0 B22R3.1010764 Cc1cc(n[nH]c1=O)SCc2ccc3ncccc3c2 62a_100000703657_100012187101 [0,0,0,0,0,0|4,0,0]=4 1 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2ccc3ccccc3c2 62a_100010363809_100011216711 [0,0,0,0,0,0|3,0,1]=4 2 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2ccc3ccccc3c2 62a_100011216711_100010363809 [0,0,0,0,0,0|3,0,1]=4 3 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2ccc3ncccc3c2 62a_100000703657_100010363809 [0,0,0,0,0,0|2,0,1]=3 4 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2ccc3ncccc3c2 62a_100010363809_100000703657 [0,0,0,0,0,0|2,0,1]=3 5 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2ccc3nccnc3c2 62a_100010363809_200011762199 [0,0,0,0,0,0|3,0,1]=4 6 B22R3.1010764 Cc1nc(c[nH]c1=O)SCc2ccc3nccnc3c2 62a_200011762199_100010363809 [0,0,0,0,0,0|3,0,1]=4 7 B22R3.1010764 Nc1cc(n[nH]c1=O)SCc2ccc3ncccc3c2 62a_100000703657_100000102183 [0,0,0,0,0,0|4,0,0]=4 8 B22R3.1010764 Nc1ncc([nH]c1=O)SCc2ccc3ccccc3c2 62a_100009840296_100011216711 [0,0,0,0,0,0|3,0,1]=4 9 B22R3.1010764 Nc1ncc([nH]c1=O)SCc2ccc3ccccc3c2 62a_100011216711_100009840296 [0,0,0,0,0,0|3,0,1]=4 10 B22R3.1010764 Nc1ncc([nH]c1=O)SCc2ccc3ncccc3c2 62a_100000703657_100009840296 [0,0,0,0,0,0|2,0,1]=3 11 B22R3.1010764 Nc1ncc([nH]c1=O)SCc2ccc3ncccc3c2 62a_100009840296_100000703657 [0,0,0,0,0,0|2,0,1]=3 12 B22R3.1010764 Nc1ncc([nH]c1=O)SCc2ccc3nccnc3c2 62a_100009840296_200011762199 [0,0,0,0,0,0|3,0,1]=4 13 B22R3.1010764 Nc1ncc([nH]c1=O)SCc2ccc3nccnc3c2 62a_200011762199_100009840296 [0,0,0,0,0,0|3,0,1]=4 14 B22R3.1010764 O=c1[nH]cc(cc1Br)SCc2ccc3ccccc3c2 62a_100010125443_100011216711 [0,0,0,0,0,0|4,0,0]=4 15 B22R3.1010764 O=c1[nH]cc(cc1Br)SCc2ccc3ccccc3c2 62a_100011216711_100010125443 [0,0,0,0,0,0|4,0,0]=4 16 B22R3.1010764 O=c1[nH]cc(cc1Br)SCc2ccc3ncccc3c2 62a_100000703657_100010125443 [0,0,0,0,0,0|3,0,0]=3 17 B22R3.1010764 O=c1[nH]cc(cc1Br)SCc2ccc3ncccc3c2 62a_100010125443_100000703657 [0,0,0,0,0,0|3,0,0]=3 18 B22R3.1010764 O=c1[nH]cc(cc1Br)SCc2ccc3nccnc3c2 62a_100010125443_200011762199 [0,0,0,0,0,0|4,0,0]=4 19 B22R3.1010764 O=c1[nH]cc(cc1Br)SCc2ccc3nccnc3c2 62a_200011762199_100010125443 [0,0,0,0,0,0|4,0,0]=4 20 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3ccccc3c2 207a_100000211940_100000051075 [0,0,0,0,0,0|4,0,0]=4 21 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3ccccc3c2 270302a_100000211940_100000051075 [0,0,0,0,0,0|4,0,0]=4 22 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3ncccc3c2 207a_100011198106_100000051075 [0,0,0,0,0,0|3,0,0]=3 23 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3ncccc3c2 270302a_100011198106_100000051075 [0,0,0,0,0,0|3,0,0]=3 24 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3nccnc3c2 207a_100011219565_100000051075 [0,0,0,0,0,0|4,0,0]=4 25 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3nccnc3c2 270302a_100011219565_100000051075 [0,0,0,0,0,0|4,0,0]=4 26 B22R3.1010764 O=c1[nH]cc(cc1Cl)CNc2ccc3ncncc3c2 207a_100000099906_100000051075 [0,0,0,0,0,0|4,0,0]=4 27 B22R3.1010764 O=c1[nH]cc(cc1F)SCc2ccc3ccccc3c2 62a_100000723523_100011216711 [0,0,0,0,0,0|4,0,0]=4 28 B22R3.1010764 O=c1[nH]cc(cc1F)SCc2ccc3ccccc3c2 62a_100011216711_100000723523 [0,0,0,0,0,0|4,0,0]=4 29 B22R3.1010764 O=c1[nH]cc(cc1F)SCc2ccc3ncccc3c2 62a_100000703657_100000723523 [0,0,0,0,0,0|3,0,0]=3 30 B22R3.1010764 O=c1[nH]cc(cc1F)SCc2ccc3ncccc3c2 62a_100000723523_100000703657 [0,0,0,0,0,0|3,0,0]=3 31 B22R3.1010764 O=c1[nH]cc(cc1F)SCc2ccc3nccnc3c2 62a_100000723523_200011762199 [0,0,0,0,0,0|4,0,0]=4 32 B22R3.1010764 O=c1[nH]cc(cc1F)SCc2ccc3nccnc3c2 62a_200011762199_100000723523 [0,0,0,0,0,0|4,0,0]=4 33 B22R3.1010764 O=c1[nH]cc(cc1O)SCc2ccc3ccccc3c2 62a_100011216711_100009814561 [0,0,0,0,0,0|3,0,1]=4 34 B22R3.1010764 O=c1[nH]cc(cc1O)SCc2ccc3ncccc3c2 62a_100000703657_100009814561 [0,0,0,0,0,0|2,0,1]=3 35 B22R3.1010764 O=c1[nH]cc(cc1O)SCc2ccc3nccnc3c2 62a_200011762199_100009814561 [0,0,0,0,0,0|3,0,1]=4 36 B21R3.30927 O=c1ccc(c[nH]1)OCc2ccc3ccccc3c2 34a_100000075641_100011216711 [1,0,0,0,0,0|3,0,0]=4 37 B21R3.30927 O=c1ccc(c[nH]1)OCc2ccc3ncccc3c2 34a_100000075641_100000703657 [1,0,0,0,0,0|2,0,0]=3 38 B21R3.30927 O=c1ccc(c[nH]1)SCc2ccc3ccccc3c2 62a_100000212171_100011216711 [1,0,0,0,0,0|3,0,0]=4 39 B21R3.30927 O=c1ccc(c[nH]1)SCc2ccc3ccccc3c2 62a_100011216711_100000212171 [1,0,0,0,0,0|3,0,0]=4 40 B21R3.30927 O=c1ccc(c[nH]1)SCc2ccc3ncccc3c2 62a_100000212171_100000703657 [1,0,0,0,0,0|2,0,0]=3 41 B21R3.30927 O=c1ccc(c[nH]1)SCc2ccc3ncccc3c2 62a_100000703657_100000212171 [1,0,0,0,0,0|2,0,0]=3 42 B21R3.30927 O=c1ccc(c[nH]1)SCc2ccc3nccnc3c2 62a_100000212171_200011762199 [1,0,0,0,0,0|3,0,0]=4 43 B21R3.30927 O=c1ccc(c[nH]1)SCc2ccc3nccnc3c2 62a_200011762199_100000212171 [1,0,0,0,0,0|3,0,0]=4 44 B21R3.30927 O=c1ccc(n[nH]1)CNc2ccc3ncccc3c2 207a_100011198106_100011361533 [1,0,0,0,0,0|3,0,0]=4 45 B21R3.30927 O=c1ccc(n[nH]1)SCc2ccc3ncccc3c2 62a_100000703657_100009820020 [1,0,0,0,0,0|3,0,0]=4 46 B21R3.30927 O=c1ccc(n[nH]1)SCc2ccc3ncccc3c2 62a_100009820020_100000703657 [1,0,0,0,0,0|3,0,0]=4 47 B21R3.30927 O=c1ncc(c[nH]1)SCc2ccc3ncccc3c2 62a_100000703657_102495366499 [1,0,0,0,0,0|3,0,0]=4 48 B21R3.30927 O=c1ncc(c[nH]1)SCc2ccc3ncccc3c2 62a_102495366499_100000703657 [1,0,0,0,0,0|3,0,0]=4 49 B21R3.469780 O=c1cccc([nH]1)CNc2ccc3ccccc3c2 207a_100000211940_100011935257 [1,0,0,0,0,0|3,0,0]=4 50 B21R3.469780 O=c1cccc([nH]1)CNc2ccc3ncccc3c2 207a_100011198106_100011935257 [1,0,0,0,0,0|2,0,0]=3 51 B21R3.469780 O=c1cccc([nH]1)CNc2ccc3nccnc3c2 207a_100011219565_100011935257 [1,0,0,0,0,0|3,0,0]=4 52 B21R3.469780 O=c1cccc([nH]1)CNc2ccc3ncncc3c2 207a_100000099906_100011935257 [1,0,0,0,0,0|3,0,0]=4 53 B21R3.469780 O=c1cccc([nH]1)OCc2ccc3ccccc3c2 34a_100000033347_100011216711 [1,0,0,0,0,0|3,0,0]=4 54 B21R3.469780 O=c1cccc([nH]1)OCc2ccc3ncccc3c2 34a_100000033347_100000703657 [1,0,0,0,0,0|2,0,0]=3 55 B21R3.469780 O=c1cccc([nH]1)SCc2ccc3ccccc3c2 62a_100011216711_100000752884 [1,0,0,0,0,0|3,0,0]=4 56 B21R3.469780 O=c1cccc([nH]1)SCc2ccc3ncccc3c2 62a_100000703657_100000752884 [1,0,0,0,0,0|2,0,0]=3 57 B21R3.469780 O=c1cccc([nH]1)SCc2ccc3nccnc3c2 62a_200011762199_100000752884 [1,0,0,0,0,0|3,0,0]=4 58 B23R3.66249 O=c1[nH]cc(cc1Cl)CNc2cc(c3ncccc3c2)Cl 207a_200009830422_100000051075 [0,1,0,0,0,0|3,0,0]=4 59 B23R3.66249 O=c1[nH]cc(cc1Cl)CNc2cc(c3ncccc3c2)Cl 270302a_200009830422_100000051075 [0,1,0,0,0,0|3,0,0]=4 60 B23R3.820767 Cc1[nH]c(=O)c(cc1SCc2ccc3ncccc3c2)N 62a_100000703657_100010126670 [0,1,0,0,0,0|3,0,0]=4 61 B23R3.820767 Cc1[nH]c(=O)c(cc1SCc2ccc3ncccc3c2)N 62a_100010126670_100000703657 [0,1,0,0,0,0|3,0,0]=4 62 B23R3.2001749 COc1cc(c[nH]c1=O)SCc2ccc3ncccc3c2 62a_100000703657_100010125397 [0,1,0,0,0,0|2,0,1]=4 63 B23R3.7972456 O=c1[nH]cc(cc1Cl)CNc2ccc3ncc(cc3c2)Br 207a_100009888932_100000051075 [0,1,0,0,0,0|3,0,0]=4 64 B23R3.7972456 O=c1[nH]cc(cc1Cl)CNc2ccc3ncc(cc3c2)Br 270302a_100009888932_100000051075 [0,1,0,0,0,0|3,0,0]=4 65 B23R3.7978101 Cc1ccc2cc(ccc2n1)NCc3c[nH]c(=O)c(c3)Cl 207a_100011216442_100000051075 [0,1,0,0,0,0|3,0,0]=4 66 B23R3.7978101 Cc1ccc2cc(ccc2n1)NCc3c[nH]c(=O)c(c3)Cl 270302a_100011216442_100000051075 [0,1,0,0,0,0|3,0,0]=4 67 B23R3.18034613 Cc1c(c[nH]c(=O)c1N)SCc2ccc3ncccc3c2 62a_100000703657_100010163742 [0,1,0,0,0,0|3,0,0]=4 68 B23R3.18034613 Cc1c(c[nH]c(=O)c1N)SCc2ccc3ncccc3c2 62a_100010163742_100000703657 [0,1,0,0,0,0|3,0,0]=4 69 B23R3.127843063 Cc1cc(cn(c1=O)C)SCc2ccc3ncccc3c2 62a_100000703657_100011830242 [0,1,0,0,0,0|3,0,0]=4 70 B23R3.127843063 Cc1cc(cn(c1=O)C)SCc2ccc3ncccc3c2 62a_100011830242_100000703657 [0,1,0,0,0,0|3,0,0]=4 71 B23R3.127843063 Cn1cc(cc(c1=O)F)SCc2ccc3ncccc3c2 62a_100000703657_100010749421 [0,1,0,0,0,0|3,0,0]=4 72 B23R3.127843063 Cn1cc(cc(c1=O)F)SCc2ccc3ncccc3c2 62a_100010749421_100000703657 [0,1,0,0,0,0|3,0,0]=4 73 B23R3.127843063 Cn1cc(cc(c1=O)N)SCc2ccc3ncccc3c2 62a_100000703657_106446545582 [0,1,0,0,0,0|3,0,0]=4 74 B23R3.127843063 Cn1cc(cc(c1=O)N)SCc2ccc3ncccc3c2 62a_106446545582_100000703657 [0,1,0,0,0,0|3,0,0]=4 75 B23R3.130125423 O=c1[nH]cc(cc1Cl)CNc2ccc3nccc(c3c2)Br 207a_100010074812_100000051075 [0,1,0,0,0,0|3,0,0]=4 76 B23R3.130125423 O=c1[nH]cc(cc1Cl)CNc2ccc3nccc(c3c2)Br 270302a_100010074812_100000051075 [0,1,0,0,0,0|3,0,0]=4 77 B23R3.130125423 O=c1[nH]cc(cc1Cl)CNc2ccc3nccc(c3c2)Cl 207a_100009879071_100000051075 [0,1,0,0,0,0|3,0,0]=4 78 B23R3.130125423 O=c1[nH]cc(cc1Cl)CNc2ccc3nccc(c3c2)Cl 270302a_100009879071_100000051075 [0,1,0,0,0,0|3,0,0]=4 79 B21R3.29979 Cc1nc(c[nH]c1=O)Sc2ccc3ncccc3c2 62a_100010363809_100011215947 [0,0,0,0,1,0|2,0,1]=4 80 B21R3.29979 Cc1nc(c[nH]c1=O)Sc2ccc3ncccc3c2 62a_100011215947_100010363809 [0,0,0,0,1,0|2,0,1]=4 81 B21R3.29979 Nc1ncc([nH]c1=O)Sc2ccc3ncccc3c2 62a_100009840296_100011215947 [0,0,0,0,1,0|2,0,1]=4 82 B21R3.29979 Nc1ncc([nH]c1=O)Sc2ccc3ncccc3c2 62a_100011215947_100009840296 [0,0,0,0,1,0|2,0,1]=4 83 B21R3.29979 O=c1[nH]cc(cc1Br)Sc2ccc3ncccc3c2 62a_100010125443_100011215947 [0,0,0,0,1,0|3,0,0]=4 84 B21R3.29979 O=c1[nH]cc(cc1Br)Sc2ccc3ncccc3c2 62a_100011215947_100010125443 [0,0,0,0,1,0|3,0,0]=4 85 B21R3.29979 O=c1[nH]cc(cc1F)Sc2ccc3ncccc3c2 62a_100000723523_100011215947 [0,0,0,0,1,0|3,0,0]=4 86 B21R3.29979 O=c1[nH]cc(cc1F)Sc2ccc3ncccc3c2 62a_100011215947_100000723523 [0,0,0,0,1,0|3,0,0]=4 87 B21R3.29979 O=c1[nH]cc(cc1O)Sc2ccc3ncccc3c2 62a_100011215947_100009814561 [0,0,0,0,1,0|2,0,1]=4 88 B23R3.1300129 O=c1[nH]cc(cc1Cl)CNCc2ccc3ccccc3c2 207a_100000739491_100000051075 [0,0,0,0,0,1|3,0,0]=4 89 B23R3.1300129 O=c1[nH]cc(cc1Cl)CNCc2ccc3ccccc3c2 270004a_100000739491_100000051075 [0,0,0,0,0,1|3,0,0]=4 90 B23R3.1300129 O=c1[nH]cc(cc1Cl)CNCc2ccc3ncccc3c2 207a_100000238500_100000051075 [0,0,0,0,0,1|2,0,0]=3 91 B23R3.1300129 O=c1[nH]cc(cc1Cl)CNCc2ccc3ncccc3c2 270004a_100000238500_100000051075 [0,0,0,0,0,1|2,0,0]=3 92 B23R3.1300129 O=c1[nH]cc(cc1Cl)CNCc2ccc3nccnc3c2 207a_106354213004_100000051075 [0,0,0,0,0,1|3,0,0]=4 93 B23R3.1300129 O=c1[nH]cc(cc1Cl)CNCc2ccc3nccnc3c2 270004a_106354213004_100000051075 [0,0,0,0,0,1|3,0,0]=4 94 B22R3.261823 Nc1[nH]c(=O)ccc1SCc2ccc3ncccc3c2 62a_100009884077_100000703657 [1,1,0,0,0,0|2,0,0]=4 95 B22R3.261823 O=c1cc(c(c[nH]1)SCc2ccc3ncccc3c2)F 62a_100000703657_100015631685 [1,1,0,0,0,0|2,0,0]=4 96 B22R3.261823 O=c1cc(c(c[nH]1)SCc2ccc3ncccc3c2)F 62a_100015631685_100000703657 [1,1,0,0,0,0|2,0,0]=4 97 B22R3.237891 O=c1cccc([nH]1)CNc2ccc3ncc(cc3c2)Br 207a_100009888932_100011935257 [1,1,0,0,0,0|2,0,0]=4 98 B22R3.237892 O=c1cccc([nH]1)CNc2ccc3nccc(c3c2)Br 207a_100010074812_100011935257 [1,1,0,0,0,0|2,0,0]=4 99 B22R3.237892 O=c1cccc([nH]1)CNc2ccc3nccc(c3c2)Cl 207a_100009879071_100011935257 [1,1,0,0,0,0|2,0,0]=4 100 B22R3.240734 Cn1c(cccc1=O)SCc2ccc3ncccc3c2 62a_100000703657_100000726605 [1,1,0,0,0,0|2,0,0]=4 101 B22R3.240734 Cn1c(cccc1=O)SCc2ccc3ncccc3c2 62a_100000726605_100000703657 [1,1,0,0,0,0|2,0,0]=4 102 B22R3.708628 O=c1cccc([nH]1)CNc2cc(c3ncccc3c2)Cl 207a_200009830422_100011935257 [1,1,0,0,0,0|2,0,0]=4 103 B22R3.5442415 Cc1ccc2cc(ccc2n1)NCc3cccc(=O)[nH]3 207a_100011216442_100011935257 [1,1,0,0,0,0|2,0,0]=4 104 B24R3.1032173 CN(Cc1c[nH]c(=O)c(c1)Cl)Cc2ccc3ncccc3c2 270004a_100000207558_100000051075 [0,1,0,0,0,1|2,0,0]=4 105 B22R3.82875149 NC(=O)C(=O)NN=C1CCc2c1c3c(cc2)cccc3 4a_100000211141_100000076176 [0,0,1,1,0,0|2,0,0]=4 106 B20R2.1757 CNC(=O)C(=O)NCCc1ccc2ccccc2c1 1626a_100000746582_100011218921 [0,0,1,0,1,0|1,0,1]=4 107 B20R2.1757 CNC(=O)C(=O)NCCc1ccc2ccccc2c1 240690a_100000746582_100011218921 [0,0,1,0,1,0|1,0,1]=4 108 B20R2.1757 CNC(=O)C(=O)NCCc1ccc2ccccc2c1 527a_100000746582_100011218921 [0,0,1,0,1,0|1,0,1]=4 109 B20R3.19901 O=c1ccc(c[nH]1)Sc2ccc3ncccc3c2 62a_100000212171_100011215947 [1,0,0,0,1,0|2,0,0]=4 110 B20R3.19901 O=c1ccc(c[nH]1)Sc2ccc3ncccc3c2 62a_100011215947_100000212171 [1,0,0,0,1,0|2,0,0]=4 111 B20R3.86130 O=c1[nH]nc([nH]1)COc2ccc3ncccc3c2 7a_100011215586_100000754189 [1,0,0,0,1,0|2,0,0]=4 112 B20R3.86130 O=c1[nH]nc([nH]1)CSc2ccc3ncccc3c2 62a_100011215947_100000754189 [1,0,0,0,1,0|2,0,0]=4 113 B20R3.298912 O=c1cccc([nH]1)Sc2ccc3ncccc3c2 62a_100011215947_100000752884 [1,0,0,0,1,0|2,0,0]=4 114 B20R3.19568 Cc1nc(c[nH]c1=O)c2ccc3ncccc3c2 271570a_100012351079_100010363809 [0,0,0,0,2,0|1,0,1]=4 115 B20R3.19568 Nc1ncc([nH]c1=O)c2ccc3ncccc3c2 271570a_100012351079_100009840296 [0,0,0,0,2,0|1,0,1]=4 116 B20R3.19568 O=c1[nH]cc(cc1Br)c2ccc3ncccc3c2 271570a_100012351079_100010125443 [0,0,0,0,2,0|2,0,0]=4 117 B20R3.19568 O=c1[nH]cc(cc1F)c2ccc3ncccc3c2 271570a_100012351079_100000723523 [0,0,0,0,2,0|2,0,0]=4 118 B20R3.19568 O=c1[nH]cc(cc1O)c2ccc3ncccc3c2 271570a_100012351079_100009814561 [0,0,0,0,2,0|1,0,1]=4 119 B22R3.46963 O=c1ccc(c[nH]1)COCc2ccc3ccccc3c2 34a_100011999846_100011216711 [1,0,0,0,0,1|2,0,0]=4 120 B22R3.46963 O=c1ccc(c[nH]1)COCc2ccc3ncccc3c2 34a_100011999846_100000703657 [1,0,0,0,0,1|1,0,0]=3 121 B22R3.46963 O=c1ccc(n[nH]1)CNCc2ccc3ncccc3c2 207a_100000238500_100011361533 [1,0,0,0,0,1|2,0,0]=4 122 B22R3.46963 O=c1ccc(n[nH]1)CNCc2ccc3ncccc3c2 270004a_100000238500_100011361533 [1,0,0,0,0,1|2,0,0]=4 123 B22R3.708960 O=c1cccc([nH]1)CNCc2ccc3ccccc3c2 207a_100000739491_100011935257 [1,0,0,0,0,1|2,0,0]=4 124 B22R3.708960 O=c1cccc([nH]1)CNCc2ccc3ccccc3c2 2230a_100000696482_100011216711 [1,0,0,0,0,1|2,0,0]=4 125 B22R3.708960 O=c1cccc([nH]1)CNCc2ccc3ncccc3c2 207a_100000238500_100011935257 [1,0,0,0,0,1|1,0,0]=3 126 B22R3.708960 O=c1cccc([nH]1)CNCc2ccc3ncccc3c2 2230a_100000696482_100000703657 [1,0,0,0,0,1|1,0,0]=3 127 B22R3.708960 O=c1cccc([nH]1)CNCc2ccc3nccnc3c2 207a_106354213004_100011935257 [1,0,0,0,0,1|2,0,0]=4 128 B22R3.708960 O=c1cccc([nH]1)CNCc2ccc3nccnc3c2 2230a_100000696482_200011762199 [1,0,0,0,0,1|2,0,0]=4