0 B23R3.14924 Cc1cc(cc(c1)Nc2cc(ccn2)c3nc(no3)C)C 27a_100000210930_100000069648 [0,0,0,0,0,0|4,0,0]=4 1 B23R3.14924 Cc1cc(cc(c1)Nc2cc(ncn2)n3cc(cn3)C)C 27a_100000210930_100011443397 [0,0,0,0,0,0|4,0,0]=4 2 B23R3.14924 Cc1cc(cc(c1)Sc2cc(ccn2)c3noc(n3)C)C 62a_100011215608_200010982891 [0,0,0,0,0,0|4,0,0]=4 3 B23R3.14924 Cc1cc(cc(c1)Sc2cc(ccn2)c3noc(n3)C)C 62a_200010982891_100011215608 [0,0,0,0,0,0|4,0,0]=4 4 B23R3.14924 Cc1cc(cc(c1)Sc2cccc(n2)n3cc(cn3)C)C 62a_100011215608_200011960883 [0,0,0,0,0,0|4,0,0]=4 5 B23R3.14924 Cc1cc(cc(c1)Sc2cccc(n2)n3cc(cn3)C)C 62a_200011960883_100011215608 [0,0,0,0,0,0|4,0,0]=4 6 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3ccco3)Br 27a_100000695972_100011935169 [1,0,0,0,0,0|2,1,0]=4 7 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3ccco3)C 27a_100000210930_100011935169 [1,0,0,0,0,0|1,1,0]=3 8 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3ccco3)Cl 27a_100012022512_100011935169 [1,0,0,0,0,0|2,1,0]=4 9 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3ccco3)F 27a_100000742734_100011935169 [1,0,0,0,0,0|2,1,0]=4 10 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3ccco3)O 27a_100011995906_100011935169 [1,0,0,0,0,0|2,1,0]=4 11 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3cccs3)C 27a_100000210930_200011934877 [1,0,0,0,0,0|1,0,0]=2 12 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3cccs3)Cl 27a_100012022512_200011934877 [1,0,0,0,0,0|2,0,0]=3 13 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3cccs3)F 27a_100000742734_200011934877 [1,0,0,0,0,0|2,0,0]=3 14 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)c3cccs3)O 27a_100011995906_200011934877 [1,0,0,0,0,0|2,0,0]=3 15 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)n3cccn3)Br 27a_100000695972_100000755582 [1,0,0,0,0,0|3,0,0]=4 16 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)n3cccn3)C 27a_100000210930_100000755582 [1,0,0,0,0,0|2,0,0]=3 17 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)n3cccn3)Cl 27a_100012022512_100000755582 [1,0,0,0,0,0|3,0,0]=4 18 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)n3cccn3)F 27a_100000742734_100000755582 [1,0,0,0,0,0|3,0,0]=4 19 B22R3.221684 Cc1cc(cc(c1)Nc2nccc(n2)n3cccn3)O 27a_100011995906_100000755582 [1,0,0,0,0,0|3,0,0]=4 20 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3ccco3)C 62a_100011215608_100011935169 [1,0,0,0,0,0|2,1,0]=4 21 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3ccco3)C 62a_100011935169_100011215608 [1,0,0,0,0,0|2,1,0]=4 22 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)C 62a_100011215608_200011934877 [1,0,0,0,0,0|2,0,0]=3 23 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)C 62a_200011934877_100011215608 [1,0,0,0,0,0|2,0,0]=3 24 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)F 62a_100011356977_200011934877 [1,0,0,0,0,0|3,0,0]=4 25 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)F 62a_200011934877_100011356977 [1,0,0,0,0,0|3,0,0]=4 26 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)N 62a_100000695972_200011934877 [1,0,0,0,0,0|3,0,0]=4 27 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)N 62a_200011934877_100000695972 [1,0,0,0,0,0|3,0,0]=4 28 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)O 62a_200011934877_100011999630 [1,0,0,0,0,0|3,0,0]=4 29 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)n3cccn3)C 62a_100000755582_100011215608 [1,0,0,0,0,0|3,0,0]=4 30 B22R3.221684 Cc1cc(cc(c1)Sc2nccc(n2)n3cccn3)C 62a_100011215608_100000755582 [1,0,0,0,0,0|3,0,0]=4 31 B22R3.221684 Cc1cc(cc(n1)C)Sc2nccc(n2)c3cccs3 62a_100000066820_200011934877 [1,0,0,0,0,0|3,0,0]=4 32 B22R3.221684 Cc1cc(cc(n1)C)Sc2nccc(n2)c3cccs3 62a_200011934877_100000066820 [1,0,0,0,0,0|3,0,0]=4 33 B22R3.221684 Cc1cc(nc(c1)Sc2nccc(n2)c3cccs3)C 62a_100000069240_200011934877 [1,0,0,0,0,0|3,0,0]=4 34 B22R3.221684 Cc1cc(nc(c1)Sc2nccc(n2)c3cccs3)C 62a_200011934877_100000069240 [1,0,0,0,0,0|3,0,0]=4 35 B22R3.221684 Fc1cc(cc(c1)Nc2nccc(n2)c3cccs3)Br 27a_100000705686_200011934877 [1,0,0,0,0,0|3,0,0]=4 36 B22R3.221684 Fc1cc(cc(c1)Nc2nccc(n2)c3cccs3)Cl 27a_100000686136_200011934877 [1,0,0,0,0,0|3,0,0]=4 37 B22R3.221684 Fc1cc(cc(c1)Nc2nccc(n2)c3cccs3)F 27a_100000233717_200011934877 [1,0,0,0,0,0|3,0,0]=4 38 B22R3.221684 Fc1cc(cc(c1)Nc2nccc(n2)c3cccs3)I 27a_100011356972_200011934877 [1,0,0,0,0,0|3,0,0]=4 39 B22R3.221684 Oc1cc(cc(c1)Nc2nccc(n2)c3cccs3)Cl 27a_100000123917_200011934877 [1,0,0,0,0,0|3,0,0]=4 40 B22R3.221684 Oc1cc(cc(c1)Nc2nccc(n2)c3cccs3)O 27a_100000043371_200011934877 [1,0,0,0,0,0|3,0,0]=4 41 B22R3.226583 Cc1cc(cc(c1)c2cc(ccn2)c3noc(n3)C)C 271570a_100000693139_200010982891 [0,0,0,0,1,0|3,0,0]=4 42 B22R3.226583 Cc1cc(cc(c1)c2cccc(n2)n3cc(cn3)C)C 271570a_100000693139_200011960883 [0,0,0,0,1,0|3,0,0]=4 43 B24R3.19702 Cc1cc(cc(c1)Nc2nccc(n2)c3ccc(cc3)F)C 27a_100000210930_100012232393 [0,0,0,0,0,1|3,0,0]=4 44 B24R3.19702 Cc1cc(cc(c1)Nc2nccc(n2)c3ccc(cc3)N)C 27a_100000210930_200010589329 [0,0,0,0,0,1|3,0,0]=4 45 B24R3.21002 Cc1cc(cc(c1)Nc2nccc(n2)c3cccc(c3)F)C 27a_100000210930_100012356558 [0,0,0,0,0,1|3,0,0]=4 46 B24R3.21002 Cc1cc(cc(c1)Nc2nccc(n2)c3cncc(c3)F)Br 27a_100000695972_200012501547 [0,0,0,0,0,1|3,0,0]=4 47 B24R3.21002 Cc1cc(cc(c1)Nc2nccc(n2)c3cncc(c3)F)C 27a_100000210930_200012501547 [0,0,0,0,0,1|2,0,0]=3 48 B24R3.21002 Cc1cc(cc(c1)Nc2nccc(n2)c3cncc(c3)F)Cl 27a_100012022512_200012501547 [0,0,0,0,0,1|3,0,0]=4 49 B24R3.21002 Cc1cc(cc(c1)Nc2nccc(n2)c3cncc(c3)F)F 27a_100000742734_200012501547 [0,0,0,0,0,1|3,0,0]=4 50 B24R3.21002 Cc1cc(cc(c1)Nc2nccc(n2)c3cncc(c3)F)O 27a_100011995906_200012501547 [0,0,0,0,0,1|3,0,0]=4 51 B24R3.21002 Cc1cc(cc(c1)Sc2nccc(n2)c3cncc(c3)F)C 62a_100011215608_200012501547 [0,0,0,0,0,1|3,0,0]=4 52 B24R3.21002 Cc1cc(cc(c1)Sc2nccc(n2)c3cncc(c3)F)C 62a_200012501547_100011215608 [0,0,0,0,0,1|3,0,0]=4 53 B23R3.47011 CCc1cc(cc(c1)Nc2nccc(n2)c3ccco3)C 27a_100012022893_100011935169 [1,1,0,0,0,0|1,1,0]=4 54 B23R3.47011 CCc1cc(cc(c1)Nc2nccc(n2)c3cccs3)C 27a_100012022893_200011934877 [1,1,0,0,0,0|1,0,0]=3 55 B23R3.47011 CCc1cc(cc(c1)Nc2nccc(n2)n3cccn3)C 27a_100012022893_100000755582 [1,1,0,0,0,0|2,0,0]=4 56 B23R3.47011 COc1cc(cc(c1)Nc2nccc(n2)c3ccco3)C 27a_100012001870_100011935169 [1,1,0,0,0,0|1,1,0]=4 57 B23R3.47011 COc1cc(cc(c1)Nc2nccc(n2)c3cccs3)Br 27a_100000750983_200011934877 [1,1,0,0,0,0|2,0,0]=4 58 B23R3.47011 COc1cc(cc(c1)Nc2nccc(n2)c3cccs3)C 27a_100012001870_200011934877 [1,1,0,0,0,0|1,0,0]=3 59 B23R3.47011 COc1cc(cc(c1)Nc2nccc(n2)c3cccs3)Cl 27a_100000051436_200011934877 [1,1,0,0,0,0|2,0,0]=4 60 B23R3.47011 COc1cc(cc(c1)Nc2nccc(n2)c3cccs3)F 27a_100000687699_200011934877 [1,1,0,0,0,0|2,0,0]=4 61 B23R3.47011 COc1cc(cc(c1)Nc2nccc(n2)c3cccs3)O 27a_200000692186_200011934877 [1,1,0,0,0,0|2,0,0]=4 62 B23R3.47011 COc1cc(cc(c1)Nc2nccc(n2)n3cccn3)C 27a_100012001870_100000755582 [1,1,0,0,0,0|2,0,0]=4 63 B23R3.47011 COc1cc(cc(c1)Sc2nccc(n2)c3cccs3)C 62a_200011934877_100010187550 [1,1,0,0,0,0|2,0,0]=4 64 B23R3.47011 Cc1cc(cc(c1)Nc2nccc(n2)c3cccs3)C#N 27a_100012017395_200011934877 [1,1,0,0,0,0|1,0,1]=4 65 B23R3.47011 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)CO 62a_100000720511_200011934877 [1,1,0,0,0,0|2,0,0]=4 66 B23R3.47011 Cc1cc(cc(c1)Sc2nccc(n2)c3cccs3)CO 62a_200011934877_100000720511 [1,1,0,0,0,0|2,0,0]=4 67 B23R3.47011 OCc1cc(cc(c1)Nc2nccc(n2)c3cccs3)Cl 27a_100012002482_200011934877 [1,1,0,0,0,0|2,0,0]=4 68 B23R3.47011 OCc1cc(cc(c1)Nc2nccc(n2)c3cccs3)O 27a_200000124675_200011934877 [1,1,0,0,0,0|2,0,0]=4 69 B23R3.109931 Cc1cc(cc(c1)N(C)c2nccc(n2)c3cccs3)F 27a_103496528823_200011934877 [1,1,0,0,0,0|2,0,0]=4 70 B23R3.290394 Cc1cc(cc(c1Br)C)Nc2nccc(n2)c3ccco3 27a_100000684802_100011935169 [1,1,0,0,0,0|1,1,0]=4 71 B23R3.290394 Cc1cc(cc(c1Br)C)Nc2nccc(n2)n3cccn3 27a_100000684802_100000755582 [1,1,0,0,0,0|2,0,0]=4 72 B23R3.290394 Cc1cc(cc(c1C)C)Nc2nccc(n2)c3ccco3 27a_100000074974_100011935169 [1,1,0,0,0,0|1,1,0]=4 73 B23R3.290394 Cc1cc(cc(c1C)C)Nc2nccc(n2)c3cccs3 27a_100000074974_200011934877 [1,1,0,0,0,0|1,0,0]=3 74 B23R3.290394 Cc1cc(cc(c1C)C)Nc2nccc(n2)n3cccn3 27a_100000074974_100000755582 [1,1,0,0,0,0|2,0,0]=4 75 B23R3.290394 Cc1cc(cc(c1F)C)Nc2nccc(n2)c3ccco3 27a_100000061604_100011935169 [1,1,0,0,0,0|1,1,0]=4 76 B23R3.290394 Cc1cc(cc(c1F)C)Nc2nccc(n2)c3cccs3 27a_100000061604_200011934877 [1,1,0,0,0,0|1,0,0]=3 77 B23R3.290394 Cc1cc(cc(c1F)C)Nc2nccc(n2)n3cccn3 27a_100000061604_100000755582 [1,1,0,0,0,0|2,0,0]=4 78 B23R3.290394 Cc1cc(cc(c1F)F)Nc2nccc(n2)c3cccs3 27a_100010704045_200011934877 [1,1,0,0,0,0|2,0,0]=4 79 B23R3.290394 Cc1cc(cc(c1I)C)Nc2nccc(n2)c3ccco3 27a_100000215964_100011935169 [1,1,0,0,0,0|1,1,0]=4 80 B23R3.290394 Cc1cc(cc(c1I)C)Nc2nccc(n2)n3cccn3 27a_100000215964_100000755582 [1,1,0,0,0,0|2,0,0]=4 81 B23R3.290394 Cc1cc(cc(c1N)C)Sc2nccc(n2)c3cccs3 62a_100000737279_200011934877 [1,1,0,0,0,0|2,0,0]=4 82 B23R3.290394 Cc1cc(cc(c1N)C)Sc2nccc(n2)c3cccs3 62a_200011934877_100000737279 [1,1,0,0,0,0|2,0,0]=4 83 B23R3.290394 Cc1cc(cc(c1O)Br)Nc2nccc(n2)c3cccs3 27a_100010064301_200011934877 [1,1,0,0,0,0|2,0,0]=4 84 B23R3.290394 Cc1cc(cc(c1O)C)Nc2nccc(n2)c3ccco3 27a_100000703291_100011935169 [1,1,0,0,0,0|1,1,0]=4 85 B23R3.290394 Cc1cc(cc(c1O)C)Nc2nccc(n2)c3cccs3 27a_100000703291_200011934877 [1,1,0,0,0,0|1,0,0]=3 86 B23R3.290394 Cc1cc(cc(c1O)C)Nc2nccc(n2)n3cccn3 27a_100000703291_100000755582 [1,1,0,0,0,0|2,0,0]=4 87 B23R3.290394 Cc1cc(cc(c1O)C)Sc2nccc(n2)c3cccs3 62a_100011216129_200011934877 [1,1,0,0,0,0|2,0,0]=4 88 B23R3.290394 Cc1cc(cc(c1O)C)Sc2nccc(n2)c3cccs3 62a_200011934877_100011216129 [1,1,0,0,0,0|2,0,0]=4 89 B23R3.1969326 Cc1cc(c(c(c1)Nc2nccc(n2)c3ccco3)C)C 27a_100000035412_100011935169 [1,1,0,0,0,0|1,1,0]=4 90 B23R3.1969326 Cc1cc(c(c(c1)Nc2nccc(n2)c3ccco3)O)C 27a_100011216242_100011935169 [1,1,0,0,0,0|1,1,0]=4 91 B23R3.1969326 Cc1cc(c(c(c1)Nc2nccc(n2)c3cccs3)C)C 27a_100000035412_200011934877 [1,1,0,0,0,0|1,0,0]=3 92 B23R3.1969326 Cc1cc(c(c(c1)Nc2nccc(n2)c3cccs3)O)C 27a_100011216242_200011934877 [1,1,0,0,0,0|1,0,0]=3 93 B23R3.1969326 Cc1cc(c(c(c1)Nc2nccc(n2)n3cccn3)C)C 27a_100000035412_100000755582 [1,1,0,0,0,0|2,0,0]=4 94 B23R3.1969326 Cc1cc(c(c(c1)Nc2nccc(n2)n3cccn3)O)C 27a_100011216242_100000755582 [1,1,0,0,0,0|2,0,0]=4 95 B23R3.1969326 Cc1cc(c(c(c1)Sc2nccc(n2)c3cccs3)N)C 62a_100000688863_200011934877 [1,1,0,0,0,0|2,0,0]=4 96 B23R3.1969326 Cc1cc(c(c(c1)Sc2nccc(n2)c3cccs3)N)C 62a_200011934877_100000688863 [1,1,0,0,0,0|2,0,0]=4 97 B23R3.1969326 Cc1cc(c(c(c1)Sc2nccc(n2)c3cccs3)O)C 62a_100011934984_200011934877 [1,1,0,0,0,0|2,0,0]=4 98 B23R3.1969326 Cc1cc(c(c(c1)Sc2nccc(n2)c3cccs3)O)C 62a_200011934877_100011934984 [1,1,0,0,0,0|2,0,0]=4 99 B23R3.1969326 Cc1cc(cc(c1O)Nc2nccc(n2)c3cccs3)Br 27a_100011825904_200011934877 [1,1,0,0,0,0|2,0,0]=4 100 B23R3.1969326 Cc1cc(cc(c1O)Nc2nccc(n2)c3cccs3)F 27a_100000130126_200011934877 [1,1,0,0,0,0|2,0,0]=4 101 B25R3.2498 COc1ccc(cc1)c2ccnc(n2)Nc3cc(cc(c3)C)C 27a_100000210930_100011935080 [0,1,0,0,0,1|2,0,0]=4 102 B25R3.12580 COc1cccc(c1)c2ccnc(n2)Nc3cc(cc(c3)C)C 27a_100000210930_100011935025 [0,1,0,0,0,1|2,0,0]=4 103 B25R3.25027 Cc1cc(cc(c1Br)C)Nc2nccc(n2)c3cncc(c3)F 27a_100000684802_200012501547 [0,1,0,0,0,1|2,0,0]=4 104 B25R3.25027 Cc1cc(cc(c1C)C)Nc2nccc(n2)c3cncc(c3)F 27a_100000074974_200012501547 [0,1,0,0,0,1|2,0,0]=4 105 B25R3.25027 Cc1cc(cc(c1F)C)Nc2nccc(n2)c3cncc(c3)F 27a_100000061604_200012501547 [0,1,0,0,0,1|2,0,0]=4 106 B25R3.25027 Cc1cc(cc(c1I)C)Nc2nccc(n2)c3cncc(c3)F 27a_100000215964_200012501547 [0,1,0,0,0,1|2,0,0]=4 107 B25R3.25027 Cc1cc(cc(c1O)C)Nc2nccc(n2)c3cncc(c3)F 27a_100000703291_200012501547 [0,1,0,0,0,1|2,0,0]=4 108 B25R3.73982 CCc1cc(cc(c1)Nc2nccc(n2)c3cncc(c3)F)C 27a_100012022893_200012501547 [0,1,0,0,0,1|2,0,0]=4 109 B25R3.73982 COc1cc(cc(c1)Nc2nccc(n2)c3cncc(c3)F)C 27a_100012001870_200012501547 [0,1,0,0,0,1|2,0,0]=4 110 B25R3.13706406 Cc1cc(c(c(c1)Nc2nccc(n2)c3cncc(c3)F)C)C 27a_100000035412_200012501547 [0,1,0,0,0,1|2,0,0]=4 111 B25R3.13706406 Cc1cc(c(c(c1)Nc2nccc(n2)c3cncc(c3)F)O)C 27a_100011216242_200012501547 [0,1,0,0,0,1|2,0,0]=4 112 B25R3.13153091 Cc1cc(cc(c1)Nc2nc(cc(n2)Nc3cc([nH]n3)C)C)C 27a_100000210930_100010889330 [0,1,0,0,0,1|2,0,0]=4 113 B23R3.109634 Cc1cc(cc(c1)CNc2nccc(n2)c3ccco3)C 27a_100020591340_100011935169 [1,0,0,0,0,1|1,1,0]=4 114 B23R3.109634 Cc1cc(cc(c1)CNc2nccc(n2)c3cccs3)C 27a_100020591340_200011934877 [1,0,0,0,0,1|1,0,0]=3 115 B23R3.109634 Cc1cc(cc(c1)CNc2nccc(n2)c3cccs3)F 27a_100011830484_200011934877 [1,0,0,0,0,1|2,0,0]=4 116 B23R3.109634 Cc1cc(cc(c1)CNc2nccc(n2)n3cccn3)C 27a_100020591340_100000755582 [1,0,0,0,0,1|2,0,0]=4 117 B23R3.809211 Cc1cccc(c1)Nc2nccc(n2)c3cncc(c3)F 27a_100000188690_200012501547 [1,0,0,0,0,1|2,0,0]=4 118 B23R3.1962463 Cc1cc(cc(c1)Nc2ccc(nn2)c3ccc(o3)C)C 27a_100000210930_200011319710 [0,0,0,0,1,1|1,1,0]=4 119 B23R3.1962463 Cc1cc(cc(c1)Nc2ccc(nn2)c3ccc(s3)C)C 27a_100000210930_200011319686 [0,0,0,0,1,1|1,0,0]=3 120 B23R3.1962463 Cc1cc(cc(c1)Nc2ccc(nn2)c3ccc(s3)C)F 27a_100000742734_200011319686 [0,0,0,0,1,1|2,0,0]=4 121 B23R3.1962463 Cc1cc(cc(c1)Nc2ccc(nn2)c3ccc(s3)C)O 27a_100011995906_200011319686 [0,0,0,0,1,1|2,0,0]=4 122 B23R3.1962463 Cc1cc(cc(c1)Nc2ccc(nn2)c3nnc(o3)C)C 27a_100000210930_100009842727 [0,0,0,0,1,1|1,1,0]=4 123 B23R3.114394 Cc1cc(cc(c1)Nc2ncccc2c3noc(n3)C)C 27a_100000210930_200000087708 [0,0,0,0,1,1|2,0,0]=4 124 B23R3.137374 Cc1cc(cc(c1)c2nccc(n2)c3cncc(c3)F)C 271570a_100000693139_200012501547 [0,0,0,0,1,1|2,0,0]=4 125 B25R3.2580017 Cc1cc(cc(c1)CNc2nccc(n2)c3cncc(c3)F)C 27a_100020591340_200012501547 [0,0,0,0,0,2|2,0,0]=4 126 B25R3.2533697 Cc1cc(cc(c1)C=NNc2nccc(n2)c3ccc(o3)C)C 4a_100010730661_100000745632 [0,0,0,0,0,2|1,1,0]=4