0 B27R4.26996800 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3cccc4)C 4a_100000183277_100000182148 [0,0,0,0,0,0|0,0,0]=0 1 B27R4.26996800 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3cccn4)C 4a_100000183277_100012002220 [0,0,0,0,0,0|1,0,0]=1 2 B27R4.26996800 Cc1cc(nc2c1cccc2)NN=Cc3nc(n4c3cccc4)C 4a_100000183277_100000014345 [0,0,0,0,0,0|3,0,0]=3 3 B27R4.26996800 Cc1cc(nc2c1cccc2)NN=Cc3nn(c4c3cccc4)C 4a_100000183277_100011361492 [0,0,0,0,0,0|1,0,0]=1 4 B27R4.26996800 Cc1nc(nc2c1cccc2)CNCc3cn(c4c3cccc4)C 34a_100011997738_100000736427 [0,0,0,0,0,0|2,0,2]=4 5 B26R4.3691815 Cc1cc(nc2c1cccc2)NCCc3c[nH]c4c3cccc4 27a_100000211132_100000184993 [1,0,0,0,0,0|1,0,1]=3 6 B26R4.3691815 Cc1cc(nc2c1cccc2)NCCc3coc4c3cccc4 27a_100011934666_100000184993 [1,0,0,0,0,0|2,0,1]=4 7 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cccc4 4a_100000183277_100000182151 [1,0,0,0,0,0|0,0,0]=1 8 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cccn4 4a_100000183277_100000187067 [1,0,0,0,0,0|1,0,0]=2 9 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3ccnc4 4a_100000183277_100000087688 [1,0,0,0,0,0|1,0,0]=2 10 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cncc4 4a_100000183277_100011787733 [1,0,0,0,0,0|1,0,0]=2 11 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cncn4 4a_100000183277_100009863359 [1,0,0,0,0,0|2,0,0]=3 12 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3nccc4 4a_100000183277_100000133833 [1,0,0,0,0,0|1,0,0]=2 13 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3cccc4 4a_100000183277_100000052358 [1,0,0,0,0,0|1,0,1]=3 14 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3cccn4 4a_100000183277_100000059808 [1,0,0,0,0,0|2,0,1]=4 15 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3cnn4c3cccc4 4a_100000183277_100011787723 [1,0,0,0,0,0|1,0,1]=3 16 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3coc4c3cccc4 4a_100000183277_100000688544 [1,0,0,0,0,0|1,0,0]=2 17 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3csc4c3cccc4 4a_100000183277_100000239721 [1,0,0,0,0,0|1,0,0]=2 18 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3cccc4 4a_100000183277_100000059708 [1,0,0,0,0,0|1,0,0]=2 19 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3ncc4n3cccc4 4a_100000183277_100000069005 [1,0,0,0,0,0|3,0,0]=4 20 B26R4.3691815 Cc1cc(nc2c1cccc2)NN=Cc3ncn4c3cccc4 4a_100000183277_100000084368 [1,0,0,0,0,0|3,0,0]=4 21 B26R4.3691815 Cc1cc(nc2c1cccc2)SCCc3c[nH]c4c3cccc4 62a_100012354972_100011218569 [1,0,0,0,0,0|2,0,1]=4 22 B26R4.3691815 Cc1nc(nc2c1cccc2)NCCc3c[nH]c4c3cccc4 27a_100000211132_100000046098 [1,0,0,0,0,0|2,0,1]=4 23 B26R4.108946307 Cc1nc(c2n1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100000014345 [1,0,0,0,0,0|3,0,0]=4 24 B26R4.108946307 Cn1cc(c2c1cccc2)C=NNc3ccc4ccccc4c3 4a_100016987534_100000182148 [1,0,0,0,0,0|1,0,0]=2 25 B26R4.108946307 Cn1cc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100000182148 [1,0,0,0,0,0|0,0,0]=1 26 B26R4.108946307 Cn1cc(c2c1cccc2)C=NNc3ccc4cccnc4c3 4a_200016991157_100000182148 [1,0,0,0,0,0|2,0,0]=3 27 B26R4.108946307 Cn1cc(c2c1cccc2)C=NNc3ccc4ncccc4c3 4a_100025741853_100000182148 [1,0,0,0,0,0|2,0,0]=3 28 B26R4.108946307 Cn1cc(c2c1cccc2)C=NNc3cnc4ccccc4n3 4a_100000199685_100000182148 [1,0,0,0,0,0|1,0,0]=2 29 B26R4.108946307 Cn1cc(c2c1cccc2)CNCc3ccc4ccccc4n3 207a_100011997738_100000759686 [1,0,0,0,0,0|1,0,2]=4 30 B26R4.108946307 Cn1cc(c2c1cccc2)CNCc3ccc4ccccc4n3 270004a_100011997738_100000759686 [1,0,0,0,0,0|1,0,2]=4 31 B26R4.108946307 Cn1cc(c2c1cccc2)CNCc3ccc4ccccc4n3 34a_100011997738_100000737579 [1,0,0,0,0,0|1,0,2]=4 32 B26R4.108946307 Cn1cc(c2c1nccc2)C=NNc3ccc4ccccc4c3 4a_100016987534_100012002220 [1,0,0,0,0,0|2,0,0]=3 33 B26R4.108946307 Cn1cc(c2c1nccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100012002220 [1,0,0,0,0,0|1,0,0]=2 34 B26R4.108946307 Cn1cc(c2c1nccc2)C=NNc3ccc4cccnc4c3 4a_200016991157_100012002220 [1,0,0,0,0,0|3,0,0]=4 35 B26R4.108946307 Cn1cc(c2c1nccc2)C=NNc3ccc4ncccc4c3 4a_100025741853_100012002220 [1,0,0,0,0,0|3,0,0]=4 36 B26R4.108946307 Cn1cc(c2c1nccc2)C=NNc3cnc4ccccc4n3 4a_100000199685_100012002220 [1,0,0,0,0,0|2,0,0]=3 37 B26R4.108946307 Cn1nc(c2c1cccc2)C=NNc3ccc4ccccc4c3 4a_100016987534_100011361492 [1,0,0,0,0,0|2,0,0]=3 38 B26R4.108946307 Cn1nc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100011361492 [1,0,0,0,0,0|1,0,0]=2 39 B26R4.108946307 Cn1nc(c2c1cccc2)C=NNc3ccc4cccnc4c3 4a_200016991157_100011361492 [1,0,0,0,0,0|3,0,0]=4 40 B26R4.108946307 Cn1nc(c2c1cccc2)C=NNc3ccc4ncccc4c3 4a_100025741853_100011361492 [1,0,0,0,0,0|3,0,0]=4 41 B26R4.108946307 Cn1nc(c2c1cccc2)C=NNc3cnc4ccccc4n3 4a_100000199685_100011361492 [1,0,0,0,0,0|2,0,0]=3 42 B28R4.36387598 CC(=NNc1cc(c2ccccc2n1)C)c3cn(c4c3cccc4)C 4a_100000183277_100000185445 [0,1,0,0,0,0|0,0,0]=1 43 B28R4.36387598 CC(=NNc1cc(c2ccccc2n1)C)c3nn(c4c3cccc4)C 4a_100000183277_100012180635 [0,1,0,0,0,0|1,0,0]=2 44 B28R4.185972618 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3cccc4C)C 4a_100000183277_100000103792 [0,1,0,0,0,0|0,0,0]=1 45 B28R4.186000300 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3c(ccc4)C)C 4a_100000183277_100000103794 [0,1,0,0,0,0|0,0,0]=1 46 B28R4.191976970 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3cc(cc4)Br)C 4a_100000183277_100009812439 [0,1,0,0,0,0|0,0,0]=1 47 B28R4.191976970 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3cc(cc4)F)C 4a_100000183277_100000050698 [0,1,0,0,0,0|0,0,0]=1 48 B28R4.194056286 Cc1cc(nc2c1cccc2)NN=Cc3c(n(c4c3cccc4)C)C 4a_100000183277_100000009060 [0,1,0,0,0,0|0,0,0]=1 49 B28R4.194056286 Cc1cc(nc2c1cccc2)NN=Cc3c(n(c4c3cccc4)C)Cl 4a_100000183277_100000018933 [0,1,0,0,0,0|0,0,0]=1 50 B28R4.433374762 CCn1cc(c2c1cccc2)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000187703 [0,1,0,0,0,0|0,0,0]=1 51 B28R4.433374762 CCn1cc(c2c1nccc2)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100012003554 [0,1,0,0,0,0|1,0,0]=2 52 B28R4.520285146 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3ccc(c4)Br)C 4a_100000183277_100010195443 [0,1,0,0,0,0|0,0,0]=1 53 B28R4.520285146 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3ccc(c4)F)C 4a_100000183277_100000086894 [0,1,0,0,0,0|0,0,0]=1 54 B28R4.520285146 Cc1ccc2c(cn(c2c1)C)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100012003550 [0,1,0,0,0,0|0,0,0]=1 55 B28R4.891636154 Cn1cc(c2c1cccc2)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100000182148 [0,1,0,0,0,0|1,0,0]=2 56 B28R4.891636154 Cn1cc(c2c1nccc2)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100012002220 [0,1,0,0,0,0|2,0,0]=3 57 B28R4.891636154 Cn1nc(c2c1cccc2)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100011361492 [0,1,0,0,0,0|2,0,0]=3 58 B26R3.4108381 Cc1cc(nc2c1cccc2)NN=CC=CN(C)c3ccccc3 4a_100000183277_100016262311 [0,0,1,0,0,0|0,0,0]=1 59 B26R3.43624577 CC/C=C(/C=NNc1cc(c2ccccc2n1)C)\c3ccccc3 4a_100000183277_200015306110 [0,0,1,0,0,0|1,0,0]=2 60 B26R3.64362355 COc1ccccc1CC(=O)NN=Cc2cn(c3c2cccc3)C 4a_100000189968_100000182148 [0,0,1,0,0,0|3,0,0]=4 61 B26R4.26001894 Cc1cc(nc2c1cccc2)NCc3cn(c4c3cccc4)C 27a_100011997738_100000184993 [0,0,0,0,1,0|0,0,1]=2 62 B26R4.26001894 Cc1cc(nc2c1cccc2)NCc3nn(c4c3cccc4)C 27a_200011934655_100000184993 [0,0,0,0,1,0|1,0,1]=3 63 B26R4.26001894 Cc1cc(nc2c1cccc2)NN=C3CC(c4c3cccc4)C 4a_100000183277_100000750356 [0,0,0,0,1,0|1,0,1]=3 64 B26R4.26001894 Cc1nc(nc2c1cccc2)NCc3cn(c4c3cccc4)C 27a_100011997738_100000046098 [0,0,0,0,1,0|1,0,1]=3 65 B26R4.26001894 Cc1nc(nc2c1cccc2)NCc3nn(c4c3cccc4)C 27a_200011934655_100000046098 [0,0,0,0,1,0|2,0,1]=4 66 B26R4.26001894 Cn1cc(c2c1cccc2)CNc3cc(=O)n4ccccc4n3 27a_100011997738_100000707704 [0,0,0,0,1,0|2,0,1]=4 67 B26R4.26001894 Cn1cc(c2c1cccc2)CNc3nc(c4ccccc4n3)N 27a_100011997738_100000690328 [0,0,0,0,1,0|2,0,1]=4 68 B26R4.26001894 Cn1cc(c2c1cccc2)CNc3nc(c4ccccc4n3)O 27a_100011997738_100000187174 [0,0,0,0,1,0|2,0,1]=4 69 B26R4.387203246 Cn1cc(c2c1cccc2)C=NNc3nc4ccccc4n3C 4a_100000738164_100000182148 [0,0,0,0,1,0|1,0,0]=2 70 B26R4.387203246 Cn1cc(c2c1nccc2)C=NNc3nc4ccccc4n3C 4a_100000738164_100012002220 [0,0,0,0,1,0|2,0,0]=3 71 B26R4.387203246 Cn1nc(c2c1cccc2)C=NNc3nc4ccccc4n3C 4a_100000738164_100011361492 [0,0,0,0,1,0|2,0,0]=3 72 B28R4.34974693 Cc1cc(c2ccccc2n1)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000752230 [0,0,0,0,0,1|1,0,0]=2 73 B28R4.191461223 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c(=O)c4c3cccc4 4a_100000183277_100009868339 [0,0,0,0,0,1|2,0,0]=3 74 B28R4.191461223 Cc1cc(nc2c1cccc2)NN=Cc3ccc(c4c3cccc4)Br 4a_100000183277_100012359940 [0,0,0,0,0,1|2,0,0]=3 75 B28R4.191461223 Cc1cc(nc2c1cccc2)NN=Cc3ccc(c4c3cccc4)C 4a_100000183277_100000188529 [0,0,0,0,0,1|1,0,0]=2 76 B28R4.191461223 Cc1cc(nc2c1cccc2)NN=Cc3ccc(c4c3cccc4)Cl 4a_100000183277_100011204464 [0,0,0,0,0,1|2,0,0]=3 77 B28R4.191461223 Cc1cc(nc2c1cccc2)NN=Cc3ccc(c4c3cccc4)F 4a_100000183277_100011934225 [0,0,0,0,0,1|2,0,0]=3 78 B28R4.191461223 Cc1cc(nc2c1cccc2)NN=Cc3ccc(c4c3cccc4)O 4a_100000183277_100011933922 [0,0,0,0,0,1|2,0,0]=3 79 B28R4.191461223 Cc1cc(nc2c1cccc2)NN=Cc3ccc(c4c3cccn4)O 4a_100000183277_100011996884 [0,0,0,0,0,1|3,0,0]=4 80 B28R4.191461223 Cc1cc(nc2c1cccc2)NN=Cc3ccc(c4c3nccc4)Br 4a_100000183277_100000694311 [0,0,0,0,0,1|3,0,0]=4 81 B25R3.2245975 COc1ccccc1CC=NNc2cc(c3ccccc3n2)C 4a_100000183277_100011713418 [1,0,1,0,0,0|1,0,1]=4 82 B25R3.2033477 CN(C=CC=NNc1ccc2ccccc2c1)c3ccccc3 4a_100016987534_100016262311 [1,0,1,0,0,0|1,0,0]=3 83 B25R3.2033477 CN(C=CC=NNc1ccc2ccccc2n1)c3ccccc3 4a_100000212036_100016262311 [1,0,1,0,0,0|0,0,0]=2 84 B25R3.2033477 CN(C=CC=NNc1ccc2cccnc2c1)c3ccccc3 4a_200016991157_100016262311 [1,0,1,0,0,0|2,0,0]=4 85 B25R3.2033477 CN(C=CC=NNc1ccc2ncccc2c1)c3ccccc3 4a_100025741853_100016262311 [1,0,1,0,0,0|2,0,0]=4 86 B25R3.2033477 CN(C=CC=NNc1cnc2ccccc2n1)c3ccccc3 4a_100000199685_100016262311 [1,0,1,0,0,0|1,0,0]=3 87 B25R3.91906 CC/C=C(/C=NNc1ccc2ccccc2c1)\c3ccccc3 4a_100016987534_200015306110 [1,0,1,0,0,0|2,0,0]=4 88 B25R3.91906 CC/C=C(/C=NNc1ccc2ccccc2n1)\c3ccccc3 4a_100000212036_200015306110 [1,0,1,0,0,0|1,0,0]=3 89 B25R3.91906 CC/C=C(/C=NNc1cnc2ccccc2n1)\c3ccccc3 4a_100000199685_200015306110 [1,0,1,0,0,0|2,0,0]=4 90 B25R3.4656061 C/C=C(/C=NNc1cc(c2ccccc2n1)C)\c3ccccc3 4a_100000183277_200015352894 [1,0,1,0,0,0|0,0,0]=2 91 B25R3.4656061 CCC(C=NNc1cc(c2ccccc2n1)C)c3ccccc3 4a_100000183277_100000753018 [1,0,1,0,0,0|0,0,2]=4 92 B25R4.1679030 C(=NNc1ccc2ccccc2c1)c3c[nH]c4c3cccc4 4a_100016987534_100000182151 [2,0,0,0,0,0|1,0,0]=3 93 B25R4.1679030 C(=NNc1ccc2ccccc2c1)c3c[nH]c4c3cccn4 4a_100016987534_100000187067 [2,0,0,0,0,0|2,0,0]=4 94 B25R4.1679030 C(=NNc1ccc2ccccc2c1)c3c[nH]c4c3ccnc4 4a_100016987534_100000087688 [2,0,0,0,0,0|2,0,0]=4 95 B25R4.1679030 C(=NNc1ccc2ccccc2c1)c3c[nH]c4c3cncc4 4a_100016987534_100011787733 [2,0,0,0,0,0|2,0,0]=4 96 B25R4.1679030 C(=NNc1ccc2ccccc2c1)c3c[nH]c4c3nccc4 4a_100016987534_100000133833 [2,0,0,0,0,0|2,0,0]=4 97 B25R4.1679030 C(=NNc1ccc2ccccc2c1)c3coc4c3cccc4 4a_100016987534_100000688544 [2,0,0,0,0,0|2,0,0]=4 98 B25R4.1679030 C(=NNc1ccc2ccccc2c1)c3csc4c3cccc4 4a_100016987534_100000239721 [2,0,0,0,0,0|2,0,0]=4 99 B25R4.1679030 C(=NNc1ccc2ccccc2c1)c3n[nH]c4c3cccc4 4a_100016987534_100000059708 [2,0,0,0,0,0|2,0,0]=4 100 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3c[nH]c4c3cccc4 4a_100000212036_100000182151 [2,0,0,0,0,0|0,0,0]=2 101 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3c[nH]c4c3cccn4 4a_100000212036_100000187067 [2,0,0,0,0,0|1,0,0]=3 102 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3c[nH]c4c3ccnc4 4a_100000212036_100000087688 [2,0,0,0,0,0|1,0,0]=3 103 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3c[nH]c4c3cncc4 4a_100000212036_100011787733 [2,0,0,0,0,0|1,0,0]=3 104 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3c[nH]c4c3cncn4 4a_100000212036_100009863359 [2,0,0,0,0,0|2,0,0]=4 105 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3c[nH]c4c3nccc4 4a_100000212036_100000133833 [2,0,0,0,0,0|1,0,0]=3 106 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3cnc4n3cccc4 4a_100000212036_100000052358 [2,0,0,0,0,0|1,0,1]=4 107 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3cnn4c3cccc4 4a_100000212036_100011787723 [2,0,0,0,0,0|1,0,1]=4 108 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3coc4c3cccc4 4a_100000212036_100000688544 [2,0,0,0,0,0|1,0,0]=3 109 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3csc4c3cccc4 4a_100000212036_100000239721 [2,0,0,0,0,0|1,0,0]=3 110 B25R4.1679030 C(=NNc1ccc2ccccc2n1)c3n[nH]c4c3cccc4 4a_100000212036_100000059708 [2,0,0,0,0,0|1,0,0]=3 111 B25R4.1679030 C(=NNc1ccc2cccnc2c1)c3c[nH]c4c3cccc4 4a_200016991157_100000182151 [2,0,0,0,0,0|2,0,0]=4 112 B25R4.1679030 C(=NNc1ccc2ncccc2c1)c3c[nH]c4c3cccc4 4a_100025741853_100000182151 [2,0,0,0,0,0|2,0,0]=4 113 B25R4.1679030 C(=NNc1cnc2ccccc2n1)c3c[nH]c4c3cccc4 4a_100000199685_100000182151 [2,0,0,0,0,0|1,0,0]=3 114 B25R4.1679030 C(=NNc1cnc2ccccc2n1)c3c[nH]c4c3cccn4 4a_100000199685_100000187067 [2,0,0,0,0,0|2,0,0]=4 115 B25R4.1679030 C(=NNc1cnc2ccccc2n1)c3c[nH]c4c3ccnc4 4a_100000199685_100000087688 [2,0,0,0,0,0|2,0,0]=4 116 B25R4.1679030 C(=NNc1cnc2ccccc2n1)c3c[nH]c4c3cncc4 4a_100000199685_100011787733 [2,0,0,0,0,0|2,0,0]=4 117 B25R4.1679030 C(=NNc1cnc2ccccc2n1)c3c[nH]c4c3nccc4 4a_100000199685_100000133833 [2,0,0,0,0,0|2,0,0]=4 118 B25R4.1679030 C(=NNc1cnc2ccccc2n1)c3coc4c3cccc4 4a_100000199685_100000688544 [2,0,0,0,0,0|2,0,0]=4 119 B25R4.1679030 C(=NNc1cnc2ccccc2n1)c3csc4c3cccc4 4a_100000199685_100000239721 [2,0,0,0,0,0|2,0,0]=4 120 B25R4.1679030 C(=NNc1cnc2ccccc2n1)c3n[nH]c4c3cccc4 4a_100000199685_100000059708 [2,0,0,0,0,0|2,0,0]=4 121 B25R4.1679030 c1ccc2nc(ccc2c1)NCCc3c[nH]c4c3cccc4 27a_100000211132_100011291633 [2,0,0,0,0,0|1,0,1]=4 122 B27R3.20929036 CN(C=CC=NNc1nc2ccccc2n(c1=O)C)c3ccccc3 4a_100000118634_100016262311 [0,1,1,0,0,0|1,0,0]=3 123 B27R3.85422764 CC(=CC(=O)NNC(=O)c1cn(c2c1cccc2)C)c3ccccc3 22a_100000198693_100000743005 [0,1,1,0,0,0|1,0,1]=4 124 B27R3.49138414 CC/C=C(/C=NNc1nc2ccccc2n(c1=O)C)\c3ccccc3 4a_100000118634_200015306110 [0,1,1,0,0,0|2,0,0]=4 125 B27R3.487464530 COC(=O)C(C=NNc1cc(c2ccccc2n1)C)c3ccccc3 4a_100000183277_100000075785 [0,1,1,0,0,0|1,0,1]=4 126 B27R4.1078920 COc1cc(nc2c1cccc2)NCCc3c[nH]c4c3cccc4 27a_100000211132_200010892118 [1,1,0,0,0,0|1,0,1]=4 127 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3c[nH]c4c3cccc4 4a_100000183277_100000187069 [1,1,0,0,0,0|0,0,0]=2 128 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3c[nH]c4c3cccn4 4a_100000183277_100000688311 [1,1,0,0,0,0|1,0,0]=3 129 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3c[nH]c4c3ccnc4 4a_100000183277_100009852523 [1,1,0,0,0,0|1,0,0]=3 130 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3c[nH]c4c3cncc4 4a_100000183277_100012001811 [1,1,0,0,0,0|1,0,0]=3 131 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3cnc4n3cccc4 4a_100000183277_100009863281 [1,1,0,0,0,0|1,0,1]=4 132 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3cnn4c3cccc4 4a_100000183277_100012186296 [1,1,0,0,0,0|1,0,1]=4 133 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3coc4c3cccc4 4a_100000183277_100000751042 [1,1,0,0,0,0|1,0,0]=3 134 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3csc4c3cccc4 4a_100000183277_100000689785 [1,1,0,0,0,0|1,0,0]=3 135 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3n[nH]c4c3cccc4 4a_100000183277_100000087549 [1,1,0,0,0,0|1,0,0]=3 136 B27R4.3937798 CC(=NNc1cc(c2ccccc2n1)C)c3n[nH]c4c3cccn4 4a_100000183277_100009865035 [1,1,0,0,0,0|2,0,0]=4 137 B27R4.3937798 Cc1cc(nc2c1cccc2)NNC(=O)C3=CCc4c3cccc4 22a_100000183277_100000037392 [1,1,0,0,0,0|1,0,1]=4 138 B27R4.3937798 Cc1cc(nc2c1cccc2)SCC(=O)c3c[nH]c4c3cccc4 62a_100012354972_100000183220 [1,1,0,0,0,0|2,0,0]=4 139 B27R4.14666754 Cc1cc(nc2c1cccc2)NCCc3c[nH]c4c3ccc(c4)F 27a_100000709932_100000184993 [1,1,0,0,0,0|1,0,1]=4 140 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3ccc(c4)Br 4a_100000183277_100011361519 [1,1,0,0,0,0|0,0,0]=2 141 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3ccc(c4)Cl 4a_100000183277_100000743236 [1,1,0,0,0,0|0,0,0]=2 142 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3ccc(c4)F 4a_100000183277_100000743237 [1,1,0,0,0,0|0,0,0]=2 143 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3ccc(n4)Cl 4a_100000183277_100000099817 [1,1,0,0,0,0|1,0,0]=3 144 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cnc(c4)Br 4a_100000183277_100009814794 [1,1,0,0,0,0|1,0,0]=3 145 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cnc(c4)Cl 4a_100000183277_100000050511 [1,1,0,0,0,0|1,0,0]=3 146 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3ncc(c4)Br 4a_100000183277_100010168556 [1,1,0,0,0,0|1,0,0]=3 147 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3ncc(n4)Br 4a_100000183277_203552255033 [1,1,0,0,0,0|2,0,0]=4 148 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3ccc(c4)Br 4a_100000183277_100010220036 [1,1,0,0,0,0|1,0,1]=4 149 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3ccc(c4)Cl 4a_100000183277_100000097743 [1,1,0,0,0,0|1,0,1]=4 150 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3ccc(c4)F 4a_100000183277_100010721590 [1,1,0,0,0,0|1,0,1]=4 151 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3ccc(c4)Br 4a_100000183277_100009817233 [1,1,0,0,0,0|1,0,0]=3 152 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3ccc(c4)Cl 4a_100000183277_100000086628 [1,1,0,0,0,0|1,0,0]=3 153 B27R4.14666754 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3ccc(c4)F 4a_100000183277_100000086633 [1,1,0,0,0,0|1,0,0]=3 154 B27R4.14666754 Cc1ccc2c(c[nH]c2c1)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000743239 [1,1,0,0,0,0|0,0,0]=2 155 B27R4.14666754 Cc1ccc2c(c[nH]c2c1)CCNc3cc(c4ccccc4n3)C 27a_100000709966_100000184993 [1,1,0,0,0,0|1,0,1]=4 156 B27R4.14666754 Cc1ccn2c(cnc2c1)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000097740 [1,1,0,0,0,0|1,0,1]=4 157 B27R4.18977886 Cc1cc(nc2c1cc(cc2)F)NCCc3c[nH]c4c3cccc4 27a_100000211132_200000079853 [1,1,0,0,0,0|1,0,1]=4 158 B27R4.25895984 Cc1[nH]c2ccccc2c1C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000186307 [1,1,0,0,0,0|0,0,0]=2 159 B27R4.25895984 Cc1[nH]c2ccccc2c1CCNc3cc(c4ccccc4n3)C 27a_100000750322_100000184993 [1,1,0,0,0,0|1,0,1]=4 160 B27R4.25895984 Cc1cc(nc2c1cccc2)NN=CC3C(=O)Nc4c3cccc4 4a_100000183277_100000076095 [1,1,0,0,0,0|0,0,1]=3 161 B27R4.25895984 Cc1cc(nc2c1cccc2)NN=Cc3c([nH]c4c3cccc4)Br 4a_100000183277_100010159312 [1,1,0,0,0,0|0,0,0]=2 162 B27R4.25895984 Cc1cc(nc2c1cccc2)NN=Cc3c([nH]c4c3cccc4)Cl 4a_100000183277_100000017700 [1,1,0,0,0,0|0,0,0]=2 163 B27R4.25895984 Cc1cc(nc2c1cccc2)NN=Cc3c4ccccc4nn3C 4a_100000183277_100000066482 [1,1,0,0,0,0|1,0,1]=4 164 B27R4.25895984 Cc1nc2ccccn2c1C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000182234 [1,1,0,0,0,0|1,0,1]=4 165 B27R4.25895984 Cc1sc2ccccc2c1C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000066825 [1,1,0,0,0,0|1,0,0]=3 166 B27R4.89846546 Cn1c(=O)c(nc2c1cccc2)NN=Cc3c[nH]c4c3cccc4 4a_100000118634_100000182151 [1,1,0,0,0,0|1,0,0]=3 167 B27R4.89846546 Cn1c(=O)c(nc2c1cccc2)NN=Cc3c[nH]c4c3cccn4 4a_100000118634_100000187067 [1,1,0,0,0,0|2,0,0]=4 168 B27R4.89846546 Cn1c(=O)c(nc2c1cccc2)NN=Cc3c[nH]c4c3ccnc4 4a_100000118634_100000087688 [1,1,0,0,0,0|2,0,0]=4 169 B27R4.89846546 Cn1c(=O)c(nc2c1cccc2)NN=Cc3c[nH]c4c3cncc4 4a_100000118634_100011787733 [1,1,0,0,0,0|2,0,0]=4 170 B27R4.89846546 Cn1c(=O)c(nc2c1cccc2)NN=Cc3c[nH]c4c3nccc4 4a_100000118634_100000133833 [1,1,0,0,0,0|2,0,0]=4 171 B27R4.89846546 Cn1c(=O)c(nc2c1cccc2)NN=Cc3coc4c3cccc4 4a_100000118634_100000688544 [1,1,0,0,0,0|2,0,0]=4 172 B27R4.89846546 Cn1c(=O)c(nc2c1cccc2)NN=Cc3csc4c3cccc4 4a_100000118634_100000239721 [1,1,0,0,0,0|2,0,0]=4 173 B27R4.89846546 Cn1c(=O)c(nc2c1cccc2)NN=Cc3n[nH]c4c3cccc4 4a_100000118634_100000059708 [1,1,0,0,0,0|2,0,0]=4 174 B27R4.107925445 Cc1cc(nc2c1cccc2)NCCc3c[nH]c4c3cc(cc4)Br 27a_100016990496_100000184993 [1,1,0,0,0,0|1,0,1]=4 175 B27R4.107925445 Cc1cc(nc2c1cccc2)NCCc3c[nH]c4c3cc(cc4)Cl 27a_100000763428_100000184993 [1,1,0,0,0,0|1,0,1]=4 176 B27R4.107925445 Cc1cc(nc2c1cccc2)NCCc3c[nH]c4c3cc(cc4)F 27a_100000725365_100000184993 [1,1,0,0,0,0|1,0,1]=4 177 B27R4.107925445 Cc1cc(nc2c1cccc2)NCCc3c[nH]c4c3cc(cc4)O 27a_100000009091_100000184993 [1,1,0,0,0,0|1,0,1]=4 178 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cc(cc4)Br 4a_100000183277_100000187850 [1,1,0,0,0,0|0,0,0]=2 179 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cc(cc4)Cl 4a_100000183277_100011218521 [1,1,0,0,0,0|0,0,0]=2 180 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cc(cc4)F 4a_100000183277_100000747633 [1,1,0,0,0,0|0,0,0]=2 181 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cc(cc4)I 4a_100000183277_100010871809 [1,1,0,0,0,0|0,0,0]=2 182 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cc(cc4)O 4a_100000183277_100000059740 [1,1,0,0,0,0|0,0,0]=2 183 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cc(cn4)Br 4a_100000183277_100012356305 [1,1,0,0,0,0|1,0,0]=3 184 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cc(cn4)Cl 4a_100000183277_100009850991 [1,1,0,0,0,0|1,0,0]=3 185 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cc(cn4)F 4a_100000183277_100000118109 [1,1,0,0,0,0|1,0,0]=3 186 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3nc(cc4)F 4a_100000183277_100009880496 [1,1,0,0,0,0|1,0,0]=3 187 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3nc(cn4)Br 4a_100000183277_100010090762 [1,1,0,0,0,0|2,0,0]=4 188 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3cc(cc4)Br 4a_100000183277_100000757799 [1,1,0,0,0,0|1,0,1]=4 189 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3cc(cc4)Cl 4a_100000183277_100000095899 [1,1,0,0,0,0|1,0,1]=4 190 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3csc4c3cc(cc4)Br 4a_100000183277_100009814807 [1,1,0,0,0,0|1,0,0]=3 191 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3csc4c3cc(cc4)Cl 4a_100000183277_100000040578 [1,1,0,0,0,0|1,0,0]=3 192 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3cc(cc4)Br 4a_100000183277_100009888965 [1,1,0,0,0,0|1,0,0]=3 193 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3cc(cc4)Cl 4a_100000183277_100000086617 [1,1,0,0,0,0|1,0,0]=3 194 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3cc(cc4)F 4a_100000183277_100000084349 [1,1,0,0,0,0|1,0,0]=3 195 B27R4.107925445 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3cc(cn4)Br 4a_100000183277_100010234984 [1,1,0,0,0,0|2,0,0]=4 196 B27R4.107925445 Cc1ccc2[nH]cc(c2c1)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000757390 [1,1,0,0,0,0|0,0,0]=2 197 B27R4.107925445 Cc1ccc2[nH]cc(c2c1)CCNc3cc(c4ccccc4n3)C 27a_100000008874_100000184993 [1,1,0,0,0,0|1,0,1]=4 198 B27R4.107925445 Cc1ccc2[nH]nc(c2c1)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000050950 [1,1,0,0,0,0|1,0,0]=3 199 B27R4.107925445 Cc1ccc2ncc(n2c1)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000097737 [1,1,0,0,0,0|1,0,1]=4 200 B27R4.107925445 Cc1cnc2[nH]cc(c2c1)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000118124 [1,1,0,0,0,0|1,0,0]=3 201 B27R4.132406205 Cc1cc(nc2c1cccc2)NCCc3c[nH]c4c3cccc4C 27a_100015184521_100000184993 [1,1,0,0,0,0|1,0,1]=4 202 B27R4.132406205 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cccc4Br 4a_100000183277_100009814786 [1,1,0,0,0,0|0,0,0]=2 203 B27R4.132406205 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cccc4C 4a_100000183277_100000040139 [1,1,0,0,0,0|0,0,0]=2 204 B27R4.132406205 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3cccc4Cl 4a_100000183277_100011361501 [1,1,0,0,0,0|0,0,0]=2 205 B27R4.132406205 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3cccc4Br 4a_100000183277_100010272206 [1,1,0,0,0,0|1,0,1]=4 206 B27R4.132406205 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3cccc4Br 4a_100000183277_100009814788 [1,1,0,0,0,0|1,0,0]=3 207 B27R4.132406205 Cc1cc(nc2c1cccc2)NN=Cc3n[nH]c4c3cccc4C 4a_100000183277_100000050344 [1,1,0,0,0,0|1,0,0]=3 208 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3c(ccc4)Br 4a_100000183277_100000693042 [1,1,0,0,0,0|0,0,0]=2 209 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3c(ccc4)C 4a_100000183277_100000743823 [1,1,0,0,0,0|0,0,0]=2 210 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3c(ccc4)Cl 4a_100000183277_100011934431 [1,1,0,0,0,0|0,0,0]=2 211 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3c(ccc4)F 4a_100000183277_100000684713 [1,1,0,0,0,0|0,0,0]=2 212 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3c(ccc4)O 4a_100000183277_100000050372 [1,1,0,0,0,0|0,0,0]=2 213 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3c(ccn4)Br 4a_100000183277_100010212590 [1,1,0,0,0,0|1,0,0]=3 214 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3c[nH]c4c3c(ccn4)Cl 4a_100000183277_100012000600 [1,1,0,0,0,0|1,0,0]=3 215 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3c(ccc4)C 4a_100000183277_100000101704 [1,1,0,0,0,0|1,0,1]=4 216 B27R4.132497323 Cc1cc(nc2c1cccc2)NN=Cc3cnc4n3c(ccc4)Cl 4a_100000183277_100000099958 [1,1,0,0,0,0|1,0,1]=4 217 B27R4.3804304 Cn1cc(c2c1cccc2)C=NNc3nc4ccccc4[nH]c3=O 4a_100000014649_100000182148 [1,1,0,0,0,0|1,0,0]=3 218 B27R4.3804304 Cn1cc(c2c1nccc2)C=NNc3nc4ccccc4[nH]c3=O 4a_100000014649_100012002220 [1,1,0,0,0,0|2,0,0]=4 219 B27R4.3804304 Cn1nc(c2c1cccc2)C=NNc3nc4ccccc4[nH]c3=O 4a_100000014649_100011361492 [1,1,0,0,0,0|2,0,0]=4 220 B27R4.25288837 Cc1cccc2c1n(cc2C=NNc3ccc4ccccc4c3)C 4a_100016987534_100000103792 [1,1,0,0,0,0|1,0,0]=3 221 B27R4.25288837 Cc1cccc2c1n(cc2C=NNc3ccc4ccccc4n3)C 4a_100000212036_100000103792 [1,1,0,0,0,0|0,0,0]=2 222 B27R4.25288837 Cc1cccc2c1n(cc2C=NNc3ccc4cccnc4c3)C 4a_200016991157_100000103792 [1,1,0,0,0,0|2,0,0]=4 223 B27R4.25288837 Cc1cccc2c1n(cc2C=NNc3ccc4ncccc4c3)C 4a_100025741853_100000103792 [1,1,0,0,0,0|2,0,0]=4 224 B27R4.25288837 Cc1cccc2c1n(cc2C=NNc3cnc4ccccc4n3)C 4a_100000199685_100000103792 [1,1,0,0,0,0|1,0,0]=3 225 B27R4.25292092 Cc1cccc2c1c(cn2C)C=NNc3ccc4ccccc4c3 4a_100016987534_100000103794 [1,1,0,0,0,0|1,0,0]=3 226 B27R4.25292092 Cc1cccc2c1c(cn2C)C=NNc3ccc4ccccc4n3 4a_100000212036_100000103794 [1,1,0,0,0,0|0,0,0]=2 227 B27R4.25292092 Cc1cccc2c1c(cn2C)C=NNc3ccc4cccnc4c3 4a_200016991157_100000103794 [1,1,0,0,0,0|2,0,0]=4 228 B27R4.25292092 Cc1cccc2c1c(cn2C)C=NNc3ccc4ncccc4c3 4a_100025741853_100000103794 [1,1,0,0,0,0|2,0,0]=4 229 B27R4.25292092 Cc1cccc2c1c(cn2C)C=NNc3cnc4ccccc4n3 4a_100000199685_100000103794 [1,1,0,0,0,0|1,0,0]=3 230 B27R4.49593556 CC(=NNc1ccc2ccccc2c1)c3cn(c4c3cccc4)C 4a_100016987534_100000185445 [1,1,0,0,0,0|1,0,0]=3 231 B27R4.49593556 CC(=NNc1ccc2ccccc2c1)c3nn(c4c3cccc4)C 4a_100016987534_100012180635 [1,1,0,0,0,0|2,0,0]=4 232 B27R4.49593556 CC(=NNc1ccc2ccccc2n1)c3cn(c4c3cccc4)C 4a_100000212036_100000185445 [1,1,0,0,0,0|0,0,0]=2 233 B27R4.49593556 CC(=NNc1ccc2ccccc2n1)c3nn(c4c3cccc4)C 4a_100000212036_100012180635 [1,1,0,0,0,0|1,0,0]=3 234 B27R4.49593556 CC(=NNc1ccc2cccnc2c1)c3cn(c4c3cccc4)C 4a_200016991157_100000185445 [1,1,0,0,0,0|2,0,0]=4 235 B27R4.49593556 CC(=NNc1ccc2ncccc2c1)c3cn(c4c3cccc4)C 4a_100025741853_100000185445 [1,1,0,0,0,0|2,0,0]=4 236 B27R4.49593556 CC(=NNc1cnc2ccccc2n1)c3cn(c4c3cccc4)C 4a_100000199685_100000185445 [1,1,0,0,0,0|1,0,0]=3 237 B27R4.49593556 CC(=NNc1cnc2ccccc2n1)c3nn(c4c3cccc4)C 4a_100000199685_100012180635 [1,1,0,0,0,0|2,0,0]=4 238 B27R4.78973324 CCn1cc(c2c1cccc2)C=NNc3ccc4ccccc4c3 4a_100016987534_100000187703 [1,1,0,0,0,0|1,0,0]=3 239 B27R4.78973324 CCn1cc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100000187703 [1,1,0,0,0,0|0,0,0]=2 240 B27R4.78973324 CCn1cc(c2c1cccc2)C=NNc3ccc4cccnc4c3 4a_200016991157_100000187703 [1,1,0,0,0,0|2,0,0]=4 241 B27R4.78973324 CCn1cc(c2c1cccc2)C=NNc3ccc4ncccc4c3 4a_100025741853_100000187703 [1,1,0,0,0,0|2,0,0]=4 242 B27R4.78973324 CCn1cc(c2c1cccc2)C=NNc3cnc4ccccc4n3 4a_100000199685_100000187703 [1,1,0,0,0,0|1,0,0]=3 243 B27R4.78973324 CCn1cc(c2c1nccc2)C=NNc3ccc4ccccc4c3 4a_100016987534_100012003554 [1,1,0,0,0,0|2,0,0]=4 244 B27R4.78973324 CCn1cc(c2c1nccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100012003554 [1,1,0,0,0,0|1,0,0]=3 245 B27R4.78973324 CCn1cc(c2c1nccc2)C=NNc3cnc4ccccc4n3 4a_100000199685_100012003554 [1,1,0,0,0,0|2,0,0]=4 246 B27R4.106245375 Cc1ccc2c(cn(c2c1)C)C=NNc3ccc4ccccc4c3 4a_100016987534_100012003550 [1,1,0,0,0,0|1,0,0]=3 247 B27R4.106245375 Cc1ccc2c(cn(c2c1)C)C=NNc3ccc4ccccc4n3 4a_100000212036_100012003550 [1,1,0,0,0,0|0,0,0]=2 248 B27R4.106245375 Cc1ccc2c(cn(c2c1)C)C=NNc3ccc4cccnc4c3 4a_200016991157_100012003550 [1,1,0,0,0,0|2,0,0]=4 249 B27R4.106245375 Cc1ccc2c(cn(c2c1)C)C=NNc3ccc4ncccc4c3 4a_100025741853_100012003550 [1,1,0,0,0,0|2,0,0]=4 250 B27R4.106245375 Cc1ccc2c(cn(c2c1)C)C=NNc3cnc4ccccc4n3 4a_100000199685_100012003550 [1,1,0,0,0,0|1,0,0]=3 251 B27R4.106245375 Cn1cc(c2c1cc(cc2)Br)C=NNc3ccc4ccccc4c3 4a_100016987534_100010195443 [1,1,0,0,0,0|1,0,0]=3 252 B27R4.106245375 Cn1cc(c2c1cc(cc2)Br)C=NNc3ccc4ccccc4n3 4a_100000212036_100010195443 [1,1,0,0,0,0|0,0,0]=2 253 B27R4.106245375 Cn1cc(c2c1cc(cc2)Br)C=NNc3ccc4cccnc4c3 4a_200016991157_100010195443 [1,1,0,0,0,0|2,0,0]=4 254 B27R4.106245375 Cn1cc(c2c1cc(cc2)Br)C=NNc3ccc4ncccc4c3 4a_100025741853_100010195443 [1,1,0,0,0,0|2,0,0]=4 255 B27R4.106245375 Cn1cc(c2c1cc(cc2)Br)C=NNc3cnc4ccccc4n3 4a_100000199685_100010195443 [1,1,0,0,0,0|1,0,0]=3 256 B27R4.106245375 Cn1cc(c2c1cc(cc2)F)C=NNc3ccc4ccccc4c3 4a_100016987534_100000086894 [1,1,0,0,0,0|1,0,0]=3 257 B27R4.106245375 Cn1cc(c2c1cc(cc2)F)C=NNc3ccc4ccccc4n3 4a_100000212036_100000086894 [1,1,0,0,0,0|0,0,0]=2 258 B27R4.106245375 Cn1cc(c2c1cc(cc2)F)C=NNc3ccc4cccnc4c3 4a_200016991157_100000086894 [1,1,0,0,0,0|2,0,0]=4 259 B27R4.106245375 Cn1cc(c2c1cc(cc2)F)C=NNc3ccc4ncccc4c3 4a_100025741853_100000086894 [1,1,0,0,0,0|2,0,0]=4 260 B27R4.106245375 Cn1cc(c2c1cc(cc2)F)C=NNc3cnc4ccccc4n3 4a_100000199685_100000086894 [1,1,0,0,0,0|1,0,0]=3 261 B27R4.137170673 Cn1cc(c2c1ccc(c2)Br)C=NNc3ccc4ccccc4c3 4a_100016987534_100009812439 [1,1,0,0,0,0|1,0,0]=3 262 B27R4.137170673 Cn1cc(c2c1ccc(c2)Br)C=NNc3ccc4ccccc4n3 4a_100000212036_100009812439 [1,1,0,0,0,0|0,0,0]=2 263 B27R4.137170673 Cn1cc(c2c1ccc(c2)Br)C=NNc3ccc4cccnc4c3 4a_200016991157_100009812439 [1,1,0,0,0,0|2,0,0]=4 264 B27R4.137170673 Cn1cc(c2c1ccc(c2)Br)C=NNc3ccc4ncccc4c3 4a_100025741853_100009812439 [1,1,0,0,0,0|2,0,0]=4 265 B27R4.137170673 Cn1cc(c2c1ccc(c2)Br)C=NNc3cnc4ccccc4n3 4a_100000199685_100009812439 [1,1,0,0,0,0|1,0,0]=3 266 B27R4.137170673 Cn1cc(c2c1ccc(c2)F)C=NNc3ccc4ccccc4c3 4a_100016987534_100000050698 [1,1,0,0,0,0|1,0,0]=3 267 B27R4.137170673 Cn1cc(c2c1ccc(c2)F)C=NNc3ccc4ccccc4n3 4a_100000212036_100000050698 [1,1,0,0,0,0|0,0,0]=2 268 B27R4.137170673 Cn1cc(c2c1ccc(c2)F)C=NNc3ccc4cccnc4c3 4a_200016991157_100000050698 [1,1,0,0,0,0|2,0,0]=4 269 B27R4.137170673 Cn1cc(c2c1ccc(c2)F)C=NNc3ccc4ncccc4c3 4a_100025741853_100000050698 [1,1,0,0,0,0|2,0,0]=4 270 B27R4.137170673 Cn1cc(c2c1ccc(c2)F)C=NNc3cnc4ccccc4n3 4a_100000199685_100000050698 [1,1,0,0,0,0|1,0,0]=3 271 B27R4.227091149 Cc1c(c2ccccc2n1C)C=NNc3ccc4ccccc4c3 4a_100016987534_100000009060 [1,1,0,0,0,0|1,0,0]=3 272 B27R4.227091149 Cc1c(c2ccccc2n1C)C=NNc3ccc4ccccc4n3 4a_100000212036_100000009060 [1,1,0,0,0,0|0,0,0]=2 273 B27R4.227091149 Cc1c(c2ccccc2n1C)C=NNc3ccc4cccnc4c3 4a_200016991157_100000009060 [1,1,0,0,0,0|2,0,0]=4 274 B27R4.227091149 Cc1c(c2ccccc2n1C)C=NNc3ccc4ncccc4c3 4a_100025741853_100000009060 [1,1,0,0,0,0|2,0,0]=4 275 B27R4.227091149 Cc1c(c2ccccc2n1C)C=NNc3cnc4ccccc4n3 4a_100000199685_100000009060 [1,1,0,0,0,0|1,0,0]=3 276 B27R4.227091149 Cn1c(c(c2c1cccc2)C=NNc3ccc4ccccc4c3)Cl 4a_100016987534_100000018933 [1,1,0,0,0,0|1,0,0]=3 277 B27R4.227091149 Cn1c(c(c2c1cccc2)C=NNc3ccc4ccccc4n3)Cl 4a_100000212036_100000018933 [1,1,0,0,0,0|0,0,0]=2 278 B27R4.227091149 Cn1c(c(c2c1cccc2)C=NNc3ccc4cccnc4c3)Cl 4a_200016991157_100000018933 [1,1,0,0,0,0|2,0,0]=4 279 B27R4.227091149 Cn1c(c(c2c1cccc2)C=NNc3ccc4ncccc4c3)Cl 4a_100025741853_100000018933 [1,1,0,0,0,0|2,0,0]=4 280 B27R4.227091149 Cn1c(c(c2c1cccc2)C=NNc3cnc4ccccc4n3)Cl 4a_100000199685_100000018933 [1,1,0,0,0,0|1,0,0]=3 281 B27R4.26996844 Cc1cc(nc2c1cccc2)NN=C3CC(c4c3cccc4)(C)C 4a_100000183277_100000744877 [0,1,0,0,1,0|1,0,1]=4 282 B27R4.26997502 Cc1cc(nc2c1cccc2)NN=C3C(=O)N(c4c3cccc4)C 4a_100000183277_100000183014 [0,1,0,0,1,0|0,0,0]=2 283 B27R4.26997502 Cc1cc(nc2c1cccc2)NN=C3C(=O)N(c4c3cccc4)Cl 4a_100000183277_200000101830 [0,1,0,0,1,0|1,0,0]=3 284 B27R4.43729215 COc1cc(nc2c1cccc2)NCc3cn(c4c3cccc4)C 27a_100011997738_200010892118 [0,1,0,0,1,0|0,0,1]=3 285 B27R4.43729215 COc1cc(nc2c1cccc2)NCc3nn(c4c3cccc4)C 27a_200011934655_200010892118 [0,1,0,0,1,0|1,0,1]=4 286 B27R4.107017057 Cc1cc(nc2c1cc(cc2)F)NCc3cn(c4c3cccc4)C 27a_100011997738_200000079853 [0,1,0,0,1,0|0,0,1]=3 287 B27R4.107017057 Cc1cc(nc2c1cc(cc2)F)NCc3nn(c4c3cccc4)C 27a_200011934655_200000079853 [0,1,0,0,1,0|1,0,1]=4 288 B27R4.6780299 CCn1c(nc2c1cccc2)NN=Cc3cn(c4c3cccc4)C 4a_100015185756_100000182148 [0,1,0,0,1,0|1,0,0]=3 289 B27R4.6780299 CCn1c(nc2c1cccc2)NN=Cc3cn(c4c3cccn4)C 4a_100015185756_100012002220 [0,1,0,0,1,0|2,0,0]=4 290 B27R4.6780299 CCn1c(nc2c1cccc2)NN=Cc3nn(c4c3cccc4)C 4a_100015185756_100011361492 [0,1,0,0,1,0|2,0,0]=4 291 B27R4.25288823 Cc1cccc2c1n(cc2C=NNc3nc4ccccc4n3C)C 4a_100000738164_100000103792 [0,1,0,0,1,0|1,0,0]=3 292 B27R4.132561009 Cc1cccc2c1c(cn2C)C=NNc3nc4ccccc4n3C 4a_100000738164_100000103794 [0,1,0,0,1,0|1,0,0]=3 293 B27R4.137170911 Cn1cc(c2c1ccc(c2)Br)C=NNc3nc4ccccc4n3C 4a_100000738164_100009812439 [0,1,0,0,1,0|1,0,0]=3 294 B27R4.137170911 Cn1cc(c2c1ccc(c2)F)C=NNc3nc4ccccc4n3C 4a_100000738164_100000050698 [0,1,0,0,1,0|1,0,0]=3 295 B27R4.227091251 Cc1c(c2ccccc2n1C)C=NNc3nc4ccccc4n3C 4a_100000738164_100000009060 [0,1,0,0,1,0|1,0,0]=3 296 B27R4.227091251 Cn1c(nc2c1cccc2)NN=Cc3c(n(c4c3cccc4)C)Cl 4a_100000738164_100000018933 [0,1,0,0,1,0|1,0,0]=3 297 B27R4.301092176 CCn1cc(c2c1cccc2)C=NNc3nc4ccccc4n3C 4a_100000738164_100000187703 [0,1,0,0,1,0|1,0,0]=3 298 B27R4.301092176 CCn1cc(c2c1nccc2)C=NNc3nc4ccccc4n3C 4a_100000738164_100012003554 [0,1,0,0,1,0|2,0,0]=4 299 B27R4.373553241 CC(=NNc1nc2ccccc2n1C)c3cn(c4c3cccc4)C 4a_100000738164_100000185445 [0,1,0,0,1,0|1,0,0]=3 300 B27R4.373553241 CC(=NNc1nc2ccccc2n1C)c3nn(c4c3cccc4)C 4a_100000738164_100012180635 [0,1,0,0,1,0|2,0,0]=4 301 B27R4.423321673 Cc1ccc2c(cn(c2c1)C)C=NNc3nc4ccccc4n3C 4a_100000738164_100012003550 [0,1,0,0,1,0|1,0,0]=3 302 B27R4.423321673 Cn1cc(c2c1cc(cc2)Br)C=NNc3nc4ccccc4n3C 4a_100000738164_100010195443 [0,1,0,0,1,0|1,0,0]=3 303 B27R4.423321673 Cn1cc(c2c1cc(cc2)F)C=NNc3nc4ccccc4n3C 4a_100000738164_100000086894 [0,1,0,0,1,0|1,0,0]=3 304 B29R4.361194723 Cc1cc(c2ccccc2n1)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100000752230 [0,1,0,0,0,1|2,0,0]=4 305 B29R4.371345826 Cc1cc(nc2c1cccc2)NN=Cc3cc(=O)n(c4c3cccc4)C 4a_100000183277_100000013873 [0,1,0,0,0,1|2,0,0]=4 306 B29R4.55646747 Cc1cc(nc2c1cccc2)NNC(=O)Cc3cn(c4c3cccc4)C 22a_100000183277_100011218532 [0,1,0,0,0,1|0,0,1]=3 307 B29R4.366976939 CC(=NNc1cc(c2ccccc2n1)C)c3ccc(c4c3cccc4)C 4a_100000183277_100011216557 [0,1,0,0,0,1|1,0,0]=3 308 B29R4.366976939 CC(=NNc1cc(c2ccccc2n1)C)c3ccc(c4c3cccc4)F 4a_100000183277_100011218236 [0,1,0,0,0,1|2,0,0]=4 309 B29R4.366976939 Cc1cc(nc2c1cccc2)NNC(=O)c3ccc(c4c3cccc4)C 22a_100000183277_100011217726 [0,1,0,0,0,1|1,0,1]=4 310 B29R4.580501774 COc1ccc(c2c1cccc2)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100011218379 [0,1,0,0,0,1|1,0,0]=3 311 B29R4.580501774 COc1ncc(c2c1cccc2)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_200010629827 [0,1,0,0,0,1|1,0,0]=3 312 B29R4.2039337320 Cc1ccc(c2c1cccc2)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100000188529 [0,1,0,0,0,1|2,0,0]=4 313 B29R4.2050024153 Cc1cc(nc2c1cccc2)NN=Cc3cc4ccccc4n(c3=O)C 4a_100000183277_100000026196 [0,1,0,0,0,1|0,0,0]=2 314 B29R4.1499405934 CCn1cc(c2c1cccc2)C(=NNc3cc(c4ccccc4n3)C)C 4a_100000183277_200000069586 [0,2,0,0,0,0|0,0,0]=2 315 B29R4.3765814473 CC(=NNc1nc2ccccc2n(c1=O)C)c3cn(c4c3cccc4)C 4a_100000118634_100000185445 [0,2,0,0,0,0|1,0,0]=3 316 B29R4.3765814473 CC(=NNc1nc2ccccc2n(c1=O)C)c3nn(c4c3cccc4)C 4a_100000118634_100012180635 [0,2,0,0,0,0|2,0,0]=4 317 B29R4.356555509 Cc1cccc2c1n(cc2C=NNc3nc4ccccc4n(c3=O)C)C 4a_100000118634_100000103792 [0,2,0,0,0,0|1,0,0]=3 318 B29R4.2013501584 Cc1cccc2c1c(cn2C)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100000103794 [0,2,0,0,0,0|1,0,0]=3 319 B29R4.367925938 Cc1cc(nc2c1cccc2)NN=Cc3c(n(c4c3cc(cc4)O)C)C 4a_100000183277_100010621882 [0,2,0,0,0,0|0,0,0]=2 320 B29R4.582574434 COc1ccc2c(c1)c(cn2C)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000012615 [0,2,0,0,0,0|0,0,0]=2 321 B29R4.2042603600 Cn1cc(c2c1ccc(c2)Br)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100009812439 [0,2,0,0,0,0|1,0,0]=3 322 B29R4.2042603600 Cn1cc(c2c1ccc(c2)F)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100000050698 [0,2,0,0,0,0|1,0,0]=3 323 B29R4.1493526379 CCn1c(c(c2c1cccc2)C=NNc3cc(c4ccccc4n3)C)Cl 4a_100000183277_100010004027 [0,2,0,0,0,0|0,0,0]=2 324 B29R4.1588273723 Cc1c(c2ccccc2n1C)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100000009060 [0,2,0,0,0,0|1,0,0]=3 325 B29R4.1588273723 Cn1c(c(c2c1cccc2)C=NNc3nc4ccccc4n(c3=O)C)Cl 4a_100000118634_100000018933 [0,2,0,0,0,0|1,0,0]=3 326 B29R4.55645309 CC(=O)n1cc(c2c1cccc2)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000039895 [0,2,0,0,0,0|0,0,0]=2 327 B29R4.55645309 CC(=O)n1cc(c2c1nccc2)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000106790 [0,2,0,0,0,0|1,0,0]=3 328 B29R4.55645309 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3cccc4)C(C)C 4a_100000183277_100000013612 [0,2,0,0,0,0|0,0,0]=2 329 B29R4.305536956 C#CCn1cc(c2c1cccc2)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000188329 [0,2,0,0,0,0|0,0,0]=2 330 B29R4.305536956 Cc1cc(nc2c1cccc2)NN=Cc3cn(c4c3cccc4)CCO 4a_100000183277_200011998117 [0,2,0,0,0,0|0,0,0]=2 331 B29R4.3361303551 CCn1cc(c2c1cccc2)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100000187703 [0,2,0,0,0,0|1,0,0]=3 332 B29R4.3361303551 CCn1cc(c2c1nccc2)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100012003554 [0,2,0,0,0,0|2,0,0]=4 333 B29R4.1062203032 COc1ccc2c(cn(c2c1)C)C=NNc3cc(c4ccccc4n3)C 4a_100000183277_100000050535 [0,2,0,0,0,0|0,0,0]=2 334 B29R4.4340881416 Cc1ccc2c(cn(c2c1)C)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100012003550 [0,2,0,0,0,0|1,0,0]=3 335 B29R4.4340881416 Cn1cc(c2c1cc(cc2)Br)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100010195443 [0,2,0,0,0,0|1,0,0]=3 336 B29R4.4340881416 Cn1cc(c2c1cc(cc2)F)C=NNc3nc4ccccc4n(c3=O)C 4a_100000118634_100000086894 [0,2,0,0,0,0|1,0,0]=3 337 B29R4.2643851 CCn1c(nc2ccccc2c1=O)NN=Cc3cn(c4c3cccc4)C 4a_100000017179_100000182148 [0,2,0,0,0,0|2,0,0]=4 338 B27R4.26996686 Cc1cc(nc2c1cccc2)NN=Cc3cccc4c3cccc4 4a_100000183277_100000210074 [0,0,1,1,0,0|1,0,1]=4 339 B27R4.26996686 Cc1cc(nc2c1cccc2)NN=Cc3ccnc4c3cccc4 4a_100000183277_100000239886 [0,0,1,1,0,0|0,0,2]=4 340 B27R4.26996686 Cc1cc(nc2c1cccc2)NN=Cc3cncc4c3cccc4 4a_100000183277_100000684730 [0,0,1,1,0,0|2,0,0]=4 341 B27R4.26997503 Cc1cc(nc2c1cccc2)NCc3ccn(n3)c4ccccc4 27a_100000741621_100000184993 [0,0,1,1,0,0|2,0,0]=4 342 B27R4.26997503 Cc1cc(nc2c1cccc2)NN=C3CCN(C3)c4ccccc4 4a_100000183277_100000745599 [0,0,1,1,0,0|0,0,2]=4 343 B27R4.361198026 Cc1cc(nc2c1cccc2)NN=Cc3cccc4c3n(cc4)C 4a_100000183277_100012002307 [0,0,1,1,0,0|0,0,0]=2 344 B27R4.361198026 Cc1cc(nc2c1cccc2)NN=Cc3cccc4c3n(nc4)C 4a_100000183277_100000102508 [0,0,1,1,0,0|1,0,0]=3 345 B25R3.2250283 CNc1ccccc1C(=NNc2cc(c3ccccc3n2)C)C 4a_100000183277_100000020593 [0,0,1,0,1,0|0,0,1]=3 346 B25R3.2250283 COc1ccccc1C(=NNc2cc(c3ccccc3n2)C)C 4a_100000183277_100000173324 [0,0,1,0,1,0|1,0,1]=4 347 B25R3.46487 CN(C=CC=NNc1nc2ccccc2n1C)c3ccccc3 4a_100000738164_100016262311 [0,0,1,0,1,0|1,0,0]=3 348 B25R3.3642521 CC(=CC=NNc1cc(c2ccccc2n1)C)c3ccccc3 4a_100000183277_200043867958 [0,0,1,0,1,0|1,0,0]=3 349 B25R3.3642521 Cc1cc(nc2c1cccc2)NN=CCC(C)c3ccccc3 4a_100000183277_100000189432 [0,0,1,0,1,0|1,0,1]=4 350 B25R3.157738359 CC(=CC(=O)NCc1cn(c2c1cccc2)C)c3ccccc3 11a_100011997738_100000743005 [0,0,1,0,1,0|1,0,1]=4 351 B25R3.157738359 CC(=CC(=O)NCc1cn(c2c1cccc2)C)c3ccccc3 1626a_100011997738_100000743005 [0,0,1,0,1,0|1,0,1]=4 352 B25R3.157738359 CC(=CC(=O)NCc1cn(c2c1cccc2)C)c3ccccc3 240690a_100011997738_100000743005 [0,0,1,0,1,0|1,0,1]=4 353 B25R3.157738359 CC(=CC(=O)NCc1cn(c2c1cccc2)C)c3ccccc3 527a_100011997738_100000743005 [0,0,1,0,1,0|1,0,1]=4 354 B25R3.28991680 Cc1cc(nc2c1cccc2)NN=Cc3ccccc3C(C)C 4a_100000183277_100011361515 [0,0,1,0,1,0|1,0,1]=4 355 B25R3.28991680 Cc1cc(nc2c1cccc2)NN=Cc3ccccc3N(C)C 4a_100000183277_100000750901 [0,0,1,0,1,0|0,0,1]=3 356 B25R3.28991680 Cc1cc(nc2c1cccc2)NN=Cc3cccnc3N(C)C 4a_100000183277_100000731630 [0,0,1,0,1,0|1,0,1]=4 357 B25R3.181427 CC/C=C(/C=NNc1nc2ccccc2n1C)\c3ccccc3 4a_100000738164_200015306110 [0,0,1,0,1,0|2,0,0]=4 358 B25R3.35151372 C=C=CC(=NNc1cc(c2ccccc2n1)C)c3ccccc3 4a_100000183277_100010632647 [0,0,1,0,1,0|1,0,1]=4 359 B25R3.35151372 CC=CC(=NNc1cc(c2ccccc2n1)C)c3ccccc3 4a_100000183277_100000719237 [0,0,1,0,1,0|1,0,0]=3 360 B25R3.35151372 CCCC(=NNc1cc(c2ccccc2n1)C)c3ccccc3 4a_100000183277_100000211045 [0,0,1,0,1,0|1,0,1]=4 361 B25R3.35151372 COCC(=NNc1cc(c2ccccc2n1)C)c3ccccc3 4a_100000183277_100000765260 [0,0,1,0,1,0|1,0,1]=4 362 B25R3.35151372 CSCC(=NNc1cc(c2ccccc2n1)C)c3ccccc3 4a_100000183277_100000748581 [0,0,1,0,1,0|1,0,1]=4 363 B25R3.35151372 Cc1cc(nc2c1cccc2)NN=C(C=C[O-])c3ccccc3 4a_100000183277_100000198476 [0,0,1,0,1,0|2,0,0]=4 364 B25R3.35151372 Cc1cc(nc2c1cccc2)NN=C(C=NO)c3ccccc3 4a_100000183277_100016272100 [0,0,1,0,1,0|1,0,1]=4 365 B25R4.63097 Cn1c(nc2c1cccc2)NN=Cc3c[nH]c4c3cccc4 4a_100000738164_100000182151 [1,0,0,0,1,0|1,0,0]=3 366 B25R4.63097 Cn1c(nc2c1cccc2)NN=Cc3c[nH]c4c3cccn4 4a_100000738164_100000187067 [1,0,0,0,1,0|2,0,0]=4 367 B25R4.63097 Cn1c(nc2c1cccc2)NN=Cc3c[nH]c4c3ccnc4 4a_100000738164_100000087688 [1,0,0,0,1,0|2,0,0]=4 368 B25R4.63097 Cn1c(nc2c1cccc2)NN=Cc3c[nH]c4c3cncc4 4a_100000738164_100011787733 [1,0,0,0,1,0|2,0,0]=4 369 B25R4.63097 Cn1c(nc2c1cccc2)NN=Cc3c[nH]c4c3nccc4 4a_100000738164_100000133833 [1,0,0,0,1,0|2,0,0]=4 370 B25R4.63097 Cn1c(nc2c1cccc2)NN=Cc3coc4c3cccc4 4a_100000738164_100000688544 [1,0,0,0,1,0|2,0,0]=4 371 B25R4.63097 Cn1c(nc2c1cccc2)NN=Cc3csc4c3cccc4 4a_100000738164_100000239721 [1,0,0,0,1,0|2,0,0]=4 372 B25R4.63097 Cn1c(nc2c1cccc2)NN=Cc3n[nH]c4c3cccc4 4a_100000738164_100000059708 [1,0,0,0,1,0|2,0,0]=4 373 B25R4.4345849 Cc1cc(nc2c1cccc2)NCc3csc4c3cccc4 27a_100000744611_100000184993 [1,0,0,0,1,0|1,0,1]=4 374 B25R4.4345849 Cc1cc(nc2c1cccc2)NN=C3CCc4c3cccc4 4a_100000183277_100000212051 [1,0,0,0,1,0|1,0,1]=4 375 B25R4.4345849 Cc1cc(nc2c1cccc2)NN=C3COc4c3cccc4 4a_100000183277_100000185568 [1,0,0,0,1,0|1,0,1]=4 376 B25R4.4345849 Cc1cc(nc2c1cccc2)NN=C3CSc4c3cccc4 4a_100000183277_100000062685 [1,0,0,0,1,0|1,0,1]=4 377 B25R4.261570929 CC1CC(=NNc2ccc3ccccc3n2)c4c1cccc4 4a_100000212036_100000750356 [1,0,0,0,1,0|1,0,1]=4 378 B25R4.261570929 Cn1cc(c2c1cccc2)CNc3ccc4ccccc4n3 27a_100011997738_100011291633 [1,0,0,0,1,0|0,0,1]=3 379 B25R4.261570929 Cn1cc(c2c1cccc2)CNc3ccc4cccnc4n3 27a_100011997738_100000075685 [1,0,0,0,1,0|1,0,1]=4 380 B25R4.261570929 Cn1cc(c2c1cccc2)CNc3ccc4ccncc4n3 27a_100011997738_100000020162 [1,0,0,0,1,0|1,0,1]=4 381 B25R4.261570929 Cn1cc(c2c1cccc2)CNc3ccc4ncccc4n3 27a_100011997738_100000073381 [1,0,0,0,1,0|1,0,1]=4 382 B25R4.261570929 Cn1cc(c2c1cccc2)CNc3cnc4ccccc4n3 27a_100011997738_100000756483 [1,0,0,0,1,0|1,0,1]=4 383 B25R4.261570929 Cn1cc(c2c1cccc2)CNc3ncc4ccccc4n3 27a_100011997738_100000097389 [1,0,0,0,1,0|1,0,1]=4 384 B25R4.261570929 Cn1nc(c2c1cccc2)CNc3ccc4ccccc4n3 27a_200011934655_100011291633 [1,0,0,0,1,0|1,0,1]=4 385 B25R4.261570935 Cn1cc(c2c1cccc2)C=NNc3nc4ccccc4[nH]3 4a_100000188875_100000182148 [1,0,0,0,1,0|1,0,0]=3 386 B25R4.261570935 Cn1cc(c2c1cccc2)C=NNc3nc4ccccc4o3 4a_100000182307_100000182148 [1,0,0,0,1,0|1,0,0]=3 387 B25R4.261570935 Cn1cc(c2c1cccc2)C=NNc3nc4ccccc4s3 4a_100000181811_100000182148 [1,0,0,0,1,0|1,0,0]=3 388 B25R4.261570935 Cn1cc(c2c1nccc2)C=NNc3nc4ccccc4[nH]3 4a_100000188875_100012002220 [1,0,0,0,1,0|2,0,0]=4 389 B25R4.261570935 Cn1cc(c2c1nccc2)C=NNc3nc4ccccc4o3 4a_100000182307_100012002220 [1,0,0,0,1,0|2,0,0]=4 390 B25R4.261570935 Cn1cc(c2c1nccc2)C=NNc3nc4ccccc4s3 4a_100000181811_100012002220 [1,0,0,0,1,0|2,0,0]=4 391 B25R4.261570935 Cn1nc(c2c1cccc2)C=NNc3nc4ccccc4[nH]3 4a_100000188875_100011361492 [1,0,0,0,1,0|2,0,0]=4 392 B25R4.261570935 Cn1nc(c2c1cccc2)C=NNc3nc4ccccc4o3 4a_100000182307_100011361492 [1,0,0,0,1,0|2,0,0]=4 393 B25R4.261570935 Cn1nc(c2c1cccc2)C=NNc3nc4ccccc4s3 4a_100000181811_100011361492 [1,0,0,0,1,0|2,0,0]=4 394 B25R4.47547055 Cc1cc(nc2c1cccc2)Sc3cn(c4c3cccn4)C 62a_100012354972_100010205794 [0,0,0,0,2,0|2,0,0]=4 395 B25R4.47547055 Cc1cc(nc2c1cccc2)Sc3nn(c4c3cccc4)C 62a_100009817141_100000184993 [0,0,0,0,2,0|2,0,0]=4 396 B25R4.47547055 Cc1cc(nc2c1cccc2)Sc3nn(c4c3cccc4)C 62a_100012354972_100009817141 [0,0,0,0,2,0|2,0,0]=4 397 B25R4.1256291710 Cn1cc(c2c1cccc2)CNc3nc4ccccc4n3C 27a_100011997738_200000239431 [0,0,0,0,2,0|1,0,1]=4 398 B27R4.3937801 Cc1cc(nc2c1cccc2)NCCCc3c[nH]c4c3cccc4 27a_100102525078_100000184993 [1,0,0,0,0,1|1,0,1]=4 399 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=CC3=Cc4ccccc4OC3 4a_100000183277_100000013085 [1,0,0,0,0,1|1,0,1]=4 400 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3cc4ccccc4cn3 4a_100000183277_100000059776 [1,0,0,0,0,1|2,0,0]=4 401 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3ccc4ccccc4c3 4a_100000183277_100000211584 [1,0,0,0,0,1|1,0,0]=3 402 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3ccc4ccccc4n3 4a_100000183277_100000759686 [1,0,0,0,0,1|1,0,0]=3 403 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3ccc4cccnc4c3 4a_100000183277_100011784159 [1,0,0,0,0,1|2,0,0]=4 404 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3ccc4cccnc4n3 4a_100000183277_100000067973 [1,0,0,0,0,1|2,0,0]=4 405 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3ccc4cnccc4c3 4a_100000183277_100000068276 [1,0,0,0,0,1|2,0,0]=4 406 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3ccc4ncccc4c3 4a_100000183277_100000211315 [1,0,0,0,0,1|2,0,0]=4 407 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3cnc4ccccc4c3 4a_100000183277_100000750898 [1,0,0,0,0,1|0,0,1]=3 408 B27R4.26996789 Cc1cc(nc2c1cccc2)NN=Cc3cnc4ccccc4n3 4a_100000183277_100000204677 [1,0,0,0,0,1|0,0,1]=3 409 B27R4.3809776 Cc1cc(c2ccccc2n1)C=NNc3ccc4ccccc4c3 4a_100016987534_100000752230 [1,0,0,0,0,1|2,0,0]=4 410 B27R4.3809776 Cc1cc(c2ccccc2n1)C=NNc3ccc4ccccc4n3 4a_100000212036_100000752230 [1,0,0,0,0,1|1,0,0]=3 411 B27R4.3809776 Cc1cc(c2ccccc2n1)C=NNc3cnc4ccccc4n3 4a_100000199685_100000752230 [1,0,0,0,0,1|2,0,0]=4 412 B27R4.26495863 Brc1ccc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100012359940 [1,0,0,0,0,1|2,0,0]=4 413 B27R4.26495863 Cc1ccc(c2c1cccc2)C=NNc3ccc4ccccc4c3 4a_100016987534_100000188529 [1,0,0,0,0,1|2,0,0]=4 414 B27R4.26495863 Cc1ccc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100000188529 [1,0,0,0,0,1|1,0,0]=3 415 B27R4.26495863 Cc1ccc(c2c1cccc2)C=NNc3cnc4ccccc4n3 4a_100000199685_100000188529 [1,0,0,0,0,1|2,0,0]=4 416 B27R4.26495863 Clc1ccc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100011204464 [1,0,0,0,0,1|2,0,0]=4 417 B27R4.26495863 Fc1ccc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100011934225 [1,0,0,0,0,1|2,0,0]=4 418 B27R4.26495863 O=c1[nH]cc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100009868339 [1,0,0,0,0,1|2,0,0]=4 419 B27R4.26495863 Oc1ccc(c2c1cccc2)C=NNc3ccc4ccccc4n3 4a_100000212036_100011933922 [1,0,0,0,0,1|2,0,0]=4 420 B27R4.26495874 Cn1cc(c2c1cccc2)C=NNc3nnc(c4c3cccc4)Cl 4a_100000015230_100000182148 [0,0,0,0,1,1|2,0,0]=4 421 B27R4.25867818 Cc1cc(c2ccccc2n1)C=NNc3nc4ccccc4n3C 4a_100000738164_100000752230 [0,0,0,0,1,1|2,0,0]=4 422 B27R4.136762028 Cc1ccc(c2c1cccc2)C=NNc3nc4ccccc4n3C 4a_100000738164_100000188529 [0,0,0,0,1,1|2,0,0]=4