211184_100000182767 [0,0,0,0,1,1|2,0,0]=4 12966 B20R2.174710 O=C(C=Cc1cccs1)NCCCc2ccccc2 1626a_100000211184_100000182767 [0,0,0,0,1,1|2,0,0]=4 12967 B20R2.174710 O=C(C=Cc1cccs1)NCCCc2ccccc2 240690a_100000211184_100000182767 [0,0,0,0,1,1|2,0,0]=4 12968 B20R2.174710 O=C(C=Cc1cccs1)NCCOc2ccccc2 11a_100000174943_100000182767 [0,0,0,0,1,1|2,0,0]=4 12969 B20R2.174710 O=C(C=Cc1cccs1)NCCOc2ccccc2 1626a_100000174943_100000182767 [0,0,0,0,1,1|2,0,0]=4 12970 B20R2.174710 O=C(C=Cc1cccs1)NCCOc2ccccc2 240690a_100000174943_100000182767 [0,0,0,0,1,1|2,0,0]=4 12971 B20R2.174710 O=C(C=Cc1cccs1)NCCSc2ccccc2 240690a_100000189519_100000182767 [0,0,0,0,1,1|2,0,0]=4 12972 B20R2.174710 O=C(C=Cc1cccs1)NNCCc2ccccc2 22a_100000740470_100000182767 [0,0,0,0,1,1|2,0,0]=4 12973 B20R2.174710 O=C(C=Cc1ccoc1)CCCCc2ccccc2 1458a_100000238621_100000701786 [0,0,0,0,1,1|2,0,0]=4 12974 B20R2.174710 O=C(C=Cc1ccoc1)CCCOc2ccccc2 1458a_100000238621_100000199009 [0,0,0,0,1,1|2,0,0]=4 12975 B20R2.174710 O=C(C=Cc1ccoc1)CCCSc2ccccc2 1458a_100000238621_200011203293 [0,0,0,0,1,1|2,0,0]=4 12976 B20R2.174710 O=C(C=Cc1ccoc1)CCOCc2ccccc2 1458a_100000238621_100000234347 [0,0,0,0,1,1|2,0,0]=4 12977 B20R2.174710 O=C(C=Cc1ccoc1)CCSCc2ccccc2 1458a_100000238621_200011297719 [0,0,0,0,1,1|2,0,0]=4 12978 B20R2.174710 O=C(C=Cc1ccoc1)NCCCc2ccccc2 11a_100000211184_100000238621 [0,0,0,0,1,1|2,0,0]=4 12979 B20R2.174710 O=C(C=Cc1ccoc1)NCCCc2ccccc2 1626a_100000211184_100000238621 [0,0,0,0,1,1|2,0,0]=4 12980 B20R2.174710 O=C(C=Cc1ccoc1)NCCCc2ccccc2 240690a_100000211184_100000238621 [0,0,0,0,1,1|2,0,0]=4 12981 B20R2.174710 O=C(C=Cc1ccoc1)NCCOc2ccccc2 11a_100000174943_100000238621 [0,0,0,0,1,1|2,0,0]=4 12982 B20R2.174710 O=C(C=Cc1ccoc1)NCCOc2ccccc2 1626a_100000174943_100000238621 [0,0,0,0,1,1|2,0,0]=4 12983 B20R2.174710 O=C(C=Cc1ccoc1)NCCOc2ccccc2 240690a_100000174943_100000238621 [0,0,0,0,1,1|2,0,0]=4 12984 B20R2.174710 O=C(C=Cc1ccoc1)NCCSc2ccccc2 240690a_100000189519_100000238621 [0,0,0,0,1,1|2,0,0]=4 12985 B20R2.174710 O=C(C=Cc1ccoc1)NNCCc2ccccc2 22a_100000740470_100000238621 [0,0,0,0,1,1|2,0,0]=4 12986 B20R2.174710 O=C(C=Cc1ccsc1)CCCCc2ccccc2 1458a_100000698588_100000701786 [0,0,0,0,1,1|2,0,0]=4 12987 B20R2.174710 O=C(C=Cc1ccsc1)CCCOc2ccccc2 1458a_100000698588_100000199009 [0,0,0,0,1,1|2,0,0]=4 12988 B20R2.174710 O=C(C=Cc1ccsc1)CCCSc2ccccc2 1458a_100000698588_200011203293 [0,0,0,0,1,1|2,0,0]=4 12989 B20R2.174710 O=C(C=Cc1ccsc1)CCOCc2ccccc2 1458a_100000698588_100000234347 [0,0,0,0,1,1|2,0,0]=4 12990 B20R2.174710 O=C(C=Cc1ccsc1)CCSCc2ccccc2 1458a_100000698588_200011297719 [0,0,0,0,1,1|2,0,0]=4 12991 B20R2.174710 O=C(C=Cc1ccsc1)NCCCc2ccccc2 11a_100000211184_100000698588 [0,0,0,0,1,1|2,0,0]=4 12992 B20R2.174710 O=C(C=Cc1ccsc1)NCCCc2ccccc2 1626a_100000211184_100000698588 [0,0,0,0,1,1|2,0,0]=4 12993 B20R2.174710 O=C(C=Cc1ccsc1)NCCCc2ccccc2 240690a_100000211184_100000698588 [0,0,0,0,1,1|2,0,0]=4 12994 B20R2.174710 O=C(C=Cc1ccsc1)NCCCc2ccccc2 527a_100000211184_100000698588 [0,0,0,0,1,1|2,0,0]=4 12995 B20R2.174710 O=C(C=Cc1ccsc1)NCCOc2ccccc2 11a_100000174943_100000698588 [0,0,0,0,1,1|2,0,0]=4 12996 B20R2.174710 O=C(C=Cc1ccsc1)NCCOc2ccccc2 1626a_100000174943_100000698588 [0,0,0,0,1,1|2,0,0]=4 12997 B20R2.174710 O=C(C=Cc1ccsc1)NCCOc2ccccc2 240690a_100000174943_100000698588 [0,0,0,0,1,1|2,0,0]=4 12998 B20R2.174710 O=C(C=Cc1ccsc1)NCCOc2ccccc2 527a_100000174943_100000698588 [0,0,0,0,1,1|2,0,0]=4 12999 B20R2.174710 O=C(C=Cc1ccsc1)NCCSc2ccccc2 240690a_100000189519_100000698588 [0,0,0,0,1,1|2,0,0]=4 13000 B20R2.174710 O=C(C=Cc1ccsc1)NCCSc2ccccc2 527a_100000189519_100000698588 [0,0,0,0,1,1|2,0,0]=4 13001 B20R2.174710 O=C(C=Cc1ccsc1)NNCCc2ccccc2 22a_100000740470_100000698588 [0,0,0,0,1,1|2,0,0]=4 13002 B22R2.359960 O=C(C/C=C/c1ccccc1)CCCCc2ccccc2 1458a_100011215911_100016265936 [0,0,0,0,0,2|1,0,0]=3 13003 B22R2.359960 O=C(C/C=C/c1ccccc1)CCCCc2ccccc2 1458a_100011219626_100000701786 [0,0,0,0,0,2|1,0,0]=3 13004 B22R2.359960 O=C(C/C=C/c1ccccc1)CCCCc2ccncc2 1458a_100011219626_100020630000 [0,0,0,0,0,2|2,0,0]=4 13005 B22R2.359960 O=C(C/C=C/c1ccccc1)CCCOc2ccccc2 1458a_100000212059_100016265936 [0,0,0,0,0,2|1,0,0]=3 13006 B22R2.359960 O=C(C/C=C/c1ccccc1)CCCOc2ccccc2 1458a_100011219626_100000199009 [0,0,0,0,0,2|1,0,0]=3 13007 B22R2.359960 O=C(C/C=C/c1ccccc1)CCCSc2ccccc2 1458a_100000182835_100016265936 [0,0,0,0,0,2|1,0,0]=3 13008 B22R2.359960 O=C(C/C=C/c1ccccc1)CCCSc2ccccc2 1458a_100011219626_200011203293 [0,0,0,0,0,2|1,0,0]=3 13009 B22R2.359960 O=C(C/C=C/c1ccccc1)CCOCc2ccccc2 1458a_100000743319_100016265936 [0,0,0,0,0,2|1,0,0]=3 13010 B22R2.359960 O=C(C/C=C/c1ccccc1)CCOCc2ccccc2 1458a_100011219626_100000234347 [0,0,0,0,0,2|1,0,0]=3 13011 B22R2.359960 O=C(C/C=C/c1ccccc1)CCSCc2ccccc2 1458a_100000173759_100016265936 [0,0,0,0,0,2|1,0,0]=3 13012 B22R2.359960 O=C(C/C=C/c1ccccc1)CCSCc2ccccc2 1458a_100011219626_200011297719 [0,0,0,0,0,2|1,0,0]=3 13013 B22R2.359960 O=C(C/C=C/c1ccccc1)CCSCc2ccccn2 1458a_100000742633_100016265936 [0,0,0,0,0,2|2,0,0]=4 13014 B22R2.359960 O=C(C/C=C/c1ccccc1)NC/C=C/c2ccccc2 11a_100020603302_100011219626 [0,0,0,0,0,2|1,0,1]=4 13015 B22R2.359960 O=C(C/C=C/c1ccccc1)NC/C=C/c2ccccc2 1626a_100020603302_100011219626 [0,0,0,0,0,2|1,0,1]=4 13016 B22R2.359960 O=C(C/C=C/c1ccccc1)NC/C=C/c2ccccc2 240690a_100020603302_100011219626 [0,0,0,0,0,2|1,0,1]=4 13017 B22R2.359960 O=C(C/C=C/c1ccccc1)NCC#Cc2ccccc2 11a_100000735379_100011219626 [0,0,0,0,0,2|1,0,1]=4 13018 B22R2.359960 O=C(C/C=C/c1ccccc1)NCC#Cc2ccccc2 1626a_100000735379_100011219626 [0,0,0,0,0,2|1,0,1]=4 13019 B22R2.359960 O=C(C/C=C/c1ccccc1)NCC#Cc2ccccc2 240690a_100000735379_100011219626 [0,0,0,0,0,2|1,0,1]=4 13020 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2ccccc2 11a_100000211184_100011219626 [0,0,0,0,0,2|1,0,0]=3 13021 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2ccccc2 1626a_100000211184_100011219626 [0,0,0,0,0,2|1,0,0]=3 13022 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2ccccc2 240690a_100000211184_100011219626 [0,0,0,0,0,2|1,0,0]=3 13023 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2ccccn2 11a_100000689020_100011219626 [0,0,0,0,0,2|2,0,0]=4 13024 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2ccccn2 1626a_100000689020_100011219626 [0,0,0,0,0,2|2,0,0]=4 13025 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2ccccn2 240690a_100000689020_100011219626 [0,0,0,0,0,2|2,0,0]=4 13026 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2cccnc2 11a_100011532358_100011219626 [0,0,0,0,0,2|2,0,0]=4 13027 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2cccnc2 240690a_100011532358_100011219626 [0,0,0,0,0,2|2,0,0]=4 13028 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2ccncc2 1626a_100011275580_100011219626 [0,0,0,0,0,2|2,0,0]=4 13029 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCCc2ccncc2 240690a_100011275580_100011219626 [0,0,0,0,0,2|2,0,0]=4 13030 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2ccccc2 11a_100000174943_100011219626 [0,0,0,0,0,2|1,0,0]=3 13031 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2ccccc2 1626a_100000174943_100011219626 [0,0,0,0,0,2|1,0,0]=3 13032 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2ccccc2 240690a_100000174943_100011219626 [0,0,0,0,0,2|1,0,0]=3 13033 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2ccccn2 11a_106741647558_100011219626 [0,0,0,0,0,2|2,0,0]=4 13034 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2ccccn2 1626a_106741647558_100011219626 [0,0,0,0,0,2|2,0,0]=4 13035 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2ccccn2 240690a_106741647558_100011219626 [0,0,0,0,0,2|2,0,0]=4 13036 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2cccnc2 11a_100000754688_100011219626 [0,0,0,0,0,2|2,0,0]=4 13037 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2cccnc2 240690a_100000754688_100011219626 [0,0,0,0,0,2|2,0,0]=4 13038 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2ccncc2 11a_100025717301_100011219626 [0,0,0,0,0,2|2,0,0]=4 13039 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCOc2ccncc2 240690a_100025717301_100011219626 [0,0,0,0,0,2|2,0,0]=4 13040 B22R2.359960 O=C(C/C=C/c1ccccc1)NCCSc2ccccc2 240690a_100000189519_100011219626 [0,0,0,0,0,2|1,0,0]=3 13041 B22R2.359960 O=C(C/C=C/c1ccccc1)NNCCc2ccccc2 22a_100000740470_100011219626 [0,0,0,0,0,2|1,0,0]=3 13042 B22R2.359960 O=C(C=CCCc1ccccc1)C/C=C/c2ccccc2 1458a_100016484021_100016265936 [0,0,0,0,0,2|1,0,0]=3 13043 B22R2.359960 O=C(C=CSc1ccccc1)CCCCc2ccccc2 1458a_100016262050_100000701786 [0,0,0,0,0,2|1,0,0]=3 13044 B22R2.359960 O=C(C=CSc1ccccc1)CCCCc2ccncc2 1458a_100016262050_100020630000 [0,0,0,0,0,2|2,0,0]=4 13045 B22R2.359960 O=C(C=CSc1ccccc1)CCCOc2ccccc2 1458a_100016262050_100000199009 [0,0,0,0,0,2|1,0,0]=3 13046 B22R2.359960 O=C(C=CSc1ccccc1)CCCSc2ccccc2 1458a_100016262050_200011203293 [0,0,0,0,0,2|1,0,0]=3 13047 B22R2.359960 O=C(C=CSc1ccccc1)CCOCc2ccccc2 1458a_100016262050_100000234347 [0,0,0,0,0,2|1,0,0]=3 13048 B22R2.359960 O=C(C=CSc1ccccc1)CCSCc2ccccc2 1458a_100016262050_200011297719 [0,0,0,0,0,2|1,0,0]=3 13049 B22R2.359960 O=C(C=CSc1ccccc1)NC/C=C/c2ccccc2 11a_100020603302_100016262050 [0,0,0,0,0,2|1,0,1]=4 13050 B22R2.359960 O=C(C=CSc1ccccc1)NC/C=C/c2ccccc2 1626a_100020603302_100016262050 [0,0,0,0,0,2|1,0,1]=4 13051 B22R2.359960 O=C(C=CSc1ccccc1)NC/C=C/c2ccccc2 240690a_100020603302_100016262050 [0,0,0,0,0,2|1,0,1]=4 13052 B22R2.359960 O=C(C=CSc1ccccc1)NCC#Cc2ccccc2 11a_100000735379_100016262050 [0,0,0,0,0,2|1,0,1]=4 13053 B22R2.359960 O=C(C=CSc1ccccc1)NCC#Cc2ccccc2 1626a_100000735379_100016262050 [0,0,0,0,0,2|1,0,1]=4 13054 B22R2.359960 O=C(C=CSc1ccccc1)NCC#Cc2ccccc2 240690a_100000735379_100016262050 [0,0,0,0,0,2|1,0,1]=4 13055 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2ccccc2 11a_100000211184_100016262050 [0,0,0,0,0,2|1,0,0]=3 13056 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2ccccc2 1626a_100000211184_100016262050 [0,0,0,0,0,2|1,0,0]=3 13057 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2ccccc2 240690a_100000211184_100016262050 [0,0,0,0,0,2|1,0,0]=3 13058 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2ccccn2 11a_100000689020_100016262050 [0,0,0,0,0,2|2,0,0]=4 13059 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2ccccn2 1626a_100000689020_100016262050 [0,0,0,0,0,2|2,0,0]=4 13060 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2ccccn2 240690a_100000689020_100016262050 [0,0,0,0,0,2|2,0,0]=4 13061 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2cccnc2 11a_100011532358_100016262050 [0,0,0,0,0,2|2,0,0]=4 13062 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2cccnc2 240690a_100011532358_100016262050 [0,0,0,0,0,2|2,0,0]=4 13063 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2ccncc2 1626a_100011275580_100016262050 [0,0,0,0,0,2|2,0,0]=4 13064 B22R2.359960 O=C(C=CSc1ccccc1)NCCCc2ccncc2 240690a_100011275580_100016262050 [0,0,0,0,0,2|2,0,0]=4 13065 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2ccccc2 11a_100000174943_100016262050 [0,0,0,0,0,2|1,0,0]=3 13066 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2ccccc2 1626a_100000174943_100016262050 [0,0,0,0,0,2|1,0,0]=3 13067 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2ccccc2 240690a_100000174943_100016262050 [0,0,0,0,0,2|1,0,0]=3 13068 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2ccccn2 11a_106741647558_100016262050 [0,0,0,0,0,2|2,0,0]=4 13069 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2ccccn2 1626a_106741647558_100016262050 [0,0,0,0,0,2|2,0,0]=4 13070 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2ccccn2 240690a_106741647558_100016262050 [0,0,0,0,0,2|2,0,0]=4 13071 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2cccnc2 11a_100000754688_100016262050 [0,0,0,0,0,2|2,0,0]=4 13072 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2cccnc2 240690a_100000754688_100016262050 [0,0,0,0,0,2|2,0,0]=4 13073 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2ccncc2 11a_100025717301_100016262050 [0,0,0,0,0,2|2,0,0]=4 13074 B22R2.359960 O=C(C=CSc1ccccc1)NCCOc2ccncc2 240690a_100025717301_100016262050 [0,0,0,0,0,2|2,0,0]=4 13075 B22R2.359960 O=C(C=CSc1ccccc1)NCCSc2ccccc2 240690a_100000189519_100016262050 [0,0,0,0,0,2|1,0,0]=3 13076 B22R2.359960 O=C(C=CSc1ccccc1)NNCCc2ccccc2 22a_100000740470_100016262050 [0,0,0,0,0,2|1,0,0]=3 13077 B22R2.359960 O=C(COCCc1ccccc1)NCCc2ccccc2 34a_100000210268_100000183012 [0,0,0,0,0,2|0,0,2]=4 13078 B22R2.359960 O=C(COCCc1ccccc1)NCCc2ccccc2 7a_100000210268_100000183012 [0,0,0,0,0,2|0,0,2]=4 13079 B22R2.359960 O=C(COCCc1ccccc1)NOCc2ccccc2 34a_100000210268_100000230105 [0,0,0,0,0,2|1,0,1]=4 13080 B22R2.359960 O=C(COCCc1ccccc1)NOCc2ccccc2 7a_100000210268_100000230105 [0,0,0,0,0,2|1,0,1]=4 13081 B22R2.359960 O=C(COCCc1ccccc1)OCCc2ccccc2 34a_100000210268_200000077782 [0,0,0,0,0,2|0,0,2]=4 13082 B22R2.359960 O=C(COCCc1ccccc1)OCCc2ccccc2 7a_100000210268_200000077782 [0,0,0,0,0,2|0,0,2]=4 13083 B22R2.360319 O=C(C=Cc1ccccc1)CCCCCc2ccccc2 1458a_100000210462_200011217138 [0,0,0,0,0,2|1,0,0]=3 13084 B22R2.360319 O=C(C=Cc1ccccc1)CCCCOc2ccccc2 1458a_100000210462_100011215240 [0,0,0,0,0,2|1,0,0]=3 13085 B22R2.360319 O=C(C=Cc1ccccc1)CCCOCc2ccccc2 1458a_100000210462_100011215529 [0,0,0,0,0,2|1,0,0]=3 13086 B22R2.360319 O=C(C=Cc1ccccc1)NCCCCc2ccccc2 11a_100015280158_100000210462 [0,0,0,0,0,2|1,0,0]=3 13087 B22R2.360319 O=C(C=Cc1ccccc1)NCCCCc2ccccc2 1626a_100015280158_100000210462 [0,0,0,0,0,2|1,0,0]=3 13088 B22R2.360319 O=C(C=Cc1ccccc1)NCCCOc2ccccc2 11a_100000216521_100000210462 [0,0,0,0,0,2|1,0,0]=3 13089 B22R2.360319 O=C(C=Cc1ccccc1)NCCCOc2ccccc2 1626a_100000216521_100000210462 [0,0,0,0,0,2|1,0,0]=3 13090 B22R2.360319 O=C(C=Cc1ccccc1)NCCCSc2ccccc2 11a_100000184639_100000210462 [0,0,0,0,0,2|1,0,0]=3 13091 B22R2.360319 O=C(C=Cc1ccccc1)NCCOCc2ccccc2 11a_100000753106_100000210462 [0,0,0,0,0,2|1,0,0]=3 13092 B22R2.360319 O=C(C=Cc1ccccc1)NCCOCc2ccccc2 1626a_100000753106_100000210462 [0,0,0,0,0,2|1,0,0]=3 13093 B22R2.360319 O=C(C=Cc1ccccc1)NCCSCc2ccccc2 11a_100000189534_100000210462 [0,0,0,0,0,2|1,0,0]=3 13094 B22R2.360319 O=C(C=Cc1ccccc1)NCCSSc2ccccn2 11a_100016995281_100000210462 [0,0,0,0,0,2|2,0,0]=4 13095 B22R2.360319 O=C(C=Cc1ccccn1)CCCCCc2ccccc2 1458a_100000740811_200011217138 [0,0,0,0,0,2|2,0,0]=4 13096 B22R2.360319 O=C(C=Cc1ccccn1)CCCCOc2ccccc2 1458a_100000740811_100011215240 [0,0,0,0,0,2|2,0,0]=4 13097 B22R2.360319 O=C(C=Cc1ccccn1)CCCOCc2ccccc2 1458a_100000740811_100011215529 [0,0,0,0,0,2|2,0,0]=4 13098 B22R2.360319 O=C(C=Cc1ccccn1)NCCCCc2ccccc2 11a_100015280158_100000740811 [0,0,0,0,0,2|2,0,0]=4 13099 B22R2.360319 O=C(C=Cc1ccccn1)NCCCCc2ccccc2 240690a_100015280158_100000740811 [0,0,0,0,0,2|2,0,0]=4 13100 B22R2.360319 O=C(C=Cc1ccccn1)NCCCOc2ccccc2 11a_100000216521_100000740811 [0,0,0,0,0,2|2,0,0]=4 13101 B22R2.360319 O=C(C=Cc1ccccn1)NCCCOc2ccccc2 240690a_100000216521_100000740811 [0,0,0,0,0,2|2,0,0]=4 13102 B22R2.360319 O=C(C=Cc1ccccn1)NCCCSc2ccccc2 11a_100000184639_100000740811 [0,0,0,0,0,2|2,0,0]=4 13103 B22R2.360319 O=C(C=Cc1ccccn1)NCCCSc2ccccc2 240690a_100000184639_100000740811 [0,0,0,0,0,2|2,0,0]=4 13104 B22R2.360319 O=C(C=Cc1ccccn1)NCCOCc2ccccc2 11a_100000753106_100000740811 [0,0,0,0,0,2|2,0,0]=4 13105 B22R2.360319 O=C(C=Cc1ccccn1)NCCOCc2ccccc2 240690a_100000753106_100000740811 [0,0,0,0,0,2|2,0,0]=4 13106 B22R2.360319 O=C(C=Cc1ccccn1)NCCSCc2ccccc2 11a_100000189534_100000740811 [0,0,0,0,0,2|2,0,0]=4 13107 B22R2.360319 O=C(C=Cc1ccccn1)NCCSCc2ccccc2 240690a_100000189534_100000740811 [0,0,0,0,0,2|2,0,0]=4 13108 B22R2.360319 O=C(C=Cc1cccnc1)CCCCCc2ccccc2 1458a_100000735890_200011217138 [0,0,0,0,0,2|2,0,0]=4 13109 B22R2.360319 O=C(C=Cc1cccnc1)CCCCOc2ccccc2 1458a_100000735890_100011215240 [0,0,0,0,0,2|2,0,0]=4 13110 B22R2.360319 O=C(C=Cc1cccnc1)CCCOCc2ccccc2 1458a_100000735890_100011215529 [0,0,0,0,0,2|2,0,0]=4 13111 B22R2.360319 O=C(C=Cc1cccnc1)NCCCCc2ccccc2 11a_100015280158_100000735890 [0,0,0,0,0,2|2,0,0]=4 13112 B22R2.360319 O=C(C=Cc1cccnc1)NCCCCc2ccccc2 240690a_100015280158_100000735890 [0,0,0,0,0,2|2,0,0]=4 13113 B22R2.360319 O=C(C=Cc1cccnc1)NCCCOc2ccccc2 11a_100000216521_100000735890 [0,0,0,0,0,2|2,0,0]=4 13114 B22R2.360319 O=C(C=Cc1cccnc1)NCCCOc2ccccc2 240690a_100000216521_100000735890 [0,0,0,0,0,2|2,0,0]=4 13115 B22R2.360319 O=C(C=Cc1cccnc1)NCCCSc2ccccc2 11a_100000184639_100000735890 [0,0,0,0,0,2|2,0,0]=4 13116 B22R2.360319 O=C(C=Cc1cccnc1)NCCCSc2ccccc2 240690a_100000184639_100000735890 [0,0,0,0,0,2|2,0,0]=4 13117 B22R2.360319 O=C(C=Cc1cccnc1)NCCOCc2ccccc2 11a_100000753106_100000735890 [0,0,0,0,0,2|2,0,0]=4 13118 B22R2.360319 O=C(C=Cc1cccnc1)NCCOCc2ccccc2 240690a_100000753106_100000735890 [0,0,0,0,0,2|2,0,0]=4 13119 B22R2.360319 O=C(C=Cc1cccnc1)NCCSCc2ccccc2 11a_100000189534_100000735890 [0,0,0,0,0,2|2,0,0]=4 13120 B22R2.360319 O=C(C=Cc1cccnc1)NCCSCc2ccccc2 240690a_100000189534_100000735890 [0,0,0,0,0,2|2,0,0]=4 13121 B22R2.360319 O=C(C=Cc1ccncc1)CCCCCc2ccccc2 1458a_100000682801_200011217138 [0,0,0,0,0,2|2,0,0]=4 13122 B22R2.360319 O=C(C=Cc1ccncc1)CCCCOc2ccccc2 1458a_100000682801_100011215240 [0,0,0,0,0,2|2,0,0]=4 13123 B22R2.360319 O=C(C=Cc1ccncc1)CCCOCc2ccccc2 1458a_100000682801_100011215529 [0,0,0,0,0,2|2,0,0]=4 13124 B22R2.360319 O=C(C=Cc1ccncc1)NCCCCc2ccccc2 240690a_100015280158_100000682801 [0,0,0,0,0,2|2,0,0]=4 13125 B22R2.360319 O=C(C=Cc1ccncc1)NCCCOc2ccccc2 240690a_100000216521_100000682801 [0,0,0,0,0,2|2,0,0]=4 13126 B22R2.360319 O=C(C=Cc1ccncc1)NCCCSc2ccccc2 240690a_100000184639_100000682801 [0,0,0,0,0,2|2,0,0]=4 13127 B22R2.360319 O=C(C=Cc1ccncc1)NCCOCc2ccccc2 240690a_100000753106_100000682801 [0,0,0,0,0,2|2,0,0]=4 13128 B22R2.360319 O=C(C=Cc1ccncc1)NCCSCc2ccccc2 240690a_100000189534_100000682801 [0,0,0,0,0,2|2,0,0]=4 13129 B22R2.360319 O=C(CCOCCc1ccccc1)OCc2ccccc2 7a_100000210268_100009813219 [0,0,0,0,0,2|1,0,1]=4 13130 B22R2.360319 O=C(CCOCCc1ccccc1)OCc2ccccc2 7a_100009831632_100000765856 [0,0,0,0,0,2|1,0,1]=4 13131 B22R2.360319 O=C(CCc1ccccc1)COCCCc2ccccc2 34a_100000210828_100012361361 [0,0,0,0,0,2|0,0,2]=4 13132 B22R2.360319 O=C(CCc1ccccc1)COCCCc2ccccc2 7a_100000210828_100012361361 [0,0,0,0,0,2|0,0,2]=4 13133 B22R2.360319 O=C(CCc1ccccc1)COCCNc2ccccc2 34a_100000211345_100012361361 [0,0,0,0,0,2|0,0,2]=4 13134 B22R2.360319 O=C(CCc1ccccc1)COCCOc2ccccc2 34a_100000210260_100012361361 [0,0,0,0,0,2|0,0,2]=4 13135 B22R2.360319 O=C(CCc1ccccc1)COCCOc2ccccc2 7a_100000210260_100012361361 [0,0,0,0,0,2|0,0,2]=4 13136 B22R2.360319 O=C(CCc1ccccc1)COCCSc2ccccc2 7a_100000230494_100012361361 [0,0,0,0,0,2|0,0,2]=4 13137 B22R2.360319 O=C(COCCCc1ccccc1)NCc2ccccc2 34a_100000210828_100000183539 [0,0,0,0,0,2|1,0,1]=4 13138 B22R2.360319 O=C(COCCCc1ccccc1)NCc2ccccc2 7a_100000210828_100000183539 [0,0,0,0,0,2|1,0,1]=4 13139 B22R2.360319 O=C(COCCCc1ccccc1)OCc2ccccc2 34a_100000210828_100000753625 [0,0,0,0,0,2|1,0,1]=4 13140 B22R2.360319 O=C(COCCCc1ccccc1)OCc2ccccc2 7a_100000210828_100000753625 [0,0,0,0,0,2|1,0,1]=4 13141 B22R2.360319 O=C(COCCNc1ccccc1)NCc2ccccc2 34a_100000211345_100000183539 [0,0,0,0,0,2|1,0,1]=4 13142 B22R2.360319 O=C(COCCNc1ccccc1)OCc2ccccc2 34a_100000211345_100000753625 [0,0,0,0,0,2|1,0,1]=4 13143 B22R2.360319 O=C(COCCOc1ccccc1)NCc2ccccc2 34a_100000210260_100000183539 [0,0,0,0,0,2|1,0,1]=4 13144 B22R2.360319 O=C(COCCOc1ccccc1)NCc2ccccc2 7a_100000210260_100000183539 [0,0,0,0,0,2|1,0,1]=4 13145 B22R2.360319 O=C(COCCOc1ccccc1)OCc2ccccc2 34a_100000210260_100000753625 [0,0,0,0,0,2|1,0,1]=4 13146 B22R2.360319 O=C(COCCOc1ccccc1)OCc2ccccc2 7a_100000210260_100000753625 [0,0,0,0,0,2|1,0,1]=4 13147 B22R2.360319 O=C(COCCSc1ccccc1)NCc2ccccc2 7a_100000230494_100000183539 [0,0,0,0,0,2|1,0,1]=4 13148 B22R2.360319 O=C(COCCSc1ccccc1)OCc2ccccc2 7a_100000230494_100000753625 [0,0,0,0,0,2|1,0,1]=4