0 B23R4.6141 c1cc2c(cn1)CCCC2Nc3nc4cnccn4n3 27a_100020634316_100010748104 [0,0,0,0,0,0|3,0,1]=4 1 B23R4.6141 c1ccc2[nH]c(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100009814255 [0,0,0,0,0,0|1,0,0]=1 2 B23R4.6141 c1ccc2c(c1)CC(C2)NC3CCCc4c3cccc4 269862a_100000753258_100000210882 [0,0,0,0,0,0|2,0,1]=3 3 B23R4.6141 c1ccc2c(c1)CC(C2)NC3CCCc4c3cccn4 269862a_100000753258_100000058033 [0,0,0,0,0,0|3,0,1]=4 4 B23R4.6141 c1ccc2c(c1)CC(C2)NC3CCCc4c3ccnc4 269862a_100000753258_100000087567 [0,0,0,0,0,0|3,0,1]=4 5 B23R4.6141 c1ccc2c(c1)CC(C2)NC3CCCc4c3cncc4 269862a_100000753258_100016991936 [0,0,0,0,0,0|3,0,1]=4 6 B23R4.6141 c1ccc2c(c1)CC(C2)NC3CCCc4c3nccc4 269862a_100000753258_100000067617 [0,0,0,0,0,0|3,0,1]=4 7 B23R4.6141 c1ccc2c(c1)CC(C2)NC3CCSc4c3cccc4 269862a_100000753258_100000183853 [0,0,0,0,0,0|3,0,1]=4 8 B23R4.6141 c1ccc2c(c1)CC(C2)NC3COCc4c3cccc4 269862a_100000753258_100000117393 [0,0,0,0,0,0|3,0,1]=4 9 B23R4.6141 c1ccc2c(c1)CC(C2)N[C@H]3CCCc4c3cccc4 34a_100020654734_100000753484 [0,0,0,0,0,0|2,0,1]=3 10 B23R4.6141 c1ccc2c(c1)CC(C2)OC3CCCc4c3cccc4 34a_100000183665_100000753484 [0,0,0,0,0,0|3,0,1]=4 11 B23R4.6141 c1ccc2c(c1)CC(C2)OC3CCCc4c3cccc4 7a_100000183665_100000753484 [0,0,0,0,0,0|3,0,1]=4 12 B23R4.6141 c1ccc2c(c1)CCC[C@@H]2Nc3nc4ccccc4[nH]3 27a_100020654734_100009814255 [0,0,0,0,0,0|0,0,0]=0 13 B23R4.6141 c1ccc2c(c1)CCC[C@@H]2Nc3nc4ccccc4s3 27a_100020654734_100000751744 [0,0,0,0,0,0|1,0,0]=1 14 B23R4.6141 c1ccc2c(c1)CCC[C@@H]2Nc3nc4cccnc4s3 27a_100020654734_100010188088 [0,0,0,0,0,0|2,0,0]=2 15 B23R4.6141 c1ccc2c(c1)CCC[C@@H]2Nc3nc4cnccn4n3 27a_100020654734_100010748104 [0,0,0,0,0,0|2,0,1]=3 16 B23R4.6141 c1ccc2c(c1)OCCC2Nc3nc4ccccc4[nH]3 27a_100015190321_100009814255 [0,0,0,0,0,0|1,0,0]=1 17 B23R4.6141 c1ccc2c(c1)OCCC2Nc3nc4ccccc4s3 27a_100015190321_100000751744 [0,0,0,0,0,0|2,0,0]=2 18 B23R4.6141 c1ccc2c(c1)OCCC2Nc3nc4cccnc4s3 27a_100015190321_100010188088 [0,0,0,0,0,0|3,0,0]=3 19 B23R4.6141 c1ccc2c(c1)OCCC2Nc3nc4cnccn4n3 27a_100015190321_100010748104 [0,0,0,0,0,0|3,0,1]=4 20 B23R4.6141 c1ccc2c(cccc2c1)Nc3nc4ccccc4[nH]3 27a_100000185869_100009814255 [0,0,0,0,0,0|0,0,4]=4 21 B23R4.6141 c1ccc2sc(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000751744 [0,0,0,0,0,0|2,0,0]=2 22 B23R4.6141 c1cnc2c(c1)CCCC2Nc3nc4ccccc4[nH]3 27a_100011259139_100009814255 [0,0,0,0,0,0|1,0,0]=1 23 B23R4.6141 c1cnc2c(c1)CCCC2Nc3nc4ccccc4s3 27a_100011259139_100000751744 [0,0,0,0,0,0|2,0,0]=2 24 B23R4.6141 c1cnc2c(c1)CCCC2Nc3nc4cccnc4s3 27a_100011259139_100010188088 [0,0,0,0,0,0|3,0,0]=3 25 B23R4.6141 c1cnc2c(c1)CCCC2Nc3nc4cnccn4n3 27a_100011259139_100010748104 [0,0,0,0,0,0|3,0,1]=4 26 B23R4.6141 c1cnc2c(c1)OCCC2Nc3nc4ccccc4[nH]3 27a_100009852857_100009814255 [0,0,0,0,0,0|2,0,0]=2 27 B23R4.6141 c1cnc2c(c1)OCCC2Nc3nc4ccccc4s3 27a_100009852857_100000751744 [0,0,0,0,0,0|3,0,0]=3 28 B23R4.6141 c1cnc2c(c1)OCCC2Nc3nc4cccnc4s3 27a_100009852857_100010188088 [0,0,0,0,0,0|4,0,0]=4 29 B23R4.6141 c1cnc2sc(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100010188088 [0,0,0,0,0,0|3,0,0]=3 30 B24R4.26442 Brc1ccc2c(c1)CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000688402 [0,1,0,0,0,0|2,0,1]=4 31 B24R4.26442 Brc1ccc2c(c1)CCC[C@@H]2NC3Cc4ccccc4C3 34a_100160469487_100000753484 [0,1,0,0,0,0|2,0,1]=4 32 B24R4.26442 Brc1ccc2c(c1)CCC[C@@H]2Nc3nc4ccccc4[nH]3 27a_100160469487_100009814255 [0,1,0,0,0,0|0,0,0]=1 33 B24R4.26442 Brc1ccc2c(c1)CCC[C@@H]2Nc3nc4ccccc4s3 27a_100160469487_100000751744 [0,1,0,0,0,0|1,0,0]=2 34 B24R4.26442 Brc1ccc2c(c1)CCC[C@@H]2Nc3nc4cccnc4s3 27a_100160469487_100010188088 [0,1,0,0,0,0|2,0,0]=3 35 B24R4.26442 Brc1ccc2c(c1)CCC[C@@H]2Nc3nc4cnccn4n3 27a_100160469487_100010748104 [0,1,0,0,0,0|2,0,1]=4 36 B24R4.26442 Brc1ccc2c(c1)OCC[C@H]2Nc3nc4ccccc4[nH]3 27a_100020639266_100009814255 [0,1,0,0,0,0|1,0,0]=2 37 B24R4.26442 Brc1ccc2c(c1)OCC[C@H]2Nc3nc4ccccc4s3 27a_100020639266_100000751744 [0,1,0,0,0,0|2,0,0]=3 38 B24R4.26442 Brc1ccc2c(c1)OCC[C@H]2Nc3nc4cccnc4s3 27a_100020639266_100010188088 [0,1,0,0,0,0|3,0,0]=4 39 B24R4.26442 Cc1ccc2c(c1)CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000074264 [0,1,0,0,0,0|2,0,1]=4 40 B24R4.26442 Clc1ccc2c(c1)CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000081257 [0,1,0,0,0,0|2,0,1]=4 41 B24R4.26442 Clc1ccc2c(c1)CCCC2NC3Cc4ccccc4C3 34a_100025717365_100000753484 [0,1,0,0,0,0|2,0,1]=4 42 B24R4.26442 Clc1ccc2c(c1)CCCC2Nc3nc4ccccc4[nH]3 27a_100025717365_100009814255 [0,1,0,0,0,0|0,0,0]=1 43 B24R4.26442 Clc1ccc2c(c1)CCCC2Nc3nc4ccccc4s3 27a_100025717365_100000751744 [0,1,0,0,0,0|1,0,0]=2 44 B24R4.26442 Clc1ccc2c(c1)CCCC2Nc3nc4cccnc4s3 27a_100025717365_100010188088 [0,1,0,0,0,0|2,0,0]=3 45 B24R4.26442 Clc1ccc2c(c1)CCCC2Nc3nc4cnccn4n3 27a_100025717365_100010748104 [0,1,0,0,0,0|2,0,1]=4 46 B24R4.26442 Fc1ccc2c(c1)CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000090879 [0,1,0,0,0,0|2,0,1]=4 47 B24R4.26442 Fc1ccc2c(c1)CCCC2NC3Cc4ccccc4C3 34a_100000695172_100000753484 [0,1,0,0,0,0|2,0,1]=4 48 B24R4.26442 Fc1ccc2c(c1)CCCC2Nc3nc4ccccc4[nH]3 27a_100000695172_100009814255 [0,1,0,0,0,0|0,0,0]=1 49 B24R4.26442 Fc1ccc2c(c1)CCCC2Nc3nc4ccccc4s3 27a_100000695172_100000751744 [0,1,0,0,0,0|1,0,0]=2 50 B24R4.26442 Fc1ccc2c(c1)CCCC2Nc3nc4cccnc4s3 27a_100000695172_100010188088 [0,1,0,0,0,0|2,0,0]=3 51 B24R4.26442 Fc1ccc2c(c1)CCCC2Nc3nc4cnccn4n3 27a_100000695172_100010748104 [0,1,0,0,0,0|2,0,1]=4 52 B24R4.26442 Fc1ccc2c(c1)OCCC2Nc3nc4ccccc4[nH]3 27a_100015190460_100009814255 [0,1,0,0,0,0|1,0,0]=2 53 B24R4.26442 Fc1ccc2c(c1)OCCC2Nc3nc4ccccc4s3 27a_100015190460_100000751744 [0,1,0,0,0,0|2,0,0]=3 54 B24R4.26442 Fc1ccc2c(c1)OCCC2Nc3nc4cccnc4s3 27a_100015190460_100010188088 [0,1,0,0,0,0|3,0,0]=4 55 B24R4.26442 Ic1ccc2c(c1)CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000050035 [0,1,0,0,0,0|2,0,1]=4 56 B24R4.46510 Cn1c(nc2c1cccc2)NC3CCCc4c3ccnc4 27a_100020634316_200000239431 [0,1,0,0,0,0|1,0,0]=2 57 B24R4.46510 Cn1c(nc2c1cccc2)NC3CCCc4c3nccc4 27a_100011259139_200000239431 [0,1,0,0,0,0|1,0,0]=2 58 B24R4.46510 Cn1c(nc2c1cccc2)NC3CCOc4c3cccc4 27a_100015190321_200000239431 [0,1,0,0,0,0|1,0,0]=2 59 B24R4.46510 Cn1c(nc2c1cccc2)NC3CCOc4c3nccc4 27a_100009852857_200000239431 [0,1,0,0,0,0|2,0,0]=3 60 B24R4.46510 Cn1c(nc2c1cccc2)N[C@H]3CCCc4c3cccc4 27a_100020654734_200000239431 [0,1,0,0,0,0|0,0,0]=1 61 B24R4.46510 OC1c2ccccc2CC1N[C@H]3CCCc4c3cccc4 34a_100020654734_100000211646 [0,1,0,0,0,0|2,0,1]=4 62 B24R4.94536 CC1CCc2ccccc2C1NC3Cc4ccccc4C3 269862a_100000753258_100000696181 [0,1,0,0,0,0|2,0,1]=4 63 B24R4.2065355 Brc1ccc2c(c1)C(CCC2)NC3Cc4ccccc4C3 269862a_100000753258_100000760428 [0,1,0,0,0,0|2,0,1]=4 64 B24R4.2065355 Brc1ccc2c(c1)C(CCC2)NC3Cc4ccccc4C3 34a_100011742594_100000753484 [0,1,0,0,0,0|2,0,1]=4 65 B24R4.2065355 Brc1ccc2c(c1)C(CCC2)Nc3nc4ccccc4[nH]3 27a_100011742594_100009814255 [0,1,0,0,0,0|0,0,0]=1 66 B24R4.2065355 Brc1ccc2c(c1)C(CCC2)Nc3nc4ccccc4s3 27a_100011742594_100000751744 [0,1,0,0,0,0|1,0,0]=2 67 B24R4.2065355 Brc1ccc2c(c1)C(CCC2)Nc3nc4cccnc4s3 27a_100011742594_100010188088 [0,1,0,0,0,0|2,0,0]=3 68 B24R4.2065355 Brc1ccc2c(c1)C(CCC2)Nc3nc4cnccn4n3 27a_100011742594_100010748104 [0,1,0,0,0,0|2,0,1]=4 69 B24R4.2065355 Brc1ccc2c(c1)C(CCS2)Nc3nc4ccccc4[nH]3 27a_100000744474_100009814255 [0,1,0,0,0,0|1,0,0]=2 70 B24R4.2065355 Brc1ccc2c(c1)C(CCS2)Nc3nc4ccccc4s3 27a_100000744474_100000751744 [0,1,0,0,0,0|2,0,0]=3 71 B24R4.2065355 Brc1ccc2c(c1)C(CCS2)Nc3nc4cccnc4s3 27a_100000744474_100010188088 [0,1,0,0,0,0|3,0,0]=4 72 B24R4.2065355 Brc1ccc2c(c1)[C@H](CCO2)Nc3nc4ccccc4[nH]3 27a_100020639276_100009814255 [0,1,0,0,0,0|1,0,0]=2 73 B24R4.2065355 Brc1ccc2c(c1)[C@H](CCO2)Nc3nc4ccccc4s3 27a_100020639276_100000751744 [0,1,0,0,0,0|2,0,0]=3 74 B24R4.2065355 Brc1ccc2c(c1)[C@H](CCO2)Nc3nc4cccnc4s3 27a_100020639276_100010188088 [0,1,0,0,0,0|3,0,0]=4 75 B24R4.2065355 Cc1ccc2c(c1)C(CCC2)NC3Cc4ccccc4C3 269862a_100000753258_100000685544 [0,1,0,0,0,0|2,0,1]=4 76 B24R4.2065355 Cc1ccc2c(c1)C(CCC2)NC3Cc4ccccc4C3 34a_100015204190_100000753484 [0,1,0,0,0,0|2,0,1]=4 77 B24R4.2065355 Cc1ccc2c(c1)C(CCC2)Nc3nc4ccccc4[nH]3 27a_100015204190_100009814255 [0,1,0,0,0,0|0,0,0]=1 78 B24R4.2065355 Cc1ccc2c(c1)C(CCC2)Nc3nc4ccccc4s3 27a_100015204190_100000751744 [0,1,0,0,0,0|1,0,0]=2 79 B24R4.2065355 Cc1ccc2c(c1)C(CCC2)Nc3nc4cccnc4s3 27a_100015204190_100010188088 [0,1,0,0,0,0|2,0,0]=3 80 B24R4.2065355 Cc1ccc2c(c1)C(CCC2)Nc3nc4cnccn4n3 27a_100015204190_100010748104 [0,1,0,0,0,0|2,0,1]=4 81 B24R4.2065355 Clc1ccc2c(c1)C(CCC2)NC3Cc4ccccc4C3 269862a_100000753258_100000691401 [0,1,0,0,0,0|2,0,1]=4 82 B24R4.2065355 Clc1ccc2c(c1)C(CCO2)Nc3nc4ccccc4[nH]3 27a_100011264799_100009814255 [0,1,0,0,0,0|1,0,0]=2 83 B24R4.2065355 Clc1ccc2c(c1)C(CCO2)Nc3nc4ccccc4s3 27a_100011264799_100000751744 [0,1,0,0,0,0|2,0,0]=3 84 B24R4.2065355 Clc1ccc2c(c1)C(CCO2)Nc3nc4cccnc4s3 27a_100011264799_100010188088 [0,1,0,0,0,0|3,0,0]=4 85 B24R4.2065355 Clc1ccc2c(c1)[C@H](CCC2)NC3Cc4ccccc4C3 34a_100011998213_100000753484 [0,1,0,0,0,0|2,0,1]=4 86 B24R4.2065355 Clc1ccc2c(c1)[C@H](CCC2)Nc3nc4ccccc4[nH]3 27a_100011998213_100009814255 [0,1,0,0,0,0|0,0,0]=1 87 B24R4.2065355 Clc1ccc2c(c1)[C@H](CCC2)Nc3nc4ccccc4s3 27a_100011998213_100000751744 [0,1,0,0,0,0|1,0,0]=2 88 B24R4.2065355 Clc1ccc2c(c1)[C@H](CCC2)Nc3nc4cccnc4s3 27a_100011998213_100010188088 [0,1,0,0,0,0|2,0,0]=3 89 B24R4.2065355 Clc1ccc2c(c1)[C@H](CCC2)Nc3nc4cnccn4n3 27a_100011998213_100010748104 [0,1,0,0,0,0|2,0,1]=4 90 B24R4.2065355 Fc1ccc2c(c1)C(CCC2)NC3Cc4ccccc4C3 269862a_100000753258_100000691130 [0,1,0,0,0,0|2,0,1]=4 91 B24R4.2065355 Fc1ccc2c(c1)C(CCO2)Nc3nc4ccccc4[nH]3 27a_100000754146_100009814255 [0,1,0,0,0,0|1,0,0]=2 92 B24R4.2065355 Fc1ccc2c(c1)C(CCO2)Nc3nc4ccccc4s3 27a_100000754146_100000751744 [0,1,0,0,0,0|2,0,0]=3 93 B24R4.2065355 Fc1ccc2c(c1)C(CCO2)Nc3nc4cccnc4s3 27a_100000754146_100010188088 [0,1,0,0,0,0|3,0,0]=4 94 B24R4.2065355 Fc1ccc2c(c1)[C@@H](CCC2)NC3Cc4ccccc4C3 34a_200000724602_100000753484 [0,1,0,0,0,0|2,0,1]=4 95 B24R4.2065355 Fc1ccc2c(c1)[C@@H](CCC2)Nc3nc4ccccc4[nH]3 27a_200000724602_100009814255 [0,1,0,0,0,0|0,0,0]=1 96 B24R4.2065355 Fc1ccc2c(c1)[C@@H](CCC2)Nc3nc4ccccc4s3 27a_200000724602_100000751744 [0,1,0,0,0,0|1,0,0]=2 97 B24R4.2065355 Fc1ccc2c(c1)[C@@H](CCC2)Nc3nc4cccnc4s3 27a_200000724602_100010188088 [0,1,0,0,0,0|2,0,0]=3 98 B24R4.2065355 Fc1ccc2c(c1)[C@@H](CCC2)Nc3nc4cnccn4n3 27a_200000724602_100010748104 [0,1,0,0,0,0|2,0,1]=4 99 B24R4.2065355 Ic1ccc2c(c1)C(CCC2)NC3Cc4ccccc4C3 269862a_100000753258_100000050175 [0,1,0,0,0,0|2,0,1]=4 100 B24R4.3402214 Brc1cccc2c1CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000691372 [0,1,0,0,0,0|2,0,1]=4 101 B24R4.3402214 Brc1cccc2c1CCCC2NC3Cc4ccccc4C3 34a_100020639248_100000753484 [0,1,0,0,0,0|2,0,1]=4 102 B24R4.3402214 Brc1cccc2c1CCCC2Nc3nc4ccccc4[nH]3 27a_100020639248_100009814255 [0,1,0,0,0,0|0,0,0]=1 103 B24R4.3402214 Brc1cccc2c1CCCC2Nc3nc4ccccc4s3 27a_100020639248_100000751744 [0,1,0,0,0,0|1,0,0]=2 104 B24R4.3402214 Brc1cccc2c1CCCC2Nc3nc4cccnc4s3 27a_100020639248_100010188088 [0,1,0,0,0,0|2,0,0]=3 105 B24R4.3402214 Brc1cccc2c1CCCC2Nc3nc4cnccn4n3 27a_100020639248_100010748104 [0,1,0,0,0,0|2,0,1]=4 106 B24R4.3402214 Brc1cccc2c1OCCC2Nc3nc4ccccc4[nH]3 27a_100000727345_100009814255 [0,1,0,0,0,0|1,0,0]=2 107 B24R4.3402214 Brc1cccc2c1OCCC2Nc3nc4ccccc4s3 27a_100000727345_100000751744 [0,1,0,0,0,0|2,0,0]=3 108 B24R4.3402214 Brc1cccc2c1OCCC2Nc3nc4cccnc4s3 27a_100000727345_100010188088 [0,1,0,0,0,0|3,0,0]=4 109 B24R4.3402214 Cc1cccc2c1OCC[C@H]2Nc3nc4ccccc4[nH]3 27a_100000717741_100009814255 [0,1,0,0,0,0|1,0,0]=2 110 B24R4.3402214 Cc1cccc2c1OCC[C@H]2Nc3nc4ccccc4s3 27a_100000717741_100000751744 [0,1,0,0,0,0|2,0,0]=3 111 B24R4.3402214 Cc1cccc2c1OCC[C@H]2Nc3nc4cccnc4s3 27a_100000717741_100010188088 [0,1,0,0,0,0|3,0,0]=4 112 B24R4.3402214 Clc1cccc2c1CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000063505 [0,1,0,0,0,0|2,0,1]=4 113 B24R4.3402214 Clc1cccc2c1CCC[C@H]2NC3Cc4ccccc4C3 34a_100025717364_100000753484 [0,1,0,0,0,0|2,0,1]=4 114 B24R4.3402214 Clc1cccc2c1CCC[C@H]2Nc3nc4ccccc4[nH]3 27a_100025717364_100009814255 [0,1,0,0,0,0|0,0,0]=1 115 B24R4.3402214 Clc1cccc2c1CCC[C@H]2Nc3nc4ccccc4s3 27a_100025717364_100000751744 [0,1,0,0,0,0|1,0,0]=2 116 B24R4.3402214 Clc1cccc2c1CCC[C@H]2Nc3nc4cccnc4s3 27a_100025717364_100010188088 [0,1,0,0,0,0|2,0,0]=3 117 B24R4.3402214 Clc1cccc2c1CCC[C@H]2Nc3nc4cnccn4n3 27a_100025717364_100010748104 [0,1,0,0,0,0|2,0,1]=4 118 B24R4.3402214 Fc1cccc2c1CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000087435 [0,1,0,0,0,0|2,0,1]=4 119 B24R4.3402214 Fc1cccc2c1CCCC2NC3Cc4ccccc4C3 34a_100000085590_100000753484 [0,1,0,0,0,0|2,0,1]=4 120 B24R4.3402214 Fc1cccc2c1CCCC2Nc3nc4ccccc4[nH]3 27a_100000085590_100009814255 [0,1,0,0,0,0|0,0,0]=1 121 B24R4.3402214 Fc1cccc2c1CCCC2Nc3nc4ccccc4s3 27a_100000085590_100000751744 [0,1,0,0,0,0|1,0,0]=2 122 B24R4.3402214 Fc1cccc2c1CCCC2Nc3nc4cccnc4s3 27a_100000085590_100010188088 [0,1,0,0,0,0|2,0,0]=3 123 B24R4.3402214 Fc1cccc2c1CCCC2Nc3nc4cnccn4n3 27a_100000085590_100010748104 [0,1,0,0,0,0|2,0,1]=4 124 B24R4.3402214 Fc1cccc2c1OCCC2Nc3nc4ccccc4[nH]3 27a_100000746867_100009814255 [0,1,0,0,0,0|1,0,0]=2 125 B24R4.3402214 Fc1cccc2c1OCCC2Nc3nc4ccccc4s3 27a_100000746867_100000751744 [0,1,0,0,0,0|2,0,0]=3 126 B24R4.3402214 Fc1cccc2c1OCCC2Nc3nc4cccnc4s3 27a_100000746867_100010188088 [0,1,0,0,0,0|3,0,0]=4 127 B24R4.3402214 Oc1cccc2c1CCCC2NC3Cc4ccccc4C3 269862a_100000753258_100000763485 [0,1,0,0,0,0|2,0,1]=4 128 B24R4.3403390 Brc1cccc2c1CC(C2)N[C@H]3CCCc4c3cccc4 270004a_100020654734_100010205903 [0,1,0,0,0,0|2,0,1]=4 129 B24R4.3403390 Cc1cccc2c1CC(C2)N[C@H]3CCCc4c3cccc4 270004a_100020654734_100010637320 [0,1,0,0,0,0|2,0,1]=4 130 B24R4.3403390 Cc1cccc2c1nc(s2)NC3CCCc4c3ccnc4 27a_100020634316_100010008827 [0,1,0,0,0,0|2,0,0]=3 131 B24R4.3403390 Cc1cccc2c1nc(s2)NC3CCCc4c3nccc4 27a_100011259139_100010008827 [0,1,0,0,0,0|2,0,0]=3 132 B24R4.3403390 Cc1cccc2c1nc(s2)NC3CCOc4c3cccc4 27a_100015190321_100010008827 [0,1,0,0,0,0|2,0,0]=3 133 B24R4.3403390 Cc1cccc2c1nc(s2)NC3CCOc4c3nccc4 27a_100009852857_100010008827 [0,1,0,0,0,0|3,0,0]=4 134 B24R4.3403390 Cc1cccc2c1nc(s2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010008827 [0,1,0,0,0,0|1,0,0]=2 135 B24R4.3403390 Clc1ncnc2c1cc([nH]2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010240015 [0,1,0,0,0,0|3,0,0]=4 136 B24R4.3403390 Fc1cccc2c1nc(s2)NC3CCCc4c3ccnc4 27a_100020634316_100010008856 [0,1,0,0,0,0|2,0,0]=3 137 B24R4.3403390 Fc1cccc2c1nc(s2)NC3CCCc4c3nccc4 27a_100011259139_100010008856 [0,1,0,0,0,0|2,0,0]=3 138 B24R4.3403390 Fc1cccc2c1nc(s2)NC3CCOc4c3cccc4 27a_100015190321_100010008856 [0,1,0,0,0,0|2,0,0]=3 139 B24R4.3403390 Fc1cccc2c1nc(s2)NC3CCOc4c3nccc4 27a_100009852857_100010008856 [0,1,0,0,0,0|3,0,0]=4 140 B24R4.3403390 Fc1cccc2c1nc(s2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010008856 [0,1,0,0,0,0|1,0,0]=2 141 B24R4.3403390 Nc1ncnc2c1[nH]c(n2)NC3CCCc4c3ccnc4 27a_100020634316_100009817290 [0,1,0,0,0,0|3,0,0]=4 142 B24R4.3403390 Nc1ncnc2c1[nH]c(n2)NC3CCCc4c3nccc4 27a_100011259139_100009817290 [0,1,0,0,0,0|3,0,0]=4 143 B24R4.3403390 Nc1ncnc2c1[nH]c(n2)NC3CCOc4c3cccc4 27a_100015190321_100009817290 [0,1,0,0,0,0|3,0,0]=4 144 B24R4.3403390 Nc1ncnc2c1[nH]c(n2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100009817290 [0,1,0,0,0,0|2,0,0]=3 145 B24R4.3597233 CC1CCC(c2c1cccc2)NC3Cc4ccccc4C3 269862a_100000753258_100000689179 [0,1,0,0,0,0|2,0,1]=4 146 B24R4.14279927 Brc1ccc2c(c1)CC(C2)NC3CCCc4c3cccc4 269862a_100015193702_100000210882 [0,1,0,0,0,0|2,0,1]=4 147 B24R4.14279927 Brc1ccc2c(c1)CC(C2)N[C@H]3CCCc4c3cccc4 270004a_100020654734_100010185598 [0,1,0,0,0,0|2,0,1]=4 148 B24R4.14279927 Cc1ccc2nc(sc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100010186437 [0,1,0,0,0,0|2,0,0]=3 149 B24R4.14279927 Cc1ccc2nc(sc2c1)NC3CCCc4c3nccc4 27a_100011259139_100010186437 [0,1,0,0,0,0|2,0,0]=3 150 B24R4.14279927 Cc1ccc2nc(sc2c1)NC3CCOc4c3cccc4 27a_100015190321_100010186437 [0,1,0,0,0,0|2,0,0]=3 151 B24R4.14279927 Cc1ccc2nc(sc2c1)NC3CCOc4c3nccc4 27a_100009852857_100010186437 [0,1,0,0,0,0|3,0,0]=4 152 B24R4.14279927 Cc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010186437 [0,1,0,0,0,0|1,0,0]=2 153 B24R4.14279927 Fc1ccc2nc(sc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000751617 [0,1,0,0,0,0|2,0,0]=3 154 B24R4.14279927 Fc1ccc2nc(sc2c1)NC3CCCc4c3nccc4 27a_100011259139_100000751617 [0,1,0,0,0,0|2,0,0]=3 155 B24R4.14279927 Fc1ccc2nc(sc2c1)NC3CCOc4c3cccc4 27a_100015190321_100000751617 [0,1,0,0,0,0|2,0,0]=3 156 B24R4.14279927 Fc1ccc2nc(sc2c1)NC3CCOc4c3nccc4 27a_100009852857_100000751617 [0,1,0,0,0,0|3,0,0]=4 157 B24R4.14279927 Fc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000751617 [0,1,0,0,0,0|1,0,0]=2 158 B24R4.14279927 Fc1ccc2nc(sc2n1)NC3CCCc4c3ccnc4 27a_100020634316_200010738066 [0,1,0,0,0,0|3,0,0]=4 159 B24R4.14279927 Fc1ccc2nc(sc2n1)NC3CCCc4c3nccc4 27a_100011259139_200010738066 [0,1,0,0,0,0|3,0,0]=4 160 B24R4.14279927 Fc1ccc2nc(sc2n1)NC3CCOc4c3cccc4 27a_100015190321_200010738066 [0,1,0,0,0,0|3,0,0]=4 161 B24R4.14279927 Fc1ccc2nc(sc2n1)N[C@H]3CCCc4c3cccc4 27a_100020654734_200010738066 [0,1,0,0,0,0|2,0,0]=3 162 B24R4.14279927 Fc1ccc2sc(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_200010206605 [0,1,0,0,0,0|2,0,0]=3 163 B24R4.14279927 Fc1ccc2sc(nc2c1)NC3CCCc4c3nccc4 27a_100011259139_200010206605 [0,1,0,0,0,0|2,0,0]=3 164 B24R4.14279927 Fc1ccc2sc(nc2c1)NC3CCOc4c3cccc4 27a_100015190321_200010206605 [0,1,0,0,0,0|2,0,0]=3 165 B24R4.14279927 Fc1ccc2sc(nc2c1)NC3CCOc4c3nccc4 27a_100009852857_200010206605 [0,1,0,0,0,0|3,0,0]=4 166 B24R4.14279927 Fc1ccc2sc(nc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_200010206605 [0,1,0,0,0,0|1,0,0]=2 167 B24R4.14279927 Ic1ccc2c(c1)CC(C2)NC3CCCc4c3cccc4 269862a_100015191792_100000210882 [0,1,0,0,0,0|2,0,1]=4 168 B24R4.14279927 Nc1ccc2nc(sc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100010253933 [0,1,0,0,0,0|2,0,0]=3 169 B24R4.14279927 Nc1ccc2nc(sc2c1)NC3CCCc4c3nccc4 27a_100011259139_100010253933 [0,1,0,0,0,0|2,0,0]=3 170 B24R4.14279927 Nc1ccc2nc(sc2c1)NC3CCOc4c3cccc4 27a_100015190321_100010253933 [0,1,0,0,0,0|2,0,0]=3 171 B24R4.14279927 Nc1ccc2nc(sc2c1)NC3CCOc4c3nccc4 27a_100009852857_100010253933 [0,1,0,0,0,0|3,0,0]=4 172 B24R4.14279927 Nc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010253933 [0,1,0,0,0,0|1,0,0]=2 173 B24R4.14279927 Nc1ccc2sc(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100010329861 [0,1,0,0,0,0|2,0,0]=3 174 B24R4.14279927 Nc1ccc2sc(nc2c1)NC3CCCc4c3nccc4 27a_100011259139_100010329861 [0,1,0,0,0,0|2,0,0]=3 175 B24R4.14279927 Nc1ccc2sc(nc2c1)NC3CCOc4c3cccc4 27a_100015190321_100010329861 [0,1,0,0,0,0|2,0,0]=3 176 B24R4.14279927 Nc1ccc2sc(nc2c1)NC3CCOc4c3nccc4 27a_100009852857_100010329861 [0,1,0,0,0,0|3,0,0]=4 177 B24R4.14279927 Nc1ccc2sc(nc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010329861 [0,1,0,0,0,0|1,0,0]=2 178 B24R4.14279927 Oc1ccc2nc(sc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100010063415 [0,1,0,0,0,0|2,0,0]=3 179 B24R4.14279927 Oc1ccc2nc(sc2c1)NC3CCCc4c3nccc4 27a_100011259139_100010063415 [0,1,0,0,0,0|2,0,0]=3 180 B24R4.14279927 Oc1ccc2nc(sc2c1)NC3CCOc4c3cccc4 27a_100015190321_100010063415 [0,1,0,0,0,0|2,0,0]=3 181 B24R4.14279927 Oc1ccc2nc(sc2c1)NC3CCOc4c3nccc4 27a_100009852857_100010063415 [0,1,0,0,0,0|3,0,0]=4 182 B24R4.14279927 Oc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010063415 [0,1,0,0,0,0|1,0,0]=2 183 B24R4.32682920 Fc1cccc2c1C(CCO2)Nc3nc4ccccc4[nH]3 27a_100009881269_100009814255 [0,1,0,0,0,0|1,0,0]=2 184 B24R4.32682920 Fc1cccc2c1C(CCO2)Nc3nc4ccccc4s3 27a_100009881269_100000751744 [0,1,0,0,0,0|2,0,0]=3 185 B24R4.32682920 Fc1cccc2c1C(CCO2)Nc3nc4cccnc4s3 27a_100009881269_100010188088 [0,1,0,0,0,0|3,0,0]=4 186 B24R4.145169885 CN(C1Cc2ccccc2C1)C3CCCc4c3cccc4 269982a_100000185324_100000753484 [0,1,0,0,0,0|2,0,1]=4 187 B24R4.145169885 CN(C1Cc2ccccc2C1)C3CCCc4c3cccc4 34a_100000185324_100000753484 [0,1,0,0,0,0|2,0,1]=4 188 B24R4.145169885 CN(c1nc2ccccc2[nH]1)C3CCCc4c3cccc4 27a_100000185324_100009814255 [0,1,0,0,0,0|0,0,0]=1 189 B24R4.145169885 CN(c1nc2ccccc2s1)C3CCCc4c3cccc4 27a_100000185324_100000751744 [0,1,0,0,0,0|1,0,0]=2 190 B24R4.145169885 CN(c1nc2cccnc2s1)C3CCCc4c3cccc4 27a_100000185324_100010188088 [0,1,0,0,0,0|2,0,0]=3 191 B24R4.145169885 CN(c1nc2cnccn2n1)C3CCCc4c3cccc4 27a_100000185324_100010748104 [0,1,0,0,0,0|2,0,1]=4 192 B22R3.797 CC(Cc1ccccc1)N[C@H]2CCCc3c2cccc3 34a_100020654734_200011218536 [0,0,1,0,0,0|2,0,1]=4 193 B22R3.797 O=C(CC1OCCc2c1cccc2)Nc3ccccc3 11a_100000106764_100000751863 [0,0,1,0,0,0|3,0,0]=4 194 B22R3.797 O=C(CC1OCCc2c1cccc2)Nc3ccccc3 1626a_100000106764_100000751863 [0,0,1,0,0,0|3,0,0]=4 195 B22R3.797 O=C(CC1OCCc2c1cccc2)Nc3ccccc3 22a_100000106764_100000751863 [0,0,1,0,0,0|3,0,0]=4 196 B22R3.797 O=C(CC1OCCc2c1cccc2)Nc3ccccc3 527a_100000106764_100000751863 [0,0,1,0,0,0|3,0,0]=4 197 B22R3.797 O=C(C[n+]1ccccc1)N[C@H]2CCCc3c2cccc3 11a_100020654734_200000086051 [0,0,1,0,0,0|3,0,0]=4 198 B22R3.797 O=C(C[n+]1ccccc1)N[C@H]2CCCc3c2cccc3 240690a_100020654734_200000086051 [0,0,1,0,0,0|3,0,0]=4 199 B22R3.797 O=C(C[n+]1ccccc1)N[C@H]2CCCc3c2cccc3 527a_100020654734_200000086051 [0,0,1,0,0,0|3,0,0]=4 200 B22R3.797 O=C(Cc1ccccn1)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000233486 [0,0,1,0,0,0|3,0,0]=4 201 B22R3.797 O=C(Cc1cccnc1)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000737805 [0,0,1,0,0,0|3,0,0]=4 202 B22R3.797 O=C(Cc1cccnc1)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000737805 [0,0,1,0,0,0|3,0,0]=4 203 B22R3.797 O=C(Cc1cccnc1)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000737805 [0,0,1,0,0,0|3,0,0]=4 204 B22R3.797 O=C(Cc1ccncc1)N[C@H]2CCCc3c2cccc3 11a_100020654734_100011201483 [0,0,1,0,0,0|3,0,0]=4 205 B22R3.797 O=C(Cc1ccncc1)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100011201483 [0,0,1,0,0,0|3,0,0]=4 206 B22R3.797 O=C(Nc1ccccc1)NC2CCCc3c2ccnc3 2430a_100000106764_100020634316 [0,0,1,0,0,0|2,0,0]=3 207 B22R3.797 O=C(Nc1ccccc1)NC2CCCc3c2nccc3 2430a_100000106764_100011259139 [0,0,1,0,0,0|2,0,0]=3 208 B22R3.797 O=C(Nc1ccccc1)NC2CCOc3c2cccc3 2430a_100000106764_100015190321 [0,0,1,0,0,0|2,0,0]=3 209 B22R3.797 O=C(Nc1ccccc1)NC2CCOc3c2nccc3 2430a_100000106764_100009852857 [0,0,1,0,0,0|3,0,0]=4 210 B22R3.797 O=C(Nc1ccccc1)N[C@H]2CCCc3c2cccc3 2430a_100000106764_100020654734 [0,0,1,0,0,0|1,0,0]=2 211 B22R3.18536 Brc1ccccc1C=NNC2CCCc3c2cccc3 4a_100159326319_100000211189 [0,0,1,0,0,0|3,0,0]=4 212 B22R3.18536 Brc1ccccc1CCNC2CCCc3c2cccc3 269862a_100000747383_100000210882 [0,0,1,0,0,0|2,0,1]=4 213 B22R3.18536 Brc1ccccc1CCN[C@H]2CCCc3c2cccc3 34a_100020654734_100012161201 [0,0,1,0,0,0|2,0,1]=4 214 B22R3.18536 Cc1ccccc1C=NNC2CCCc3c2cccc3 4a_100159326319_100000211143 [0,0,1,0,0,0|3,0,0]=4 215 B22R3.18536 Cc1ccccc1CCNC2CCCc3c2cccc3 269862a_100000685071_100000210882 [0,0,1,0,0,0|2,0,1]=4 216 B22R3.18536 Cc1ccccc1CCN[C@H]2CCCc3c2cccc3 34a_100020654734_100011713688 [0,0,1,0,0,0|2,0,1]=4 217 B22R3.18536 Clc1ccccc1C=NNC2CCCc3c2cccc3 4a_100159326319_100000210073 [0,0,1,0,0,0|3,0,0]=4 218 B22R3.18536 Clc1ccccc1CCNC2CCCc3c2cccc3 269862a_100011207228_100000210882 [0,0,1,0,0,0|2,0,1]=4 219 B22R3.18536 Clc1ccccc1CCN[C@H]2CCCc3c2cccc3 270004a_100020654734_200011713468 [0,0,1,0,0,0|2,0,1]=4 220 B22R3.18536 Clc1ccccc1CCN[C@H]2CCCc3c2cccc3 34a_100020654734_100011713703 [0,0,1,0,0,0|2,0,1]=4 221 B22R3.18536 Fc1ccccc1C=NNC2CCCc3c2cccc3 4a_100159326319_100000210811 [0,0,1,0,0,0|3,0,0]=4 222 B22R3.18536 Fc1ccccc1CCNC2CCCc3c2cccc3 269862a_100000185272_100000210882 [0,0,1,0,0,0|2,0,1]=4 223 B22R3.18536 Fc1ccccc1CCN[C@H]2CCCc3c2cccc3 34a_100020654734_100000720011 [0,0,1,0,0,0|2,0,1]=4 224 B22R3.18536 Ic1ccccc1C=NNC2CCCc3c2cccc3 4a_100159326319_100000010305 [0,0,1,0,0,0|3,0,0]=4 225 B22R3.18536 Oc1ccccc1C=NNC2CCCc3c2cccc3 4a_100159326319_100000185834 [0,0,1,0,0,0|3,0,0]=4 226 B22R3.18536 Oc1ccccc1CCNC2CCCc3c2cccc3 269862a_100011207237_100000210882 [0,0,1,0,0,0|2,0,1]=4 227 B22R3.18536 Oc1ccccc1CCN[C@H]2CCCc3c2cccc3 34a_100020654734_100000722297 [0,0,1,0,0,0|2,0,1]=4 228 B22R3.38404 CCCC(NC1Cc2ccccc2C1)c3ccccc3 269862a_100000753258_100000211045 [0,0,1,0,0,0|2,0,1]=4 229 B22R3.38404 CCCC(NC1Cc2ccccc2C1)c3ccccc3 34a_100000189686_100000753484 [0,0,1,0,0,0|2,0,1]=4 230 B22R3.38404 CCCC(Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100000189686_100009814255 [0,0,1,0,0,0|0,0,0]=1 231 B22R3.38404 CCCC(Nc1nc2ccccc2[nH]1)c3cccnc3 27a_100011351308_100009814255 [0,0,1,0,0,0|1,0,0]=2 232 B22R3.38404 CCCC(Nc1nc2ccccc2[nH]1)c3ccncc3 27a_100011351316_100009814255 [0,0,1,0,0,0|1,0,0]=2 233 B22R3.38404 CCCC(Nc1nc2ccccc2s1)c3ccccc3 27a_100000189686_100000751744 [0,0,1,0,0,0|1,0,0]=2 234 B22R3.38404 CCCC(Nc1nc2ccccc2s1)c3cccnc3 27a_100011351308_100000751744 [0,0,1,0,0,0|2,0,0]=3 235 B22R3.38404 CCCC(Nc1nc2ccccc2s1)c3ccncc3 27a_100011351316_100000751744 [0,0,1,0,0,0|2,0,0]=3 236 B22R3.38404 CCCC(Nc1nc2cccnc2s1)c3ccccc3 27a_100000189686_100010188088 [0,0,1,0,0,0|2,0,0]=3 237 B22R3.38404 CCCC(Nc1nc2cccnc2s1)c3cccnc3 27a_100011351308_100010188088 [0,0,1,0,0,0|3,0,0]=4 238 B22R3.38404 CCCC(Nc1nc2cccnc2s1)c3ccncc3 27a_100011351316_100010188088 [0,0,1,0,0,0|3,0,0]=4 239 B22R3.38404 CCCC(Nc1nc2cnccn2n1)c3ccccc3 27a_100000189686_100010748104 [0,0,1,0,0,0|2,0,1]=4 240 B22R3.38404 CCCN(Cc1nc2ccccc2[nH]1)c3ccccc3 2230a_200011218496_100000737899 [0,0,1,0,0,0|2,0,0]=3 241 B22R3.38404 CCCN(Cc1nc2ccccc2[nH]1)c3ccccc3 269982a_200011218496_100000737899 [0,0,1,0,0,0|2,0,0]=3 242 B22R3.38404 CCCN(Cc1nc2ccccc2o1)c3ccccc3 2230a_200011218496_100000195508 [0,0,1,0,0,0|3,0,0]=4 243 B22R3.38404 CCCN(Cc1nc2ccccc2o1)c3ccccc3 34a_200011218496_200012361514 [0,0,1,0,0,0|3,0,0]=4 244 B22R3.38404 CCCN(Cc1nc2ccccc2s1)c3ccccc3 2230a_200011218496_100000766747 [0,0,1,0,0,0|3,0,0]=4 245 B22R3.38404 CCCN(Cc1nc2ccccc2s1)c3ccccc3 269982a_200011218496_100011217541 [0,0,1,0,0,0|3,0,0]=4 246 B22R3.38404 CCCN(Cc1nc2ccccc2s1)c3ccccc3 34a_200011218496_100011217541 [0,0,1,0,0,0|3,0,0]=4 247 B22R3.38404 CCCN(Cc1nc2cccnc2[nH]1)c3ccccc3 2230a_200011218496_100011549802 [0,0,1,0,0,0|3,0,0]=4 248 B22R3.38404 COC[C@@H](Nc1nc2ccccc2[nH]1)c3ccccc3 27a_103619048568_100009814255 [0,0,1,0,0,0|1,0,0]=2 249 B22R3.38404 COC[C@@H](Nc1nc2ccccc2s1)c3ccccc3 27a_103619048568_100000751744 [0,0,1,0,0,0|2,0,0]=3 250 B22R3.38404 COC[C@@H](Nc1nc2cccnc2s1)c3ccccc3 27a_103619048568_100010188088 [0,0,1,0,0,0|3,0,0]=4 251 B22R3.38404 ClCCC(Sc1cc2ccccc2[nH]1)c3ccccc3 62a_200010132975_100010232065 [0,0,1,0,0,0|3,0,0]=4 252 B22R3.38404 ClCCC(Sc1nc2ccccc2[nH]1)c3ccccc3 62a_200010132975_100009814255 [0,0,1,0,0,0|2,0,0]=3 253 B22R3.38404 ClCCC(Sc1nc2ccccc2s1)c3ccccc3 62a_200010132975_100000751744 [0,0,1,0,0,0|3,0,0]=4 254 B22R3.38404 OCCN(Cc1nc2ccccc2[nH]1)c3ccccc3 2230a_100000211345_100000737899 [0,0,1,0,0,0|3,0,0]=4 255 B22R3.38404 OCCN(Cc1nc2ccccc2[nH]1)c3ccccc3 269982a_100000211345_100000737899 [0,0,1,0,0,0|3,0,0]=4 256 B22R3.38404 OCC[C@H](Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100025705951_100009814255 [0,0,1,0,0,0|1,0,0]=2 257 B22R3.38404 OCC[C@H](Nc1nc2ccccc2s1)c3ccccc3 27a_100025705951_100000751744 [0,0,1,0,0,0|2,0,0]=3 258 B22R3.38404 OCC[C@H](Nc1nc2cccnc2s1)c3ccccc3 27a_100025705951_100010188088 [0,0,1,0,0,0|3,0,0]=4 259 B22R3.816194 BrCCc1ccccc1OCc2nc3ccccc3[nH]2 7a_100000722297_100000737899 [0,0,1,0,0,0|3,0,0]=4 260 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3[nH]2 207a_100000737634_100000185668 [0,0,1,0,0,0|2,0,0]=3 261 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3[nH]2 2230a_100000737634_100000737899 [0,0,1,0,0,0|2,0,0]=3 262 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3[nH]2 7a_100000737634_100000737899 [0,0,1,0,0,0|2,0,0]=3 263 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3o2 2230a_100000737634_100000195508 [0,0,1,0,0,0|3,0,0]=4 264 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3o2 34a_100000737634_200012361514 [0,0,1,0,0,0|3,0,0]=4 265 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3o2 7a_100000737634_100000195508 [0,0,1,0,0,0|3,0,0]=4 266 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3s2 2230a_100000737634_100000766747 [0,0,1,0,0,0|3,0,0]=4 267 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3s2 270302a_100000737634_100011204187 [0,0,1,0,0,0|3,0,0]=4 268 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3s2 34a_100000737634_100011217541 [0,0,1,0,0,0|3,0,0]=4 269 B22R3.816194 CCCc1ccccc1NCc2nc3ccccc3s2 7a_100000737634_100011217541 [0,0,1,0,0,0|3,0,0]=4 270 B22R3.816194 CCCc1ccccc1NCc2nc3cccnc3[nH]2 2230a_100000737634_100011549802 [0,0,1,0,0,0|3,0,0]=4 271 B22R3.816194 CCCc1ccccc1NCc2nc3cccnc3[nH]2 7a_100000737634_100011549802 [0,0,1,0,0,0|3,0,0]=4 272 B22R3.816194 CCCc1ccccc1OCc2nc3ccccc3[nH]2 7a_100011217252_100000737899 [0,0,1,0,0,0|2,0,0]=3 273 B22R3.816194 CCCc1ccccc1OCc2nc3ccccc3o2 34a_100011217252_200012361514 [0,0,1,0,0,0|3,0,0]=4 274 B22R3.816194 CCCc1ccccc1OCc2nc3ccccc3o2 7a_100011217252_100000195508 [0,0,1,0,0,0|3,0,0]=4 275 B22R3.816194 CCCc1ccccc1OCc2nc3ccccc3s2 34a_100011217252_100011217541 [0,0,1,0,0,0|3,0,0]=4 276 B22R3.816194 CCCc1ccccc1OCc2nc3ccccc3s2 7a_100011217252_100011217541 [0,0,1,0,0,0|3,0,0]=4 277 B22R3.816194 CCCc1ccccc1OCc2nc3cccnc3[nH]2 7a_100011217252_100011549802 [0,0,1,0,0,0|3,0,0]=4 278 B22R3.816194 CCNc1ccccc1OCc2nc3ccccc3[nH]2 7a_103624766699_100000737899 [0,0,1,0,0,0|3,0,0]=4 279 B22R3.816194 CCNc1ccccc1SCc2nc3ccccc3[nH]2 62a_114873767003_100000737899 [0,0,1,0,0,0|3,0,0]=4 280 B22R3.816194 CCOc1ccccc1CNc2nc3ccccc3[nH]2 27a_100000188671_100009814255 [0,0,1,0,0,0|1,0,0]=2 281 B22R3.816194 CCOc1ccccc1CNc2nc3ccccc3s2 27a_100000188671_100000751744 [0,0,1,0,0,0|2,0,0]=3 282 B22R3.816194 CCOc1ccccc1CNc2nc3cccnc3s2 27a_100000188671_100010188088 [0,0,1,0,0,0|3,0,0]=4 283 B22R3.816194 CCOc1ccccc1NCc2nc3ccccc3[nH]2 207a_100000211218_100000185668 [0,0,1,0,0,0|3,0,0]=4 284 B22R3.816194 CCOc1ccccc1OCc2nc3ccccc3[nH]2 7a_100000211404_100000737899 [0,0,1,0,0,0|3,0,0]=4 285 B22R3.816194 CCOc1ccccc1SCc2nc3ccccc3[nH]2 62a_100000230754_100000737899 [0,0,1,0,0,0|3,0,0]=4 286 B22R3.816194 CCOc1ncccc1CNc2nc3ccccc3[nH]2 27a_100000737023_100009814255 [0,0,1,0,0,0|2,0,0]=3 287 B22R3.816194 CCOc1ncccc1CNc2nc3ccccc3s2 27a_100000737023_100000751744 [0,0,1,0,0,0|3,0,0]=4 288 B22R3.816194 CCSc1ccccc1NCc2nc3ccccc3[nH]2 207a_100011223125_100000185668 [0,0,1,0,0,0|3,0,0]=4 289 B22R3.816194 CCSc1ccccc1SCc2nc3ccccc3[nH]2 62a_100000230856_100000737899 [0,0,1,0,0,0|3,0,0]=4 290 B22R3.816194 CNCc1ccccc1SCc2nc3ccccc3[nH]2 62a_100000184654_100000737899 [0,0,1,0,0,0|3,0,0]=4 291 B22R3.816194 COCc1ccccc1OCc2nc3ccccc3[nH]2 7a_100011488565_100000737899 [0,0,1,0,0,0|3,0,0]=4 292 B22R3.816194 COCc1ccccc1SCc2nc3ccccc3[nH]2 62a_100011493684_100000737899 [0,0,1,0,0,0|3,0,0]=4 293 B22R3.816194 CSCc1ccccc1SCc2nc3ccccc3[nH]2 62a_100000148299_100000737899 [0,0,1,0,0,0|3,0,0]=4 294 B22R3.816194 N#CCc1ccccc1CSc2nc3ccccc3[nH]2 62a_100010402002_100009814255 [0,0,1,0,0,0|2,0,1]=4 295 B22R3.816194 NCCc1ccccc1SCc2nc3ccccc3[nH]2 62a_100000747383_100000737899 [0,0,1,0,0,0|3,0,0]=4 296 B22R3.816194 OCCc1ccccc1NCc2nc3ccccc3[nH]2 207a_100011215289_100000185668 [0,0,1,0,0,0|3,0,0]=4 297 B22R3.816194 OCCc1ccccc1NCc2nc3ccccc3[nH]2 2230a_100011215289_100000737899 [0,0,1,0,0,0|3,0,0]=4 298 B22R3.816194 OCCc1ccccc1OCc2nc3ccccc3[nH]2 7a_100000719421_100000737899 [0,0,1,0,0,0|3,0,0]=4 299 B22R3.816194 OCCc1ccccc1SCc2nc3ccccc3[nH]2 62a_100000731337_100000737899 [0,0,1,0,0,0|3,0,0]=4 300 B22R3.1416235 CCC(NC1Cc2ccccc2C1)c3ccccc3C 269862a_100000753258_100011350723 [0,0,1,0,0,0|2,0,1]=4 301 B22R3.1416235 CCC(Nc1nc2ccccc2[nH]1)c3ncccc3C 27a_200011536107_100009814255 [0,0,1,0,0,0|1,0,0]=2 302 B22R3.1416235 CCC(Nc1nc2ccccc2s1)c3ncccc3C 27a_200011536107_100000751744 [0,0,1,0,0,0|2,0,0]=3 303 B22R3.1416235 CCC(Nc1nc2cccnc2s1)c3ncccc3C 27a_200011536107_100010188088 [0,0,1,0,0,0|3,0,0]=4 304 B22R3.1416235 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3Br 2230a_114873767003_100000737899 [0,0,1,0,0,0|3,0,0]=4 305 B22R3.1416235 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3Br 269982a_114873767003_100000737899 [0,0,1,0,0,0|3,0,0]=4 306 B22R3.1416235 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3C 2230a_100000211084_100000737899 [0,0,1,0,0,0|2,0,0]=3 307 B22R3.1416235 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3C 269982a_100000211084_100000737899 [0,0,1,0,0,0|2,0,0]=3 308 B22R3.1416235 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3F 2230a_100000220365_100000737899 [0,0,1,0,0,0|3,0,0]=4 309 B22R3.1416235 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3F 269982a_100000220365_100000737899 [0,0,1,0,0,0|3,0,0]=4 310 B22R3.1416235 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3O 269982a_103624766699_100000737899 [0,0,1,0,0,0|3,0,0]=4 311 B22R3.1416235 CCN(Cc1nc2ccccc2o1)c3ccccc3C 2230a_100000211084_100000195508 [0,0,1,0,0,0|3,0,0]=4 312 B22R3.1416235 CCN(Cc1nc2ccccc2o1)c3ccccc3C 34a_100000211084_200012361514 [0,0,1,0,0,0|3,0,0]=4 313 B22R3.1416235 CCN(Cc1nc2ccccc2s1)c3ccccc3C 2230a_100000211084_100000766747 [0,0,1,0,0,0|3,0,0]=4 314 B22R3.1416235 CCN(Cc1nc2ccccc2s1)c3ccccc3C 269982a_100000211084_100011217541 [0,0,1,0,0,0|3,0,0]=4 315 B22R3.1416235 CCN(Cc1nc2ccccc2s1)c3ccccc3C 34a_100000211084_100011217541 [0,0,1,0,0,0|3,0,0]=4 316 B22R3.1416235 CCN(Cc1nc2cccnc2[nH]1)c3ccccc3C 2230a_100000211084_100011549802 [0,0,1,0,0,0|3,0,0]=4 317 B22R3.1416235 CC[C@H](Nc1nc2ccccc2[nH]1)c3ccccc3Cl 27a_200016987949_100009814255 [0,0,1,0,0,0|1,0,0]=2 318 B22R3.1416235 CC[C@H](Nc1nc2ccccc2[nH]1)c3ccccc3F 27a_100015190424_100009814255 [0,0,1,0,0,0|1,0,0]=2 319 B22R3.1416235 CC[C@H](Nc1nc2ccccc2s1)c3ccccc3Cl 27a_200016987949_100000751744 [0,0,1,0,0,0|2,0,0]=3 320 B22R3.1416235 CC[C@H](Nc1nc2ccccc2s1)c3ccccc3F 27a_100015190424_100000751744 [0,0,1,0,0,0|2,0,0]=3 321 B22R3.1416235 CC[C@H](Nc1nc2cccnc2s1)c3ccccc3Cl 27a_200016987949_100010188088 [0,0,1,0,0,0|3,0,0]=4 322 B22R3.1416235 CC[C@H](Nc1nc2cccnc2s1)c3ccccc3F 27a_100015190424_100010188088 [0,0,1,0,0,0|3,0,0]=4 323 B22R3.1416235 OCC(Nc1nc2ccccc2[nH]1)c3ccccc3Cl 27a_100138412506_100009814255 [0,0,1,0,0,0|2,0,0]=3 324 B22R3.1416235 OCC(Nc1nc2ccccc2[nH]1)c3ccncc3Cl 27a_200020642286_100009814255 [0,0,1,0,0,0|3,0,0]=4 325 B22R3.1416235 OCC(Nc1nc2ccccc2s1)c3ccccc3Cl 27a_100138412506_100000751744 [0,0,1,0,0,0|3,0,0]=4 326 B22R3.1416235 OC[C@@H](Nc1nc2ccccc2[nH]1)c3ccccc3Br 27a_100161155918_100009814255 [0,0,1,0,0,0|2,0,0]=3 327 B22R3.1416235 OC[C@@H](Nc1nc2ccccc2s1)c3ccccc3Br 27a_100161155918_100000751744 [0,0,1,0,0,0|3,0,0]=4 328 B22R3.1416235 OC[C@H](Nc1nc2ccccc2[nH]1)c3ccccc3F 27a_100009818778_100009814255 [0,0,1,0,0,0|2,0,0]=3 329 B22R3.1416235 OC[C@H](Nc1nc2ccccc2s1)c3ccccc3F 27a_100009818778_100000751744 [0,0,1,0,0,0|3,0,0]=4 330 B22R3.3018238 C(=Cc1nc2ccccc2[nH]1)COCc3ccccc3 271570a_200011106559_100009814255 [0,0,1,0,0,0|2,0,1]=4 331 B22R3.3018238 C(=NNCCc1ccccc1)c2nc3ccccc3[nH]2 4a_100000740470_100000185668 [0,0,1,0,0,0|3,0,0]=4 332 B22R3.3018238 C(=NNc1nc2ccccc2[nH]1)CCc3ccccc3 4a_100000188875_100000198083 [0,0,1,0,0,0|1,0,1]=3 333 B22R3.3018238 C(=NNc1nc2ccccc2[nH]1)COc3ccccc3 4a_100000188875_100000758736 [0,0,1,0,0,0|2,0,1]=4 334 B22R3.3018238 C(=NNc1nc2ccccc2o1)CCc3ccccc3 4a_100000182307_100000198083 [0,0,1,0,0,0|2,0,1]=4 335 B22R3.3018238 C(=NNc1nc2ccccc2s1)CCc3ccccc3 4a_100000181811_100000198083 [0,0,1,0,0,0|2,0,1]=4 336 B22R3.3018238 c1ccc(cc1)CCCCNC2Cc3ccccc3C2 2230a_100000753258_100000701786 [0,0,1,0,0,0|2,0,1]=4 337 B22R3.3018238 c1ccc(cc1)CCCCNC2Cc3ccccc3C2 34a_100000753258_100000701786 [0,0,1,0,0,0|2,0,1]=4 338 B22R3.3018238 c1ccc(cc1)CCCCNC2Cc3ccccc3C2 34a_100015280158_100000753484 [0,0,1,0,0,0|2,0,1]=4 339 B22R3.3018238 c1ccc(cc1)CCCCNc2nc3ccccc3[nH]2 27a_100015280158_100009814255 [0,0,1,0,0,0|0,0,0]=1 340 B22R3.3018238 c1ccc(cc1)CCCCNc2nc3ccccc3s2 27a_100015280158_100000751744 [0,0,1,0,0,0|1,0,0]=2 341 B22R3.3018238 c1ccc(cc1)CCCCNc2nc3cccnc3s2 27a_100015280158_100010188088 [0,0,1,0,0,0|2,0,0]=3 342 B22R3.3018238 c1ccc(cc1)CCCCNc2nc3cnccn3n2 27a_100015280158_100010748104 [0,0,1,0,0,0|2,0,1]=4 343 B22R3.3018238 c1ccc(cc1)CCCCSc2cc3ccccc3[nH]2 62a_100000701786_100010232065 [0,0,1,0,0,0|2,0,0]=3 344 B22R3.3018238 c1ccc(cc1)CCCCSc2cc3ccccc3o2 62a_100000701786_100010159458 [0,0,1,0,0,0|3,0,0]=4 345 B22R3.3018238 c1ccc(cc1)CCCCSc2cc3cccnc3[nH]2 62a_100000701786_100010079843 [0,0,1,0,0,0|3,0,0]=4 346 B22R3.3018238 c1ccc(cc1)CCCCSc2cn3ccccc3n2 62a_100000701786_100009819586 [0,0,1,0,0,0|3,0,0]=4 347 B22R3.3018238 c1ccc(cc1)CCCCSc2nc3ccccc3[nH]2 62a_100000701786_100009814255 [0,0,1,0,0,0|1,0,0]=2 348 B22R3.3018238 c1ccc(cc1)CCCCSc2nc3ccccc3s2 62a_100000701786_100000751744 [0,0,1,0,0,0|2,0,0]=3 349 B22R3.3018238 c1ccc(cc1)CCCCSc2nc3cccnc3s2 62a_100000701786_100010188088 [0,0,1,0,0,0|3,0,0]=4 350 B22R3.3018238 c1ccc(cc1)CCCCSc2nc3cccnc3s2 62a_100010188088_100000701786 [0,0,1,0,0,0|3,0,0]=4 351 B22R3.3018238 c1ccc(cc1)CCCNCc2cc3ccccc3[nH]2 270004a_100000211184_100000051030 [0,0,1,0,0,0|3,0,0]=4 352 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 207a_100000211184_100000185668 [0,0,1,0,0,0|2,0,0]=3 353 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 2230a_100000211184_100000737899 [0,0,1,0,0,0|2,0,0]=3 354 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 270004a_100000211184_100000185668 [0,0,1,0,0,0|2,0,0]=3 355 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3ccccc3o2 2230a_100000211184_100000195508 [0,0,1,0,0,0|3,0,0]=4 356 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3ccccc3o2 34a_100000211184_200012361514 [0,0,1,0,0,0|3,0,0]=4 357 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3ccccc3s2 2230a_100000211184_100000766747 [0,0,1,0,0,0|3,0,0]=4 358 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3ccccc3s2 270004a_100000211184_100011204187 [0,0,1,0,0,0|3,0,0]=4 359 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3ccccc3s2 34a_100000211184_100011217541 [0,0,1,0,0,0|3,0,0]=4 360 B22R3.3018238 c1ccc(cc1)CCCNCc2nc3cccnc3[nH]2 2230a_100000211184_100011549802 [0,0,1,0,0,0|3,0,0]=4 361 B22R3.3018238 c1ccc(cc1)CCCOCc2nc3ccccc3[nH]2 7a_100000210828_100000737899 [0,0,1,0,0,0|2,0,0]=3 362 B22R3.3018238 c1ccc(cc1)CCCOCc2nc3ccccc3o2 34a_100000210828_200012361514 [0,0,1,0,0,0|3,0,0]=4 363 B22R3.3018238 c1ccc(cc1)CCCOCc2nc3ccccc3o2 7a_100000210828_100000195508 [0,0,1,0,0,0|3,0,0]=4 364 B22R3.3018238 c1ccc(cc1)CCCOCc2nc3ccccc3s2 34a_100000210828_100011217541 [0,0,1,0,0,0|3,0,0]=4 365 B22R3.3018238 c1ccc(cc1)CCCOCc2nc3ccccc3s2 7a_100000210828_100011217541 [0,0,1,0,0,0|3,0,0]=4 366 B22R3.3018238 c1ccc(cc1)CCCOCc2nc3cccnc3[nH]2 7a_100000210828_100011549802 [0,0,1,0,0,0|3,0,0]=4 367 B22R3.3018238 c1ccc(cc1)CCCSCc2nc3ccccc3[nH]2 62a_100000211621_100000737899 [0,0,1,0,0,0|2,0,0]=3 368 B22R3.3018238 c1ccc(cc1)CCCSCc2nc3ccccc3o2 62a_100000211621_100000195508 [0,0,1,0,0,0|3,0,0]=4 369 B22R3.3018238 c1ccc(cc1)CCCSCc2nc3ccccc3s2 62a_100000211621_100000766747 [0,0,1,0,0,0|3,0,0]=4 370 B22R3.3018238 c1ccc(cc1)CCCSCc2nc3ccccc3s2 62a_100011217541_100000211621 [0,0,1,0,0,0|3,0,0]=4 371 B22R3.3018238 c1ccc(cc1)CCCSCc2nc3cccnc3[nH]2 62a_100011549802_100000211621 [0,0,1,0,0,0|3,0,0]=4 372 B22R3.3018238 c1ccc(cc1)CCOCCc2nc3ccccc3[nH]2 7a_100000210268_100015206048 [0,0,1,0,0,0|2,0,0]=3 373 B22R3.3018238 c1ccc(cc1)CCSCCc2nc3ccccc3[nH]2 62a_100000765856_100015206048 [0,0,1,0,0,0|2,0,0]=3 374 B22R3.3018238 c1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100015611070 [0,0,1,0,0,0|2,0,0]=3 375 B22R3.3018238 c1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100015611070 [0,0,1,0,0,0|2,0,0]=3 376 B22R3.3018238 c1ccc(cc1)CNCCSc2nc3ccccc3o2 207a_100015185336_100015611070 [0,0,1,0,0,0|3,0,0]=4 377 B22R3.3018238 c1ccc(cc1)CNCCSc2nc3ccccc3o2 270004a_100015185336_100015611070 [0,0,1,0,0,0|3,0,0]=4 378 B22R3.3018238 c1ccc(cc1)COCCNc2nc3ccccc3[nH]2 27a_100000753106_100009814255 [0,0,1,0,0,0|1,0,0]=2 379 B22R3.3018238 c1ccc(cc1)COCCNc2nc3ccccc3s2 27a_100000753106_100000751744 [0,0,1,0,0,0|2,0,0]=3 380 B22R3.3018238 c1ccc(cc1)COCCNc2nc3cccnc3s2 27a_100000753106_100010188088 [0,0,1,0,0,0|3,0,0]=4 381 B22R3.3018238 c1ccc(cc1)COCCSc2cc3ccccc3[nH]2 62a_100000234347_100010232065 [0,0,1,0,0,0|3,0,0]=4 382 B22R3.3018238 c1ccc(cc1)COCCSc2nc3ccccc3[nH]2 62a_100000234347_100009814255 [0,0,1,0,0,0|2,0,0]=3 383 B22R3.3018238 c1ccc(cc1)COCCSc2nc3ccccc3s2 62a_100000234347_100000751744 [0,0,1,0,0,0|3,0,0]=4 384 B22R3.3018238 c1ccc(cc1)COCSCc2nc3ccccc3[nH]2 62a_100000763385_100000737899 [0,0,1,0,0,0|3,0,0]=4 385 B22R3.3018238 c1ccc(cc1)CSCCNc2nc3ccccc3[nH]2 27a_100000189534_100009814255 [0,0,1,0,0,0|1,0,0]=2 386 B22R3.3018238 c1ccc(cc1)CSCCNc2nc3ccccc3s2 27a_100000189534_100000751744 [0,0,1,0,0,0|2,0,0]=3 387 B22R3.3018238 c1ccc(cc1)CSCCNc2nc3cccnc3s2 27a_100000189534_100010188088 [0,0,1,0,0,0|3,0,0]=4 388 B22R3.3018238 c1ccc(cc1)CSCCSc2cc3ccccc3[nH]2 62a_200011297719_100010232065 [0,0,1,0,0,0|3,0,0]=4 389 B22R3.3018238 c1ccc(cc1)CSCCSc2nc3ccccc3[nH]2 62a_200011297719_100009814255 [0,0,1,0,0,0|2,0,0]=3 390 B22R3.3018238 c1ccc(cc1)CSCCSc2nc3ccccc3s2 62a_200011297719_100000751744 [0,0,1,0,0,0|3,0,0]=4 391 B22R3.3018238 c1ccc(cc1)CSCSCc2nc3ccccc3[nH]2 62a_200011217039_100000737899 [0,0,1,0,0,0|3,0,0]=4 392 B22R3.3018238 c1ccc(cc1)OCCCNc2nc3ccccc3[nH]2 27a_100000216521_100009814255 [0,0,1,0,0,0|1,0,0]=2 393 B22R3.3018238 c1ccc(cc1)OCCCNc2nc3ccccc3s2 27a_100000216521_100000751744 [0,0,1,0,0,0|2,0,0]=3 394 B22R3.3018238 c1ccc(cc1)OCCCNc2nc3cccnc3s2 27a_100000216521_100010188088 [0,0,1,0,0,0|3,0,0]=4 395 B22R3.3018238 c1ccc(cc1)OCCCSc2cc3ccccc3[nH]2 62a_100000199009_100010232065 [0,0,1,0,0,0|3,0,0]=4 396 B22R3.3018238 c1ccc(cc1)OCCCSc2nc3ccccc3[nH]2 62a_100000199009_100009814255 [0,0,1,0,0,0|2,0,0]=3 397 B22R3.3018238 c1ccc(cc1)OCCCSc2nc3ccccc3s2 62a_100000199009_100000751744 [0,0,1,0,0,0|3,0,0]=4 398 B22R3.3018238 c1ccc(cc1)OCCNCc2nc3ccccc3[nH]2 207a_100000174943_100000185668 [0,0,1,0,0,0|3,0,0]=4 399 B22R3.3018238 c1ccc(cc1)OCCNCc2nc3ccccc3[nH]2 2230a_100000174943_100000737899 [0,0,1,0,0,0|3,0,0]=4 400 B22R3.3018238 c1ccc(cc1)OCCNCc2nc3ccccc3[nH]2 270004a_100000174943_100000185668 [0,0,1,0,0,0|3,0,0]=4 401 B22R3.3018238 c1ccc(cc1)OCCNCc2nc3ccccc3[nH]2 270004a_100000729406_100000758736 [0,0,1,0,0,0|3,0,0]=4 402 B22R3.3018238 c1ccc(cc1)OCCOCc2nc3ccccc3[nH]2 7a_100000210260_100000737899 [0,0,1,0,0,0|3,0,0]=4 403 B22R3.3018238 c1ccc(cc1)OCCSCc2nc3ccccc3[nH]2 62a_100000184471_100000737899 [0,0,1,0,0,0|3,0,0]=4 404 B22R3.3018238 c1ccc(cc1)SCCCNc2nc3ccccc3[nH]2 27a_100000184639_100009814255 [0,0,1,0,0,0|1,0,0]=2 405 B22R3.3018238 c1ccc(cc1)SCCCNc2nc3ccccc3s2 27a_100000184639_100000751744 [0,0,1,0,0,0|2,0,0]=3 406 B22R3.3018238 c1ccc(cc1)SCCCNc2nc3cccnc3s2 27a_100000184639_100010188088 [0,0,1,0,0,0|3,0,0]=4 407 B22R3.3018238 c1ccc(cc1)SCCCSc2cc3ccccc3[nH]2 62a_200011203293_100010232065 [0,0,1,0,0,0|3,0,0]=4 408 B22R3.3018238 c1ccc(cc1)SCCCSc2nc3ccccc3[nH]2 62a_200011203293_100009814255 [0,0,1,0,0,0|2,0,0]=3 409 B22R3.3018238 c1ccc(cc1)SCCCSc2nc3ccccc3s2 62a_200011203293_100000751744 [0,0,1,0,0,0|3,0,0]=4 410 B22R3.3018238 c1ccc(cc1)SCCNCc2nc3ccccc3[nH]2 207a_100000189519_100000185668 [0,0,1,0,0,0|3,0,0]=4 411 B22R3.3018238 c1ccc(cc1)SCCNCc2nc3ccccc3[nH]2 2230a_100000189519_100000737899 [0,0,1,0,0,0|3,0,0]=4 412 B22R3.3018238 c1ccc(cc1)SCCNCc2nc3ccccc3[nH]2 270004a_100000189519_100000185668 [0,0,1,0,0,0|3,0,0]=4 413 B22R3.3018238 c1ccc(cc1)SCCOCc2nc3ccccc3[nH]2 7a_100000230494_100000737899 [0,0,1,0,0,0|3,0,0]=4 414 B22R3.3018238 c1ccc(cc1)SCCSCc2nc3ccccc3[nH]2 62a_100000246102_100000737899 [0,0,1,0,0,0|3,0,0]=4 415 B22R3.3018238 c1ccc(cc1)SCSCCc2nc3ccccc3[nH]2 62a_100011218342_100015206048 [0,0,1,0,0,0|3,0,0]=4 416 B22R3.3018238 c1ccc(nc1)CCCNCc2nc3ccccc3[nH]2 207a_100000689020_100000185668 [0,0,1,0,0,0|3,0,0]=4 417 B22R3.3018238 c1ccc(nc1)CCCNCc2nc3ccccc3[nH]2 270004a_100000689020_100000185668 [0,0,1,0,0,0|3,0,0]=4 418 B22R3.3018238 c1ccc(nc1)CCSCCc2nc3ccccc3[nH]2 62a_100015183660_100015206048 [0,0,1,0,0,0|3,0,0]=4 419 B22R3.3018238 c1ccc(nc1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000209966 [0,0,1,0,0,0|3,0,0]=4 420 B22R3.3018238 c1ccc(nc1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000209966 [0,0,1,0,0,0|3,0,0]=4 421 B22R3.3018238 c1ccc2[nH]c(cc2c1)SCCCCc3ccncc3 62a_100020630000_100010232065 [0,0,1,0,0,0|3,0,0]=4 422 B22R3.3018238 c1ccc2[nH]c(nc2c1)CCCNCc3ccncc3 207a_100000734966_100000186114 [0,0,1,0,0,0|3,0,0]=4 423 B22R3.3018238 c1ccc2[nH]c(nc2c1)CCSCCc3ccncc3 62a_100000723409_100015206048 [0,0,1,0,0,0|3,0,0]=4 424 B22R3.3018238 c1ccc2[nH]c(nc2c1)CNCCCc3ccncc3 207a_100011275580_100000185668 [0,0,1,0,0,0|3,0,0]=4 425 B22R3.3018238 c1ccc2[nH]c(nc2c1)CNCCCc3ccncc3 2230a_100011275580_100000737899 [0,0,1,0,0,0|3,0,0]=4 426 B22R3.3018238 c1ccc2[nH]c(nc2c1)CNCCCc3ccncc3 270004a_100011275580_100000185668 [0,0,1,0,0,0|3,0,0]=4 427 B22R3.3018238 c1ccc2[nH]c(nc2c1)SCCCCc3ccncc3 62a_100020630000_100009814255 [0,0,1,0,0,0|2,0,0]=3 428 B22R3.3018238 c1ccc2sc(nc2c1)SCCCCc3ccncc3 62a_100020630000_100000751744 [0,0,1,0,0,0|3,0,0]=4 429 B22R3.3018238 c1cncc(c1)CCCNCc2nc3ccccc3[nH]2 207a_100011532358_100000185668 [0,0,1,0,0,0|3,0,0]=4 430 B22R3.3018238 c1cncc(c1)CCCNCc2nc3ccccc3[nH]2 2230a_100011532358_100000737899 [0,0,1,0,0,0|3,0,0]=4 431 B22R3.3018238 c1cncc(c1)CCCNCc2nc3ccccc3[nH]2 270004a_100011532358_100000185668 [0,0,1,0,0,0|3,0,0]=4 432 B22R3.3018238 c1cncc(c1)CCSCCc2nc3ccccc3[nH]2 62a_200011713674_100015206048 [0,0,1,0,0,0|3,0,0]=4 433 B22R3.3018238 c1cncc(c1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000209961 [0,0,1,0,0,0|3,0,0]=4 434 B22R3.3018238 c1cncc(c1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000209961 [0,0,1,0,0,0|3,0,0]=4 435 B22R3.3768459 CC(Nc1nc2ccccc2[nH]1)c3ccccc3C#N 27a_100160469468_100009814255 [0,0,1,0,0,0|1,0,1]=3 436 B22R3.3768459 CC(Nc1nc2ccccc2s1)c3ccccc3C#N 27a_100160469468_100000751744 [0,0,1,0,0,0|2,0,1]=4 437 B22R3.3768459 CCc1ccccc1C(=O)Cc2nc3ccccc3[nH]2 1458a_100000689120_100000737899 [0,0,1,0,0,0|2,0,1]=4 438 B22R3.3768459 COc1ccccc1C(C)Nc2nc3ccccc3[nH]2 27a_100000185323_100009814255 [0,0,1,0,0,0|1,0,0]=2 439 B22R3.3768459 COc1ccccc1C(C)Nc2nc3ccccc3s2 27a_100000185323_100000751744 [0,0,1,0,0,0|2,0,0]=3 440 B22R3.3768459 COc1ccccc1C(C)Nc2nc3cccnc3s2 27a_100000185323_100010188088 [0,0,1,0,0,0|3,0,0]=4 441 B22R3.3768459 COc1ccccc1N(C)Cc2nc3ccccc3[nH]2 2230a_100000219746_100000737899 [0,0,1,0,0,0|3,0,0]=4 442 B22R3.3768459 COc1ccccc1N(C)Cc2nc3ccccc3[nH]2 269982a_100000219746_100000737899 [0,0,1,0,0,0|3,0,0]=4 443 B22R4.1716 c1ccc2c(c1)CCCC2OC3Cc4c3cccc4 7a_100000183665_100009813401 [0,0,0,0,1,0|2,0,1]=4 444 B22R4.4503 c1ccc2c(c1)CC(C2)NC3CCc4c3cccc4 2230a_100000753258_200000721974 [0,0,0,0,1,0|2,0,1]=4 445 B22R4.4503 c1ccc2c(c1)CC(C2)NC3CCc4c3cccc4 269862a_100000753258_100000212051 [0,0,0,0,1,0|2,0,1]=4 446 B22R4.4503 c1ccc2c(c1)CC(C2)N[C@H]3CCc4c3cccc4 34a_100016989578_100000753484 [0,0,0,0,1,0|2,0,1]=4 447 B22R4.4503 c1ccc2c(c1)CCC2Sc3nc4cccnc4s3 62a_100010188088_200000721974 [0,0,0,0,1,0|3,0,0]=4 448 B22R4.4503 c1ccc2c(c1)CC[C@@H]2Nc3nc4ccccc4[nH]3 27a_100016989578_100009814255 [0,0,0,0,1,0|0,0,0]=1 449 B22R4.4503 c1ccc2c(c1)CC[C@@H]2Nc3nc4ccccc4s3 27a_100016989578_100000751744 [0,0,0,0,1,0|1,0,0]=2 450 B22R4.4503 c1ccc2c(c1)CC[C@@H]2Nc3nc4cccnc4s3 27a_100016989578_100010188088 [0,0,0,0,1,0|2,0,0]=3 451 B22R4.4503 c1ccc2c(c1)CC[C@@H]2Nc3nc4cnccn4n3 27a_100016989578_100010748104 [0,0,0,0,1,0|2,0,1]=4 452 B22R4.4503 c1ccc2c(c1)OCC2Nc3nc4ccccc4[nH]3 27a_100000747519_100009814255 [0,0,0,0,1,0|1,0,0]=2 453 B22R4.4503 c1ccc2c(c1)OCC2Nc3nc4ccccc4s3 27a_100000747519_100000751744 [0,0,0,0,1,0|2,0,0]=3 454 B22R4.4503 c1ccc2c(c1)OCC2Nc3nc4cccnc4s3 27a_100000747519_100010188088 [0,0,0,0,1,0|3,0,0]=4 455 B22R4.4561 c1ccc2c(c1)CCC[C@@H]2Nc3nn4ccnc4s3 27a_100020654734_100011333511 [0,0,0,0,1,0|3,0,0]=4 456 B24R4.1620053 c1ccc2c(c1)CC(C2)NC3CCCCc4c3cccc4 269862a_100000753258_100000184060 [0,0,0,0,0,1|2,0,1]=4 457 B24R4.1620053 c1ccc2c(c1)CC(C2)NC3CCCOc4c3cccc4 269862a_100000753258_100000750279 [0,0,0,0,0,1|2,0,1]=4 458 B24R4.1620726 c1cc2c(cn1)CCCC2NCc3cc4ccncc4[nH]3 270004a_100020634316_200000084276 [0,0,0,0,0,1|3,0,0]=4 459 B24R4.1620726 c1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000051030 [0,0,0,0,0,1|2,0,0]=3 460 B24R4.1620726 c1ccc2[nH]c(nc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000185668 [0,0,0,0,0,1|1,0,0]=2 461 B24R4.1620726 c1ccc2[nH]c(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000737899 [0,0,0,0,0,1|1,0,0]=2 462 B24R4.1620726 c1ccc2[nH]c(nc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000185668 [0,0,0,0,0,1|1,0,0]=2 463 B24R4.1620726 c1ccc2[nH]c(nc2c1)NN=C3CCCc4c3ccnc4 4a_100000188875_100000087567 [0,0,0,0,0,1|1,0,1]=3 464 B24R4.1620726 c1ccc2[nH]c(nc2c1)NN=C3CCCc4c3cncc4 4a_100000188875_100016991936 [0,0,0,0,0,1|1,0,1]=3 465 B24R4.1620726 c1ccc2c(c1)CC(=NNC3CCCc4c3cccc4)C2 4a_100159326319_100000211675 [0,0,0,0,0,1|2,0,0]=3 466 B24R4.1620726 c1ccc2c(c1)CC(C2)CNC3CCCc4c3cccc4 269862a_100000757167_100000210882 [0,0,0,0,0,1|2,0,1]=4 467 B24R4.1620726 c1ccc2c(c1)CC(O2)CNC3CCCc4c3cccc4 269862a_100015207006_100000210882 [0,0,0,0,0,1|2,0,1]=4 468 B24R4.1620726 c1ccc2c(c1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000210882 [0,0,0,0,0,1|0,0,1]=2 469 B24R4.1620726 c1ccc2c(c1)CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000210882 [0,0,0,0,0,1|1,0,1]=3 470 B24R4.1620726 c1ccc2c(c1)CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000210882 [0,0,0,0,0,1|1,0,1]=3 471 B24R4.1620726 c1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000210882 [0,0,0,0,0,1|2,0,0]=3 472 B24R4.1620726 c1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000210882 [0,0,0,0,0,1|2,0,0]=3 473 B24R4.1620726 c1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000210882 [0,0,0,0,0,1|2,0,0]=3 474 B24R4.1620726 c1ccc2c(c1)CCCC2NCc3cn4cccnc4n3 269862a_100025705072_100000210882 [0,0,0,0,0,1|3,0,0]=4 475 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3cn4ccccc4n3 34a_100000183665_100000689847 [0,0,0,0,0,1|3,0,0]=4 476 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3cn4ccccc4n3 7a_100000183665_100000689847 [0,0,0,0,0,1|3,0,0]=4 477 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3nc4ccccc4[nH]3 7a_100000183665_100000737899 [0,0,0,0,0,1|1,0,0]=2 478 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3nc4ccccc4o3 34a_100000183665_200012361514 [0,0,0,0,0,1|2,0,0]=3 479 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3nc4ccccc4o3 7a_100000183665_100000195508 [0,0,0,0,0,1|2,0,0]=3 480 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3nc4ccccc4s3 34a_100000183665_100011217541 [0,0,0,0,0,1|2,0,0]=3 481 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3nc4ccccc4s3 7a_100000183665_100011217541 [0,0,0,0,0,1|2,0,0]=3 482 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3nc4cccnc4[nH]3 7a_100000183665_100011549802 [0,0,0,0,0,1|2,0,0]=3 483 B24R4.1620726 c1ccc2c(c1)CCCC2OCc3nc4ncccc4o3 7a_100000183665_100000696355 [0,0,0,0,0,1|3,0,0]=4 484 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4[nH]3 270004a_100020654734_100000051030 [0,0,0,0,0,1|1,0,0]=2 485 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4o3 207a_100020654734_100000229944 [0,0,0,0,0,1|2,0,0]=3 486 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4o3 270004a_100020654734_100000229944 [0,0,0,0,0,1|2,0,0]=3 487 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4s3 207a_100020654734_100000686906 [0,0,0,0,0,1|2,0,0]=3 488 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4s3 270004a_100020654734_100000686906 [0,0,0,0,0,1|2,0,0]=3 489 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4cccnc4[nH]3 207a_100020654734_100000088027 [0,0,0,0,0,1|2,0,0]=3 490 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4cccnc4[nH]3 270004a_100020654734_100000088027 [0,0,0,0,0,1|2,0,0]=3 491 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4cccnc4s3 207a_100020654734_100000050461 [0,0,0,0,0,1|3,0,0]=4 492 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4cccnc4s3 270004a_100020654734_100000050461 [0,0,0,0,0,1|3,0,0]=4 493 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccncc4[nH]3 270004a_100020654734_200000084276 [0,0,0,0,0,1|2,0,0]=3 494 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4cnccc4o3 207a_100020654734_100009860033 [0,0,0,0,0,1|3,0,0]=4 495 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4cnccc4o3 270004a_100020654734_100009860033 [0,0,0,0,0,1|3,0,0]=4 496 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4cnccc4s3 207a_100020654734_100000054438 [0,0,0,0,0,1|3,0,0]=4 497 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4cnccc4s3 270004a_100020654734_100000054438 [0,0,0,0,0,1|3,0,0]=4 498 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ncccc4o3 207a_100020654734_100000104172 [0,0,0,0,0,1|3,0,0]=4 499 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ncccc4o3 270004a_100020654734_100000104172 [0,0,0,0,0,1|3,0,0]=4 500 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cn4ccccc4n3 207a_100020654734_100000743146 [0,0,0,0,0,1|2,0,0]=3 501 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3cn4ccccc4n3 34a_100020654734_100000689847 [0,0,0,0,0,1|2,0,0]=3 502 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4[nH]3 207a_100020654734_100000185668 [0,0,0,0,0,1|0,0,0]=1 503 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4[nH]3 270004a_100020654734_100000185668 [0,0,0,0,0,1|0,0,0]=1 504 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4o3 34a_100020654734_200012361514 [0,0,0,0,0,1|1,0,0]=2 505 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4s3 270004a_100020654734_100011204187 [0,0,0,0,0,1|1,0,0]=2 506 B24R4.1620726 c1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4s3 34a_100020654734_100011217541 [0,0,0,0,0,1|1,0,0]=2 507 B24R4.1620726 c1ccc2c(c1)CCOC2CNc3nc4ccccc4[nH]3 27a_100000755408_100009814255 [0,0,0,0,0,1|1,0,0]=2 508 B24R4.1620726 c1ccc2c(c1)CCOC2CNc3nc4ccccc4s3 27a_100000755408_100000751744 [0,0,0,0,0,1|2,0,0]=3 509 B24R4.1620726 c1ccc2c(c1)CCOC2CNc3nc4cccnc4s3 27a_100000755408_100010188088 [0,0,0,0,0,1|3,0,0]=4 510 B24R4.1620726 c1ccc2c(c1)COCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000117393 [0,0,0,0,0,1|1,0,1]=3 511 B24R4.1620726 c1ccc2c(c1)COCC2=NNc3nc4ccccc4o3 4a_100000182307_100000117393 [0,0,0,0,0,1|2,0,1]=4 512 B24R4.1620726 c1ccc2c(c1)COCC2=NNc3nc4ccccc4s3 4a_100000181811_100000117393 [0,0,0,0,0,1|2,0,1]=4 513 B24R4.1620726 c1ccc2c(c1)COCC2NCc3cc4ccccc4o3 269862a_100011220112_100000117393 [0,0,0,0,0,1|3,0,0]=4 514 B24R4.1620726 c1ccc2c(c1)COCC2NCc3cc4ccccc4s3 269862a_100015187092_100000117393 [0,0,0,0,0,1|3,0,0]=4 515 B24R4.1620726 c1ccc2c(c1)COCC2NCc3cn4ccccc4n3 269862a_100000195574_100000117393 [0,0,0,0,0,1|3,0,0]=4 516 B24R4.1620726 c1ccc2c(c1)COCC2OCc3nc4ccccc4o3 34a_100012179175_200012361514 [0,0,0,0,0,1|3,0,0]=4 517 B24R4.1620726 c1ccc2c(c1)COCC2OCc3nc4ccccc4s3 34a_100012179175_100011217541 [0,0,0,0,0,1|3,0,0]=4 518 B24R4.1620726 c1ccc2c(c1)CSCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000740248 [0,0,0,0,0,1|1,0,1]=3 519 B24R4.1620726 c1ccc2c(c1)CSCC2=NNc3nc4ccccc4o3 4a_100000182307_100000740248 [0,0,0,0,0,1|2,0,1]=4 520 B24R4.1620726 c1ccc2c(c1)CSCC2=NNc3nc4ccccc4s3 4a_100000181811_100000740248 [0,0,0,0,0,1|2,0,1]=4 521 B24R4.1620726 c1ccc2c(c1)NCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000691674 [0,0,0,0,0,1|1,0,1]=3 522 B24R4.1620726 c1ccc2c(c1)NCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000691674 [0,0,0,0,0,1|2,0,1]=4 523 B24R4.1620726 c1ccc2c(c1)NCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000691674 [0,0,0,0,0,1|2,0,1]=4 524 B24R4.1620726 c1ccc2c(c1)NNCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100020634119 [0,0,0,0,0,1|2,0,1]=4 525 B24R4.1620726 c1ccc2c(c1)OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000195411 [0,0,0,0,0,1|1,0,1]=3 526 B24R4.1620726 c1ccc2c(c1)OCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000195411 [0,0,0,0,0,1|2,0,1]=4 527 B24R4.1620726 c1ccc2c(c1)OCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000195411 [0,0,0,0,0,1|2,0,1]=4 528 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cc4ccccc4[nH]3 270004a_100015190321_100000051030 [0,0,0,0,0,1|2,0,0]=3 529 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cc4ccccc4o3 207a_100015190321_100000229944 [0,0,0,0,0,1|3,0,0]=4 530 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cc4ccccc4o3 270004a_100015190321_100000229944 [0,0,0,0,0,1|3,0,0]=4 531 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cc4ccccc4s3 207a_100015190321_100000686906 [0,0,0,0,0,1|3,0,0]=4 532 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cc4ccccc4s3 270004a_100015190321_100000686906 [0,0,0,0,0,1|3,0,0]=4 533 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cc4cccnc4[nH]3 207a_100015190321_100000088027 [0,0,0,0,0,1|3,0,0]=4 534 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cc4cccnc4[nH]3 270004a_100015190321_100000088027 [0,0,0,0,0,1|3,0,0]=4 535 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cc4ccncc4[nH]3 270004a_100015190321_200000084276 [0,0,0,0,0,1|3,0,0]=4 536 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cn4ccccc4n3 207a_100015190321_100000743146 [0,0,0,0,0,1|3,0,0]=4 537 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3cn4ccccc4n3 2230a_100015190321_100000689847 [0,0,0,0,0,1|3,0,0]=4 538 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 207a_100015190321_100000185668 [0,0,0,0,0,1|1,0,0]=2 539 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 2230a_100015190321_100000737899 [0,0,0,0,0,1|1,0,0]=2 540 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 270004a_100015190321_100000185668 [0,0,0,0,0,1|1,0,0]=2 541 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3nc4ccccc4o3 2230a_100015190321_100000195508 [0,0,0,0,0,1|2,0,0]=3 542 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3nc4ccccc4s3 2230a_100015190321_100000766747 [0,0,0,0,0,1|2,0,0]=3 543 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3nc4ccccc4s3 270004a_100015190321_100011204187 [0,0,0,0,0,1|2,0,0]=3 544 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3nc4cccnc4[nH]3 2230a_100015190321_100011549802 [0,0,0,0,0,1|2,0,0]=3 545 B24R4.1620726 c1ccc2c(c1)OCCC2NCc3nc4ncccc4o3 2230a_100015190321_100000696355 [0,0,0,0,0,1|3,0,0]=4 546 B24R4.1620726 c1ccc2c(c1)OCCC2OCc3nc4ccccc4[nH]3 7a_100000708930_100000737899 [0,0,0,0,0,1|2,0,0]=3 547 B24R4.1620726 c1ccc2c(c1)OCCC2OCc3nc4ccccc4o3 7a_100000708930_100000195508 [0,0,0,0,0,1|3,0,0]=4 548 B24R4.1620726 c1ccc2c(c1)OCCC2OCc3nc4ccccc4s3 7a_100000708930_100011217541 [0,0,0,0,0,1|3,0,0]=4 549 B24R4.1620726 c1ccc2c(c1)OCCC2OCc3nc4cccnc4[nH]3 7a_100000708930_100011549802 [0,0,0,0,0,1|3,0,0]=4 550 B24R4.1620726 c1ccc2c(c1)SCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000183853 [0,0,0,0,0,1|1,0,1]=3 551 B24R4.1620726 c1ccc2c(c1)SCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000183853 [0,0,0,0,0,1|2,0,1]=4 552 B24R4.1620726 c1ccc2c(c1)SCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000183853 [0,0,0,0,0,1|2,0,1]=4 553 B24R4.1620726 c1ccc2c(c1)SCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000183853 [0,0,0,0,0,1|3,0,0]=4 554 B24R4.1620726 c1ccc2c(c1)SCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000183853 [0,0,0,0,0,1|3,0,0]=4 555 B24R4.1620726 c1ccc2c(c1)SCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000183853 [0,0,0,0,0,1|3,0,0]=4 556 B24R4.1620726 c1ccc2oc(cc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000229944 [0,0,0,0,0,1|3,0,0]=4 557 B24R4.1620726 c1ccc2oc(cc2c1)CNC3CCCc4c3ccnc4 269862a_100011220112_100000087567 [0,0,0,0,0,1|3,0,0]=4 558 B24R4.1620726 c1ccc2oc(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000229944 [0,0,0,0,0,1|3,0,0]=4 559 B24R4.1620726 c1ccc2oc(cc2c1)CNC3CCCc4c3cncc4 269862a_100011220112_100016991936 [0,0,0,0,0,1|3,0,0]=4 560 B24R4.1620726 c1ccc2oc(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000195508 [0,0,0,0,0,1|2,0,0]=3 561 B24R4.1620726 c1ccc2oc(nc2c1)NN=C3CCCc4c3ccnc4 4a_100000182307_100000087567 [0,0,0,0,0,1|2,0,1]=4 562 B24R4.1620726 c1ccc2oc(nc2c1)NN=C3CCCc4c3cncc4 4a_100000182307_100016991936 [0,0,0,0,0,1|2,0,1]=4 563 B24R4.1620726 c1ccc2sc(cc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000686906 [0,0,0,0,0,1|3,0,0]=4 564 B24R4.1620726 c1ccc2sc(cc2c1)CNC3CCCc4c3ccnc4 269862a_100015187092_100000087567 [0,0,0,0,0,1|3,0,0]=4 565 B24R4.1620726 c1ccc2sc(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000686906 [0,0,0,0,0,1|3,0,0]=4 566 B24R4.1620726 c1ccc2sc(cc2c1)CNC3CCCc4c3cncc4 269862a_100015187092_100016991936 [0,0,0,0,0,1|3,0,0]=4 567 B24R4.1620726 c1ccc2sc(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000766747 [0,0,0,0,0,1|2,0,0]=3 568 B24R4.1620726 c1ccc2sc(nc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100011204187 [0,0,0,0,0,1|2,0,0]=3 569 B24R4.1620726 c1ccc2sc(nc2c1)NN=C3CCCc4c3ccnc4 4a_100000181811_100000087567 [0,0,0,0,0,1|2,0,1]=4 570 B24R4.1620726 c1ccc2sc(nc2c1)NN=C3CCCc4c3cncc4 4a_100000181811_100016991936 [0,0,0,0,0,1|2,0,1]=4 571 B24R4.1620726 c1ccn2cc(nc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000743146 [0,0,0,0,0,1|3,0,0]=4 572 B24R4.1620726 c1ccn2cc(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000689847 [0,0,0,0,0,1|3,0,0]=4 573 B24R4.1620726 c1ccn2cc(nc2c1)CNC3CCCc4c3ccnc4 269862a_100000195574_100000087567 [0,0,0,0,0,1|3,0,0]=4 574 B24R4.1620726 c1ccn2cc(nc2c1)CNC3CCCc4c3cncc4 269862a_100000195574_100016991936 [0,0,0,0,0,1|3,0,0]=4 575 B24R4.1620726 c1cnc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000088027 [0,0,0,0,0,1|3,0,0]=4 576 B24R4.1620726 c1cnc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000088027 [0,0,0,0,0,1|3,0,0]=4 577 B24R4.1620726 c1cnc2[nH]c(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100011549802 [0,0,0,0,0,1|2,0,0]=3 578 B24R4.1620726 c1cnc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000058033 [0,0,0,0,0,1|1,0,1]=3 579 B24R4.1620726 c1cnc2c(c1)C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000058033 [0,0,0,0,0,1|2,0,1]=4 580 B24R4.1620726 c1cnc2c(c1)C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000058033 [0,0,0,0,0,1|2,0,1]=4 581 B24R4.1620726 c1cnc2c(c1)C(CCC2)NCc3cc4ccccc4o3 269862a_100011220112_100000058033 [0,0,0,0,0,1|3,0,0]=4 582 B24R4.1620726 c1cnc2c(c1)C(CCC2)NCc3cc4ccccc4s3 269862a_100015187092_100000058033 [0,0,0,0,0,1|3,0,0]=4 583 B24R4.1620726 c1cnc2c(c1)C(CCC2)NCc3cn4ccccc4n3 269862a_100000195574_100000058033 [0,0,0,0,0,1|3,0,0]=4 584 B24R4.1620726 c1cnc2c(c1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000067617 [0,0,0,0,0,1|1,0,1]=3 585 B24R4.1620726 c1cnc2c(c1)CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000067617 [0,0,0,0,0,1|2,0,1]=4 586 B24R4.1620726 c1cnc2c(c1)CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000067617 [0,0,0,0,0,1|2,0,1]=4 587 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4ccccc4[nH]3 270004a_100011259139_100000051030 [0,0,0,0,0,1|2,0,0]=3 588 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4ccccc4o3 207a_100011259139_100000229944 [0,0,0,0,0,1|3,0,0]=4 589 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000067617 [0,0,0,0,0,1|3,0,0]=4 590 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4ccccc4o3 270004a_100011259139_100000229944 [0,0,0,0,0,1|3,0,0]=4 591 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4ccccc4s3 207a_100011259139_100000686906 [0,0,0,0,0,1|3,0,0]=4 592 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000067617 [0,0,0,0,0,1|3,0,0]=4 593 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4ccccc4s3 270004a_100011259139_100000686906 [0,0,0,0,0,1|3,0,0]=4 594 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4cccnc4[nH]3 207a_100011259139_100000088027 [0,0,0,0,0,1|3,0,0]=4 595 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4cccnc4[nH]3 270004a_100011259139_100000088027 [0,0,0,0,0,1|3,0,0]=4 596 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cc4ccncc4[nH]3 270004a_100011259139_200000084276 [0,0,0,0,0,1|3,0,0]=4 597 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cn4ccccc4n3 207a_100011259139_100000743146 [0,0,0,0,0,1|3,0,0]=4 598 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cn4ccccc4n3 2230a_100011259139_100000689847 [0,0,0,0,0,1|3,0,0]=4 599 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000067617 [0,0,0,0,0,1|3,0,0]=4 600 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 207a_100011259139_100000185668 [0,0,0,0,0,1|1,0,0]=2 601 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 2230a_100011259139_100000737899 [0,0,0,0,0,1|1,0,0]=2 602 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 270004a_100011259139_100000185668 [0,0,0,0,0,1|1,0,0]=2 603 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3nc4ccccc4o3 2230a_100011259139_100000195508 [0,0,0,0,0,1|2,0,0]=3 604 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3nc4ccccc4s3 2230a_100011259139_100000766747 [0,0,0,0,0,1|2,0,0]=3 605 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3nc4ccccc4s3 270004a_100011259139_100011204187 [0,0,0,0,0,1|2,0,0]=3 606 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3nc4cccnc4[nH]3 2230a_100011259139_100011549802 [0,0,0,0,0,1|2,0,0]=3 607 B24R4.1620726 c1cnc2c(c1)CCCC2NCc3nc4ncccc4o3 2230a_100011259139_100000696355 [0,0,0,0,0,1|3,0,0]=4 608 B24R4.1620726 c1cnc2c(c1)OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000100482 [0,0,0,0,0,1|2,0,1]=4 609 B24R4.1620726 c1cnc2c(c1)OCCC2NCc3cc4ccccc4[nH]3 270004a_100009852857_100000051030 [0,0,0,0,0,1|3,0,0]=4 610 B24R4.1620726 c1cnc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 207a_100009852857_100000185668 [0,0,0,0,0,1|2,0,0]=3 611 B24R4.1620726 c1cnc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 2230a_100009852857_100000737899 [0,0,0,0,0,1|2,0,0]=3 612 B24R4.1620726 c1cnc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 270004a_100009852857_100000185668 [0,0,0,0,0,1|2,0,0]=3 613 B24R4.1620726 c1cnc2c(c1)OCCC2NCc3nc4ccccc4o3 2230a_100009852857_100000195508 [0,0,0,0,0,1|3,0,0]=4 614 B24R4.1620726 c1cnc2c(c1)OCCC2NCc3nc4ccccc4s3 2230a_100009852857_100000766747 [0,0,0,0,0,1|3,0,0]=4 615 B24R4.1620726 c1cnc2c(c1)OCCC2NCc3nc4ccccc4s3 270004a_100009852857_100011204187 [0,0,0,0,0,1|3,0,0]=4 616 B24R4.1620726 c1cnc2c(c1)OCCC2NCc3nc4cccnc4[nH]3 2230a_100009852857_100011549802 [0,0,0,0,0,1|3,0,0]=4 617 B24R4.1620726 c1cnc2nc(oc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000696355 [0,0,0,0,0,1|3,0,0]=4 618 B24R4.6842361 c1cc2c(cn1)CCCC2Nc3ccc4ccncc4n3 27a_100020634316_100000020162 [0,0,0,0,0,1|3,0,0]=4 619 B24R4.6842361 c1ccc2c(c1)CC(CO2)NC3CCCc4c3cccc4 269862a_100000739546_100000210882 [0,0,0,0,0,1|2,0,1]=4 620 B24R4.6842361 c1ccc2c(c1)CC(CO2)N[C@H]3CCCc4c3cccc4 270004a_100020654734_100000048293 [0,0,0,0,0,1|2,0,1]=4 621 B24R4.6842361 c1ccc2c(c1)CCC(C2)NC3CCCc4c3cccc4 269862a_100000748446_100000210882 [0,0,0,0,0,1|2,0,1]=4 622 B24R4.6842361 c1ccc2c(c1)CCC(C2)N[C@H]3CCCc4c3cccc4 270004a_100020654734_100000212018 [0,0,0,0,0,1|2,0,1]=4 623 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3cc4nccnc4cn3 27a_100020654734_100000070204 [0,0,0,0,0,1|3,0,0]=4 624 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3ccc4ccccc4n3 27a_100020654734_100011291633 [0,0,0,0,0,1|1,0,0]=2 625 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3ccc4cccnc4n3 27a_100020654734_100000075685 [0,0,0,0,0,1|2,0,0]=3 626 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3ccc4ccncc4n3 27a_100020654734_100000020162 [0,0,0,0,0,1|2,0,0]=3 627 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3ccc4ncccc4n3 27a_100020654734_100000073381 [0,0,0,0,0,1|2,0,0]=3 628 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3ccc4nccnc4n3 27a_100020654734_100012351543 [0,0,0,0,0,1|3,0,0]=4 629 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3cnc4ccccc4n3 27a_100020654734_100000756483 [0,0,0,0,0,1|0,0,1]=2 630 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3cnc4cccnc4n3 27a_100020654734_200010275043 [0,0,0,0,0,1|1,0,1]=3 631 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3cnc4ncccc4n3 27a_100020654734_100000084304 [0,0,0,0,0,1|1,0,1]=3 632 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3cnc4nccnc4c3 27a_100020654734_100000753224 [0,0,0,0,0,1|3,0,0]=4 633 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3ncc4ccccc4n3 27a_100020654734_100000097389 [0,0,0,0,0,1|0,0,1]=2 634 B24R4.6842361 c1ccc2c(c1)CCC[C@@H]2Nc3ncc4cccnc4n3 27a_100020654734_100009875485 [0,0,0,0,0,1|1,0,1]=3 635 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3ccc4ccccc4n3 27a_100015190321_100011291633 [0,0,0,0,0,1|2,0,0]=3 636 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3ccc4cccnc4n3 27a_100015190321_100000075685 [0,0,0,0,0,1|3,0,0]=4 637 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3ccc4ccncc4n3 27a_100015190321_100000020162 [0,0,0,0,0,1|3,0,0]=4 638 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3ccc4ncccc4n3 27a_100015190321_100000073381 [0,0,0,0,0,1|3,0,0]=4 639 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3cnc4ccccc4n3 27a_100015190321_100000756483 [0,0,0,0,0,1|1,0,1]=3 640 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3cnc4cccnc4n3 27a_100015190321_200010275043 [0,0,0,0,0,1|2,0,1]=4 641 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3cnc4ncccc4n3 27a_100015190321_100000084304 [0,0,0,0,0,1|2,0,1]=4 642 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3ncc4ccccc4n3 27a_100015190321_100000097389 [0,0,0,0,0,1|1,0,1]=3 643 B24R4.6842361 c1ccc2c(c1)OCCC2Nc3ncc4cccnc4n3 27a_100015190321_100009875485 [0,0,0,0,0,1|2,0,1]=4 644 B24R4.6842361 c1ccc2nc(ccc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100011291633 [0,0,0,0,0,1|2,0,0]=3 645 B24R4.6842361 c1ccc2nc(cnc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000756483 [0,0,0,0,0,1|1,0,1]=3 646 B24R4.6842361 c1ccc2nc(ncc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000097389 [0,0,0,0,0,1|1,0,1]=3 647 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3ccc4ccccc4n3 27a_100011259139_100011291633 [0,0,0,0,0,1|2,0,0]=3 648 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3ccc4cccnc4n3 27a_100011259139_100000075685 [0,0,0,0,0,1|3,0,0]=4 649 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3ccc4ccncc4n3 27a_100011259139_100000020162 [0,0,0,0,0,1|3,0,0]=4 650 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3ccc4ncccc4n3 27a_100011259139_100000073381 [0,0,0,0,0,1|3,0,0]=4 651 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3cnc4ccccc4n3 27a_100011259139_100000756483 [0,0,0,0,0,1|1,0,1]=3 652 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3cnc4cccnc4n3 27a_100011259139_200010275043 [0,0,0,0,0,1|2,0,1]=4 653 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3cnc4ncccc4n3 27a_100011259139_100000084304 [0,0,0,0,0,1|2,0,1]=4 654 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3ncc4ccccc4n3 27a_100011259139_100000097389 [0,0,0,0,0,1|1,0,1]=3 655 B24R4.6842361 c1cnc2c(c1)CCCC2Nc3ncc4cccnc4n3 27a_100011259139_100009875485 [0,0,0,0,0,1|2,0,1]=4 656 B24R4.6842361 c1cnc2c(c1)OCCC2Nc3ccc4ccccc4n3 27a_100009852857_100011291633 [0,0,0,0,0,1|3,0,0]=4 657 B24R4.6842361 c1cnc2c(c1)OCCC2Nc3cnc4ccccc4n3 27a_100009852857_100000756483 [0,0,0,0,0,1|2,0,1]=4 658 B24R4.6842361 c1cnc2c(c1)OCCC2Nc3ncc4ccccc4n3 27a_100009852857_100000097389 [0,0,0,0,0,1|2,0,1]=4 659 B24R4.6842361 c1cnc2ccc(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000073381 [0,0,0,0,0,1|3,0,0]=4 660 B24R4.6842361 c1cnc2nc(ccc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000075685 [0,0,0,0,0,1|3,0,0]=4 661 B24R4.6842361 c1cnc2nc(cnc2c1)NC3CCCc4c3ccnc4 27a_100020634316_200010275043 [0,0,0,0,0,1|2,0,1]=4 662 B24R4.6842361 c1cnc2nc(ncc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100009875485 [0,0,0,0,0,1|2,0,1]=4 663 B24R4.6842361 c1cnc2ncc(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000084304 [0,0,0,0,0,1|2,0,1]=4 664 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3cc4ccccc4[nH]3 270004a_100000059810_100000051030 [0,0,0,0,0,1|3,0,0]=4 665 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4[nH]3 2230a_100000059810_100000737899 [0,0,0,0,0,1|2,0,0]=3 666 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4[nH]3 269982a_100000059810_100000737899 [0,0,0,0,0,1|2,0,0]=3 667 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4[nH]3 270004a_100000059810_100000185668 [0,0,0,0,0,1|2,0,0]=3 668 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4o3 2230a_100000059810_100000195508 [0,0,0,0,0,1|3,0,0]=4 669 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4o3 34a_100000059810_200012361514 [0,0,0,0,0,1|3,0,0]=4 670 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4s3 2230a_100000059810_100000766747 [0,0,0,0,0,1|3,0,0]=4 671 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4s3 269982a_100000059810_100011217541 [0,0,0,0,0,1|3,0,0]=4 672 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4s3 270004a_100000059810_100011204187 [0,0,0,0,0,1|3,0,0]=4 673 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4ccccc4s3 34a_100000059810_100011217541 [0,0,0,0,0,1|3,0,0]=4 674 B24R4.86211889 c1ccc2c(c1)CCCN(C2)Cc3nc4cccnc4[nH]3 2230a_100000059810_100011549802 [0,0,0,0,0,1|3,0,0]=4 675 B24R4.86211889 c1ccc2c(c1)CN(CCO2)Cc3nc4ccccc4[nH]3 2230a_100000744108_100000737899 [0,0,0,0,0,1|3,0,0]=4 676 B24R4.86211889 c1ccc2c(c1)CN(CCO2)Cc3nc4ccccc4[nH]3 269982a_100000744108_100000737899 [0,0,0,0,0,1|3,0,0]=4 677 B24R4.86211889 c1ccc2c(c1)CN(CCO2)Cc3nc4ccccc4[nH]3 270004a_100000744108_100000185668 [0,0,0,0,0,1|3,0,0]=4 678 B21R3.3124 C(=NNC1CCCc2c1cccc2)c3ccccc3 4a_100159326319_100015611070 [1,0,1,0,0,0|2,0,0]=4 679 B21R3.3124 c1ccc(cc1)CCNC2CCCc3c2cccc3 269862a_100000106460_100000210882 [1,0,1,0,0,0|1,0,1]=4 680 B21R3.3124 c1ccc(cc1)CCN[C@H]2CCCc3c2cccc3 34a_100020654734_100000765856 [1,0,1,0,0,0|1,0,1]=4 681 B21R3.2502 CCC(Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100000737752_100009814255 [1,0,1,0,0,0|0,0,0]=2 682 B21R3.2502 CCC(Nc1nc2ccccc2[nH]1)c3ccccn3 27a_100015186561_100009814255 [1,0,1,0,0,0|1,0,0]=3 683 B21R3.2502 CCC(Nc1nc2ccccc2[nH]1)c3cccnc3 27a_100000246009_100009814255 [1,0,1,0,0,0|1,0,0]=3 684 B21R3.2502 CCC(Nc1nc2ccccc2[nH]1)c3ccncc3 27a_100000246010_100009814255 [1,0,1,0,0,0|1,0,0]=3 685 B21R3.2502 CCC(Nc1nc2ccccc2[nH]1)c3cnccn3 27a_200016994365_100009814255 [1,0,1,0,0,0|2,0,0]=4 686 B21R3.2502 CCC(Nc1nc2ccccc2s1)c3ccccc3 27a_100000737752_100000751744 [1,0,1,0,0,0|1,0,0]=3 687 B21R3.2502 CCC(Nc1nc2ccccc2s1)c3ccccn3 27a_100015186561_100000751744 [1,0,1,0,0,0|2,0,0]=4 688 B21R3.2502 CCC(Nc1nc2ccccc2s1)c3cccnc3 27a_100000246009_100000751744 [1,0,1,0,0,0|2,0,0]=4 689 B21R3.2502 CCC(Nc1nc2ccccc2s1)c3ccncc3 27a_100000246010_100000751744 [1,0,1,0,0,0|2,0,0]=4 690 B21R3.2502 CCC(Nc1nc2cccnc2s1)c3ccccc3 27a_100000737752_100010188088 [1,0,1,0,0,0|2,0,0]=4 691 B21R3.2502 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3 2230a_100000210013_100000737899 [1,0,1,0,0,0|2,0,0]=4 692 B21R3.2502 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3 269982a_100000210013_100000737899 [1,0,1,0,0,0|2,0,0]=4 693 B21R3.2502 OCC(Nc1nc2ccccc2[nH]1)c3ccccn3 27a_100015196888_100009814255 [1,0,1,0,0,0|2,0,0]=4 694 B21R3.2502 OC[C@@H](Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100000751927_100009814255 [1,0,1,0,0,0|1,0,0]=3 695 B21R3.2502 OC[C@@H](Nc1nc2ccccc2[nH]1)c3ccncc3 27a_100138412524_100009814255 [1,0,1,0,0,0|2,0,0]=4 696 B21R3.2502 OC[C@@H](Nc1nc2ccccc2s1)c3ccccc3 27a_100000751927_100000751744 [1,0,1,0,0,0|2,0,0]=4 697 B21R3.75855 C#Cc1ccccc1CNc2nc3ccccc3[nH]2 27a_100020634229_100009814255 [1,0,1,0,0,0|0,0,2]=4 698 B21R3.75855 CCc1ccccc1NCc2nc3ccccc3[nH]2 207a_100000212081_100000185668 [1,0,1,0,0,0|2,0,0]=4 699 B21R3.75855 CCc1ccccc1NCc2nc3ccccc3[nH]2 2230a_100000212081_100000737899 [1,0,1,0,0,0|2,0,0]=4 700 B21R3.75855 CCc1ccccc1NCc2nc3ccccc3[nH]2 7a_100000212081_100000737899 [1,0,1,0,0,0|2,0,0]=4 701 B21R3.75855 CCc1ccccc1OCc2nc3ccccc3[nH]2 7a_100000210936_100000737899 [1,0,1,0,0,0|2,0,0]=4 702 B21R3.75855 CCc1ccccc1SCc2nc3ccccc3[nH]2 62a_100011215823_100000737899 [1,0,1,0,0,0|2,0,0]=4 703 B21R3.75855 COc1ccccc1CNc2nc3ccccc3[nH]2 27a_100000188900_100009814255 [1,0,1,0,0,0|1,0,0]=3 704 B21R3.75855 COc1ccccc1CNc2nc3ccccc3s2 27a_100000188900_100000751744 [1,0,1,0,0,0|2,0,0]=4 705 B21R3.75855 COc1ccccc1CSc2nc3ccccc3[nH]2 62a_100000210004_100009814255 [1,0,1,0,0,0|2,0,0]=4 706 B21R3.75855 COc1ncccc1CNc2nc3ccccc3[nH]2 27a_100102524934_100009814255 [1,0,1,0,0,0|2,0,0]=4 707 B21R3.75855 CSc1ccccc1CNc2nc3ccccc3[nH]2 27a_102495365025_100009814255 [1,0,1,0,0,0|1,0,0]=3 708 B21R3.75855 CSc1ccccc1CNc2nc3ccccc3s2 27a_102495365025_100000751744 [1,0,1,0,0,0|2,0,0]=4 709 B21R3.75855 CSc1ccccc1CSc2nc3ccccc3[nH]2 62a_100000699184_100009814255 [1,0,1,0,0,0|2,0,0]=4 710 B21R3.75855 N#Cc1ccccc1CNc2nc3ccccc3[nH]2 27a_100016989011_100009814255 [1,0,1,0,0,0|1,0,1]=4 711 B21R3.75855 OCc1ccccc1CNc2nc3ccccc3[nH]2 27a_100000743596_100009814255 [1,0,1,0,0,0|1,0,0]=3 712 B21R3.75855 OCc1ccccc1CNc2nc3ccccc3s2 27a_100000743596_100000751744 [1,0,1,0,0,0|2,0,0]=4 713 B21R3.75855 OCc1ccccc1CSc2nc3ccccc3[nH]2 62a_100009816955_100009814255 [1,0,1,0,0,0|2,0,0]=4 714 B21R3.3965166 CC(Nc1nc2ccccc2[nH]1)c3ccccc3Br 27a_100000181357_100009814255 [1,0,1,0,0,0|1,0,0]=3 715 B21R3.3965166 CC(Nc1nc2ccccc2[nH]1)c3ccccc3Cl 27a_100000174978_100009814255 [1,0,1,0,0,0|1,0,0]=3 716 B21R3.3965166 CC(Nc1nc2ccccc2[nH]1)c3ccccc3F 27a_100000181408_100009814255 [1,0,1,0,0,0|1,0,0]=3 717 B21R3.3965166 CC(Nc1nc2ccccc2[nH]1)c3cccnc3O 27a_100159269580_100009814255 [1,0,1,0,0,0|2,0,0]=4 718 B21R3.3965166 CC(Nc1nc2ccccc2[nH]1)c3ncccc3Br 27a_100159271932_100009814255 [1,0,1,0,0,0|2,0,0]=4 719 B21R3.3965166 CC(Nc1nc2ccccc2s1)c3ccccc3Br 27a_100000181357_100000751744 [1,0,1,0,0,0|2,0,0]=4 720 B21R3.3965166 CC(Nc1nc2ccccc2s1)c3ccccc3Cl 27a_100000174978_100000751744 [1,0,1,0,0,0|2,0,0]=4 721 B21R3.3965166 CC(Nc1nc2ccccc2s1)c3ccccc3F 27a_100000181408_100000751744 [1,0,1,0,0,0|2,0,0]=4 722 B21R3.3965166 CC(Sc1nc2ccccc2[nH]1)c3ccccc3Cl 62a_100000181259_100009814255 [1,0,1,0,0,0|2,0,0]=4 723 B21R3.3965166 CC(Sc1nc2ccccc2[nH]1)c3ccccc3F 62a_200000741388_100009814255 [1,0,1,0,0,0|2,0,0]=4 724 B21R3.3965166 C[C@@H](Nc1nc2ccccc2[nH]1)c3ccccc3O 27a_100025703389_100009814255 [1,0,1,0,0,0|1,0,0]=3 725 B21R3.3965166 C[C@@H](Nc1nc2ccccc2s1)c3ccccc3O 27a_100025703389_100000751744 [1,0,1,0,0,0|2,0,0]=4 726 B21R3.3965166 Cc1ccccc1C(C)Nc2nc3ccccc3[nH]2 27a_100000181355_100009814255 [1,0,1,0,0,0|0,0,0]=2 727 B21R3.3965166 Cc1ccccc1C(C)Nc2nc3ccccc3s2 27a_100000181355_100000751744 [1,0,1,0,0,0|1,0,0]=3 728 B21R3.3965166 Cc1ccccc1C(C)Nc2nc3cccnc3s2 27a_100000181355_100010188088 [1,0,1,0,0,0|2,0,0]=4 729 B21R3.3965166 Cc1ccccc1N(C)Cc2nc3ccccc3[nH]2 2230a_100000219699_100000737899 [1,0,1,0,0,0|2,0,0]=4 730 B21R3.3965166 Cc1ccccc1N(C)Cc2nc3ccccc3[nH]2 269982a_100000219699_100000737899 [1,0,1,0,0,0|2,0,0]=4 731 B21R3.3965166 Cc1cccnc1C(C)Nc2nc3ccccc3[nH]2 27a_100011536111_100009814255 [1,0,1,0,0,0|1,0,0]=3 732 B21R3.3965166 Cc1cccnc1C(C)Nc2nc3ccccc3s2 27a_100011536111_100000751744 [1,0,1,0,0,0|2,0,0]=4 733 B23R3.1471 Cc1ccc(cc1)CC(=O)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000212244 [0,1,1,0,0,0|2,0,0]=4 734 B23R3.1471 Cc1ccc(cc1)CC(=O)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000212244 [0,1,1,0,0,0|2,0,0]=4 735 B23R3.1471 Cc1ccc(cc1)CC(=O)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000212244 [0,1,1,0,0,0|2,0,0]=4 736 B23R3.1471 Cc1ccc(cc1)NC(=O)NC2CCCc3c2ccnc3 2430a_100000124888_100020634316 [0,1,1,0,0,0|2,0,0]=4 737 B23R3.1471 Cc1ccc(cc1)NC(=O)NC2CCCc3c2nccc3 2430a_100000124888_100011259139 [0,1,1,0,0,0|2,0,0]=4 738 B23R3.1471 Cc1ccc(cc1)NC(=O)NC2CCOc3c2cccc3 2430a_100000124888_100015190321 [0,1,1,0,0,0|2,0,0]=4 739 B23R3.1471 Cc1ccc(cc1)NC(=O)N[C@H]2CCCc3c2cccc3 2430a_100000124888_100020654734 [0,1,1,0,0,0|1,0,0]=3 740 B23R3.1471 O=C(Cc1ccc(cc1)Br)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000198978 [0,1,1,0,0,0|2,0,0]=4 741 B23R3.1471 O=C(Cc1ccc(cc1)Br)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000198978 [0,1,1,0,0,0|2,0,0]=4 742 B23R3.1471 O=C(Cc1ccc(cc1)Br)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000198978 [0,1,1,0,0,0|2,0,0]=4 743 B23R3.1471 O=C(Cc1ccc(cc1)Cl)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000211027 [0,1,1,0,0,0|2,0,0]=4 744 B23R3.1471 O=C(Cc1ccc(cc1)Cl)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000211027 [0,1,1,0,0,0|2,0,0]=4 745 B23R3.1471 O=C(Cc1ccc(cc1)Cl)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000211027 [0,1,1,0,0,0|2,0,0]=4 746 B23R3.1471 O=C(Cc1ccc(cc1)F)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000210951 [0,1,1,0,0,0|2,0,0]=4 747 B23R3.1471 O=C(Cc1ccc(cc1)F)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000210951 [0,1,1,0,0,0|2,0,0]=4 748 B23R3.1471 O=C(Cc1ccc(cc1)F)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000210951 [0,1,1,0,0,0|2,0,0]=4 749 B23R3.1471 O=C(Cc1ccc(cc1)F)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000210951 [0,1,1,0,0,0|2,0,0]=4 750 B23R3.1471 O=C(Cc1ccc(cc1)I)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000688869 [0,1,1,0,0,0|2,0,0]=4 751 B23R3.1471 O=C(Cc1ccc(cc1)I)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000688869 [0,1,1,0,0,0|2,0,0]=4 752 B23R3.1471 O=C(Cc1ccc(cc1)I)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000688869 [0,1,1,0,0,0|2,0,0]=4 753 B23R3.1471 O=C(Cc1ccc(cc1)I)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000688869 [0,1,1,0,0,0|2,0,0]=4 754 B23R3.1471 O=C(Cc1ccc(cc1)O)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000198540 [0,1,1,0,0,0|2,0,0]=4 755 B23R3.1471 O=C(Cc1ccc(cc1)O)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000198540 [0,1,1,0,0,0|2,0,0]=4 756 B23R3.1471 O=C(Cc1ccc(cc1)O)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000198540 [0,1,1,0,0,0|2,0,0]=4 757 B23R3.1471 O=C(Nc1ccc(cc1)Br)NC2CCCc3c2ccnc3 2430a_100000210018_100020634316 [0,1,1,0,0,0|2,0,0]=4 758 B23R3.1471 O=C(Nc1ccc(cc1)Br)NC2CCCc3c2nccc3 2430a_100000210018_100011259139 [0,1,1,0,0,0|2,0,0]=4 759 B23R3.1471 O=C(Nc1ccc(cc1)Br)NC2CCOc3c2cccc3 2430a_100000210018_100015190321 [0,1,1,0,0,0|2,0,0]=4 760 B23R3.1471 O=C(Nc1ccc(cc1)Br)N[C@H]2CCCc3c2cccc3 2430a_100000210018_100020654734 [0,1,1,0,0,0|1,0,0]=3 761 B23R3.1471 O=C(Nc1ccc(cc1)Cl)NC2CCCc3c2ccnc3 2430a_100000210052_100020634316 [0,1,1,0,0,0|2,0,0]=4 762 B23R3.1471 O=C(Nc1ccc(cc1)Cl)NC2CCCc3c2nccc3 2430a_100000210052_100011259139 [0,1,1,0,0,0|2,0,0]=4 763 B23R3.1471 O=C(Nc1ccc(cc1)Cl)NC2CCOc3c2cccc3 2430a_100000210052_100015190321 [0,1,1,0,0,0|2,0,0]=4 764 B23R3.1471 O=C(Nc1ccc(cc1)Cl)N[C@H]2CCCc3c2cccc3 2430a_100000210052_100020654734 [0,1,1,0,0,0|1,0,0]=3 765 B23R3.1471 O=C(Nc1ccc(cc1)F)NC2CCCc3c2ccnc3 2430a_100000185862_100020634316 [0,1,1,0,0,0|2,0,0]=4 766 B23R3.1471 O=C(Nc1ccc(cc1)F)NC2CCCc3c2nccc3 2430a_100000185862_100011259139 [0,1,1,0,0,0|2,0,0]=4 767 B23R3.1471 O=C(Nc1ccc(cc1)F)NC2CCOc3c2cccc3 2430a_100000185862_100015190321 [0,1,1,0,0,0|2,0,0]=4 768 B23R3.1471 O=C(Nc1ccc(cc1)F)N[C@H]2CCCc3c2cccc3 2430a_100000185862_100020654734 [0,1,1,0,0,0|1,0,0]=3 769 B23R3.1471 O=C(Nc1ccc(cc1)I)NC2CCCc3c2ccnc3 2430a_100000185761_100020634316 [0,1,1,0,0,0|2,0,0]=4 770 B23R3.1471 O=C(Nc1ccc(cc1)I)NC2CCCc3c2nccc3 2430a_100000185761_100011259139 [0,1,1,0,0,0|2,0,0]=4 771 B23R3.1471 O=C(Nc1ccc(cc1)I)NC2CCOc3c2cccc3 2430a_100000185761_100015190321 [0,1,1,0,0,0|2,0,0]=4 772 B23R3.1471 O=C(Nc1ccc(cc1)I)N[C@H]2CCCc3c2cccc3 2430a_100000185761_100020654734 [0,1,1,0,0,0|1,0,0]=3 773 B23R3.1471 O=C(Nc1ccc(cc1)O)NC2CCCc3c2ccnc3 2430a_100000185829_100020634316 [0,1,1,0,0,0|2,0,0]=4 774 B23R3.1471 O=C(Nc1ccc(cc1)O)NC2CCCc3c2nccc3 2430a_100000185829_100011259139 [0,1,1,0,0,0|2,0,0]=4 775 B23R3.1471 O=C(Nc1ccc(cc1)O)NC2CCOc3c2cccc3 2430a_100000185829_100015190321 [0,1,1,0,0,0|2,0,0]=4 776 B23R3.1471 O=C(Nc1ccc(cc1)O)N[C@H]2CCCc3c2cccc3 2430a_100000185829_100020654734 [0,1,1,0,0,0|1,0,0]=3 777 B23R3.17033 Cc1ccccc1CC(=O)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000212180 [0,1,1,0,0,0|2,0,0]=4 778 B23R3.17033 Cc1ccccc1CC(=O)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000212180 [0,1,1,0,0,0|2,0,0]=4 779 B23R3.17033 Cc1ccccc1CC(=O)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000212180 [0,1,1,0,0,0|2,0,0]=4 780 B23R3.17033 Cc1ccccc1CC(=O)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000212180 [0,1,1,0,0,0|2,0,0]=4 781 B23R3.17033 Cc1ccccc1NC(=O)NC2CCCc3c2ccnc3 2430a_100015192222_100020634316 [0,1,1,0,0,0|2,0,0]=4 782 B23R3.17033 Cc1ccccc1NC(=O)NC2CCCc3c2nccc3 2430a_100015192222_100011259139 [0,1,1,0,0,0|2,0,0]=4 783 B23R3.17033 Cc1ccccc1NC(=O)NC2CCOc3c2cccc3 2430a_100015192222_100015190321 [0,1,1,0,0,0|2,0,0]=4 784 B23R3.17033 Cc1ccccc1NC(=O)N[C@H]2CCCc3c2cccc3 2430a_100015192222_100020654734 [0,1,1,0,0,0|1,0,0]=3 785 B23R3.17033 O=C(Cc1ccccc1Br)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000751119 [0,1,1,0,0,0|2,0,0]=4 786 B23R3.17033 O=C(Cc1ccccc1Br)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000751119 [0,1,1,0,0,0|2,0,0]=4 787 B23R3.17033 O=C(Cc1ccccc1Br)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000751119 [0,1,1,0,0,0|2,0,0]=4 788 B23R3.17033 O=C(Cc1ccccc1Cl)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000183793 [0,1,1,0,0,0|2,0,0]=4 789 B23R3.17033 O=C(Cc1ccccc1Cl)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000183793 [0,1,1,0,0,0|2,0,0]=4 790 B23R3.17033 O=C(Cc1ccccc1Cl)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000183793 [0,1,1,0,0,0|2,0,0]=4 791 B23R3.17033 O=C(Cc1ccccc1Cl)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000183793 [0,1,1,0,0,0|2,0,0]=4 792 B23R3.17033 O=C(Cc1ccccc1F)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000212012 [0,1,1,0,0,0|2,0,0]=4 793 B23R3.17033 O=C(Cc1ccccc1F)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000212012 [0,1,1,0,0,0|2,0,0]=4 794 B23R3.17033 O=C(Cc1ccccc1F)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000212012 [0,1,1,0,0,0|2,0,0]=4 795 B23R3.17033 O=C(Cc1ccccc1F)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000212012 [0,1,1,0,0,0|2,0,0]=4 796 B23R3.17033 O=C(Cc1ccccc1I)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000036491 [0,1,1,0,0,0|2,0,0]=4 797 B23R3.17033 O=C(Cc1ccccc1I)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000036491 [0,1,1,0,0,0|2,0,0]=4 798 B23R3.17033 O=C(Cc1ccccc1I)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000036491 [0,1,1,0,0,0|2,0,0]=4 799 B23R3.17033 O=C(Cc1ccccc1I)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000036491 [0,1,1,0,0,0|2,0,0]=4 800 B23R3.17033 O=C(Cc1ccccc1O)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000743006 [0,1,1,0,0,0|2,0,0]=4 801 B23R3.17033 O=C(Cc1ccccc1O)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000743006 [0,1,1,0,0,0|2,0,0]=4 802 B23R3.17033 O=C(Nc1ccccc1Br)NC2CCCc3c2ccnc3 2430a_100000210017_100020634316 [0,1,1,0,0,0|2,0,0]=4 803 B23R3.17033 O=C(Nc1ccccc1Br)NC2CCCc3c2nccc3 2430a_100000210017_100011259139 [0,1,1,0,0,0|2,0,0]=4 804 B23R3.17033 O=C(Nc1ccccc1Br)NC2CCOc3c2cccc3 2430a_100000210017_100015190321 [0,1,1,0,0,0|2,0,0]=4 805 B23R3.17033 O=C(Nc1ccccc1Br)N[C@H]2CCCc3c2cccc3 2430a_100000210017_100020654734 [0,1,1,0,0,0|1,0,0]=3 806 B23R3.17033 O=C(Nc1ccccc1Cl)NC2CCCc3c2ccnc3 2430a_100000185783_100020634316 [0,1,1,0,0,0|2,0,0]=4 807 B23R3.17033 O=C(Nc1ccccc1Cl)NC2CCCc3c2nccc3 2430a_100000185783_100011259139 [0,1,1,0,0,0|2,0,0]=4 808 B23R3.17033 O=C(Nc1ccccc1Cl)NC2CCOc3c2cccc3 2430a_100000185783_100015190321 [0,1,1,0,0,0|2,0,0]=4 809 B23R3.17033 O=C(Nc1ccccc1Cl)N[C@H]2CCCc3c2cccc3 2430a_100000185783_100020654734 [0,1,1,0,0,0|1,0,0]=3 810 B23R3.17033 O=C(Nc1ccccc1F)NC2CCCc3c2ccnc3 2430a_100000210422_100020634316 [0,1,1,0,0,0|2,0,0]=4 811 B23R3.17033 O=C(Nc1ccccc1F)NC2CCCc3c2nccc3 2430a_100000210422_100011259139 [0,1,1,0,0,0|2,0,0]=4 812 B23R3.17033 O=C(Nc1ccccc1F)NC2CCOc3c2cccc3 2430a_100000210422_100015190321 [0,1,1,0,0,0|2,0,0]=4 813 B23R3.17033 O=C(Nc1ccccc1F)N[C@H]2CCCc3c2cccc3 2430a_100000210422_100020654734 [0,1,1,0,0,0|1,0,0]=3 814 B23R3.17033 O=C(Nc1ccccc1I)NC2CCCc3c2ccnc3 2430a_100000210053_100020634316 [0,1,1,0,0,0|2,0,0]=4 815 B23R3.17033 O=C(Nc1ccccc1I)NC2CCCc3c2nccc3 2430a_100000210053_100011259139 [0,1,1,0,0,0|2,0,0]=4 816 B23R3.17033 O=C(Nc1ccccc1I)NC2CCOc3c2cccc3 2430a_100000210053_100015190321 [0,1,1,0,0,0|2,0,0]=4 817 B23R3.17033 O=C(Nc1ccccc1I)N[C@H]2CCCc3c2cccc3 2430a_100000210053_100020654734 [0,1,1,0,0,0|1,0,0]=3 818 B23R3.17033 O=C(Nc1ccccc1O)NC2CCCc3c2ccnc3 2430a_100000185747_100020634316 [0,1,1,0,0,0|2,0,0]=4 819 B23R3.17033 O=C(Nc1ccccc1O)NC2CCCc3c2nccc3 2430a_100000185747_100011259139 [0,1,1,0,0,0|2,0,0]=4 820 B23R3.17033 O=C(Nc1ccccc1O)NC2CCOc3c2cccc3 2430a_100000185747_100015190321 [0,1,1,0,0,0|2,0,0]=4 821 B23R3.17033 O=C(Nc1ccccc1O)N[C@H]2CCCc3c2cccc3 2430a_100000185747_100020654734 [0,1,1,0,0,0|1,0,0]=3 822 B23R3.17476 O=C(Nc1ccccc1)NC2CCCc3c2ccc(c3)Cl 2430a_100000106764_100025717365 [0,1,1,0,0,0|1,0,0]=3 823 B23R3.17476 O=C(Nc1ccccc1)NC2CCCc3c2ccc(c3)F 2430a_100000106764_100000695172 [0,1,1,0,0,0|1,0,0]=3 824 B23R3.17476 O=C(Nc1ccccc1)NC2CCOc3c2ccc(c3)F 2430a_100000106764_100015190460 [0,1,1,0,0,0|2,0,0]=4 825 B23R3.17476 O=C(Nc1ccccc1)N[C@@H]2CCOc3c2ccc(c3)Br 2430a_100000106764_100020639266 [0,1,1,0,0,0|2,0,0]=4 826 B23R3.17476 O=C(Nc1ccccc1)N[C@H]2CCCc3c2ccc(c3)Br 2430a_100000106764_100160469487 [0,1,1,0,0,0|1,0,0]=3 827 B23R3.44114 Cc1cccc(c1)CC(=O)N[C@H]2CCCc3c2cccc3 11a_100020654734_100011206899 [0,1,1,0,0,0|2,0,0]=4 828 B23R3.44114 Cc1cccc(c1)CC(=O)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100011206899 [0,1,1,0,0,0|2,0,0]=4 829 B23R3.44114 Cc1cccc(c1)CC(=O)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100011206899 [0,1,1,0,0,0|2,0,0]=4 830 B23R3.44114 Cc1cccc(c1)CC(=O)N[C@H]2CCCc3c2cccc3 527a_100020654734_100011206899 [0,1,1,0,0,0|2,0,0]=4 831 B23R3.44114 Cc1cccc(c1)NC(=O)NC2CCCc3c2ccnc3 2430a_100000188690_100020634316 [0,1,1,0,0,0|2,0,0]=4 832 B23R3.44114 Cc1cccc(c1)NC(=O)NC2CCCc3c2ccnc3 512a_100000188690_100020634316 [0,1,1,0,0,0|2,0,0]=4 833 B23R3.44114 Cc1cccc(c1)NC(=O)NC2CCCc3c2nccc3 2430a_100000188690_100011259139 [0,1,1,0,0,0|2,0,0]=4 834 B23R3.44114 Cc1cccc(c1)NC(=O)NC2CCCc3c2nccc3 512a_100000188690_100011259139 [0,1,1,0,0,0|2,0,0]=4 835 B23R3.44114 Cc1cccc(c1)NC(=O)NC2CCOc3c2cccc3 2430a_100000188690_100015190321 [0,1,1,0,0,0|2,0,0]=4 836 B23R3.44114 Cc1cccc(c1)NC(=O)NC2CCOc3c2cccc3 512a_100000188690_100015190321 [0,1,1,0,0,0|2,0,0]=4 837 B23R3.44114 Cc1cccc(c1)NC(=O)N[C@H]2CCCc3c2cccc3 2430a_100000188690_100020654734 [0,1,1,0,0,0|1,0,0]=3 838 B23R3.44114 Cc1cccc(c1)NC(=O)N[C@H]2CCCc3c2cccc3 512a_100000188690_100020654734 [0,1,1,0,0,0|1,0,0]=3 839 B23R3.44114 O=C(Cc1cccc(c1)Br)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000747190 [0,1,1,0,0,0|2,0,0]=4 840 B23R3.44114 O=C(Cc1cccc(c1)Br)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000747190 [0,1,1,0,0,0|2,0,0]=4 841 B23R3.44114 O=C(Cc1cccc(c1)Br)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000747190 [0,1,1,0,0,0|2,0,0]=4 842 B23R3.44114 O=C(Cc1cccc(c1)Cl)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000749307 [0,1,1,0,0,0|2,0,0]=4 843 B23R3.44114 O=C(Cc1cccc(c1)Cl)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000749307 [0,1,1,0,0,0|2,0,0]=4 844 B23R3.44114 O=C(Cc1cccc(c1)Cl)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000749307 [0,1,1,0,0,0|2,0,0]=4 845 B23R3.44114 O=C(Cc1cccc(c1)Cl)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000749307 [0,1,1,0,0,0|2,0,0]=4 846 B23R3.44114 O=C(Cc1cccc(c1)F)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000211661 [0,1,1,0,0,0|2,0,0]=4 847 B23R3.44114 O=C(Cc1cccc(c1)F)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000211661 [0,1,1,0,0,0|2,0,0]=4 848 B23R3.44114 O=C(Cc1cccc(c1)F)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000211661 [0,1,1,0,0,0|2,0,0]=4 849 B23R3.44114 O=C(Cc1cccc(c1)F)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000211661 [0,1,1,0,0,0|2,0,0]=4 850 B23R3.44114 O=C(Cc1cccc(c1)I)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000238430 [0,1,1,0,0,0|2,0,0]=4 851 B23R3.44114 O=C(Cc1cccc(c1)I)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000238430 [0,1,1,0,0,0|2,0,0]=4 852 B23R3.44114 O=C(Cc1cccc(c1)I)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000238430 [0,1,1,0,0,0|2,0,0]=4 853 B23R3.44114 O=C(Cc1cccc(c1)I)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000238430 [0,1,1,0,0,0|2,0,0]=4 854 B23R3.44114 O=C(Cc1cccc(c1)O)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000745134 [0,1,1,0,0,0|2,0,0]=4 855 B23R3.44114 O=C(Cc1cccc(c1)O)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000745134 [0,1,1,0,0,0|2,0,0]=4 856 B23R3.44114 O=C(Nc1cccc(c1)Br)NC2CCCc3c2ccnc3 2430a_100000210019_100020634316 [0,1,1,0,0,0|2,0,0]=4 857 B23R3.44114 O=C(Nc1cccc(c1)Br)NC2CCCc3c2ccnc3 512a_100000210019_100020634316 [0,1,1,0,0,0|2,0,0]=4 858 B23R3.44114 O=C(Nc1cccc(c1)Br)NC2CCCc3c2nccc3 2430a_100000210019_100011259139 [0,1,1,0,0,0|2,0,0]=4 859 B23R3.44114 O=C(Nc1cccc(c1)Br)NC2CCCc3c2nccc3 512a_100000210019_100011259139 [0,1,1,0,0,0|2,0,0]=4 860 B23R3.44114 O=C(Nc1cccc(c1)Br)NC2CCOc3c2cccc3 2430a_100000210019_100015190321 [0,1,1,0,0,0|2,0,0]=4 861 B23R3.44114 O=C(Nc1cccc(c1)Br)NC2CCOc3c2cccc3 512a_100000210019_100015190321 [0,1,1,0,0,0|2,0,0]=4 862 B23R3.44114 O=C(Nc1cccc(c1)Br)N[C@H]2CCCc3c2cccc3 2430a_100000210019_100020654734 [0,1,1,0,0,0|1,0,0]=3 863 B23R3.44114 O=C(Nc1cccc(c1)Br)N[C@H]2CCCc3c2cccc3 512a_100000210019_100020654734 [0,1,1,0,0,0|1,0,0]=3 864 B23R3.44114 O=C(Nc1cccc(c1)Cl)NC2CCCc3c2ccnc3 2430a_100000185859_100020634316 [0,1,1,0,0,0|2,0,0]=4 865 B23R3.44114 O=C(Nc1cccc(c1)Cl)NC2CCCc3c2nccc3 2430a_100000185859_100011259139 [0,1,1,0,0,0|2,0,0]=4 866 B23R3.44114 O=C(Nc1cccc(c1)Cl)NC2CCOc3c2cccc3 2430a_100000185859_100015190321 [0,1,1,0,0,0|2,0,0]=4 867 B23R3.44114 O=C(Nc1cccc(c1)Cl)N[C@H]2CCCc3c2cccc3 2430a_100000185859_100020654734 [0,1,1,0,0,0|1,0,0]=3 868 B23R3.44114 O=C(Nc1cccc(c1)F)NC2CCCc3c2ccnc3 2430a_100000210047_100020634316 [0,1,1,0,0,0|2,0,0]=4 869 B23R3.44114 O=C(Nc1cccc(c1)F)NC2CCCc3c2ccnc3 512a_100000210047_100020634316 [0,1,1,0,0,0|2,0,0]=4 870 B23R3.44114 O=C(Nc1cccc(c1)F)NC2CCCc3c2nccc3 2430a_100000210047_100011259139 [0,1,1,0,0,0|2,0,0]=4 871 B23R3.44114 O=C(Nc1cccc(c1)F)NC2CCCc3c2nccc3 512a_100000210047_100011259139 [0,1,1,0,0,0|2,0,0]=4 872 B23R3.44114 O=C(Nc1cccc(c1)F)NC2CCOc3c2cccc3 2430a_100000210047_100015190321 [0,1,1,0,0,0|2,0,0]=4 873 B23R3.44114 O=C(Nc1cccc(c1)F)NC2CCOc3c2cccc3 512a_100000210047_100015190321 [0,1,1,0,0,0|2,0,0]=4 874 B23R3.44114 O=C(Nc1cccc(c1)F)N[C@H]2CCCc3c2cccc3 2430a_100000210047_100020654734 [0,1,1,0,0,0|1,0,0]=3 875 B23R3.44114 O=C(Nc1cccc(c1)F)N[C@H]2CCCc3c2cccc3 512a_100000210047_100020654734 [0,1,1,0,0,0|1,0,0]=3 876 B23R3.44114 O=C(Nc1cccc(c1)I)NC2CCCc3c2ccnc3 2430a_100000211102_100020634316 [0,1,1,0,0,0|2,0,0]=4 877 B23R3.44114 O=C(Nc1cccc(c1)I)NC2CCCc3c2ccnc3 512a_100000211102_100020634316 [0,1,1,0,0,0|2,0,0]=4 878 B23R3.44114 O=C(Nc1cccc(c1)I)NC2CCCc3c2nccc3 2430a_100000211102_100011259139 [0,1,1,0,0,0|2,0,0]=4 879 B23R3.44114 O=C(Nc1cccc(c1)I)NC2CCCc3c2nccc3 512a_100000211102_100011259139 [0,1,1,0,0,0|2,0,0]=4 880 B23R3.44114 O=C(Nc1cccc(c1)I)NC2CCOc3c2cccc3 2430a_100000211102_100015190321 [0,1,1,0,0,0|2,0,0]=4 881 B23R3.44114 O=C(Nc1cccc(c1)I)NC2CCOc3c2cccc3 512a_100000211102_100015190321 [0,1,1,0,0,0|2,0,0]=4 882 B23R3.44114 O=C(Nc1cccc(c1)I)N[C@H]2CCCc3c2cccc3 2430a_100000211102_100020654734 [0,1,1,0,0,0|1,0,0]=3 883 B23R3.44114 O=C(Nc1cccc(c1)I)N[C@H]2CCCc3c2cccc3 512a_100000211102_100020654734 [0,1,1,0,0,0|1,0,0]=3 884 B23R3.44114 O=C(Nc1cccc(c1)O)NC2CCCc3c2ccnc3 2430a_100000210217_100020634316 [0,1,1,0,0,0|2,0,0]=4 885 B23R3.44114 O=C(Nc1cccc(c1)O)NC2CCCc3c2ccnc3 512a_100000210217_100020634316 [0,1,1,0,0,0|2,0,0]=4 886 B23R3.44114 O=C(Nc1cccc(c1)O)NC2CCCc3c2nccc3 2430a_100000210217_100011259139 [0,1,1,0,0,0|2,0,0]=4 887 B23R3.44114 O=C(Nc1cccc(c1)O)NC2CCCc3c2nccc3 512a_100000210217_100011259139 [0,1,1,0,0,0|2,0,0]=4 888 B23R3.44114 O=C(Nc1cccc(c1)O)NC2CCOc3c2cccc3 2430a_100000210217_100015190321 [0,1,1,0,0,0|2,0,0]=4 889 B23R3.44114 O=C(Nc1cccc(c1)O)NC2CCOc3c2cccc3 512a_100000210217_100015190321 [0,1,1,0,0,0|2,0,0]=4 890 B23R3.44114 O=C(Nc1cccc(c1)O)N[C@H]2CCCc3c2cccc3 2430a_100000210217_100020654734 [0,1,1,0,0,0|1,0,0]=3 891 B23R3.44114 O=C(Nc1cccc(c1)O)N[C@H]2CCCc3c2cccc3 512a_100000210217_100020654734 [0,1,1,0,0,0|1,0,0]=3 892 B23R3.145231 Cc1ccc2c(c1)C(CCC2)NC(=O)Nc3ccccc3 2430a_100000106764_100015204190 [0,1,1,0,0,0|1,0,0]=3 893 B23R3.145231 O=C(Nc1ccccc1)NC2CCCc3c2cc(cc3)Br 2430a_100000106764_100011742594 [0,1,1,0,0,0|1,0,0]=3 894 B23R3.145231 O=C(Nc1ccccc1)NC2CCOc3c2cc(cc3)Cl 2430a_100000106764_100011264799 [0,1,1,0,0,0|2,0,0]=4 895 B23R3.145231 O=C(Nc1ccccc1)NC2CCOc3c2cc(cc3)F 2430a_100000106764_100000754146 [0,1,1,0,0,0|2,0,0]=4 896 B23R3.145231 O=C(Nc1ccccc1)NC2CCSc3c2cc(cc3)Br 2430a_100000106764_100000744474 [0,1,1,0,0,0|2,0,0]=4 897 B23R3.145231 O=C(Nc1ccccc1)N[C@@H]2CCCc3c2cc(cc3)F 2430a_100000106764_200000724602 [0,1,1,0,0,0|1,0,0]=3 898 B23R3.145231 O=C(Nc1ccccc1)N[C@H]2CCCc3c2cc(cc3)Cl 2430a_100000106764_100011998213 [0,1,1,0,0,0|1,0,0]=3 899 B23R3.145231 O=C(Nc1ccccc1)N[C@H]2CCOc3c2cc(cc3)Br 2430a_100000106764_100020639276 [0,1,1,0,0,0|2,0,0]=4 900 B23R3.674964 Cc1cccc2c1OCC[C@H]2NC(=O)Nc3ccccc3 2430a_100000106764_100000717741 [0,1,1,0,0,0|2,0,0]=4 901 B23R3.674964 O=C(Nc1ccccc1)NC2CCCc3c2cccc3Br 2430a_100000106764_100020639248 [0,1,1,0,0,0|1,0,0]=3 902 B23R3.674964 O=C(Nc1ccccc1)NC2CCCc3c2cccc3F 2430a_100000106764_100000085590 [0,1,1,0,0,0|1,0,0]=3 903 B23R3.674964 O=C(Nc1ccccc1)NC2CCOc3c2cccc3Br 2430a_100000106764_100000727345 [0,1,1,0,0,0|2,0,0]=4 904 B23R3.674964 O=C(Nc1ccccc1)NC2CCOc3c2cccc3F 2430a_100000106764_100000746867 [0,1,1,0,0,0|2,0,0]=4 905 B23R3.674964 O=C(Nc1ccccc1)N[C@@H]2CCCc3c2cccc3Cl 2430a_100000106764_100025717364 [0,1,1,0,0,0|1,0,0]=3 906 B23R3.941732 CN(C(=O)Nc1ccccc1)C2CCCc3c2cccc3 2430a_100000106764_100000185324 [0,1,1,0,0,0|1,0,0]=3 907 B23R3.15972038 O=C(Nc1ccccc1)NC2CCOc3c2c(ccc3)F 2430a_100000106764_100009881269 [0,1,1,0,0,0|2,0,0]=4 908 B23R3.19474132 C=C(C(=O)N[C@H]1CCCc2c1cccc2)c3ccccc3 1626a_100020654734_100000065200 [0,1,1,0,0,0|2,0,0]=4 909 B23R3.19474132 CN(C(=O)NC1CCCc2c1ccnc2)c3ccccc3 512a_100020634316_100000210012 [0,1,1,0,0,0|2,0,0]=4 910 B23R3.19474132 CN(C(=O)NC1CCCc2c1nccc2)c3ccccc3 512a_100011259139_100000210012 [0,1,1,0,0,0|2,0,0]=4 911 B23R3.19474132 CN(C(=O)NC1CCOc2c1cccc2)c3ccccc3 512a_100015190321_100000210012 [0,1,1,0,0,0|2,0,0]=4 912 B23R3.19474132 CN(C(=O)N[C@H]1CCCc2c1cccc2)c3ccccc3 512a_100020654734_100000210012 [0,1,1,0,0,0|1,0,0]=3 913 B23R3.19474132 C[C@H](C(=O)N[C@H]1CCCc2c1cccc2)c3ccccc3 11a_100020654734_100000751047 [0,1,1,0,0,0|2,0,0]=4 914 B23R3.19474132 C[C@H](C(=O)N[C@H]1CCCc2c1cccc2)c3ccccc3 1626a_100020654734_100000751047 [0,1,1,0,0,0|2,0,0]=4 915 B23R3.19474132 C[C@H](C(=O)N[C@H]1CCCc2c1cccc2)c3ccccc3 240690a_100020654734_100000751047 [0,1,1,0,0,0|2,0,0]=4 916 B23R3.19474132 C[C@H](C(=O)N[C@H]1CCCc2c1cccc2)c3ccccc3 527a_100020654734_100000751047 [0,1,1,0,0,0|2,0,0]=4 917 B23R3.19474132 O=C(N[C@H]1CCCc2c1cccc2)C(F)c3ccccc3 11a_100020654734_100000698975 [0,1,1,0,0,0|2,0,0]=4 918 B23R3.19474132 O=C(N[C@H]1CCCc2c1cccc2)C(F)c3ccccc3 1626a_100020654734_100000698975 [0,1,1,0,0,0|2,0,0]=4 919 B23R3.19474132 O=C(N[C@H]1CCCc2c1cccc2)C(F)c3ccccc3 240690a_100020654734_100000698975 [0,1,1,0,0,0|2,0,0]=4 920 B23R3.19474132 O=C(N[C@H]1CCCc2c1cccc2)C(F)c3ccccc3 527a_100020654734_100000698975 [0,1,1,0,0,0|2,0,0]=4 921 B23R3.19474132 O=C(N[C@H]1CCCc2c1cccc2)[C@H](O)c3ccccc3 240690a_100020654734_100000684486 [0,1,1,0,0,0|2,0,0]=4 922 B23R3.18329 CCCCC(Nc1nc2ccccc2[nH]1)c3cccnc3 27a_200011711859_100009814255 [0,1,1,0,0,0|1,0,0]=3 923 B23R3.18329 CCCCC(Nc1nc2ccccc2[nH]1)c3ccncc3 27a_100015203128_100009814255 [0,1,1,0,0,0|1,0,0]=3 924 B23R3.18329 CCCCC(Nc1nc2ccccc2s1)c3cccnc3 27a_200011711859_100000751744 [0,1,1,0,0,0|2,0,0]=4 925 B23R3.18329 CCCCC(Nc1nc2ccccc2s1)c3ccncc3 27a_100015203128_100000751744 [0,1,1,0,0,0|2,0,0]=4 926 B23R3.18329 CCCCN(Cc1nc2ccccc2[nH]1)c3ccccc3 2230a_100000211623_100000737899 [0,1,1,0,0,0|2,0,0]=4 927 B23R3.18329 CCCCN(Cc1nc2ccccc2[nH]1)c3ccccc3 269982a_100000211623_100000737899 [0,1,1,0,0,0|2,0,0]=4 928 B23R3.18329 OCCCC(Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100000759318_100009814255 [0,1,1,0,0,0|0,0,0]=2 929 B23R3.18329 OCCCC(Nc1nc2ccccc2s1)c3ccccc3 27a_100000759318_100000751744 [0,1,1,0,0,0|1,0,0]=3 930 B23R3.18329 OCCCC(Nc1nc2cccnc2s1)c3ccccc3 27a_100000759318_100010188088 [0,1,1,0,0,0|2,0,0]=4 931 B23R3.18329 OCCCN(Cc1nc2ccccc2[nH]1)c3ccccc3 2230a_100000212590_100000737899 [0,1,1,0,0,0|2,0,0]=4 932 B23R3.18329 OCCCN(Cc1nc2ccccc2[nH]1)c3ccccc3 269982a_100000212590_100000737899 [0,1,1,0,0,0|2,0,0]=4 933 B23R3.54548 CCC[C@@H](Nc1nc2ccccc2[nH]1)c3ccc(cc3)C 27a_200020633650_100009814255 [0,1,1,0,0,0|0,0,0]=2 934 B23R3.54548 CCC[C@@H](Nc1nc2ccccc2s1)c3ccc(cc3)C 27a_200020633650_100000751744 [0,1,1,0,0,0|1,0,0]=3 935 B23R3.54548 CCC[C@@H](Nc1nc2cccnc2s1)c3ccc(cc3)C 27a_200020633650_100010188088 [0,1,1,0,0,0|2,0,0]=4 936 B23R3.54548 CCC[C@H](Nc1nc2ccccc2[nH]1)c3ccc(cc3)F 27a_100020612123_100009814255 [0,1,1,0,0,0|0,0,0]=2 937 B23R3.54548 CCC[C@H](Nc1nc2ccccc2s1)c3ccc(cc3)F 27a_100020612123_100000751744 [0,1,1,0,0,0|1,0,0]=3 938 B23R3.54548 CCC[C@H](Nc1nc2cccnc2s1)c3ccc(cc3)F 27a_100020612123_100010188088 [0,1,1,0,0,0|2,0,0]=4 939 B23R3.54548 Cc1ccc(cc1)C(CCO)Nc2nc3ccccc3[nH]2 27a_100011661551_100009814255 [0,1,1,0,0,0|1,0,0]=3 940 B23R3.54548 Cc1ccc(cc1)C(CCO)Nc2nc3ccccc3s2 27a_100011661551_100000751744 [0,1,1,0,0,0|2,0,0]=4 941 B23R3.54548 OCCC(Nc1nc2ccccc2[nH]1)c3ccc(cc3)Cl 27a_100000730317_100009814255 [0,1,1,0,0,0|1,0,0]=3 942 B23R3.54548 OCCC(Nc1nc2ccccc2[nH]1)c3ccc(cc3)F 27a_100000752280_100009814255 [0,1,1,0,0,0|1,0,0]=3 943 B23R3.54548 OCCC(Nc1nc2ccccc2s1)c3ccc(cc3)Cl 27a_100000730317_100000751744 [0,1,1,0,0,0|2,0,0]=4 944 B23R3.54548 OCCC(Nc1nc2ccccc2s1)c3ccc(cc3)F 27a_100000752280_100000751744 [0,1,1,0,0,0|2,0,0]=4 945 B23R3.54548 OCC[C@H](Nc1nc2ccccc2[nH]1)c3ccc(cc3)Br 27a_102125605589_100009814255 [0,1,1,0,0,0|1,0,0]=3 946 B23R3.54548 OCC[C@H](Nc1nc2ccccc2s1)c3ccc(cc3)Br 27a_102125605589_100000751744 [0,1,1,0,0,0|2,0,0]=4 947 B23R3.937640 CC(C)CC(Nc1nc2ccccc2[nH]1)c3ccccn3 27a_100159271263_100009814255 [0,1,1,0,0,0|1,0,0]=3 948 B23R3.937640 CC(C)CC(Nc1nc2ccccc2[nH]1)c3cccnc3 27a_200011351310_100009814255 [0,1,1,0,0,0|1,0,0]=3 949 B23R3.937640 CC(C)CC(Nc1nc2ccccc2s1)c3ccccn3 27a_100159271263_100000751744 [0,1,1,0,0,0|2,0,0]=4 950 B23R3.937640 CC(C)CC(Nc1nc2ccccc2s1)c3cccnc3 27a_200011351310_100000751744 [0,1,1,0,0,0|2,0,0]=4 951 B23R3.937640 CC(C)C[C@H](Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100016987908_100009814255 [0,1,1,0,0,0|0,0,0]=2 952 B23R3.937640 CC(C)C[C@H](Nc1nc2ccccc2s1)c3ccccc3 27a_100016987908_100000751744 [0,1,1,0,0,0|1,0,0]=3 953 B23R3.937640 CC(C)C[C@H](Nc1nc2cccnc2s1)c3ccccc3 27a_100016987908_100010188088 [0,1,1,0,0,0|2,0,0]=4 954 B23R3.937640 CN(C)CC(Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100000209865_100009814255 [0,1,1,0,0,0|1,0,0]=3 955 B23R3.937640 CN(C)CC(Nc1nc2ccccc2s1)c3ccccc3 27a_100000209865_100000751744 [0,1,1,0,0,0|2,0,0]=4 956 B23R3.1010886 CCCC(Nc1nc2ccccc2n1C)c3ccccc3 27a_100000189686_200000239431 [0,1,1,0,0,0|0,0,0]=2 957 B23R3.1010886 CCCC(Nc1nc2ccccc2n1C)c3cccnc3 27a_100011351308_200000239431 [0,1,1,0,0,0|1,0,0]=3 958 B23R3.1010886 CCCC(Nc1nc2ccccc2n1C)c3ccncc3 27a_100011351316_200000239431 [0,1,1,0,0,0|1,0,0]=3 959 B23R3.1010886 CCCN(Cc1nc2ccccc2n1C)c3ccccc3 2230a_200011218496_100000748711 [0,1,1,0,0,0|2,0,0]=4 960 B23R3.1010886 CCCN(Cc1nc2ccccc2n1C)c3ccccc3 269982a_200011218496_100000748711 [0,1,1,0,0,0|2,0,0]=4 961 B23R3.1010886 CCCN(Cc1nc2ccccc2n1C)c3ccccc3 34a_200011218496_100000748711 [0,1,1,0,0,0|2,0,0]=4 962 B23R3.1010886 COC[C@@H](Nc1nc2ccccc2n1C)c3ccccc3 27a_103619048568_200000239431 [0,1,1,0,0,0|1,0,0]=3 963 B23R3.1010886 Cn1c(nc2c1cccc2)N[C@@H](CCO)c3ccccc3 27a_100025705951_200000239431 [0,1,1,0,0,0|1,0,0]=3 964 B23R3.1010886 Cn1c(nc2c1cccc2)SC(CCCl)c3ccccc3 62a_200000239431_200010132975 [0,1,1,0,0,0|2,0,0]=4 965 B23R3.1010886 Cn1c(nc2c1cccc2)SC(CCCl)c3ccccc3 62a_200010132975_200000239431 [0,1,1,0,0,0|2,0,0]=4 966 B23R3.1010889 C=CCC(Nc1nc2ccccc2[nH]1)c3cccc(c3)Cl 27a_100025714385_100009814255 [0,1,1,0,0,0|0,0,2]=4 967 B23R3.1010889 Cc1cccc(c1)C(CCO)Nc2nc3ccccc3[nH]2 27a_100011661531_100009814255 [0,1,1,0,0,0|1,0,0]=3 968 B23R3.1010889 Cc1cccc(c1)C(CCO)Nc2nc3ccccc3s2 27a_100011661531_100000751744 [0,1,1,0,0,0|2,0,0]=4 969 B23R3.1010889 OCCC(Nc1nc2ccccc2[nH]1)c3cccc(c3)Br 27a_200011661555_100009814255 [0,1,1,0,0,0|1,0,0]=3 970 B23R3.1010889 OCCC(Nc1nc2ccccc2[nH]1)c3cccc(c3)Cl 27a_200011661548_100009814255 [0,1,1,0,0,0|1,0,0]=3 971 B23R3.1010889 OCCC(Nc1nc2ccccc2[nH]1)c3cccc(c3)F 27a_100011661530_100009814255 [0,1,1,0,0,0|1,0,0]=3 972 B23R3.1010889 OCCC(Nc1nc2ccccc2s1)c3cccc(c3)Br 27a_200011661555_100000751744 [0,1,1,0,0,0|2,0,0]=4 973 B23R3.1010889 OCCC(Nc1nc2ccccc2s1)c3cccc(c3)Cl 27a_200011661548_100000751744 [0,1,1,0,0,0|2,0,0]=4 974 B23R3.1010889 OCCC(Nc1nc2ccccc2s1)c3cccc(c3)F 27a_100011661530_100000751744 [0,1,1,0,0,0|2,0,0]=4 975 B23R3.1010889 OCC[C@H](Nc1nc2ccccc2[nH]1)c3cccc(c3)O 27a_100025705919_100009814255 [0,1,1,0,0,0|1,0,0]=3 976 B23R3.1010889 OCC[C@H](Nc1nc2ccccc2s1)c3cccc(c3)O 27a_100025705919_100000751744 [0,1,1,0,0,0|2,0,0]=4 977 B23R3.1010894 CCCN(Cc1nc2ccccc2[nH]1)c3ccccc3F 2230a_100011231789_100000737899 [0,1,1,0,0,0|2,0,0]=4 978 B23R3.1010894 CCCN(Cc1nc2ccccc2[nH]1)c3ccccc3F 269982a_100011231789_100000737899 [0,1,1,0,0,0|2,0,0]=4 979 B23R3.1010894 OCCC(Nc1nc2ccccc2[nH]1)c3ccccc3Cl 27a_100011661560_100009814255 [0,1,1,0,0,0|1,0,0]=3 980 B23R3.1010894 OCCC(Nc1nc2ccccc2[nH]1)c3ccccc3F 27a_100011661569_100009814255 [0,1,1,0,0,0|1,0,0]=3 981 B23R3.1010894 OCCC(Nc1nc2ccccc2s1)c3ccccc3Cl 27a_100011661560_100000751744 [0,1,1,0,0,0|2,0,0]=4 982 B23R3.1010894 OCCC(Nc1nc2ccccc2s1)c3ccccc3F 27a_100011661569_100000751744 [0,1,1,0,0,0|2,0,0]=4 983 B23R3.1904603 CCCC(Nc1nc2cc(ccc2s1)F)c3ccccc3 27a_100000189686_200010206605 [0,1,1,0,0,0|1,0,0]=3 984 B23R3.1904603 CCCC(Nc1nc2cc(ccc2s1)F)c3cccnc3 27a_100011351308_200010206605 [0,1,1,0,0,0|2,0,0]=4 985 B23R3.1904603 CCCC(Nc1nc2cc(ccc2s1)F)c3ccncc3 27a_100011351316_200010206605 [0,1,1,0,0,0|2,0,0]=4 986 B23R3.1904603 CCCC(Nc1nc2cc(ccc2s1)N)c3ccccc3 27a_100000189686_100010329861 [0,1,1,0,0,0|1,0,0]=3 987 B23R3.1904603 CCCC(Nc1nc2cc(ccc2s1)N)c3cccnc3 27a_100011351308_100010329861 [0,1,1,0,0,0|2,0,0]=4 988 B23R3.1904603 CCCC(Nc1nc2cc(ccc2s1)N)c3ccncc3 27a_100011351316_100010329861 [0,1,1,0,0,0|2,0,0]=4 989 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)C)c3ccccc3 27a_100000189686_100010186437 [0,1,1,0,0,0|1,0,0]=3 990 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)C)c3cccnc3 27a_100011351308_100010186437 [0,1,1,0,0,0|2,0,0]=4 991 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)C)c3ccncc3 27a_100011351316_100010186437 [0,1,1,0,0,0|2,0,0]=4 992 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)F)c3ccccc3 27a_100000189686_100000751617 [0,1,1,0,0,0|1,0,0]=3 993 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)F)c3cccnc3 27a_100011351308_100000751617 [0,1,1,0,0,0|2,0,0]=4 994 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)F)c3ccncc3 27a_100011351316_100000751617 [0,1,1,0,0,0|2,0,0]=4 995 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)N)c3ccccc3 27a_100000189686_100010253933 [0,1,1,0,0,0|1,0,0]=3 996 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)N)c3cccnc3 27a_100011351308_100010253933 [0,1,1,0,0,0|2,0,0]=4 997 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)N)c3ccncc3 27a_100011351316_100010253933 [0,1,1,0,0,0|2,0,0]=4 998 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)O)c3ccccc3 27a_100000189686_100010063415 [0,1,1,0,0,0|1,0,0]=3 999 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)O)c3cccnc3 27a_100011351308_100010063415 [0,1,1,0,0,0|2,0,0]=4 1000 B23R3.1904603 CCCC(Nc1nc2ccc(cc2s1)O)c3ccncc3 27a_100011351316_100010063415 [0,1,1,0,0,0|2,0,0]=4 1001 B23R3.1904603 CCCC(Nc1nc2ccc(nc2s1)F)c3ccccc3 27a_100000189686_200010738066 [0,1,1,0,0,0|2,0,0]=4 1002 B23R3.1904603 CCCN(Cc1nc2cc(ccc2[nH]1)Br)c3ccccc3 2230a_200011218496_100000701424 [0,1,1,0,0,0|2,0,0]=4 1003 B23R3.1904603 CCCN(Cc1nc2cc(ccc2[nH]1)Br)c3ccccc3 269982a_200011218496_100000701424 [0,1,1,0,0,0|2,0,0]=4 1004 B23R3.1904603 CCCN(Cc1nc2cc(ccc2[nH]1)Br)c3ccccc3 34a_200011218496_100000701424 [0,1,1,0,0,0|2,0,0]=4 1005 B23R3.1904603 CCCN(Cc1nc2cc(ccc2[nH]1)Cl)c3ccccc3 2230a_200011218496_100000179801 [0,1,1,0,0,0|2,0,0]=4 1006 B23R3.1904603 CCCN(Cc1nc2cc(ccc2[nH]1)Cl)c3ccccc3 269982a_200011218496_100000179801 [0,1,1,0,0,0|2,0,0]=4 1007 B23R3.1904603 CCCN(Cc1nc2ccc(cc2[nH]1)C)c3ccccc3 2230a_200011218496_100020603265 [0,1,1,0,0,0|2,0,0]=4 1008 B23R3.1904603 CCCN(Cc1nc2ccc(cc2[nH]1)C)c3ccccc3 269982a_200011218496_100020603265 [0,1,1,0,0,0|2,0,0]=4 1009 B23R3.1904603 CCCN(Cc1nc2ccc(cc2[nH]1)C)c3ccccc3 34a_200011218496_100020603265 [0,1,1,0,0,0|2,0,0]=4 1010 B23R3.1904603 CCCN(Cc1nc2ccc(cc2[nH]1)F)c3ccccc3 2230a_200011218496_200011347187 [0,1,1,0,0,0|2,0,0]=4 1011 B23R3.1904603 CCCN(Cc1nc2ccc(cc2[nH]1)F)c3ccccc3 269982a_200011218496_200011347187 [0,1,1,0,0,0|2,0,0]=4 1012 B23R3.1904603 COC[C@@H](Nc1nc2cc(ccc2s1)F)c3ccccc3 27a_103619048568_200010206605 [0,1,1,0,0,0|2,0,0]=4 1013 B23R3.1904603 COC[C@@H](Nc1nc2cc(ccc2s1)N)c3ccccc3 27a_103619048568_100010329861 [0,1,1,0,0,0|2,0,0]=4 1014 B23R3.1904603 COC[C@@H](Nc1nc2ccc(cc2s1)C)c3ccccc3 27a_103619048568_100010186437 [0,1,1,0,0,0|2,0,0]=4 1015 B23R3.1904603 COC[C@@H](Nc1nc2ccc(cc2s1)F)c3ccccc3 27a_103619048568_100000751617 [0,1,1,0,0,0|2,0,0]=4 1016 B23R3.1904603 COC[C@@H](Nc1nc2ccc(cc2s1)N)c3ccccc3 27a_103619048568_100010253933 [0,1,1,0,0,0|2,0,0]=4 1017 B23R3.1904603 COC[C@@H](Nc1nc2ccc(cc2s1)O)c3ccccc3 27a_103619048568_100010063415 [0,1,1,0,0,0|2,0,0]=4 1018 B23R3.1904603 Cc1ccc2nc(sc2c1)N[C@@H](CCO)c3ccccc3 27a_100025705951_100010186437 [0,1,1,0,0,0|2,0,0]=4 1019 B23R3.1904603 Nc1ccc2nc(sc2c1)N[C@@H](CCO)c3ccccc3 27a_100025705951_100010253933 [0,1,1,0,0,0|2,0,0]=4 1020 B23R3.1904603 Nc1ccc2sc(nc2c1)N[C@@H](CCO)c3ccccc3 27a_100025705951_100010329861 [0,1,1,0,0,0|2,0,0]=4 1021 B23R3.1904603 OCC[C@H](Nc1nc2cc(ccc2s1)F)c3ccccc3 27a_100025705951_200010206605 [0,1,1,0,0,0|2,0,0]=4 1022 B23R3.1904603 OCC[C@H](Nc1nc2ccc(cc2s1)F)c3ccccc3 27a_100025705951_100000751617 [0,1,1,0,0,0|2,0,0]=4 1023 B23R3.1904603 OCC[C@H](Nc1nc2ccc(cc2s1)O)c3ccccc3 27a_100025705951_100010063415 [0,1,1,0,0,0|2,0,0]=4 1024 B23R3.1904904 CCCC(Nc1nc2c(cccc2s1)C)c3ccccc3 27a_100000189686_100010008827 [0,1,1,0,0,0|1,0,0]=3 1025 B23R3.1904904 CCCC(Nc1nc2c(cccc2s1)C)c3cccnc3 27a_100011351308_100010008827 [0,1,1,0,0,0|2,0,0]=4 1026 B23R3.1904904 CCCC(Nc1nc2c(cccc2s1)C)c3ccncc3 27a_100011351316_100010008827 [0,1,1,0,0,0|2,0,0]=4 1027 B23R3.1904904 CCCC(Nc1nc2c(cccc2s1)F)c3ccccc3 27a_100000189686_100010008856 [0,1,1,0,0,0|1,0,0]=3 1028 B23R3.1904904 CCCC(Nc1nc2c(cccc2s1)F)c3cccnc3 27a_100011351308_100010008856 [0,1,1,0,0,0|2,0,0]=4 1029 B23R3.1904904 CCCC(Nc1nc2c(cccc2s1)F)c3ccncc3 27a_100011351316_100010008856 [0,1,1,0,0,0|2,0,0]=4 1030 B23R3.1904904 CCCC(Nc1nc2ncnc(c2[nH]1)N)c3ccccc3 27a_100000189686_100009817290 [0,1,1,0,0,0|2,0,0]=4 1031 B23R3.1904904 COC[C@@H](Nc1nc2c(cccc2s1)C)c3ccccc3 27a_103619048568_100010008827 [0,1,1,0,0,0|2,0,0]=4 1032 B23R3.1904904 COC[C@@H](Nc1nc2c(cccc2s1)F)c3ccccc3 27a_103619048568_100010008856 [0,1,1,0,0,0|2,0,0]=4 1033 B23R3.1904904 Cc1cccc2c1nc(s2)N[C@@H](CCO)c3ccccc3 27a_100025705951_100010008827 [0,1,1,0,0,0|2,0,0]=4 1034 B23R3.1904904 OCC[C@H](Nc1nc2c(cccc2s1)F)c3ccccc3 27a_100025705951_100010008856 [0,1,1,0,0,0|2,0,0]=4 1035 B23R3.1939242 CCC(C)C(Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100025702663_100009814255 [0,1,1,0,0,0|0,0,0]=2 1036 B23R3.1939242 CCC(C)C(Nc1nc2ccccc2s1)c3ccccc3 27a_100025702663_100000751744 [0,1,1,0,0,0|1,0,0]=3 1037 B23R3.1939242 CCC(C)C(Nc1nc2cccnc2s1)c3ccccc3 27a_100025702663_100010188088 [0,1,1,0,0,0|2,0,0]=4 1038 B23R3.1939242 CNC(=O)C(Nc1nc2ccccc2[nH]1)c3ccccc3 27a_100000741928_100009814255 [0,1,1,0,0,0|1,0,1]=4 1039 B23R3.20606131 COCC(c1ccccn1)N(C)c2nc3ccccc3[nH]2 27a_200011935022_100009814255 [0,1,1,0,0,0|2,0,0]=4 1040 B23R3.53266 CCCc1ccccc1NCc2nc3ccccc3n2C 207a_100000737634_100000188960 [0,1,1,0,0,0|2,0,0]=4 1041 B23R3.53266 CCCc1ccccc1NCc2nc3ccccc3n2C 2230a_100000737634_100000748711 [0,1,1,0,0,0|2,0,0]=4 1042 B23R3.53266 CCCc1ccccc1NCc2nc3ccccc3n2C 34a_100000737634_100000748711 [0,1,1,0,0,0|2,0,0]=4 1043 B23R3.53266 CCCc1ccccc1NCc2nc3ccccc3n2C 7a_100000737634_100000748711 [0,1,1,0,0,0|2,0,0]=4 1044 B23R3.53266 CCCc1ccccc1OCc2nc3ccccc3n2C 34a_100011217252_100000748711 [0,1,1,0,0,0|2,0,0]=4 1045 B23R3.53266 CCCc1ccccc1OCc2nc3ccccc3n2C 7a_100011217252_100000748711 [0,1,1,0,0,0|2,0,0]=4 1046 B23R3.53266 CCOc1ccccc1CNc2nc3ccccc3n2C 27a_100000188671_200000239431 [0,1,1,0,0,0|1,0,0]=3 1047 B23R3.53266 CCOc1ncccc1CNc2nc3ccccc3n2C 27a_100000737023_200000239431 [0,1,1,0,0,0|2,0,0]=4 1048 B23R3.446326 CCCc1ccccc1NCc2nc3cc(ccc3[nH]2)Br 2230a_100000737634_100000701424 [0,1,1,0,0,0|2,0,0]=4 1049 B23R3.446326 CCCc1ccccc1NCc2nc3cc(ccc3[nH]2)Br 34a_100000737634_100000701424 [0,1,1,0,0,0|2,0,0]=4 1050 B23R3.446326 CCCc1ccccc1NCc2nc3cc(ccc3[nH]2)Br 7a_100000737634_100000701424 [0,1,1,0,0,0|2,0,0]=4 1051 B23R3.446326 CCCc1ccccc1NCc2nc3cc(ccc3[nH]2)Cl 2230a_100000737634_100000179801 [0,1,1,0,0,0|2,0,0]=4 1052 B23R3.446326 CCCc1ccccc1NCc2nc3cc(ccc3[nH]2)Cl 7a_100000737634_100000179801 [0,1,1,0,0,0|2,0,0]=4 1053 B23R3.446326 CCCc1ccccc1NCc2nc3cc(ccc3[nH]2)F 207a_100000737634_200011915233 [0,1,1,0,0,0|2,0,0]=4 1054 B23R3.446326 CCCc1ccccc1NCc2nc3ccc(cc3[nH]2)Br 207a_100000737634_200011361486 [0,1,1,0,0,0|2,0,0]=4 1055 B23R3.446326 CCCc1ccccc1NCc2nc3ccc(cc3[nH]2)C 2230a_100000737634_100020603265 [0,1,1,0,0,0|2,0,0]=4 1056 B23R3.446326 CCCc1ccccc1NCc2nc3ccc(cc3[nH]2)C 34a_100000737634_100020603265 [0,1,1,0,0,0|2,0,0]=4 1057 B23R3.446326 CCCc1ccccc1NCc2nc3ccc(cc3[nH]2)C 7a_100000737634_100020603265 [0,1,1,0,0,0|2,0,0]=4 1058 B23R3.446326 CCCc1ccccc1NCc2nc3ccc(cc3[nH]2)F 2230a_100000737634_200011347187 [0,1,1,0,0,0|2,0,0]=4 1059 B23R3.446326 CCCc1ccccc1NCc2nc3ccc(cc3[nH]2)F 7a_100000737634_200011347187 [0,1,1,0,0,0|2,0,0]=4 1060 B23R3.446326 CCCc1ccccc1OCc2nc3cc(ccc3[nH]2)Br 34a_100011217252_100000701424 [0,1,1,0,0,0|2,0,0]=4 1061 B23R3.446326 CCCc1ccccc1OCc2nc3cc(ccc3[nH]2)Br 7a_100011217252_100000701424 [0,1,1,0,0,0|2,0,0]=4 1062 B23R3.446326 CCCc1ccccc1OCc2nc3cc(ccc3[nH]2)Cl 7a_100011217252_100000179801 [0,1,1,0,0,0|2,0,0]=4 1063 B23R3.446326 CCCc1ccccc1OCc2nc3ccc(cc3[nH]2)C 34a_100011217252_100020603265 [0,1,1,0,0,0|2,0,0]=4 1064 B23R3.446326 CCCc1ccccc1OCc2nc3ccc(cc3[nH]2)C 7a_100011217252_100020603265 [0,1,1,0,0,0|2,0,0]=4 1065 B23R3.446326 CCCc1ccccc1OCc2nc3ccc(cc3[nH]2)F 7a_100011217252_200011347187 [0,1,1,0,0,0|2,0,0]=4 1066 B23R3.446326 CCOc1ccccc1CNc2nc3cc(ccc3s2)F 27a_100000188671_200010206605 [0,1,1,0,0,0|2,0,0]=4 1067 B23R3.446326 CCOc1ccccc1CNc2nc3cc(ccc3s2)N 27a_100000188671_100010329861 [0,1,1,0,0,0|2,0,0]=4 1068 B23R3.446326 CCOc1ccccc1CNc2nc3ccc(cc3s2)C 27a_100000188671_100010186437 [0,1,1,0,0,0|2,0,0]=4 1069 B23R3.446326 CCOc1ccccc1CNc2nc3ccc(cc3s2)F 27a_100000188671_100000751617 [0,1,1,0,0,0|2,0,0]=4 1070 B23R3.446326 CCOc1ccccc1CNc2nc3ccc(cc3s2)N 27a_100000188671_100010253933 [0,1,1,0,0,0|2,0,0]=4 1071 B23R3.446326 CCOc1ccccc1CNc2nc3ccc(cc3s2)O 27a_100000188671_100010063415 [0,1,1,0,0,0|2,0,0]=4 1072 B23R3.446327 CCOc1ccccc1CNc2nc3c(cccc3s2)C 27a_100000188671_100010008827 [0,1,1,0,0,0|2,0,0]=4 1073 B23R3.446327 CCOc1ccccc1CNc2nc3c(cccc3s2)F 27a_100000188671_100010008856 [0,1,1,0,0,0|2,0,0]=4 1074 B23R3.1382876 CCC(=O)c1ccccc1CSc2nc3ccccc3[nH]2 1458a_100000683890_100000210202 [0,1,1,0,0,0|1,0,1]=4 1075 B23R3.1382876 CCC(C)c1ccccc1NCc2nc3ccccc3[nH]2 207a_200000211393_100000185668 [0,1,1,0,0,0|2,0,0]=4 1076 B23R3.1382876 CCC(C)c1ccccc1NCc2nc3ccccc3[nH]2 2230a_200000211393_100000737899 [0,1,1,0,0,0|2,0,0]=4 1077 B23R3.1382876 CCC(C)c1ccccc1NCc2nc3ccccc3[nH]2 7a_200000211393_100000737899 [0,1,1,0,0,0|2,0,0]=4 1078 B23R3.1382876 CCC(C)c1ccccc1OCc2nc3ccccc3[nH]2 7a_100000211618_100000737899 [0,1,1,0,0,0|2,0,0]=4 1079 B23R3.1419781 CCCCc1ccccc1NCc2nc3ccccc3[nH]2 207a_200011217597_100000185668 [0,1,1,0,0,0|2,0,0]=4 1080 B23R3.1419781 CCCCc1ccccc1NCc2nc3ccccc3[nH]2 2230a_200011217597_100000737899 [0,1,1,0,0,0|2,0,0]=4 1081 B23R3.1419781 CCCCc1ccccc1NCc2nc3ccccc3[nH]2 7a_200011217597_100000737899 [0,1,1,0,0,0|2,0,0]=4 1082 B23R3.1419781 CCCOc1ccccc1NCc2nc3ccccc3[nH]2 207a_100000683936_100000185668 [0,1,1,0,0,0|2,0,0]=4 1083 B23R3.1419781 CCCOc1ccccc1NCc2nc3ccccc3[nH]2 27a_100000729406_100000174042 [0,1,1,0,0,0|2,0,0]=4 1084 B23R3.1419781 CCCOc1ccccc1OCc2nc3ccccc3[nH]2 7a_100000180214_100000737899 [0,1,1,0,0,0|2,0,0]=4 1085 B23R3.1419781 CCCOc1ccccc1SCc2nc3ccccc3[nH]2 62a_100000174042_100000737899 [0,1,1,0,0,0|2,0,0]=4 1086 B23R3.1419781 CCCSc1ccccc1NCc2nc3ccccc3[nH]2 207a_100015184514_100000185668 [0,1,1,0,0,0|2,0,0]=4 1087 B23R3.1419781 CCCSc1ccccc1NCc2nc3ccccc3[nH]2 7a_100015184514_100000737899 [0,1,1,0,0,0|2,0,0]=4 1088 B23R3.1419781 CCOCc1ccccc1SCc2nc3ccccc3[nH]2 62a_200011493690_100000737899 [0,1,1,0,0,0|2,0,0]=4 1089 B23R3.1419781 CCSCc1ccccc1SCc2nc3ccccc3[nH]2 62a_200000173030_100000737899 [0,1,1,0,0,0|2,0,0]=4 1090 B23R3.1419781 COCCc1ccccc1OCc2nc3ccccc3[nH]2 7a_100000722730_100000737899 [0,1,1,0,0,0|2,0,0]=4 1091 B23R3.1419781 OCCCc1ccccc1SCc2nc3ccccc3[nH]2 62a_100000699526_100000737899 [0,1,1,0,0,0|2,0,0]=4 1092 B23R3.1446225 CC(C)Oc1ccccc1CNc2nc3ccccc3[nH]2 27a_100000188901_100009814255 [0,1,1,0,0,0|1,0,0]=3 1093 B23R3.1446225 CC(C)Oc1ccccc1CNc2nc3ccccc3s2 27a_100000188901_100000751744 [0,1,1,0,0,0|2,0,0]=4 1094 B23R3.1446225 CC(C)Oc1ncccc1CNc2nc3ccccc3[nH]2 27a_100000740383_100009814255 [0,1,1,0,0,0|2,0,0]=4 1095 B23R3.1446225 CN(C)Cc1ccccc1CNc2nc3ccccc3[nH]2 27a_100000740863_100009814255 [0,1,1,0,0,0|1,0,0]=3 1096 B23R3.1446225 CN(C)Cc1ccccc1CNc2nc3ccccc3s2 27a_100000740863_100000751744 [0,1,1,0,0,0|2,0,0]=4 1097 B23R3.1446225 FC(F)Oc1ccccc1CNc2nc3ccccc3[nH]2 27a_100000181768_100009814255 [0,1,1,0,0,0|2,0,0]=4 1098 B23R3.1991770 CCOc1cccc(c1CNc2nc3ccccc3[nH]2)F 27a_200011324351_100009814255 [0,1,1,0,0,0|1,0,0]=3 1099 B23R3.1991770 CCOc1cccc(c1CNc2nc3ccccc3s2)F 27a_200011324351_100000751744 [0,1,1,0,0,0|2,0,0]=4 1100 B23R3.20129821 CCOc1ccccc1CN(C)c2nc3ccccc3[nH]2 27a_100000742257_100009814255 [0,1,1,0,0,0|1,0,0]=3 1101 B23R3.20129821 CCOc1ccccc1CN(C)c2nc3ccccc3s2 27a_100000742257_100000751744 [0,1,1,0,0,0|2,0,0]=4 1102 B23R3.20144624 CCOc1ccccc1C(C)Nc2nc3ccccc3[nH]2 27a_100000737537_100009814255 [0,1,1,0,0,0|1,0,0]=3 1103 B23R3.20144624 CCOc1ccccc1C(C)Nc2nc3ccccc3s2 27a_100000737537_100000751744 [0,1,1,0,0,0|2,0,0]=4 1104 B23R3.301905 Cc1ccccc1N(Cc2nc3ccccc3[nH]2)C(C)C 2230a_100000219700_100000737899 [0,1,1,0,0,0|2,0,0]=4 1105 B23R3.301905 Cc1ccccc1N(Cc2nc3ccccc3[nH]2)C(C)C 269982a_100000219700_100000737899 [0,1,1,0,0,0|2,0,0]=4 1106 B23R3.301905 Cc1ccccc1N(Cc2nc3ccccc3[nH]2)C(C)C 7a_100000219700_100000737899 [0,1,1,0,0,0|2,0,0]=4 1107 B23R3.1929326 CCC(Nc1nc2ccccc2[nH]1)c3ccc(cc3C)C 27a_100015185828_100009814255 [0,1,1,0,0,0|0,0,0]=2 1108 B23R3.1929326 CCC(Nc1nc2ccccc2s1)c3ccc(cc3C)C 27a_100015185828_100000751744 [0,1,1,0,0,0|1,0,0]=3 1109 B23R3.1929326 CCC(Nc1nc2cccnc2s1)c3ccc(cc3C)C 27a_100015185828_100010188088 [0,1,1,0,0,0|2,0,0]=4 1110 B23R3.1929326 CCN(Cc1nc2ccccc2[nH]1)c3ccc(cc3C)F 2230a_100000221679_100000737899 [0,1,1,0,0,0|2,0,0]=4 1111 B23R3.1929326 CCN(Cc1nc2ccccc2[nH]1)c3ccc(cc3C)F 269982a_100000221679_100000737899 [0,1,1,0,0,0|2,0,0]=4 1112 B23R3.1929326 CCN(Cc1nc2ccccc2[nH]1)c3ccc(cc3C)F 7a_100000221679_100000737899 [0,1,1,0,0,0|2,0,0]=4 1113 B23R3.1929326 Cc1cc(ccc1[C@@H](CO)Nc2nc3ccccc3[nH]2)Br 27a_100138412551_100009814255 [0,1,1,0,0,0|1,0,0]=3 1114 B23R3.1929326 Cc1cc(ccc1[C@@H](CO)Nc2nc3ccccc3s2)Br 27a_100138412551_100000751744 [0,1,1,0,0,0|2,0,0]=4 1115 B23R3.1929326 OC[C@@H](Nc1nc2ccccc2[nH]1)c3ccc(cc3Cl)F 27a_102531768864_100009814255 [0,1,1,0,0,0|2,0,0]=4 1116 B23R3.1929326 OC[C@@H](Nc1nc2ccccc2[nH]1)c3ccc(cc3F)F 27a_100138412331_100009814255 [0,1,1,0,0,0|2,0,0]=4 1117 B23R3.1929326 OC[C@H](Nc1nc2ccccc2[nH]1)c3ccc(cc3O)F 27a_100138412282_100009814255 [0,1,1,0,0,0|2,0,0]=4 1118 B23R3.1929328 CCN(Cc1nc2ccccc2[nH]1)c3cccc(c3C)C 2230a_100000219776_100000737899 [0,1,1,0,0,0|2,0,0]=4 1119 B23R3.1929328 CCN(Cc1nc2ccccc2[nH]1)c3cccc(c3C)C 269982a_100000219776_100000737899 [0,1,1,0,0,0|2,0,0]=4 1120 B23R3.1929328 CCN(Cc1nc2ccccc2[nH]1)c3cccc(c3C)C 7a_100000219776_100000737899 [0,1,1,0,0,0|2,0,0]=4 1121 B23R3.3088921 CCC(Nc1nc2ccccc2n1C)c3ncccc3C 27a_200011536107_200000239431 [0,1,1,0,0,0|1,0,0]=3 1122 B23R3.3088921 CCN(Cc1nc2ccccc2n1C)c3ccccc3C 2230a_100000211084_100000748711 [0,1,1,0,0,0|2,0,0]=4 1123 B23R3.3088921 CCN(Cc1nc2ccccc2n1C)c3ccccc3C 269982a_100000211084_100000748711 [0,1,1,0,0,0|2,0,0]=4 1124 B23R3.3088921 CCN(Cc1nc2ccccc2n1C)c3ccccc3C 34a_100000211084_100000748711 [0,1,1,0,0,0|2,0,0]=4 1125 B23R3.3088921 CC[C@H](Nc1nc2ccccc2n1C)c3ccccc3Cl 27a_200016987949_200000239431 [0,1,1,0,0,0|1,0,0]=3 1126 B23R3.3088921 CC[C@H](Nc1nc2ccccc2n1C)c3ccccc3F 27a_100015190424_200000239431 [0,1,1,0,0,0|1,0,0]=3 1127 B23R3.3088921 Cn1c(nc2c1cccc2)NC(CO)c3ccccc3Cl 27a_100138412506_200000239431 [0,1,1,0,0,0|2,0,0]=4 1128 B23R3.3088921 Cn1c(nc2c1cccc2)N[C@@H](CO)c3ccccc3F 27a_100009818778_200000239431 [0,1,1,0,0,0|2,0,0]=4 1129 B23R3.3088921 Cn1c(nc2c1cccc2)N[C@H](CO)c3ccccc3Br 27a_100161155918_200000239431 [0,1,1,0,0,0|2,0,0]=4 1130 B23R3.3088975 CCN(Cc1nc2ccccc2[nH]1)c3cc(ccc3C)C 2230a_100000743043_100000737899 [0,1,1,0,0,0|2,0,0]=4 1131 B23R3.3088975 CCN(Cc1nc2ccccc2[nH]1)c3cc(ccc3C)C 269982a_100000743043_100000737899 [0,1,1,0,0,0|2,0,0]=4 1132 B23R3.3088975 CCN(Cc1nc2ccccc2[nH]1)c3cc(ccc3C)C 7a_100000743043_100000737899 [0,1,1,0,0,0|2,0,0]=4 1133 B23R3.3088975 CCN(Cc1nc2ccccc2[nH]1)c3cc(ccc3C)O 269982a_100000211784_100000737899 [0,1,1,0,0,0|2,0,0]=4 1134 B23R3.3088975 CC[C@H](Nc1nc2ccccc2[nH]1)c3cc(ccc3Br)Cl 27a_200015425730_100009814255 [0,1,1,0,0,0|1,0,0]=3 1135 B23R3.3088975 CC[C@H](Nc1nc2ccccc2[nH]1)c3cc(ccc3F)F 27a_100015190423_100009814255 [0,1,1,0,0,0|1,0,0]=3 1136 B23R3.3088975 CC[C@H](Nc1nc2ccccc2s1)c3cc(ccc3F)F 27a_100015190423_100000751744 [0,1,1,0,0,0|2,0,0]=4 1137 B23R3.3088975 OC[C@@H](Nc1nc2ccccc2[nH]1)c3cc(ccc3F)Br 27a_100010142275_100009814255 [0,1,1,0,0,0|2,0,0]=4 1138 B23R3.5145116 CCC(Nc1nc2ccccc2[nH]1)c3ccccc3OC 27a_100016991433_100009814255 [0,1,1,0,0,0|0,0,0]=2 1139 B23R3.5145116 CCC(Nc1nc2ccccc2s1)c3ccccc3OC 27a_100016991433_100000751744 [0,1,1,0,0,0|1,0,0]=3 1140 B23R3.5145116 CCC(Nc1nc2cccnc2s1)c3ccccc3OC 27a_100016991433_100010188088 [0,1,1,0,0,0|2,0,0]=4 1141 B23R3.5145116 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3OC 2230a_100020603010_100000737899 [0,1,1,0,0,0|2,0,0]=4 1142 B23R3.5145116 CCN(Cc1nc2ccccc2[nH]1)c3ccccc3OC 269982a_100020603010_100000737899 [0,1,1,0,0,0|2,0,0]=4 1143 B23R3.5145116 COc1ccccc1C(CO)Nc2nc3ccccc3[nH]2 27a_100000756845_100009814255 [0,1,1,0,0,0|1,0,0]=3 1144 B23R3.5145116 COc1ccccc1C(CO)Nc2nc3ccccc3s2 27a_100000756845_100000751744 [0,1,1,0,0,0|2,0,0]=4 1145 B23R3.20755996 CCC(Nc1nc2cc(ccc2s1)F)c3ncccc3C 27a_200011536107_200010206605 [0,1,1,0,0,0|2,0,0]=4 1146 B23R3.20755996 CCC(Nc1nc2cc(ccc2s1)N)c3ncccc3C 27a_200011536107_100010329861 [0,1,1,0,0,0|2,0,0]=4 1147 B23R3.20755996 CCC(Nc1nc2ccc(cc2s1)C)c3ncccc3C 27a_200011536107_100010186437 [0,1,1,0,0,0|2,0,0]=4 1148 B23R3.20755996 CCC(Nc1nc2ccc(cc2s1)F)c3ncccc3C 27a_200011536107_100000751617 [0,1,1,0,0,0|2,0,0]=4 1149 B23R3.20755996 CCC(Nc1nc2ccc(cc2s1)N)c3ncccc3C 27a_200011536107_100010253933 [0,1,1,0,0,0|2,0,0]=4 1150 B23R3.20755996 CCC(Nc1nc2ccc(cc2s1)O)c3ncccc3C 27a_200011536107_100010063415 [0,1,1,0,0,0|2,0,0]=4 1151 B23R3.20755996 CCN(Cc1nc2cc(ccc2[nH]1)Br)c3ccccc3C 2230a_100000211084_100000701424 [0,1,1,0,0,0|2,0,0]=4 1152 B23R3.20755996 CCN(Cc1nc2cc(ccc2[nH]1)Br)c3ccccc3C 269982a_100000211084_100000701424 [0,1,1,0,0,0|2,0,0]=4 1153 B23R3.20755996 CCN(Cc1nc2cc(ccc2[nH]1)Br)c3ccccc3C 34a_100000211084_100000701424 [0,1,1,0,0,0|2,0,0]=4 1154 B23R3.20755996 CCN(Cc1nc2cc(ccc2[nH]1)Cl)c3ccccc3C 2230a_100000211084_100000179801 [0,1,1,0,0,0|2,0,0]=4 1155 B23R3.20755996 CCN(Cc1nc2cc(ccc2[nH]1)Cl)c3ccccc3C 269982a_100000211084_100000179801 [0,1,1,0,0,0|2,0,0]=4 1156 B23R3.20755996 CCN(Cc1nc2ccc(cc2[nH]1)C)c3ccccc3C 2230a_100000211084_100020603265 [0,1,1,0,0,0|2,0,0]=4 1157 B23R3.20755996 CCN(Cc1nc2ccc(cc2[nH]1)C)c3ccccc3C 269982a_100000211084_100020603265 [0,1,1,0,0,0|2,0,0]=4 1158 B23R3.20755996 CCN(Cc1nc2ccc(cc2[nH]1)C)c3ccccc3C 34a_100000211084_100020603265 [0,1,1,0,0,0|2,0,0]=4 1159 B23R3.20755996 CCN(Cc1nc2ccc(cc2[nH]1)F)c3ccccc3C 2230a_100000211084_200011347187 [0,1,1,0,0,0|2,0,0]=4 1160 B23R3.20755996 CCN(Cc1nc2ccc(cc2[nH]1)F)c3ccccc3C 269982a_100000211084_200011347187 [0,1,1,0,0,0|2,0,0]=4 1161 B23R3.20755996 CC[C@H](Nc1nc2cc(ccc2s1)F)c3ccccc3Cl 27a_200016987949_200010206605 [0,1,1,0,0,0|2,0,0]=4 1162 B23R3.20755996 CC[C@H](Nc1nc2cc(ccc2s1)F)c3ccccc3F 27a_100015190424_200010206605 [0,1,1,0,0,0|2,0,0]=4 1163 B23R3.20755996 CC[C@H](Nc1nc2cc(ccc2s1)N)c3ccccc3Cl 27a_200016987949_100010329861 [0,1,1,0,0,0|2,0,0]=4 1164 B23R3.20755996 CC[C@H](Nc1nc2cc(ccc2s1)N)c3ccccc3F 27a_100015190424_100010329861 [0,1,1,0,0,0|2,0,0]=4 1165 B23R3.20755996 CC[C@H](Nc1nc2ccc(cc2s1)C)c3ccccc3Cl 27a_200016987949_100010186437 [0,1,1,0,0,0|2,0,0]=4 1166 B23R3.20755996 CC[C@H](Nc1nc2ccc(cc2s1)C)c3ccccc3F 27a_100015190424_100010186437 [0,1,1,0,0,0|2,0,0]=4 1167 B23R3.20755996 CC[C@H](Nc1nc2ccc(cc2s1)F)c3ccccc3Cl 27a_200016987949_100000751617 [0,1,1,0,0,0|2,0,0]=4 1168 B23R3.20755996 CC[C@H](Nc1nc2ccc(cc2s1)F)c3ccccc3F 27a_100015190424_100000751617 [0,1,1,0,0,0|2,0,0]=4 1169 B23R3.20755996 CC[C@H](Nc1nc2ccc(cc2s1)N)c3ccccc3Cl 27a_200016987949_100010253933 [0,1,1,0,0,0|2,0,0]=4 1170 B23R3.20755996 CC[C@H](Nc1nc2ccc(cc2s1)N)c3ccccc3F 27a_100015190424_100010253933 [0,1,1,0,0,0|2,0,0]=4 1171 B23R3.20755996 CC[C@H](Nc1nc2ccc(cc2s1)O)c3ccccc3Cl 27a_200016987949_100010063415 [0,1,1,0,0,0|2,0,0]=4 1172 B23R3.20755996 CC[C@H](Nc1nc2ccc(cc2s1)O)c3ccccc3F 27a_100015190424_100010063415 [0,1,1,0,0,0|2,0,0]=4 1173 B23R3.20766941 CCC(Nc1nc2c(cccc2s1)C)c3ncccc3C 27a_200011536107_100010008827 [0,1,1,0,0,0|2,0,0]=4 1174 B23R3.20766941 CCC(Nc1nc2c(cccc2s1)F)c3ncccc3C 27a_200011536107_100010008856 [0,1,1,0,0,0|2,0,0]=4 1175 B23R3.20766941 CC[C@H](Nc1nc2c(cccc2s1)C)c3ccccc3Cl 27a_200016987949_100010008827 [0,1,1,0,0,0|2,0,0]=4 1176 B23R3.20766941 CC[C@H](Nc1nc2c(cccc2s1)C)c3ccccc3F 27a_100015190424_100010008827 [0,1,1,0,0,0|2,0,0]=4 1177 B23R3.20766941 CC[C@H](Nc1nc2c(cccc2s1)F)c3ccccc3Cl 27a_200016987949_100010008856 [0,1,1,0,0,0|2,0,0]=4 1178 B23R3.20766941 CC[C@H](Nc1nc2c(cccc2s1)F)c3ccccc3F 27a_100015190424_100010008856 [0,1,1,0,0,0|2,0,0]=4 1179 B23R3.27586 Cn1c(cc2c1cccc2)OCCCCc3ccccc3 34a_100000066695_100000701786 [0,1,1,0,0,0|2,0,0]=4 1180 B23R3.27586 Cn1c(nc2c1cccc2)CCCNCc3ccccc3 207a_100000756681_100015611070 [0,1,1,0,0,0|2,0,0]=4 1181 B23R3.27586 Cn1c(nc2c1cccc2)CCCNCc3ccccc3 270004a_100000756681_100015611070 [0,1,1,0,0,0|2,0,0]=4 1182 B23R3.27586 Cn1c(nc2c1cccc2)CCOCCc3ccccc3 7a_100011327700_100000765856 [0,1,1,0,0,0|2,0,0]=4 1183 B23R3.27586 Cn1c(nc2c1cccc2)CNCCCc3ccccc3 207a_100000211184_100000188960 [0,1,1,0,0,0|2,0,0]=4 1184 B23R3.27586 Cn1c(nc2c1cccc2)CNCCCc3ccccc3 2230a_100000211184_100000748711 [0,1,1,0,0,0|2,0,0]=4 1185 B23R3.27586 Cn1c(nc2c1cccc2)CNCCCc3ccccc3 270004a_100000211184_100000188960 [0,1,1,0,0,0|2,0,0]=4 1186 B23R3.27586 Cn1c(nc2c1cccc2)CNCCCc3ccccc3 34a_100000211184_100000748711 [0,1,1,0,0,0|2,0,0]=4 1187 B23R3.27586 Cn1c(nc2c1cccc2)COCCCc3ccccc3 34a_100000210828_100000748711 [0,1,1,0,0,0|2,0,0]=4 1188 B23R3.27586 Cn1c(nc2c1cccc2)COCCCc3ccccc3 7a_100000210828_100000748711 [0,1,1,0,0,0|2,0,0]=4 1189 B23R3.27586 Cn1c(nc2c1cccc2)CSCCCc3ccccc3 62a_100000748711_100000211621 [0,1,1,0,0,0|2,0,0]=4 1190 B23R3.27586 Cn1c(nc2c1cccc2)NCCCCc3ccccc3 27a_100015280158_200000239431 [0,1,1,0,0,0|0,0,0]=2 1191 B23R3.27586 Cn1c(nc2c1cccc2)NCCCOc3ccccc3 27a_100000216521_200000239431 [0,1,1,0,0,0|1,0,0]=3 1192 B23R3.27586 Cn1c(nc2c1cccc2)NCCCSc3ccccc3 27a_100000184639_200000239431 [0,1,1,0,0,0|1,0,0]=3 1193 B23R3.27586 Cn1c(nc2c1cccc2)NCCOCc3ccccc3 27a_100000753106_200000239431 [0,1,1,0,0,0|1,0,0]=3 1194 B23R3.27586 Cn1c(nc2c1cccc2)NCCSCc3ccccc3 27a_100000189534_200000239431 [0,1,1,0,0,0|1,0,0]=3 1195 B23R3.27586 Cn1c(nc2c1cccc2)NN=CCCc3ccccc3 4a_100000738164_100000198083 [0,1,1,0,0,0|1,0,1]=4 1196 B23R3.27586 Cn1c(nc2c1cccc2)SCCCCc3ccccc3 62a_100000701786_200000239431 [0,1,1,0,0,0|1,0,0]=3 1197 B23R3.27586 Cn1c(nc2c1cccc2)SCCCCc3ccccc3 62a_200000239431_100000701786 [0,1,1,0,0,0|1,0,0]=3 1198 B23R3.27586 Cn1c(nc2c1cccc2)SCCCCc3ccncc3 62a_100020630000_200000239431 [0,1,1,0,0,0|2,0,0]=4 1199 B23R3.27586 Cn1c(nc2c1cccc2)SCCCCc3ccncc3 62a_200000239431_100020630000 [0,1,1,0,0,0|2,0,0]=4 1200 B23R3.27586 Cn1c(nc2c1cccc2)SCCCOc3ccccc3 62a_100000199009_200000239431 [0,1,1,0,0,0|2,0,0]=4 1201 B23R3.27586 Cn1c(nc2c1cccc2)SCCCOc3ccccc3 62a_200000239431_100000199009 [0,1,1,0,0,0|2,0,0]=4 1202 B23R3.27586 Cn1c(nc2c1cccc2)SCCCSc3ccccc3 62a_200000239431_200011203293 [0,1,1,0,0,0|2,0,0]=4 1203 B23R3.27586 Cn1c(nc2c1cccc2)SCCCSc3ccccc3 62a_200011203293_200000239431 [0,1,1,0,0,0|2,0,0]=4 1204 B23R3.27586 Cn1c(nc2c1cccc2)SCCOCc3ccccc3 62a_100000234347_200000239431 [0,1,1,0,0,0|2,0,0]=4 1205 B23R3.27586 Cn1c(nc2c1cccc2)SCCOCc3ccccc3 62a_200000239431_100000234347 [0,1,1,0,0,0|2,0,0]=4 1206 B23R3.27586 Cn1c(nc2c1cccc2)SCCSCc3ccccc3 62a_200000239431_200011297719 [0,1,1,0,0,0|2,0,0]=4 1207 B23R3.27586 Cn1c(nc2c1cccc2)SCCSCc3ccccc3 62a_200011297719_200000239431 [0,1,1,0,0,0|2,0,0]=4 1208 B23R3.51009 CC(COCc1nc2ccccc2[nH]1)Cc3ccccc3 7a_100012125295_100000737899 [0,1,1,0,0,0|2,0,0]=4 1209 B23R3.51009 CC(Cc1ccccc1)OCCc2nc3ccccc3[nH]2 7a_100000748627_100015206048 [0,1,1,0,0,0|2,0,0]=4 1210 B23R3.51009 CC(Cc1ccccc1)SCCc2nc3ccccc3[nH]2 62a_200011218536_100015206048 [0,1,1,0,0,0|2,0,0]=4 1211 B23R3.51009 CN(CCCc1nc2ccccc2[nH]1)Cc3ccccc3 269982a_100000744488_100000211182 [0,1,1,0,0,0|2,0,0]=4 1212 B23R3.51009 CN(CCCc1nc2ccccc2[nH]1)Cc3ccccc3 270004a_100000744488_100015611070 [0,1,1,0,0,0|2,0,0]=4 1213 B23R3.51009 CN(CCNc1nc2ccccc2[nH]1)Cc3ccccc3 27a_100000744458_100009814255 [0,1,1,0,0,0|1,0,0]=3 1214 B23R3.51009 CN(CCNc1nc2ccccc2s1)Cc3ccccc3 27a_100000744458_100000751744 [0,1,1,0,0,0|2,0,0]=4 1215 B23R3.51009 O=C(CCCc1nc2ccccc2[nH]1)Cc3ccccc3 1458a_100000738306_100015291786 [0,1,1,0,0,0|1,0,1]=4 1216 B23R3.51009 OC(CNCc1nc2ccccc2[nH]1)Cc3ccccc3 207a_100000752270_100000185668 [0,1,1,0,0,0|2,0,0]=4 1217 B23R3.51009 OC(CNCc1nc2ccccc2[nH]1)Cc3ccccc3 2230a_100000752270_100000737899 [0,1,1,0,0,0|2,0,0]=4 1218 B23R3.51009 OC(CNCc1nc2ccccc2[nH]1)Cc3ccccc3 270004a_100000752270_100000185668 [0,1,1,0,0,0|2,0,0]=4 1219 B23R3.51009 O[C@H](CSCc1nc2ccccc2[nH]1)Cc3ccccc3 62a_100000729385_100000737899 [0,1,1,0,0,0|2,0,0]=4 1220 B23R3.51075 CC(CC=NNc1nc2ccccc2[nH]1)c3ccccc3 4a_100000188875_100000189432 [0,1,1,0,0,0|1,0,1]=4 1221 B23R3.51075 CC(CCNCc1nc2ccccc2[nH]1)c3ccccc3 270004a_100000729406_100000189432 [0,1,1,0,0,0|2,0,0]=4 1222 B23R3.51075 CC(CNCCc1nc2ccccc2[nH]1)c3ccccc3 270004a_100015184290_100000212034 [0,1,1,0,0,0|2,0,0]=4 1223 B23R3.51075 CC(COCCc1nc2ccccc2[nH]1)c3ccccc3 7a_100011215166_100015206048 [0,1,1,0,0,0|2,0,0]=4 1224 B23R3.51075 CC(CSCCc1nc2ccccc2[nH]1)c3ccccc3 62a_100000756946_100015206048 [0,1,1,0,0,0|2,0,0]=4 1225 B23R3.51075 CC(NCCCc1nc2ccccc2[nH]1)c3ccccc3 269862a_100000734966_100000185851 [0,1,1,0,0,0|2,0,0]=4 1226 B23R3.51075 CN(CCCNc1nc2ccccc2[nH]1)c3ccccc3 27a_100000211881_100009814255 [0,1,1,0,0,0|1,0,0]=3 1227 B23R3.51075 CN(CCCNc1nc2ccccc2s1)c3ccccc3 27a_100000211881_100000751744 [0,1,1,0,0,0|2,0,0]=4 1228 B23R3.51075 O=C(CCCSc1nc2ccccc2[nH]1)c3ccccc3 62a_100000211006_100009814255 [0,1,1,0,0,0|1,0,1]=4 1229 B23R3.51075 O=C(NCCNc1nc2ccccc2[nH]1)c3ccccc3 27a_100000736134_100009814255 [0,1,1,0,0,0|1,0,1]=4 1230 B23R3.51075 OC(CCNCc1nc2ccccc2[nH]1)c3ccccc3 207a_100000763605_100000185668 [0,1,1,0,0,0|2,0,0]=4 1231 B23R3.51075 OC(CCNCc1nc2ccccc2[nH]1)c3ccccc3 2230a_100000763605_100000737899 [0,1,1,0,0,0|2,0,0]=4 1232 B23R3.51075 OC(CCNCc1nc2ccccc2[nH]1)c3ccccc3 270004a_100000763605_100000185668 [0,1,1,0,0,0|2,0,0]=4 1233 B23R3.51075 OC(CSCCc1nc2ccccc2[nH]1)c3ccccc3 62a_100000185958_100015206048 [0,1,1,0,0,0|2,0,0]=4 1234 B23R3.51075 O[C@H](CCSCc1nc2ccccc2[nH]1)c3ccccc3 62a_100000729684_100000737899 [0,1,1,0,0,0|2,0,0]=4 1235 B23R3.51075 O[C@H](CSCCc1nc2ccccc2[nH]1)c3ccccc3 62a_100011933945_100015206048 [0,1,1,0,0,0|2,0,0]=4 1236 B23R3.675309 Cc1cccc2c1nc(s2)NCCCCc3ccccc3 27a_100015280158_100010008827 [0,1,1,0,0,0|1,0,0]=3 1237 B23R3.675309 Cc1cccc2c1nc(s2)NCCCOc3ccccc3 27a_100000216521_100010008827 [0,1,1,0,0,0|2,0,0]=4 1238 B23R3.675309 Cc1cccc2c1nc(s2)NCCCSc3ccccc3 27a_100000184639_100010008827 [0,1,1,0,0,0|2,0,0]=4 1239 B23R3.675309 Cc1cccc2c1nc(s2)NCCOCc3ccccc3 27a_100000753106_100010008827 [0,1,1,0,0,0|2,0,0]=4 1240 B23R3.675309 Cc1cccc2c1nc(s2)NCCSCc3ccccc3 27a_100000189534_100010008827 [0,1,1,0,0,0|2,0,0]=4 1241 B23R3.675309 Cc1cccc2c1nc(s2)SCCCCc3ccccc3 62a_100000701786_100010008827 [0,1,1,0,0,0|2,0,0]=4 1242 B23R3.675309 Fc1cccc2c1nc(s2)NCCCCc3ccccc3 27a_100015280158_100010008856 [0,1,1,0,0,0|1,0,0]=3 1243 B23R3.675309 Fc1cccc2c1nc(s2)NCCCOc3ccccc3 27a_100000216521_100010008856 [0,1,1,0,0,0|2,0,0]=4 1244 B23R3.675309 Fc1cccc2c1nc(s2)NCCCSc3ccccc3 27a_100000184639_100010008856 [0,1,1,0,0,0|2,0,0]=4 1245 B23R3.675309 Fc1cccc2c1nc(s2)NCCOCc3ccccc3 27a_100000753106_100010008856 [0,1,1,0,0,0|2,0,0]=4 1246 B23R3.675309 Fc1cccc2c1nc(s2)NCCSCc3ccccc3 27a_100000189534_100010008856 [0,1,1,0,0,0|2,0,0]=4 1247 B23R3.675309 Fc1cccc2c1nc(s2)SCCCCc3ccccc3 62a_100000701786_100010008856 [0,1,1,0,0,0|2,0,0]=4 1248 B23R3.675309 Nc1ncnc2c1[nH]c(n2)NCCCCc3ccccc3 27a_100015280158_100009817290 [0,1,1,0,0,0|2,0,0]=4 1249 B23R3.1338538 Brc1ccc(cc1)CCC=NNc2nc3ccccc3[nH]2 4a_100000188875_100011361538 [0,1,1,0,0,0|1,0,1]=4 1250 B23R3.1338538 Brc1ccc(cc1)CCCCSc2nc3ccccc3[nH]2 62a_200012094861_100009814255 [0,1,1,0,0,0|1,0,0]=3 1251 B23R3.1338538 Brc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 207a_100011297623_100000185668 [0,1,1,0,0,0|2,0,0]=4 1252 B23R3.1338538 Brc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 2230a_100011297623_100000737899 [0,1,1,0,0,0|2,0,0]=4 1253 B23R3.1338538 Brc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 270004a_100011297623_100000185668 [0,1,1,0,0,0|2,0,0]=4 1254 B23R3.1338538 Brc1ccc(cc1)CCCOCc2nc3ccccc3[nH]2 7a_100011709247_100000737899 [0,1,1,0,0,0|2,0,0]=4 1255 B23R3.1338538 Brc1ccc(cc1)CCCSCc2nc3ccccc3[nH]2 62a_100011713682_100000737899 [0,1,1,0,0,0|2,0,0]=4 1256 B23R3.1338538 Brc1ccc(cc1)CCOCCc2nc3ccccc3[nH]2 7a_100000766406_100015206048 [0,1,1,0,0,0|2,0,0]=4 1257 B23R3.1338538 Brc1ccc(cc1)CCSCCc2nc3ccccc3[nH]2 62a_100011740612_100015206048 [0,1,1,0,0,0|2,0,0]=4 1258 B23R3.1338538 Brc1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000186029 [0,1,1,0,0,0|2,0,0]=4 1259 B23R3.1338538 Brc1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000186029 [0,1,1,0,0,0|2,0,0]=4 1260 B23R3.1338538 Brc1ccc(cc1)OCCCSc2nc3ccccc3[nH]2 62a_100011259224_100009814255 [0,1,1,0,0,0|2,0,0]=4 1261 B23R3.1338538 Cc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 207a_100011236272_100000185668 [0,1,1,0,0,0|2,0,0]=4 1262 B23R3.1338538 Cc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 2230a_100011236272_100000737899 [0,1,1,0,0,0|2,0,0]=4 1263 B23R3.1338538 Cc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 270004a_100011236272_100000185668 [0,1,1,0,0,0|2,0,0]=4 1264 B23R3.1338538 Cc1ccc(cc1)CCCOCc2nc3ccccc3[nH]2 7a_100000189427_100000737899 [0,1,1,0,0,0|2,0,0]=4 1265 B23R3.1338538 Cc1ccc(cc1)CCOCCc2nc3ccccc3[nH]2 7a_100000756670_100015206048 [0,1,1,0,0,0|2,0,0]=4 1266 B23R3.1338538 Cc1ccc(cc1)CCSCCc2nc3ccccc3[nH]2 62a_100011713686_100015206048 [0,1,1,0,0,0|2,0,0]=4 1267 B23R3.1338538 Cc1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000211033 [0,1,1,0,0,0|2,0,0]=4 1268 B23R3.1338538 Cc1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000211033 [0,1,1,0,0,0|2,0,0]=4 1269 B23R3.1338538 Cc1ccc(cc1)OCCCNc2nc3ccccc3[nH]2 27a_100000747266_100009814255 [0,1,1,0,0,0|1,0,0]=3 1270 B23R3.1338538 Cc1ccc(cc1)OCCCNc2nc3ccccc3s2 27a_100000747266_100000751744 [0,1,1,0,0,0|2,0,0]=4 1271 B23R3.1338538 Clc1ccc(cc1)CCCCNc2nc3ccccc3[nH]2 27a_100160821348_100009814255 [0,1,1,0,0,0|0,0,0]=2 1272 B23R3.1338538 Clc1ccc(cc1)CCCCNc2nc3ccccc3s2 27a_100160821348_100000751744 [0,1,1,0,0,0|1,0,0]=3 1273 B23R3.1338538 Clc1ccc(cc1)CCCCNc2nc3cccnc3s2 27a_100160821348_100010188088 [0,1,1,0,0,0|2,0,0]=4 1274 B23R3.1338538 Clc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 207a_100000748451_100000185668 [0,1,1,0,0,0|2,0,0]=4 1275 B23R3.1338538 Clc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 2230a_100000748451_100000737899 [0,1,1,0,0,0|2,0,0]=4 1276 B23R3.1338538 Clc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 270004a_100000748451_100000185668 [0,1,1,0,0,0|2,0,0]=4 1277 B23R3.1338538 Clc1ccc(cc1)CCCOCc2nc3ccccc3[nH]2 7a_100011217485_100000737899 [0,1,1,0,0,0|2,0,0]=4 1278 B23R3.1338538 Clc1ccc(cc1)CCCSCc2nc3ccccc3[nH]2 62a_100000759440_100000737899 [0,1,1,0,0,0|2,0,0]=4 1279 B23R3.1338538 Clc1ccc(cc1)CCOCCc2nc3ccccc3[nH]2 7a_100011219627_100015206048 [0,1,1,0,0,0|2,0,0]=4 1280 B23R3.1338538 Clc1ccc(cc1)CCSCCc2nc3ccccc3[nH]2 62a_100011713675_100015206048 [0,1,1,0,0,0|2,0,0]=4 1281 B23R3.1338538 Clc1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000189385 [0,1,1,0,0,0|2,0,0]=4 1282 B23R3.1338538 Clc1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000189385 [0,1,1,0,0,0|2,0,0]=4 1283 B23R3.1338538 Clc1ccc(cc1)COCCNc2nc3ccccc3[nH]2 27a_100000189180_100009814255 [0,1,1,0,0,0|1,0,0]=3 1284 B23R3.1338538 Clc1ccc(cc1)COCCNc2nc3ccccc3s2 27a_100000189180_100000751744 [0,1,1,0,0,0|2,0,0]=4 1285 B23R3.1338538 Clc1ccc(cc1)CSCCNc2nc3ccccc3[nH]2 27a_100000739548_100009814255 [0,1,1,0,0,0|1,0,0]=3 1286 B23R3.1338538 Clc1ccc(cc1)CSCCNc2nc3ccccc3s2 27a_100000739548_100000751744 [0,1,1,0,0,0|2,0,0]=4 1287 B23R3.1338538 Clc1ccc(cc1)OCCCNc2nc3ccccc3[nH]2 27a_200011199081_100009814255 [0,1,1,0,0,0|1,0,0]=3 1288 B23R3.1338538 Clc1ccc(cc1)OCCCNc2nc3ccccc3s2 27a_200011199081_100000751744 [0,1,1,0,0,0|2,0,0]=4 1289 B23R3.1338538 Clc1ccc(cc1)SCCCNc2nc3ccccc3[nH]2 27a_100000189518_100009814255 [0,1,1,0,0,0|1,0,0]=3 1290 B23R3.1338538 Clc1ccc(cc1)SCCCNc2nc3ccccc3s2 27a_100000189518_100000751744 [0,1,1,0,0,0|2,0,0]=4 1291 B23R3.1338538 Fc1ccc(cc1)CCC=NNc2nc3ccccc3[nH]2 4a_100000188875_100000727037 [0,1,1,0,0,0|1,0,1]=4 1292 B23R3.1338538 Fc1ccc(cc1)CCCCSc2cc3ccccc3[nH]2 62a_100012093538_100010232065 [0,1,1,0,0,0|2,0,0]=4 1293 B23R3.1338538 Fc1ccc(cc1)CCCCSc2nc3ccccc3[nH]2 62a_100012093538_100009814255 [0,1,1,0,0,0|1,0,0]=3 1294 B23R3.1338538 Fc1ccc(cc1)CCCCSc2nc3ccccc3s2 62a_100012093538_100000751744 [0,1,1,0,0,0|2,0,0]=4 1295 B23R3.1338538 Fc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 207a_100025745824_100000185668 [0,1,1,0,0,0|2,0,0]=4 1296 B23R3.1338538 Fc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 2230a_100025745824_100000737899 [0,1,1,0,0,0|2,0,0]=4 1297 B23R3.1338538 Fc1ccc(cc1)CCCNCc2nc3ccccc3[nH]2 270004a_100025745824_100000185668 [0,1,1,0,0,0|2,0,0]=4 1298 B23R3.1338538 Fc1ccc(cc1)CCCOCc2nc3ccccc3[nH]2 7a_100000757351_100000737899 [0,1,1,0,0,0|2,0,0]=4 1299 B23R3.1338538 Fc1ccc(cc1)CCCSCc2nc3ccccc3[nH]2 62a_200011713563_100000737899 [0,1,1,0,0,0|2,0,0]=4 1300 B23R3.1338538 Fc1ccc(cc1)CCOCCc2nc3ccccc3[nH]2 7a_100000754732_100015206048 [0,1,1,0,0,0|2,0,0]=4 1301 B23R3.1338538 Fc1ccc(cc1)CCSCCc2nc3ccccc3[nH]2 62a_100011217392_100015206048 [0,1,1,0,0,0|2,0,0]=4 1302 B23R3.1338538 Fc1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000210084 [0,1,1,0,0,0|2,0,0]=4 1303 B23R3.1338538 Fc1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000210084 [0,1,1,0,0,0|2,0,0]=4 1304 B23R3.1338538 Fc1ccc(cc1)CSCCNc2nc3ccccc3[nH]2 27a_100020610864_100009814255 [0,1,1,0,0,0|1,0,0]=3 1305 B23R3.1338538 Fc1ccc(cc1)CSCCNc2nc3ccccc3s2 27a_100020610864_100000751744 [0,1,1,0,0,0|2,0,0]=4 1306 B23R3.1338538 Fc1ccc(cc1)OCCCNc2nc3ccccc3[nH]2 27a_100000747263_100009814255 [0,1,1,0,0,0|1,0,0]=3 1307 B23R3.1338538 Fc1ccc(cc1)OCCCNc2nc3ccccc3s2 27a_100000747263_100000751744 [0,1,1,0,0,0|2,0,0]=4 1308 B23R3.1338538 Fc1ccc(cc1)OCCCSc2nc3ccccc3[nH]2 62a_100000181347_100009814255 [0,1,1,0,0,0|2,0,0]=4 1309 B23R3.1338538 Fc1ccc(cc1)SCCCNc2nc3ccccc3[nH]2 27a_100000683907_100009814255 [0,1,1,0,0,0|1,0,0]=3 1310 B23R3.1338538 Fc1ccc(cc1)SCCCNc2nc3ccccc3s2 27a_100000683907_100000751744 [0,1,1,0,0,0|2,0,0]=4 1311 B23R3.1338538 Ic1ccc(cc1)CCOCCc2nc3ccccc3[nH]2 7a_100012291149_100015206048 [0,1,1,0,0,0|2,0,0]=4 1312 B23R3.1338538 Ic1ccc(cc1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000188517 [0,1,1,0,0,0|2,0,0]=4 1313 B23R3.1338538 Oc1ccc(cc1)CCC=NNc2nc3ccccc3[nH]2 4a_100000188875_200011361653 [0,1,1,0,0,0|1,0,1]=4 1314 B23R3.1338538 Oc1ccc(cc1)CCSCCc2nc3ccccc3[nH]2 62a_100009816426_100015206048 [0,1,1,0,0,0|2,0,0]=4 1315 B23R3.3559244 CC(=NNc1nc2ccccc2[nH]1)CCc3ccccc3 4a_100000188875_100000210092 [0,1,1,0,0,0|1,0,1]=4 1316 B23R3.3559244 CC(CCc1ccccc1)NCc2nc3ccccc3[nH]2 207a_100000210798_100000185668 [0,1,1,0,0,0|2,0,0]=4 1317 B23R3.3559244 CC(CCc1ccccc1)NCc2nc3ccccc3[nH]2 2230a_100000210798_100000737899 [0,1,1,0,0,0|2,0,0]=4 1318 B23R3.3559244 CC(CCc1ccccc1)NCc2nc3ccccc3[nH]2 270004a_100000210798_100000185668 [0,1,1,0,0,0|2,0,0]=4 1319 B23R3.3559244 CC(CCc1ccccc1)NCc2nc3ccccc3[nH]2 270004a_100000729406_100000210092 [0,1,1,0,0,0|2,0,0]=4 1320 B23R3.3559244 CC(CCc1nc2ccccc2[nH]1)NCc3ccccc3 270004a_100015324214_200000143796 [0,1,1,0,0,0|2,0,0]=4 1321 B23R3.3559244 CN(CCc1ccccc1)CCc2nc3ccccc3[nH]2 269982a_100000207497_100015206048 [0,1,1,0,0,0|2,0,0]=4 1322 B23R3.3559244 CN(CCc1ccccc1)CCc2nc3ccccc3[nH]2 269982a_100015206297_100000765856 [0,1,1,0,0,0|2,0,0]=4 1323 B23R3.3559244 C[C@@H](CCc1ccccc1)OCc2nc3ccccc3[nH]2 7a_100009815974_100000737899 [0,1,1,0,0,0|2,0,0]=4 1324 B23R3.3559244 O=C(CCc1ccccc1)CCc2nc3ccccc3[nH]2 1458a_100102526157_100000765856 [0,1,1,0,0,0|1,0,1]=4 1325 B23R3.3559244 O=C(CCc1ccccc1)CSc2nc3ccccc3[nH]2 1458a_100000179484_100000765856 [0,1,1,0,0,0|1,0,1]=4 1326 B23R3.3559244 O=C(CCc1ccccc1)CSc2nc3ccccc3[nH]2 62a_100012361361_100009814255 [0,1,1,0,0,0|1,0,1]=4 1327 B23R3.3559244 O=C(CCc1ccccc1)NNc2nc3ccccc3[nH]2 22a_100000188875_100000185753 [0,1,1,0,0,0|1,0,1]=4 1328 B23R3.3559244 O=C(CNc1nc2ccccc2[nH]1)NCc3ccccc3 27a_100000739245_100009814255 [0,1,1,0,0,0|1,0,1]=4 1329 B23R3.3559244 OC(CNc1nc2ccccc2[nH]1)COc3ccccc3 27a_100000738913_100009814255 [0,1,1,0,0,0|1,0,0]=3 1330 B23R3.3559244 OC(CNc1nc2ccccc2s1)COc3ccccc3 27a_100000738913_100000751744 [0,1,1,0,0,0|2,0,0]=4 1331 B23R3.7932701 Brc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 207a_100000753791_100000185668 [0,1,1,0,0,0|2,0,0]=4 1332 B23R3.7932701 Brc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 2230a_100000753791_100000737899 [0,1,1,0,0,0|2,0,0]=4 1333 B23R3.7932701 Brc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 270004a_100000753791_100000185668 [0,1,1,0,0,0|2,0,0]=4 1334 B23R3.7932701 Brc1cccc(c1)CCCOCc2nc3ccccc3[nH]2 7a_100011709248_100000737899 [0,1,1,0,0,0|2,0,0]=4 1335 B23R3.7932701 Brc1cccc(c1)CCCSCc2nc3ccccc3[nH]2 62a_100011713683_100000737899 [0,1,1,0,0,0|2,0,0]=4 1336 B23R3.7932701 Brc1cccc(c1)CCOCCc2nc3ccccc3[nH]2 7a_100011217444_100015206048 [0,1,1,0,0,0|2,0,0]=4 1337 B23R3.7932701 Brc1cccc(c1)CCSCCc2nc3ccccc3[nH]2 62a_100011740638_100015206048 [0,1,1,0,0,0|2,0,0]=4 1338 B23R3.7932701 Brc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000210085 [0,1,1,0,0,0|2,0,0]=4 1339 B23R3.7932701 Brc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000210085 [0,1,1,0,0,0|2,0,0]=4 1340 B23R3.7932701 Cc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 207a_103496528808_100000185668 [0,1,1,0,0,0|2,0,0]=4 1341 B23R3.7932701 Cc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 2230a_103496528808_100000737899 [0,1,1,0,0,0|2,0,0]=4 1342 B23R3.7932701 Cc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 270004a_103496528808_100000185668 [0,1,1,0,0,0|2,0,0]=4 1343 B23R3.7932701 Cc1cccc(c1)CCOCCc2nc3ccccc3[nH]2 7a_100011217157_100015206048 [0,1,1,0,0,0|2,0,0]=4 1344 B23R3.7932701 Cc1cccc(c1)CCSCCc2nc3ccccc3[nH]2 62a_100011713685_100015206048 [0,1,1,0,0,0|2,0,0]=4 1345 B23R3.7932701 Cc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000211157 [0,1,1,0,0,0|2,0,0]=4 1346 B23R3.7932701 Cc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000211157 [0,1,1,0,0,0|2,0,0]=4 1347 B23R3.7932701 Clc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 207a_100000704586_100000185668 [0,1,1,0,0,0|2,0,0]=4 1348 B23R3.7932701 Clc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 2230a_100000704586_100000737899 [0,1,1,0,0,0|2,0,0]=4 1349 B23R3.7932701 Clc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 270004a_100000704586_100000185668 [0,1,1,0,0,0|2,0,0]=4 1350 B23R3.7932701 Clc1cccc(c1)CCCOCc2nc3ccccc3[nH]2 7a_100011709246_100000737899 [0,1,1,0,0,0|2,0,0]=4 1351 B23R3.7932701 Clc1cccc(c1)CCOCCc2nc3ccccc3[nH]2 7a_100000754733_100015206048 [0,1,1,0,0,0|2,0,0]=4 1352 B23R3.7932701 Clc1cccc(c1)CCSCCc2nc3ccccc3[nH]2 62a_100011713710_100015206048 [0,1,1,0,0,0|2,0,0]=4 1353 B23R3.7932701 Clc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000210801 [0,1,1,0,0,0|2,0,0]=4 1354 B23R3.7932701 Clc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000210801 [0,1,1,0,0,0|2,0,0]=4 1355 B23R3.7932701 Clc1cccc(c1)CSCCNc2nc3ccccc3[nH]2 27a_200011225440_100009814255 [0,1,1,0,0,0|1,0,0]=3 1356 B23R3.7932701 Clc1cccc(c1)CSCCNc2nc3ccccc3s2 27a_200011225440_100000751744 [0,1,1,0,0,0|2,0,0]=4 1357 B23R3.7932701 Clc1cccc(c1)OCCCNc2nc3ccccc3[nH]2 27a_100011220311_100009814255 [0,1,1,0,0,0|1,0,0]=3 1358 B23R3.7932701 Clc1cccc(c1)OCCCNc2nc3ccccc3s2 27a_100011220311_100000751744 [0,1,1,0,0,0|2,0,0]=4 1359 B23R3.7932701 Clc1cccc(c1)OCCCSc2nc3ccccc3[nH]2 62a_100000742658_100009814255 [0,1,1,0,0,0|2,0,0]=4 1360 B23R3.7932701 Fc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 207a_100000754185_100000185668 [0,1,1,0,0,0|2,0,0]=4 1361 B23R3.7932701 Fc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 2230a_100000754185_100000737899 [0,1,1,0,0,0|2,0,0]=4 1362 B23R3.7932701 Fc1cccc(c1)CCCNCc2nc3ccccc3[nH]2 270004a_100000754185_100000185668 [0,1,1,0,0,0|2,0,0]=4 1363 B23R3.7932701 Fc1cccc(c1)CCCSCc2nc3ccccc3[nH]2 62a_200000698031_100000737899 [0,1,1,0,0,0|2,0,0]=4 1364 B23R3.7932701 Fc1cccc(c1)CCOCCc2nc3ccccc3[nH]2 7a_100000763591_100015206048 [0,1,1,0,0,0|2,0,0]=4 1365 B23R3.7932701 Fc1cccc(c1)CCSCCc2nc3ccccc3[nH]2 62a_100011217235_100015206048 [0,1,1,0,0,0|2,0,0]=4 1366 B23R3.7932701 Fc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000210812 [0,1,1,0,0,0|2,0,0]=4 1367 B23R3.7932701 Fc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000210812 [0,1,1,0,0,0|2,0,0]=4 1368 B23R3.7932701 Fc1cccc(c1)OCCCNc2nc3ccccc3[nH]2 27a_100102661586_100009814255 [0,1,1,0,0,0|1,0,0]=3 1369 B23R3.7932701 Fc1cccc(c1)OCCCNc2nc3ccccc3s2 27a_100102661586_100000751744 [0,1,1,0,0,0|2,0,0]=4 1370 B23R3.7932701 Ic1cccc(c1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000014684 [0,1,1,0,0,0|2,0,0]=4 1371 B23R3.7932701 Ic1cccc(c1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000014684 [0,1,1,0,0,0|2,0,0]=4 1372 B23R3.7932701 Nc1cccc(c1)CCCOCc2nc3ccccc3[nH]2 7a_200000698965_100000737899 [0,1,1,0,0,0|2,0,0]=4 1373 B23R3.7932701 Oc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000188321 [0,1,1,0,0,0|2,0,0]=4 1374 B23R3.7932701 Oc1cccc(c1)CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000188321 [0,1,1,0,0,0|2,0,0]=4 1375 B23R3.8046005 Brc1ccc2[nH]c(nc2c1)CNCCCc3ccccc3 2230a_100000211184_100000701424 [0,1,1,0,0,0|2,0,0]=4 1376 B23R3.8046005 Brc1ccc2[nH]c(nc2c1)CNCCCc3ccccc3 34a_100000211184_100000701424 [0,1,1,0,0,0|2,0,0]=4 1377 B23R3.8046005 Brc1ccc2[nH]c(nc2c1)COCCCc3ccccc3 34a_100000210828_100000701424 [0,1,1,0,0,0|2,0,0]=4 1378 B23R3.8046005 Brc1ccc2[nH]c(nc2c1)COCCCc3ccccc3 7a_100000210828_100000701424 [0,1,1,0,0,0|2,0,0]=4 1379 B23R3.8046005 Brc1ccc2[nH]c(nc2c1)CSCCCc3ccccc3 62a_100000701424_100000211621 [0,1,1,0,0,0|2,0,0]=4 1380 B23R3.8046005 Brc1ccc2nc([nH]c2c1)CNCCCc3ccccc3 207a_100000211184_200011361486 [0,1,1,0,0,0|2,0,0]=4 1381 B23R3.8046005 Brc1ccc2nc([nH]c2c1)CNCCCc3ccccc3 270004a_100000211184_200011361486 [0,1,1,0,0,0|2,0,0]=4 1382 B23R3.8046005 Cc1ccc2[nH]c(nc2c1)CCCOCc3ccccc3 7a_200102524980_100000211182 [0,1,1,0,0,0|2,0,0]=4 1383 B23R3.8046005 Cc1ccc2nc([nH]c2c1)CCOCCc3ccccc3 7a_100000210268_200015184454 [0,1,1,0,0,0|2,0,0]=4 1384 B23R3.8046005 Cc1ccc2nc([nH]c2c1)CCSCCc3ccccc3 62a_100000765856_200015184454 [0,1,1,0,0,0|2,0,0]=4 1385 B23R3.8046005 Cc1ccc2nc([nH]c2c1)CNCCCc3ccccc3 2230a_100000211184_100020603265 [0,1,1,0,0,0|2,0,0]=4 1386 B23R3.8046005 Cc1ccc2nc([nH]c2c1)CNCCCc3ccccc3 34a_100000211184_100020603265 [0,1,1,0,0,0|2,0,0]=4 1387 B23R3.8046005 Cc1ccc2nc([nH]c2c1)COCCCc3ccccc3 34a_100000210828_100020603265 [0,1,1,0,0,0|2,0,0]=4 1388 B23R3.8046005 Cc1ccc2nc([nH]c2c1)COCCCc3ccccc3 7a_100000210828_100020603265 [0,1,1,0,0,0|2,0,0]=4 1389 B23R3.8046005 Cc1ccc2nc(sc2c1)NCCCCc3ccccc3 27a_100015280158_100010186437 [0,1,1,0,0,0|1,0,0]=3 1390 B23R3.8046005 Cc1ccc2nc(sc2c1)NCCCOc3ccccc3 27a_100000216521_100010186437 [0,1,1,0,0,0|2,0,0]=4 1391 B23R3.8046005 Cc1ccc2nc(sc2c1)NCCCSc3ccccc3 27a_100000184639_100010186437 [0,1,1,0,0,0|2,0,0]=4 1392 B23R3.8046005 Cc1ccc2nc(sc2c1)NCCOCc3ccccc3 27a_100000753106_100010186437 [0,1,1,0,0,0|2,0,0]=4 1393 B23R3.8046005 Cc1ccc2nc(sc2c1)NCCSCc3ccccc3 27a_100000189534_100010186437 [0,1,1,0,0,0|2,0,0]=4 1394 B23R3.8046005 Cc1ccc2nc(sc2c1)SCCCCc3ccccc3 62a_100000701786_100010186437 [0,1,1,0,0,0|2,0,0]=4 1395 B23R3.8046005 Clc1ccc2[nH]c(nc2c1)CCCNCc3ccccc3 207a_100020603499_100015611070 [0,1,1,0,0,0|2,0,0]=4 1396 B23R3.8046005 Clc1ccc2[nH]c(nc2c1)CNCCCc3ccccc3 2230a_100000211184_100000179801 [0,1,1,0,0,0|2,0,0]=4 1397 B23R3.8046005 Clc1ccc2[nH]c(nc2c1)COCCCc3ccccc3 7a_100000210828_100000179801 [0,1,1,0,0,0|2,0,0]=4 1398 B23R3.8046005 Clc1ccc2nc([nH]c2c1)CCOCCc3ccccc3 7a_100000210268_100015185377 [0,1,1,0,0,0|2,0,0]=4 1399 B23R3.8046005 Clc1ccc2nc([nH]c2c1)CCSCCc3ccccc3 62a_100000765856_100015185377 [0,1,1,0,0,0|2,0,0]=4 1400 B23R3.8046005 Fc1ccc2[nH]c(nc2c1)CCCNCc3ccccc3 207a_100020603232_100015611070 [0,1,1,0,0,0|2,0,0]=4 1401 B23R3.8046005 Fc1ccc2[nH]c(nc2c1)CNCCCc3ccccc3 207a_100000211184_200011915233 [0,1,1,0,0,0|2,0,0]=4 1402 B23R3.8046005 Fc1ccc2[nH]c(nc2c1)CNCCCc3ccccc3 270004a_100000211184_200011915233 [0,1,1,0,0,0|2,0,0]=4 1403 B23R3.8046005 Fc1ccc2nc([nH]c2c1)CNCCCc3ccccc3 2230a_100000211184_200011347187 [0,1,1,0,0,0|2,0,0]=4 1404 B23R3.8046005 Fc1ccc2nc([nH]c2c1)COCCCc3ccccc3 7a_100000210828_200011347187 [0,1,1,0,0,0|2,0,0]=4 1405 B23R3.8046005 Fc1ccc2nc(sc2c1)NCCCCc3ccccc3 27a_100015280158_100000751617 [0,1,1,0,0,0|1,0,0]=3 1406 B23R3.8046005 Fc1ccc2nc(sc2c1)NCCCOc3ccccc3 27a_100000216521_100000751617 [0,1,1,0,0,0|2,0,0]=4 1407 B23R3.8046005 Fc1ccc2nc(sc2c1)NCCCSc3ccccc3 27a_100000184639_100000751617 [0,1,1,0,0,0|2,0,0]=4 1408 B23R3.8046005 Fc1ccc2nc(sc2c1)NCCOCc3ccccc3 27a_100000753106_100000751617 [0,1,1,0,0,0|2,0,0]=4 1409 B23R3.8046005 Fc1ccc2nc(sc2c1)NCCSCc3ccccc3 27a_100000189534_100000751617 [0,1,1,0,0,0|2,0,0]=4 1410 B23R3.8046005 Fc1ccc2nc(sc2c1)SCCCCc3ccccc3 62a_100000701786_100000751617 [0,1,1,0,0,0|2,0,0]=4 1411 B23R3.8046005 Fc1ccc2nc(sc2c1)SCCCCc3ccccc3 62a_100000751617_100000701786 [0,1,1,0,0,0|2,0,0]=4 1412 B23R3.8046005 Fc1ccc2nc(sc2n1)NCCCCc3ccccc3 27a_100015280158_200010738066 [0,1,1,0,0,0|2,0,0]=4 1413 B23R3.8046005 Fc1ccc2sc(nc2c1)NCCCCc3ccccc3 27a_100015280158_200010206605 [0,1,1,0,0,0|1,0,0]=3 1414 B23R3.8046005 Fc1ccc2sc(nc2c1)NCCCOc3ccccc3 27a_100000216521_200010206605 [0,1,1,0,0,0|2,0,0]=4 1415 B23R3.8046005 Fc1ccc2sc(nc2c1)NCCCSc3ccccc3 27a_100000184639_200010206605 [0,1,1,0,0,0|2,0,0]=4 1416 B23R3.8046005 Fc1ccc2sc(nc2c1)NCCOCc3ccccc3 27a_100000753106_200010206605 [0,1,1,0,0,0|2,0,0]=4 1417 B23R3.8046005 Fc1ccc2sc(nc2c1)NCCSCc3ccccc3 27a_100000189534_200010206605 [0,1,1,0,0,0|2,0,0]=4 1418 B23R3.8046005 Fc1ccc2sc(nc2c1)SCCCCc3ccccc3 62a_100000701786_200010206605 [0,1,1,0,0,0|2,0,0]=4 1419 B23R3.8046005 Fc1ccc2sc(nc2c1)SCCCCc3ccccc3 62a_200010206605_100000701786 [0,1,1,0,0,0|2,0,0]=4 1420 B23R3.8046005 Nc1ccc2nc(sc2c1)NCCCCc3ccccc3 27a_100015280158_100010253933 [0,1,1,0,0,0|1,0,0]=3 1421 B23R3.8046005 Nc1ccc2nc(sc2c1)NCCCOc3ccccc3 27a_100000216521_100010253933 [0,1,1,0,0,0|2,0,0]=4 1422 B23R3.8046005 Nc1ccc2nc(sc2c1)NCCCSc3ccccc3 27a_100000184639_100010253933 [0,1,1,0,0,0|2,0,0]=4 1423 B23R3.8046005 Nc1ccc2nc(sc2c1)NCCOCc3ccccc3 27a_100000753106_100010253933 [0,1,1,0,0,0|2,0,0]=4 1424 B23R3.8046005 Nc1ccc2nc(sc2c1)NCCSCc3ccccc3 27a_100000189534_100010253933 [0,1,1,0,0,0|2,0,0]=4 1425 B23R3.8046005 Nc1ccc2nc(sc2c1)SCCCCc3ccccc3 62a_100000701786_100010253933 [0,1,1,0,0,0|2,0,0]=4 1426 B23R3.8046005 Nc1ccc2nc(sc2c1)SCCCCc3ccccc3 62a_100010253933_100000701786 [0,1,1,0,0,0|2,0,0]=4 1427 B23R3.8046005 Nc1ccc2sc(nc2c1)NCCCCc3ccccc3 27a_100015280158_100010329861 [0,1,1,0,0,0|1,0,0]=3 1428 B23R3.8046005 Nc1ccc2sc(nc2c1)NCCCOc3ccccc3 27a_100000216521_100010329861 [0,1,1,0,0,0|2,0,0]=4 1429 B23R3.8046005 Nc1ccc2sc(nc2c1)NCCCSc3ccccc3 27a_100000184639_100010329861 [0,1,1,0,0,0|2,0,0]=4 1430 B23R3.8046005 Nc1ccc2sc(nc2c1)NCCOCc3ccccc3 27a_100000753106_100010329861 [0,1,1,0,0,0|2,0,0]=4 1431 B23R3.8046005 Nc1ccc2sc(nc2c1)NCCSCc3ccccc3 27a_100000189534_100010329861 [0,1,1,0,0,0|2,0,0]=4 1432 B23R3.8046005 Nc1ccc2sc(nc2c1)SCCCCc3ccccc3 62a_100000701786_100010329861 [0,1,1,0,0,0|2,0,0]=4 1433 B23R3.8046005 Nc1ccc2sc(nc2c1)SCCCCc3ccccc3 62a_100010329861_100000701786 [0,1,1,0,0,0|2,0,0]=4 1434 B23R3.8046005 Oc1ccc2nc(sc2c1)NCCCCc3ccccc3 27a_100015280158_100010063415 [0,1,1,0,0,0|1,0,0]=3 1435 B23R3.8046005 Oc1ccc2nc(sc2c1)NCCCOc3ccccc3 27a_100000216521_100010063415 [0,1,1,0,0,0|2,0,0]=4 1436 B23R3.8046005 Oc1ccc2nc(sc2c1)NCCCSc3ccccc3 27a_100000184639_100010063415 [0,1,1,0,0,0|2,0,0]=4 1437 B23R3.8046005 Oc1ccc2nc(sc2c1)NCCOCc3ccccc3 27a_100000753106_100010063415 [0,1,1,0,0,0|2,0,0]=4 1438 B23R3.8046005 Oc1ccc2nc(sc2c1)NCCSCc3ccccc3 27a_100000189534_100010063415 [0,1,1,0,0,0|2,0,0]=4 1439 B23R3.8046005 Oc1ccc2nc(sc2c1)SCCCCc3ccccc3 62a_100000701786_100010063415 [0,1,1,0,0,0|2,0,0]=4 1440 B23R3.8281260 Brc1ccccc1CCC=NNc2nc3ccccc3[nH]2 4a_100000188875_100011713448 [0,1,1,0,0,0|1,0,1]=4 1441 B23R3.8281260 Brc1ccccc1CCCOCc2nc3ccccc3[nH]2 7a_100000699526_100000737899 [0,1,1,0,0,0|2,0,0]=4 1442 B23R3.8281260 Brc1ccccc1CCCSCc2nc3ccccc3[nH]2 62a_200011713681_100000737899 [0,1,1,0,0,0|2,0,0]=4 1443 B23R3.8281260 Brc1ccccc1CCOCCc2nc3ccccc3[nH]2 7a_100000731337_100015206048 [0,1,1,0,0,0|2,0,0]=4 1444 B23R3.8281260 Brc1ccccc1CCSCCc2nc3ccccc3[nH]2 62a_100012161201_100015206048 [0,1,1,0,0,0|2,0,0]=4 1445 B23R3.8281260 Brc1ccccc1CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000211189 [0,1,1,0,0,0|2,0,0]=4 1446 B23R3.8281260 Brc1ccccc1CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000211189 [0,1,1,0,0,0|2,0,0]=4 1447 B23R3.8281260 Brc1ccccc1OCCCSc2nc3ccccc3[nH]2 62a_200011259276_100009814255 [0,1,1,0,0,0|2,0,0]=4 1448 B23R3.8281260 Cc1ccccc1CCOCCc2nc3ccccc3[nH]2 7a_100011220023_100015206048 [0,1,1,0,0,0|2,0,0]=4 1449 B23R3.8281260 Cc1ccccc1CCSCCc2nc3ccccc3[nH]2 62a_100011713688_100015206048 [0,1,1,0,0,0|2,0,0]=4 1450 B23R3.8281260 Cc1ccccc1CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000211143 [0,1,1,0,0,0|2,0,0]=4 1451 B23R3.8281260 Cc1ccccc1CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000211143 [0,1,1,0,0,0|2,0,0]=4 1452 B23R3.8281260 Cc1ccccc1CSCCNc2nc3ccccc3[nH]2 27a_200000189569_100009814255 [0,1,1,0,0,0|1,0,0]=3 1453 B23R3.8281260 Cc1ccccc1CSCCNc2nc3ccccc3s2 27a_200000189569_100000751744 [0,1,1,0,0,0|2,0,0]=4 1454 B23R3.8281260 Cc1ccccc1OCCCNc2nc3ccccc3[nH]2 27a_106633784460_100009814255 [0,1,1,0,0,0|1,0,0]=3 1455 B23R3.8281260 Cc1ccccc1OCCCNc2nc3ccccc3s2 27a_106633784460_100000751744 [0,1,1,0,0,0|2,0,0]=4 1456 B23R3.8281260 Cc1ccccc1OCCCSc2nc3ccccc3[nH]2 62a_100000742659_100009814255 [0,1,1,0,0,0|2,0,0]=4 1457 B23R3.8281260 Clc1ccccc1CCCOCc2nc3ccccc3[nH]2 7a_100011709251_100000737899 [0,1,1,0,0,0|2,0,0]=4 1458 B23R3.8281260 Clc1ccccc1CCNCCc2nc3ccccc3[nH]2 270004a_100015184290_200011713468 [0,1,1,0,0,0|2,0,0]=4 1459 B23R3.8281260 Clc1ccccc1CCOCCc2nc3ccccc3[nH]2 7a_100011215284_100015206048 [0,1,1,0,0,0|2,0,0]=4 1460 B23R3.8281260 Clc1ccccc1CCSCCc2nc3ccccc3[nH]2 62a_100011713703_100015206048 [0,1,1,0,0,0|2,0,0]=4 1461 B23R3.8281260 Clc1ccccc1CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000210073 [0,1,1,0,0,0|2,0,0]=4 1462 B23R3.8281260 Clc1ccccc1CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000210073 [0,1,1,0,0,0|2,0,0]=4 1463 B23R3.8281260 Clc1ccccc1COCCNc2nc3ccccc3[nH]2 27a_100000745786_100009814255 [0,1,1,0,0,0|1,0,0]=3 1464 B23R3.8281260 Clc1ccccc1COCCNc2nc3ccccc3s2 27a_100000745786_100000751744 [0,1,1,0,0,0|2,0,0]=4 1465 B23R3.8281260 Clc1ccccc1CSCCNc2nc3ccccc3[nH]2 27a_100011219180_100009814255 [0,1,1,0,0,0|1,0,0]=3 1466 B23R3.8281260 Clc1ccccc1CSCCNc2nc3ccccc3s2 27a_100011219180_100000751744 [0,1,1,0,0,0|2,0,0]=4 1467 B23R3.8281260 Clc1ccccc1SCCCSc2nc3ccccc3[nH]2 62a_100000750589_100009814255 [0,1,1,0,0,0|2,0,0]=4 1468 B23R3.8281260 Fc1ccccc1CCC=NNc2nc3ccccc3[nH]2 4a_100000188875_100011713414 [0,1,1,0,0,0|1,0,1]=4 1469 B23R3.8281260 Fc1ccccc1CCCNCc2nc3ccccc3[nH]2 207a_100000724733_100000185668 [0,1,1,0,0,0|2,0,0]=4 1470 B23R3.8281260 Fc1ccccc1CCCNCc2nc3ccccc3[nH]2 2230a_100000724733_100000737899 [0,1,1,0,0,0|2,0,0]=4 1471 B23R3.8281260 Fc1ccccc1CCCNCc2nc3ccccc3[nH]2 270004a_100000724733_100000185668 [0,1,1,0,0,0|2,0,0]=4 1472 B23R3.8281260 Fc1ccccc1CCCOCc2nc3ccccc3[nH]2 7a_100011709249_100000737899 [0,1,1,0,0,0|2,0,0]=4 1473 B23R3.8281260 Fc1ccccc1CCOCCc2nc3ccccc3[nH]2 7a_100000753711_100015206048 [0,1,1,0,0,0|2,0,0]=4 1474 B23R3.8281260 Fc1ccccc1CCSCCc2nc3ccccc3[nH]2 62a_100011713696_100015206048 [0,1,1,0,0,0|2,0,0]=4 1475 B23R3.8281260 Fc1ccccc1CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000210811 [0,1,1,0,0,0|2,0,0]=4 1476 B23R3.8281260 Fc1ccccc1CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000210811 [0,1,1,0,0,0|2,0,0]=4 1477 B23R3.8281260 Fc1ccccc1OCCCNc2nc3ccccc3[nH]2 27a_100000707858_100009814255 [0,1,1,0,0,0|1,0,0]=3 1478 B23R3.8281260 Fc1ccccc1OCCCNc2nc3ccccc3s2 27a_100000707858_100000751744 [0,1,1,0,0,0|2,0,0]=4 1479 B23R3.8281260 Fc1ccccc1OCCCSc2nc3ccccc3[nH]2 62a_100011203253_100009814255 [0,1,1,0,0,0|2,0,0]=4 1480 B23R3.8281260 Ic1ccccc1CCOCCc2nc3ccccc3[nH]2 7a_100010255290_100015206048 [0,1,1,0,0,0|2,0,0]=4 1481 B23R3.8281260 Ic1ccccc1CNCCCc2nc3ccccc3[nH]2 207a_100000734966_100000010305 [0,1,1,0,0,0|2,0,0]=4 1482 B23R3.8281260 Ic1ccccc1CNCCCc2nc3ccccc3[nH]2 270004a_100000734966_100000010305 [0,1,1,0,0,0|2,0,0]=4 1483 B23R3.8281260 Oc1ccccc1CCSCCc2nc3ccccc3[nH]2 62a_100000722297_100015206048 [0,1,1,0,0,0|2,0,0]=4 1484 B23R3.19444762 CC(NCCCc1ccccc1)c2nc3ccccc3[nH]2 270004a_100000211184_100000199114 [0,1,1,0,0,0|2,0,0]=4 1485 B23R3.19444762 CN(CCCCc1ccccc1)c2nc3ccccc3[nH]2 27a_100000741445_100009814255 [0,1,1,0,0,0|0,0,0]=2 1486 B23R3.19444762 CN(CCCCc1ccccc1)c2nc3ccccc3s2 27a_100000741445_100000751744 [0,1,1,0,0,0|1,0,0]=3 1487 B23R3.19444762 CN(CCCCc1ccccc1)c2nc3cccnc3s2 27a_100000741445_100010188088 [0,1,1,0,0,0|2,0,0]=4 1488 B23R3.19444762 CN(CCCOc1ccccc1)c2nc3ccccc3[nH]2 27a_100000225623_100009814255 [0,1,1,0,0,0|1,0,0]=3 1489 B23R3.19444762 CN(CCCOc1ccccc1)c2nc3ccccc3s2 27a_100000225623_100000751744 [0,1,1,0,0,0|2,0,0]=4 1490 B23R3.19444762 CN(CCCSc1ccccc1)c2nc3ccccc3[nH]2 27a_100015183843_100009814255 [0,1,1,0,0,0|1,0,0]=3 1491 B23R3.19444762 CN(CCCSc1ccccc1)c2nc3ccccc3s2 27a_100015183843_100000751744 [0,1,1,0,0,0|2,0,0]=4 1492 B23R3.19444762 CN(CCOCc1ccccc1)c2nc3ccccc3[nH]2 27a_100000687121_100009814255 [0,1,1,0,0,0|1,0,0]=3 1493 B23R3.19444762 CN(CCOCc1ccccc1)c2nc3ccccc3s2 27a_100000687121_100000751744 [0,1,1,0,0,0|2,0,0]=4 1494 B23R3.19444762 C[C@H](NCCCc1ccccc1)c2nc3ccccc3[nH]2 2230a_100015206438_100000211621 [0,1,1,0,0,0|2,0,0]=4 1495 B23R3.19445676 CC(CCCc1ccccc1)Sc2cc3ccccc3[nH]2 62a_200010759516_100010232065 [0,1,1,0,0,0|2,0,0]=4 1496 B23R3.19445676 CC(CCCc1ccccc1)Sc2nc3ccccc3[nH]2 62a_200010759516_100009814255 [0,1,1,0,0,0|1,0,0]=3 1497 B23R3.19445676 CC(CCCc1ccccc1)Sc2nc3ccccc3s2 62a_200010759516_100000751744 [0,1,1,0,0,0|2,0,0]=4 1498 B23R3.19445676 CN(CCCc1ccccc1)Cc2nc3ccccc3[nH]2 2230a_100000693637_100000737899 [0,1,1,0,0,0|2,0,0]=4 1499 B23R3.19445676 CN(CCCc1ccccc1)Cc2nc3ccccc3[nH]2 2230a_100000736437_100000211621 [0,1,1,0,0,0|2,0,0]=4 1500 B23R3.19445676 CN(CCCc1ccccc1)Cc2nc3ccccc3[nH]2 269982a_100000693637_100000737899 [0,1,1,0,0,0|2,0,0]=4 1501 B23R3.19445676 CN(CCCc1ccccc1)Cc2nc3ccccc3[nH]2 269982a_100000736437_100000211621 [0,1,1,0,0,0|2,0,0]=4 1502 B23R3.19445676 CN(CCCc1ccccc1)Cc2nc3ccccc3[nH]2 270004a_100000693637_100000185668 [0,1,1,0,0,0|2,0,0]=4 1503 B23R3.19445676 O=C(CCCc1ccccc1)Cc2nc3ccccc3[nH]2 1458a_100011207963_100000737899 [0,1,1,0,0,0|1,0,1]=4 1504 B23R3.19445676 O=C(CNCc1ccccc1)Nc2nc3ccccc3[nH]2 2230a_100015324214_100011353410 [0,1,1,0,0,0|1,0,1]=4 1505 B23R3.1506334 CC(Nc1nc2ccccc2n1C)c3ccccc3C#N 27a_100160469468_200000239431 [0,1,1,0,0,0|1,0,1]=4 1506 B23R3.1506334 COc1ccccc1C(C)Nc2nc3ccccc3n2C 27a_100000185323_200000239431 [0,1,1,0,0,0|1,0,0]=3 1507 B23R3.1764995 COc1cccc(c1[C@H](C)Nc2nc3ccccc3[nH]2)F 27a_100025712826_100009814255 [0,1,1,0,0,0|1,0,0]=3 1508 B23R3.1764995 COc1cccc(c1[C@H](C)Nc2nc3ccccc3s2)F 27a_100025712826_100000751744 [0,1,1,0,0,0|2,0,0]=4 1509 B23R3.1979862 COc1ccc(cc1C(C)Nc2nc3ccccc3[nH]2)Cl 27a_100011217627_100009814255 [0,1,1,0,0,0|1,0,0]=3 1510 B23R3.1979862 COc1ccc(cc1C(C)Nc2nc3ccccc3s2)Cl 27a_100011217627_100000751744 [0,1,1,0,0,0|2,0,0]=4 1511 B23R3.2054057 COc1ccccc1C(C)Nc2nc3cc(ccc3s2)F 27a_100000185323_200010206605 [0,1,1,0,0,0|2,0,0]=4 1512 B23R3.2054057 COc1ccccc1C(C)Nc2nc3cc(ccc3s2)N 27a_100000185323_100010329861 [0,1,1,0,0,0|2,0,0]=4 1513 B23R3.2054057 COc1ccccc1C(C)Nc2nc3ccc(cc3s2)C 27a_100000185323_100010186437 [0,1,1,0,0,0|2,0,0]=4 1514 B23R3.2054057 COc1ccccc1C(C)Nc2nc3ccc(cc3s2)F 27a_100000185323_100000751617 [0,1,1,0,0,0|2,0,0]=4 1515 B23R3.2054057 COc1ccccc1C(C)Nc2nc3ccc(cc3s2)N 27a_100000185323_100010253933 [0,1,1,0,0,0|2,0,0]=4 1516 B23R3.2054057 COc1ccccc1C(C)Nc2nc3ccc(cc3s2)O 27a_100000185323_100010063415 [0,1,1,0,0,0|2,0,0]=4 1517 B23R3.2054058 COc1ccccc1C(C)Nc2nc3c(cccc3s2)C 27a_100000185323_100010008827 [0,1,1,0,0,0|2,0,0]=4 1518 B23R3.2054058 COc1ccccc1C(C)Nc2nc3c(cccc3s2)F 27a_100000185323_100010008856 [0,1,1,0,0,0|2,0,0]=4 1519 B23R3.5130157 COc1ccccc1C(C)N(C)c2nc3ccccc3[nH]2 27a_100015187102_100009814255 [0,1,1,0,0,0|1,0,0]=3 1520 B23R3.5130157 COc1ccccc1C(C)N(C)c2nc3ccccc3s2 27a_100015187102_100000751744 [0,1,1,0,0,0|2,0,0]=4 1521 B23R3.19359834 CC(C)c1ccccc1N(C)Cc2nc3ccccc3[nH]2 2230a_106256037369_100000737899 [0,1,1,0,0,0|2,0,0]=4 1522 B23R3.19359834 CC(C)c1ccccc1N(C)Cc2nc3ccccc3[nH]2 269982a_106256037369_100000737899 [0,1,1,0,0,0|2,0,0]=4 1523 B23R3.19359834 C[C@@H](Nc1nc2ccccc2[nH]1)c3ccccc3[N+](=O)[O-] 27a_100025717333_100009814255 [0,1,1,0,0,0|2,0,0]=4 1524 B23R4.8878476 CN(C1CCCc2c1cccc2)C3Cc4c3cccc4 269982a_100000185324_100009813401 [0,1,0,0,1,0|1,0,1]=4 1525 B23R4.2397 Cn1c(nc2c1cccc2)NC3COc4c3cccc4 27a_100000747519_200000239431 [0,1,0,0,1,0|1,0,0]=3 1526 B23R4.2397 Cn1c(nc2c1cccc2)N[C@H]3CCc4c3cccc4 27a_100016989578_200000239431 [0,1,0,0,1,0|0,0,0]=2 1527 B23R4.2397 Cn1c(nc2c1cccc2)SC3CCc4c3cccc4 62a_200000239431_200000721974 [0,1,0,0,1,0|1,0,0]=3 1528 B23R4.16933 Brc1ccc2c(c1)CCC2Nc3nc4ccccc4[nH]3 27a_100000744021_100009814255 [0,1,0,0,1,0|0,0,0]=2 1529 B23R4.16933 Brc1ccc2c(c1)CCC2Nc3nc4ccccc4s3 27a_100000744021_100000751744 [0,1,0,0,1,0|1,0,0]=3 1530 B23R4.16933 Brc1ccc2c(c1)CCC2Nc3nc4cccnc4s3 27a_100000744021_100010188088 [0,1,0,0,1,0|2,0,0]=4 1531 B23R4.16933 Brc1ccc2c(c1)OCC2Nc3nc4ccccc4[nH]3 27a_100020628175_100009814255 [0,1,0,0,1,0|1,0,0]=3 1532 B23R4.16933 Brc1ccc2c(c1)OCC2Nc3nc4ccccc4s3 27a_100020628175_100000751744 [0,1,0,0,1,0|2,0,0]=4 1533 B23R4.16933 Cc1ccc2c(c1)CCC2Nc3nc4ccccc4[nH]3 27a_200000746848_100009814255 [0,1,0,0,1,0|0,0,0]=2 1534 B23R4.16933 Cc1ccc2c(c1)CCC2Nc3nc4ccccc4s3 27a_200000746848_100000751744 [0,1,0,0,1,0|1,0,0]=3 1535 B23R4.16933 Cc1ccc2c(c1)CCC2Nc3nc4cccnc4s3 27a_200000746848_100010188088 [0,1,0,0,1,0|2,0,0]=4 1536 B23R4.16933 Clc1ccc2c(c1)CCC2Nc3nc4ccccc4[nH]3 27a_100000743821_100009814255 [0,1,0,0,1,0|0,0,0]=2 1537 B23R4.16933 Clc1ccc2c(c1)CCC2Nc3nc4ccccc4s3 27a_100000743821_100000751744 [0,1,0,0,1,0|1,0,0]=3 1538 B23R4.16933 Clc1ccc2c(c1)CCC2Nc3nc4cccnc4s3 27a_100000743821_100010188088 [0,1,0,0,1,0|2,0,0]=4 1539 B23R4.16933 Clc1ccc2c(c1)OC[C@H]2Nc3nc4ccccc4[nH]3 27a_100138412546_100009814255 [0,1,0,0,1,0|1,0,0]=3 1540 B23R4.16933 Clc1ccc2c(c1)OC[C@H]2Nc3nc4ccccc4s3 27a_100138412546_100000751744 [0,1,0,0,1,0|2,0,0]=4 1541 B23R4.16933 Fc1ccc2c(c1)CC[C@H]2Nc3nc4ccccc4[nH]3 27a_100025717273_100009814255 [0,1,0,0,1,0|0,0,0]=2 1542 B23R4.16933 Fc1ccc2c(c1)CC[C@H]2Nc3nc4ccccc4s3 27a_100025717273_100000751744 [0,1,0,0,1,0|1,0,0]=3 1543 B23R4.16933 Fc1ccc2c(c1)CC[C@H]2Nc3nc4cccnc4s3 27a_100025717273_100010188088 [0,1,0,0,1,0|2,0,0]=4 1544 B23R4.16933 Fc1ccc2c(c1)OC[C@@H]2Nc3nc4ccccc4[nH]3 27a_100102463760_100009814255 [0,1,0,0,1,0|1,0,0]=3 1545 B23R4.16933 Fc1ccc2c(c1)OC[C@@H]2Nc3nc4ccccc4s3 27a_100102463760_100000751744 [0,1,0,0,1,0|2,0,0]=4 1546 B23R4.54437 O[C@@H]1Cc2ccccc2[C@@H]1Nc3nc4ccccc4[nH]3 27a_100000744645_100009814255 [0,1,0,0,1,0|0,0,0]=2 1547 B23R4.54437 O[C@@H]1Cc2ccccc2[C@@H]1Nc3nc4ccccc4s3 27a_100000744645_100000751744 [0,1,0,0,1,0|1,0,0]=3 1548 B23R4.54437 O[C@@H]1Cc2ccccc2[C@@H]1Nc3nc4cccnc4s3 27a_100000744645_100010188088 [0,1,0,0,1,0|2,0,0]=4 1549 B23R4.1811441 Brc1ccc2[nH]c(cc2c1)SC3CCc4c3cccc4 62a_100011012855_200000721974 [0,1,0,0,1,0|2,0,0]=4 1550 B23R4.1811441 Cc1ccc2nc(sc2c1)NC3COc4c3cccc4 27a_100000747519_100010186437 [0,1,0,0,1,0|2,0,0]=4 1551 B23R4.1811441 Cc1ccc2nc(sc2c1)N[C@H]3CCc4c3cccc4 27a_100016989578_100010186437 [0,1,0,0,1,0|1,0,0]=3 1552 B23R4.1811441 Fc1ccc2nc(sc2c1)NC3COc4c3cccc4 27a_100000747519_100000751617 [0,1,0,0,1,0|2,0,0]=4 1553 B23R4.1811441 Fc1ccc2nc(sc2c1)N[C@H]3CCc4c3cccc4 27a_100016989578_100000751617 [0,1,0,0,1,0|1,0,0]=3 1554 B23R4.1811441 Fc1ccc2nc(sc2c1)SC3CCc4c3cccc4 62a_100000751617_200000721974 [0,1,0,0,1,0|2,0,0]=4 1555 B23R4.1811441 Fc1ccc2nc(sc2n1)N[C@H]3CCc4c3cccc4 27a_100016989578_200010738066 [0,1,0,0,1,0|2,0,0]=4 1556 B23R4.1811441 Fc1ccc2sc(nc2c1)NC3COc4c3cccc4 27a_100000747519_200010206605 [0,1,0,0,1,0|2,0,0]=4 1557 B23R4.1811441 Fc1ccc2sc(nc2c1)N[C@H]3CCc4c3cccc4 27a_100016989578_200010206605 [0,1,0,0,1,0|1,0,0]=3 1558 B23R4.1811441 Fc1ccc2sc(nc2c1)SC3CCc4c3cccc4 62a_200010206605_200000721974 [0,1,0,0,1,0|2,0,0]=4 1559 B23R4.1811441 Nc1ccc2nc(sc2c1)NC3COc4c3cccc4 27a_100000747519_100010253933 [0,1,0,0,1,0|2,0,0]=4 1560 B23R4.1811441 Nc1ccc2nc(sc2c1)N[C@H]3CCc4c3cccc4 27a_100016989578_100010253933 [0,1,0,0,1,0|1,0,0]=3 1561 B23R4.1811441 Nc1ccc2nc(sc2c1)SC3CCc4c3cccc4 62a_100010253933_200000721974 [0,1,0,0,1,0|2,0,0]=4 1562 B23R4.1811441 Nc1ccc2sc(nc2c1)NC3COc4c3cccc4 27a_100000747519_100010329861 [0,1,0,0,1,0|2,0,0]=4 1563 B23R4.1811441 Nc1ccc2sc(nc2c1)N[C@H]3CCc4c3cccc4 27a_100016989578_100010329861 [0,1,0,0,1,0|1,0,0]=3 1564 B23R4.1811441 Nc1ccc2sc(nc2c1)SC3CCc4c3cccc4 62a_100010329861_200000721974 [0,1,0,0,1,0|2,0,0]=4 1565 B23R4.1811441 Oc1ccc2nc(sc2c1)NC3COc4c3cccc4 27a_100000747519_100010063415 [0,1,0,0,1,0|2,0,0]=4 1566 B23R4.1811441 Oc1ccc2nc(sc2c1)N[C@H]3CCc4c3cccc4 27a_100016989578_100010063415 [0,1,0,0,1,0|1,0,0]=3 1567 B23R4.2136411 Brc1ccc2c(c1)C(CC2)Nc3nc4ccccc4[nH]3 27a_100011435097_100009814255 [0,1,0,0,1,0|0,0,0]=2 1568 B23R4.2136411 Brc1ccc2c(c1)C(CC2)Nc3nc4ccccc4s3 27a_100011435097_100000751744 [0,1,0,0,1,0|1,0,0]=3 1569 B23R4.2136411 Brc1ccc2c(c1)C(CC2)Nc3nc4cccnc4s3 27a_100011435097_100010188088 [0,1,0,0,1,0|2,0,0]=4 1570 B23R4.2136411 Clc1ccc2c(c1)C(CC2)Nc3nc4ccccc4[nH]3 27a_100016987686_100009814255 [0,1,0,0,1,0|0,0,0]=2 1571 B23R4.2136411 Clc1ccc2c(c1)C(CC2)Nc3nc4ccccc4s3 27a_100016987686_100000751744 [0,1,0,0,1,0|1,0,0]=3 1572 B23R4.2136411 Clc1ccc2c(c1)C(CC2)Nc3nc4cccnc4s3 27a_100016987686_100010188088 [0,1,0,0,1,0|2,0,0]=4 1573 B23R4.2136411 Clc1ccc2c(c1)C(CO2)Nc3nc4ccccc4[nH]3 27a_100000705955_100009814255 [0,1,0,0,1,0|1,0,0]=3 1574 B23R4.2136411 Clc1ccc2c(c1)C(CO2)Nc3nc4ccccc4s3 27a_100000705955_100000751744 [0,1,0,0,1,0|2,0,0]=4 1575 B23R4.2136411 Fc1ccc2c(c1)C(CC2)Nc3nc4ccccc4[nH]3 27a_100000752734_100009814255 [0,1,0,0,1,0|0,0,0]=2 1576 B23R4.2136411 Fc1ccc2c(c1)C(CC2)Nc3nc4ccccc4s3 27a_100000752734_100000751744 [0,1,0,0,1,0|1,0,0]=3 1577 B23R4.2136411 Fc1ccc2c(c1)C(CC2)Nc3nc4cccnc4s3 27a_100000752734_100010188088 [0,1,0,0,1,0|2,0,0]=4 1578 B23R4.2136411 Fc1ccc2c(c1)[C@@H](CO2)Nc3nc4ccccc4[nH]3 27a_100161114692_100009814255 [0,1,0,0,1,0|1,0,0]=3 1579 B23R4.2136411 Fc1ccc2c(c1)[C@@H](CO2)Nc3nc4ccccc4s3 27a_100161114692_100000751744 [0,1,0,0,1,0|2,0,0]=4 1580 B23R4.2671290 Brc1cccc2c1CCC2Nc3nc4ccccc4[nH]3 27a_100000751068_100009814255 [0,1,0,0,1,0|0,0,0]=2 1581 B23R4.2671290 Brc1cccc2c1CCC2Nc3nc4ccccc4s3 27a_100000751068_100000751744 [0,1,0,0,1,0|1,0,0]=3 1582 B23R4.2671290 Brc1cccc2c1CCC2Nc3nc4cccnc4s3 27a_100000751068_100010188088 [0,1,0,0,1,0|2,0,0]=4 1583 B23R4.2671290 Brc1cccc2c1OCC2Nc3nc4ccccc4[nH]3 27a_100025715106_100009814255 [0,1,0,0,1,0|1,0,0]=3 1584 B23R4.2671290 Brc1cccc2c1OCC2Nc3nc4ccccc4s3 27a_100025715106_100000751744 [0,1,0,0,1,0|2,0,0]=4 1585 B23R4.2671290 Cc1cccc2c1CC[C@@H]2Nc3nc4ccccc4[nH]3 27a_100134618347_100009814255 [0,1,0,0,1,0|0,0,0]=2 1586 B23R4.2671290 Cc1cccc2c1CC[C@@H]2Nc3nc4ccccc4s3 27a_100134618347_100000751744 [0,1,0,0,1,0|1,0,0]=3 1587 B23R4.2671290 Cc1cccc2c1CC[C@@H]2Nc3nc4cccnc4s3 27a_100134618347_100010188088 [0,1,0,0,1,0|2,0,0]=4 1588 B23R4.2671290 Clc1cccc2c1CCC2Nc3nc4ccccc4[nH]3 27a_100000743989_100009814255 [0,1,0,0,1,0|0,0,0]=2 1589 B23R4.2671290 Clc1cccc2c1CCC2Nc3nc4ccccc4s3 27a_100000743989_100000751744 [0,1,0,0,1,0|1,0,0]=3 1590 B23R4.2671290 Clc1cccc2c1CCC2Nc3nc4cccnc4s3 27a_100000743989_100010188088 [0,1,0,0,1,0|2,0,0]=4 1591 B23R4.2671290 Clc1cccc2c1OC[C@@H]2Nc3nc4ccccc4[nH]3 27a_100102463758_100009814255 [0,1,0,0,1,0|1,0,0]=3 1592 B23R4.2671290 Clc1cccc2c1OC[C@@H]2Nc3nc4ccccc4s3 27a_100102463758_100000751744 [0,1,0,0,1,0|2,0,0]=4 1593 B23R4.2671290 Fc1cccc2c1CC[C@@H]2Nc3nc4ccccc4[nH]3 27a_100015193782_100009814255 [0,1,0,0,1,0|0,0,0]=2 1594 B23R4.2671290 Fc1cccc2c1CC[C@@H]2Nc3nc4ccccc4s3 27a_100015193782_100000751744 [0,1,0,0,1,0|1,0,0]=3 1595 B23R4.2671290 Fc1cccc2c1CC[C@@H]2Nc3nc4cccnc4s3 27a_100015193782_100010188088 [0,1,0,0,1,0|2,0,0]=4 1596 B23R4.2671290 Oc1cccc2c1CC[C@@H]2Nc3nc4ccccc4[nH]3 27a_100134616730_100009814255 [0,1,0,0,1,0|0,0,0]=2 1597 B23R4.2671290 Oc1cccc2c1CC[C@@H]2Nc3nc4ccccc4s3 27a_100134616730_100000751744 [0,1,0,0,1,0|1,0,0]=3 1598 B23R4.2671290 Oc1cccc2c1CC[C@@H]2Nc3nc4cccnc4s3 27a_100134616730_100010188088 [0,1,0,0,1,0|2,0,0]=4 1599 B23R4.2671509 Brc1cccc2c1[nH]c(c2)SC3CCc4c3cccc4 62a_100135389745_200000721974 [0,1,0,0,1,0|2,0,0]=4 1600 B23R4.2671509 Cc1cccc2c1nc(s2)NC3COc4c3cccc4 27a_100000747519_100010008827 [0,1,0,0,1,0|2,0,0]=4 1601 B23R4.2671509 Cc1cccc2c1nc(s2)N[C@H]3CCc4c3cccc4 27a_100016989578_100010008827 [0,1,0,0,1,0|1,0,0]=3 1602 B23R4.2671509 Fc1cccc2c1nc(s2)NC3COc4c3cccc4 27a_100000747519_100010008856 [0,1,0,0,1,0|2,0,0]=4 1603 B23R4.2671509 Fc1cccc2c1nc(s2)N[C@H]3CCc4c3cccc4 27a_100016989578_100010008856 [0,1,0,0,1,0|1,0,0]=3 1604 B23R4.2671509 Nc1ncnc2c1[nH]c(n2)N[C@H]3CCc4c3cccc4 27a_100016989578_100009817290 [0,1,0,0,1,0|2,0,0]=4 1605 B23R4.2695166 Brc1cccc2c1C(CC2)Nc3nc4ccccc4[nH]3 27a_100103168669_100009814255 [0,1,0,0,1,0|0,0,0]=2 1606 B23R4.2695166 Brc1cccc2c1C(CC2)Nc3nc4ccccc4s3 27a_100103168669_100000751744 [0,1,0,0,1,0|1,0,0]=3 1607 B23R4.2695166 Brc1cccc2c1C(CC2)Nc3nc4cccnc4s3 27a_100103168669_100010188088 [0,1,0,0,1,0|2,0,0]=4 1608 B23R4.2695166 Fc1cccc2c1[C@@H](CO2)Nc3nc4ccccc4[nH]3 27a_200015272058_100009814255 [0,1,0,0,1,0|1,0,0]=3 1609 B23R4.2695166 Fc1cccc2c1[C@@H](CO2)Nc3nc4ccccc4s3 27a_200015272058_100000751744 [0,1,0,0,1,0|2,0,0]=4 1610 B23R4.4058264 O=C1CC(c2c1cccc2)Sc3nc4ccccc4[nH]3 62a_100010208147_100009814255 [0,1,0,0,1,0|1,0,1]=4 1611 B23R4.4058264 O=C1NC(c2c1cccc2)Nc3nc4ccccc4[nH]3 27a_100016086272_100009814255 [0,1,0,0,1,0|1,0,1]=4 1612 B25R4.63254 Brc1c(sc2c1cccc2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100009816528 [0,1,0,0,0,1|2,0,0]=4 1613 B25R4.63254 Cc1c([nH]c2c1cccc2)CNC3CCCc4c3ccnc4 270004a_100020634316_100000066550 [0,1,0,0,0,1|2,0,0]=4 1614 B25R4.63254 Cc1c([nH]c2c1cccc2)CNC3CCCc4c3nccc4 270004a_100011259139_100000066550 [0,1,0,0,0,1|2,0,0]=4 1615 B25R4.63254 Cc1c([nH]c2c1cccc2)CNC3CCOc4c3cccc4 270004a_100015190321_100000066550 [0,1,0,0,0,1|2,0,0]=4 1616 B25R4.63254 Cc1c([nH]c2c1cccc2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000066550 [0,1,0,0,0,1|1,0,0]=3 1617 B25R4.63254 Cc1c(oc2c1cccc2)CNC3CCCc4c3cccc4 269862a_100153394726_100000210882 [0,1,0,0,0,1|2,0,0]=4 1618 B25R4.63254 Cc1c(oc2c1cccc2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000077534 [0,1,0,0,0,1|2,0,0]=4 1619 B25R4.63254 Cc1c(oc2c1cccc2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000077534 [0,1,0,0,0,1|2,0,0]=4 1620 B25R4.63254 Cc1c(sc2c1cccc2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000038699 [0,1,0,0,0,1|2,0,0]=4 1621 B25R4.63254 Cc1c(sc2c1cccc2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000038699 [0,1,0,0,0,1|2,0,0]=4 1622 B25R4.63254 Clc1c([nH]c2c1cccc2)CNC3CCCc4c3ccnc4 270004a_100020634316_100000050720 [0,1,0,0,0,1|2,0,0]=4 1623 B25R4.63254 Clc1c([nH]c2c1cccc2)CNC3CCCc4c3nccc4 270004a_100011259139_100000050720 [0,1,0,0,0,1|2,0,0]=4 1624 B25R4.63254 Clc1c([nH]c2c1cccc2)CNC3CCOc4c3cccc4 270004a_100015190321_100000050720 [0,1,0,0,0,1|2,0,0]=4 1625 B25R4.63254 Clc1c([nH]c2c1cccc2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000050720 [0,1,0,0,0,1|1,0,0]=3 1626 B25R4.63254 Clc1c(sc2c1cccc2)CNC3CCCc4c3cccc4 269862a_200015185765_100000210882 [0,1,0,0,0,1|2,0,0]=4 1627 B25R4.63254 Clc1c(sc2c1cccc2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000017830 [0,1,0,0,0,1|2,0,0]=4 1628 B25R4.63254 Clc1c(sc2c1cccc2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000017830 [0,1,0,0,0,1|2,0,0]=4 1629 B25R4.63254 Clc1c(sc2c1cccc2)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000021718 [0,1,0,0,0,1|2,0,0]=4 1630 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCCc4c3cccc4 269862a_100011934526_100000210882 [0,1,0,0,0,1|1,0,0]=3 1631 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCCc4c3cccn4 269862a_100011934526_100000058033 [0,1,0,0,0,1|2,0,0]=4 1632 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCCc4c3ccnc4 269862a_100011934526_100000087567 [0,1,0,0,0,1|2,0,0]=4 1633 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCCc4c3ccnc4 270004a_100020634316_100000033373 [0,1,0,0,0,1|2,0,0]=4 1634 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCCc4c3cncc4 269862a_100011934526_100016991936 [0,1,0,0,0,1|2,0,0]=4 1635 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCCc4c3nccc4 269862a_100011934526_100000067617 [0,1,0,0,0,1|2,0,0]=4 1636 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCCc4c3nccc4 270004a_100011259139_100000033373 [0,1,0,0,0,1|2,0,0]=4 1637 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCOc4c3cccc4 270004a_100015190321_100000033373 [0,1,0,0,0,1|2,0,0]=4 1638 B25R4.63254 Cn1c(cc2c1cccc2)CNC3CCSc4c3cccc4 269862a_100011934526_100000183853 [0,1,0,0,0,1|2,0,0]=4 1639 B25R4.63254 Cn1c(cc2c1cccc2)CNC3COCc4c3cccc4 269862a_100011934526_100000117393 [0,1,0,0,0,1|2,0,0]=4 1640 B25R4.63254 Cn1c(cc2c1cccc2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000033373 [0,1,0,0,0,1|1,0,0]=3 1641 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3cccc4 269862a_100000700934_100000210882 [0,1,0,0,0,1|0,0,0]=2 1642 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3cccn4 269862a_100000700934_100000058033 [0,1,0,0,0,1|1,0,0]=3 1643 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3ccnc4 207a_100020634316_100000188960 [0,1,0,0,0,1|1,0,0]=3 1644 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3ccnc4 2230a_100020634316_100000748711 [0,1,0,0,0,1|1,0,0]=3 1645 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3ccnc4 269862a_100000700934_100000087567 [0,1,0,0,0,1|1,0,0]=3 1646 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3ccnc4 270004a_100020634316_100000188960 [0,1,0,0,0,1|1,0,0]=3 1647 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3cncc4 269862a_100000700934_100016991936 [0,1,0,0,0,1|1,0,0]=3 1648 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3nccc4 207a_100011259139_100000188960 [0,1,0,0,0,1|1,0,0]=3 1649 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3nccc4 2230a_100011259139_100000748711 [0,1,0,0,0,1|1,0,0]=3 1650 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3nccc4 269862a_100000700934_100000067617 [0,1,0,0,0,1|1,0,0]=3 1651 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCCc4c3nccc4 270004a_100011259139_100000188960 [0,1,0,0,0,1|1,0,0]=3 1652 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCOc4c3cccc4 207a_100015190321_100000188960 [0,1,0,0,0,1|1,0,0]=3 1653 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCOc4c3cccc4 2230a_100015190321_100000748711 [0,1,0,0,0,1|1,0,0]=3 1654 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCOc4c3cccc4 270004a_100015190321_100000188960 [0,1,0,0,0,1|1,0,0]=3 1655 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCOc4c3nccc4 207a_100009852857_100000188960 [0,1,0,0,0,1|2,0,0]=4 1656 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCOc4c3nccc4 2230a_100009852857_100000748711 [0,1,0,0,0,1|2,0,0]=4 1657 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCOc4c3nccc4 270004a_100009852857_100000188960 [0,1,0,0,0,1|2,0,0]=4 1658 B25R4.63254 Cn1c(nc2c1cccc2)CNC3CCSc4c3cccc4 269862a_100000700934_100000183853 [0,1,0,0,0,1|1,0,0]=3 1659 B25R4.63254 Cn1c(nc2c1cccc2)CNC3COCc4c3cccc4 269862a_100000700934_100000117393 [0,1,0,0,0,1|1,0,0]=3 1660 B25R4.63254 Cn1c(nc2c1cccc2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000188960 [0,1,0,0,0,1|0,0,0]=2 1661 B25R4.63254 Cn1c(nc2c1cccc2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000188960 [0,1,0,0,0,1|0,0,0]=2 1662 B25R4.63254 Cn1c(nc2c1cccc2)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000748711 [0,1,0,0,0,1|0,0,0]=2 1663 B25R4.63254 Cn1c(nc2c1cccc2)COC3CCCc4c3cccc4 34a_100000183665_100000748711 [0,1,0,0,0,1|1,0,0]=3 1664 B25R4.63254 Cn1c(nc2c1cccc2)COC3CCCc4c3cccc4 7a_100000183665_100000748711 [0,1,0,0,0,1|1,0,0]=3 1665 B25R4.63254 Cn1c(nc2c1cccc2)COC3CCOc4c3cccc4 7a_100000708930_100000748711 [0,1,0,0,0,1|2,0,0]=4 1666 B25R4.63254 Cn1c(nc2c1cccc2)COC3COCc4c3cccc4 34a_100012179175_100000748711 [0,1,0,0,0,1|2,0,0]=4 1667 B25R4.63254 Cn1c(nc2c1cccc2)NCC3OCCc4c3cccc4 27a_100000755408_200000239431 [0,1,0,0,0,1|1,0,0]=3 1668 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CCCc4c3cccc4 4a_100000738164_100000210882 [0,1,0,0,0,1|0,0,1]=3 1669 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CCCc4c3cccn4 4a_100000738164_100000058033 [0,1,0,0,0,1|1,0,1]=4 1670 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CCCc4c3ccnc4 4a_100000738164_100000087567 [0,1,0,0,0,1|1,0,1]=4 1671 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CCCc4c3cncc4 4a_100000738164_100016991936 [0,1,0,0,0,1|1,0,1]=4 1672 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CCCc4c3nccc4 4a_100000738164_100000067617 [0,1,0,0,0,1|1,0,1]=4 1673 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CCNc4c3cccc4 4a_100000738164_100000691674 [0,1,0,0,0,1|1,0,1]=4 1674 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CCOc4c3cccc4 4a_100000738164_100000195411 [0,1,0,0,0,1|1,0,1]=4 1675 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CCSc4c3cccc4 4a_100000738164_100000183853 [0,1,0,0,0,1|1,0,1]=4 1676 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3COCc4c3cccc4 4a_100000738164_100000117393 [0,1,0,0,0,1|1,0,1]=4 1677 B25R4.63254 Cn1c(nc2c1cccc2)NN=C3CSCc4c3cccc4 4a_100000738164_100000740248 [0,1,0,0,0,1|1,0,1]=4 1678 B25R4.2368398 Brc1ccc2c(c1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000688402 [0,1,0,0,0,1|0,0,1]=3 1679 B25R4.2368398 Brc1ccc2c(c1)CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000688402 [0,1,0,0,0,1|1,0,1]=4 1680 B25R4.2368398 Brc1ccc2c(c1)CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000688402 [0,1,0,0,0,1|1,0,1]=4 1681 B25R4.2368398 Brc1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000688402 [0,1,0,0,0,1|2,0,0]=4 1682 B25R4.2368398 Brc1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000688402 [0,1,0,0,0,1|2,0,0]=4 1683 B25R4.2368398 Brc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000688402 [0,1,0,0,0,1|2,0,0]=4 1684 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4[nH]3 270004a_100160469487_100000051030 [0,1,0,0,0,1|1,0,0]=3 1685 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4o3 207a_100160469487_100000229944 [0,1,0,0,0,1|2,0,0]=4 1686 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4o3 270004a_100160469487_100000229944 [0,1,0,0,0,1|2,0,0]=4 1687 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4s3 207a_100160469487_100000686906 [0,1,0,0,0,1|2,0,0]=4 1688 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4s3 270004a_100160469487_100000686906 [0,1,0,0,0,1|2,0,0]=4 1689 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cc4cccnc4[nH]3 207a_100160469487_100000088027 [0,1,0,0,0,1|2,0,0]=4 1690 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cc4cccnc4[nH]3 270004a_100160469487_100000088027 [0,1,0,0,0,1|2,0,0]=4 1691 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cc4ccncc4[nH]3 270004a_100160469487_200000084276 [0,1,0,0,0,1|2,0,0]=4 1692 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cn4ccccc4n3 207a_100160469487_100000743146 [0,1,0,0,0,1|2,0,0]=4 1693 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cn4ccccc4n3 2230a_100160469487_100000689847 [0,1,0,0,0,1|2,0,0]=4 1694 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3cn4ccccc4n3 34a_100160469487_100000689847 [0,1,0,0,0,1|2,0,0]=4 1695 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4[nH]3 207a_100160469487_100000185668 [0,1,0,0,0,1|0,0,0]=2 1696 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4[nH]3 2230a_100160469487_100000737899 [0,1,0,0,0,1|0,0,0]=2 1697 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4[nH]3 270004a_100160469487_100000185668 [0,1,0,0,0,1|0,0,0]=2 1698 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4o3 2230a_100160469487_100000195508 [0,1,0,0,0,1|1,0,0]=3 1699 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4o3 34a_100160469487_200012361514 [0,1,0,0,0,1|1,0,0]=3 1700 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4s3 2230a_100160469487_100000766747 [0,1,0,0,0,1|1,0,0]=3 1701 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4s3 270004a_100160469487_100011204187 [0,1,0,0,0,1|1,0,0]=3 1702 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ccccc4s3 34a_100160469487_100011217541 [0,1,0,0,0,1|1,0,0]=3 1703 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4cccnc4[nH]3 2230a_100160469487_100011549802 [0,1,0,0,0,1|1,0,0]=3 1704 B25R4.2368398 Brc1ccc2c(c1)CCC[C@@H]2NCc3nc4ncccc4o3 2230a_100160469487_100000696355 [0,1,0,0,0,1|2,0,0]=4 1705 B25R4.2368398 Brc1ccc2c(c1)NCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100010157303 [0,1,0,0,0,1|1,0,1]=4 1706 B25R4.2368398 Brc1ccc2c(c1)OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000696939 [0,1,0,0,0,1|1,0,1]=4 1707 B25R4.2368398 Brc1ccc2c(c1)OCCC2OCc3nc4ccccc4[nH]3 7a_100012676011_100000737899 [0,1,0,0,0,1|2,0,0]=4 1708 B25R4.2368398 Brc1ccc2c(c1)OCC[C@H]2NCc3cc4ccccc4[nH]3 270004a_100020639266_100000051030 [0,1,0,0,0,1|2,0,0]=4 1709 B25R4.2368398 Brc1ccc2c(c1)OCC[C@H]2NCc3nc4ccccc4[nH]3 207a_100020639266_100000185668 [0,1,0,0,0,1|1,0,0]=3 1710 B25R4.2368398 Brc1ccc2c(c1)OCC[C@H]2NCc3nc4ccccc4[nH]3 2230a_100020639266_100000737899 [0,1,0,0,0,1|1,0,0]=3 1711 B25R4.2368398 Brc1ccc2c(c1)OCC[C@H]2NCc3nc4ccccc4[nH]3 270004a_100020639266_100000185668 [0,1,0,0,0,1|1,0,0]=3 1712 B25R4.2368398 Brc1ccc2c(c1)OCC[C@H]2NCc3nc4ccccc4o3 2230a_100020639266_100000195508 [0,1,0,0,0,1|2,0,0]=4 1713 B25R4.2368398 Brc1ccc2c(c1)OCC[C@H]2NCc3nc4ccccc4s3 2230a_100020639266_100000766747 [0,1,0,0,0,1|2,0,0]=4 1714 B25R4.2368398 Brc1ccc2c(c1)OCC[C@H]2NCc3nc4ccccc4s3 270004a_100020639266_100011204187 [0,1,0,0,0,1|2,0,0]=4 1715 B25R4.2368398 Brc1ccc2c(c1)OCC[C@H]2NCc3nc4cccnc4[nH]3 2230a_100020639266_100011549802 [0,1,0,0,0,1|2,0,0]=4 1716 B25R4.2368398 Brc1ccc2c(c1)SCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100010688399 [0,1,0,0,0,1|1,0,1]=4 1717 B25R4.2368398 Cc1ccc2c(c1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000074264 [0,1,0,0,0,1|0,0,1]=3 1718 B25R4.2368398 Cc1ccc2c(c1)CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000074264 [0,1,0,0,0,1|1,0,1]=4 1719 B25R4.2368398 Cc1ccc2c(c1)CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000074264 [0,1,0,0,0,1|1,0,1]=4 1720 B25R4.2368398 Cc1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000074264 [0,1,0,0,0,1|2,0,0]=4 1721 B25R4.2368398 Cc1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000074264 [0,1,0,0,0,1|2,0,0]=4 1722 B25R4.2368398 Cc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000074264 [0,1,0,0,0,1|2,0,0]=4 1723 B25R4.2368398 Cc1ccc2c(c1)OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100011219134 [0,1,0,0,0,1|1,0,1]=4 1724 B25R4.2368398 Clc1ccc2c(c1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000081257 [0,1,0,0,0,1|0,0,1]=3 1725 B25R4.2368398 Clc1ccc2c(c1)CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000081257 [0,1,0,0,0,1|1,0,1]=4 1726 B25R4.2368398 Clc1ccc2c(c1)CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000081257 [0,1,0,0,0,1|1,0,1]=4 1727 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4ccccc4[nH]3 270004a_100025717365_100000051030 [0,1,0,0,0,1|1,0,0]=3 1728 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 207a_100025717365_100000229944 [0,1,0,0,0,1|2,0,0]=4 1729 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000081257 [0,1,0,0,0,1|2,0,0]=4 1730 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 270004a_100025717365_100000229944 [0,1,0,0,0,1|2,0,0]=4 1731 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 207a_100025717365_100000686906 [0,1,0,0,0,1|2,0,0]=4 1732 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000081257 [0,1,0,0,0,1|2,0,0]=4 1733 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 270004a_100025717365_100000686906 [0,1,0,0,0,1|2,0,0]=4 1734 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4cccnc4[nH]3 207a_100025717365_100000088027 [0,1,0,0,0,1|2,0,0]=4 1735 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4cccnc4[nH]3 270004a_100025717365_100000088027 [0,1,0,0,0,1|2,0,0]=4 1736 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cc4ccncc4[nH]3 270004a_100025717365_200000084276 [0,1,0,0,0,1|2,0,0]=4 1737 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 207a_100025717365_100000743146 [0,1,0,0,0,1|2,0,0]=4 1738 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 2230a_100025717365_100000689847 [0,1,0,0,0,1|2,0,0]=4 1739 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000081257 [0,1,0,0,0,1|2,0,0]=4 1740 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 34a_100025717365_100000689847 [0,1,0,0,0,1|2,0,0]=4 1741 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 207a_100025717365_100000185668 [0,1,0,0,0,1|0,0,0]=2 1742 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 2230a_100025717365_100000737899 [0,1,0,0,0,1|0,0,0]=2 1743 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 270004a_100025717365_100000185668 [0,1,0,0,0,1|0,0,0]=2 1744 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ccccc4o3 2230a_100025717365_100000195508 [0,1,0,0,0,1|1,0,0]=3 1745 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ccccc4o3 34a_100025717365_200012361514 [0,1,0,0,0,1|1,0,0]=3 1746 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ccccc4s3 2230a_100025717365_100000766747 [0,1,0,0,0,1|1,0,0]=3 1747 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ccccc4s3 270004a_100025717365_100011204187 [0,1,0,0,0,1|1,0,0]=3 1748 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ccccc4s3 34a_100025717365_100011217541 [0,1,0,0,0,1|1,0,0]=3 1749 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4cccnc4[nH]3 2230a_100025717365_100011549802 [0,1,0,0,0,1|1,0,0]=3 1750 B25R4.2368398 Clc1ccc2c(c1)CCCC2NCc3nc4ncccc4o3 2230a_100025717365_100000696355 [0,1,0,0,0,1|2,0,0]=4 1751 B25R4.2368398 Clc1ccc2c(c1)NCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000076634 [0,1,0,0,0,1|1,0,1]=4 1752 B25R4.2368398 Clc1ccc2c(c1)OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100012000073 [0,1,0,0,0,1|1,0,1]=4 1753 B25R4.2368398 Clc1ccc2c(n1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000089724 [0,1,0,0,0,1|1,0,1]=4 1754 B25R4.2368398 Fc1ccc2c(c1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000090879 [0,1,0,0,0,1|0,0,1]=3 1755 B25R4.2368398 Fc1ccc2c(c1)CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000090879 [0,1,0,0,0,1|1,0,1]=4 1756 B25R4.2368398 Fc1ccc2c(c1)CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000090879 [0,1,0,0,0,1|1,0,1]=4 1757 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4ccccc4[nH]3 270004a_100000695172_100000051030 [0,1,0,0,0,1|1,0,0]=3 1758 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 207a_100000695172_100000229944 [0,1,0,0,0,1|2,0,0]=4 1759 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000090879 [0,1,0,0,0,1|2,0,0]=4 1760 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 270004a_100000695172_100000229944 [0,1,0,0,0,1|2,0,0]=4 1761 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 207a_100000695172_100000686906 [0,1,0,0,0,1|2,0,0]=4 1762 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000090879 [0,1,0,0,0,1|2,0,0]=4 1763 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 270004a_100000695172_100000686906 [0,1,0,0,0,1|2,0,0]=4 1764 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4cccnc4[nH]3 207a_100000695172_100000088027 [0,1,0,0,0,1|2,0,0]=4 1765 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4cccnc4[nH]3 270004a_100000695172_100000088027 [0,1,0,0,0,1|2,0,0]=4 1766 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cc4ccncc4[nH]3 270004a_100000695172_200000084276 [0,1,0,0,0,1|2,0,0]=4 1767 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 207a_100000695172_100000743146 [0,1,0,0,0,1|2,0,0]=4 1768 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 2230a_100000695172_100000689847 [0,1,0,0,0,1|2,0,0]=4 1769 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000090879 [0,1,0,0,0,1|2,0,0]=4 1770 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 34a_100000695172_100000689847 [0,1,0,0,0,1|2,0,0]=4 1771 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 207a_100000695172_100000185668 [0,1,0,0,0,1|0,0,0]=2 1772 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 2230a_100000695172_100000737899 [0,1,0,0,0,1|0,0,0]=2 1773 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ccccc4[nH]3 270004a_100000695172_100000185668 [0,1,0,0,0,1|0,0,0]=2 1774 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ccccc4o3 2230a_100000695172_100000195508 [0,1,0,0,0,1|1,0,0]=3 1775 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ccccc4o3 34a_100000695172_200012361514 [0,1,0,0,0,1|1,0,0]=3 1776 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ccccc4s3 2230a_100000695172_100000766747 [0,1,0,0,0,1|1,0,0]=3 1777 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ccccc4s3 270004a_100000695172_100011204187 [0,1,0,0,0,1|1,0,0]=3 1778 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ccccc4s3 34a_100000695172_100011217541 [0,1,0,0,0,1|1,0,0]=3 1779 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4cccnc4[nH]3 2230a_100000695172_100011549802 [0,1,0,0,0,1|1,0,0]=3 1780 B25R4.2368398 Fc1ccc2c(c1)CCCC2NCc3nc4ncccc4o3 2230a_100000695172_100000696355 [0,1,0,0,0,1|2,0,0]=4 1781 B25R4.2368398 Fc1ccc2c(c1)OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000701688 [0,1,0,0,0,1|1,0,1]=4 1782 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3cc4ccccc4[nH]3 270004a_100015190460_100000051030 [0,1,0,0,0,1|2,0,0]=4 1783 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 207a_100015190460_100000185668 [0,1,0,0,0,1|1,0,0]=3 1784 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 2230a_100015190460_100000737899 [0,1,0,0,0,1|1,0,0]=3 1785 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4ccccc4[nH]3 270004a_100015190460_100000185668 [0,1,0,0,0,1|1,0,0]=3 1786 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4ccccc4o3 2230a_100015190460_100000195508 [0,1,0,0,0,1|2,0,0]=4 1787 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4ccccc4o3 34a_100015190460_200012361514 [0,1,0,0,0,1|2,0,0]=4 1788 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4ccccc4s3 2230a_100015190460_100000766747 [0,1,0,0,0,1|2,0,0]=4 1789 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4ccccc4s3 270004a_100015190460_100011204187 [0,1,0,0,0,1|2,0,0]=4 1790 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4ccccc4s3 34a_100015190460_100011217541 [0,1,0,0,0,1|2,0,0]=4 1791 B25R4.2368398 Fc1ccc2c(c1)OCCC2NCc3nc4cccnc4[nH]3 2230a_100015190460_100011549802 [0,1,0,0,0,1|2,0,0]=4 1792 B25R4.2368398 Ic1ccc2c(c1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000050035 [0,1,0,0,0,1|0,0,1]=3 1793 B25R4.2368398 Ic1ccc2c(c1)CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000050035 [0,1,0,0,0,1|1,0,1]=4 1794 B25R4.2368398 Ic1ccc2c(c1)CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000050035 [0,1,0,0,0,1|1,0,1]=4 1795 B25R4.2368398 Ic1ccc2c(c1)CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000050035 [0,1,0,0,0,1|2,0,0]=4 1796 B25R4.2368398 Ic1ccc2c(c1)CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000050035 [0,1,0,0,0,1|2,0,0]=4 1797 B25R4.2368398 Ic1ccc2c(c1)CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000050035 [0,1,0,0,0,1|2,0,0]=4 1798 B25R4.2368398 O=c1ccc2c([nH]1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000188899 [0,1,0,0,0,1|1,0,1]=4 1799 B25R4.2368398 Oc1ccc2c(c1)CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000746981 [0,1,0,0,0,1|0,0,1]=3 1800 B25R4.2368398 Oc1ccc2c(c1)CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000746981 [0,1,0,0,0,1|1,0,1]=4 1801 B25R4.2368398 Oc1ccc2c(c1)CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000746981 [0,1,0,0,0,1|1,0,1]=4 1802 B25R4.2368398 Oc1ccc2c(c1)OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000089553 [0,1,0,0,0,1|1,0,1]=4 1803 B25R4.4040990 Brc1cccc2c1CC(=NNC3CCCc4c3cccc4)C2 4a_100159326319_100010205903 [0,1,0,0,0,1|2,0,0]=4 1804 B25R4.4040990 Brc1cccc2c1cc([nH]2)CNC3CCCc4c3ccnc4 270004a_100020634316_200010333833 [0,1,0,0,0,1|2,0,0]=4 1805 B25R4.4040990 Brc1cccc2c1cc([nH]2)CNC3CCCc4c3nccc4 270004a_100011259139_200010333833 [0,1,0,0,0,1|2,0,0]=4 1806 B25R4.4040990 Brc1cccc2c1cc([nH]2)CNC3CCOc4c3cccc4 270004a_100015190321_200010333833 [0,1,0,0,0,1|2,0,0]=4 1807 B25R4.4040990 Brc1cccc2c1cc([nH]2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_200010333833 [0,1,0,0,0,1|1,0,0]=3 1808 B25R4.4040990 Brc1cccc2c1cc(s2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100010109917 [0,1,0,0,0,1|2,0,0]=4 1809 B25R4.4040990 Brc1cccc2c1cc(s2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100010109917 [0,1,0,0,0,1|2,0,0]=4 1810 B25R4.4040990 Brc1cccc2c1nc(s2)NN=C3CCCc4c3cccc4 4a_100009820880_100000210882 [0,1,0,0,0,1|1,0,1]=4 1811 B25R4.4040990 Brc1cccc2c1sc(c2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100010110135 [0,1,0,0,0,1|2,0,0]=4 1812 B25R4.4040990 Brc1cccc2c1sc(c2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100010110135 [0,1,0,0,0,1|2,0,0]=4 1813 B25R4.4040990 Brc1cccn2c1nc(c2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100012360382 [0,1,0,0,0,1|2,0,0]=4 1814 B25R4.4040990 Cc1cccc2c1CC(=NNC3CCCc4c3cccc4)C2 4a_100159326319_100010637320 [0,1,0,0,0,1|2,0,0]=4 1815 B25R4.4040990 Cc1cccc2c1nc(o2)CNC3CCCc4c3ccnc4 2230a_100020634316_100011397728 [0,1,0,0,0,1|2,0,0]=4 1816 B25R4.4040990 Cc1cccc2c1nc(o2)CNC3CCCc4c3nccc4 2230a_100011259139_100011397728 [0,1,0,0,0,1|2,0,0]=4 1817 B25R4.4040990 Cc1cccc2c1nc(o2)CNC3CCOc4c3cccc4 2230a_100015190321_100011397728 [0,1,0,0,0,1|2,0,0]=4 1818 B25R4.4040990 Cc1cccc2c1nc(o2)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100011397728 [0,1,0,0,0,1|1,0,0]=3 1819 B25R4.4040990 Cc1cccc2c1nc(o2)COC3CCCc4c3cccc4 34a_100000183665_100011397728 [0,1,0,0,0,1|2,0,0]=4 1820 B25R4.4040990 Cc1cccc2c1nc(o2)COC3CCCc4c3cccc4 7a_100000183665_100011397728 [0,1,0,0,0,1|2,0,0]=4 1821 B25R4.4040990 Cc1cccc2c1nc(s2)NCC3OCCc4c3cccc4 27a_100000755408_100010008827 [0,1,0,0,0,1|2,0,0]=4 1822 B25R4.4040990 Cc1cccc2c1nc(s2)NN=C3CCCc4c3cccc4 4a_100000081539_100000210882 [0,1,0,0,0,1|1,0,1]=4 1823 B25R4.4040990 Cc1cccn2c1nc(c2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100011997822 [0,1,0,0,0,1|2,0,0]=4 1824 B25R4.4040990 Cc1cccn2c1nc(c2)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000017237 [0,1,0,0,0,1|2,0,0]=4 1825 B25R4.4040990 Cc1ccnc2c1nc([nH]2)CNC3CCCc4c3ccnc4 2230a_100020634316_200000699823 [0,1,0,0,0,1|2,0,0]=4 1826 B25R4.4040990 Cc1ccnc2c1nc([nH]2)CNC3CCCc4c3nccc4 2230a_100011259139_200000699823 [0,1,0,0,0,1|2,0,0]=4 1827 B25R4.4040990 Cc1ccnc2c1nc([nH]2)CNC3CCOc4c3cccc4 2230a_100015190321_200000699823 [0,1,0,0,0,1|2,0,0]=4 1828 B25R4.4040990 Cc1ccnc2c1nc([nH]2)CN[C@H]3CCCc4c3cccc4 34a_100020654734_200000699823 [0,1,0,0,0,1|1,0,0]=3 1829 B25R4.4040990 Cc1ccnc2c1nc([nH]2)COC3CCCc4c3cccc4 34a_100000183665_200000699823 [0,1,0,0,0,1|2,0,0]=4 1830 B25R4.4040990 Cc1ccnc2c1nc([nH]2)COC3CCCc4c3cccc4 7a_100000183665_200000699823 [0,1,0,0,0,1|2,0,0]=4 1831 B25R4.4040990 Clc1cccc2c1cc(s2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000117544 [0,1,0,0,0,1|2,0,0]=4 1832 B25R4.4040990 Clc1cccc2c1cc(s2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000117544 [0,1,0,0,0,1|2,0,0]=4 1833 B25R4.4040990 Clc1cccn2c1nc(c2)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100011361495 [0,1,0,0,0,1|2,0,0]=4 1834 B25R4.4040990 Clc1cccn2c1nc(c2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100011361495 [0,1,0,0,0,1|2,0,0]=4 1835 B25R4.4040990 Fc1cccc2c1nc(s2)NCC3OCCc4c3cccc4 27a_100000755408_100010008856 [0,1,0,0,0,1|2,0,0]=4 1836 B25R4.4707046 CC1CCc2ccccc2C1=NNc3nc4ccccc4[nH]3 4a_100000188875_100000696181 [0,1,0,0,0,1|0,0,1]=3 1837 B25R4.4707046 CC1CCc2ccccc2C1=NNc3nc4ccccc4o3 4a_100000182307_100000696181 [0,1,0,0,0,1|1,0,1]=4 1838 B25R4.4707046 CC1CCc2ccccc2C1=NNc3nc4ccccc4s3 4a_100000181811_100000696181 [0,1,0,0,0,1|1,0,1]=4 1839 B25R4.4707046 CC1CCc2ccccc2C1NCc3cc4ccccc4o3 269862a_100011220112_100000696181 [0,1,0,0,0,1|2,0,0]=4 1840 B25R4.4707046 CC1CCc2ccccc2C1NCc3cc4ccccc4s3 269862a_100015187092_100000696181 [0,1,0,0,0,1|2,0,0]=4 1841 B25R4.4707046 CC1CCc2ccccc2C1NCc3cn4ccccc4n3 269862a_100000195574_100000696181 [0,1,0,0,0,1|2,0,0]=4 1842 B25R4.4917548 CN(Cc1cc2ccccc2[nH]1)C3CCCc4c3cccc4 270004a_100000185324_100000051030 [0,1,0,0,0,1|1,0,0]=3 1843 B25R4.4917548 CN(Cc1cc2ccccc2o1)C3CCCc4c3cccc4 270004a_100000185324_100000229944 [0,1,0,0,0,1|2,0,0]=4 1844 B25R4.4917548 CN(Cc1cc2ccccc2s1)C3CCCc4c3cccc4 270004a_100000185324_100000686906 [0,1,0,0,0,1|2,0,0]=4 1845 B25R4.4917548 CN(Cc1cc2cccnc2[nH]1)C3CCCc4c3cccc4 270004a_100000185324_100000088027 [0,1,0,0,0,1|2,0,0]=4 1846 B25R4.4917548 CN(Cc1cc2ccncc2[nH]1)C3CCCc4c3cccc4 270004a_100000185324_200000084276 [0,1,0,0,0,1|2,0,0]=4 1847 B25R4.4917548 CN(Cc1cn2ccccc2n1)C3CCCc4c3cccc4 2230a_100000185324_100000689847 [0,1,0,0,0,1|2,0,0]=4 1848 B25R4.4917548 CN(Cc1cn2ccccc2n1)C3CCCc4c3cccc4 269982a_100000185324_100000689847 [0,1,0,0,0,1|2,0,0]=4 1849 B25R4.4917548 CN(Cc1cn2ccccc2n1)C3CCCc4c3cccc4 34a_100000185324_100000689847 [0,1,0,0,0,1|2,0,0]=4 1850 B25R4.4917548 CN(Cc1nc2ccccc2[nH]1)C3CCCc4c3cccc4 2230a_100000185324_100000737899 [0,1,0,0,0,1|0,0,0]=2 1851 B25R4.4917548 CN(Cc1nc2ccccc2[nH]1)C3CCCc4c3cccc4 269982a_100000185324_100000737899 [0,1,0,0,0,1|0,0,0]=2 1852 B25R4.4917548 CN(Cc1nc2ccccc2[nH]1)C3CCCc4c3cccc4 270004a_100000185324_100000185668 [0,1,0,0,0,1|0,0,0]=2 1853 B25R4.4917548 CN(Cc1nc2ccccc2o1)C3CCCc4c3cccc4 2230a_100000185324_100000195508 [0,1,0,0,0,1|1,0,0]=3 1854 B25R4.4917548 CN(Cc1nc2ccccc2o1)C3CCCc4c3cccc4 34a_100000185324_200012361514 [0,1,0,0,0,1|1,0,0]=3 1855 B25R4.4917548 CN(Cc1nc2ccccc2s1)C3CCCc4c3cccc4 2230a_100000185324_100000766747 [0,1,0,0,0,1|1,0,0]=3 1856 B25R4.4917548 CN(Cc1nc2ccccc2s1)C3CCCc4c3cccc4 269982a_100000185324_100011217541 [0,1,0,0,0,1|1,0,0]=3 1857 B25R4.4917548 CN(Cc1nc2ccccc2s1)C3CCCc4c3cccc4 270004a_100000185324_100011204187 [0,1,0,0,0,1|1,0,0]=3 1858 B25R4.4917548 CN(Cc1nc2ccccc2s1)C3CCCc4c3cccc4 34a_100000185324_100011217541 [0,1,0,0,0,1|1,0,0]=3 1859 B25R4.4917548 CN(Cc1nc2cccnc2[nH]1)C3CCCc4c3cccc4 2230a_100000185324_100011549802 [0,1,0,0,0,1|1,0,0]=3 1860 B25R4.4917548 CN(Cc1nc2ncccc2o1)C3CCCc4c3cccc4 2230a_100000185324_100000696355 [0,1,0,0,0,1|2,0,0]=4 1861 B25R4.4917548 O=C(Cc1nc2ccccc2[nH]1)C3CCCc4c3cccc4 1458a_100011198263_100000737899 [0,1,0,0,0,1|1,0,0]=3 1862 B25R4.4917548 O=C(Cc1nc2ccccc2[nH]1)C3OCCc4c3cccc4 1458a_100000026751_100000737899 [0,1,0,0,0,1|2,0,0]=4 1863 B25R4.4917548 O=C(Cc1nc2ccccc2o1)C3CCCc4c3cccc4 1458a_100011198263_100000195508 [0,1,0,0,0,1|2,0,0]=4 1864 B25R4.4917548 O=C(Cc1nc2ccccc2s1)C3CCCc4c3cccc4 1458a_100011198263_100011217541 [0,1,0,0,0,1|2,0,0]=4 1865 B25R4.4917548 O=C(Cc1nc2cccnc2[nH]1)C3CCCc4c3cccc4 1458a_100011198263_100011549802 [0,1,0,0,0,1|2,0,0]=4 1866 B25R4.18943647 Brc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000760428 [0,1,0,0,0,1|0,0,1]=3 1867 B25R4.18943647 Brc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCN2 4a_100000188875_100000697366 [0,1,0,0,0,1|1,0,1]=4 1868 B25R4.18943647 Brc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100000243215 [0,1,0,0,0,1|1,0,1]=4 1869 B25R4.18943647 Brc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCS2 4a_100000188875_100000744447 [0,1,0,0,0,1|1,0,1]=4 1870 B25R4.18943647 Brc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)COC2 4a_100000188875_100010205901 [0,1,0,0,0,1|1,0,1]=4 1871 B25R4.18943647 Brc1ccc2c(c1)C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000760428 [0,1,0,0,0,1|1,0,1]=4 1872 B25R4.18943647 Brc1ccc2c(c1)C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000760428 [0,1,0,0,0,1|1,0,1]=4 1873 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4[nH]3 270004a_100011742594_100000051030 [0,1,0,0,0,1|1,0,0]=3 1874 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 207a_100011742594_100000229944 [0,1,0,0,0,1|2,0,0]=4 1875 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 269862a_100011220112_100000760428 [0,1,0,0,0,1|2,0,0]=4 1876 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 270004a_100011742594_100000229944 [0,1,0,0,0,1|2,0,0]=4 1877 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 207a_100011742594_100000686906 [0,1,0,0,0,1|2,0,0]=4 1878 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 269862a_100015187092_100000760428 [0,1,0,0,0,1|2,0,0]=4 1879 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 270004a_100011742594_100000686906 [0,1,0,0,0,1|2,0,0]=4 1880 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4cccnc4[nH]3 207a_100011742594_100000088027 [0,1,0,0,0,1|2,0,0]=4 1881 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4cccnc4[nH]3 270004a_100011742594_100000088027 [0,1,0,0,0,1|2,0,0]=4 1882 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cc4ccncc4[nH]3 270004a_100011742594_200000084276 [0,1,0,0,0,1|2,0,0]=4 1883 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 207a_100011742594_100000743146 [0,1,0,0,0,1|2,0,0]=4 1884 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 2230a_100011742594_100000689847 [0,1,0,0,0,1|2,0,0]=4 1885 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 269862a_100000195574_100000760428 [0,1,0,0,0,1|2,0,0]=4 1886 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 34a_100011742594_100000689847 [0,1,0,0,0,1|2,0,0]=4 1887 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4[nH]3 207a_100011742594_100000185668 [0,1,0,0,0,1|0,0,0]=2 1888 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4[nH]3 2230a_100011742594_100000737899 [0,1,0,0,0,1|0,0,0]=2 1889 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4[nH]3 270004a_100011742594_100000185668 [0,1,0,0,0,1|0,0,0]=2 1890 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4o3 2230a_100011742594_100000195508 [0,1,0,0,0,1|1,0,0]=3 1891 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4o3 34a_100011742594_200012361514 [0,1,0,0,0,1|1,0,0]=3 1892 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4s3 2230a_100011742594_100000766747 [0,1,0,0,0,1|1,0,0]=3 1893 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4s3 270004a_100011742594_100011204187 [0,1,0,0,0,1|1,0,0]=3 1894 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4s3 34a_100011742594_100011217541 [0,1,0,0,0,1|1,0,0]=3 1895 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4cccnc4[nH]3 2230a_100011742594_100011549802 [0,1,0,0,0,1|1,0,0]=3 1896 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)NCc3nc4ncccc4o3 2230a_100011742594_100000696355 [0,1,0,0,0,1|2,0,0]=4 1897 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)OCc3nc4ccccc4[nH]3 7a_100011660633_100000737899 [0,1,0,0,0,1|1,0,0]=3 1898 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)OCc3nc4ccccc4o3 34a_100011660633_200012361514 [0,1,0,0,0,1|2,0,0]=4 1899 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)OCc3nc4ccccc4o3 7a_100011660633_100000195508 [0,1,0,0,0,1|2,0,0]=4 1900 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)OCc3nc4ccccc4s3 34a_100011660633_100011217541 [0,1,0,0,0,1|2,0,0]=4 1901 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)OCc3nc4ccccc4s3 7a_100011660633_100011217541 [0,1,0,0,0,1|2,0,0]=4 1902 B25R4.18943647 Brc1ccc2c(c1)C(CCC2)OCc3nc4cccnc4[nH]3 7a_100011660633_100011549802 [0,1,0,0,0,1|2,0,0]=4 1903 B25R4.18943647 Brc1ccc2c(c1)C(CCO2)OCc3nc4ccccc4[nH]3 7a_100000760992_100000737899 [0,1,0,0,0,1|2,0,0]=4 1904 B25R4.18943647 Brc1ccc2c(c1)C(CCS2)NCc3cc4ccccc4[nH]3 270004a_100000744474_100000051030 [0,1,0,0,0,1|2,0,0]=4 1905 B25R4.18943647 Brc1ccc2c(c1)C(CCS2)NCc3nc4ccccc4[nH]3 207a_100000744474_100000185668 [0,1,0,0,0,1|1,0,0]=3 1906 B25R4.18943647 Brc1ccc2c(c1)C(CCS2)NCc3nc4ccccc4[nH]3 2230a_100000744474_100000737899 [0,1,0,0,0,1|1,0,0]=3 1907 B25R4.18943647 Brc1ccc2c(c1)C(CCS2)NCc3nc4ccccc4[nH]3 270004a_100000744474_100000185668 [0,1,0,0,0,1|1,0,0]=3 1908 B25R4.18943647 Brc1ccc2c(c1)C(CCS2)NCc3nc4ccccc4o3 2230a_100000744474_100000195508 [0,1,0,0,0,1|2,0,0]=4 1909 B25R4.18943647 Brc1ccc2c(c1)C(CCS2)NCc3nc4ccccc4s3 2230a_100000744474_100000766747 [0,1,0,0,0,1|2,0,0]=4 1910 B25R4.18943647 Brc1ccc2c(c1)C(CCS2)NCc3nc4ccccc4s3 270004a_100000744474_100011204187 [0,1,0,0,0,1|2,0,0]=4 1911 B25R4.18943647 Brc1ccc2c(c1)C(CCS2)NCc3nc4cccnc4[nH]3 2230a_100000744474_100011549802 [0,1,0,0,0,1|2,0,0]=4 1912 B25R4.18943647 Brc1ccc2c(c1)[C@H](CCO2)NCc3cc4ccccc4[nH]3 270004a_100020639276_100000051030 [0,1,0,0,0,1|2,0,0]=4 1913 B25R4.18943647 Brc1ccc2c(c1)[C@H](CCO2)NCc3nc4ccccc4[nH]3 207a_100020639276_100000185668 [0,1,0,0,0,1|1,0,0]=3 1914 B25R4.18943647 Brc1ccc2c(c1)[C@H](CCO2)NCc3nc4ccccc4[nH]3 2230a_100020639276_100000737899 [0,1,0,0,0,1|1,0,0]=3 1915 B25R4.18943647 Brc1ccc2c(c1)[C@H](CCO2)NCc3nc4ccccc4[nH]3 270004a_100020639276_100000185668 [0,1,0,0,0,1|1,0,0]=3 1916 B25R4.18943647 Brc1ccc2c(c1)[C@H](CCO2)NCc3nc4ccccc4o3 2230a_100020639276_100000195508 [0,1,0,0,0,1|2,0,0]=4 1917 B25R4.18943647 Brc1ccc2c(c1)[C@H](CCO2)NCc3nc4ccccc4s3 2230a_100020639276_100000766747 [0,1,0,0,0,1|2,0,0]=4 1918 B25R4.18943647 Brc1ccc2c(c1)[C@H](CCO2)NCc3nc4ccccc4s3 270004a_100020639276_100011204187 [0,1,0,0,0,1|2,0,0]=4 1919 B25R4.18943647 Brc1ccc2c(c1)[C@H](CCO2)NCc3nc4cccnc4[nH]3 2230a_100020639276_100011549802 [0,1,0,0,0,1|2,0,0]=4 1920 B25R4.18943647 Cc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000685544 [0,1,0,0,0,1|0,0,1]=3 1921 B25R4.18943647 Cc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCN2 4a_100000188875_100000076293 [0,1,0,0,0,1|1,0,1]=4 1922 B25R4.18943647 Cc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100011218626 [0,1,0,0,0,1|1,0,1]=4 1923 B25R4.18943647 Cc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCS2 4a_100000188875_100011247500 [0,1,0,0,0,1|1,0,1]=4 1924 B25R4.18943647 Cc1ccc2c(c1)C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000685544 [0,1,0,0,0,1|1,0,1]=4 1925 B25R4.18943647 Cc1ccc2c(c1)C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000685544 [0,1,0,0,0,1|1,0,1]=4 1926 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4[nH]3 270004a_100015204190_100000051030 [0,1,0,0,0,1|1,0,0]=3 1927 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 207a_100015204190_100000229944 [0,1,0,0,0,1|2,0,0]=4 1928 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 269862a_100011220112_100000685544 [0,1,0,0,0,1|2,0,0]=4 1929 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 270004a_100015204190_100000229944 [0,1,0,0,0,1|2,0,0]=4 1930 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 207a_100015204190_100000686906 [0,1,0,0,0,1|2,0,0]=4 1931 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 269862a_100015187092_100000685544 [0,1,0,0,0,1|2,0,0]=4 1932 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 270004a_100015204190_100000686906 [0,1,0,0,0,1|2,0,0]=4 1933 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4cccnc4[nH]3 207a_100015204190_100000088027 [0,1,0,0,0,1|2,0,0]=4 1934 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4cccnc4[nH]3 270004a_100015204190_100000088027 [0,1,0,0,0,1|2,0,0]=4 1935 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cc4ccncc4[nH]3 270004a_100015204190_200000084276 [0,1,0,0,0,1|2,0,0]=4 1936 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 207a_100015204190_100000743146 [0,1,0,0,0,1|2,0,0]=4 1937 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 2230a_100015204190_100000689847 [0,1,0,0,0,1|2,0,0]=4 1938 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 269862a_100000195574_100000685544 [0,1,0,0,0,1|2,0,0]=4 1939 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 34a_100015204190_100000689847 [0,1,0,0,0,1|2,0,0]=4 1940 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4[nH]3 207a_100015204190_100000185668 [0,1,0,0,0,1|0,0,0]=2 1941 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4[nH]3 2230a_100015204190_100000737899 [0,1,0,0,0,1|0,0,0]=2 1942 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4[nH]3 270004a_100015204190_100000185668 [0,1,0,0,0,1|0,0,0]=2 1943 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4o3 2230a_100015204190_100000195508 [0,1,0,0,0,1|1,0,0]=3 1944 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4o3 34a_100015204190_200012361514 [0,1,0,0,0,1|1,0,0]=3 1945 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4s3 2230a_100015204190_100000766747 [0,1,0,0,0,1|1,0,0]=3 1946 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4s3 270004a_100015204190_100011204187 [0,1,0,0,0,1|1,0,0]=3 1947 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ccccc4s3 34a_100015204190_100011217541 [0,1,0,0,0,1|1,0,0]=3 1948 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4cccnc4[nH]3 2230a_100015204190_100011549802 [0,1,0,0,0,1|1,0,0]=3 1949 B25R4.18943647 Cc1ccc2c(c1)C(CCC2)NCc3nc4ncccc4o3 2230a_100015204190_100000696355 [0,1,0,0,0,1|2,0,0]=4 1950 B25R4.18943647 Clc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000691401 [0,1,0,0,0,1|0,0,1]=3 1951 B25R4.18943647 Clc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCN2 4a_100000188875_100000094280 [0,1,0,0,0,1|1,0,1]=4 1952 B25R4.18943647 Clc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100011216342 [0,1,0,0,0,1|1,0,1]=4 1953 B25R4.18943647 Clc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCS2 4a_100000188875_100000230377 [0,1,0,0,0,1|1,0,1]=4 1954 B25R4.18943647 Clc1ccc2c(c1)C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000691401 [0,1,0,0,0,1|1,0,1]=4 1955 B25R4.18943647 Clc1ccc2c(c1)C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000691401 [0,1,0,0,0,1|1,0,1]=4 1956 B25R4.18943647 Clc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 269862a_100011220112_100000691401 [0,1,0,0,0,1|2,0,0]=4 1957 B25R4.18943647 Clc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 269862a_100015187092_100000691401 [0,1,0,0,0,1|2,0,0]=4 1958 B25R4.18943647 Clc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 269862a_100000195574_100000691401 [0,1,0,0,0,1|2,0,0]=4 1959 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3cc4ccccc4[nH]3 270004a_100011264799_100000051030 [0,1,0,0,0,1|2,0,0]=4 1960 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4[nH]3 207a_100011264799_100000185668 [0,1,0,0,0,1|1,0,0]=3 1961 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4[nH]3 2230a_100011264799_100000737899 [0,1,0,0,0,1|1,0,0]=3 1962 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4[nH]3 270004a_100011264799_100000185668 [0,1,0,0,0,1|1,0,0]=3 1963 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4o3 2230a_100011264799_100000195508 [0,1,0,0,0,1|2,0,0]=4 1964 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4o3 34a_100011264799_200012361514 [0,1,0,0,0,1|2,0,0]=4 1965 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4s3 2230a_100011264799_100000766747 [0,1,0,0,0,1|2,0,0]=4 1966 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4s3 270004a_100011264799_100011204187 [0,1,0,0,0,1|2,0,0]=4 1967 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4s3 34a_100011264799_100011217541 [0,1,0,0,0,1|2,0,0]=4 1968 B25R4.18943647 Clc1ccc2c(c1)C(CCO2)NCc3nc4cccnc4[nH]3 2230a_100011264799_100011549802 [0,1,0,0,0,1|2,0,0]=4 1969 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cc4ccccc4[nH]3 270004a_100011998213_100000051030 [0,1,0,0,0,1|1,0,0]=3 1970 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cc4ccccc4o3 207a_100011998213_100000229944 [0,1,0,0,0,1|2,0,0]=4 1971 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cc4ccccc4o3 270004a_100011998213_100000229944 [0,1,0,0,0,1|2,0,0]=4 1972 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cc4ccccc4s3 207a_100011998213_100000686906 [0,1,0,0,0,1|2,0,0]=4 1973 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cc4ccccc4s3 270004a_100011998213_100000686906 [0,1,0,0,0,1|2,0,0]=4 1974 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cc4cccnc4[nH]3 207a_100011998213_100000088027 [0,1,0,0,0,1|2,0,0]=4 1975 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cc4cccnc4[nH]3 270004a_100011998213_100000088027 [0,1,0,0,0,1|2,0,0]=4 1976 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cc4ccncc4[nH]3 270004a_100011998213_200000084276 [0,1,0,0,0,1|2,0,0]=4 1977 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cn4ccccc4n3 207a_100011998213_100000743146 [0,1,0,0,0,1|2,0,0]=4 1978 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cn4ccccc4n3 2230a_100011998213_100000689847 [0,1,0,0,0,1|2,0,0]=4 1979 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3cn4ccccc4n3 34a_100011998213_100000689847 [0,1,0,0,0,1|2,0,0]=4 1980 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ccccc4[nH]3 207a_100011998213_100000185668 [0,1,0,0,0,1|0,0,0]=2 1981 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ccccc4[nH]3 2230a_100011998213_100000737899 [0,1,0,0,0,1|0,0,0]=2 1982 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ccccc4[nH]3 270004a_100011998213_100000185668 [0,1,0,0,0,1|0,0,0]=2 1983 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ccccc4o3 2230a_100011998213_100000195508 [0,1,0,0,0,1|1,0,0]=3 1984 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ccccc4o3 34a_100011998213_200012361514 [0,1,0,0,0,1|1,0,0]=3 1985 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ccccc4s3 2230a_100011998213_100000766747 [0,1,0,0,0,1|1,0,0]=3 1986 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ccccc4s3 270004a_100011998213_100011204187 [0,1,0,0,0,1|1,0,0]=3 1987 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ccccc4s3 34a_100011998213_100011217541 [0,1,0,0,0,1|1,0,0]=3 1988 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4cccnc4[nH]3 2230a_100011998213_100011549802 [0,1,0,0,0,1|1,0,0]=3 1989 B25R4.18943647 Clc1ccc2c(c1)[C@H](CCC2)NCc3nc4ncccc4o3 2230a_100011998213_100000696355 [0,1,0,0,0,1|2,0,0]=4 1990 B25R4.18943647 Clc1ccc2c(n1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000693748 [0,1,0,0,0,1|1,0,1]=4 1991 B25R4.18943647 Clc1cnc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000062881 [0,1,0,0,0,1|1,0,1]=4 1992 B25R4.18943647 Fc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000691130 [0,1,0,0,0,1|0,0,1]=3 1993 B25R4.18943647 Fc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCN2 4a_100000188875_100000094279 [0,1,0,0,0,1|1,0,1]=4 1994 B25R4.18943647 Fc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100011218674 [0,1,0,0,0,1|1,0,1]=4 1995 B25R4.18943647 Fc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCS2 4a_100000188875_100000199066 [0,1,0,0,0,1|1,0,1]=4 1996 B25R4.18943647 Fc1ccc2c(c1)C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000691130 [0,1,0,0,0,1|1,0,1]=4 1997 B25R4.18943647 Fc1ccc2c(c1)C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000691130 [0,1,0,0,0,1|1,0,1]=4 1998 B25R4.18943647 Fc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 269862a_100011220112_100000691130 [0,1,0,0,0,1|2,0,0]=4 1999 B25R4.18943647 Fc1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 269862a_100015187092_100000691130 [0,1,0,0,0,1|2,0,0]=4 2000 B25R4.18943647 Fc1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 269862a_100000195574_100000691130 [0,1,0,0,0,1|2,0,0]=4 2001 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3cc4ccccc4[nH]3 270004a_100000754146_100000051030 [0,1,0,0,0,1|2,0,0]=4 2002 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4[nH]3 207a_100000754146_100000185668 [0,1,0,0,0,1|1,0,0]=3 2003 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4[nH]3 2230a_100000754146_100000737899 [0,1,0,0,0,1|1,0,0]=3 2004 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4[nH]3 270004a_100000754146_100000185668 [0,1,0,0,0,1|1,0,0]=3 2005 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4o3 2230a_100000754146_100000195508 [0,1,0,0,0,1|2,0,0]=4 2006 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4o3 34a_100000754146_200012361514 [0,1,0,0,0,1|2,0,0]=4 2007 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4s3 2230a_100000754146_100000766747 [0,1,0,0,0,1|2,0,0]=4 2008 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4s3 270004a_100000754146_100011204187 [0,1,0,0,0,1|2,0,0]=4 2009 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4ccccc4s3 34a_100000754146_100011217541 [0,1,0,0,0,1|2,0,0]=4 2010 B25R4.18943647 Fc1ccc2c(c1)C(CCO2)NCc3nc4cccnc4[nH]3 2230a_100000754146_100011549802 [0,1,0,0,0,1|2,0,0]=4 2011 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cc4ccccc4[nH]3 270004a_200000724602_100000051030 [0,1,0,0,0,1|1,0,0]=3 2012 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cc4ccccc4o3 207a_200000724602_100000229944 [0,1,0,0,0,1|2,0,0]=4 2013 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cc4ccccc4o3 270004a_200000724602_100000229944 [0,1,0,0,0,1|2,0,0]=4 2014 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cc4ccccc4s3 207a_200000724602_100000686906 [0,1,0,0,0,1|2,0,0]=4 2015 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cc4ccccc4s3 270004a_200000724602_100000686906 [0,1,0,0,0,1|2,0,0]=4 2016 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cc4cccnc4[nH]3 207a_200000724602_100000088027 [0,1,0,0,0,1|2,0,0]=4 2017 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cc4cccnc4[nH]3 270004a_200000724602_100000088027 [0,1,0,0,0,1|2,0,0]=4 2018 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cc4ccncc4[nH]3 270004a_200000724602_200000084276 [0,1,0,0,0,1|2,0,0]=4 2019 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cn4ccccc4n3 207a_200000724602_100000743146 [0,1,0,0,0,1|2,0,0]=4 2020 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cn4ccccc4n3 2230a_200000724602_100000689847 [0,1,0,0,0,1|2,0,0]=4 2021 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3cn4ccccc4n3 34a_200000724602_100000689847 [0,1,0,0,0,1|2,0,0]=4 2022 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ccccc4[nH]3 207a_200000724602_100000185668 [0,1,0,0,0,1|0,0,0]=2 2023 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ccccc4[nH]3 2230a_200000724602_100000737899 [0,1,0,0,0,1|0,0,0]=2 2024 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ccccc4[nH]3 270004a_200000724602_100000185668 [0,1,0,0,0,1|0,0,0]=2 2025 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ccccc4o3 2230a_200000724602_100000195508 [0,1,0,0,0,1|1,0,0]=3 2026 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ccccc4o3 34a_200000724602_200012361514 [0,1,0,0,0,1|1,0,0]=3 2027 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ccccc4s3 2230a_200000724602_100000766747 [0,1,0,0,0,1|1,0,0]=3 2028 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ccccc4s3 270004a_200000724602_100011204187 [0,1,0,0,0,1|1,0,0]=3 2029 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ccccc4s3 34a_200000724602_100011217541 [0,1,0,0,0,1|1,0,0]=3 2030 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4cccnc4[nH]3 2230a_200000724602_100011549802 [0,1,0,0,0,1|1,0,0]=3 2031 B25R4.18943647 Fc1ccc2c(c1)[C@@H](CCC2)NCc3nc4ncccc4o3 2230a_200000724602_100000696355 [0,1,0,0,0,1|2,0,0]=4 2032 B25R4.18943647 Ic1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000050175 [0,1,0,0,0,1|0,0,1]=3 2033 B25R4.18943647 Ic1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100011265717 [0,1,0,0,0,1|1,0,1]=4 2034 B25R4.18943647 Ic1ccc2c(c1)C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000050175 [0,1,0,0,0,1|1,0,1]=4 2035 B25R4.18943647 Ic1ccc2c(c1)C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000050175 [0,1,0,0,0,1|1,0,1]=4 2036 B25R4.18943647 Ic1ccc2c(c1)C(CCC2)NCc3cc4ccccc4o3 269862a_100011220112_100000050175 [0,1,0,0,0,1|2,0,0]=4 2037 B25R4.18943647 Ic1ccc2c(c1)C(CCC2)NCc3cc4ccccc4s3 269862a_100015187092_100000050175 [0,1,0,0,0,1|2,0,0]=4 2038 B25R4.18943647 Ic1ccc2c(c1)C(CCC2)NCc3cn4ccccc4n3 269862a_100000195574_100000050175 [0,1,0,0,0,1|2,0,0]=4 2039 B25R4.18943647 Nc1ccc2c(c1)C(CCC2)OCc3nc4ccccc4o3 34a_100009883350_200012361514 [0,1,0,0,0,1|2,0,0]=4 2040 B25R4.18943647 Nc1ccc2c(c1)C(CCC2)OCc3nc4ccccc4s3 34a_100009883350_100011217541 [0,1,0,0,0,1|2,0,0]=4 2041 B25R4.18943647 Oc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000723779 [0,1,0,0,0,1|0,0,1]=3 2042 B25R4.18943647 Oc1ccc2c(c1)C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100000078962 [0,1,0,0,0,1|1,0,1]=4 2043 B25R4.18943647 Oc1ccc2c(c1)C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000723779 [0,1,0,0,0,1|1,0,1]=4 2044 B25R4.18943647 Oc1ccc2c(c1)C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000723779 [0,1,0,0,0,1|1,0,1]=4 2045 B25R4.26276710 Brc1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100009820874 [0,1,0,0,0,1|2,0,0]=4 2046 B25R4.26276710 Brc1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100009820874 [0,1,0,0,0,1|2,0,0]=4 2047 B25R4.26276710 Brc1ccc2[nH]c(cc2c1)CNC3CCCc4c3nccc4 207a_100011259139_100009820874 [0,1,0,0,0,1|2,0,0]=4 2048 B25R4.26276710 Brc1ccc2[nH]c(cc2c1)CNC3CCCc4c3nccc4 270004a_100011259139_100009820874 [0,1,0,0,0,1|2,0,0]=4 2049 B25R4.26276710 Brc1ccc2[nH]c(cc2c1)CNC3CCOc4c3cccc4 207a_100015190321_100009820874 [0,1,0,0,0,1|2,0,0]=4 2050 B25R4.26276710 Brc1ccc2[nH]c(cc2c1)CNC3CCOc4c3cccc4 270004a_100015190321_100009820874 [0,1,0,0,0,1|2,0,0]=4 2051 B25R4.26276710 Brc1ccc2[nH]c(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100009820874 [0,1,0,0,0,1|1,0,0]=3 2052 B25R4.26276710 Brc1ccc2[nH]c(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100009820874 [0,1,0,0,0,1|1,0,0]=3 2053 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000701424 [0,1,0,0,0,1|1,0,0]=3 2054 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100000701424 [0,1,0,0,0,1|1,0,0]=3 2055 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100000701424 [0,1,0,0,0,1|1,0,0]=3 2056 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)CNC3CCOc4c3nccc4 2230a_100009852857_100000701424 [0,1,0,0,0,1|2,0,0]=4 2057 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000701424 [0,1,0,0,0,1|0,0,0]=2 2058 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)COC3CCCc4c3cccc4 34a_100000183665_100000701424 [0,1,0,0,0,1|1,0,0]=3 2059 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)COC3CCCc4c3cccc4 7a_100000183665_100000701424 [0,1,0,0,0,1|1,0,0]=3 2060 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)COC3CCOc4c3cccc4 7a_100000708930_100000701424 [0,1,0,0,0,1|2,0,0]=4 2061 B25R4.26276710 Brc1ccc2[nH]c(nc2c1)COC3COCc4c3cccc4 34a_100012179175_100000701424 [0,1,0,0,0,1|2,0,0]=4 2062 B25R4.26276710 Brc1ccc2c(c1)CC(=NNC3CCCc4c3cccc4)C2 4a_100159326319_100010185598 [0,1,0,0,0,1|2,0,0]=4 2063 B25R4.26276710 Brc1ccc2cc([nH]c2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000736022 [0,1,0,0,0,1|2,0,0]=4 2064 B25R4.26276710 Brc1ccc2cc([nH]c2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000736022 [0,1,0,0,0,1|2,0,0]=4 2065 B25R4.26276710 Brc1ccc2cc([nH]c2c1)CNC3CCCc4c3nccc4 207a_100011259139_100000736022 [0,1,0,0,0,1|2,0,0]=4 2066 B25R4.26276710 Brc1ccc2cc([nH]c2c1)CNC3CCCc4c3nccc4 270004a_100011259139_100000736022 [0,1,0,0,0,1|2,0,0]=4 2067 B25R4.26276710 Brc1ccc2cc([nH]c2c1)CNC3CCOc4c3cccc4 207a_100015190321_100000736022 [0,1,0,0,0,1|2,0,0]=4 2068 B25R4.26276710 Brc1ccc2cc([nH]c2c1)CNC3CCOc4c3cccc4 270004a_100015190321_100000736022 [0,1,0,0,0,1|2,0,0]=4 2069 B25R4.26276710 Brc1ccc2cc([nH]c2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000736022 [0,1,0,0,0,1|1,0,0]=3 2070 B25R4.26276710 Brc1ccc2cc([nH]c2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000736022 [0,1,0,0,0,1|1,0,0]=3 2071 B25R4.26276710 Brc1ccc2cc(sc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100009814784 [0,1,0,0,0,1|2,0,0]=4 2072 B25R4.26276710 Brc1ccc2cc(sc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100009814784 [0,1,0,0,0,1|2,0,0]=4 2073 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CNC3CCCc4c3ccnc4 207a_100020634316_200011361486 [0,1,0,0,0,1|1,0,0]=3 2074 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_200011361486 [0,1,0,0,0,1|1,0,0]=3 2075 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CNC3CCCc4c3nccc4 207a_100011259139_200011361486 [0,1,0,0,0,1|1,0,0]=3 2076 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CNC3CCCc4c3nccc4 270004a_100011259139_200011361486 [0,1,0,0,0,1|1,0,0]=3 2077 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CNC3CCOc4c3cccc4 207a_100015190321_200011361486 [0,1,0,0,0,1|1,0,0]=3 2078 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CNC3CCOc4c3cccc4 270004a_100015190321_200011361486 [0,1,0,0,0,1|1,0,0]=3 2079 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CNC3CCOc4c3nccc4 207a_100009852857_200011361486 [0,1,0,0,0,1|2,0,0]=4 2080 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CNC3CCOc4c3nccc4 270004a_100009852857_200011361486 [0,1,0,0,0,1|2,0,0]=4 2081 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_200011361486 [0,1,0,0,0,1|0,0,0]=2 2082 B25R4.26276710 Brc1ccc2nc([nH]c2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_200011361486 [0,1,0,0,0,1|0,0,0]=2 2083 B25R4.26276710 Brc1ccc2nc(cn2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100012351728 [0,1,0,0,0,1|2,0,0]=4 2084 B25R4.26276710 Brc1ccc2nc(cn2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100012351728 [0,1,0,0,0,1|2,0,0]=4 2085 B25R4.26276710 Brc1ccc2nc(cn2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000741204 [0,1,0,0,0,1|2,0,0]=4 2086 B25R4.26276710 Brc1ccc2nc(oc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000729449 [0,1,0,0,0,1|2,0,0]=4 2087 B25R4.26276710 Brc1ccc2nc(oc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100000729449 [0,1,0,0,0,1|2,0,0]=4 2088 B25R4.26276710 Brc1ccc2nc(oc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100000729449 [0,1,0,0,0,1|2,0,0]=4 2089 B25R4.26276710 Brc1ccc2nc(oc2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000729449 [0,1,0,0,0,1|1,0,0]=3 2090 B25R4.26276710 Brc1ccc2nc(oc2c1)COC3CCCc4c3cccc4 34a_100000183665_100000729449 [0,1,0,0,0,1|2,0,0]=4 2091 B25R4.26276710 Brc1ccc2nc(oc2c1)COC3CCCc4c3cccc4 7a_100000183665_100000729449 [0,1,0,0,0,1|2,0,0]=4 2092 B25R4.26276710 Brc1ccc2nc(sc2c1)NN=C3CCCc4c3cccc4 4a_100009816745_100000210882 [0,1,0,0,0,1|1,0,1]=4 2093 B25R4.26276710 Brc1ccc2oc(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000755920 [0,1,0,0,0,1|2,0,0]=4 2094 B25R4.26276710 Brc1ccc2oc(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000755920 [0,1,0,0,0,1|2,0,0]=4 2095 B25R4.26276710 Brc1ccc2oc(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000730559 [0,1,0,0,0,1|2,0,0]=4 2096 B25R4.26276710 Brc1ccc2oc(nc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100000730559 [0,1,0,0,0,1|2,0,0]=4 2097 B25R4.26276710 Brc1ccc2oc(nc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100000730559 [0,1,0,0,0,1|2,0,0]=4 2098 B25R4.26276710 Brc1ccc2oc(nc2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000730559 [0,1,0,0,0,1|1,0,0]=3 2099 B25R4.26276710 Brc1ccc2oc(nc2c1)COC3CCCc4c3cccc4 34a_100000183665_100000730559 [0,1,0,0,0,1|2,0,0]=4 2100 B25R4.26276710 Brc1ccc2oc(nc2c1)COC3CCCc4c3cccc4 7a_100000183665_100000730559 [0,1,0,0,0,1|2,0,0]=4 2101 B25R4.26276710 Brc1ccc2sc(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100010238522 [0,1,0,0,0,1|2,0,0]=4 2102 B25R4.26276710 Brc1ccc2sc(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100010238522 [0,1,0,0,0,1|2,0,0]=4 2103 B25R4.26276710 Brc1ccn2cc(nc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000731868 [0,1,0,0,0,1|2,0,0]=4 2104 B25R4.26276710 Cc1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000084633 [0,1,0,0,0,1|2,0,0]=4 2105 B25R4.26276710 Cc1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000084633 [0,1,0,0,0,1|2,0,0]=4 2106 B25R4.26276710 Cc1ccc2[nH]c(cc2c1)CNC3CCCc4c3nccc4 207a_100011259139_100000084633 [0,1,0,0,0,1|2,0,0]=4 2107 B25R4.26276710 Cc1ccc2[nH]c(cc2c1)CNC3CCCc4c3nccc4 270004a_100011259139_100000084633 [0,1,0,0,0,1|2,0,0]=4 2108 B25R4.26276710 Cc1ccc2[nH]c(cc2c1)CNC3CCOc4c3cccc4 207a_100015190321_100000084633 [0,1,0,0,0,1|2,0,0]=4 2109 B25R4.26276710 Cc1ccc2[nH]c(cc2c1)CNC3CCOc4c3cccc4 270004a_100015190321_100000084633 [0,1,0,0,0,1|2,0,0]=4 2110 B25R4.26276710 Cc1ccc2[nH]c(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000084633 [0,1,0,0,0,1|1,0,0]=3 2111 B25R4.26276710 Cc1ccc2[nH]c(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000084633 [0,1,0,0,0,1|1,0,0]=3 2112 B25R4.26276710 Cc1ccc2nc([nH]c2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100020603265 [0,1,0,0,0,1|1,0,0]=3 2113 B25R4.26276710 Cc1ccc2nc([nH]c2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100020603265 [0,1,0,0,0,1|1,0,0]=3 2114 B25R4.26276710 Cc1ccc2nc([nH]c2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100020603265 [0,1,0,0,0,1|1,0,0]=3 2115 B25R4.26276710 Cc1ccc2nc([nH]c2c1)CNC3CCOc4c3nccc4 2230a_100009852857_100020603265 [0,1,0,0,0,1|2,0,0]=4 2116 B25R4.26276710 Cc1ccc2nc([nH]c2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100020603265 [0,1,0,0,0,1|0,0,0]=2 2117 B25R4.26276710 Cc1ccc2nc([nH]c2c1)COC3CCCc4c3cccc4 34a_100000183665_100020603265 [0,1,0,0,0,1|1,0,0]=3 2118 B25R4.26276710 Cc1ccc2nc([nH]c2c1)COC3CCCc4c3cccc4 7a_100000183665_100020603265 [0,1,0,0,0,1|1,0,0]=3 2119 B25R4.26276710 Cc1ccc2nc([nH]c2c1)COC3CCOc4c3cccc4 7a_100000708930_100020603265 [0,1,0,0,0,1|2,0,0]=4 2120 B25R4.26276710 Cc1ccc2nc([nH]c2c1)COC3COCc4c3cccc4 34a_100012179175_100020603265 [0,1,0,0,0,1|2,0,0]=4 2121 B25R4.26276710 Cc1ccc2nc(cn2c1)CNC3CCCc4c3cccc4 269862a_103437854201_100000210882 [0,1,0,0,0,1|2,0,0]=4 2122 B25R4.26276710 Cc1ccc2nc(oc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100011295139 [0,1,0,0,0,1|2,0,0]=4 2123 B25R4.26276710 Cc1ccc2nc(oc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100011295139 [0,1,0,0,0,1|2,0,0]=4 2124 B25R4.26276710 Cc1ccc2nc(oc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100011295139 [0,1,0,0,0,1|2,0,0]=4 2125 B25R4.26276710 Cc1ccc2nc(oc2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100011295139 [0,1,0,0,0,1|1,0,0]=3 2126 B25R4.26276710 Cc1ccc2nc(oc2c1)COC3CCCc4c3cccc4 34a_100000183665_100011295139 [0,1,0,0,0,1|2,0,0]=4 2127 B25R4.26276710 Cc1ccc2nc(oc2c1)COC3CCCc4c3cccc4 7a_100000183665_100011295139 [0,1,0,0,0,1|2,0,0]=4 2128 B25R4.26276710 Cc1ccc2nc(sc2c1)NCC3OCCc4c3cccc4 27a_100000755408_100010186437 [0,1,0,0,0,1|2,0,0]=4 2129 B25R4.26276710 Cc1ccc2nc(sc2c1)NN=C3CCCc4c3cccc4 4a_100000067901_100000210882 [0,1,0,0,0,1|1,0,1]=4 2130 B25R4.26276710 Cc1ccc2oc(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100011374149 [0,1,0,0,0,1|2,0,0]=4 2131 B25R4.26276710 Cc1ccc2oc(nc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100011374149 [0,1,0,0,0,1|2,0,0]=4 2132 B25R4.26276710 Cc1ccc2oc(nc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100011374149 [0,1,0,0,0,1|2,0,0]=4 2133 B25R4.26276710 Cc1ccc2oc(nc2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100011374149 [0,1,0,0,0,1|1,0,0]=3 2134 B25R4.26276710 Cc1ccc2oc(nc2c1)COC3CCCc4c3cccc4 34a_100000183665_100011374149 [0,1,0,0,0,1|2,0,0]=4 2135 B25R4.26276710 Cc1ccc2oc(nc2c1)COC3CCCc4c3cccc4 7a_100000183665_100011374149 [0,1,0,0,0,1|2,0,0]=4 2136 B25R4.26276710 Cc1ccc2sc(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000050833 [0,1,0,0,0,1|2,0,0]=4 2137 B25R4.26276710 Cc1ccc2sc(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000050833 [0,1,0,0,0,1|2,0,0]=4 2138 B25R4.26276710 Cc1ccn2cc(nc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_200012001332 [0,1,0,0,0,1|2,0,0]=4 2139 B25R4.26276710 Cc1ccn2cc(nc2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_200015186621 [0,1,0,0,0,1|2,0,0]=4 2140 B25R4.26276710 Clc1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000084621 [0,1,0,0,0,1|2,0,0]=4 2141 B25R4.26276710 Clc1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000084621 [0,1,0,0,0,1|2,0,0]=4 2142 B25R4.26276710 Clc1ccc2[nH]c(cc2c1)CNC3CCCc4c3nccc4 207a_100011259139_100000084621 [0,1,0,0,0,1|2,0,0]=4 2143 B25R4.26276710 Clc1ccc2[nH]c(cc2c1)CNC3CCCc4c3nccc4 270004a_100011259139_100000084621 [0,1,0,0,0,1|2,0,0]=4 2144 B25R4.26276710 Clc1ccc2[nH]c(cc2c1)CNC3CCOc4c3cccc4 207a_100015190321_100000084621 [0,1,0,0,0,1|2,0,0]=4 2145 B25R4.26276710 Clc1ccc2[nH]c(cc2c1)CNC3CCOc4c3cccc4 270004a_100015190321_100000084621 [0,1,0,0,0,1|2,0,0]=4 2146 B25R4.26276710 Clc1ccc2[nH]c(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000084621 [0,1,0,0,0,1|1,0,0]=3 2147 B25R4.26276710 Clc1ccc2[nH]c(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000084621 [0,1,0,0,0,1|1,0,0]=3 2148 B25R4.26276710 Clc1ccc2[nH]c(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000179801 [0,1,0,0,0,1|1,0,0]=3 2149 B25R4.26276710 Clc1ccc2[nH]c(nc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100000179801 [0,1,0,0,0,1|1,0,0]=3 2150 B25R4.26276710 Clc1ccc2[nH]c(nc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100000179801 [0,1,0,0,0,1|1,0,0]=3 2151 B25R4.26276710 Clc1ccc2[nH]c(nc2c1)CNC3CCOc4c3nccc4 2230a_100009852857_100000179801 [0,1,0,0,0,1|2,0,0]=4 2152 B25R4.26276710 Clc1ccc2[nH]c(nc2c1)COC3CCCc4c3cccc4 7a_100000183665_100000179801 [0,1,0,0,0,1|1,0,0]=3 2153 B25R4.26276710 Clc1ccc2[nH]c(nc2c1)COC3CCOc4c3cccc4 7a_100000708930_100000179801 [0,1,0,0,0,1|2,0,0]=4 2154 B25R4.26276710 Clc1ccc2c(c1)CC(=NNC3CCCc4c3cccc4)C2 4a_100159326319_100000092892 [0,1,0,0,0,1|2,0,0]=4 2155 B25R4.26276710 Clc1ccc2cc([nH]c2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000100868 [0,1,0,0,0,1|2,0,0]=4 2156 B25R4.26276710 Clc1ccc2cc([nH]c2c1)CNC3CCCc4c3nccc4 270004a_100011259139_100000100868 [0,1,0,0,0,1|2,0,0]=4 2157 B25R4.26276710 Clc1ccc2cc([nH]c2c1)CNC3CCOc4c3cccc4 270004a_100015190321_100000100868 [0,1,0,0,0,1|2,0,0]=4 2158 B25R4.26276710 Clc1ccc2cc([nH]c2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000100868 [0,1,0,0,0,1|1,0,0]=3 2159 B25R4.26276710 Clc1ccc2nc(cn2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000689856 [0,1,0,0,0,1|2,0,0]=4 2160 B25R4.26276710 Clc1ccc2nc(oc2c1)NN=C3CCCc4c3cccc4 4a_200000068541_100000210882 [0,1,0,0,0,1|1,0,1]=4 2161 B25R4.26276710 Clc1ccc2nc(sc2c1)NN=C3CCCc4c3cccc4 4a_100000043616_100000210882 [0,1,0,0,0,1|1,0,1]=4 2162 B25R4.26276710 Clc1ccc2oc(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100012003054 [0,1,0,0,0,1|2,0,0]=4 2163 B25R4.26276710 Clc1ccc2oc(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100012003054 [0,1,0,0,0,1|2,0,0]=4 2164 B25R4.26276710 Clc1ccc2oc(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100011222916 [0,1,0,0,0,1|2,0,0]=4 2165 B25R4.26276710 Clc1ccc2oc(nc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100011222916 [0,1,0,0,0,1|2,0,0]=4 2166 B25R4.26276710 Clc1ccc2oc(nc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100011222916 [0,1,0,0,0,1|2,0,0]=4 2167 B25R4.26276710 Clc1ccc2oc(nc2c1)COC3CCCc4c3cccc4 7a_100000183665_100011222916 [0,1,0,0,0,1|2,0,0]=4 2168 B25R4.26276710 Clc1ccc2sc(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_200000119088 [0,1,0,0,0,1|2,0,0]=4 2169 B25R4.26276710 Clc1ccc2sc(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_200000119088 [0,1,0,0,0,1|2,0,0]=4 2170 B25R4.26276710 Clc1ccc2sc(nc2c1)NN=C3CCCc4c3cccc4 4a_100000026785_100000210882 [0,1,0,0,0,1|1,0,1]=4 2171 B25R4.26276710 Fc1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000050952 [0,1,0,0,0,1|2,0,0]=4 2172 B25R4.26276710 Fc1ccc2[nH]c(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000050952 [0,1,0,0,0,1|2,0,0]=4 2173 B25R4.26276710 Fc1ccc2[nH]c(cc2c1)CNC3CCCc4c3nccc4 207a_100011259139_100000050952 [0,1,0,0,0,1|2,0,0]=4 2174 B25R4.26276710 Fc1ccc2[nH]c(cc2c1)CNC3CCCc4c3nccc4 270004a_100011259139_100000050952 [0,1,0,0,0,1|2,0,0]=4 2175 B25R4.26276710 Fc1ccc2[nH]c(cc2c1)CNC3CCOc4c3cccc4 207a_100015190321_100000050952 [0,1,0,0,0,1|2,0,0]=4 2176 B25R4.26276710 Fc1ccc2[nH]c(cc2c1)CNC3CCOc4c3cccc4 270004a_100015190321_100000050952 [0,1,0,0,0,1|2,0,0]=4 2177 B25R4.26276710 Fc1ccc2[nH]c(cc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_100000050952 [0,1,0,0,0,1|1,0,0]=3 2178 B25R4.26276710 Fc1ccc2[nH]c(cc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000050952 [0,1,0,0,0,1|1,0,0]=3 2179 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_200011915233 [0,1,0,0,0,1|1,0,0]=3 2180 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_200011915233 [0,1,0,0,0,1|1,0,0]=3 2181 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CNC3CCCc4c3nccc4 207a_100011259139_200011915233 [0,1,0,0,0,1|1,0,0]=3 2182 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CNC3CCCc4c3nccc4 270004a_100011259139_200011915233 [0,1,0,0,0,1|1,0,0]=3 2183 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CNC3CCOc4c3cccc4 207a_100015190321_200011915233 [0,1,0,0,0,1|1,0,0]=3 2184 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CNC3CCOc4c3cccc4 270004a_100015190321_200011915233 [0,1,0,0,0,1|1,0,0]=3 2185 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CNC3CCOc4c3nccc4 207a_100009852857_200011915233 [0,1,0,0,0,1|2,0,0]=4 2186 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CNC3CCOc4c3nccc4 270004a_100009852857_200011915233 [0,1,0,0,0,1|2,0,0]=4 2187 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CN[C@H]3CCCc4c3cccc4 207a_100020654734_200011915233 [0,1,0,0,0,1|0,0,0]=2 2188 B25R4.26276710 Fc1ccc2[nH]c(nc2c1)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_200011915233 [0,1,0,0,0,1|0,0,0]=2 2189 B25R4.26276710 Fc1ccc2nc([nH]c2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_200011347187 [0,1,0,0,0,1|1,0,0]=3 2190 B25R4.26276710 Fc1ccc2nc([nH]c2c1)CNC3CCCc4c3nccc4 2230a_100011259139_200011347187 [0,1,0,0,0,1|1,0,0]=3 2191 B25R4.26276710 Fc1ccc2nc([nH]c2c1)CNC3CCOc4c3cccc4 2230a_100015190321_200011347187 [0,1,0,0,0,1|1,0,0]=3 2192 B25R4.26276710 Fc1ccc2nc([nH]c2c1)CNC3CCOc4c3nccc4 2230a_100009852857_200011347187 [0,1,0,0,0,1|2,0,0]=4 2193 B25R4.26276710 Fc1ccc2nc([nH]c2c1)COC3CCCc4c3cccc4 7a_100000183665_200011347187 [0,1,0,0,0,1|1,0,0]=3 2194 B25R4.26276710 Fc1ccc2nc([nH]c2c1)COC3CCOc4c3cccc4 7a_100000708930_200011347187 [0,1,0,0,0,1|2,0,0]=4 2195 B25R4.26276710 Fc1ccc2nc(oc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000687025 [0,1,0,0,0,1|2,0,0]=4 2196 B25R4.26276710 Fc1ccc2nc(oc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100000687025 [0,1,0,0,0,1|2,0,0]=4 2197 B25R4.26276710 Fc1ccc2nc(oc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100000687025 [0,1,0,0,0,1|2,0,0]=4 2198 B25R4.26276710 Fc1ccc2nc(oc2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000687025 [0,1,0,0,0,1|1,0,0]=3 2199 B25R4.26276710 Fc1ccc2nc(oc2c1)COC3CCCc4c3cccc4 34a_100000183665_100000687025 [0,1,0,0,0,1|2,0,0]=4 2200 B25R4.26276710 Fc1ccc2nc(oc2c1)COC3CCCc4c3cccc4 7a_100000183665_100000687025 [0,1,0,0,0,1|2,0,0]=4 2201 B25R4.26276710 Fc1ccc2nc(sc2c1)NCC3OCCc4c3cccc4 27a_100000755408_100000751617 [0,1,0,0,0,1|2,0,0]=4 2202 B25R4.26276710 Fc1ccc2nc(sc2c1)NN=C3CCCc4c3cccc4 4a_100000081544_100000210882 [0,1,0,0,0,1|1,0,1]=4 2203 B25R4.26276710 Fc1ccc2oc(nc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000687093 [0,1,0,0,0,1|2,0,0]=4 2204 B25R4.26276710 Fc1ccc2oc(nc2c1)CNC3CCCc4c3nccc4 2230a_100011259139_100000687093 [0,1,0,0,0,1|2,0,0]=4 2205 B25R4.26276710 Fc1ccc2oc(nc2c1)CNC3CCOc4c3cccc4 2230a_100015190321_100000687093 [0,1,0,0,0,1|2,0,0]=4 2206 B25R4.26276710 Fc1ccc2oc(nc2c1)CN[C@H]3CCCc4c3cccc4 34a_100020654734_100000687093 [0,1,0,0,0,1|1,0,0]=3 2207 B25R4.26276710 Fc1ccc2oc(nc2c1)COC3CCCc4c3cccc4 34a_100000183665_100000687093 [0,1,0,0,0,1|2,0,0]=4 2208 B25R4.26276710 Fc1ccc2oc(nc2c1)COC3CCCc4c3cccc4 7a_100000183665_100000687093 [0,1,0,0,0,1|2,0,0]=4 2209 B25R4.26276710 Fc1ccc2sc(nc2c1)NCC3OCCc4c3cccc4 27a_100000755408_200010206605 [0,1,0,0,0,1|2,0,0]=4 2210 B25R4.26276710 Nc1ccc2nc(sc2c1)NCC3OCCc4c3cccc4 27a_100000755408_100010253933 [0,1,0,0,0,1|2,0,0]=4 2211 B25R4.26276710 Nc1ccc2sc(nc2c1)NCC3OCCc4c3cccc4 27a_100000755408_100010329861 [0,1,0,0,0,1|2,0,0]=4 2212 B25R4.26276710 Oc1ccc2nc(sc2c1)NCC3OCCc4c3cccc4 27a_100000755408_100010063415 [0,1,0,0,0,1|2,0,0]=4 2213 B25R4.42644258 Brc1cccc2c1CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000691372 [0,1,0,0,0,1|0,0,1]=3 2214 B25R4.42644258 Brc1cccc2c1CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000691372 [0,1,0,0,0,1|1,0,1]=4 2215 B25R4.42644258 Brc1cccc2c1CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000691372 [0,1,0,0,0,1|1,0,1]=4 2216 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4ccccc4[nH]3 270004a_100020639248_100000051030 [0,1,0,0,0,1|1,0,0]=3 2217 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4ccccc4o3 207a_100020639248_100000229944 [0,1,0,0,0,1|2,0,0]=4 2218 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000691372 [0,1,0,0,0,1|2,0,0]=4 2219 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4ccccc4o3 270004a_100020639248_100000229944 [0,1,0,0,0,1|2,0,0]=4 2220 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4ccccc4s3 207a_100020639248_100000686906 [0,1,0,0,0,1|2,0,0]=4 2221 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000691372 [0,1,0,0,0,1|2,0,0]=4 2222 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4ccccc4s3 270004a_100020639248_100000686906 [0,1,0,0,0,1|2,0,0]=4 2223 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4cccnc4[nH]3 207a_100020639248_100000088027 [0,1,0,0,0,1|2,0,0]=4 2224 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4cccnc4[nH]3 270004a_100020639248_100000088027 [0,1,0,0,0,1|2,0,0]=4 2225 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cc4ccncc4[nH]3 270004a_100020639248_200000084276 [0,1,0,0,0,1|2,0,0]=4 2226 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cn4ccccc4n3 207a_100020639248_100000743146 [0,1,0,0,0,1|2,0,0]=4 2227 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cn4ccccc4n3 2230a_100020639248_100000689847 [0,1,0,0,0,1|2,0,0]=4 2228 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000691372 [0,1,0,0,0,1|2,0,0]=4 2229 B25R4.42644258 Brc1cccc2c1CCCC2NCc3cn4ccccc4n3 34a_100020639248_100000689847 [0,1,0,0,0,1|2,0,0]=4 2230 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ccccc4[nH]3 207a_100020639248_100000185668 [0,1,0,0,0,1|0,0,0]=2 2231 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ccccc4[nH]3 2230a_100020639248_100000737899 [0,1,0,0,0,1|0,0,0]=2 2232 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ccccc4[nH]3 270004a_100020639248_100000185668 [0,1,0,0,0,1|0,0,0]=2 2233 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ccccc4o3 2230a_100020639248_100000195508 [0,1,0,0,0,1|1,0,0]=3 2234 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ccccc4o3 34a_100020639248_200012361514 [0,1,0,0,0,1|1,0,0]=3 2235 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ccccc4s3 2230a_100020639248_100000766747 [0,1,0,0,0,1|1,0,0]=3 2236 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ccccc4s3 270004a_100020639248_100011204187 [0,1,0,0,0,1|1,0,0]=3 2237 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ccccc4s3 34a_100020639248_100011217541 [0,1,0,0,0,1|1,0,0]=3 2238 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4cccnc4[nH]3 2230a_100020639248_100011549802 [0,1,0,0,0,1|1,0,0]=3 2239 B25R4.42644258 Brc1cccc2c1CCCC2NCc3nc4ncccc4o3 2230a_100020639248_100000696355 [0,1,0,0,0,1|2,0,0]=4 2240 B25R4.42644258 Brc1cccc2c1CCCC2OCc3nc4ccccc4[nH]3 7a_100009815610_100000737899 [0,1,0,0,0,1|1,0,0]=3 2241 B25R4.42644258 Brc1cccc2c1CCCC2OCc3nc4ccccc4o3 34a_100009815610_200012361514 [0,1,0,0,0,1|2,0,0]=4 2242 B25R4.42644258 Brc1cccc2c1CCCC2OCc3nc4ccccc4o3 7a_100009815610_100000195508 [0,1,0,0,0,1|2,0,0]=4 2243 B25R4.42644258 Brc1cccc2c1CCCC2OCc3nc4ccccc4s3 34a_100009815610_100011217541 [0,1,0,0,0,1|2,0,0]=4 2244 B25R4.42644258 Brc1cccc2c1CCCC2OCc3nc4ccccc4s3 7a_100009815610_100011217541 [0,1,0,0,0,1|2,0,0]=4 2245 B25R4.42644258 Brc1cccc2c1CCCC2OCc3nc4cccnc4[nH]3 7a_100009815610_100011549802 [0,1,0,0,0,1|2,0,0]=4 2246 B25R4.42644258 Brc1cccc2c1OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000744318 [0,1,0,0,0,1|1,0,1]=4 2247 B25R4.42644258 Brc1cccc2c1OCCC2NCc3cc4ccccc4[nH]3 270004a_100000727345_100000051030 [0,1,0,0,0,1|2,0,0]=4 2248 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4ccccc4[nH]3 207a_100000727345_100000185668 [0,1,0,0,0,1|1,0,0]=3 2249 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4ccccc4[nH]3 2230a_100000727345_100000737899 [0,1,0,0,0,1|1,0,0]=3 2250 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4ccccc4[nH]3 270004a_100000727345_100000185668 [0,1,0,0,0,1|1,0,0]=3 2251 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4ccccc4o3 2230a_100000727345_100000195508 [0,1,0,0,0,1|2,0,0]=4 2252 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4ccccc4o3 34a_100000727345_200012361514 [0,1,0,0,0,1|2,0,0]=4 2253 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4ccccc4s3 2230a_100000727345_100000766747 [0,1,0,0,0,1|2,0,0]=4 2254 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4ccccc4s3 270004a_100000727345_100011204187 [0,1,0,0,0,1|2,0,0]=4 2255 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4ccccc4s3 34a_100000727345_100011217541 [0,1,0,0,0,1|2,0,0]=4 2256 B25R4.42644258 Brc1cccc2c1OCCC2NCc3nc4cccnc4[nH]3 2230a_100000727345_100011549802 [0,1,0,0,0,1|2,0,0]=4 2257 B25R4.42644258 Brc1cccc2c1SCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100011271337 [0,1,0,0,0,1|1,0,1]=4 2258 B25R4.42644258 Brc1cncc2c1CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100010870523 [0,1,0,0,0,1|1,0,1]=4 2259 B25R4.42644258 Cc1cccc2c1OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000744394 [0,1,0,0,0,1|1,0,1]=4 2260 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3cc4ccccc4[nH]3 270004a_100000717741_100000051030 [0,1,0,0,0,1|2,0,0]=4 2261 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4ccccc4[nH]3 207a_100000717741_100000185668 [0,1,0,0,0,1|1,0,0]=3 2262 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4ccccc4[nH]3 2230a_100000717741_100000737899 [0,1,0,0,0,1|1,0,0]=3 2263 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4ccccc4[nH]3 270004a_100000717741_100000185668 [0,1,0,0,0,1|1,0,0]=3 2264 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4ccccc4o3 2230a_100000717741_100000195508 [0,1,0,0,0,1|2,0,0]=4 2265 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4ccccc4o3 34a_100000717741_200012361514 [0,1,0,0,0,1|2,0,0]=4 2266 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4ccccc4s3 2230a_100000717741_100000766747 [0,1,0,0,0,1|2,0,0]=4 2267 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4ccccc4s3 270004a_100000717741_100011204187 [0,1,0,0,0,1|2,0,0]=4 2268 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4ccccc4s3 34a_100000717741_100011217541 [0,1,0,0,0,1|2,0,0]=4 2269 B25R4.42644258 Cc1cccc2c1OCC[C@H]2NCc3nc4cccnc4[nH]3 2230a_100000717741_100011549802 [0,1,0,0,0,1|2,0,0]=4 2270 B25R4.42644258 Clc1cccc2c1CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000063505 [0,1,0,0,0,1|0,0,1]=3 2271 B25R4.42644258 Clc1cccc2c1CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000063505 [0,1,0,0,0,1|1,0,1]=4 2272 B25R4.42644258 Clc1cccc2c1CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000063505 [0,1,0,0,0,1|1,0,1]=4 2273 B25R4.42644258 Clc1cccc2c1CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000063505 [0,1,0,0,0,1|2,0,0]=4 2274 B25R4.42644258 Clc1cccc2c1CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000063505 [0,1,0,0,0,1|2,0,0]=4 2275 B25R4.42644258 Clc1cccc2c1CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000063505 [0,1,0,0,0,1|2,0,0]=4 2276 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cc4ccccc4[nH]3 270004a_100025717364_100000051030 [0,1,0,0,0,1|1,0,0]=3 2277 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cc4ccccc4o3 207a_100025717364_100000229944 [0,1,0,0,0,1|2,0,0]=4 2278 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cc4ccccc4o3 270004a_100025717364_100000229944 [0,1,0,0,0,1|2,0,0]=4 2279 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cc4ccccc4s3 207a_100025717364_100000686906 [0,1,0,0,0,1|2,0,0]=4 2280 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cc4ccccc4s3 270004a_100025717364_100000686906 [0,1,0,0,0,1|2,0,0]=4 2281 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cc4cccnc4[nH]3 207a_100025717364_100000088027 [0,1,0,0,0,1|2,0,0]=4 2282 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cc4cccnc4[nH]3 270004a_100025717364_100000088027 [0,1,0,0,0,1|2,0,0]=4 2283 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cc4ccncc4[nH]3 270004a_100025717364_200000084276 [0,1,0,0,0,1|2,0,0]=4 2284 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cn4ccccc4n3 207a_100025717364_100000743146 [0,1,0,0,0,1|2,0,0]=4 2285 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cn4ccccc4n3 2230a_100025717364_100000689847 [0,1,0,0,0,1|2,0,0]=4 2286 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3cn4ccccc4n3 34a_100025717364_100000689847 [0,1,0,0,0,1|2,0,0]=4 2287 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ccccc4[nH]3 207a_100025717364_100000185668 [0,1,0,0,0,1|0,0,0]=2 2288 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ccccc4[nH]3 2230a_100025717364_100000737899 [0,1,0,0,0,1|0,0,0]=2 2289 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ccccc4[nH]3 270004a_100025717364_100000185668 [0,1,0,0,0,1|0,0,0]=2 2290 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ccccc4o3 2230a_100025717364_100000195508 [0,1,0,0,0,1|1,0,0]=3 2291 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ccccc4o3 34a_100025717364_200012361514 [0,1,0,0,0,1|1,0,0]=3 2292 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ccccc4s3 2230a_100025717364_100000766747 [0,1,0,0,0,1|1,0,0]=3 2293 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ccccc4s3 270004a_100025717364_100011204187 [0,1,0,0,0,1|1,0,0]=3 2294 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ccccc4s3 34a_100025717364_100011217541 [0,1,0,0,0,1|1,0,0]=3 2295 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4cccnc4[nH]3 2230a_100025717364_100011549802 [0,1,0,0,0,1|1,0,0]=3 2296 B25R4.42644258 Clc1cccc2c1CCC[C@H]2NCc3nc4ncccc4o3 2230a_100025717364_100000696355 [0,1,0,0,0,1|2,0,0]=4 2297 B25R4.42644258 Clc1cccc2c1OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000742938 [0,1,0,0,0,1|1,0,1]=4 2298 B25R4.42644258 Fc1cccc2c1CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000087435 [0,1,0,0,0,1|0,0,1]=3 2299 B25R4.42644258 Fc1cccc2c1CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000087435 [0,1,0,0,0,1|1,0,1]=4 2300 B25R4.42644258 Fc1cccc2c1CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000087435 [0,1,0,0,0,1|1,0,1]=4 2301 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4ccccc4[nH]3 270004a_100000085590_100000051030 [0,1,0,0,0,1|1,0,0]=3 2302 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4ccccc4o3 207a_100000085590_100000229944 [0,1,0,0,0,1|2,0,0]=4 2303 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000087435 [0,1,0,0,0,1|2,0,0]=4 2304 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4ccccc4o3 270004a_100000085590_100000229944 [0,1,0,0,0,1|2,0,0]=4 2305 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4ccccc4s3 207a_100000085590_100000686906 [0,1,0,0,0,1|2,0,0]=4 2306 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000087435 [0,1,0,0,0,1|2,0,0]=4 2307 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4ccccc4s3 270004a_100000085590_100000686906 [0,1,0,0,0,1|2,0,0]=4 2308 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4cccnc4[nH]3 207a_100000085590_100000088027 [0,1,0,0,0,1|2,0,0]=4 2309 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4cccnc4[nH]3 270004a_100000085590_100000088027 [0,1,0,0,0,1|2,0,0]=4 2310 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cc4ccncc4[nH]3 270004a_100000085590_200000084276 [0,1,0,0,0,1|2,0,0]=4 2311 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cn4ccccc4n3 207a_100000085590_100000743146 [0,1,0,0,0,1|2,0,0]=4 2312 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cn4ccccc4n3 2230a_100000085590_100000689847 [0,1,0,0,0,1|2,0,0]=4 2313 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000087435 [0,1,0,0,0,1|2,0,0]=4 2314 B25R4.42644258 Fc1cccc2c1CCCC2NCc3cn4ccccc4n3 34a_100000085590_100000689847 [0,1,0,0,0,1|2,0,0]=4 2315 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ccccc4[nH]3 207a_100000085590_100000185668 [0,1,0,0,0,1|0,0,0]=2 2316 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ccccc4[nH]3 2230a_100000085590_100000737899 [0,1,0,0,0,1|0,0,0]=2 2317 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ccccc4[nH]3 270004a_100000085590_100000185668 [0,1,0,0,0,1|0,0,0]=2 2318 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ccccc4o3 2230a_100000085590_100000195508 [0,1,0,0,0,1|1,0,0]=3 2319 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ccccc4o3 34a_100000085590_200012361514 [0,1,0,0,0,1|1,0,0]=3 2320 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ccccc4s3 2230a_100000085590_100000766747 [0,1,0,0,0,1|1,0,0]=3 2321 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ccccc4s3 270004a_100000085590_100011204187 [0,1,0,0,0,1|1,0,0]=3 2322 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ccccc4s3 34a_100000085590_100011217541 [0,1,0,0,0,1|1,0,0]=3 2323 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4cccnc4[nH]3 2230a_100000085590_100011549802 [0,1,0,0,0,1|1,0,0]=3 2324 B25R4.42644258 Fc1cccc2c1CCCC2NCc3nc4ncccc4o3 2230a_100000085590_100000696355 [0,1,0,0,0,1|2,0,0]=4 2325 B25R4.42644258 Fc1cccc2c1NCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000068929 [0,1,0,0,0,1|1,0,1]=4 2326 B25R4.42644258 Fc1cccc2c1OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000744082 [0,1,0,0,0,1|1,0,1]=4 2327 B25R4.42644258 Fc1cccc2c1OCCC2NCc3cc4ccccc4[nH]3 270004a_100000746867_100000051030 [0,1,0,0,0,1|2,0,0]=4 2328 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4ccccc4[nH]3 207a_100000746867_100000185668 [0,1,0,0,0,1|1,0,0]=3 2329 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4ccccc4[nH]3 2230a_100000746867_100000737899 [0,1,0,0,0,1|1,0,0]=3 2330 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4ccccc4[nH]3 270004a_100000746867_100000185668 [0,1,0,0,0,1|1,0,0]=3 2331 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4ccccc4o3 2230a_100000746867_100000195508 [0,1,0,0,0,1|2,0,0]=4 2332 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4ccccc4o3 34a_100000746867_200012361514 [0,1,0,0,0,1|2,0,0]=4 2333 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4ccccc4s3 2230a_100000746867_100000766747 [0,1,0,0,0,1|2,0,0]=4 2334 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4ccccc4s3 270004a_100000746867_100011204187 [0,1,0,0,0,1|2,0,0]=4 2335 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4ccccc4s3 34a_100000746867_100011217541 [0,1,0,0,0,1|2,0,0]=4 2336 B25R4.42644258 Fc1cccc2c1OCCC2NCc3nc4cccnc4[nH]3 2230a_100000746867_100011549802 [0,1,0,0,0,1|2,0,0]=4 2337 B25R4.42644258 Oc1cccc2c1CCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000763485 [0,1,0,0,0,1|0,0,1]=3 2338 B25R4.42644258 Oc1cccc2c1CCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000763485 [0,1,0,0,0,1|1,0,1]=4 2339 B25R4.42644258 Oc1cccc2c1CCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000763485 [0,1,0,0,0,1|1,0,1]=4 2340 B25R4.42644258 Oc1cccc2c1CCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000763485 [0,1,0,0,0,1|2,0,0]=4 2341 B25R4.42644258 Oc1cccc2c1CCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000763485 [0,1,0,0,0,1|2,0,0]=4 2342 B25R4.42644258 Oc1cccc2c1CCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000763485 [0,1,0,0,0,1|2,0,0]=4 2343 B25R4.42644258 Oc1cccc2c1OCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100009867664 [0,1,0,0,0,1|1,0,1]=4 2344 B25R4.46592515 CC1CCC(=NNc2nc3ccccc3[nH]2)c4c1cccc4 4a_100000188875_100000689179 [0,1,0,0,0,1|0,0,1]=3 2345 B25R4.46592515 CC1CCC(=NNc2nc3ccccc3o2)c4c1cccc4 4a_100000182307_100000689179 [0,1,0,0,0,1|1,0,1]=4 2346 B25R4.46592515 CC1CCC(=NNc2nc3ccccc3s2)c4c1cccc4 4a_100000181811_100000689179 [0,1,0,0,0,1|1,0,1]=4 2347 B25R4.46592515 CC1CCC(c2c1cccc2)NCc3cc4ccccc4o3 269862a_100011220112_100000689179 [0,1,0,0,0,1|2,0,0]=4 2348 B25R4.46592515 CC1CCC(c2c1cccc2)NCc3cc4ccccc4s3 269862a_100015187092_100000689179 [0,1,0,0,0,1|2,0,0]=4 2349 B25R4.46592515 CC1CCC(c2c1cccc2)NCc3cn4ccccc4n3 269862a_100000195574_100000689179 [0,1,0,0,0,1|2,0,0]=4 2350 B25R4.46592515 O=C1CCC(c2c1cccc2)OCc3nc4ccccc4[nH]3 7a_100000100557_100000737899 [0,1,0,0,0,1|1,0,1]=4 2351 B25R4.46592515 O=S1CCC(=NNc2nc3ccccc3[nH]2)c4c1cccc4 4a_100000188875_100011445602 [0,1,0,0,0,1|1,0,1]=4 2352 B25R4.46592515 OC1CCC(=NNc2nc3ccccc3[nH]2)c4c1cccc4 4a_100000188875_100000100557 [0,1,0,0,0,1|0,0,1]=3 2353 B25R4.46592515 OC1CCC(=NNc2nc3ccccc3o2)c4c1cccc4 4a_100000182307_100000100557 [0,1,0,0,0,1|1,0,1]=4 2354 B25R4.46592515 OC1CCC(=NNc2nc3ccccc3s2)c4c1cccc4 4a_100000181811_100000100557 [0,1,0,0,0,1|1,0,1]=4 2355 B25R4.203444797 CC1(CCCc2c1cccc2)OCc3nc4ccccc4[nH]3 7a_200011345745_100000737899 [0,1,0,0,0,1|1,0,0]=3 2356 B25R4.203444797 CC1(CCCc2c1cccc2)OCc3nc4ccccc4o3 34a_200011345745_200012361514 [0,1,0,0,0,1|2,0,0]=4 2357 B25R4.203444797 CC1(CCCc2c1cccc2)OCc3nc4ccccc4o3 7a_200011345745_100000195508 [0,1,0,0,0,1|2,0,0]=4 2358 B25R4.203444797 CC1(CCCc2c1cccc2)OCc3nc4ccccc4s3 34a_200011345745_100011217541 [0,1,0,0,0,1|2,0,0]=4 2359 B25R4.203444797 CC1(CCCc2c1cccc2)OCc3nc4ccccc4s3 7a_200011345745_100011217541 [0,1,0,0,0,1|2,0,0]=4 2360 B25R4.203444797 CC1(CCCc2c1cccc2)OCc3nc4cccnc4[nH]3 7a_200011345745_100011549802 [0,1,0,0,0,1|2,0,0]=4 2361 B25R4.203444797 OC1(CCCc2c1cccc2)CNc3nc4ccccc4[nH]3 27a_100000753875_100009814255 [0,1,0,0,0,1|0,0,0]=2 2362 B25R4.203444797 OC1(CCCc2c1cccc2)CNc3nc4ccccc4s3 27a_100000753875_100000751744 [0,1,0,0,0,1|1,0,0]=3 2363 B25R4.203444797 OC1(CCCc2c1cccc2)CNc3nc4cccnc4s3 27a_100000753875_100010188088 [0,1,0,0,0,1|2,0,0]=4 2364 B25R4.366775664 Brc1cccc2c1C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100009816782 [0,1,0,0,0,1|0,0,1]=3 2365 B25R4.366775664 Brc1cccc2c1C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100010205896 [0,1,0,0,0,1|1,0,1]=4 2366 B25R4.366775664 Brc1cccc2c1C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100009816782 [0,1,0,0,0,1|1,0,1]=4 2367 B25R4.366775664 Brc1cccc2c1C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100009816782 [0,1,0,0,0,1|1,0,1]=4 2368 B25R4.366775664 Cc1cccc2c1C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000087433 [0,1,0,0,0,1|0,0,1]=3 2369 B25R4.366775664 Cc1cccc2c1C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100009848157 [0,1,0,0,0,1|1,0,1]=4 2370 B25R4.366775664 Cc1cccc2c1C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000087433 [0,1,0,0,0,1|1,0,1]=4 2371 B25R4.366775664 Cc1cccc2c1C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000087433 [0,1,0,0,0,1|1,0,1]=4 2372 B25R4.366775664 Clc1cccc2c1C(=NNc3nc4ccccc4[nH]3)CCC2 4a_100000188875_100000068142 [0,1,0,0,0,1|0,0,1]=3 2373 B25R4.366775664 Clc1cccc2c1C(=NNc3nc4ccccc4[nH]3)CCN2 4a_100000188875_100000099848 [0,1,0,0,0,1|1,0,1]=4 2374 B25R4.366775664 Clc1cccc2c1C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_200009878488 [0,1,0,0,0,1|1,0,1]=4 2375 B25R4.366775664 Clc1cccc2c1C(=NNc3nc4ccccc4o3)CCC2 4a_100000182307_100000068142 [0,1,0,0,0,1|1,0,1]=4 2376 B25R4.366775664 Clc1cccc2c1C(=NNc3nc4ccccc4s3)CCC2 4a_100000181811_100000068142 [0,1,0,0,0,1|1,0,1]=4 2377 B25R4.366775664 Fc1cccc2c1C(=NNc3nc4ccccc4[nH]3)CCO2 4a_100000188875_100000092872 [0,1,0,0,0,1|1,0,1]=4 2378 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3cc4ccccc4[nH]3 270004a_100009881269_100000051030 [0,1,0,0,0,1|2,0,0]=4 2379 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4ccccc4[nH]3 207a_100009881269_100000185668 [0,1,0,0,0,1|1,0,0]=3 2380 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4ccccc4[nH]3 2230a_100009881269_100000737899 [0,1,0,0,0,1|1,0,0]=3 2381 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4ccccc4[nH]3 270004a_100009881269_100000185668 [0,1,0,0,0,1|1,0,0]=3 2382 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4ccccc4o3 2230a_100009881269_100000195508 [0,1,0,0,0,1|2,0,0]=4 2383 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4ccccc4o3 34a_100009881269_200012361514 [0,1,0,0,0,1|2,0,0]=4 2384 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4ccccc4s3 2230a_100009881269_100000766747 [0,1,0,0,0,1|2,0,0]=4 2385 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4ccccc4s3 270004a_100009881269_100011204187 [0,1,0,0,0,1|2,0,0]=4 2386 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4ccccc4s3 34a_100009881269_100011217541 [0,1,0,0,0,1|2,0,0]=4 2387 B25R4.366775664 Fc1cccc2c1C(CCO2)NCc3nc4cccnc4[nH]3 2230a_100009881269_100011549802 [0,1,0,0,0,1|2,0,0]=4 2388 B25R4.441814131 CC(NC1CCCc2c1ccnc2)c3cc4ccccc4[nH]3 269862a_100020634316_100000696822 [0,1,0,0,0,1|2,0,0]=4 2389 B25R4.441814131 CC(NC1CCCc2c1ccnc2)c3nc4ccccc4[nH]3 270004a_100020634316_100000199114 [0,1,0,0,0,1|1,0,0]=3 2390 B25R4.441814131 CC(NC1CCCc2c1nccc2)c3cc4ccccc4[nH]3 269862a_100011259139_100000696822 [0,1,0,0,0,1|2,0,0]=4 2391 B25R4.441814131 CC(NC1CCCc2c1nccc2)c3nc4ccccc4[nH]3 270004a_100011259139_100000199114 [0,1,0,0,0,1|1,0,0]=3 2392 B25R4.441814131 CC(NC1CCOc2c1cccc2)c3cc4ccccc4[nH]3 269862a_100015190321_100000696822 [0,1,0,0,0,1|2,0,0]=4 2393 B25R4.441814131 CC(NC1CCOc2c1cccc2)c3nc4ccccc4[nH]3 270004a_100015190321_100000199114 [0,1,0,0,0,1|1,0,0]=3 2394 B25R4.441814131 CC(NC1CCOc2c1nccc2)c3nc4ccccc4[nH]3 270004a_100009852857_100000199114 [0,1,0,0,0,1|2,0,0]=4 2395 B25R4.441814131 CC(N[C@H]1CCCc2c1cccc2)c3cc4ccccc4[nH]3 269862a_100020654734_100000696822 [0,1,0,0,0,1|1,0,0]=3 2396 B25R4.441814131 CC(N[C@H]1CCCc2c1cccc2)c3cc4ccccc4o3 269862a_100020654734_100000185295 [0,1,0,0,0,1|2,0,0]=4 2397 B25R4.441814131 CC(N[C@H]1CCCc2c1cccc2)c3cc4ccccc4s3 269862a_100020654734_100011216072 [0,1,0,0,0,1|2,0,0]=4 2398 B25R4.441814131 CC(N[C@H]1CCCc2c1cccc2)c3nc4ccccc4[nH]3 270004a_100020654734_100000199114 [0,1,0,0,0,1|0,0,0]=2 2399 B25R4.441814131 CN(CC1OCCc2c1cccc2)c3nc4ccccc4[nH]3 27a_100015203942_100009814255 [0,1,0,0,0,1|1,0,0]=3 2400 B25R4.441814131 CN(CC1OCCc2c1cccc2)c3nc4ccccc4s3 27a_100015203942_100000751744 [0,1,0,0,0,1|2,0,0]=4 2401 B25R4.441814131 O=C(N[C@H]1CCCc2c1cccc2)C3=Cc4ccccc4C3 11a_100020654734_100009862756 [0,1,0,0,0,1|2,0,0]=4 2402 B25R4.441814131 O=C(N[C@H]1CCCc2c1cccc2)C3=Cc4ccccc4C3 1626a_100020654734_100009862756 [0,1,0,0,0,1|2,0,0]=4 2403 B25R4.441814131 O=C(N[C@H]1CCCc2c1cccc2)C3=Cc4ccccc4C3 240690a_100020654734_100009862756 [0,1,0,0,0,1|2,0,0]=4 2404 B25R4.102583 Cc1cc2ccccc2nc1NC3CCCc4c3ccnc4 27a_100020634316_100000751756 [0,1,0,0,0,1|2,0,0]=4 2405 B25R4.102583 Cc1cc2ccccc2nc1NC3CCCc4c3nccc4 27a_100011259139_100000751756 [0,1,0,0,0,1|2,0,0]=4 2406 B25R4.102583 Cc1cc2ccccc2nc1NC3CCOc4c3cccc4 27a_100015190321_100000751756 [0,1,0,0,0,1|2,0,0]=4 2407 B25R4.102583 Cc1cc2ccccc2nc1N[C@H]3CCCc4c3cccc4 27a_100020654734_100000751756 [0,1,0,0,0,1|1,0,0]=3 2408 B25R4.102583 Cc1cc2cccnc2nc1N[C@H]3CCCc4c3cccc4 27a_100020654734_100009877248 [0,1,0,0,0,1|2,0,0]=4 2409 B25R4.102583 Cc1nc2ccccc2nc1NC3CCCc4c3ccnc4 27a_100020634316_100000185947 [0,1,0,0,0,1|1,0,1]=4 2410 B25R4.102583 Cc1nc2ccccc2nc1NC3CCCc4c3nccc4 27a_100011259139_100000185947 [0,1,0,0,0,1|1,0,1]=4 2411 B25R4.102583 Cc1nc2ccccc2nc1NC3CCOc4c3cccc4 27a_100015190321_100000185947 [0,1,0,0,0,1|1,0,1]=4 2412 B25R4.102583 Cc1nc2ccccc2nc1N[C@H]3CCCc4c3cccc4 27a_100020654734_100000185947 [0,1,0,0,0,1|0,0,1]=3 2413 B25R4.102583 Nc1nc2ccccc2nc1NC3CCCc4c3ccnc4 27a_100020634316_100000009970 [0,1,0,0,0,1|1,0,1]=4 2414 B25R4.102583 Nc1nc2ccccc2nc1NC3CCCc4c3nccc4 27a_100011259139_100000009970 [0,1,0,0,0,1|1,0,1]=4 2415 B25R4.102583 Nc1nc2ccccc2nc1NC3CCOc4c3cccc4 27a_100015190321_100000009970 [0,1,0,0,0,1|1,0,1]=4 2416 B25R4.102583 Nc1nc2ccccc2nc1N[C@H]3CCCc4c3cccc4 27a_100020654734_100000009970 [0,1,0,0,0,1|0,0,1]=3 2417 B25R4.1549635 CN(c1ccc2ccccc2n1)C3CCCc4c3cccc4 27a_100000185324_100011291633 [0,1,0,0,0,1|1,0,0]=3 2418 B25R4.1549635 CN(c1ccc2cccnc2n1)C3CCCc4c3cccc4 27a_100000185324_100000075685 [0,1,0,0,0,1|2,0,0]=4 2419 B25R4.1549635 CN(c1ccc2ccncc2n1)C3CCCc4c3cccc4 27a_100000185324_100000020162 [0,1,0,0,0,1|2,0,0]=4 2420 B25R4.1549635 CN(c1ccc2ncccc2n1)C3CCCc4c3cccc4 27a_100000185324_100000073381 [0,1,0,0,0,1|2,0,0]=4 2421 B25R4.1549635 CN(c1cnc2ccccc2n1)C3CCCc4c3cccc4 27a_100000185324_100000756483 [0,1,0,0,0,1|0,0,1]=3 2422 B25R4.1549635 CN(c1cnc2cccnc2n1)C3CCCc4c3cccc4 27a_100000185324_200010275043 [0,1,0,0,0,1|1,0,1]=4 2423 B25R4.1549635 CN(c1cnc2ncccc2n1)C3CCCc4c3cccc4 27a_100000185324_100000084304 [0,1,0,0,0,1|1,0,1]=4 2424 B25R4.1549635 CN(c1ncc2ccccc2n1)C3CCCc4c3cccc4 27a_100000185324_100000097389 [0,1,0,0,0,1|0,0,1]=3 2425 B25R4.1549635 CN(c1ncc2cccnc2n1)C3CCCc4c3cccc4 27a_100000185324_100009875485 [0,1,0,0,0,1|1,0,1]=4 2426 B25R4.2308916 Fc1ccc2cnc(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000104070 [0,1,0,0,0,1|1,0,1]=4 2427 B25R4.2308916 Fc1ccc2cnc(nc2c1)NC3CCCc4c3nccc4 27a_100011259139_100000104070 [0,1,0,0,0,1|1,0,1]=4 2428 B25R4.2308916 Fc1ccc2cnc(nc2c1)NC3CCOc4c3cccc4 27a_100015190321_100000104070 [0,1,0,0,0,1|1,0,1]=4 2429 B25R4.2308916 Fc1ccc2cnc(nc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000104070 [0,1,0,0,0,1|0,0,1]=3 2430 B25R4.2308916 Fc1cnc2ccc(nc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100009889179 [0,1,0,0,0,1|2,0,0]=4 2431 B25R4.2308916 O=c1ccc2cnc(cc2[nH]1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010563892 [0,1,0,0,0,1|2,0,0]=4 2432 B25R4.2308916 Oc1ccc2ncc(nc2c1)NC3CCCc4c3ccnc4 27a_100020634316_200020640061 [0,1,0,0,0,1|1,0,1]=4 2433 B25R4.2308916 Oc1ccc2ncc(nc2c1)NC3CCCc4c3nccc4 27a_100011259139_200020640061 [0,1,0,0,0,1|1,0,1]=4 2434 B25R4.2308916 Oc1ccc2ncc(nc2c1)NC3CCOc4c3cccc4 27a_100015190321_200020640061 [0,1,0,0,0,1|1,0,1]=4 2435 B25R4.2308916 Oc1ccc2ncc(nc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_200020640061 [0,1,0,0,0,1|0,0,1]=3 2436 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3ccc4ccccc4n3 27a_100160469487_100011291633 [0,1,0,0,0,1|1,0,0]=3 2437 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3ccc4cccnc4n3 27a_100160469487_100000075685 [0,1,0,0,0,1|2,0,0]=4 2438 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3ccc4ccncc4n3 27a_100160469487_100000020162 [0,1,0,0,0,1|2,0,0]=4 2439 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3ccc4ncccc4n3 27a_100160469487_100000073381 [0,1,0,0,0,1|2,0,0]=4 2440 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3cnc4ccccc4n3 27a_100160469487_100000756483 [0,1,0,0,0,1|0,0,1]=3 2441 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3cnc4cccnc4n3 27a_100160469487_200010275043 [0,1,0,0,0,1|1,0,1]=4 2442 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3cnc4ncccc4n3 27a_100160469487_100000084304 [0,1,0,0,0,1|1,0,1]=4 2443 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3ncc4ccccc4n3 27a_100160469487_100000097389 [0,1,0,0,0,1|0,0,1]=3 2444 B25R4.2393613 Brc1ccc2c(c1)CCC[C@@H]2Nc3ncc4cccnc4n3 27a_100160469487_100009875485 [0,1,0,0,0,1|1,0,1]=4 2445 B25R4.2393613 Brc1ccc2c(c1)OCC[C@H]2Nc3ccc4ccccc4n3 27a_100020639266_100011291633 [0,1,0,0,0,1|2,0,0]=4 2446 B25R4.2393613 Brc1ccc2c(c1)OCC[C@H]2Nc3cnc4ccccc4n3 27a_100020639266_100000756483 [0,1,0,0,0,1|1,0,1]=4 2447 B25R4.2393613 Brc1ccc2c(c1)OCC[C@H]2Nc3ncc4ccccc4n3 27a_100020639266_100000097389 [0,1,0,0,0,1|1,0,1]=4 2448 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3ccc4ccccc4n3 27a_100025717365_100011291633 [0,1,0,0,0,1|1,0,0]=3 2449 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3ccc4cccnc4n3 27a_100025717365_100000075685 [0,1,0,0,0,1|2,0,0]=4 2450 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3ccc4ccncc4n3 27a_100025717365_100000020162 [0,1,0,0,0,1|2,0,0]=4 2451 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3ccc4ncccc4n3 27a_100025717365_100000073381 [0,1,0,0,0,1|2,0,0]=4 2452 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3cnc4ccccc4n3 27a_100025717365_100000756483 [0,1,0,0,0,1|0,0,1]=3 2453 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3cnc4cccnc4n3 27a_100025717365_200010275043 [0,1,0,0,0,1|1,0,1]=4 2454 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3cnc4ncccc4n3 27a_100025717365_100000084304 [0,1,0,0,0,1|1,0,1]=4 2455 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3ncc4ccccc4n3 27a_100025717365_100000097389 [0,1,0,0,0,1|0,0,1]=3 2456 B25R4.2393613 Clc1ccc2c(c1)CCCC2Nc3ncc4cccnc4n3 27a_100025717365_100009875485 [0,1,0,0,0,1|1,0,1]=4 2457 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3ccc4ccccc4n3 27a_100000695172_100011291633 [0,1,0,0,0,1|1,0,0]=3 2458 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3ccc4cccnc4n3 27a_100000695172_100000075685 [0,1,0,0,0,1|2,0,0]=4 2459 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3ccc4ccncc4n3 27a_100000695172_100000020162 [0,1,0,0,0,1|2,0,0]=4 2460 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3ccc4ncccc4n3 27a_100000695172_100000073381 [0,1,0,0,0,1|2,0,0]=4 2461 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3cnc4ccccc4n3 27a_100000695172_100000756483 [0,1,0,0,0,1|0,0,1]=3 2462 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3cnc4cccnc4n3 27a_100000695172_200010275043 [0,1,0,0,0,1|1,0,1]=4 2463 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3cnc4ncccc4n3 27a_100000695172_100000084304 [0,1,0,0,0,1|1,0,1]=4 2464 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3ncc4ccccc4n3 27a_100000695172_100000097389 [0,1,0,0,0,1|0,0,1]=3 2465 B25R4.2393613 Fc1ccc2c(c1)CCCC2Nc3ncc4cccnc4n3 27a_100000695172_100009875485 [0,1,0,0,0,1|1,0,1]=4 2466 B25R4.2393613 Fc1ccc2c(c1)OCCC2Nc3ccc4ccccc4n3 27a_100015190460_100011291633 [0,1,0,0,0,1|2,0,0]=4 2467 B25R4.2393613 Fc1ccc2c(c1)OCCC2Nc3cnc4ccccc4n3 27a_100015190460_100000756483 [0,1,0,0,0,1|1,0,1]=4 2468 B25R4.2393613 Fc1ccc2c(c1)OCCC2Nc3ncc4ccccc4n3 27a_100015190460_100000097389 [0,1,0,0,0,1|1,0,1]=4 2469 B25R4.4032627 O=c1cc[nH]c2c1cnc(c2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000101246 [0,1,0,0,0,1|2,0,0]=4 2470 B25R4.4032627 Oc1nccc2c1cnc(c2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100020669822 [0,1,0,0,0,1|2,0,0]=4 2471 B25R4.4345885 Cc1cc(nc2c1cccc2)NC3CCCc4c3ccnc4 27a_100020634316_100000184993 [0,1,0,0,0,1|2,0,0]=4 2472 B25R4.4345885 Cc1cc(nc2c1cccc2)NC3CCCc4c3nccc4 27a_100011259139_100000184993 [0,1,0,0,0,1|2,0,0]=4 2473 B25R4.4345885 Cc1cc(nc2c1cccc2)NC3CCOc4c3cccc4 27a_100015190321_100000184993 [0,1,0,0,0,1|2,0,0]=4 2474 B25R4.4345885 Cc1cc(nc2c1cccc2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000184993 [0,1,0,0,0,1|1,0,0]=3 2475 B25R4.4345885 Cc1nc(nc2c1cccc2)NC3CCCc4c3ccnc4 27a_100020634316_100000046098 [0,1,0,0,0,1|1,0,1]=4 2476 B25R4.4345885 Cc1nc(nc2c1cccc2)NC3CCCc4c3nccc4 27a_100011259139_100000046098 [0,1,0,0,0,1|1,0,1]=4 2477 B25R4.4345885 Cc1nc(nc2c1cccc2)NC3CCOc4c3cccc4 27a_100015190321_100000046098 [0,1,0,0,0,1|1,0,1]=4 2478 B25R4.4345885 Cc1nc(nc2c1cccc2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000046098 [0,1,0,0,0,1|0,0,1]=3 2479 B25R4.4345885 Nc1nc(nc2c1cccc2)NC3CCCc4c3ccnc4 27a_100020634316_100000690328 [0,1,0,0,0,1|1,0,1]=4 2480 B25R4.4345885 Nc1nc(nc2c1cccc2)NC3CCCc4c3nccc4 27a_100011259139_100000690328 [0,1,0,0,0,1|1,0,1]=4 2481 B25R4.4345885 Nc1nc(nc2c1cccc2)NC3CCOc4c3cccc4 27a_100015190321_100000690328 [0,1,0,0,0,1|1,0,1]=4 2482 B25R4.4345885 Nc1nc(nc2c1cccc2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000690328 [0,1,0,0,0,1|0,0,1]=3 2483 B25R4.4345885 O=c1cc(nc2n1cccc2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000707704 [0,1,0,0,0,1|2,0,0]=4 2484 B25R4.4345885 Oc1nc(nc2c1cccc2)NC3CCCc4c3ccnc4 27a_100020634316_100000187174 [0,1,0,0,0,1|1,0,1]=4 2485 B25R4.4345885 Oc1nc(nc2c1cccc2)NC3CCCc4c3nccc4 27a_100011259139_100000187174 [0,1,0,0,0,1|1,0,1]=4 2486 B25R4.4345885 Oc1nc(nc2c1cccc2)NC3CCOc4c3cccc4 27a_100015190321_100000187174 [0,1,0,0,0,1|1,0,1]=4 2487 B25R4.4345885 Oc1nc(nc2c1cccc2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000187174 [0,1,0,0,0,1|0,0,1]=3 2488 B25R4.18688465 Cc1ccc2nc(ccc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100011865911 [0,1,0,0,0,1|2,0,0]=4 2489 B25R4.18688465 Cc1ccc2nc(ccc2c1)NC3CCCc4c3nccc4 27a_100011259139_100011865911 [0,1,0,0,0,1|2,0,0]=4 2490 B25R4.18688465 Cc1ccc2nc(ccc2c1)NC3CCOc4c3cccc4 27a_100015190321_100011865911 [0,1,0,0,0,1|2,0,0]=4 2491 B25R4.18688465 Cc1ccc2nc(ccc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100011865911 [0,1,0,0,0,1|1,0,0]=3 2492 B25R4.18688465 Cc1ccc2nc(ccc2n1)N[C@H]3CCCc4c3cccc4 27a_100020654734_200009884078 [0,1,0,0,0,1|2,0,0]=4 2493 B25R4.18688465 Fc1ccc2nc(ccc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100011998705 [0,1,0,0,0,1|2,0,0]=4 2494 B25R4.18688465 Fc1ccc2nc(ccc2c1)NC3CCCc4c3nccc4 27a_100011259139_100011998705 [0,1,0,0,0,1|2,0,0]=4 2495 B25R4.18688465 Fc1ccc2nc(ccc2c1)NC3CCOc4c3cccc4 27a_100015190321_100011998705 [0,1,0,0,0,1|2,0,0]=4 2496 B25R4.18688465 Fc1ccc2nc(ccc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100011998705 [0,1,0,0,0,1|1,0,0]=3 2497 B25R4.18688465 Fc1ccc2nc(cnc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100000098432 [0,1,0,0,0,1|1,0,1]=4 2498 B25R4.18688465 Fc1ccc2nc(cnc2c1)NC3CCCc4c3nccc4 27a_100011259139_100000098432 [0,1,0,0,0,1|1,0,1]=4 2499 B25R4.18688465 Fc1ccc2nc(cnc2c1)NC3CCOc4c3cccc4 27a_100015190321_100000098432 [0,1,0,0,0,1|1,0,1]=4 2500 B25R4.18688465 Fc1ccc2nc(cnc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100000098432 [0,1,0,0,0,1|0,0,1]=3 2501 B25R4.18688465 Nc1ccc2nc(cnc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100009885871 [0,1,0,0,0,1|1,0,1]=4 2502 B25R4.18688465 Nc1ccc2nc(cnc2c1)NC3CCCc4c3nccc4 27a_100011259139_100009885871 [0,1,0,0,0,1|1,0,1]=4 2503 B25R4.18688465 Nc1ccc2nc(cnc2c1)NC3CCOc4c3cccc4 27a_100015190321_100009885871 [0,1,0,0,0,1|1,0,1]=4 2504 B25R4.18688465 Nc1ccc2nc(cnc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100009885871 [0,1,0,0,0,1|0,0,1]=3 2505 B25R4.18688465 Oc1ccc2nc(cnc2c1)NC3CCCc4c3ccnc4 27a_100020634316_200010664160 [0,1,0,0,0,1|1,0,1]=4 2506 B25R4.18688465 Oc1ccc2nc(cnc2c1)NC3CCCc4c3nccc4 27a_100011259139_200010664160 [0,1,0,0,0,1|1,0,1]=4 2507 B25R4.18688465 Oc1ccc2nc(cnc2c1)NC3CCOc4c3cccc4 27a_100015190321_200010664160 [0,1,0,0,0,1|1,0,1]=4 2508 B25R4.18688465 Oc1ccc2nc(cnc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_200010664160 [0,1,0,0,0,1|0,0,1]=3 2509 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3ccc4ccccc4n3 27a_100011742594_100011291633 [0,1,0,0,0,1|1,0,0]=3 2510 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3ccc4cccnc4n3 27a_100011742594_100000075685 [0,1,0,0,0,1|2,0,0]=4 2511 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3ccc4ccncc4n3 27a_100011742594_100000020162 [0,1,0,0,0,1|2,0,0]=4 2512 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3ccc4ncccc4n3 27a_100011742594_100000073381 [0,1,0,0,0,1|2,0,0]=4 2513 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3cnc4ccccc4n3 27a_100011742594_100000756483 [0,1,0,0,0,1|0,0,1]=3 2514 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3cnc4cccnc4n3 27a_100011742594_200010275043 [0,1,0,0,0,1|1,0,1]=4 2515 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3cnc4ncccc4n3 27a_100011742594_100000084304 [0,1,0,0,0,1|1,0,1]=4 2516 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3ncc4ccccc4n3 27a_100011742594_100000097389 [0,1,0,0,0,1|0,0,1]=3 2517 B25R4.18943444 Brc1ccc2c(c1)C(CCC2)Nc3ncc4cccnc4n3 27a_100011742594_100009875485 [0,1,0,0,0,1|1,0,1]=4 2518 B25R4.18943444 Brc1ccc2c(c1)C(CCS2)Nc3ccc4ccccc4n3 27a_100000744474_100011291633 [0,1,0,0,0,1|2,0,0]=4 2519 B25R4.18943444 Brc1ccc2c(c1)C(CCS2)Nc3cnc4ccccc4n3 27a_100000744474_100000756483 [0,1,0,0,0,1|1,0,1]=4 2520 B25R4.18943444 Brc1ccc2c(c1)C(CCS2)Nc3ncc4ccccc4n3 27a_100000744474_100000097389 [0,1,0,0,0,1|1,0,1]=4 2521 B25R4.18943444 Brc1ccc2c(c1)[C@H](CCO2)Nc3ccc4ccccc4n3 27a_100020639276_100011291633 [0,1,0,0,0,1|2,0,0]=4 2522 B25R4.18943444 Brc1ccc2c(c1)[C@H](CCO2)Nc3cnc4ccccc4n3 27a_100020639276_100000756483 [0,1,0,0,0,1|1,0,1]=4 2523 B25R4.18943444 Brc1ccc2c(c1)[C@H](CCO2)Nc3ncc4ccccc4n3 27a_100020639276_100000097389 [0,1,0,0,0,1|1,0,1]=4 2524 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3ccc4ccccc4n3 27a_100015204190_100011291633 [0,1,0,0,0,1|1,0,0]=3 2525 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3ccc4cccnc4n3 27a_100015204190_100000075685 [0,1,0,0,0,1|2,0,0]=4 2526 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3ccc4ccncc4n3 27a_100015204190_100000020162 [0,1,0,0,0,1|2,0,0]=4 2527 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3ccc4ncccc4n3 27a_100015204190_100000073381 [0,1,0,0,0,1|2,0,0]=4 2528 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3cnc4ccccc4n3 27a_100015204190_100000756483 [0,1,0,0,0,1|0,0,1]=3 2529 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3cnc4cccnc4n3 27a_100015204190_200010275043 [0,1,0,0,0,1|1,0,1]=4 2530 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3cnc4ncccc4n3 27a_100015204190_100000084304 [0,1,0,0,0,1|1,0,1]=4 2531 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3ncc4ccccc4n3 27a_100015204190_100000097389 [0,1,0,0,0,1|0,0,1]=3 2532 B25R4.18943444 Cc1ccc2c(c1)C(CCC2)Nc3ncc4cccnc4n3 27a_100015204190_100009875485 [0,1,0,0,0,1|1,0,1]=4 2533 B25R4.18943444 Clc1ccc2c(c1)C(CCO2)Nc3ccc4ccccc4n3 27a_100011264799_100011291633 [0,1,0,0,0,1|2,0,0]=4 2534 B25R4.18943444 Clc1ccc2c(c1)C(CCO2)Nc3cnc4ccccc4n3 27a_100011264799_100000756483 [0,1,0,0,0,1|1,0,1]=4 2535 B25R4.18943444 Clc1ccc2c(c1)C(CCO2)Nc3ncc4ccccc4n3 27a_100011264799_100000097389 [0,1,0,0,0,1|1,0,1]=4 2536 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3ccc4ccccc4n3 27a_100011998213_100011291633 [0,1,0,0,0,1|1,0,0]=3 2537 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3ccc4cccnc4n3 27a_100011998213_100000075685 [0,1,0,0,0,1|2,0,0]=4 2538 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3ccc4ccncc4n3 27a_100011998213_100000020162 [0,1,0,0,0,1|2,0,0]=4 2539 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3ccc4ncccc4n3 27a_100011998213_100000073381 [0,1,0,0,0,1|2,0,0]=4 2540 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3cnc4ccccc4n3 27a_100011998213_100000756483 [0,1,0,0,0,1|0,0,1]=3 2541 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3cnc4cccnc4n3 27a_100011998213_200010275043 [0,1,0,0,0,1|1,0,1]=4 2542 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3cnc4ncccc4n3 27a_100011998213_100000084304 [0,1,0,0,0,1|1,0,1]=4 2543 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3ncc4ccccc4n3 27a_100011998213_100000097389 [0,1,0,0,0,1|0,0,1]=3 2544 B25R4.18943444 Clc1ccc2c(c1)[C@H](CCC2)Nc3ncc4cccnc4n3 27a_100011998213_100009875485 [0,1,0,0,0,1|1,0,1]=4 2545 B25R4.18943444 Fc1ccc2c(c1)C(CCO2)Nc3ccc4ccccc4n3 27a_100000754146_100011291633 [0,1,0,0,0,1|2,0,0]=4 2546 B25R4.18943444 Fc1ccc2c(c1)C(CCO2)Nc3cnc4ccccc4n3 27a_100000754146_100000756483 [0,1,0,0,0,1|1,0,1]=4 2547 B25R4.18943444 Fc1ccc2c(c1)C(CCO2)Nc3ncc4ccccc4n3 27a_100000754146_100000097389 [0,1,0,0,0,1|1,0,1]=4 2548 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3ccc4ccccc4n3 27a_200000724602_100011291633 [0,1,0,0,0,1|1,0,0]=3 2549 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3ccc4cccnc4n3 27a_200000724602_100000075685 [0,1,0,0,0,1|2,0,0]=4 2550 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3ccc4ccncc4n3 27a_200000724602_100000020162 [0,1,0,0,0,1|2,0,0]=4 2551 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3ccc4ncccc4n3 27a_200000724602_100000073381 [0,1,0,0,0,1|2,0,0]=4 2552 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3cnc4ccccc4n3 27a_200000724602_100000756483 [0,1,0,0,0,1|0,0,1]=3 2553 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3cnc4cccnc4n3 27a_200000724602_200010275043 [0,1,0,0,0,1|1,0,1]=4 2554 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3cnc4ncccc4n3 27a_200000724602_100000084304 [0,1,0,0,0,1|1,0,1]=4 2555 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3ncc4ccccc4n3 27a_200000724602_100000097389 [0,1,0,0,0,1|0,0,1]=3 2556 B25R4.18943444 Fc1ccc2c(c1)[C@@H](CCC2)Nc3ncc4cccnc4n3 27a_200000724602_100009875485 [0,1,0,0,0,1|1,0,1]=4 2557 B25R4.43302088 Brc1cccc2c1CCCC2Nc3ccc4ccccc4n3 27a_100020639248_100011291633 [0,1,0,0,0,1|1,0,0]=3 2558 B25R4.43302088 Brc1cccc2c1CCCC2Nc3ccc4cccnc4n3 27a_100020639248_100000075685 [0,1,0,0,0,1|2,0,0]=4 2559 B25R4.43302088 Brc1cccc2c1CCCC2Nc3ccc4ccncc4n3 27a_100020639248_100000020162 [0,1,0,0,0,1|2,0,0]=4 2560 B25R4.43302088 Brc1cccc2c1CCCC2Nc3ccc4ncccc4n3 27a_100020639248_100000073381 [0,1,0,0,0,1|2,0,0]=4 2561 B25R4.43302088 Brc1cccc2c1CCCC2Nc3cnc4ccccc4n3 27a_100020639248_100000756483 [0,1,0,0,0,1|0,0,1]=3 2562 B25R4.43302088 Brc1cccc2c1CCCC2Nc3cnc4cccnc4n3 27a_100020639248_200010275043 [0,1,0,0,0,1|1,0,1]=4 2563 B25R4.43302088 Brc1cccc2c1CCCC2Nc3cnc4ncccc4n3 27a_100020639248_100000084304 [0,1,0,0,0,1|1,0,1]=4 2564 B25R4.43302088 Brc1cccc2c1CCCC2Nc3ncc4ccccc4n3 27a_100020639248_100000097389 [0,1,0,0,0,1|0,0,1]=3 2565 B25R4.43302088 Brc1cccc2c1CCCC2Nc3ncc4cccnc4n3 27a_100020639248_100009875485 [0,1,0,0,0,1|1,0,1]=4 2566 B25R4.43302088 Brc1cccc2c1OCCC2Nc3ccc4ccccc4n3 27a_100000727345_100011291633 [0,1,0,0,0,1|2,0,0]=4 2567 B25R4.43302088 Brc1cccc2c1OCCC2Nc3cnc4ccccc4n3 27a_100000727345_100000756483 [0,1,0,0,0,1|1,0,1]=4 2568 B25R4.43302088 Brc1cccc2c1OCCC2Nc3ncc4ccccc4n3 27a_100000727345_100000097389 [0,1,0,0,0,1|1,0,1]=4 2569 B25R4.43302088 Cc1cccc2c1OCC[C@H]2Nc3ccc4ccccc4n3 27a_100000717741_100011291633 [0,1,0,0,0,1|2,0,0]=4 2570 B25R4.43302088 Cc1cccc2c1OCC[C@H]2Nc3cnc4ccccc4n3 27a_100000717741_100000756483 [0,1,0,0,0,1|1,0,1]=4 2571 B25R4.43302088 Cc1cccc2c1OCC[C@H]2Nc3ncc4ccccc4n3 27a_100000717741_100000097389 [0,1,0,0,0,1|1,0,1]=4 2572 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3ccc4ccccc4n3 27a_100025717364_100011291633 [0,1,0,0,0,1|1,0,0]=3 2573 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3ccc4cccnc4n3 27a_100025717364_100000075685 [0,1,0,0,0,1|2,0,0]=4 2574 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3ccc4ccncc4n3 27a_100025717364_100000020162 [0,1,0,0,0,1|2,0,0]=4 2575 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3ccc4ncccc4n3 27a_100025717364_100000073381 [0,1,0,0,0,1|2,0,0]=4 2576 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3cnc4ccccc4n3 27a_100025717364_100000756483 [0,1,0,0,0,1|0,0,1]=3 2577 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3cnc4cccnc4n3 27a_100025717364_200010275043 [0,1,0,0,0,1|1,0,1]=4 2578 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3cnc4ncccc4n3 27a_100025717364_100000084304 [0,1,0,0,0,1|1,0,1]=4 2579 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3ncc4ccccc4n3 27a_100025717364_100000097389 [0,1,0,0,0,1|0,0,1]=3 2580 B25R4.43302088 Clc1cccc2c1CCC[C@H]2Nc3ncc4cccnc4n3 27a_100025717364_100009875485 [0,1,0,0,0,1|1,0,1]=4 2581 B25R4.43302088 Fc1cccc2c1CCCC2Nc3ccc4ccccc4n3 27a_100000085590_100011291633 [0,1,0,0,0,1|1,0,0]=3 2582 B25R4.43302088 Fc1cccc2c1CCCC2Nc3ccc4cccnc4n3 27a_100000085590_100000075685 [0,1,0,0,0,1|2,0,0]=4 2583 B25R4.43302088 Fc1cccc2c1CCCC2Nc3ccc4ccncc4n3 27a_100000085590_100000020162 [0,1,0,0,0,1|2,0,0]=4 2584 B25R4.43302088 Fc1cccc2c1CCCC2Nc3ccc4ncccc4n3 27a_100000085590_100000073381 [0,1,0,0,0,1|2,0,0]=4 2585 B25R4.43302088 Fc1cccc2c1CCCC2Nc3cnc4ccccc4n3 27a_100000085590_100000756483 [0,1,0,0,0,1|0,0,1]=3 2586 B25R4.43302088 Fc1cccc2c1CCCC2Nc3cnc4cccnc4n3 27a_100000085590_200010275043 [0,1,0,0,0,1|1,0,1]=4 2587 B25R4.43302088 Fc1cccc2c1CCCC2Nc3cnc4ncccc4n3 27a_100000085590_100000084304 [0,1,0,0,0,1|1,0,1]=4 2588 B25R4.43302088 Fc1cccc2c1CCCC2Nc3ncc4ccccc4n3 27a_100000085590_100000097389 [0,1,0,0,0,1|0,0,1]=3 2589 B25R4.43302088 Fc1cccc2c1CCCC2Nc3ncc4cccnc4n3 27a_100000085590_100009875485 [0,1,0,0,0,1|1,0,1]=4 2590 B25R4.43302088 Fc1cccc2c1OCCC2Nc3ccc4ccccc4n3 27a_100000746867_100011291633 [0,1,0,0,0,1|2,0,0]=4 2591 B25R4.43302088 Fc1cccc2c1OCCC2Nc3cnc4ccccc4n3 27a_100000746867_100000756483 [0,1,0,0,0,1|1,0,1]=4 2592 B25R4.43302088 Fc1cccc2c1OCCC2Nc3ncc4ccccc4n3 27a_100000746867_100000097389 [0,1,0,0,0,1|1,0,1]=4 2593 B25R4.43328204 Cc1cccc2c1nc(cc2)NC3CCCc4c3ccnc4 27a_100020634316_100012002297 [0,1,0,0,0,1|2,0,0]=4 2594 B25R4.43328204 Cc1cccc2c1nc(cc2)NC3CCCc4c3nccc4 27a_100011259139_100012002297 [0,1,0,0,0,1|2,0,0]=4 2595 B25R4.43328204 Cc1cccc2c1nc(cc2)NC3CCOc4c3cccc4 27a_100015190321_100012002297 [0,1,0,0,0,1|2,0,0]=4 2596 B25R4.43328204 Cc1cccc2c1nc(cc2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100012002297 [0,1,0,0,0,1|1,0,0]=3 2597 B25R4.43328204 Oc1cccc2c1nc(cc2)NC3CCCc4c3ccnc4 27a_100020634316_100010153751 [0,1,0,0,0,1|2,0,0]=4 2598 B25R4.43328204 Oc1cccc2c1nc(cc2)NC3CCCc4c3nccc4 27a_100011259139_100010153751 [0,1,0,0,0,1|2,0,0]=4 2599 B25R4.43328204 Oc1cccc2c1nc(cc2)NC3CCOc4c3cccc4 27a_100015190321_100010153751 [0,1,0,0,0,1|2,0,0]=4 2600 B25R4.43328204 Oc1cccc2c1nc(cc2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010153751 [0,1,0,0,0,1|1,0,0]=3 2601 B25R4.366775480 Fc1cccc2c1C(CCO2)Nc3ccc4ccccc4n3 27a_100009881269_100011291633 [0,1,0,0,0,1|2,0,0]=4 2602 B25R4.366775480 Fc1cccc2c1C(CCO2)Nc3cnc4ccccc4n3 27a_100009881269_100000756483 [0,1,0,0,0,1|1,0,1]=4 2603 B25R4.366775480 Fc1cccc2c1C(CCO2)Nc3ncc4ccccc4n3 27a_100009881269_100000097389 [0,1,0,0,0,1|1,0,1]=4 2604 B25R4.3021974 Cn1c(nc2c1cccc2)CN3CCCc4ccccc4C3 2230a_100000059810_100000748711 [0,1,0,0,0,1|2,0,0]=4 2605 B25R4.3021974 Cn1c(nc2c1cccc2)CN3CCCc4ccccc4C3 269982a_100000059810_100000748711 [0,1,0,0,0,1|2,0,0]=4 2606 B25R4.3021974 Cn1c(nc2c1cccc2)CN3CCCc4ccccc4C3 270004a_100000059810_100000188960 [0,1,0,0,0,1|2,0,0]=4 2607 B25R4.3021974 Cn1c(nc2c1cccc2)CN3CCCc4ccccc4C3 34a_100000059810_100000748711 [0,1,0,0,0,1|2,0,0]=4 2608 B25R4.6384223 CC(c1nc2ccccc2[nH]1)N3CCCc4ccccc4C3 270004a_100000059810_100000199114 [0,1,0,0,0,1|2,0,0]=4 2609 B25R4.246172672 Brc1ccc2[nH]c(nc2c1)CN3CCCc4ccccc4C3 2230a_100000059810_100000701424 [0,1,0,0,0,1|2,0,0]=4 2610 B25R4.246172672 Brc1ccc2[nH]c(nc2c1)CN3CCCc4ccccc4C3 269982a_100000059810_100000701424 [0,1,0,0,0,1|2,0,0]=4 2611 B25R4.246172672 Brc1ccc2[nH]c(nc2c1)CN3CCCc4ccccc4C3 34a_100000059810_100000701424 [0,1,0,0,0,1|2,0,0]=4 2612 B25R4.246172672 Brc1ccc2nc([nH]c2c1)CN3CCCc4ccccc4C3 270004a_100000059810_200011361486 [0,1,0,0,0,1|2,0,0]=4 2613 B25R4.246172672 Cc1ccc2nc([nH]c2c1)CN3CCCc4ccccc4C3 2230a_100000059810_100020603265 [0,1,0,0,0,1|2,0,0]=4 2614 B25R4.246172672 Cc1ccc2nc([nH]c2c1)CN3CCCc4ccccc4C3 269982a_100000059810_100020603265 [0,1,0,0,0,1|2,0,0]=4 2615 B25R4.246172672 Cc1ccc2nc([nH]c2c1)CN3CCCc4ccccc4C3 34a_100000059810_100020603265 [0,1,0,0,0,1|2,0,0]=4 2616 B25R4.246172672 Clc1ccc2[nH]c(nc2c1)CN3CCCc4ccccc4C3 2230a_100000059810_100000179801 [0,1,0,0,0,1|2,0,0]=4 2617 B25R4.246172672 Clc1ccc2[nH]c(nc2c1)CN3CCCc4ccccc4C3 269982a_100000059810_100000179801 [0,1,0,0,0,1|2,0,0]=4 2618 B25R4.246172672 Fc1ccc2[nH]c(nc2c1)CN3CCCc4ccccc4C3 270004a_100000059810_200011915233 [0,1,0,0,0,1|2,0,0]=4 2619 B25R4.246172672 Fc1ccc2nc([nH]c2c1)CN3CCCc4ccccc4C3 2230a_100000059810_200011347187 [0,1,0,0,0,1|2,0,0]=4 2620 B25R4.246172672 Fc1ccc2nc([nH]c2c1)CN3CCCc4ccccc4C3 269982a_100000059810_200011347187 [0,1,0,0,0,1|2,0,0]=4 2621 B25R4.18135 COc1ccc2c(c1)CCCC2Nc3nc4ccccc4[nH]3 27a_100011207993_100009814255 [0,2,0,0,0,0|0,0,0]=2 2622 B25R4.18135 COc1ccc2c(c1)CCCC2Nc3nc4ccccc4s3 27a_100011207993_100000751744 [0,2,0,0,0,0|1,0,0]=3 2623 B25R4.18135 COc1ccc2c(c1)CCCC2Nc3nc4cccnc4s3 27a_100011207993_100010188088 [0,2,0,0,0,0|2,0,0]=4 2624 B25R4.2368071 Cc1ccc2nc(sc2c1)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_100010186437 [0,2,0,0,0,0|1,0,0]=3 2625 B25R4.2368071 Cc1ccc2nc(sc2c1)NC3CCCc4c3ccc(c4)F 27a_100000695172_100010186437 [0,2,0,0,0,0|1,0,0]=3 2626 B25R4.2368071 Cc1ccc2nc(sc2c1)NC3CCOc4c3ccc(c4)F 27a_100015190460_100010186437 [0,2,0,0,0,0|2,0,0]=4 2627 B25R4.2368071 Cc1ccc2nc(sc2c1)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_100010186437 [0,2,0,0,0,0|2,0,0]=4 2628 B25R4.2368071 Cc1ccc2nc(sc2c1)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_100010186437 [0,2,0,0,0,0|1,0,0]=3 2629 B25R4.2368071 Fc1ccc2c(c1)CCCC2Nc3nc4cc(ccc4s3)F 27a_100000695172_200010206605 [0,2,0,0,0,0|1,0,0]=3 2630 B25R4.2368071 Fc1ccc2c(c1)CCCC2Nc3nc4ccc(cc4s3)F 27a_100000695172_100000751617 [0,2,0,0,0,0|1,0,0]=3 2631 B25R4.2368071 Fc1ccc2c(c1)CCCC2Nc3nc4ccc(nc4s3)F 27a_100000695172_200010738066 [0,2,0,0,0,0|2,0,0]=4 2632 B25R4.2368071 Fc1ccc2c(c1)OCCC2Nc3nc4cc(ccc4s3)F 27a_100015190460_200010206605 [0,2,0,0,0,0|2,0,0]=4 2633 B25R4.2368071 Fc1ccc2c(c1)OCCC2Nc3nc4ccc(cc4s3)F 27a_100015190460_100000751617 [0,2,0,0,0,0|2,0,0]=4 2634 B25R4.2368071 Fc1ccc2nc(sc2c1)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_100000751617 [0,2,0,0,0,0|1,0,0]=3 2635 B25R4.2368071 Fc1ccc2nc(sc2c1)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_100000751617 [0,2,0,0,0,0|2,0,0]=4 2636 B25R4.2368071 Fc1ccc2nc(sc2c1)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_100000751617 [0,2,0,0,0,0|1,0,0]=3 2637 B25R4.2368071 Fc1ccc2nc(sc2n1)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_200010738066 [0,2,0,0,0,0|2,0,0]=4 2638 B25R4.2368071 Fc1ccc2nc(sc2n1)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_200010738066 [0,2,0,0,0,0|2,0,0]=4 2639 B25R4.2368071 Fc1ccc2sc(nc2c1)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_200010206605 [0,2,0,0,0,0|1,0,0]=3 2640 B25R4.2368071 Fc1ccc2sc(nc2c1)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_200010206605 [0,2,0,0,0,0|2,0,0]=4 2641 B25R4.2368071 Fc1ccc2sc(nc2c1)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_200010206605 [0,2,0,0,0,0|1,0,0]=3 2642 B25R4.2368071 Nc1ccc2nc(sc2c1)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_100010253933 [0,2,0,0,0,0|1,0,0]=3 2643 B25R4.2368071 Nc1ccc2nc(sc2c1)NC3CCCc4c3ccc(c4)F 27a_100000695172_100010253933 [0,2,0,0,0,0|1,0,0]=3 2644 B25R4.2368071 Nc1ccc2nc(sc2c1)NC3CCOc4c3ccc(c4)F 27a_100015190460_100010253933 [0,2,0,0,0,0|2,0,0]=4 2645 B25R4.2368071 Nc1ccc2nc(sc2c1)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_100010253933 [0,2,0,0,0,0|2,0,0]=4 2646 B25R4.2368071 Nc1ccc2nc(sc2c1)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_100010253933 [0,2,0,0,0,0|1,0,0]=3 2647 B25R4.2368071 Nc1ccc2sc(nc2c1)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_100010329861 [0,2,0,0,0,0|1,0,0]=3 2648 B25R4.2368071 Nc1ccc2sc(nc2c1)NC3CCCc4c3ccc(c4)F 27a_100000695172_100010329861 [0,2,0,0,0,0|1,0,0]=3 2649 B25R4.2368071 Nc1ccc2sc(nc2c1)NC3CCOc4c3ccc(c4)F 27a_100015190460_100010329861 [0,2,0,0,0,0|2,0,0]=4 2650 B25R4.2368071 Nc1ccc2sc(nc2c1)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_100010329861 [0,2,0,0,0,0|2,0,0]=4 2651 B25R4.2368071 Nc1ccc2sc(nc2c1)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_100010329861 [0,2,0,0,0,0|1,0,0]=3 2652 B25R4.2368071 Oc1ccc2nc(sc2c1)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_100010063415 [0,2,0,0,0,0|1,0,0]=3 2653 B25R4.2368071 Oc1ccc2nc(sc2c1)NC3CCCc4c3ccc(c4)F 27a_100000695172_100010063415 [0,2,0,0,0,0|1,0,0]=3 2654 B25R4.2368071 Oc1ccc2nc(sc2c1)NC3CCOc4c3ccc(c4)F 27a_100015190460_100010063415 [0,2,0,0,0,0|2,0,0]=4 2655 B25R4.2368071 Oc1ccc2nc(sc2c1)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_100010063415 [0,2,0,0,0,0|2,0,0]=4 2656 B25R4.2368071 Oc1ccc2nc(sc2c1)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_100010063415 [0,2,0,0,0,0|1,0,0]=3 2657 B25R4.2393589 Cn1c(nc2c1cccc2)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_200000239431 [0,2,0,0,0,0|0,0,0]=2 2658 B25R4.2393589 Cn1c(nc2c1cccc2)NC3CCCc4c3ccc(c4)F 27a_100000695172_200000239431 [0,2,0,0,0,0|0,0,0]=2 2659 B25R4.2393589 Cn1c(nc2c1cccc2)NC3CCOc4c3ccc(c4)F 27a_100015190460_200000239431 [0,2,0,0,0,0|1,0,0]=3 2660 B25R4.2393589 Cn1c(nc2c1cccc2)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_200000239431 [0,2,0,0,0,0|1,0,0]=3 2661 B25R4.2393589 Cn1c(nc2c1cccc2)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_200000239431 [0,2,0,0,0,0|0,0,0]=2 2662 B25R4.2393635 Cc1cccc2c1nc(s2)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_100010008827 [0,2,0,0,0,0|1,0,0]=3 2663 B25R4.2393635 Cc1cccc2c1nc(s2)NC3CCCc4c3ccc(c4)F 27a_100000695172_100010008827 [0,2,0,0,0,0|1,0,0]=3 2664 B25R4.2393635 Cc1cccc2c1nc(s2)NC3CCOc4c3ccc(c4)F 27a_100015190460_100010008827 [0,2,0,0,0,0|2,0,0]=4 2665 B25R4.2393635 Cc1cccc2c1nc(s2)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_100010008827 [0,2,0,0,0,0|2,0,0]=4 2666 B25R4.2393635 Cc1cccc2c1nc(s2)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_100010008827 [0,2,0,0,0,0|1,0,0]=3 2667 B25R4.2393635 Fc1ccc2c(c1)CCCC2Nc3nc4c(cccc4s3)F 27a_100000695172_100010008856 [0,2,0,0,0,0|1,0,0]=3 2668 B25R4.2393635 Fc1ccc2c(c1)OCCC2Nc3nc4c(cccc4s3)F 27a_100015190460_100010008856 [0,2,0,0,0,0|2,0,0]=4 2669 B25R4.2393635 Fc1cccc2c1nc(s2)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_100010008856 [0,2,0,0,0,0|1,0,0]=3 2670 B25R4.2393635 Fc1cccc2c1nc(s2)N[C@@H]3CCOc4c3ccc(c4)Br 27a_100020639266_100010008856 [0,2,0,0,0,0|2,0,0]=4 2671 B25R4.2393635 Fc1cccc2c1nc(s2)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_100010008856 [0,2,0,0,0,0|1,0,0]=3 2672 B25R4.2393635 Nc1ncnc2c1[nH]c(n2)NC3CCCc4c3ccc(c4)Cl 27a_100025717365_100009817290 [0,2,0,0,0,0|2,0,0]=4 2673 B25R4.2393635 Nc1ncnc2c1[nH]c(n2)NC3CCCc4c3ccc(c4)F 27a_100000695172_100009817290 [0,2,0,0,0,0|2,0,0]=4 2674 B25R4.2393635 Nc1ncnc2c1[nH]c(n2)N[C@H]3CCCc4c3ccc(c4)Br 27a_100160469487_100009817290 [0,2,0,0,0,0|2,0,0]=4 2675 B25R4.4537448 Fc1cc2c(cc1F)[C@H](CCO2)Nc3nc4ccccc4[nH]3 27a_100016159608_100009814255 [0,2,0,0,0,0|1,0,0]=3 2676 B25R4.4537448 Fc1cc2c(cc1F)[C@H](CCO2)Nc3nc4ccccc4s3 27a_100016159608_100000751744 [0,2,0,0,0,0|2,0,0]=4 2677 B25R4.27990514 Fc1cc(c2c(c1)OCCC2Nc3nc4ccccc4[nH]3)F 27a_100011749293_100009814255 [0,2,0,0,0,0|1,0,0]=3 2678 B25R4.27990514 Fc1cc(c2c(c1)OCCC2Nc3nc4ccccc4s3)F 27a_100011749293_100000751744 [0,2,0,0,0,0|2,0,0]=4 2679 B25R4.47062659 Fc1ccc2c(c1F)OCCC2Nc3nc4ccccc4[nH]3 27a_100011799186_100009814255 [0,2,0,0,0,0|1,0,0]=3 2680 B25R4.47062659 Fc1ccc2c(c1F)OCCC2Nc3nc4ccccc4s3 27a_100011799186_100000751744 [0,2,0,0,0,0|2,0,0]=4 2681 B25R4.3018538 CN(c1nc2ccccc2n1C)C3CCCc4c3cccc4 27a_100000185324_200000239431 [0,2,0,0,0,0|0,0,0]=2 2682 B25R4.18943420 Cc1ccc2c(c1)C(CCC2)Nc3nc4ccccc4n3C 27a_100015204190_200000239431 [0,2,0,0,0,0|0,0,0]=2 2683 B25R4.18943420 Cn1c(nc2c1cccc2)NC3CCCc4c3cc(cc4)Br 27a_100011742594_200000239431 [0,2,0,0,0,0|0,0,0]=2 2684 B25R4.18943420 Cn1c(nc2c1cccc2)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_200000239431 [0,2,0,0,0,0|1,0,0]=3 2685 B25R4.18943420 Cn1c(nc2c1cccc2)NC3CCOc4c3cc(cc4)F 27a_100000754146_200000239431 [0,2,0,0,0,0|1,0,0]=3 2686 B25R4.18943420 Cn1c(nc2c1cccc2)NC3CCSc4c3cc(cc4)Br 27a_100000744474_200000239431 [0,2,0,0,0,0|1,0,0]=3 2687 B25R4.18943420 Cn1c(nc2c1cccc2)N[C@@H]3CCCc4c3cc(cc4)F 27a_200000724602_200000239431 [0,2,0,0,0,0|0,0,0]=2 2688 B25R4.18943420 Cn1c(nc2c1cccc2)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_200000239431 [0,2,0,0,0,0|0,0,0]=2 2689 B25R4.18943420 Cn1c(nc2c1cccc2)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_200000239431 [0,2,0,0,0,0|1,0,0]=3 2690 B25R4.43302066 Cc1cccc2c1OCC[C@H]2Nc3nc4ccccc4n3C 27a_100000717741_200000239431 [0,2,0,0,0,0|1,0,0]=3 2691 B25R4.43302066 Cn1c(nc2c1cccc2)NC3CCCc4c3cccc4Br 27a_100020639248_200000239431 [0,2,0,0,0,0|0,0,0]=2 2692 B25R4.43302066 Cn1c(nc2c1cccc2)NC3CCCc4c3cccc4F 27a_100000085590_200000239431 [0,2,0,0,0,0|0,0,0]=2 2693 B25R4.43302066 Cn1c(nc2c1cccc2)NC3CCOc4c3cccc4Br 27a_100000727345_200000239431 [0,2,0,0,0,0|1,0,0]=3 2694 B25R4.43302066 Cn1c(nc2c1cccc2)NC3CCOc4c3cccc4F 27a_100000746867_200000239431 [0,2,0,0,0,0|1,0,0]=3 2695 B25R4.43302066 Cn1c(nc2c1cccc2)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_200000239431 [0,2,0,0,0,0|0,0,0]=2 2696 B25R4.366775459 Cn1c(nc2c1cccc2)NC3CCOc4c3c(ccc4)F 27a_100009881269_200000239431 [0,2,0,0,0,0|1,0,0]=3 2697 B25R4.20006378 CC1(CC(c2ccccc2O1)Nc3nc4ccccc4[nH]3)C 27a_100000686917_100009814255 [0,2,0,0,0,0|1,0,0]=3 2698 B25R4.20006378 CC1(CC(c2ccccc2O1)Nc3nc4ccccc4s3)C 27a_100000686917_100000751744 [0,2,0,0,0,0|2,0,0]=4 2699 B25R4.20006378 O=S1(=O)Cc2ccccc2C(C1)Nc3nc4ccccc4[nH]3 27a_100015190536_100009814255 [0,2,0,0,0,0|1,0,0]=3 2700 B25R4.20006378 O=S1(=O)Cc2ccccc2C(C1)Nc3nc4ccccc4s3 27a_100015190536_100000751744 [0,2,0,0,0,0|2,0,0]=4 2701 B25R4.1804533 COc1ccc2c(c1)C(CCO2)Nc3nc4ccccc4[nH]3 27a_100015190458_100009814255 [0,2,0,0,0,0|1,0,0]=3 2702 B25R4.1804533 COc1ccc2c(c1)C(CCO2)Nc3nc4ccccc4s3 27a_100015190458_100000751744 [0,2,0,0,0,0|2,0,0]=4 2703 B25R4.18943466 Cc1ccc2c(c1)C(CCC2)Nc3nc4c(cccc4s3)C 27a_100015204190_100010008827 [0,2,0,0,0,0|1,0,0]=3 2704 B25R4.18943466 Cc1ccc2c(c1)C(CCC2)Nc3nc4c(cccc4s3)F 27a_100015204190_100010008856 [0,2,0,0,0,0|1,0,0]=3 2705 B25R4.18943466 Cc1ccc2c(c1)C(CCC2)Nc3nc4ncnc(c4[nH]3)N 27a_100015204190_100009817290 [0,2,0,0,0,0|2,0,0]=4 2706 B25R4.18943466 Cc1cccc2c1nc(s2)NC3CCCc4c3cc(cc4)Br 27a_100011742594_100010008827 [0,2,0,0,0,0|1,0,0]=3 2707 B25R4.18943466 Cc1cccc2c1nc(s2)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_100010008827 [0,2,0,0,0,0|2,0,0]=4 2708 B25R4.18943466 Cc1cccc2c1nc(s2)NC3CCOc4c3cc(cc4)F 27a_100000754146_100010008827 [0,2,0,0,0,0|2,0,0]=4 2709 B25R4.18943466 Cc1cccc2c1nc(s2)N[C@@H]3CCCc4c3cc(cc4)F 27a_200000724602_100010008827 [0,2,0,0,0,0|1,0,0]=3 2710 B25R4.18943466 Cc1cccc2c1nc(s2)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_100010008827 [0,2,0,0,0,0|1,0,0]=3 2711 B25R4.18943466 Cc1cccc2c1nc(s2)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_100010008827 [0,2,0,0,0,0|2,0,0]=4 2712 B25R4.18943466 Fc1ccc2c(c1)C(CCO2)Nc3nc4c(cccc4s3)F 27a_100000754146_100010008856 [0,2,0,0,0,0|2,0,0]=4 2713 B25R4.18943466 Fc1ccc2c(c1)[C@@H](CCC2)Nc3nc4c(cccc4s3)F 27a_200000724602_100010008856 [0,2,0,0,0,0|1,0,0]=3 2714 B25R4.18943466 Fc1cccc2c1nc(s2)NC3CCCc4c3cc(cc4)Br 27a_100011742594_100010008856 [0,2,0,0,0,0|1,0,0]=3 2715 B25R4.18943466 Fc1cccc2c1nc(s2)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_100010008856 [0,2,0,0,0,0|2,0,0]=4 2716 B25R4.18943466 Fc1cccc2c1nc(s2)NC3CCSc4c3cc(cc4)Br 27a_100000744474_100010008856 [0,2,0,0,0,0|2,0,0]=4 2717 B25R4.18943466 Fc1cccc2c1nc(s2)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_100010008856 [0,2,0,0,0,0|1,0,0]=3 2718 B25R4.18943466 Fc1cccc2c1nc(s2)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_100010008856 [0,2,0,0,0,0|2,0,0]=4 2719 B25R4.18943466 Nc1ncnc2c1[nH]c(n2)NC3CCCc4c3cc(cc4)Br 27a_100011742594_100009817290 [0,2,0,0,0,0|2,0,0]=4 2720 B25R4.18943466 Nc1ncnc2c1[nH]c(n2)N[C@@H]3CCCc4c3cc(cc4)F 27a_200000724602_100009817290 [0,2,0,0,0,0|2,0,0]=4 2721 B25R4.18943466 Nc1ncnc2c1[nH]c(n2)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_100009817290 [0,2,0,0,0,0|2,0,0]=4 2722 B25R4.50440239 Cc1cc(cc2c1OCCC2Nc3nc4ccccc4[nH]3)F 27a_100012004503_100009814255 [0,2,0,0,0,0|1,0,0]=3 2723 B25R4.50440239 Cc1cc(cc2c1OCCC2Nc3nc4ccccc4s3)F 27a_100012004503_100000751744 [0,2,0,0,0,0|2,0,0]=4 2724 B25R4.50440239 Fc1cc(c2c(c1)C(CCC2)Nc3nc4ccccc4[nH]3)F 27a_100011742606_100009814255 [0,2,0,0,0,0|0,0,0]=2 2725 B25R4.50440239 Fc1cc(c2c(c1)C(CCC2)Nc3nc4ccccc4s3)F 27a_100011742606_100000751744 [0,2,0,0,0,0|1,0,0]=3 2726 B25R4.50440239 Fc1cc(c2c(c1)C(CCC2)Nc3nc4cccnc4s3)F 27a_100011742606_100010188088 [0,2,0,0,0,0|2,0,0]=4 2727 B25R4.50440239 Fc1cc(c2c(c1)C(CCO2)Nc3nc4ccccc4[nH]3)Cl 27a_100011382876_100009814255 [0,2,0,0,0,0|1,0,0]=3 2728 B25R4.50440239 Fc1cc(c2c(c1)C(CCO2)Nc3nc4ccccc4s3)Cl 27a_100011382876_100000751744 [0,2,0,0,0,0|2,0,0]=4 2729 B25R4.1737809990 Cc1ccc2c(c1)C(CCC2)Nc3nc4cc(ccc4s3)F 27a_100015204190_200010206605 [0,2,0,0,0,0|1,0,0]=3 2730 B25R4.1737809990 Cc1ccc2c(c1)C(CCC2)Nc3nc4cc(ccc4s3)N 27a_100015204190_100010329861 [0,2,0,0,0,0|1,0,0]=3 2731 B25R4.1737809990 Cc1ccc2c(c1)C(CCC2)Nc3nc4ccc(cc4s3)C 27a_100015204190_100010186437 [0,2,0,0,0,0|1,0,0]=3 2732 B25R4.1737809990 Cc1ccc2c(c1)C(CCC2)Nc3nc4ccc(cc4s3)F 27a_100015204190_100000751617 [0,2,0,0,0,0|1,0,0]=3 2733 B25R4.1737809990 Cc1ccc2c(c1)C(CCC2)Nc3nc4ccc(cc4s3)N 27a_100015204190_100010253933 [0,2,0,0,0,0|1,0,0]=3 2734 B25R4.1737809990 Cc1ccc2c(c1)C(CCC2)Nc3nc4ccc(cc4s3)O 27a_100015204190_100010063415 [0,2,0,0,0,0|1,0,0]=3 2735 B25R4.1737809990 Cc1ccc2c(c1)C(CCC2)Nc3nc4ccc(nc4s3)F 27a_100015204190_200010738066 [0,2,0,0,0,0|2,0,0]=4 2736 B25R4.1737809990 Cc1ccc2nc(sc2c1)NC3CCCc4c3cc(cc4)Br 27a_100011742594_100010186437 [0,2,0,0,0,0|1,0,0]=3 2737 B25R4.1737809990 Cc1ccc2nc(sc2c1)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_100010186437 [0,2,0,0,0,0|2,0,0]=4 2738 B25R4.1737809990 Cc1ccc2nc(sc2c1)NC3CCOc4c3cc(cc4)F 27a_100000754146_100010186437 [0,2,0,0,0,0|2,0,0]=4 2739 B25R4.1737809990 Cc1ccc2nc(sc2c1)N[C@@H]3CCCc4c3cc(cc4)F 27a_200000724602_100010186437 [0,2,0,0,0,0|1,0,0]=3 2740 B25R4.1737809990 Cc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_100010186437 [0,2,0,0,0,0|1,0,0]=3 2741 B25R4.1737809990 Cc1ccc2nc(sc2c1)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_100010186437 [0,2,0,0,0,0|2,0,0]=4 2742 B25R4.1737809990 Fc1ccc2c(c1)C(CCO2)Nc3nc4cc(ccc4s3)F 27a_100000754146_200010206605 [0,2,0,0,0,0|2,0,0]=4 2743 B25R4.1737809990 Fc1ccc2c(c1)C(CCO2)Nc3nc4ccc(cc4s3)F 27a_100000754146_100000751617 [0,2,0,0,0,0|2,0,0]=4 2744 B25R4.1737809990 Fc1ccc2c(c1)[C@@H](CCC2)Nc3nc4cc(ccc4s3)F 27a_200000724602_200010206605 [0,2,0,0,0,0|1,0,0]=3 2745 B25R4.1737809990 Fc1ccc2c(c1)[C@@H](CCC2)Nc3nc4ccc(cc4s3)F 27a_200000724602_100000751617 [0,2,0,0,0,0|1,0,0]=3 2746 B25R4.1737809990 Fc1ccc2c(c1)[C@@H](CCC2)Nc3nc4ccc(nc4s3)F 27a_200000724602_200010738066 [0,2,0,0,0,0|2,0,0]=4 2747 B25R4.1737809990 Fc1ccc2nc(sc2c1)NC3CCCc4c3cc(cc4)Br 27a_100011742594_100000751617 [0,2,0,0,0,0|1,0,0]=3 2748 B25R4.1737809990 Fc1ccc2nc(sc2c1)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_100000751617 [0,2,0,0,0,0|2,0,0]=4 2749 B25R4.1737809990 Fc1ccc2nc(sc2c1)NC3CCSc4c3cc(cc4)Br 27a_100000744474_100000751617 [0,2,0,0,0,0|2,0,0]=4 2750 B25R4.1737809990 Fc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_100000751617 [0,2,0,0,0,0|1,0,0]=3 2751 B25R4.1737809990 Fc1ccc2nc(sc2c1)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_100000751617 [0,2,0,0,0,0|2,0,0]=4 2752 B25R4.1737809990 Fc1ccc2nc(sc2n1)NC3CCCc4c3cc(cc4)Br 27a_100011742594_200010738066 [0,2,0,0,0,0|2,0,0]=4 2753 B25R4.1737809990 Fc1ccc2nc(sc2n1)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_200010738066 [0,2,0,0,0,0|2,0,0]=4 2754 B25R4.1737809990 Fc1ccc2sc(nc2c1)NC3CCCc4c3cc(cc4)Br 27a_100011742594_200010206605 [0,2,0,0,0,0|1,0,0]=3 2755 B25R4.1737809990 Fc1ccc2sc(nc2c1)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_200010206605 [0,2,0,0,0,0|2,0,0]=4 2756 B25R4.1737809990 Fc1ccc2sc(nc2c1)NC3CCSc4c3cc(cc4)Br 27a_100000744474_200010206605 [0,2,0,0,0,0|2,0,0]=4 2757 B25R4.1737809990 Fc1ccc2sc(nc2c1)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_200010206605 [0,2,0,0,0,0|1,0,0]=3 2758 B25R4.1737809990 Fc1ccc2sc(nc2c1)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_200010206605 [0,2,0,0,0,0|2,0,0]=4 2759 B25R4.1737809990 Nc1ccc2nc(sc2c1)NC3CCCc4c3cc(cc4)Br 27a_100011742594_100010253933 [0,2,0,0,0,0|1,0,0]=3 2760 B25R4.1737809990 Nc1ccc2nc(sc2c1)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_100010253933 [0,2,0,0,0,0|2,0,0]=4 2761 B25R4.1737809990 Nc1ccc2nc(sc2c1)NC3CCOc4c3cc(cc4)F 27a_100000754146_100010253933 [0,2,0,0,0,0|2,0,0]=4 2762 B25R4.1737809990 Nc1ccc2nc(sc2c1)NC3CCSc4c3cc(cc4)Br 27a_100000744474_100010253933 [0,2,0,0,0,0|2,0,0]=4 2763 B25R4.1737809990 Nc1ccc2nc(sc2c1)N[C@@H]3CCCc4c3cc(cc4)F 27a_200000724602_100010253933 [0,2,0,0,0,0|1,0,0]=3 2764 B25R4.1737809990 Nc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_100010253933 [0,2,0,0,0,0|1,0,0]=3 2765 B25R4.1737809990 Nc1ccc2nc(sc2c1)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_100010253933 [0,2,0,0,0,0|2,0,0]=4 2766 B25R4.1737809990 Nc1ccc2sc(nc2c1)NC3CCCc4c3cc(cc4)Br 27a_100011742594_100010329861 [0,2,0,0,0,0|1,0,0]=3 2767 B25R4.1737809990 Nc1ccc2sc(nc2c1)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_100010329861 [0,2,0,0,0,0|2,0,0]=4 2768 B25R4.1737809990 Nc1ccc2sc(nc2c1)NC3CCOc4c3cc(cc4)F 27a_100000754146_100010329861 [0,2,0,0,0,0|2,0,0]=4 2769 B25R4.1737809990 Nc1ccc2sc(nc2c1)NC3CCSc4c3cc(cc4)Br 27a_100000744474_100010329861 [0,2,0,0,0,0|2,0,0]=4 2770 B25R4.1737809990 Nc1ccc2sc(nc2c1)N[C@@H]3CCCc4c3cc(cc4)F 27a_200000724602_100010329861 [0,2,0,0,0,0|1,0,0]=3 2771 B25R4.1737809990 Nc1ccc2sc(nc2c1)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_100010329861 [0,2,0,0,0,0|1,0,0]=3 2772 B25R4.1737809990 Nc1ccc2sc(nc2c1)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_100010329861 [0,2,0,0,0,0|2,0,0]=4 2773 B25R4.1737809990 Oc1ccc2nc(sc2c1)NC3CCCc4c3cc(cc4)Br 27a_100011742594_100010063415 [0,2,0,0,0,0|1,0,0]=3 2774 B25R4.1737809990 Oc1ccc2nc(sc2c1)NC3CCOc4c3cc(cc4)Cl 27a_100011264799_100010063415 [0,2,0,0,0,0|2,0,0]=4 2775 B25R4.1737809990 Oc1ccc2nc(sc2c1)NC3CCOc4c3cc(cc4)F 27a_100000754146_100010063415 [0,2,0,0,0,0|2,0,0]=4 2776 B25R4.1737809990 Oc1ccc2nc(sc2c1)NC3CCSc4c3cc(cc4)Br 27a_100000744474_100010063415 [0,2,0,0,0,0|2,0,0]=4 2777 B25R4.1737809990 Oc1ccc2nc(sc2c1)N[C@@H]3CCCc4c3cc(cc4)F 27a_200000724602_100010063415 [0,2,0,0,0,0|1,0,0]=3 2778 B25R4.1737809990 Oc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cc(cc4)Cl 27a_100011998213_100010063415 [0,2,0,0,0,0|1,0,0]=3 2779 B25R4.1737809990 Oc1ccc2nc(sc2c1)N[C@H]3CCOc4c3cc(cc4)Br 27a_100020639276_100010063415 [0,2,0,0,0,0|2,0,0]=4 2780 B25R4.43302107 Cc1cccc2c1OCC[C@H]2Nc3nc4c(cccc4s3)C 27a_100000717741_100010008827 [0,2,0,0,0,0|2,0,0]=4 2781 B25R4.43302107 Cc1cccc2c1OCC[C@H]2Nc3nc4c(cccc4s3)F 27a_100000717741_100010008856 [0,2,0,0,0,0|2,0,0]=4 2782 B25R4.43302107 Cc1cccc2c1nc(s2)NC3CCCc4c3cccc4Br 27a_100020639248_100010008827 [0,2,0,0,0,0|1,0,0]=3 2783 B25R4.43302107 Cc1cccc2c1nc(s2)NC3CCCc4c3cccc4F 27a_100000085590_100010008827 [0,2,0,0,0,0|1,0,0]=3 2784 B25R4.43302107 Cc1cccc2c1nc(s2)NC3CCOc4c3cccc4Br 27a_100000727345_100010008827 [0,2,0,0,0,0|2,0,0]=4 2785 B25R4.43302107 Cc1cccc2c1nc(s2)NC3CCOc4c3cccc4F 27a_100000746867_100010008827 [0,2,0,0,0,0|2,0,0]=4 2786 B25R4.43302107 Cc1cccc2c1nc(s2)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_100010008827 [0,2,0,0,0,0|1,0,0]=3 2787 B25R4.43302107 Fc1cccc2c1CCCC2Nc3nc4c(cccc4s3)F 27a_100000085590_100010008856 [0,2,0,0,0,0|1,0,0]=3 2788 B25R4.43302107 Fc1cccc2c1OCCC2Nc3nc4c(cccc4s3)F 27a_100000746867_100010008856 [0,2,0,0,0,0|2,0,0]=4 2789 B25R4.43302107 Fc1cccc2c1nc(s2)NC3CCCc4c3cccc4Br 27a_100020639248_100010008856 [0,2,0,0,0,0|1,0,0]=3 2790 B25R4.43302107 Fc1cccc2c1nc(s2)NC3CCOc4c3cccc4Br 27a_100000727345_100010008856 [0,2,0,0,0,0|2,0,0]=4 2791 B25R4.43302107 Fc1cccc2c1nc(s2)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_100010008856 [0,2,0,0,0,0|1,0,0]=3 2792 B25R4.43302107 Nc1ncnc2c1[nH]c(n2)NC3CCCc4c3cccc4Br 27a_100020639248_100009817290 [0,2,0,0,0,0|2,0,0]=4 2793 B25R4.43302107 Nc1ncnc2c1[nH]c(n2)NC3CCCc4c3cccc4F 27a_100000085590_100009817290 [0,2,0,0,0,0|2,0,0]=4 2794 B25R4.43302107 Nc1ncnc2c1[nH]c(n2)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_100009817290 [0,2,0,0,0,0|2,0,0]=4 2795 B25R4.46640028 Fc1ccc(c2c1OCCC2Nc3nc4ccccc4[nH]3)F 27a_100020639281_100009814255 [0,2,0,0,0,0|1,0,0]=3 2796 B25R4.46640028 Fc1ccc(c2c1OCCC2Nc3nc4ccccc4s3)F 27a_100020639281_100000751744 [0,2,0,0,0,0|2,0,0]=4 2797 B25R4.195398829 Cc1ccc2nc(sc2c1)NC3CCCc4c3cccc4Br 27a_100020639248_100010186437 [0,2,0,0,0,0|1,0,0]=3 2798 B25R4.195398829 Cc1ccc2nc(sc2c1)NC3CCCc4c3cccc4F 27a_100000085590_100010186437 [0,2,0,0,0,0|1,0,0]=3 2799 B25R4.195398829 Cc1ccc2nc(sc2c1)NC3CCOc4c3cccc4Br 27a_100000727345_100010186437 [0,2,0,0,0,0|2,0,0]=4 2800 B25R4.195398829 Cc1ccc2nc(sc2c1)NC3CCOc4c3cccc4F 27a_100000746867_100010186437 [0,2,0,0,0,0|2,0,0]=4 2801 B25R4.195398829 Cc1ccc2nc(sc2c1)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_100010186437 [0,2,0,0,0,0|1,0,0]=3 2802 B25R4.195398829 Cc1ccc2nc(sc2c1)N[C@@H]3CCOc4c3cccc4C 27a_100000717741_100010186437 [0,2,0,0,0,0|2,0,0]=4 2803 B25R4.195398829 Cc1cccc2c1OCC[C@H]2Nc3nc4cc(ccc4s3)F 27a_100000717741_200010206605 [0,2,0,0,0,0|2,0,0]=4 2804 B25R4.195398829 Cc1cccc2c1OCC[C@H]2Nc3nc4cc(ccc4s3)N 27a_100000717741_100010329861 [0,2,0,0,0,0|2,0,0]=4 2805 B25R4.195398829 Cc1cccc2c1OCC[C@H]2Nc3nc4ccc(cc4s3)F 27a_100000717741_100000751617 [0,2,0,0,0,0|2,0,0]=4 2806 B25R4.195398829 Cc1cccc2c1OCC[C@H]2Nc3nc4ccc(cc4s3)N 27a_100000717741_100010253933 [0,2,0,0,0,0|2,0,0]=4 2807 B25R4.195398829 Cc1cccc2c1OCC[C@H]2Nc3nc4ccc(cc4s3)O 27a_100000717741_100010063415 [0,2,0,0,0,0|2,0,0]=4 2808 B25R4.195398829 Fc1ccc2nc(sc2c1)NC3CCCc4c3cccc4Br 27a_100020639248_100000751617 [0,2,0,0,0,0|1,0,0]=3 2809 B25R4.195398829 Fc1ccc2nc(sc2c1)NC3CCCc4c3cccc4F 27a_100000085590_100000751617 [0,2,0,0,0,0|1,0,0]=3 2810 B25R4.195398829 Fc1ccc2nc(sc2c1)NC3CCOc4c3cccc4Br 27a_100000727345_100000751617 [0,2,0,0,0,0|2,0,0]=4 2811 B25R4.195398829 Fc1ccc2nc(sc2c1)NC3CCOc4c3cccc4F 27a_100000746867_100000751617 [0,2,0,0,0,0|2,0,0]=4 2812 B25R4.195398829 Fc1ccc2nc(sc2c1)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_100000751617 [0,2,0,0,0,0|1,0,0]=3 2813 B25R4.195398829 Fc1ccc2nc(sc2n1)NC3CCCc4c3cccc4Br 27a_100020639248_200010738066 [0,2,0,0,0,0|2,0,0]=4 2814 B25R4.195398829 Fc1ccc2nc(sc2n1)NC3CCCc4c3cccc4F 27a_100000085590_200010738066 [0,2,0,0,0,0|2,0,0]=4 2815 B25R4.195398829 Fc1ccc2nc(sc2n1)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_200010738066 [0,2,0,0,0,0|2,0,0]=4 2816 B25R4.195398829 Fc1ccc2sc(nc2c1)NC3CCCc4c3cccc4Br 27a_100020639248_200010206605 [0,2,0,0,0,0|1,0,0]=3 2817 B25R4.195398829 Fc1ccc2sc(nc2c1)NC3CCCc4c3cccc4F 27a_100000085590_200010206605 [0,2,0,0,0,0|1,0,0]=3 2818 B25R4.195398829 Fc1ccc2sc(nc2c1)NC3CCOc4c3cccc4Br 27a_100000727345_200010206605 [0,2,0,0,0,0|2,0,0]=4 2819 B25R4.195398829 Fc1ccc2sc(nc2c1)NC3CCOc4c3cccc4F 27a_100000746867_200010206605 [0,2,0,0,0,0|2,0,0]=4 2820 B25R4.195398829 Fc1ccc2sc(nc2c1)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_200010206605 [0,2,0,0,0,0|1,0,0]=3 2821 B25R4.195398829 Nc1ccc2nc(sc2c1)NC3CCCc4c3cccc4Br 27a_100020639248_100010253933 [0,2,0,0,0,0|1,0,0]=3 2822 B25R4.195398829 Nc1ccc2nc(sc2c1)NC3CCCc4c3cccc4F 27a_100000085590_100010253933 [0,2,0,0,0,0|1,0,0]=3 2823 B25R4.195398829 Nc1ccc2nc(sc2c1)NC3CCOc4c3cccc4Br 27a_100000727345_100010253933 [0,2,0,0,0,0|2,0,0]=4 2824 B25R4.195398829 Nc1ccc2nc(sc2c1)NC3CCOc4c3cccc4F 27a_100000746867_100010253933 [0,2,0,0,0,0|2,0,0]=4 2825 B25R4.195398829 Nc1ccc2nc(sc2c1)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_100010253933 [0,2,0,0,0,0|1,0,0]=3 2826 B25R4.195398829 Nc1ccc2sc(nc2c1)NC3CCCc4c3cccc4Br 27a_100020639248_100010329861 [0,2,0,0,0,0|1,0,0]=3 2827 B25R4.195398829 Nc1ccc2sc(nc2c1)NC3CCCc4c3cccc4F 27a_100000085590_100010329861 [0,2,0,0,0,0|1,0,0]=3 2828 B25R4.195398829 Nc1ccc2sc(nc2c1)NC3CCOc4c3cccc4Br 27a_100000727345_100010329861 [0,2,0,0,0,0|2,0,0]=4 2829 B25R4.195398829 Nc1ccc2sc(nc2c1)NC3CCOc4c3cccc4F 27a_100000746867_100010329861 [0,2,0,0,0,0|2,0,0]=4 2830 B25R4.195398829 Nc1ccc2sc(nc2c1)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_100010329861 [0,2,0,0,0,0|1,0,0]=3 2831 B25R4.195398829 Oc1ccc2nc(sc2c1)NC3CCCc4c3cccc4Br 27a_100020639248_100010063415 [0,2,0,0,0,0|1,0,0]=3 2832 B25R4.195398829 Oc1ccc2nc(sc2c1)NC3CCCc4c3cccc4F 27a_100000085590_100010063415 [0,2,0,0,0,0|1,0,0]=3 2833 B25R4.195398829 Oc1ccc2nc(sc2c1)NC3CCOc4c3cccc4Br 27a_100000727345_100010063415 [0,2,0,0,0,0|2,0,0]=4 2834 B25R4.195398829 Oc1ccc2nc(sc2c1)NC3CCOc4c3cccc4F 27a_100000746867_100010063415 [0,2,0,0,0,0|2,0,0]=4 2835 B25R4.195398829 Oc1ccc2nc(sc2c1)N[C@@H]3CCCc4c3cccc4Cl 27a_100025717364_100010063415 [0,2,0,0,0,0|1,0,0]=3 2836 B25R4.397273 COc1cccc2c1nc(s2)NC3CCCc4c3ccnc4 27a_100020634316_100010195968 [0,2,0,0,0,0|2,0,0]=4 2837 B25R4.397273 COc1cccc2c1nc(s2)NC3CCCc4c3nccc4 27a_100011259139_100010195968 [0,2,0,0,0,0|2,0,0]=4 2838 B25R4.397273 COc1cccc2c1nc(s2)NC3CCOc4c3cccc4 27a_100015190321_100010195968 [0,2,0,0,0,0|2,0,0]=4 2839 B25R4.397273 COc1cccc2c1nc(s2)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010195968 [0,2,0,0,0,0|1,0,0]=3 2840 B25R4.42669061 CN(c1nc2c(cccc2s1)F)C3CCCc4c3cccc4 27a_100000185324_100010008856 [0,2,0,0,0,0|1,0,0]=3 2841 B25R4.42669061 CN(c1nc2ncnc(c2[nH]1)N)C3CCCc4c3cccc4 27a_100000185324_100009817290 [0,2,0,0,0,0|2,0,0]=4 2842 B25R4.42669061 Cc1cccc2c1nc(s2)N(C)C3CCCc4c3cccc4 27a_100000185324_100010008827 [0,2,0,0,0,0|1,0,0]=3 2843 B25R4.416865548 Nc1nc2[nH]c(nc2c(=O)[nH]1)N[C@H]3CCCc4c3cccc4 27a_100020654734_200009813169 [0,2,0,0,0,0|2,0,0]=4 2844 B25R4.416865548 O=c1[nH]c(=O)c2nc([nH]c2[nH]1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010005409 [0,2,0,0,0,0|2,0,0]=4 2845 B25R4.2324733959 Cc1cccc2c1nc(s2)NC3CCOc4c3c(ccc4)F 27a_100009881269_100010008827 [0,2,0,0,0,0|2,0,0]=4 2846 B25R4.2324733959 Fc1cccc2c1C(CCO2)Nc3nc4c(cccc4s3)F 27a_100009881269_100010008856 [0,2,0,0,0,0|2,0,0]=4 2847 B25R4.234979218 O=S1(=O)CCC(c2c1cccc2)Nc3nc4ccccc4[nH]3 27a_100000734777_100009814255 [0,2,0,0,0,0|1,0,0]=3 2848 B25R4.234979218 O=S1(=O)CCC(c2c1cccc2)Nc3nc4ccccc4s3 27a_100000734777_100000751744 [0,2,0,0,0,0|2,0,0]=4 2849 B25R4.10749657 COc1ccc2nc(sc2c1)NC3CCCc4c3ccnc4 27a_100020634316_100010195960 [0,2,0,0,0,0|2,0,0]=4 2850 B25R4.10749657 COc1ccc2nc(sc2c1)NC3CCCc4c3nccc4 27a_100011259139_100010195960 [0,2,0,0,0,0|2,0,0]=4 2851 B25R4.10749657 COc1ccc2nc(sc2c1)NC3CCOc4c3cccc4 27a_100015190321_100010195960 [0,2,0,0,0,0|2,0,0]=4 2852 B25R4.10749657 COc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_100010195960 [0,2,0,0,0,0|1,0,0]=3 2853 B25R4.10749657 O=Cc1ccc2nc(sc2c1)NC3CCCc4c3ccnc4 27a_100020634316_200010272093 [0,2,0,0,0,0|2,0,0]=4 2854 B25R4.10749657 O=Cc1ccc2nc(sc2c1)NC3CCCc4c3nccc4 27a_100011259139_200010272093 [0,2,0,0,0,0|2,0,0]=4 2855 B25R4.10749657 O=Cc1ccc2nc(sc2c1)NC3CCOc4c3cccc4 27a_100015190321_200010272093 [0,2,0,0,0,0|2,0,0]=4 2856 B25R4.10749657 O=Cc1ccc2nc(sc2c1)N[C@H]3CCCc4c3cccc4 27a_100020654734_200010272093 [0,2,0,0,0,0|1,0,0]=3 2857 B25R4.18927884 CN(c1nc2cc(ccc2s1)F)C3CCCc4c3cccc4 27a_100000185324_200010206605 [0,2,0,0,0,0|1,0,0]=3 2858 B25R4.18927884 CN(c1nc2cc(ccc2s1)N)C3CCCc4c3cccc4 27a_100000185324_100010329861 [0,2,0,0,0,0|1,0,0]=3 2859 B25R4.18927884 CN(c1nc2ccc(cc2s1)F)C3CCCc4c3cccc4 27a_100000185324_100000751617 [0,2,0,0,0,0|1,0,0]=3 2860 B25R4.18927884 CN(c1nc2ccc(cc2s1)N)C3CCCc4c3cccc4 27a_100000185324_100010253933 [0,2,0,0,0,0|1,0,0]=3 2861 B25R4.18927884 CN(c1nc2ccc(cc2s1)O)C3CCCc4c3cccc4 27a_100000185324_100010063415 [0,2,0,0,0,0|1,0,0]=3 2862 B25R4.18927884 CN(c1nc2ccc(nc2s1)F)C3CCCc4c3cccc4 27a_100000185324_200010738066 [0,2,0,0,0,0|2,0,0]=4 2863 B25R4.18927884 Cc1ccc2nc(sc2c1)N(C)C3CCCc4c3cccc4 27a_100000185324_100010186437 [0,2,0,0,0,0|1,0,0]=3 2864 B25R4.1737810000 Cc1ccc2nc(sc2c1)NC3CCOc4c3c(ccc4)F 27a_100009881269_100010186437 [0,2,0,0,0,0|2,0,0]=4 2865 B25R4.1737810000 Fc1ccc2nc(sc2c1)NC3CCOc4c3c(ccc4)F 27a_100009881269_100000751617 [0,2,0,0,0,0|2,0,0]=4 2866 B25R4.1737810000 Fc1ccc2sc(nc2c1)NC3CCOc4c3c(ccc4)F 27a_100009881269_200010206605 [0,2,0,0,0,0|2,0,0]=4 2867 B25R4.1737810000 Nc1ccc2nc(sc2c1)NC3CCOc4c3c(ccc4)F 27a_100009881269_100010253933 [0,2,0,0,0,0|2,0,0]=4 2868 B25R4.1737810000 Nc1ccc2sc(nc2c1)NC3CCOc4c3c(ccc4)F 27a_100009881269_100010329861 [0,2,0,0,0,0|2,0,0]=4 2869 B25R4.1737810000 Oc1ccc2nc(sc2c1)NC3CCOc4c3c(ccc4)F 27a_100009881269_100010063415 [0,2,0,0,0,0|2,0,0]=4 2870 B21R2.13144 O=C(CCCCCc1ccccc1)Nc2ccccc2 11a_100000106764_100011216832 [0,0,2,0,0,0|2,0,0]=4 2871 B21R2.13144 O=C(CCCCCc1ccccc1)Nc2ccccc2 1626a_100000106764_100011216832 [0,0,2,0,0,0|2,0,0]=4 2872 B21R2.13144 O=C(CCCCCc1ccccc1)Nc2ccccc2 22a_100000106764_100011216832 [0,0,2,0,0,0|2,0,0]=4 2873 B21R2.13144 O=C(CCCCCc1ccccc1)Nc2ccccc2 527a_100000106764_100011216832 [0,0,2,0,0,0|2,0,0]=4 2874 B21R2.13144 O=C(NCCCCc1ccccc1)Nc2ccccc2 2430a_100000106764_100015280158 [0,0,2,0,0,0|1,0,0]=3 2875 B21R2.13144 O=C(NCCCOc1ccccc1)Nc2ccccc2 2430a_100000106764_100000216521 [0,0,2,0,0,0|2,0,0]=4 2876 B21R2.13144 O=C(NCCCSc1ccccc1)Nc2ccccc2 2430a_100000106764_100000184639 [0,0,2,0,0,0|2,0,0]=4 2877 B21R2.13144 O=C(NCCOCc1ccccc1)Nc2ccccc2 2430a_100000106764_100000753106 [0,0,2,0,0,0|2,0,0]=4 2878 B21R2.13144 O=C(NCCSCc1ccccc1)Nc2ccccc2 2430a_100000106764_100000189534 [0,0,2,0,0,0|2,0,0]=4 2879 B21R2.14186 CCOc1ccccc1CNC(=O)Nc2ccccc2 2430a_100000106764_100000188671 [0,0,2,0,0,0|2,0,0]=4 2880 B21R2.14798 CCCC(NC(=O)Nc1ccccc1)c2ccccc2 2430a_100000106764_100000189686 [0,0,2,0,0,0|1,0,0]=3 2881 B21R2.14798 CCCC(NC(=O)Nc1ccccc1)c2cccnc2 2430a_100000106764_100011351308 [0,0,2,0,0,0|2,0,0]=4 2882 B21R2.14798 CCCC(NC(=O)Nc1ccccc1)c2ccncc2 2430a_100000106764_100011351316 [0,0,2,0,0,0|2,0,0]=4 2883 B21R2.14798 COC[C@@H](NC(=O)Nc1ccccc1)c2ccccc2 2430a_100000106764_103619048568 [0,0,2,0,0,0|2,0,0]=4 2884 B21R2.14798 O=C(Nc1ccccc1)N[C@@H](CCO)c2ccccc2 2430a_100000106764_100025705951 [0,0,2,0,0,0|2,0,0]=4 2885 B21R2.23122 COc1ccccc1C(C)NC(=O)Nc2ccccc2 2430a_100000106764_100000185323 [0,0,2,0,0,0|2,0,0]=4 2886 B21R2.512837 CCC(NC(=O)Nc1ccccc1)c2ncccc2C 2430a_100000106764_200011536107 [0,0,2,0,0,0|2,0,0]=4 2887 B21R2.512837 CC[C@H](NC(=O)Nc1ccccc1)c2ccccc2Cl 2430a_100000106764_200016987949 [0,0,2,0,0,0|2,0,0]=4 2888 B21R2.512837 CC[C@H](NC(=O)Nc1ccccc1)c2ccccc2F 2430a_100000106764_100015190424 [0,0,2,0,0,0|2,0,0]=4 2889 B21R2.7365 CCCC/C=C/C=CC=NNc1nc2ccccc2[nH]1 4a_100000188875_200016287853 [0,0,2,0,0,0|1,0,1]=4 2890 B23R4.6142 c1ccc2c(c1)CCC[C@@H]2Nc3ccc4sccc4n3 27a_100020654734_100012000956 [0,0,1,1,0,0|2,0,0]=4 2891 B23R4.6142 c1ccc2c(c1)CCC[C@@H]2Nc3ncc4[nH]ccc4n3 27a_100020654734_100009831719 [0,0,1,1,0,0|1,0,1]=4 2892 B23R4.6142 c1ccc2c(c1)CCC[C@@H]2Nc3ncc4cc[nH]c4n3 27a_100020654734_100000059789 [0,0,1,1,0,0|1,0,1]=4 2893 B23R4.6142 c1ccc2c(c1)CCC[C@@H]2Nc3ncc4ccsc4n3 27a_100020654734_100009840870 [0,0,1,1,0,0|1,0,1]=4 2894 B23R4.6142 c1ccc2c(c1)CCC[C@@H]2Nc3ncc4sccc4n3 27a_100020654734_100000117912 [0,0,1,1,0,0|1,0,1]=4 2895 B23R4.4964803 c1ccc2c(c1)CCC[C@@H]2Nc3nccc4c3cco4 27a_100020654734_100000041166 [0,0,1,1,0,0|2,0,0]=4 2896 B23R4.4964803 c1ccc2c(c1)CCC[C@@H]2Nc3nccc4c3ccs4 27a_100020654734_100000047778 [0,0,1,1,0,0|2,0,0]=4 2897 B23R4.4964803 c1ccc2c(c1)CCC[C@@H]2Nc3nccc4c3scc4 27a_100020654734_100000117209 [0,0,1,1,0,0|2,0,0]=4 2898 B23R4.4964803 c1ccc2c(c1)CCC[C@@H]2Nc3nccn4c3ccc4 27a_100020654734_100000094558 [0,0,1,1,0,0|2,0,0]=4 2899 B23R4.5382 c1ccc(cc1)C2CCCN2c3nc4ccccc4[nH]3 27a_100000243309_100009814255 [0,0,1,1,0,0|0,0,0]=2 2900 B23R4.5382 c1ccc(cc1)C2CCCN2c3nc4ccccc4s3 27a_100000243309_100000751744 [0,0,1,1,0,0|1,0,0]=3 2901 B23R4.5382 c1ccc(cc1)C2CCCN2c3nc4cccnc4s3 27a_100000243309_100010188088 [0,0,1,1,0,0|2,0,0]=4 2902 B23R4.5382 c1ccc(cc1)C2SCCN2c3nc4ccccc4[nH]3 27a_100000215944_100009814255 [0,0,1,1,0,0|1,0,0]=3 2903 B23R4.5382 c1ccc(cc1)C2SCCN2c3nc4ccccc4s3 27a_100000215944_100000751744 [0,0,1,1,0,0|2,0,0]=4 2904 B23R4.5382 c1ccc(nc1)C2CCCN2c3nc4ccccc4[nH]3 27a_100000744244_100009814255 [0,0,1,1,0,0|1,0,0]=3 2905 B23R4.5382 c1ccc(nc1)C2CCCN2c3nc4ccccc4s3 27a_100000744244_100000751744 [0,0,1,1,0,0|2,0,0]=4 2906 B23R4.5382 c1ccc2[nH]c(nc2c1)N3CCCC3c4ccncc4 27a_106446545576_100009814255 [0,0,1,1,0,0|1,0,0]=3 2907 B23R4.5382 c1ccc2sc(nc2c1)N3CCCC3c4ccncc4 27a_106446545576_100000751744 [0,0,1,1,0,0|2,0,0]=4 2908 B23R4.5382 c1cncc(c1)C2CCCN2c3nc4ccccc4[nH]3 27a_100000233489_100009814255 [0,0,1,1,0,0|1,0,0]=3 2909 B23R4.5382 c1cncc(c1)C2CCCN2c3nc4ccccc4s3 27a_100000233489_100000751744 [0,0,1,1,0,0|2,0,0]=4 2910 B23R4.1519793 c1ccc(cc1)C(Nc2nc3ccccc3[nH]2)C4CC4 27a_100000735078_100009814255 [0,0,1,1,0,0|0,0,0]=2 2911 B23R4.1519793 c1ccc(cc1)C(Nc2nc3ccccc3s2)C4CC4 27a_100000735078_100000751744 [0,0,1,1,0,0|1,0,0]=3 2912 B23R4.1519793 c1ccc(cc1)C(Nc2nc3cccnc3s2)C4CC4 27a_100000735078_100010188088 [0,0,1,1,0,0|2,0,0]=4 2913 B23R4.1519793 c1ccc(nc1)C(Nc2nc3ccccc3[nH]2)C4CC4 27a_100000238667_100009814255 [0,0,1,1,0,0|1,0,0]=3 2914 B23R4.1519793 c1ccc(nc1)C(Nc2nc3ccccc3s2)C4CC4 27a_100000238667_100000751744 [0,0,1,1,0,0|2,0,0]=4 2915 B23R4.1519793 c1ccc2[nH]c(nc2c1)NC(c3ccncc3)C4CC4 27a_100012004521_100009814255 [0,0,1,1,0,0|1,0,0]=3 2916 B23R4.1519793 c1ccc2sc(nc2c1)NC(c3ccncc3)C4CC4 27a_100012004521_100000751744 [0,0,1,1,0,0|2,0,0]=4 2917 B23R4.1519793 c1cncc(c1)C(Nc2nc3ccccc3[nH]2)C4CC4 27a_100000238668_100009814255 [0,0,1,1,0,0|1,0,0]=3 2918 B23R4.1519793 c1cncc(c1)C(Nc2nc3ccccc3s2)C4CC4 27a_100000238668_100000751744 [0,0,1,1,0,0|2,0,0]=4 2919 B23R4.4605517 c1ccc(cc1)C2(CCC2)Nc3nc4ccccc4[nH]3 27a_100000734848_100009814255 [0,0,1,1,0,0|0,0,0]=2 2920 B23R4.4605517 c1ccc(cc1)C2(CCC2)Nc3nc4ccccc4s3 27a_100000734848_100000751744 [0,0,1,1,0,0|1,0,0]=3 2921 B23R4.4605517 c1ccc(cc1)C2(CCC2)Nc3nc4cccnc4s3 27a_100000734848_100010188088 [0,0,1,1,0,0|2,0,0]=4 2922 B23R4.49972150 c1ccc(c(c1)CNc2nc3ccccc3[nH]2)C4CC4 27a_100020678745_100009814255 [0,0,1,1,0,0|0,0,0]=2 2923 B23R4.49972150 c1ccc(c(c1)CNc2nc3ccccc3s2)C4CC4 27a_100020678745_100000751744 [0,0,1,1,0,0|1,0,0]=3 2924 B23R4.49972150 c1ccc(c(c1)CNc2nc3cccnc3s2)C4CC4 27a_100020678745_100010188088 [0,0,1,1,0,0|2,0,0]=4 2925 B23R4.49972150 c1ccc(c(c1)NCc2nc3ccccc3[nH]2)C4CC4 207a_100011236190_100000185668 [0,0,1,1,0,0|2,0,0]=4 2926 B23R4.49972150 c1ccc(c(c1)SCc2nc3ccccc3[nH]2)C4CC4 62a_100009819954_100000737899 [0,0,1,1,0,0|2,0,0]=4 2927 B23R4.49972179 c1cc(c2c(c1)OCO2)CNc3nc4ccccc4[nH]3 27a_100000743722_100009814255 [0,0,1,1,0,0|2,0,0]=4 2928 B23R4.49972179 c1cc2c(c(c1)CNc3nc4ccccc4[nH]3)OCC2 27a_200000703977_100009814255 [0,0,1,1,0,0|1,0,0]=3 2929 B23R4.49972179 c1cc2c(c(c1)CNc3nc4ccccc4s3)OCC2 27a_200000703977_100000751744 [0,0,1,1,0,0|2,0,0]=4 2930 B23R4.49972179 c1cc2c(c(c1)NCc3nc4ccccc4[nH]3)CCC2 207a_100000043548_100000185668 [0,0,1,1,0,0|2,0,0]=4 2931 B23R4.49972179 c1cc2c(c(c1)NCc3nc4ccccc4[nH]3)CCC2 2230a_100000043548_100000737899 [0,0,1,1,0,0|2,0,0]=4 2932 B23R4.49972179 c1cc2c(c(c1)OCc3nc4ccccc4[nH]3)CCC2 7a_100000074356_100000737899 [0,0,1,1,0,0|2,0,0]=4 2933 B23R4.49972179 c1cc2c(c(c1)SCc3nc4ccccc4[nH]3)CCC2 62a_100010343934_100000737899 [0,0,1,1,0,0|2,0,0]=4 2934 B23R4.52026354 c1ccc2c(c1)CCCN(C2)c3nc4ccccc4[nH]3 27a_100000059810_100009814255 [0,0,1,1,0,0|0,0,0]=2 2935 B23R4.52026354 c1ccc2c(c1)CCCN(C2)c3nc4ccccc4s3 27a_100000059810_100000751744 [0,0,1,1,0,0|1,0,0]=3 2936 B23R4.52026354 c1ccc2c(c1)CCCN(C2)c3nc4cccnc4s3 27a_100000059810_100010188088 [0,0,1,1,0,0|2,0,0]=4 2937 B23R4.52026354 c1ccc2c(c1)CN(CCO2)c3nc4ccccc4[nH]3 27a_100000744108_100009814255 [0,0,1,1,0,0|1,0,0]=3 2938 B23R4.52026354 c1ccc2c(c1)CN(CCO2)c3nc4ccccc4s3 27a_100000744108_100000751744 [0,0,1,1,0,0|2,0,0]=4 2939 B23R4.3721238 c1ccc2c(c1)CCC(C2)Nc3nc4ccccc4[nH]3 27a_100000748446_100009814255 [0,0,1,1,0,0|0,0,2]=4 2940 B23R4.1827408 Brc1ccccc1C2(CC2)Nc3nc4ccccc4[nH]3 27a_200000691159_100009814255 [0,0,1,1,0,0|1,0,0]=3 2941 B23R4.1827408 Brc1ccccc1C2(CC2)Nc3nc4ccccc4s3 27a_200000691159_100000751744 [0,0,1,1,0,0|2,0,0]=4 2942 B23R4.1827408 Clc1ccccc1C2(CC2)Nc3nc4ccccc4[nH]3 27a_100015187805_100009814255 [0,0,1,1,0,0|1,0,0]=3 2943 B23R4.1827408 Clc1ccccc1C2(CC2)Nc3nc4ccccc4s3 27a_100015187805_100000751744 [0,0,1,1,0,0|2,0,0]=4 2944 B23R4.1827408 Fc1ccccc1C2(CC2)Nc3nc4ccccc4[nH]3 27a_100000757808_100009814255 [0,0,1,1,0,0|1,0,0]=3 2945 B23R4.1827408 Fc1ccccc1C2(CC2)Nc3nc4ccccc4s3 27a_100000757808_100000751744 [0,0,1,1,0,0|2,0,0]=4 2946 B23R4.1518864 c1ccc(cc1)C2CCN2Cc3nc4ccccc4[nH]3 2230a_100000739605_100000737899 [0,0,1,1,0,0|2,0,0]=4 2947 B23R4.1518864 c1ccc(cc1)C2CCN2Cc3nc4ccccc4[nH]3 269982a_100000739605_100000737899 [0,0,1,1,0,0|2,0,0]=4 2948 B23R4.1518864 c1ccc(cc1)C2CCN2Cc3nc4ccccc4[nH]3 270004a_100000739605_100000185668 [0,0,1,1,0,0|2,0,0]=4 2949 B23R4.1519690 c1ccc(cc1)[C@H]2C[C@@H]2NCc3nc4ccccc4[nH]3 207a_100020588832_100000185668 [0,0,1,1,0,0|2,0,0]=4 2950 B23R4.1519690 c1ccc(cc1)[C@H]2C[C@@H]2NCc3nc4ccccc4[nH]3 2230a_100020588832_100000737899 [0,0,1,1,0,0|2,0,0]=4 2951 B23R4.1520403 c1ccc(cc1)C[C@H]2CN2Cc3nc4ccccc4[nH]3 2230a_100016998360_100000737899 [0,0,1,1,0,0|2,0,0]=4 2952 B23R4.1520403 c1ccc(cc1)C[C@H]2CN2Cc3nc4ccccc4[nH]3 269982a_100016998360_100000737899 [0,0,1,1,0,0|2,0,0]=4 2953 B23R4.1520403 c1ccc(cc1)C[C@H]2CN2Cc3nc4ccccc4[nH]3 270004a_100016998360_100000185668 [0,0,1,1,0,0|2,0,0]=4 2954 B23R4.1529940 c1ccc2c(c1)CC2COCc3nc4ccccc4[nH]3 7a_100012476685_100000737899 [0,0,1,1,0,0|2,0,0]=4 2955 B23R4.1529940 c1ccc2c(c1)CC2SCCc3nc4ccccc4[nH]3 62a_100009813401_100015206048 [0,0,1,1,0,0|2,0,0]=4 2956 B23R4.1541696 c1ccc2c(c1)CCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000212051 [0,0,1,1,0,0|1,0,1]=4 2957 B23R4.1541696 c1ccc2c(c1)CCC2CNc3nc4ccccc4[nH]3 27a_100020632452_100009814255 [0,0,1,1,0,0|0,0,0]=2 2958 B23R4.1541696 c1ccc2c(c1)CCC2CNc3nc4ccccc4s3 27a_100020632452_100000751744 [0,0,1,1,0,0|1,0,0]=3 2959 B23R4.1541696 c1ccc2c(c1)CCC2CNc3nc4cccnc4s3 27a_100020632452_100010188088 [0,0,1,1,0,0|2,0,0]=4 2960 B23R4.1541696 c1ccc2c(c1)CCC2OCc3nc4ccccc4[nH]3 7a_100000212247_100000737899 [0,0,1,1,0,0|2,0,0]=4 2961 B23R4.1541696 c1ccc2c(c1)CC[C@@H]2NCc3nc4ccccc4[nH]3 207a_100016989578_100000185668 [0,0,1,1,0,0|2,0,0]=4 2962 B23R4.1541696 c1ccc2c(c1)CC[C@@H]2NCc3nc4ccccc4[nH]3 2230a_100016989578_100000737899 [0,0,1,1,0,0|2,0,0]=4 2963 B23R4.1541696 c1ccc2c(c1)CC[C@@H]2NCc3nc4ccccc4[nH]3 270004a_100016989578_100000185668 [0,0,1,1,0,0|2,0,0]=4 2964 B23R4.2192251 CC1c2ccccc2CCN1c3nc4ccccc4[nH]3 27a_100011660714_100009814255 [0,0,1,1,0,0|0,0,0]=2 2965 B23R4.2192251 CC1c2ccccc2CCN1c3nc4ccccc4s3 27a_100011660714_100000751744 [0,0,1,1,0,0|1,0,0]=3 2966 B23R4.2192251 CC1c2ccccc2CCN1c3nc4cccnc4s3 27a_100011660714_100010188088 [0,0,1,1,0,0|2,0,0]=4 2967 B21R3.24493 O=C(Cc1ccccc1)C2CCCc3c2cccc3 1458a_100011198263_100015291786 [0,0,1,0,1,0|2,0,0]=4 2968 B21R3.24493 O=C(Nc1ccccc1)C2CCCc3c2cccc3 11a_100000106764_100011198263 [0,0,1,0,1,0|1,0,0]=3 2969 B21R3.24493 O=C(Nc1ccccc1)C2CCCc3c2cccc3 1626a_100000106764_100011198263 [0,0,1,0,1,0|1,0,0]=3 2970 B21R3.24493 O=C(Nc1ccccc1)C2CCCc3c2cccc3 22a_100000106764_100011198263 [0,0,1,0,1,0|1,0,0]=3 2971 B21R3.24493 O=C(Nc1ccccc1)C2CCCc3c2cccc3 527a_100000106764_100011198263 [0,0,1,0,1,0|1,0,0]=3 2972 B21R3.24493 O=C(Nc1ccccc1)C2OCCc3c2cccc3 11a_100000106764_100000026751 [0,0,1,0,1,0|2,0,0]=4 2973 B21R3.24493 O=C(Nc1ccccc1)C2OCCc3c2cccc3 1626a_100000106764_100000026751 [0,0,1,0,1,0|2,0,0]=4 2974 B21R3.24493 O=C(Nc1ccccc1)C2OCCc3c2cccc3 22a_100000106764_100000026751 [0,0,1,0,1,0|2,0,0]=4 2975 B21R3.24493 O=C(Nc1ccccc1)C2OCCc3c2cccc3 527a_100000106764_100000026751 [0,0,1,0,1,0|2,0,0]=4 2976 B21R3.24497 O=C(CC1CCc2c1cccc2)Nc3ccccc3 11a_100000106764_100000756587 [0,0,1,0,1,0|2,0,0]=4 2977 B21R3.24497 O=C(CC1CCc2c1cccc2)Nc3ccccc3 1626a_100000106764_100000756587 [0,0,1,0,1,0|2,0,0]=4 2978 B21R3.24497 O=C(CC1CCc2c1cccc2)Nc3ccccc3 22a_100000106764_100000756587 [0,0,1,0,1,0|2,0,0]=4 2979 B21R3.24497 O=C(CC1CCc2c1cccc2)Nc3ccccc3 527a_100000106764_100000756587 [0,0,1,0,1,0|2,0,0]=4 2980 B21R3.24497 O=C(Nc1ccccc1)NC2COc3c2cccc3 2430a_100000106764_100000747519 [0,0,1,0,1,0|2,0,0]=4 2981 B21R3.24497 O=C(Nc1ccccc1)N[C@H]2CCc3c2cccc3 2430a_100000106764_100016989578 [0,0,1,0,1,0|1,0,0]=3 2982 B21R3.521193 CC(N[C@H]1CCCc2c1cccc2)c3ccccc3 269862a_100020654734_100000185851 [0,0,1,0,1,0|1,0,1]=4 2983 B21R3.521193 CC(N[C@H]1CCCc2c1cccc2)c3ccccc3 34a_100020654734_100000211855 [0,0,1,0,1,0|1,0,1]=4 2984 B21R3.521193 C[C@@H](NC1CCCc2c1cccc2)c3ccccc3 269862a_100000751104_100000210882 [0,0,1,0,1,0|1,0,1]=4 2985 B21R3.521193 O=C(NC1CCCc2c1ccnc2)c3ccccc3 11a_100020634316_100000185807 [0,0,1,0,1,0|2,0,0]=4 2986 B21R3.521193 O=C(NC1CCCc2c1ccnc2)c3ccccc3 1626a_100020634316_100000185807 [0,0,1,0,1,0|2,0,0]=4 2987 B21R3.521193 O=C(NC1CCCc2c1ccnc2)c3ccccc3 240690a_100020634316_100000185807 [0,0,1,0,1,0|2,0,0]=4 2988 B21R3.521193 O=C(NC1CCCc2c1ccnc2)c3ccccc3 527a_100020634316_100000185807 [0,0,1,0,1,0|2,0,0]=4 2989 B21R3.521193 O=C(NC1CCCc2c1nccc2)c3ccccc3 11a_100011259139_100000185807 [0,0,1,0,1,0|2,0,0]=4 2990 B21R3.521193 O=C(NC1CCCc2c1nccc2)c3ccccc3 1626a_100011259139_100000185807 [0,0,1,0,1,0|2,0,0]=4 2991 B21R3.521193 O=C(NC1CCCc2c1nccc2)c3ccccc3 240690a_100011259139_100000185807 [0,0,1,0,1,0|2,0,0]=4 2992 B21R3.521193 O=C(NC1CCCc2c1nccc2)c3ccccc3 527a_100011259139_100000185807 [0,0,1,0,1,0|2,0,0]=4 2993 B21R3.521193 O=C(NC1CCOc2c1cccc2)c3ccccc3 11a_100015190321_100000185807 [0,0,1,0,1,0|2,0,0]=4 2994 B21R3.521193 O=C(NC1CCOc2c1cccc2)c3ccccc3 1626a_100015190321_100000185807 [0,0,1,0,1,0|2,0,0]=4 2995 B21R3.521193 O=C(NC1CCOc2c1cccc2)c3ccccc3 240690a_100015190321_100000185807 [0,0,1,0,1,0|2,0,0]=4 2996 B21R3.521193 O=C(NC1CCOc2c1cccc2)c3ccccc3 527a_100015190321_100000185807 [0,0,1,0,1,0|2,0,0]=4 2997 B21R3.521193 O=C(N[C@H]1CCCc2c1cccc2)c3ccccc3 11a_100020654734_100000185807 [0,0,1,0,1,0|1,0,0]=3 2998 B21R3.521193 O=C(N[C@H]1CCCc2c1cccc2)c3ccccc3 1626a_100020654734_100000185807 [0,0,1,0,1,0|1,0,0]=3 2999 B21R3.521193 O=C(N[C@H]1CCCc2c1cccc2)c3ccccc3 240690a_100020654734_100000185807 [0,0,1,0,1,0|1,0,0]=3 3000 B21R3.521193 O=C(N[C@H]1CCCc2c1cccc2)c3ccccc3 527a_100020654734_100000185807 [0,0,1,0,1,0|1,0,0]=3 3001 B21R3.525 Brc1ccccc1CNC2CCCc3c2cccc3 269862a_100000689332_100000210882 [0,0,1,0,1,0|1,0,1]=4 3002 B21R3.525 Brc1ccccc1CN[C@H]2CCCc3c2cccc3 207a_100020654734_100000211189 [0,0,1,0,1,0|1,0,1]=4 3003 B21R3.525 Brc1ccccc1CN[C@H]2CCCc3c2cccc3 270004a_100020654734_100000211189 [0,0,1,0,1,0|1,0,1]=4 3004 B21R3.525 Brc1ccccc1CN[C@H]2CCCc3c2cccc3 34a_100020654734_100000184730 [0,0,1,0,1,0|1,0,1]=4 3005 B21R3.525 Cc1ccccc1CNC2CCCc3c2cccc3 269862a_100000174972_100000210882 [0,0,1,0,1,0|1,0,1]=4 3006 B21R3.525 Cc1ccccc1CN[C@H]2CCCc3c2cccc3 207a_100020654734_100000211143 [0,0,1,0,1,0|1,0,1]=4 3007 B21R3.525 Cc1ccccc1CN[C@H]2CCCc3c2cccc3 270004a_100020654734_100000211143 [0,0,1,0,1,0|1,0,1]=4 3008 B21R3.525 Cc1ccccc1CN[C@H]2CCCc3c2cccc3 34a_100020654734_100000211839 [0,0,1,0,1,0|1,0,1]=4 3009 B21R3.525 Clc1ccccc1CNC2CCCc3c2cccc3 269862a_100000174879_100000210882 [0,0,1,0,1,0|1,0,1]=4 3010 B21R3.525 Clc1ccccc1CN[C@H]2CCCc3c2cccc3 207a_100020654734_100000210073 [0,0,1,0,1,0|1,0,1]=4 3011 B21R3.525 Clc1ccccc1CN[C@H]2CCCc3c2cccc3 270004a_100020654734_100000210073 [0,0,1,0,1,0|1,0,1]=4 3012 B21R3.525 Clc1ccccc1CN[C@H]2CCCc3c2cccc3 34a_100020654734_100000187162 [0,0,1,0,1,0|1,0,1]=4 3013 B21R3.525 Fc1ccccc1CNC2CCCc3c2cccc3 269862a_100000174869_100000210882 [0,0,1,0,1,0|1,0,1]=4 3014 B21R3.525 Fc1ccccc1CN[C@H]2CCCc3c2cccc3 207a_100020654734_100000210811 [0,0,1,0,1,0|1,0,1]=4 3015 B21R3.525 Fc1ccccc1CN[C@H]2CCCc3c2cccc3 270004a_100020654734_100000210811 [0,0,1,0,1,0|1,0,1]=4 3016 B21R3.525 Fc1ccccc1CN[C@H]2CCCc3c2cccc3 34a_100020654734_100000211605 [0,0,1,0,1,0|1,0,1]=4 3017 B21R3.525 Ic1ccccc1CNC2CCCc3c2cccc3 269862a_100015347259_100000210882 [0,0,1,0,1,0|1,0,1]=4 3018 B21R3.525 Ic1ccccc1CN[C@H]2CCCc3c2cccc3 207a_100020654734_100000010305 [0,0,1,0,1,0|1,0,1]=4 3019 B21R3.525 Ic1ccccc1CN[C@H]2CCCc3c2cccc3 270004a_100020654734_100000010305 [0,0,1,0,1,0|1,0,1]=4 3020 B21R3.525 Ic1ccccc1CN[C@H]2CCCc3c2cccc3 34a_100020654734_100011215278 [0,0,1,0,1,0|1,0,1]=4 3021 B21R3.525 Oc1ccccc1CNC2CCCc3c2cccc3 269862a_100000185550_100000210882 [0,0,1,0,1,0|1,0,1]=4 3022 B21R3.25611 CCCC(Nc1nc2ccccc2[nH]1)c3cccs3 27a_200015187693_100009814255 [0,0,1,0,1,0|1,0,0]=3 3023 B21R3.25611 CCCC(Nc1nc2ccccc2s1)c3cccs3 27a_200015187693_100000751744 [0,0,1,0,1,0|2,0,0]=4 3024 B21R3.544527 CCCN(c1ccccc1)c2nc3ccccc3[nH]2 27a_200011218496_100009814255 [0,0,1,0,1,0|1,0,0]=3 3025 B21R3.544527 CCCN(c1ccccc1)c2nc3ccccc3s2 27a_200011218496_100000751744 [0,0,1,0,1,0|2,0,0]=4 3026 B21R3.544527 CCNC(c1ccccc1)c2nc3ccccc3[nH]2 2230a_103437231834_100000210202 [0,0,1,0,1,0|1,0,0]=3 3027 B21R3.544527 CCNC(c1ccccc1)c2nc3ccccc3[nH]2 270004a_100015525214_100020600520 [0,0,1,0,1,0|1,0,0]=3 3028 B21R3.901793 CCC(Nc1nc2ccccc2[nH]1)c3ccnn3C 27a_100011935024_100009814255 [0,0,1,0,1,0|2,0,0]=4 3029 B21R3.2211533 CCN(c1nc2ccccc2[nH]1)c3ccccc3C 27a_100000211084_100009814255 [0,0,1,0,1,0|1,0,0]=3 3030 B21R3.2211533 CCN(c1nc2ccccc2[nH]1)c3ccccc3F 27a_100000220365_100009814255 [0,0,1,0,1,0|2,0,0]=4 3031 B21R3.2211533 CCN(c1nc2ccccc2[nH]1)c3ccccc3O 27a_103624766699_100009814255 [0,0,1,0,1,0|2,0,0]=4 3032 B21R3.2211533 CCN(c1nc2ccccc2s1)c3ccccc3C 27a_100000211084_100000751744 [0,0,1,0,1,0|2,0,0]=4 3033 B21R3.2429731 c1coc(c1)CSCCNc2nc3ccccc3[nH]2 27a_100000184675_100009814255 [0,0,1,0,1,0|2,0,0]=4 3034 B21R3.2429969 C(=C/c1ccccc1)\CNc2nc3ccccc3[nH]2 27a_100020603302_100009814255 [0,0,1,0,1,0|0,0,2]=4 3035 B21R3.2429969 C(=NNc1nc2ccccc2[nH]1)Cc3ccccc3 4a_100000188875_100000209964 [0,0,1,0,1,0|1,0,1]=4 3036 B21R3.2429969 c1ccc(cc1)CCCNc2nc3ccccc3[nH]2 27a_100000211184_100009814255 [0,0,1,0,1,0|0,0,0]=2 3037 B21R3.2429969 c1ccc(cc1)CCCNc2nc3ccccc3s2 27a_100000211184_100000751744 [0,0,1,0,1,0|1,0,0]=3 3038 B21R3.2429969 c1ccc(cc1)CCCNc2nc3cccnc3s2 27a_100000211184_100010188088 [0,0,1,0,1,0|2,0,0]=4 3039 B21R3.2429969 c1ccc(cc1)CCCSc2cc3ccccc3[nH]2 62a_100000211621_100010232065 [0,0,1,0,1,0|2,0,0]=4 3040 B21R3.2429969 c1ccc(cc1)CCCSc2nc3ccccc3[nH]2 62a_100000211621_100009814255 [0,0,1,0,1,0|1,0,0]=3 3041 B21R3.2429969 c1ccc(cc1)CCCSc2nc3ccccc3s2 62a_100000211621_100000751744 [0,0,1,0,1,0|2,0,0]=4 3042 B21R3.2429969 c1ccc(cc1)CCNCc2cc3ccccc3[nH]2 270004a_100000106460_100000051030 [0,0,1,0,1,0|2,0,0]=4 3043 B21R3.2429969 c1ccc(cc1)CCNCc2nc3ccccc3[nH]2 207a_100000106460_100000185668 [0,0,1,0,1,0|1,0,0]=3 3044 B21R3.2429969 c1ccc(cc1)CCNCc2nc3ccccc3[nH]2 2230a_100000106460_100000737899 [0,0,1,0,1,0|1,0,0]=3 3045 B21R3.2429969 c1ccc(cc1)CCNCc2nc3ccccc3[nH]2 270004a_100000106460_100000185668 [0,0,1,0,1,0|1,0,0]=3 3046 B21R3.2429969 c1ccc(cc1)CCNCc2nc3ccccc3o2 2230a_100000106460_100000195508 [0,0,1,0,1,0|2,0,0]=4 3047 B21R3.2429969 c1ccc(cc1)CCNCc2nc3ccccc3o2 34a_100000106460_200012361514 [0,0,1,0,1,0|2,0,0]=4 3048 B21R3.2429969 c1ccc(cc1)CCNCc2nc3ccccc3s2 2230a_100000106460_100000766747 [0,0,1,0,1,0|2,0,0]=4 3049 B21R3.2429969 c1ccc(cc1)CCNCc2nc3ccccc3s2 270004a_100000106460_100011204187 [0,0,1,0,1,0|2,0,0]=4 3050 B21R3.2429969 c1ccc(cc1)CCNCc2nc3ccccc3s2 34a_100000106460_100011217541 [0,0,1,0,1,0|2,0,0]=4 3051 B21R3.2429969 c1ccc(cc1)CCNCc2nc3cccnc3[nH]2 2230a_100000106460_100011549802 [0,0,1,0,1,0|2,0,0]=4 3052 B21R3.2429969 c1ccc(cc1)CCOCc2nc3ccccc3[nH]2 7a_100000210268_100000737899 [0,0,1,0,1,0|1,0,0]=3 3053 B21R3.2429969 c1ccc(cc1)CCOCc2nc3ccccc3o2 34a_100000210268_200012361514 [0,0,1,0,1,0|2,0,0]=4 3054 B21R3.2429969 c1ccc(cc1)CCOCc2nc3ccccc3o2 7a_100000210268_100000195508 [0,0,1,0,1,0|2,0,0]=4 3055 B21R3.2429969 c1ccc(cc1)CCOCc2nc3ccccc3s2 34a_100000210268_100011217541 [0,0,1,0,1,0|2,0,0]=4 3056 B21R3.2429969 c1ccc(cc1)CCOCc2nc3ccccc3s2 7a_100000210268_100011217541 [0,0,1,0,1,0|2,0,0]=4 3057 B21R3.2429969 c1ccc(cc1)CCOCc2nc3cccnc3[nH]2 7a_100000210268_100011549802 [0,0,1,0,1,0|2,0,0]=4 3058 B21R3.2429969 c1ccc(cc1)CCSCc2nc3ccccc3[nH]2 62a_100000765856_100000737899 [0,0,1,0,1,0|1,0,0]=3 3059 B21R3.2429969 c1ccc(cc1)CCSCc2nc3ccccc3o2 62a_100000765856_100000195508 [0,0,1,0,1,0|2,0,0]=4 3060 B21R3.2429969 c1ccc(cc1)CCSCc2nc3ccccc3s2 62a_100000765856_100000766747 [0,0,1,0,1,0|2,0,0]=4 3061 B21R3.2429969 c1ccc(cc1)CCSCc2nc3ccccc3s2 62a_100011217541_100011218657 [0,0,1,0,1,0|2,0,0]=4 3062 B21R3.2429969 c1ccc(cc1)CCSCc2nc3cccnc3[nH]2 62a_100011549802_100011218657 [0,0,1,0,1,0|2,0,0]=4 3063 B21R3.2429969 c1ccc(cc1)CNCCc2nc3ccccc3[nH]2 270004a_100015184290_100015611070 [0,0,1,0,1,0|1,0,0]=3 3064 B21R3.2429969 c1ccc(cc1)CNCCc2nc3ccccc3s2 207a_200000203819_100015611070 [0,0,1,0,1,0|2,0,0]=4 3065 B21R3.2429969 c1ccc(cc1)CNCCc2nc3ccccc3s2 270004a_200000203819_100015611070 [0,0,1,0,1,0|2,0,0]=4 3066 B21R3.2429969 c1ccc(cc1)COCCc2nc3ccccc3[nH]2 7a_100000210790_100015206048 [0,0,1,0,1,0|1,0,0]=3 3067 B21R3.2429969 c1ccc(cc1)COCSc2nc3ccccc3[nH]2 62a_100000763385_100009814255 [0,0,1,0,1,0|2,0,0]=4 3068 B21R3.2429969 c1ccc(cc1)CSCCc2nc3ccccc3[nH]2 62a_100000211182_100015206048 [0,0,1,0,1,0|1,0,0]=3 3069 B21R3.2429969 c1ccc(cc1)CSCSc2nc3ccccc3[nH]2 62a_200011217039_100009814255 [0,0,1,0,1,0|2,0,0]=4 3070 B21R3.2429969 c1ccc(cc1)OCCNc2nc3ccccc3[nH]2 27a_100000174943_100009814255 [0,0,1,0,1,0|1,0,0]=3 3071 B21R3.2429969 c1ccc(cc1)OCCNc2nc3ccccc3s2 27a_100000174943_100000751744 [0,0,1,0,1,0|2,0,0]=4 3072 B21R3.2429969 c1ccc(cc1)OCCSc2nc3ccccc3[nH]2 62a_100000184471_100009814255 [0,0,1,0,1,0|2,0,0]=4 3073 B21R3.2429969 c1ccc(cc1)SCCNc2nc3ccccc3[nH]2 27a_100000189519_100009814255 [0,0,1,0,1,0|1,0,0]=3 3074 B21R3.2429969 c1ccc(cc1)SCCNc2nc3ccccc3s2 27a_100000189519_100000751744 [0,0,1,0,1,0|2,0,0]=4 3075 B21R3.2429969 c1ccc(cc1)SCCSc2nc3ccccc3[nH]2 62a_100000246102_100009814255 [0,0,1,0,1,0|2,0,0]=4 3076 B21R3.2429969 c1ccc(cc1)SCSCc2nc3ccccc3[nH]2 62a_100011218342_100000737899 [0,0,1,0,1,0|2,0,0]=4 3077 B21R3.2429969 c1ccc(nc1)CCCNc2nc3ccccc3[nH]2 27a_100000689020_100009814255 [0,0,1,0,1,0|1,0,0]=3 3078 B21R3.2429969 c1ccc(nc1)CCCNc2nc3ccccc3s2 27a_100000689020_100000751744 [0,0,1,0,1,0|2,0,0]=4 3079 B21R3.2429969 c1ccc(nc1)CCNCc2nc3ccccc3[nH]2 207a_100000211156_100000185668 [0,0,1,0,1,0|2,0,0]=4 3080 B21R3.2429969 c1ccc(nc1)CCNCc2nc3ccccc3[nH]2 270004a_100000211156_100000185668 [0,0,1,0,1,0|2,0,0]=4 3081 B21R3.2429969 c1ccc(nc1)CCSCc2nc3ccccc3[nH]2 62a_100015183660_100000737899 [0,0,1,0,1,0|2,0,0]=4 3082 B21R3.2429969 c1ccc(nc1)CNCCc2nc3ccccc3[nH]2 270004a_100015184290_100000209966 [0,0,1,0,1,0|2,0,0]=4 3083 B21R3.2429969 c1ccc(nc1)CSCCc2nc3ccccc3[nH]2 62a_100000721315_100015206048 [0,0,1,0,1,0|2,0,0]=4 3084 B21R3.2429969 c1ccc(nc1)OCCNc2nc3ccccc3[nH]2 27a_106741647558_100009814255 [0,0,1,0,1,0|2,0,0]=4 3085 B21R3.2429969 c1ccc2[nH]c(nc2c1)CCSCc3ccncc3 62a_100015193705_100015206048 [0,0,1,0,1,0|2,0,0]=4 3086 B21R3.2429969 c1ccc2[nH]c(nc2c1)CNCCc3ccncc3 207a_100000742849_100000185668 [0,0,1,0,1,0|2,0,0]=4 3087 B21R3.2429969 c1ccc2[nH]c(nc2c1)CNCCc3ccncc3 270004a_100000742849_100000185668 [0,0,1,0,1,0|2,0,0]=4 3088 B21R3.2429969 c1ccc2[nH]c(nc2c1)CSCCc3ccncc3 62a_100000723409_100000737899 [0,0,1,0,1,0|2,0,0]=4 3089 B21R3.2429969 c1ccc2[nH]c(nc2c1)NCCCc3ccncc3 27a_100011275580_100009814255 [0,0,1,0,1,0|1,0,0]=3 3090 B21R3.2429969 c1ccc2[nH]c(nc2c1)NCCOc3ccncc3 27a_100025717301_100009814255 [0,0,1,0,1,0|2,0,0]=4 3091 B21R3.2429969 c1ccc2sc(nc2c1)NCCCc3ccncc3 27a_100011275580_100000751744 [0,0,1,0,1,0|2,0,0]=4 3092 B21R3.2429969 c1cncc(c1)CCCNc2nc3ccccc3[nH]2 27a_100011532358_100009814255 [0,0,1,0,1,0|1,0,0]=3 3093 B21R3.2429969 c1cncc(c1)CCCNc2nc3ccccc3s2 27a_100011532358_100000751744 [0,0,1,0,1,0|2,0,0]=4 3094 B21R3.2429969 c1cncc(c1)CCNCc2nc3ccccc3[nH]2 207a_100000736294_100000185668 [0,0,1,0,1,0|2,0,0]=4 3095 B21R3.2429969 c1cncc(c1)CCNCc2nc3ccccc3[nH]2 2230a_100000736294_100000737899 [0,0,1,0,1,0|2,0,0]=4 3096 B21R3.2429969 c1cncc(c1)CCNCc2nc3ccccc3[nH]2 270004a_100000736294_100000185668 [0,0,1,0,1,0|2,0,0]=4 3097 B21R3.2429969 c1cncc(c1)CCSCc2nc3ccccc3[nH]2 62a_200011713674_100000737899 [0,0,1,0,1,0|2,0,0]=4 3098 B21R3.2429969 c1cncc(c1)CNCCc2nc3ccccc3[nH]2 270004a_100015184290_100000209961 [0,0,1,0,1,0|2,0,0]=4 3099 B21R3.2429969 c1cncc(c1)CSCCc2nc3ccccc3[nH]2 62a_100000741622_100015206048 [0,0,1,0,1,0|2,0,0]=4 3100 B21R3.2429969 c1cncc(c1)OCCNc2nc3ccccc3[nH]2 27a_100000754688_100009814255 [0,0,1,0,1,0|2,0,0]=4 3101 B21R4.922922 c1ccc2c(c1)CC2Sc3cc4ccccc4[nH]3 62a_100009813401_100010232065 [0,0,0,0,2,0|2,0,0]=4 3102 B21R4.922922 c1ccc2c(c1)CC2Sc3nc4ccccc4[nH]3 62a_100009813401_100009814255 [0,0,0,0,2,0|1,0,0]=3 3103 B21R4.922922 c1ccc2c(c1)CC2Sc3nc4ccccc4s3 62a_100009813401_100000751744 [0,0,0,0,2,0|2,0,0]=4 3104 B23R3.3783 O=C(C#Cc1ccccc1)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000736102 [0,0,1,0,0,1|2,0,0]=4 3105 B23R3.3783 O=C(C=Cc1ccccc1)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000210462 [0,0,1,0,0,1|2,0,0]=4 3106 B23R3.3783 O=C(C=Cc1ccccc1)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000210462 [0,0,1,0,0,1|2,0,0]=4 3107 B23R3.3783 O=C(CCc1ccccc1)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000185753 [0,0,1,0,0,1|2,0,0]=4 3108 B23R3.3783 O=C(CCc1ccccc1)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000185753 [0,0,1,0,0,1|2,0,0]=4 3109 B23R3.3783 O=C(CCc1ccccc1)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000185753 [0,0,1,0,0,1|2,0,0]=4 3110 B23R3.3783 O=C(CCc1ccccc1)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000185753 [0,0,1,0,0,1|2,0,0]=4 3111 B23R3.3783 O=C(CNc1ccccc1)NC2CCOc3c2cccc3 34a_100000106764_100000198603 [0,0,1,0,0,1|2,0,0]=4 3112 B23R3.3783 O=C(COc1ccccc1)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000186222 [0,0,1,0,0,1|2,0,0]=4 3113 B23R3.3783 O=C(COc1ccccc1)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000186222 [0,0,1,0,0,1|2,0,0]=4 3114 B23R3.3783 O=C(COc1ccccc1)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000186222 [0,0,1,0,0,1|2,0,0]=4 3115 B23R3.3783 O=C(COc1ccccc1)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000186222 [0,0,1,0,0,1|2,0,0]=4 3116 B23R3.3783 O=C(CSc1ccccc1)N[C@H]2CCCc3c2cccc3 11a_100020654734_100000211596 [0,0,1,0,0,1|2,0,0]=4 3117 B23R3.3783 O=C(CSc1ccccc1)N[C@H]2CCCc3c2cccc3 1626a_100020654734_100000211596 [0,0,1,0,0,1|2,0,0]=4 3118 B23R3.3783 O=C(CSc1ccccc1)N[C@H]2CCCc3c2cccc3 240690a_100020654734_100000211596 [0,0,1,0,0,1|2,0,0]=4 3119 B23R3.3783 O=C(CSc1ccccc1)N[C@H]2CCCc3c2cccc3 527a_100020654734_100000211596 [0,0,1,0,0,1|2,0,0]=4 3120 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2ccnc3 2708a_100015324214_100020634316 [0,0,1,0,0,1|2,0,0]=4 3121 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2ccnc3 2708a_100020634316_100015324214 [0,0,1,0,0,1|2,0,0]=4 3122 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2ccnc3 273464a_100015324214_100020634316 [0,0,1,0,0,1|2,0,0]=4 3123 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2ccnc3 273464a_100020634316_100015324214 [0,0,1,0,0,1|2,0,0]=4 3124 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2ccnc3 512a_100015324214_100020634316 [0,0,1,0,0,1|2,0,0]=4 3125 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2ccnc3 512a_100020634316_100015324214 [0,0,1,0,0,1|2,0,0]=4 3126 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2nccc3 2708a_100011259139_100015324214 [0,0,1,0,0,1|2,0,0]=4 3127 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2nccc3 2708a_100015324214_100011259139 [0,0,1,0,0,1|2,0,0]=4 3128 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2nccc3 273464a_100011259139_100015324214 [0,0,1,0,0,1|2,0,0]=4 3129 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2nccc3 273464a_100015324214_100011259139 [0,0,1,0,0,1|2,0,0]=4 3130 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2nccc3 512a_100011259139_100015324214 [0,0,1,0,0,1|2,0,0]=4 3131 B23R3.3783 O=C(NCc1ccccc1)NC2CCCc3c2nccc3 512a_100015324214_100011259139 [0,0,1,0,0,1|2,0,0]=4 3132 B23R3.3783 O=C(NCc1ccccc1)NC2CCOc3c2cccc3 2708a_100015190321_100015324214 [0,0,1,0,0,1|2,0,0]=4 3133 B23R3.3783 O=C(NCc1ccccc1)NC2CCOc3c2cccc3 2708a_100015324214_100015190321 [0,0,1,0,0,1|2,0,0]=4 3134 B23R3.3783 O=C(NCc1ccccc1)NC2CCOc3c2cccc3 273464a_100015190321_100015324214 [0,0,1,0,0,1|2,0,0]=4 3135 B23R3.3783 O=C(NCc1ccccc1)NC2CCOc3c2cccc3 273464a_100015324214_100015190321 [0,0,1,0,0,1|2,0,0]=4 3136 B23R3.3783 O=C(NCc1ccccc1)NC2CCOc3c2cccc3 512a_100015190321_100015324214 [0,0,1,0,0,1|2,0,0]=4 3137 B23R3.3783 O=C(NCc1ccccc1)NC2CCOc3c2cccc3 512a_100015324214_100015190321 [0,0,1,0,0,1|2,0,0]=4 3138 B23R3.3783 O=C(NCc1ccccc1)N[C@H]2CCCc3c2cccc3 2708a_100015324214_100020654734 [0,0,1,0,0,1|1,0,0]=3 3139 B23R3.3783 O=C(NCc1ccccc1)N[C@H]2CCCc3c2cccc3 2708a_100020654734_100015324214 [0,0,1,0,0,1|1,0,0]=3 3140 B23R3.3783 O=C(NCc1ccccc1)N[C@H]2CCCc3c2cccc3 273464a_100015324214_100020654734 [0,0,1,0,0,1|1,0,0]=3 3141 B23R3.3783 O=C(NCc1ccccc1)N[C@H]2CCCc3c2cccc3 273464a_100020654734_100015324214 [0,0,1,0,0,1|1,0,0]=3 3142 B23R3.3783 O=C(NCc1ccccc1)N[C@H]2CCCc3c2cccc3 512a_100015324214_100020654734 [0,0,1,0,0,1|1,0,0]=3 3143 B23R3.3783 O=C(NCc1ccccc1)N[C@H]2CCCc3c2cccc3 512a_100020654734_100015324214 [0,0,1,0,0,1|1,0,0]=3 3144 B23R3.3783 O=C(NCc1ccccn1)N[C@H]2CCCc3c2cccc3 2708a_100000210449_100020654734 [0,0,1,0,0,1|2,0,0]=4 3145 B23R3.3783 O=C(NCc1ccccn1)N[C@H]2CCCc3c2cccc3 2708a_100020654734_100000210449 [0,0,1,0,0,1|2,0,0]=4 3146 B23R3.3783 O=C(NCc1ccccn1)N[C@H]2CCCc3c2cccc3 273464a_100000210449_100020654734 [0,0,1,0,0,1|2,0,0]=4 3147 B23R3.3783 O=C(NCc1ccccn1)N[C@H]2CCCc3c2cccc3 273464a_100020654734_100000210449 [0,0,1,0,0,1|2,0,0]=4 3148 B23R3.3783 O=C(NCc1ccccn1)N[C@H]2CCCc3c2cccc3 512a_100020654734_100000210449 [0,0,1,0,0,1|2,0,0]=4 3149 B23R3.3783 O=C(NCc1cccnc1)N[C@H]2CCCc3c2cccc3 2708a_100000210453_100020654734 [0,0,1,0,0,1|2,0,0]=4 3150 B23R3.3783 O=C(NCc1cccnc1)N[C@H]2CCCc3c2cccc3 2708a_100020654734_100000210453 [0,0,1,0,0,1|2,0,0]=4 3151 B23R3.3783 O=C(NCc1cccnc1)N[C@H]2CCCc3c2cccc3 273464a_100000210453_100020654734 [0,0,1,0,0,1|2,0,0]=4 3152 B23R3.3783 O=C(NCc1cccnc1)N[C@H]2CCCc3c2cccc3 273464a_100020654734_100000210453 [0,0,1,0,0,1|2,0,0]=4 3153 B23R3.3783 O=C(NCc1cccnc1)N[C@H]2CCCc3c2cccc3 512a_100000210453_100020654734 [0,0,1,0,0,1|2,0,0]=4 3154 B23R3.3783 O=C(NCc1cccnc1)N[C@H]2CCCc3c2cccc3 512a_100020654734_100000210453 [0,0,1,0,0,1|2,0,0]=4 3155 B23R3.3783 O=C(NCc1ccncc1)N[C@H]2CCCc3c2cccc3 2708a_100000210450_100020654734 [0,0,1,0,0,1|2,0,0]=4 3156 B23R3.3783 O=C(NCc1ccncc1)N[C@H]2CCCc3c2cccc3 2708a_100020654734_100000210450 [0,0,1,0,0,1|2,0,0]=4 3157 B23R3.3783 O=C(NCc1ccncc1)N[C@H]2CCCc3c2cccc3 273464a_100000210450_100020654734 [0,0,1,0,0,1|2,0,0]=4 3158 B23R3.3783 O=C(NCc1ccncc1)N[C@H]2CCCc3c2cccc3 273464a_100020654734_100000210450 [0,0,1,0,0,1|2,0,0]=4 3159 B23R3.3783 O=C(NCc1ccncc1)N[C@H]2CCCc3c2cccc3 512a_100020654734_100000210450 [0,0,1,0,0,1|2,0,0]=4 3160 B23R3.3783 O=C(NNc1ccccc1)NC2CCCc3c2ccnc3 273464a_100020634316_100015195140 [0,0,1,0,0,1|2,0,0]=4 3161 B23R3.3783 O=C(NNc1ccccc1)NC2CCCc3c2ccnc3 512a_100020634316_100015195140 [0,0,1,0,0,1|2,0,0]=4 3162 B23R3.3783 O=C(NNc1ccccc1)NC2CCCc3c2nccc3 273464a_100011259139_100015195140 [0,0,1,0,0,1|2,0,0]=4 3163 B23R3.3783 O=C(NNc1ccccc1)NC2CCCc3c2nccc3 512a_100011259139_100015195140 [0,0,1,0,0,1|2,0,0]=4 3164 B23R3.3783 O=C(NNc1ccccc1)NC2CCOc3c2cccc3 273464a_100015190321_100015195140 [0,0,1,0,0,1|2,0,0]=4 3165 B23R3.3783 O=C(NNc1ccccc1)NC2CCOc3c2cccc3 512a_100015190321_100015195140 [0,0,1,0,0,1|2,0,0]=4 3166 B23R3.3783 O=C(NNc1ccccc1)N[C@H]2CCCc3c2cccc3 273464a_100020654734_100015195140 [0,0,1,0,0,1|1,0,0]=3 3167 B23R3.3783 O=C(NNc1ccccc1)N[C@H]2CCCc3c2cccc3 512a_100020654734_100015195140 [0,0,1,0,0,1|1,0,0]=3 3168 B23R3.3783 O=C(NNc1ccccn1)N[C@H]2CCCc3c2cccc3 273464a_100020654734_100000183288 [0,0,1,0,0,1|2,0,0]=4 3169 B23R3.3783 O=C(NNc1ccccn1)N[C@H]2CCCc3c2cccc3 512a_100020654734_100000183288 [0,0,1,0,0,1|2,0,0]=4 3170 B23R3.3783 O=C(NNc1cccnc1)N[C@H]2CCCc3c2cccc3 273464a_100020654734_100000728903 [0,0,1,0,0,1|2,0,0]=4 3171 B23R3.3783 O=C(NNc1cccnc1)N[C@H]2CCCc3c2cccc3 512a_100020654734_100000728903 [0,0,1,0,0,1|2,0,0]=4 3172 B23R3.3783 O=C(NNc1ccncc1)N[C@H]2CCCc3c2cccc3 273464a_100020654734_100000698918 [0,0,1,0,0,1|2,0,0]=4 3173 B23R3.3783 O=C(NNc1ccncc1)N[C@H]2CCCc3c2cccc3 512a_100020654734_100000698918 [0,0,1,0,0,1|2,0,0]=4 3174 B23R3.938629 O=C(CNC1CCCc2c1ccnc2)Nc3ccccc3 2230a_100020634316_100000182850 [0,0,1,0,0,1|2,0,0]=4 3175 B23R3.938629 O=C(CNC1CCCc2c1nccc2)Nc3ccccc3 2230a_100011259139_100000182850 [0,0,1,0,0,1|2,0,0]=4 3176 B23R3.938629 O=C(CNC1CCOc2c1cccc2)Nc3ccccc3 2230a_100015190321_100000182850 [0,0,1,0,0,1|2,0,0]=4 3177 B23R3.938629 O=C(CN[C@H]1CCCc2c1cccc2)Nc3ccccc3 34a_100020654734_100000182850 [0,0,1,0,0,1|1,0,0]=3 3178 B23R3.938629 O=C(CN[C@H]1CCCc2c1cccc2)Oc3ccccc3 34a_100020654734_100009813826 [0,0,1,0,0,1|2,0,0]=4 3179 B23R3.938629 O=C(COC1CCCc2c1cccc2)Nc3ccccc3 34a_100000183665_100000182850 [0,0,1,0,0,1|2,0,0]=4 3180 B23R3.938629 O=C(COC1CCCc2c1cccc2)Nc3ccccc3 7a_100000183665_100000182850 [0,0,1,0,0,1|2,0,0]=4 3181 B23R3.938629 O=C(NCC1OCCc2c1cccc2)Nc3ccccc3 2430a_100000106764_100000755408 [0,0,1,0,0,1|2,0,0]=4 3182 B23R3.17054 Brc1ccccc1C=CCN[C@H]2CCCc3c2cccc3 270004a_100020654734_200016268969 [0,0,1,0,0,1|2,0,0]=4 3183 B23R3.17054 Clc1ccccc1C=CCN[C@H]2CCCc3c2cccc3 270004a_100020654734_200102525841 [0,0,1,0,0,1|2,0,0]=4 3184 B23R3.17054 Clc1ccccc1CC=NNC2CCCc3c2cccc3 4a_100159326319_200011713468 [0,0,1,0,0,1|2,0,0]=4 3185 B23R3.17054 Fc1ccccc1C=CCN[C@H]2CCCc3c2cccc3 270004a_100020654734_200102525844 [0,0,1,0,0,1|2,0,0]=4 3186 B23R3.17054 Fc1ccccc1CC=NNC2CCCc3c2cccc3 4a_100159326319_200000687578 [0,0,1,0,0,1|2,0,0]=4 3187 B23R3.91154 CCCC(=NNc1nc2ccccc2[nH]1)c3ccccc3 4a_100000188875_100000211045 [0,0,1,0,0,1|0,0,1]=3 3188 B23R3.91154 CCCC(=NNc1nc2ccccc2[nH]1)c3ccccn3 4a_100000188875_100000751832 [0,0,1,0,0,1|1,0,1]=4 3189 B23R3.91154 CCCC(=NNc1nc2ccccc2[nH]1)c3cccnc3 4a_100000188875_100000700227 [0,0,1,0,0,1|1,0,1]=4 3190 B23R3.91154 CCCC(=NNc1nc2ccccc2[nH]1)c3ccncc3 4a_100000188875_100011350605 [0,0,1,0,0,1|1,0,1]=4 3191 B23R3.91154 CCCC(=NNc1nc2ccccc2o1)c3ccccc3 4a_100000182307_100000211045 [0,0,1,0,0,1|1,0,1]=4 3192 B23R3.91154 CCCC(=NNc1nc2ccccc2s1)c3ccccc3 4a_100000181811_100000211045 [0,0,1,0,0,1|1,0,1]=4 3193 B23R3.91154 CCCC(NCc1cc2ccccc2[nH]1)c3ccccc3 270004a_100000189686_100000051030 [0,0,1,0,0,1|1,0,0]=3 3194 B23R3.91154 CCCC(NCc1cc2ccccc2[nH]1)c3cccnc3 270004a_100011351308_100000051030 [0,0,1,0,0,1|2,0,0]=4 3195 B23R3.91154 CCCC(NCc1cc2ccccc2[nH]1)c3ccncc3 270004a_100011351316_100000051030 [0,0,1,0,0,1|2,0,0]=4 3196 B23R3.91154 CCCC(NCc1cc2ccccc2o1)c3ccccc3 207a_100000189686_100000229944 [0,0,1,0,0,1|2,0,0]=4 3197 B23R3.91154 CCCC(NCc1cc2ccccc2o1)c3ccccc3 269862a_100011220112_100000211045 [0,0,1,0,0,1|2,0,0]=4 3198 B23R3.91154 CCCC(NCc1cc2ccccc2o1)c3ccccc3 270004a_100000189686_100000229944 [0,0,1,0,0,1|2,0,0]=4 3199 B23R3.91154 CCCC(NCc1cc2ccccc2s1)c3ccccc3 207a_100000189686_100000686906 [0,0,1,0,0,1|2,0,0]=4 3200 B23R3.91154 CCCC(NCc1cc2ccccc2s1)c3ccccc3 269862a_100015187092_100000211045 [0,0,1,0,0,1|2,0,0]=4 3201 B23R3.91154 CCCC(NCc1cc2ccccc2s1)c3ccccc3 270004a_100000189686_100000686906 [0,0,1,0,0,1|2,0,0]=4 3202 B23R3.91154 CCCC(NCc1cc2cccnc2[nH]1)c3ccccc3 207a_100000189686_100000088027 [0,0,1,0,0,1|2,0,0]=4 3203 B23R3.91154 CCCC(NCc1cc2cccnc2[nH]1)c3ccccc3 270004a_100000189686_100000088027 [0,0,1,0,0,1|2,0,0]=4 3204 B23R3.91154 CCCC(NCc1cc2ccncc2[nH]1)c3ccccc3 270004a_100000189686_200000084276 [0,0,1,0,0,1|2,0,0]=4 3205 B23R3.91154 CCCC(NCc1cn2ccccc2n1)c3ccccc3 207a_100000189686_100000743146 [0,0,1,0,0,1|2,0,0]=4 3206 B23R3.91154 CCCC(NCc1cn2ccccc2n1)c3ccccc3 2230a_100000189686_100000689847 [0,0,1,0,0,1|2,0,0]=4 3207 B23R3.91154 CCCC(NCc1cn2ccccc2n1)c3ccccc3 269862a_100000195574_100000211045 [0,0,1,0,0,1|2,0,0]=4 3208 B23R3.91154 CCCC(NCc1cn2ccccc2n1)c3ccccc3 34a_100000189686_100000689847 [0,0,1,0,0,1|2,0,0]=4 3209 B23R3.91154 CCCC(NCc1nc2ccccc2[nH]1)c3ccccc3 207a_100000189686_100000185668 [0,0,1,0,0,1|0,0,0]=2 3210 B23R3.91154 CCCC(NCc1nc2ccccc2[nH]1)c3ccccc3 2230a_100000189686_100000737899 [0,0,1,0,0,1|0,0,0]=2 3211 B23R3.91154 CCCC(NCc1nc2ccccc2[nH]1)c3ccccc3 270004a_100000189686_100000185668 [0,0,1,0,0,1|0,0,0]=2 3212 B23R3.91154 CCCC(NCc1nc2ccccc2[nH]1)c3cccnc3 207a_100011351308_100000185668 [0,0,1,0,0,1|1,0,0]=3 3213 B23R3.91154 CCCC(NCc1nc2ccccc2[nH]1)c3cccnc3 2230a_100011351308_100000737899 [0,0,1,0,0,1|1,0,0]=3 3214 B23R3.91154 CCCC(NCc1nc2ccccc2[nH]1)c3cccnc3 270004a_100011351308_100000185668 [0,0,1,0,0,1|1,0,0]=3 3215 B23R3.91154 CCCC(NCc1nc2ccccc2[nH]1)c3ccncc3 207a_100011351316_100000185668 [0,0,1,0,0,1|1,0,0]=3 3216 B23R3.91154 CCCC(NCc1nc2ccccc2[nH]1)c3ccncc3 270004a_100011351316_100000185668 [0,0,1,0,0,1|1,0,0]=3 3217 B23R3.91154 CCCC(NCc1nc2ccccc2o1)c3ccccc3 2230a_100000189686_100000195508 [0,0,1,0,0,1|1,0,0]=3 3218 B23R3.91154 CCCC(NCc1nc2ccccc2o1)c3ccccc3 34a_100000189686_200012361514 [0,0,1,0,0,1|1,0,0]=3 3219 B23R3.91154 CCCC(NCc1nc2ccccc2o1)c3cccnc3 2230a_100011351308_100000195508 [0,0,1,0,0,1|2,0,0]=4 3220 B23R3.91154 CCCC(NCc1nc2ccccc2s1)c3ccccc3 2230a_100000189686_100000766747 [0,0,1,0,0,1|1,0,0]=3 3221 B23R3.91154 CCCC(NCc1nc2ccccc2s1)c3ccccc3 270004a_100000189686_100011204187 [0,0,1,0,0,1|1,0,0]=3 3222 B23R3.91154 CCCC(NCc1nc2ccccc2s1)c3ccccc3 34a_100000189686_100011217541 [0,0,1,0,0,1|1,0,0]=3 3223 B23R3.91154 CCCC(NCc1nc2ccccc2s1)c3cccnc3 2230a_100011351308_100000766747 [0,0,1,0,0,1|2,0,0]=4 3224 B23R3.91154 CCCC(NCc1nc2ccccc2s1)c3cccnc3 270004a_100011351308_100011204187 [0,0,1,0,0,1|2,0,0]=4 3225 B23R3.91154 CCCC(NCc1nc2ccccc2s1)c3ccncc3 270004a_100011351316_100011204187 [0,0,1,0,0,1|2,0,0]=4 3226 B23R3.91154 CCCC(NCc1nc2cccnc2[nH]1)c3ccccc3 2230a_100000189686_100011549802 [0,0,1,0,0,1|1,0,0]=3 3227 B23R3.91154 CCCC(NCc1nc2cccnc2[nH]1)c3cccnc3 2230a_100011351308_100011549802 [0,0,1,0,0,1|2,0,0]=4 3228 B23R3.91154 CCCC(NCc1nc2ncccc2o1)c3ccccc3 2230a_100000189686_100000696355 [0,0,1,0,0,1|2,0,0]=4 3229 B23R3.91154 CCCC(OCc1nc2ccccc2[nH]1)c3ccccc3 7a_100000747916_100000737899 [0,0,1,0,0,1|1,0,0]=3 3230 B23R3.91154 CCCC(OCc1nc2ccccc2o1)c3ccccc3 34a_100000747916_200012361514 [0,0,1,0,0,1|2,0,0]=4 3231 B23R3.91154 CCCC(OCc1nc2ccccc2o1)c3ccccc3 7a_100000747916_100000195508 [0,0,1,0,0,1|2,0,0]=4 3232 B23R3.91154 CCCC(OCc1nc2ccccc2s1)c3ccccc3 34a_100000747916_100011217541 [0,0,1,0,0,1|2,0,0]=4 3233 B23R3.91154 CCCC(OCc1nc2ccccc2s1)c3ccccc3 7a_100000747916_100011217541 [0,0,1,0,0,1|2,0,0]=4 3234 B23R3.91154 CCCC(OCc1nc2cccnc2[nH]1)c3ccccc3 7a_100000747916_100011549802 [0,0,1,0,0,1|2,0,0]=4 3235 B23R3.91154 CCCN(CCc1nc2ccccc2[nH]1)c3ccccc3 269982a_200011218496_100015206048 [0,0,1,0,0,1|2,0,0]=4 3236 B23R3.91154 COCC(=NNc1nc2ccccc2[nH]1)c3ccccc3 4a_100000188875_100000765260 [0,0,1,0,0,1|1,0,1]=4 3237 B23R3.91154 COC[C@@H](NCc1cc2ccccc2[nH]1)c3ccccc3 270004a_103619048568_100000051030 [0,0,1,0,0,1|2,0,0]=4 3238 B23R3.91154 COC[C@@H](NCc1nc2ccccc2[nH]1)c3ccccc3 207a_103619048568_100000185668 [0,0,1,0,0,1|1,0,0]=3 3239 B23R3.91154 COC[C@@H](NCc1nc2ccccc2[nH]1)c3ccccc3 2230a_103619048568_100000737899 [0,0,1,0,0,1|1,0,0]=3 3240 B23R3.91154 COC[C@@H](NCc1nc2ccccc2[nH]1)c3ccccc3 270004a_103619048568_100000185668 [0,0,1,0,0,1|1,0,0]=3 3241 B23R3.91154 COC[C@@H](NCc1nc2ccccc2o1)c3ccccc3 2230a_103619048568_100000195508 [0,0,1,0,0,1|2,0,0]=4 3242 B23R3.91154 COC[C@@H](NCc1nc2ccccc2o1)c3ccccc3 34a_103619048568_200012361514 [0,0,1,0,0,1|2,0,0]=4 3243 B23R3.91154 COC[C@@H](NCc1nc2ccccc2s1)c3ccccc3 2230a_103619048568_100000766747 [0,0,1,0,0,1|2,0,0]=4 3244 B23R3.91154 COC[C@@H](NCc1nc2ccccc2s1)c3ccccc3 270004a_103619048568_100011204187 [0,0,1,0,0,1|2,0,0]=4 3245 B23R3.91154 COC[C@@H](NCc1nc2ccccc2s1)c3ccccc3 34a_103619048568_100011217541 [0,0,1,0,0,1|2,0,0]=4 3246 B23R3.91154 COC[C@@H](NCc1nc2cccnc2[nH]1)c3ccccc3 2230a_103619048568_100011549802 [0,0,1,0,0,1|2,0,0]=4 3247 B23R3.91154 CSCC(=NNc1nc2ccccc2[nH]1)c3ccccc3 4a_100000188875_100000748581 [0,0,1,0,0,1|1,0,1]=4 3248 B23R3.91154 ClCCC(SCc1nc2ccccc2[nH]1)c3ccccc3 62a_200010132975_100000737899 [0,0,1,0,0,1|2,0,0]=4 3249 B23R3.91154 ClCC[C@@H](OCc1nc2ccccc2[nH]1)c3ccccc3 7a_100000729684_100000737899 [0,0,1,0,0,1|2,0,0]=4 3250 B23R3.91154 OCC[C@H](NCc1cc2ccccc2[nH]1)c3ccccc3 270004a_100025705951_100000051030 [0,0,1,0,0,1|2,0,0]=4 3251 B23R3.91154 OCC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3 207a_100025705951_100000185668 [0,0,1,0,0,1|1,0,0]=3 3252 B23R3.91154 OCC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3 2230a_100025705951_100000737899 [0,0,1,0,0,1|1,0,0]=3 3253 B23R3.91154 OCC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3 270004a_100025705951_100000185668 [0,0,1,0,0,1|1,0,0]=3 3254 B23R3.91154 OCC[C@H](NCc1nc2ccccc2o1)c3ccccc3 2230a_100025705951_100000195508 [0,0,1,0,0,1|2,0,0]=4 3255 B23R3.91154 OCC[C@H](NCc1nc2ccccc2s1)c3ccccc3 2230a_100025705951_100000766747 [0,0,1,0,0,1|2,0,0]=4 3256 B23R3.91154 OCC[C@H](NCc1nc2ccccc2s1)c3ccccc3 270004a_100025705951_100011204187 [0,0,1,0,0,1|2,0,0]=4 3257 B23R3.91154 OCC[C@H](NCc1nc2cccnc2[nH]1)c3ccccc3 2230a_100025705951_100011549802 [0,0,1,0,0,1|2,0,0]=4 3258 B23R3.91353 CCCC(Nc1ccc2ccccc2n1)c3ccccc3 27a_100000189686_100011291633 [0,0,1,0,0,1|1,0,0]=3 3259 B23R3.91353 CCCC(Nc1ccc2ccccc2n1)c3cccnc3 27a_100011351308_100011291633 [0,0,1,0,0,1|2,0,0]=4 3260 B23R3.91353 CCCC(Nc1ccc2ccccc2n1)c3ccncc3 27a_100011351316_100011291633 [0,0,1,0,0,1|2,0,0]=4 3261 B23R3.91353 CCCC(Nc1ccc2cccnc2n1)c3ccccc3 27a_100000189686_100000075685 [0,0,1,0,0,1|2,0,0]=4 3262 B23R3.91353 CCCC(Nc1ccc2ccncc2n1)c3ccccc3 27a_100000189686_100000020162 [0,0,1,0,0,1|2,0,0]=4 3263 B23R3.91353 CCCC(Nc1ccc2ncccc2n1)c3ccccc3 27a_100000189686_100000073381 [0,0,1,0,0,1|2,0,0]=4 3264 B23R3.91353 CCCC(Nc1cnc2ccccc2n1)c3ccccc3 27a_100000189686_100000756483 [0,0,1,0,0,1|0,0,1]=3 3265 B23R3.91353 CCCC(Nc1cnc2ccccc2n1)c3cccnc3 27a_100011351308_100000756483 [0,0,1,0,0,1|1,0,1]=4 3266 B23R3.91353 CCCC(Nc1cnc2ccccc2n1)c3ccncc3 27a_100011351316_100000756483 [0,0,1,0,0,1|1,0,1]=4 3267 B23R3.91353 CCCC(Nc1cnc2cccnc2n1)c3ccccc3 27a_100000189686_200010275043 [0,0,1,0,0,1|1,0,1]=4 3268 B23R3.91353 CCCC(Nc1cnc2ncccc2n1)c3ccccc3 27a_100000189686_100000084304 [0,0,1,0,0,1|1,0,1]=4 3269 B23R3.91353 CCCC(Nc1ncc2ccccc2n1)c3ccccc3 27a_100000189686_100000097389 [0,0,1,0,0,1|0,0,1]=3 3270 B23R3.91353 CCCC(Nc1ncc2ccccc2n1)c3cccnc3 27a_100011351308_100000097389 [0,0,1,0,0,1|1,0,1]=4 3271 B23R3.91353 CCCC(Nc1ncc2ccccc2n1)c3ccncc3 27a_100011351316_100000097389 [0,0,1,0,0,1|1,0,1]=4 3272 B23R3.91353 CCCC(Nc1ncc2cccnc2n1)c3ccccc3 27a_100000189686_100009875485 [0,0,1,0,0,1|1,0,1]=4 3273 B23R3.91353 COC[C@@H](Nc1ccc2ccccc2n1)c3ccccc3 27a_103619048568_100011291633 [0,0,1,0,0,1|2,0,0]=4 3274 B23R3.91353 COC[C@@H](Nc1cnc2ccccc2n1)c3ccccc3 27a_103619048568_100000756483 [0,0,1,0,0,1|1,0,1]=4 3275 B23R3.91353 COC[C@@H](Nc1ncc2ccccc2n1)c3ccccc3 27a_103619048568_100000097389 [0,0,1,0,0,1|1,0,1]=4 3276 B23R3.91353 OCC[C@H](Nc1ccc2ccccc2n1)c3ccccc3 27a_100025705951_100011291633 [0,0,1,0,0,1|2,0,0]=4 3277 B23R3.91353 OCC[C@H](Nc1cnc2ccccc2n1)c3ccccc3 27a_100025705951_100000756483 [0,0,1,0,0,1|1,0,1]=4 3278 B23R3.91353 OCC[C@H](Nc1ncc2ccccc2n1)c3ccccc3 27a_100025705951_100000097389 [0,0,1,0,0,1|1,0,1]=4 3279 B23R3.1901514 CCCN(Cc1ccccc1)Cc2nc3ccccc3[nH]2 2230a_100000184400_100000737899 [0,0,1,0,0,1|2,0,0]=4 3280 B23R3.1901514 CCCN(Cc1ccccc1)Cc2nc3ccccc3[nH]2 269982a_100000184400_100000737899 [0,0,1,0,0,1|2,0,0]=4 3281 B23R3.1901514 CCCN(Cc1ccccc1)Cc2nc3ccccc3[nH]2 270004a_100000184400_100000185668 [0,0,1,0,0,1|2,0,0]=4 3282 B23R3.1901514 COCC(Cc1ccccc1)Nc2nc3ccccc3[nH]2 27a_100000766165_100009814255 [0,0,1,0,0,1|1,0,0]=3 3283 B23R3.1901514 COCC(Cc1ccccc1)Nc2nc3ccccc3s2 27a_100000766165_100000751744 [0,0,1,0,0,1|2,0,0]=4 3284 B23R3.421212 BrCCc1ccccc1OCCc2nc3ccccc3[nH]2 7a_100000722297_100015206048 [0,0,1,0,0,1|2,0,0]=4 3285 B23R3.421212 C=CCc1ccccc1CNCc2nc3ccccc3[nH]2 270004a_100000729406_100010619294 [0,0,1,0,0,1|0,0,2]=4 3286 B23R3.421212 CCCc1ccccc1NCCc2nc3ccccc3[nH]2 7a_100000737634_100015206048 [0,0,1,0,0,1|1,0,0]=3 3287 B23R3.421212 CCCc1ccccc1OCCc2nc3ccccc3[nH]2 7a_100011217252_100015206048 [0,0,1,0,0,1|1,0,0]=3 3288 B23R3.421212 CCNc1ccccc1OCCc2nc3ccccc3[nH]2 7a_103624766699_100015206048 [0,0,1,0,0,1|2,0,0]=4 3289 B23R3.421212 CCNc1ccccc1SCCc2nc3ccccc3[nH]2 62a_114873767003_100015206048 [0,0,1,0,0,1|2,0,0]=4 3290 B23R3.421212 CCOc1ccccc1C=NNc2nc3ccccc3[nH]2 4a_100000188875_100000169843 [0,0,1,0,0,1|1,0,1]=4 3291 B23R3.421212 CCOc1ccccc1CCNc2nc3ccccc3[nH]2 27a_100000750806_100009814255 [0,0,1,0,0,1|1,0,0]=3 3292 B23R3.421212 CCOc1ccccc1CCNc2nc3ccccc3s2 27a_100000750806_100000751744 [0,0,1,0,0,1|2,0,0]=4 3293 B23R3.421212 CCOc1ccccc1CNCc2cc3ccccc3[nH]2 207a_100015204011_100000169843 [0,0,1,0,0,1|2,0,0]=4 3294 B23R3.421212 CCOc1ccccc1CNCc2cc3ccccc3[nH]2 270004a_100000188671_100000051030 [0,0,1,0,0,1|2,0,0]=4 3295 B23R3.421212 CCOc1ccccc1CNCc2cc3ccccc3[nH]2 270004a_100015204011_100000169843 [0,0,1,0,0,1|2,0,0]=4 3296 B23R3.421212 CCOc1ccccc1CNCc2nc3ccccc3[nH]2 207a_100000188671_100000185668 [0,0,1,0,0,1|1,0,0]=3 3297 B23R3.421212 CCOc1ccccc1CNCc2nc3ccccc3[nH]2 270004a_100000188671_100000185668 [0,0,1,0,0,1|1,0,0]=3 3298 B23R3.421212 CCOc1ccccc1CNCc2nc3ccccc3[nH]2 270004a_100000729406_100000169843 [0,0,1,0,0,1|1,0,0]=3 3299 B23R3.421212 CCOc1ccccc1CNCc2nc3ccccc3o2 270004a_100000733820_100000169843 [0,0,1,0,0,1|2,0,0]=4 3300 B23R3.421212 CCOc1ccccc1CNCc2nc3ccccc3s2 270004a_100000188671_100011204187 [0,0,1,0,0,1|2,0,0]=4 3301 B23R3.421212 CCOc1ccccc1COCc2nc3ccccc3[nH]2 7a_100000708577_100000737899 [0,0,1,0,0,1|2,0,0]=4 3302 B23R3.421212 CCOc1ccccc1OCCc2nc3ccccc3[nH]2 7a_100000211404_100015206048 [0,0,1,0,0,1|2,0,0]=4 3303 B23R3.421212 CCOc1ccccc1SCCc2nc3ccccc3[nH]2 62a_100000230754_100015206048 [0,0,1,0,0,1|2,0,0]=4 3304 B23R3.421212 CCOc1cccnc1CNCc2nc3ccccc3[nH]2 270004a_100000729406_100009876934 [0,0,1,0,0,1|2,0,0]=4 3305 B23R3.421212 CCOc1ccncc1CNCc2nc3ccccc3[nH]2 270004a_100000729406_200011935332 [0,0,1,0,0,1|2,0,0]=4 3306 B23R3.421212 CCOc1ncccc1CNCc2nc3ccccc3[nH]2 207a_100000737023_100000185668 [0,0,1,0,0,1|2,0,0]=4 3307 B23R3.421212 CCOc1ncccc1CNCc2nc3ccccc3[nH]2 270004a_100000729406_100011290805 [0,0,1,0,0,1|2,0,0]=4 3308 B23R3.421212 CCOc1ncccc1CNCc2nc3ccccc3[nH]2 270004a_100000737023_100000185668 [0,0,1,0,0,1|2,0,0]=4 3309 B23R3.421212 CCSc1ccccc1SCCc2nc3ccccc3[nH]2 62a_100000230856_100015206048 [0,0,1,0,0,1|2,0,0]=4 3310 B23R3.421212 CNCc1ccccc1SCCc2nc3ccccc3[nH]2 62a_100000184654_100015206048 [0,0,1,0,0,1|2,0,0]=4 3311 B23R3.421212 COCc1ccccc1OCCc2nc3ccccc3[nH]2 7a_100011488565_100015206048 [0,0,1,0,0,1|2,0,0]=4 3312 B23R3.421212 COCc1ccccc1SCCc2nc3ccccc3[nH]2 62a_100011493684_100015206048 [0,0,1,0,0,1|2,0,0]=4 3313 B23R3.421212 CSCc1ccccc1SCCc2nc3ccccc3[nH]2 62a_100000148299_100015206048 [0,0,1,0,0,1|2,0,0]=4 3314 B23R3.421212 NCCc1ccccc1SCCc2nc3ccccc3[nH]2 62a_100000747383_100015206048 [0,0,1,0,0,1|2,0,0]=4 3315 B23R3.421212 OCCc1ccccc1OCCc2nc3ccccc3[nH]2 7a_100000719421_100015206048 [0,0,1,0,0,1|2,0,0]=4 3316 B23R3.421212 OCCc1ccccc1SCCc2nc3ccccc3[nH]2 62a_100000731337_100015206048 [0,0,1,0,0,1|2,0,0]=4 3317 B23R3.446355 CCOc1ccccc1CNc2ccc3ccccc3n2 27a_100000188671_100011291633 [0,0,1,0,0,1|2,0,0]=4 3318 B23R3.446355 CCOc1ccccc1CNc2cnc3ccccc3n2 27a_100000188671_100000756483 [0,0,1,0,0,1|1,0,1]=4 3319 B23R3.446355 CCOc1ccccc1CNc2ncc3ccccc3n2 27a_100000188671_100000097389 [0,0,1,0,0,1|1,0,1]=4 3320 B23R3.1021739 CCC(=NNc1nc2ccccc2[nH]1)c3ccccc3C 4a_100000188875_100011350723 [0,0,1,0,0,1|0,0,1]=3 3321 B23R3.1021739 CCC(=NNc1nc2ccccc2[nH]1)c3ccccc3Cl 4a_100000188875_100011400563 [0,0,1,0,0,1|1,0,1]=4 3322 B23R3.1021739 CCC(=NNc1nc2ccccc2[nH]1)c3ccccc3F 4a_100000188875_100000686739 [0,0,1,0,0,1|1,0,1]=4 3323 B23R3.1021739 CCC(=NNc1nc2ccccc2[nH]1)c3ccccc3O 4a_100000188875_100000184720 [0,0,1,0,0,1|1,0,1]=4 3324 B23R3.1021739 CCC(=NNc1nc2ccccc2[nH]1)c3ncccc3C 4a_100000188875_100000725274 [0,0,1,0,0,1|1,0,1]=4 3325 B23R3.1021739 CCC(=NNc1nc2ccccc2o1)c3ccccc3C 4a_100000182307_100011350723 [0,0,1,0,0,1|1,0,1]=4 3326 B23R3.1021739 CCC(=NNc1nc2ccccc2s1)c3ccccc3C 4a_100000181811_100011350723 [0,0,1,0,0,1|1,0,1]=4 3327 B23R3.1021739 CCC(NCc1cc2ccccc2[nH]1)c3ncccc3C 270004a_200011536107_100000051030 [0,0,1,0,0,1|2,0,0]=4 3328 B23R3.1021739 CCC(NCc1cc2ccccc2o1)c3ccccc3C 269862a_100011220112_100011350723 [0,0,1,0,0,1|2,0,0]=4 3329 B23R3.1021739 CCC(NCc1cc2ccccc2s1)c3ccccc3C 269862a_100015187092_100011350723 [0,0,1,0,0,1|2,0,0]=4 3330 B23R3.1021739 CCC(NCc1cn2ccccc2n1)c3ccccc3C 269862a_100000195574_100011350723 [0,0,1,0,0,1|2,0,0]=4 3331 B23R3.1021739 CCC(NCc1nc2ccccc2[nH]1)c3ncccc3C 207a_200011536107_100000185668 [0,0,1,0,0,1|1,0,0]=3 3332 B23R3.1021739 CCC(NCc1nc2ccccc2[nH]1)c3ncccc3C 2230a_200011536107_100000737899 [0,0,1,0,0,1|1,0,0]=3 3333 B23R3.1021739 CCC(NCc1nc2ccccc2[nH]1)c3ncccc3C 270004a_200011536107_100000185668 [0,0,1,0,0,1|1,0,0]=3 3334 B23R3.1021739 CCC(NCc1nc2ccccc2o1)c3ncccc3C 2230a_200011536107_100000195508 [0,0,1,0,0,1|2,0,0]=4 3335 B23R3.1021739 CCC(NCc1nc2ccccc2s1)c3ncccc3C 2230a_200011536107_100000766747 [0,0,1,0,0,1|2,0,0]=4 3336 B23R3.1021739 CCC(NCc1nc2ccccc2s1)c3ncccc3C 270004a_200011536107_100011204187 [0,0,1,0,0,1|2,0,0]=4 3337 B23R3.1021739 CCC(NCc1nc2cccnc2[nH]1)c3ncccc3C 2230a_200011536107_100011549802 [0,0,1,0,0,1|2,0,0]=4 3338 B23R3.1021739 CCC(OCc1nc2ccccc2[nH]1)c3ccccc3F 7a_200011689290_100000737899 [0,0,1,0,0,1|2,0,0]=4 3339 B23R3.1021739 CCN(CCc1nc2ccccc2[nH]1)c3ccccc3C 269982a_100000211084_100015206048 [0,0,1,0,0,1|2,0,0]=4 3340 B23R3.1021739 CC[C@H](NCc1cc2ccccc2[nH]1)c3ccccc3Cl 270004a_200016987949_100000051030 [0,0,1,0,0,1|2,0,0]=4 3341 B23R3.1021739 CC[C@H](NCc1cc2ccccc2[nH]1)c3ccccc3F 270004a_100015190424_100000051030 [0,0,1,0,0,1|2,0,0]=4 3342 B23R3.1021739 CC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3Cl 207a_200016987949_100000185668 [0,0,1,0,0,1|1,0,0]=3 3343 B23R3.1021739 CC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3Cl 2230a_200016987949_100000737899 [0,0,1,0,0,1|1,0,0]=3 3344 B23R3.1021739 CC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3Cl 270004a_200016987949_100000185668 [0,0,1,0,0,1|1,0,0]=3 3345 B23R3.1021739 CC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3F 207a_100015190424_100000185668 [0,0,1,0,0,1|1,0,0]=3 3346 B23R3.1021739 CC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3F 2230a_100015190424_100000737899 [0,0,1,0,0,1|1,0,0]=3 3347 B23R3.1021739 CC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3F 270004a_100015190424_100000185668 [0,0,1,0,0,1|1,0,0]=3 3348 B23R3.1021739 CC[C@H](NCc1nc2ccccc2o1)c3ccccc3Cl 2230a_200016987949_100000195508 [0,0,1,0,0,1|2,0,0]=4 3349 B23R3.1021739 CC[C@H](NCc1nc2ccccc2o1)c3ccccc3Cl 34a_200016987949_200012361514 [0,0,1,0,0,1|2,0,0]=4 3350 B23R3.1021739 CC[C@H](NCc1nc2ccccc2o1)c3ccccc3F 2230a_100015190424_100000195508 [0,0,1,0,0,1|2,0,0]=4 3351 B23R3.1021739 CC[C@H](NCc1nc2ccccc2o1)c3ccccc3F 34a_100015190424_200012361514 [0,0,1,0,0,1|2,0,0]=4 3352 B23R3.1021739 CC[C@H](NCc1nc2ccccc2s1)c3ccccc3Cl 2230a_200016987949_100000766747 [0,0,1,0,0,1|2,0,0]=4 3353 B23R3.1021739 CC[C@H](NCc1nc2ccccc2s1)c3ccccc3Cl 270004a_200016987949_100011204187 [0,0,1,0,0,1|2,0,0]=4 3354 B23R3.1021739 CC[C@H](NCc1nc2ccccc2s1)c3ccccc3Cl 34a_200016987949_100011217541 [0,0,1,0,0,1|2,0,0]=4 3355 B23R3.1021739 CC[C@H](NCc1nc2ccccc2s1)c3ccccc3F 2230a_100015190424_100000766747 [0,0,1,0,0,1|2,0,0]=4 3356 B23R3.1021739 CC[C@H](NCc1nc2ccccc2s1)c3ccccc3F 270004a_100015190424_100011204187 [0,0,1,0,0,1|2,0,0]=4 3357 B23R3.1021739 CC[C@H](NCc1nc2ccccc2s1)c3ccccc3F 34a_100015190424_100011217541 [0,0,1,0,0,1|2,0,0]=4 3358 B23R3.1021739 CC[C@H](NCc1nc2cccnc2[nH]1)c3ccccc3Cl 2230a_200016987949_100011549802 [0,0,1,0,0,1|2,0,0]=4 3359 B23R3.1021739 CC[C@H](NCc1nc2cccnc2[nH]1)c3ccccc3F 2230a_100015190424_100011549802 [0,0,1,0,0,1|2,0,0]=4 3360 B23R3.1021739 Cc1ccccc1C(C#N)NCc2nc3ccccc3[nH]2 2230a_102495364774_100000737899 [0,0,1,0,0,1|1,0,1]=4 3361 B23R3.1021739 OCC(NCc1nc2ccccc2[nH]1)c3ccccc3Cl 207a_100138412506_100000185668 [0,0,1,0,0,1|2,0,0]=4 3362 B23R3.1021739 OCC(NCc1nc2ccccc2[nH]1)c3ccccc3Cl 2230a_100138412506_100000737899 [0,0,1,0,0,1|2,0,0]=4 3363 B23R3.1021739 OCC(NCc1nc2ccccc2[nH]1)c3ccccc3Cl 270004a_100138412506_100000185668 [0,0,1,0,0,1|2,0,0]=4 3364 B23R3.1021739 OC[C@@H](NCc1nc2ccccc2[nH]1)c3ccccc3Br 207a_100161155918_100000185668 [0,0,1,0,0,1|2,0,0]=4 3365 B23R3.1021739 OC[C@@H](NCc1nc2ccccc2[nH]1)c3ccccc3Br 2230a_100161155918_100000737899 [0,0,1,0,0,1|2,0,0]=4 3366 B23R3.1021739 OC[C@@H](NCc1nc2ccccc2[nH]1)c3ccccc3Br 270004a_100161155918_100000185668 [0,0,1,0,0,1|2,0,0]=4 3367 B23R3.1021739 OC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3F 207a_100009818778_100000185668 [0,0,1,0,0,1|2,0,0]=4 3368 B23R3.1021739 OC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3F 2230a_100009818778_100000737899 [0,0,1,0,0,1|2,0,0]=4 3369 B23R3.1021739 OC[C@H](NCc1nc2ccccc2[nH]1)c3ccccc3F 270004a_100009818778_100000185668 [0,0,1,0,0,1|2,0,0]=4 3370 B23R3.1028838 CCC(Nc1ccc2ccccc2n1)c3ncccc3C 27a_200011536107_100011291633 [0,0,1,0,0,1|2,0,0]=4 3371 B23R3.1028838 CCC(Nc1cnc2ccccc2n1)c3ncccc3C 27a_200011536107_100000756483 [0,0,1,0,0,1|1,0,1]=4 3372 B23R3.1028838 CCC(Nc1ncc2ccccc2n1)c3ncccc3C 27a_200011536107_100000097389 [0,0,1,0,0,1|1,0,1]=4 3373 B23R3.1028838 CC[C@H](Nc1ccc2ccccc2n1)c3ccccc3Cl 27a_200016987949_100011291633 [0,0,1,0,0,1|2,0,0]=4 3374 B23R3.1028838 CC[C@H](Nc1ccc2ccccc2n1)c3ccccc3F 27a_100015190424_100011291633 [0,0,1,0,0,1|2,0,0]=4 3375 B23R3.1028838 CC[C@H](Nc1cnc2ccccc2n1)c3ccccc3Cl 27a_200016987949_100000756483 [0,0,1,0,0,1|1,0,1]=4 3376 B23R3.1028838 CC[C@H](Nc1cnc2ccccc2n1)c3ccccc3F 27a_100015190424_100000756483 [0,0,1,0,0,1|1,0,1]=4 3377 B23R3.1028838 CC[C@H](Nc1ncc2ccccc2n1)c3ccccc3Cl 27a_200016987949_100000097389 [0,0,1,0,0,1|1,0,1]=4 3378 B23R3.1028838 CC[C@H](Nc1ncc2ccccc2n1)c3ccccc3F 27a_100015190424_100000097389 [0,0,1,0,0,1|1,0,1]=4 3379 B23R3.20776216 CCN(Cc1nc2ccccc2[nH]1)Cc3ccccc3C 2230a_100000201206_100000737899 [0,0,1,0,0,1|2,0,0]=4 3380 B23R3.20776216 CCN(Cc1nc2ccccc2[nH]1)Cc3ccccc3C 269982a_100000201206_100000737899 [0,0,1,0,0,1|2,0,0]=4 3381 B23R3.20776216 CCN(Cc1nc2ccccc2[nH]1)Cc3ccccc3C 270004a_100000201206_100000185668 [0,0,1,0,0,1|2,0,0]=4 3382 B23R3.20776216 OCC(Cc1ccccc1Cl)Nc2nc3ccccc3[nH]2 27a_100012001541_100009814255 [0,0,1,0,0,1|2,0,0]=4 3383 B23R3.1974307 c1ccc(cc1)CCCCNc2ccc3ccccc3c2 34a_100000211940_100000701786 [0,0,1,0,0,1|2,0,0]=4 3384 B23R3.1974307 c1ccc(cc1)CCCCNc2ccc3ccccc3c2 7a_100000211940_100000701786 [0,0,1,0,0,1|2,0,0]=4 3385 B23R3.1974307 c1ccc(cc1)CCCCNc2ccc3ccccc3n2 27a_100015280158_100011291633 [0,0,1,0,0,1|1,0,0]=3 3386 B23R3.1974307 c1ccc(cc1)CCCCNc2ccc3cccnc3n2 27a_100015280158_100000075685 [0,0,1,0,0,1|2,0,0]=4 3387 B23R3.1974307 c1ccc(cc1)CCCCNc2ccc3ccncc3n2 27a_100015280158_100000020162 [0,0,1,0,0,1|2,0,0]=4 3388 B23R3.1974307 c1ccc(cc1)CCCCNc2ccc3ncccc3n2 27a_100015280158_100000073381 [0,0,1,0,0,1|2,0,0]=4 3389 B23R3.1974307 c1ccc(cc1)CCCCNc2cnc3ccccc3n2 27a_100015280158_100000756483 [0,0,1,0,0,1|0,0,1]=3 3390 B23R3.1974307 c1ccc(cc1)CCCCNc2cnc3cccnc3n2 27a_100015280158_200010275043 [0,0,1,0,0,1|1,0,1]=4 3391 B23R3.1974307 c1ccc(cc1)CCCCNc2cnc3ncccc3n2 27a_100015280158_100000084304 [0,0,1,0,0,1|1,0,1]=4 3392 B23R3.1974307 c1ccc(cc1)CCCCNc2ncc3ccccc3n2 27a_100015280158_100000097389 [0,0,1,0,0,1|0,0,1]=3 3393 B23R3.1974307 c1ccc(cc1)CCCCNc2ncc3cccnc3n2 27a_100015280158_100009875485 [0,0,1,0,0,1|1,0,1]=4 3394 B23R3.1974307 c1ccc(cc1)CCCCOc2cnc3ccccc3c2 34a_100011934006_100000701786 [0,0,1,0,0,1|2,0,0]=4 3395 B23R3.1974307 c1ccc(cc1)CCCCOc2cnc3ccccc3c2 7a_100011934006_100000701786 [0,0,1,0,0,1|2,0,0]=4 3396 B23R3.1974307 c1ccc(cc1)CCCCSc2cc3ccccc3cn2 62a_100000701786_100000047361 [0,0,1,0,0,1|2,0,0]=4 3397 B23R3.1974307 c1ccc(cc1)CCCCSc2cc3ccccc3cn2 62a_100009816522_100000701786 [0,0,1,0,0,1|2,0,0]=4 3398 B23R3.1974307 c1ccc(cc1)CCCCSc2ccc3ccccc3n2 62a_100000701786_100011291633 [0,0,1,0,0,1|2,0,0]=4 3399 B23R3.1974307 c1ccc(cc1)CCCCSc2ccc3ccccc3n2 62a_100011291633_100000701786 [0,0,1,0,0,1|2,0,0]=4 3400 B23R3.1974307 c1ccc(cc1)CCCCSc2cnc3ccccc3c2 62a_100000701786_100000737414 [0,0,1,0,0,1|2,0,0]=4 3401 B23R3.1974307 c1ccc(cc1)CCCCSc2cnc3ccccc3n2 62a_100000701786_100000756483 [0,0,1,0,0,1|1,0,1]=4 3402 B23R3.1974307 c1ccc(cc1)CCCCSc2cnc3ccccc3n2 62a_100000756483_100000701786 [0,0,1,0,0,1|1,0,1]=4 3403 B23R3.1974307 c1ccc(cc1)CCCCSc2ncc3ccccc3n2 62a_100000701786_100000097389 [0,0,1,0,0,1|1,0,1]=4 3404 B23R3.1974307 c1ccc(cc1)COCCNc2ccc3ccccc3n2 27a_100000753106_100011291633 [0,0,1,0,0,1|2,0,0]=4 3405 B23R3.1974307 c1ccc(cc1)COCCNc2cnc3ccccc3n2 27a_100000753106_100000756483 [0,0,1,0,0,1|1,0,1]=4 3406 B23R3.1974307 c1ccc(cc1)COCCNc2ncc3ccccc3n2 27a_100000753106_100000097389 [0,0,1,0,0,1|1,0,1]=4 3407 B23R3.1974307 c1ccc(cc1)CSCCNc2ccc3ccccc3n2 27a_100000189534_100011291633 [0,0,1,0,0,1|2,0,0]=4 3408 B23R3.1974307 c1ccc(cc1)CSCCNc2cnc3ccccc3n2 27a_100000189534_100000756483 [0,0,1,0,0,1|1,0,1]=4 3409 B23R3.1974307 c1ccc(cc1)CSCCNc2ncc3ccccc3n2 27a_100000189534_100000097389 [0,0,1,0,0,1|1,0,1]=4 3410 B23R3.1974307 c1ccc(cc1)OCCCNc2ccc3ccccc3n2 27a_100000216521_100011291633 [0,0,1,0,0,1|2,0,0]=4 3411 B23R3.1974307 c1ccc(cc1)OCCCNc2cnc3ccccc3n2 27a_100000216521_100000756483 [0,0,1,0,0,1|1,0,1]=4 3412 B23R3.1974307 c1ccc(cc1)OCCCNc2ncc3ccccc3n2 27a_100000216521_100000097389 [0,0,1,0,0,1|1,0,1]=4 3413 B23R3.1974307 c1ccc(cc1)SCCCNc2ccc3ccccc3n2 27a_100000184639_100011291633 [0,0,1,0,0,1|2,0,0]=4 3414 B23R3.1974307 c1ccc(cc1)SCCCNc2cnc3ccccc3n2 27a_100000184639_100000756483 [0,0,1,0,0,1|1,0,1]=4 3415 B23R3.1974307 c1ccc(cc1)SCCCNc2ncc3ccccc3n2 27a_100000184639_100000097389 [0,0,1,0,0,1|1,0,1]=4 3416 B23R3.3869082 C(=NNc1nc2ccccc2[nH]1)CCCc3ccccc3 4a_100000188875_100011361547 [0,0,1,0,0,1|0,0,1]=3 3417 B23R3.3869082 C(=NNc1nc2ccccc2[nH]1)COCc3ccccc3 4a_100000188875_100011215530 [0,0,1,0,0,1|1,0,1]=4 3418 B23R3.3869082 C(=NNc1nc2ccccc2o1)CCCc3ccccc3 4a_100000182307_100011361547 [0,0,1,0,0,1|1,0,1]=4 3419 B23R3.3869082 C(=NNc1nc2ccccc2s1)CCCc3ccccc3 4a_100000181811_100011361547 [0,0,1,0,0,1|1,0,1]=4 3420 B23R3.3869082 c1ccc(cc1)CCCCCNc2nc3ccccc3[nH]2 27a_100000750932_100009814255 [0,0,1,0,0,1|0,0,0]=2 3421 B23R3.3869082 c1ccc(cc1)CCCCCNc2nc3ccccc3s2 27a_100000750932_100000751744 [0,0,1,0,0,1|1,0,0]=3 3422 B23R3.3869082 c1ccc(cc1)CCCCCNc2nc3cccnc3s2 27a_100000750932_100010188088 [0,0,1,0,0,1|2,0,0]=4 3423 B23R3.3869082 c1ccc(cc1)CCCCCSc2cc3ccccc3[nH]2 62a_200011217138_100010232065 [0,0,1,0,0,1|2,0,0]=4 3424 B23R3.3869082 c1ccc(cc1)CCCCCSc2nc3ccccc3[nH]2 62a_200011217138_100009814255 [0,0,1,0,0,1|1,0,0]=3 3425 B23R3.3869082 c1ccc(cc1)CCCCCSc2nc3ccccc3s2 62a_200011217138_100000751744 [0,0,1,0,0,1|2,0,0]=4 3426 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3ccccc3[nH]2 270004a_100015280158_100000051030 [0,0,1,0,0,1|1,0,0]=3 3427 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3ccccc3o2 207a_100015280158_100000229944 [0,0,1,0,0,1|2,0,0]=4 3428 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3ccccc3o2 270004a_100015280158_100000229944 [0,0,1,0,0,1|2,0,0]=4 3429 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3ccccc3s2 207a_100015280158_100000686906 [0,0,1,0,0,1|2,0,0]=4 3430 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3ccccc3s2 2230a_100015187092_100000701786 [0,0,1,0,0,1|2,0,0]=4 3431 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3ccccc3s2 270004a_100015280158_100000686906 [0,0,1,0,0,1|2,0,0]=4 3432 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3cccnc3[nH]2 207a_100015280158_100000088027 [0,0,1,0,0,1|2,0,0]=4 3433 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3cccnc3[nH]2 270004a_100015280158_100000088027 [0,0,1,0,0,1|2,0,0]=4 3434 B23R3.3869082 c1ccc(cc1)CCCCNCc2cc3ccncc3[nH]2 270004a_100015280158_200000084276 [0,0,1,0,0,1|2,0,0]=4 3435 B23R3.3869082 c1ccc(cc1)CCCCNCc2cn3ccccc3n2 207a_100015280158_100000743146 [0,0,1,0,0,1|2,0,0]=4 3436 B23R3.3869082 c1ccc(cc1)CCCCNCc2cn3ccccc3n2 2230a_100015280158_100000689847 [0,0,1,0,0,1|2,0,0]=4 3437 B23R3.3869082 c1ccc(cc1)CCCCNCc2cn3ccccc3n2 34a_100015280158_100000689847 [0,0,1,0,0,1|2,0,0]=4 3438 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ccccc3[nH]2 207a_100015280158_100000185668 [0,0,1,0,0,1|0,0,0]=2 3439 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ccccc3[nH]2 2230a_100015280158_100000737899 [0,0,1,0,0,1|0,0,0]=2 3440 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ccccc3[nH]2 270004a_100015280158_100000185668 [0,0,1,0,0,1|0,0,0]=2 3441 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ccccc3o2 2230a_100015280158_100000195508 [0,0,1,0,0,1|1,0,0]=3 3442 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ccccc3o2 34a_100015280158_200012361514 [0,0,1,0,0,1|1,0,0]=3 3443 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ccccc3s2 2230a_100015280158_100000766747 [0,0,1,0,0,1|1,0,0]=3 3444 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ccccc3s2 270004a_100015280158_100011204187 [0,0,1,0,0,1|1,0,0]=3 3445 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ccccc3s2 34a_100015280158_100011217541 [0,0,1,0,0,1|1,0,0]=3 3446 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3cccnc3[nH]2 2230a_100015280158_100011549802 [0,0,1,0,0,1|1,0,0]=3 3447 B23R3.3869082 c1ccc(cc1)CCCCNCc2nc3ncccc3o2 2230a_100015280158_100000696355 [0,0,1,0,0,1|2,0,0]=4 3448 B23R3.3869082 c1ccc(cc1)CCCCOCc2nc3ccccc3[nH]2 7a_100000703073_100000737899 [0,0,1,0,0,1|1,0,0]=3 3449 B23R3.3869082 c1ccc(cc1)CCCCOCc2nc3ccccc3o2 34a_100000703073_200012361514 [0,0,1,0,0,1|2,0,0]=4 3450 B23R3.3869082 c1ccc(cc1)CCCCOCc2nc3ccccc3o2 7a_100000703073_100000195508 [0,0,1,0,0,1|2,0,0]=4 3451 B23R3.3869082 c1ccc(cc1)CCCCOCc2nc3ccccc3s2 34a_100000703073_100011217541 [0,0,1,0,0,1|2,0,0]=4 3452 B23R3.3869082 c1ccc(cc1)CCCCOCc2nc3ccccc3s2 7a_100000703073_100011217541 [0,0,1,0,0,1|2,0,0]=4 3453 B23R3.3869082 c1ccc(cc1)CCCCOCc2nc3cccnc3[nH]2 7a_100000703073_100011549802 [0,0,1,0,0,1|2,0,0]=4 3454 B23R3.3869082 c1ccc(cc1)CCCCSCc2nc3ccccc3[nH]2 62a_100000701786_100000737899 [0,0,1,0,0,1|1,0,0]=3 3455 B23R3.3869082 c1ccc(cc1)CCCCSCc2nc3ccccc3o2 62a_100000701786_100000195508 [0,0,1,0,0,1|2,0,0]=4 3456 B23R3.3869082 c1ccc(cc1)CCCCSCc2nc3ccccc3s2 62a_100000701786_100000766747 [0,0,1,0,0,1|2,0,0]=4 3457 B23R3.3869082 c1ccc(cc1)CCCCSCc2nc3ccccc3s2 62a_100011217541_100000701786 [0,0,1,0,0,1|2,0,0]=4 3458 B23R3.3869082 c1ccc(cc1)CCCCSCc2nc3cccnc3[nH]2 62a_100011549802_100000701786 [0,0,1,0,0,1|2,0,0]=4 3459 B23R3.3869082 c1ccc(cc1)CCCOCCc2nc3ccccc3[nH]2 7a_100000210828_100015206048 [0,0,1,0,0,1|1,0,0]=3 3460 B23R3.3869082 c1ccc(cc1)CCCSCCc2nc3ccccc3[nH]2 62a_100000211621_100015206048 [0,0,1,0,0,1|1,0,0]=3 3461 B23R3.3869082 c1ccc(cc1)COCCCNc2nc3ccccc3[nH]2 27a_200000206031_100009814255 [0,0,1,0,0,1|0,0,0]=2 3462 B23R3.3869082 c1ccc(cc1)COCCCNc2nc3ccccc3s2 27a_200000206031_100000751744 [0,0,1,0,0,1|1,0,0]=3 3463 B23R3.3869082 c1ccc(cc1)COCCCNc2nc3cccnc3s2 27a_200000206031_100010188088 [0,0,1,0,0,1|2,0,0]=4 3464 B23R3.3869082 c1ccc(cc1)COCCCSc2cc3ccccc3[nH]2 62a_100011215529_100010232065 [0,0,1,0,0,1|2,0,0]=4 3465 B23R3.3869082 c1ccc(cc1)COCCCSc2nc3ccccc3[nH]2 62a_100011215529_100009814255 [0,0,1,0,0,1|1,0,0]=3 3466 B23R3.3869082 c1ccc(cc1)COCCCSc2nc3ccccc3s2 62a_100011215529_100000751744 [0,0,1,0,0,1|2,0,0]=4 3467 B23R3.3869082 c1ccc(cc1)COCCNCc2cc3ccccc3[nH]2 270004a_100000753106_100000051030 [0,0,1,0,0,1|2,0,0]=4 3468 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3ccccc3[nH]2 207a_100000753106_100000185668 [0,0,1,0,0,1|1,0,0]=3 3469 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3ccccc3[nH]2 2230a_100000753106_100000737899 [0,0,1,0,0,1|1,0,0]=3 3470 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3ccccc3[nH]2 270004a_100000753106_100000185668 [0,0,1,0,0,1|1,0,0]=3 3471 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3ccccc3o2 2230a_100000753106_100000195508 [0,0,1,0,0,1|2,0,0]=4 3472 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3ccccc3o2 34a_100000753106_200012361514 [0,0,1,0,0,1|2,0,0]=4 3473 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3ccccc3s2 2230a_100000753106_100000766747 [0,0,1,0,0,1|2,0,0]=4 3474 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3ccccc3s2 270004a_100000753106_100011204187 [0,0,1,0,0,1|2,0,0]=4 3475 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3ccccc3s2 34a_100000753106_100011217541 [0,0,1,0,0,1|2,0,0]=4 3476 B23R3.3869082 c1ccc(cc1)COCCNCc2nc3cccnc3[nH]2 2230a_100000753106_100011549802 [0,0,1,0,0,1|2,0,0]=4 3477 B23R3.3869082 c1ccc(cc1)COCCOCc2nc3ccccc3[nH]2 7a_100000759325_100000737899 [0,0,1,0,0,1|2,0,0]=4 3478 B23R3.3869082 c1ccc(cc1)COCCSCc2nc3ccccc3[nH]2 62a_100000234347_100000737899 [0,0,1,0,0,1|2,0,0]=4 3479 B23R3.3869082 c1ccc(cc1)COCCSCc2nc3ccccc3[nH]2 7a_100015184497_100000211182 [0,0,1,0,0,1|2,0,0]=4 3480 B23R3.3869082 c1ccc(cc1)COCSCCc2nc3ccccc3[nH]2 62a_100000763385_100015206048 [0,0,1,0,0,1|2,0,0]=4 3481 B23R3.3869082 c1ccc(cc1)CSCCNCc2cc3ccccc3[nH]2 270004a_100000189534_100000051030 [0,0,1,0,0,1|2,0,0]=4 3482 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3[nH]2 207a_100000189534_100000185668 [0,0,1,0,0,1|1,0,0]=3 3483 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3[nH]2 2230a_100000189534_100000737899 [0,0,1,0,0,1|1,0,0]=3 3484 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3[nH]2 270004a_100000189534_100000185668 [0,0,1,0,0,1|1,0,0]=3 3485 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3[nH]2 7a_100000189534_100000737899 [0,0,1,0,0,1|1,0,0]=3 3486 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3o2 2230a_100000189534_100000195508 [0,0,1,0,0,1|2,0,0]=4 3487 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3o2 34a_100000189534_200012361514 [0,0,1,0,0,1|2,0,0]=4 3488 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3o2 7a_100000189534_100000195508 [0,0,1,0,0,1|2,0,0]=4 3489 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3s2 2230a_100000189534_100000766747 [0,0,1,0,0,1|2,0,0]=4 3490 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3s2 270004a_100000189534_100011204187 [0,0,1,0,0,1|2,0,0]=4 3491 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3s2 34a_100000189534_100011217541 [0,0,1,0,0,1|2,0,0]=4 3492 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3ccccc3s2 7a_100000189534_100011217541 [0,0,1,0,0,1|2,0,0]=4 3493 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3cccnc3[nH]2 2230a_100000189534_100011549802 [0,0,1,0,0,1|2,0,0]=4 3494 B23R3.3869082 c1ccc(cc1)CSCCNCc2nc3cccnc3[nH]2 7a_100000189534_100011549802 [0,0,1,0,0,1|2,0,0]=4 3495 B23R3.3869082 c1ccc(cc1)CSCCOCc2nc3ccccc3[nH]2 7a_100011205989_100000737899 [0,0,1,0,0,1|2,0,0]=4 3496 B23R3.3869082 c1ccc(cc1)CSCCSCc2nc3ccccc3[nH]2 62a_200011297719_100000737899 [0,0,1,0,0,1|2,0,0]=4 3497 B23R3.3869082 c1ccc(cc1)CSCSCCc2nc3ccccc3[nH]2 62a_200011217039_100015206048 [0,0,1,0,0,1|2,0,0]=4 3498 B23R3.3869082 c1ccc(cc1)OCCCCSc2cc3ccccc3[nH]2 62a_100011215240_100010232065 [0,0,1,0,0,1|2,0,0]=4 3499 B23R3.3869082 c1ccc(cc1)OCCCCSc2nc3ccccc3[nH]2 62a_100011215240_100009814255 [0,0,1,0,0,1|1,0,0]=3 3500 B23R3.3869082 c1ccc(cc1)OCCCCSc2nc3ccccc3s2 62a_100011215240_100000751744 [0,0,1,0,0,1|2,0,0]=4 3501 B23R3.3869082 c1ccc(cc1)OCCCNCc2cc3ccccc3[nH]2 270004a_100000216521_100000051030 [0,0,1,0,0,1|2,0,0]=4 3502 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3ccccc3[nH]2 207a_100000216521_100000185668 [0,0,1,0,0,1|1,0,0]=3 3503 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3ccccc3[nH]2 2230a_100000216521_100000737899 [0,0,1,0,0,1|1,0,0]=3 3504 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3ccccc3[nH]2 270004a_100000216521_100000185668 [0,0,1,0,0,1|1,0,0]=3 3505 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3ccccc3o2 2230a_100000216521_100000195508 [0,0,1,0,0,1|2,0,0]=4 3506 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3ccccc3o2 34a_100000216521_200012361514 [0,0,1,0,0,1|2,0,0]=4 3507 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3ccccc3s2 2230a_100000216521_100000766747 [0,0,1,0,0,1|2,0,0]=4 3508 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3ccccc3s2 270004a_100000216521_100011204187 [0,0,1,0,0,1|2,0,0]=4 3509 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3ccccc3s2 34a_100000216521_100011217541 [0,0,1,0,0,1|2,0,0]=4 3510 B23R3.3869082 c1ccc(cc1)OCCCNCc2nc3cccnc3[nH]2 2230a_100000216521_100011549802 [0,0,1,0,0,1|2,0,0]=4 3511 B23R3.3869082 c1ccc(cc1)OCCCOCc2nc3ccccc3[nH]2 7a_100011215863_100000737899 [0,0,1,0,0,1|2,0,0]=4 3512 B23R3.3869082 c1ccc(cc1)OCCCSCc2nc3ccccc3[nH]2 62a_100000199009_100000737899 [0,0,1,0,0,1|2,0,0]=4 3513 B23R3.3869082 c1ccc(cc1)OCCNCCc2nc3ccccc3[nH]2 270004a_100015184290_100000758736 [0,0,1,0,0,1|2,0,0]=4 3514 B23R3.3869082 c1ccc(cc1)OCCOCCc2nc3ccccc3[nH]2 7a_100000210260_100015206048 [0,0,1,0,0,1|2,0,0]=4 3515 B23R3.3869082 c1ccc(cc1)OCCSCCc2nc3ccccc3[nH]2 62a_100000184471_100015206048 [0,0,1,0,0,1|2,0,0]=4 3516 B23R3.3869082 c1ccc(cc1)SCCCNCc2cc3ccccc3[nH]2 270004a_100000184639_100000051030 [0,0,1,0,0,1|2,0,0]=4 3517 B23R3.3869082 c1ccc(cc1)SCCCNCc2nc3ccccc3[nH]2 207a_100000184639_100000185668 [0,0,1,0,0,1|1,0,0]=3 3518 B23R3.3869082 c1ccc(cc1)SCCCNCc2nc3ccccc3[nH]2 2230a_100000184639_100000737899 [0,0,1,0,0,1|1,0,0]=3 3519 B23R3.3869082 c1ccc(cc1)SCCCNCc2nc3ccccc3[nH]2 270004a_100000184639_100000185668 [0,0,1,0,0,1|1,0,0]=3 3520 B23R3.3869082 c1ccc(cc1)SCCCNCc2nc3ccccc3o2 2230a_100000184639_100000195508 [0,0,1,0,0,1|2,0,0]=4 3521 B23R3.3869082 c1ccc(cc1)SCCCNCc2nc3ccccc3s2 2230a_100000184639_100000766747 [0,0,1,0,0,1|2,0,0]=4 3522 B23R3.3869082 c1ccc(cc1)SCCCNCc2nc3ccccc3s2 270004a_100000184639_100011204187 [0,0,1,0,0,1|2,0,0]=4 3523 B23R3.3869082 c1ccc(cc1)SCCCNCc2nc3cccnc3[nH]2 2230a_100000184639_100011549802 [0,0,1,0,0,1|2,0,0]=4 3524 B23R3.3869082 c1ccc(cc1)SCCCSCc2nc3ccccc3[nH]2 62a_200011203293_100000737899 [0,0,1,0,0,1|2,0,0]=4 3525 B23R3.3869082 c1ccc(cc1)SCCOCCc2nc3ccccc3[nH]2 7a_100000230494_100015206048 [0,0,1,0,0,1|2,0,0]=4 3526 B23R3.3869082 c1ccc(cc1)SCCSCCc2nc3ccccc3[nH]2 62a_100000246102_100015206048 [0,0,1,0,0,1|2,0,0]=4 3527 B23R3.3869082 c1ccc2[nH]c(nc2c1)CSCCCCc3ccncc3 62a_100020630000_100000737899 [0,0,1,0,0,1|2,0,0]=4 3528 B23R3.3869082 c1cncc(c1)CCCCOCc2nc3ccccc3[nH]2 7a_100012039607_100000737899 [0,0,1,0,0,1|2,0,0]=4 3529 B23R3.2054088 COc1ccccc1C(C)Nc2ccc3ccccc3n2 27a_100000185323_100011291633 [0,0,1,0,0,1|2,0,0]=4 3530 B23R3.2054088 COc1ccccc1C(C)Nc2cnc3ccccc3n2 27a_100000185323_100000756483 [0,0,1,0,0,1|1,0,1]=4 3531 B23R3.2054088 COc1ccccc1C(C)Nc2ncc3ccccc3n2 27a_100000185323_100000097389 [0,0,1,0,0,1|1,0,1]=4 3532 B23R3.5144230 CCc1ccccc1CN(C)Cc2nc3ccccc3[nH]2 270004a_100000736437_100011219594 [0,0,1,0,0,1|2,0,0]=4 3533 B23R3.27290673 CC(NCc1nc2ccccc2[nH]1)c3ccccc3C#N 207a_100160469468_100000185668 [0,0,1,0,0,1|1,0,1]=4 3534 B23R3.27290673 CC(NCc1nc2ccccc2[nH]1)c3ccccc3C#N 2230a_100160469468_100000737899 [0,0,1,0,0,1|1,0,1]=4 3535 B23R3.27290673 CC(NCc1nc2ccccc2[nH]1)c3ccccc3C#N 270004a_100160469468_100000185668 [0,0,1,0,0,1|1,0,1]=4 3536 B23R3.27290673 CCc1ccccc1C(=O)NCc2nc3ccccc3[nH]2 240690a_100000729406_100000689120 [0,0,1,0,0,1|1,0,1]=4 3537 B23R3.27290673 CCc1ccccc1C(=O)NCc2nc3ccccc3[nH]2 527a_100000729406_100000689120 [0,0,1,0,0,1|1,0,1]=4 3538 B23R3.27290673 CCc1ccccc1C(=O)NNc2nc3ccccc3[nH]2 22a_100000188875_100000689120 [0,0,1,0,0,1|1,0,1]=4 3539 B23R3.27290673 CNc1ccccc1C(=NNc2nc3ccccc3[nH]2)C 4a_100000188875_100000020593 [0,0,1,0,0,1|1,0,1]=4 3540 B23R3.27290673 COc1ccccc1C(=NNc2nc3ccccc3[nH]2)C 4a_100000188875_100000173324 [0,0,1,0,0,1|1,0,1]=4 3541 B23R3.27290673 COc1ccccc1C(C)NCc2cc3ccccc3[nH]2 270004a_100000185323_100000051030 [0,0,1,0,0,1|2,0,0]=4 3542 B23R3.27290673 COc1ccccc1C(C)NCc2nc3ccccc3[nH]2 207a_100000185323_100000185668 [0,0,1,0,0,1|1,0,0]=3 3543 B23R3.27290673 COc1ccccc1C(C)NCc2nc3ccccc3[nH]2 2230a_100000185323_100000737899 [0,0,1,0,0,1|1,0,0]=3 3544 B23R3.27290673 COc1ccccc1C(C)NCc2nc3ccccc3[nH]2 270004a_100000185323_100000185668 [0,0,1,0,0,1|1,0,0]=3 3545 B23R3.27290673 COc1ccccc1C(C)NCc2nc3ccccc3o2 2230a_100000185323_100000195508 [0,0,1,0,0,1|2,0,0]=4 3546 B23R3.27290673 COc1ccccc1C(C)NCc2nc3ccccc3s2 2230a_100000185323_100000766747 [0,0,1,0,0,1|2,0,0]=4 3547 B23R3.27290673 COc1ccccc1C(C)NCc2nc3ccccc3s2 270004a_100000185323_100011204187 [0,0,1,0,0,1|2,0,0]=4 3548 B23R3.27290673 COc1ccccc1C(C)NCc2nc3cccnc3[nH]2 2230a_100000185323_100011549802 [0,0,1,0,0,1|2,0,0]=4 3549 B23R3.27290673 COc1ccccc1C(C)OCc2nc3ccccc3[nH]2 7a_100000742714_100000737899 [0,0,1,0,0,1|2,0,0]=4 3550 B23R4.1529622 c1ccc2c(c1)CCC2Sc3cc4ccccc4cn3 62a_100009816522_200000721974 [0,0,0,0,1,1|2,0,0]=4 3551 B23R4.1529622 c1ccc2c(c1)CCC2Sc3ccc4ccccc4n3 62a_100011291633_200000721974 [0,0,0,0,1,1|2,0,0]=4 3552 B23R4.1529622 c1ccc2c(c1)CCC2Sc3cnc4ccccc4n3 62a_100000756483_200000721974 [0,0,0,0,1,1|1,0,1]=4 3553 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3ccc4ccccc4n3 27a_100016989578_100011291633 [0,0,0,0,1,1|1,0,0]=3 3554 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3ccc4cccnc4n3 27a_100016989578_100000075685 [0,0,0,0,1,1|2,0,0]=4 3555 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3ccc4ccncc4n3 27a_100016989578_100000020162 [0,0,0,0,1,1|2,0,0]=4 3556 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3ccc4ncccc4n3 27a_100016989578_100000073381 [0,0,0,0,1,1|2,0,0]=4 3557 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3cnc4ccccc4n3 27a_100016989578_100000756483 [0,0,0,0,1,1|0,0,1]=3 3558 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3cnc4cccnc4n3 27a_100016989578_200010275043 [0,0,0,0,1,1|1,0,1]=4 3559 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3cnc4ncccc4n3 27a_100016989578_100000084304 [0,0,0,0,1,1|1,0,1]=4 3560 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3ncc4ccccc4n3 27a_100016989578_100000097389 [0,0,0,0,1,1|0,0,1]=3 3561 B23R4.1529622 c1ccc2c(c1)CC[C@@H]2Nc3ncc4cccnc4n3 27a_100016989578_100009875485 [0,0,0,0,1,1|1,0,1]=4 3562 B23R4.1529622 c1ccc2c(c1)OCC2Nc3ccc4ccccc4n3 27a_100000747519_100011291633 [0,0,0,0,1,1|2,0,0]=4 3563 B23R4.1529622 c1ccc2c(c1)OCC2Nc3cnc4ccccc4n3 27a_100000747519_100000756483 [0,0,0,0,1,1|1,0,1]=4 3564 B23R4.1529622 c1ccc2c(c1)OCC2Nc3ncc4ccccc4n3 27a_100000747519_100000097389 [0,0,0,0,1,1|1,0,1]=4 3565 B25R4.9214497 c1ccc2c(c1)CCCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000184060 [0,0,0,0,0,2|0,0,1]=3 3566 B25R4.9214497 c1ccc2c(c1)CCCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000184060 [0,0,0,0,0,2|1,0,1]=4 3567 B25R4.9214497 c1ccc2c(c1)CCCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000184060 [0,0,0,0,0,2|1,0,1]=4 3568 B25R4.9214497 c1ccc2c(c1)CCCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000184060 [0,0,0,0,0,2|2,0,0]=4 3569 B25R4.9214497 c1ccc2c(c1)CCCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000184060 [0,0,0,0,0,2|2,0,0]=4 3570 B25R4.9214497 c1ccc2c(c1)CCCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000184060 [0,0,0,0,0,2|2,0,0]=4 3571 B25R4.9214497 c1ccc2c(c1)CNCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100020645865 [0,0,0,0,0,2|0,0,1]=3 3572 B25R4.9214497 c1ccc2c(c1)CNCCC2=NNc3nc4ccccc4o3 4a_100000182307_100020645865 [0,0,0,0,0,2|1,0,1]=4 3573 B25R4.9214497 c1ccc2c(c1)CNCCC2=NNc3nc4ccccc4s3 4a_100000181811_100020645865 [0,0,0,0,0,2|1,0,1]=4 3574 B25R4.9214497 c1ccc2c(c1)NCCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000763191 [0,0,0,0,0,2|0,0,1]=3 3575 B25R4.9214497 c1ccc2c(c1)NCCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000763191 [0,0,0,0,0,2|1,0,1]=4 3576 B25R4.9214497 c1ccc2c(c1)NCCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000763191 [0,0,0,0,0,2|1,0,1]=4 3577 B25R4.9214497 c1ccc2c(c1)OCCCC2=NNc3nc4ccccc4[nH]3 4a_100000188875_100000750279 [0,0,0,0,0,2|0,0,1]=3 3578 B25R4.9214497 c1ccc2c(c1)OCCCC2=NNc3nc4ccccc4o3 4a_100000182307_100000750279 [0,0,0,0,0,2|1,0,1]=4 3579 B25R4.9214497 c1ccc2c(c1)OCCCC2=NNc3nc4ccccc4s3 4a_100000181811_100000750279 [0,0,0,0,0,2|1,0,1]=4 3580 B25R4.9214497 c1ccc2c(c1)OCCCC2NCc3cc4ccccc4o3 269862a_100011220112_100000750279 [0,0,0,0,0,2|2,0,0]=4 3581 B25R4.9214497 c1ccc2c(c1)OCCCC2NCc3cc4ccccc4s3 269862a_100015187092_100000750279 [0,0,0,0,0,2|2,0,0]=4 3582 B25R4.9214497 c1ccc2c(c1)OCCCC2NCc3cn4ccccc4n3 269862a_100000195574_100000750279 [0,0,0,0,0,2|2,0,0]=4 3583 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3cc4ccccc4[nH]3 4a_100159326319_100000051030 [0,0,0,0,0,2|1,0,0]=3 3584 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3cc4ccccc4o3 4a_100159326319_100000229944 [0,0,0,0,0,2|2,0,0]=4 3585 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3cc4ccccc4s3 4a_100159326319_100000686906 [0,0,0,0,0,2|2,0,0]=4 3586 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3cc4cccnc4[nH]3 4a_100159326319_100000088027 [0,0,0,0,0,2|2,0,0]=4 3587 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3cc4ccncc4[nH]3 4a_100159326319_200000084276 [0,0,0,0,0,2|2,0,0]=4 3588 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3cc4cnccc4[nH]3 4a_100159326319_100000084277 [0,0,0,0,0,2|2,0,0]=4 3589 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3cn4ccccc4n3 4a_100159326319_100000743146 [0,0,0,0,0,2|2,0,0]=4 3590 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3nc4ccccc4[nH]3 4a_100159326319_100000185668 [0,0,0,0,0,2|0,0,0]=2 3591 B25R4.1701907 C(=NNC1CCCc2c1cccc2)c3nc4ccccc4s3 4a_100159326319_100011204187 [0,0,0,0,0,2|1,0,0]=3 3592 B25R4.1701907 c1ccc2[nH]c(nc2c1)CCNC3CCCc4c3ccnc4 269862a_100015184290_100000087567 [0,0,0,0,0,2|1,0,0]=3 3593 B25R4.1701907 c1ccc2[nH]c(nc2c1)CCNC3CCCc4c3cncc4 269862a_100015184290_100016991936 [0,0,0,0,0,2|1,0,0]=3 3594 B25R4.1701907 c1ccc2c(c1)CCCC2NCCc3cn4ccccc4n3 269862a_100000689867_100000210882 [0,0,0,0,0,2|2,0,0]=4 3595 B25R4.1701907 c1ccc2c(c1)CCCC2NCCc3nc4ccccc4[nH]3 269862a_100015184290_100000210882 [0,0,0,0,0,2|0,0,0]=2 3596 B25R4.1701907 c1ccc2c(c1)CCCC2NCCc3nc4ccccc4s3 269862a_200000203819_100000210882 [0,0,0,0,0,2|1,0,0]=3 3597 B25R4.1701907 c1ccc2c(c1)CCCC2NCCn3nc4ccccc4n3 269862a_100000090509_100000210882 [0,0,0,0,0,2|1,0,1]=4 3598 B25R4.1701907 c1ccc2c(c1)CCCC2OCCc3nc4ccccc4[nH]3 7a_100000183665_100015206048 [0,0,0,0,0,2|1,0,0]=3 3599 B25R4.1701907 c1ccc2c(c1)CCCN2CCNc3nc4ccccc4[nH]3 27a_100011200932_100009814255 [0,0,0,0,0,2|1,0,0]=3 3600 B25R4.1701907 c1ccc2c(c1)CCCN2CCNc3nc4ccccc4s3 27a_100011200932_100000751744 [0,0,0,0,0,2|2,0,0]=4 3601 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3cc4ccccc4[nH]3 270004a_100000755408_100000051030 [0,0,0,0,0,2|2,0,0]=4 3602 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4ccccc4[nH]3 207a_100000755408_100000185668 [0,0,0,0,0,2|1,0,0]=3 3603 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4ccccc4[nH]3 2230a_100000755408_100000737899 [0,0,0,0,0,2|1,0,0]=3 3604 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4ccccc4[nH]3 270004a_100000755408_100000185668 [0,0,0,0,0,2|1,0,0]=3 3605 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4ccccc4o3 2230a_100000755408_100000195508 [0,0,0,0,0,2|2,0,0]=4 3606 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4ccccc4o3 34a_100000755408_200012361514 [0,0,0,0,0,2|2,0,0]=4 3607 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4ccccc4s3 2230a_100000755408_100000766747 [0,0,0,0,0,2|2,0,0]=4 3608 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4ccccc4s3 270004a_100000755408_100011204187 [0,0,0,0,0,2|2,0,0]=4 3609 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4ccccc4s3 34a_100000755408_100011217541 [0,0,0,0,0,2|2,0,0]=4 3610 B25R4.1701907 c1ccc2c(c1)CCOC2CNCc3nc4cccnc4[nH]3 2230a_100000755408_100011549802 [0,0,0,0,0,2|2,0,0]=4 3611 B25R4.1701907 c1ccc2c(c1)COCC2NCCc3nc4ccccc4[nH]3 269862a_100015184290_100000117393 [0,0,0,0,0,2|1,0,0]=3 3612 B25R4.1701907 c1ccc2c(c1)COCC2NCCc3nc4ccccc4s3 269862a_200000203819_100000117393 [0,0,0,0,0,2|2,0,0]=4 3613 B25R4.1701907 c1ccc2c(c1)OCCC2OCCc3nc4ccccc4[nH]3 7a_100000708930_100015206048 [0,0,0,0,0,2|2,0,0]=4 3614 B25R4.1701907 c1ccc2c(c1)SCCC2NCCc3nc4ccccc4[nH]3 269862a_100015184290_100000183853 [0,0,0,0,0,2|1,0,0]=3 3615 B25R4.1701907 c1ccc2c(c1)SCCC2NCCc3nc4ccccc4s3 269862a_200000203819_100000183853 [0,0,0,0,0,2|2,0,0]=4 3616 B25R4.1701907 c1ccc2sc(nc2c1)CCNC3CCCc4c3ccnc4 269862a_200000203819_100000087567 [0,0,0,0,0,2|2,0,0]=4 3617 B25R4.1701907 c1ccc2sc(nc2c1)CCNC3CCCc4c3cncc4 269862a_200000203819_100016991936 [0,0,0,0,0,2|2,0,0]=4 3618 B25R4.1701907 c1cnc2c(c1)C(CCC2)NCCc3nc4ccccc4[nH]3 269862a_100015184290_100000058033 [0,0,0,0,0,2|1,0,0]=3 3619 B25R4.1701907 c1cnc2c(c1)C(CCC2)NCCc3nc4ccccc4s3 269862a_200000203819_100000058033 [0,0,0,0,0,2|2,0,0]=4 3620 B25R4.1701907 c1cnc2c(c1)CCCC2NCCc3nc4ccccc4[nH]3 269862a_100015184290_100000067617 [0,0,0,0,0,2|1,0,0]=3 3621 B25R4.1701907 c1cnc2c(c1)CCCC2NCCc3nc4ccccc4s3 269862a_200000203819_100000067617 [0,0,0,0,0,2|2,0,0]=4 3622 B25R4.6453975 C1=C(COc2c1cccc2)CN[C@H]3CCCc4c3cccc4 270004a_100020654734_100000013085 [0,0,0,0,0,2|2,0,0]=4 3623 B25R4.6453975 c1ccc2c(c1)CC(=NNC3CCCc4c3cccc4)CO2 4a_100159326319_100000048293 [0,0,0,0,0,2|2,0,0]=4 3624 B25R4.6453975 c1ccc2c(c1)CCC(=NNC3CCCc4c3cccc4)C2 4a_100159326319_100000212018 [0,0,0,0,0,2|2,0,0]=4 3625 B25R4.6453975 c1ccc2c(c1)CCCC2=NNc3ccc4ccccc4n3 4a_100000212036_100000210882 [0,0,0,0,0,2|1,0,1]=4 3626 B25R4.6453975 c1ccc2c(c1)CCCC2=NNc3cnc4ccccc4n3 4a_100000199685_100000210882 [0,0,0,0,0,2|0,0,2]=4 3627 B25R4.6453975 c1ccc2c(c1)CCCC2NCc3ccc4ccccc4c3 269862a_100000739491_100000210882 [0,0,0,0,0,2|2,0,0]=4 3628 B25R4.6453975 c1ccc2c(c1)CCCC2NCc3cnc4ccccc4c3 269862a_100000742225_100000210882 [0,0,0,0,0,2|1,0,0]=3 3629 B25R4.6453975 c1ccc2c(c1)CCCC2OCc3cc4ccccc4cn3 34a_100000183665_100009869231 [0,0,0,0,0,2|2,0,0]=4 3630 B25R4.6453975 c1ccc2c(c1)CCCC2OCc3cc4ccccc4cn3 7a_100000183665_100009869231 [0,0,0,0,0,2|2,0,0]=4 3631 B25R4.6453975 c1ccc2c(c1)CCCC2OCc3ccc4ccccc4n3 34a_100000183665_100000737579 [0,0,0,0,0,2|2,0,0]=4 3632 B25R4.6453975 c1ccc2c(c1)CCCC2OCc3ccc4ccccc4n3 7a_100000183665_100000737579 [0,0,0,0,0,2|2,0,0]=4 3633 B25R4.6453975 c1ccc2c(c1)CCCC2OCc3cnc4ccccc4n3 7a_100000183665_200000751123 [0,0,0,0,0,2|1,0,1]=4 3634 B25R4.6453975 c1ccc2c(c1)CCCC2OCc3ncc4ccccc4n3 34a_100000183665_100009868571 [0,0,0,0,0,2|1,0,1]=4 3635 B25R4.6453975 c1ccc2c(c1)CCCC2OCc3ncc4ccccc4n3 7a_100000183665_100009868571 [0,0,0,0,0,2|1,0,1]=4 3636 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4cn3 207a_100020654734_100000059776 [0,0,0,0,0,2|1,0,0]=3 3637 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4cn3 270004a_100020654734_100000059776 [0,0,0,0,0,2|1,0,0]=3 3638 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3cc4ccccc4cn3 34a_100020654734_100009869231 [0,0,0,0,0,2|1,0,0]=3 3639 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3ccc4ccccc4c3 207a_100020654734_100000211584 [0,0,0,0,0,2|2,0,0]=4 3640 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3ccc4ccccc4c3 270004a_100020654734_100000211584 [0,0,0,0,0,2|2,0,0]=4 3641 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3ccc4ccccc4c3 34a_100020654734_100011216711 [0,0,0,0,0,2|2,0,0]=4 3642 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3ccc4ccccc4n3 207a_100020654734_100000759686 [0,0,0,0,0,2|1,0,0]=3 3643 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3ccc4ccccc4n3 270004a_100020654734_100000759686 [0,0,0,0,0,2|1,0,0]=3 3644 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3ccc4ccccc4n3 34a_100020654734_100000737579 [0,0,0,0,0,2|1,0,0]=3 3645 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3cnc4ccccc4c3 207a_100020654734_100000750898 [0,0,0,0,0,2|1,0,0]=3 3646 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3cnc4ccccc4c3 270004a_100020654734_100000750898 [0,0,0,0,0,2|1,0,0]=3 3647 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3cnc4ccccc4n3 270004a_100020654734_100000204677 [0,0,0,0,0,2|0,0,1]=3 3648 B25R4.6453975 c1ccc2c(c1)CCC[C@@H]2NCc3ncc4ccccc4n3 34a_100020654734_100009868571 [0,0,0,0,0,2|0,0,1]=3 3649 B25R4.6453975 c1ccc2c(c1)CCOC2CNc3ccc4ccccc4n3 27a_100000755408_100011291633 [0,0,0,0,0,2|2,0,0]=4 3650 B25R4.6453975 c1ccc2c(c1)CCOC2CNc3cnc4ccccc4n3 27a_100000755408_100000756483 [0,0,0,0,0,2|1,0,1]=4 3651 B25R4.6453975 c1ccc2c(c1)CCOC2CNc3ncc4ccccc4n3 27a_100000755408_100000097389 [0,0,0,0,0,2|1,0,1]=4 3652 B25R4.6453975 c1ccc2c(c1)COCC2NCc3cnc4ccccc4c3 269862a_100000742225_100000117393 [0,0,0,0,0,2|2,0,0]=4 3653 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3cc4ccccc4cn3 207a_100015190321_100000059776 [0,0,0,0,0,2|2,0,0]=4 3654 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3cc4ccccc4cn3 2230a_100015190321_100009869231 [0,0,0,0,0,2|2,0,0]=4 3655 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3cc4ccccc4cn3 270004a_100015190321_100000059776 [0,0,0,0,0,2|2,0,0]=4 3656 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3ccc4ccccc4n3 207a_100015190321_100000759686 [0,0,0,0,0,2|2,0,0]=4 3657 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3ccc4ccccc4n3 2230a_100015190321_100000737579 [0,0,0,0,0,2|2,0,0]=4 3658 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3ccc4ccccc4n3 270004a_100015190321_100000759686 [0,0,0,0,0,2|2,0,0]=4 3659 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3cnc4ccccc4c3 207a_100015190321_100000750898 [0,0,0,0,0,2|2,0,0]=4 3660 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3cnc4ccccc4c3 270004a_100015190321_100000750898 [0,0,0,0,0,2|2,0,0]=4 3661 B25R4.6453975 c1ccc2c(c1)OCCC2NCc3cnc4ccccc4n3 270004a_100015190321_100000204677 [0,0,0,0,0,2|1,0,1]=4 3662 B25R4.6453975 c1ccc2c(c1)SCCC2NCc3cnc4ccccc4c3 269862a_100000742225_100000183853 [0,0,0,0,0,2|2,0,0]=4 3663 B25R4.6453975 c1ccc2cc(ncc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000059776 [0,0,0,0,0,2|2,0,0]=4 3664 B25R4.6453975 c1ccc2cc(ncc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100009869231 [0,0,0,0,0,2|2,0,0]=4 3665 B25R4.6453975 c1ccc2cc(ncc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000059776 [0,0,0,0,0,2|2,0,0]=4 3666 B25R4.6453975 c1ccc2nc(ccc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000759686 [0,0,0,0,0,2|2,0,0]=4 3667 B25R4.6453975 c1ccc2nc(ccc2c1)CNC3CCCc4c3ccnc4 2230a_100020634316_100000737579 [0,0,0,0,0,2|2,0,0]=4 3668 B25R4.6453975 c1ccc2nc(ccc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000759686 [0,0,0,0,0,2|2,0,0]=4 3669 B25R4.6453975 c1ccc2nc(cnc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000204677 [0,0,0,0,0,2|1,0,1]=4 3670 B25R4.6453975 c1ccc2ncc(cc2c1)CNC3CCCc4c3ccnc4 207a_100020634316_100000750898 [0,0,0,0,0,2|2,0,0]=4 3671 B25R4.6453975 c1ccc2ncc(cc2c1)CNC3CCCc4c3ccnc4 269862a_100000742225_100000087567 [0,0,0,0,0,2|2,0,0]=4 3672 B25R4.6453975 c1ccc2ncc(cc2c1)CNC3CCCc4c3ccnc4 270004a_100020634316_100000750898 [0,0,0,0,0,2|2,0,0]=4 3673 B25R4.6453975 c1ccc2ncc(cc2c1)CNC3CCCc4c3cncc4 269862a_100000742225_100016991936 [0,0,0,0,0,2|2,0,0]=4 3674 B25R4.6453975 c1cnc2c(c1)C(CCC2)NCc3cnc4ccccc4c3 269862a_100000742225_100000058033 [0,0,0,0,0,2|2,0,0]=4 3675 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3cc4ccccc4cn3 207a_100011259139_100000059776 [0,0,0,0,0,2|2,0,0]=4 3676 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3cc4ccccc4cn3 2230a_100011259139_100009869231 [0,0,0,0,0,2|2,0,0]=4 3677 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3cc4ccccc4cn3 270004a_100011259139_100000059776 [0,0,0,0,0,2|2,0,0]=4 3678 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3ccc4ccccc4n3 207a_100011259139_100000759686 [0,0,0,0,0,2|2,0,0]=4 3679 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3ccc4ccccc4n3 2230a_100011259139_100000737579 [0,0,0,0,0,2|2,0,0]=4 3680 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3ccc4ccccc4n3 270004a_100011259139_100000759686 [0,0,0,0,0,2|2,0,0]=4 3681 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3cnc4ccccc4c3 207a_100011259139_100000750898 [0,0,0,0,0,2|2,0,0]=4 3682 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3cnc4ccccc4c3 269862a_100000742225_100000067617 [0,0,0,0,0,2|2,0,0]=4 3683 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3cnc4ccccc4c3 270004a_100011259139_100000750898 [0,0,0,0,0,2|2,0,0]=4 3684 B25R4.6453975 c1cnc2c(c1)CCCC2NCc3cnc4ccccc4n3 270004a_100011259139_100000204677 [0,0,0,0,0,2|1,0,1]=4 3685 B25R4.113383505 c1ccc2c(c1)CCCN(C2)CCc3nc4ccccc4[nH]3 269982a_100000059810_100015206048 [0,0,0,0,0,2|2,0,0]=4