0 B17R3.2681 c1ccc2c(c1)CCC2Sc3c[nH]cn3 62a_100000756875_200000721974 [0,0,0,0,0,0|2,0,0]=2 1 B17R3.2681 c1ccc2c(c1)CCC2Sc3c[nH]nn3 62a_100009819707_200000721974 [0,0,0,0,0,0|3,0,0]=3 2 B17R3.2681 c1ccc2c(c1)CCC2Sc3cc[nH]n3 62a_100000062575_200000721974 [0,0,0,0,0,0|4,0,0]=4 3 B17R3.2681 c1ccc2c(c1)CCC2Sc3ccoc3 62a_100011215275_200000721974 [0,0,0,0,0,0|4,0,0]=4 4 B17R3.2681 c1ccc2c(c1)CCC2Sc3ccon3 62a_100009818083_200000721974 [0,0,0,0,0,0|4,0,0]=4 5 B17R3.2681 c1ccc2c(c1)CCC2Sc3ccsc3 62a_100000738268_200000721974 [0,0,0,0,0,0|4,0,0]=4 6 B17R3.2681 c1ccc2c(c1)CCC2Sc3ccsn3 62a_100009818082_200000721974 [0,0,0,0,0,0|4,0,0]=4 7 B17R3.2681 c1ccc2c(c1)CCC2Sc3cn[nH]c3 62a_100000238712_200000721974 [0,0,0,0,0,0|4,0,0]=4 8 B17R3.2681 c1ccc2c(c1)CCC2Sc3cnco3 62a_100020591547_200000721974 [0,0,0,0,0,0|3,0,1]=4 9 B17R3.2681 c1ccc2c(c1)CCC2Sc3cncs3 62a_100011934649_200000721974 [0,0,0,0,0,0|3,0,1]=4 10 B17R3.2681 c1ccc2c(c1)CCC2Sc3cscn3 62a_100000751502_200000721974 [0,0,0,0,0,0|3,0,0]=3 11 B17R3.2681 c1ccc2c(c1)CCC2Sc3nc[nH]n3 62a_100000761765_200000721974 [0,0,0,0,0,0|3,0,0]=3 12 B17R3.2681 c1ccc2c(c1)CCC2Sc3ncc[nH]3 62a_100025796157_200000721974 [0,0,0,0,0,0|4,0,0]=4 13 B17R3.2681 c1ccc2c(c1)CCC2Sc3ncco3 62a_100011787736_200000721974 [0,0,0,0,0,0|4,0,0]=4 14 B17R3.2681 c1ccc2c(c1)CCC2Sc3nccs3 62a_100000211983_200000721974 [0,0,0,0,0,0|4,0,0]=4 15 B17R3.2681 c1ccc2c(c1)CCC2Sc3ncns3 62a_100000693119_200000721974 [0,0,0,0,0,0|3,0,1]=4 16 B17R3.2681 c1ccc2c(c1)CC[C@@H]2Nc3ncns3 27a_100016989578_100000693119 [0,0,0,0,0,0|3,0,1]=4 17 B17R3.2681 c1ccc2c(coc2c1)Sc3c[nH]cn3 62a_100000756875_100009812202 [0,0,0,0,0,0|3,0,1]=4 18 B17R3.2681 c1ccc2c(csc2c1)Sc3c[nH]cn3 62a_100000756875_100009813928 [0,0,0,0,0,0|3,0,1]=4 19 B17R3.2681 c1ccc2c(n[nH]c2c1)Sc3c[nH]cn3 62a_100000756875_100000050141 [0,0,0,0,0,0|4,0,0]=4 20 B17R3.2681 c1ccc2c(noc2c1)Sc3c[nH]cn3 62a_100000756875_200000703156 [0,0,0,0,0,0|4,0,0]=4 21 B17R3.2681 c1ccc2c(noc2c1)Sc3c[nH]cn3 62a_200000703156_100000756875 [0,0,0,0,0,0|4,0,0]=4 22 B17R3.2681 c1coc(c1)SC2CCc3c2cccc3 62a_100009814098_200000721974 [0,0,0,0,0,0|4,0,0]=4 23 B17R3.2681 c1csc(c1)SC2CCc3c2cccc3 62a_100011215356_200000721974 [0,0,0,0,0,0|4,0,0]=4 24 B18R3.184 Cc1[nH]cnc1SC2CCc3c2cccc3 62a_100010186451_200000721974 [0,1,0,0,0,0|2,0,0]=3 25 B18R3.184 Cc1scnc1SC2CCc3c2cccc3 62a_100000732656_200000721974 [0,1,0,0,0,0|3,0,0]=4 26 B18R3.2886 Cc1nc(c[nH]1)SC2CCc3c2cccc3 62a_100009814057_200000721974 [0,1,0,0,0,0|2,0,0]=3 27 B18R3.2886 Cc1nc(cs1)SC2CCc3c2cccc3 62a_100011934587_200000721974 [0,1,0,0,0,0|3,0,0]=4 28 B18R3.2886 Cc1nc(n[nH]1)SC2CCc3c2cccc3 62a_100000732540_200000721974 [0,1,0,0,0,0|3,0,0]=4 29 B18R3.2886 Cc1noc(n1)CC2CCc3c2cccc3 270196a_100000212224_100000756587 [0,1,0,0,0,0|2,0,1]=4 30 B18R3.2886 Cc1noc(n1)CN2CCc3c2cccc3 270196a_100000212224_100000742689 [0,1,0,0,0,0|1,0,1]=3 31 B18R3.2886 Cn1cc(nn1)Cn2ccc3c2cccc3 274090a_200000210301_100011470671 [0,1,0,0,0,0|1,0,2]=4 32 B18R3.2886 Cn1cc(nn1)Cn2cnc3c2cccc3 274090a_200000210301_100000753827 [0,1,0,0,0,0|2,0,1]=4 33 B18R3.2886 Cn1cc(nn1)Cn2nnc3c2cccc3 274090a_200000210301_100000014657 [0,1,0,0,0,0|3,0,0]=4 34 B18R3.2886 Cn1cc(nn1)SC2CCc3c2cccc3 62a_100000760339_200000721974 [0,1,0,0,0,0|3,0,0]=4 35 B18R3.2886 Cn1cnc(c1)SC2CCc3c2cccc3 62a_100000040308_200000721974 [0,1,0,0,0,0|2,0,0]=3 36 B18R3.2886 Cn1cnc(n1)SC2CCc3c2cccc3 62a_100009819955_200000721974 [0,1,0,0,0,0|3,0,0]=4 37 B18R3.2886 Nc1nc(cs1)SC2CCc3c2cccc3 62a_100011998049_200000721974 [0,1,0,0,0,0|3,0,0]=4 38 B18R3.2886 Nc1nc(n[nH]1)SC2CCc3c2cccc3 62a_100015184587_200000721974 [0,1,0,0,0,0|3,0,0]=4 39 B18R3.2886 [13CH3]n1cc(nn1)Cn2ccc3c2cccc3 274090a_200025704644_100011470671 [0,1,0,0,0,0|1,0,2]=4 40 B18R3.2886 [13CH3]n1cc(nn1)Cn2cnc3c2cccc3 274090a_200025704644_100000753827 [0,1,0,0,0,0|2,0,1]=4 41 B18R3.2886 [13CH3]n1cc(nn1)Cn2nnc3c2cccc3 274090a_200025704644_100000014657 [0,1,0,0,0,0|3,0,0]=4 42 B18R3.618712 O=C1CC(c2c1cccc2)Sc3c[nH]cn3 62a_100000756875_100010208147 [0,1,0,0,0,0|2,0,1]=4 43 B18R3.618712 O=C1CC(c2c1cccc2)Sc3c[nH]cn3 62a_100010208147_100000756875 [0,1,0,0,0,0|2,0,1]=4 44 B16R2.5 C=CCC(=O)CN1CCc2c1cccc2 1458a_100000742689_100000210623 [0,0,1,0,0,0|2,0,1]=4 45 B16R2.5 CNNC(=O)CN1CCc2c1cccc2 22a_100016993582_100000742689 [0,0,1,0,0,0|2,0,1]=4 46 B16R2.685 CCN(CC1=NCCN1)c2ccccc2 269982a_100000210013_100000737910 [0,0,1,0,0,0|2,0,1]=4 47 B16R2.685 CCN(CC1=NCCN1)c2ccccc2 34a_100000210013_100000737910 [0,0,1,0,0,0|2,0,1]=4 48 B16R2.685 CCN(Cc1c[nH]cn1)c2ccccc2 2230a_100000210013_100000707719 [0,0,1,0,0,0|0,0,0]=1 49 B16R2.685 CCN(Cc1c[nH]cn1)c2ccccc2 269982a_100000210013_100000707719 [0,0,1,0,0,0|0,0,0]=1 50 B16R2.685 CCN(Cc1c[nH]cn1)c2ccccc2 34a_100000210013_100000707719 [0,0,1,0,0,0|0,0,0]=1 51 B16R2.685 CCN(Cc1ccco1)c2ccccc2 2230a_100000230375_100000210202 [0,0,1,0,0,0|2,0,0]=3 52 B16R2.685 CCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100000204670 [0,0,1,0,0,0|2,0,0]=3 53 B16R2.685 CCN(Cc1ccco1)c2ccccc2 34a_100000230375_100000210202 [0,0,1,0,0,0|2,0,0]=3 54 B16R2.685 CCN(Cc1ccn[nH]1)c2ccccc2 2230a_100000210013_100000728653 [0,0,1,0,0,0|2,0,1]=4 55 B16R2.685 CCN(Cc1ccn[nH]1)c2ccccc2 269982a_100000210013_100000728653 [0,0,1,0,0,0|2,0,1]=4 56 B16R2.685 CCN(Cc1ccn[nH]1)c2ccccc2 34a_100000210013_100000728653 [0,0,1,0,0,0|2,0,1]=4 57 B16R2.685 CCN(Cc1ccon1)c2ccccc2 2230a_100000210013_100000234950 [0,0,1,0,0,0|2,0,0]=3 58 B16R2.685 CCN(Cc1ccon1)c2ccccc2 269982a_100000210013_100000234950 [0,0,1,0,0,0|2,0,0]=3 59 B16R2.685 CCN(Cc1ccon1)c2ccccc2 34a_100000210013_100000234950 [0,0,1,0,0,0|2,0,0]=3 60 B16R2.685 CCN(Cc1ccsc1)c2ccccc2 2230a_100000210013_100011261437 [0,0,1,0,0,0|2,0,0]=3 61 B16R2.685 CCN(Cc1ccsc1)c2ccccc2 269982a_100000210013_100011233845 [0,0,1,0,0,0|2,0,0]=3 62 B16R2.685 CCN(Cc1ccsc1)c2ccccc2 34a_100000210013_100011261437 [0,0,1,0,0,0|2,0,0]=3 63 B16R2.685 CCN(Cc1cncs1)c2ccccc2 2230a_100000210013_100015185245 [0,0,1,0,0,0|1,0,1]=3 64 B16R2.685 CCN(Cc1cncs1)c2ccccc2 269982a_100000210013_100015185245 [0,0,1,0,0,0|1,0,1]=3 65 B16R2.685 CCN(Cc1cncs1)c2ccccc2 34a_100000210013_100015185245 [0,0,1,0,0,0|1,0,1]=3 66 B16R2.685 CCN(Cc1cscn1)c2ccccc2 2230a_100000210013_100000205941 [0,0,1,0,0,0|1,0,0]=2 67 B16R2.685 CCN(Cc1cscn1)c2ccccc2 269982a_100000210013_100000205941 [0,0,1,0,0,0|1,0,0]=2 68 B16R2.685 CCN(Cc1cscn1)c2ccccc2 34a_100000210013_100000205941 [0,0,1,0,0,0|1,0,0]=2 69 B16R2.685 CCN(Cc1ncc[nH]1)c2ccccc2 2230a_100000210013_100016991755 [0,0,1,0,0,0|2,0,0]=3 70 B16R2.685 CCN(Cc1ncc[nH]1)c2ccccc2 269982a_100000210013_100016991755 [0,0,1,0,0,0|2,0,0]=3 71 B16R2.685 CCN(Cc1ncc[nH]1)c2ccccc2 34a_100000210013_100016991755 [0,0,1,0,0,0|2,0,0]=3 72 B16R2.685 CCN(Cc1ncco1)c2ccccc2 2230a_100000210013_103436540062 [0,0,1,0,0,0|2,0,0]=3 73 B16R2.685 CCN(Cc1ncco1)c2ccccc2 269982a_100000210013_103436540062 [0,0,1,0,0,0|2,0,0]=3 74 B16R2.685 CCN(Cc1ncco1)c2ccccc2 34a_100000210013_103436540062 [0,0,1,0,0,0|2,0,0]=3 75 B16R2.685 CCN(Cc1nccs1)c2ccccc2 2230a_100000210013_100015184050 [0,0,1,0,0,0|2,0,0]=3 76 B16R2.685 CCN(Cc1nccs1)c2ccccc2 269982a_100000210013_100015184050 [0,0,1,0,0,0|2,0,0]=3 77 B16R2.685 CCN(Cc1nccs1)c2ccccc2 34a_100000210013_100015184050 [0,0,1,0,0,0|2,0,0]=3 78 B16R2.685 CCN(Cc1ncon1)c2ccccc2 269982a_100000210013_100000233494 [0,0,1,0,0,0|2,0,0]=3 79 B16R2.685 CCN(Cc1ncon1)c2ccccc2 34a_100000210013_100000233494 [0,0,1,0,0,0|2,0,0]=3 80 B16R2.685 CCN(Cc1nnn[nH]1)c2ccccc2 269982a_100000210013_100000765167 [0,0,1,0,0,0|2,0,1]=4 81 B16R2.685 CCN(Cc1nnn[nH]1)c2ccccc2 34a_100000210013_100000765167 [0,0,1,0,0,0|2,0,1]=4 82 B16R2.685 CCN(Cn1cncn1)c2ccccc2 2230a_100000210013_200020645497 [0,0,1,0,0,0|1,0,1]=3 83 B16R2.685 CCN(Cn1cncn1)c2ccccc2 269982a_100000210013_200020645497 [0,0,1,0,0,0|1,0,1]=3 84 B16R2.685 CCN(Cn1cncn1)c2ccccc2 34a_100000210013_200020645497 [0,0,1,0,0,0|1,0,1]=3 85 B16R2.685 FCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100015361967 [0,0,1,0,0,0|3,0,0]=4 86 B16R2.685 FCN(Cc1ccco1)c2ccccc2 34a_100000230375_100015361967 [0,0,1,0,0,0|3,0,0]=4 87 B16R2.1480 BrCc1ncccc1OCc2c[nH]cn2 34a_200020655725_100000707719 [0,0,1,0,0,0|3,0,0]=4 88 B16R2.1480 C#Cc1ccccc1NCc2c[nH]cn2 34a_100011470550_100000707719 [0,0,1,0,0,0|0,0,2]=3 89 B16R2.1480 C#Cc1ccccc1NCc2cscn2 34a_100011470550_100000205941 [0,0,1,0,0,0|1,0,2]=4 90 B16R2.1480 C#Cc1ccccc1OCc2c[nH]cn2 34a_200011470546_100000707719 [0,0,1,0,0,0|1,0,2]=4 91 B16R2.1480 C=Cc1ccccc1NCc2c[nH]cn2 34a_100012022501_100000707719 [0,0,1,0,0,0|0,0,2]=3 92 B16R2.1480 C=Cc1ccccc1NCc2cscn2 207a_100012022501_100000743575 [0,0,1,0,0,0|1,0,2]=4 93 B16R2.1480 C=Cc1ccccc1NCc2cscn2 34a_100012022501_100000205941 [0,0,1,0,0,0|1,0,2]=4 94 B16R2.1480 C=Cc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011218376 [0,0,1,0,0,0|1,0,2]=4 95 B16R2.1480 C=Cc1ccccc1SCc2c[nH]cn2 62a_100011218376_100000707719 [0,0,1,0,0,0|1,0,2]=4 96 B16R2.1480 CCc1ccccc1NCC2=NCCN2 34a_100000212081_100000737910 [0,0,1,0,0,0|2,0,1]=4 97 B16R2.1480 CCc1ccccc1NCC2=NCCN2 7a_100000212081_100000737910 [0,0,1,0,0,0|2,0,1]=4 98 B16R2.1480 CCc1ccccc1NCc2c[nH]cn2 2230a_100000212081_100000707719 [0,0,1,0,0,0|0,0,0]=1 99 B16R2.1480 CCc1ccccc1NCc2c[nH]cn2 34a_100000212081_100000707719 [0,0,1,0,0,0|0,0,0]=1 100 B16R2.1480 CCc1ccccc1NCc2cc[nH]n2 207a_100000212081_100000738523 [0,0,1,0,0,0|2,0,0]=3 101 B16R2.1480 CCc1ccccc1NCc2ccco2 207a_100000212081_100000186105 [0,0,1,0,0,0|2,0,0]=3 102 B16R2.1480 CCc1ccccc1NCc2ccco2 270302a_100000212081_100000186105 [0,0,1,0,0,0|2,0,0]=3 103 B16R2.1480 CCc1ccccc1NCc2cccs2 207a_100000212081_100000209959 [0,0,1,0,0,0|2,0,0]=3 104 B16R2.1480 CCc1ccccc1NCc2cccs2 270302a_100000212081_100000209959 [0,0,1,0,0,0|2,0,0]=3 105 B16R2.1480 CCc1ccccc1NCc2ccn[nH]2 2230a_100000212081_100000728653 [0,0,1,0,0,0|2,0,1]=4 106 B16R2.1480 CCc1ccccc1NCc2ccn[nH]2 34a_100000212081_100000728653 [0,0,1,0,0,0|2,0,1]=4 107 B16R2.1480 CCc1ccccc1NCc2ccn[nH]2 7a_100000212081_100000728653 [0,0,1,0,0,0|2,0,1]=4 108 B16R2.1480 CCc1ccccc1NCc2ccoc2 207a_100000212081_100011215517 [0,0,1,0,0,0|2,0,0]=3 109 B16R2.1480 CCc1ccccc1NCc2ccon2 2230a_100000212081_100000234950 [0,0,1,0,0,0|2,0,0]=3 110 B16R2.1480 CCc1ccccc1NCc2ccon2 34a_100000212081_100000234950 [0,0,1,0,0,0|2,0,0]=3 111 B16R2.1480 CCc1ccccc1NCc2ccon2 7a_100000212081_100000234950 [0,0,1,0,0,0|2,0,0]=3 112 B16R2.1480 CCc1ccccc1NCc2ccsc2 207a_100000212081_100000188534 [0,0,1,0,0,0|2,0,0]=3 113 B16R2.1480 CCc1ccccc1NCc2ccsc2 2230a_100000212081_100011261437 [0,0,1,0,0,0|2,0,0]=3 114 B16R2.1480 CCc1ccccc1NCc2ccsc2 270302a_100000212081_100000188534 [0,0,1,0,0,0|2,0,0]=3 115 B16R2.1480 CCc1ccccc1NCc2ccsc2 34a_100000212081_100011261437 [0,0,1,0,0,0|2,0,0]=3 116 B16R2.1480 CCc1ccccc1NCc2ccsc2 7a_100000212081_100011261437 [0,0,1,0,0,0|2,0,0]=3 117 B16R2.1480 CCc1ccccc1NCc2cn[nH]c2 207a_100000212081_100016992096 [0,0,1,0,0,0|2,0,0]=3 118 B16R2.1480 CCc1ccccc1NCc2cn[nH]c2 270302a_100000212081_100016992096 [0,0,1,0,0,0|2,0,0]=3 119 B16R2.1480 CCc1ccccc1NCc2cnc[nH]2 207a_100000212081_100000742939 [0,0,1,0,0,0|0,0,2]=3 120 B16R2.1480 CCc1ccccc1NCc2cncs2 207a_100000212081_100000749870 [0,0,1,0,0,0|1,0,1]=3 121 B16R2.1480 CCc1ccccc1NCc2cncs2 2230a_100000212081_100015185245 [0,0,1,0,0,0|1,0,1]=3 122 B16R2.1480 CCc1ccccc1NCc2cncs2 270302a_100000212081_100000749870 [0,0,1,0,0,0|1,0,1]=3 123 B16R2.1480 CCc1ccccc1NCc2cncs2 34a_100000212081_100015185245 [0,0,1,0,0,0|1,0,1]=3 124 B16R2.1480 CCc1ccccc1NCc2cncs2 7a_100000212081_100015185245 [0,0,1,0,0,0|1,0,1]=3 125 B16R2.1480 CCc1ccccc1NCc2cscn2 207a_100000212081_100000743575 [0,0,1,0,0,0|1,0,0]=2 126 B16R2.1480 CCc1ccccc1NCc2cscn2 2230a_100000212081_100000205941 [0,0,1,0,0,0|1,0,0]=2 127 B16R2.1480 CCc1ccccc1NCc2cscn2 270302a_100000212081_100000743575 [0,0,1,0,0,0|1,0,0]=2 128 B16R2.1480 CCc1ccccc1NCc2cscn2 34a_100000212081_100000205941 [0,0,1,0,0,0|1,0,0]=2 129 B16R2.1480 CCc1ccccc1NCc2cscn2 7a_100000212081_100000205941 [0,0,1,0,0,0|1,0,0]=2 130 B16R2.1480 CCc1ccccc1NCc2ncc[nH]2 207a_100000212081_100000743867 [0,0,1,0,0,0|2,0,0]=3 131 B16R2.1480 CCc1ccccc1NCc2ncc[nH]2 2230a_100000212081_100016991755 [0,0,1,0,0,0|2,0,0]=3 132 B16R2.1480 CCc1ccccc1NCc2ncc[nH]2 34a_100000212081_100016991755 [0,0,1,0,0,0|2,0,0]=3 133 B16R2.1480 CCc1ccccc1NCc2ncc[nH]2 7a_100000212081_100000753453 [0,0,1,0,0,0|2,0,0]=3 134 B16R2.1480 CCc1ccccc1NCc2ncco2 2230a_100000212081_103436540062 [0,0,1,0,0,0|2,0,0]=3 135 B16R2.1480 CCc1ccccc1NCc2ncco2 34a_100000212081_103436540062 [0,0,1,0,0,0|2,0,0]=3 136 B16R2.1480 CCc1ccccc1NCc2ncco2 7a_100000212081_103436540062 [0,0,1,0,0,0|2,0,0]=3 137 B16R2.1480 CCc1ccccc1NCc2nccs2 207a_100000212081_100000750902 [0,0,1,0,0,0|2,0,0]=3 138 B16R2.1480 CCc1ccccc1NCc2nccs2 2230a_100000212081_100015184050 [0,0,1,0,0,0|2,0,0]=3 139 B16R2.1480 CCc1ccccc1NCc2nccs2 270302a_100000212081_100000750902 [0,0,1,0,0,0|2,0,0]=3 140 B16R2.1480 CCc1ccccc1NCc2nccs2 34a_100000212081_100015184050 [0,0,1,0,0,0|2,0,0]=3 141 B16R2.1480 CCc1ccccc1NCc2nccs2 7a_100000212081_100015184050 [0,0,1,0,0,0|2,0,0]=3 142 B16R2.1480 CCc1ccccc1NCc2ncon2 34a_100000212081_100000233494 [0,0,1,0,0,0|2,0,0]=3 143 B16R2.1480 CCc1ccccc1NCc2nnn[nH]2 34a_100000212081_100000765167 [0,0,1,0,0,0|2,0,1]=4 144 B16R2.1480 CCc1ccccc1NCc2nnn[nH]2 7a_100000212081_100000765167 [0,0,1,0,0,0|2,0,1]=4 145 B16R2.1480 CCc1ccccc1NCn2cncn2 2230a_100000212081_200020645497 [0,0,1,0,0,0|1,0,1]=3 146 B16R2.1480 CCc1ccccc1NCn2cncn2 34a_100000212081_200020645497 [0,0,1,0,0,0|1,0,1]=3 147 B16R2.1480 CCc1ccccc1NCn2cncn2 7a_100000212081_200020645497 [0,0,1,0,0,0|1,0,1]=3 148 B16R2.1480 CCc1ccccc1OCc2c[nH]cn2 34a_100000210936_100000707719 [0,0,1,0,0,0|1,0,0]=2 149 B16R2.1480 CCc1ccccc1OCc2ccon2 34a_100000210936_100000234950 [0,0,1,0,0,0|3,0,0]=4 150 B16R2.1480 CCc1ccccc1OCc2ccon2 7a_100000210936_100000234950 [0,0,1,0,0,0|3,0,0]=4 151 B16R2.1480 CCc1ccccc1OCc2ccsc2 34a_100000210936_100011261437 [0,0,1,0,0,0|3,0,0]=4 152 B16R2.1480 CCc1ccccc1OCc2ccsc2 7a_100000210936_100011261437 [0,0,1,0,0,0|3,0,0]=4 153 B16R2.1480 CCc1ccccc1OCc2cncs2 34a_100000210936_100015185245 [0,0,1,0,0,0|2,0,1]=4 154 B16R2.1480 CCc1ccccc1OCc2cncs2 7a_100000210936_100015185245 [0,0,1,0,0,0|2,0,1]=4 155 B16R2.1480 CCc1ccccc1OCc2cscn2 34a_100000210936_100000205941 [0,0,1,0,0,0|2,0,0]=3 156 B16R2.1480 CCc1ccccc1OCc2cscn2 7a_100000210936_100000205941 [0,0,1,0,0,0|2,0,0]=3 157 B16R2.1480 CCc1ccccc1OCc2ncc[nH]2 34a_100000210936_100016991755 [0,0,1,0,0,0|3,0,0]=4 158 B16R2.1480 CCc1ccccc1OCc2ncc[nH]2 7a_100000210936_100000753453 [0,0,1,0,0,0|3,0,0]=4 159 B16R2.1480 CCc1ccccc1OCc2ncco2 34a_100000210936_103436540062 [0,0,1,0,0,0|3,0,0]=4 160 B16R2.1480 CCc1ccccc1OCc2ncco2 7a_100000210936_103436540062 [0,0,1,0,0,0|3,0,0]=4 161 B16R2.1480 CCc1ccccc1OCc2nccs2 34a_100000210936_100015184050 [0,0,1,0,0,0|3,0,0]=4 162 B16R2.1480 CCc1ccccc1OCc2nccs2 7a_100000210936_100015184050 [0,0,1,0,0,0|3,0,0]=4 163 B16R2.1480 CCc1ccccc1OCc2ncon2 34a_100000210936_100000233494 [0,0,1,0,0,0|3,0,0]=4 164 B16R2.1480 CCc1ccccc1OCn2cncn2 34a_100000210936_200020645497 [0,0,1,0,0,0|2,0,1]=4 165 B16R2.1480 CCc1ccccc1OCn2cncn2 7a_100000210936_200020645497 [0,0,1,0,0,0|2,0,1]=4 166 B16R2.1480 CCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011215823 [0,0,1,0,0,0|1,0,0]=2 167 B16R2.1480 CCc1ccccc1SCc2c[nH]cn2 62a_100011215823_100000707719 [0,0,1,0,0,0|1,0,0]=2 168 B16R2.1480 CCc1ccccc1SCc2ccon2 62a_100000234950_100011215823 [0,0,1,0,0,0|3,0,0]=4 169 B16R2.1480 CCc1ccccc1SCc2ccon2 62a_100011215823_100000234950 [0,0,1,0,0,0|3,0,0]=4 170 B16R2.1480 CCc1ccccc1SCc2ccsc2 62a_100011215823_100011233845 [0,0,1,0,0,0|3,0,0]=4 171 B16R2.1480 CCc1ccccc1SCc2ccsc2 62a_100011261437_100011215823 [0,0,1,0,0,0|3,0,0]=4 172 B16R2.1480 CCc1ccccc1SCc2cncs2 62a_100011215823_100015185245 [0,0,1,0,0,0|2,0,1]=4 173 B16R2.1480 CCc1ccccc1SCc2cncs2 62a_100015185245_100011215823 [0,0,1,0,0,0|2,0,1]=4 174 B16R2.1480 CCc1ccccc1SCc2cscn2 62a_100000205941_100011215823 [0,0,1,0,0,0|2,0,0]=3 175 B16R2.1480 CCc1ccccc1SCc2cscn2 62a_100011215823_100000205941 [0,0,1,0,0,0|2,0,0]=3 176 B16R2.1480 CCc1ccccc1SCc2ncc[nH]2 62a_100011215823_100016991755 [0,0,1,0,0,0|3,0,0]=4 177 B16R2.1480 CCc1ccccc1SCc2ncc[nH]2 62a_100016991755_100011215823 [0,0,1,0,0,0|3,0,0]=4 178 B16R2.1480 CCc1ccccc1SCc2ncco2 62a_100011215823_103436540062 [0,0,1,0,0,0|3,0,0]=4 179 B16R2.1480 CCc1ccccc1SCc2ncco2 62a_103436540062_100011215823 [0,0,1,0,0,0|3,0,0]=4 180 B16R2.1480 CCc1ccccc1SCc2nccs2 62a_100011215823_100015184050 [0,0,1,0,0,0|3,0,0]=4 181 B16R2.1480 CCc1ccccc1SCc2nccs2 62a_100015184050_100011215823 [0,0,1,0,0,0|3,0,0]=4 182 B16R2.1480 CCc1ccccc1SCc2ncon2 62a_100000233494_100011215823 [0,0,1,0,0,0|3,0,0]=4 183 B16R2.1480 CCc1ccccc1SCc2ncon2 62a_100011215823_100000233494 [0,0,1,0,0,0|3,0,0]=4 184 B16R2.1480 CCc1ccccc1SCn2cncn2 62a_100011215823_200020645497 [0,0,1,0,0,0|2,0,1]=4 185 B16R2.1480 CCc1ccccc1SCn2cncn2 62a_200020645497_100011215823 [0,0,1,0,0,0|2,0,1]=4 186 B16R2.1480 CCc1ccncc1SCc2c[nH]cn2 62a_100000707719_100009819861 [0,0,1,0,0,0|2,0,0]=3 187 B16R2.1480 CCc1ccncc1SCc2c[nH]cn2 62a_100009819861_100000707719 [0,0,1,0,0,0|2,0,0]=3 188 B16R2.1480 CCc1ccncc1SCc2cscn2 62a_100000205941_100009819861 [0,0,1,0,0,0|3,0,0]=4 189 B16R2.1480 CCc1ccncc1SCc2cscn2 62a_100009819861_100000205941 [0,0,1,0,0,0|3,0,0]=4 190 B16R2.1480 CCc1cnccc1SCc2c[nH]cn2 62a_100000707719_100025704421 [0,0,1,0,0,0|2,0,0]=3 191 B16R2.1480 CCc1cnccc1SCc2c[nH]cn2 62a_100025704421_100000707719 [0,0,1,0,0,0|2,0,0]=3 192 B16R2.1480 CCc1cnccc1SCc2cscn2 62a_100000205941_100025704421 [0,0,1,0,0,0|3,0,0]=4 193 B16R2.1480 CCc1cnccc1SCc2cscn2 62a_100025704421_100000205941 [0,0,1,0,0,0|3,0,0]=4 194 B16R2.1480 CCc1cncnc1NCc2c[nH]cn2 27a_100000758547_200000100055 [0,0,1,0,0,0|2,0,0]=3 195 B16R2.1480 CCc1cncnc1NCc2c[nH]nn2 27a_100020620823_200000100055 [0,0,1,0,0,0|3,0,0]=4 196 B16R2.1480 CCc1cncnc1NCc2cocn2 27a_100015188801_200000100055 [0,0,1,0,0,0|3,0,0]=4 197 B16R2.1480 CCc1cncnc1NCc2cscn2 27a_100015185402_200000100055 [0,0,1,0,0,0|3,0,0]=4 198 B16R2.1480 CCc1cncnc1SCc2c[nH]cn2 62a_100000707719_200000100055 [0,0,1,0,0,0|3,0,0]=4 199 B16R2.1480 CCc1cncnc1SCc2c[nH]cn2 62a_200000100055_100000707719 [0,0,1,0,0,0|3,0,0]=4 200 B16R2.1480 CCc1ncccc1SCc2c[nH]cn2 62a_100000707719_100009877225 [0,0,1,0,0,0|2,0,0]=3 201 B16R2.1480 CCc1ncccc1SCc2c[nH]cn2 62a_100009877225_100000707719 [0,0,1,0,0,0|2,0,0]=3 202 B16R2.1480 CCc1ncccc1SCc2cscn2 62a_100000205941_100009877225 [0,0,1,0,0,0|3,0,0]=4 203 B16R2.1480 CCc1ncccc1SCc2cscn2 62a_100009877225_100000205941 [0,0,1,0,0,0|3,0,0]=4 204 B16R2.1480 CCc1nccnc1NCc2c[nH]cn2 27a_100000758547_100011995844 [0,0,1,0,0,0|2,0,0]=3 205 B16R2.1480 CCc1nccnc1NCc2c[nH]nn2 27a_100020620823_100011995844 [0,0,1,0,0,0|3,0,0]=4 206 B16R2.1480 CCc1nccnc1NCc2cocn2 27a_100015188801_100011995844 [0,0,1,0,0,0|3,0,0]=4 207 B16R2.1480 CCc1nccnc1NCc2cscn2 27a_100015185402_100011995844 [0,0,1,0,0,0|3,0,0]=4 208 B16R2.1480 CCc1nccnc1SCc2c[nH]cn2 62a_100000707719_100011995844 [0,0,1,0,0,0|3,0,0]=4 209 B16R2.1480 CCc1nccnc1SCc2c[nH]cn2 62a_100011995844_100000707719 [0,0,1,0,0,0|3,0,0]=4 210 B16R2.1480 CCc1ncncc1NCc2c[nH]cn2 27a_100000758547_100009816992 [0,0,1,0,0,0|2,0,0]=3 211 B16R2.1480 CCc1ncncc1NCc2c[nH]nn2 27a_100020620823_100009816992 [0,0,1,0,0,0|3,0,0]=4 212 B16R2.1480 CCc1ncncc1NCc2cocn2 27a_100015188801_100009816992 [0,0,1,0,0,0|3,0,0]=4 213 B16R2.1480 CCc1ncncc1NCc2cscn2 27a_100015185402_100009816992 [0,0,1,0,0,0|3,0,0]=4 214 B16R2.1480 CCc1ncncc1SCc2c[nH]cn2 62a_100000707719_100009816992 [0,0,1,0,0,0|3,0,0]=4 215 B16R2.1480 CCc1ncncc1SCc2c[nH]cn2 62a_100009816992_100000707719 [0,0,1,0,0,0|3,0,0]=4 216 B16R2.1480 CNc1ccccc1OCc2c[nH]cn2 34a_100000033821_100000707719 [0,0,1,0,0,0|2,0,0]=3 217 B16R2.1480 CNc1ccccc1OCc2cscn2 34a_100000033821_100000205941 [0,0,1,0,0,0|3,0,0]=4 218 B16R2.1480 CNc1ccccc1SCc2c[nH]cn2 62a_100000707719_100020606079 [0,0,1,0,0,0|2,0,0]=3 219 B16R2.1480 CNc1ccccc1SCc2c[nH]cn2 62a_100020606079_100000707719 [0,0,1,0,0,0|2,0,0]=3 220 B16R2.1480 CNc1ccccc1SCc2cscn2 62a_100000205941_100020606079 [0,0,1,0,0,0|3,0,0]=4 221 B16R2.1480 CNc1ccccc1SCc2cscn2 62a_100020606079_100000205941 [0,0,1,0,0,0|3,0,0]=4 222 B16R2.1480 CNc1cccnc1SCc2c[nH]cn2 62a_100000707719_200011806188 [0,0,1,0,0,0|3,0,0]=4 223 B16R2.1480 CNc1ccncc1SCc2c[nH]cn2 62a_100000707719_100010069531 [0,0,1,0,0,0|3,0,0]=4 224 B16R2.1480 CNc1ccncc1SCc2c[nH]cn2 62a_100010069531_100000707719 [0,0,1,0,0,0|3,0,0]=4 225 B16R2.1480 CNc1ncccc1SCc2c[nH]cn2 62a_100000700899_100000707719 [0,0,1,0,0,0|3,0,0]=4 226 B16R2.1480 CNc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000700899 [0,0,1,0,0,0|3,0,0]=4 227 B16R2.1480 COc1ccccc1CSc2c[nH]cn2 62a_100000210004_100000756875 [0,0,1,0,0,0|3,0,0]=4 228 B16R2.1480 COc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000210004 [0,0,1,0,0,0|3,0,0]=4 229 B16R2.1480 COc1ccccc1NCc2c[nH]cn2 34a_100000210025_100000707719 [0,0,1,0,0,0|1,0,0]=2 230 B16R2.1480 COc1ccccc1NCc2cc[nH]n2 207a_100000210025_100000738523 [0,0,1,0,0,0|3,0,0]=4 231 B16R2.1480 COc1ccccc1NCc2ccco2 207a_100000210025_100000186105 [0,0,1,0,0,0|3,0,0]=4 232 B16R2.1480 COc1ccccc1NCc2ccco2 270302a_100000210025_100000186105 [0,0,1,0,0,0|3,0,0]=4 233 B16R2.1480 COc1ccccc1NCc2cccs2 207a_100000210025_100000209959 [0,0,1,0,0,0|3,0,0]=4 234 B16R2.1480 COc1ccccc1NCc2cccs2 270302a_100000210025_100000209959 [0,0,1,0,0,0|3,0,0]=4 235 B16R2.1480 COc1ccccc1NCc2ccoc2 207a_100000210025_100011215517 [0,0,1,0,0,0|3,0,0]=4 236 B16R2.1480 COc1ccccc1NCc2ccon2 34a_100000210025_100000234950 [0,0,1,0,0,0|3,0,0]=4 237 B16R2.1480 COc1ccccc1NCc2ccsc2 207a_100000210025_100000188534 [0,0,1,0,0,0|3,0,0]=4 238 B16R2.1480 COc1ccccc1NCc2ccsc2 270302a_100000210025_100000188534 [0,0,1,0,0,0|3,0,0]=4 239 B16R2.1480 COc1ccccc1NCc2ccsc2 34a_100000210025_100011261437 [0,0,1,0,0,0|3,0,0]=4 240 B16R2.1480 COc1ccccc1NCc2cn[nH]c2 207a_100000210025_100016992096 [0,0,1,0,0,0|3,0,0]=4 241 B16R2.1480 COc1ccccc1NCc2cn[nH]c2 270302a_100000210025_100016992096 [0,0,1,0,0,0|3,0,0]=4 242 B16R2.1480 COc1ccccc1NCc2cnc[nH]2 207a_100000210025_100000742939 [0,0,1,0,0,0|1,0,2]=4 243 B16R2.1480 COc1ccccc1NCc2cncs2 207a_100000210025_100000749870 [0,0,1,0,0,0|2,0,1]=4 244 B16R2.1480 COc1ccccc1NCc2cncs2 270302a_100000210025_100000749870 [0,0,1,0,0,0|2,0,1]=4 245 B16R2.1480 COc1ccccc1NCc2cncs2 34a_100000210025_100015185245 [0,0,1,0,0,0|2,0,1]=4 246 B16R2.1480 COc1ccccc1NCc2cscn2 207a_100000210025_100000743575 [0,0,1,0,0,0|2,0,0]=3 247 B16R2.1480 COc1ccccc1NCc2cscn2 270302a_100000210025_100000743575 [0,0,1,0,0,0|2,0,0]=3 248 B16R2.1480 COc1ccccc1NCc2cscn2 34a_100000210025_100000205941 [0,0,1,0,0,0|2,0,0]=3 249 B16R2.1480 COc1ccccc1NCc2ncc[nH]2 207a_100000210025_100000743867 [0,0,1,0,0,0|3,0,0]=4 250 B16R2.1480 COc1ccccc1NCc2ncc[nH]2 34a_100000210025_100016991755 [0,0,1,0,0,0|3,0,0]=4 251 B16R2.1480 COc1ccccc1NCc2ncco2 34a_100000210025_103436540062 [0,0,1,0,0,0|3,0,0]=4 252 B16R2.1480 COc1ccccc1NCc2nccs2 207a_100000210025_100000750902 [0,0,1,0,0,0|3,0,0]=4 253 B16R2.1480 COc1ccccc1NCc2nccs2 270302a_100000210025_100000750902 [0,0,1,0,0,0|3,0,0]=4 254 B16R2.1480 COc1ccccc1NCc2nccs2 34a_100000210025_100015184050 [0,0,1,0,0,0|3,0,0]=4 255 B16R2.1480 COc1ccccc1NCc2ncon2 34a_100000210025_100000233494 [0,0,1,0,0,0|3,0,0]=4 256 B16R2.1480 COc1ccccc1NCn2cncn2 34a_100000210025_200020645497 [0,0,1,0,0,0|2,0,1]=4 257 B16R2.1480 COc1ccccc1OCc2c[nH]cn2 34a_100000210385_100000707719 [0,0,1,0,0,0|2,0,0]=3 258 B16R2.1480 COc1ccccc1OCc2cscn2 34a_100000210385_100000205941 [0,0,1,0,0,0|3,0,0]=4 259 B16R2.1480 COc1ccccc1SCc2c[nH]cn2 62a_100000210334_100000707719 [0,0,1,0,0,0|2,0,0]=3 260 B16R2.1480 COc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000210334 [0,0,1,0,0,0|2,0,0]=3 261 B16R2.1480 COc1ccccc1SCc2cscn2 62a_100000205941_100000210334 [0,0,1,0,0,0|3,0,0]=4 262 B16R2.1480 COc1ccccc1SCc2cscn2 62a_100000210334_100000205941 [0,0,1,0,0,0|3,0,0]=4 263 B16R2.1480 COc1cccnc1OCc2c[nH]cn2 34a_100025773188_100000707719 [0,0,1,0,0,0|3,0,0]=4 264 B16R2.1480 COc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000690851 [0,0,1,0,0,0|3,0,0]=4 265 B16R2.1480 COc1cccnc1SCc2c[nH]cn2 62a_100000767102_100000707719 [0,0,1,0,0,0|3,0,0]=4 266 B16R2.1480 COc1ccncc1OCc2c[nH]cn2 34a_100000101186_100000707719 [0,0,1,0,0,0|3,0,0]=4 267 B16R2.1480 COc1ccncc1SCc2c[nH]cn2 62a_100000707719_100011997281 [0,0,1,0,0,0|3,0,0]=4 268 B16R2.1480 COc1ccncc1SCc2c[nH]cn2 62a_100011997281_100000707719 [0,0,1,0,0,0|3,0,0]=4 269 B16R2.1480 COc1cnccc1SCc2c[nH]cn2 62a_100000707719_100016988167 [0,0,1,0,0,0|3,0,0]=4 270 B16R2.1480 COc1cnccc1SCc2c[nH]cn2 62a_100016988167_100000707719 [0,0,1,0,0,0|3,0,0]=4 271 B16R2.1480 COc1cncnc1NCc2c[nH]cn2 27a_100000758547_100012001275 [0,0,1,0,0,0|3,0,0]=4 272 B16R2.1480 COc1ncccc1OCc2c[nH]cn2 34a_100000698397_100000707719 [0,0,1,0,0,0|3,0,0]=4 273 B16R2.1480 COc1ncccc1SCc2c[nH]cn2 62a_100000047025_100000707719 [0,0,1,0,0,0|3,0,0]=4 274 B16R2.1480 COc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000047025 [0,0,1,0,0,0|3,0,0]=4 275 B16R2.1480 COc1nccnc1NCc2c[nH]cn2 27a_100000758547_100009858322 [0,0,1,0,0,0|3,0,0]=4 276 B16R2.1480 CSc1ccccc1CSc2c[nH]cn2 62a_100000699184_100000756875 [0,0,1,0,0,0|3,0,0]=4 277 B16R2.1480 CSc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000699184 [0,0,1,0,0,0|3,0,0]=4 278 B16R2.1480 CSc1ccccc1NCc2c[nH]cn2 34a_100000211160_100000707719 [0,0,1,0,0,0|1,0,0]=2 279 B16R2.1480 CSc1ccccc1NCc2cc[nH]n2 207a_100000211160_100000738523 [0,0,1,0,0,0|3,0,0]=4 280 B16R2.1480 CSc1ccccc1NCc2ccco2 207a_100000211160_100000186105 [0,0,1,0,0,0|3,0,0]=4 281 B16R2.1480 CSc1ccccc1NCc2ccco2 270302a_100000211160_100000186105 [0,0,1,0,0,0|3,0,0]=4 282 B16R2.1480 CSc1ccccc1NCc2cccs2 207a_100000211160_100000209959 [0,0,1,0,0,0|3,0,0]=4 283 B16R2.1480 CSc1ccccc1NCc2cccs2 270302a_100000211160_100000209959 [0,0,1,0,0,0|3,0,0]=4 284 B16R2.1480 CSc1ccccc1NCc2ccoc2 207a_100000211160_100011215517 [0,0,1,0,0,0|3,0,0]=4 285 B16R2.1480 CSc1ccccc1NCc2ccon2 34a_100000211160_100000234950 [0,0,1,0,0,0|3,0,0]=4 286 B16R2.1480 CSc1ccccc1NCc2ccsc2 207a_100000211160_100000188534 [0,0,1,0,0,0|3,0,0]=4 287 B16R2.1480 CSc1ccccc1NCc2ccsc2 270302a_100000211160_100000188534 [0,0,1,0,0,0|3,0,0]=4 288 B16R2.1480 CSc1ccccc1NCc2ccsc2 34a_100000211160_100011261437 [0,0,1,0,0,0|3,0,0]=4 289 B16R2.1480 CSc1ccccc1NCc2cn[nH]c2 207a_100000211160_100016992096 [0,0,1,0,0,0|3,0,0]=4 290 B16R2.1480 CSc1ccccc1NCc2cn[nH]c2 270302a_100000211160_100016992096 [0,0,1,0,0,0|3,0,0]=4 291 B16R2.1480 CSc1ccccc1NCc2cnc[nH]2 207a_100000211160_100000742939 [0,0,1,0,0,0|1,0,2]=4 292 B16R2.1480 CSc1ccccc1NCc2cncs2 207a_100000211160_100000749870 [0,0,1,0,0,0|2,0,1]=4 293 B16R2.1480 CSc1ccccc1NCc2cncs2 270302a_100000211160_100000749870 [0,0,1,0,0,0|2,0,1]=4 294 B16R2.1480 CSc1ccccc1NCc2cncs2 34a_100000211160_100015185245 [0,0,1,0,0,0|2,0,1]=4 295 B16R2.1480 CSc1ccccc1NCc2cscn2 207a_100000211160_100000743575 [0,0,1,0,0,0|2,0,0]=3 296 B16R2.1480 CSc1ccccc1NCc2cscn2 270302a_100000211160_100000743575 [0,0,1,0,0,0|2,0,0]=3 297 B16R2.1480 CSc1ccccc1NCc2cscn2 34a_100000211160_100000205941 [0,0,1,0,0,0|2,0,0]=3 298 B16R2.1480 CSc1ccccc1NCc2ncc[nH]2 207a_100000211160_100000743867 [0,0,1,0,0,0|3,0,0]=4 299 B16R2.1480 CSc1ccccc1NCc2ncc[nH]2 34a_100000211160_100016991755 [0,0,1,0,0,0|3,0,0]=4 300 B16R2.1480 CSc1ccccc1NCc2ncco2 34a_100000211160_103436540062 [0,0,1,0,0,0|3,0,0]=4 301 B16R2.1480 CSc1ccccc1NCc2nccs2 207a_100000211160_100000750902 [0,0,1,0,0,0|3,0,0]=4 302 B16R2.1480 CSc1ccccc1NCc2nccs2 270302a_100000211160_100000750902 [0,0,1,0,0,0|3,0,0]=4 303 B16R2.1480 CSc1ccccc1NCc2nccs2 34a_100000211160_100015184050 [0,0,1,0,0,0|3,0,0]=4 304 B16R2.1480 CSc1ccccc1NCc2ncon2 34a_100000211160_100000233494 [0,0,1,0,0,0|3,0,0]=4 305 B16R2.1480 CSc1ccccc1NCn2cncn2 34a_100000211160_200020645497 [0,0,1,0,0,0|2,0,1]=4 306 B16R2.1480 CSc1ccccc1OCc2c[nH]cn2 34a_100011216402_100000707719 [0,0,1,0,0,0|2,0,0]=3 307 B16R2.1480 CSc1ccccc1OCc2cscn2 34a_100011216402_100000205941 [0,0,1,0,0,0|3,0,0]=4 308 B16R2.1480 CSc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011217816 [0,0,1,0,0,0|2,0,0]=3 309 B16R2.1480 CSc1ccccc1SCc2c[nH]cn2 62a_100011217816_100000707719 [0,0,1,0,0,0|2,0,0]=3 310 B16R2.1480 CSc1ccccc1SCc2cscn2 62a_100000205941_100011217816 [0,0,1,0,0,0|3,0,0]=4 311 B16R2.1480 CSc1ccccc1SCc2cscn2 62a_100011217816_100000205941 [0,0,1,0,0,0|3,0,0]=4 312 B16R2.1480 CSc1ncccc1SCc2c[nH]cn2 62a_100000707719_100011465278 [0,0,1,0,0,0|3,0,0]=4 313 B16R2.1480 CSc1ncccc1SCc2c[nH]cn2 62a_100011465278_100000707719 [0,0,1,0,0,0|3,0,0]=4 314 B16R2.1480 N#Cc1ccccc1NCc2c[nH]cn2 34a_100000211148_100000707719 [0,0,1,0,0,0|1,0,1]=3 315 B16R2.1480 N#Cc1ccccc1NCc2cscn2 270302a_100000211148_100000743575 [0,0,1,0,0,0|2,0,1]=4 316 B16R2.1480 N#Cc1ccccc1NCc2cscn2 34a_100000211148_100000205941 [0,0,1,0,0,0|2,0,1]=4 317 B16R2.1480 N#Cc1ccccc1OCc2c[nH]cn2 34a_100000211048_100000707719 [0,0,1,0,0,0|2,0,1]=4 318 B16R2.1480 N#Cc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000188569 [0,0,1,0,0,0|2,0,1]=4 319 B16R2.1480 N#Cc1cccnc1NCc2c[nH]cn2 27a_100000758547_100000211984 [0,0,1,0,0,0|2,0,1]=4 320 B16R2.1480 N#Cc1ccncc1NCc2c[nH]cn2 27a_100000758547_100000684818 [0,0,1,0,0,0|2,0,1]=4 321 B16R2.1480 N#Cc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000687039 [0,0,1,0,0,0|2,0,1]=4 322 B16R2.1480 NCc1ccccc1OCc2c[nH]cn2 34a_100000185550_100000707719 [0,0,1,0,0,0|2,0,0]=3 323 B16R2.1480 NCc1ccccc1OCc2cscn2 34a_100000185550_100000205941 [0,0,1,0,0,0|3,0,0]=4 324 B16R2.1480 NCc1ccccc1SCc2c[nH]cn2 62a_100000689332_100000707719 [0,0,1,0,0,0|2,0,0]=3 325 B16R2.1480 NCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000689332 [0,0,1,0,0,0|2,0,0]=3 326 B16R2.1480 NCc1ccccc1SCc2cscn2 62a_100000205941_100000689332 [0,0,1,0,0,0|3,0,0]=4 327 B16R2.1480 NCc1ccccc1SCc2cscn2 62a_100000689332_100000205941 [0,0,1,0,0,0|3,0,0]=4 328 B16R2.1480 NCc1cccnc1SCc2c[nH]cn2 62a_100000707719_100015189234 [0,0,1,0,0,0|3,0,0]=4 329 B16R2.1480 NCc1cccnc1SCc2c[nH]cn2 62a_100015189234_100000707719 [0,0,1,0,0,0|3,0,0]=4 330 B16R2.1480 NCc1ccncc1SCc2c[nH]cn2 62a_100000707719_100020640021 [0,0,1,0,0,0|3,0,0]=4 331 B16R2.1480 NCc1ccncc1SCc2c[nH]cn2 62a_100020640021_100000707719 [0,0,1,0,0,0|3,0,0]=4 332 B16R2.1480 NCc1ncccc1SCc2c[nH]cn2 62a_100000707719_100020591323 [0,0,1,0,0,0|3,0,0]=4 333 B16R2.1480 NCc1ncccc1SCc2c[nH]cn2 62a_100020591323_100000707719 [0,0,1,0,0,0|3,0,0]=4 334 B16R2.1480 NNc1ccccc1SCc2c[nH]cn2 62a_100000241748_100000707719 [0,0,1,0,0,0|3,0,0]=4 335 B16R2.1480 NNc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000241748 [0,0,1,0,0,0|3,0,0]=4 336 B16R2.1480 O=Cc1ccccc1SCc2c[nH]cn2 62a_100000210073_100000707719 [0,0,1,0,0,0|2,0,1]=4 337 B16R2.1480 O=Cc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000210073 [0,0,1,0,0,0|2,0,1]=4 338 B16R2.1480 OCc1ccccc1CSc2c[nH]cn2 62a_100000756875_100009816955 [0,0,1,0,0,0|3,0,0]=4 339 B16R2.1480 OCc1ccccc1CSc2c[nH]cn2 62a_100009816955_100000756875 [0,0,1,0,0,0|3,0,0]=4 340 B16R2.1480 OCc1ccccc1NCc2c[nH]cn2 34a_100000212039_100000707719 [0,0,1,0,0,0|1,0,0]=2 341 B16R2.1480 OCc1ccccc1NCc2cc[nH]n2 207a_100000212039_100000738523 [0,0,1,0,0,0|3,0,0]=4 342 B16R2.1480 OCc1ccccc1NCc2ccco2 207a_100000212039_100000186105 [0,0,1,0,0,0|3,0,0]=4 343 B16R2.1480 OCc1ccccc1NCc2ccco2 270302a_100000212039_100000186105 [0,0,1,0,0,0|3,0,0]=4 344 B16R2.1480 OCc1ccccc1NCc2cccs2 207a_100000212039_100000209959 [0,0,1,0,0,0|3,0,0]=4 345 B16R2.1480 OCc1ccccc1NCc2cccs2 270302a_100000212039_100000209959 [0,0,1,0,0,0|3,0,0]=4 346 B16R2.1480 OCc1ccccc1NCc2ccoc2 207a_100000212039_100011215517 [0,0,1,0,0,0|3,0,0]=4 347 B16R2.1480 OCc1ccccc1NCc2ccon2 34a_100000212039_100000234950 [0,0,1,0,0,0|3,0,0]=4 348 B16R2.1480 OCc1ccccc1NCc2ccsc2 207a_100000212039_100000188534 [0,0,1,0,0,0|3,0,0]=4 349 B16R2.1480 OCc1ccccc1NCc2ccsc2 270302a_100000212039_100000188534 [0,0,1,0,0,0|3,0,0]=4 350 B16R2.1480 OCc1ccccc1NCc2ccsc2 34a_100000212039_100011261437 [0,0,1,0,0,0|3,0,0]=4 351 B16R2.1480 OCc1ccccc1NCc2cn[nH]c2 207a_100000212039_100016992096 [0,0,1,0,0,0|3,0,0]=4 352 B16R2.1480 OCc1ccccc1NCc2cn[nH]c2 270302a_100000212039_100016992096 [0,0,1,0,0,0|3,0,0]=4 353 B16R2.1480 OCc1ccccc1NCc2cnc[nH]2 207a_100000212039_100000742939 [0,0,1,0,0,0|1,0,2]=4 354 B16R2.1480 OCc1ccccc1NCc2cncs2 207a_100000212039_100000749870 [0,0,1,0,0,0|2,0,1]=4 355 B16R2.1480 OCc1ccccc1NCc2cncs2 270302a_100000212039_100000749870 [0,0,1,0,0,0|2,0,1]=4 356 B16R2.1480 OCc1ccccc1NCc2cncs2 34a_100000212039_100015185245 [0,0,1,0,0,0|2,0,1]=4 357 B16R2.1480 OCc1ccccc1NCc2cscn2 207a_100000212039_100000743575 [0,0,1,0,0,0|2,0,0]=3 358 B16R2.1480 OCc1ccccc1NCc2cscn2 270302a_100000212039_100000743575 [0,0,1,0,0,0|2,0,0]=3 359 B16R2.1480 OCc1ccccc1NCc2cscn2 34a_100000212039_100000205941 [0,0,1,0,0,0|2,0,0]=3 360 B16R2.1480 OCc1ccccc1NCc2ncc[nH]2 207a_100000212039_100000743867 [0,0,1,0,0,0|3,0,0]=4 361 B16R2.1480 OCc1ccccc1NCc2ncc[nH]2 34a_100000212039_100016991755 [0,0,1,0,0,0|3,0,0]=4 362 B16R2.1480 OCc1ccccc1NCc2ncco2 34a_100000212039_103436540062 [0,0,1,0,0,0|3,0,0]=4 363 B16R2.1480 OCc1ccccc1NCc2nccs2 207a_100000212039_100000750902 [0,0,1,0,0,0|3,0,0]=4 364 B16R2.1480 OCc1ccccc1NCc2nccs2 270302a_100000212039_100000750902 [0,0,1,0,0,0|3,0,0]=4 365 B16R2.1480 OCc1ccccc1NCc2nccs2 34a_100000212039_100015184050 [0,0,1,0,0,0|3,0,0]=4 366 B16R2.1480 OCc1ccccc1NCc2ncon2 34a_100000212039_100000233494 [0,0,1,0,0,0|3,0,0]=4 367 B16R2.1480 OCc1ccccc1NCn2cncn2 34a_100000212039_200020645497 [0,0,1,0,0,0|2,0,1]=4 368 B16R2.1480 OCc1ccccc1OCc2c[nH]cn2 34a_100011216872_100000707719 [0,0,1,0,0,0|2,0,0]=3 369 B16R2.1480 OCc1ccccc1OCc2cscn2 34a_100011216872_100000205941 [0,0,1,0,0,0|3,0,0]=4 370 B16R2.1480 OCc1ccccc1SCc2c[nH]cn2 62a_100000187465_100000707719 [0,0,1,0,0,0|2,0,0]=3 371 B16R2.1480 OCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000187465 [0,0,1,0,0,0|2,0,0]=3 372 B16R2.1480 OCc1ccccc1SCc2cscn2 62a_100000187465_100000205941 [0,0,1,0,0,0|3,0,0]=4 373 B16R2.1480 OCc1ccccc1SCc2cscn2 62a_100000205941_100000187465 [0,0,1,0,0,0|3,0,0]=4 374 B16R2.1480 OCc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000748726 [0,0,1,0,0,0|3,0,0]=4 375 B16R2.1480 OCc1cccnc1SCc2c[nH]cn2 62a_100000748726_100000707719 [0,0,1,0,0,0|3,0,0]=4 376 B16R2.1480 OCc1ccncc1OCc2c[nH]cn2 34a_100000078615_100000707719 [0,0,1,0,0,0|3,0,0]=4 377 B16R2.1480 OCc1ccncc1SCc2c[nH]cn2 62a_100000707719_100009873359 [0,0,1,0,0,0|3,0,0]=4 378 B16R2.1480 OCc1ccncc1SCc2c[nH]cn2 62a_100009873359_100000707719 [0,0,1,0,0,0|3,0,0]=4 379 B16R2.1480 OCc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000117392 [0,0,1,0,0,0|2,0,0]=3 380 B16R2.1480 OCc1cnccc1NCc2c[nH]nn2 27a_100020620823_100000117392 [0,0,1,0,0,0|3,0,0]=4 381 B16R2.1480 OCc1cnccc1NCc2cocn2 27a_100015188801_100000117392 [0,0,1,0,0,0|3,0,0]=4 382 B16R2.1480 OCc1cnccc1NCc2cscn2 27a_100015185402_100000117392 [0,0,1,0,0,0|3,0,0]=4 383 B16R2.1480 OCc1cnccc1SCc2c[nH]cn2 62a_100000117392_100000707719 [0,0,1,0,0,0|3,0,0]=4 384 B16R2.1480 OCc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000117392 [0,0,1,0,0,0|3,0,0]=4 385 B16R2.1480 OCc1ncccc1OCc2c[nH]cn2 34a_100000731849_100000707719 [0,0,1,0,0,0|3,0,0]=4 386 B16R2.1480 OCc1ncccc1SCc2c[nH]cn2 62a_100000707719_100011996772 [0,0,1,0,0,0|3,0,0]=4 387 B16R2.1480 OCc1ncccc1SCc2c[nH]cn2 62a_100011996772_100000707719 [0,0,1,0,0,0|3,0,0]=4 388 B16R2.2257 c1cc(ccn1)CCNCc2cc[nH]n2 207a_100000742849_100000738523 [0,0,1,0,0,0|3,0,0]=4 389 B16R2.2257 c1cc(ccn1)CCNCc2cc[nH]n2 270004a_100000742849_100000738523 [0,0,1,0,0,0|3,0,0]=4 390 B16R2.2257 c1cc(ccn1)CCNCc2ccoc2 207a_100000742849_100011215517 [0,0,1,0,0,0|3,0,0]=4 391 B16R2.2257 c1cc(ccn1)CCNCc2ccoc2 2230a_100015206860_100000723409 [0,0,1,0,0,0|3,0,0]=4 392 B16R2.2257 c1cc(ccn1)CCNCc2ccoc2 270004a_100000742849_100011215517 [0,0,1,0,0,0|3,0,0]=4 393 B16R2.2257 c1cc(ccn1)CCNCc2ccsc2 207a_100000742849_100000188534 [0,0,1,0,0,0|3,0,0]=4 394 B16R2.2257 c1cc(ccn1)CCNCc2ccsc2 2230a_100000186416_100000723409 [0,0,1,0,0,0|3,0,0]=4 395 B16R2.2257 c1cc(ccn1)CCNCc2ccsc2 270004a_100000742849_100000188534 [0,0,1,0,0,0|3,0,0]=4 396 B16R2.2257 c1cc(ccn1)CCNCc2cn[nH]c2 207a_100000742849_100016992096 [0,0,1,0,0,0|3,0,0]=4 397 B16R2.2257 c1cc(ccn1)CCNCc2cn[nH]c2 270004a_100000742849_100016992096 [0,0,1,0,0,0|3,0,0]=4 398 B16R2.2257 c1cc(ccn1)CCNCc2cnc[nH]2 207a_100000742849_100000742939 [0,0,1,0,0,0|1,0,2]=4 399 B16R2.2257 c1cc(ccn1)CCNCc2cnco2 270004a_100000742849_100000064291 [0,0,1,0,0,0|2,0,1]=4 400 B16R2.2257 c1cc(ccn1)CCNCc2cncs2 207a_100000742849_100000749870 [0,0,1,0,0,0|2,0,1]=4 401 B16R2.2257 c1cc(ccn1)CCNCc2cncs2 2230a_100016987365_100000723409 [0,0,1,0,0,0|2,0,1]=4 402 B16R2.2257 c1cc(ccn1)CCNCc2cncs2 270004a_100000742849_100000749870 [0,0,1,0,0,0|2,0,1]=4 403 B16R2.2257 c1cc(ccn1)CCNCc2cocn2 270004a_100000742849_100000050382 [0,0,1,0,0,0|2,0,0]=3 404 B16R2.2257 c1cc(ccn1)CCNCc2cscn2 207a_100000742849_100000743575 [0,0,1,0,0,0|2,0,0]=3 405 B16R2.2257 c1cc(ccn1)CCNCc2cscn2 2230a_100015185402_100000723409 [0,0,1,0,0,0|2,0,0]=3 406 B16R2.2257 c1cc(ccn1)CCNCc2cscn2 270004a_100000742849_100000743575 [0,0,1,0,0,0|2,0,0]=3 407 B16R2.2257 c1cc(ccn1)CCNCc2csnn2 270004a_100000742849_100000738508 [0,0,1,0,0,0|3,0,0]=4 408 B16R2.2257 c1cc(ccn1)CCNCc2ncc[nH]2 207a_100000742849_100000743867 [0,0,1,0,0,0|3,0,0]=4 409 B16R2.2257 c1cc(ccn1)CCNCc2ncco2 2230a_100016994969_100000723409 [0,0,1,0,0,0|3,0,0]=4 410 B16R2.2257 c1cc(ccn1)CCNCc2ncco2 270004a_100000742849_100000064290 [0,0,1,0,0,0|3,0,0]=4 411 B16R2.2257 c1cc(ccn1)CCNCc2nccs2 207a_100000742849_100000750902 [0,0,1,0,0,0|3,0,0]=4 412 B16R2.2257 c1cc(ccn1)CCNCc2nccs2 2230a_100000740555_100000723409 [0,0,1,0,0,0|3,0,0]=4 413 B16R2.2257 c1cc(ccn1)CCNCc2nccs2 270004a_100000742849_100000750902 [0,0,1,0,0,0|3,0,0]=4 414 B16R2.2257 c1cc(ccn1)CCOCc2c[nH]cn2 34a_100011216225_100000707719 [0,0,1,0,0,0|2,0,0]=3 415 B16R2.2257 c1cc(ccn1)CCOCc2cscn2 34a_100011216225_100000205941 [0,0,1,0,0,0|3,0,0]=4 416 B16R2.2257 c1cc(ccn1)CCSCc2c[nH]cn2 62a_100000707719_100000723409 [0,0,1,0,0,0|2,0,0]=3 417 B16R2.2257 c1cc(ccn1)CCSCc2c[nH]cn2 62a_100000723409_100000707719 [0,0,1,0,0,0|2,0,0]=3 418 B16R2.2257 c1cc(ccn1)CCSCc2cscn2 62a_100000205941_100000723409 [0,0,1,0,0,0|3,0,0]=4 419 B16R2.2257 c1cc(ccn1)CCSCc2cscn2 62a_100000723409_100000205941 [0,0,1,0,0,0|3,0,0]=4 420 B16R2.2257 c1cc(ccn1)CSCCc2c[nH]cn2 62a_100015193705_100020628418 [0,0,1,0,0,0|3,0,0]=4 421 B16R2.2257 c1cc(ccn1)CSCCc2c[nH]cn2 62a_100020628418_100015193705 [0,0,1,0,0,0|3,0,0]=4 422 B16R2.2257 c1ccc(cc1)CCCSc2c[nH]cn2 62a_100000211621_100000756875 [0,0,1,0,0,0|2,0,0]=3 423 B16R2.2257 c1ccc(cc1)CCCSc2c[nH]cn2 62a_100000756875_100000211621 [0,0,1,0,0,0|2,0,0]=3 424 B16R2.2257 c1ccc(cc1)CCCSc2c[nH]nn2 62a_100000211621_100009819707 [0,0,1,0,0,0|3,0,0]=4 425 B16R2.2257 c1ccc(cc1)CCCSc2c[nH]nn2 62a_100009819707_100000211621 [0,0,1,0,0,0|3,0,0]=4 426 B16R2.2257 c1ccc(cc1)CCCSc2cscn2 62a_100000211621_100000751502 [0,0,1,0,0,0|3,0,0]=4 427 B16R2.2257 c1ccc(cc1)CCCSc2cscn2 62a_100000751502_100000211621 [0,0,1,0,0,0|3,0,0]=4 428 B16R2.2257 c1ccc(cc1)CCCSc2nc[nH]n2 62a_100000211621_100000761765 [0,0,1,0,0,0|3,0,0]=4 429 B16R2.2257 c1ccc(cc1)CCCSc2nc[nH]n2 62a_100000761765_100000211621 [0,0,1,0,0,0|3,0,0]=4 430 B16R2.2257 c1ccc(cc1)CCNCC2=NCCN2 34a_100000106460_100000737910 [0,0,1,0,0,0|2,0,1]=4 431 B16R2.2257 c1ccc(cc1)CCNCc2c[nH]cn2 2230a_100000106460_100000707719 [0,0,1,0,0,0|0,0,0]=1 432 B16R2.2257 c1ccc(cc1)CCNCc2c[nH]cn2 34a_100000106460_100000707719 [0,0,1,0,0,0|0,0,0]=1 433 B16R2.2257 c1ccc(cc1)CCNCc2cc[nH]n2 207a_100000106460_100000738523 [0,0,1,0,0,0|2,0,0]=3 434 B16R2.2257 c1ccc(cc1)CCNCc2cc[nH]n2 270004a_100000106460_100000738523 [0,0,1,0,0,0|2,0,0]=3 435 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 207a_100000106460_100000186105 [0,0,1,0,0,0|2,0,0]=3 436 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100000765856 [0,0,1,0,0,0|2,0,0]=3 437 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 270004a_100000106460_100000186105 [0,0,1,0,0,0|2,0,0]=3 438 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 34a_100000185738_100000765856 [0,0,1,0,0,0|2,0,0]=3 439 B16R2.2257 c1ccc(cc1)CCNCc2cccs2 207a_100000106460_100000209959 [0,0,1,0,0,0|2,0,0]=3 440 B16R2.2257 c1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100000765856 [0,0,1,0,0,0|2,0,0]=3 441 B16R2.2257 c1ccc(cc1)CCNCc2cccs2 270004a_100000106460_100000209959 [0,0,1,0,0,0|2,0,0]=3 442 B16R2.2257 c1ccc(cc1)CCNCc2ccn[nH]2 2230a_100000106460_100000728653 [0,0,1,0,0,0|2,0,1]=4 443 B16R2.2257 c1ccc(cc1)CCNCc2ccn[nH]2 34a_100000106460_100000728653 [0,0,1,0,0,0|2,0,1]=4 444 B16R2.2257 c1ccc(cc1)CCNCc2ccoc2 207a_100000106460_100011215517 [0,0,1,0,0,0|2,0,0]=3 445 B16R2.2257 c1ccc(cc1)CCNCc2ccoc2 2230a_100015206860_100000765856 [0,0,1,0,0,0|2,0,0]=3 446 B16R2.2257 c1ccc(cc1)CCNCc2ccoc2 270004a_100000106460_100011215517 [0,0,1,0,0,0|2,0,0]=3 447 B16R2.2257 c1ccc(cc1)CCNCc2ccoc2 34a_100015206860_100000765856 [0,0,1,0,0,0|2,0,0]=3 448 B16R2.2257 c1ccc(cc1)CCNCc2ccon2 2230a_100000106460_100000234950 [0,0,1,0,0,0|2,0,0]=3 449 B16R2.2257 c1ccc(cc1)CCNCc2ccon2 34a_100000106460_100000234950 [0,0,1,0,0,0|2,0,0]=3 450 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 207a_100000106460_100000188534 [0,0,1,0,0,0|2,0,0]=3 451 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 2230a_100000106460_100011261437 [0,0,1,0,0,0|2,0,0]=3 452 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 2230a_100000186416_100000765856 [0,0,1,0,0,0|2,0,0]=3 453 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 270004a_100000106460_100000188534 [0,0,1,0,0,0|2,0,0]=3 454 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 34a_100000106460_100011261437 [0,0,1,0,0,0|2,0,0]=3 455 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 34a_100000186416_100000765856 [0,0,1,0,0,0|2,0,0]=3 456 B16R2.2257 c1ccc(cc1)CCNCc2cn[nH]c2 207a_100000106460_100016992096 [0,0,1,0,0,0|2,0,0]=3 457 B16R2.2257 c1ccc(cc1)CCNCc2cn[nH]c2 270004a_100000106460_100016992096 [0,0,1,0,0,0|2,0,0]=3 458 B16R2.2257 c1ccc(cc1)CCNCc2cnc[nH]2 207a_100000106460_100000742939 [0,0,1,0,0,0|0,0,2]=3 459 B16R2.2257 c1ccc(cc1)CCNCc2cnco2 270004a_100000106460_100000064291 [0,0,1,0,0,0|1,0,1]=3 460 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 207a_100000106460_100000749870 [0,0,1,0,0,0|1,0,1]=3 461 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 2230a_100000106460_100015185245 [0,0,1,0,0,0|1,0,1]=3 462 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100000765856 [0,0,1,0,0,0|1,0,1]=3 463 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 270004a_100000106460_100000749870 [0,0,1,0,0,0|1,0,1]=3 464 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 34a_100000106460_100015185245 [0,0,1,0,0,0|1,0,1]=3 465 B16R2.2257 c1ccc(cc1)CCNCc2cocn2 270004a_100000106460_100000050382 [0,0,1,0,0,0|1,0,0]=2 466 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 207a_100000106460_100000743575 [0,0,1,0,0,0|1,0,0]=2 467 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 2230a_100000106460_100000205941 [0,0,1,0,0,0|1,0,0]=2 468 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 2230a_100015185402_100000765856 [0,0,1,0,0,0|1,0,0]=2 469 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 270004a_100000106460_100000743575 [0,0,1,0,0,0|1,0,0]=2 470 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 34a_100000106460_100000205941 [0,0,1,0,0,0|1,0,0]=2 471 B16R2.2257 c1ccc(cc1)CCNCc2csnn2 270004a_100000106460_100000738508 [0,0,1,0,0,0|2,0,0]=3 472 B16R2.2257 c1ccc(cc1)CCNCc2ncc[nH]2 207a_100000106460_100000743867 [0,0,1,0,0,0|2,0,0]=3 473 B16R2.2257 c1ccc(cc1)CCNCc2ncc[nH]2 2230a_100000106460_100016991755 [0,0,1,0,0,0|2,0,0]=3 474 B16R2.2257 c1ccc(cc1)CCNCc2ncc[nH]2 34a_100000106460_100016991755 [0,0,1,0,0,0|2,0,0]=3 475 B16R2.2257 c1ccc(cc1)CCNCc2ncco2 2230a_100000106460_103436540062 [0,0,1,0,0,0|2,0,0]=3 476 B16R2.2257 c1ccc(cc1)CCNCc2ncco2 2230a_100016994969_100000765856 [0,0,1,0,0,0|2,0,0]=3 477 B16R2.2257 c1ccc(cc1)CCNCc2ncco2 270004a_100000106460_100000064290 [0,0,1,0,0,0|2,0,0]=3 478 B16R2.2257 c1ccc(cc1)CCNCc2ncco2 34a_100000106460_103436540062 [0,0,1,0,0,0|2,0,0]=3 479 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 207a_100000106460_100000750902 [0,0,1,0,0,0|2,0,0]=3 480 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 2230a_100000106460_100015184050 [0,0,1,0,0,0|2,0,0]=3 481 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100000765856 [0,0,1,0,0,0|2,0,0]=3 482 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 270004a_100000106460_100000750902 [0,0,1,0,0,0|2,0,0]=3 483 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 34a_100000106460_100015184050 [0,0,1,0,0,0|2,0,0]=3 484 B16R2.2257 c1ccc(cc1)CCNCc2ncon2 34a_100000106460_100000233494 [0,0,1,0,0,0|2,0,0]=3 485 B16R2.2257 c1ccc(cc1)CCNCc2nnc[nH]2 2230a_200015183720_100000765856 [0,0,1,0,0,0|1,0,2]=4 486 B16R2.2257 c1ccc(cc1)CCNCc2nnn[nH]2 34a_100000106460_100000765167 [0,0,1,0,0,0|2,0,1]=4 487 B16R2.2257 c1ccc(cc1)CCNCn2cncn2 2230a_100000106460_200020645497 [0,0,1,0,0,0|1,0,1]=3 488 B16R2.2257 c1ccc(cc1)CCNCn2cncn2 34a_100000106460_200020645497 [0,0,1,0,0,0|1,0,1]=3 489 B16R2.2257 c1ccc(cc1)CCOCc2c[nH]cn2 34a_100000210268_100000707719 [0,0,1,0,0,0|1,0,0]=2 490 B16R2.2257 c1ccc(cc1)CCOCc2ccco2 34a_100000210059_100000765856 [0,0,1,0,0,0|3,0,0]=4 491 B16R2.2257 c1ccc(cc1)CCOCc2cccs2 34a_100000211240_100000765856 [0,0,1,0,0,0|3,0,0]=4 492 B16R2.2257 c1ccc(cc1)CCOCc2ccoc2 34a_100011215357_100000765856 [0,0,1,0,0,0|3,0,0]=4 493 B16R2.2257 c1ccc(cc1)CCOCc2ccon2 34a_100000210268_100000234950 [0,0,1,0,0,0|3,0,0]=4 494 B16R2.2257 c1ccc(cc1)CCOCc2ccon2 7a_100000210268_100000234950 [0,0,1,0,0,0|3,0,0]=4 495 B16R2.2257 c1ccc(cc1)CCOCc2ccsc2 34a_100000210268_100011261437 [0,0,1,0,0,0|3,0,0]=4 496 B16R2.2257 c1ccc(cc1)CCOCc2ccsc2 34a_100011215551_100000765856 [0,0,1,0,0,0|3,0,0]=4 497 B16R2.2257 c1ccc(cc1)CCOCc2ccsc2 7a_100000210268_100011261437 [0,0,1,0,0,0|3,0,0]=4 498 B16R2.2257 c1ccc(cc1)CCOCc2cncs2 34a_100000210268_100015185245 [0,0,1,0,0,0|2,0,1]=4 499 B16R2.2257 c1ccc(cc1)CCOCc2cncs2 7a_100000210268_100015185245 [0,0,1,0,0,0|2,0,1]=4 500 B16R2.2257 c1ccc(cc1)CCOCc2cscn2 34a_100000210268_100000205941 [0,0,1,0,0,0|2,0,0]=3 501 B16R2.2257 c1ccc(cc1)CCOCc2cscn2 7a_100000210268_100000205941 [0,0,1,0,0,0|2,0,0]=3 502 B16R2.2257 c1ccc(cc1)CCOCc2ncc[nH]2 34a_100000210268_100016991755 [0,0,1,0,0,0|3,0,0]=4 503 B16R2.2257 c1ccc(cc1)CCOCc2ncc[nH]2 7a_100000210268_100000753453 [0,0,1,0,0,0|3,0,0]=4 504 B16R2.2257 c1ccc(cc1)CCOCc2ncco2 34a_100000062594_100000765856 [0,0,1,0,0,0|3,0,0]=4 505 B16R2.2257 c1ccc(cc1)CCOCc2ncco2 34a_100000210268_103436540062 [0,0,1,0,0,0|3,0,0]=4 506 B16R2.2257 c1ccc(cc1)CCOCc2ncco2 7a_100000210268_103436540062 [0,0,1,0,0,0|3,0,0]=4 507 B16R2.2257 c1ccc(cc1)CCOCc2nccs2 34a_100000210268_100015184050 [0,0,1,0,0,0|3,0,0]=4 508 B16R2.2257 c1ccc(cc1)CCOCc2nccs2 7a_100000210268_100015184050 [0,0,1,0,0,0|3,0,0]=4 509 B16R2.2257 c1ccc(cc1)CCOCc2ncon2 34a_100000210268_100000233494 [0,0,1,0,0,0|3,0,0]=4 510 B16R2.2257 c1ccc(cc1)CCOCn2cccn2 34a_100000731028_100000765856 [0,0,1,0,0,0|3,0,0]=4 511 B16R2.2257 c1ccc(cc1)CCOCn2cncn2 34a_100000210268_200020645497 [0,0,1,0,0,0|2,0,1]=4 512 B16R2.2257 c1ccc(cc1)CCOCn2cncn2 7a_100000210268_200020645497 [0,0,1,0,0,0|2,0,1]=4 513 B16R2.2257 c1ccc(cc1)CCSCc2c[nH]cn2 62a_100000707719_100011218657 [0,0,1,0,0,0|1,0,0]=2 514 B16R2.2257 c1ccc(cc1)CCSCc2c[nH]cn2 62a_100000765856_100000707719 [0,0,1,0,0,0|1,0,0]=2 515 B16R2.2257 c1ccc(cc1)CCSCc2ccon2 62a_100000234950_100011218657 [0,0,1,0,0,0|3,0,0]=4 516 B16R2.2257 c1ccc(cc1)CCSCc2ccon2 62a_100000765856_100000234950 [0,0,1,0,0,0|3,0,0]=4 517 B16R2.2257 c1ccc(cc1)CCSCc2ccsc2 62a_100000765856_100011233845 [0,0,1,0,0,0|3,0,0]=4 518 B16R2.2257 c1ccc(cc1)CCSCc2ccsc2 62a_100011261437_100011218657 [0,0,1,0,0,0|3,0,0]=4 519 B16R2.2257 c1ccc(cc1)CCSCc2cncs2 62a_100000765856_100015185245 [0,0,1,0,0,0|2,0,1]=4 520 B16R2.2257 c1ccc(cc1)CCSCc2cncs2 62a_100015185245_100011218657 [0,0,1,0,0,0|2,0,1]=4 521 B16R2.2257 c1ccc(cc1)CCSCc2cscn2 62a_100000205941_100011218657 [0,0,1,0,0,0|2,0,0]=3 522 B16R2.2257 c1ccc(cc1)CCSCc2cscn2 62a_100000765856_100000205941 [0,0,1,0,0,0|2,0,0]=3 523 B16R2.2257 c1ccc(cc1)CCSCc2ncc[nH]2 62a_100000765856_100016991755 [0,0,1,0,0,0|3,0,0]=4 524 B16R2.2257 c1ccc(cc1)CCSCc2ncc[nH]2 62a_100016991755_100011218657 [0,0,1,0,0,0|3,0,0]=4 525 B16R2.2257 c1ccc(cc1)CCSCc2ncco2 62a_100000765856_103436540062 [0,0,1,0,0,0|3,0,0]=4 526 B16R2.2257 c1ccc(cc1)CCSCc2ncco2 62a_103436540062_100011218657 [0,0,1,0,0,0|3,0,0]=4 527 B16R2.2257 c1ccc(cc1)CCSCc2nccs2 62a_100000765856_100015184050 [0,0,1,0,0,0|3,0,0]=4 528 B16R2.2257 c1ccc(cc1)CCSCc2nccs2 62a_100015184050_100011218657 [0,0,1,0,0,0|3,0,0]=4 529 B16R2.2257 c1ccc(cc1)CCSCc2ncon2 62a_100000233494_100011218657 [0,0,1,0,0,0|3,0,0]=4 530 B16R2.2257 c1ccc(cc1)CCSCc2ncon2 62a_100000765856_100000233494 [0,0,1,0,0,0|3,0,0]=4 531 B16R2.2257 c1ccc(cc1)CCSCn2cncn2 62a_100000765856_200020645497 [0,0,1,0,0,0|2,0,1]=4 532 B16R2.2257 c1ccc(cc1)CCSCn2cncn2 62a_200020645497_100011218657 [0,0,1,0,0,0|2,0,1]=4 533 B16R2.2257 c1ccc(cc1)CNCCc2c[nH]cn2 2230a_100015324214_100020628418 [0,0,1,0,0,0|2,0,0]=3 534 B16R2.2257 c1ccc(cc1)CNCCc2c[nH]cn2 270004a_100000755092_100015611070 [0,0,1,0,0,0|2,0,0]=3 535 B16R2.2257 c1ccc(cc1)COCCc2c[nH]cn2 7a_100000210790_100020628418 [0,0,1,0,0,0|2,0,0]=3 536 B16R2.2257 c1ccc(cc1)COCSc2c[nH]cn2 62a_100000756875_100000763385 [0,0,1,0,0,0|3,0,0]=4 537 B16R2.2257 c1ccc(cc1)COCSc2c[nH]cn2 62a_100000763385_100000756875 [0,0,1,0,0,0|3,0,0]=4 538 B16R2.2257 c1ccc(cc1)CSCCc2c[nH]cn2 62a_100000211182_100020628418 [0,0,1,0,0,0|2,0,0]=3 539 B16R2.2257 c1ccc(cc1)CSCCc2c[nH]cn2 62a_100020628418_100015291786 [0,0,1,0,0,0|2,0,0]=3 540 B16R2.2257 c1ccc(cc1)CSCSc2c[nH]cn2 62a_100000756875_200011217039 [0,0,1,0,0,0|3,0,0]=4 541 B16R2.2257 c1ccc(cc1)CSCSc2c[nH]cn2 62a_200011217039_100000756875 [0,0,1,0,0,0|3,0,0]=4 542 B16R2.2257 c1ccc(cc1)OCCSc2c[nH]cn2 62a_100000184471_100000756875 [0,0,1,0,0,0|3,0,0]=4 543 B16R2.2257 c1ccc(cc1)OCCSc2c[nH]cn2 62a_100000756875_100000184471 [0,0,1,0,0,0|3,0,0]=4 544 B16R2.2257 c1ccc(cc1)SCCSc2c[nH]cn2 62a_100000246102_100000756875 [0,0,1,0,0,0|3,0,0]=4 545 B16R2.2257 c1ccc(cc1)SCCSc2c[nH]cn2 62a_100000756875_100000246102 [0,0,1,0,0,0|3,0,0]=4 546 B16R2.2257 c1ccc(cc1)SCNCc2ccco2 2230a_100000185738_100011218342 [0,0,1,0,0,0|3,0,0]=4 547 B16R2.2257 c1ccc(cc1)SCNCc2cccs2 2230a_100000211653_100011218342 [0,0,1,0,0,0|3,0,0]=4 548 B16R2.2257 c1ccc(cc1)SCNCc2ccoc2 2230a_100015206860_100011218342 [0,0,1,0,0,0|3,0,0]=4 549 B16R2.2257 c1ccc(cc1)SCNCc2ccsc2 2230a_100000186416_100011218342 [0,0,1,0,0,0|3,0,0]=4 550 B16R2.2257 c1ccc(cc1)SCNCc2cncs2 2230a_100016987365_100011218342 [0,0,1,0,0,0|2,0,1]=4 551 B16R2.2257 c1ccc(cc1)SCNCc2cscn2 2230a_100015185402_100011218342 [0,0,1,0,0,0|2,0,0]=3 552 B16R2.2257 c1ccc(cc1)SCNCc2ncco2 2230a_100016994969_100011218342 [0,0,1,0,0,0|3,0,0]=4 553 B16R2.2257 c1ccc(cc1)SCNCc2nccs2 2230a_100000740555_100011218342 [0,0,1,0,0,0|3,0,0]=4 554 B16R2.2257 c1ccc(cc1)SCSCc2c[nH]cn2 62a_100000707719_100011218342 [0,0,1,0,0,0|2,0,0]=3 555 B16R2.2257 c1ccc(cc1)SCSCc2c[nH]cn2 62a_100011218342_100000707719 [0,0,1,0,0,0|2,0,0]=3 556 B16R2.2257 c1ccc(cc1)SCSCc2cscn2 62a_100000205941_100011218342 [0,0,1,0,0,0|3,0,0]=4 557 B16R2.2257 c1ccc(cc1)SCSCc2cscn2 62a_100011218342_100000205941 [0,0,1,0,0,0|3,0,0]=4 558 B16R2.2257 c1ccc(nc1)CCNCc2cc[nH]n2 207a_100000211156_100000738523 [0,0,1,0,0,0|3,0,0]=4 559 B16R2.2257 c1ccc(nc1)CCNCc2cc[nH]n2 270004a_100000211156_100000738523 [0,0,1,0,0,0|3,0,0]=4 560 B16R2.2257 c1ccc(nc1)CCNCc2ccco2 207a_100000211156_100000186105 [0,0,1,0,0,0|3,0,0]=4 561 B16R2.2257 c1ccc(nc1)CCNCc2ccco2 2230a_100000185738_100015183660 [0,0,1,0,0,0|3,0,0]=4 562 B16R2.2257 c1ccc(nc1)CCNCc2ccco2 270004a_100000211156_100000186105 [0,0,1,0,0,0|3,0,0]=4 563 B16R2.2257 c1ccc(nc1)CCNCc2cccs2 207a_100000211156_100000209959 [0,0,1,0,0,0|3,0,0]=4 564 B16R2.2257 c1ccc(nc1)CCNCc2cccs2 2230a_100000211653_100015183660 [0,0,1,0,0,0|3,0,0]=4 565 B16R2.2257 c1ccc(nc1)CCNCc2cccs2 270004a_100000211156_100000209959 [0,0,1,0,0,0|3,0,0]=4 566 B16R2.2257 c1ccc(nc1)CCNCc2ccoc2 207a_100000211156_100011215517 [0,0,1,0,0,0|3,0,0]=4 567 B16R2.2257 c1ccc(nc1)CCNCc2ccoc2 2230a_100015206860_100015183660 [0,0,1,0,0,0|3,0,0]=4 568 B16R2.2257 c1ccc(nc1)CCNCc2ccoc2 270004a_100000211156_100011215517 [0,0,1,0,0,0|3,0,0]=4 569 B16R2.2257 c1ccc(nc1)CCNCc2ccsc2 207a_100000211156_100000188534 [0,0,1,0,0,0|3,0,0]=4 570 B16R2.2257 c1ccc(nc1)CCNCc2ccsc2 2230a_100000186416_100015183660 [0,0,1,0,0,0|3,0,0]=4 571 B16R2.2257 c1ccc(nc1)CCNCc2ccsc2 270004a_100000211156_100000188534 [0,0,1,0,0,0|3,0,0]=4 572 B16R2.2257 c1ccc(nc1)CCNCc2cn[nH]c2 207a_100000211156_100016992096 [0,0,1,0,0,0|3,0,0]=4 573 B16R2.2257 c1ccc(nc1)CCNCc2cn[nH]c2 270004a_100000211156_100016992096 [0,0,1,0,0,0|3,0,0]=4 574 B16R2.2257 c1ccc(nc1)CCNCc2cnc[nH]2 207a_100000211156_100000742939 [0,0,1,0,0,0|1,0,2]=4 575 B16R2.2257 c1ccc(nc1)CCNCc2cnco2 270004a_100000211156_100000064291 [0,0,1,0,0,0|2,0,1]=4 576 B16R2.2257 c1ccc(nc1)CCNCc2cncs2 207a_100000211156_100000749870 [0,0,1,0,0,0|2,0,1]=4 577 B16R2.2257 c1ccc(nc1)CCNCc2cncs2 2230a_100016987365_100015183660 [0,0,1,0,0,0|2,0,1]=4 578 B16R2.2257 c1ccc(nc1)CCNCc2cncs2 270004a_100000211156_100000749870 [0,0,1,0,0,0|2,0,1]=4 579 B16R2.2257 c1ccc(nc1)CCNCc2cocn2 270004a_100000211156_100000050382 [0,0,1,0,0,0|2,0,0]=3 580 B16R2.2257 c1ccc(nc1)CCNCc2cscn2 207a_100000211156_100000743575 [0,0,1,0,0,0|2,0,0]=3 581 B16R2.2257 c1ccc(nc1)CCNCc2cscn2 2230a_100015185402_100015183660 [0,0,1,0,0,0|2,0,0]=3 582 B16R2.2257 c1ccc(nc1)CCNCc2cscn2 270004a_100000211156_100000743575 [0,0,1,0,0,0|2,0,0]=3 583 B16R2.2257 c1ccc(nc1)CCNCc2csnn2 270004a_100000211156_100000738508 [0,0,1,0,0,0|3,0,0]=4 584 B16R2.2257 c1ccc(nc1)CCNCc2ncc[nH]2 207a_100000211156_100000743867 [0,0,1,0,0,0|3,0,0]=4 585 B16R2.2257 c1ccc(nc1)CCNCc2ncco2 2230a_100016994969_100015183660 [0,0,1,0,0,0|3,0,0]=4 586 B16R2.2257 c1ccc(nc1)CCNCc2ncco2 270004a_100000211156_100000064290 [0,0,1,0,0,0|3,0,0]=4 587 B16R2.2257 c1ccc(nc1)CCNCc2nccs2 207a_100000211156_100000750902 [0,0,1,0,0,0|3,0,0]=4 588 B16R2.2257 c1ccc(nc1)CCNCc2nccs2 2230a_100000740555_100015183660 [0,0,1,0,0,0|3,0,0]=4 589 B16R2.2257 c1ccc(nc1)CCNCc2nccs2 270004a_100000211156_100000750902 [0,0,1,0,0,0|3,0,0]=4 590 B16R2.2257 c1ccc(nc1)CCOCc2c[nH]cn2 34a_100000210271_100000707719 [0,0,1,0,0,0|2,0,0]=3 591 B16R2.2257 c1ccc(nc1)CCOCc2cscn2 34a_100000210271_100000205941 [0,0,1,0,0,0|3,0,0]=4 592 B16R2.2257 c1ccc(nc1)CCSCc2c[nH]cn2 62a_100000707719_100015183660 [0,0,1,0,0,0|2,0,0]=3 593 B16R2.2257 c1ccc(nc1)CCSCc2c[nH]cn2 62a_100015183660_100000707719 [0,0,1,0,0,0|2,0,0]=3 594 B16R2.2257 c1ccc(nc1)CCSCc2cscn2 62a_100000205941_100015183660 [0,0,1,0,0,0|3,0,0]=4 595 B16R2.2257 c1ccc(nc1)CCSCc2cscn2 62a_100015183660_100000205941 [0,0,1,0,0,0|3,0,0]=4 596 B16R2.2257 c1ccc(nc1)CNCCc2c[nH]cn2 270004a_100000755092_100000209966 [0,0,1,0,0,0|3,0,0]=4 597 B16R2.2257 c1ccc(nc1)CSCCc2c[nH]cn2 62a_100000721315_100020628418 [0,0,1,0,0,0|3,0,0]=4 598 B16R2.2257 c1ccc(nc1)CSCCc2c[nH]cn2 62a_100020628418_100000721315 [0,0,1,0,0,0|3,0,0]=4 599 B16R2.2257 c1cnc(cn1)CCNCc2cocn2 270004a_100000723456_100000050382 [0,0,1,0,0,0|3,0,0]=4 600 B16R2.2257 c1cnc(cn1)CCNCc2cscn2 207a_100000723456_100000743575 [0,0,1,0,0,0|3,0,0]=4 601 B16R2.2257 c1cnc(cn1)CCNCc2cscn2 270004a_100000723456_100000743575 [0,0,1,0,0,0|3,0,0]=4 602 B16R2.2257 c1cnc(cn1)CCOCc2c[nH]cn2 34a_100011349526_100000707719 [0,0,1,0,0,0|3,0,0]=4 603 B16R2.2257 c1cncc(c1)CCNCc2c[nH]cn2 2230a_100000736294_100000707719 [0,0,1,0,0,0|1,0,0]=2 604 B16R2.2257 c1cncc(c1)CCNCc2cc[nH]n2 207a_100000736294_100000738523 [0,0,1,0,0,0|3,0,0]=4 605 B16R2.2257 c1cncc(c1)CCNCc2cc[nH]n2 270004a_100000736294_100000738523 [0,0,1,0,0,0|3,0,0]=4 606 B16R2.2257 c1cncc(c1)CCNCc2ccco2 207a_100000736294_100000186105 [0,0,1,0,0,0|3,0,0]=4 607 B16R2.2257 c1cncc(c1)CCNCc2ccco2 2230a_100000185738_200011713674 [0,0,1,0,0,0|3,0,0]=4 608 B16R2.2257 c1cncc(c1)CCNCc2ccco2 270004a_100000736294_100000186105 [0,0,1,0,0,0|3,0,0]=4 609 B16R2.2257 c1cncc(c1)CCNCc2cccs2 207a_100000736294_100000209959 [0,0,1,0,0,0|3,0,0]=4 610 B16R2.2257 c1cncc(c1)CCNCc2cccs2 2230a_100000211653_200011713674 [0,0,1,0,0,0|3,0,0]=4 611 B16R2.2257 c1cncc(c1)CCNCc2cccs2 270004a_100000736294_100000209959 [0,0,1,0,0,0|3,0,0]=4 612 B16R2.2257 c1cncc(c1)CCNCc2ccoc2 207a_100000736294_100011215517 [0,0,1,0,0,0|3,0,0]=4 613 B16R2.2257 c1cncc(c1)CCNCc2ccoc2 2230a_100015206860_200011713674 [0,0,1,0,0,0|3,0,0]=4 614 B16R2.2257 c1cncc(c1)CCNCc2ccoc2 270004a_100000736294_100011215517 [0,0,1,0,0,0|3,0,0]=4 615 B16R2.2257 c1cncc(c1)CCNCc2ccon2 2230a_100000736294_100000234950 [0,0,1,0,0,0|3,0,0]=4 616 B16R2.2257 c1cncc(c1)CCNCc2ccsc2 207a_100000736294_100000188534 [0,0,1,0,0,0|3,0,0]=4 617 B16R2.2257 c1cncc(c1)CCNCc2ccsc2 2230a_100000186416_200011713674 [0,0,1,0,0,0|3,0,0]=4 618 B16R2.2257 c1cncc(c1)CCNCc2ccsc2 2230a_100000736294_100011261437 [0,0,1,0,0,0|3,0,0]=4 619 B16R2.2257 c1cncc(c1)CCNCc2ccsc2 270004a_100000736294_100000188534 [0,0,1,0,0,0|3,0,0]=4 620 B16R2.2257 c1cncc(c1)CCNCc2cn[nH]c2 207a_100000736294_100016992096 [0,0,1,0,0,0|3,0,0]=4 621 B16R2.2257 c1cncc(c1)CCNCc2cn[nH]c2 270004a_100000736294_100016992096 [0,0,1,0,0,0|3,0,0]=4 622 B16R2.2257 c1cncc(c1)CCNCc2cnc[nH]2 207a_100000736294_100000742939 [0,0,1,0,0,0|1,0,2]=4 623 B16R2.2257 c1cncc(c1)CCNCc2cnco2 270004a_100000736294_100000064291 [0,0,1,0,0,0|2,0,1]=4 624 B16R2.2257 c1cncc(c1)CCNCc2cncs2 207a_100000736294_100000749870 [0,0,1,0,0,0|2,0,1]=4 625 B16R2.2257 c1cncc(c1)CCNCc2cncs2 2230a_100000736294_100015185245 [0,0,1,0,0,0|2,0,1]=4 626 B16R2.2257 c1cncc(c1)CCNCc2cncs2 2230a_100016987365_200011713674 [0,0,1,0,0,0|2,0,1]=4 627 B16R2.2257 c1cncc(c1)CCNCc2cncs2 270004a_100000736294_100000749870 [0,0,1,0,0,0|2,0,1]=4 628 B16R2.2257 c1cncc(c1)CCNCc2cocn2 270004a_100000736294_100000050382 [0,0,1,0,0,0|2,0,0]=3 629 B16R2.2257 c1cncc(c1)CCNCc2cscn2 207a_100000736294_100000743575 [0,0,1,0,0,0|2,0,0]=3 630 B16R2.2257 c1cncc(c1)CCNCc2cscn2 2230a_100000736294_100000205941 [0,0,1,0,0,0|2,0,0]=3 631 B16R2.2257 c1cncc(c1)CCNCc2cscn2 2230a_100015185402_200011713674 [0,0,1,0,0,0|2,0,0]=3 632 B16R2.2257 c1cncc(c1)CCNCc2cscn2 270004a_100000736294_100000743575 [0,0,1,0,0,0|2,0,0]=3 633 B16R2.2257 c1cncc(c1)CCNCc2csnn2 270004a_100000736294_100000738508 [0,0,1,0,0,0|3,0,0]=4 634 B16R2.2257 c1cncc(c1)CCNCc2ncc[nH]2 207a_100000736294_100000743867 [0,0,1,0,0,0|3,0,0]=4 635 B16R2.2257 c1cncc(c1)CCNCc2ncc[nH]2 2230a_100000736294_100016991755 [0,0,1,0,0,0|3,0,0]=4 636 B16R2.2257 c1cncc(c1)CCNCc2ncco2 2230a_100000736294_103436540062 [0,0,1,0,0,0|3,0,0]=4 637 B16R2.2257 c1cncc(c1)CCNCc2ncco2 2230a_100016994969_200011713674 [0,0,1,0,0,0|3,0,0]=4 638 B16R2.2257 c1cncc(c1)CCNCc2ncco2 270004a_100000736294_100000064290 [0,0,1,0,0,0|3,0,0]=4 639 B16R2.2257 c1cncc(c1)CCNCc2nccs2 207a_100000736294_100000750902 [0,0,1,0,0,0|3,0,0]=4 640 B16R2.2257 c1cncc(c1)CCNCc2nccs2 2230a_100000736294_100015184050 [0,0,1,0,0,0|3,0,0]=4 641 B16R2.2257 c1cncc(c1)CCNCc2nccs2 2230a_100000740555_200011713674 [0,0,1,0,0,0|3,0,0]=4 642 B16R2.2257 c1cncc(c1)CCNCc2nccs2 270004a_100000736294_100000750902 [0,0,1,0,0,0|3,0,0]=4 643 B16R2.2257 c1cncc(c1)CCNCn2cncn2 2230a_100000736294_200020645497 [0,0,1,0,0,0|2,0,1]=4 644 B16R2.2257 c1cncc(c1)CCOCc2c[nH]cn2 34a_100011217484_100000707719 [0,0,1,0,0,0|2,0,0]=3 645 B16R2.2257 c1cncc(c1)CCOCc2cscn2 34a_100011217484_100000205941 [0,0,1,0,0,0|3,0,0]=4 646 B16R2.2257 c1cncc(c1)CCSCc2c[nH]cn2 62a_100000707719_200011713674 [0,0,1,0,0,0|2,0,0]=3 647 B16R2.2257 c1cncc(c1)CCSCc2c[nH]cn2 62a_200011713674_100000707719 [0,0,1,0,0,0|2,0,0]=3 648 B16R2.2257 c1cncc(c1)CCSCc2cscn2 62a_100000205941_200011713674 [0,0,1,0,0,0|3,0,0]=4 649 B16R2.2257 c1cncc(c1)CCSCc2cscn2 62a_200011713674_100000205941 [0,0,1,0,0,0|3,0,0]=4 650 B16R2.2257 c1cncc(c1)CNCCc2c[nH]cn2 270004a_100000755092_100000209961 [0,0,1,0,0,0|3,0,0]=4 651 B16R2.2257 c1cncc(c1)CSCCc2c[nH]cn2 62a_100000741622_100020628418 [0,0,1,0,0,0|3,0,0]=4 652 B16R2.2257 c1cncc(c1)CSCCc2c[nH]cn2 62a_100020628418_100000741622 [0,0,1,0,0,0|3,0,0]=4 653 B16R2.2257 c1coc(c1)CNCCc2ccncc2 207a_100000742849_100000186105 [0,0,1,0,0,0|3,0,0]=4 654 B16R2.2257 c1coc(c1)CNCCc2ccncc2 2230a_100000185738_100000723409 [0,0,1,0,0,0|3,0,0]=4 655 B16R2.2257 c1coc(c1)CNCCc2ccncc2 270004a_100000742849_100000186105 [0,0,1,0,0,0|3,0,0]=4 656 B16R2.2257 c1csc(c1)CNCCc2ccncc2 207a_100000742849_100000209959 [0,0,1,0,0,0|3,0,0]=4 657 B16R2.2257 c1csc(c1)CNCCc2ccncc2 2230a_100000211653_100000723409 [0,0,1,0,0,0|3,0,0]=4 658 B16R2.2257 c1csc(c1)CNCCc2ccncc2 270004a_100000742849_100000209959 [0,0,1,0,0,0|3,0,0]=4 659 B16R2.2257 c1ncc(cn1)CCOCc2c[nH]cn2 34a_100011709255_100000707719 [0,0,1,0,0,0|3,0,0]=4 660 B16R2.2965 CC(Sc1c[nH]cn1)c2ccccc2Cl 62a_100000181259_100000756875 [0,0,1,0,0,0|3,0,0]=4 661 B16R2.2965 CC(Sc1c[nH]cn1)c2ccccc2Cl 62a_100000756875_100000181259 [0,0,1,0,0,0|3,0,0]=4 662 B16R2.2965 CC(Sc1c[nH]cn1)c2ccccc2F 62a_100000756875_200000741388 [0,0,1,0,0,0|3,0,0]=4 663 B16R2.2965 CC(Sc1c[nH]cn1)c2ccccc2F 62a_200000741388_100000756875 [0,0,1,0,0,0|3,0,0]=4 664 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Br 2230a_100020606079_100000707719 [0,0,1,0,0,0|1,0,0]=2 665 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Br 269982a_100020606079_100000707719 [0,0,1,0,0,0|1,0,0]=2 666 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Br 34a_100020606079_100000707719 [0,0,1,0,0,0|1,0,0]=2 667 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Cl 2230a_100000219374_100000707719 [0,0,1,0,0,0|1,0,0]=2 668 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Cl 269982a_100000219374_100000707719 [0,0,1,0,0,0|1,0,0]=2 669 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Cl 34a_100000219374_100000707719 [0,0,1,0,0,0|1,0,0]=2 670 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2F 2230a_100000220357_100000707719 [0,0,1,0,0,0|1,0,0]=2 671 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2F 269982a_100000220357_100000707719 [0,0,1,0,0,0|1,0,0]=2 672 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2F 34a_100000220357_100000707719 [0,0,1,0,0,0|1,0,0]=2 673 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2F 38a_100000220357_100000707719 [0,0,1,0,0,0|1,0,0]=2 674 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2O 269982a_100000033821_100000707719 [0,0,1,0,0,0|1,0,0]=2 675 B16R2.2965 CN(Cc1ccon1)c2ccccc2Br 2230a_100020606079_100000234950 [0,0,1,0,0,0|3,0,0]=4 676 B16R2.2965 CN(Cc1ccon1)c2ccccc2Br 269982a_100020606079_100000234950 [0,0,1,0,0,0|3,0,0]=4 677 B16R2.2965 CN(Cc1ccon1)c2ccccc2Br 34a_100020606079_100000234950 [0,0,1,0,0,0|3,0,0]=4 678 B16R2.2965 CN(Cc1ccon1)c2ccccc2Cl 2230a_100000219374_100000234950 [0,0,1,0,0,0|3,0,0]=4 679 B16R2.2965 CN(Cc1ccon1)c2ccccc2Cl 269982a_100000219374_100000234950 [0,0,1,0,0,0|3,0,0]=4 680 B16R2.2965 CN(Cc1ccon1)c2ccccc2Cl 34a_100000219374_100000234950 [0,0,1,0,0,0|3,0,0]=4 681 B16R2.2965 CN(Cc1ccon1)c2ccccc2F 2230a_100000220357_100000234950 [0,0,1,0,0,0|3,0,0]=4 682 B16R2.2965 CN(Cc1ccon1)c2ccccc2F 269982a_100000220357_100000234950 [0,0,1,0,0,0|3,0,0]=4 683 B16R2.2965 CN(Cc1ccon1)c2ccccc2F 34a_100000220357_100000234950 [0,0,1,0,0,0|3,0,0]=4 684 B16R2.2965 CN(Cc1ccon1)c2ccccc2F 38a_100000220357_100000234950 [0,0,1,0,0,0|3,0,0]=4 685 B16R2.2965 CN(Cc1ccon1)c2ccccc2O 269982a_100000033821_100000234950 [0,0,1,0,0,0|3,0,0]=4 686 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Br 2230a_100020606079_100011261437 [0,0,1,0,0,0|3,0,0]=4 687 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Br 269982a_100020606079_100011233845 [0,0,1,0,0,0|3,0,0]=4 688 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Br 34a_100020606079_100011261437 [0,0,1,0,0,0|3,0,0]=4 689 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Cl 2230a_100000219374_100011261437 [0,0,1,0,0,0|3,0,0]=4 690 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Cl 269982a_100000219374_100011233845 [0,0,1,0,0,0|3,0,0]=4 691 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Cl 34a_100000219374_100011261437 [0,0,1,0,0,0|3,0,0]=4 692 B16R2.2965 CN(Cc1ccsc1)c2ccccc2F 2230a_100000220357_100011261437 [0,0,1,0,0,0|3,0,0]=4 693 B16R2.2965 CN(Cc1ccsc1)c2ccccc2F 269982a_100000220357_100011233845 [0,0,1,0,0,0|3,0,0]=4 694 B16R2.2965 CN(Cc1ccsc1)c2ccccc2F 34a_100000220357_100011261437 [0,0,1,0,0,0|3,0,0]=4 695 B16R2.2965 CN(Cc1ccsc1)c2ccccc2F 38a_100000220357_100011233845 [0,0,1,0,0,0|3,0,0]=4 696 B16R2.2965 CN(Cc1ccsc1)c2ccccc2O 269982a_100000033821_100011233845 [0,0,1,0,0,0|3,0,0]=4 697 B16R2.2965 CN(Cc1cncs1)c2ccccc2Br 2230a_100020606079_100015185245 [0,0,1,0,0,0|2,0,1]=4 698 B16R2.2965 CN(Cc1cncs1)c2ccccc2Br 269982a_100020606079_100015185245 [0,0,1,0,0,0|2,0,1]=4 699 B16R2.2965 CN(Cc1cncs1)c2ccccc2Br 34a_100020606079_100015185245 [0,0,1,0,0,0|2,0,1]=4 700 B16R2.2965 CN(Cc1cncs1)c2ccccc2Cl 2230a_100000219374_100015185245 [0,0,1,0,0,0|2,0,1]=4 701 B16R2.2965 CN(Cc1cncs1)c2ccccc2Cl 269982a_100000219374_100015185245 [0,0,1,0,0,0|2,0,1]=4 702 B16R2.2965 CN(Cc1cncs1)c2ccccc2Cl 34a_100000219374_100015185245 [0,0,1,0,0,0|2,0,1]=4 703 B16R2.2965 CN(Cc1cncs1)c2ccccc2F 2230a_100000220357_100015185245 [0,0,1,0,0,0|2,0,1]=4 704 B16R2.2965 CN(Cc1cncs1)c2ccccc2F 269982a_100000220357_100015185245 [0,0,1,0,0,0|2,0,1]=4 705 B16R2.2965 CN(Cc1cncs1)c2ccccc2F 34a_100000220357_100015185245 [0,0,1,0,0,0|2,0,1]=4 706 B16R2.2965 CN(Cc1cncs1)c2ccccc2O 269982a_100000033821_100015185245 [0,0,1,0,0,0|2,0,1]=4 707 B16R2.2965 CN(Cc1cscn1)c2ccccc2Br 2230a_100020606079_100000205941 [0,0,1,0,0,0|2,0,0]=3 708 B16R2.2965 CN(Cc1cscn1)c2ccccc2Br 269982a_100020606079_100000205941 [0,0,1,0,0,0|2,0,0]=3 709 B16R2.2965 CN(Cc1cscn1)c2ccccc2Br 34a_100020606079_100000205941 [0,0,1,0,0,0|2,0,0]=3 710 B16R2.2965 CN(Cc1cscn1)c2ccccc2Cl 2230a_100000219374_100000205941 [0,0,1,0,0,0|2,0,0]=3 711 B16R2.2965 CN(Cc1cscn1)c2ccccc2Cl 269982a_100000219374_100000205941 [0,0,1,0,0,0|2,0,0]=3 712 B16R2.2965 CN(Cc1cscn1)c2ccccc2Cl 34a_100000219374_100000205941 [0,0,1,0,0,0|2,0,0]=3 713 B16R2.2965 CN(Cc1cscn1)c2ccccc2F 2230a_100000220357_100000205941 [0,0,1,0,0,0|2,0,0]=3 714 B16R2.2965 CN(Cc1cscn1)c2ccccc2F 269982a_100000220357_100000205941 [0,0,1,0,0,0|2,0,0]=3 715 B16R2.2965 CN(Cc1cscn1)c2ccccc2F 34a_100000220357_100000205941 [0,0,1,0,0,0|2,0,0]=3 716 B16R2.2965 CN(Cc1cscn1)c2ccccc2O 269982a_100000033821_100000205941 [0,0,1,0,0,0|2,0,0]=3 717 B16R2.2965 CN(Cc1cscn1)c2ccncc2Br 27a_100000225794_100000726257 [0,0,1,0,0,0|3,0,0]=4 718 B16R2.2965 CN(Cc1cscn1)c2ccncc2F 27a_100000225794_100000035921 [0,0,1,0,0,0|3,0,0]=4 719 B16R2.2965 CN(Cc1cscn1)c2ncccc2Br 27a_100000225794_100000696092 [0,0,1,0,0,0|3,0,0]=4 720 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Br 2230a_100020606079_100016991755 [0,0,1,0,0,0|3,0,0]=4 721 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Br 269982a_100020606079_100016991755 [0,0,1,0,0,0|3,0,0]=4 722 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Br 34a_100020606079_100016991755 [0,0,1,0,0,0|3,0,0]=4 723 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Cl 2230a_100000219374_100016991755 [0,0,1,0,0,0|3,0,0]=4 724 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Cl 269982a_100000219374_100016991755 [0,0,1,0,0,0|3,0,0]=4 725 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Cl 34a_100000219374_100016991755 [0,0,1,0,0,0|3,0,0]=4 726 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2F 2230a_100000220357_100016991755 [0,0,1,0,0,0|3,0,0]=4 727 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2F 269982a_100000220357_100016991755 [0,0,1,0,0,0|3,0,0]=4 728 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2F 34a_100000220357_100016991755 [0,0,1,0,0,0|3,0,0]=4 729 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2F 38a_100000220357_100016991755 [0,0,1,0,0,0|3,0,0]=4 730 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2O 269982a_100000033821_100016991755 [0,0,1,0,0,0|3,0,0]=4 731 B16R2.2965 CN(Cc1ncco1)c2ccccc2Br 2230a_100020606079_103436540062 [0,0,1,0,0,0|3,0,0]=4 732 B16R2.2965 CN(Cc1ncco1)c2ccccc2Br 269982a_100020606079_103436540062 [0,0,1,0,0,0|3,0,0]=4 733 B16R2.2965 CN(Cc1ncco1)c2ccccc2Br 34a_100020606079_103436540062 [0,0,1,0,0,0|3,0,0]=4 734 B16R2.2965 CN(Cc1ncco1)c2ccccc2Cl 2230a_100000219374_103436540062 [0,0,1,0,0,0|3,0,0]=4 735 B16R2.2965 CN(Cc1ncco1)c2ccccc2Cl 269982a_100000219374_103436540062 [0,0,1,0,0,0|3,0,0]=4 736 B16R2.2965 CN(Cc1ncco1)c2ccccc2Cl 34a_100000219374_103436540062 [0,0,1,0,0,0|3,0,0]=4 737 B16R2.2965 CN(Cc1ncco1)c2ccccc2F 2230a_100000220357_103436540062 [0,0,1,0,0,0|3,0,0]=4 738 B16R2.2965 CN(Cc1ncco1)c2ccccc2F 269982a_100000220357_103436540062 [0,0,1,0,0,0|3,0,0]=4 739 B16R2.2965 CN(Cc1ncco1)c2ccccc2F 34a_100000220357_103436540062 [0,0,1,0,0,0|3,0,0]=4 740 B16R2.2965 CN(Cc1ncco1)c2ccccc2F 38a_100000220357_103436540062 [0,0,1,0,0,0|3,0,0]=4 741 B16R2.2965 CN(Cc1ncco1)c2ccccc2O 269982a_100000033821_103436540062 [0,0,1,0,0,0|3,0,0]=4 742 B16R2.2965 CN(Cc1nccs1)c2ccccc2Br 2230a_100020606079_100015184050 [0,0,1,0,0,0|3,0,0]=4 743 B16R2.2965 CN(Cc1nccs1)c2ccccc2Br 269982a_100020606079_100015184050 [0,0,1,0,0,0|3,0,0]=4 744 B16R2.2965 CN(Cc1nccs1)c2ccccc2Br 34a_100020606079_100015184050 [0,0,1,0,0,0|3,0,0]=4 745 B16R2.2965 CN(Cc1nccs1)c2ccccc2Cl 2230a_100000219374_100015184050 [0,0,1,0,0,0|3,0,0]=4 746 B16R2.2965 CN(Cc1nccs1)c2ccccc2Cl 269982a_100000219374_100015184050 [0,0,1,0,0,0|3,0,0]=4 747 B16R2.2965 CN(Cc1nccs1)c2ccccc2Cl 34a_100000219374_100015184050 [0,0,1,0,0,0|3,0,0]=4 748 B16R2.2965 CN(Cc1nccs1)c2ccccc2F 2230a_100000220357_100015184050 [0,0,1,0,0,0|3,0,0]=4 749 B16R2.2965 CN(Cc1nccs1)c2ccccc2F 269982a_100000220357_100015184050 [0,0,1,0,0,0|3,0,0]=4 750 B16R2.2965 CN(Cc1nccs1)c2ccccc2F 34a_100000220357_100015184050 [0,0,1,0,0,0|3,0,0]=4 751 B16R2.2965 CN(Cc1nccs1)c2ccccc2F 38a_100000220357_100015184050 [0,0,1,0,0,0|3,0,0]=4 752 B16R2.2965 CN(Cc1nccs1)c2ccccc2O 269982a_100000033821_100015184050 [0,0,1,0,0,0|3,0,0]=4 753 B16R2.2965 CN(Cc1ncon1)c2ccccc2Br 269982a_100020606079_100000233494 [0,0,1,0,0,0|3,0,0]=4 754 B16R2.2965 CN(Cc1ncon1)c2ccccc2Br 34a_100020606079_100000233494 [0,0,1,0,0,0|3,0,0]=4 755 B16R2.2965 CN(Cc1ncon1)c2ccccc2Cl 269982a_100000219374_100000233494 [0,0,1,0,0,0|3,0,0]=4 756 B16R2.2965 CN(Cc1ncon1)c2ccccc2Cl 34a_100000219374_100000233494 [0,0,1,0,0,0|3,0,0]=4 757 B16R2.2965 CN(Cc1ncon1)c2ccccc2F 269982a_100000220357_100000233494 [0,0,1,0,0,0|3,0,0]=4 758 B16R2.2965 CN(Cc1ncon1)c2ccccc2F 34a_100000220357_100000233494 [0,0,1,0,0,0|3,0,0]=4 759 B16R2.2965 CN(Cc1ncon1)c2ccccc2F 38a_100000220357_100000233494 [0,0,1,0,0,0|3,0,0]=4 760 B16R2.2965 CN(Cc1ncon1)c2ccccc2O 269982a_100000033821_100000233494 [0,0,1,0,0,0|3,0,0]=4 761 B16R2.2965 CN(Cn1cncn1)c2ccccc2Br 2230a_100020606079_200020645497 [0,0,1,0,0,0|2,0,1]=4 762 B16R2.2965 CN(Cn1cncn1)c2ccccc2Br 269982a_100020606079_200020645497 [0,0,1,0,0,0|2,0,1]=4 763 B16R2.2965 CN(Cn1cncn1)c2ccccc2Br 34a_100020606079_200020645497 [0,0,1,0,0,0|2,0,1]=4 764 B16R2.2965 CN(Cn1cncn1)c2ccccc2Cl 2230a_100000219374_200020645497 [0,0,1,0,0,0|2,0,1]=4 765 B16R2.2965 CN(Cn1cncn1)c2ccccc2Cl 269982a_100000219374_200020645497 [0,0,1,0,0,0|2,0,1]=4 766 B16R2.2965 CN(Cn1cncn1)c2ccccc2Cl 34a_100000219374_200020645497 [0,0,1,0,0,0|2,0,1]=4 767 B16R2.2965 CN(Cn1cncn1)c2ccccc2F 2230a_100000220357_200020645497 [0,0,1,0,0,0|2,0,1]=4 768 B16R2.2965 CN(Cn1cncn1)c2ccccc2F 269982a_100000220357_200020645497 [0,0,1,0,0,0|2,0,1]=4 769 B16R2.2965 CN(Cn1cncn1)c2ccccc2F 34a_100000220357_200020645497 [0,0,1,0,0,0|2,0,1]=4 770 B16R2.2965 CN(Cn1cncn1)c2ccccc2F 38a_100000220357_200020645497 [0,0,1,0,0,0|2,0,1]=4 771 B16R2.2965 CN(Cn1cncn1)c2ccccc2O 269982a_100000033821_200020645497 [0,0,1,0,0,0|2,0,1]=4 772 B16R2.2965 Cc1ccccc1C(=O)Cc2c[nH]cn2 1458a_100000212026_100000707719 [0,0,1,0,0,0|2,0,0]=3 773 B16R2.2965 Cc1ccccc1C(=O)Cc2cscn2 1458a_100000212026_100000205941 [0,0,1,0,0,0|3,0,0]=4 774 B16R2.2965 Cc1ccccc1N(C)CC2=NCCN2 269982a_100000219699_100000737910 [0,0,1,0,0,0|2,0,1]=4 775 B16R2.2965 Cc1ccccc1N(C)CC2=NCCN2 34a_100000219699_100000737910 [0,0,1,0,0,0|2,0,1]=4 776 B16R2.2965 Cc1ccccc1N(C)Cc2c[nH]cn2 2230a_100000219699_100000707719 [0,0,1,0,0,0|0,0,0]=1 777 B16R2.2965 Cc1ccccc1N(C)Cc2c[nH]cn2 269982a_100000219699_100000707719 [0,0,1,0,0,0|0,0,0]=1 778 B16R2.2965 Cc1ccccc1N(C)Cc2c[nH]cn2 34a_100000219699_100000707719 [0,0,1,0,0,0|0,0,0]=1 779 B16R2.2965 Cc1ccccc1N(C)Cc2ccn[nH]2 2230a_100000219699_100000728653 [0,0,1,0,0,0|2,0,1]=4 780 B16R2.2965 Cc1ccccc1N(C)Cc2ccn[nH]2 269982a_100000219699_100000728653 [0,0,1,0,0,0|2,0,1]=4 781 B16R2.2965 Cc1ccccc1N(C)Cc2ccn[nH]2 34a_100000219699_100000728653 [0,0,1,0,0,0|2,0,1]=4 782 B16R2.2965 Cc1ccccc1N(C)Cc2ccon2 2230a_100000219699_100000234950 [0,0,1,0,0,0|2,0,0]=3 783 B16R2.2965 Cc1ccccc1N(C)Cc2ccon2 269982a_100000219699_100000234950 [0,0,1,0,0,0|2,0,0]=3 784 B16R2.2965 Cc1ccccc1N(C)Cc2ccon2 34a_100000219699_100000234950 [0,0,1,0,0,0|2,0,0]=3 785 B16R2.2965 Cc1ccccc1N(C)Cc2ccsc2 2230a_100000219699_100011261437 [0,0,1,0,0,0|2,0,0]=3 786 B16R2.2965 Cc1ccccc1N(C)Cc2ccsc2 269982a_100000219699_100011233845 [0,0,1,0,0,0|2,0,0]=3 787 B16R2.2965 Cc1ccccc1N(C)Cc2ccsc2 34a_100000219699_100011261437 [0,0,1,0,0,0|2,0,0]=3 788 B16R2.2965 Cc1ccccc1N(C)Cc2cncs2 2230a_100000219699_100015185245 [0,0,1,0,0,0|1,0,1]=3 789 B16R2.2965 Cc1ccccc1N(C)Cc2cncs2 269982a_100000219699_100015185245 [0,0,1,0,0,0|1,0,1]=3 790 B16R2.2965 Cc1ccccc1N(C)Cc2cncs2 34a_100000219699_100015185245 [0,0,1,0,0,0|1,0,1]=3 791 B16R2.2965 Cc1ccccc1N(C)Cc2cscn2 2230a_100000219699_100000205941 [0,0,1,0,0,0|1,0,0]=2 792 B16R2.2965 Cc1ccccc1N(C)Cc2cscn2 269982a_100000219699_100000205941 [0,0,1,0,0,0|1,0,0]=2 793 B16R2.2965 Cc1ccccc1N(C)Cc2cscn2 34a_100000219699_100000205941 [0,0,1,0,0,0|1,0,0]=2 794 B16R2.2965 Cc1ccccc1N(C)Cc2ncc[nH]2 2230a_100000219699_100016991755 [0,0,1,0,0,0|2,0,0]=3 795 B16R2.2965 Cc1ccccc1N(C)Cc2ncc[nH]2 269982a_100000219699_100016991755 [0,0,1,0,0,0|2,0,0]=3 796 B16R2.2965 Cc1ccccc1N(C)Cc2ncc[nH]2 34a_100000219699_100016991755 [0,0,1,0,0,0|2,0,0]=3 797 B16R2.2965 Cc1ccccc1N(C)Cc2ncco2 2230a_100000219699_103436540062 [0,0,1,0,0,0|2,0,0]=3 798 B16R2.2965 Cc1ccccc1N(C)Cc2ncco2 269982a_100000219699_103436540062 [0,0,1,0,0,0|2,0,0]=3 799 B16R2.2965 Cc1ccccc1N(C)Cc2ncco2 34a_100000219699_103436540062 [0,0,1,0,0,0|2,0,0]=3 800 B16R2.2965 Cc1ccccc1N(C)Cc2nccs2 2230a_100000219699_100015184050 [0,0,1,0,0,0|2,0,0]=3 801 B16R2.2965 Cc1ccccc1N(C)Cc2nccs2 269982a_100000219699_100015184050 [0,0,1,0,0,0|2,0,0]=3 802 B16R2.2965 Cc1ccccc1N(C)Cc2nccs2 34a_100000219699_100015184050 [0,0,1,0,0,0|2,0,0]=3 803 B16R2.2965 Cc1ccccc1N(C)Cc2ncon2 269982a_100000219699_100000233494 [0,0,1,0,0,0|2,0,0]=3 804 B16R2.2965 Cc1ccccc1N(C)Cc2ncon2 34a_100000219699_100000233494 [0,0,1,0,0,0|2,0,0]=3 805 B16R2.2965 Cc1ccccc1N(C)Cc2nnn[nH]2 269982a_100000219699_100000765167 [0,0,1,0,0,0|2,0,1]=4 806 B16R2.2965 Cc1ccccc1N(C)Cc2nnn[nH]2 34a_100000219699_100000765167 [0,0,1,0,0,0|2,0,1]=4 807 B16R2.2965 Cc1ccccc1N(C)Cn2cncn2 2230a_100000219699_200020645497 [0,0,1,0,0,0|1,0,1]=3 808 B16R2.2965 Cc1ccccc1N(C)Cn2cncn2 269982a_100000219699_200020645497 [0,0,1,0,0,0|1,0,1]=3 809 B16R2.2965 Cc1ccccc1N(C)Cn2cncn2 34a_100000219699_200020645497 [0,0,1,0,0,0|1,0,1]=3 810 B16R2.2965 Cc1ccnnc1N(C)Cc2cscn2 27a_100000225794_100000089043 [0,0,1,0,0,0|3,0,0]=4 811 B16R2.2965 Cc1cnccc1N(C)Cc2ccco2 27a_100000185268_100000765111 [0,0,1,0,0,0|3,0,0]=4 812 B16R2.2965 Cc1cnccc1N(C)Cc2cccs2 27a_100000184426_100000765111 [0,0,1,0,0,0|3,0,0]=4 813 B16R2.2965 Cc1cnccc1N(C)Cc2ccon2 27a_100000757864_100000765111 [0,0,1,0,0,0|3,0,0]=4 814 B16R2.2965 Cc1cnccc1N(C)Cc2ccsc2 27a_100020654213_100000765111 [0,0,1,0,0,0|3,0,0]=4 815 B16R2.2965 Cc1cnccc1N(C)Cc2cscn2 27a_100000225794_100000765111 [0,0,1,0,0,0|2,0,0]=3 816 B16R2.2965 Cc1cnccc1N(C)Cc2ncc[nH]2 27a_100015184136_100000765111 [0,0,1,0,0,0|3,0,0]=4 817 B16R2.2965 Cc1cnccc1N(C)Cc2nccs2 27a_100000765864_100000765111 [0,0,1,0,0,0|3,0,0]=4 818 B16R2.2965 Cc1cncnc1N(C)Cc2cscn2 27a_100000225794_100011998708 [0,0,1,0,0,0|3,0,0]=4 819 B16R2.2965 Cc1nccnc1N(C)Cc2cscn2 27a_100000225794_100011999405 [0,0,1,0,0,0|3,0,0]=4 820 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2Br 1458a_100000188424_100000707719 [0,0,1,0,0,0|3,0,0]=4 821 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2Cl 1458a_100000185844_100000707719 [0,0,1,0,0,0|3,0,0]=4 822 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2F 1458a_100000188656_100000707719 [0,0,1,0,0,0|3,0,0]=4 823 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2I 1458a_100000187884_100000707719 [0,0,1,0,0,0|3,0,0]=4 824 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2O 1458a_100015234032_100000707719 [0,0,1,0,0,0|3,0,0]=4 825 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2[O-] 1458a_100009911694_100000707719 [0,0,1,0,0,0|3,0,0]=4 826 B16R3.8 c1ccc2c(c[nH]c2c1)c3c[nH]cn3 271570a_100012356747_100000756875 [0,0,0,0,1,0|2,0,1]=4 827 B16R3.8 c1ccc2c(coc2c1)c3c[nH]cn3 271570a_100000084643_100000756875 [0,0,0,0,1,0|2,0,1]=4 828 B16R3.8 c1ccc2c(csc2c1)c3c[nH]cn3 271570a_100000038073_100000756875 [0,0,0,0,1,0|2,0,1]=4 829 B16R3.1777 c1ccc2c(c1)CC2Sc3c[nH]cn3 62a_100000756875_100009813401 [0,0,0,0,1,0|2,0,0]=3 830 B16R3.1777 c1ccc2c(c1)CC2Sc3c[nH]cn3 62a_100009813401_100000756875 [0,0,0,0,1,0|2,0,0]=3 831 B16R3.1777 c1ccc2c(c1)CC2Sc3c[nH]nn3 62a_100009813401_100009819707 [0,0,0,0,1,0|3,0,0]=4 832 B16R3.1777 c1ccc2c(c1)CC2Sc3c[nH]nn3 62a_100009819707_100009813401 [0,0,0,0,1,0|3,0,0]=4 833 B16R3.1777 c1ccc2c(c1)CC2Sc3cscn3 62a_100000751502_100009813401 [0,0,0,0,1,0|3,0,0]=4 834 B16R3.1777 c1ccc2c(c1)CC2Sc3cscn3 62a_100009813401_100000751502 [0,0,0,0,1,0|3,0,0]=4 835 B16R3.1777 c1ccc2c(c1)CC2Sc3nc[nH]n3 62a_100000761765_100009813401 [0,0,0,0,1,0|3,0,0]=4 836 B16R3.1777 c1ccc2c(c1)CC2Sc3nc[nH]n3 62a_100009813401_100000761765 [0,0,0,0,1,0|3,0,0]=4 837 B18R3.2098 c1ccc(nc1)SC2CCc3c2cccc3 62a_100011216584_200000721974 [0,0,0,0,0,1|3,0,0]=4 838 B18R3.2098 c1ccc2c(c1)CCC2Sc3ccncn3 62a_100000703185_200000721974 [0,0,0,0,0,1|2,0,1]=4 839 B18R3.2098 c1ccc2c(c1)CCC2Sc3cnccn3 62a_100000211759_200000721974 [0,0,0,0,0,1|2,0,1]=4 840 B18R3.2098 c1ccc2c(c1)CCC2Sc3cncnc3 62a_100011206942_200000721974 [0,0,0,0,0,1|2,0,1]=4 841 B18R3.2098 c1ccc2c(c1)CC[C@@H]2Nc3ccncn3 27a_100016989578_100000703185 [0,0,0,0,0,1|2,0,1]=4 842 B18R3.2098 c1ccc2c(c1)CC[C@@H]2Nc3cnccn3 27a_100016989578_100000211759 [0,0,0,0,0,1|2,0,1]=4 843 B18R3.2098 c1cnc(nc1)N[C@H]2CCc3c2cccc3 27a_100016989578_100000211032 [0,0,0,0,0,1|3,0,0]=4 844 B18R3.2098 c1cnc(nc1)SC2CCc3c2cccc3 62a_100000211032_200000721974 [0,0,0,0,0,1|3,0,0]=4 845 B18R3.2098 c1cncc(c1)SC2CCc3c2cccc3 62a_100000210063_200000721974 [0,0,0,0,0,1|3,0,0]=4 846 B18R3.2098 c1cnnc(c1)N[C@H]2CCc3c2cccc3 27a_100016989578_100016991348 [0,0,0,0,0,1|3,0,0]=4 847 B18R3.2098 c1cnnc(c1)SC2CCc3c2cccc3 62a_100016991348_200000721974 [0,0,0,0,0,1|3,0,0]=4 848 B18R3.3347 c1ccc2c(c1)CCC2CNc3ncns3 27a_100020632452_100000693119 [0,0,0,0,0,1|2,0,1]=4 849 B18R3.3347 c1ccc2c(c1)CCC2NCc3cc[nH]n3 269862a_100000739516_100000212051 [0,0,0,0,0,1|3,0,0]=4 850 B18R3.3347 c1ccc2c(c1)CCC2NCc3ccoc3 2230a_100015206860_200000721974 [0,0,0,0,0,1|3,0,0]=4 851 B18R3.3347 c1ccc2c(c1)CCC2NCc3ccoc3 269862a_100015206860_100000212051 [0,0,0,0,0,1|3,0,0]=4 852 B18R3.3347 c1ccc2c(c1)CCC2NCc3ccon3 269862a_100000688301_100000212051 [0,0,0,0,0,1|3,0,0]=4 853 B18R3.3347 c1ccc2c(c1)CCC2NCc3ccsc3 2230a_100000186416_200000721974 [0,0,0,0,0,1|3,0,0]=4 854 B18R3.3347 c1ccc2c(c1)CCC2NCc3ccsc3 269862a_100000186416_100000212051 [0,0,0,0,0,1|3,0,0]=4 855 B18R3.3347 c1ccc2c(c1)CCC2NCc3cnco3 269862a_100020634212_100000212051 [0,0,0,0,0,1|2,0,1]=4 856 B18R3.3347 c1ccc2c(c1)CCC2NCc3cncs3 2230a_100016987365_200000721974 [0,0,0,0,0,1|2,0,1]=4 857 B18R3.3347 c1ccc2c(c1)CCC2NCc3cncs3 269862a_100016987365_100000212051 [0,0,0,0,0,1|2,0,1]=4 858 B18R3.3347 c1ccc2c(c1)CCC2NCc3cocn3 269862a_100015188801_100000212051 [0,0,0,0,0,1|2,0,0]=3 859 B18R3.3347 c1ccc2c(c1)CCC2NCc3cscn3 2230a_100015185402_200000721974 [0,0,0,0,0,1|2,0,0]=3 860 B18R3.3347 c1ccc2c(c1)CCC2NCc3cscn3 269862a_100015185402_100000212051 [0,0,0,0,0,1|2,0,0]=3 861 B18R3.3347 c1ccc2c(c1)CCC2NCc3ncco3 2230a_100016994969_200000721974 [0,0,0,0,0,1|3,0,0]=4 862 B18R3.3347 c1ccc2c(c1)CCC2NCc3nccs3 2230a_100000740555_200000721974 [0,0,0,0,0,1|3,0,0]=4 863 B18R3.3347 c1ccc2c(c1)CCC2NCc3nccs3 269862a_100000740555_100000212051 [0,0,0,0,0,1|3,0,0]=4 864 B18R3.3347 c1ccc2c(c1)CCC2OCc3c[nH]cn3 34a_100000212247_100000707719 [0,0,0,0,0,1|1,0,0]=2 865 B18R3.3347 c1ccc2c(c1)CCC2OCc3ccon3 34a_100000212247_100000234950 [0,0,0,0,0,1|3,0,0]=4 866 B18R3.3347 c1ccc2c(c1)CCC2OCc3ccon3 7a_100000212247_100000234950 [0,0,0,0,0,1|3,0,0]=4 867 B18R3.3347 c1ccc2c(c1)CCC2OCc3ccsc3 34a_100000212247_100011261437 [0,0,0,0,0,1|3,0,0]=4 868 B18R3.3347 c1ccc2c(c1)CCC2OCc3ccsc3 7a_100000212247_100011261437 [0,0,0,0,0,1|3,0,0]=4 869 B18R3.3347 c1ccc2c(c1)CCC2OCc3cncs3 34a_100000212247_100015185245 [0,0,0,0,0,1|2,0,1]=4 870 B18R3.3347 c1ccc2c(c1)CCC2OCc3cncs3 7a_100000212247_100015185245 [0,0,0,0,0,1|2,0,1]=4 871 B18R3.3347 c1ccc2c(c1)CCC2OCc3cscn3 34a_100000212247_100000205941 [0,0,0,0,0,1|2,0,0]=3 872 B18R3.3347 c1ccc2c(c1)CCC2OCc3cscn3 7a_100000212247_100000205941 [0,0,0,0,0,1|2,0,0]=3 873 B18R3.3347 c1ccc2c(c1)CCC2OCc3ncc[nH]3 34a_100000212247_100016991755 [0,0,0,0,0,1|3,0,0]=4 874 B18R3.3347 c1ccc2c(c1)CCC2OCc3ncc[nH]3 7a_100000212247_100000753453 [0,0,0,0,0,1|3,0,0]=4 875 B18R3.3347 c1ccc2c(c1)CCC2OCc3ncco3 34a_100000212247_103436540062 [0,0,0,0,0,1|3,0,0]=4 876 B18R3.3347 c1ccc2c(c1)CCC2OCc3ncco3 7a_100000212247_103436540062 [0,0,0,0,0,1|3,0,0]=4 877 B18R3.3347 c1ccc2c(c1)CCC2OCc3nccs3 34a_100000212247_100015184050 [0,0,0,0,0,1|3,0,0]=4 878 B18R3.3347 c1ccc2c(c1)CCC2OCc3nccs3 7a_100000212247_100015184050 [0,0,0,0,0,1|3,0,0]=4 879 B18R3.3347 c1ccc2c(c1)CCC2OCc3ncon3 34a_100000212247_100000233494 [0,0,0,0,0,1|3,0,0]=4 880 B18R3.3347 c1ccc2c(c1)CCC2OCn3cncn3 34a_100000212247_200020645497 [0,0,0,0,0,1|2,0,1]=4 881 B18R3.3347 c1ccc2c(c1)CCC2OCn3cncn3 7a_100000212247_200020645497 [0,0,0,0,0,1|2,0,1]=4 882 B18R3.3347 c1ccc2c(c1)CCC2SCc3c[nH]cn3 62a_100000707719_200000721974 [0,0,0,0,0,1|1,0,0]=2 883 B18R3.3347 c1ccc2c(c1)CCC2SCc3ccon3 62a_100000234950_200000721974 [0,0,0,0,0,1|3,0,0]=4 884 B18R3.3347 c1ccc2c(c1)CCC2SCc3ccsc3 62a_100011261437_200000721974 [0,0,0,0,0,1|3,0,0]=4 885 B18R3.3347 c1ccc2c(c1)CCC2SCc3cncs3 62a_100015185245_200000721974 [0,0,0,0,0,1|2,0,1]=4 886 B18R3.3347 c1ccc2c(c1)CCC2SCc3cscn3 62a_100000205941_200000721974 [0,0,0,0,0,1|2,0,0]=3 887 B18R3.3347 c1ccc2c(c1)CCC2SCc3ncc[nH]3 62a_100016991755_200000721974 [0,0,0,0,0,1|3,0,0]=4 888 B18R3.3347 c1ccc2c(c1)CCC2SCc3ncco3 62a_103436540062_200000721974 [0,0,0,0,0,1|3,0,0]=4 889 B18R3.3347 c1ccc2c(c1)CCC2SCc3nccs3 62a_100015184050_200000721974 [0,0,0,0,0,1|3,0,0]=4 890 B18R3.3347 c1ccc2c(c1)CCC2SCc3ncon3 62a_100000233494_200000721974 [0,0,0,0,0,1|3,0,0]=4 891 B18R3.3347 c1ccc2c(c1)CCC2SCn3cncn3 62a_200020645497_200000721974 [0,0,0,0,0,1|2,0,1]=4 892 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3c[nH]cn3 2230a_100016989578_100000707719 [0,0,0,0,0,1|1,0,0]=2 893 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3c[nH]cn3 34a_100016989578_100000707719 [0,0,0,0,0,1|1,0,0]=2 894 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cc[nH]n3 207a_100016989578_100000738523 [0,0,0,0,0,1|3,0,0]=4 895 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cc[nH]n3 270004a_100016989578_100000738523 [0,0,0,0,0,1|3,0,0]=4 896 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ccoc3 207a_100016989578_100011215517 [0,0,0,0,0,1|3,0,0]=4 897 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ccoc3 270004a_100016989578_100011215517 [0,0,0,0,0,1|3,0,0]=4 898 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ccon3 2230a_100016989578_100000234950 [0,0,0,0,0,1|3,0,0]=4 899 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ccon3 34a_100016989578_100000234950 [0,0,0,0,0,1|3,0,0]=4 900 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ccsc3 207a_100016989578_100000188534 [0,0,0,0,0,1|3,0,0]=4 901 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ccsc3 2230a_100016989578_100011261437 [0,0,0,0,0,1|3,0,0]=4 902 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ccsc3 270004a_100016989578_100000188534 [0,0,0,0,0,1|3,0,0]=4 903 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ccsc3 34a_100016989578_100011261437 [0,0,0,0,0,1|3,0,0]=4 904 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cn[nH]c3 207a_100016989578_100016992096 [0,0,0,0,0,1|3,0,0]=4 905 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cn[nH]c3 270004a_100016989578_100016992096 [0,0,0,0,0,1|3,0,0]=4 906 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cnc[nH]3 207a_100016989578_100000742939 [0,0,0,0,0,1|1,0,2]=4 907 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cnco3 270004a_100016989578_100000064291 [0,0,0,0,0,1|2,0,1]=4 908 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cncs3 207a_100016989578_100000749870 [0,0,0,0,0,1|2,0,1]=4 909 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cncs3 2230a_100016989578_100015185245 [0,0,0,0,0,1|2,0,1]=4 910 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cncs3 270004a_100016989578_100000749870 [0,0,0,0,0,1|2,0,1]=4 911 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cncs3 34a_100016989578_100015185245 [0,0,0,0,0,1|2,0,1]=4 912 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cocn3 270004a_100016989578_100000050382 [0,0,0,0,0,1|2,0,0]=3 913 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cscn3 207a_100016989578_100000743575 [0,0,0,0,0,1|2,0,0]=3 914 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cscn3 2230a_100016989578_100000205941 [0,0,0,0,0,1|2,0,0]=3 915 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cscn3 270004a_100016989578_100000743575 [0,0,0,0,0,1|2,0,0]=3 916 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3cscn3 34a_100016989578_100000205941 [0,0,0,0,0,1|2,0,0]=3 917 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3csnn3 270004a_100016989578_100000738508 [0,0,0,0,0,1|3,0,0]=4 918 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ncc[nH]3 207a_100016989578_100000743867 [0,0,0,0,0,1|3,0,0]=4 919 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ncc[nH]3 2230a_100016989578_100016991755 [0,0,0,0,0,1|3,0,0]=4 920 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ncc[nH]3 34a_100016989578_100016991755 [0,0,0,0,0,1|3,0,0]=4 921 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ncco3 2230a_100016989578_103436540062 [0,0,0,0,0,1|3,0,0]=4 922 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ncco3 270004a_100016989578_100000064290 [0,0,0,0,0,1|3,0,0]=4 923 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ncco3 34a_100016989578_103436540062 [0,0,0,0,0,1|3,0,0]=4 924 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3nccs3 207a_100016989578_100000750902 [0,0,0,0,0,1|3,0,0]=4 925 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3nccs3 2230a_100016989578_100015184050 [0,0,0,0,0,1|3,0,0]=4 926 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3nccs3 270004a_100016989578_100000750902 [0,0,0,0,0,1|3,0,0]=4 927 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3nccs3 34a_100016989578_100015184050 [0,0,0,0,0,1|3,0,0]=4 928 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCc3ncon3 34a_100016989578_100000233494 [0,0,0,0,0,1|3,0,0]=4 929 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCn3cncn3 2230a_100016989578_200020645497 [0,0,0,0,0,1|2,0,1]=4 930 B18R3.3347 c1ccc2c(c1)CC[C@@H]2NCn3cncn3 34a_100016989578_200020645497 [0,0,0,0,0,1|2,0,1]=4 931 B18R3.3347 c1ccc2c(c1)OCC2NCc3c[nH]cn3 2230a_100000747519_100000707719 [0,0,0,0,0,1|2,0,0]=3 932 B18R3.3347 c1ccc2c(c1)OCC2NCc3cocn3 270004a_100000747519_100000050382 [0,0,0,0,0,1|3,0,0]=4 933 B18R3.3347 c1ccc2c(c1)OCC2NCc3cscn3 207a_100000747519_100000743575 [0,0,0,0,0,1|3,0,0]=4 934 B18R3.3347 c1ccc2c(c1)OCC2NCc3cscn3 2230a_100000747519_100000205941 [0,0,0,0,0,1|3,0,0]=4 935 B18R3.3347 c1ccc2c(c1)OCC2NCc3cscn3 270004a_100000747519_100000743575 [0,0,0,0,0,1|3,0,0]=4 936 B18R3.3347 c1ccc2c(c1)nnn2CSc3c[nH]cn3 62a_100000756875_100000033166 [0,0,0,0,0,1|2,0,0]=3 937 B18R3.3347 c1ccc2c(c1)nnn2CSc3c[nH]nn3 62a_100009819707_100000033166 [0,0,0,0,0,1|3,0,0]=4 938 B18R3.3347 c1ccc2c(c1)nnn2CSc3cscn3 62a_100000751502_100000033166 [0,0,0,0,0,1|3,0,0]=4 939 B18R3.3347 c1ccc2c(c1)nnn2CSc3nc[nH]n3 62a_100000761765_100000033166 [0,0,0,0,0,1|3,0,0]=4 940 B18R3.3347 c1ccc2c(coc2c1)SCc3c[nH]cn3 62a_100000707719_100009812202 [0,0,0,0,0,1|2,0,1]=4 941 B18R3.3347 c1ccc2c(csc2c1)CSc3c[nH]cn3 62a_100000756875_200000742921 [0,0,0,0,0,1|2,0,1]=4 942 B18R3.3347 c1ccc2c(csc2c1)CSc3c[nH]cn3 62a_200000742921_100000756875 [0,0,0,0,0,1|2,0,1]=4 943 B18R3.3347 c1ccc2c(csc2c1)OCc3c[nH]cn3 34a_100000077758_100000707719 [0,0,0,0,0,1|2,0,1]=4 944 B18R3.3347 c1ccc2c(csc2c1)SCc3c[nH]cn3 62a_100000707719_100009813928 [0,0,0,0,0,1|2,0,1]=4 945 B18R3.3347 c1ccc2c(n[nH]c2c1)SCc3c[nH]cn3 62a_100000707719_100000050141 [0,0,0,0,0,1|3,0,0]=4 946 B18R3.3347 c1ccc2c(noc2c1)CSc3c[nH]cn3 62a_100000756875_100009813815 [0,0,0,0,0,1|3,0,0]=4 947 B18R3.3347 c1ccc2c(noc2c1)CSc3c[nH]cn3 62a_100009813815_100000756875 [0,0,0,0,0,1|3,0,0]=4 948 B18R3.3347 c1ccc2c(noc2c1)SCc3c[nH]cn3 62a_100000707719_200000703156 [0,0,0,0,0,1|3,0,0]=4 949 B18R3.3347 c1ccc2c(noc2c1)SCc3c[nH]cn3 62a_200000703156_100000707719 [0,0,0,0,0,1|3,0,0]=4 950 B18R3.3347 c1coc(c1)CNC2CCc3c2cccc3 2230a_100000185738_200000721974 [0,0,0,0,0,1|3,0,0]=4 951 B18R3.3347 c1coc(c1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100000186105 [0,0,0,0,0,1|3,0,0]=4 952 B18R3.3347 c1coc(c1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100000186105 [0,0,0,0,0,1|3,0,0]=4 953 B18R3.3347 c1csc(c1)CNC2CCc3c2cccc3 2230a_100000211653_200000721974 [0,0,0,0,0,1|3,0,0]=4 954 B18R3.3347 c1csc(c1)CNC2CCc3c2cccc3 269862a_100000211653_100000212051 [0,0,0,0,0,1|3,0,0]=4 955 B18R3.3347 c1csc(c1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100000209959 [0,0,0,0,0,1|3,0,0]=4 956 B18R3.3347 c1csc(c1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100000209959 [0,0,0,0,0,1|3,0,0]=4 957 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3c[nH]cn3 2230a_100020645890_100000707719 [0,0,0,0,0,1|1,0,0]=2 958 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3c[nH]cn3 269982a_100020645890_100000707719 [0,0,0,0,0,1|1,0,0]=2 959 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cc[nH]n3 270004a_100020645890_100000738523 [0,0,0,0,0,1|3,0,0]=4 960 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ccoc3 270004a_100020645890_100011215517 [0,0,0,0,0,1|3,0,0]=4 961 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ccon3 2230a_100020645890_100000234950 [0,0,0,0,0,1|3,0,0]=4 962 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ccon3 269982a_100020645890_100000234950 [0,0,0,0,0,1|3,0,0]=4 963 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ccsc3 2230a_100020645890_100011261437 [0,0,0,0,0,1|3,0,0]=4 964 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ccsc3 269982a_100020645890_100011233845 [0,0,0,0,0,1|3,0,0]=4 965 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ccsc3 270004a_100020645890_100000188534 [0,0,0,0,0,1|3,0,0]=4 966 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cn[nH]c3 270004a_100020645890_100016992096 [0,0,0,0,0,1|3,0,0]=4 967 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cnco3 270004a_100020645890_100000064291 [0,0,0,0,0,1|2,0,1]=4 968 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cncs3 2230a_100020645890_100015185245 [0,0,0,0,0,1|2,0,1]=4 969 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cncs3 269982a_100020645890_100015185245 [0,0,0,0,0,1|2,0,1]=4 970 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cncs3 270004a_100020645890_100000749870 [0,0,0,0,0,1|2,0,1]=4 971 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cocn3 270004a_100020645890_100000050382 [0,0,0,0,0,1|2,0,0]=3 972 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cscn3 2230a_100020645890_100000205941 [0,0,0,0,0,1|2,0,0]=3 973 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cscn3 269982a_100020645890_100000205941 [0,0,0,0,0,1|2,0,0]=3 974 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3cscn3 270004a_100020645890_100000743575 [0,0,0,0,0,1|2,0,0]=3 975 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3csnn3 270004a_100020645890_100000738508 [0,0,0,0,0,1|3,0,0]=4 976 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ncc[nH]3 2230a_100020645890_100016991755 [0,0,0,0,0,1|3,0,0]=4 977 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ncc[nH]3 269982a_100020645890_100016991755 [0,0,0,0,0,1|3,0,0]=4 978 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ncco3 2230a_100020645890_103436540062 [0,0,0,0,0,1|3,0,0]=4 979 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ncco3 269982a_100020645890_103436540062 [0,0,0,0,0,1|3,0,0]=4 980 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ncco3 270004a_100020645890_100000064290 [0,0,0,0,0,1|3,0,0]=4 981 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3nccs3 2230a_100020645890_100015184050 [0,0,0,0,0,1|3,0,0]=4 982 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3nccs3 269982a_100020645890_100015184050 [0,0,0,0,0,1|3,0,0]=4 983 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3nccs3 270004a_100020645890_100000750902 [0,0,0,0,0,1|3,0,0]=4 984 B18R3.36580 c1cc2c(cn1)CCN(C2)Cc3ncon3 269982a_100020645890_100000233494 [0,0,0,0,0,1|3,0,0]=4 985 B18R3.36580 c1cc2c(cn1)CCN(C2)Cn3cncn3 2230a_100020645890_200020645497 [0,0,0,0,0,1|2,0,1]=4 986 B18R3.36580 c1cc2c(cn1)CCN(C2)Cn3cncn3 269982a_100020645890_200020645497 [0,0,0,0,0,1|2,0,1]=4 987 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3c[nH]cn3 2230a_100015190008_100000707719 [0,0,0,0,0,1|1,0,0]=2 988 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3c[nH]cn3 269982a_100015190008_100000707719 [0,0,0,0,0,1|1,0,0]=2 989 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cc[nH]n3 270004a_100015190008_100000738523 [0,0,0,0,0,1|3,0,0]=4 990 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ccoc3 270004a_100015190008_100011215517 [0,0,0,0,0,1|3,0,0]=4 991 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ccon3 2230a_100015190008_100000234950 [0,0,0,0,0,1|3,0,0]=4 992 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ccon3 269982a_100015190008_100000234950 [0,0,0,0,0,1|3,0,0]=4 993 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ccsc3 2230a_100015190008_100011261437 [0,0,0,0,0,1|3,0,0]=4 994 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ccsc3 269982a_100015190008_100011233845 [0,0,0,0,0,1|3,0,0]=4 995 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ccsc3 270004a_100015190008_100000188534 [0,0,0,0,0,1|3,0,0]=4 996 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cn[nH]c3 270004a_100015190008_100016992096 [0,0,0,0,0,1|3,0,0]=4 997 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cnco3 270004a_100015190008_100000064291 [0,0,0,0,0,1|2,0,1]=4 998 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cncs3 2230a_100015190008_100015185245 [0,0,0,0,0,1|2,0,1]=4 999 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cncs3 269982a_100015190008_100015185245 [0,0,0,0,0,1|2,0,1]=4 1000 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cncs3 270004a_100015190008_100000749870 [0,0,0,0,0,1|2,0,1]=4 1001 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cocn3 270004a_100015190008_100000050382 [0,0,0,0,0,1|2,0,0]=3 1002 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cscn3 2230a_100015190008_100000205941 [0,0,0,0,0,1|2,0,0]=3 1003 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cscn3 269982a_100015190008_100000205941 [0,0,0,0,0,1|2,0,0]=3 1004 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3cscn3 270004a_100015190008_100000743575 [0,0,0,0,0,1|2,0,0]=3 1005 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3csnn3 270004a_100015190008_100000738508 [0,0,0,0,0,1|3,0,0]=4 1006 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ncc[nH]3 2230a_100015190008_100016991755 [0,0,0,0,0,1|3,0,0]=4 1007 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ncc[nH]3 269982a_100015190008_100016991755 [0,0,0,0,0,1|3,0,0]=4 1008 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ncco3 2230a_100015190008_103436540062 [0,0,0,0,0,1|3,0,0]=4 1009 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ncco3 269982a_100015190008_103436540062 [0,0,0,0,0,1|3,0,0]=4 1010 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ncco3 270004a_100015190008_100000064290 [0,0,0,0,0,1|3,0,0]=4 1011 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3nccs3 2230a_100015190008_100015184050 [0,0,0,0,0,1|3,0,0]=4 1012 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3nccs3 269982a_100015190008_100015184050 [0,0,0,0,0,1|3,0,0]=4 1013 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3nccs3 270004a_100015190008_100000750902 [0,0,0,0,0,1|3,0,0]=4 1014 B18R3.36580 c1cc2c(cn1)CN(CC2)Cc3ncon3 269982a_100015190008_100000233494 [0,0,0,0,0,1|3,0,0]=4 1015 B18R3.36580 c1cc2c(cn1)CN(CC2)Cn3cncn3 2230a_100015190008_200020645497 [0,0,0,0,0,1|2,0,1]=4 1016 B18R3.36580 c1cc2c(cn1)CN(CC2)Cn3cncn3 269982a_100015190008_200020645497 [0,0,0,0,0,1|2,0,1]=4 1017 B18R3.36580 c1ccc2c(c1)CCN(C2)CC3=NCCN3 269982a_100000188457_100000737910 [0,0,0,0,0,1|2,0,1]=4 1018 B18R3.36580 c1ccc2c(c1)CCN(C2)CC3=NCCN3 34a_100000188457_100000737910 [0,0,0,0,0,1|2,0,1]=4 1019 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 2230a_100000188457_100000707719 [0,0,0,0,0,1|0,0,0]=1 1020 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 269982a_100000188457_100000707719 [0,0,0,0,0,1|0,0,0]=1 1021 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 34a_100000188457_100000707719 [0,0,0,0,0,1|0,0,0]=1 1022 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cc[nH]n3 270004a_100000188457_100000738523 [0,0,0,0,0,1|2,0,0]=3 1023 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccn[nH]3 2230a_100000188457_100000728653 [0,0,0,0,0,1|2,0,1]=4 1024 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccn[nH]3 269982a_100000188457_100000728653 [0,0,0,0,0,1|2,0,1]=4 1025 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccn[nH]3 34a_100000188457_100000728653 [0,0,0,0,0,1|2,0,1]=4 1026 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccoc3 270004a_100000188457_100011215517 [0,0,0,0,0,1|2,0,0]=3 1027 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccon3 2230a_100000188457_100000234950 [0,0,0,0,0,1|2,0,0]=3 1028 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccon3 269982a_100000188457_100000234950 [0,0,0,0,0,1|2,0,0]=3 1029 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccon3 34a_100000188457_100000234950 [0,0,0,0,0,1|2,0,0]=3 1030 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccsc3 2230a_100000188457_100011261437 [0,0,0,0,0,1|2,0,0]=3 1031 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccsc3 269982a_100000188457_100011233845 [0,0,0,0,0,1|2,0,0]=3 1032 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccsc3 270004a_100000188457_100000188534 [0,0,0,0,0,1|2,0,0]=3 1033 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ccsc3 34a_100000188457_100011261437 [0,0,0,0,0,1|2,0,0]=3 1034 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cn[nH]c3 270004a_100000188457_100016992096 [0,0,0,0,0,1|2,0,0]=3 1035 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cnco3 270004a_100000188457_100000064291 [0,0,0,0,0,1|1,0,1]=3 1036 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cncs3 2230a_100000188457_100015185245 [0,0,0,0,0,1|1,0,1]=3 1037 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cncs3 269982a_100000188457_100015185245 [0,0,0,0,0,1|1,0,1]=3 1038 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cncs3 270004a_100000188457_100000749870 [0,0,0,0,0,1|1,0,1]=3 1039 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cncs3 34a_100000188457_100015185245 [0,0,0,0,0,1|1,0,1]=3 1040 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cocn3 270004a_100000188457_100000050382 [0,0,0,0,0,1|1,0,0]=2 1041 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cscn3 2230a_100000188457_100000205941 [0,0,0,0,0,1|1,0,0]=2 1042 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cscn3 269982a_100000188457_100000205941 [0,0,0,0,0,1|1,0,0]=2 1043 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cscn3 270004a_100000188457_100000743575 [0,0,0,0,0,1|1,0,0]=2 1044 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3cscn3 34a_100000188457_100000205941 [0,0,0,0,0,1|1,0,0]=2 1045 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3csnn3 270004a_100000188457_100000738508 [0,0,0,0,0,1|2,0,0]=3 1046 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 2230a_100000188457_100016991755 [0,0,0,0,0,1|2,0,0]=3 1047 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 269982a_100000188457_100016991755 [0,0,0,0,0,1|2,0,0]=3 1048 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 34a_100000188457_100016991755 [0,0,0,0,0,1|2,0,0]=3 1049 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncco3 2230a_100000188457_103436540062 [0,0,0,0,0,1|2,0,0]=3 1050 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncco3 269982a_100000188457_103436540062 [0,0,0,0,0,1|2,0,0]=3 1051 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncco3 270004a_100000188457_100000064290 [0,0,0,0,0,1|2,0,0]=3 1052 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncco3 34a_100000188457_103436540062 [0,0,0,0,0,1|2,0,0]=3 1053 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3nccs3 2230a_100000188457_100015184050 [0,0,0,0,0,1|2,0,0]=3 1054 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3nccs3 269982a_100000188457_100015184050 [0,0,0,0,0,1|2,0,0]=3 1055 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3nccs3 270004a_100000188457_100000750902 [0,0,0,0,0,1|2,0,0]=3 1056 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3nccs3 34a_100000188457_100015184050 [0,0,0,0,0,1|2,0,0]=3 1057 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncon3 269982a_100000188457_100000233494 [0,0,0,0,0,1|2,0,0]=3 1058 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3ncon3 34a_100000188457_100000233494 [0,0,0,0,0,1|2,0,0]=3 1059 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3nnn[nH]3 269982a_100000188457_100000765167 [0,0,0,0,0,1|2,0,1]=4 1060 B18R3.36580 c1ccc2c(c1)CCN(C2)Cc3nnn[nH]3 34a_100000188457_100000765167 [0,0,0,0,0,1|2,0,1]=4 1061 B18R3.36580 c1ccc2c(c1)CCN(C2)Cn3cncn3 2230a_100000188457_200020645497 [0,0,0,0,0,1|1,0,1]=3 1062 B18R3.36580 c1ccc2c(c1)CCN(C2)Cn3cncn3 269982a_100000188457_200020645497 [0,0,0,0,0,1|1,0,1]=3 1063 B18R3.36580 c1ccc2c(c1)CCN(C2)Cn3cncn3 34a_100000188457_200020645497 [0,0,0,0,0,1|1,0,1]=3 1064 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3c[nH]cn3 2230a_100015206102_100000707719 [0,0,0,0,0,1|1,0,0]=2 1065 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3c[nH]cn3 269982a_100015206102_100000707719 [0,0,0,0,0,1|1,0,0]=2 1066 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cc[nH]n3 270004a_100015206102_100000738523 [0,0,0,0,0,1|3,0,0]=4 1067 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ccoc3 270004a_100015206102_100011215517 [0,0,0,0,0,1|3,0,0]=4 1068 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ccon3 2230a_100015206102_100000234950 [0,0,0,0,0,1|3,0,0]=4 1069 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ccon3 269982a_100015206102_100000234950 [0,0,0,0,0,1|3,0,0]=4 1070 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ccsc3 2230a_100015206102_100011261437 [0,0,0,0,0,1|3,0,0]=4 1071 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ccsc3 269982a_100015206102_100011233845 [0,0,0,0,0,1|3,0,0]=4 1072 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ccsc3 270004a_100015206102_100000188534 [0,0,0,0,0,1|3,0,0]=4 1073 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cn[nH]c3 270004a_100015206102_100016992096 [0,0,0,0,0,1|3,0,0]=4 1074 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cnco3 270004a_100015206102_100000064291 [0,0,0,0,0,1|2,0,1]=4 1075 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cncs3 2230a_100015206102_100015185245 [0,0,0,0,0,1|2,0,1]=4 1076 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cncs3 269982a_100015206102_100015185245 [0,0,0,0,0,1|2,0,1]=4 1077 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cncs3 270004a_100015206102_100000749870 [0,0,0,0,0,1|2,0,1]=4 1078 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cocn3 270004a_100015206102_100000050382 [0,0,0,0,0,1|2,0,0]=3 1079 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cscn3 2230a_100015206102_100000205941 [0,0,0,0,0,1|2,0,0]=3 1080 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cscn3 269982a_100015206102_100000205941 [0,0,0,0,0,1|2,0,0]=3 1081 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3cscn3 270004a_100015206102_100000743575 [0,0,0,0,0,1|2,0,0]=3 1082 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3csnn3 270004a_100015206102_100000738508 [0,0,0,0,0,1|3,0,0]=4 1083 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ncc[nH]3 2230a_100015206102_100016991755 [0,0,0,0,0,1|3,0,0]=4 1084 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ncc[nH]3 269982a_100015206102_100016991755 [0,0,0,0,0,1|3,0,0]=4 1085 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ncco3 2230a_100015206102_103436540062 [0,0,0,0,0,1|3,0,0]=4 1086 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ncco3 269982a_100015206102_103436540062 [0,0,0,0,0,1|3,0,0]=4 1087 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ncco3 270004a_100015206102_100000064290 [0,0,0,0,0,1|3,0,0]=4 1088 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3nccs3 2230a_100015206102_100015184050 [0,0,0,0,0,1|3,0,0]=4 1089 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3nccs3 269982a_100015206102_100015184050 [0,0,0,0,0,1|3,0,0]=4 1090 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3nccs3 270004a_100015206102_100000750902 [0,0,0,0,0,1|3,0,0]=4 1091 B18R3.36580 c1cnc2c(c1)CCN(C2)Cc3ncon3 269982a_100015206102_100000233494 [0,0,0,0,0,1|3,0,0]=4 1092 B18R3.36580 c1cnc2c(c1)CCN(C2)Cn3cncn3 2230a_100015206102_200020645497 [0,0,0,0,0,1|2,0,1]=4 1093 B18R3.36580 c1cnc2c(c1)CCN(C2)Cn3cncn3 269982a_100015206102_200020645497 [0,0,0,0,0,1|2,0,1]=4 1094 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3c[nH]cn3 2230a_100000699647_100000707719 [0,0,0,0,0,1|1,0,0]=2 1095 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3c[nH]cn3 269982a_100000699647_100000707719 [0,0,0,0,0,1|1,0,0]=2 1096 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cc[nH]n3 270004a_100000699647_100000738523 [0,0,0,0,0,1|3,0,0]=4 1097 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ccoc3 270004a_100000699647_100011215517 [0,0,0,0,0,1|3,0,0]=4 1098 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ccon3 2230a_100000699647_100000234950 [0,0,0,0,0,1|3,0,0]=4 1099 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ccon3 269982a_100000699647_100000234950 [0,0,0,0,0,1|3,0,0]=4 1100 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ccsc3 2230a_100000699647_100011261437 [0,0,0,0,0,1|3,0,0]=4 1101 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ccsc3 269982a_100000699647_100011233845 [0,0,0,0,0,1|3,0,0]=4 1102 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ccsc3 270004a_100000699647_100000188534 [0,0,0,0,0,1|3,0,0]=4 1103 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cn[nH]c3 270004a_100000699647_100016992096 [0,0,0,0,0,1|3,0,0]=4 1104 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cnco3 270004a_100000699647_100000064291 [0,0,0,0,0,1|2,0,1]=4 1105 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cncs3 2230a_100000699647_100015185245 [0,0,0,0,0,1|2,0,1]=4 1106 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cncs3 269982a_100000699647_100015185245 [0,0,0,0,0,1|2,0,1]=4 1107 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cncs3 270004a_100000699647_100000749870 [0,0,0,0,0,1|2,0,1]=4 1108 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cocn3 270004a_100000699647_100000050382 [0,0,0,0,0,1|2,0,0]=3 1109 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cscn3 2230a_100000699647_100000205941 [0,0,0,0,0,1|2,0,0]=3 1110 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cscn3 269982a_100000699647_100000205941 [0,0,0,0,0,1|2,0,0]=3 1111 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3cscn3 270004a_100000699647_100000743575 [0,0,0,0,0,1|2,0,0]=3 1112 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3csnn3 270004a_100000699647_100000738508 [0,0,0,0,0,1|3,0,0]=4 1113 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ncc[nH]3 2230a_100000699647_100016991755 [0,0,0,0,0,1|3,0,0]=4 1114 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ncc[nH]3 269982a_100000699647_100016991755 [0,0,0,0,0,1|3,0,0]=4 1115 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ncco3 2230a_100000699647_103436540062 [0,0,0,0,0,1|3,0,0]=4 1116 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ncco3 269982a_100000699647_103436540062 [0,0,0,0,0,1|3,0,0]=4 1117 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ncco3 270004a_100000699647_100000064290 [0,0,0,0,0,1|3,0,0]=4 1118 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3nccs3 2230a_100000699647_100015184050 [0,0,0,0,0,1|3,0,0]=4 1119 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3nccs3 269982a_100000699647_100015184050 [0,0,0,0,0,1|3,0,0]=4 1120 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3nccs3 270004a_100000699647_100000750902 [0,0,0,0,0,1|3,0,0]=4 1121 B18R3.36580 c1cnc2c(c1)CN(CC2)Cc3ncon3 269982a_100000699647_100000233494 [0,0,0,0,0,1|3,0,0]=4 1122 B18R3.36580 c1cnc2c(c1)CN(CC2)Cn3cncn3 2230a_100000699647_200020645497 [0,0,0,0,0,1|2,0,1]=4 1123 B18R3.36580 c1cnc2c(c1)CN(CC2)Cn3cncn3 269982a_100000699647_200020645497 [0,0,0,0,0,1|2,0,1]=4 1124 B18R3.36580 c1coc(c1)CN2CCc3ccccc3C2 270004a_100000188457_100000186105 [0,0,0,0,0,1|2,0,0]=3 1125 B18R3.36580 c1coc(c1)CN2CCc3cccnc3C2 270004a_100015206102_100000186105 [0,0,0,0,0,1|3,0,0]=4 1126 B18R3.36580 c1coc(c1)CN2CCc3ccncc3C2 270004a_100015190008_100000186105 [0,0,0,0,0,1|3,0,0]=4 1127 B18R3.36580 c1coc(c1)CN2CCc3cnccc3C2 270004a_100020645890_100000186105 [0,0,0,0,0,1|3,0,0]=4 1128 B18R3.36580 c1coc(c1)CN2CCc3ncccc3C2 270004a_100000699647_100000186105 [0,0,0,0,0,1|3,0,0]=4 1129 B18R3.36580 c1csc(c1)CN2CCc3ccccc3C2 270004a_100000188457_100000209959 [0,0,0,0,0,1|2,0,0]=3 1130 B18R3.36580 c1csc(c1)CN2CCc3cccnc3C2 270004a_100015206102_100000209959 [0,0,0,0,0,1|3,0,0]=4 1131 B18R3.36580 c1csc(c1)CN2CCc3ccncc3C2 270004a_100015190008_100000209959 [0,0,0,0,0,1|3,0,0]=4 1132 B18R3.36580 c1csc(c1)CN2CCc3cnccc3C2 270004a_100020645890_100000209959 [0,0,0,0,0,1|3,0,0]=4 1133 B18R3.36580 c1csc(c1)CN2CCc3ncccc3C2 270004a_100000699647_100000209959 [0,0,0,0,0,1|3,0,0]=4 1134 B18R3.36580 c1ncc2c(n1)CCN(C2)Cc3c[nH]cn3 2230a_100012000121_100000707719 [0,0,0,0,0,1|2,0,0]=3 1135 B18R3.36580 c1ncc2c(n1)CCN(C2)Cc3c[nH]cn3 269982a_100012000121_100000707719 [0,0,0,0,0,1|2,0,0]=3 1136 B18R3.36580 c1ncc2c(n1)CCN(C2)Cc3cocn3 270004a_100012000121_100000050382 [0,0,0,0,0,1|3,0,0]=4 1137 B18R3.36580 c1ncc2c(n1)CCN(C2)Cc3cscn3 2230a_100012000121_100000205941 [0,0,0,0,0,1|3,0,0]=4 1138 B18R3.36580 c1ncc2c(n1)CCN(C2)Cc3cscn3 269982a_100012000121_100000205941 [0,0,0,0,0,1|3,0,0]=4 1139 B18R3.36580 c1ncc2c(n1)CCN(C2)Cc3cscn3 270004a_100012000121_100000743575 [0,0,0,0,0,1|3,0,0]=4 1140 B15R2.4 CNC(=O)CN1CCc2c1cccc2 527a_100102657272_100000742689 [1,0,1,0,0,0|1,0,1]=4 1141 B15R2.1259 CC(Cc1c[nH]cn1)c2ccccc2 271570a_100000062452_100000756875 [1,0,1,0,0,0|1,0,0]=3 1142 B15R2.1259 CC(Cc1cscn1)c2ccccc2 271570a_100000062452_100000751502 [1,0,1,0,0,0|2,0,0]=4 1143 B15R2.1259 CC(Cc1nc[nH]n1)c2ccccc2 271570a_100000062452_100000761765 [1,0,1,0,0,0|2,0,0]=4 1144 B15R2.1259 CC(Sc1c[nH]cn1)c2ccccc2 62a_100000230085_100000756875 [1,0,1,0,0,0|2,0,0]=4 1145 B15R2.1259 CC(Sc1c[nH]cn1)c2ccccc2 62a_100000756875_100000230085 [1,0,1,0,0,0|2,0,0]=4 1146 B15R2.1259 CN(Cc1c[nH]cn1)c2ccccc2 2230a_100000210012_100000707719 [1,0,1,0,0,0|0,0,0]=2 1147 B15R2.1259 CN(Cc1c[nH]cn1)c2ccccc2 269982a_100000210012_100000707719 [1,0,1,0,0,0|0,0,0]=2 1148 B15R2.1259 CN(Cc1c[nH]cn1)c2ccccc2 34a_100000210012_100000707719 [1,0,1,0,0,0|0,0,0]=2 1149 B15R2.1259 CN(Cc1ccco1)c2ccccc2 2230a_100000230375_200000210301 [1,0,1,0,0,0|2,0,0]=4 1150 B15R2.1259 CN(Cc1ccco1)c2ccccc2 269982a_100000230375_200000210301 [1,0,1,0,0,0|2,0,0]=4 1151 B15R2.1259 CN(Cc1ccco1)c2ccccc2 34a_100000230375_200000210301 [1,0,1,0,0,0|2,0,0]=4 1152 B15R2.1259 CN(Cc1ccon1)c2ccccc2 2230a_100000210012_100000234950 [1,0,1,0,0,0|2,0,0]=4 1153 B15R2.1259 CN(Cc1ccon1)c2ccccc2 269982a_100000210012_100000234950 [1,0,1,0,0,0|2,0,0]=4 1154 B15R2.1259 CN(Cc1ccon1)c2ccccc2 34a_100000210012_100000234950 [1,0,1,0,0,0|2,0,0]=4 1155 B15R2.1259 CN(Cc1ccsc1)c2ccccc2 2230a_100000210012_100011261437 [1,0,1,0,0,0|2,0,0]=4 1156 B15R2.1259 CN(Cc1ccsc1)c2ccccc2 269982a_100000210012_100011233845 [1,0,1,0,0,0|2,0,0]=4 1157 B15R2.1259 CN(Cc1ccsc1)c2ccccc2 34a_100000210012_100011261437 [1,0,1,0,0,0|2,0,0]=4 1158 B15R2.1259 CN(Cc1cncs1)c2ccccc2 2230a_100000210012_100015185245 [1,0,1,0,0,0|1,0,1]=4 1159 B15R2.1259 CN(Cc1cncs1)c2ccccc2 269982a_100000210012_100015185245 [1,0,1,0,0,0|1,0,1]=4 1160 B15R2.1259 CN(Cc1cncs1)c2ccccc2 34a_100000210012_100015185245 [1,0,1,0,0,0|1,0,1]=4 1161 B15R2.1259 CN(Cc1cscn1)c2ccccc2 2230a_100000210012_100000205941 [1,0,1,0,0,0|1,0,0]=3 1162 B15R2.1259 CN(Cc1cscn1)c2ccccc2 269982a_100000210012_100000205941 [1,0,1,0,0,0|1,0,0]=3 1163 B15R2.1259 CN(Cc1cscn1)c2ccccc2 34a_100000210012_100000205941 [1,0,1,0,0,0|1,0,0]=3 1164 B15R2.1259 CN(Cc1ncc[nH]1)c2ccccc2 2230a_100000210012_100016991755 [1,0,1,0,0,0|2,0,0]=4 1165 B15R2.1259 CN(Cc1ncc[nH]1)c2ccccc2 269982a_100000210012_100016991755 [1,0,1,0,0,0|2,0,0]=4 1166 B15R2.1259 CN(Cc1ncc[nH]1)c2ccccc2 34a_100000210012_100016991755 [1,0,1,0,0,0|2,0,0]=4 1167 B15R2.1259 CN(Cc1ncco1)c2ccccc2 2230a_100000210012_103436540062 [1,0,1,0,0,0|2,0,0]=4 1168 B15R2.1259 CN(Cc1ncco1)c2ccccc2 269982a_100000210012_103436540062 [1,0,1,0,0,0|2,0,0]=4 1169 B15R2.1259 CN(Cc1ncco1)c2ccccc2 34a_100000210012_103436540062 [1,0,1,0,0,0|2,0,0]=4 1170 B15R2.1259 CN(Cc1nccs1)c2ccccc2 2230a_100000210012_100015184050 [1,0,1,0,0,0|2,0,0]=4 1171 B15R2.1259 CN(Cc1nccs1)c2ccccc2 269982a_100000210012_100015184050 [1,0,1,0,0,0|2,0,0]=4 1172 B15R2.1259 CN(Cc1nccs1)c2ccccc2 34a_100000210012_100015184050 [1,0,1,0,0,0|2,0,0]=4 1173 B15R2.1259 CN(Cc1ncon1)c2ccccc2 269982a_100000210012_100000233494 [1,0,1,0,0,0|2,0,0]=4 1174 B15R2.1259 CN(Cc1ncon1)c2ccccc2 34a_100000210012_100000233494 [1,0,1,0,0,0|2,0,0]=4 1175 B15R2.1259 CN(Cn1cncn1)c2ccccc2 2230a_100000210012_200020645497 [1,0,1,0,0,0|1,0,1]=4 1176 B15R2.1259 CN(Cn1cncn1)c2ccccc2 269982a_100000210012_200020645497 [1,0,1,0,0,0|1,0,1]=4 1177 B15R2.1259 CN(Cn1cncn1)c2ccccc2 34a_100000210012_200020645497 [1,0,1,0,0,0|1,0,1]=4 1178 B15R2.1259 O=C(Cc1c[nH]cn1)c2ccccc2 1458a_100000185807_100000707719 [1,0,1,0,0,0|2,0,0]=4 1179 B15R2.1259 [13CH3]N(Cc1ccco1)c2ccccc2 2230a_100000230375_200025704644 [1,0,1,0,0,0|2,0,0]=4 1180 B15R2.1259 [13CH3]N(Cc1ccco1)c2ccccc2 269982a_100000230375_200025704644 [1,0,1,0,0,0|2,0,0]=4 1181 B15R2.1259 [13CH3]N(Cc1ccco1)c2ccccc2 34a_100000230375_200025704644 [1,0,1,0,0,0|2,0,0]=4 1182 B15R2.562 Brc1ccccc1NCc2c[nH]cn2 34a_100000210017_100000707719 [1,0,1,0,0,0|1,0,0]=3 1183 B15R2.562 Brc1ccccc1NCc2cscn2 207a_100000210017_100000743575 [1,0,1,0,0,0|2,0,0]=4 1184 B15R2.562 Brc1ccccc1NCc2cscn2 34a_100000210017_100000205941 [1,0,1,0,0,0|2,0,0]=4 1185 B15R2.562 Brc1ccccc1OCc2c[nH]cn2 34a_100000181306_100000707719 [1,0,1,0,0,0|2,0,0]=4 1186 B15R2.562 Brc1ccccc1SCc2c[nH]cn2 62a_100000695589_100000707719 [1,0,1,0,0,0|2,0,0]=4 1187 B15R2.562 Brc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000695589 [1,0,1,0,0,0|2,0,0]=4 1188 B15R2.562 Brc1cccnc1NCc2c[nH]cn2 27a_100000758547_100000696092 [1,0,1,0,0,0|2,0,0]=4 1189 B15R2.562 Brc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000726257 [1,0,1,0,0,0|2,0,0]=4 1190 B15R2.562 C[n+]1ccccc1SCc2c[nH]cn2 62a_100000707719_100000212160 [1,0,1,0,0,0|2,0,0]=4 1191 B15R2.562 Cc1ccccc1CSc2c[nH]cn2 62a_100000211839_100000756875 [1,0,1,0,0,0|2,0,0]=4 1192 B15R2.562 Cc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000211839 [1,0,1,0,0,0|2,0,0]=4 1193 B15R2.562 Cc1ccccc1NCc2c[nH]cn2 34a_100015192222_100000707719 [1,0,1,0,0,0|0,0,0]=2 1194 B15R2.562 Cc1ccccc1NCc2cc[nH]n2 207a_100015192222_100000738523 [1,0,1,0,0,0|2,0,0]=4 1195 B15R2.562 Cc1ccccc1NCc2ccco2 207a_100015192222_100000186105 [1,0,1,0,0,0|2,0,0]=4 1196 B15R2.562 Cc1ccccc1NCc2ccco2 270302a_100015192222_100000186105 [1,0,1,0,0,0|2,0,0]=4 1197 B15R2.562 Cc1ccccc1NCc2cccs2 207a_100015192222_100000209959 [1,0,1,0,0,0|2,0,0]=4 1198 B15R2.562 Cc1ccccc1NCc2cccs2 270302a_100015192222_100000209959 [1,0,1,0,0,0|2,0,0]=4 1199 B15R2.562 Cc1ccccc1NCc2ccoc2 207a_100015192222_100011215517 [1,0,1,0,0,0|2,0,0]=4 1200 B15R2.562 Cc1ccccc1NCc2ccon2 34a_100015192222_100000234950 [1,0,1,0,0,0|2,0,0]=4 1201 B15R2.562 Cc1ccccc1NCc2ccsc2 207a_100015192222_100000188534 [1,0,1,0,0,0|2,0,0]=4 1202 B15R2.562 Cc1ccccc1NCc2ccsc2 270302a_100015192222_100000188534 [1,0,1,0,0,0|2,0,0]=4 1203 B15R2.562 Cc1ccccc1NCc2ccsc2 34a_100015192222_100011261437 [1,0,1,0,0,0|2,0,0]=4 1204 B15R2.562 Cc1ccccc1NCc2cn[nH]c2 207a_100015192222_100016992096 [1,0,1,0,0,0|2,0,0]=4 1205 B15R2.562 Cc1ccccc1NCc2cn[nH]c2 270302a_100015192222_100016992096 [1,0,1,0,0,0|2,0,0]=4 1206 B15R2.562 Cc1ccccc1NCc2cnc[nH]2 207a_100015192222_100000742939 [1,0,1,0,0,0|0,0,2]=4 1207 B15R2.562 Cc1ccccc1NCc2cncs2 207a_100015192222_100000749870 [1,0,1,0,0,0|1,0,1]=4 1208 B15R2.562 Cc1ccccc1NCc2cncs2 270302a_100015192222_100000749870 [1,0,1,0,0,0|1,0,1]=4 1209 B15R2.562 Cc1ccccc1NCc2cncs2 34a_100015192222_100015185245 [1,0,1,0,0,0|1,0,1]=4 1210 B15R2.562 Cc1ccccc1NCc2cscn2 207a_100015192222_100000743575 [1,0,1,0,0,0|1,0,0]=3 1211 B15R2.562 Cc1ccccc1NCc2cscn2 270302a_100015192222_100000743575 [1,0,1,0,0,0|1,0,0]=3 1212 B15R2.562 Cc1ccccc1NCc2cscn2 34a_100015192222_100000205941 [1,0,1,0,0,0|1,0,0]=3 1213 B15R2.562 Cc1ccccc1NCc2ncc[nH]2 207a_100015192222_100000743867 [1,0,1,0,0,0|2,0,0]=4 1214 B15R2.562 Cc1ccccc1NCc2ncc[nH]2 34a_100015192222_100016991755 [1,0,1,0,0,0|2,0,0]=4 1215 B15R2.562 Cc1ccccc1NCc2ncco2 34a_100015192222_103436540062 [1,0,1,0,0,0|2,0,0]=4 1216 B15R2.562 Cc1ccccc1NCc2nccs2 207a_100015192222_100000750902 [1,0,1,0,0,0|2,0,0]=4 1217 B15R2.562 Cc1ccccc1NCc2nccs2 270302a_100015192222_100000750902 [1,0,1,0,0,0|2,0,0]=4 1218 B15R2.562 Cc1ccccc1NCc2nccs2 34a_100015192222_100015184050 [1,0,1,0,0,0|2,0,0]=4 1219 B15R2.562 Cc1ccccc1NCc2ncon2 34a_100015192222_100000233494 [1,0,1,0,0,0|2,0,0]=4 1220 B15R2.562 Cc1ccccc1NCn2cncn2 34a_100015192222_200020645497 [1,0,1,0,0,0|1,0,1]=4 1221 B15R2.562 Cc1ccccc1OCc2c[nH]cn2 34a_100000210338_100000707719 [1,0,1,0,0,0|1,0,0]=3 1222 B15R2.562 Cc1ccccc1OCc2cscn2 34a_100000210338_100000205941 [1,0,1,0,0,0|2,0,0]=4 1223 B15R2.562 Cc1ccccc1OCc2cscn2 7a_100000210338_100000205941 [1,0,1,0,0,0|2,0,0]=4 1224 B15R2.562 Cc1ccccc1SCc2c[nH]cn2 62a_100000210755_100000707719 [1,0,1,0,0,0|1,0,0]=3 1225 B15R2.562 Cc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000210755 [1,0,1,0,0,0|1,0,0]=3 1226 B15R2.562 Cc1ccccc1SCc2cscn2 62a_100000205941_100000210755 [1,0,1,0,0,0|2,0,0]=4 1227 B15R2.562 Cc1ccccc1SCc2cscn2 62a_100000210755_100000205941 [1,0,1,0,0,0|2,0,0]=4 1228 B15R2.562 Cc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000751373 [1,0,1,0,0,0|2,0,0]=4 1229 B15R2.562 Cc1cccnc1SCc2c[nH]cn2 62a_100000751373_100000707719 [1,0,1,0,0,0|2,0,0]=4 1230 B15R2.562 Cc1ccncc1OCc2c[nH]cn2 34a_100011997053_100000707719 [1,0,1,0,0,0|2,0,0]=4 1231 B15R2.562 Cc1ccncc1SCc2c[nH]cn2 62a_100000707719_100000761580 [1,0,1,0,0,0|2,0,0]=4 1232 B15R2.562 Cc1ccncc1SCc2c[nH]cn2 62a_100000761580_100000707719 [1,0,1,0,0,0|2,0,0]=4 1233 B15R2.562 Cc1ccnnc1NCc2c[nH]cn2 27a_100000758547_100000089043 [1,0,1,0,0,0|2,0,0]=4 1234 B15R2.562 Cc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000765111 [1,0,1,0,0,0|1,0,0]=3 1235 B15R2.562 Cc1cnccc1NCc2c[nH]nn2 27a_100020620823_100000765111 [1,0,1,0,0,0|2,0,0]=4 1236 B15R2.562 Cc1cnccc1NCc2cocn2 27a_100015188801_100000765111 [1,0,1,0,0,0|2,0,0]=4 1237 B15R2.562 Cc1cnccc1NCc2cscn2 27a_100015185402_100000765111 [1,0,1,0,0,0|2,0,0]=4 1238 B15R2.562 Cc1cnccc1OCc2c[nH]cn2 34a_100000694293_100000707719 [1,0,1,0,0,0|2,0,0]=4 1239 B15R2.562 Cc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000765111 [1,0,1,0,0,0|2,0,0]=4 1240 B15R2.562 Cc1cnccc1SCc2c[nH]cn2 62a_100000765111_100000707719 [1,0,1,0,0,0|2,0,0]=4 1241 B15R2.562 Cc1cncnc1NCc2c[nH]cn2 27a_100000758547_100011998708 [1,0,1,0,0,0|2,0,0]=4 1242 B15R2.562 Cc1ncccc1OCc2c[nH]cn2 34a_100000745507_100000707719 [1,0,1,0,0,0|2,0,0]=4 1243 B15R2.562 Cc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000751574 [1,0,1,0,0,0|2,0,0]=4 1244 B15R2.562 Cc1ncccc1SCc2c[nH]cn2 62a_100000751574_100000707719 [1,0,1,0,0,0|2,0,0]=4 1245 B15R2.562 Cc1nccnc1NCc2c[nH]cn2 27a_100000758547_100011999405 [1,0,1,0,0,0|2,0,0]=4 1246 B15R2.562 Clc1ccccc1NCc2c[nH]cn2 34a_100000185783_100000707719 [1,0,1,0,0,0|1,0,0]=3 1247 B15R2.562 Clc1ccccc1NCc2cscn2 207a_100000185783_100000743575 [1,0,1,0,0,0|2,0,0]=4 1248 B15R2.562 Clc1ccccc1NCc2cscn2 34a_100000185783_100000205941 [1,0,1,0,0,0|2,0,0]=4 1249 B15R2.562 Clc1ccccc1OCc2c[nH]cn2 34a_100000210172_100000707719 [1,0,1,0,0,0|2,0,0]=4 1250 B15R2.562 Clc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000764095 [1,0,1,0,0,0|2,0,0]=4 1251 B15R2.562 Clc1ccccc1SCc2c[nH]cn2 62a_100000764095_100000707719 [1,0,1,0,0,0|2,0,0]=4 1252 B15R2.562 Fc1ccccc1NCc2c[nH]cn2 34a_100000210422_100000707719 [1,0,1,0,0,0|1,0,0]=3 1253 B15R2.562 Fc1ccccc1NCc2cscn2 207a_100000210422_100000743575 [1,0,1,0,0,0|2,0,0]=4 1254 B15R2.562 Fc1ccccc1NCc2cscn2 34a_100000210422_100000205941 [1,0,1,0,0,0|2,0,0]=4 1255 B15R2.562 Fc1ccccc1OCc2c[nH]cn2 34a_100000210171_100000707719 [1,0,1,0,0,0|2,0,0]=4 1256 B15R2.562 Fc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011215700 [1,0,1,0,0,0|2,0,0]=4 1257 B15R2.562 Fc1ccccc1SCc2c[nH]cn2 62a_100011215700_100000707719 [1,0,1,0,0,0|2,0,0]=4 1258 B15R2.562 Fc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000035921 [1,0,1,0,0,0|2,0,0]=4 1259 B15R2.562 Ic1ccccc1NCc2c[nH]cn2 34a_100000210053_100000707719 [1,0,1,0,0,0|1,0,0]=3 1260 B15R2.562 Ic1ccccc1NCc2cscn2 207a_100000210053_100000743575 [1,0,1,0,0,0|2,0,0]=4 1261 B15R2.562 Ic1ccccc1NCc2cscn2 34a_100000210053_100000205941 [1,0,1,0,0,0|2,0,0]=4 1262 B15R2.562 Ic1ccccc1OCc2c[nH]cn2 34a_100000739446_100000707719 [1,0,1,0,0,0|2,0,0]=4 1263 B15R2.562 Nc1ccccc1OCc2c[nH]cn2 34a_100000185747_100000707719 [1,0,1,0,0,0|2,0,0]=4 1264 B15R2.562 Nc1ccccc1SCc2c[nH]cn2 62a_100000210017_100000707719 [1,0,1,0,0,0|2,0,0]=4 1265 B15R2.562 Nc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000210017 [1,0,1,0,0,0|2,0,0]=4 1266 B15R2.562 Oc1ccccc1NCc2c[nH]cn2 34a_100000185747_100000707719 [1,0,1,0,0,0|1,0,0]=3 1267 B15R2.562 Oc1ccccc1NCc2cscn2 34a_100000185747_100000205941 [1,0,1,0,0,0|2,0,0]=4 1268 B15R2.562 Oc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000739446 [1,0,1,0,0,0|2,0,0]=4 1269 B15R2.562 Oc1ccccc1SCc2c[nH]cn2 62a_100000739446_100000707719 [1,0,1,0,0,0|2,0,0]=4 1270 B17R2.39 NC(=O)CC(=O)CN1CCc2c1cccc2 1458a_100000742689_100000187820 [0,1,1,0,0,0|2,0,0]=4 1271 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)Br 2230a_100000219632_100000707719 [0,1,1,0,0,0|0,0,0]=2 1272 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)Br 269982a_100000219632_100000707719 [0,1,1,0,0,0|0,0,0]=2 1273 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)Br 34a_100000219632_100000707719 [0,1,1,0,0,0|0,0,0]=2 1274 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)C 2230a_100000219985_100000707719 [0,1,1,0,0,0|0,0,0]=2 1275 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)C 269982a_100000219985_100000707719 [0,1,1,0,0,0|0,0,0]=2 1276 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)C 34a_100000219985_100000707719 [0,1,1,0,0,0|0,0,0]=2 1277 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)Cl 2230a_100000220165_100000707719 [0,1,1,0,0,0|0,0,0]=2 1278 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)Cl 269982a_100000220165_100000707719 [0,1,1,0,0,0|0,0,0]=2 1279 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)Cl 34a_100000220165_100000707719 [0,1,1,0,0,0|0,0,0]=2 1280 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)F 2230a_100102640331_100000707719 [0,1,1,0,0,0|0,0,0]=2 1281 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)F 269982a_100102640331_100000707719 [0,1,1,0,0,0|0,0,0]=2 1282 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)F 34a_100102640331_100000707719 [0,1,1,0,0,0|0,0,0]=2 1283 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)O 2230a_100011337800_100000707719 [0,1,1,0,0,0|0,0,0]=2 1284 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)O 269982a_100011337800_100000707719 [0,1,1,0,0,0|0,0,0]=2 1285 B17R2.164 CCN(Cc1c[nH]cn1)c2ccc(cc2)O 34a_100011337800_100000707719 [0,1,1,0,0,0|0,0,0]=2 1286 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)C 2230a_100000198071_100000210202 [0,1,1,0,0,0|2,0,0]=4 1287 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)C 269982a_100000198071_100000204670 [0,1,1,0,0,0|2,0,0]=4 1288 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)C 34a_100000198071_100000210202 [0,1,1,0,0,0|2,0,0]=4 1289 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)Cl 2230a_100000189056_100000210202 [0,1,1,0,0,0|2,0,0]=4 1290 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)Cl 269982a_100000189056_100000204670 [0,1,1,0,0,0|2,0,0]=4 1291 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)Cl 34a_100000189056_100000210202 [0,1,1,0,0,0|2,0,0]=4 1292 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)F 2230a_100000739240_100000210202 [0,1,1,0,0,0|2,0,0]=4 1293 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)F 269982a_100000739240_100000204670 [0,1,1,0,0,0|2,0,0]=4 1294 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)F 34a_100000739240_100000210202 [0,1,1,0,0,0|2,0,0]=4 1295 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)Br 2230a_100000188760_100000210202 [0,1,1,0,0,0|2,0,0]=4 1296 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)Br 269982a_100000188760_100000204670 [0,1,1,0,0,0|2,0,0]=4 1297 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)Br 34a_100000188760_100000210202 [0,1,1,0,0,0|2,0,0]=4 1298 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)C 2230a_100000187402_100000210202 [0,1,1,0,0,0|2,0,0]=4 1299 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)C 269982a_100000187402_100000204670 [0,1,1,0,0,0|2,0,0]=4 1300 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)C 34a_100000187402_100000210202 [0,1,1,0,0,0|2,0,0]=4 1301 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)F 2230a_100000742479_100000210202 [0,1,1,0,0,0|2,0,0]=4 1302 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)F 269982a_100000742479_100000204670 [0,1,1,0,0,0|2,0,0]=4 1303 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)F 34a_100000742479_100000210202 [0,1,1,0,0,0|2,0,0]=4 1304 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)Br 2230a_100000219632_100000234950 [0,1,1,0,0,0|2,0,0]=4 1305 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)Br 269982a_100000219632_100000234950 [0,1,1,0,0,0|2,0,0]=4 1306 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)Br 34a_100000219632_100000234950 [0,1,1,0,0,0|2,0,0]=4 1307 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)C 2230a_100000219985_100000234950 [0,1,1,0,0,0|2,0,0]=4 1308 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)C 269982a_100000219985_100000234950 [0,1,1,0,0,0|2,0,0]=4 1309 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)C 34a_100000219985_100000234950 [0,1,1,0,0,0|2,0,0]=4 1310 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)Cl 2230a_100000220165_100000234950 [0,1,1,0,0,0|2,0,0]=4 1311 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)Cl 269982a_100000220165_100000234950 [0,1,1,0,0,0|2,0,0]=4 1312 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)Cl 34a_100000220165_100000234950 [0,1,1,0,0,0|2,0,0]=4 1313 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)F 2230a_100102640331_100000234950 [0,1,1,0,0,0|2,0,0]=4 1314 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)F 269982a_100102640331_100000234950 [0,1,1,0,0,0|2,0,0]=4 1315 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)F 34a_100102640331_100000234950 [0,1,1,0,0,0|2,0,0]=4 1316 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)O 2230a_100011337800_100000234950 [0,1,1,0,0,0|2,0,0]=4 1317 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)O 269982a_100011337800_100000234950 [0,1,1,0,0,0|2,0,0]=4 1318 B17R2.164 CCN(Cc1ccon1)c2ccc(cc2)O 34a_100011337800_100000234950 [0,1,1,0,0,0|2,0,0]=4 1319 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)Br 2230a_100000219632_100011261437 [0,1,1,0,0,0|2,0,0]=4 1320 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)Br 269982a_100000219632_100011233845 [0,1,1,0,0,0|2,0,0]=4 1321 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)Br 34a_100000219632_100011261437 [0,1,1,0,0,0|2,0,0]=4 1322 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)C 2230a_100000219985_100011261437 [0,1,1,0,0,0|2,0,0]=4 1323 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)C 269982a_100000219985_100011233845 [0,1,1,0,0,0|2,0,0]=4 1324 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)C 34a_100000219985_100011261437 [0,1,1,0,0,0|2,0,0]=4 1325 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)Cl 2230a_100000220165_100011261437 [0,1,1,0,0,0|2,0,0]=4 1326 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)Cl 269982a_100000220165_100011233845 [0,1,1,0,0,0|2,0,0]=4 1327 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)Cl 34a_100000220165_100011261437 [0,1,1,0,0,0|2,0,0]=4 1328 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)F 2230a_100102640331_100011261437 [0,1,1,0,0,0|2,0,0]=4 1329 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)F 269982a_100102640331_100011233845 [0,1,1,0,0,0|2,0,0]=4 1330 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)F 34a_100102640331_100011261437 [0,1,1,0,0,0|2,0,0]=4 1331 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)O 2230a_100011337800_100011261437 [0,1,1,0,0,0|2,0,0]=4 1332 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)O 269982a_100011337800_100011233845 [0,1,1,0,0,0|2,0,0]=4 1333 B17R2.164 CCN(Cc1ccsc1)c2ccc(cc2)O 34a_100011337800_100011261437 [0,1,1,0,0,0|2,0,0]=4 1334 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)Br 2230a_100000219632_100015185245 [0,1,1,0,0,0|1,0,1]=4 1335 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)Br 269982a_100000219632_100015185245 [0,1,1,0,0,0|1,0,1]=4 1336 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)Br 34a_100000219632_100015185245 [0,1,1,0,0,0|1,0,1]=4 1337 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)C 2230a_100000219985_100015185245 [0,1,1,0,0,0|1,0,1]=4 1338 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)C 269982a_100000219985_100015185245 [0,1,1,0,0,0|1,0,1]=4 1339 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)C 34a_100000219985_100015185245 [0,1,1,0,0,0|1,0,1]=4 1340 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)Cl 2230a_100000220165_100015185245 [0,1,1,0,0,0|1,0,1]=4 1341 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)Cl 269982a_100000220165_100015185245 [0,1,1,0,0,0|1,0,1]=4 1342 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)Cl 34a_100000220165_100015185245 [0,1,1,0,0,0|1,0,1]=4 1343 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)F 2230a_100102640331_100015185245 [0,1,1,0,0,0|1,0,1]=4 1344 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)F 269982a_100102640331_100015185245 [0,1,1,0,0,0|1,0,1]=4 1345 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)F 34a_100102640331_100015185245 [0,1,1,0,0,0|1,0,1]=4 1346 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)O 2230a_100011337800_100015185245 [0,1,1,0,0,0|1,0,1]=4 1347 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)O 269982a_100011337800_100015185245 [0,1,1,0,0,0|1,0,1]=4 1348 B17R2.164 CCN(Cc1cncs1)c2ccc(cc2)O 34a_100011337800_100015185245 [0,1,1,0,0,0|1,0,1]=4 1349 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)Br 2230a_100000219632_100000205941 [0,1,1,0,0,0|1,0,0]=3 1350 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)Br 269982a_100000219632_100000205941 [0,1,1,0,0,0|1,0,0]=3 1351 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)Br 34a_100000219632_100000205941 [0,1,1,0,0,0|1,0,0]=3 1352 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)C 2230a_100000219985_100000205941 [0,1,1,0,0,0|1,0,0]=3 1353 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)C 269982a_100000219985_100000205941 [0,1,1,0,0,0|1,0,0]=3 1354 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)C 34a_100000219985_100000205941 [0,1,1,0,0,0|1,0,0]=3 1355 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)Cl 2230a_100000220165_100000205941 [0,1,1,0,0,0|1,0,0]=3 1356 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)Cl 269982a_100000220165_100000205941 [0,1,1,0,0,0|1,0,0]=3 1357 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)Cl 34a_100000220165_100000205941 [0,1,1,0,0,0|1,0,0]=3 1358 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)F 2230a_100102640331_100000205941 [0,1,1,0,0,0|1,0,0]=3 1359 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)F 269982a_100102640331_100000205941 [0,1,1,0,0,0|1,0,0]=3 1360 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)F 34a_100102640331_100000205941 [0,1,1,0,0,0|1,0,0]=3 1361 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)O 2230a_100011337800_100000205941 [0,1,1,0,0,0|1,0,0]=3 1362 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)O 269982a_100011337800_100000205941 [0,1,1,0,0,0|1,0,0]=3 1363 B17R2.164 CCN(Cc1cscn1)c2ccc(cc2)O 34a_100011337800_100000205941 [0,1,1,0,0,0|1,0,0]=3 1364 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)Br 2230a_100000219632_100016991755 [0,1,1,0,0,0|2,0,0]=4 1365 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)Br 269982a_100000219632_100016991755 [0,1,1,0,0,0|2,0,0]=4 1366 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)Br 34a_100000219632_100016991755 [0,1,1,0,0,0|2,0,0]=4 1367 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)C 2230a_100000219985_100016991755 [0,1,1,0,0,0|2,0,0]=4 1368 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)C 269982a_100000219985_100016991755 [0,1,1,0,0,0|2,0,0]=4 1369 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)C 34a_100000219985_100016991755 [0,1,1,0,0,0|2,0,0]=4 1370 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)Cl 2230a_100000220165_100016991755 [0,1,1,0,0,0|2,0,0]=4 1371 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)Cl 269982a_100000220165_100016991755 [0,1,1,0,0,0|2,0,0]=4 1372 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)Cl 269982a_100102558475_100000204670 [0,1,1,0,0,0|2,0,0]=4 1373 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)Cl 34a_100000220165_100016991755 [0,1,1,0,0,0|2,0,0]=4 1374 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)Cl 34a_100102558475_100000210202 [0,1,1,0,0,0|2,0,0]=4 1375 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)F 2230a_100102640331_100016991755 [0,1,1,0,0,0|2,0,0]=4 1376 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)F 269982a_100102640331_100016991755 [0,1,1,0,0,0|2,0,0]=4 1377 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)F 34a_100102640331_100016991755 [0,1,1,0,0,0|2,0,0]=4 1378 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)O 2230a_100011337800_100016991755 [0,1,1,0,0,0|2,0,0]=4 1379 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)O 269982a_100011337800_100016991755 [0,1,1,0,0,0|2,0,0]=4 1380 B17R2.164 CCN(Cc1ncc[nH]1)c2ccc(cc2)O 34a_100011337800_100016991755 [0,1,1,0,0,0|2,0,0]=4 1381 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)Br 2230a_100000219632_103436540062 [0,1,1,0,0,0|2,0,0]=4 1382 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)Br 269982a_100000219632_103436540062 [0,1,1,0,0,0|2,0,0]=4 1383 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)Br 34a_100000219632_103436540062 [0,1,1,0,0,0|2,0,0]=4 1384 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)C 2230a_100000219985_103436540062 [0,1,1,0,0,0|2,0,0]=4 1385 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)C 269982a_100000219985_103436540062 [0,1,1,0,0,0|2,0,0]=4 1386 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)C 34a_100000219985_103436540062 [0,1,1,0,0,0|2,0,0]=4 1387 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)Cl 2230a_100000220165_103436540062 [0,1,1,0,0,0|2,0,0]=4 1388 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)Cl 269982a_100000220165_103436540062 [0,1,1,0,0,0|2,0,0]=4 1389 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)Cl 34a_100000220165_103436540062 [0,1,1,0,0,0|2,0,0]=4 1390 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)F 2230a_100102640331_103436540062 [0,1,1,0,0,0|2,0,0]=4 1391 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)F 269982a_100102640331_103436540062 [0,1,1,0,0,0|2,0,0]=4 1392 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)F 34a_100102640331_103436540062 [0,1,1,0,0,0|2,0,0]=4 1393 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)O 2230a_100011337800_103436540062 [0,1,1,0,0,0|2,0,0]=4 1394 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)O 269982a_100011337800_103436540062 [0,1,1,0,0,0|2,0,0]=4 1395 B17R2.164 CCN(Cc1ncco1)c2ccc(cc2)O 34a_100011337800_103436540062 [0,1,1,0,0,0|2,0,0]=4 1396 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)Br 2230a_100000219632_100015184050 [0,1,1,0,0,0|2,0,0]=4 1397 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)Br 269982a_100000219632_100015184050 [0,1,1,0,0,0|2,0,0]=4 1398 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)Br 34a_100000219632_100015184050 [0,1,1,0,0,0|2,0,0]=4 1399 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)C 2230a_100000219985_100015184050 [0,1,1,0,0,0|2,0,0]=4 1400 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)C 269982a_100000219985_100015184050 [0,1,1,0,0,0|2,0,0]=4 1401 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)C 34a_100000219985_100015184050 [0,1,1,0,0,0|2,0,0]=4 1402 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)Cl 2230a_100000220165_100015184050 [0,1,1,0,0,0|2,0,0]=4 1403 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)Cl 269982a_100000220165_100015184050 [0,1,1,0,0,0|2,0,0]=4 1404 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)Cl 34a_100000220165_100015184050 [0,1,1,0,0,0|2,0,0]=4 1405 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)F 2230a_100102640331_100015184050 [0,1,1,0,0,0|2,0,0]=4 1406 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)F 269982a_100102640331_100015184050 [0,1,1,0,0,0|2,0,0]=4 1407 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)F 34a_100102640331_100015184050 [0,1,1,0,0,0|2,0,0]=4 1408 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)O 2230a_100011337800_100015184050 [0,1,1,0,0,0|2,0,0]=4 1409 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)O 269982a_100011337800_100015184050 [0,1,1,0,0,0|2,0,0]=4 1410 B17R2.164 CCN(Cc1nccs1)c2ccc(cc2)O 34a_100011337800_100015184050 [0,1,1,0,0,0|2,0,0]=4 1411 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)Br 269982a_100000219632_100000233494 [0,1,1,0,0,0|2,0,0]=4 1412 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)Br 34a_100000219632_100000233494 [0,1,1,0,0,0|2,0,0]=4 1413 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)C 269982a_100000219985_100000233494 [0,1,1,0,0,0|2,0,0]=4 1414 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)C 34a_100000219985_100000233494 [0,1,1,0,0,0|2,0,0]=4 1415 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)Cl 269982a_100000220165_100000233494 [0,1,1,0,0,0|2,0,0]=4 1416 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)Cl 34a_100000220165_100000233494 [0,1,1,0,0,0|2,0,0]=4 1417 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)F 269982a_100102640331_100000233494 [0,1,1,0,0,0|2,0,0]=4 1418 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)F 34a_100102640331_100000233494 [0,1,1,0,0,0|2,0,0]=4 1419 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)O 269982a_100011337800_100000233494 [0,1,1,0,0,0|2,0,0]=4 1420 B17R2.164 CCN(Cc1ncon1)c2ccc(cc2)O 34a_100011337800_100000233494 [0,1,1,0,0,0|2,0,0]=4 1421 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)Br 2230a_100000219632_200020645497 [0,1,1,0,0,0|1,0,1]=4 1422 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)Br 269982a_100000219632_200020645497 [0,1,1,0,0,0|1,0,1]=4 1423 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)Br 34a_100000219632_200020645497 [0,1,1,0,0,0|1,0,1]=4 1424 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)C 2230a_100000219985_200020645497 [0,1,1,0,0,0|1,0,1]=4 1425 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)C 269982a_100000219985_200020645497 [0,1,1,0,0,0|1,0,1]=4 1426 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)C 34a_100000219985_200020645497 [0,1,1,0,0,0|1,0,1]=4 1427 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)Cl 2230a_100000220165_200020645497 [0,1,1,0,0,0|1,0,1]=4 1428 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)Cl 269982a_100000220165_200020645497 [0,1,1,0,0,0|1,0,1]=4 1429 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)Cl 34a_100000220165_200020645497 [0,1,1,0,0,0|1,0,1]=4 1430 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)F 2230a_100102640331_200020645497 [0,1,1,0,0,0|1,0,1]=4 1431 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)F 269982a_100102640331_200020645497 [0,1,1,0,0,0|1,0,1]=4 1432 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)F 34a_100102640331_200020645497 [0,1,1,0,0,0|1,0,1]=4 1433 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)O 2230a_100011337800_200020645497 [0,1,1,0,0,0|1,0,1]=4 1434 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)O 269982a_100011337800_200020645497 [0,1,1,0,0,0|1,0,1]=4 1435 B17R2.164 CCN(Cn1cncn1)c2ccc(cc2)O 34a_100011337800_200020645497 [0,1,1,0,0,0|1,0,1]=4 1436 B17R2.2192 C=CCN(Cc1c[nH]cn1)c2ccccc2 2230a_100000211662_100000707719 [0,1,1,0,0,0|0,0,1]=3 1437 B17R2.2192 C=CCN(Cc1c[nH]cn1)c2ccccc2 269982a_100000211662_100000707719 [0,1,1,0,0,0|0,0,1]=3 1438 B17R2.2192 C=CCN(Cc1c[nH]cn1)c2ccccc2 34a_100000211662_100000707719 [0,1,1,0,0,0|0,0,1]=3 1439 B17R2.2192 C=CCN(Cc1cscn1)c2ccccc2 2230a_100000211662_100000205941 [0,1,1,0,0,0|1,0,1]=4 1440 B17R2.2192 C=CCN(Cc1cscn1)c2ccccc2 269982a_100000211662_100000205941 [0,1,1,0,0,0|1,0,1]=4 1441 B17R2.2192 C=CCN(Cc1cscn1)c2ccccc2 34a_100000211662_100000205941 [0,1,1,0,0,0|1,0,1]=4 1442 B17R2.2192 CCCN(Cc1c[nH]cn1)c2ccccc2 2230a_200011218496_100000707719 [0,1,1,0,0,0|0,0,0]=2 1443 B17R2.2192 CCCN(Cc1c[nH]cn1)c2ccccc2 269982a_200011218496_100000707719 [0,1,1,0,0,0|0,0,0]=2 1444 B17R2.2192 CCCN(Cc1c[nH]cn1)c2ccccc2 34a_200011218496_100000707719 [0,1,1,0,0,0|0,0,0]=2 1445 B17R2.2192 CCCN(Cc1ccco1)c2ccccc2 2230a_100000230375_100000210303 [0,1,1,0,0,0|2,0,0]=4 1446 B17R2.2192 CCCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100000210303 [0,1,1,0,0,0|2,0,0]=4 1447 B17R2.2192 CCCN(Cc1ccco1)c2ccccc2 34a_100000230375_100000210303 [0,1,1,0,0,0|2,0,0]=4 1448 B17R2.2192 CCCN(Cc1ccon1)c2ccccc2 2230a_200011218496_100000234950 [0,1,1,0,0,0|2,0,0]=4 1449 B17R2.2192 CCCN(Cc1ccon1)c2ccccc2 269982a_200011218496_100000234950 [0,1,1,0,0,0|2,0,0]=4 1450 B17R2.2192 CCCN(Cc1ccon1)c2ccccc2 34a_200011218496_100000234950 [0,1,1,0,0,0|2,0,0]=4 1451 B17R2.2192 CCCN(Cc1ccsc1)c2ccccc2 2230a_200011218496_100011261437 [0,1,1,0,0,0|2,0,0]=4 1452 B17R2.2192 CCCN(Cc1ccsc1)c2ccccc2 269982a_200011218496_100011233845 [0,1,1,0,0,0|2,0,0]=4 1453 B17R2.2192 CCCN(Cc1ccsc1)c2ccccc2 34a_200011218496_100011261437 [0,1,1,0,0,0|2,0,0]=4 1454 B17R2.2192 CCCN(Cc1cncs1)c2ccccc2 2230a_200011218496_100015185245 [0,1,1,0,0,0|1,0,1]=4 1455 B17R2.2192 CCCN(Cc1cncs1)c2ccccc2 269982a_200011218496_100015185245 [0,1,1,0,0,0|1,0,1]=4 1456 B17R2.2192 CCCN(Cc1cncs1)c2ccccc2 34a_200011218496_100015185245 [0,1,1,0,0,0|1,0,1]=4 1457 B17R2.2192 CCCN(Cc1cscn1)c2ccccc2 2230a_200011218496_100000205941 [0,1,1,0,0,0|1,0,0]=3 1458 B17R2.2192 CCCN(Cc1cscn1)c2ccccc2 269982a_200011218496_100000205941 [0,1,1,0,0,0|1,0,0]=3 1459 B17R2.2192 CCCN(Cc1cscn1)c2ccccc2 34a_200011218496_100000205941 [0,1,1,0,0,0|1,0,0]=3 1460 B17R2.2192 CCCN(Cc1ncc[nH]1)c2ccccc2 2230a_200011218496_100016991755 [0,1,1,0,0,0|2,0,0]=4 1461 B17R2.2192 CCCN(Cc1ncc[nH]1)c2ccccc2 269982a_200011218496_100016991755 [0,1,1,0,0,0|2,0,0]=4 1462 B17R2.2192 CCCN(Cc1ncc[nH]1)c2ccccc2 34a_200011218496_100016991755 [0,1,1,0,0,0|2,0,0]=4 1463 B17R2.2192 CCCN(Cc1ncco1)c2ccccc2 2230a_200011218496_103436540062 [0,1,1,0,0,0|2,0,0]=4 1464 B17R2.2192 CCCN(Cc1ncco1)c2ccccc2 269982a_200011218496_103436540062 [0,1,1,0,0,0|2,0,0]=4 1465 B17R2.2192 CCCN(Cc1ncco1)c2ccccc2 34a_200011218496_103436540062 [0,1,1,0,0,0|2,0,0]=4 1466 B17R2.2192 CCCN(Cc1nccs1)c2ccccc2 2230a_200011218496_100015184050 [0,1,1,0,0,0|2,0,0]=4 1467 B17R2.2192 CCCN(Cc1nccs1)c2ccccc2 269982a_200011218496_100015184050 [0,1,1,0,0,0|2,0,0]=4 1468 B17R2.2192 CCCN(Cc1nccs1)c2ccccc2 34a_200011218496_100015184050 [0,1,1,0,0,0|2,0,0]=4 1469 B17R2.2192 CCCN(Cc1ncon1)c2ccccc2 269982a_200011218496_100000233494 [0,1,1,0,0,0|2,0,0]=4 1470 B17R2.2192 CCCN(Cc1ncon1)c2ccccc2 34a_200011218496_100000233494 [0,1,1,0,0,0|2,0,0]=4 1471 B17R2.2192 CCCN(Cn1cncn1)c2ccccc2 2230a_200011218496_200020645497 [0,1,1,0,0,0|1,0,1]=4 1472 B17R2.2192 CCCN(Cn1cncn1)c2ccccc2 269982a_200011218496_200020645497 [0,1,1,0,0,0|1,0,1]=4 1473 B17R2.2192 CCCN(Cn1cncn1)c2ccccc2 34a_200011218496_200020645497 [0,1,1,0,0,0|1,0,1]=4 1474 B17R2.2192 COCN(Cc1ccco1)c2ccccc2 2230a_100000230375_100000766300 [0,1,1,0,0,0|2,0,0]=4 1475 B17R2.2192 COCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100000766300 [0,1,1,0,0,0|2,0,0]=4 1476 B17R2.2192 CSCN(Cc1ccco1)c2ccccc2 2230a_100000230375_100011218213 [0,1,1,0,0,0|2,0,0]=4 1477 B17R2.2192 CSCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100011218213 [0,1,1,0,0,0|2,0,0]=4 1478 B17R2.2192 CSCN(Cc1ccco1)c2ccccc2 34a_100000230375_100011218213 [0,1,1,0,0,0|2,0,0]=4 1479 B17R2.2192 ClCCC(Sc1c[nH]cn1)c2ccccc2 62a_100000756875_200010132975 [0,1,1,0,0,0|2,0,0]=4 1480 B17R2.2192 ClCCC(Sc1c[nH]cn1)c2ccccc2 62a_200010132975_100000756875 [0,1,1,0,0,0|2,0,0]=4 1481 B17R2.2192 FCCN(Cc1ccco1)c2ccccc2 2230a_100000230375_100011217306 [0,1,1,0,0,0|2,0,0]=4 1482 B17R2.2192 FCCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100011217306 [0,1,1,0,0,0|2,0,0]=4 1483 B17R2.2192 FCCN(Cc1ccco1)c2ccccc2 34a_100000230375_100011217306 [0,1,1,0,0,0|2,0,0]=4 1484 B17R2.2192 OCCN(Cc1c[nH]cn1)c2ccccc2 2230a_100000211345_100000707719 [0,1,1,0,0,0|0,0,0]=2 1485 B17R2.2192 OCCN(Cc1c[nH]cn1)c2ccccc2 269982a_100000211345_100000707719 [0,1,1,0,0,0|0,0,0]=2 1486 B17R2.2192 OCCN(Cc1c[nH]cn1)c2ccccc2 34a_100000211345_100000707719 [0,1,1,0,0,0|0,0,0]=2 1487 B17R2.2192 OCCN(Cc1ccco1)c2ccccc2 2230a_100000230375_100000211926 [0,1,1,0,0,0|2,0,0]=4 1488 B17R2.2192 OCCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100000211926 [0,1,1,0,0,0|2,0,0]=4 1489 B17R2.2192 OCCN(Cc1ccco1)c2ccccc2 34a_100000230375_100000211926 [0,1,1,0,0,0|2,0,0]=4 1490 B17R2.2192 OCCN(Cc1ccon1)c2ccccc2 2230a_100000211345_100000234950 [0,1,1,0,0,0|2,0,0]=4 1491 B17R2.2192 OCCN(Cc1ccon1)c2ccccc2 269982a_100000211345_100000234950 [0,1,1,0,0,0|2,0,0]=4 1492 B17R2.2192 OCCN(Cc1ccon1)c2ccccc2 34a_100000211345_100000234950 [0,1,1,0,0,0|2,0,0]=4 1493 B17R2.2192 OCCN(Cc1ccsc1)c2ccccc2 2230a_100000211345_100011261437 [0,1,1,0,0,0|2,0,0]=4 1494 B17R2.2192 OCCN(Cc1ccsc1)c2ccccc2 269982a_100000211345_100011233845 [0,1,1,0,0,0|2,0,0]=4 1495 B17R2.2192 OCCN(Cc1ccsc1)c2ccccc2 34a_100000211345_100011261437 [0,1,1,0,0,0|2,0,0]=4 1496 B17R2.2192 OCCN(Cc1cncs1)c2ccccc2 2230a_100000211345_100015185245 [0,1,1,0,0,0|1,0,1]=4 1497 B17R2.2192 OCCN(Cc1cncs1)c2ccccc2 269982a_100000211345_100015185245 [0,1,1,0,0,0|1,0,1]=4 1498 B17R2.2192 OCCN(Cc1cncs1)c2ccccc2 34a_100000211345_100015185245 [0,1,1,0,0,0|1,0,1]=4 1499 B17R2.2192 OCCN(Cc1cscn1)c2ccccc2 2230a_100000211345_100000205941 [0,1,1,0,0,0|1,0,0]=3 1500 B17R2.2192 OCCN(Cc1cscn1)c2ccccc2 269982a_100000211345_100000205941 [0,1,1,0,0,0|1,0,0]=3 1501 B17R2.2192 OCCN(Cc1cscn1)c2ccccc2 34a_100000211345_100000205941 [0,1,1,0,0,0|1,0,0]=3 1502 B17R2.2192 OCCN(Cc1ncc[nH]1)c2ccccc2 2230a_100000211345_100016991755 [0,1,1,0,0,0|2,0,0]=4 1503 B17R2.2192 OCCN(Cc1ncc[nH]1)c2ccccc2 269982a_100000211345_100016991755 [0,1,1,0,0,0|2,0,0]=4 1504 B17R2.2192 OCCN(Cc1ncc[nH]1)c2ccccc2 34a_100000211345_100016991755 [0,1,1,0,0,0|2,0,0]=4 1505 B17R2.2192 OCCN(Cc1ncco1)c2ccccc2 2230a_100000211345_103436540062 [0,1,1,0,0,0|2,0,0]=4 1506 B17R2.2192 OCCN(Cc1ncco1)c2ccccc2 269982a_100000211345_103436540062 [0,1,1,0,0,0|2,0,0]=4 1507 B17R2.2192 OCCN(Cc1ncco1)c2ccccc2 34a_100000211345_103436540062 [0,1,1,0,0,0|2,0,0]=4 1508 B17R2.2192 OCCN(Cc1nccs1)c2ccccc2 2230a_100000211345_100015184050 [0,1,1,0,0,0|2,0,0]=4 1509 B17R2.2192 OCCN(Cc1nccs1)c2ccccc2 269982a_100000211345_100015184050 [0,1,1,0,0,0|2,0,0]=4 1510 B17R2.2192 OCCN(Cc1nccs1)c2ccccc2 34a_100000211345_100015184050 [0,1,1,0,0,0|2,0,0]=4 1511 B17R2.2192 OCCN(Cc1ncon1)c2ccccc2 269982a_100000211345_100000233494 [0,1,1,0,0,0|2,0,0]=4 1512 B17R2.2192 OCCN(Cc1ncon1)c2ccccc2 34a_100000211345_100000233494 [0,1,1,0,0,0|2,0,0]=4 1513 B17R2.2192 OCCN(Cn1cncn1)c2ccccc2 2230a_100000211345_200020645497 [0,1,1,0,0,0|1,0,1]=4 1514 B17R2.2192 OCCN(Cn1cncn1)c2ccccc2 269982a_100000211345_200020645497 [0,1,1,0,0,0|1,0,1]=4 1515 B17R2.2192 OCCN(Cn1cncn1)c2ccccc2 34a_100000211345_200020645497 [0,1,1,0,0,0|1,0,1]=4 1516 B17R2.6039 CCN(Cc1cc(cs1)Br)c2ccccc2 2230a_100000210013_100000746031 [0,1,1,0,0,0|2,0,0]=4 1517 B17R2.6039 CCN(Cc1cc(cs1)Br)c2ccccc2 269982a_100000210013_100000746031 [0,1,1,0,0,0|2,0,0]=4 1518 B17R2.6039 CCN(Cc1cc(cs1)Br)c2ccccc2 34a_100000210013_100000746031 [0,1,1,0,0,0|2,0,0]=4 1519 B17R2.6039 CCN(Cc1cc(on1)C)c2ccccc2 2230a_100000210013_100000199038 [0,1,1,0,0,0|2,0,0]=4 1520 B17R2.6039 CCN(Cc1cc(on1)C)c2ccccc2 269982a_100000210013_100000199038 [0,1,1,0,0,0|2,0,0]=4 1521 B17R2.6039 CCN(Cc1cc(on1)C)c2ccccc2 34a_100000210013_100000199038 [0,1,1,0,0,0|2,0,0]=4 1522 B17R2.6039 CCN(Cc1ccc(s1)Br)c2ccccc2 2230a_100000210013_100000708592 [0,1,1,0,0,0|2,0,0]=4 1523 B17R2.6039 CCN(Cc1ccc(s1)Br)c2ccccc2 269982a_100000210013_100000708592 [0,1,1,0,0,0|2,0,0]=4 1524 B17R2.6039 CCN(Cc1ccc(s1)Br)c2ccccc2 34a_100000210013_100000708592 [0,1,1,0,0,0|2,0,0]=4 1525 B17R2.6039 CCN(Cc1ccc(s1)Cl)c2ccccc2 2230a_100000210013_100000185097 [0,1,1,0,0,0|2,0,0]=4 1526 B17R2.6039 CCN(Cc1ccc(s1)Cl)c2ccccc2 269982a_100000210013_100000185097 [0,1,1,0,0,0|2,0,0]=4 1527 B17R2.6039 CCN(Cc1ccc(s1)Cl)c2ccccc2 34a_100000210013_100000185097 [0,1,1,0,0,0|2,0,0]=4 1528 B17R2.6039 CCN(Cc1ccn(n1)C)c2ccccc2 2230a_100000210013_100000726502 [0,1,1,0,0,0|2,0,0]=4 1529 B17R2.6039 CCN(Cc1ccn(n1)C)c2ccccc2 269982a_100000210013_100000726502 [0,1,1,0,0,0|2,0,0]=4 1530 B17R2.6039 CCN(Cc1ccn(n1)C)c2ccccc2 34a_100000210013_100000726502 [0,1,1,0,0,0|2,0,0]=4 1531 B17R2.6039 CCN(Cc1cn(cn1)C)c2ccccc2 2230a_100000210013_100000717665 [0,1,1,0,0,0|0,0,0]=2 1532 B17R2.6039 CCN(Cc1cn(cn1)C)c2ccccc2 269982a_100000210013_100000717665 [0,1,1,0,0,0|0,0,0]=2 1533 B17R2.6039 CCN(Cc1cn(cn1)C)c2ccccc2 34a_100000210013_100000717665 [0,1,1,0,0,0|0,0,0]=2 1534 B17R2.6039 CCN(Cc1cnc(s1)Br)c2ccccc2 2230a_100000210013_100000717027 [0,1,1,0,0,0|1,0,1]=4 1535 B17R2.6039 CCN(Cc1cnc(s1)Br)c2ccccc2 269982a_100000210013_100000717027 [0,1,1,0,0,0|1,0,1]=4 1536 B17R2.6039 CCN(Cc1cnc(s1)Br)c2ccccc2 34a_100000210013_100000717027 [0,1,1,0,0,0|1,0,1]=4 1537 B17R2.6039 CCN(Cc1cnc(s1)C)c2ccccc2 2230a_100000210013_100020635045 [0,1,1,0,0,0|1,0,1]=4 1538 B17R2.6039 CCN(Cc1cnc(s1)C)c2ccccc2 269982a_100000210013_100020635045 [0,1,1,0,0,0|1,0,1]=4 1539 B17R2.6039 CCN(Cc1cnc(s1)C)c2ccccc2 34a_100000210013_100020635045 [0,1,1,0,0,0|1,0,1]=4 1540 B17R2.6039 CCN(Cc1cnc(s1)Cl)c2ccccc2 2230a_100000210013_100000058068 [0,1,1,0,0,0|1,0,1]=4 1541 B17R2.6039 CCN(Cc1cnc(s1)Cl)c2ccccc2 269982a_100000210013_100000058068 [0,1,1,0,0,0|1,0,1]=4 1542 B17R2.6039 CCN(Cc1cnc(s1)Cl)c2ccccc2 34a_100000210013_100000058068 [0,1,1,0,0,0|1,0,1]=4 1543 B17R2.6039 CCN(Cc1cnn(c1)C)c2ccccc2 2230a_100000210013_100000744441 [0,1,1,0,0,0|2,0,0]=4 1544 B17R2.6039 CCN(Cc1cnn(c1)C)c2ccccc2 269982a_100000210013_100000744441 [0,1,1,0,0,0|2,0,0]=4 1545 B17R2.6039 CCN(Cc1cnn(c1)C)c2ccccc2 34a_100000210013_100000744441 [0,1,1,0,0,0|2,0,0]=4 1546 B17R2.6039 CCN(Cc1csc(n1)C)c2ccccc2 2230a_100000210013_100015186478 [0,1,1,0,0,0|1,0,0]=3 1547 B17R2.6039 CCN(Cc1csc(n1)C)c2ccccc2 269982a_100000210013_100015186478 [0,1,1,0,0,0|1,0,0]=3 1548 B17R2.6039 CCN(Cc1csc(n1)C)c2ccccc2 34a_100000210013_100015186478 [0,1,1,0,0,0|1,0,0]=3 1549 B17R2.6039 CCN(Cc1csc(n1)Cl)c2ccccc2 2230a_100000210013_100000024076 [0,1,1,0,0,0|1,0,0]=3 1550 B17R2.6039 CCN(Cc1csc(n1)Cl)c2ccccc2 269982a_100000210013_100000024076 [0,1,1,0,0,0|1,0,0]=3 1551 B17R2.6039 CCN(Cc1csc(n1)Cl)c2ccccc2 34a_100000210013_100000024076 [0,1,1,0,0,0|1,0,0]=3 1552 B17R2.6039 CCN(Cc1n[nH]c(=O)[nH]1)c2ccccc2 2230a_100000210013_100000754189 [0,1,1,0,0,0|1,0,1]=4 1553 B17R2.6039 CCN(Cc1n[nH]c(=O)[nH]1)c2ccccc2 269982a_100000210013_100000754189 [0,1,1,0,0,0|1,0,1]=4 1554 B17R2.6039 CCN(Cc1nc(no1)C)c2ccccc2 2230a_100000210013_100000735555 [0,1,1,0,0,0|1,0,1]=4 1555 B17R2.6039 CCN(Cc1nc(no1)C)c2ccccc2 269982a_100000210013_100000735555 [0,1,1,0,0,0|1,0,1]=4 1556 B17R2.6039 CCN(Cc1nc(no1)C)c2ccccc2 34a_100000210013_100000735555 [0,1,1,0,0,0|1,0,1]=4 1557 B17R2.6039 CCN(Cc1ncn(n1)C)c2ccccc2 2230a_100000210013_100016995526 [0,1,1,0,0,0|1,0,0]=3 1558 B17R2.6039 CCN(Cc1ncn(n1)C)c2ccccc2 269982a_100000210013_100016995526 [0,1,1,0,0,0|1,0,0]=3 1559 B17R2.6039 CCN(Cc1ncn(n1)C)c2ccccc2 34a_100000210013_100016995526 [0,1,1,0,0,0|1,0,0]=3 1560 B17R2.6039 CCN(Cc1noc(n1)C)c2ccccc2 2230a_100000210013_100000231061 [0,1,1,0,0,0|2,0,0]=4 1561 B17R2.6039 CCN(Cc1noc(n1)C)c2ccccc2 269982a_100000210013_100000231061 [0,1,1,0,0,0|2,0,0]=4 1562 B17R2.6039 CCN(Cc1noc(n1)C)c2ccccc2 34a_100000210013_100000231061 [0,1,1,0,0,0|2,0,0]=4 1563 B17R2.6039 CCN(Cc1nsc(n1)Cl)c2ccccc2 2230a_100000210013_100000043760 [0,1,1,0,0,0|2,0,0]=4 1564 B17R2.6039 CCN(Cc1nsc(n1)Cl)c2ccccc2 269982a_100000210013_100000043760 [0,1,1,0,0,0|2,0,0]=4 1565 B17R2.6039 CCN(Cc1nsc(n1)Cl)c2ccccc2 34a_100000210013_100000043760 [0,1,1,0,0,0|2,0,0]=4 1566 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)Br 2230a_100000738899_100000707719 [0,1,1,0,0,0|0,0,0]=2 1567 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)Br 269982a_100000738899_100000707719 [0,1,1,0,0,0|0,0,0]=2 1568 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)Br 34a_100000738899_100000707719 [0,1,1,0,0,0|0,0,0]=2 1569 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)C 2230a_100000182157_100000707719 [0,1,1,0,0,0|0,0,0]=2 1570 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)C 269982a_100000182157_100000707719 [0,1,1,0,0,0|0,0,0]=2 1571 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)C 34a_100000182157_100000707719 [0,1,1,0,0,0|0,0,0]=2 1572 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)O 2230a_100000717746_100000707719 [0,1,1,0,0,0|0,0,0]=2 1573 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)O 269982a_100000717746_100000707719 [0,1,1,0,0,0|0,0,0]=2 1574 B17R2.6046 CCN(Cc1c[nH]cn1)c2cccc(c2)O 34a_100000717746_100000707719 [0,1,1,0,0,0|0,0,0]=2 1575 B17R2.6046 CCN(Cc1ccco1)c2cccc(c2)Cl 2230a_100011231625_100000210202 [0,1,1,0,0,0|2,0,0]=4 1576 B17R2.6046 CCN(Cc1ccco1)c2cccc(c2)Cl 269982a_100011231625_100000204670 [0,1,1,0,0,0|2,0,0]=4 1577 B17R2.6046 CCN(Cc1ccco1)c2cccc(c2)Cl 34a_100011231625_100000210202 [0,1,1,0,0,0|2,0,0]=4 1578 B17R2.6046 CCN(Cc1ccco1)c2cccc(c2)F 2230a_100011231644_100000210202 [0,1,1,0,0,0|2,0,0]=4 1579 B17R2.6046 CCN(Cc1ccco1)c2cccc(c2)F 269982a_100011231644_100000204670 [0,1,1,0,0,0|2,0,0]=4 1580 B17R2.6046 CCN(Cc1ccco1)c2cccc(c2)F 34a_100011231644_100000210202 [0,1,1,0,0,0|2,0,0]=4 1581 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)Br 2230a_100000738899_100000234950 [0,1,1,0,0,0|2,0,0]=4 1582 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)Br 269982a_100000738899_100000234950 [0,1,1,0,0,0|2,0,0]=4 1583 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)Br 34a_100000738899_100000234950 [0,1,1,0,0,0|2,0,0]=4 1584 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)C 2230a_100000182157_100000234950 [0,1,1,0,0,0|2,0,0]=4 1585 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)C 269982a_100000182157_100000234950 [0,1,1,0,0,0|2,0,0]=4 1586 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)C 34a_100000182157_100000234950 [0,1,1,0,0,0|2,0,0]=4 1587 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)C 7a_100000182157_100000234950 [0,1,1,0,0,0|2,0,0]=4 1588 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)O 2230a_100000717746_100000234950 [0,1,1,0,0,0|2,0,0]=4 1589 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)O 269982a_100000717746_100000234950 [0,1,1,0,0,0|2,0,0]=4 1590 B17R2.6046 CCN(Cc1ccon1)c2cccc(c2)O 34a_100000717746_100000234950 [0,1,1,0,0,0|2,0,0]=4 1591 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)Br 2230a_100000738899_100011261437 [0,1,1,0,0,0|2,0,0]=4 1592 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)Br 269982a_100000738899_100011233845 [0,1,1,0,0,0|2,0,0]=4 1593 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)Br 34a_100000738899_100011261437 [0,1,1,0,0,0|2,0,0]=4 1594 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)C 2230a_100000182157_100011261437 [0,1,1,0,0,0|2,0,0]=4 1595 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)C 269982a_100000182157_100011233845 [0,1,1,0,0,0|2,0,0]=4 1596 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)C 34a_100000182157_100011261437 [0,1,1,0,0,0|2,0,0]=4 1597 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)C 7a_100000182157_100011261437 [0,1,1,0,0,0|2,0,0]=4 1598 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)O 2230a_100000717746_100011261437 [0,1,1,0,0,0|2,0,0]=4 1599 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)O 269982a_100000717746_100011233845 [0,1,1,0,0,0|2,0,0]=4 1600 B17R2.6046 CCN(Cc1ccsc1)c2cccc(c2)O 34a_100000717746_100011261437 [0,1,1,0,0,0|2,0,0]=4 1601 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)Br 2230a_100000738899_100015185245 [0,1,1,0,0,0|1,0,1]=4 1602 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)Br 269982a_100000738899_100015185245 [0,1,1,0,0,0|1,0,1]=4 1603 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)Br 34a_100000738899_100015185245 [0,1,1,0,0,0|1,0,1]=4 1604 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)C 2230a_100000182157_100015185245 [0,1,1,0,0,0|1,0,1]=4 1605 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)C 269982a_100000182157_100015185245 [0,1,1,0,0,0|1,0,1]=4 1606 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)C 34a_100000182157_100015185245 [0,1,1,0,0,0|1,0,1]=4 1607 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)C 7a_100000182157_100015185245 [0,1,1,0,0,0|1,0,1]=4 1608 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)O 2230a_100000717746_100015185245 [0,1,1,0,0,0|1,0,1]=4 1609 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)O 269982a_100000717746_100015185245 [0,1,1,0,0,0|1,0,1]=4 1610 B17R2.6046 CCN(Cc1cncs1)c2cccc(c2)O 34a_100000717746_100015185245 [0,1,1,0,0,0|1,0,1]=4 1611 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)Br 2230a_100000738899_100000205941 [0,1,1,0,0,0|1,0,0]=3 1612 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)Br 269982a_100000738899_100000205941 [0,1,1,0,0,0|1,0,0]=3 1613 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)Br 34a_100000738899_100000205941 [0,1,1,0,0,0|1,0,0]=3 1614 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)C 2230a_100000182157_100000205941 [0,1,1,0,0,0|1,0,0]=3 1615 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)C 269982a_100000182157_100000205941 [0,1,1,0,0,0|1,0,0]=3 1616 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)C 34a_100000182157_100000205941 [0,1,1,0,0,0|1,0,0]=3 1617 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)C 7a_100000182157_100000205941 [0,1,1,0,0,0|1,0,0]=3 1618 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)O 2230a_100000717746_100000205941 [0,1,1,0,0,0|1,0,0]=3 1619 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)O 269982a_100000717746_100000205941 [0,1,1,0,0,0|1,0,0]=3 1620 B17R2.6046 CCN(Cc1cscn1)c2cccc(c2)O 34a_100000717746_100000205941 [0,1,1,0,0,0|1,0,0]=3 1621 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)Br 2230a_100000738899_100016991755 [0,1,1,0,0,0|2,0,0]=4 1622 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)Br 269982a_100000738899_100016991755 [0,1,1,0,0,0|2,0,0]=4 1623 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)Br 34a_100000738899_100016991755 [0,1,1,0,0,0|2,0,0]=4 1624 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)C 2230a_100000182157_100016991755 [0,1,1,0,0,0|2,0,0]=4 1625 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)C 269982a_100000182157_100016991755 [0,1,1,0,0,0|2,0,0]=4 1626 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)C 34a_100000182157_100016991755 [0,1,1,0,0,0|2,0,0]=4 1627 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)C 7a_100000182157_100000753453 [0,1,1,0,0,0|2,0,0]=4 1628 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)O 2230a_100000717746_100016991755 [0,1,1,0,0,0|2,0,0]=4 1629 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)O 269982a_100000717746_100016991755 [0,1,1,0,0,0|2,0,0]=4 1630 B17R2.6046 CCN(Cc1ncc[nH]1)c2cccc(c2)O 34a_100000717746_100016991755 [0,1,1,0,0,0|2,0,0]=4 1631 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)Br 2230a_100000738899_103436540062 [0,1,1,0,0,0|2,0,0]=4 1632 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)Br 269982a_100000738899_103436540062 [0,1,1,0,0,0|2,0,0]=4 1633 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)Br 34a_100000738899_103436540062 [0,1,1,0,0,0|2,0,0]=4 1634 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)C 2230a_100000182157_103436540062 [0,1,1,0,0,0|2,0,0]=4 1635 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)C 269982a_100000182157_103436540062 [0,1,1,0,0,0|2,0,0]=4 1636 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)C 34a_100000182157_103436540062 [0,1,1,0,0,0|2,0,0]=4 1637 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)C 7a_100000182157_103436540062 [0,1,1,0,0,0|2,0,0]=4 1638 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)O 2230a_100000717746_103436540062 [0,1,1,0,0,0|2,0,0]=4 1639 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)O 269982a_100000717746_103436540062 [0,1,1,0,0,0|2,0,0]=4 1640 B17R2.6046 CCN(Cc1ncco1)c2cccc(c2)O 34a_100000717746_103436540062 [0,1,1,0,0,0|2,0,0]=4 1641 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)Br 2230a_100000738899_100015184050 [0,1,1,0,0,0|2,0,0]=4 1642 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)Br 269982a_100000738899_100015184050 [0,1,1,0,0,0|2,0,0]=4 1643 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)Br 34a_100000738899_100015184050 [0,1,1,0,0,0|2,0,0]=4 1644 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)C 2230a_100000182157_100015184050 [0,1,1,0,0,0|2,0,0]=4 1645 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)C 269982a_100000182157_100015184050 [0,1,1,0,0,0|2,0,0]=4 1646 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)C 34a_100000182157_100015184050 [0,1,1,0,0,0|2,0,0]=4 1647 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)C 7a_100000182157_100015184050 [0,1,1,0,0,0|2,0,0]=4 1648 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)O 2230a_100000717746_100015184050 [0,1,1,0,0,0|2,0,0]=4 1649 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)O 269982a_100000717746_100015184050 [0,1,1,0,0,0|2,0,0]=4 1650 B17R2.6046 CCN(Cc1nccs1)c2cccc(c2)O 34a_100000717746_100015184050 [0,1,1,0,0,0|2,0,0]=4 1651 B17R2.6046 CCN(Cc1ncon1)c2cccc(c2)Br 269982a_100000738899_100000233494 [0,1,1,0,0,0|2,0,0]=4 1652 B17R2.6046 CCN(Cc1ncon1)c2cccc(c2)Br 34a_100000738899_100000233494 [0,1,1,0,0,0|2,0,0]=4 1653 B17R2.6046 CCN(Cc1ncon1)c2cccc(c2)C 269982a_100000182157_100000233494 [0,1,1,0,0,0|2,0,0]=4 1654 B17R2.6046 CCN(Cc1ncon1)c2cccc(c2)C 34a_100000182157_100000233494 [0,1,1,0,0,0|2,0,0]=4 1655 B17R2.6046 CCN(Cc1ncon1)c2cccc(c2)O 269982a_100000717746_100000233494 [0,1,1,0,0,0|2,0,0]=4 1656 B17R2.6046 CCN(Cc1ncon1)c2cccc(c2)O 34a_100000717746_100000233494 [0,1,1,0,0,0|2,0,0]=4 1657 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)Br 2230a_100000738899_200020645497 [0,1,1,0,0,0|1,0,1]=4 1658 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)Br 269982a_100000738899_200020645497 [0,1,1,0,0,0|1,0,1]=4 1659 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)Br 34a_100000738899_200020645497 [0,1,1,0,0,0|1,0,1]=4 1660 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)C 2230a_100000182157_200020645497 [0,1,1,0,0,0|1,0,1]=4 1661 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)C 269982a_100000182157_200020645497 [0,1,1,0,0,0|1,0,1]=4 1662 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)C 34a_100000182157_200020645497 [0,1,1,0,0,0|1,0,1]=4 1663 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)C 7a_100000182157_200020645497 [0,1,1,0,0,0|1,0,1]=4 1664 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)O 2230a_100000717746_200020645497 [0,1,1,0,0,0|1,0,1]=4 1665 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)O 269982a_100000717746_200020645497 [0,1,1,0,0,0|1,0,1]=4 1666 B17R2.6046 CCN(Cn1cncn1)c2cccc(c2)O 34a_100000717746_200020645497 [0,1,1,0,0,0|1,0,1]=4 1667 B17R2.6057 CCN(Cc1ccsc1Br)c2ccccc2 2230a_100000210013_100009814289 [0,1,1,0,0,0|2,0,0]=4 1668 B17R2.6057 CCN(Cc1ccsc1Br)c2ccccc2 269982a_100000210013_100009814289 [0,1,1,0,0,0|2,0,0]=4 1669 B17R2.6057 CCN(Cc1ccsc1Br)c2ccccc2 34a_100000210013_100009814289 [0,1,1,0,0,0|2,0,0]=4 1670 B17R2.6057 CCN(Cc1ccsc1Cl)c2ccccc2 2230a_100000210013_100010167017 [0,1,1,0,0,0|2,0,0]=4 1671 B17R2.6057 CCN(Cc1ccsc1Cl)c2ccccc2 269982a_100000210013_100010167017 [0,1,1,0,0,0|2,0,0]=4 1672 B17R2.6057 CCN(Cc1ccsc1Cl)c2ccccc2 34a_100000210013_100010167017 [0,1,1,0,0,0|2,0,0]=4 1673 B17R2.6057 CCN(Cc1nc[nH]c1C)c2ccccc2 2230a_100000210013_100000751220 [0,1,1,0,0,0|0,0,0]=2 1674 B17R2.6057 CCN(Cc1nc[nH]c1C)c2ccccc2 269982a_100000210013_100000751220 [0,1,1,0,0,0|0,0,0]=2 1675 B17R2.6057 CCN(Cc1nccn1C)c2ccccc2 2230a_100000210013_100000700302 [0,1,1,0,0,0|2,0,0]=4 1676 B17R2.6057 CCN(Cc1nccn1C)c2ccccc2 269982a_100000210013_100000700302 [0,1,1,0,0,0|2,0,0]=4 1677 B17R2.6057 CCN(Cc1nccn1C)c2ccccc2 34a_100000210013_100000700302 [0,1,1,0,0,0|2,0,0]=4 1678 B17R2.6057 CCN(Cc1ncoc1C)c2ccccc2 2230a_100000210013_200000693990 [0,1,1,0,0,0|1,0,0]=3 1679 B17R2.6057 CCN(Cc1ncoc1C)c2ccccc2 34a_100000210013_200000693990 [0,1,1,0,0,0|1,0,0]=3 1680 B17R2.6057 CCN(Cc1nnsc1Cl)c2ccccc2 2230a_100000210013_100000018852 [0,1,1,0,0,0|2,0,0]=4 1681 B17R2.6057 CCN(Cc1nnsc1Cl)c2ccccc2 269982a_100000210013_100000018852 [0,1,1,0,0,0|2,0,0]=4 1682 B17R2.6057 CCN(Cc1nonc1C)c2ccccc2 2230a_100000210013_200000044682 [0,1,1,0,0,0|1,0,1]=4 1683 B17R2.6057 CCN(Cc1nonc1C)c2ccccc2 269982a_100000210013_200000044682 [0,1,1,0,0,0|1,0,1]=4 1684 B17R2.6057 CCN(Cc1nonc1C)c2ccccc2 34a_100000210013_200000044682 [0,1,1,0,0,0|1,0,1]=4 1685 B17R2.21294 CC(C)N(Cc1c[nH]cn1)c2ccccc2 2230a_100000210572_100000707719 [0,1,1,0,0,0|0,0,0]=2 1686 B17R2.21294 CC(C)N(Cc1c[nH]cn1)c2ccccc2 269982a_100000210572_100000707719 [0,1,1,0,0,0|0,0,0]=2 1687 B17R2.21294 CC(C)N(Cc1c[nH]cn1)c2ccccc2 34a_100000210572_100000707719 [0,1,1,0,0,0|0,0,0]=2 1688 B17R2.21294 CC(C)N(Cc1ccco1)c2ccccc2 2230a_100000230375_100000210206 [0,1,1,0,0,0|2,0,0]=4 1689 B17R2.21294 CC(C)N(Cc1ccco1)c2ccccc2 269982a_100000230375_100000210206 [0,1,1,0,0,0|2,0,0]=4 1690 B17R2.21294 CC(C)N(Cc1ccco1)c2ccccc2 34a_100000230375_100000210206 [0,1,1,0,0,0|2,0,0]=4 1691 B17R2.21294 CC(C)N(Cc1ccon1)c2ccccc2 2230a_100000210572_100000234950 [0,1,1,0,0,0|2,0,0]=4 1692 B17R2.21294 CC(C)N(Cc1ccon1)c2ccccc2 269982a_100000210572_100000234950 [0,1,1,0,0,0|2,0,0]=4 1693 B17R2.21294 CC(C)N(Cc1ccon1)c2ccccc2 34a_100000210572_100000234950 [0,1,1,0,0,0|2,0,0]=4 1694 B17R2.21294 CC(C)N(Cc1ccon1)c2ccccc2 7a_100000210572_100000234950 [0,1,1,0,0,0|2,0,0]=4 1695 B17R2.21294 CC(C)N(Cc1ccsc1)c2ccccc2 2230a_100000210572_100011261437 [0,1,1,0,0,0|2,0,0]=4 1696 B17R2.21294 CC(C)N(Cc1ccsc1)c2ccccc2 269982a_100000210572_100011233845 [0,1,1,0,0,0|2,0,0]=4 1697 B17R2.21294 CC(C)N(Cc1ccsc1)c2ccccc2 34a_100000210572_100011261437 [0,1,1,0,0,0|2,0,0]=4 1698 B17R2.21294 CC(C)N(Cc1ccsc1)c2ccccc2 7a_100000210572_100011261437 [0,1,1,0,0,0|2,0,0]=4 1699 B17R2.21294 CC(C)N(Cc1cncs1)c2ccccc2 2230a_100000210572_100015185245 [0,1,1,0,0,0|1,0,1]=4 1700 B17R2.21294 CC(C)N(Cc1cncs1)c2ccccc2 269982a_100000210572_100015185245 [0,1,1,0,0,0|1,0,1]=4 1701 B17R2.21294 CC(C)N(Cc1cncs1)c2ccccc2 34a_100000210572_100015185245 [0,1,1,0,0,0|1,0,1]=4 1702 B17R2.21294 CC(C)N(Cc1cncs1)c2ccccc2 7a_100000210572_100015185245 [0,1,1,0,0,0|1,0,1]=4 1703 B17R2.21294 CC(C)N(Cc1cscn1)c2ccccc2 2230a_100000210572_100000205941 [0,1,1,0,0,0|1,0,0]=3 1704 B17R2.21294 CC(C)N(Cc1cscn1)c2ccccc2 269982a_100000210572_100000205941 [0,1,1,0,0,0|1,0,0]=3 1705 B17R2.21294 CC(C)N(Cc1cscn1)c2ccccc2 34a_100000210572_100000205941 [0,1,1,0,0,0|1,0,0]=3 1706 B17R2.21294 CC(C)N(Cc1cscn1)c2ccccc2 7a_100000210572_100000205941 [0,1,1,0,0,0|1,0,0]=3 1707 B17R2.21294 CC(C)N(Cc1ncc[nH]1)c2ccccc2 2230a_100000210572_100016991755 [0,1,1,0,0,0|2,0,0]=4 1708 B17R2.21294 CC(C)N(Cc1ncc[nH]1)c2ccccc2 269982a_100000210572_100016991755 [0,1,1,0,0,0|2,0,0]=4 1709 B17R2.21294 CC(C)N(Cc1ncc[nH]1)c2ccccc2 34a_100000210572_100016991755 [0,1,1,0,0,0|2,0,0]=4 1710 B17R2.21294 CC(C)N(Cc1ncc[nH]1)c2ccccc2 7a_100000210572_100000753453 [0,1,1,0,0,0|2,0,0]=4 1711 B17R2.21294 CC(C)N(Cc1ncco1)c2ccccc2 2230a_100000210572_103436540062 [0,1,1,0,0,0|2,0,0]=4 1712 B17R2.21294 CC(C)N(Cc1ncco1)c2ccccc2 269982a_100000210572_103436540062 [0,1,1,0,0,0|2,0,0]=4 1713 B17R2.21294 CC(C)N(Cc1ncco1)c2ccccc2 34a_100000210572_103436540062 [0,1,1,0,0,0|2,0,0]=4 1714 B17R2.21294 CC(C)N(Cc1ncco1)c2ccccc2 7a_100000210572_103436540062 [0,1,1,0,0,0|2,0,0]=4 1715 B17R2.21294 CC(C)N(Cc1nccs1)c2ccccc2 2230a_100000210572_100015184050 [0,1,1,0,0,0|2,0,0]=4 1716 B17R2.21294 CC(C)N(Cc1nccs1)c2ccccc2 269982a_100000210572_100015184050 [0,1,1,0,0,0|2,0,0]=4 1717 B17R2.21294 CC(C)N(Cc1nccs1)c2ccccc2 34a_100000210572_100015184050 [0,1,1,0,0,0|2,0,0]=4 1718 B17R2.21294 CC(C)N(Cc1nccs1)c2ccccc2 7a_100000210572_100015184050 [0,1,1,0,0,0|2,0,0]=4 1719 B17R2.21294 CC(C)N(Cc1ncon1)c2ccccc2 269982a_100000210572_100000233494 [0,1,1,0,0,0|2,0,0]=4 1720 B17R2.21294 CC(C)N(Cc1ncon1)c2ccccc2 34a_100000210572_100000233494 [0,1,1,0,0,0|2,0,0]=4 1721 B17R2.21294 CC(C)N(Cn1cncn1)c2ccccc2 2230a_100000210572_200020645497 [0,1,1,0,0,0|1,0,1]=4 1722 B17R2.21294 CC(C)N(Cn1cncn1)c2ccccc2 269982a_100000210572_200020645497 [0,1,1,0,0,0|1,0,1]=4 1723 B17R2.21294 CC(C)N(Cn1cncn1)c2ccccc2 34a_100000210572_200020645497 [0,1,1,0,0,0|1,0,1]=4 1724 B17R2.21294 CC(C)N(Cn1cncn1)c2ccccc2 7a_100000210572_200020645497 [0,1,1,0,0,0|1,0,1]=4 1725 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2Br 2230a_114873767003_100000707719 [0,1,1,0,0,0|0,0,0]=2 1726 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2Br 269982a_114873767003_100000707719 [0,1,1,0,0,0|0,0,0]=2 1727 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2Br 34a_114873767003_100000707719 [0,1,1,0,0,0|0,0,0]=2 1728 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2C 2230a_100000211084_100000707719 [0,1,1,0,0,0|0,0,0]=2 1729 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2C 269982a_100000211084_100000707719 [0,1,1,0,0,0|0,0,0]=2 1730 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2C 34a_100000211084_100000707719 [0,1,1,0,0,0|0,0,0]=2 1731 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2F 2230a_100000220365_100000707719 [0,1,1,0,0,0|0,0,0]=2 1732 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2F 269982a_100000220365_100000707719 [0,1,1,0,0,0|0,0,0]=2 1733 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2F 34a_100000220365_100000707719 [0,1,1,0,0,0|0,0,0]=2 1734 B17R2.48520 CCN(Cc1c[nH]cn1)c2ccccc2O 269982a_103624766699_100000707719 [0,1,1,0,0,0|0,0,0]=2 1735 B17R2.48520 CCN(Cc1ccon1)c2ccccc2Br 2230a_114873767003_100000234950 [0,1,1,0,0,0|2,0,0]=4 1736 B17R2.48520 CCN(Cc1ccon1)c2ccccc2Br 269982a_114873767003_100000234950 [0,1,1,0,0,0|2,0,0]=4 1737 B17R2.48520 CCN(Cc1ccon1)c2ccccc2Br 34a_114873767003_100000234950 [0,1,1,0,0,0|2,0,0]=4 1738 B17R2.48520 CCN(Cc1ccon1)c2ccccc2C 2230a_100000211084_100000234950 [0,1,1,0,0,0|2,0,0]=4 1739 B17R2.48520 CCN(Cc1ccon1)c2ccccc2C 269982a_100000211084_100000234950 [0,1,1,0,0,0|2,0,0]=4 1740 B17R2.48520 CCN(Cc1ccon1)c2ccccc2C 34a_100000211084_100000234950 [0,1,1,0,0,0|2,0,0]=4 1741 B17R2.48520 CCN(Cc1ccon1)c2ccccc2F 2230a_100000220365_100000234950 [0,1,1,0,0,0|2,0,0]=4 1742 B17R2.48520 CCN(Cc1ccon1)c2ccccc2F 269982a_100000220365_100000234950 [0,1,1,0,0,0|2,0,0]=4 1743 B17R2.48520 CCN(Cc1ccon1)c2ccccc2F 34a_100000220365_100000234950 [0,1,1,0,0,0|2,0,0]=4 1744 B17R2.48520 CCN(Cc1ccon1)c2ccccc2O 269982a_103624766699_100000234950 [0,1,1,0,0,0|2,0,0]=4 1745 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2Br 2230a_114873767003_100011261437 [0,1,1,0,0,0|2,0,0]=4 1746 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2Br 269982a_114873767003_100011233845 [0,1,1,0,0,0|2,0,0]=4 1747 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2Br 34a_114873767003_100011261437 [0,1,1,0,0,0|2,0,0]=4 1748 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2C 2230a_100000211084_100011261437 [0,1,1,0,0,0|2,0,0]=4 1749 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2C 269982a_100000211084_100011233845 [0,1,1,0,0,0|2,0,0]=4 1750 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2C 34a_100000211084_100011261437 [0,1,1,0,0,0|2,0,0]=4 1751 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2F 2230a_100000220365_100011261437 [0,1,1,0,0,0|2,0,0]=4 1752 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2F 269982a_100000220365_100011233845 [0,1,1,0,0,0|2,0,0]=4 1753 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2F 34a_100000220365_100011261437 [0,1,1,0,0,0|2,0,0]=4 1754 B17R2.48520 CCN(Cc1ccsc1)c2ccccc2O 269982a_103624766699_100011233845 [0,1,1,0,0,0|2,0,0]=4 1755 B17R2.48520 CCN(Cc1cncs1)c2ccccc2Br 2230a_114873767003_100015185245 [0,1,1,0,0,0|1,0,1]=4 1756 B17R2.48520 CCN(Cc1cncs1)c2ccccc2Br 269982a_114873767003_100015185245 [0,1,1,0,0,0|1,0,1]=4 1757 B17R2.48520 CCN(Cc1cncs1)c2ccccc2Br 34a_114873767003_100015185245 [0,1,1,0,0,0|1,0,1]=4 1758 B17R2.48520 CCN(Cc1cncs1)c2ccccc2C 2230a_100000211084_100015185245 [0,1,1,0,0,0|1,0,1]=4 1759 B17R2.48520 CCN(Cc1cncs1)c2ccccc2C 269982a_100000211084_100015185245 [0,1,1,0,0,0|1,0,1]=4 1760 B17R2.48520 CCN(Cc1cncs1)c2ccccc2C 34a_100000211084_100015185245 [0,1,1,0,0,0|1,0,1]=4 1761 B17R2.48520 CCN(Cc1cncs1)c2ccccc2F 2230a_100000220365_100015185245 [0,1,1,0,0,0|1,0,1]=4 1762 B17R2.48520 CCN(Cc1cncs1)c2ccccc2F 269982a_100000220365_100015185245 [0,1,1,0,0,0|1,0,1]=4 1763 B17R2.48520 CCN(Cc1cncs1)c2ccccc2F 34a_100000220365_100015185245 [0,1,1,0,0,0|1,0,1]=4 1764 B17R2.48520 CCN(Cc1cncs1)c2ccccc2O 269982a_103624766699_100015185245 [0,1,1,0,0,0|1,0,1]=4 1765 B17R2.48520 CCN(Cc1cscn1)c2ccccc2Br 2230a_114873767003_100000205941 [0,1,1,0,0,0|1,0,0]=3 1766 B17R2.48520 CCN(Cc1cscn1)c2ccccc2Br 269982a_114873767003_100000205941 [0,1,1,0,0,0|1,0,0]=3 1767 B17R2.48520 CCN(Cc1cscn1)c2ccccc2Br 34a_114873767003_100000205941 [0,1,1,0,0,0|1,0,0]=3 1768 B17R2.48520 CCN(Cc1cscn1)c2ccccc2C 2230a_100000211084_100000205941 [0,1,1,0,0,0|1,0,0]=3 1769 B17R2.48520 CCN(Cc1cscn1)c2ccccc2C 269982a_100000211084_100000205941 [0,1,1,0,0,0|1,0,0]=3 1770 B17R2.48520 CCN(Cc1cscn1)c2ccccc2C 34a_100000211084_100000205941 [0,1,1,0,0,0|1,0,0]=3 1771 B17R2.48520 CCN(Cc1cscn1)c2ccccc2F 2230a_100000220365_100000205941 [0,1,1,0,0,0|1,0,0]=3 1772 B17R2.48520 CCN(Cc1cscn1)c2ccccc2F 269982a_100000220365_100000205941 [0,1,1,0,0,0|1,0,0]=3 1773 B17R2.48520 CCN(Cc1cscn1)c2ccccc2F 34a_100000220365_100000205941 [0,1,1,0,0,0|1,0,0]=3 1774 B17R2.48520 CCN(Cc1cscn1)c2ccccc2O 269982a_103624766699_100000205941 [0,1,1,0,0,0|1,0,0]=3 1775 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2Br 2230a_114873767003_100016991755 [0,1,1,0,0,0|2,0,0]=4 1776 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2Br 269982a_114873767003_100016991755 [0,1,1,0,0,0|2,0,0]=4 1777 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2Br 34a_114873767003_100016991755 [0,1,1,0,0,0|2,0,0]=4 1778 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2C 2230a_100000211084_100016991755 [0,1,1,0,0,0|2,0,0]=4 1779 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2C 269982a_100000211084_100016991755 [0,1,1,0,0,0|2,0,0]=4 1780 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2C 34a_100000211084_100016991755 [0,1,1,0,0,0|2,0,0]=4 1781 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2F 2230a_100000220365_100016991755 [0,1,1,0,0,0|2,0,0]=4 1782 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2F 269982a_100000220365_100016991755 [0,1,1,0,0,0|2,0,0]=4 1783 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2F 34a_100000220365_100016991755 [0,1,1,0,0,0|2,0,0]=4 1784 B17R2.48520 CCN(Cc1ncc[nH]1)c2ccccc2O 269982a_103624766699_100016991755 [0,1,1,0,0,0|2,0,0]=4 1785 B17R2.48520 CCN(Cc1ncco1)c2ccccc2Br 2230a_114873767003_103436540062 [0,1,1,0,0,0|2,0,0]=4 1786 B17R2.48520 CCN(Cc1ncco1)c2ccccc2Br 269982a_114873767003_103436540062 [0,1,1,0,0,0|2,0,0]=4 1787 B17R2.48520 CCN(Cc1ncco1)c2ccccc2Br 34a_114873767003_103436540062 [0,1,1,0,0,0|2,0,0]=4 1788 B17R2.48520 CCN(Cc1ncco1)c2ccccc2C 2230a_100000211084_103436540062 [0,1,1,0,0,0|2,0,0]=4 1789 B17R2.48520 CCN(Cc1ncco1)c2ccccc2C 269982a_100000211084_103436540062 [0,1,1,0,0,0|2,0,0]=4 1790 B17R2.48520 CCN(Cc1ncco1)c2ccccc2C 34a_100000211084_103436540062 [0,1,1,0,0,0|2,0,0]=4 1791 B17R2.48520 CCN(Cc1ncco1)c2ccccc2F 2230a_100000220365_103436540062 [0,1,1,0,0,0|2,0,0]=4 1792 B17R2.48520 CCN(Cc1ncco1)c2ccccc2F 269982a_100000220365_103436540062 [0,1,1,0,0,0|2,0,0]=4 1793 B17R2.48520 CCN(Cc1ncco1)c2ccccc2F 34a_100000220365_103436540062 [0,1,1,0,0,0|2,0,0]=4 1794 B17R2.48520 CCN(Cc1ncco1)c2ccccc2O 269982a_103624766699_103436540062 [0,1,1,0,0,0|2,0,0]=4 1795 B17R2.48520 CCN(Cc1nccs1)c2ccccc2Br 2230a_114873767003_100015184050 [0,1,1,0,0,0|2,0,0]=4 1796 B17R2.48520 CCN(Cc1nccs1)c2ccccc2Br 269982a_114873767003_100015184050 [0,1,1,0,0,0|2,0,0]=4 1797 B17R2.48520 CCN(Cc1nccs1)c2ccccc2Br 34a_114873767003_100015184050 [0,1,1,0,0,0|2,0,0]=4 1798 B17R2.48520 CCN(Cc1nccs1)c2ccccc2C 2230a_100000211084_100015184050 [0,1,1,0,0,0|2,0,0]=4 1799 B17R2.48520 CCN(Cc1nccs1)c2ccccc2C 269982a_100000211084_100015184050 [0,1,1,0,0,0|2,0,0]=4 1800 B17R2.48520 CCN(Cc1nccs1)c2ccccc2C 34a_100000211084_100015184050 [0,1,1,0,0,0|2,0,0]=4 1801 B17R2.48520 CCN(Cc1nccs1)c2ccccc2F 2230a_100000220365_100015184050 [0,1,1,0,0,0|2,0,0]=4 1802 B17R2.48520 CCN(Cc1nccs1)c2ccccc2F 269982a_100000220365_100015184050 [0,1,1,0,0,0|2,0,0]=4 1803 B17R2.48520 CCN(Cc1nccs1)c2ccccc2F 34a_100000220365_100015184050 [0,1,1,0,0,0|2,0,0]=4 1804 B17R2.48520 CCN(Cc1nccs1)c2ccccc2O 269982a_103624766699_100015184050 [0,1,1,0,0,0|2,0,0]=4 1805 B17R2.48520 CCN(Cc1ncon1)c2ccccc2Br 269982a_114873767003_100000233494 [0,1,1,0,0,0|2,0,0]=4 1806 B17R2.48520 CCN(Cc1ncon1)c2ccccc2Br 34a_114873767003_100000233494 [0,1,1,0,0,0|2,0,0]=4 1807 B17R2.48520 CCN(Cc1ncon1)c2ccccc2C 269982a_100000211084_100000233494 [0,1,1,0,0,0|2,0,0]=4 1808 B17R2.48520 CCN(Cc1ncon1)c2ccccc2C 34a_100000211084_100000233494 [0,1,1,0,0,0|2,0,0]=4 1809 B17R2.48520 CCN(Cc1ncon1)c2ccccc2F 269982a_100000220365_100000233494 [0,1,1,0,0,0|2,0,0]=4 1810 B17R2.48520 CCN(Cc1ncon1)c2ccccc2F 34a_100000220365_100000233494 [0,1,1,0,0,0|2,0,0]=4 1811 B17R2.48520 CCN(Cc1ncon1)c2ccccc2O 269982a_103624766699_100000233494 [0,1,1,0,0,0|2,0,0]=4 1812 B17R2.48520 CCN(Cn1cncn1)c2ccccc2Br 2230a_114873767003_200020645497 [0,1,1,0,0,0|1,0,1]=4 1813 B17R2.48520 CCN(Cn1cncn1)c2ccccc2Br 269982a_114873767003_200020645497 [0,1,1,0,0,0|1,0,1]=4 1814 B17R2.48520 CCN(Cn1cncn1)c2ccccc2Br 34a_114873767003_200020645497 [0,1,1,0,0,0|1,0,1]=4 1815 B17R2.48520 CCN(Cn1cncn1)c2ccccc2C 2230a_100000211084_200020645497 [0,1,1,0,0,0|1,0,1]=4 1816 B17R2.48520 CCN(Cn1cncn1)c2ccccc2C 269982a_100000211084_200020645497 [0,1,1,0,0,0|1,0,1]=4 1817 B17R2.48520 CCN(Cn1cncn1)c2ccccc2C 34a_100000211084_200020645497 [0,1,1,0,0,0|1,0,1]=4 1818 B17R2.48520 CCN(Cn1cncn1)c2ccccc2F 2230a_100000220365_200020645497 [0,1,1,0,0,0|1,0,1]=4 1819 B17R2.48520 CCN(Cn1cncn1)c2ccccc2F 269982a_100000220365_200020645497 [0,1,1,0,0,0|1,0,1]=4 1820 B17R2.48520 CCN(Cn1cncn1)c2ccccc2F 34a_100000220365_200020645497 [0,1,1,0,0,0|1,0,1]=4 1821 B17R2.48520 CCN(Cn1cncn1)c2ccccc2O 269982a_103624766699_200020645497 [0,1,1,0,0,0|1,0,1]=4 1822 B17R2.1057 C#Cc1ccccc1NCc2cn(cn2)C 34a_100011470550_100000717665 [0,1,1,0,0,0|0,0,2]=4 1823 B17R2.1057 C=Cc1ccccc1NCc2c[nH]c(n2)C 207a_100012022501_100011219055 [0,1,1,0,0,0|0,0,2]=4 1824 B17R2.1057 C=Cc1ccccc1NCc2cn(cn2)C 207a_100012022501_100000684808 [0,1,1,0,0,0|0,0,2]=4 1825 B17R2.1057 C=Cc1ccccc1NCc2cn(cn2)C 34a_100012022501_100000717665 [0,1,1,0,0,0|0,0,2]=4 1826 B17R2.1057 CCc1ccccc1NCc2c[nH]c(n2)C 207a_100000212081_100011219055 [0,1,1,0,0,0|0,0,0]=2 1827 B17R2.1057 CCc1ccccc1NCc2cc(co2)Br 270302a_100000212081_100000747035 [0,1,1,0,0,0|2,0,0]=4 1828 B17R2.1057 CCc1ccccc1NCc2cc(cs2)Br 207a_100000212081_100000211722 [0,1,1,0,0,0|2,0,0]=4 1829 B17R2.1057 CCc1ccccc1NCc2cc(cs2)Br 2230a_100000212081_100000746031 [0,1,1,0,0,0|2,0,0]=4 1830 B17R2.1057 CCc1ccccc1NCc2cc(cs2)Br 270302a_100000212081_100000211722 [0,1,1,0,0,0|2,0,0]=4 1831 B17R2.1057 CCc1ccccc1NCc2cc(cs2)Br 34a_100000212081_100000746031 [0,1,1,0,0,0|2,0,0]=4 1832 B17R2.1057 CCc1ccccc1NCc2cc(cs2)Br 7a_100000212081_100000746031 [0,1,1,0,0,0|2,0,0]=4 1833 B17R2.1057 CCc1ccccc1NCc2cc(cs2)C 207a_100000212081_100102525248 [0,1,1,0,0,0|2,0,0]=4 1834 B17R2.1057 CCc1ccccc1NCc2cc(cs2)C 270302a_100000212081_100102525248 [0,1,1,0,0,0|2,0,0]=4 1835 B17R2.1057 CCc1ccccc1NCc2cc(cs2)Cl 207a_100000212081_100000102487 [0,1,1,0,0,0|2,0,0]=4 1836 B17R2.1057 CCc1ccccc1NCc2cc(cs2)Cl 270302a_100000212081_100000102487 [0,1,1,0,0,0|2,0,0]=4 1837 B17R2.1057 CCc1ccccc1NCc2cc(cs2)I 207a_100000212081_100010179861 [0,1,1,0,0,0|2,0,0]=4 1838 B17R2.1057 CCc1ccccc1NCc2cc(cs2)I 270302a_100000212081_100010179861 [0,1,1,0,0,0|2,0,0]=4 1839 B17R2.1057 CCc1ccccc1NCc2cc(on2)C 207a_100000212081_100011217994 [0,1,1,0,0,0|2,0,0]=4 1840 B17R2.1057 CCc1ccccc1NCc2cc(on2)C 2230a_100000212081_100000199038 [0,1,1,0,0,0|2,0,0]=4 1841 B17R2.1057 CCc1ccccc1NCc2cc(on2)C 34a_100000212081_100000199038 [0,1,1,0,0,0|2,0,0]=4 1842 B17R2.1057 CCc1ccccc1NCc2cc(on2)C 7a_100000212081_100000199038 [0,1,1,0,0,0|2,0,0]=4 1843 B17R2.1057 CCc1ccccc1NCc2cc(sn2)C 207a_100000212081_200000100279 [0,1,1,0,0,0|2,0,0]=4 1844 B17R2.1057 CCc1ccccc1NCc2cc(sn2)C 270302a_100000212081_200000100279 [0,1,1,0,0,0|2,0,0]=4 1845 B17R2.1057 CCc1ccccc1NCc2ccc(o2)Br 207a_100000212081_100000185145 [0,1,1,0,0,0|2,0,0]=4 1846 B17R2.1057 CCc1ccccc1NCc2ccc(o2)C 207a_100000212081_100000183696 [0,1,1,0,0,0|2,0,0]=4 1847 B17R2.1057 CCc1ccccc1NCc2ccc(o2)C 270302a_100000212081_100000183696 [0,1,1,0,0,0|2,0,0]=4 1848 B17R2.1057 CCc1ccccc1NCc2ccc(o2)Cl 207a_100000212081_100000188459 [0,1,1,0,0,0|2,0,0]=4 1849 B17R2.1057 CCc1ccccc1NCc2ccc(o2)I 207a_100000212081_100000186757 [0,1,1,0,0,0|2,0,0]=4 1850 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Br 207a_100000212081_100000179771 [0,1,1,0,0,0|2,0,0]=4 1851 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Br 2230a_100000212081_100000708592 [0,1,1,0,0,0|2,0,0]=4 1852 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Br 270302a_100000212081_100000179771 [0,1,1,0,0,0|2,0,0]=4 1853 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Br 34a_100000212081_100000708592 [0,1,1,0,0,0|2,0,0]=4 1854 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Br 7a_100000212081_100000708592 [0,1,1,0,0,0|2,0,0]=4 1855 B17R2.1057 CCc1ccccc1NCc2ccc(s2)C 207a_100000212081_100000211121 [0,1,1,0,0,0|2,0,0]=4 1856 B17R2.1057 CCc1ccccc1NCc2ccc(s2)C 270302a_100000212081_100000211121 [0,1,1,0,0,0|2,0,0]=4 1857 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Cl 207a_100000212081_100000242774 [0,1,1,0,0,0|2,0,0]=4 1858 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Cl 2230a_100000212081_100000185097 [0,1,1,0,0,0|2,0,0]=4 1859 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Cl 270302a_100000212081_100000242774 [0,1,1,0,0,0|2,0,0]=4 1860 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Cl 34a_100000212081_100000185097 [0,1,1,0,0,0|2,0,0]=4 1861 B17R2.1057 CCc1ccccc1NCc2ccc(s2)Cl 7a_100000212081_100000185097 [0,1,1,0,0,0|2,0,0]=4 1862 B17R2.1057 CCc1ccccc1NCc2ccn(n2)C 207a_100000212081_100000750880 [0,1,1,0,0,0|2,0,0]=4 1863 B17R2.1057 CCc1ccccc1NCc2ccn(n2)C 2230a_100000212081_100000726502 [0,1,1,0,0,0|2,0,0]=4 1864 B17R2.1057 CCc1ccccc1NCc2ccn(n2)C 270302a_100000212081_100000750880 [0,1,1,0,0,0|2,0,0]=4 1865 B17R2.1057 CCc1ccccc1NCc2ccn(n2)C 34a_100000212081_100000726502 [0,1,1,0,0,0|2,0,0]=4 1866 B17R2.1057 CCc1ccccc1NCc2ccn(n2)C 7a_100000212081_100000726502 [0,1,1,0,0,0|2,0,0]=4 1867 B17R2.1057 CCc1ccccc1NCc2cn(cn2)C 207a_100000212081_100000684808 [0,1,1,0,0,0|0,0,0]=2 1868 B17R2.1057 CCc1ccccc1NCc2cn(cn2)C 2230a_100000212081_100000717665 [0,1,1,0,0,0|0,0,0]=2 1869 B17R2.1057 CCc1ccccc1NCc2cn(cn2)C 34a_100000212081_100000717665 [0,1,1,0,0,0|0,0,0]=2 1870 B17R2.1057 CCc1ccccc1NCc2cn(cn2)C 7a_100000212081_100000717665 [0,1,1,0,0,0|0,0,0]=2 1871 B17R2.1057 CCc1ccccc1NCc2cn(nn2)C 207a_100000212081_100000749909 [0,1,1,0,0,0|1,0,0]=3 1872 B17R2.1057 CCc1ccccc1NCc2cnc(o2)C 207a_100000212081_100000084308 [0,1,1,0,0,0|1,0,1]=4 1873 B17R2.1057 CCc1ccccc1NCc2cnc(o2)C 270302a_100000212081_100000084308 [0,1,1,0,0,0|1,0,1]=4 1874 B17R2.1057 CCc1ccccc1NCc2cnc(s2)Br 2230a_100000212081_100000717027 [0,1,1,0,0,0|1,0,1]=4 1875 B17R2.1057 CCc1ccccc1NCc2cnc(s2)Br 34a_100000212081_100000717027 [0,1,1,0,0,0|1,0,1]=4 1876 B17R2.1057 CCc1ccccc1NCc2cnc(s2)Br 7a_100000212081_100000717027 [0,1,1,0,0,0|1,0,1]=4 1877 B17R2.1057 CCc1ccccc1NCc2cnc(s2)C 207a_100000212081_100000740557 [0,1,1,0,0,0|1,0,1]=4 1878 B17R2.1057 CCc1ccccc1NCc2cnc(s2)C 2230a_100000212081_100020635045 [0,1,1,0,0,0|1,0,1]=4 1879 B17R2.1057 CCc1ccccc1NCc2cnc(s2)C 34a_100000212081_100020635045 [0,1,1,0,0,0|1,0,1]=4 1880 B17R2.1057 CCc1ccccc1NCc2cnc(s2)C 7a_100000212081_100020635045 [0,1,1,0,0,0|1,0,1]=4 1881 B17R2.1057 CCc1ccccc1NCc2cnc(s2)Cl 2230a_100000212081_100000058068 [0,1,1,0,0,0|1,0,1]=4 1882 B17R2.1057 CCc1ccccc1NCc2cnc(s2)Cl 34a_100000212081_100000058068 [0,1,1,0,0,0|1,0,1]=4 1883 B17R2.1057 CCc1ccccc1NCc2cnc(s2)Cl 7a_100000212081_100000058068 [0,1,1,0,0,0|1,0,1]=4 1884 B17R2.1057 CCc1ccccc1NCc2cnn(c2)C 207a_100000212081_100000206001 [0,1,1,0,0,0|2,0,0]=4 1885 B17R2.1057 CCc1ccccc1NCc2cnn(c2)C 2230a_100000212081_100000744441 [0,1,1,0,0,0|2,0,0]=4 1886 B17R2.1057 CCc1ccccc1NCc2cnn(c2)C 270302a_100000212081_100000206001 [0,1,1,0,0,0|2,0,0]=4 1887 B17R2.1057 CCc1ccccc1NCc2cnn(c2)C 34a_100000212081_100000744441 [0,1,1,0,0,0|2,0,0]=4 1888 B17R2.1057 CCc1ccccc1NCc2cnn(c2)C 7a_100000212081_100000744441 [0,1,1,0,0,0|2,0,0]=4 1889 B17R2.1057 CCc1ccccc1NCc2coc(n2)C 207a_100000212081_100011361629 [0,1,1,0,0,0|1,0,0]=3 1890 B17R2.1057 CCc1ccccc1NCc2csc(c2)Br 207a_100000212081_100000737087 [0,1,1,0,0,0|2,0,0]=4 1891 B17R2.1057 CCc1ccccc1NCc2csc(c2)Br 270302a_100000212081_100000737087 [0,1,1,0,0,0|2,0,0]=4 1892 B17R2.1057 CCc1ccccc1NCc2csc(c2)C 207a_100000212081_100011998532 [0,1,1,0,0,0|2,0,0]=4 1893 B17R2.1057 CCc1ccccc1NCc2csc(c2)C 270302a_100000212081_100011998532 [0,1,1,0,0,0|2,0,0]=4 1894 B17R2.1057 CCc1ccccc1NCc2csc(c2)Cl 207a_100000212081_100009844934 [0,1,1,0,0,0|2,0,0]=4 1895 B17R2.1057 CCc1ccccc1NCc2csc(c2)Cl 270302a_100000212081_100009844934 [0,1,1,0,0,0|2,0,0]=4 1896 B17R2.1057 CCc1ccccc1NCc2csc(n2)C 207a_100000212081_100000203724 [0,1,1,0,0,0|1,0,0]=3 1897 B17R2.1057 CCc1ccccc1NCc2csc(n2)C 2230a_100000212081_100015186478 [0,1,1,0,0,0|1,0,0]=3 1898 B17R2.1057 CCc1ccccc1NCc2csc(n2)C 270302a_100000212081_100000203724 [0,1,1,0,0,0|1,0,0]=3 1899 B17R2.1057 CCc1ccccc1NCc2csc(n2)C 34a_100000212081_100015186478 [0,1,1,0,0,0|1,0,0]=3 1900 B17R2.1057 CCc1ccccc1NCc2csc(n2)C 7a_100000212081_100015186478 [0,1,1,0,0,0|1,0,0]=3 1901 B17R2.1057 CCc1ccccc1NCc2csc(n2)Cl 2230a_100000212081_100000024076 [0,1,1,0,0,0|1,0,0]=3 1902 B17R2.1057 CCc1ccccc1NCc2csc(n2)Cl 34a_100000212081_100000024076 [0,1,1,0,0,0|1,0,0]=3 1903 B17R2.1057 CCc1ccccc1NCc2csc(n2)Cl 7a_100000212081_100000024076 [0,1,1,0,0,0|1,0,0]=3 1904 B17R2.1057 CCc1ccccc1NCc2n[nH]c(=O)[nH]2 2230a_100000212081_100000754189 [0,1,1,0,0,0|1,0,1]=4 1905 B17R2.1057 CCc1ccccc1NCc2n[nH]c(=O)[nH]2 7a_100000212081_100000754189 [0,1,1,0,0,0|1,0,1]=4 1906 B17R2.1057 CCc1ccccc1NCc2nc(c[nH]2)C 207a_100000212081_100000082322 [0,1,1,0,0,0|2,0,0]=4 1907 B17R2.1057 CCc1ccccc1NCc2nc(cs2)C 207a_100000212081_100000756994 [0,1,1,0,0,0|2,0,0]=4 1908 B17R2.1057 CCc1ccccc1NCc2nc(no2)C 2230a_100000212081_100000735555 [0,1,1,0,0,0|1,0,1]=4 1909 B17R2.1057 CCc1ccccc1NCc2nc(no2)C 34a_100000212081_100000735555 [0,1,1,0,0,0|1,0,1]=4 1910 B17R2.1057 CCc1ccccc1NCc2nc(no2)C 7a_100000212081_100000735555 [0,1,1,0,0,0|1,0,1]=4 1911 B17R2.1057 CCc1ccccc1NCc2ncc(s2)Br 270302a_100000212081_100000699580 [0,1,1,0,0,0|2,0,0]=4 1912 B17R2.1057 CCc1ccccc1NCc2ncc(s2)C 207a_100000212081_100011361622 [0,1,1,0,0,0|2,0,0]=4 1913 B17R2.1057 CCc1ccccc1NCc2ncc(s2)C 270302a_100000212081_100011361622 [0,1,1,0,0,0|2,0,0]=4 1914 B17R2.1057 CCc1ccccc1NCc2ncc(s2)Cl 270302a_100000212081_100000699884 [0,1,1,0,0,0|2,0,0]=4 1915 B17R2.1057 CCc1ccccc1NCc2ncn(n2)C 207a_100000212081_100010630104 [0,1,1,0,0,0|1,0,0]=3 1916 B17R2.1057 CCc1ccccc1NCc2ncn(n2)C 2230a_100000212081_100016995526 [0,1,1,0,0,0|1,0,0]=3 1917 B17R2.1057 CCc1ccccc1NCc2ncn(n2)C 34a_100000212081_100016995526 [0,1,1,0,0,0|1,0,0]=3 1918 B17R2.1057 CCc1ccccc1NCc2ncn(n2)C 7a_100000212081_100016995526 [0,1,1,0,0,0|1,0,0]=3 1919 B17R2.1057 CCc1ccccc1NCc2noc(n2)C 2230a_100000212081_100000231061 [0,1,1,0,0,0|2,0,0]=4 1920 B17R2.1057 CCc1ccccc1NCc2noc(n2)C 34a_100000212081_100000231061 [0,1,1,0,0,0|2,0,0]=4 1921 B17R2.1057 CCc1ccccc1NCc2noc(n2)C 7a_100000212081_100000231061 [0,1,1,0,0,0|2,0,0]=4 1922 B17R2.1057 CCc1ccccc1NCc2nsc(n2)Cl 2230a_100000212081_100000043760 [0,1,1,0,0,0|2,0,0]=4 1923 B17R2.1057 CCc1ccccc1NCc2nsc(n2)Cl 34a_100000212081_100000043760 [0,1,1,0,0,0|2,0,0]=4 1924 B17R2.1057 CCc1ccccc1OCc2cn(cn2)C 34a_100000210936_100000717665 [0,1,1,0,0,0|1,0,0]=3 1925 B17R2.1057 CCc1ccccc1OCc2cn(cn2)C 7a_100000210936_100000717665 [0,1,1,0,0,0|1,0,0]=3 1926 B17R2.1057 CCc1ccccc1OCc2csc(n2)C 34a_100000210936_100015186478 [0,1,1,0,0,0|2,0,0]=4 1927 B17R2.1057 CCc1ccccc1OCc2csc(n2)C 7a_100000210936_100015186478 [0,1,1,0,0,0|2,0,0]=4 1928 B17R2.1057 CCc1ccccc1OCc2csc(n2)Cl 34a_100000210936_100000024076 [0,1,1,0,0,0|2,0,0]=4 1929 B17R2.1057 CCc1ccccc1OCc2csc(n2)Cl 7a_100000210936_100000024076 [0,1,1,0,0,0|2,0,0]=4 1930 B17R2.1057 CCc1ccccc1OCc2ncn(n2)C 34a_100000210936_100016995526 [0,1,1,0,0,0|2,0,0]=4 1931 B17R2.1057 CCc1ccccc1OCc2ncn(n2)C 7a_100000210936_100016995526 [0,1,1,0,0,0|2,0,0]=4 1932 B17R2.1057 CCc1ccccc1SCc2cn(cn2)C 62a_100000717665_100011215823 [0,1,1,0,0,0|1,0,0]=3 1933 B17R2.1057 CCc1ccccc1SCc2cn(cn2)C 62a_100011215823_100000717665 [0,1,1,0,0,0|1,0,0]=3 1934 B17R2.1057 CCc1ccccc1SCc2csc(n2)C 62a_100011215823_100015186478 [0,1,1,0,0,0|2,0,0]=4 1935 B17R2.1057 CCc1ccccc1SCc2csc(n2)C 62a_100015186478_100011215823 [0,1,1,0,0,0|2,0,0]=4 1936 B17R2.1057 CCc1ccccc1SCc2csc(n2)Cl 62a_100000024076_100011215823 [0,1,1,0,0,0|2,0,0]=4 1937 B17R2.1057 CCc1ccccc1SCc2csc(n2)Cl 62a_100011215823_100000024076 [0,1,1,0,0,0|2,0,0]=4 1938 B17R2.1057 CCc1ccccc1SCc2ncn(n2)C 62a_100011215823_100016995526 [0,1,1,0,0,0|2,0,0]=4 1939 B17R2.1057 CCc1ccccc1SCc2ncn(n2)C 62a_100016995526_100011215823 [0,1,1,0,0,0|2,0,0]=4 1940 B17R2.1057 CCc1ccncc1SCc2cn(cn2)C 62a_100000717665_100009819861 [0,1,1,0,0,0|2,0,0]=4 1941 B17R2.1057 CCc1ccncc1SCc2cn(cn2)C 62a_100009819861_100000717665 [0,1,1,0,0,0|2,0,0]=4 1942 B17R2.1057 CCc1cnccc1SCc2cn(cn2)C 62a_100000717665_100025704421 [0,1,1,0,0,0|2,0,0]=4 1943 B17R2.1057 CCc1cnccc1SCc2cn(cn2)C 62a_100025704421_100000717665 [0,1,1,0,0,0|2,0,0]=4 1944 B17R2.1057 CCc1cncnc1NCc2cn(cn2)C 27a_100011834058_200000100055 [0,1,1,0,0,0|2,0,0]=4 1945 B17R2.1057 CCc1ncccc1SCc2cn(cn2)C 62a_100000717665_100009877225 [0,1,1,0,0,0|2,0,0]=4 1946 B17R2.1057 CCc1ncccc1SCc2cn(cn2)C 62a_100009877225_100000717665 [0,1,1,0,0,0|2,0,0]=4 1947 B17R2.1057 CCc1nccnc1NCc2cn(cn2)C 27a_100011834058_100011995844 [0,1,1,0,0,0|2,0,0]=4 1948 B17R2.1057 CCc1ncncc1NCc2cn(cn2)C 27a_100011834058_100009816992 [0,1,1,0,0,0|2,0,0]=4 1949 B17R2.1057 CNc1ccccc1OCc2cn(cn2)C 34a_100000033821_100000717665 [0,1,1,0,0,0|2,0,0]=4 1950 B17R2.1057 CNc1ccccc1SCc2cn(cn2)C 62a_100000717665_100020606079 [0,1,1,0,0,0|2,0,0]=4 1951 B17R2.1057 CNc1ccccc1SCc2cn(cn2)C 62a_100020606079_100000717665 [0,1,1,0,0,0|2,0,0]=4 1952 B17R2.1057 COc1ccccc1NCc2c[nH]c(n2)C 207a_100000210025_100011219055 [0,1,1,0,0,0|1,0,0]=3 1953 B17R2.1057 COc1ccccc1NCc2cn(cn2)C 207a_100000210025_100000684808 [0,1,1,0,0,0|1,0,0]=3 1954 B17R2.1057 COc1ccccc1NCc2cn(cn2)C 34a_100000210025_100000717665 [0,1,1,0,0,0|1,0,0]=3 1955 B17R2.1057 COc1ccccc1NCc2cn(nn2)C 207a_100000210025_100000749909 [0,1,1,0,0,0|2,0,0]=4 1956 B17R2.1057 COc1ccccc1NCc2coc(n2)C 207a_100000210025_100011361629 [0,1,1,0,0,0|2,0,0]=4 1957 B17R2.1057 COc1ccccc1NCc2csc(n2)C 207a_100000210025_100000203724 [0,1,1,0,0,0|2,0,0]=4 1958 B17R2.1057 COc1ccccc1NCc2csc(n2)C 270302a_100000210025_100000203724 [0,1,1,0,0,0|2,0,0]=4 1959 B17R2.1057 COc1ccccc1NCc2csc(n2)C 34a_100000210025_100015186478 [0,1,1,0,0,0|2,0,0]=4 1960 B17R2.1057 COc1ccccc1NCc2csc(n2)Cl 34a_100000210025_100000024076 [0,1,1,0,0,0|2,0,0]=4 1961 B17R2.1057 COc1ccccc1NCc2ncn(n2)C 207a_100000210025_100010630104 [0,1,1,0,0,0|2,0,0]=4 1962 B17R2.1057 COc1ccccc1NCc2ncn(n2)C 34a_100000210025_100016995526 [0,1,1,0,0,0|2,0,0]=4 1963 B17R2.1057 COc1ccccc1OCc2cn(cn2)C 34a_100000210385_100000717665 [0,1,1,0,0,0|2,0,0]=4 1964 B17R2.1057 COc1ccccc1SCc2cn(cn2)C 62a_100000210334_100000717665 [0,1,1,0,0,0|2,0,0]=4 1965 B17R2.1057 COc1ccccc1SCc2cn(cn2)C 62a_100000717665_100000210334 [0,1,1,0,0,0|2,0,0]=4 1966 B17R2.1057 CSc1ccccc1NCc2c[nH]c(n2)C 207a_100000211160_100011219055 [0,1,1,0,0,0|1,0,0]=3 1967 B17R2.1057 CSc1ccccc1NCc2cn(cn2)C 207a_100000211160_100000684808 [0,1,1,0,0,0|1,0,0]=3 1968 B17R2.1057 CSc1ccccc1NCc2cn(cn2)C 34a_100000211160_100000717665 [0,1,1,0,0,0|1,0,0]=3 1969 B17R2.1057 CSc1ccccc1NCc2cn(nn2)C 207a_100000211160_100000749909 [0,1,1,0,0,0|2,0,0]=4 1970 B17R2.1057 CSc1ccccc1NCc2coc(n2)C 207a_100000211160_100011361629 [0,1,1,0,0,0|2,0,0]=4 1971 B17R2.1057 CSc1ccccc1NCc2csc(n2)C 207a_100000211160_100000203724 [0,1,1,0,0,0|2,0,0]=4 1972 B17R2.1057 CSc1ccccc1NCc2csc(n2)C 270302a_100000211160_100000203724 [0,1,1,0,0,0|2,0,0]=4 1973 B17R2.1057 CSc1ccccc1NCc2csc(n2)C 34a_100000211160_100015186478 [0,1,1,0,0,0|2,0,0]=4 1974 B17R2.1057 CSc1ccccc1NCc2csc(n2)Cl 34a_100000211160_100000024076 [0,1,1,0,0,0|2,0,0]=4 1975 B17R2.1057 CSc1ccccc1NCc2ncn(n2)C 207a_100000211160_100010630104 [0,1,1,0,0,0|2,0,0]=4 1976 B17R2.1057 CSc1ccccc1NCc2ncn(n2)C 34a_100000211160_100016995526 [0,1,1,0,0,0|2,0,0]=4 1977 B17R2.1057 CSc1ccccc1OCc2cn(cn2)C 34a_100011216402_100000717665 [0,1,1,0,0,0|2,0,0]=4 1978 B17R2.1057 CSc1ccccc1SCc2cn(cn2)C 62a_100000717665_100011217816 [0,1,1,0,0,0|2,0,0]=4 1979 B17R2.1057 CSc1ccccc1SCc2cn(cn2)C 62a_100011217816_100000717665 [0,1,1,0,0,0|2,0,0]=4 1980 B17R2.1057 Cc1nc(c[nH]1)CNc2ccccc2CO 207a_100000212039_100011219055 [0,1,1,0,0,0|1,0,0]=3 1981 B17R2.1057 Cc1nc(co1)CNc2ccccc2CO 207a_100000212039_100011361629 [0,1,1,0,0,0|2,0,0]=4 1982 B17R2.1057 Cc1nc(cs1)CNc2ccccc2CO 207a_100000212039_100000203724 [0,1,1,0,0,0|2,0,0]=4 1983 B17R2.1057 Cc1nc(cs1)CNc2ccccc2CO 270302a_100000212039_100000203724 [0,1,1,0,0,0|2,0,0]=4 1984 B17R2.1057 Cc1nc(cs1)CNc2ccccc2CO 34a_100000212039_100015186478 [0,1,1,0,0,0|2,0,0]=4 1985 B17R2.1057 Cn1cc(nn1)CNc2ccccc2CO 207a_100000212039_100000749909 [0,1,1,0,0,0|2,0,0]=4 1986 B17R2.1057 Cn1cnc(c1)CNc2ccccc2C#N 34a_100000211148_100000717665 [0,1,1,0,0,0|1,0,1]=4 1987 B17R2.1057 Cn1cnc(c1)CNc2ccccc2CO 207a_100000212039_100000684808 [0,1,1,0,0,0|1,0,0]=3 1988 B17R2.1057 Cn1cnc(c1)CNc2ccccc2CO 34a_100000212039_100000717665 [0,1,1,0,0,0|1,0,0]=3 1989 B17R2.1057 Cn1cnc(c1)CNc2ccncc2CO 27a_100011834058_100000117392 [0,1,1,0,0,0|2,0,0]=4 1990 B17R2.1057 Cn1cnc(c1)COc2ccccc2CN 34a_100000185550_100000717665 [0,1,1,0,0,0|2,0,0]=4 1991 B17R2.1057 Cn1cnc(c1)COc2ccccc2CO 34a_100011216872_100000717665 [0,1,1,0,0,0|2,0,0]=4 1992 B17R2.1057 Cn1cnc(c1)CSc2ccccc2CN 62a_100000689332_100000717665 [0,1,1,0,0,0|2,0,0]=4 1993 B17R2.1057 Cn1cnc(c1)CSc2ccccc2CN 62a_100000717665_100000689332 [0,1,1,0,0,0|2,0,0]=4 1994 B17R2.1057 Cn1cnc(c1)CSc2ccccc2CO 62a_100000187465_100000717665 [0,1,1,0,0,0|2,0,0]=4 1995 B17R2.1057 Cn1cnc(c1)CSc2ccccc2CO 62a_100000717665_100000187465 [0,1,1,0,0,0|2,0,0]=4 1996 B17R2.1057 Cn1cnc(n1)CNc2ccccc2CO 207a_100000212039_100010630104 [0,1,1,0,0,0|2,0,0]=4 1997 B17R2.1057 Cn1cnc(n1)CNc2ccccc2CO 34a_100000212039_100016995526 [0,1,1,0,0,0|2,0,0]=4 1998 B17R2.1057 OCc1ccccc1NCc2csc(n2)Cl 34a_100000212039_100000024076 [0,1,1,0,0,0|2,0,0]=4 1999 B17R2.2749 CCc1ccccc1C(=O)Cc2c[nH]cn2 1458a_100000689120_100000707719 [0,1,1,0,0,0|1,0,0]=3 2000 B17R2.2749 CCc1ccccc1C(=O)Cc2cscn2 1458a_100000689120_100000205941 [0,1,1,0,0,0|2,0,0]=4 2001 B17R2.2749 CN(Cc1c[nH]cn1)c2ccccc2C#N 2230a_100000744078_100000707719 [0,1,1,0,0,0|1,0,1]=4 2002 B17R2.2749 CN(Cc1c[nH]cn1)c2ccccc2C#N 269982a_100000744078_100000707719 [0,1,1,0,0,0|1,0,1]=4 2003 B17R2.2749 COc1ccccc1C(=O)Cc2c[nH]cn2 1458a_100000185835_100000707719 [0,1,1,0,0,0|2,0,0]=4 2004 B17R2.2749 COc1ccccc1N(C)Cc2c[nH]cn2 2230a_100000219746_100000707719 [0,1,1,0,0,0|1,0,0]=3 2005 B17R2.2749 COc1ccccc1N(C)Cc2c[nH]cn2 269982a_100000219746_100000707719 [0,1,1,0,0,0|1,0,0]=3 2006 B17R2.2749 COc1ccccc1N(C)Cc2c[nH]cn2 34a_100000219746_100000707719 [0,1,1,0,0,0|1,0,0]=3 2007 B17R2.2749 COc1ccccc1N(C)Cc2cscn2 2230a_100000219746_100000205941 [0,1,1,0,0,0|2,0,0]=4 2008 B17R2.2749 COc1ccccc1N(C)Cc2cscn2 269982a_100000219746_100000205941 [0,1,1,0,0,0|2,0,0]=4 2009 B17R2.2749 COc1ccccc1N(C)Cc2cscn2 34a_100000219746_100000205941 [0,1,1,0,0,0|2,0,0]=4 2010 B17R2.2749 CSc1ccccc1C(=O)Cc2c[nH]cn2 1458a_100000183967_100000707719 [0,1,1,0,0,0|2,0,0]=4 2011 B17R2.2749 O=C(Cc1c[nH]cn1)c2ccccc2CO 1458a_100011301526_100000707719 [0,1,1,0,0,0|2,0,0]=4 2012 B17R2.2750 C=Cc1ccccc1NCc2nc[nH]c2C 207a_100012022501_100000032982 [0,1,1,0,0,0|0,0,2]=4 2013 B17R2.2750 CCc1ccccc1NCc2c[nH]nc2C 207a_100000212081_100000737037 [0,1,1,0,0,0|2,0,0]=4 2014 B17R2.2750 CCc1ccccc1NCc2c[nH]nc2C 270302a_100000212081_100000737037 [0,1,1,0,0,0|2,0,0]=4 2015 B17R2.2750 CCc1ccccc1NCc2ccsc2Br 207a_100000212081_100009816921 [0,1,1,0,0,0|2,0,0]=4 2016 B17R2.2750 CCc1ccccc1NCc2ccsc2Br 2230a_100000212081_100009814289 [0,1,1,0,0,0|2,0,0]=4 2017 B17R2.2750 CCc1ccccc1NCc2ccsc2Br 270302a_100000212081_100009816921 [0,1,1,0,0,0|2,0,0]=4 2018 B17R2.2750 CCc1ccccc1NCc2ccsc2Br 34a_100000212081_100009814289 [0,1,1,0,0,0|2,0,0]=4 2019 B17R2.2750 CCc1ccccc1NCc2ccsc2Br 7a_100000212081_100009814289 [0,1,1,0,0,0|2,0,0]=4 2020 B17R2.2750 CCc1ccccc1NCc2ccsc2Cl 207a_100000212081_100000089901 [0,1,1,0,0,0|2,0,0]=4 2021 B17R2.2750 CCc1ccccc1NCc2ccsc2Cl 2230a_100000212081_100010167017 [0,1,1,0,0,0|2,0,0]=4 2022 B17R2.2750 CCc1ccccc1NCc2ccsc2Cl 270302a_100000212081_100000089901 [0,1,1,0,0,0|2,0,0]=4 2023 B17R2.2750 CCc1ccccc1NCc2ccsc2Cl 34a_100000212081_100010167017 [0,1,1,0,0,0|2,0,0]=4 2024 B17R2.2750 CCc1ccccc1NCc2ccsc2Cl 7a_100000212081_100010167017 [0,1,1,0,0,0|2,0,0]=4 2025 B17R2.2750 CCc1ccccc1NCc2cncn2C 207a_100000212081_100000750899 [0,1,1,0,0,0|0,0,2]=4 2026 B17R2.2750 CCc1ccccc1NCc2cncn2C 270302a_100000212081_100000750899 [0,1,1,0,0,0|0,0,2]=4 2027 B17R2.2750 CCc1ccccc1NCc2cscc2Br 207a_100000212081_100000685484 [0,1,1,0,0,0|2,0,0]=4 2028 B17R2.2750 CCc1ccccc1NCc2cscc2Br 270302a_100000212081_100000685484 [0,1,1,0,0,0|2,0,0]=4 2029 B17R2.2750 CCc1ccccc1NCc2n[nH]cc2Cl 207a_100000212081_100000040271 [0,1,1,0,0,0|2,0,0]=4 2030 B17R2.2750 CCc1ccccc1NCc2nc[nH]c2C 207a_100000212081_100000032982 [0,1,1,0,0,0|0,0,0]=2 2031 B17R2.2750 CCc1ccccc1NCc2nc[nH]c2C 2230a_100000212081_100000751220 [0,1,1,0,0,0|0,0,0]=2 2032 B17R2.2750 CCc1ccccc1NCc2nccn2C 207a_100000212081_100000748660 [0,1,1,0,0,0|2,0,0]=4 2033 B17R2.2750 CCc1ccccc1NCc2nccn2C 2230a_100000212081_100000700302 [0,1,1,0,0,0|2,0,0]=4 2034 B17R2.2750 CCc1ccccc1NCc2nccn2C 34a_100000212081_100000700302 [0,1,1,0,0,0|2,0,0]=4 2035 B17R2.2750 CCc1ccccc1NCc2nccn2C 7a_100000212081_100000700302 [0,1,1,0,0,0|2,0,0]=4 2036 B17R2.2750 CCc1ccccc1NCc2ncoc2C 2230a_100000212081_200000693990 [0,1,1,0,0,0|1,0,0]=3 2037 B17R2.2750 CCc1ccccc1NCc2ncoc2C 34a_100000212081_200000693990 [0,1,1,0,0,0|1,0,0]=3 2038 B17R2.2750 CCc1ccccc1NCc2ncoc2C 7a_100000212081_200000693990 [0,1,1,0,0,0|1,0,0]=3 2039 B17R2.2750 CCc1ccccc1NCc2nnsc2Cl 2230a_100000212081_100000018852 [0,1,1,0,0,0|2,0,0]=4 2040 B17R2.2750 CCc1ccccc1NCc2nnsc2Cl 7a_100000212081_100000018852 [0,1,1,0,0,0|2,0,0]=4 2041 B17R2.2750 CCc1ccccc1NCc2nonc2C 2230a_100000212081_200000044682 [0,1,1,0,0,0|1,0,1]=4 2042 B17R2.2750 CCc1ccccc1NCc2nonc2C 34a_100000212081_200000044682 [0,1,1,0,0,0|1,0,1]=4 2043 B17R2.2750 CCc1ccccc1NCc2nonc2C 7a_100000212081_200000044682 [0,1,1,0,0,0|1,0,1]=4 2044 B17R2.2750 CCc1ccccc1NCc2occc2C 207a_100000212081_100000763527 [0,1,1,0,0,0|2,0,0]=4 2045 B17R2.2750 CCc1ccccc1NCc2occc2C 270302a_100000212081_100000763527 [0,1,1,0,0,0|2,0,0]=4 2046 B17R2.2750 CCc1ccccc1NCc2sccc2Br 207a_100000212081_100000766043 [0,1,1,0,0,0|2,0,0]=4 2047 B17R2.2750 CCc1ccccc1NCc2sccc2Br 270302a_100000212081_100000766043 [0,1,1,0,0,0|2,0,0]=4 2048 B17R2.2750 CCc1ccccc1NCc2sccc2C 207a_100000212081_100000210881 [0,1,1,0,0,0|2,0,0]=4 2049 B17R2.2750 CCc1ccccc1NCc2sccc2C 270302a_100000212081_100000210881 [0,1,1,0,0,0|2,0,0]=4 2050 B17R2.2750 CCc1ccccc1NCc2sccc2Cl 207a_100000212081_100000722334 [0,1,1,0,0,0|2,0,0]=4 2051 B17R2.2750 CCc1ccccc1NCc2sccc2Cl 270302a_100000212081_100000722334 [0,1,1,0,0,0|2,0,0]=4 2052 B17R2.2750 CCc1ccccc1NCc2scnc2C 207a_100000212081_100000764165 [0,1,1,0,0,0|1,0,1]=4 2053 B17R2.2750 CCc1ccccc1NCc2scnc2C 270302a_100000212081_100000764165 [0,1,1,0,0,0|1,0,1]=4 2054 B17R2.2750 CCc1ccccc1OCc2ncoc2C 34a_100000210936_200000693990 [0,1,1,0,0,0|2,0,0]=4 2055 B17R2.2750 CCc1ccccc1OCc2ncoc2C 7a_100000210936_200000693990 [0,1,1,0,0,0|2,0,0]=4 2056 B17R2.2750 CCc1ccccc1SCc2nc[nH]c2C 62a_100000751220_100011215823 [0,1,1,0,0,0|1,0,0]=3 2057 B17R2.2750 CCc1ccccc1SCc2nc[nH]c2C 62a_100011215823_100000751220 [0,1,1,0,0,0|1,0,0]=3 2058 B17R2.2750 CCc1ccccc1SCc2ncoc2C 62a_100011215823_200000693990 [0,1,1,0,0,0|2,0,0]=4 2059 B17R2.2750 CCc1ccccc1SCc2ncoc2C 62a_200000693990_100011215823 [0,1,1,0,0,0|2,0,0]=4 2060 B17R2.2750 CCc1ccncc1SCc2nc[nH]c2C 62a_100000751220_100009819861 [0,1,1,0,0,0|2,0,0]=4 2061 B17R2.2750 CCc1ccncc1SCc2nc[nH]c2C 62a_100009819861_100000751220 [0,1,1,0,0,0|2,0,0]=4 2062 B17R2.2750 CCc1cnccc1SCc2nc[nH]c2C 62a_100000751220_100025704421 [0,1,1,0,0,0|2,0,0]=4 2063 B17R2.2750 CCc1cnccc1SCc2nc[nH]c2C 62a_100025704421_100000751220 [0,1,1,0,0,0|2,0,0]=4 2064 B17R2.2750 CCc1ncccc1SCc2nc[nH]c2C 62a_100000751220_100009877225 [0,1,1,0,0,0|2,0,0]=4 2065 B17R2.2750 CCc1ncccc1SCc2nc[nH]c2C 62a_100009877225_100000751220 [0,1,1,0,0,0|2,0,0]=4 2066 B17R2.2750 CNc1ccccc1SCc2nc[nH]c2C 62a_100000751220_100020606079 [0,1,1,0,0,0|2,0,0]=4 2067 B17R2.2750 CNc1ccccc1SCc2nc[nH]c2C 62a_100020606079_100000751220 [0,1,1,0,0,0|2,0,0]=4 2068 B17R2.2750 COc1ccccc1NCc2nc[nH]c2C 207a_100000210025_100000032982 [0,1,1,0,0,0|1,0,0]=3 2069 B17R2.2750 COc1ccccc1NCc2ncoc2C 34a_100000210025_200000693990 [0,1,1,0,0,0|2,0,0]=4 2070 B17R2.2750 COc1ccccc1SCc2nc[nH]c2C 62a_100000210334_100000751220 [0,1,1,0,0,0|2,0,0]=4 2071 B17R2.2750 COc1ccccc1SCc2nc[nH]c2C 62a_100000751220_100000210334 [0,1,1,0,0,0|2,0,0]=4 2072 B17R2.2750 CSc1ccccc1NCc2nc[nH]c2C 207a_100000211160_100000032982 [0,1,1,0,0,0|1,0,0]=3 2073 B17R2.2750 CSc1ccccc1NCc2ncoc2C 34a_100000211160_200000693990 [0,1,1,0,0,0|2,0,0]=4 2074 B17R2.2750 CSc1ccccc1SCc2nc[nH]c2C 62a_100000751220_100011217816 [0,1,1,0,0,0|2,0,0]=4 2075 B17R2.2750 CSc1ccccc1SCc2nc[nH]c2C 62a_100011217816_100000751220 [0,1,1,0,0,0|2,0,0]=4 2076 B17R2.2750 Cc1[nH]cnc1CNc2ccccc2CO 207a_100000212039_100000032982 [0,1,1,0,0,0|1,0,0]=3 2077 B17R2.2750 Cc1[nH]cnc1CSc2ccccc2CN 62a_100000689332_100000751220 [0,1,1,0,0,0|2,0,0]=4 2078 B17R2.2750 Cc1[nH]cnc1CSc2ccccc2CN 62a_100000751220_100000689332 [0,1,1,0,0,0|2,0,0]=4 2079 B17R2.2750 Cc1[nH]cnc1CSc2ccccc2CO 62a_100000187465_100000751220 [0,1,1,0,0,0|2,0,0]=4 2080 B17R2.2750 Cc1[nH]cnc1CSc2ccccc2CO 62a_100000751220_100000187465 [0,1,1,0,0,0|2,0,0]=4 2081 B17R2.2750 Cc1ocnc1CNc2ccccc2CO 34a_100000212039_200000693990 [0,1,1,0,0,0|2,0,0]=4 2082 B17R2.4343 BrCCc1ccccc1OCc2c[nH]cn2 34a_100000722297_100000707719 [0,1,1,0,0,0|1,0,0]=3 2083 B17R2.4343 BrCCc1ccccc1OCc2cscn2 34a_100000722297_100000205941 [0,1,1,0,0,0|2,0,0]=4 2084 B17R2.4343 BrCCc1ccccc1OCc2cscn2 7a_100000722297_100000205941 [0,1,1,0,0,0|2,0,0]=4 2085 B17R2.4343 C/C=C/c1ccccc1OCc2c[nH]cn2 34a_200000189419_100000707719 [0,1,1,0,0,0|1,0,1]=4 2086 B17R2.4343 C=CCc1ccccc1NCc2c[nH]cn2 2230a_200138433279_100000707719 [0,1,1,0,0,0|0,0,1]=3 2087 B17R2.4343 C=CCc1ccccc1NCc2c[nH]cn2 34a_200138433279_100000707719 [0,1,1,0,0,0|0,0,1]=3 2088 B17R2.4343 C=CCc1ccccc1NCc2cscn2 207a_200138433279_100000743575 [0,1,1,0,0,0|1,0,1]=4 2089 B17R2.4343 C=CCc1ccccc1NCc2cscn2 2230a_200138433279_100000205941 [0,1,1,0,0,0|1,0,1]=4 2090 B17R2.4343 C=CCc1ccccc1NCc2cscn2 270302a_200138433279_100000743575 [0,1,1,0,0,0|1,0,1]=4 2091 B17R2.4343 C=CCc1ccccc1NCc2cscn2 34a_200138433279_100000205941 [0,1,1,0,0,0|1,0,1]=4 2092 B17R2.4343 C=CCc1ccccc1OCc2c[nH]cn2 34a_100000211836_100000707719 [0,1,1,0,0,0|1,0,1]=4 2093 B17R2.4343 C=CCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100009828059 [0,1,1,0,0,0|1,0,1]=4 2094 B17R2.4343 C=CCc1ccccc1SCc2c[nH]cn2 62a_100009828059_100000707719 [0,1,1,0,0,0|1,0,1]=4 2095 B17R2.4343 CCCc1ccccc1NCc2c[nH]cn2 2230a_100000737634_100000707719 [0,1,1,0,0,0|0,0,0]=2 2096 B17R2.4343 CCCc1ccccc1NCc2c[nH]cn2 34a_100000737634_100000707719 [0,1,1,0,0,0|0,0,0]=2 2097 B17R2.4343 CCCc1ccccc1NCc2cc[nH]n2 207a_100000737634_100000738523 [0,1,1,0,0,0|2,0,0]=4 2098 B17R2.4343 CCCc1ccccc1NCc2ccco2 207a_100000737634_100000186105 [0,1,1,0,0,0|2,0,0]=4 2099 B17R2.4343 CCCc1ccccc1NCc2ccco2 270302a_100000737634_100000186105 [0,1,1,0,0,0|2,0,0]=4 2100 B17R2.4343 CCCc1ccccc1NCc2cccs2 207a_100000737634_100000209959 [0,1,1,0,0,0|2,0,0]=4 2101 B17R2.4343 CCCc1ccccc1NCc2cccs2 270302a_100000737634_100000209959 [0,1,1,0,0,0|2,0,0]=4 2102 B17R2.4343 CCCc1ccccc1NCc2ccoc2 207a_100000737634_100011215517 [0,1,1,0,0,0|2,0,0]=4 2103 B17R2.4343 CCCc1ccccc1NCc2ccon2 2230a_100000737634_100000234950 [0,1,1,0,0,0|2,0,0]=4 2104 B17R2.4343 CCCc1ccccc1NCc2ccon2 34a_100000737634_100000234950 [0,1,1,0,0,0|2,0,0]=4 2105 B17R2.4343 CCCc1ccccc1NCc2ccon2 7a_100000737634_100000234950 [0,1,1,0,0,0|2,0,0]=4 2106 B17R2.4343 CCCc1ccccc1NCc2ccsc2 207a_100000737634_100000188534 [0,1,1,0,0,0|2,0,0]=4 2107 B17R2.4343 CCCc1ccccc1NCc2ccsc2 2230a_100000737634_100011261437 [0,1,1,0,0,0|2,0,0]=4 2108 B17R2.4343 CCCc1ccccc1NCc2ccsc2 270302a_100000737634_100000188534 [0,1,1,0,0,0|2,0,0]=4 2109 B17R2.4343 CCCc1ccccc1NCc2ccsc2 34a_100000737634_100011261437 [0,1,1,0,0,0|2,0,0]=4 2110 B17R2.4343 CCCc1ccccc1NCc2ccsc2 7a_100000737634_100011261437 [0,1,1,0,0,0|2,0,0]=4 2111 B17R2.4343 CCCc1ccccc1NCc2cn[nH]c2 207a_100000737634_100016992096 [0,1,1,0,0,0|2,0,0]=4 2112 B17R2.4343 CCCc1ccccc1NCc2cn[nH]c2 270302a_100000737634_100016992096 [0,1,1,0,0,0|2,0,0]=4 2113 B17R2.4343 CCCc1ccccc1NCc2cnc[nH]2 207a_100000737634_100000742939 [0,1,1,0,0,0|0,0,2]=4 2114 B17R2.4343 CCCc1ccccc1NCc2cncs2 207a_100000737634_100000749870 [0,1,1,0,0,0|1,0,1]=4 2115 B17R2.4343 CCCc1ccccc1NCc2cncs2 2230a_100000737634_100015185245 [0,1,1,0,0,0|1,0,1]=4 2116 B17R2.4343 CCCc1ccccc1NCc2cncs2 270302a_100000737634_100000749870 [0,1,1,0,0,0|1,0,1]=4 2117 B17R2.4343 CCCc1ccccc1NCc2cncs2 34a_100000737634_100015185245 [0,1,1,0,0,0|1,0,1]=4 2118 B17R2.4343 CCCc1ccccc1NCc2cncs2 7a_100000737634_100015185245 [0,1,1,0,0,0|1,0,1]=4 2119 B17R2.4343 CCCc1ccccc1NCc2cscn2 207a_100000737634_100000743575 [0,1,1,0,0,0|1,0,0]=3 2120 B17R2.4343 CCCc1ccccc1NCc2cscn2 2230a_100000737634_100000205941 [0,1,1,0,0,0|1,0,0]=3 2121 B17R2.4343 CCCc1ccccc1NCc2cscn2 270302a_100000737634_100000743575 [0,1,1,0,0,0|1,0,0]=3 2122 B17R2.4343 CCCc1ccccc1NCc2cscn2 34a_100000737634_100000205941 [0,1,1,0,0,0|1,0,0]=3 2123 B17R2.4343 CCCc1ccccc1NCc2cscn2 7a_100000737634_100000205941 [0,1,1,0,0,0|1,0,0]=3 2124 B17R2.4343 CCCc1ccccc1NCc2ncc[nH]2 207a_100000737634_100000743867 [0,1,1,0,0,0|2,0,0]=4 2125 B17R2.4343 CCCc1ccccc1NCc2ncc[nH]2 2230a_100000737634_100016991755 [0,1,1,0,0,0|2,0,0]=4 2126 B17R2.4343 CCCc1ccccc1NCc2ncc[nH]2 34a_100000737634_100016991755 [0,1,1,0,0,0|2,0,0]=4 2127 B17R2.4343 CCCc1ccccc1NCc2ncc[nH]2 7a_100000737634_100000753453 [0,1,1,0,0,0|2,0,0]=4 2128 B17R2.4343 CCCc1ccccc1NCc2ncco2 2230a_100000737634_103436540062 [0,1,1,0,0,0|2,0,0]=4 2129 B17R2.4343 CCCc1ccccc1NCc2ncco2 34a_100000737634_103436540062 [0,1,1,0,0,0|2,0,0]=4 2130 B17R2.4343 CCCc1ccccc1NCc2ncco2 7a_100000737634_103436540062 [0,1,1,0,0,0|2,0,0]=4 2131 B17R2.4343 CCCc1ccccc1NCc2nccs2 207a_100000737634_100000750902 [0,1,1,0,0,0|2,0,0]=4 2132 B17R2.4343 CCCc1ccccc1NCc2nccs2 2230a_100000737634_100015184050 [0,1,1,0,0,0|2,0,0]=4 2133 B17R2.4343 CCCc1ccccc1NCc2nccs2 270302a_100000737634_100000750902 [0,1,1,0,0,0|2,0,0]=4 2134 B17R2.4343 CCCc1ccccc1NCc2nccs2 34a_100000737634_100015184050 [0,1,1,0,0,0|2,0,0]=4 2135 B17R2.4343 CCCc1ccccc1NCc2nccs2 7a_100000737634_100015184050 [0,1,1,0,0,0|2,0,0]=4 2136 B17R2.4343 CCCc1ccccc1NCc2ncon2 34a_100000737634_100000233494 [0,1,1,0,0,0|2,0,0]=4 2137 B17R2.4343 CCCc1ccccc1NCn2cncn2 2230a_100000737634_200020645497 [0,1,1,0,0,0|1,0,1]=4 2138 B17R2.4343 CCCc1ccccc1NCn2cncn2 34a_100000737634_200020645497 [0,1,1,0,0,0|1,0,1]=4 2139 B17R2.4343 CCCc1ccccc1NCn2cncn2 7a_100000737634_200020645497 [0,1,1,0,0,0|1,0,1]=4 2140 B17R2.4343 CCCc1ccccc1OCc2c[nH]cn2 34a_100011217252_100000707719 [0,1,1,0,0,0|1,0,0]=3 2141 B17R2.4343 CCCc1ccccc1OCc2cscn2 34a_100011217252_100000205941 [0,1,1,0,0,0|2,0,0]=4 2142 B17R2.4343 CCCc1ccccc1OCc2cscn2 7a_100011217252_100000205941 [0,1,1,0,0,0|2,0,0]=4 2143 B17R2.4343 CCCc1ncncc1NCc2c[nH]cn2 27a_100000758547_100009816987 [0,1,1,0,0,0|2,0,0]=4 2144 B17R2.4343 CCNc1ccccc1OCc2c[nH]cn2 34a_103624766699_100000707719 [0,1,1,0,0,0|1,0,0]=3 2145 B17R2.4343 CCNc1ccccc1OCc2cscn2 34a_103624766699_100000205941 [0,1,1,0,0,0|2,0,0]=4 2146 B17R2.4343 CCNc1ccccc1OCc2cscn2 7a_103624766699_100000205941 [0,1,1,0,0,0|2,0,0]=4 2147 B17R2.4343 CCNc1ccccc1SCc2c[nH]cn2 62a_100000707719_114873767003 [0,1,1,0,0,0|1,0,0]=3 2148 B17R2.4343 CCNc1ccccc1SCc2c[nH]cn2 62a_114873767003_100000707719 [0,1,1,0,0,0|1,0,0]=3 2149 B17R2.4343 CCNc1ccccc1SCc2cscn2 62a_100000205941_114873767003 [0,1,1,0,0,0|2,0,0]=4 2150 B17R2.4343 CCNc1ccccc1SCc2cscn2 62a_114873767003_100000205941 [0,1,1,0,0,0|2,0,0]=4 2151 B17R2.4343 CCOc1ccccc1NCc2c[nH]cn2 34a_100000211218_100000707719 [0,1,1,0,0,0|0,0,0]=2 2152 B17R2.4343 CCOc1ccccc1NCc2cc[nH]n2 207a_100000211218_100000738523 [0,1,1,0,0,0|2,0,0]=4 2153 B17R2.4343 CCOc1ccccc1NCc2ccco2 207a_100000211218_100000186105 [0,1,1,0,0,0|2,0,0]=4 2154 B17R2.4343 CCOc1ccccc1NCc2ccco2 270302a_100000211218_100000186105 [0,1,1,0,0,0|2,0,0]=4 2155 B17R2.4343 CCOc1ccccc1NCc2cccs2 207a_100000211218_100000209959 [0,1,1,0,0,0|2,0,0]=4 2156 B17R2.4343 CCOc1ccccc1NCc2cccs2 270302a_100000211218_100000209959 [0,1,1,0,0,0|2,0,0]=4 2157 B17R2.4343 CCOc1ccccc1NCc2ccoc2 207a_100000211218_100011215517 [0,1,1,0,0,0|2,0,0]=4 2158 B17R2.4343 CCOc1ccccc1NCc2ccon2 34a_100000211218_100000234950 [0,1,1,0,0,0|2,0,0]=4 2159 B17R2.4343 CCOc1ccccc1NCc2ccsc2 207a_100000211218_100000188534 [0,1,1,0,0,0|2,0,0]=4 2160 B17R2.4343 CCOc1ccccc1NCc2ccsc2 270302a_100000211218_100000188534 [0,1,1,0,0,0|2,0,0]=4 2161 B17R2.4343 CCOc1ccccc1NCc2ccsc2 34a_100000211218_100011261437 [0,1,1,0,0,0|2,0,0]=4 2162 B17R2.4343 CCOc1ccccc1NCc2cn[nH]c2 207a_100000211218_100016992096 [0,1,1,0,0,0|2,0,0]=4 2163 B17R2.4343 CCOc1ccccc1NCc2cn[nH]c2 270302a_100000211218_100016992096 [0,1,1,0,0,0|2,0,0]=4 2164 B17R2.4343 CCOc1ccccc1NCc2cnc[nH]2 207a_100000211218_100000742939 [0,1,1,0,0,0|0,0,2]=4 2165 B17R2.4343 CCOc1ccccc1NCc2cncs2 207a_100000211218_100000749870 [0,1,1,0,0,0|1,0,1]=4 2166 B17R2.4343 CCOc1ccccc1NCc2cncs2 270302a_100000211218_100000749870 [0,1,1,0,0,0|1,0,1]=4 2167 B17R2.4343 CCOc1ccccc1NCc2cncs2 34a_100000211218_100015185245 [0,1,1,0,0,0|1,0,1]=4 2168 B17R2.4343 CCOc1ccccc1NCc2cscn2 207a_100000211218_100000743575 [0,1,1,0,0,0|1,0,0]=3 2169 B17R2.4343 CCOc1ccccc1NCc2cscn2 270302a_100000211218_100000743575 [0,1,1,0,0,0|1,0,0]=3 2170 B17R2.4343 CCOc1ccccc1NCc2cscn2 34a_100000211218_100000205941 [0,1,1,0,0,0|1,0,0]=3 2171 B17R2.4343 CCOc1ccccc1NCc2ncc[nH]2 207a_100000211218_100000743867 [0,1,1,0,0,0|2,0,0]=4 2172 B17R2.4343 CCOc1ccccc1NCc2ncc[nH]2 34a_100000211218_100016991755 [0,1,1,0,0,0|2,0,0]=4 2173 B17R2.4343 CCOc1ccccc1NCc2ncco2 34a_100000211218_103436540062 [0,1,1,0,0,0|2,0,0]=4 2174 B17R2.4343 CCOc1ccccc1NCc2nccs2 207a_100000211218_100000750902 [0,1,1,0,0,0|2,0,0]=4 2175 B17R2.4343 CCOc1ccccc1NCc2nccs2 270302a_100000211218_100000750902 [0,1,1,0,0,0|2,0,0]=4 2176 B17R2.4343 CCOc1ccccc1NCc2nccs2 34a_100000211218_100015184050 [0,1,1,0,0,0|2,0,0]=4 2177 B17R2.4343 CCOc1ccccc1NCc2ncon2 34a_100000211218_100000233494 [0,1,1,0,0,0|2,0,0]=4 2178 B17R2.4343 CCOc1ccccc1NCn2cncn2 34a_100000211218_200020645497 [0,1,1,0,0,0|1,0,1]=4 2179 B17R2.4343 CCOc1ccccc1OCc2c[nH]cn2 34a_100000211404_100000707719 [0,1,1,0,0,0|1,0,0]=3 2180 B17R2.4343 CCOc1ccccc1OCc2cscn2 34a_100000211404_100000205941 [0,1,1,0,0,0|2,0,0]=4 2181 B17R2.4343 CCOc1ccccc1OCc2cscn2 7a_100000211404_100000205941 [0,1,1,0,0,0|2,0,0]=4 2182 B17R2.4343 CCOc1ccccc1SCc2c[nH]cn2 62a_100000230754_100000707719 [0,1,1,0,0,0|1,0,0]=3 2183 B17R2.4343 CCOc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000230754 [0,1,1,0,0,0|1,0,0]=3 2184 B17R2.4343 CCOc1ccccc1SCc2cscn2 62a_100000205941_100000230754 [0,1,1,0,0,0|2,0,0]=4 2185 B17R2.4343 CCOc1ccccc1SCc2cscn2 62a_100000230754_100000205941 [0,1,1,0,0,0|2,0,0]=4 2186 B17R2.4343 CCOc1cccnc1SCc2c[nH]cn2 62a_100000707719_100011597540 [0,1,1,0,0,0|2,0,0]=4 2187 B17R2.4343 CCOc1cccnc1SCc2c[nH]cn2 62a_100011597540_100000707719 [0,1,1,0,0,0|2,0,0]=4 2188 B17R2.4343 CCOc1ncccc1OCc2c[nH]cn2 34a_100011998697_100000707719 [0,1,1,0,0,0|2,0,0]=4 2189 B17R2.4343 CCOc1ncccc1SCc2c[nH]cn2 62a_100000707719_100011465154 [0,1,1,0,0,0|2,0,0]=4 2190 B17R2.4343 CCOc1ncccc1SCc2c[nH]cn2 62a_100011465154_100000707719 [0,1,1,0,0,0|2,0,0]=4 2191 B17R2.4343 CCOc1nccnc1NCc2c[nH]cn2 27a_100000758547_200010128176 [0,1,1,0,0,0|2,0,0]=4 2192 B17R2.4343 CCSc1ccccc1NCc2c[nH]cn2 34a_100011223125_100000707719 [0,1,1,0,0,0|0,0,0]=2 2193 B17R2.4343 CCSc1ccccc1NCc2cc[nH]n2 207a_100011223125_100000738523 [0,1,1,0,0,0|2,0,0]=4 2194 B17R2.4343 CCSc1ccccc1NCc2ccco2 207a_100011223125_100000186105 [0,1,1,0,0,0|2,0,0]=4 2195 B17R2.4343 CCSc1ccccc1NCc2ccco2 270302a_100011223125_100000186105 [0,1,1,0,0,0|2,0,0]=4 2196 B17R2.4343 CCSc1ccccc1NCc2cccs2 207a_100011223125_100000209959 [0,1,1,0,0,0|2,0,0]=4 2197 B17R2.4343 CCSc1ccccc1NCc2cccs2 270302a_100011223125_100000209959 [0,1,1,0,0,0|2,0,0]=4 2198 B17R2.4343 CCSc1ccccc1NCc2ccoc2 207a_100011223125_100011215517 [0,1,1,0,0,0|2,0,0]=4 2199 B17R2.4343 CCSc1ccccc1NCc2ccon2 34a_100011223125_100000234950 [0,1,1,0,0,0|2,0,0]=4 2200 B17R2.4343 CCSc1ccccc1NCc2ccsc2 207a_100011223125_100000188534 [0,1,1,0,0,0|2,0,0]=4 2201 B17R2.4343 CCSc1ccccc1NCc2ccsc2 270302a_100011223125_100000188534 [0,1,1,0,0,0|2,0,0]=4 2202 B17R2.4343 CCSc1ccccc1NCc2ccsc2 34a_100011223125_100011261437 [0,1,1,0,0,0|2,0,0]=4 2203 B17R2.4343 CCSc1ccccc1NCc2cn[nH]c2 207a_100011223125_100016992096 [0,1,1,0,0,0|2,0,0]=4 2204 B17R2.4343 CCSc1ccccc1NCc2cn[nH]c2 270302a_100011223125_100016992096 [0,1,1,0,0,0|2,0,0]=4 2205 B17R2.4343 CCSc1ccccc1NCc2cnc[nH]2 207a_100011223125_100000742939 [0,1,1,0,0,0|0,0,2]=4 2206 B17R2.4343 CCSc1ccccc1NCc2cncs2 207a_100011223125_100000749870 [0,1,1,0,0,0|1,0,1]=4 2207 B17R2.4343 CCSc1ccccc1NCc2cncs2 270302a_100011223125_100000749870 [0,1,1,0,0,0|1,0,1]=4 2208 B17R2.4343 CCSc1ccccc1NCc2cncs2 34a_100011223125_100015185245 [0,1,1,0,0,0|1,0,1]=4 2209 B17R2.4343 CCSc1ccccc1NCc2cscn2 207a_100011223125_100000743575 [0,1,1,0,0,0|1,0,0]=3 2210 B17R2.4343 CCSc1ccccc1NCc2cscn2 270302a_100011223125_100000743575 [0,1,1,0,0,0|1,0,0]=3 2211 B17R2.4343 CCSc1ccccc1NCc2cscn2 34a_100011223125_100000205941 [0,1,1,0,0,0|1,0,0]=3 2212 B17R2.4343 CCSc1ccccc1NCc2ncc[nH]2 207a_100011223125_100000743867 [0,1,1,0,0,0|2,0,0]=4 2213 B17R2.4343 CCSc1ccccc1NCc2ncc[nH]2 34a_100011223125_100016991755 [0,1,1,0,0,0|2,0,0]=4 2214 B17R2.4343 CCSc1ccccc1NCc2ncco2 34a_100011223125_103436540062 [0,1,1,0,0,0|2,0,0]=4 2215 B17R2.4343 CCSc1ccccc1NCc2nccs2 207a_100011223125_100000750902 [0,1,1,0,0,0|2,0,0]=4 2216 B17R2.4343 CCSc1ccccc1NCc2nccs2 270302a_100011223125_100000750902 [0,1,1,0,0,0|2,0,0]=4 2217 B17R2.4343 CCSc1ccccc1NCc2nccs2 34a_100011223125_100015184050 [0,1,1,0,0,0|2,0,0]=4 2218 B17R2.4343 CCSc1ccccc1NCc2ncon2 34a_100011223125_100000233494 [0,1,1,0,0,0|2,0,0]=4 2219 B17R2.4343 CCSc1ccccc1NCn2cncn2 34a_100011223125_200020645497 [0,1,1,0,0,0|1,0,1]=4 2220 B17R2.4343 CCSc1ccccc1SCc2c[nH]cn2 62a_100000230856_100000707719 [0,1,1,0,0,0|1,0,0]=3 2221 B17R2.4343 CCSc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000230856 [0,1,1,0,0,0|1,0,0]=3 2222 B17R2.4343 CCSc1ccccc1SCc2cscn2 62a_100000205941_100000230856 [0,1,1,0,0,0|2,0,0]=4 2223 B17R2.4343 CCSc1ccccc1SCc2cscn2 62a_100000230856_100000205941 [0,1,1,0,0,0|2,0,0]=4 2224 B17R2.4343 CNCc1ccccc1OCc2c[nH]cn2 34a_100015189988_100000707719 [0,1,1,0,0,0|1,0,0]=3 2225 B17R2.4343 CNCc1ccccc1OCc2cscn2 34a_100015189988_100000205941 [0,1,1,0,0,0|2,0,0]=4 2226 B17R2.4343 CNCc1ccccc1SCc2c[nH]cn2 62a_100000184654_100000707719 [0,1,1,0,0,0|1,0,0]=3 2227 B17R2.4343 CNCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000184654 [0,1,1,0,0,0|1,0,0]=3 2228 B17R2.4343 CNCc1ccccc1SCc2cscn2 62a_100000184654_100000205941 [0,1,1,0,0,0|2,0,0]=4 2229 B17R2.4343 CNCc1ccccc1SCc2cscn2 62a_100000205941_100000184654 [0,1,1,0,0,0|2,0,0]=4 2230 B17R2.4343 CNCc1cccnc1SCc2c[nH]cn2 62a_100000707719_103496529121 [0,1,1,0,0,0|2,0,0]=4 2231 B17R2.4343 CNCc1cccnc1SCc2c[nH]cn2 62a_103496529121_100000707719 [0,1,1,0,0,0|2,0,0]=4 2232 B17R2.4343 COCc1ccccc1OCc2c[nH]cn2 34a_100011488565_100000707719 [0,1,1,0,0,0|1,0,0]=3 2233 B17R2.4343 COCc1ccccc1OCc2cscn2 34a_100011488565_100000205941 [0,1,1,0,0,0|2,0,0]=4 2234 B17R2.4343 COCc1ccccc1OCc2cscn2 7a_100011488565_100000205941 [0,1,1,0,0,0|2,0,0]=4 2235 B17R2.4343 COCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011493684 [0,1,1,0,0,0|1,0,0]=3 2236 B17R2.4343 COCc1ccccc1SCc2c[nH]cn2 62a_100011493684_100000707719 [0,1,1,0,0,0|1,0,0]=3 2237 B17R2.4343 COCc1ccccc1SCc2cscn2 62a_100000205941_100011493684 [0,1,1,0,0,0|2,0,0]=4 2238 B17R2.4343 COCc1ccccc1SCc2cscn2 62a_100011493684_100000205941 [0,1,1,0,0,0|2,0,0]=4 2239 B17R2.4343 CSCc1ccccc1SCc2c[nH]cn2 62a_100000148299_100000707719 [0,1,1,0,0,0|1,0,0]=3 2240 B17R2.4343 CSCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000148299 [0,1,1,0,0,0|1,0,0]=3 2241 B17R2.4343 CSCc1ccccc1SCc2cscn2 62a_100000148299_100000205941 [0,1,1,0,0,0|2,0,0]=4 2242 B17R2.4343 CSCc1ccccc1SCc2cscn2 62a_100000205941_100000148299 [0,1,1,0,0,0|2,0,0]=4 2243 B17R2.4343 N#CCc1ccccc1OCc2c[nH]cn2 34a_100000043107_100000707719 [0,1,1,0,0,0|1,0,1]=4 2244 B17R2.4343 N#CCc1ccccc1SCc2c[nH]cn2 62a_100000033512_100000707719 [0,1,1,0,0,0|1,0,1]=4 2245 B17R2.4343 N#CCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000033512 [0,1,1,0,0,0|1,0,1]=4 2246 B17R2.4343 NCCc1ccccc1OCc2c[nH]cn2 34a_100011207237_100000707719 [0,1,1,0,0,0|1,0,0]=3 2247 B17R2.4343 NCCc1ccccc1OCc2cscn2 34a_100011207237_100000205941 [0,1,1,0,0,0|2,0,0]=4 2248 B17R2.4343 NCCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000747383 [0,1,1,0,0,0|1,0,0]=3 2249 B17R2.4343 NCCc1ccccc1SCc2c[nH]cn2 62a_100000747383_100000707719 [0,1,1,0,0,0|1,0,0]=3 2250 B17R2.4343 NCCc1ccccc1SCc2cscn2 62a_100000205941_100000747383 [0,1,1,0,0,0|2,0,0]=4 2251 B17R2.4343 NCCc1ccccc1SCc2cscn2 62a_100000747383_100000205941 [0,1,1,0,0,0|2,0,0]=4 2252 B17R2.4343 NNCc1ccccc1SCc2c[nH]cn2 62a_100000707719_200016993956 [0,1,1,0,0,0|2,0,0]=4 2253 B17R2.4343 NNCc1ccccc1SCc2c[nH]cn2 62a_200016993956_100000707719 [0,1,1,0,0,0|2,0,0]=4 2254 B17R2.4343 OCCc1ccccc1NCc2c[nH]cn2 2230a_100011215289_100000707719 [0,1,1,0,0,0|0,0,0]=2 2255 B17R2.4343 OCCc1ccccc1NCc2c[nH]cn2 34a_100011215289_100000707719 [0,1,1,0,0,0|0,0,0]=2 2256 B17R2.4343 OCCc1ccccc1NCc2cc[nH]n2 207a_100011215289_100000738523 [0,1,1,0,0,0|2,0,0]=4 2257 B17R2.4343 OCCc1ccccc1NCc2ccco2 207a_100011215289_100000186105 [0,1,1,0,0,0|2,0,0]=4 2258 B17R2.4343 OCCc1ccccc1NCc2ccco2 270302a_100011215289_100000186105 [0,1,1,0,0,0|2,0,0]=4 2259 B17R2.4343 OCCc1ccccc1NCc2cccs2 207a_100011215289_100000209959 [0,1,1,0,0,0|2,0,0]=4 2260 B17R2.4343 OCCc1ccccc1NCc2cccs2 270302a_100011215289_100000209959 [0,1,1,0,0,0|2,0,0]=4 2261 B17R2.4343 OCCc1ccccc1NCc2ccoc2 207a_100011215289_100011215517 [0,1,1,0,0,0|2,0,0]=4 2262 B17R2.4343 OCCc1ccccc1NCc2ccon2 2230a_100011215289_100000234950 [0,1,1,0,0,0|2,0,0]=4 2263 B17R2.4343 OCCc1ccccc1NCc2ccon2 34a_100011215289_100000234950 [0,1,1,0,0,0|2,0,0]=4 2264 B17R2.4343 OCCc1ccccc1NCc2ccsc2 207a_100011215289_100000188534 [0,1,1,0,0,0|2,0,0]=4 2265 B17R2.4343 OCCc1ccccc1NCc2ccsc2 2230a_100011215289_100011261437 [0,1,1,0,0,0|2,0,0]=4 2266 B17R2.4343 OCCc1ccccc1NCc2ccsc2 270302a_100011215289_100000188534 [0,1,1,0,0,0|2,0,0]=4 2267 B17R2.4343 OCCc1ccccc1NCc2ccsc2 34a_100011215289_100011261437 [0,1,1,0,0,0|2,0,0]=4 2268 B17R2.4343 OCCc1ccccc1NCc2cn[nH]c2 207a_100011215289_100016992096 [0,1,1,0,0,0|2,0,0]=4 2269 B17R2.4343 OCCc1ccccc1NCc2cn[nH]c2 270302a_100011215289_100016992096 [0,1,1,0,0,0|2,0,0]=4 2270 B17R2.4343 OCCc1ccccc1NCc2cnc[nH]2 207a_100011215289_100000742939 [0,1,1,0,0,0|0,0,2]=4 2271 B17R2.4343 OCCc1ccccc1NCc2cncs2 207a_100011215289_100000749870 [0,1,1,0,0,0|1,0,1]=4 2272 B17R2.4343 OCCc1ccccc1NCc2cncs2 2230a_100011215289_100015185245 [0,1,1,0,0,0|1,0,1]=4 2273 B17R2.4343 OCCc1ccccc1NCc2cncs2 270302a_100011215289_100000749870 [0,1,1,0,0,0|1,0,1]=4 2274 B17R2.4343 OCCc1ccccc1NCc2cncs2 34a_100011215289_100015185245 [0,1,1,0,0,0|1,0,1]=4 2275 B17R2.4343 OCCc1ccccc1NCc2cscn2 207a_100011215289_100000743575 [0,1,1,0,0,0|1,0,0]=3 2276 B17R2.4343 OCCc1ccccc1NCc2cscn2 2230a_100011215289_100000205941 [0,1,1,0,0,0|1,0,0]=3 2277 B17R2.4343 OCCc1ccccc1NCc2cscn2 270302a_100011215289_100000743575 [0,1,1,0,0,0|1,0,0]=3 2278 B17R2.4343 OCCc1ccccc1NCc2cscn2 34a_100011215289_100000205941 [0,1,1,0,0,0|1,0,0]=3 2279 B17R2.4343 OCCc1ccccc1NCc2ncc[nH]2 207a_100011215289_100000743867 [0,1,1,0,0,0|2,0,0]=4 2280 B17R2.4343 OCCc1ccccc1NCc2ncc[nH]2 2230a_100011215289_100016991755 [0,1,1,0,0,0|2,0,0]=4 2281 B17R2.4343 OCCc1ccccc1NCc2ncc[nH]2 34a_100011215289_100016991755 [0,1,1,0,0,0|2,0,0]=4 2282 B17R2.4343 OCCc1ccccc1NCc2ncco2 2230a_100011215289_103436540062 [0,1,1,0,0,0|2,0,0]=4 2283 B17R2.4343 OCCc1ccccc1NCc2ncco2 34a_100011215289_103436540062 [0,1,1,0,0,0|2,0,0]=4 2284 B17R2.4343 OCCc1ccccc1NCc2nccs2 207a_100011215289_100000750902 [0,1,1,0,0,0|2,0,0]=4 2285 B17R2.4343 OCCc1ccccc1NCc2nccs2 2230a_100011215289_100015184050 [0,1,1,0,0,0|2,0,0]=4 2286 B17R2.4343 OCCc1ccccc1NCc2nccs2 270302a_100011215289_100000750902 [0,1,1,0,0,0|2,0,0]=4 2287 B17R2.4343 OCCc1ccccc1NCc2nccs2 34a_100011215289_100015184050 [0,1,1,0,0,0|2,0,0]=4 2288 B17R2.4343 OCCc1ccccc1NCc2ncon2 34a_100011215289_100000233494 [0,1,1,0,0,0|2,0,0]=4 2289 B17R2.4343 OCCc1ccccc1NCn2cncn2 2230a_100011215289_200020645497 [0,1,1,0,0,0|1,0,1]=4 2290 B17R2.4343 OCCc1ccccc1NCn2cncn2 34a_100011215289_200020645497 [0,1,1,0,0,0|1,0,1]=4 2291 B17R2.4343 OCCc1ccccc1OCc2c[nH]cn2 34a_100000719421_100000707719 [0,1,1,0,0,0|1,0,0]=3 2292 B17R2.4343 OCCc1ccccc1OCc2cscn2 34a_100000719421_100000205941 [0,1,1,0,0,0|2,0,0]=4 2293 B17R2.4343 OCCc1ccccc1OCc2cscn2 7a_100000719421_100000205941 [0,1,1,0,0,0|2,0,0]=4 2294 B17R2.4343 OCCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000731337 [0,1,1,0,0,0|1,0,0]=3 2295 B17R2.4343 OCCc1ccccc1SCc2c[nH]cn2 62a_100000731337_100000707719 [0,1,1,0,0,0|1,0,0]=3 2296 B17R2.4343 OCCc1ccccc1SCc2cscn2 62a_100000205941_100000731337 [0,1,1,0,0,0|2,0,0]=4 2297 B17R2.4343 OCCc1ccccc1SCc2cscn2 62a_100000731337_100000205941 [0,1,1,0,0,0|2,0,0]=4 2298 B17R2.5678 C=C(C)c1ccccc1NCc2c[nH]cn2 34a_100000037685_100000707719 [0,1,1,0,0,0|0,0,1]=3 2299 B17R2.5678 C=C(C)c1ccccc1NCc2cscn2 207a_100000037685_100000743575 [0,1,1,0,0,0|1,0,1]=4 2300 B17R2.5678 C=C(C)c1ccccc1NCc2cscn2 270302a_100000037685_100000743575 [0,1,1,0,0,0|1,0,1]=4 2301 B17R2.5678 C=C(C)c1ccccc1NCc2cscn2 34a_100000037685_100000205941 [0,1,1,0,0,0|1,0,1]=4 2302 B17R2.5678 CC(=O)c1ccccc1SCc2c[nH]cn2 62a_100000751169_100000707719 [0,1,1,0,0,0|1,0,1]=4 2303 B17R2.5678 CC(=O)c1cccnc1NCc2c[nH]cn2 27a_100000758547_100009816689 [0,1,1,0,0,0|1,0,1]=4 2304 B17R2.5678 CC(=O)c1cnccc1NCc2c[nH]cn2 27a_100000758547_100160469449 [0,1,1,0,0,0|1,0,1]=4 2305 B17R2.5678 CC(C)c1ccccc1NCc2c[nH]cn2 2230a_100000210643_100000707719 [0,1,1,0,0,0|0,0,0]=2 2306 B17R2.5678 CC(C)c1ccccc1NCc2c[nH]cn2 34a_100000210643_100000707719 [0,1,1,0,0,0|0,0,0]=2 2307 B17R2.5678 CC(C)c1ccccc1NCc2cc[nH]n2 207a_100000210643_100000738523 [0,1,1,0,0,0|2,0,0]=4 2308 B17R2.5678 CC(C)c1ccccc1NCc2ccco2 207a_100000210643_100000186105 [0,1,1,0,0,0|2,0,0]=4 2309 B17R2.5678 CC(C)c1ccccc1NCc2ccco2 270302a_100000210643_100000186105 [0,1,1,0,0,0|2,0,0]=4 2310 B17R2.5678 CC(C)c1ccccc1NCc2cccs2 207a_100000210643_100000209959 [0,1,1,0,0,0|2,0,0]=4 2311 B17R2.5678 CC(C)c1ccccc1NCc2cccs2 270302a_100000210643_100000209959 [0,1,1,0,0,0|2,0,0]=4 2312 B17R2.5678 CC(C)c1ccccc1NCc2ccoc2 207a_100000210643_100011215517 [0,1,1,0,0,0|2,0,0]=4 2313 B17R2.5678 CC(C)c1ccccc1NCc2ccon2 2230a_100000210643_100000234950 [0,1,1,0,0,0|2,0,0]=4 2314 B17R2.5678 CC(C)c1ccccc1NCc2ccon2 34a_100000210643_100000234950 [0,1,1,0,0,0|2,0,0]=4 2315 B17R2.5678 CC(C)c1ccccc1NCc2ccon2 7a_100000210643_100000234950 [0,1,1,0,0,0|2,0,0]=4 2316 B17R2.5678 CC(C)c1ccccc1NCc2ccsc2 207a_100000210643_100000188534 [0,1,1,0,0,0|2,0,0]=4 2317 B17R2.5678 CC(C)c1ccccc1NCc2ccsc2 2230a_100000210643_100011261437 [0,1,1,0,0,0|2,0,0]=4 2318 B17R2.5678 CC(C)c1ccccc1NCc2ccsc2 270302a_100000210643_100000188534 [0,1,1,0,0,0|2,0,0]=4 2319 B17R2.5678 CC(C)c1ccccc1NCc2ccsc2 34a_100000210643_100011261437 [0,1,1,0,0,0|2,0,0]=4 2320 B17R2.5678 CC(C)c1ccccc1NCc2ccsc2 7a_100000210643_100011261437 [0,1,1,0,0,0|2,0,0]=4 2321 B17R2.5678 CC(C)c1ccccc1NCc2cn[nH]c2 207a_100000210643_100016992096 [0,1,1,0,0,0|2,0,0]=4 2322 B17R2.5678 CC(C)c1ccccc1NCc2cn[nH]c2 270302a_100000210643_100016992096 [0,1,1,0,0,0|2,0,0]=4 2323 B17R2.5678 CC(C)c1ccccc1NCc2cnc[nH]2 207a_100000210643_100000742939 [0,1,1,0,0,0|0,0,2]=4 2324 B17R2.5678 CC(C)c1ccccc1NCc2cncs2 207a_100000210643_100000749870 [0,1,1,0,0,0|1,0,1]=4 2325 B17R2.5678 CC(C)c1ccccc1NCc2cncs2 2230a_100000210643_100015185245 [0,1,1,0,0,0|1,0,1]=4 2326 B17R2.5678 CC(C)c1ccccc1NCc2cncs2 270302a_100000210643_100000749870 [0,1,1,0,0,0|1,0,1]=4 2327 B17R2.5678 CC(C)c1ccccc1NCc2cncs2 34a_100000210643_100015185245 [0,1,1,0,0,0|1,0,1]=4 2328 B17R2.5678 CC(C)c1ccccc1NCc2cncs2 7a_100000210643_100015185245 [0,1,1,0,0,0|1,0,1]=4 2329 B17R2.5678 CC(C)c1ccccc1NCc2cscn2 207a_100000210643_100000743575 [0,1,1,0,0,0|1,0,0]=3 2330 B17R2.5678 CC(C)c1ccccc1NCc2cscn2 2230a_100000210643_100000205941 [0,1,1,0,0,0|1,0,0]=3 2331 B17R2.5678 CC(C)c1ccccc1NCc2cscn2 270302a_100000210643_100000743575 [0,1,1,0,0,0|1,0,0]=3 2332 B17R2.5678 CC(C)c1ccccc1NCc2cscn2 34a_100000210643_100000205941 [0,1,1,0,0,0|1,0,0]=3 2333 B17R2.5678 CC(C)c1ccccc1NCc2cscn2 7a_100000210643_100000205941 [0,1,1,0,0,0|1,0,0]=3 2334 B17R2.5678 CC(C)c1ccccc1NCc2ncc[nH]2 207a_100000210643_100000743867 [0,1,1,0,0,0|2,0,0]=4 2335 B17R2.5678 CC(C)c1ccccc1NCc2ncc[nH]2 2230a_100000210643_100016991755 [0,1,1,0,0,0|2,0,0]=4 2336 B17R2.5678 CC(C)c1ccccc1NCc2ncc[nH]2 34a_100000210643_100016991755 [0,1,1,0,0,0|2,0,0]=4 2337 B17R2.5678 CC(C)c1ccccc1NCc2ncc[nH]2 7a_100000210643_100000753453 [0,1,1,0,0,0|2,0,0]=4 2338 B17R2.5678 CC(C)c1ccccc1NCc2ncco2 2230a_100000210643_103436540062 [0,1,1,0,0,0|2,0,0]=4 2339 B17R2.5678 CC(C)c1ccccc1NCc2ncco2 34a_100000210643_103436540062 [0,1,1,0,0,0|2,0,0]=4 2340 B17R2.5678 CC(C)c1ccccc1NCc2ncco2 7a_100000210643_103436540062 [0,1,1,0,0,0|2,0,0]=4 2341 B17R2.5678 CC(C)c1ccccc1NCc2nccs2 207a_100000210643_100000750902 [0,1,1,0,0,0|2,0,0]=4 2342 B17R2.5678 CC(C)c1ccccc1NCc2nccs2 2230a_100000210643_100015184050 [0,1,1,0,0,0|2,0,0]=4 2343 B17R2.5678 CC(C)c1ccccc1NCc2nccs2 270302a_100000210643_100000750902 [0,1,1,0,0,0|2,0,0]=4 2344 B17R2.5678 CC(C)c1ccccc1NCc2nccs2 34a_100000210643_100015184050 [0,1,1,0,0,0|2,0,0]=4 2345 B17R2.5678 CC(C)c1ccccc1NCc2nccs2 7a_100000210643_100015184050 [0,1,1,0,0,0|2,0,0]=4 2346 B17R2.5678 CC(C)c1ccccc1NCc2ncon2 34a_100000210643_100000233494 [0,1,1,0,0,0|2,0,0]=4 2347 B17R2.5678 CC(C)c1ccccc1NCn2cncn2 2230a_100000210643_200020645497 [0,1,1,0,0,0|1,0,1]=4 2348 B17R2.5678 CC(C)c1ccccc1NCn2cncn2 34a_100000210643_200020645497 [0,1,1,0,0,0|1,0,1]=4 2349 B17R2.5678 CC(C)c1ccccc1NCn2cncn2 7a_100000210643_200020645497 [0,1,1,0,0,0|1,0,1]=4 2350 B17R2.5678 CC(C)c1ccccc1OCc2c[nH]cn2 34a_100000211617_100000707719 [0,1,1,0,0,0|1,0,0]=3 2351 B17R2.5678 CC(C)c1ccccc1OCc2cscn2 34a_100000211617_100000205941 [0,1,1,0,0,0|2,0,0]=4 2352 B17R2.5678 CC(C)c1ccccc1OCc2cscn2 7a_100000211617_100000205941 [0,1,1,0,0,0|2,0,0]=4 2353 B17R2.5678 CC(C)c1ccccc1SCc2c[nH]cn2 62a_100000707719_100000708600 [0,1,1,0,0,0|1,0,0]=3 2354 B17R2.5678 CC(C)c1ccccc1SCc2c[nH]cn2 62a_100000708600_100000707719 [0,1,1,0,0,0|1,0,0]=3 2355 B17R2.5678 CC(C)c1ccccc1SCc2cscn2 62a_100000205941_100000708600 [0,1,1,0,0,0|2,0,0]=4 2356 B17R2.5678 CC(C)c1ccccc1SCc2cscn2 62a_100000708600_100000205941 [0,1,1,0,0,0|2,0,0]=4 2357 B17R2.5678 CC(C)c1cccnc1SCc2c[nH]cn2 62a_100000707719_200010382935 [0,1,1,0,0,0|2,0,0]=4 2358 B17R2.5678 CC(C)c1cccnc1SCc2c[nH]cn2 62a_200010382935_100000707719 [0,1,1,0,0,0|2,0,0]=4 2359 B17R2.5678 CC(C)c1ncccc1OCc2c[nH]cn2 34a_100012183336_100000707719 [0,1,1,0,0,0|2,0,0]=4 2360 B17R2.5678 CC(C)c1ncncc1NCc2c[nH]cn2 27a_100000758547_100009816988 [0,1,1,0,0,0|2,0,0]=4 2361 B17R2.5678 CC(N)c1ccccc1SCc2c[nH]cn2 62a_100000181357_100000707719 [0,1,1,0,0,0|1,0,0]=3 2362 B17R2.5678 CC(N)c1ccccc1SCc2c[nH]cn2 62a_100000707719_100000181357 [0,1,1,0,0,0|1,0,0]=3 2363 B17R2.5678 CC(N)c1ccccc1SCc2cscn2 62a_100000181357_100000205941 [0,1,1,0,0,0|2,0,0]=4 2364 B17R2.5678 CC(N)c1ccccc1SCc2cscn2 62a_100000205941_100000181357 [0,1,1,0,0,0|2,0,0]=4 2365 B17R2.5678 CC(N)c1ncccc1SCc2c[nH]cn2 62a_100000707719_100159271932 [0,1,1,0,0,0|2,0,0]=4 2366 B17R2.5678 CC(N)c1ncccc1SCc2c[nH]cn2 62a_100159271932_100000707719 [0,1,1,0,0,0|2,0,0]=4 2367 B17R2.5678 CC(O)c1ccccc1NCc2c[nH]cn2 2230a_100011405641_100000707719 [0,1,1,0,0,0|0,0,0]=2 2368 B17R2.5678 CC(O)c1ccccc1NCc2cc[nH]n2 207a_100011405641_100000738523 [0,1,1,0,0,0|2,0,0]=4 2369 B17R2.5678 CC(O)c1ccccc1NCc2ccco2 207a_100011405641_100000186105 [0,1,1,0,0,0|2,0,0]=4 2370 B17R2.5678 CC(O)c1ccccc1NCc2ccco2 270302a_100011405641_100000186105 [0,1,1,0,0,0|2,0,0]=4 2371 B17R2.5678 CC(O)c1ccccc1NCc2cccs2 207a_100011405641_100000209959 [0,1,1,0,0,0|2,0,0]=4 2372 B17R2.5678 CC(O)c1ccccc1NCc2cccs2 270302a_100011405641_100000209959 [0,1,1,0,0,0|2,0,0]=4 2373 B17R2.5678 CC(O)c1ccccc1NCc2ccoc2 207a_100011405641_100011215517 [0,1,1,0,0,0|2,0,0]=4 2374 B17R2.5678 CC(O)c1ccccc1NCc2ccon2 2230a_100011405641_100000234950 [0,1,1,0,0,0|2,0,0]=4 2375 B17R2.5678 CC(O)c1ccccc1NCc2ccsc2 207a_100011405641_100000188534 [0,1,1,0,0,0|2,0,0]=4 2376 B17R2.5678 CC(O)c1ccccc1NCc2ccsc2 2230a_100011405641_100011261437 [0,1,1,0,0,0|2,0,0]=4 2377 B17R2.5678 CC(O)c1ccccc1NCc2ccsc2 270302a_100011405641_100000188534 [0,1,1,0,0,0|2,0,0]=4 2378 B17R2.5678 CC(O)c1ccccc1NCc2cn[nH]c2 207a_100011405641_100016992096 [0,1,1,0,0,0|2,0,0]=4 2379 B17R2.5678 CC(O)c1ccccc1NCc2cn[nH]c2 270302a_100011405641_100016992096 [0,1,1,0,0,0|2,0,0]=4 2380 B17R2.5678 CC(O)c1ccccc1NCc2cnc[nH]2 207a_100011405641_100000742939 [0,1,1,0,0,0|0,0,2]=4 2381 B17R2.5678 CC(O)c1ccccc1NCc2cncs2 207a_100011405641_100000749870 [0,1,1,0,0,0|1,0,1]=4 2382 B17R2.5678 CC(O)c1ccccc1NCc2cncs2 2230a_100011405641_100015185245 [0,1,1,0,0,0|1,0,1]=4 2383 B17R2.5678 CC(O)c1ccccc1NCc2cncs2 270302a_100011405641_100000749870 [0,1,1,0,0,0|1,0,1]=4 2384 B17R2.5678 CC(O)c1ccccc1NCc2cscn2 207a_100011405641_100000743575 [0,1,1,0,0,0|1,0,0]=3 2385 B17R2.5678 CC(O)c1ccccc1NCc2cscn2 2230a_100011405641_100000205941 [0,1,1,0,0,0|1,0,0]=3 2386 B17R2.5678 CC(O)c1ccccc1NCc2cscn2 270302a_100011405641_100000743575 [0,1,1,0,0,0|1,0,0]=3 2387 B17R2.5678 CC(O)c1ccccc1NCc2ncc[nH]2 207a_100011405641_100000743867 [0,1,1,0,0,0|2,0,0]=4 2388 B17R2.5678 CC(O)c1ccccc1NCc2ncc[nH]2 2230a_100011405641_100016991755 [0,1,1,0,0,0|2,0,0]=4 2389 B17R2.5678 CC(O)c1ccccc1NCc2ncco2 2230a_100011405641_103436540062 [0,1,1,0,0,0|2,0,0]=4 2390 B17R2.5678 CC(O)c1ccccc1NCc2nccs2 207a_100011405641_100000750902 [0,1,1,0,0,0|2,0,0]=4 2391 B17R2.5678 CC(O)c1ccccc1NCc2nccs2 2230a_100011405641_100015184050 [0,1,1,0,0,0|2,0,0]=4 2392 B17R2.5678 CC(O)c1ccccc1NCc2nccs2 270302a_100011405641_100000750902 [0,1,1,0,0,0|2,0,0]=4 2393 B17R2.5678 CC(O)c1ccccc1NCn2cncn2 2230a_100011405641_200020645497 [0,1,1,0,0,0|1,0,1]=4 2394 B17R2.5678 CC(O)c1ccccc1OCc2c[nH]cn2 34a_200011232679_100000707719 [0,1,1,0,0,0|1,0,0]=3 2395 B17R2.5678 CC(O)c1ccccc1OCc2cscn2 34a_200011232679_100000205941 [0,1,1,0,0,0|2,0,0]=4 2396 B17R2.5678 CC(O)c1ccccc1OCc2cscn2 7a_200011232679_100000205941 [0,1,1,0,0,0|2,0,0]=4 2397 B17R2.5678 CC(O)c1ccccc1SCc2c[nH]cn2 62a_100000702211_100000707719 [0,1,1,0,0,0|1,0,0]=3 2398 B17R2.5678 CC(O)c1ccccc1SCc2c[nH]cn2 62a_100000707719_100000702211 [0,1,1,0,0,0|1,0,0]=3 2399 B17R2.5678 CC(O)c1ccccc1SCc2cscn2 62a_100000205941_100000702211 [0,1,1,0,0,0|2,0,0]=4 2400 B17R2.5678 CC(O)c1ccccc1SCc2cscn2 62a_100000702211_100000205941 [0,1,1,0,0,0|2,0,0]=4 2401 B17R2.5678 CC(O)c1cccnc1SCc2c[nH]cn2 62a_100000707719_100009865335 [0,1,1,0,0,0|2,0,0]=4 2402 B17R2.5678 CC(O)c1cccnc1SCc2c[nH]cn2 62a_100009865335_100000707719 [0,1,1,0,0,0|2,0,0]=4 2403 B17R2.5678 CN(C)c1ccccc1NCc2cscn2 207a_100000737595_100000743575 [0,1,1,0,0,0|2,0,0]=4 2404 B17R2.5678 CN(C)c1ccccc1NCc2cscn2 270302a_100000737595_100000743575 [0,1,1,0,0,0|2,0,0]=4 2405 B17R2.5678 CN(C)c1ccccc1SCc2c[nH]cn2 62a_100000707719_100011290883 [0,1,1,0,0,0|2,0,0]=4 2406 B17R2.5678 CN(C)c1ccccc1SCc2c[nH]cn2 62a_100011290883_100000707719 [0,1,1,0,0,0|2,0,0]=4 2407 B17R2.5678 CS(=O)c1ccccc1SCc2c[nH]cn2 62a_100000734199_100000707719 [0,1,1,0,0,0|2,0,0]=4 2408 B17R2.5678 C[C@@H](N)c1ccccc1OCc2c[nH]cn2 34a_100025703389_100000707719 [0,1,1,0,0,0|1,0,0]=3 2409 B17R2.5678 C[C@@H](N)c1ccccc1OCc2cscn2 34a_100025703389_100000205941 [0,1,1,0,0,0|2,0,0]=4 2410 B17R2.5678 C[C@H](O)c1ncccc1SCc2c[nH]cn2 62a_100000707719_100013325542 [0,1,1,0,0,0|2,0,0]=4 2411 B17R2.5678 C[C@H](O)c1ncccc1SCc2c[nH]cn2 62a_100013325542_100000707719 [0,1,1,0,0,0|2,0,0]=4 2412 B17R2.5678 FC(F)c1ccccc1NCc2c[nH]cn2 2230a_100000734540_100000707719 [0,1,1,0,0,0|1,0,0]=3 2413 B17R2.5678 FC(F)c1ccccc1NCc2c[nH]cn2 34a_100000734540_100000707719 [0,1,1,0,0,0|1,0,0]=3 2414 B17R2.5678 FC(F)c1ccccc1NCc2cscn2 2230a_100000734540_100000205941 [0,1,1,0,0,0|2,0,0]=4 2415 B17R2.5678 FC(F)c1ccccc1NCc2cscn2 34a_100000734540_100000205941 [0,1,1,0,0,0|2,0,0]=4 2416 B17R2.5678 FC(F)c1ccccc1NCc2cscn2 7a_100000734540_100000205941 [0,1,1,0,0,0|2,0,0]=4 2417 B17R2.5678 FC(F)c1ccccc1SCc2c[nH]cn2 62a_100000707719_100010169824 [0,1,1,0,0,0|2,0,0]=4 2418 B17R2.5678 FC(F)c1ccccc1SCc2c[nH]cn2 62a_100010169824_100000707719 [0,1,1,0,0,0|2,0,0]=4 2419 B17R2.5678 NC(=O)c1ccccc1NCc2c[nH]cn2 34a_100000185089_100000707719 [0,1,1,0,0,0|1,0,1]=4 2420 B17R2.9549 CCc1ccc(cc1NCc2c[nH]cn2)Br 2230a_100012354963_100000707719 [0,1,1,0,0,0|0,0,0]=2 2421 B17R2.9549 CCc1ccc(cc1NCc2c[nH]cn2)Br 34a_100012354963_100000707719 [0,1,1,0,0,0|0,0,0]=2 2422 B17R2.9549 CCc1ccc(cc1NCc2c[nH]cn2)Cl 2230a_200012281948_100000707719 [0,1,1,0,0,0|0,0,0]=2 2423 B17R2.9549 CCc1ccc(cc1NCc2c[nH]cn2)Cl 34a_200012281948_100000707719 [0,1,1,0,0,0|0,0,0]=2 2424 B17R2.9549 CCc1ccc(cc1NCc2cc[nH]n2)Br 207a_100012354963_100000738523 [0,1,1,0,0,0|2,0,0]=4 2425 B17R2.9549 CCc1ccc(cc1NCc2cc[nH]n2)Cl 207a_200012281948_100000738523 [0,1,1,0,0,0|2,0,0]=4 2426 B17R2.9549 CCc1ccc(cc1NCc2ccco2)Br 207a_100012354963_100000186105 [0,1,1,0,0,0|2,0,0]=4 2427 B17R2.9549 CCc1ccc(cc1NCc2ccco2)Br 270302a_100012354963_100000186105 [0,1,1,0,0,0|2,0,0]=4 2428 B17R2.9549 CCc1ccc(cc1NCc2ccco2)Cl 207a_200012281948_100000186105 [0,1,1,0,0,0|2,0,0]=4 2429 B17R2.9549 CCc1ccc(cc1NCc2ccco2)Cl 270302a_200012281948_100000186105 [0,1,1,0,0,0|2,0,0]=4 2430 B17R2.9549 CCc1ccc(cc1NCc2cccs2)Br 207a_100012354963_100000209959 [0,1,1,0,0,0|2,0,0]=4 2431 B17R2.9549 CCc1ccc(cc1NCc2cccs2)Br 270302a_100012354963_100000209959 [0,1,1,0,0,0|2,0,0]=4 2432 B17R2.9549 CCc1ccc(cc1NCc2cccs2)Cl 207a_200012281948_100000209959 [0,1,1,0,0,0|2,0,0]=4 2433 B17R2.9549 CCc1ccc(cc1NCc2cccs2)Cl 270302a_200012281948_100000209959 [0,1,1,0,0,0|2,0,0]=4 2434 B17R2.9549 CCc1ccc(cc1NCc2ccoc2)Br 207a_100012354963_100011215517 [0,1,1,0,0,0|2,0,0]=4 2435 B17R2.9549 CCc1ccc(cc1NCc2ccoc2)Cl 207a_200012281948_100011215517 [0,1,1,0,0,0|2,0,0]=4 2436 B17R2.9549 CCc1ccc(cc1NCc2ccon2)Br 2230a_100012354963_100000234950 [0,1,1,0,0,0|2,0,0]=4 2437 B17R2.9549 CCc1ccc(cc1NCc2ccon2)Br 34a_100012354963_100000234950 [0,1,1,0,0,0|2,0,0]=4 2438 B17R2.9549 CCc1ccc(cc1NCc2ccon2)Br 7a_100012354963_100000234950 [0,1,1,0,0,0|2,0,0]=4 2439 B17R2.9549 CCc1ccc(cc1NCc2ccon2)Cl 2230a_200012281948_100000234950 [0,1,1,0,0,0|2,0,0]=4 2440 B17R2.9549 CCc1ccc(cc1NCc2ccon2)Cl 34a_200012281948_100000234950 [0,1,1,0,0,0|2,0,0]=4 2441 B17R2.9549 CCc1ccc(cc1NCc2ccon2)Cl 7a_200012281948_100000234950 [0,1,1,0,0,0|2,0,0]=4 2442 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Br 207a_100012354963_100000188534 [0,1,1,0,0,0|2,0,0]=4 2443 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Br 2230a_100012354963_100011261437 [0,1,1,0,0,0|2,0,0]=4 2444 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Br 270302a_100012354963_100000188534 [0,1,1,0,0,0|2,0,0]=4 2445 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Br 34a_100012354963_100011261437 [0,1,1,0,0,0|2,0,0]=4 2446 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Br 7a_100012354963_100011261437 [0,1,1,0,0,0|2,0,0]=4 2447 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Cl 207a_200012281948_100000188534 [0,1,1,0,0,0|2,0,0]=4 2448 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Cl 2230a_200012281948_100011261437 [0,1,1,0,0,0|2,0,0]=4 2449 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Cl 270302a_200012281948_100000188534 [0,1,1,0,0,0|2,0,0]=4 2450 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Cl 34a_200012281948_100011261437 [0,1,1,0,0,0|2,0,0]=4 2451 B17R2.9549 CCc1ccc(cc1NCc2ccsc2)Cl 7a_200012281948_100011261437 [0,1,1,0,0,0|2,0,0]=4 2452 B17R2.9549 CCc1ccc(cc1NCc2cn[nH]c2)Br 207a_100012354963_100016992096 [0,1,1,0,0,0|2,0,0]=4 2453 B17R2.9549 CCc1ccc(cc1NCc2cn[nH]c2)Br 270302a_100012354963_100016992096 [0,1,1,0,0,0|2,0,0]=4 2454 B17R2.9549 CCc1ccc(cc1NCc2cn[nH]c2)Cl 207a_200012281948_100016992096 [0,1,1,0,0,0|2,0,0]=4 2455 B17R2.9549 CCc1ccc(cc1NCc2cn[nH]c2)Cl 270302a_200012281948_100016992096 [0,1,1,0,0,0|2,0,0]=4 2456 B17R2.9549 CCc1ccc(cc1NCc2cnc[nH]2)Br 207a_100012354963_100000742939 [0,1,1,0,0,0|0,0,2]=4 2457 B17R2.9549 CCc1ccc(cc1NCc2cnc[nH]2)Cl 207a_200012281948_100000742939 [0,1,1,0,0,0|0,0,2]=4 2458 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Br 207a_100012354963_100000749870 [0,1,1,0,0,0|1,0,1]=4 2459 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Br 2230a_100012354963_100015185245 [0,1,1,0,0,0|1,0,1]=4 2460 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Br 270302a_100012354963_100000749870 [0,1,1,0,0,0|1,0,1]=4 2461 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Br 34a_100012354963_100015185245 [0,1,1,0,0,0|1,0,1]=4 2462 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Br 7a_100012354963_100015185245 [0,1,1,0,0,0|1,0,1]=4 2463 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Cl 207a_200012281948_100000749870 [0,1,1,0,0,0|1,0,1]=4 2464 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Cl 2230a_200012281948_100015185245 [0,1,1,0,0,0|1,0,1]=4 2465 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Cl 270302a_200012281948_100000749870 [0,1,1,0,0,0|1,0,1]=4 2466 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Cl 34a_200012281948_100015185245 [0,1,1,0,0,0|1,0,1]=4 2467 B17R2.9549 CCc1ccc(cc1NCc2cncs2)Cl 7a_200012281948_100015185245 [0,1,1,0,0,0|1,0,1]=4 2468 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Br 207a_100012354963_100000743575 [0,1,1,0,0,0|1,0,0]=3 2469 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Br 2230a_100012354963_100000205941 [0,1,1,0,0,0|1,0,0]=3 2470 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Br 270302a_100012354963_100000743575 [0,1,1,0,0,0|1,0,0]=3 2471 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Br 34a_100012354963_100000205941 [0,1,1,0,0,0|1,0,0]=3 2472 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Br 7a_100012354963_100000205941 [0,1,1,0,0,0|1,0,0]=3 2473 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Cl 207a_200012281948_100000743575 [0,1,1,0,0,0|1,0,0]=3 2474 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Cl 2230a_200012281948_100000205941 [0,1,1,0,0,0|1,0,0]=3 2475 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Cl 270302a_200012281948_100000743575 [0,1,1,0,0,0|1,0,0]=3 2476 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Cl 34a_200012281948_100000205941 [0,1,1,0,0,0|1,0,0]=3 2477 B17R2.9549 CCc1ccc(cc1NCc2cscn2)Cl 7a_200012281948_100000205941 [0,1,1,0,0,0|1,0,0]=3 2478 B17R2.9549 CCc1ccc(cc1NCc2ncc[nH]2)Br 207a_100012354963_100000743867 [0,1,1,0,0,0|2,0,0]=4 2479 B17R2.9549 CCc1ccc(cc1NCc2ncc[nH]2)Br 2230a_100012354963_100016991755 [0,1,1,0,0,0|2,0,0]=4 2480 B17R2.9549 CCc1ccc(cc1NCc2ncc[nH]2)Br 34a_100012354963_100016991755 [0,1,1,0,0,0|2,0,0]=4 2481 B17R2.9549 CCc1ccc(cc1NCc2ncc[nH]2)Br 7a_100012354963_100000753453 [0,1,1,0,0,0|2,0,0]=4 2482 B17R2.9549 CCc1ccc(cc1NCc2ncc[nH]2)Cl 207a_200012281948_100000743867 [0,1,1,0,0,0|2,0,0]=4 2483 B17R2.9549 CCc1ccc(cc1NCc2ncc[nH]2)Cl 2230a_200012281948_100016991755 [0,1,1,0,0,0|2,0,0]=4 2484 B17R2.9549 CCc1ccc(cc1NCc2ncc[nH]2)Cl 34a_200012281948_100016991755 [0,1,1,0,0,0|2,0,0]=4 2485 B17R2.9549 CCc1ccc(cc1NCc2ncc[nH]2)Cl 7a_200012281948_100000753453 [0,1,1,0,0,0|2,0,0]=4 2486 B17R2.9549 CCc1ccc(cc1NCc2ncco2)Br 2230a_100012354963_103436540062 [0,1,1,0,0,0|2,0,0]=4 2487 B17R2.9549 CCc1ccc(cc1NCc2ncco2)Br 34a_100012354963_103436540062 [0,1,1,0,0,0|2,0,0]=4 2488 B17R2.9549 CCc1ccc(cc1NCc2ncco2)Br 7a_100012354963_103436540062 [0,1,1,0,0,0|2,0,0]=4 2489 B17R2.9549 CCc1ccc(cc1NCc2ncco2)Cl 2230a_200012281948_103436540062 [0,1,1,0,0,0|2,0,0]=4 2490 B17R2.9549 CCc1ccc(cc1NCc2ncco2)Cl 34a_200012281948_103436540062 [0,1,1,0,0,0|2,0,0]=4 2491 B17R2.9549 CCc1ccc(cc1NCc2ncco2)Cl 7a_200012281948_103436540062 [0,1,1,0,0,0|2,0,0]=4 2492 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Br 207a_100012354963_100000750902 [0,1,1,0,0,0|2,0,0]=4 2493 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Br 2230a_100012354963_100015184050 [0,1,1,0,0,0|2,0,0]=4 2494 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Br 270302a_100012354963_100000750902 [0,1,1,0,0,0|2,0,0]=4 2495 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Br 34a_100012354963_100015184050 [0,1,1,0,0,0|2,0,0]=4 2496 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Br 7a_100012354963_100015184050 [0,1,1,0,0,0|2,0,0]=4 2497 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Cl 207a_200012281948_100000750902 [0,1,1,0,0,0|2,0,0]=4 2498 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Cl 2230a_200012281948_100015184050 [0,1,1,0,0,0|2,0,0]=4 2499 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Cl 270302a_200012281948_100000750902 [0,1,1,0,0,0|2,0,0]=4 2500 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Cl 34a_200012281948_100015184050 [0,1,1,0,0,0|2,0,0]=4 2501 B17R2.9549 CCc1ccc(cc1NCc2nccs2)Cl 7a_200012281948_100015184050 [0,1,1,0,0,0|2,0,0]=4 2502 B17R2.9549 CCc1ccc(cc1NCc2ncon2)Br 34a_100012354963_100000233494 [0,1,1,0,0,0|2,0,0]=4 2503 B17R2.9549 CCc1ccc(cc1NCc2ncon2)Cl 34a_200012281948_100000233494 [0,1,1,0,0,0|2,0,0]=4 2504 B17R2.9549 CCc1ccc(cc1NCn2cncn2)Br 2230a_100012354963_200020645497 [0,1,1,0,0,0|1,0,1]=4 2505 B17R2.9549 CCc1ccc(cc1NCn2cncn2)Br 34a_100012354963_200020645497 [0,1,1,0,0,0|1,0,1]=4 2506 B17R2.9549 CCc1ccc(cc1NCn2cncn2)Br 7a_100012354963_200020645497 [0,1,1,0,0,0|1,0,1]=4 2507 B17R2.9549 CCc1ccc(cc1NCn2cncn2)Cl 2230a_200012281948_200020645497 [0,1,1,0,0,0|1,0,1]=4 2508 B17R2.9549 CCc1ccc(cc1NCn2cncn2)Cl 34a_200012281948_200020645497 [0,1,1,0,0,0|1,0,1]=4 2509 B17R2.9549 CCc1ccc(cc1NCn2cncn2)Cl 7a_200012281948_200020645497 [0,1,1,0,0,0|1,0,1]=4 2510 B17R2.9549 CCc1cnc(cc1NCc2c[nH]cn2)C 27a_100000758547_100010291839 [0,1,1,0,0,0|1,0,0]=3 2511 B17R2.9549 CCc1cnc(cc1NCc2c[nH]nn2)C 27a_100020620823_100010291839 [0,1,1,0,0,0|2,0,0]=4 2512 B17R2.9549 CCc1cnc(cc1NCc2cocn2)C 27a_100015188801_100010291839 [0,1,1,0,0,0|2,0,0]=4 2513 B17R2.9549 CCc1cnc(cc1NCc2cscn2)C 27a_100015185402_100010291839 [0,1,1,0,0,0|2,0,0]=4 2514 B17R2.9549 CCc1cnc(cc1SCc2c[nH]cn2)C 62a_100000707719_100010291839 [0,1,1,0,0,0|2,0,0]=4 2515 B17R2.9549 CCc1cnc(cc1SCc2c[nH]cn2)C 62a_100010291839_100000707719 [0,1,1,0,0,0|2,0,0]=4 2516 B17R2.9549 CCc1cnc(nc1NCc2c[nH]cn2)C 27a_100000758547_200000069817 [0,1,1,0,0,0|2,0,0]=4 2517 B17R2.9549 CCc1ncc(cc1SCc2c[nH]cn2)N 62a_100000707719_100013085292 [0,1,1,0,0,0|2,0,0]=4 2518 B17R2.9549 CCc1ncc(cc1SCc2c[nH]cn2)N 62a_100013085292_100000707719 [0,1,1,0,0,0|2,0,0]=4 2519 B17R2.9549 CNc1ccc(cc1SCc2c[nH]cn2)C 62a_100000221369_100000707719 [0,1,1,0,0,0|2,0,0]=4 2520 B17R2.9549 CNc1ccc(cc1SCc2c[nH]cn2)C 62a_100000707719_100000221369 [0,1,1,0,0,0|2,0,0]=4 2521 B17R2.9549 CNc1ccc(cc1SCc2c[nH]cn2)F 62a_100000707719_100011246292 [0,1,1,0,0,0|2,0,0]=4 2522 B17R2.9549 CNc1ccc(cc1SCc2c[nH]cn2)F 62a_100011246292_100000707719 [0,1,1,0,0,0|2,0,0]=4 2523 B17R2.9549 COc1ccc(cc1NCc2c[nH]cn2)Br 34a_100000743470_100000707719 [0,1,1,0,0,0|1,0,0]=3 2524 B17R2.9549 COc1ccc(cc1NCc2c[nH]cn2)C 2230a_100000210980_100000707719 [0,1,1,0,0,0|1,0,0]=3 2525 B17R2.9549 COc1ccc(cc1NCc2c[nH]cn2)C 34a_100000210980_100000707719 [0,1,1,0,0,0|1,0,0]=3 2526 B17R2.9549 COc1ccc(cc1NCc2c[nH]cn2)Cl 34a_100000182114_100000707719 [0,1,1,0,0,0|1,0,0]=3 2527 B17R2.9549 COc1ccc(cc1NCc2c[nH]cn2)F 34a_100000757179_100000707719 [0,1,1,0,0,0|1,0,0]=3 2528 B17R2.9549 COc1ccc(cc1NCc2cscn2)Br 207a_100000743470_100000743575 [0,1,1,0,0,0|2,0,0]=4 2529 B17R2.9549 COc1ccc(cc1NCc2cscn2)Br 270302a_100000743470_100000743575 [0,1,1,0,0,0|2,0,0]=4 2530 B17R2.9549 COc1ccc(cc1NCc2cscn2)Br 34a_100000743470_100000205941 [0,1,1,0,0,0|2,0,0]=4 2531 B17R2.9549 COc1ccc(cc1NCc2cscn2)C 207a_100000210980_100000743575 [0,1,1,0,0,0|2,0,0]=4 2532 B17R2.9549 COc1ccc(cc1NCc2cscn2)C 2230a_100000210980_100000205941 [0,1,1,0,0,0|2,0,0]=4 2533 B17R2.9549 COc1ccc(cc1NCc2cscn2)C 270302a_100000210980_100000743575 [0,1,1,0,0,0|2,0,0]=4 2534 B17R2.9549 COc1ccc(cc1NCc2cscn2)C 34a_100000210980_100000205941 [0,1,1,0,0,0|2,0,0]=4 2535 B17R2.9549 COc1ccc(cc1NCc2cscn2)Cl 207a_100000182114_100000743575 [0,1,1,0,0,0|2,0,0]=4 2536 B17R2.9549 COc1ccc(cc1NCc2cscn2)Cl 270302a_100000182114_100000743575 [0,1,1,0,0,0|2,0,0]=4 2537 B17R2.9549 COc1ccc(cc1NCc2cscn2)Cl 34a_100000182114_100000205941 [0,1,1,0,0,0|2,0,0]=4 2538 B17R2.9549 COc1ccc(cc1NCc2cscn2)F 207a_100000757179_100000743575 [0,1,1,0,0,0|2,0,0]=4 2539 B17R2.9549 COc1ccc(cc1NCc2cscn2)F 270302a_100000757179_100000743575 [0,1,1,0,0,0|2,0,0]=4 2540 B17R2.9549 COc1ccc(cc1NCc2cscn2)F 34a_100000757179_100000205941 [0,1,1,0,0,0|2,0,0]=4 2541 B17R2.9549 COc1ccc(cc1NCc2cscn2)I 207a_100011249504_100000743575 [0,1,1,0,0,0|2,0,0]=4 2542 B17R2.9549 COc1ccc(cc1NCc2cscn2)I 270302a_100011249504_100000743575 [0,1,1,0,0,0|2,0,0]=4 2543 B17R2.9549 COc1ccc(cc1OCc2c[nH]cn2)Br 34a_100009816560_100000707719 [0,1,1,0,0,0|2,0,0]=4 2544 B17R2.9549 COc1ccc(cc1OCc2c[nH]cn2)C 34a_100011216497_100000707719 [0,1,1,0,0,0|2,0,0]=4 2545 B17R2.9549 COc1ccc(cc1OCc2c[nH]cn2)Cl 34a_100000101779_100000707719 [0,1,1,0,0,0|2,0,0]=4 2546 B17R2.9549 COc1ccc(cc1OCc2c[nH]cn2)F 34a_100000034962_100000707719 [0,1,1,0,0,0|2,0,0]=4 2547 B17R2.9549 COc1ccc(cc1OCc2c[nH]cn2)N 34a_100000211920_100000707719 [0,1,1,0,0,0|2,0,0]=4 2548 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100012351588 [0,1,1,0,0,0|2,0,0]=4 2549 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)Br 62a_100012351588_100000707719 [0,1,1,0,0,0|2,0,0]=4 2550 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)C 62a_100000186399_100000707719 [0,1,1,0,0,0|2,0,0]=4 2551 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)C 62a_100000707719_100000186399 [0,1,1,0,0,0|2,0,0]=4 2552 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100011215930 [0,1,1,0,0,0|2,0,0]=4 2553 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100011215930_100000707719 [0,1,1,0,0,0|2,0,0]=4 2554 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)F 62a_100000171694_100000707719 [0,1,1,0,0,0|2,0,0]=4 2555 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)F 62a_100000707719_100000171694 [0,1,1,0,0,0|2,0,0]=4 2556 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)N 62a_100000707719_100011356947 [0,1,1,0,0,0|2,0,0]=4 2557 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)N 62a_100011356947_100000707719 [0,1,1,0,0,0|2,0,0]=4 2558 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)O 62a_100000707719_100010234764 [0,1,1,0,0,0|2,0,0]=4 2559 B17R2.9549 COc1ccc(cc1SCc2c[nH]cn2)O 62a_100010234764_100000707719 [0,1,1,0,0,0|2,0,0]=4 2560 B17R2.9549 CSc1ccc(cc1NCc2c[nH]cn2)Cl 34a_100000745667_100000707719 [0,1,1,0,0,0|1,0,0]=3 2561 B17R2.9549 CSc1ccc(cc1NCc2cscn2)Cl 207a_100000745667_100000743575 [0,1,1,0,0,0|2,0,0]=4 2562 B17R2.9549 CSc1ccc(cc1NCc2cscn2)Cl 270302a_100000745667_100000743575 [0,1,1,0,0,0|2,0,0]=4 2563 B17R2.9549 CSc1ccc(cc1NCc2cscn2)Cl 34a_100000745667_100000205941 [0,1,1,0,0,0|2,0,0]=4 2564 B17R2.9549 CSc1ccc(cc1SCc2c[nH]cn2)C 62a_100000707719_200010201864 [0,1,1,0,0,0|2,0,0]=4 2565 B17R2.9549 CSc1ccc(cc1SCc2c[nH]cn2)C 62a_200010201864_100000707719 [0,1,1,0,0,0|2,0,0]=4 2566 B17R2.9549 CSc1ccc(cc1SCc2c[nH]cn2)F 62a_100000707719_100009817003 [0,1,1,0,0,0|2,0,0]=4 2567 B17R2.9549 CSc1ccc(cc1SCc2c[nH]cn2)F 62a_100009817003_100000707719 [0,1,1,0,0,0|2,0,0]=4 2568 B17R2.9549 Cc1ccc(c(c1)NCc2c[nH]cn2)C#N 34a_100011218341_100000707719 [0,1,1,0,0,0|1,0,1]=4 2569 B17R2.9549 Cc1ccc(c(c1)NCc2c[nH]cn2)CO 34a_100000087799_100000707719 [0,1,1,0,0,0|1,0,0]=3 2570 B17R2.9549 Cc1ccc(c(c1)NCc2cscn2)CO 207a_100000087799_100000743575 [0,1,1,0,0,0|2,0,0]=4 2571 B17R2.9549 Cc1ccc(c(c1)NCc2cscn2)CO 270302a_100000087799_100000743575 [0,1,1,0,0,0|2,0,0]=4 2572 B17R2.9549 Cc1ccc(c(c1)NCc2cscn2)CO 34a_100000087799_100000205941 [0,1,1,0,0,0|2,0,0]=4 2573 B17R2.9549 N#Cc1ccc(cc1NCc2c[nH]cn2)Br 27a_100000758547_100010214477 [0,1,1,0,0,0|1,0,1]=4 2574 B17R2.9549 N#Cc1ccc(cc1NCc2c[nH]cn2)Cl 27a_100000758547_100012355178 [0,1,1,0,0,0|1,0,1]=4 2575 B17R2.9549 N#Cc1ccc(cc1NCc2c[nH]cn2)Cl 34a_100000211392_100000707719 [0,1,1,0,0,0|1,0,1]=4 2576 B17R2.9549 N#Cc1ccc(cc1NCc2c[nH]cn2)F 27a_100000758547_100011935285 [0,1,1,0,0,0|1,0,1]=4 2577 B17R2.9549 N#Cc1ccc(cc1NCc2c[nH]cn2)F 34a_100011935279_100000707719 [0,1,1,0,0,0|1,0,1]=4 2578 B17R2.9549 NCc1ccc(cc1SCc2c[nH]cn2)F 62a_100000707719_100000708791 [0,1,1,0,0,0|2,0,0]=4 2579 B17R2.9549 NCc1ccc(cc1SCc2c[nH]cn2)F 62a_100000708791_100000707719 [0,1,1,0,0,0|2,0,0]=4 2580 B17R2.9549 OCc1ccc(cc1NCc2c[nH]cn2)Br 34a_100000718831_100000707719 [0,1,1,0,0,0|1,0,0]=3 2581 B17R2.9549 OCc1ccc(cc1NCc2c[nH]cn2)Cl 34a_100000238622_100000707719 [0,1,1,0,0,0|1,0,0]=3 2582 B17R2.9549 OCc1ccc(cc1NCc2c[nH]cn2)F 34a_100011996588_100000707719 [0,1,1,0,0,0|1,0,0]=3 2583 B17R2.9549 OCc1ccc(cc1NCc2cscn2)Br 207a_100000718831_100000743575 [0,1,1,0,0,0|2,0,0]=4 2584 B17R2.9549 OCc1ccc(cc1NCc2cscn2)Br 270302a_100000718831_100000743575 [0,1,1,0,0,0|2,0,0]=4 2585 B17R2.9549 OCc1ccc(cc1NCc2cscn2)Br 34a_100000718831_100000205941 [0,1,1,0,0,0|2,0,0]=4 2586 B17R2.9549 OCc1ccc(cc1NCc2cscn2)Cl 207a_100000238622_100000743575 [0,1,1,0,0,0|2,0,0]=4 2587 B17R2.9549 OCc1ccc(cc1NCc2cscn2)Cl 270302a_100000238622_100000743575 [0,1,1,0,0,0|2,0,0]=4 2588 B17R2.9549 OCc1ccc(cc1NCc2cscn2)Cl 34a_100000238622_100000205941 [0,1,1,0,0,0|2,0,0]=4 2589 B17R2.9549 OCc1ccc(cc1NCc2cscn2)F 207a_100011996588_100000743575 [0,1,1,0,0,0|2,0,0]=4 2590 B17R2.9549 OCc1ccc(cc1NCc2cscn2)F 270302a_100011996588_100000743575 [0,1,1,0,0,0|2,0,0]=4 2591 B17R2.9549 OCc1ccc(cc1NCc2cscn2)F 34a_100011996588_100000205941 [0,1,1,0,0,0|2,0,0]=4 2592 B17R2.9549 OCc1ccc(cc1OCc2c[nH]cn2)Br 34a_100000071718_100000707719 [0,1,1,0,0,0|2,0,0]=4 2593 B17R2.9549 OCc1ccc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100010146605 [0,1,1,0,0,0|2,0,0]=4 2594 B17R2.9549 OCc1ccc(cc1SCc2c[nH]cn2)Br 62a_100010146605_100000707719 [0,1,1,0,0,0|2,0,0]=4 2595 B17R2.9549 OCc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100000722340 [0,1,1,0,0,0|2,0,0]=4 2596 B17R2.9549 OCc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100000722340_100000707719 [0,1,1,0,0,0|2,0,0]=4 2597 B17R2.9549 OCc1ccc(cc1SCc2c[nH]cn2)F 62a_100000707719_100000744086 [0,1,1,0,0,0|2,0,0]=4 2598 B17R2.9549 OCc1ccc(cc1SCc2c[nH]cn2)F 62a_100000744086_100000707719 [0,1,1,0,0,0|2,0,0]=4 2599 B17R2.9549 OCc1ccc(cc1SCc2c[nH]cn2)O 62a_100000707719_100010146404 [0,1,1,0,0,0|2,0,0]=4 2600 B17R2.9549 OCc1ccc(cc1SCc2c[nH]cn2)O 62a_100010146404_100000707719 [0,1,1,0,0,0|2,0,0]=4 2601 B17R2.10450 C#Cc1cc(ccc1NCc2c[nH]cn2)C 34a_200012001881_100000707719 [0,1,1,0,0,0|0,0,2]=4 2602 B17R2.10450 CCc1cc(ccc1NCc2c[nH]cn2)Br 2230a_100000686106_100000707719 [0,1,1,0,0,0|0,0,0]=2 2603 B17R2.10450 CCc1cc(ccc1NCc2c[nH]cn2)Br 34a_100000686106_100000707719 [0,1,1,0,0,0|0,0,0]=2 2604 B17R2.10450 CCc1cc(ccc1NCc2c[nH]cn2)Cl 2230a_100012017146_100000707719 [0,1,1,0,0,0|0,0,0]=2 2605 B17R2.10450 CCc1cc(ccc1NCc2c[nH]cn2)Cl 34a_100012017146_100000707719 [0,1,1,0,0,0|0,0,0]=2 2606 B17R2.10450 CCc1cc(ccc1NCc2c[nH]cn2)I 2230a_100000014069_100000707719 [0,1,1,0,0,0|0,0,0]=2 2607 B17R2.10450 CCc1cc(ccc1NCc2c[nH]cn2)I 34a_100000014069_100000707719 [0,1,1,0,0,0|0,0,0]=2 2608 B17R2.10450 CCc1cc(ccc1NCc2cc[nH]n2)Br 207a_100000686106_100000738523 [0,1,1,0,0,0|2,0,0]=4 2609 B17R2.10450 CCc1cc(ccc1NCc2cc[nH]n2)Cl 207a_100012017146_100000738523 [0,1,1,0,0,0|2,0,0]=4 2610 B17R2.10450 CCc1cc(ccc1NCc2cc[nH]n2)I 207a_100000014069_100000738523 [0,1,1,0,0,0|2,0,0]=4 2611 B17R2.10450 CCc1cc(ccc1NCc2ccco2)Br 207a_100000686106_100000186105 [0,1,1,0,0,0|2,0,0]=4 2612 B17R2.10450 CCc1cc(ccc1NCc2ccco2)Br 270302a_100000686106_100000186105 [0,1,1,0,0,0|2,0,0]=4 2613 B17R2.10450 CCc1cc(ccc1NCc2ccco2)Cl 207a_100012017146_100000186105 [0,1,1,0,0,0|2,0,0]=4 2614 B17R2.10450 CCc1cc(ccc1NCc2ccco2)Cl 270302a_100012017146_100000186105 [0,1,1,0,0,0|2,0,0]=4 2615 B17R2.10450 CCc1cc(ccc1NCc2ccco2)I 207a_100000014069_100000186105 [0,1,1,0,0,0|2,0,0]=4 2616 B17R2.10450 CCc1cc(ccc1NCc2ccco2)I 270302a_100000014069_100000186105 [0,1,1,0,0,0|2,0,0]=4 2617 B17R2.10450 CCc1cc(ccc1NCc2cccs2)Br 207a_100000686106_100000209959 [0,1,1,0,0,0|2,0,0]=4 2618 B17R2.10450 CCc1cc(ccc1NCc2cccs2)Br 270302a_100000686106_100000209959 [0,1,1,0,0,0|2,0,0]=4 2619 B17R2.10450 CCc1cc(ccc1NCc2cccs2)Cl 207a_100012017146_100000209959 [0,1,1,0,0,0|2,0,0]=4 2620 B17R2.10450 CCc1cc(ccc1NCc2cccs2)Cl 270302a_100012017146_100000209959 [0,1,1,0,0,0|2,0,0]=4 2621 B17R2.10450 CCc1cc(ccc1NCc2cccs2)I 207a_100000014069_100000209959 [0,1,1,0,0,0|2,0,0]=4 2622 B17R2.10450 CCc1cc(ccc1NCc2cccs2)I 270302a_100000014069_100000209959 [0,1,1,0,0,0|2,0,0]=4 2623 B17R2.10450 CCc1cc(ccc1NCc2ccoc2)Br 207a_100000686106_100011215517 [0,1,1,0,0,0|2,0,0]=4 2624 B17R2.10450 CCc1cc(ccc1NCc2ccoc2)Cl 207a_100012017146_100011215517 [0,1,1,0,0,0|2,0,0]=4 2625 B17R2.10450 CCc1cc(ccc1NCc2ccoc2)I 207a_100000014069_100011215517 [0,1,1,0,0,0|2,0,0]=4 2626 B17R2.10450 CCc1cc(ccc1NCc2ccon2)Br 2230a_100000686106_100000234950 [0,1,1,0,0,0|2,0,0]=4 2627 B17R2.10450 CCc1cc(ccc1NCc2ccon2)Br 34a_100000686106_100000234950 [0,1,1,0,0,0|2,0,0]=4 2628 B17R2.10450 CCc1cc(ccc1NCc2ccon2)Br 7a_100000686106_100000234950 [0,1,1,0,0,0|2,0,0]=4 2629 B17R2.10450 CCc1cc(ccc1NCc2ccon2)Cl 2230a_100012017146_100000234950 [0,1,1,0,0,0|2,0,0]=4 2630 B17R2.10450 CCc1cc(ccc1NCc2ccon2)Cl 34a_100012017146_100000234950 [0,1,1,0,0,0|2,0,0]=4 2631 B17R2.10450 CCc1cc(ccc1NCc2ccon2)Cl 7a_100012017146_100000234950 [0,1,1,0,0,0|2,0,0]=4 2632 B17R2.10450 CCc1cc(ccc1NCc2ccon2)I 2230a_100000014069_100000234950 [0,1,1,0,0,0|2,0,0]=4 2633 B17R2.10450 CCc1cc(ccc1NCc2ccon2)I 34a_100000014069_100000234950 [0,1,1,0,0,0|2,0,0]=4 2634 B17R2.10450 CCc1cc(ccc1NCc2ccon2)I 7a_100000014069_100000234950 [0,1,1,0,0,0|2,0,0]=4 2635 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Br 207a_100000686106_100000188534 [0,1,1,0,0,0|2,0,0]=4 2636 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Br 2230a_100000686106_100011261437 [0,1,1,0,0,0|2,0,0]=4 2637 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Br 270302a_100000686106_100000188534 [0,1,1,0,0,0|2,0,0]=4 2638 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Br 34a_100000686106_100011261437 [0,1,1,0,0,0|2,0,0]=4 2639 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Br 7a_100000686106_100011261437 [0,1,1,0,0,0|2,0,0]=4 2640 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Cl 207a_100012017146_100000188534 [0,1,1,0,0,0|2,0,0]=4 2641 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Cl 2230a_100012017146_100011261437 [0,1,1,0,0,0|2,0,0]=4 2642 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Cl 270302a_100012017146_100000188534 [0,1,1,0,0,0|2,0,0]=4 2643 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Cl 34a_100012017146_100011261437 [0,1,1,0,0,0|2,0,0]=4 2644 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)Cl 7a_100012017146_100011261437 [0,1,1,0,0,0|2,0,0]=4 2645 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)I 207a_100000014069_100000188534 [0,1,1,0,0,0|2,0,0]=4 2646 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)I 2230a_100000014069_100011261437 [0,1,1,0,0,0|2,0,0]=4 2647 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)I 270302a_100000014069_100000188534 [0,1,1,0,0,0|2,0,0]=4 2648 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)I 34a_100000014069_100011261437 [0,1,1,0,0,0|2,0,0]=4 2649 B17R2.10450 CCc1cc(ccc1NCc2ccsc2)I 7a_100000014069_100011261437 [0,1,1,0,0,0|2,0,0]=4 2650 B17R2.10450 CCc1cc(ccc1NCc2cn[nH]c2)Br 207a_100000686106_100016992096 [0,1,1,0,0,0|2,0,0]=4 2651 B17R2.10450 CCc1cc(ccc1NCc2cn[nH]c2)Br 270302a_100000686106_100016992096 [0,1,1,0,0,0|2,0,0]=4 2652 B17R2.10450 CCc1cc(ccc1NCc2cn[nH]c2)Cl 207a_100012017146_100016992096 [0,1,1,0,0,0|2,0,0]=4 2653 B17R2.10450 CCc1cc(ccc1NCc2cn[nH]c2)Cl 270302a_100012017146_100016992096 [0,1,1,0,0,0|2,0,0]=4 2654 B17R2.10450 CCc1cc(ccc1NCc2cn[nH]c2)I 207a_100000014069_100016992096 [0,1,1,0,0,0|2,0,0]=4 2655 B17R2.10450 CCc1cc(ccc1NCc2cn[nH]c2)I 270302a_100000014069_100016992096 [0,1,1,0,0,0|2,0,0]=4 2656 B17R2.10450 CCc1cc(ccc1NCc2cnc[nH]2)Br 207a_100000686106_100000742939 [0,1,1,0,0,0|0,0,2]=4 2657 B17R2.10450 CCc1cc(ccc1NCc2cnc[nH]2)Cl 207a_100012017146_100000742939 [0,1,1,0,0,0|0,0,2]=4 2658 B17R2.10450 CCc1cc(ccc1NCc2cnc[nH]2)I 207a_100000014069_100000742939 [0,1,1,0,0,0|0,0,2]=4 2659 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Br 207a_100000686106_100000749870 [0,1,1,0,0,0|1,0,1]=4 2660 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Br 2230a_100000686106_100015185245 [0,1,1,0,0,0|1,0,1]=4 2661 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Br 270302a_100000686106_100000749870 [0,1,1,0,0,0|1,0,1]=4 2662 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Br 34a_100000686106_100015185245 [0,1,1,0,0,0|1,0,1]=4 2663 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Br 7a_100000686106_100015185245 [0,1,1,0,0,0|1,0,1]=4 2664 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Cl 207a_100012017146_100000749870 [0,1,1,0,0,0|1,0,1]=4 2665 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Cl 2230a_100012017146_100015185245 [0,1,1,0,0,0|1,0,1]=4 2666 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Cl 270302a_100012017146_100000749870 [0,1,1,0,0,0|1,0,1]=4 2667 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Cl 34a_100012017146_100015185245 [0,1,1,0,0,0|1,0,1]=4 2668 B17R2.10450 CCc1cc(ccc1NCc2cncs2)Cl 7a_100012017146_100015185245 [0,1,1,0,0,0|1,0,1]=4 2669 B17R2.10450 CCc1cc(ccc1NCc2cncs2)I 207a_100000014069_100000749870 [0,1,1,0,0,0|1,0,1]=4 2670 B17R2.10450 CCc1cc(ccc1NCc2cncs2)I 2230a_100000014069_100015185245 [0,1,1,0,0,0|1,0,1]=4 2671 B17R2.10450 CCc1cc(ccc1NCc2cncs2)I 270302a_100000014069_100000749870 [0,1,1,0,0,0|1,0,1]=4 2672 B17R2.10450 CCc1cc(ccc1NCc2cncs2)I 34a_100000014069_100015185245 [0,1,1,0,0,0|1,0,1]=4 2673 B17R2.10450 CCc1cc(ccc1NCc2cncs2)I 7a_100000014069_100015185245 [0,1,1,0,0,0|1,0,1]=4 2674 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Br 207a_100000686106_100000743575 [0,1,1,0,0,0|1,0,0]=3 2675 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Br 2230a_100000686106_100000205941 [0,1,1,0,0,0|1,0,0]=3 2676 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Br 270302a_100000686106_100000743575 [0,1,1,0,0,0|1,0,0]=3 2677 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Br 34a_100000686106_100000205941 [0,1,1,0,0,0|1,0,0]=3 2678 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Br 7a_100000686106_100000205941 [0,1,1,0,0,0|1,0,0]=3 2679 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Cl 207a_100012017146_100000743575 [0,1,1,0,0,0|1,0,0]=3 2680 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Cl 2230a_100012017146_100000205941 [0,1,1,0,0,0|1,0,0]=3 2681 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Cl 270302a_100012017146_100000743575 [0,1,1,0,0,0|1,0,0]=3 2682 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Cl 34a_100012017146_100000205941 [0,1,1,0,0,0|1,0,0]=3 2683 B17R2.10450 CCc1cc(ccc1NCc2cscn2)Cl 7a_100012017146_100000205941 [0,1,1,0,0,0|1,0,0]=3 2684 B17R2.10450 CCc1cc(ccc1NCc2cscn2)I 207a_100000014069_100000743575 [0,1,1,0,0,0|1,0,0]=3 2685 B17R2.10450 CCc1cc(ccc1NCc2cscn2)I 2230a_100000014069_100000205941 [0,1,1,0,0,0|1,0,0]=3 2686 B17R2.10450 CCc1cc(ccc1NCc2cscn2)I 270302a_100000014069_100000743575 [0,1,1,0,0,0|1,0,0]=3 2687 B17R2.10450 CCc1cc(ccc1NCc2cscn2)I 34a_100000014069_100000205941 [0,1,1,0,0,0|1,0,0]=3 2688 B17R2.10450 CCc1cc(ccc1NCc2cscn2)I 7a_100000014069_100000205941 [0,1,1,0,0,0|1,0,0]=3 2689 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)Br 207a_100000686106_100000743867 [0,1,1,0,0,0|2,0,0]=4 2690 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)Br 2230a_100000686106_100016991755 [0,1,1,0,0,0|2,0,0]=4 2691 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)Br 34a_100000686106_100016991755 [0,1,1,0,0,0|2,0,0]=4 2692 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)Br 7a_100000686106_100000753453 [0,1,1,0,0,0|2,0,0]=4 2693 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)Cl 207a_100012017146_100000743867 [0,1,1,0,0,0|2,0,0]=4 2694 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)Cl 2230a_100012017146_100016991755 [0,1,1,0,0,0|2,0,0]=4 2695 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)Cl 34a_100012017146_100016991755 [0,1,1,0,0,0|2,0,0]=4 2696 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)Cl 7a_100012017146_100000753453 [0,1,1,0,0,0|2,0,0]=4 2697 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)I 207a_100000014069_100000743867 [0,1,1,0,0,0|2,0,0]=4 2698 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)I 2230a_100000014069_100016991755 [0,1,1,0,0,0|2,0,0]=4 2699 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)I 34a_100000014069_100016991755 [0,1,1,0,0,0|2,0,0]=4 2700 B17R2.10450 CCc1cc(ccc1NCc2ncc[nH]2)I 7a_100000014069_100000753453 [0,1,1,0,0,0|2,0,0]=4 2701 B17R2.10450 CCc1cc(ccc1NCc2ncco2)Br 2230a_100000686106_103436540062 [0,1,1,0,0,0|2,0,0]=4 2702 B17R2.10450 CCc1cc(ccc1NCc2ncco2)Br 34a_100000686106_103436540062 [0,1,1,0,0,0|2,0,0]=4 2703 B17R2.10450 CCc1cc(ccc1NCc2ncco2)Br 7a_100000686106_103436540062 [0,1,1,0,0,0|2,0,0]=4 2704 B17R2.10450 CCc1cc(ccc1NCc2ncco2)Cl 2230a_100012017146_103436540062 [0,1,1,0,0,0|2,0,0]=4 2705 B17R2.10450 CCc1cc(ccc1NCc2ncco2)Cl 34a_100012017146_103436540062 [0,1,1,0,0,0|2,0,0]=4 2706 B17R2.10450 CCc1cc(ccc1NCc2ncco2)Cl 7a_100012017146_103436540062 [0,1,1,0,0,0|2,0,0]=4 2707 B17R2.10450 CCc1cc(ccc1NCc2ncco2)I 2230a_100000014069_103436540062 [0,1,1,0,0,0|2,0,0]=4 2708 B17R2.10450 CCc1cc(ccc1NCc2ncco2)I 34a_100000014069_103436540062 [0,1,1,0,0,0|2,0,0]=4 2709 B17R2.10450 CCc1cc(ccc1NCc2ncco2)I 7a_100000014069_103436540062 [0,1,1,0,0,0|2,0,0]=4 2710 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Br 207a_100000686106_100000750902 [0,1,1,0,0,0|2,0,0]=4 2711 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Br 2230a_100000686106_100015184050 [0,1,1,0,0,0|2,0,0]=4 2712 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Br 270302a_100000686106_100000750902 [0,1,1,0,0,0|2,0,0]=4 2713 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Br 34a_100000686106_100015184050 [0,1,1,0,0,0|2,0,0]=4 2714 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Br 7a_100000686106_100015184050 [0,1,1,0,0,0|2,0,0]=4 2715 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Cl 207a_100012017146_100000750902 [0,1,1,0,0,0|2,0,0]=4 2716 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Cl 2230a_100012017146_100015184050 [0,1,1,0,0,0|2,0,0]=4 2717 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Cl 270302a_100012017146_100000750902 [0,1,1,0,0,0|2,0,0]=4 2718 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Cl 34a_100012017146_100015184050 [0,1,1,0,0,0|2,0,0]=4 2719 B17R2.10450 CCc1cc(ccc1NCc2nccs2)Cl 7a_100012017146_100015184050 [0,1,1,0,0,0|2,0,0]=4 2720 B17R2.10450 CCc1cc(ccc1NCc2nccs2)I 207a_100000014069_100000750902 [0,1,1,0,0,0|2,0,0]=4 2721 B17R2.10450 CCc1cc(ccc1NCc2nccs2)I 2230a_100000014069_100015184050 [0,1,1,0,0,0|2,0,0]=4 2722 B17R2.10450 CCc1cc(ccc1NCc2nccs2)I 270302a_100000014069_100000750902 [0,1,1,0,0,0|2,0,0]=4 2723 B17R2.10450 CCc1cc(ccc1NCc2nccs2)I 34a_100000014069_100015184050 [0,1,1,0,0,0|2,0,0]=4 2724 B17R2.10450 CCc1cc(ccc1NCc2nccs2)I 7a_100000014069_100015184050 [0,1,1,0,0,0|2,0,0]=4 2725 B17R2.10450 CCc1cc(ccc1NCc2ncon2)Br 34a_100000686106_100000233494 [0,1,1,0,0,0|2,0,0]=4 2726 B17R2.10450 CCc1cc(ccc1NCc2ncon2)Cl 34a_100012017146_100000233494 [0,1,1,0,0,0|2,0,0]=4 2727 B17R2.10450 CCc1cc(ccc1NCc2ncon2)I 34a_100000014069_100000233494 [0,1,1,0,0,0|2,0,0]=4 2728 B17R2.10450 CCc1cc(ccc1NCn2cncn2)Br 2230a_100000686106_200020645497 [0,1,1,0,0,0|1,0,1]=4 2729 B17R2.10450 CCc1cc(ccc1NCn2cncn2)Br 34a_100000686106_200020645497 [0,1,1,0,0,0|1,0,1]=4 2730 B17R2.10450 CCc1cc(ccc1NCn2cncn2)Br 7a_100000686106_200020645497 [0,1,1,0,0,0|1,0,1]=4 2731 B17R2.10450 CCc1cc(ccc1NCn2cncn2)Cl 2230a_100012017146_200020645497 [0,1,1,0,0,0|1,0,1]=4 2732 B17R2.10450 CCc1cc(ccc1NCn2cncn2)Cl 34a_100012017146_200020645497 [0,1,1,0,0,0|1,0,1]=4 2733 B17R2.10450 CCc1cc(ccc1NCn2cncn2)Cl 7a_100012017146_200020645497 [0,1,1,0,0,0|1,0,1]=4 2734 B17R2.10450 CCc1cc(ccc1NCn2cncn2)I 2230a_100000014069_200020645497 [0,1,1,0,0,0|1,0,1]=4 2735 B17R2.10450 CCc1cc(ccc1NCn2cncn2)I 34a_100000014069_200020645497 [0,1,1,0,0,0|1,0,1]=4 2736 B17R2.10450 CCc1cc(ccc1NCn2cncn2)I 7a_100000014069_200020645497 [0,1,1,0,0,0|1,0,1]=4 2737 B17R2.10450 CCc1cc(ccc1OCc2c[nH]cn2)Br 34a_100012338938_100000707719 [0,1,1,0,0,0|1,0,0]=3 2738 B17R2.10450 CCc1cc(ccc1OCc2c[nH]cn2)C 34a_100009844793_100000707719 [0,1,1,0,0,0|1,0,0]=3 2739 B17R2.10450 CCc1cc(ccc1OCc2c[nH]cn2)F 34a_200000035566_100000707719 [0,1,1,0,0,0|1,0,0]=3 2740 B17R2.10450 CCc1cc(ccc1OCc2cscn2)Br 34a_100012338938_100000205941 [0,1,1,0,0,0|2,0,0]=4 2741 B17R2.10450 CCc1cc(ccc1OCc2cscn2)Br 7a_100012338938_100000205941 [0,1,1,0,0,0|2,0,0]=4 2742 B17R2.10450 CCc1cc(ccc1OCc2cscn2)C 34a_100009844793_100000205941 [0,1,1,0,0,0|2,0,0]=4 2743 B17R2.10450 CCc1cc(ccc1OCc2cscn2)C 7a_100009844793_100000205941 [0,1,1,0,0,0|2,0,0]=4 2744 B17R2.10450 CCc1cc(ccc1OCc2cscn2)F 34a_200000035566_100000205941 [0,1,1,0,0,0|2,0,0]=4 2745 B17R2.10450 CCc1cc(ccc1OCc2cscn2)F 7a_200000035566_100000205941 [0,1,1,0,0,0|2,0,0]=4 2746 B17R2.10450 CCc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100011216195 [0,1,1,0,0,0|1,0,0]=3 2747 B17R2.10450 CCc1cc(ccc1SCc2c[nH]cn2)Br 62a_100011216195_100000707719 [0,1,1,0,0,0|1,0,0]=3 2748 B17R2.10450 CCc1cc(ccc1SCc2c[nH]cn2)N 62a_100000707719_100010109747 [0,1,1,0,0,0|1,0,0]=3 2749 B17R2.10450 CCc1cc(ccc1SCc2c[nH]cn2)N 62a_100010109747_100000707719 [0,1,1,0,0,0|1,0,0]=3 2750 B17R2.10450 CCc1cc(ccc1SCc2cscn2)Br 62a_100000205941_100011216195 [0,1,1,0,0,0|2,0,0]=4 2751 B17R2.10450 CCc1cc(ccc1SCc2cscn2)Br 62a_100011216195_100000205941 [0,1,1,0,0,0|2,0,0]=4 2752 B17R2.10450 CCc1cc(ccc1SCc2cscn2)N 62a_100000205941_100010109747 [0,1,1,0,0,0|2,0,0]=4 2753 B17R2.10450 CCc1cc(ccc1SCc2cscn2)N 62a_100010109747_100000205941 [0,1,1,0,0,0|2,0,0]=4 2754 B17R2.10450 CCc1nc(ccc1OCc2c[nH]cn2)C 34a_100000718140_100000707719 [0,1,1,0,0,0|2,0,0]=4 2755 B17R2.10450 CNc1cc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100020633008 [0,1,1,0,0,0|2,0,0]=4 2756 B17R2.10450 CNc1cc(ccc1SCc2c[nH]cn2)F 62a_100020633008_100000707719 [0,1,1,0,0,0|2,0,0]=4 2757 B17R2.10450 COc1cc(ccc1NCc2c[nH]cn2)Br 34a_100011279103_100000707719 [0,1,1,0,0,0|1,0,0]=3 2758 B17R2.10450 COc1cc(ccc1NCc2c[nH]cn2)C 2230a_100000746441_100000707719 [0,1,1,0,0,0|1,0,0]=3 2759 B17R2.10450 COc1cc(ccc1NCc2c[nH]cn2)C 34a_100000746441_100000707719 [0,1,1,0,0,0|1,0,0]=3 2760 B17R2.10450 COc1cc(ccc1NCc2c[nH]cn2)Cl 34a_100000707585_100000707719 [0,1,1,0,0,0|1,0,0]=3 2761 B17R2.10450 COc1cc(ccc1NCc2c[nH]cn2)F 34a_100000737216_100000707719 [0,1,1,0,0,0|1,0,0]=3 2762 B17R2.10450 COc1cc(ccc1NCc2c[nH]cn2)I 34a_100015196925_100000707719 [0,1,1,0,0,0|1,0,0]=3 2763 B17R2.10450 COc1cc(ccc1NCc2c[nH]cn2)O 34a_100015326901_100000707719 [0,1,1,0,0,0|1,0,0]=3 2764 B17R2.10450 COc1cc(ccc1NCc2cscn2)Br 207a_100011279103_100000743575 [0,1,1,0,0,0|2,0,0]=4 2765 B17R2.10450 COc1cc(ccc1NCc2cscn2)Br 270302a_100011279103_100000743575 [0,1,1,0,0,0|2,0,0]=4 2766 B17R2.10450 COc1cc(ccc1NCc2cscn2)Br 34a_100011279103_100000205941 [0,1,1,0,0,0|2,0,0]=4 2767 B17R2.10450 COc1cc(ccc1NCc2cscn2)C 207a_100000746441_100000743575 [0,1,1,0,0,0|2,0,0]=4 2768 B17R2.10450 COc1cc(ccc1NCc2cscn2)C 2230a_100000746441_100000205941 [0,1,1,0,0,0|2,0,0]=4 2769 B17R2.10450 COc1cc(ccc1NCc2cscn2)C 270302a_100000746441_100000743575 [0,1,1,0,0,0|2,0,0]=4 2770 B17R2.10450 COc1cc(ccc1NCc2cscn2)C 34a_100000746441_100000205941 [0,1,1,0,0,0|2,0,0]=4 2771 B17R2.10450 COc1cc(ccc1NCc2cscn2)Cl 207a_100000707585_100000743575 [0,1,1,0,0,0|2,0,0]=4 2772 B17R2.10450 COc1cc(ccc1NCc2cscn2)Cl 270302a_100000707585_100000743575 [0,1,1,0,0,0|2,0,0]=4 2773 B17R2.10450 COc1cc(ccc1NCc2cscn2)Cl 34a_100000707585_100000205941 [0,1,1,0,0,0|2,0,0]=4 2774 B17R2.10450 COc1cc(ccc1NCc2cscn2)F 207a_100000737216_100000743575 [0,1,1,0,0,0|2,0,0]=4 2775 B17R2.10450 COc1cc(ccc1NCc2cscn2)F 270302a_100000737216_100000743575 [0,1,1,0,0,0|2,0,0]=4 2776 B17R2.10450 COc1cc(ccc1NCc2cscn2)F 34a_100000737216_100000205941 [0,1,1,0,0,0|2,0,0]=4 2777 B17R2.10450 COc1cc(ccc1NCc2cscn2)I 207a_100015196925_100000743575 [0,1,1,0,0,0|2,0,0]=4 2778 B17R2.10450 COc1cc(ccc1NCc2cscn2)I 270302a_100015196925_100000743575 [0,1,1,0,0,0|2,0,0]=4 2779 B17R2.10450 COc1cc(ccc1NCc2cscn2)I 34a_100015196925_100000205941 [0,1,1,0,0,0|2,0,0]=4 2780 B17R2.10450 COc1cc(ccc1NCc2cscn2)O 270302a_100015326901_100000743575 [0,1,1,0,0,0|2,0,0]=4 2781 B17R2.10450 COc1cc(ccc1NCc2cscn2)O 34a_100015326901_100000205941 [0,1,1,0,0,0|2,0,0]=4 2782 B17R2.10450 COc1cc(ccc1OCc2c[nH]cn2)Br 34a_100000694246_100000707719 [0,1,1,0,0,0|2,0,0]=4 2783 B17R2.10450 COc1cc(ccc1OCc2c[nH]cn2)C 34a_100000186466_100000707719 [0,1,1,0,0,0|2,0,0]=4 2784 B17R2.10450 COc1cc(ccc1OCc2c[nH]cn2)Cl 34a_100000033002_100000707719 [0,1,1,0,0,0|2,0,0]=4 2785 B17R2.10450 COc1cc(ccc1OCc2c[nH]cn2)F 34a_100000036057_100000707719 [0,1,1,0,0,0|2,0,0]=4 2786 B17R2.10450 COc1cc(ccc1OCc2c[nH]cn2)I 34a_100000049635_100000707719 [0,1,1,0,0,0|2,0,0]=4 2787 B17R2.10450 COc1cc(ccc1OCc2c[nH]cn2)N 34a_100000726020_100000707719 [0,1,1,0,0,0|2,0,0]=4 2788 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100010245111 [0,1,1,0,0,0|2,0,0]=4 2789 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)Br 62a_100010245111_100000707719 [0,1,1,0,0,0|2,0,0]=4 2790 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)C 62a_100000707719_100010200004 [0,1,1,0,0,0|2,0,0]=4 2791 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)C 62a_100010200004_100000707719 [0,1,1,0,0,0|2,0,0]=4 2792 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100000050115_100000707719 [0,1,1,0,0,0|2,0,0]=4 2793 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100000707719_100000050115 [0,1,1,0,0,0|2,0,0]=4 2794 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100000757151 [0,1,1,0,0,0|2,0,0]=4 2795 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)F 62a_100000757151_100000707719 [0,1,1,0,0,0|2,0,0]=4 2796 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)N 62a_100000707719_100000765947 [0,1,1,0,0,0|2,0,0]=4 2797 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)N 62a_100000765947_100000707719 [0,1,1,0,0,0|2,0,0]=4 2798 B17R2.10450 COc1cc(ccc1SCc2c[nH]cn2)O 62a_100000707719_100011827694 [0,1,1,0,0,0|2,0,0]=4 2799 B17R2.10450 CSc1cc(ccc1SCc2c[nH]cn2)C 62a_100000707719_200010709736 [0,1,1,0,0,0|2,0,0]=4 2800 B17R2.10450 CSc1cc(ccc1SCc2c[nH]cn2)C 62a_200010709736_100000707719 [0,1,1,0,0,0|2,0,0]=4 2801 B17R2.10450 CSc1cc(cnc1NCc2c[nH]cn2)C 27a_100000758547_100010884634 [0,1,1,0,0,0|2,0,0]=4 2802 B17R2.10450 Cc1ccc(c(c1)CO)NCc2c[nH]cn2 34a_100011215565_100000707719 [0,1,1,0,0,0|1,0,0]=3 2803 B17R2.10450 Cc1ccc(c(c1)CO)NCc2cscn2 207a_100011215565_100000743575 [0,1,1,0,0,0|2,0,0]=4 2804 B17R2.10450 Cc1ccc(c(c1)CO)NCc2cscn2 270302a_100011215565_100000743575 [0,1,1,0,0,0|2,0,0]=4 2805 B17R2.10450 Cc1ccc(c(c1)CO)NCc2cscn2 34a_100011215565_100000205941 [0,1,1,0,0,0|2,0,0]=4 2806 B17R2.10450 Cc1ccc(c(c1)CO)OCc2c[nH]cn2 34a_200011846009_100000707719 [0,1,1,0,0,0|2,0,0]=4 2807 B17R2.10450 Cc1ccc(c(c1)CO)SCc2c[nH]cn2 62a_100000707719_100012361352 [0,1,1,0,0,0|2,0,0]=4 2808 B17R2.10450 Cc1ccc(c(c1)CO)SCc2c[nH]cn2 62a_100012361352_100000707719 [0,1,1,0,0,0|2,0,0]=4 2809 B17R2.10450 Fc1ccc(c(c1)CBr)OCc2c[nH]cn2 34a_100010161318_100000707719 [0,1,1,0,0,0|2,0,0]=4 2810 B17R2.10450 N#Cc1cc(ccc1NCc2c[nH]cn2)Br 27a_100000758547_100011219714 [0,1,1,0,0,0|1,0,1]=4 2811 B17R2.10450 N#Cc1cc(ccc1NCc2c[nH]cn2)F 34a_100000685569_100000707719 [0,1,1,0,0,0|1,0,1]=4 2812 B17R2.10450 NCc1cc(ccc1OCc2c[nH]cn2)Br 34a_100000730032_100000707719 [0,1,1,0,0,0|2,0,0]=4 2813 B17R2.10450 NCc1cc(ccc1OCc2c[nH]cn2)Cl 34a_100000238540_100000707719 [0,1,1,0,0,0|2,0,0]=4 2814 B17R2.10450 NCc1cc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100000742738 [0,1,1,0,0,0|2,0,0]=4 2815 B17R2.10450 NCc1cc(ccc1SCc2c[nH]cn2)F 62a_100000742738_100000707719 [0,1,1,0,0,0|2,0,0]=4 2816 B17R2.10450 Nc1ccc(c(c1)CO)SCc2c[nH]cn2 62a_100000707719_100012347228 [0,1,1,0,0,0|2,0,0]=4 2817 B17R2.10450 Nc1ccc(c(c1)CO)SCc2c[nH]cn2 62a_100012347228_100000707719 [0,1,1,0,0,0|2,0,0]=4 2818 B17R2.10450 OCc1cc(ccc1NCc2c[nH]cn2)Br 34a_100012353972_100000707719 [0,1,1,0,0,0|1,0,0]=3 2819 B17R2.10450 OCc1cc(ccc1NCc2c[nH]cn2)Cl 34a_100011214999_100000707719 [0,1,1,0,0,0|1,0,0]=3 2820 B17R2.10450 OCc1cc(ccc1NCc2c[nH]cn2)F 34a_100011296978_100000707719 [0,1,1,0,0,0|1,0,0]=3 2821 B17R2.10450 OCc1cc(ccc1NCc2cscn2)Br 207a_100012353972_100000743575 [0,1,1,0,0,0|2,0,0]=4 2822 B17R2.10450 OCc1cc(ccc1NCc2cscn2)Br 270302a_100012353972_100000743575 [0,1,1,0,0,0|2,0,0]=4 2823 B17R2.10450 OCc1cc(ccc1NCc2cscn2)Br 34a_100012353972_100000205941 [0,1,1,0,0,0|2,0,0]=4 2824 B17R2.10450 OCc1cc(ccc1NCc2cscn2)Cl 207a_100011214999_100000743575 [0,1,1,0,0,0|2,0,0]=4 2825 B17R2.10450 OCc1cc(ccc1NCc2cscn2)Cl 270302a_100011214999_100000743575 [0,1,1,0,0,0|2,0,0]=4 2826 B17R2.10450 OCc1cc(ccc1NCc2cscn2)Cl 34a_100011214999_100000205941 [0,1,1,0,0,0|2,0,0]=4 2827 B17R2.10450 OCc1cc(ccc1NCc2cscn2)F 207a_100011296978_100000743575 [0,1,1,0,0,0|2,0,0]=4 2828 B17R2.10450 OCc1cc(ccc1NCc2cscn2)F 270302a_100011296978_100000743575 [0,1,1,0,0,0|2,0,0]=4 2829 B17R2.10450 OCc1cc(ccc1NCc2cscn2)F 34a_100011296978_100000205941 [0,1,1,0,0,0|2,0,0]=4 2830 B17R2.10450 OCc1cc(ccc1NCc2cscn2)I 207a_114929179932_100000743575 [0,1,1,0,0,0|2,0,0]=4 2831 B17R2.10450 OCc1cc(ccc1NCc2cscn2)I 270302a_114929179932_100000743575 [0,1,1,0,0,0|2,0,0]=4 2832 B17R2.10450 OCc1cc(ccc1OCc2c[nH]cn2)Br 34a_100000184703_100000707719 [0,1,1,0,0,0|2,0,0]=4 2833 B17R2.10450 OCc1cc(ccc1OCc2c[nH]cn2)Cl 34a_100011218961_100000707719 [0,1,1,0,0,0|2,0,0]=4 2834 B17R2.10450 OCc1cc(ccc1OCc2c[nH]cn2)F 34a_100011291448_100000707719 [0,1,1,0,0,0|2,0,0]=4 2835 B17R2.10450 OCc1cc(ccc1OCc2c[nH]cn2)I 34a_100000049520_100000707719 [0,1,1,0,0,0|2,0,0]=4 2836 B17R2.10450 OCc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100011356890 [0,1,1,0,0,0|2,0,0]=4 2837 B17R2.10450 OCc1cc(ccc1SCc2c[nH]cn2)Br 62a_100011356890_100000707719 [0,1,1,0,0,0|2,0,0]=4 2838 B17R2.10450 OCc1cc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100011217561 [0,1,1,0,0,0|2,0,0]=4 2839 B17R2.10450 OCc1cc(ccc1SCc2c[nH]cn2)F 62a_100011217561_100000707719 [0,1,1,0,0,0|2,0,0]=4 2840 B17R2.10450 OCc1cc(ccc1SCc2c[nH]cn2)O 62a_100000707719_100012351483 [0,1,1,0,0,0|2,0,0]=4 2841 B17R2.10450 OCc1cc(ccc1SCc2c[nH]cn2)O 62a_100012351483_100000707719 [0,1,1,0,0,0|2,0,0]=4 2842 B17R2.16287 CNc1c(cccc1SCc2c[nH]cn2)N 62a_100010510394_100000707719 [0,1,1,0,0,0|2,0,0]=4 2843 B17R2.16287 COc1c(cccc1NCc2c[nH]cn2)Br 34a_100011935253_100000707719 [0,1,1,0,0,0|1,0,0]=3 2844 B17R2.16287 COc1c(cccc1NCc2c[nH]cn2)C 34a_100012017360_100000707719 [0,1,1,0,0,0|1,0,0]=3 2845 B17R2.16287 COc1c(cccc1NCc2c[nH]cn2)Cl 2230a_100000743799_100000707719 [0,1,1,0,0,0|1,0,0]=3 2846 B17R2.16287 COc1c(cccc1NCc2c[nH]cn2)Cl 34a_100000743799_100000707719 [0,1,1,0,0,0|1,0,0]=3 2847 B17R2.16287 COc1c(cccc1NCc2c[nH]cn2)F 34a_100011215007_100000707719 [0,1,1,0,0,0|1,0,0]=3 2848 B17R2.16287 COc1c(cccc1NCc2cscn2)Br 207a_100011935253_100000743575 [0,1,1,0,0,0|2,0,0]=4 2849 B17R2.16287 COc1c(cccc1NCc2cscn2)Br 270302a_100011935253_100000743575 [0,1,1,0,0,0|2,0,0]=4 2850 B17R2.16287 COc1c(cccc1NCc2cscn2)Br 34a_100011935253_100000205941 [0,1,1,0,0,0|2,0,0]=4 2851 B17R2.16287 COc1c(cccc1NCc2cscn2)C 207a_100012017360_100000743575 [0,1,1,0,0,0|2,0,0]=4 2852 B17R2.16287 COc1c(cccc1NCc2cscn2)C 270302a_100012017360_100000743575 [0,1,1,0,0,0|2,0,0]=4 2853 B17R2.16287 COc1c(cccc1NCc2cscn2)C 34a_100012017360_100000205941 [0,1,1,0,0,0|2,0,0]=4 2854 B17R2.16287 COc1c(cccc1NCc2cscn2)Cl 207a_100000743799_100000743575 [0,1,1,0,0,0|2,0,0]=4 2855 B17R2.16287 COc1c(cccc1NCc2cscn2)Cl 2230a_100000743799_100000205941 [0,1,1,0,0,0|2,0,0]=4 2856 B17R2.16287 COc1c(cccc1NCc2cscn2)Cl 270302a_100000743799_100000743575 [0,1,1,0,0,0|2,0,0]=4 2857 B17R2.16287 COc1c(cccc1NCc2cscn2)Cl 34a_100000743799_100000205941 [0,1,1,0,0,0|2,0,0]=4 2858 B17R2.16287 COc1c(cccc1NCc2cscn2)F 207a_100011215007_100000743575 [0,1,1,0,0,0|2,0,0]=4 2859 B17R2.16287 COc1c(cccc1NCc2cscn2)F 270302a_100011215007_100000743575 [0,1,1,0,0,0|2,0,0]=4 2860 B17R2.16287 COc1c(cccc1NCc2cscn2)F 34a_100011215007_100000205941 [0,1,1,0,0,0|2,0,0]=4 2861 B17R2.16287 COc1c(cccc1OCc2c[nH]cn2)Br 34a_100010234590_100000707719 [0,1,1,0,0,0|2,0,0]=4 2862 B17R2.16287 COc1c(cccc1OCc2c[nH]cn2)Cl 34a_200009886253_100000707719 [0,1,1,0,0,0|2,0,0]=4 2863 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)Br 62a_100000707719_100010146560 [0,1,1,0,0,0|2,0,0]=4 2864 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)Br 62a_100010146560_100000707719 [0,1,1,0,0,0|2,0,0]=4 2865 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)C 62a_100000707719_100010141385 [0,1,1,0,0,0|2,0,0]=4 2866 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)C 62a_100010141385_100000707719 [0,1,1,0,0,0|2,0,0]=4 2867 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)Cl 62a_100000707719_100010147678 [0,1,1,0,0,0|2,0,0]=4 2868 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)Cl 62a_100010147678_100000707719 [0,1,1,0,0,0|2,0,0]=4 2869 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)F 62a_100000707719_100009816759 [0,1,1,0,0,0|2,0,0]=4 2870 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)F 62a_100009816759_100000707719 [0,1,1,0,0,0|2,0,0]=4 2871 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)N 62a_100011935253_100000707719 [0,1,1,0,0,0|2,0,0]=4 2872 B17R2.16287 COc1c(cccc1SCc2c[nH]cn2)O 62a_100000707719_100010234590 [0,1,1,0,0,0|2,0,0]=4 2873 B17R2.16287 CSc1c(cccc1OCc2c[nH]cn2)C 34a_200000099257_100000707719 [0,1,1,0,0,0|2,0,0]=4 2874 B17R2.16287 CSc1c(cccc1SCc2c[nH]cn2)F 62a_100000707719_200010709249 [0,1,1,0,0,0|2,0,0]=4 2875 B17R2.16287 CSc1c(cccc1SCc2c[nH]cn2)F 62a_200010709249_100000707719 [0,1,1,0,0,0|2,0,0]=4 2876 B17R2.16287 Cc1cccc(c1C#N)NCc2c[nH]cn2 2230a_100000763283_100000707719 [0,1,1,0,0,0|1,0,1]=4 2877 B17R2.16287 Cc1cccc(c1C#N)NCc2c[nH]cn2 34a_100000763283_100000707719 [0,1,1,0,0,0|1,0,1]=4 2878 B17R2.16287 Cc1cccc(c1CO)OCc2c[nH]cn2 34a_200009874777_100000707719 [0,1,1,0,0,0|2,0,0]=4 2879 B17R2.16287 N#Cc1c(cccc1NCc2c[nH]cn2)Br 27a_100000758547_100010071968 [0,1,1,0,0,0|1,0,1]=4 2880 B17R2.16287 N#Cc1c(cccc1NCc2c[nH]cn2)Cl 2230a_100000236969_100000707719 [0,1,1,0,0,0|1,0,1]=4 2881 B17R2.16287 N#Cc1c(cccc1NCc2c[nH]cn2)Cl 27a_100000758547_200000049503 [0,1,1,0,0,0|1,0,1]=4 2882 B17R2.16287 N#Cc1c(cccc1NCc2c[nH]cn2)F 2230a_100000236971_100000707719 [0,1,1,0,0,0|1,0,1]=4 2883 B17R2.16287 N#Cc1c(cccc1NCc2c[nH]cn2)F 27a_100000758547_100000039607 [0,1,1,0,0,0|1,0,1]=4 2884 B17R2.16287 N#Cc1c(cccc1NCc2c[nH]cn2)F 34a_100000236971_100000707719 [0,1,1,0,0,0|1,0,1]=4 2885 B17R2.16287 NCc1c(cccc1SCc2c[nH]cn2)F 62a_100000707719_100012349121 [0,1,1,0,0,0|2,0,0]=4 2886 B17R2.16287 NCc1c(cccc1SCc2c[nH]cn2)F 62a_100012349121_100000707719 [0,1,1,0,0,0|2,0,0]=4 2887 B17R2.16287 Nc1cccc(c1CO)SCc2c[nH]cn2 62a_100000707719_100000747656 [0,1,1,0,0,0|2,0,0]=4 2888 B17R2.16287 Nc1cccc(c1CO)SCc2c[nH]cn2 62a_100000747656_100000707719 [0,1,1,0,0,0|2,0,0]=4 2889 B17R2.16287 OCc1c(cccc1NCc2c[nH]cn2)Br 34a_100000747656_100000707719 [0,1,1,0,0,0|1,0,0]=3 2890 B17R2.16287 OCc1c(cccc1NCc2c[nH]cn2)Cl 34a_100011916388_100000707719 [0,1,1,0,0,0|1,0,0]=3 2891 B17R2.16287 OCc1c(cccc1NCc2c[nH]cn2)F 34a_100011846719_100000707719 [0,1,1,0,0,0|1,0,0]=3 2892 B17R2.16287 OCc1c(cccc1NCc2cscn2)Br 207a_100000747656_100000743575 [0,1,1,0,0,0|2,0,0]=4 2893 B17R2.16287 OCc1c(cccc1NCc2cscn2)Br 270302a_100000747656_100000743575 [0,1,1,0,0,0|2,0,0]=4 2894 B17R2.16287 OCc1c(cccc1NCc2cscn2)Br 34a_100000747656_100000205941 [0,1,1,0,0,0|2,0,0]=4 2895 B17R2.16287 OCc1c(cccc1NCc2cscn2)Cl 207a_100011916388_100000743575 [0,1,1,0,0,0|2,0,0]=4 2896 B17R2.16287 OCc1c(cccc1NCc2cscn2)Cl 270302a_100011916388_100000743575 [0,1,1,0,0,0|2,0,0]=4 2897 B17R2.16287 OCc1c(cccc1NCc2cscn2)Cl 34a_100011916388_100000205941 [0,1,1,0,0,0|2,0,0]=4 2898 B17R2.16287 OCc1c(cccc1NCc2cscn2)F 207a_100011846719_100000743575 [0,1,1,0,0,0|2,0,0]=4 2899 B17R2.16287 OCc1c(cccc1NCc2cscn2)F 270302a_100011846719_100000743575 [0,1,1,0,0,0|2,0,0]=4 2900 B17R2.16287 OCc1c(cccc1NCc2cscn2)F 34a_100011846719_100000205941 [0,1,1,0,0,0|2,0,0]=4 2901 B17R2.16287 OCc1c(cccc1SCc2c[nH]cn2)F 62a_100000707719_100012355691 [0,1,1,0,0,0|2,0,0]=4 2902 B17R2.16287 OCc1c(cccc1SCc2c[nH]cn2)F 62a_100012355691_100000707719 [0,1,1,0,0,0|2,0,0]=4 2903 B17R2.71328 CCc1cccc(c1NCc2c[nH]cn2)C 2230a_100000210048_100000707719 [0,1,1,0,0,0|0,0,0]=2 2904 B17R2.71328 CCc1cccc(c1NCc2c[nH]cn2)C 34a_100000210048_100000707719 [0,1,1,0,0,0|0,0,0]=2 2905 B17R2.71328 CCc1cccc(c1NCc2cc[nH]n2)C 207a_100000210048_100000738523 [0,1,1,0,0,0|2,0,0]=4 2906 B17R2.71328 CCc1cccc(c1NCc2ccco2)C 207a_100000210048_100000186105 [0,1,1,0,0,0|2,0,0]=4 2907 B17R2.71328 CCc1cccc(c1NCc2ccco2)C 270302a_100000210048_100000186105 [0,1,1,0,0,0|2,0,0]=4 2908 B17R2.71328 CCc1cccc(c1NCc2cccs2)C 207a_100000210048_100000209959 [0,1,1,0,0,0|2,0,0]=4 2909 B17R2.71328 CCc1cccc(c1NCc2cccs2)C 270302a_100000210048_100000209959 [0,1,1,0,0,0|2,0,0]=4 2910 B17R2.71328 CCc1cccc(c1NCc2ccoc2)C 207a_100000210048_100011215517 [0,1,1,0,0,0|2,0,0]=4 2911 B17R2.71328 CCc1cccc(c1NCc2ccon2)C 2230a_100000210048_100000234950 [0,1,1,0,0,0|2,0,0]=4 2912 B17R2.71328 CCc1cccc(c1NCc2ccon2)C 34a_100000210048_100000234950 [0,1,1,0,0,0|2,0,0]=4 2913 B17R2.71328 CCc1cccc(c1NCc2ccon2)C 7a_100000210048_100000234950 [0,1,1,0,0,0|2,0,0]=4 2914 B17R2.71328 CCc1cccc(c1NCc2ccsc2)C 207a_100000210048_100000188534 [0,1,1,0,0,0|2,0,0]=4 2915 B17R2.71328 CCc1cccc(c1NCc2ccsc2)C 2230a_100000210048_100011261437 [0,1,1,0,0,0|2,0,0]=4 2916 B17R2.71328 CCc1cccc(c1NCc2ccsc2)C 270302a_100000210048_100000188534 [0,1,1,0,0,0|2,0,0]=4 2917 B17R2.71328 CCc1cccc(c1NCc2ccsc2)C 34a_100000210048_100011261437 [0,1,1,0,0,0|2,0,0]=4 2918 B17R2.71328 CCc1cccc(c1NCc2ccsc2)C 7a_100000210048_100011261437 [0,1,1,0,0,0|2,0,0]=4 2919 B17R2.71328 CCc1cccc(c1NCc2cn[nH]c2)C 207a_100000210048_100016992096 [0,1,1,0,0,0|2,0,0]=4 2920 B17R2.71328 CCc1cccc(c1NCc2cn[nH]c2)C 270302a_100000210048_100016992096 [0,1,1,0,0,0|2,0,0]=4 2921 B17R2.71328 CCc1cccc(c1NCc2cnc[nH]2)C 207a_100000210048_100000742939 [0,1,1,0,0,0|0,0,2]=4 2922 B17R2.71328 CCc1cccc(c1NCc2cncs2)C 207a_100000210048_100000749870 [0,1,1,0,0,0|1,0,1]=4 2923 B17R2.71328 CCc1cccc(c1NCc2cncs2)C 2230a_100000210048_100015185245 [0,1,1,0,0,0|1,0,1]=4 2924 B17R2.71328 CCc1cccc(c1NCc2cncs2)C 270302a_100000210048_100000749870 [0,1,1,0,0,0|1,0,1]=4 2925 B17R2.71328 CCc1cccc(c1NCc2cncs2)C 34a_100000210048_100015185245 [0,1,1,0,0,0|1,0,1]=4 2926 B17R2.71328 CCc1cccc(c1NCc2cncs2)C 7a_100000210048_100015185245 [0,1,1,0,0,0|1,0,1]=4 2927 B17R2.71328 CCc1cccc(c1NCc2cscn2)C 207a_100000210048_100000743575 [0,1,1,0,0,0|1,0,0]=3 2928 B17R2.71328 CCc1cccc(c1NCc2cscn2)C 2230a_100000210048_100000205941 [0,1,1,0,0,0|1,0,0]=3 2929 B17R2.71328 CCc1cccc(c1NCc2cscn2)C 270302a_100000210048_100000743575 [0,1,1,0,0,0|1,0,0]=3 2930 B17R2.71328 CCc1cccc(c1NCc2cscn2)C 34a_100000210048_100000205941 [0,1,1,0,0,0|1,0,0]=3 2931 B17R2.71328 CCc1cccc(c1NCc2cscn2)C 7a_100000210048_100000205941 [0,1,1,0,0,0|1,0,0]=3 2932 B17R2.71328 CCc1cccc(c1NCc2ncc[nH]2)C 207a_100000210048_100000743867 [0,1,1,0,0,0|2,0,0]=4 2933 B17R2.71328 CCc1cccc(c1NCc2ncc[nH]2)C 2230a_100000210048_100016991755 [0,1,1,0,0,0|2,0,0]=4 2934 B17R2.71328 CCc1cccc(c1NCc2ncc[nH]2)C 34a_100000210048_100016991755 [0,1,1,0,0,0|2,0,0]=4 2935 B17R2.71328 CCc1cccc(c1NCc2ncc[nH]2)C 7a_100000210048_100000753453 [0,1,1,0,0,0|2,0,0]=4 2936 B17R2.71328 CCc1cccc(c1NCc2ncco2)C 2230a_100000210048_103436540062 [0,1,1,0,0,0|2,0,0]=4 2937 B17R2.71328 CCc1cccc(c1NCc2ncco2)C 34a_100000210048_103436540062 [0,1,1,0,0,0|2,0,0]=4 2938 B17R2.71328 CCc1cccc(c1NCc2ncco2)C 7a_100000210048_103436540062 [0,1,1,0,0,0|2,0,0]=4 2939 B17R2.71328 CCc1cccc(c1NCc2nccs2)C 207a_100000210048_100000750902 [0,1,1,0,0,0|2,0,0]=4 2940 B17R2.71328 CCc1cccc(c1NCc2nccs2)C 2230a_100000210048_100015184050 [0,1,1,0,0,0|2,0,0]=4 2941 B17R2.71328 CCc1cccc(c1NCc2nccs2)C 270302a_100000210048_100000750902 [0,1,1,0,0,0|2,0,0]=4 2942 B17R2.71328 CCc1cccc(c1NCc2nccs2)C 34a_100000210048_100015184050 [0,1,1,0,0,0|2,0,0]=4 2943 B17R2.71328 CCc1cccc(c1NCc2nccs2)C 7a_100000210048_100015184050 [0,1,1,0,0,0|2,0,0]=4 2944 B17R2.71328 CCc1cccc(c1NCc2ncon2)C 34a_100000210048_100000233494 [0,1,1,0,0,0|2,0,0]=4 2945 B17R2.71328 CCc1cccc(c1NCn2cncn2)C 2230a_100000210048_200020645497 [0,1,1,0,0,0|1,0,1]=4 2946 B17R2.71328 CCc1cccc(c1NCn2cncn2)C 34a_100000210048_200020645497 [0,1,1,0,0,0|1,0,1]=4 2947 B17R2.71328 CCc1cccc(c1NCn2cncn2)C 7a_100000210048_200020645497 [0,1,1,0,0,0|1,0,1]=4 2948 B17R2.71328 CCc1cccc(c1OCc2c[nH]cn2)Br 34a_200010001580_100000707719 [0,1,1,0,0,0|1,0,0]=3 2949 B17R2.71328 CCc1cccc(c1OCc2c[nH]cn2)C 34a_100000034007_100000707719 [0,1,1,0,0,0|1,0,0]=3 2950 B17R2.71328 CCc1cccc(c1OCc2cscn2)Br 34a_200010001580_100000205941 [0,1,1,0,0,0|2,0,0]=4 2951 B17R2.71328 CCc1cccc(c1OCc2cscn2)Br 7a_200010001580_100000205941 [0,1,1,0,0,0|2,0,0]=4 2952 B17R2.71328 CCc1cccc(c1OCc2cscn2)C 34a_100000034007_100000205941 [0,1,1,0,0,0|2,0,0]=4 2953 B17R2.71328 CCc1cccc(c1OCc2cscn2)C 7a_100000034007_100000205941 [0,1,1,0,0,0|2,0,0]=4 2954 B17R2.71328 CCc1cccc(c1SCc2c[nH]cn2)C 62a_100000036235_100000707719 [0,1,1,0,0,0|1,0,0]=3 2955 B17R2.71328 CCc1cccc(c1SCc2c[nH]cn2)C 62a_100000707719_100000036235 [0,1,1,0,0,0|1,0,0]=3 2956 B17R2.71328 CCc1cccc(c1SCc2cscn2)C 62a_100000036235_100000205941 [0,1,1,0,0,0|2,0,0]=4 2957 B17R2.71328 CCc1cccc(c1SCc2cscn2)C 62a_100000205941_100000036235 [0,1,1,0,0,0|2,0,0]=4 2958 B17R2.71328 CCc1occc(=O)c1OCc2c[nH]cn2 34a_100000033269_100000707719 [0,1,1,0,0,0|2,0,0]=4 2959 B17R2.71328 COc1cccc(c1NCc2c[nH]cn2)Br 34a_100000708083_100000707719 [0,1,1,0,0,0|1,0,0]=3 2960 B17R2.71328 COc1cccc(c1NCc2c[nH]cn2)C 2230a_100000758225_100000707719 [0,1,1,0,0,0|1,0,0]=3 2961 B17R2.71328 COc1cccc(c1NCc2c[nH]cn2)C 34a_100000758225_100000707719 [0,1,1,0,0,0|1,0,0]=3 2962 B17R2.71328 COc1cccc(c1NCc2c[nH]cn2)Cl 34a_100011309317_100000707719 [0,1,1,0,0,0|1,0,0]=3 2963 B17R2.71328 COc1cccc(c1NCc2c[nH]cn2)F 34a_100000686744_100000707719 [0,1,1,0,0,0|1,0,0]=3 2964 B17R2.71328 COc1cccc(c1NCc2c[nH]cn2)O 34a_100012022766_100000707719 [0,1,1,0,0,0|1,0,0]=3 2965 B17R2.71328 COc1cccc(c1NCc2cscn2)Br 34a_100000708083_100000205941 [0,1,1,0,0,0|2,0,0]=4 2966 B17R2.71328 COc1cccc(c1NCc2cscn2)C 207a_100000758225_100000743575 [0,1,1,0,0,0|2,0,0]=4 2967 B17R2.71328 COc1cccc(c1NCc2cscn2)C 2230a_100000758225_100000205941 [0,1,1,0,0,0|2,0,0]=4 2968 B17R2.71328 COc1cccc(c1NCc2cscn2)C 270302a_100000758225_100000743575 [0,1,1,0,0,0|2,0,0]=4 2969 B17R2.71328 COc1cccc(c1NCc2cscn2)C 34a_100000758225_100000205941 [0,1,1,0,0,0|2,0,0]=4 2970 B17R2.71328 COc1cccc(c1NCc2cscn2)Cl 207a_100011309317_100000743575 [0,1,1,0,0,0|2,0,0]=4 2971 B17R2.71328 COc1cccc(c1NCc2cscn2)Cl 34a_100011309317_100000205941 [0,1,1,0,0,0|2,0,0]=4 2972 B17R2.71328 COc1cccc(c1NCc2cscn2)F 207a_100000686744_100000743575 [0,1,1,0,0,0|2,0,0]=4 2973 B17R2.71328 COc1cccc(c1NCc2cscn2)F 270302a_100000686744_100000743575 [0,1,1,0,0,0|2,0,0]=4 2974 B17R2.71328 COc1cccc(c1NCc2cscn2)F 34a_100000686744_100000205941 [0,1,1,0,0,0|2,0,0]=4 2975 B17R2.71328 COc1cccc(c1NCc2cscn2)O 34a_100012022766_100000205941 [0,1,1,0,0,0|2,0,0]=4 2976 B17R2.71328 COc1cccc(c1OCc2c[nH]cn2)Br 34a_100000686866_100000707719 [0,1,1,0,0,0|2,0,0]=4 2977 B17R2.71328 COc1cccc(c1OCc2c[nH]cn2)C 34a_100011219253_100000707719 [0,1,1,0,0,0|2,0,0]=4 2978 B17R2.71328 COc1cccc(c1OCc2c[nH]cn2)Cl 34a_100009851661_100000707719 [0,1,1,0,0,0|2,0,0]=4 2979 B17R2.71328 COc1cccc(c1OCc2c[nH]cn2)F 34a_100000036725_100000707719 [0,1,1,0,0,0|2,0,0]=4 2980 B17R2.71328 COc1cccc(c1OCc2c[nH]cn2)N 34a_100000123586_100000707719 [0,1,1,0,0,0|2,0,0]=4 2981 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100010131421 [0,1,1,0,0,0|2,0,0]=4 2982 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)Br 62a_100010131421_100000707719 [0,1,1,0,0,0|2,0,0]=4 2983 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)C 62a_100000707719_100010191535 [0,1,1,0,0,0|2,0,0]=4 2984 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)C 62a_100010191535_100000707719 [0,1,1,0,0,0|2,0,0]=4 2985 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)F 62a_100000703912_100000707719 [0,1,1,0,0,0|2,0,0]=4 2986 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)F 62a_100000707719_100000703912 [0,1,1,0,0,0|2,0,0]=4 2987 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)N 62a_100000703447_100000707719 [0,1,1,0,0,0|2,0,0]=4 2988 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)N 62a_100000707719_100000703447 [0,1,1,0,0,0|2,0,0]=4 2989 B17R2.71328 COc1cccc(c1SCc2c[nH]cn2)O 62a_100000707719_100010202623 [0,1,1,0,0,0|2,0,0]=4 2990 B17R2.71328 Cc1cccc(c1NCc2c[nH]cn2)C#N 2230a_100011826843_100000707719 [0,1,1,0,0,0|1,0,1]=4 2991 B17R2.71328 Cc1cccc(c1NCc2c[nH]cn2)CO 34a_100011215590_100000707719 [0,1,1,0,0,0|1,0,0]=3 2992 B17R2.71328 Cc1cccc(c1NCc2cscn2)CO 207a_100011215590_100000743575 [0,1,1,0,0,0|2,0,0]=4 2993 B17R2.71328 Cc1cccc(c1NCc2cscn2)CO 270302a_100011215590_100000743575 [0,1,1,0,0,0|2,0,0]=4 2994 B17R2.71328 Cc1cccc(c1NCc2cscn2)CO 34a_100011215590_100000205941 [0,1,1,0,0,0|2,0,0]=4 2995 B17R2.71328 Cc1cccc(c1OCc2c[nH]cn2)CN 34a_100020639391_100000707719 [0,1,1,0,0,0|2,0,0]=4 2996 B17R2.71328 Cc1cccc(c1SCc2c[nH]cn2)CO 62a_100000707719_100011659289 [0,1,1,0,0,0|2,0,0]=4 2997 B17R2.71328 Cc1cccc(c1SCc2c[nH]cn2)CO 62a_100011659289_100000707719 [0,1,1,0,0,0|2,0,0]=4 2998 B17R2.71328 N#Cc1cccc(c1NCc2c[nH]cn2)F 2230a_100011219409_100000707719 [0,1,1,0,0,0|1,0,1]=4 2999 B17R2.71328 N#Cc1cccc(c1NCc2c[nH]cn2)F 34a_100011219409_100000707719 [0,1,1,0,0,0|1,0,1]=4 3000 B17R2.71328 NCc1cccc(c1SCc2c[nH]cn2)F 62a_100000707719_100020638964 [0,1,1,0,0,0|2,0,0]=4 3001 B17R2.71328 NCc1cccc(c1SCc2c[nH]cn2)F 62a_100020638964_100000707719 [0,1,1,0,0,0|2,0,0]=4 3002 B17R2.71328 OCc1cccc(c1NCc2c[nH]cn2)Cl 34a_100012182729_100000707719 [0,1,1,0,0,0|1,0,0]=3 3003 B17R2.71328 OCc1cccc(c1NCc2c[nH]cn2)F 34a_100000692437_100000707719 [0,1,1,0,0,0|1,0,0]=3 3004 B17R2.71328 OCc1cccc(c1NCc2cscn2)Br 270302a_100012349457_100000743575 [0,1,1,0,0,0|2,0,0]=4 3005 B17R2.71328 OCc1cccc(c1NCc2cscn2)Cl 270302a_100012182729_100000743575 [0,1,1,0,0,0|2,0,0]=4 3006 B17R2.71328 OCc1cccc(c1NCc2cscn2)Cl 34a_100012182729_100000205941 [0,1,1,0,0,0|2,0,0]=4 3007 B17R2.71328 OCc1cccc(c1NCc2cscn2)F 207a_100000692437_100000743575 [0,1,1,0,0,0|2,0,0]=4 3008 B17R2.71328 OCc1cccc(c1NCc2cscn2)F 270302a_100000692437_100000743575 [0,1,1,0,0,0|2,0,0]=4 3009 B17R2.71328 OCc1cccc(c1NCc2cscn2)F 34a_100000692437_100000205941 [0,1,1,0,0,0|2,0,0]=4 3010 B17R2.71328 OCc1cccc(c1OCc2c[nH]cn2)F 34a_100011997349_100000707719 [0,1,1,0,0,0|2,0,0]=4 3011 B17R2.71328 OCc1cccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100010146604 [0,1,1,0,0,0|2,0,0]=4 3012 B17R2.71328 OCc1cccc(c1SCc2c[nH]cn2)Br 62a_100010146604_100000707719 [0,1,1,0,0,0|2,0,0]=4 3013 B17R2.71328 OCc1cccc(c1SCc2c[nH]cn2)F 62a_100000707719_100012351117 [0,1,1,0,0,0|2,0,0]=4 3014 B17R2.71328 OCc1cccc(c1SCc2c[nH]cn2)F 62a_100012351117_100000707719 [0,1,1,0,0,0|2,0,0]=4 3015 B17R2.346 Brc1ccc(cc1)CCCSc2c[nH]cn2 62a_100000756875_100011713682 [0,1,1,0,0,0|2,0,0]=4 3016 B17R2.346 Brc1ccc(cc1)CCCSc2c[nH]cn2 62a_100011713682_100000756875 [0,1,1,0,0,0|2,0,0]=4 3017 B17R2.346 Brc1ccc(cc1)CCNCc2c[nH]cn2 2230a_100000755846_100000707719 [0,1,1,0,0,0|0,0,0]=2 3018 B17R2.346 Brc1ccc(cc1)CCNCc2c[nH]cn2 34a_100000755846_100000707719 [0,1,1,0,0,0|0,0,0]=2 3019 B17R2.346 Brc1ccc(cc1)CCNCc2cc[nH]n2 207a_100000755846_100000738523 [0,1,1,0,0,0|2,0,0]=4 3020 B17R2.346 Brc1ccc(cc1)CCNCc2cc[nH]n2 270004a_100000755846_100000738523 [0,1,1,0,0,0|2,0,0]=4 3021 B17R2.346 Brc1ccc(cc1)CCNCc2ccco2 207a_100000755846_100000186105 [0,1,1,0,0,0|2,0,0]=4 3022 B17R2.346 Brc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100011740612 [0,1,1,0,0,0|2,0,0]=4 3023 B17R2.346 Brc1ccc(cc1)CCNCc2ccco2 270004a_100000755846_100000186105 [0,1,1,0,0,0|2,0,0]=4 3024 B17R2.346 Brc1ccc(cc1)CCNCc2ccco2 34a_100000185738_100011740612 [0,1,1,0,0,0|2,0,0]=4 3025 B17R2.346 Brc1ccc(cc1)CCNCc2cccs2 207a_100000755846_100000209959 [0,1,1,0,0,0|2,0,0]=4 3026 B17R2.346 Brc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100011740612 [0,1,1,0,0,0|2,0,0]=4 3027 B17R2.346 Brc1ccc(cc1)CCNCc2cccs2 270004a_100000755846_100000209959 [0,1,1,0,0,0|2,0,0]=4 3028 B17R2.346 Brc1ccc(cc1)CCNCc2ccoc2 207a_100000755846_100011215517 [0,1,1,0,0,0|2,0,0]=4 3029 B17R2.346 Brc1ccc(cc1)CCNCc2ccoc2 2230a_100015206860_100011740612 [0,1,1,0,0,0|2,0,0]=4 3030 B17R2.346 Brc1ccc(cc1)CCNCc2ccoc2 270004a_100000755846_100011215517 [0,1,1,0,0,0|2,0,0]=4 3031 B17R2.346 Brc1ccc(cc1)CCNCc2ccoc2 34a_100015206860_100011740612 [0,1,1,0,0,0|2,0,0]=4 3032 B17R2.346 Brc1ccc(cc1)CCNCc2ccon2 2230a_100000755846_100000234950 [0,1,1,0,0,0|2,0,0]=4 3033 B17R2.346 Brc1ccc(cc1)CCNCc2ccon2 34a_100000755846_100000234950 [0,1,1,0,0,0|2,0,0]=4 3034 B17R2.346 Brc1ccc(cc1)CCNCc2ccsc2 207a_100000755846_100000188534 [0,1,1,0,0,0|2,0,0]=4 3035 B17R2.346 Brc1ccc(cc1)CCNCc2ccsc2 2230a_100000186416_100011740612 [0,1,1,0,0,0|2,0,0]=4 3036 B17R2.346 Brc1ccc(cc1)CCNCc2ccsc2 2230a_100000755846_100011261437 [0,1,1,0,0,0|2,0,0]=4 3037 B17R2.346 Brc1ccc(cc1)CCNCc2ccsc2 270004a_100000755846_100000188534 [0,1,1,0,0,0|2,0,0]=4 3038 B17R2.346 Brc1ccc(cc1)CCNCc2ccsc2 34a_100000186416_100011740612 [0,1,1,0,0,0|2,0,0]=4 3039 B17R2.346 Brc1ccc(cc1)CCNCc2ccsc2 34a_100000755846_100011261437 [0,1,1,0,0,0|2,0,0]=4 3040 B17R2.346 Brc1ccc(cc1)CCNCc2cn[nH]c2 207a_100000755846_100016992096 [0,1,1,0,0,0|2,0,0]=4 3041 B17R2.346 Brc1ccc(cc1)CCNCc2cn[nH]c2 270004a_100000755846_100016992096 [0,1,1,0,0,0|2,0,0]=4 3042 B17R2.346 Brc1ccc(cc1)CCNCc2cnc[nH]2 207a_100000755846_100000742939 [0,1,1,0,0,0|0,0,2]=4 3043 B17R2.346 Brc1ccc(cc1)CCNCc2cnco2 270004a_100000755846_100000064291 [0,1,1,0,0,0|1,0,1]=4 3044 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 207a_100000755846_100000749870 [0,1,1,0,0,0|1,0,1]=4 3045 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 2230a_100000755846_100015185245 [0,1,1,0,0,0|1,0,1]=4 3046 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100011740612 [0,1,1,0,0,0|1,0,1]=4 3047 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 270004a_100000755846_100000749870 [0,1,1,0,0,0|1,0,1]=4 3048 B17R2.346 Brc1ccc(cc1)CCNCc2cncs2 34a_100000755846_100015185245 [0,1,1,0,0,0|1,0,1]=4 3049 B17R2.346 Brc1ccc(cc1)CCNCc2cocn2 270004a_100000755846_100000050382 [0,1,1,0,0,0|1,0,0]=3 3050 B17R2.346 Brc1ccc(cc1)CCNCc2cscn2 207a_100000755846_100000743575 [0,1,1,0,0,0|1,0,0]=3 3051 B17R2.346 Brc1ccc(cc1)CCNCc2cscn2 2230a_100000755846_100000205941 [0,1,1,0,0,0|1,0,0]=3 3052 B17R2.346 Brc1ccc(cc1)CCNCc2cscn2 2230a_100015185402_100011740612 [0,1,1,0,0,0|1,0,0]=3 3053 B17R2.346 Brc1ccc(cc1)CCNCc2cscn2 270004a_100000755846_100000743575 [0,1,1,0,0,0|1,0,0]=3 3054 B17R2.346 Brc1ccc(cc1)CCNCc2cscn2 34a_100000755846_100000205941 [0,1,1,0,0,0|1,0,0]=3 3055 B17R2.346 Brc1ccc(cc1)CCNCc2csnn2 270004a_100000755846_100000738508 [0,1,1,0,0,0|2,0,0]=4 3056 B17R2.346 Brc1ccc(cc1)CCNCc2ncc[nH]2 207a_100000755846_100000743867 [0,1,1,0,0,0|2,0,0]=4 3057 B17R2.346 Brc1ccc(cc1)CCNCc2ncc[nH]2 2230a_100000755846_100016991755 [0,1,1,0,0,0|2,0,0]=4 3058 B17R2.346 Brc1ccc(cc1)CCNCc2ncc[nH]2 34a_100000755846_100016991755 [0,1,1,0,0,0|2,0,0]=4 3059 B17R2.346 Brc1ccc(cc1)CCNCc2ncco2 2230a_100000755846_103436540062 [0,1,1,0,0,0|2,0,0]=4 3060 B17R2.346 Brc1ccc(cc1)CCNCc2ncco2 2230a_100016994969_100011740612 [0,1,1,0,0,0|2,0,0]=4 3061 B17R2.346 Brc1ccc(cc1)CCNCc2ncco2 270004a_100000755846_100000064290 [0,1,1,0,0,0|2,0,0]=4 3062 B17R2.346 Brc1ccc(cc1)CCNCc2ncco2 34a_100000755846_103436540062 [0,1,1,0,0,0|2,0,0]=4 3063 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 207a_100000755846_100000750902 [0,1,1,0,0,0|2,0,0]=4 3064 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100011740612 [0,1,1,0,0,0|2,0,0]=4 3065 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 2230a_100000755846_100015184050 [0,1,1,0,0,0|2,0,0]=4 3066 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 270004a_100000755846_100000750902 [0,1,1,0,0,0|2,0,0]=4 3067 B17R2.346 Brc1ccc(cc1)CCNCc2nccs2 34a_100000755846_100015184050 [0,1,1,0,0,0|2,0,0]=4 3068 B17R2.346 Brc1ccc(cc1)CCNCc2ncon2 34a_100000755846_100000233494 [0,1,1,0,0,0|2,0,0]=4 3069 B17R2.346 Brc1ccc(cc1)CCNCn2cncn2 2230a_100000755846_200020645497 [0,1,1,0,0,0|1,0,1]=4 3070 B17R2.346 Brc1ccc(cc1)CCNCn2cncn2 34a_100000755846_200020645497 [0,1,1,0,0,0|1,0,1]=4 3071 B17R2.346 Brc1ccc(cc1)CCOCc2c[nH]cn2 34a_100000766406_100000707719 [0,1,1,0,0,0|1,0,0]=3 3072 B17R2.346 Brc1ccc(cc1)CCOCc2cscn2 34a_100000766406_100000205941 [0,1,1,0,0,0|2,0,0]=4 3073 B17R2.346 Brc1ccc(cc1)CCOCc2cscn2 7a_100000766406_100000205941 [0,1,1,0,0,0|2,0,0]=4 3074 B17R2.346 Brc1ccc(cc1)CCSCc2c[nH]cn2 62a_100000707719_100011740612 [0,1,1,0,0,0|1,0,0]=3 3075 B17R2.346 Brc1ccc(cc1)CCSCc2c[nH]cn2 62a_100011740612_100000707719 [0,1,1,0,0,0|1,0,0]=3 3076 B17R2.346 Brc1ccc(cc1)CCSCc2cscn2 62a_100000205941_100011740612 [0,1,1,0,0,0|2,0,0]=4 3077 B17R2.346 Brc1ccc(cc1)CCSCc2cscn2 62a_100011740612_100000205941 [0,1,1,0,0,0|2,0,0]=4 3078 B17R2.346 Brc1ccc(cc1)CNCCc2c[nH]cn2 2230a_100000174875_100020628418 [0,1,1,0,0,0|2,0,0]=4 3079 B17R2.346 Brc1ccc(cc1)CNCCc2c[nH]cn2 270004a_100000755092_100000186029 [0,1,1,0,0,0|2,0,0]=4 3080 B17R2.346 Brc1ccc(cc1)CSCCc2c[nH]cn2 62a_100000189115_100020628418 [0,1,1,0,0,0|2,0,0]=4 3081 B17R2.346 Brc1ccc(cc1)CSCCc2c[nH]cn2 62a_100020628418_100000189115 [0,1,1,0,0,0|2,0,0]=4 3082 B17R2.346 Brc1ccc(nc1)CCOCc2c[nH]cn2 34a_100012357577_100000707719 [0,1,1,0,0,0|2,0,0]=4 3083 B17R2.346 Cc1ccc(cc1)CCNCc2c[nH]cn2 2230a_100000705350_100000707719 [0,1,1,0,0,0|0,0,0]=2 3084 B17R2.346 Cc1ccc(cc1)CCNCc2c[nH]cn2 34a_100000705350_100000707719 [0,1,1,0,0,0|0,0,0]=2 3085 B17R2.346 Cc1ccc(cc1)CCNCc2cc[nH]n2 207a_100000705350_100000738523 [0,1,1,0,0,0|2,0,0]=4 3086 B17R2.346 Cc1ccc(cc1)CCNCc2cc[nH]n2 270004a_100000705350_100000738523 [0,1,1,0,0,0|2,0,0]=4 3087 B17R2.346 Cc1ccc(cc1)CCNCc2ccco2 207a_100000705350_100000186105 [0,1,1,0,0,0|2,0,0]=4 3088 B17R2.346 Cc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100011713686 [0,1,1,0,0,0|2,0,0]=4 3089 B17R2.346 Cc1ccc(cc1)CCNCc2ccco2 270004a_100000705350_100000186105 [0,1,1,0,0,0|2,0,0]=4 3090 B17R2.346 Cc1ccc(cc1)CCNCc2ccco2 34a_100000185738_100011713686 [0,1,1,0,0,0|2,0,0]=4 3091 B17R2.346 Cc1ccc(cc1)CCNCc2cccs2 207a_100000705350_100000209959 [0,1,1,0,0,0|2,0,0]=4 3092 B17R2.346 Cc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100011713686 [0,1,1,0,0,0|2,0,0]=4 3093 B17R2.346 Cc1ccc(cc1)CCNCc2cccs2 270004a_100000705350_100000209959 [0,1,1,0,0,0|2,0,0]=4 3094 B17R2.346 Cc1ccc(cc1)CCNCc2ccoc2 207a_100000705350_100011215517 [0,1,1,0,0,0|2,0,0]=4 3095 B17R2.346 Cc1ccc(cc1)CCNCc2ccoc2 2230a_100015206860_100011713686 [0,1,1,0,0,0|2,0,0]=4 3096 B17R2.346 Cc1ccc(cc1)CCNCc2ccoc2 270004a_100000705350_100011215517 [0,1,1,0,0,0|2,0,0]=4 3097 B17R2.346 Cc1ccc(cc1)CCNCc2ccoc2 34a_100015206860_100011713686 [0,1,1,0,0,0|2,0,0]=4 3098 B17R2.346 Cc1ccc(cc1)CCNCc2ccon2 2230a_100000705350_100000234950 [0,1,1,0,0,0|2,0,0]=4 3099 B17R2.346 Cc1ccc(cc1)CCNCc2ccon2 34a_100000705350_100000234950 [0,1,1,0,0,0|2,0,0]=4 3100 B17R2.346 Cc1ccc(cc1)CCNCc2ccsc2 207a_100000705350_100000188534 [0,1,1,0,0,0|2,0,0]=4 3101 B17R2.346 Cc1ccc(cc1)CCNCc2ccsc2 2230a_100000186416_100011713686 [0,1,1,0,0,0|2,0,0]=4 3102 B17R2.346 Cc1ccc(cc1)CCNCc2ccsc2 2230a_100000705350_100011261437 [0,1,1,0,0,0|2,0,0]=4 3103 B17R2.346 Cc1ccc(cc1)CCNCc2ccsc2 270004a_100000705350_100000188534 [0,1,1,0,0,0|2,0,0]=4 3104 B17R2.346 Cc1ccc(cc1)CCNCc2ccsc2 34a_100000186416_100011713686 [0,1,1,0,0,0|2,0,0]=4 3105 B17R2.346 Cc1ccc(cc1)CCNCc2ccsc2 34a_100000705350_100011261437 [0,1,1,0,0,0|2,0,0]=4 3106 B17R2.346 Cc1ccc(cc1)CCNCc2cn[nH]c2 207a_100000705350_100016992096 [0,1,1,0,0,0|2,0,0]=4 3107 B17R2.346 Cc1ccc(cc1)CCNCc2cn[nH]c2 270004a_100000705350_100016992096 [0,1,1,0,0,0|2,0,0]=4 3108 B17R2.346 Cc1ccc(cc1)CCNCc2cnc[nH]2 207a_100000705350_100000742939 [0,1,1,0,0,0|0,0,2]=4 3109 B17R2.346 Cc1ccc(cc1)CCNCc2cnco2 270004a_100000705350_100000064291 [0,1,1,0,0,0|1,0,1]=4 3110 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 207a_100000705350_100000749870 [0,1,1,0,0,0|1,0,1]=4 3111 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 2230a_100000705350_100015185245 [0,1,1,0,0,0|1,0,1]=4 3112 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100011713686 [0,1,1,0,0,0|1,0,1]=4 3113 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 270004a_100000705350_100000749870 [0,1,1,0,0,0|1,0,1]=4 3114 B17R2.346 Cc1ccc(cc1)CCNCc2cncs2 34a_100000705350_100015185245 [0,1,1,0,0,0|1,0,1]=4 3115 B17R2.346 Cc1ccc(cc1)CCNCc2cocn2 270004a_100000705350_100000050382 [0,1,1,0,0,0|1,0,0]=3 3116 B17R2.346 Cc1ccc(cc1)CCNCc2cscn2 207a_100000705350_100000743575 [0,1,1,0,0,0|1,0,0]=3 3117 B17R2.346 Cc1ccc(cc1)CCNCc2cscn2 2230a_100000705350_100000205941 [0,1,1,0,0,0|1,0,0]=3 3118 B17R2.346 Cc1ccc(cc1)CCNCc2cscn2 2230a_100015185402_100011713686 [0,1,1,0,0,0|1,0,0]=3 3119 B17R2.346 Cc1ccc(cc1)CCNCc2cscn2 270004a_100000705350_100000743575 [0,1,1,0,0,0|1,0,0]=3 3120 B17R2.346 Cc1ccc(cc1)CCNCc2cscn2 34a_100000705350_100000205941 [0,1,1,0,0,0|1,0,0]=3 3121 B17R2.346 Cc1ccc(cc1)CCNCc2csnn2 270004a_100000705350_100000738508 [0,1,1,0,0,0|2,0,0]=4 3122 B17R2.346 Cc1ccc(cc1)CCNCc2ncc[nH]2 207a_100000705350_100000743867 [0,1,1,0,0,0|2,0,0]=4 3123 B17R2.346 Cc1ccc(cc1)CCNCc2ncc[nH]2 2230a_100000705350_100016991755 [0,1,1,0,0,0|2,0,0]=4 3124 B17R2.346 Cc1ccc(cc1)CCNCc2ncc[nH]2 34a_100000705350_100016991755 [0,1,1,0,0,0|2,0,0]=4 3125 B17R2.346 Cc1ccc(cc1)CCNCc2ncco2 2230a_100000705350_103436540062 [0,1,1,0,0,0|2,0,0]=4 3126 B17R2.346 Cc1ccc(cc1)CCNCc2ncco2 2230a_100016994969_100011713686 [0,1,1,0,0,0|2,0,0]=4 3127 B17R2.346 Cc1ccc(cc1)CCNCc2ncco2 270004a_100000705350_100000064290 [0,1,1,0,0,0|2,0,0]=4 3128 B17R2.346 Cc1ccc(cc1)CCNCc2ncco2 34a_100000705350_103436540062 [0,1,1,0,0,0|2,0,0]=4 3129 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 207a_100000705350_100000750902 [0,1,1,0,0,0|2,0,0]=4 3130 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 2230a_100000705350_100015184050 [0,1,1,0,0,0|2,0,0]=4 3131 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100011713686 [0,1,1,0,0,0|2,0,0]=4 3132 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 270004a_100000705350_100000750902 [0,1,1,0,0,0|2,0,0]=4 3133 B17R2.346 Cc1ccc(cc1)CCNCc2nccs2 34a_100000705350_100015184050 [0,1,1,0,0,0|2,0,0]=4 3134 B17R2.346 Cc1ccc(cc1)CCNCc2ncon2 34a_100000705350_100000233494 [0,1,1,0,0,0|2,0,0]=4 3135 B17R2.346 Cc1ccc(cc1)CCNCn2cncn2 2230a_100000705350_200020645497 [0,1,1,0,0,0|1,0,1]=4 3136 B17R2.346 Cc1ccc(cc1)CCNCn2cncn2 34a_100000705350_200020645497 [0,1,1,0,0,0|1,0,1]=4 3137 B17R2.346 Cc1ccc(cc1)CCOCc2c[nH]cn2 34a_100000756670_100000707719 [0,1,1,0,0,0|1,0,0]=3 3138 B17R2.346 Cc1ccc(cc1)CCOCc2cscn2 34a_100000756670_100000205941 [0,1,1,0,0,0|2,0,0]=4 3139 B17R2.346 Cc1ccc(cc1)CCOCc2cscn2 7a_100000756670_100000205941 [0,1,1,0,0,0|2,0,0]=4 3140 B17R2.346 Cc1ccc(cc1)CCSCc2c[nH]cn2 62a_100000707719_100011713686 [0,1,1,0,0,0|1,0,0]=3 3141 B17R2.346 Cc1ccc(cc1)CCSCc2c[nH]cn2 62a_100011713686_100000707719 [0,1,1,0,0,0|1,0,0]=3 3142 B17R2.346 Cc1ccc(cc1)CCSCc2cscn2 62a_100000205941_100011713686 [0,1,1,0,0,0|2,0,0]=4 3143 B17R2.346 Cc1ccc(cc1)CCSCc2cscn2 62a_100011713686_100000205941 [0,1,1,0,0,0|2,0,0]=4 3144 B17R2.346 Cc1ccc(cc1)CNCCc2c[nH]cn2 2230a_100000174908_100020628418 [0,1,1,0,0,0|2,0,0]=4 3145 B17R2.346 Cc1ccc(cc1)CNCCc2c[nH]cn2 270004a_100000755092_100000211033 [0,1,1,0,0,0|2,0,0]=4 3146 B17R2.346 Cc1ccc(cc1)COCCc2c[nH]cn2 7a_100011215236_100020628418 [0,1,1,0,0,0|2,0,0]=4 3147 B17R2.346 Cc1ccc(cc1)CSCCc2c[nH]cn2 62a_100000210814_100020628418 [0,1,1,0,0,0|2,0,0]=4 3148 B17R2.346 Cc1ccc(cc1)CSCCc2c[nH]cn2 62a_100020628418_100000210814 [0,1,1,0,0,0|2,0,0]=4 3149 B17R2.346 Cc1ccc(cn1)CCOCc2c[nH]cn2 34a_100011815783_100000707719 [0,1,1,0,0,0|2,0,0]=4 3150 B17R2.346 Clc1ccc(cc1)CCCSc2c[nH]cn2 62a_100000756875_100000759440 [0,1,1,0,0,0|2,0,0]=4 3151 B17R2.346 Clc1ccc(cc1)CCCSc2c[nH]cn2 62a_100000759440_100000756875 [0,1,1,0,0,0|2,0,0]=4 3152 B17R2.346 Clc1ccc(cc1)CCNCc2c[nH]cn2 2230a_100000185265_100000707719 [0,1,1,0,0,0|0,0,0]=2 3153 B17R2.346 Clc1ccc(cc1)CCNCc2c[nH]cn2 34a_100000185265_100000707719 [0,1,1,0,0,0|0,0,0]=2 3154 B17R2.346 Clc1ccc(cc1)CCNCc2cc[nH]n2 207a_100000185265_100000738523 [0,1,1,0,0,0|2,0,0]=4 3155 B17R2.346 Clc1ccc(cc1)CCNCc2cc[nH]n2 270004a_100000185265_100000738523 [0,1,1,0,0,0|2,0,0]=4 3156 B17R2.346 Clc1ccc(cc1)CCNCc2ccco2 207a_100000185265_100000186105 [0,1,1,0,0,0|2,0,0]=4 3157 B17R2.346 Clc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100011713675 [0,1,1,0,0,0|2,0,0]=4 3158 B17R2.346 Clc1ccc(cc1)CCNCc2ccco2 270004a_100000185265_100000186105 [0,1,1,0,0,0|2,0,0]=4 3159 B17R2.346 Clc1ccc(cc1)CCNCc2ccco2 34a_100000185738_100011713675 [0,1,1,0,0,0|2,0,0]=4 3160 B17R2.346 Clc1ccc(cc1)CCNCc2cccs2 207a_100000185265_100000209959 [0,1,1,0,0,0|2,0,0]=4 3161 B17R2.346 Clc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100011713675 [0,1,1,0,0,0|2,0,0]=4 3162 B17R2.346 Clc1ccc(cc1)CCNCc2cccs2 270004a_100000185265_100000209959 [0,1,1,0,0,0|2,0,0]=4 3163 B17R2.346 Clc1ccc(cc1)CCNCc2ccoc2 207a_100000185265_100011215517 [0,1,1,0,0,0|2,0,0]=4 3164 B17R2.346 Clc1ccc(cc1)CCNCc2ccoc2 2230a_100015206860_100011713675 [0,1,1,0,0,0|2,0,0]=4 3165 B17R2.346 Clc1ccc(cc1)CCNCc2ccoc2 270004a_100000185265_100011215517 [0,1,1,0,0,0|2,0,0]=4 3166 B17R2.346 Clc1ccc(cc1)CCNCc2ccoc2 34a_100015206860_100011713675 [0,1,1,0,0,0|2,0,0]=4 3167 B17R2.346 Clc1ccc(cc1)CCNCc2ccon2 2230a_100000185265_100000234950 [0,1,1,0,0,0|2,0,0]=4 3168 B17R2.346 Clc1ccc(cc1)CCNCc2ccon2 34a_100000185265_100000234950 [0,1,1,0,0,0|2,0,0]=4 3169 B17R2.346 Clc1ccc(cc1)CCNCc2ccsc2 207a_100000185265_100000188534 [0,1,1,0,0,0|2,0,0]=4 3170 B17R2.346 Clc1ccc(cc1)CCNCc2ccsc2 2230a_100000185265_100011261437 [0,1,1,0,0,0|2,0,0]=4 3171 B17R2.346 Clc1ccc(cc1)CCNCc2ccsc2 2230a_100000186416_100011713675 [0,1,1,0,0,0|2,0,0]=4 3172 B17R2.346 Clc1ccc(cc1)CCNCc2ccsc2 270004a_100000185265_100000188534 [0,1,1,0,0,0|2,0,0]=4 3173 B17R2.346 Clc1ccc(cc1)CCNCc2ccsc2 34a_100000185265_100011261437 [0,1,1,0,0,0|2,0,0]=4 3174 B17R2.346 Clc1ccc(cc1)CCNCc2ccsc2 34a_100000186416_100011713675 [0,1,1,0,0,0|2,0,0]=4 3175 B17R2.346 Clc1ccc(cc1)CCNCc2cn[nH]c2 207a_100000185265_100016992096 [0,1,1,0,0,0|2,0,0]=4 3176 B17R2.346 Clc1ccc(cc1)CCNCc2cn[nH]c2 270004a_100000185265_100016992096 [0,1,1,0,0,0|2,0,0]=4 3177 B17R2.346 Clc1ccc(cc1)CCNCc2cnc[nH]2 207a_100000185265_100000742939 [0,1,1,0,0,0|0,0,2]=4 3178 B17R2.346 Clc1ccc(cc1)CCNCc2cnco2 270004a_100000185265_100000064291 [0,1,1,0,0,0|1,0,1]=4 3179 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 207a_100000185265_100000749870 [0,1,1,0,0,0|1,0,1]=4 3180 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 2230a_100000185265_100015185245 [0,1,1,0,0,0|1,0,1]=4 3181 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100011713675 [0,1,1,0,0,0|1,0,1]=4 3182 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 270004a_100000185265_100000749870 [0,1,1,0,0,0|1,0,1]=4 3183 B17R2.346 Clc1ccc(cc1)CCNCc2cncs2 34a_100000185265_100015185245 [0,1,1,0,0,0|1,0,1]=4 3184 B17R2.346 Clc1ccc(cc1)CCNCc2cocn2 270004a_100000185265_100000050382 [0,1,1,0,0,0|1,0,0]=3 3185 B17R2.346 Clc1ccc(cc1)CCNCc2cscn2 207a_100000185265_100000743575 [0,1,1,0,0,0|1,0,0]=3 3186 B17R2.346 Clc1ccc(cc1)CCNCc2cscn2 2230a_100000185265_100000205941 [0,1,1,0,0,0|1,0,0]=3 3187 B17R2.346 Clc1ccc(cc1)CCNCc2cscn2 2230a_100015185402_100011713675 [0,1,1,0,0,0|1,0,0]=3 3188 B17R2.346 Clc1ccc(cc1)CCNCc2cscn2 270004a_100000185265_100000743575 [0,1,1,0,0,0|1,0,0]=3 3189 B17R2.346 Clc1ccc(cc1)CCNCc2cscn2 34a_100000185265_100000205941 [0,1,1,0,0,0|1,0,0]=3 3190 B17R2.346 Clc1ccc(cc1)CCNCc2csnn2 270004a_100000185265_100000738508 [0,1,1,0,0,0|2,0,0]=4 3191 B17R2.346 Clc1ccc(cc1)CCNCc2ncc[nH]2 207a_100000185265_100000743867 [0,1,1,0,0,0|2,0,0]=4 3192 B17R2.346 Clc1ccc(cc1)CCNCc2ncc[nH]2 2230a_100000185265_100016991755 [0,1,1,0,0,0|2,0,0]=4 3193 B17R2.346 Clc1ccc(cc1)CCNCc2ncc[nH]2 34a_100000185265_100016991755 [0,1,1,0,0,0|2,0,0]=4 3194 B17R2.346 Clc1ccc(cc1)CCNCc2ncco2 2230a_100000185265_103436540062 [0,1,1,0,0,0|2,0,0]=4 3195 B17R2.346 Clc1ccc(cc1)CCNCc2ncco2 2230a_100016994969_100011713675 [0,1,1,0,0,0|2,0,0]=4 3196 B17R2.346 Clc1ccc(cc1)CCNCc2ncco2 270004a_100000185265_100000064290 [0,1,1,0,0,0|2,0,0]=4 3197 B17R2.346 Clc1ccc(cc1)CCNCc2ncco2 34a_100000185265_103436540062 [0,1,1,0,0,0|2,0,0]=4 3198 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 207a_100000185265_100000750902 [0,1,1,0,0,0|2,0,0]=4 3199 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 2230a_100000185265_100015184050 [0,1,1,0,0,0|2,0,0]=4 3200 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100011713675 [0,1,1,0,0,0|2,0,0]=4 3201 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 270004a_100000185265_100000750902 [0,1,1,0,0,0|2,0,0]=4 3202 B17R2.346 Clc1ccc(cc1)CCNCc2nccs2 34a_100000185265_100015184050 [0,1,1,0,0,0|2,0,0]=4 3203 B17R2.346 Clc1ccc(cc1)CCNCc2ncon2 34a_100000185265_100000233494 [0,1,1,0,0,0|2,0,0]=4 3204 B17R2.346 Clc1ccc(cc1)CCNCn2cncn2 2230a_100000185265_200020645497 [0,1,1,0,0,0|1,0,1]=4 3205 B17R2.346 Clc1ccc(cc1)CCNCn2cncn2 34a_100000185265_200020645497 [0,1,1,0,0,0|1,0,1]=4 3206 B17R2.346 Clc1ccc(cc1)CCOCc2c[nH]cn2 34a_100011219627_100000707719 [0,1,1,0,0,0|1,0,0]=3 3207 B17R2.346 Clc1ccc(cc1)CCOCc2cscn2 34a_100011219627_100000205941 [0,1,1,0,0,0|2,0,0]=4 3208 B17R2.346 Clc1ccc(cc1)CCOCc2cscn2 7a_100011219627_100000205941 [0,1,1,0,0,0|2,0,0]=4 3209 B17R2.346 Clc1ccc(cc1)CCSCc2c[nH]cn2 62a_100000707719_100011713675 [0,1,1,0,0,0|1,0,0]=3 3210 B17R2.346 Clc1ccc(cc1)CCSCc2c[nH]cn2 62a_100011713675_100000707719 [0,1,1,0,0,0|1,0,0]=3 3211 B17R2.346 Clc1ccc(cc1)CCSCc2cscn2 62a_100000205941_100011713675 [0,1,1,0,0,0|2,0,0]=4 3212 B17R2.346 Clc1ccc(cc1)CCSCc2cscn2 62a_100011713675_100000205941 [0,1,1,0,0,0|2,0,0]=4 3213 B17R2.346 Clc1ccc(cc1)CNCCc2c[nH]cn2 2230a_100000174871_100020628418 [0,1,1,0,0,0|2,0,0]=4 3214 B17R2.346 Clc1ccc(cc1)CNCCc2c[nH]cn2 270004a_100000755092_100000189385 [0,1,1,0,0,0|2,0,0]=4 3215 B17R2.346 Clc1ccc(cc1)COCCc2c[nH]cn2 7a_100000211118_100020628418 [0,1,1,0,0,0|2,0,0]=4 3216 B17R2.346 Clc1ccc(cc1)CSCCc2c[nH]cn2 62a_100000187161_100020628418 [0,1,1,0,0,0|2,0,0]=4 3217 B17R2.346 Clc1ccc(cc1)CSCCc2c[nH]cn2 62a_100020628418_100000187161 [0,1,1,0,0,0|2,0,0]=4 3218 B17R2.346 Clc1ccc(cn1)CCOCc2c[nH]cn2 34a_100009880866_100000707719 [0,1,1,0,0,0|2,0,0]=4 3219 B17R2.346 Fc1ccc(cc1)CCCSc2c[nH]cn2 62a_100000756875_200011713563 [0,1,1,0,0,0|2,0,0]=4 3220 B17R2.346 Fc1ccc(cc1)CCCSc2c[nH]cn2 62a_200011713563_100000756875 [0,1,1,0,0,0|2,0,0]=4 3221 B17R2.346 Fc1ccc(cc1)CCNCc2c[nH]cn2 2230a_100000199005_100000707719 [0,1,1,0,0,0|0,0,0]=2 3222 B17R2.346 Fc1ccc(cc1)CCNCc2c[nH]cn2 34a_100000199005_100000707719 [0,1,1,0,0,0|0,0,0]=2 3223 B17R2.346 Fc1ccc(cc1)CCNCc2cc[nH]n2 207a_100000199005_100000738523 [0,1,1,0,0,0|2,0,0]=4 3224 B17R2.346 Fc1ccc(cc1)CCNCc2cc[nH]n2 270004a_100000199005_100000738523 [0,1,1,0,0,0|2,0,0]=4 3225 B17R2.346 Fc1ccc(cc1)CCNCc2ccco2 207a_100000199005_100000186105 [0,1,1,0,0,0|2,0,0]=4 3226 B17R2.346 Fc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100011217392 [0,1,1,0,0,0|2,0,0]=4 3227 B17R2.346 Fc1ccc(cc1)CCNCc2ccco2 270004a_100000199005_100000186105 [0,1,1,0,0,0|2,0,0]=4 3228 B17R2.346 Fc1ccc(cc1)CCNCc2ccco2 34a_100000185738_100011217392 [0,1,1,0,0,0|2,0,0]=4 3229 B17R2.346 Fc1ccc(cc1)CCNCc2cccs2 207a_100000199005_100000209959 [0,1,1,0,0,0|2,0,0]=4 3230 B17R2.346 Fc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100011217392 [0,1,1,0,0,0|2,0,0]=4 3231 B17R2.346 Fc1ccc(cc1)CCNCc2cccs2 270004a_100000199005_100000209959 [0,1,1,0,0,0|2,0,0]=4 3232 B17R2.346 Fc1ccc(cc1)CCNCc2ccoc2 207a_100000199005_100011215517 [0,1,1,0,0,0|2,0,0]=4 3233 B17R2.346 Fc1ccc(cc1)CCNCc2ccoc2 2230a_100015206860_100011217392 [0,1,1,0,0,0|2,0,0]=4 3234 B17R2.346 Fc1ccc(cc1)CCNCc2ccoc2 270004a_100000199005_100011215517 [0,1,1,0,0,0|2,0,0]=4 3235 B17R2.346 Fc1ccc(cc1)CCNCc2ccoc2 34a_100015206860_100011217392 [0,1,1,0,0,0|2,0,0]=4 3236 B17R2.346 Fc1ccc(cc1)CCNCc2ccon2 2230a_100000199005_100000234950 [0,1,1,0,0,0|2,0,0]=4 3237 B17R2.346 Fc1ccc(cc1)CCNCc2ccon2 34a_100000199005_100000234950 [0,1,1,0,0,0|2,0,0]=4 3238 B17R2.346 Fc1ccc(cc1)CCNCc2ccsc2 207a_100000199005_100000188534 [0,1,1,0,0,0|2,0,0]=4 3239 B17R2.346 Fc1ccc(cc1)CCNCc2ccsc2 2230a_100000186416_100011217392 [0,1,1,0,0,0|2,0,0]=4 3240 B17R2.346 Fc1ccc(cc1)CCNCc2ccsc2 2230a_100000199005_100011261437 [0,1,1,0,0,0|2,0,0]=4 3241 B17R2.346 Fc1ccc(cc1)CCNCc2ccsc2 270004a_100000199005_100000188534 [0,1,1,0,0,0|2,0,0]=4 3242 B17R2.346 Fc1ccc(cc1)CCNCc2ccsc2 34a_100000186416_100011217392 [0,1,1,0,0,0|2,0,0]=4 3243 B17R2.346 Fc1ccc(cc1)CCNCc2ccsc2 34a_100000199005_100011261437 [0,1,1,0,0,0|2,0,0]=4 3244 B17R2.346 Fc1ccc(cc1)CCNCc2cn[nH]c2 207a_100000199005_100016992096 [0,1,1,0,0,0|2,0,0]=4 3245 B17R2.346 Fc1ccc(cc1)CCNCc2cn[nH]c2 270004a_100000199005_100016992096 [0,1,1,0,0,0|2,0,0]=4 3246 B17R2.346 Fc1ccc(cc1)CCNCc2cnc[nH]2 207a_100000199005_100000742939 [0,1,1,0,0,0|0,0,2]=4 3247 B17R2.346 Fc1ccc(cc1)CCNCc2cnco2 270004a_100000199005_100000064291 [0,1,1,0,0,0|1,0,1]=4 3248 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 207a_100000199005_100000749870 [0,1,1,0,0,0|1,0,1]=4 3249 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 2230a_100000199005_100015185245 [0,1,1,0,0,0|1,0,1]=4 3250 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100011217392 [0,1,1,0,0,0|1,0,1]=4 3251 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 270004a_100000199005_100000749870 [0,1,1,0,0,0|1,0,1]=4 3252 B17R2.346 Fc1ccc(cc1)CCNCc2cncs2 34a_100000199005_100015185245 [0,1,1,0,0,0|1,0,1]=4 3253 B17R2.346 Fc1ccc(cc1)CCNCc2cocn2 270004a_100000199005_100000050382 [0,1,1,0,0,0|1,0,0]=3 3254 B17R2.346 Fc1ccc(cc1)CCNCc2cscn2 207a_100000199005_100000743575 [0,1,1,0,0,0|1,0,0]=3 3255 B17R2.346 Fc1ccc(cc1)CCNCc2cscn2 2230a_100000199005_100000205941 [0,1,1,0,0,0|1,0,0]=3 3256 B17R2.346 Fc1ccc(cc1)CCNCc2cscn2 2230a_100015185402_100011217392 [0,1,1,0,0,0|1,0,0]=3 3257 B17R2.346 Fc1ccc(cc1)CCNCc2cscn2 270004a_100000199005_100000743575 [0,1,1,0,0,0|1,0,0]=3 3258 B17R2.346 Fc1ccc(cc1)CCNCc2cscn2 34a_100000199005_100000205941 [0,1,1,0,0,0|1,0,0]=3 3259 B17R2.346 Fc1ccc(cc1)CCNCc2csnn2 270004a_100000199005_100000738508 [0,1,1,0,0,0|2,0,0]=4 3260 B17R2.346 Fc1ccc(cc1)CCNCc2ncc[nH]2 207a_100000199005_100000743867 [0,1,1,0,0,0|2,0,0]=4 3261 B17R2.346 Fc1ccc(cc1)CCNCc2ncc[nH]2 2230a_100000199005_100016991755 [0,1,1,0,0,0|2,0,0]=4 3262 B17R2.346 Fc1ccc(cc1)CCNCc2ncc[nH]2 34a_100000199005_100016991755 [0,1,1,0,0,0|2,0,0]=4 3263 B17R2.346 Fc1ccc(cc1)CCNCc2ncco2 2230a_100000199005_103436540062 [0,1,1,0,0,0|2,0,0]=4 3264 B17R2.346 Fc1ccc(cc1)CCNCc2ncco2 2230a_100016994969_100011217392 [0,1,1,0,0,0|2,0,0]=4 3265 B17R2.346 Fc1ccc(cc1)CCNCc2ncco2 270004a_100000199005_100000064290 [0,1,1,0,0,0|2,0,0]=4 3266 B17R2.346 Fc1ccc(cc1)CCNCc2ncco2 34a_100000199005_103436540062 [0,1,1,0,0,0|2,0,0]=4 3267 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 207a_100000199005_100000750902 [0,1,1,0,0,0|2,0,0]=4 3268 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 2230a_100000199005_100015184050 [0,1,1,0,0,0|2,0,0]=4 3269 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100011217392 [0,1,1,0,0,0|2,0,0]=4 3270 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 270004a_100000199005_100000750902 [0,1,1,0,0,0|2,0,0]=4 3271 B17R2.346 Fc1ccc(cc1)CCNCc2nccs2 34a_100000199005_100015184050 [0,1,1,0,0,0|2,0,0]=4 3272 B17R2.346 Fc1ccc(cc1)CCNCc2ncon2 34a_100000199005_100000233494 [0,1,1,0,0,0|2,0,0]=4 3273 B17R2.346 Fc1ccc(cc1)CCNCn2cncn2 2230a_100000199005_200020645497 [0,1,1,0,0,0|1,0,1]=4 3274 B17R2.346 Fc1ccc(cc1)CCNCn2cncn2 34a_100000199005_200020645497 [0,1,1,0,0,0|1,0,1]=4 3275 B17R2.346 Fc1ccc(cc1)CCOCc2c[nH]cn2 34a_100000754732_100000707719 [0,1,1,0,0,0|1,0,0]=3 3276 B17R2.346 Fc1ccc(cc1)CCOCc2cscn2 34a_100000754732_100000205941 [0,1,1,0,0,0|2,0,0]=4 3277 B17R2.346 Fc1ccc(cc1)CCOCc2cscn2 7a_100000754732_100000205941 [0,1,1,0,0,0|2,0,0]=4 3278 B17R2.346 Fc1ccc(cc1)CCSCc2c[nH]cn2 62a_100000707719_100011217392 [0,1,1,0,0,0|1,0,0]=3 3279 B17R2.346 Fc1ccc(cc1)CCSCc2c[nH]cn2 62a_100011217392_100000707719 [0,1,1,0,0,0|1,0,0]=3 3280 B17R2.346 Fc1ccc(cc1)CCSCc2cscn2 62a_100000205941_100011217392 [0,1,1,0,0,0|2,0,0]=4 3281 B17R2.346 Fc1ccc(cc1)CCSCc2cscn2 62a_100011217392_100000205941 [0,1,1,0,0,0|2,0,0]=4 3282 B17R2.346 Fc1ccc(cc1)CNCCc2c[nH]cn2 2230a_100000174882_100020628418 [0,1,1,0,0,0|2,0,0]=4 3283 B17R2.346 Fc1ccc(cc1)CNCCc2c[nH]cn2 270004a_100000755092_100000210084 [0,1,1,0,0,0|2,0,0]=4 3284 B17R2.346 Fc1ccc(cc1)COCCc2c[nH]cn2 7a_100000210977_100020628418 [0,1,1,0,0,0|2,0,0]=4 3285 B17R2.346 Fc1ccc(cc1)CSCCc2c[nH]cn2 62a_100000198546_100020628418 [0,1,1,0,0,0|2,0,0]=4 3286 B17R2.346 Fc1ccc(cc1)CSCCc2c[nH]cn2 62a_100020628418_100000187164 [0,1,1,0,0,0|2,0,0]=4 3287 B17R2.346 Ic1ccc(cc1)CCOCc2c[nH]cn2 34a_100012291149_100000707719 [0,1,1,0,0,0|1,0,0]=3 3288 B17R2.346 Ic1ccc(cc1)CCOCc2cscn2 34a_100012291149_100000205941 [0,1,1,0,0,0|2,0,0]=4 3289 B17R2.346 Ic1ccc(cc1)CCOCc2cscn2 7a_100012291149_100000205941 [0,1,1,0,0,0|2,0,0]=4 3290 B17R2.346 Ic1ccc(cc1)CNCCc2c[nH]cn2 2230a_100016989417_100020628418 [0,1,1,0,0,0|2,0,0]=4 3291 B17R2.346 Ic1ccc(cc1)COCCc2c[nH]cn2 7a_100000690907_100020628418 [0,1,1,0,0,0|2,0,0]=4 3292 B17R2.346 Ic1ccc(cc1)CSCCc2c[nH]cn2 62a_100000189116_100020628418 [0,1,1,0,0,0|2,0,0]=4 3293 B17R2.346 Ic1ccc(cc1)CSCCc2c[nH]cn2 62a_100020628418_100000189116 [0,1,1,0,0,0|2,0,0]=4 3294 B17R2.346 Nc1ccc(cc1)CCOCc2c[nH]cn2 34a_100011204434_100000707719 [0,1,1,0,0,0|1,0,0]=3 3295 B17R2.346 Nc1ccc(cc1)CCOCc2cscn2 34a_100011204434_100000205941 [0,1,1,0,0,0|2,0,0]=4 3296 B17R2.346 Oc1ccc(cc1)CCNCc2c[nH]cn2 34a_100000743037_100000707719 [0,1,1,0,0,0|0,0,0]=2 3297 B17R2.346 Oc1ccc(cc1)CCNCc2cc[nH]n2 207a_100000743037_100000738523 [0,1,1,0,0,0|2,0,0]=4 3298 B17R2.346 Oc1ccc(cc1)CCNCc2cc[nH]n2 270004a_100000743037_100000738523 [0,1,1,0,0,0|2,0,0]=4 3299 B17R2.346 Oc1ccc(cc1)CCNCc2ccco2 207a_100000743037_100000186105 [0,1,1,0,0,0|2,0,0]=4 3300 B17R2.346 Oc1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100009816426 [0,1,1,0,0,0|2,0,0]=4 3301 B17R2.346 Oc1ccc(cc1)CCNCc2ccco2 270004a_100000743037_100000186105 [0,1,1,0,0,0|2,0,0]=4 3302 B17R2.346 Oc1ccc(cc1)CCNCc2cccs2 207a_100000743037_100000209959 [0,1,1,0,0,0|2,0,0]=4 3303 B17R2.346 Oc1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100009816426 [0,1,1,0,0,0|2,0,0]=4 3304 B17R2.346 Oc1ccc(cc1)CCNCc2cccs2 270004a_100000743037_100000209959 [0,1,1,0,0,0|2,0,0]=4 3305 B17R2.346 Oc1ccc(cc1)CCNCc2ccoc2 207a_100000743037_100011215517 [0,1,1,0,0,0|2,0,0]=4 3306 B17R2.346 Oc1ccc(cc1)CCNCc2ccoc2 2230a_100015206860_100009816426 [0,1,1,0,0,0|2,0,0]=4 3307 B17R2.346 Oc1ccc(cc1)CCNCc2ccoc2 270004a_100000743037_100011215517 [0,1,1,0,0,0|2,0,0]=4 3308 B17R2.346 Oc1ccc(cc1)CCNCc2ccon2 34a_100000743037_100000234950 [0,1,1,0,0,0|2,0,0]=4 3309 B17R2.346 Oc1ccc(cc1)CCNCc2ccsc2 207a_100000743037_100000188534 [0,1,1,0,0,0|2,0,0]=4 3310 B17R2.346 Oc1ccc(cc1)CCNCc2ccsc2 2230a_100000186416_100009816426 [0,1,1,0,0,0|2,0,0]=4 3311 B17R2.346 Oc1ccc(cc1)CCNCc2ccsc2 270004a_100000743037_100000188534 [0,1,1,0,0,0|2,0,0]=4 3312 B17R2.346 Oc1ccc(cc1)CCNCc2ccsc2 34a_100000743037_100011261437 [0,1,1,0,0,0|2,0,0]=4 3313 B17R2.346 Oc1ccc(cc1)CCNCc2cn[nH]c2 207a_100000743037_100016992096 [0,1,1,0,0,0|2,0,0]=4 3314 B17R2.346 Oc1ccc(cc1)CCNCc2cn[nH]c2 270004a_100000743037_100016992096 [0,1,1,0,0,0|2,0,0]=4 3315 B17R2.346 Oc1ccc(cc1)CCNCc2cnc[nH]2 207a_100000743037_100000742939 [0,1,1,0,0,0|0,0,2]=4 3316 B17R2.346 Oc1ccc(cc1)CCNCc2cnco2 270004a_100000743037_100000064291 [0,1,1,0,0,0|1,0,1]=4 3317 B17R2.346 Oc1ccc(cc1)CCNCc2cncs2 207a_100000743037_100000749870 [0,1,1,0,0,0|1,0,1]=4 3318 B17R2.346 Oc1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100009816426 [0,1,1,0,0,0|1,0,1]=4 3319 B17R2.346 Oc1ccc(cc1)CCNCc2cncs2 270004a_100000743037_100000749870 [0,1,1,0,0,0|1,0,1]=4 3320 B17R2.346 Oc1ccc(cc1)CCNCc2cncs2 34a_100000743037_100015185245 [0,1,1,0,0,0|1,0,1]=4 3321 B17R2.346 Oc1ccc(cc1)CCNCc2cocn2 270004a_100000743037_100000050382 [0,1,1,0,0,0|1,0,0]=3 3322 B17R2.346 Oc1ccc(cc1)CCNCc2cscn2 207a_100000743037_100000743575 [0,1,1,0,0,0|1,0,0]=3 3323 B17R2.346 Oc1ccc(cc1)CCNCc2cscn2 2230a_100015185402_100009816426 [0,1,1,0,0,0|1,0,0]=3 3324 B17R2.346 Oc1ccc(cc1)CCNCc2cscn2 270004a_100000743037_100000743575 [0,1,1,0,0,0|1,0,0]=3 3325 B17R2.346 Oc1ccc(cc1)CCNCc2cscn2 34a_100000743037_100000205941 [0,1,1,0,0,0|1,0,0]=3 3326 B17R2.346 Oc1ccc(cc1)CCNCc2csnn2 270004a_100000743037_100000738508 [0,1,1,0,0,0|2,0,0]=4 3327 B17R2.346 Oc1ccc(cc1)CCNCc2ncc[nH]2 207a_100000743037_100000743867 [0,1,1,0,0,0|2,0,0]=4 3328 B17R2.346 Oc1ccc(cc1)CCNCc2ncc[nH]2 34a_100000743037_100016991755 [0,1,1,0,0,0|2,0,0]=4 3329 B17R2.346 Oc1ccc(cc1)CCNCc2ncco2 2230a_100016994969_100009816426 [0,1,1,0,0,0|2,0,0]=4 3330 B17R2.346 Oc1ccc(cc1)CCNCc2ncco2 270004a_100000743037_100000064290 [0,1,1,0,0,0|2,0,0]=4 3331 B17R2.346 Oc1ccc(cc1)CCNCc2ncco2 34a_100000743037_103436540062 [0,1,1,0,0,0|2,0,0]=4 3332 B17R2.346 Oc1ccc(cc1)CCNCc2nccs2 207a_100000743037_100000750902 [0,1,1,0,0,0|2,0,0]=4 3333 B17R2.346 Oc1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100009816426 [0,1,1,0,0,0|2,0,0]=4 3334 B17R2.346 Oc1ccc(cc1)CCNCc2nccs2 270004a_100000743037_100000750902 [0,1,1,0,0,0|2,0,0]=4 3335 B17R2.346 Oc1ccc(cc1)CCNCc2nccs2 34a_100000743037_100015184050 [0,1,1,0,0,0|2,0,0]=4 3336 B17R2.346 Oc1ccc(cc1)CCNCc2ncon2 34a_100000743037_100000233494 [0,1,1,0,0,0|2,0,0]=4 3337 B17R2.346 Oc1ccc(cc1)CCNCn2cncn2 34a_100000743037_200020645497 [0,1,1,0,0,0|1,0,1]=4 3338 B17R2.346 Oc1ccc(cc1)CCSCc2c[nH]cn2 62a_100000707719_100009816426 [0,1,1,0,0,0|1,0,0]=3 3339 B17R2.346 Oc1ccc(cc1)CCSCc2c[nH]cn2 62a_100009816426_100000707719 [0,1,1,0,0,0|1,0,0]=3 3340 B17R2.346 Oc1ccc(cc1)CCSCc2cscn2 62a_100000205941_100009816426 [0,1,1,0,0,0|2,0,0]=4 3341 B17R2.346 Oc1ccc(cc1)CCSCc2cscn2 62a_100009816426_100000205941 [0,1,1,0,0,0|2,0,0]=4 3342 B17R2.3230 Brc1c[nH]c(c1)CNCCc2ccccc2 270004a_100000106460_100000720742 [0,1,1,0,0,0|1,0,1]=4 3343 B17R2.3230 Brc1cc(cs1)CNCCc2ccccc2 207a_100000106460_100000737087 [0,1,1,0,0,0|2,0,0]=4 3344 B17R2.3230 Brc1cc(cs1)CNCCc2ccccc2 270004a_100000106460_100000737087 [0,1,1,0,0,0|2,0,0]=4 3345 B17R2.3230 Brc1ccc(o1)CNCCc2ccccc2 207a_100000106460_100000185145 [0,1,1,0,0,0|2,0,0]=4 3346 B17R2.3230 Brc1ccc(o1)CNCCc2ccccc2 270004a_100000106460_100000185145 [0,1,1,0,0,0|2,0,0]=4 3347 B17R2.3230 Brc1ccc(o1)CNCCc2ccccc2 34a_100000708654_100000765856 [0,1,1,0,0,0|2,0,0]=4 3348 B17R2.3230 Brc1ccc(s1)CNCCc2ccccc2 207a_100000106460_100000179771 [0,1,1,0,0,0|2,0,0]=4 3349 B17R2.3230 Brc1ccc(s1)CNCCc2ccccc2 2230a_100000106460_100000708592 [0,1,1,0,0,0|2,0,0]=4 3350 B17R2.3230 Brc1ccc(s1)CNCCc2ccccc2 270004a_100000106460_100000179771 [0,1,1,0,0,0|2,0,0]=4 3351 B17R2.3230 Brc1ccc(s1)CNCCc2ccccc2 34a_100000106460_100000708592 [0,1,1,0,0,0|2,0,0]=4 3352 B17R2.3230 Brc1cnc(s1)CNCCc2ccccc2 270004a_100000106460_100000699580 [0,1,1,0,0,0|2,0,0]=4 3353 B17R2.3230 Brc1coc(c1)CNCCc2ccccc2 270004a_100000106460_100000747035 [0,1,1,0,0,0|2,0,0]=4 3354 B17R2.3230 Brc1csc(c1)CNCCc2ccccc2 207a_100000106460_100000211722 [0,1,1,0,0,0|2,0,0]=4 3355 B17R2.3230 Brc1csc(c1)CNCCc2ccccc2 2230a_100000106460_100000746031 [0,1,1,0,0,0|2,0,0]=4 3356 B17R2.3230 Brc1csc(c1)CNCCc2ccccc2 2230a_100000741024_100000765856 [0,1,1,0,0,0|2,0,0]=4 3357 B17R2.3230 Brc1csc(c1)CNCCc2ccccc2 270004a_100000106460_100000211722 [0,1,1,0,0,0|2,0,0]=4 3358 B17R2.3230 Brc1csc(c1)CNCCc2ccccc2 34a_100000106460_100000746031 [0,1,1,0,0,0|2,0,0]=4 3359 B17R2.3230 Brc1csc(c1)CNCCc2ccccc2 34a_100000741024_100000765856 [0,1,1,0,0,0|2,0,0]=4 3360 B17R2.3230 Brc1csc(n1)CNCCc2ccccc2 270004a_100000106460_100009816814 [0,1,1,0,0,0|2,0,0]=4 3361 B17R2.3230 Brc1nc(cs1)CNCCc2ccccc2 270004a_100000106460_100009816748 [0,1,1,0,0,0|1,0,0]=3 3362 B17R2.3230 Brc1nc(cs1)CNCCc2ccccn2 270004a_100000211156_100009816748 [0,1,1,0,0,0|2,0,0]=4 3363 B17R2.3230 Brc1nc(cs1)CNCCc2cccnc2 270004a_100000736294_100009816748 [0,1,1,0,0,0|2,0,0]=4 3364 B17R2.3230 Brc1nc(cs1)CNCCc2ccncc2 270004a_100000742849_100009816748 [0,1,1,0,0,0|2,0,0]=4 3365 B17R2.3230 Brc1ncc(s1)CNCCc2ccccc2 2230a_100000106460_100000717027 [0,1,1,0,0,0|1,0,1]=4 3366 B17R2.3230 Brc1ncc(s1)CNCCc2ccccc2 2230a_100000726991_100000765856 [0,1,1,0,0,0|1,0,1]=4 3367 B17R2.3230 Brc1ncc(s1)CNCCc2ccccc2 270004a_100000106460_100009814069 [0,1,1,0,0,0|1,0,1]=4 3368 B17R2.3230 Brc1ncc(s1)CNCCc2ccccc2 34a_100000106460_100000717027 [0,1,1,0,0,0|1,0,1]=4 3369 B17R2.3230 Cc1c[nH]c(n1)CNCCc2ccccc2 207a_100000106460_100000082322 [0,1,1,0,0,0|2,0,0]=4 3370 B17R2.3230 Cc1c[nH]c(n1)CNCCc2ccccc2 270004a_100000106460_100000082322 [0,1,1,0,0,0|2,0,0]=4 3371 B17R2.3230 Cc1cc(cs1)CNCCc2ccccc2 207a_100000106460_100011998532 [0,1,1,0,0,0|2,0,0]=4 3372 B17R2.3230 Cc1cc(cs1)CNCCc2ccccc2 270004a_100000106460_100011998532 [0,1,1,0,0,0|2,0,0]=4 3373 B17R2.3230 Cc1cc(no1)CNCCc2ccccc2 207a_100000106460_100011217994 [0,1,1,0,0,0|2,0,0]=4 3374 B17R2.3230 Cc1cc(no1)CNCCc2ccccc2 2230a_100000106460_100000199038 [0,1,1,0,0,0|2,0,0]=4 3375 B17R2.3230 Cc1cc(no1)CNCCc2ccccc2 2230a_100000745230_100000765856 [0,1,1,0,0,0|2,0,0]=4 3376 B17R2.3230 Cc1cc(no1)CNCCc2ccccc2 270004a_100000106460_100011217994 [0,1,1,0,0,0|2,0,0]=4 3377 B17R2.3230 Cc1cc(no1)CNCCc2ccccc2 34a_100000106460_100000199038 [0,1,1,0,0,0|2,0,0]=4 3378 B17R2.3230 Cc1cc(no1)CNCCc2ccccc2 34a_100000745230_100000765856 [0,1,1,0,0,0|2,0,0]=4 3379 B17R2.3230 Cc1cc(ns1)CNCCc2ccccc2 207a_100000106460_200000100279 [0,1,1,0,0,0|2,0,0]=4 3380 B17R2.3230 Cc1cc(ns1)CNCCc2ccccc2 270004a_100000106460_200000100279 [0,1,1,0,0,0|2,0,0]=4 3381 B17R2.3230 Cc1ccc(o1)CNCCc2ccccc2 207a_100000106460_100000183696 [0,1,1,0,0,0|2,0,0]=4 3382 B17R2.3230 Cc1ccc(o1)CNCCc2ccccc2 270004a_100000106460_100000183696 [0,1,1,0,0,0|2,0,0]=4 3383 B17R2.3230 Cc1ccc(o1)CNCCc2ccccc2 34a_100011194323_100000765856 [0,1,1,0,0,0|2,0,0]=4 3384 B17R2.3230 Cc1ccc(s1)CNCCc2ccccc2 207a_100000106460_100000211121 [0,1,1,0,0,0|2,0,0]=4 3385 B17R2.3230 Cc1ccc(s1)CNCCc2ccccc2 2230a_100000238518_100000765856 [0,1,1,0,0,0|2,0,0]=4 3386 B17R2.3230 Cc1ccc(s1)CNCCc2ccccc2 270004a_100000106460_100000211121 [0,1,1,0,0,0|2,0,0]=4 3387 B17R2.3230 Cc1cnc(o1)CNCCc2ccccc2 2230a_100138411809_100000765856 [0,1,1,0,0,0|2,0,0]=4 3388 B17R2.3230 Cc1cnc(o1)CNCCc2ccccc2 34a_100138411809_100000765856 [0,1,1,0,0,0|2,0,0]=4 3389 B17R2.3230 Cc1cnc(s1)CNCCc2ccccc2 207a_100000106460_100011361622 [0,1,1,0,0,0|2,0,0]=4 3390 B17R2.3230 Cc1cnc(s1)CNCCc2ccccc2 270004a_100000106460_100011361622 [0,1,1,0,0,0|2,0,0]=4 3391 B17R2.3230 Cc1csc(c1)CNCCc2ccccc2 207a_100000106460_100102525248 [0,1,1,0,0,0|2,0,0]=4 3392 B17R2.3230 Cc1csc(c1)CNCCc2ccccc2 2230a_100015204214_100000765856 [0,1,1,0,0,0|2,0,0]=4 3393 B17R2.3230 Cc1csc(c1)CNCCc2ccccc2 270004a_100000106460_100102525248 [0,1,1,0,0,0|2,0,0]=4 3394 B17R2.3230 Cc1csc(c1)CNCCc2ccccc2 34a_100015204214_100000765856 [0,1,1,0,0,0|2,0,0]=4 3395 B17R2.3230 Cc1csc(n1)CNCCc2ccccc2 207a_100000106460_100000756994 [0,1,1,0,0,0|2,0,0]=4 3396 B17R2.3230 Cc1csc(n1)CNCCc2ccccc2 2230a_100015183719_100000765856 [0,1,1,0,0,0|2,0,0]=4 3397 B17R2.3230 Cc1csc(n1)CNCCc2ccccc2 270004a_100000106460_100000756994 [0,1,1,0,0,0|2,0,0]=4 3398 B17R2.3230 Cc1nc(c[nH]1)CNCCc2ccccc2 207a_100000106460_100011219055 [0,1,1,0,0,0|0,0,0]=2 3399 B17R2.3230 Cc1nc(c[nH]1)CNCCc2ccccn2 207a_100000211156_100011219055 [0,1,1,0,0,0|1,0,0]=3 3400 B17R2.3230 Cc1nc(c[nH]1)CNCCc2cccnc2 207a_100000736294_100011219055 [0,1,1,0,0,0|1,0,0]=3 3401 B17R2.3230 Cc1nc(c[nH]1)CNCCc2ccncc2 207a_100000742849_100011219055 [0,1,1,0,0,0|1,0,0]=3 3402 B17R2.3230 Cc1nc(c[nH]1)CNCCc2cnccn2 207a_100000723456_100011219055 [0,1,1,0,0,0|2,0,0]=4 3403 B17R2.3230 Cc1nc(c[nH]1)SCCCc2ccccc2 62a_100000211621_100009814057 [0,1,1,0,0,0|2,0,0]=4 3404 B17R2.3230 Cc1nc(c[nH]1)SCCCc2ccccc2 62a_100009814057_100000211621 [0,1,1,0,0,0|2,0,0]=4 3405 B17R2.3230 Cc1nc(co1)CNCCc2ccccc2 207a_100000106460_100011361629 [0,1,1,0,0,0|1,0,0]=3 3406 B17R2.3230 Cc1nc(co1)CNCCc2ccccc2 270004a_100000106460_100011361629 [0,1,1,0,0,0|1,0,0]=3 3407 B17R2.3230 Cc1nc(co1)CNCCc2ccccn2 207a_100000211156_100011361629 [0,1,1,0,0,0|2,0,0]=4 3408 B17R2.3230 Cc1nc(co1)CNCCc2ccccn2 270004a_100000211156_100011361629 [0,1,1,0,0,0|2,0,0]=4 3409 B17R2.3230 Cc1nc(co1)CNCCc2cccnc2 207a_100000736294_100011361629 [0,1,1,0,0,0|2,0,0]=4 3410 B17R2.3230 Cc1nc(co1)CNCCc2cccnc2 270004a_100000736294_100011361629 [0,1,1,0,0,0|2,0,0]=4 3411 B17R2.3230 Cc1nc(co1)CNCCc2ccncc2 207a_100000742849_100011361629 [0,1,1,0,0,0|2,0,0]=4 3412 B17R2.3230 Cc1nc(co1)CNCCc2ccncc2 270004a_100000742849_100011361629 [0,1,1,0,0,0|2,0,0]=4 3413 B17R2.3230 Cc1nc(co1)COCCc2ccccc2 34a_100012017233_100000765856 [0,1,1,0,0,0|2,0,0]=4 3414 B17R2.3230 Cc1nc(cs1)CNCCc2ccccc2 207a_100000106460_100000203724 [0,1,1,0,0,0|1,0,0]=3 3415 B17R2.3230 Cc1nc(cs1)CNCCc2ccccc2 2230a_100000106460_100015186478 [0,1,1,0,0,0|1,0,0]=3 3416 B17R2.3230 Cc1nc(cs1)CNCCc2ccccc2 270004a_100000106460_100000203724 [0,1,1,0,0,0|1,0,0]=3 3417 B17R2.3230 Cc1nc(cs1)CNCCc2ccccc2 34a_100000106460_100015186478 [0,1,1,0,0,0|1,0,0]=3 3418 B17R2.3230 Cc1nc(cs1)CNCCc2ccccc2 34a_100000707933_100000765856 [0,1,1,0,0,0|1,0,0]=3 3419 B17R2.3230 Cc1nc(cs1)CNCCc2ccccn2 207a_100000211156_100000203724 [0,1,1,0,0,0|2,0,0]=4 3420 B17R2.3230 Cc1nc(cs1)CNCCc2ccccn2 270004a_100000211156_100000203724 [0,1,1,0,0,0|2,0,0]=4 3421 B17R2.3230 Cc1nc(cs1)CNCCc2cccnc2 207a_100000736294_100000203724 [0,1,1,0,0,0|2,0,0]=4 3422 B17R2.3230 Cc1nc(cs1)CNCCc2cccnc2 2230a_100000736294_100015186478 [0,1,1,0,0,0|2,0,0]=4 3423 B17R2.3230 Cc1nc(cs1)CNCCc2cccnc2 270004a_100000736294_100000203724 [0,1,1,0,0,0|2,0,0]=4 3424 B17R2.3230 Cc1nc(cs1)CNCCc2ccncc2 207a_100000742849_100000203724 [0,1,1,0,0,0|2,0,0]=4 3425 B17R2.3230 Cc1nc(cs1)CNCCc2ccncc2 270004a_100000742849_100000203724 [0,1,1,0,0,0|2,0,0]=4 3426 B17R2.3230 Cc1nc(cs1)COCCc2ccccc2 34a_100000210268_100015186478 [0,1,1,0,0,0|2,0,0]=4 3427 B17R2.3230 Cc1nc(cs1)COCCc2ccccc2 34a_100000735831_100000765856 [0,1,1,0,0,0|2,0,0]=4 3428 B17R2.3230 Cc1nc(cs1)COCCc2ccccc2 7a_100000210268_100015186478 [0,1,1,0,0,0|2,0,0]=4 3429 B17R2.3230 Cc1nc(cs1)CSCCc2ccccc2 62a_100000765856_100015186478 [0,1,1,0,0,0|2,0,0]=4 3430 B17R2.3230 Cc1nc(cs1)CSCCc2ccccc2 62a_100015186478_100011218657 [0,1,1,0,0,0|2,0,0]=4 3431 B17R2.3230 Cc1nc(n[nH]1)CNCCc2ccccc2 2230a_100000752542_100000765856 [0,1,1,0,0,0|1,0,0]=3 3432 B17R2.3230 Cc1nc(n[nH]1)CNCCc2ccccn2 2230a_100000752542_100015183660 [0,1,1,0,0,0|2,0,0]=4 3433 B17R2.3230 Cc1nc(n[nH]1)CNCCc2cccnc2 2230a_100000752542_200011713674 [0,1,1,0,0,0|2,0,0]=4 3434 B17R2.3230 Cc1nc(n[nH]1)CNCCc2ccncc2 2230a_100000752542_100000723409 [0,1,1,0,0,0|2,0,0]=4 3435 B17R2.3230 Cc1nc(n[nH]1)CNCSc2ccccc2 2230a_100000752542_100011218342 [0,1,1,0,0,0|2,0,0]=4 3436 B17R2.3230 Cc1nc(no1)CNCCc2ccccc2 2230a_100000106460_100000231061 [0,1,1,0,0,0|2,0,0]=4 3437 B17R2.3230 Cc1nc(no1)CNCCc2ccccc2 34a_100000106460_100000231061 [0,1,1,0,0,0|2,0,0]=4 3438 B17R2.3230 Cc1ncc(o1)CNCCc2ccccc2 207a_100000106460_100000084308 [0,1,1,0,0,0|1,0,1]=4 3439 B17R2.3230 Cc1ncc(o1)CNCCc2ccccc2 270004a_100000106460_100000084308 [0,1,1,0,0,0|1,0,1]=4 3440 B17R2.3230 Cc1ncc(s1)CNCCc2ccccc2 207a_100000106460_100000740557 [0,1,1,0,0,0|1,0,1]=4 3441 B17R2.3230 Cc1ncc(s1)CNCCc2ccccc2 2230a_100000106460_100020635045 [0,1,1,0,0,0|1,0,1]=4 3442 B17R2.3230 Cc1ncc(s1)CNCCc2ccccc2 2230a_200000743601_100000765856 [0,1,1,0,0,0|1,0,1]=4 3443 B17R2.3230 Cc1ncc(s1)CNCCc2ccccc2 270004a_100000106460_100000740557 [0,1,1,0,0,0|1,0,1]=4 3444 B17R2.3230 Cc1ncc(s1)CNCCc2ccccc2 34a_100000106460_100020635045 [0,1,1,0,0,0|1,0,1]=4 3445 B17R2.3230 Cc1noc(n1)CNCCc2ccccc2 2230a_100000106460_100000735555 [0,1,1,0,0,0|1,0,1]=4 3446 B17R2.3230 Cc1noc(n1)CNCCc2ccccc2 34a_100000106460_100000735555 [0,1,1,0,0,0|1,0,1]=4 3447 B17R2.3230 Clc1cc(cs1)CNCCc2ccccc2 207a_100000106460_100009844934 [0,1,1,0,0,0|2,0,0]=4 3448 B17R2.3230 Clc1cc(cs1)CNCCc2ccccc2 270004a_100000106460_100009844934 [0,1,1,0,0,0|2,0,0]=4 3449 B17R2.3230 Clc1ccc(o1)CNCCc2ccccc2 207a_100000106460_100000188459 [0,1,1,0,0,0|2,0,0]=4 3450 B17R2.3230 Clc1ccc(o1)CNCCc2ccccc2 270004a_100000106460_100000188459 [0,1,1,0,0,0|2,0,0]=4 3451 B17R2.3230 Clc1ccc(s1)CNCCc2ccccc2 207a_100000106460_100000242774 [0,1,1,0,0,0|2,0,0]=4 3452 B17R2.3230 Clc1ccc(s1)CNCCc2ccccc2 2230a_100000106460_100000185097 [0,1,1,0,0,0|2,0,0]=4 3453 B17R2.3230 Clc1ccc(s1)CNCCc2ccccc2 2230a_100000737310_100000765856 [0,1,1,0,0,0|2,0,0]=4 3454 B17R2.3230 Clc1ccc(s1)CNCCc2ccccc2 270004a_100000106460_100000242774 [0,1,1,0,0,0|2,0,0]=4 3455 B17R2.3230 Clc1ccc(s1)CNCCc2ccccc2 34a_100000106460_100000185097 [0,1,1,0,0,0|2,0,0]=4 3456 B17R2.3230 Clc1cnc(s1)CNCCc2ccccc2 270004a_100000106460_100000699884 [0,1,1,0,0,0|2,0,0]=4 3457 B17R2.3230 Clc1csc(c1)CNCCc2ccccc2 207a_100000106460_100000102487 [0,1,1,0,0,0|2,0,0]=4 3458 B17R2.3230 Clc1csc(c1)CNCCc2ccccc2 270004a_100000106460_100000102487 [0,1,1,0,0,0|2,0,0]=4 3459 B17R2.3230 Clc1nc(cs1)CNCCc2ccccc2 2230a_100000106460_100000024076 [0,1,1,0,0,0|1,0,0]=3 3460 B17R2.3230 Clc1nc(cs1)CNCCc2ccccc2 270004a_100000106460_100011935135 [0,1,1,0,0,0|1,0,0]=3 3461 B17R2.3230 Clc1nc(cs1)CNCCc2ccccc2 34a_100000106460_100000024076 [0,1,1,0,0,0|1,0,0]=3 3462 B17R2.3230 Clc1nc(cs1)CNCCc2ccccn2 270004a_100000211156_100011935135 [0,1,1,0,0,0|2,0,0]=4 3463 B17R2.3230 Clc1nc(cs1)CNCCc2cccnc2 2230a_100000736294_100000024076 [0,1,1,0,0,0|2,0,0]=4 3464 B17R2.3230 Clc1nc(cs1)CNCCc2cccnc2 270004a_100000736294_100011935135 [0,1,1,0,0,0|2,0,0]=4 3465 B17R2.3230 Clc1nc(cs1)CNCCc2ccncc2 270004a_100000742849_100011935135 [0,1,1,0,0,0|2,0,0]=4 3466 B17R2.3230 Clc1nc(cs1)COCCc2ccccc2 34a_100000210268_100000024076 [0,1,1,0,0,0|2,0,0]=4 3467 B17R2.3230 Clc1nc(cs1)COCCc2ccccc2 7a_100000210268_100000024076 [0,1,1,0,0,0|2,0,0]=4 3468 B17R2.3230 Clc1nc(cs1)CSCCc2ccccc2 62a_100000024076_100011218657 [0,1,1,0,0,0|2,0,0]=4 3469 B17R2.3230 Clc1nc(cs1)CSCCc2ccccc2 62a_100000765856_100000024076 [0,1,1,0,0,0|2,0,0]=4 3470 B17R2.3230 Clc1nc(ns1)CNCCc2ccccc2 2230a_100000106460_100000043760 [0,1,1,0,0,0|2,0,0]=4 3471 B17R2.3230 Clc1nc(ns1)CNCCc2ccccc2 34a_100000106460_100000043760 [0,1,1,0,0,0|2,0,0]=4 3472 B17R2.3230 Clc1ncc(s1)CNCCc2ccccc2 2230a_100000106460_100000058068 [0,1,1,0,0,0|1,0,1]=4 3473 B17R2.3230 Clc1ncc(s1)CNCCc2ccccc2 2230a_100000726635_100000765856 [0,1,1,0,0,0|1,0,1]=4 3474 B17R2.3230 Clc1ncc(s1)CNCCc2ccccc2 270004a_100000106460_100000696999 [0,1,1,0,0,0|1,0,1]=4 3475 B17R2.3230 Clc1ncc(s1)CNCCc2ccccc2 34a_100000106460_100000058068 [0,1,1,0,0,0|1,0,1]=4 3476 B17R2.3230 Cn1cc(cn1)CNCCc2ccccc2 207a_100000106460_100000206001 [0,1,1,0,0,0|2,0,0]=4 3477 B17R2.3230 Cn1cc(cn1)CNCCc2ccccc2 2230a_100000106460_100000744441 [0,1,1,0,0,0|2,0,0]=4 3478 B17R2.3230 Cn1cc(cn1)CNCCc2ccccc2 270004a_100000106460_100000206001 [0,1,1,0,0,0|2,0,0]=4 3479 B17R2.3230 Cn1cc(cn1)CNCCc2ccccc2 34a_100000106460_100000744441 [0,1,1,0,0,0|2,0,0]=4 3480 B17R2.3230 Cn1cc(cn1)CNCCc2ccccc2 34a_100000744365_100000765856 [0,1,1,0,0,0|2,0,0]=4 3481 B17R2.3230 Cn1cc(nn1)CNCCc2ccccc2 207a_100000106460_100000749909 [0,1,1,0,0,0|1,0,0]=3 3482 B17R2.3230 Cn1cc(nn1)CNCCc2ccccc2 270004a_100000106460_100000749909 [0,1,1,0,0,0|1,0,0]=3 3483 B17R2.3230 Cn1cc(nn1)CNCCc2ccccn2 207a_100000211156_100000749909 [0,1,1,0,0,0|2,0,0]=4 3484 B17R2.3230 Cn1cc(nn1)CNCCc2ccccn2 270004a_100000211156_100000749909 [0,1,1,0,0,0|2,0,0]=4 3485 B17R2.3230 Cn1cc(nn1)CNCCc2cccnc2 207a_100000736294_100000749909 [0,1,1,0,0,0|2,0,0]=4 3486 B17R2.3230 Cn1cc(nn1)CNCCc2cccnc2 270004a_100000736294_100000749909 [0,1,1,0,0,0|2,0,0]=4 3487 B17R2.3230 Cn1cc(nn1)CNCCc2ccncc2 207a_100000742849_100000749909 [0,1,1,0,0,0|2,0,0]=4 3488 B17R2.3230 Cn1cc(nn1)CNCCc2ccncc2 270004a_100000742849_100000749909 [0,1,1,0,0,0|2,0,0]=4 3489 B17R2.3230 Cn1ccc(n1)CNCCc2ccccc2 207a_100000106460_100000750880 [0,1,1,0,0,0|2,0,0]=4 3490 B17R2.3230 Cn1ccc(n1)CNCCc2ccccc2 2230a_100000106460_100000726502 [0,1,1,0,0,0|2,0,0]=4 3491 B17R2.3230 Cn1ccc(n1)CNCCc2ccccc2 2230a_100020636201_100000765856 [0,1,1,0,0,0|2,0,0]=4 3492 B17R2.3230 Cn1ccc(n1)CNCCc2ccccc2 270004a_100000106460_100000750880 [0,1,1,0,0,0|2,0,0]=4 3493 B17R2.3230 Cn1ccc(n1)CNCCc2ccccc2 34a_100000106460_100000726502 [0,1,1,0,0,0|2,0,0]=4 3494 B17R2.3230 Cn1ccc(n1)CNCCc2ccccc2 34a_100020636201_100000765856 [0,1,1,0,0,0|2,0,0]=4 3495 B17R2.3230 Cn1cnc(c1)CCNCc2ccccc2 207a_106430523030_100015611070 [0,1,1,0,0,0|2,0,0]=4 3496 B17R2.3230 Cn1cnc(c1)CCNCc2ccccc2 270004a_106430523030_100015611070 [0,1,1,0,0,0|2,0,0]=4 3497 B17R2.3230 Cn1cnc(c1)CNCCc2ccccc2 207a_100000106460_100000684808 [0,1,1,0,0,0|0,0,0]=2 3498 B17R2.3230 Cn1cnc(c1)CNCCc2ccccc2 2230a_100000106460_100000717665 [0,1,1,0,0,0|0,0,0]=2 3499 B17R2.3230 Cn1cnc(c1)CNCCc2ccccc2 270004a_100000106460_100000684808 [0,1,1,0,0,0|0,0,0]=2 3500 B17R2.3230 Cn1cnc(c1)CNCCc2ccccc2 34a_100000106460_100000717665 [0,1,1,0,0,0|0,0,0]=2 3501 B17R2.3230 Cn1cnc(c1)CNCCc2ccccn2 207a_100000211156_100000684808 [0,1,1,0,0,0|1,0,0]=3 3502 B17R2.3230 Cn1cnc(c1)CNCCc2ccccn2 270004a_100000211156_100000684808 [0,1,1,0,0,0|1,0,0]=3 3503 B17R2.3230 Cn1cnc(c1)CNCCc2cccnc2 207a_100000736294_100000684808 [0,1,1,0,0,0|1,0,0]=3 3504 B17R2.3230 Cn1cnc(c1)CNCCc2cccnc2 2230a_100000736294_100000717665 [0,1,1,0,0,0|1,0,0]=3 3505 B17R2.3230 Cn1cnc(c1)CNCCc2cccnc2 270004a_100000736294_100000684808 [0,1,1,0,0,0|1,0,0]=3 3506 B17R2.3230 Cn1cnc(c1)CNCCc2ccncc2 207a_100000742849_100000684808 [0,1,1,0,0,0|1,0,0]=3 3507 B17R2.3230 Cn1cnc(c1)CNCCc2ccncc2 270004a_100000742849_100000684808 [0,1,1,0,0,0|1,0,0]=3 3508 B17R2.3230 Cn1cnc(c1)CNCCc2cnccn2 207a_100000723456_100000684808 [0,1,1,0,0,0|2,0,0]=4 3509 B17R2.3230 Cn1cnc(c1)CNCCc2cnccn2 270004a_100000723456_100000684808 [0,1,1,0,0,0|2,0,0]=4 3510 B17R2.3230 Cn1cnc(c1)COCCc2ccccc2 34a_100000210268_100000717665 [0,1,1,0,0,0|1,0,0]=3 3511 B17R2.3230 Cn1cnc(c1)COCCc2ccccc2 34a_100000710007_100000765856 [0,1,1,0,0,0|1,0,0]=3 3512 B17R2.3230 Cn1cnc(c1)COCCc2ccccc2 7a_100000210268_100000717665 [0,1,1,0,0,0|1,0,0]=3 3513 B17R2.3230 Cn1cnc(c1)COCCc2ccccn2 34a_100000210271_100000717665 [0,1,1,0,0,0|2,0,0]=4 3514 B17R2.3230 Cn1cnc(c1)COCCc2cccnc2 34a_100011217484_100000717665 [0,1,1,0,0,0|2,0,0]=4 3515 B17R2.3230 Cn1cnc(c1)COCCc2ccncc2 34a_100011216225_100000717665 [0,1,1,0,0,0|2,0,0]=4 3516 B17R2.3230 Cn1cnc(c1)CSCCc2ccccc2 62a_100000717665_100011218657 [0,1,1,0,0,0|1,0,0]=3 3517 B17R2.3230 Cn1cnc(c1)CSCCc2ccccc2 62a_100000765856_100000717665 [0,1,1,0,0,0|1,0,0]=3 3518 B17R2.3230 Cn1cnc(c1)CSCCc2ccccn2 62a_100000717665_100015183660 [0,1,1,0,0,0|2,0,0]=4 3519 B17R2.3230 Cn1cnc(c1)CSCCc2ccccn2 62a_100015183660_100000717665 [0,1,1,0,0,0|2,0,0]=4 3520 B17R2.3230 Cn1cnc(c1)CSCCc2cccnc2 62a_100000717665_200011713674 [0,1,1,0,0,0|2,0,0]=4 3521 B17R2.3230 Cn1cnc(c1)CSCCc2cccnc2 62a_200011713674_100000717665 [0,1,1,0,0,0|2,0,0]=4 3522 B17R2.3230 Cn1cnc(c1)CSCCc2ccncc2 62a_100000717665_100000723409 [0,1,1,0,0,0|2,0,0]=4 3523 B17R2.3230 Cn1cnc(c1)CSCCc2ccncc2 62a_100000723409_100000717665 [0,1,1,0,0,0|2,0,0]=4 3524 B17R2.3230 Cn1cnc(c1)CSCSc2ccccc2 62a_100000717665_100011218342 [0,1,1,0,0,0|2,0,0]=4 3525 B17R2.3230 Cn1cnc(c1)CSCSc2ccccc2 62a_100011218342_100000717665 [0,1,1,0,0,0|2,0,0]=4 3526 B17R2.3230 Cn1cnc(c1)SCCCc2ccccc2 62a_100000040308_100000211621 [0,1,1,0,0,0|2,0,0]=4 3527 B17R2.3230 Cn1cnc(c1)SCCCc2ccccc2 62a_100000211621_100000040308 [0,1,1,0,0,0|2,0,0]=4 3528 B17R2.3230 Cn1cnc(n1)CNCCc2ccccc2 207a_100000106460_100010630104 [0,1,1,0,0,0|1,0,0]=3 3529 B17R2.3230 Cn1cnc(n1)CNCCc2ccccc2 2230a_100000106460_100016995526 [0,1,1,0,0,0|1,0,0]=3 3530 B17R2.3230 Cn1cnc(n1)CNCCc2ccccc2 2230a_100000695864_100000765856 [0,1,1,0,0,0|1,0,0]=3 3531 B17R2.3230 Cn1cnc(n1)CNCCc2ccccc2 270004a_100000106460_100010630104 [0,1,1,0,0,0|1,0,0]=3 3532 B17R2.3230 Cn1cnc(n1)CNCCc2ccccc2 34a_100000106460_100016995526 [0,1,1,0,0,0|1,0,0]=3 3533 B17R2.3230 Cn1cnc(n1)CNCCc2ccccn2 207a_100000211156_100010630104 [0,1,1,0,0,0|2,0,0]=4 3534 B17R2.3230 Cn1cnc(n1)CNCCc2ccccn2 2230a_100000695864_100015183660 [0,1,1,0,0,0|2,0,0]=4 3535 B17R2.3230 Cn1cnc(n1)CNCCc2ccccn2 270004a_100000211156_100010630104 [0,1,1,0,0,0|2,0,0]=4 3536 B17R2.3230 Cn1cnc(n1)CNCCc2cccnc2 207a_100000736294_100010630104 [0,1,1,0,0,0|2,0,0]=4 3537 B17R2.3230 Cn1cnc(n1)CNCCc2cccnc2 2230a_100000695864_200011713674 [0,1,1,0,0,0|2,0,0]=4 3538 B17R2.3230 Cn1cnc(n1)CNCCc2cccnc2 2230a_100000736294_100016995526 [0,1,1,0,0,0|2,0,0]=4 3539 B17R2.3230 Cn1cnc(n1)CNCCc2cccnc2 270004a_100000736294_100010630104 [0,1,1,0,0,0|2,0,0]=4 3540 B17R2.3230 Cn1cnc(n1)CNCCc2ccncc2 207a_100000742849_100010630104 [0,1,1,0,0,0|2,0,0]=4 3541 B17R2.3230 Cn1cnc(n1)CNCCc2ccncc2 2230a_100000695864_100000723409 [0,1,1,0,0,0|2,0,0]=4 3542 B17R2.3230 Cn1cnc(n1)CNCCc2ccncc2 270004a_100000742849_100010630104 [0,1,1,0,0,0|2,0,0]=4 3543 B17R2.3230 Cn1cnc(n1)CNCSc2ccccc2 2230a_100000695864_100011218342 [0,1,1,0,0,0|2,0,0]=4 3544 B17R2.3230 Cn1cnc(n1)COCCc2ccccc2 34a_100000210268_100016995526 [0,1,1,0,0,0|2,0,0]=4 3545 B17R2.3230 Cn1cnc(n1)COCCc2ccccc2 7a_100000210268_100016995526 [0,1,1,0,0,0|2,0,0]=4 3546 B17R2.3230 Cn1cnc(n1)CSCCc2ccccc2 62a_100000765856_100016995526 [0,1,1,0,0,0|2,0,0]=4 3547 B17R2.3230 Cn1cnc(n1)CSCCc2ccccc2 62a_100016995526_100011218657 [0,1,1,0,0,0|2,0,0]=4 3548 B17R2.3230 Ic1ccc(o1)CNCCc2ccccc2 207a_100000106460_100000186757 [0,1,1,0,0,0|2,0,0]=4 3549 B17R2.3230 Ic1csc(c1)CNCCc2ccccc2 207a_100000106460_100010179861 [0,1,1,0,0,0|2,0,0]=4 3550 B17R2.3230 O=c1[nH]nc([nH]1)CNCCc2ccccc2 2230a_100000106460_100000754189 [0,1,1,0,0,0|1,0,1]=4 3551 B17R2.3230 O=c1[nH]nc([nH]1)CNCCc2ccccc2 2230a_100000766346_100000765856 [0,1,1,0,0,0|1,0,1]=4 3552 B17R2.3366 Brc1cccc(c1)CCCSc2c[nH]cn2 62a_100000756875_100011713683 [0,1,1,0,0,0|2,0,0]=4 3553 B17R2.3366 Brc1cccc(c1)CCCSc2c[nH]cn2 62a_100011713683_100000756875 [0,1,1,0,0,0|2,0,0]=4 3554 B17R2.3366 Brc1cccc(c1)CCNCc2c[nH]cn2 2230a_100011207229_100000707719 [0,1,1,0,0,0|0,0,0]=2 3555 B17R2.3366 Brc1cccc(c1)CCNCc2c[nH]cn2 34a_100011207229_100000707719 [0,1,1,0,0,0|0,0,0]=2 3556 B17R2.3366 Brc1cccc(c1)CCNCc2cc[nH]n2 207a_100011207229_100000738523 [0,1,1,0,0,0|2,0,0]=4 3557 B17R2.3366 Brc1cccc(c1)CCNCc2cc[nH]n2 270004a_100011207229_100000738523 [0,1,1,0,0,0|2,0,0]=4 3558 B17R2.3366 Brc1cccc(c1)CCNCc2ccco2 207a_100011207229_100000186105 [0,1,1,0,0,0|2,0,0]=4 3559 B17R2.3366 Brc1cccc(c1)CCNCc2ccco2 2230a_100000185738_100011740638 [0,1,1,0,0,0|2,0,0]=4 3560 B17R2.3366 Brc1cccc(c1)CCNCc2ccco2 270004a_100011207229_100000186105 [0,1,1,0,0,0|2,0,0]=4 3561 B17R2.3366 Brc1cccc(c1)CCNCc2ccco2 34a_100000185738_100011740638 [0,1,1,0,0,0|2,0,0]=4 3562 B17R2.3366 Brc1cccc(c1)CCNCc2cccs2 207a_100011207229_100000209959 [0,1,1,0,0,0|2,0,0]=4 3563 B17R2.3366 Brc1cccc(c1)CCNCc2cccs2 2230a_100000211653_100011740638 [0,1,1,0,0,0|2,0,0]=4 3564 B17R2.3366 Brc1cccc(c1)CCNCc2cccs2 270004a_100011207229_100000209959 [0,1,1,0,0,0|2,0,0]=4 3565 B17R2.3366 Brc1cccc(c1)CCNCc2ccoc2 207a_100011207229_100011215517 [0,1,1,0,0,0|2,0,0]=4 3566 B17R2.3366 Brc1cccc(c1)CCNCc2ccoc2 2230a_100015206860_100011740638 [0,1,1,0,0,0|2,0,0]=4 3567 B17R2.3366 Brc1cccc(c1)CCNCc2ccoc2 270004a_100011207229_100011215517 [0,1,1,0,0,0|2,0,0]=4 3568 B17R2.3366 Brc1cccc(c1)CCNCc2ccoc2 34a_100015206860_100011740638 [0,1,1,0,0,0|2,0,0]=4 3569 B17R2.3366 Brc1cccc(c1)CCNCc2ccon2 2230a_100011207229_100000234950 [0,1,1,0,0,0|2,0,0]=4 3570 B17R2.3366 Brc1cccc(c1)CCNCc2ccon2 34a_100011207229_100000234950 [0,1,1,0,0,0|2,0,0]=4 3571 B17R2.3366 Brc1cccc(c1)CCNCc2ccsc2 207a_100011207229_100000188534 [0,1,1,0,0,0|2,0,0]=4 3572 B17R2.3366 Brc1cccc(c1)CCNCc2ccsc2 2230a_100000186416_100011740638 [0,1,1,0,0,0|2,0,0]=4 3573 B17R2.3366 Brc1cccc(c1)CCNCc2ccsc2 2230a_100011207229_100011261437 [0,1,1,0,0,0|2,0,0]=4 3574 B17R2.3366 Brc1cccc(c1)CCNCc2ccsc2 270004a_100011207229_100000188534 [0,1,1,0,0,0|2,0,0]=4 3575 B17R2.3366 Brc1cccc(c1)CCNCc2ccsc2 34a_100000186416_100011740638 [0,1,1,0,0,0|2,0,0]=4 3576 B17R2.3366 Brc1cccc(c1)CCNCc2ccsc2 34a_100011207229_100011261437 [0,1,1,0,0,0|2,0,0]=4 3577 B17R2.3366 Brc1cccc(c1)CCNCc2cn[nH]c2 207a_100011207229_100016992096 [0,1,1,0,0,0|2,0,0]=4 3578 B17R2.3366 Brc1cccc(c1)CCNCc2cn[nH]c2 270004a_100011207229_100016992096 [0,1,1,0,0,0|2,0,0]=4 3579 B17R2.3366 Brc1cccc(c1)CCNCc2cnc[nH]2 207a_100011207229_100000742939 [0,1,1,0,0,0|0,0,2]=4 3580 B17R2.3366 Brc1cccc(c1)CCNCc2cnco2 270004a_100011207229_100000064291 [0,1,1,0,0,0|1,0,1]=4 3581 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 207a_100011207229_100000749870 [0,1,1,0,0,0|1,0,1]=4 3582 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 2230a_100011207229_100015185245 [0,1,1,0,0,0|1,0,1]=4 3583 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 2230a_100016987365_100011740638 [0,1,1,0,0,0|1,0,1]=4 3584 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 270004a_100011207229_100000749870 [0,1,1,0,0,0|1,0,1]=4 3585 B17R2.3366 Brc1cccc(c1)CCNCc2cncs2 34a_100011207229_100015185245 [0,1,1,0,0,0|1,0,1]=4 3586 B17R2.3366 Brc1cccc(c1)CCNCc2cocn2 270004a_100011207229_100000050382 [0,1,1,0,0,0|1,0,0]=3 3587 B17R2.3366 Brc1cccc(c1)CCNCc2cscn2 207a_100011207229_100000743575 [0,1,1,0,0,0|1,0,0]=3 3588 B17R2.3366 Brc1cccc(c1)CCNCc2cscn2 2230a_100011207229_100000205941 [0,1,1,0,0,0|1,0,0]=3 3589 B17R2.3366 Brc1cccc(c1)CCNCc2cscn2 2230a_100015185402_100011740638 [0,1,1,0,0,0|1,0,0]=3 3590 B17R2.3366 Brc1cccc(c1)CCNCc2cscn2 270004a_100011207229_100000743575 [0,1,1,0,0,0|1,0,0]=3 3591 B17R2.3366 Brc1cccc(c1)CCNCc2cscn2 34a_100011207229_100000205941 [0,1,1,0,0,0|1,0,0]=3 3592 B17R2.3366 Brc1cccc(c1)CCNCc2csnn2 270004a_100011207229_100000738508 [0,1,1,0,0,0|2,0,0]=4 3593 B17R2.3366 Brc1cccc(c1)CCNCc2ncc[nH]2 207a_100011207229_100000743867 [0,1,1,0,0,0|2,0,0]=4 3594 B17R2.3366 Brc1cccc(c1)CCNCc2ncc[nH]2 2230a_100011207229_100016991755 [0,1,1,0,0,0|2,0,0]=4 3595 B17R2.3366 Brc1cccc(c1)CCNCc2ncc[nH]2 34a_100011207229_100016991755 [0,1,1,0,0,0|2,0,0]=4 3596 B17R2.3366 Brc1cccc(c1)CCNCc2ncco2 2230a_100011207229_103436540062 [0,1,1,0,0,0|2,0,0]=4 3597 B17R2.3366 Brc1cccc(c1)CCNCc2ncco2 2230a_100016994969_100011740638 [0,1,1,0,0,0|2,0,0]=4 3598 B17R2.3366 Brc1cccc(c1)CCNCc2ncco2 270004a_100011207229_100000064290 [0,1,1,0,0,0|2,0,0]=4 3599 B17R2.3366 Brc1cccc(c1)CCNCc2ncco2 34a_100011207229_103436540062 [0,1,1,0,0,0|2,0,0]=4 3600 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 207a_100011207229_100000750902 [0,1,1,0,0,0|2,0,0]=4 3601 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 2230a_100000740555_100011740638 [0,1,1,0,0,0|2,0,0]=4 3602 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 2230a_100011207229_100015184050 [0,1,1,0,0,0|2,0,0]=4 3603 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 270004a_100011207229_100000750902 [0,1,1,0,0,0|2,0,0]=4 3604 B17R2.3366 Brc1cccc(c1)CCNCc2nccs2 34a_100011207229_100015184050 [0,1,1,0,0,0|2,0,0]=4 3605 B17R2.3366 Brc1cccc(c1)CCNCc2ncon2 34a_100011207229_100000233494 [0,1,1,0,0,0|2,0,0]=4 3606 B17R2.3366 Brc1cccc(c1)CCNCn2cncn2 2230a_100011207229_200020645497 [0,1,1,0,0,0|1,0,1]=4 3607 B17R2.3366 Brc1cccc(c1)CCNCn2cncn2 34a_100011207229_200020645497 [0,1,1,0,0,0|1,0,1]=4 3608 B17R2.3366 Brc1cccc(c1)CCOCc2c[nH]cn2 34a_100011217444_100000707719 [0,1,1,0,0,0|1,0,0]=3 3609 B17R2.3366 Brc1cccc(c1)CCOCc2cscn2 34a_100011217444_100000205941 [0,1,1,0,0,0|2,0,0]=4 3610 B17R2.3366 Brc1cccc(c1)CCOCc2cscn2 7a_100011217444_100000205941 [0,1,1,0,0,0|2,0,0]=4 3611 B17R2.3366 Brc1cccc(c1)CCSCc2c[nH]cn2 62a_100000707719_100011740638 [0,1,1,0,0,0|1,0,0]=3 3612 B17R2.3366 Brc1cccc(c1)CCSCc2c[nH]cn2 62a_100011740638_100000707719 [0,1,1,0,0,0|1,0,0]=3 3613 B17R2.3366 Brc1cccc(c1)CCSCc2cscn2 62a_100000205941_100011740638 [0,1,1,0,0,0|2,0,0]=4 3614 B17R2.3366 Brc1cccc(c1)CCSCc2cscn2 62a_100011740638_100000205941 [0,1,1,0,0,0|2,0,0]=4 3615 B17R2.3366 Brc1cccc(c1)CNCCc2c[nH]cn2 2230a_100000174977_100020628418 [0,1,1,0,0,0|2,0,0]=4 3616 B17R2.3366 Brc1cccc(c1)CNCCc2c[nH]cn2 270004a_100000755092_100000210085 [0,1,1,0,0,0|2,0,0]=4 3617 B17R2.3366 Brc1cccc(c1)COCCc2c[nH]cn2 7a_100000687537_100020628418 [0,1,1,0,0,0|2,0,0]=4 3618 B17R2.3366 Brc1cccc(c1)CSCCc2c[nH]cn2 62a_100000211773_100020628418 [0,1,1,0,0,0|2,0,0]=4 3619 B17R2.3366 Brc1cccc(c1)CSCCc2c[nH]cn2 62a_100020628418_100000211773 [0,1,1,0,0,0|2,0,0]=4 3620 B17R2.3366 Brc1cccc(n1)CCOCc2c[nH]cn2 34a_100010221043_100000707719 [0,1,1,0,0,0|2,0,0]=4 3621 B17R2.3366 Cc1cccc(c1)CCNCc2c[nH]cn2 2230a_100000749837_100000707719 [0,1,1,0,0,0|0,0,0]=2 3622 B17R2.3366 Cc1cccc(c1)CCNCc2c[nH]cn2 34a_100000749837_100000707719 [0,1,1,0,0,0|0,0,0]=2 3623 B17R2.3366 Cc1cccc(c1)CCNCc2cc[nH]n2 207a_100000749837_100000738523 [0,1,1,0,0,0|2,0,0]=4 3624 B17R2.3366 Cc1cccc(c1)CCNCc2cc[nH]n2 270004a_100000749837_100000738523 [0,1,1,0,0,0|2,0,0]=4 3625 B17R2.3366 Cc1cccc(c1)CCNCc2ccco2 207a_100000749837_100000186105 [0,1,1,0,0,0|2,0,0]=4 3626 B17R2.3366 Cc1cccc(c1)CCNCc2ccco2 2230a_100000185738_100011713685 [0,1,1,0,0,0|2,0,0]=4 3627 B17R2.3366 Cc1cccc(c1)CCNCc2ccco2 270004a_100000749837_100000186105 [0,1,1,0,0,0|2,0,0]=4 3628 B17R2.3366 Cc1cccc(c1)CCNCc2ccco2 34a_100000185738_100011713685 [0,1,1,0,0,0|2,0,0]=4 3629 B17R2.3366 Cc1cccc(c1)CCNCc2cccs2 207a_100000749837_100000209959 [0,1,1,0,0,0|2,0,0]=4 3630 B17R2.3366 Cc1cccc(c1)CCNCc2cccs2 2230a_100000211653_100011713685 [0,1,1,0,0,0|2,0,0]=4 3631 B17R2.3366 Cc1cccc(c1)CCNCc2cccs2 270004a_100000749837_100000209959 [0,1,1,0,0,0|2,0,0]=4 3632 B17R2.3366 Cc1cccc(c1)CCNCc2ccoc2 207a_100000749837_100011215517 [0,1,1,0,0,0|2,0,0]=4 3633 B17R2.3366 Cc1cccc(c1)CCNCc2ccoc2 2230a_100015206860_100011713685 [0,1,1,0,0,0|2,0,0]=4 3634 B17R2.3366 Cc1cccc(c1)CCNCc2ccoc2 270004a_100000749837_100011215517 [0,1,1,0,0,0|2,0,0]=4 3635 B17R2.3366 Cc1cccc(c1)CCNCc2ccoc2 34a_100015206860_100011713685 [0,1,1,0,0,0|2,0,0]=4 3636 B17R2.3366 Cc1cccc(c1)CCNCc2ccon2 2230a_100000749837_100000234950 [0,1,1,0,0,0|2,0,0]=4 3637 B17R2.3366 Cc1cccc(c1)CCNCc2ccon2 34a_100000749837_100000234950 [0,1,1,0,0,0|2,0,0]=4 3638 B17R2.3366 Cc1cccc(c1)CCNCc2ccsc2 207a_100000749837_100000188534 [0,1,1,0,0,0|2,0,0]=4 3639 B17R2.3366 Cc1cccc(c1)CCNCc2ccsc2 2230a_100000186416_100011713685 [0,1,1,0,0,0|2,0,0]=4 3640 B17R2.3366 Cc1cccc(c1)CCNCc2ccsc2 2230a_100000749837_100011261437 [0,1,1,0,0,0|2,0,0]=4 3641 B17R2.3366 Cc1cccc(c1)CCNCc2ccsc2 270004a_100000749837_100000188534 [0,1,1,0,0,0|2,0,0]=4 3642 B17R2.3366 Cc1cccc(c1)CCNCc2ccsc2 34a_100000186416_100011713685 [0,1,1,0,0,0|2,0,0]=4 3643 B17R2.3366 Cc1cccc(c1)CCNCc2ccsc2 34a_100000749837_100011261437 [0,1,1,0,0,0|2,0,0]=4 3644 B17R2.3366 Cc1cccc(c1)CCNCc2cn[nH]c2 207a_100000749837_100016992096 [0,1,1,0,0,0|2,0,0]=4 3645 B17R2.3366 Cc1cccc(c1)CCNCc2cn[nH]c2 270004a_100000749837_100016992096 [0,1,1,0,0,0|2,0,0]=4 3646 B17R2.3366 Cc1cccc(c1)CCNCc2cnc[nH]2 207a_100000749837_100000742939 [0,1,1,0,0,0|0,0,2]=4 3647 B17R2.3366 Cc1cccc(c1)CCNCc2cnco2 270004a_100000749837_100000064291 [0,1,1,0,0,0|1,0,1]=4 3648 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 207a_100000749837_100000749870 [0,1,1,0,0,0|1,0,1]=4 3649 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 2230a_100000749837_100015185245 [0,1,1,0,0,0|1,0,1]=4 3650 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 2230a_100016987365_100011713685 [0,1,1,0,0,0|1,0,1]=4 3651 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 270004a_100000749837_100000749870 [0,1,1,0,0,0|1,0,1]=4 3652 B17R2.3366 Cc1cccc(c1)CCNCc2cncs2 34a_100000749837_100015185245 [0,1,1,0,0,0|1,0,1]=4 3653 B17R2.3366 Cc1cccc(c1)CCNCc2cocn2 270004a_100000749837_100000050382 [0,1,1,0,0,0|1,0,0]=3 3654 B17R2.3366 Cc1cccc(c1)CCNCc2cscn2 207a_100000749837_100000743575 [0,1,1,0,0,0|1,0,0]=3 3655 B17R2.3366 Cc1cccc(c1)CCNCc2cscn2 2230a_100000749837_100000205941 [0,1,1,0,0,0|1,0,0]=3 3656 B17R2.3366 Cc1cccc(c1)CCNCc2cscn2 2230a_100015185402_100011713685 [0,1,1,0,0,0|1,0,0]=3 3657 B17R2.3366 Cc1cccc(c1)CCNCc2cscn2 270004a_100000749837_100000743575 [0,1,1,0,0,0|1,0,0]=3 3658 B17R2.3366 Cc1cccc(c1)CCNCc2cscn2 34a_100000749837_100000205941 [0,1,1,0,0,0|1,0,0]=3 3659 B17R2.3366 Cc1cccc(c1)CCNCc2csnn2 270004a_100000749837_100000738508 [0,1,1,0,0,0|2,0,0]=4 3660 B17R2.3366 Cc1cccc(c1)CCNCc2ncc[nH]2 207a_100000749837_100000743867 [0,1,1,0,0,0|2,0,0]=4 3661 B17R2.3366 Cc1cccc(c1)CCNCc2ncc[nH]2 2230a_100000749837_100016991755 [0,1,1,0,0,0|2,0,0]=4 3662 B17R2.3366 Cc1cccc(c1)CCNCc2ncc[nH]2 34a_100000749837_100016991755 [0,1,1,0,0,0|2,0,0]=4 3663 B17R2.3366 Cc1cccc(c1)CCNCc2ncco2 2230a_100000749837_103436540062 [0,1,1,0,0,0|2,0,0]=4 3664 B17R2.3366 Cc1cccc(c1)CCNCc2ncco2 2230a_100016994969_100011713685 [0,1,1,0,0,0|2,0,0]=4 3665 B17R2.3366 Cc1cccc(c1)CCNCc2ncco2 270004a_100000749837_100000064290 [0,1,1,0,0,0|2,0,0]=4 3666 B17R2.3366 Cc1cccc(c1)CCNCc2ncco2 34a_100000749837_103436540062 [0,1,1,0,0,0|2,0,0]=4 3667 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 207a_100000749837_100000750902 [0,1,1,0,0,0|2,0,0]=4 3668 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 2230a_100000740555_100011713685 [0,1,1,0,0,0|2,0,0]=4 3669 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 2230a_100000749837_100015184050 [0,1,1,0,0,0|2,0,0]=4 3670 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 270004a_100000749837_100000750902 [0,1,1,0,0,0|2,0,0]=4 3671 B17R2.3366 Cc1cccc(c1)CCNCc2nccs2 34a_100000749837_100015184050 [0,1,1,0,0,0|2,0,0]=4 3672 B17R2.3366 Cc1cccc(c1)CCNCc2ncon2 34a_100000749837_100000233494 [0,1,1,0,0,0|2,0,0]=4 3673 B17R2.3366 Cc1cccc(c1)CCNCn2cncn2 2230a_100000749837_200020645497 [0,1,1,0,0,0|1,0,1]=4 3674 B17R2.3366 Cc1cccc(c1)CCNCn2cncn2 34a_100000749837_200020645497 [0,1,1,0,0,0|1,0,1]=4 3675 B17R2.3366 Cc1cccc(c1)CCOCc2c[nH]cn2 34a_100011217157_100000707719 [0,1,1,0,0,0|1,0,0]=3 3676 B17R2.3366 Cc1cccc(c1)CCOCc2cscn2 34a_100011217157_100000205941 [0,1,1,0,0,0|2,0,0]=4 3677 B17R2.3366 Cc1cccc(c1)CCOCc2cscn2 7a_100011217157_100000205941 [0,1,1,0,0,0|2,0,0]=4 3678 B17R2.3366 Cc1cccc(c1)CCSCc2c[nH]cn2 62a_100000707719_100011713685 [0,1,1,0,0,0|1,0,0]=3 3679 B17R2.3366 Cc1cccc(c1)CCSCc2c[nH]cn2 62a_100011713685_100000707719 [0,1,1,0,0,0|1,0,0]=3 3680 B17R2.3366 Cc1cccc(c1)CCSCc2cscn2 62a_100000205941_100011713685 [0,1,1,0,0,0|2,0,0]=4 3681 B17R2.3366 Cc1cccc(c1)CCSCc2cscn2 62a_100011713685_100000205941 [0,1,1,0,0,0|2,0,0]=4 3682 B17R2.3366 Cc1cccc(c1)CNCCc2c[nH]cn2 2230a_100000185548_100020628418 [0,1,1,0,0,0|2,0,0]=4 3683 B17R2.3366 Cc1cccc(c1)CNCCc2c[nH]cn2 270004a_100000755092_100000211157 [0,1,1,0,0,0|2,0,0]=4 3684 B17R2.3366 Cc1cccc(c1)COCCc2c[nH]cn2 7a_100011217746_100020628418 [0,1,1,0,0,0|2,0,0]=4 3685 B17R2.3366 Cc1cccc(c1)CSCCc2c[nH]cn2 62a_100000211840_100020628418 [0,1,1,0,0,0|2,0,0]=4 3686 B17R2.3366 Cc1cccc(c1)CSCCc2c[nH]cn2 62a_100020628418_100000211840 [0,1,1,0,0,0|2,0,0]=4 3687 B17R2.3366 Cc1cccc(n1)CCNCc2c[nH]cn2 2230a_100011824523_100000707719 [0,1,1,0,0,0|1,0,0]=3 3688 B17R2.3366 Cc1cccc(n1)CCNCc2c[nH]cn2 34a_100011824523_100000707719 [0,1,1,0,0,0|1,0,0]=3 3689 B17R2.3366 Cc1cccc(n1)CCNCc2cocn2 270004a_100011824523_100000050382 [0,1,1,0,0,0|2,0,0]=4 3690 B17R2.3366 Cc1cccc(n1)CCNCc2cscn2 207a_100011824523_100000743575 [0,1,1,0,0,0|2,0,0]=4 3691 B17R2.3366 Cc1cccc(n1)CCNCc2cscn2 2230a_100011824523_100000205941 [0,1,1,0,0,0|2,0,0]=4 3692 B17R2.3366 Cc1cccc(n1)CCNCc2cscn2 270004a_100011824523_100000743575 [0,1,1,0,0,0|2,0,0]=4 3693 B17R2.3366 Cc1cccc(n1)CCNCc2cscn2 34a_100011824523_100000205941 [0,1,1,0,0,0|2,0,0]=4 3694 B17R2.3366 Clc1cccc(c1)CCNCc2c[nH]cn2 2230a_100000185263_100000707719 [0,1,1,0,0,0|0,0,0]=2 3695 B17R2.3366 Clc1cccc(c1)CCNCc2c[nH]cn2 34a_100000185263_100000707719 [0,1,1,0,0,0|0,0,0]=2 3696 B17R2.3366 Clc1cccc(c1)CCNCc2cc[nH]n2 207a_100000185263_100000738523 [0,1,1,0,0,0|2,0,0]=4 3697 B17R2.3366 Clc1cccc(c1)CCNCc2cc[nH]n2 270004a_100000185263_100000738523 [0,1,1,0,0,0|2,0,0]=4 3698 B17R2.3366 Clc1cccc(c1)CCNCc2ccco2 207a_100000185263_100000186105 [0,1,1,0,0,0|2,0,0]=4 3699 B17R2.3366 Clc1cccc(c1)CCNCc2ccco2 2230a_100000185738_100011713710 [0,1,1,0,0,0|2,0,0]=4 3700 B17R2.3366 Clc1cccc(c1)CCNCc2ccco2 270004a_100000185263_100000186105 [0,1,1,0,0,0|2,0,0]=4 3701 B17R2.3366 Clc1cccc(c1)CCNCc2ccco2 34a_100000185738_100011713710 [0,1,1,0,0,0|2,0,0]=4 3702 B17R2.3366 Clc1cccc(c1)CCNCc2cccs2 207a_100000185263_100000209959 [0,1,1,0,0,0|2,0,0]=4 3703 B17R2.3366 Clc1cccc(c1)CCNCc2cccs2 2230a_100000211653_100011713710 [0,1,1,0,0,0|2,0,0]=4 3704 B17R2.3366 Clc1cccc(c1)CCNCc2cccs2 270004a_100000185263_100000209959 [0,1,1,0,0,0|2,0,0]=4 3705 B17R2.3366 Clc1cccc(c1)CCNCc2ccoc2 207a_100000185263_100011215517 [0,1,1,0,0,0|2,0,0]=4 3706 B17R2.3366 Clc1cccc(c1)CCNCc2ccoc2 2230a_100015206860_100011713710 [0,1,1,0,0,0|2,0,0]=4 3707 B17R2.3366 Clc1cccc(c1)CCNCc2ccoc2 270004a_100000185263_100011215517 [0,1,1,0,0,0|2,0,0]=4 3708 B17R2.3366 Clc1cccc(c1)CCNCc2ccoc2 34a_100015206860_100011713710 [0,1,1,0,0,0|2,0,0]=4 3709 B17R2.3366 Clc1cccc(c1)CCNCc2ccon2 2230a_100000185263_100000234950 [0,1,1,0,0,0|2,0,0]=4 3710 B17R2.3366 Clc1cccc(c1)CCNCc2ccon2 34a_100000185263_100000234950 [0,1,1,0,0,0|2,0,0]=4 3711 B17R2.3366 Clc1cccc(c1)CCNCc2ccsc2 207a_100000185263_100000188534 [0,1,1,0,0,0|2,0,0]=4 3712 B17R2.3366 Clc1cccc(c1)CCNCc2ccsc2 2230a_100000185263_100011261437 [0,1,1,0,0,0|2,0,0]=4 3713 B17R2.3366 Clc1cccc(c1)CCNCc2ccsc2 2230a_100000186416_100011713710 [0,1,1,0,0,0|2,0,0]=4 3714 B17R2.3366 Clc1cccc(c1)CCNCc2ccsc2 270004a_100000185263_100000188534 [0,1,1,0,0,0|2,0,0]=4 3715 B17R2.3366 Clc1cccc(c1)CCNCc2ccsc2 34a_100000185263_100011261437 [0,1,1,0,0,0|2,0,0]=4 3716 B17R2.3366 Clc1cccc(c1)CCNCc2ccsc2 34a_100000186416_100011713710 [0,1,1,0,0,0|2,0,0]=4 3717 B17R2.3366 Clc1cccc(c1)CCNCc2cn[nH]c2 207a_100000185263_100016992096 [0,1,1,0,0,0|2,0,0]=4 3718 B17R2.3366 Clc1cccc(c1)CCNCc2cn[nH]c2 270004a_100000185263_100016992096 [0,1,1,0,0,0|2,0,0]=4 3719 B17R2.3366 Clc1cccc(c1)CCNCc2cnc[nH]2 207a_100000185263_100000742939 [0,1,1,0,0,0|0,0,2]=4 3720 B17R2.3366 Clc1cccc(c1)CCNCc2cnco2 270004a_100000185263_100000064291 [0,1,1,0,0,0|1,0,1]=4 3721 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 207a_100000185263_100000749870 [0,1,1,0,0,0|1,0,1]=4 3722 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 2230a_100000185263_100015185245 [0,1,1,0,0,0|1,0,1]=4 3723 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 2230a_100016987365_100011713710 [0,1,1,0,0,0|1,0,1]=4 3724 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 270004a_100000185263_100000749870 [0,1,1,0,0,0|1,0,1]=4 3725 B17R2.3366 Clc1cccc(c1)CCNCc2cncs2 34a_100000185263_100015185245 [0,1,1,0,0,0|1,0,1]=4 3726 B17R2.3366 Clc1cccc(c1)CCNCc2cocn2 270004a_100000185263_100000050382 [0,1,1,0,0,0|1,0,0]=3 3727 B17R2.3366 Clc1cccc(c1)CCNCc2cscn2 207a_100000185263_100000743575 [0,1,1,0,0,0|1,0,0]=3 3728 B17R2.3366 Clc1cccc(c1)CCNCc2cscn2 2230a_100000185263_100000205941 [0,1,1,0,0,0|1,0,0]=3 3729 B17R2.3366 Clc1cccc(c1)CCNCc2cscn2 2230a_100015185402_100011713710 [0,1,1,0,0,0|1,0,0]=3 3730 B17R2.3366 Clc1cccc(c1)CCNCc2cscn2 270004a_100000185263_100000743575 [0,1,1,0,0,0|1,0,0]=3 3731 B17R2.3366 Clc1cccc(c1)CCNCc2cscn2 34a_100000185263_100000205941 [0,1,1,0,0,0|1,0,0]=3 3732 B17R2.3366 Clc1cccc(c1)CCNCc2csnn2 270004a_100000185263_100000738508 [0,1,1,0,0,0|2,0,0]=4 3733 B17R2.3366 Clc1cccc(c1)CCNCc2ncc[nH]2 207a_100000185263_100000743867 [0,1,1,0,0,0|2,0,0]=4 3734 B17R2.3366 Clc1cccc(c1)CCNCc2ncc[nH]2 2230a_100000185263_100016991755 [0,1,1,0,0,0|2,0,0]=4 3735 B17R2.3366 Clc1cccc(c1)CCNCc2ncc[nH]2 34a_100000185263_100016991755 [0,1,1,0,0,0|2,0,0]=4 3736 B17R2.3366 Clc1cccc(c1)CCNCc2ncco2 2230a_100000185263_103436540062 [0,1,1,0,0,0|2,0,0]=4 3737 B17R2.3366 Clc1cccc(c1)CCNCc2ncco2 2230a_100016994969_100011713710 [0,1,1,0,0,0|2,0,0]=4 3738 B17R2.3366 Clc1cccc(c1)CCNCc2ncco2 270004a_100000185263_100000064290 [0,1,1,0,0,0|2,0,0]=4 3739 B17R2.3366 Clc1cccc(c1)CCNCc2ncco2 34a_100000185263_103436540062 [0,1,1,0,0,0|2,0,0]=4 3740 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 207a_100000185263_100000750902 [0,1,1,0,0,0|2,0,0]=4 3741 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 2230a_100000185263_100015184050 [0,1,1,0,0,0|2,0,0]=4 3742 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 2230a_100000740555_100011713710 [0,1,1,0,0,0|2,0,0]=4 3743 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 270004a_100000185263_100000750902 [0,1,1,0,0,0|2,0,0]=4 3744 B17R2.3366 Clc1cccc(c1)CCNCc2nccs2 34a_100000185263_100015184050 [0,1,1,0,0,0|2,0,0]=4 3745 B17R2.3366 Clc1cccc(c1)CCNCc2ncon2 34a_100000185263_100000233494 [0,1,1,0,0,0|2,0,0]=4 3746 B17R2.3366 Clc1cccc(c1)CCNCn2cncn2 2230a_100000185263_200020645497 [0,1,1,0,0,0|1,0,1]=4 3747 B17R2.3366 Clc1cccc(c1)CCNCn2cncn2 34a_100000185263_200020645497 [0,1,1,0,0,0|1,0,1]=4 3748 B17R2.3366 Clc1cccc(c1)CCOCc2c[nH]cn2 34a_100000754733_100000707719 [0,1,1,0,0,0|1,0,0]=3 3749 B17R2.3366 Clc1cccc(c1)CCOCc2cscn2 34a_100000754733_100000205941 [0,1,1,0,0,0|2,0,0]=4 3750 B17R2.3366 Clc1cccc(c1)CCOCc2cscn2 7a_100000754733_100000205941 [0,1,1,0,0,0|2,0,0]=4 3751 B17R2.3366 Clc1cccc(c1)CCSCc2c[nH]cn2 62a_100000707719_100011713710 [0,1,1,0,0,0|1,0,0]=3 3752 B17R2.3366 Clc1cccc(c1)CCSCc2c[nH]cn2 62a_100011713710_100000707719 [0,1,1,0,0,0|1,0,0]=3 3753 B17R2.3366 Clc1cccc(c1)CCSCc2cscn2 62a_100000205941_100011713710 [0,1,1,0,0,0|2,0,0]=4 3754 B17R2.3366 Clc1cccc(c1)CCSCc2cscn2 62a_100011713710_100000205941 [0,1,1,0,0,0|2,0,0]=4 3755 B17R2.3366 Clc1cccc(c1)CNCCc2c[nH]cn2 2230a_100000174878_100020628418 [0,1,1,0,0,0|2,0,0]=4 3756 B17R2.3366 Clc1cccc(c1)CNCCc2c[nH]cn2 270004a_100000755092_100000210801 [0,1,1,0,0,0|2,0,0]=4 3757 B17R2.3366 Clc1cccc(c1)COCCc2c[nH]cn2 7a_100000241301_100020628418 [0,1,1,0,0,0|2,0,0]=4 3758 B17R2.3366 Clc1cccc(c1)CSCCc2c[nH]cn2 62a_100000187163_100020628418 [0,1,1,0,0,0|2,0,0]=4 3759 B17R2.3366 Clc1cccc(c1)CSCCc2c[nH]cn2 62a_100020628418_100000187163 [0,1,1,0,0,0|2,0,0]=4 3760 B17R2.3366 Fc1cccc(c1)CCCSc2c[nH]cn2 62a_100000756875_200000698031 [0,1,1,0,0,0|2,0,0]=4 3761 B17R2.3366 Fc1cccc(c1)CCCSc2c[nH]cn2 62a_200000698031_100000756875 [0,1,1,0,0,0|2,0,0]=4 3762 B17R2.3366 Fc1cccc(c1)CCNCc2c[nH]cn2 2230a_100000205154_100000707719 [0,1,1,0,0,0|0,0,0]=2 3763 B17R2.3366 Fc1cccc(c1)CCNCc2c[nH]cn2 34a_100000205154_100000707719 [0,1,1,0,0,0|0,0,0]=2 3764 B17R2.3366 Fc1cccc(c1)CCNCc2cc[nH]n2 207a_100000205154_100000738523 [0,1,1,0,0,0|2,0,0]=4 3765 B17R2.3366 Fc1cccc(c1)CCNCc2cc[nH]n2 270004a_100000205154_100000738523 [0,1,1,0,0,0|2,0,0]=4 3766 B17R2.3366 Fc1cccc(c1)CCNCc2ccco2 207a_100000205154_100000186105 [0,1,1,0,0,0|2,0,0]=4 3767 B17R2.3366 Fc1cccc(c1)CCNCc2ccco2 2230a_100000185738_100011217235 [0,1,1,0,0,0|2,0,0]=4 3768 B17R2.3366 Fc1cccc(c1)CCNCc2ccco2 270004a_100000205154_100000186105 [0,1,1,0,0,0|2,0,0]=4 3769 B17R2.3366 Fc1cccc(c1)CCNCc2ccco2 34a_100000185738_100011217235 [0,1,1,0,0,0|2,0,0]=4 3770 B17R2.3366 Fc1cccc(c1)CCNCc2cccs2 207a_100000205154_100000209959 [0,1,1,0,0,0|2,0,0]=4 3771 B17R2.3366 Fc1cccc(c1)CCNCc2cccs2 2230a_100000211653_100011217235 [0,1,1,0,0,0|2,0,0]=4 3772 B17R2.3366 Fc1cccc(c1)CCNCc2cccs2 270004a_100000205154_100000209959 [0,1,1,0,0,0|2,0,0]=4 3773 B17R2.3366 Fc1cccc(c1)CCNCc2ccoc2 207a_100000205154_100011215517 [0,1,1,0,0,0|2,0,0]=4 3774 B17R2.3366 Fc1cccc(c1)CCNCc2ccoc2 2230a_100015206860_100011217235 [0,1,1,0,0,0|2,0,0]=4 3775 B17R2.3366 Fc1cccc(c1)CCNCc2ccoc2 270004a_100000205154_100011215517 [0,1,1,0,0,0|2,0,0]=4 3776 B17R2.3366 Fc1cccc(c1)CCNCc2ccoc2 34a_100015206860_100011217235 [0,1,1,0,0,0|2,0,0]=4 3777 B17R2.3366 Fc1cccc(c1)CCNCc2ccon2 2230a_100000205154_100000234950 [0,1,1,0,0,0|2,0,0]=4 3778 B17R2.3366 Fc1cccc(c1)CCNCc2ccon2 34a_100000205154_100000234950 [0,1,1,0,0,0|2,0,0]=4 3779 B17R2.3366 Fc1cccc(c1)CCNCc2ccsc2 207a_100000205154_100000188534 [0,1,1,0,0,0|2,0,0]=4 3780 B17R2.3366 Fc1cccc(c1)CCNCc2ccsc2 2230a_100000186416_100011217235 [0,1,1,0,0,0|2,0,0]=4 3781 B17R2.3366 Fc1cccc(c1)CCNCc2ccsc2 2230a_100000205154_100011261437 [0,1,1,0,0,0|2,0,0]=4 3782 B17R2.3366 Fc1cccc(c1)CCNCc2ccsc2 270004a_100000205154_100000188534 [0,1,1,0,0,0|2,0,0]=4 3783 B17R2.3366 Fc1cccc(c1)CCNCc2ccsc2 34a_100000186416_100011217235 [0,1,1,0,0,0|2,0,0]=4 3784 B17R2.3366 Fc1cccc(c1)CCNCc2ccsc2 34a_100000205154_100011261437 [0,1,1,0,0,0|2,0,0]=4 3785 B17R2.3366 Fc1cccc(c1)CCNCc2cn[nH]c2 207a_100000205154_100016992096 [0,1,1,0,0,0|2,0,0]=4 3786 B17R2.3366 Fc1cccc(c1)CCNCc2cn[nH]c2 270004a_100000205154_100016992096 [0,1,1,0,0,0|2,0,0]=4 3787 B17R2.3366 Fc1cccc(c1)CCNCc2cnc[nH]2 207a_100000205154_100000742939 [0,1,1,0,0,0|0,0,2]=4 3788 B17R2.3366 Fc1cccc(c1)CCNCc2cnco2 270004a_100000205154_100000064291 [0,1,1,0,0,0|1,0,1]=4 3789 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 207a_100000205154_100000749870 [0,1,1,0,0,0|1,0,1]=4 3790 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 2230a_100000205154_100015185245 [0,1,1,0,0,0|1,0,1]=4 3791 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 2230a_100016987365_100011217235 [0,1,1,0,0,0|1,0,1]=4 3792 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 270004a_100000205154_100000749870 [0,1,1,0,0,0|1,0,1]=4 3793 B17R2.3366 Fc1cccc(c1)CCNCc2cncs2 34a_100000205154_100015185245 [0,1,1,0,0,0|1,0,1]=4 3794 B17R2.3366 Fc1cccc(c1)CCNCc2cocn2 270004a_100000205154_100000050382 [0,1,1,0,0,0|1,0,0]=3 3795 B17R2.3366 Fc1cccc(c1)CCNCc2cscn2 207a_100000205154_100000743575 [0,1,1,0,0,0|1,0,0]=3 3796 B17R2.3366 Fc1cccc(c1)CCNCc2cscn2 2230a_100000205154_100000205941 [0,1,1,0,0,0|1,0,0]=3 3797 B17R2.3366 Fc1cccc(c1)CCNCc2cscn2 2230a_100015185402_100011217235 [0,1,1,0,0,0|1,0,0]=3 3798 B17R2.3366 Fc1cccc(c1)CCNCc2cscn2 270004a_100000205154_100000743575 [0,1,1,0,0,0|1,0,0]=3 3799 B17R2.3366 Fc1cccc(c1)CCNCc2cscn2 34a_100000205154_100000205941 [0,1,1,0,0,0|1,0,0]=3 3800 B17R2.3366 Fc1cccc(c1)CCNCc2csnn2 270004a_100000205154_100000738508 [0,1,1,0,0,0|2,0,0]=4 3801 B17R2.3366 Fc1cccc(c1)CCNCc2ncc[nH]2 207a_100000205154_100000743867 [0,1,1,0,0,0|2,0,0]=4 3802 B17R2.3366 Fc1cccc(c1)CCNCc2ncc[nH]2 2230a_100000205154_100016991755 [0,1,1,0,0,0|2,0,0]=4 3803 B17R2.3366 Fc1cccc(c1)CCNCc2ncc[nH]2 34a_100000205154_100016991755 [0,1,1,0,0,0|2,0,0]=4 3804 B17R2.3366 Fc1cccc(c1)CCNCc2ncco2 2230a_100000205154_103436540062 [0,1,1,0,0,0|2,0,0]=4 3805 B17R2.3366 Fc1cccc(c1)CCNCc2ncco2 2230a_100016994969_100011217235 [0,1,1,0,0,0|2,0,0]=4 3806 B17R2.3366 Fc1cccc(c1)CCNCc2ncco2 270004a_100000205154_100000064290 [0,1,1,0,0,0|2,0,0]=4 3807 B17R2.3366 Fc1cccc(c1)CCNCc2ncco2 34a_100000205154_103436540062 [0,1,1,0,0,0|2,0,0]=4 3808 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 207a_100000205154_100000750902 [0,1,1,0,0,0|2,0,0]=4 3809 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 2230a_100000205154_100015184050 [0,1,1,0,0,0|2,0,0]=4 3810 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 2230a_100000740555_100011217235 [0,1,1,0,0,0|2,0,0]=4 3811 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 270004a_100000205154_100000750902 [0,1,1,0,0,0|2,0,0]=4 3812 B17R2.3366 Fc1cccc(c1)CCNCc2nccs2 34a_100000205154_100015184050 [0,1,1,0,0,0|2,0,0]=4 3813 B17R2.3366 Fc1cccc(c1)CCNCc2ncon2 34a_100000205154_100000233494 [0,1,1,0,0,0|2,0,0]=4 3814 B17R2.3366 Fc1cccc(c1)CCNCn2cncn2 2230a_100000205154_200020645497 [0,1,1,0,0,0|1,0,1]=4 3815 B17R2.3366 Fc1cccc(c1)CCNCn2cncn2 34a_100000205154_200020645497 [0,1,1,0,0,0|1,0,1]=4 3816 B17R2.3366 Fc1cccc(c1)CCOCc2c[nH]cn2 34a_100000763591_100000707719 [0,1,1,0,0,0|1,0,0]=3 3817 B17R2.3366 Fc1cccc(c1)CCOCc2cscn2 34a_100000763591_100000205941 [0,1,1,0,0,0|2,0,0]=4 3818 B17R2.3366 Fc1cccc(c1)CCOCc2cscn2 7a_100000763591_100000205941 [0,1,1,0,0,0|2,0,0]=4 3819 B17R2.3366 Fc1cccc(c1)CCSCc2c[nH]cn2 62a_100000707719_100011217235 [0,1,1,0,0,0|1,0,0]=3 3820 B17R2.3366 Fc1cccc(c1)CCSCc2c[nH]cn2 62a_100011217235_100000707719 [0,1,1,0,0,0|1,0,0]=3 3821 B17R2.3366 Fc1cccc(c1)CCSCc2cscn2 62a_100000205941_100011217235 [0,1,1,0,0,0|2,0,0]=4 3822 B17R2.3366 Fc1cccc(c1)CCSCc2cscn2 62a_100011217235_100000205941 [0,1,1,0,0,0|2,0,0]=4 3823 B17R2.3366 Fc1cccc(c1)CNCCc2c[nH]cn2 2230a_100000174948_100020628418 [0,1,1,0,0,0|2,0,0]=4 3824 B17R2.3366 Fc1cccc(c1)CNCCc2c[nH]cn2 270004a_100000755092_100000210812 [0,1,1,0,0,0|2,0,0]=4 3825 B17R2.3366 Fc1cccc(c1)COCCc2c[nH]cn2 7a_100000210976_100020628418 [0,1,1,0,0,0|2,0,0]=4 3826 B17R2.3366 Fc1cccc(c1)CSCCc2c[nH]cn2 62a_100000230114_100020628418 [0,1,1,0,0,0|2,0,0]=4 3827 B17R2.3366 Fc1cccc(c1)CSCCc2c[nH]cn2 62a_100020628418_100000230114 [0,1,1,0,0,0|2,0,0]=4 3828 B17R2.3366 Ic1cccc(c1)CNCCc2c[nH]cn2 2230a_100000106179_100020628418 [0,1,1,0,0,0|2,0,0]=4 3829 B17R2.3366 Ic1cccc(c1)CNCCc2c[nH]cn2 270004a_100000755092_100000014684 [0,1,1,0,0,0|2,0,0]=4 3830 B17R2.3366 Ic1cccc(c1)COCCc2c[nH]cn2 7a_100011215336_100020628418 [0,1,1,0,0,0|2,0,0]=4 3831 B17R2.3366 Ic1cccc(c1)CSCCc2c[nH]cn2 62a_100011218688_100020628418 [0,1,1,0,0,0|2,0,0]=4 3832 B17R2.3366 Ic1cccc(c1)CSCCc2c[nH]cn2 62a_100020628418_100011218688 [0,1,1,0,0,0|2,0,0]=4 3833 B17R2.3366 Nc1cccc(c1)CCOCc2c[nH]cn2 34a_100011996697_100000707719 [0,1,1,0,0,0|1,0,0]=3 3834 B17R2.3366 Nc1cccc(c1)CCOCc2cscn2 34a_100011996697_100000205941 [0,1,1,0,0,0|2,0,0]=4 3835 B17R2.3366 Oc1cccc(c1)CCNCc2c[nH]cn2 2230a_100000747277_100000707719 [0,1,1,0,0,0|0,0,0]=2 3836 B17R2.3366 Oc1cccc(c1)CCNCc2c[nH]cn2 34a_100000747277_100000707719 [0,1,1,0,0,0|0,0,0]=2 3837 B17R2.3366 Oc1cccc(c1)CCNCc2ccon2 2230a_100000747277_100000234950 [0,1,1,0,0,0|2,0,0]=4 3838 B17R2.3366 Oc1cccc(c1)CCNCc2ccon2 34a_100000747277_100000234950 [0,1,1,0,0,0|2,0,0]=4 3839 B17R2.3366 Oc1cccc(c1)CCNCc2ccsc2 2230a_100000747277_100011261437 [0,1,1,0,0,0|2,0,0]=4 3840 B17R2.3366 Oc1cccc(c1)CCNCc2ccsc2 34a_100000747277_100011261437 [0,1,1,0,0,0|2,0,0]=4 3841 B17R2.3366 Oc1cccc(c1)CCNCc2cncs2 2230a_100000747277_100015185245 [0,1,1,0,0,0|1,0,1]=4 3842 B17R2.3366 Oc1cccc(c1)CCNCc2cncs2 34a_100000747277_100015185245 [0,1,1,0,0,0|1,0,1]=4 3843 B17R2.3366 Oc1cccc(c1)CCNCc2cscn2 2230a_100000747277_100000205941 [0,1,1,0,0,0|1,0,0]=3 3844 B17R2.3366 Oc1cccc(c1)CCNCc2cscn2 34a_100000747277_100000205941 [0,1,1,0,0,0|1,0,0]=3 3845 B17R2.3366 Oc1cccc(c1)CCNCc2ncc[nH]2 2230a_100000747277_100016991755 [0,1,1,0,0,0|2,0,0]=4 3846 B17R2.3366 Oc1cccc(c1)CCNCc2ncc[nH]2 34a_100000747277_100016991755 [0,1,1,0,0,0|2,0,0]=4 3847 B17R2.3366 Oc1cccc(c1)CCNCc2ncco2 2230a_100000747277_103436540062 [0,1,1,0,0,0|2,0,0]=4 3848 B17R2.3366 Oc1cccc(c1)CCNCc2ncco2 34a_100000747277_103436540062 [0,1,1,0,0,0|2,0,0]=4 3849 B17R2.3366 Oc1cccc(c1)CCNCc2nccs2 2230a_100000747277_100015184050 [0,1,1,0,0,0|2,0,0]=4 3850 B17R2.3366 Oc1cccc(c1)CCNCc2nccs2 34a_100000747277_100015184050 [0,1,1,0,0,0|2,0,0]=4 3851 B17R2.3366 Oc1cccc(c1)CCNCc2ncon2 34a_100000747277_100000233494 [0,1,1,0,0,0|2,0,0]=4 3852 B17R2.3366 Oc1cccc(c1)CCNCn2cncn2 2230a_100000747277_200020645497 [0,1,1,0,0,0|1,0,1]=4 3853 B17R2.3366 Oc1cccc(c1)CCNCn2cncn2 34a_100000747277_200020645497 [0,1,1,0,0,0|1,0,1]=4 3854 B17R2.3366 Oc1cccc(c1)CNCCc2c[nH]cn2 2230a_100000743036_100020628418 [0,1,1,0,0,0|2,0,0]=4 3855 B17R2.3366 Oc1cccc(c1)CNCCc2c[nH]cn2 270004a_100000755092_100000188321 [0,1,1,0,0,0|2,0,0]=4 3856 B17R2.3366 Oc1cccc(c1)CSCCc2c[nH]cn2 62a_100011660834_100020628418 [0,1,1,0,0,0|2,0,0]=4 3857 B17R2.3366 Oc1cccc(c1)CSCCc2c[nH]cn2 62a_100020628418_100011660834 [0,1,1,0,0,0|2,0,0]=4 3858 B17R2.3430 Brc1ccccc1CCCSc2c[nH]cn2 62a_100000756875_200011713681 [0,1,1,0,0,0|2,0,0]=4 3859 B17R2.3430 Brc1ccccc1CCCSc2c[nH]cn2 62a_200011713681_100000756875 [0,1,1,0,0,0|2,0,0]=4 3860 B17R2.3430 Brc1ccccc1CCNCc2c[nH]cn2 2230a_100000747383_100000707719 [0,1,1,0,0,0|0,0,0]=2 3861 B17R2.3430 Brc1ccccc1CCNCc2c[nH]cn2 34a_100000747383_100000707719 [0,1,1,0,0,0|0,0,0]=2 3862 B17R2.3430 Brc1ccccc1CCNCc2cc[nH]n2 207a_100000747383_100000738523 [0,1,1,0,0,0|2,0,0]=4 3863 B17R2.3430 Brc1ccccc1CCNCc2cc[nH]n2 270004a_100000747383_100000738523 [0,1,1,0,0,0|2,0,0]=4 3864 B17R2.3430 Brc1ccccc1CCNCc2ccco2 207a_100000747383_100000186105 [0,1,1,0,0,0|2,0,0]=4 3865 B17R2.3430 Brc1ccccc1CCNCc2ccco2 2230a_100000185738_100012161201 [0,1,1,0,0,0|2,0,0]=4 3866 B17R2.3430 Brc1ccccc1CCNCc2ccco2 270004a_100000747383_100000186105 [0,1,1,0,0,0|2,0,0]=4 3867 B17R2.3430 Brc1ccccc1CCNCc2ccco2 34a_100000185738_100012161201 [0,1,1,0,0,0|2,0,0]=4 3868 B17R2.3430 Brc1ccccc1CCNCc2cccs2 207a_100000747383_100000209959 [0,1,1,0,0,0|2,0,0]=4 3869 B17R2.3430 Brc1ccccc1CCNCc2cccs2 2230a_100000211653_100012161201 [0,1,1,0,0,0|2,0,0]=4 3870 B17R2.3430 Brc1ccccc1CCNCc2cccs2 270004a_100000747383_100000209959 [0,1,1,0,0,0|2,0,0]=4 3871 B17R2.3430 Brc1ccccc1CCNCc2ccoc2 207a_100000747383_100011215517 [0,1,1,0,0,0|2,0,0]=4 3872 B17R2.3430 Brc1ccccc1CCNCc2ccoc2 2230a_100015206860_100012161201 [0,1,1,0,0,0|2,0,0]=4 3873 B17R2.3430 Brc1ccccc1CCNCc2ccoc2 270004a_100000747383_100011215517 [0,1,1,0,0,0|2,0,0]=4 3874 B17R2.3430 Brc1ccccc1CCNCc2ccoc2 34a_100015206860_100012161201 [0,1,1,0,0,0|2,0,0]=4 3875 B17R2.3430 Brc1ccccc1CCNCc2ccon2 2230a_100000747383_100000234950 [0,1,1,0,0,0|2,0,0]=4 3876 B17R2.3430 Brc1ccccc1CCNCc2ccon2 34a_100000747383_100000234950 [0,1,1,0,0,0|2,0,0]=4 3877 B17R2.3430 Brc1ccccc1CCNCc2ccsc2 207a_100000747383_100000188534 [0,1,1,0,0,0|2,0,0]=4 3878 B17R2.3430 Brc1ccccc1CCNCc2ccsc2 2230a_100000186416_100012161201 [0,1,1,0,0,0|2,0,0]=4 3879 B17R2.3430 Brc1ccccc1CCNCc2ccsc2 2230a_100000747383_100011261437 [0,1,1,0,0,0|2,0,0]=4 3880 B17R2.3430 Brc1ccccc1CCNCc2ccsc2 270004a_100000747383_100000188534 [0,1,1,0,0,0|2,0,0]=4 3881 B17R2.3430 Brc1ccccc1CCNCc2ccsc2 34a_100000186416_100012161201 [0,1,1,0,0,0|2,0,0]=4 3882 B17R2.3430 Brc1ccccc1CCNCc2ccsc2 34a_100000747383_100011261437 [0,1,1,0,0,0|2,0,0]=4 3883 B17R2.3430 Brc1ccccc1CCNCc2cn[nH]c2 207a_100000747383_100016992096 [0,1,1,0,0,0|2,0,0]=4 3884 B17R2.3430 Brc1ccccc1CCNCc2cn[nH]c2 270004a_100000747383_100016992096 [0,1,1,0,0,0|2,0,0]=4 3885 B17R2.3430 Brc1ccccc1CCNCc2cnc[nH]2 207a_100000747383_100000742939 [0,1,1,0,0,0|0,0,2]=4 3886 B17R2.3430 Brc1ccccc1CCNCc2cnco2 270004a_100000747383_100000064291 [0,1,1,0,0,0|1,0,1]=4 3887 B17R2.3430 Brc1ccccc1CCNCc2cncs2 207a_100000747383_100000749870 [0,1,1,0,0,0|1,0,1]=4 3888 B17R2.3430 Brc1ccccc1CCNCc2cncs2 2230a_100000747383_100015185245 [0,1,1,0,0,0|1,0,1]=4 3889 B17R2.3430 Brc1ccccc1CCNCc2cncs2 2230a_100016987365_100012161201 [0,1,1,0,0,0|1,0,1]=4 3890 B17R2.3430 Brc1ccccc1CCNCc2cncs2 270004a_100000747383_100000749870 [0,1,1,0,0,0|1,0,1]=4 3891 B17R2.3430 Brc1ccccc1CCNCc2cncs2 34a_100000747383_100015185245 [0,1,1,0,0,0|1,0,1]=4 3892 B17R2.3430 Brc1ccccc1CCNCc2cocn2 270004a_100000747383_100000050382 [0,1,1,0,0,0|1,0,0]=3 3893 B17R2.3430 Brc1ccccc1CCNCc2cscn2 207a_100000747383_100000743575 [0,1,1,0,0,0|1,0,0]=3 3894 B17R2.3430 Brc1ccccc1CCNCc2cscn2 2230a_100000747383_100000205941 [0,1,1,0,0,0|1,0,0]=3 3895 B17R2.3430 Brc1ccccc1CCNCc2cscn2 2230a_100015185402_100012161201 [0,1,1,0,0,0|1,0,0]=3 3896 B17R2.3430 Brc1ccccc1CCNCc2cscn2 270004a_100000747383_100000743575 [0,1,1,0,0,0|1,0,0]=3 3897 B17R2.3430 Brc1ccccc1CCNCc2cscn2 34a_100000747383_100000205941 [0,1,1,0,0,0|1,0,0]=3 3898 B17R2.3430 Brc1ccccc1CCNCc2csnn2 270004a_100000747383_100000738508 [0,1,1,0,0,0|2,0,0]=4 3899 B17R2.3430 Brc1ccccc1CCNCc2ncc[nH]2 207a_100000747383_100000743867 [0,1,1,0,0,0|2,0,0]=4 3900 B17R2.3430 Brc1ccccc1CCNCc2ncc[nH]2 2230a_100000747383_100016991755 [0,1,1,0,0,0|2,0,0]=4 3901 B17R2.3430 Brc1ccccc1CCNCc2ncc[nH]2 34a_100000747383_100016991755 [0,1,1,0,0,0|2,0,0]=4 3902 B17R2.3430 Brc1ccccc1CCNCc2ncco2 2230a_100000747383_103436540062 [0,1,1,0,0,0|2,0,0]=4 3903 B17R2.3430 Brc1ccccc1CCNCc2ncco2 2230a_100016994969_100012161201 [0,1,1,0,0,0|2,0,0]=4 3904 B17R2.3430 Brc1ccccc1CCNCc2ncco2 270004a_100000747383_100000064290 [0,1,1,0,0,0|2,0,0]=4 3905 B17R2.3430 Brc1ccccc1CCNCc2ncco2 34a_100000747383_103436540062 [0,1,1,0,0,0|2,0,0]=4 3906 B17R2.3430 Brc1ccccc1CCNCc2nccs2 207a_100000747383_100000750902 [0,1,1,0,0,0|2,0,0]=4 3907 B17R2.3430 Brc1ccccc1CCNCc2nccs2 2230a_100000740555_100012161201 [0,1,1,0,0,0|2,0,0]=4 3908 B17R2.3430 Brc1ccccc1CCNCc2nccs2 2230a_100000747383_100015184050 [0,1,1,0,0,0|2,0,0]=4 3909 B17R2.3430 Brc1ccccc1CCNCc2nccs2 270004a_100000747383_100000750902 [0,1,1,0,0,0|2,0,0]=4 3910 B17R2.3430 Brc1ccccc1CCNCc2nccs2 34a_100000747383_100015184050 [0,1,1,0,0,0|2,0,0]=4 3911 B17R2.3430 Brc1ccccc1CCNCc2ncon2 34a_100000747383_100000233494 [0,1,1,0,0,0|2,0,0]=4 3912 B17R2.3430 Brc1ccccc1CCNCn2cncn2 2230a_100000747383_200020645497 [0,1,1,0,0,0|1,0,1]=4 3913 B17R2.3430 Brc1ccccc1CCNCn2cncn2 34a_100000747383_200020645497 [0,1,1,0,0,0|1,0,1]=4 3914 B17R2.3430 Brc1ccccc1CCOCc2c[nH]cn2 34a_100000731337_100000707719 [0,1,1,0,0,0|1,0,0]=3 3915 B17R2.3430 Brc1ccccc1CCOCc2cscn2 34a_100000731337_100000205941 [0,1,1,0,0,0|2,0,0]=4 3916 B17R2.3430 Brc1ccccc1CCOCc2cscn2 7a_100000731337_100000205941 [0,1,1,0,0,0|2,0,0]=4 3917 B17R2.3430 Brc1ccccc1CCSCc2c[nH]cn2 62a_100000707719_100012161201 [0,1,1,0,0,0|1,0,0]=3 3918 B17R2.3430 Brc1ccccc1CCSCc2c[nH]cn2 62a_100012161201_100000707719 [0,1,1,0,0,0|1,0,0]=3 3919 B17R2.3430 Brc1ccccc1CCSCc2cscn2 62a_100000205941_100012161201 [0,1,1,0,0,0|2,0,0]=4 3920 B17R2.3430 Brc1ccccc1CCSCc2cscn2 62a_100012161201_100000205941 [0,1,1,0,0,0|2,0,0]=4 3921 B17R2.3430 Brc1ccccc1CNCCc2c[nH]cn2 2230a_100000689332_100020628418 [0,1,1,0,0,0|2,0,0]=4 3922 B17R2.3430 Brc1ccccc1CNCCc2c[nH]cn2 270004a_100000755092_100000211189 [0,1,1,0,0,0|2,0,0]=4 3923 B17R2.3430 Brc1ccccc1COCCc2c[nH]cn2 7a_100000756307_100020628418 [0,1,1,0,0,0|2,0,0]=4 3924 B17R2.3430 Brc1ccccc1CSCCc2c[nH]cn2 62a_100000184730_100020628418 [0,1,1,0,0,0|2,0,0]=4 3925 B17R2.3430 Brc1ccccc1CSCCc2c[nH]cn2 62a_100020628418_100000184730 [0,1,1,0,0,0|2,0,0]=4 3926 B17R2.3430 Cc1ccccc1CCNCc2c[nH]cn2 2230a_100000685071_100000707719 [0,1,1,0,0,0|0,0,0]=2 3927 B17R2.3430 Cc1ccccc1CCNCc2c[nH]cn2 34a_100000685071_100000707719 [0,1,1,0,0,0|0,0,0]=2 3928 B17R2.3430 Cc1ccccc1CCNCc2cc[nH]n2 207a_100000685071_100000738523 [0,1,1,0,0,0|2,0,0]=4 3929 B17R2.3430 Cc1ccccc1CCNCc2cc[nH]n2 270004a_100000685071_100000738523 [0,1,1,0,0,0|2,0,0]=4 3930 B17R2.3430 Cc1ccccc1CCNCc2ccco2 207a_100000685071_100000186105 [0,1,1,0,0,0|2,0,0]=4 3931 B17R2.3430 Cc1ccccc1CCNCc2ccco2 2230a_100000185738_100011713688 [0,1,1,0,0,0|2,0,0]=4 3932 B17R2.3430 Cc1ccccc1CCNCc2ccco2 270004a_100000685071_100000186105 [0,1,1,0,0,0|2,0,0]=4 3933 B17R2.3430 Cc1ccccc1CCNCc2ccco2 34a_100000185738_100011713688 [0,1,1,0,0,0|2,0,0]=4 3934 B17R2.3430 Cc1ccccc1CCNCc2cccs2 207a_100000685071_100000209959 [0,1,1,0,0,0|2,0,0]=4 3935 B17R2.3430 Cc1ccccc1CCNCc2cccs2 2230a_100000211653_100011713688 [0,1,1,0,0,0|2,0,0]=4 3936 B17R2.3430 Cc1ccccc1CCNCc2cccs2 270004a_100000685071_100000209959 [0,1,1,0,0,0|2,0,0]=4 3937 B17R2.3430 Cc1ccccc1CCNCc2ccoc2 207a_100000685071_100011215517 [0,1,1,0,0,0|2,0,0]=4 3938 B17R2.3430 Cc1ccccc1CCNCc2ccoc2 2230a_100015206860_100011713688 [0,1,1,0,0,0|2,0,0]=4 3939 B17R2.3430 Cc1ccccc1CCNCc2ccoc2 270004a_100000685071_100011215517 [0,1,1,0,0,0|2,0,0]=4 3940 B17R2.3430 Cc1ccccc1CCNCc2ccoc2 34a_100015206860_100011713688 [0,1,1,0,0,0|2,0,0]=4 3941 B17R2.3430 Cc1ccccc1CCNCc2ccon2 2230a_100000685071_100000234950 [0,1,1,0,0,0|2,0,0]=4 3942 B17R2.3430 Cc1ccccc1CCNCc2ccon2 34a_100000685071_100000234950 [0,1,1,0,0,0|2,0,0]=4 3943 B17R2.3430 Cc1ccccc1CCNCc2ccsc2 207a_100000685071_100000188534 [0,1,1,0,0,0|2,0,0]=4 3944 B17R2.3430 Cc1ccccc1CCNCc2ccsc2 2230a_100000186416_100011713688 [0,1,1,0,0,0|2,0,0]=4 3945 B17R2.3430 Cc1ccccc1CCNCc2ccsc2 2230a_100000685071_100011261437 [0,1,1,0,0,0|2,0,0]=4 3946 B17R2.3430 Cc1ccccc1CCNCc2ccsc2 270004a_100000685071_100000188534 [0,1,1,0,0,0|2,0,0]=4 3947 B17R2.3430 Cc1ccccc1CCNCc2ccsc2 34a_100000186416_100011713688 [0,1,1,0,0,0|2,0,0]=4 3948 B17R2.3430 Cc1ccccc1CCNCc2ccsc2 34a_100000685071_100011261437 [0,1,1,0,0,0|2,0,0]=4 3949 B17R2.3430 Cc1ccccc1CCNCc2cn[nH]c2 207a_100000685071_100016992096 [0,1,1,0,0,0|2,0,0]=4 3950 B17R2.3430 Cc1ccccc1CCNCc2cn[nH]c2 270004a_100000685071_100016992096 [0,1,1,0,0,0|2,0,0]=4 3951 B17R2.3430 Cc1ccccc1CCNCc2cnc[nH]2 207a_100000685071_100000742939 [0,1,1,0,0,0|0,0,2]=4 3952 B17R2.3430 Cc1ccccc1CCNCc2cnco2 270004a_100000685071_100000064291 [0,1,1,0,0,0|1,0,1]=4 3953 B17R2.3430 Cc1ccccc1CCNCc2cncs2 207a_100000685071_100000749870 [0,1,1,0,0,0|1,0,1]=4 3954 B17R2.3430 Cc1ccccc1CCNCc2cncs2 2230a_100000685071_100015185245 [0,1,1,0,0,0|1,0,1]=4 3955 B17R2.3430 Cc1ccccc1CCNCc2cncs2 2230a_100016987365_100011713688 [0,1,1,0,0,0|1,0,1]=4 3956 B17R2.3430 Cc1ccccc1CCNCc2cncs2 270004a_100000685071_100000749870 [0,1,1,0,0,0|1,0,1]=4 3957 B17R2.3430 Cc1ccccc1CCNCc2cncs2 34a_100000685071_100015185245 [0,1,1,0,0,0|1,0,1]=4 3958 B17R2.3430 Cc1ccccc1CCNCc2cocn2 270004a_100000685071_100000050382 [0,1,1,0,0,0|1,0,0]=3 3959 B17R2.3430 Cc1ccccc1CCNCc2cscn2 207a_100000685071_100000743575 [0,1,1,0,0,0|1,0,0]=3 3960 B17R2.3430 Cc1ccccc1CCNCc2cscn2 2230a_100000685071_100000205941 [0,1,1,0,0,0|1,0,0]=3 3961 B17R2.3430 Cc1ccccc1CCNCc2cscn2 2230a_100015185402_100011713688 [0,1,1,0,0,0|1,0,0]=3 3962 B17R2.3430 Cc1ccccc1CCNCc2cscn2 270004a_100000685071_100000743575 [0,1,1,0,0,0|1,0,0]=3 3963 B17R2.3430 Cc1ccccc1CCNCc2cscn2 34a_100000685071_100000205941 [0,1,1,0,0,0|1,0,0]=3 3964 B17R2.3430 Cc1ccccc1CCNCc2csnn2 270004a_100000685071_100000738508 [0,1,1,0,0,0|2,0,0]=4 3965 B17R2.3430 Cc1ccccc1CCNCc2ncc[nH]2 207a_100000685071_100000743867 [0,1,1,0,0,0|2,0,0]=4 3966 B17R2.3430 Cc1ccccc1CCNCc2ncc[nH]2 2230a_100000685071_100016991755 [0,1,1,0,0,0|2,0,0]=4 3967 B17R2.3430 Cc1ccccc1CCNCc2ncc[nH]2 34a_100000685071_100016991755 [0,1,1,0,0,0|2,0,0]=4 3968 B17R2.3430 Cc1ccccc1CCNCc2ncco2 2230a_100000685071_103436540062 [0,1,1,0,0,0|2,0,0]=4 3969 B17R2.3430 Cc1ccccc1CCNCc2ncco2 2230a_100016994969_100011713688 [0,1,1,0,0,0|2,0,0]=4 3970 B17R2.3430 Cc1ccccc1CCNCc2ncco2 270004a_100000685071_100000064290 [0,1,1,0,0,0|2,0,0]=4 3971 B17R2.3430 Cc1ccccc1CCNCc2ncco2 34a_100000685071_103436540062 [0,1,1,0,0,0|2,0,0]=4 3972 B17R2.3430 Cc1ccccc1CCNCc2nccs2 207a_100000685071_100000750902 [0,1,1,0,0,0|2,0,0]=4 3973 B17R2.3430 Cc1ccccc1CCNCc2nccs2 2230a_100000685071_100015184050 [0,1,1,0,0,0|2,0,0]=4 3974 B17R2.3430 Cc1ccccc1CCNCc2nccs2 2230a_100000740555_100011713688 [0,1,1,0,0,0|2,0,0]=4 3975 B17R2.3430 Cc1ccccc1CCNCc2nccs2 270004a_100000685071_100000750902 [0,1,1,0,0,0|2,0,0]=4 3976 B17R2.3430 Cc1ccccc1CCNCc2nccs2 34a_100000685071_100015184050 [0,1,1,0,0,0|2,0,0]=4 3977 B17R2.3430 Cc1ccccc1CCNCc2ncon2 34a_100000685071_100000233494 [0,1,1,0,0,0|2,0,0]=4 3978 B17R2.3430 Cc1ccccc1CCNCn2cncn2 2230a_100000685071_200020645497 [0,1,1,0,0,0|1,0,1]=4 3979 B17R2.3430 Cc1ccccc1CCNCn2cncn2 34a_100000685071_200020645497 [0,1,1,0,0,0|1,0,1]=4 3980 B17R2.3430 Cc1ccccc1CCOCc2c[nH]cn2 34a_100011220023_100000707719 [0,1,1,0,0,0|1,0,0]=3 3981 B17R2.3430 Cc1ccccc1CCOCc2cscn2 34a_100011220023_100000205941 [0,1,1,0,0,0|2,0,0]=4 3982 B17R2.3430 Cc1ccccc1CCOCc2cscn2 7a_100011220023_100000205941 [0,1,1,0,0,0|2,0,0]=4 3983 B17R2.3430 Cc1ccccc1CCSCc2c[nH]cn2 62a_100000707719_100011713688 [0,1,1,0,0,0|1,0,0]=3 3984 B17R2.3430 Cc1ccccc1CCSCc2c[nH]cn2 62a_100011713688_100000707719 [0,1,1,0,0,0|1,0,0]=3 3985 B17R2.3430 Cc1ccccc1CCSCc2cscn2 62a_100000205941_100011713688 [0,1,1,0,0,0|2,0,0]=4 3986 B17R2.3430 Cc1ccccc1CCSCc2cscn2 62a_100011713688_100000205941 [0,1,1,0,0,0|2,0,0]=4 3987 B17R2.3430 Cc1ccccc1CNCCc2c[nH]cn2 270004a_100000755092_100000211143 [0,1,1,0,0,0|2,0,0]=4 3988 B17R2.3430 Cc1ccccc1COCCc2c[nH]cn2 7a_100000698903_100020628418 [0,1,1,0,0,0|2,0,0]=4 3989 B17R2.3430 Cc1ccccc1CSCCc2c[nH]cn2 62a_100000211839_100020628418 [0,1,1,0,0,0|2,0,0]=4 3990 B17R2.3430 Cc1ccccc1CSCCc2c[nH]cn2 62a_100020628418_100000211839 [0,1,1,0,0,0|2,0,0]=4 3991 B17R2.3430 Cc1cccnc1CCOCc2c[nH]cn2 34a_100011997706_100000707719 [0,1,1,0,0,0|2,0,0]=4 3992 B17R2.3430 Clc1ccccc1CCNCc2c[nH]cn2 2230a_100011207228_100000707719 [0,1,1,0,0,0|0,0,0]=2 3993 B17R2.3430 Clc1ccccc1CCNCc2c[nH]cn2 34a_100011207228_100000707719 [0,1,1,0,0,0|0,0,0]=2 3994 B17R2.3430 Clc1ccccc1CCNCc2c[nH]nn2 270004a_100020620823_200011713468 [0,1,1,0,0,0|1,0,0]=3 3995 B17R2.3430 Clc1ccccc1CCNCc2cc[nH]n2 207a_100011207228_100000738523 [0,1,1,0,0,0|2,0,0]=4 3996 B17R2.3430 Clc1ccccc1CCNCc2cc[nH]n2 270004a_100011207228_100000738523 [0,1,1,0,0,0|2,0,0]=4 3997 B17R2.3430 Clc1ccccc1CCNCc2ccco2 207a_100011207228_100000186105 [0,1,1,0,0,0|2,0,0]=4 3998 B17R2.3430 Clc1ccccc1CCNCc2ccco2 2230a_100000185738_100011713703 [0,1,1,0,0,0|2,0,0]=4 3999 B17R2.3430 Clc1ccccc1CCNCc2ccco2 270004a_100000185738_200011713468 [0,1,1,0,0,0|2,0,0]=4 4000 B17R2.3430 Clc1ccccc1CCNCc2ccco2 270004a_100011207228_100000186105 [0,1,1,0,0,0|2,0,0]=4 4001 B17R2.3430 Clc1ccccc1CCNCc2ccco2 34a_100000185738_100011713703 [0,1,1,0,0,0|2,0,0]=4 4002 B17R2.3430 Clc1ccccc1CCNCc2cccs2 207a_100011207228_100000209959 [0,1,1,0,0,0|2,0,0]=4 4003 B17R2.3430 Clc1ccccc1CCNCc2cccs2 2230a_100000211653_100011713703 [0,1,1,0,0,0|2,0,0]=4 4004 B17R2.3430 Clc1ccccc1CCNCc2cccs2 270004a_100000211653_200011713468 [0,1,1,0,0,0|2,0,0]=4 4005 B17R2.3430 Clc1ccccc1CCNCc2cccs2 270004a_100011207228_100000209959 [0,1,1,0,0,0|2,0,0]=4 4006 B17R2.3430 Clc1ccccc1CCNCc2ccoc2 207a_100011207228_100011215517 [0,1,1,0,0,0|2,0,0]=4 4007 B17R2.3430 Clc1ccccc1CCNCc2ccoc2 2230a_100015206860_100011713703 [0,1,1,0,0,0|2,0,0]=4 4008 B17R2.3430 Clc1ccccc1CCNCc2ccoc2 270004a_100011207228_100011215517 [0,1,1,0,0,0|2,0,0]=4 4009 B17R2.3430 Clc1ccccc1CCNCc2ccoc2 270004a_100015206860_200011713468 [0,1,1,0,0,0|2,0,0]=4 4010 B17R2.3430 Clc1ccccc1CCNCc2ccoc2 34a_100015206860_100011713703 [0,1,1,0,0,0|2,0,0]=4 4011 B17R2.3430 Clc1ccccc1CCNCc2ccon2 2230a_100011207228_100000234950 [0,1,1,0,0,0|2,0,0]=4 4012 B17R2.3430 Clc1ccccc1CCNCc2ccon2 270004a_100000688301_200011713468 [0,1,1,0,0,0|2,0,0]=4 4013 B17R2.3430 Clc1ccccc1CCNCc2ccon2 34a_100011207228_100000234950 [0,1,1,0,0,0|2,0,0]=4 4014 B17R2.3430 Clc1ccccc1CCNCc2ccsc2 207a_100011207228_100000188534 [0,1,1,0,0,0|2,0,0]=4 4015 B17R2.3430 Clc1ccccc1CCNCc2ccsc2 2230a_100000186416_100011713703 [0,1,1,0,0,0|2,0,0]=4 4016 B17R2.3430 Clc1ccccc1CCNCc2ccsc2 2230a_100011207228_100011261437 [0,1,1,0,0,0|2,0,0]=4 4017 B17R2.3430 Clc1ccccc1CCNCc2ccsc2 270004a_100000186416_200011713468 [0,1,1,0,0,0|2,0,0]=4 4018 B17R2.3430 Clc1ccccc1CCNCc2ccsc2 270004a_100011207228_100000188534 [0,1,1,0,0,0|2,0,0]=4 4019 B17R2.3430 Clc1ccccc1CCNCc2ccsc2 34a_100000186416_100011713703 [0,1,1,0,0,0|2,0,0]=4 4020 B17R2.3430 Clc1ccccc1CCNCc2ccsc2 34a_100011207228_100011261437 [0,1,1,0,0,0|2,0,0]=4 4021 B17R2.3430 Clc1ccccc1CCNCc2cn[nH]c2 207a_100011207228_100016992096 [0,1,1,0,0,0|2,0,0]=4 4022 B17R2.3430 Clc1ccccc1CCNCc2cn[nH]c2 270004a_100000737208_200011713468 [0,1,1,0,0,0|2,0,0]=4 4023 B17R2.3430 Clc1ccccc1CCNCc2cn[nH]c2 270004a_100011207228_100016992096 [0,1,1,0,0,0|2,0,0]=4 4024 B17R2.3430 Clc1ccccc1CCNCc2cnc[nH]2 207a_100011207228_100000742939 [0,1,1,0,0,0|0,0,2]=4 4025 B17R2.3430 Clc1ccccc1CCNCc2cnco2 270004a_100011207228_100000064291 [0,1,1,0,0,0|1,0,1]=4 4026 B17R2.3430 Clc1ccccc1CCNCc2cnco2 270004a_100020634212_200011713468 [0,1,1,0,0,0|1,0,1]=4 4027 B17R2.3430 Clc1ccccc1CCNCc2cncs2 207a_100011207228_100000749870 [0,1,1,0,0,0|1,0,1]=4 4028 B17R2.3430 Clc1ccccc1CCNCc2cncs2 2230a_100011207228_100015185245 [0,1,1,0,0,0|1,0,1]=4 4029 B17R2.3430 Clc1ccccc1CCNCc2cncs2 2230a_100016987365_100011713703 [0,1,1,0,0,0|1,0,1]=4 4030 B17R2.3430 Clc1ccccc1CCNCc2cncs2 270004a_100011207228_100000749870 [0,1,1,0,0,0|1,0,1]=4 4031 B17R2.3430 Clc1ccccc1CCNCc2cncs2 270004a_100016987365_200011713468 [0,1,1,0,0,0|1,0,1]=4 4032 B17R2.3430 Clc1ccccc1CCNCc2cncs2 34a_100011207228_100015185245 [0,1,1,0,0,0|1,0,1]=4 4033 B17R2.3430 Clc1ccccc1CCNCc2cocn2 270004a_100011207228_100000050382 [0,1,1,0,0,0|1,0,0]=3 4034 B17R2.3430 Clc1ccccc1CCNCc2cocn2 270004a_100015188801_200011713468 [0,1,1,0,0,0|1,0,0]=3 4035 B17R2.3430 Clc1ccccc1CCNCc2cscn2 207a_100011207228_100000743575 [0,1,1,0,0,0|1,0,0]=3 4036 B17R2.3430 Clc1ccccc1CCNCc2cscn2 2230a_100011207228_100000205941 [0,1,1,0,0,0|1,0,0]=3 4037 B17R2.3430 Clc1ccccc1CCNCc2cscn2 2230a_100015185402_100011713703 [0,1,1,0,0,0|1,0,0]=3 4038 B17R2.3430 Clc1ccccc1CCNCc2cscn2 270004a_100011207228_100000743575 [0,1,1,0,0,0|1,0,0]=3 4039 B17R2.3430 Clc1ccccc1CCNCc2cscn2 34a_100011207228_100000205941 [0,1,1,0,0,0|1,0,0]=3 4040 B17R2.3430 Clc1ccccc1CCNCc2csnn2 270004a_100011207228_100000738508 [0,1,1,0,0,0|2,0,0]=4 4041 B17R2.3430 Clc1ccccc1CCNCc2ncc[nH]2 207a_100011207228_100000743867 [0,1,1,0,0,0|2,0,0]=4 4042 B17R2.3430 Clc1ccccc1CCNCc2ncc[nH]2 2230a_100011207228_100016991755 [0,1,1,0,0,0|2,0,0]=4 4043 B17R2.3430 Clc1ccccc1CCNCc2ncc[nH]2 270004a_100000754540_200011713468 [0,1,1,0,0,0|2,0,0]=4 4044 B17R2.3430 Clc1ccccc1CCNCc2ncc[nH]2 34a_100011207228_100016991755 [0,1,1,0,0,0|2,0,0]=4 4045 B17R2.3430 Clc1ccccc1CCNCc2ncco2 2230a_100011207228_103436540062 [0,1,1,0,0,0|2,0,0]=4 4046 B17R2.3430 Clc1ccccc1CCNCc2ncco2 2230a_100016994969_100011713703 [0,1,1,0,0,0|2,0,0]=4 4047 B17R2.3430 Clc1ccccc1CCNCc2ncco2 270004a_100011207228_100000064290 [0,1,1,0,0,0|2,0,0]=4 4048 B17R2.3430 Clc1ccccc1CCNCc2ncco2 34a_100011207228_103436540062 [0,1,1,0,0,0|2,0,0]=4 4049 B17R2.3430 Clc1ccccc1CCNCc2nccs2 207a_100011207228_100000750902 [0,1,1,0,0,0|2,0,0]=4 4050 B17R2.3430 Clc1ccccc1CCNCc2nccs2 2230a_100000740555_100011713703 [0,1,1,0,0,0|2,0,0]=4 4051 B17R2.3430 Clc1ccccc1CCNCc2nccs2 2230a_100011207228_100015184050 [0,1,1,0,0,0|2,0,0]=4 4052 B17R2.3430 Clc1ccccc1CCNCc2nccs2 270004a_100000740555_200011713468 [0,1,1,0,0,0|2,0,0]=4 4053 B17R2.3430 Clc1ccccc1CCNCc2nccs2 270004a_100011207228_100000750902 [0,1,1,0,0,0|2,0,0]=4 4054 B17R2.3430 Clc1ccccc1CCNCc2nccs2 34a_100011207228_100015184050 [0,1,1,0,0,0|2,0,0]=4 4055 B17R2.3430 Clc1ccccc1CCNCc2ncon2 34a_100011207228_100000233494 [0,1,1,0,0,0|2,0,0]=4 4056 B17R2.3430 Clc1ccccc1CCNCn2cncn2 2230a_100011207228_200020645497 [0,1,1,0,0,0|1,0,1]=4 4057 B17R2.3430 Clc1ccccc1CCNCn2cncn2 34a_100011207228_200020645497 [0,1,1,0,0,0|1,0,1]=4 4058 B17R2.3430 Clc1ccccc1CCOCc2c[nH]cn2 34a_100011215284_100000707719 [0,1,1,0,0,0|1,0,0]=3 4059 B17R2.3430 Clc1ccccc1CCOCc2cscn2 34a_100011215284_100000205941 [0,1,1,0,0,0|2,0,0]=4 4060 B17R2.3430 Clc1ccccc1CCOCc2cscn2 7a_100011215284_100000205941 [0,1,1,0,0,0|2,0,0]=4 4061 B17R2.3430 Clc1ccccc1CCSCc2c[nH]cn2 62a_100000707719_100011713703 [0,1,1,0,0,0|1,0,0]=3 4062 B17R2.3430 Clc1ccccc1CCSCc2c[nH]cn2 62a_100011713703_100000707719 [0,1,1,0,0,0|1,0,0]=3 4063 B17R2.3430 Clc1ccccc1CCSCc2cscn2 62a_100000205941_100011713703 [0,1,1,0,0,0|2,0,0]=4 4064 B17R2.3430 Clc1ccccc1CCSCc2cscn2 62a_100011713703_100000205941 [0,1,1,0,0,0|2,0,0]=4 4065 B17R2.3430 Clc1ccccc1CNCCc2c[nH]cn2 2230a_100000174879_100020628418 [0,1,1,0,0,0|2,0,0]=4 4066 B17R2.3430 Clc1ccccc1CNCCc2c[nH]cn2 270004a_100000755092_100000210073 [0,1,1,0,0,0|2,0,0]=4 4067 B17R2.3430 Clc1ccccc1COCCc2c[nH]cn2 7a_100000210847_100020628418 [0,1,1,0,0,0|2,0,0]=4 4068 B17R2.3430 Clc1ccccc1CSCCc2c[nH]cn2 62a_100000187162_100020628418 [0,1,1,0,0,0|2,0,0]=4 4069 B17R2.3430 Clc1ccccc1CSCCc2c[nH]cn2 62a_100020628418_100000187162 [0,1,1,0,0,0|2,0,0]=4 4070 B17R2.3430 Fc1ccccc1CCNCc2c[nH]cn2 2230a_100000185272_100000707719 [0,1,1,0,0,0|0,0,0]=2 4071 B17R2.3430 Fc1ccccc1CCNCc2c[nH]cn2 34a_100000185272_100000707719 [0,1,1,0,0,0|0,0,0]=2 4072 B17R2.3430 Fc1ccccc1CCNCc2cc[nH]n2 207a_100000185272_100000738523 [0,1,1,0,0,0|2,0,0]=4 4073 B17R2.3430 Fc1ccccc1CCNCc2cc[nH]n2 270004a_100000185272_100000738523 [0,1,1,0,0,0|2,0,0]=4 4074 B17R2.3430 Fc1ccccc1CCNCc2ccco2 207a_100000185272_100000186105 [0,1,1,0,0,0|2,0,0]=4 4075 B17R2.3430 Fc1ccccc1CCNCc2ccco2 2230a_100000185738_100011713696 [0,1,1,0,0,0|2,0,0]=4 4076 B17R2.3430 Fc1ccccc1CCNCc2ccco2 270004a_100000185272_100000186105 [0,1,1,0,0,0|2,0,0]=4 4077 B17R2.3430 Fc1ccccc1CCNCc2ccco2 34a_100000185738_100000720011 [0,1,1,0,0,0|2,0,0]=4 4078 B17R2.3430 Fc1ccccc1CCNCc2cccs2 207a_100000185272_100000209959 [0,1,1,0,0,0|2,0,0]=4 4079 B17R2.3430 Fc1ccccc1CCNCc2cccs2 2230a_100000211653_100011713696 [0,1,1,0,0,0|2,0,0]=4 4080 B17R2.3430 Fc1ccccc1CCNCc2cccs2 270004a_100000185272_100000209959 [0,1,1,0,0,0|2,0,0]=4 4081 B17R2.3430 Fc1ccccc1CCNCc2ccoc2 207a_100000185272_100011215517 [0,1,1,0,0,0|2,0,0]=4 4082 B17R2.3430 Fc1ccccc1CCNCc2ccoc2 2230a_100015206860_100011713696 [0,1,1,0,0,0|2,0,0]=4 4083 B17R2.3430 Fc1ccccc1CCNCc2ccoc2 270004a_100000185272_100011215517 [0,1,1,0,0,0|2,0,0]=4 4084 B17R2.3430 Fc1ccccc1CCNCc2ccoc2 34a_100015206860_100000720011 [0,1,1,0,0,0|2,0,0]=4 4085 B17R2.3430 Fc1ccccc1CCNCc2ccon2 2230a_100000185272_100000234950 [0,1,1,0,0,0|2,0,0]=4 4086 B17R2.3430 Fc1ccccc1CCNCc2ccon2 34a_100000185272_100000234950 [0,1,1,0,0,0|2,0,0]=4 4087 B17R2.3430 Fc1ccccc1CCNCc2ccsc2 207a_100000185272_100000188534 [0,1,1,0,0,0|2,0,0]=4 4088 B17R2.3430 Fc1ccccc1CCNCc2ccsc2 2230a_100000185272_100011261437 [0,1,1,0,0,0|2,0,0]=4 4089 B17R2.3430 Fc1ccccc1CCNCc2ccsc2 2230a_100000186416_100011713696 [0,1,1,0,0,0|2,0,0]=4 4090 B17R2.3430 Fc1ccccc1CCNCc2ccsc2 270004a_100000185272_100000188534 [0,1,1,0,0,0|2,0,0]=4 4091 B17R2.3430 Fc1ccccc1CCNCc2ccsc2 34a_100000185272_100011261437 [0,1,1,0,0,0|2,0,0]=4 4092 B17R2.3430 Fc1ccccc1CCNCc2ccsc2 34a_100000186416_100000720011 [0,1,1,0,0,0|2,0,0]=4 4093 B17R2.3430 Fc1ccccc1CCNCc2cn[nH]c2 207a_100000185272_100016992096 [0,1,1,0,0,0|2,0,0]=4 4094 B17R2.3430 Fc1ccccc1CCNCc2cn[nH]c2 270004a_100000185272_100016992096 [0,1,1,0,0,0|2,0,0]=4 4095 B17R2.3430 Fc1ccccc1CCNCc2cnc[nH]2 207a_100000185272_100000742939 [0,1,1,0,0,0|0,0,2]=4 4096 B17R2.3430 Fc1ccccc1CCNCc2cnco2 270004a_100000185272_100000064291 [0,1,1,0,0,0|1,0,1]=4 4097 B17R2.3430 Fc1ccccc1CCNCc2cncs2 207a_100000185272_100000749870 [0,1,1,0,0,0|1,0,1]=4 4098 B17R2.3430 Fc1ccccc1CCNCc2cncs2 2230a_100000185272_100015185245 [0,1,1,0,0,0|1,0,1]=4 4099 B17R2.3430 Fc1ccccc1CCNCc2cncs2 2230a_100016987365_100011713696 [0,1,1,0,0,0|1,0,1]=4 4100 B17R2.3430 Fc1ccccc1CCNCc2cncs2 270004a_100000185272_100000749870 [0,1,1,0,0,0|1,0,1]=4 4101 B17R2.3430 Fc1ccccc1CCNCc2cncs2 34a_100000185272_100015185245 [0,1,1,0,0,0|1,0,1]=4 4102 B17R2.3430 Fc1ccccc1CCNCc2cocn2 270004a_100000185272_100000050382 [0,1,1,0,0,0|1,0,0]=3 4103 B17R2.3430 Fc1ccccc1CCNCc2cscn2 207a_100000185272_100000743575 [0,1,1,0,0,0|1,0,0]=3 4104 B17R2.3430 Fc1ccccc1CCNCc2cscn2 2230a_100000185272_100000205941 [0,1,1,0,0,0|1,0,0]=3 4105 B17R2.3430 Fc1ccccc1CCNCc2cscn2 2230a_100015185402_100011713696 [0,1,1,0,0,0|1,0,0]=3 4106 B17R2.3430 Fc1ccccc1CCNCc2cscn2 270004a_100000185272_100000743575 [0,1,1,0,0,0|1,0,0]=3 4107 B17R2.3430 Fc1ccccc1CCNCc2cscn2 34a_100000185272_100000205941 [0,1,1,0,0,0|1,0,0]=3 4108 B17R2.3430 Fc1ccccc1CCNCc2csnn2 270004a_100000185272_100000738508 [0,1,1,0,0,0|2,0,0]=4 4109 B17R2.3430 Fc1ccccc1CCNCc2ncc[nH]2 207a_100000185272_100000743867 [0,1,1,0,0,0|2,0,0]=4 4110 B17R2.3430 Fc1ccccc1CCNCc2ncc[nH]2 2230a_100000185272_100016991755 [0,1,1,0,0,0|2,0,0]=4 4111 B17R2.3430 Fc1ccccc1CCNCc2ncc[nH]2 34a_100000185272_100016991755 [0,1,1,0,0,0|2,0,0]=4 4112 B17R2.3430 Fc1ccccc1CCNCc2ncco2 2230a_100000185272_103436540062 [0,1,1,0,0,0|2,0,0]=4 4113 B17R2.3430 Fc1ccccc1CCNCc2ncco2 2230a_100016994969_100011713696 [0,1,1,0,0,0|2,0,0]=4 4114 B17R2.3430 Fc1ccccc1CCNCc2ncco2 270004a_100000185272_100000064290 [0,1,1,0,0,0|2,0,0]=4 4115 B17R2.3430 Fc1ccccc1CCNCc2ncco2 34a_100000185272_103436540062 [0,1,1,0,0,0|2,0,0]=4 4116 B17R2.3430 Fc1ccccc1CCNCc2nccs2 207a_100000185272_100000750902 [0,1,1,0,0,0|2,0,0]=4 4117 B17R2.3430 Fc1ccccc1CCNCc2nccs2 2230a_100000185272_100015184050 [0,1,1,0,0,0|2,0,0]=4 4118 B17R2.3430 Fc1ccccc1CCNCc2nccs2 2230a_100000740555_100011713696 [0,1,1,0,0,0|2,0,0]=4 4119 B17R2.3430 Fc1ccccc1CCNCc2nccs2 270004a_100000185272_100000750902 [0,1,1,0,0,0|2,0,0]=4 4120 B17R2.3430 Fc1ccccc1CCNCc2nccs2 34a_100000185272_100015184050 [0,1,1,0,0,0|2,0,0]=4 4121 B17R2.3430 Fc1ccccc1CCNCc2ncon2 34a_100000185272_100000233494 [0,1,1,0,0,0|2,0,0]=4 4122 B17R2.3430 Fc1ccccc1CCNCn2cncn2 2230a_100000185272_200020645497 [0,1,1,0,0,0|1,0,1]=4 4123 B17R2.3430 Fc1ccccc1CCNCn2cncn2 34a_100000185272_200020645497 [0,1,1,0,0,0|1,0,1]=4 4124 B17R2.3430 Fc1ccccc1CCOCc2c[nH]cn2 34a_100000753711_100000707719 [0,1,1,0,0,0|1,0,0]=3 4125 B17R2.3430 Fc1ccccc1CCOCc2cscn2 34a_100000753711_100000205941 [0,1,1,0,0,0|2,0,0]=4 4126 B17R2.3430 Fc1ccccc1CCOCc2cscn2 7a_100000753711_100000205941 [0,1,1,0,0,0|2,0,0]=4 4127 B17R2.3430 Fc1ccccc1CCSCc2c[nH]cn2 62a_100000707719_100011713696 [0,1,1,0,0,0|1,0,0]=3 4128 B17R2.3430 Fc1ccccc1CCSCc2c[nH]cn2 62a_100011713696_100000707719 [0,1,1,0,0,0|1,0,0]=3 4129 B17R2.3430 Fc1ccccc1CCSCc2cscn2 62a_100000205941_100011713696 [0,1,1,0,0,0|2,0,0]=4 4130 B17R2.3430 Fc1ccccc1CCSCc2cscn2 62a_100011713696_100000205941 [0,1,1,0,0,0|2,0,0]=4 4131 B17R2.3430 Fc1ccccc1CNCCc2c[nH]cn2 270004a_100000755092_100000210811 [0,1,1,0,0,0|2,0,0]=4 4132 B17R2.3430 Fc1ccccc1COCCc2c[nH]cn2 7a_100000211962_100020628418 [0,1,1,0,0,0|2,0,0]=4 4133 B17R2.3430 Fc1ccccc1CSCCc2c[nH]cn2 62a_100000211605_100020628418 [0,1,1,0,0,0|2,0,0]=4 4134 B17R2.3430 Fc1ccccc1CSCCc2c[nH]cn2 62a_100020628418_100000211605 [0,1,1,0,0,0|2,0,0]=4 4135 B17R2.3430 Ic1ccccc1CCOCc2c[nH]cn2 34a_100010255290_100000707719 [0,1,1,0,0,0|1,0,0]=3 4136 B17R2.3430 Ic1ccccc1CCOCc2cscn2 34a_100010255290_100000205941 [0,1,1,0,0,0|2,0,0]=4 4137 B17R2.3430 Ic1ccccc1CCOCc2cscn2 7a_100010255290_100000205941 [0,1,1,0,0,0|2,0,0]=4 4138 B17R2.3430 Ic1ccccc1CNCCc2c[nH]cn2 270004a_100000755092_100000010305 [0,1,1,0,0,0|2,0,0]=4 4139 B17R2.3430 Ic1ccccc1COCCc2c[nH]cn2 7a_100000187465_100020628418 [0,1,1,0,0,0|2,0,0]=4 4140 B17R2.3430 Ic1ccccc1CSCCc2c[nH]cn2 62a_100011216222_100020628418 [0,1,1,0,0,0|2,0,0]=4 4141 B17R2.3430 Ic1ccccc1CSCCc2c[nH]cn2 62a_100020628418_100011216222 [0,1,1,0,0,0|2,0,0]=4 4142 B17R2.3430 Nc1ccccc1CCOCc2c[nH]cn2 34a_100011215289_100000707719 [0,1,1,0,0,0|1,0,0]=3 4143 B17R2.3430 Nc1ccccc1CCOCc2cscn2 34a_100011215289_100000205941 [0,1,1,0,0,0|2,0,0]=4 4144 B17R2.3430 O=c1ccccn1CCNCc2c[nH]cn2 2230a_100000687133_100000707719 [0,1,1,0,0,0|1,0,0]=3 4145 B17R2.3430 O=c1ccccn1CCNCc2cscn2 207a_100000687133_100000743575 [0,1,1,0,0,0|2,0,0]=4 4146 B17R2.3430 O=c1ccccn1CCNCc2cscn2 2230a_100000687133_100000205941 [0,1,1,0,0,0|2,0,0]=4 4147 B17R2.3430 Oc1ccccc1CCNCc2c[nH]cn2 34a_100011207237_100000707719 [0,1,1,0,0,0|0,0,0]=2 4148 B17R2.3430 Oc1ccccc1CCNCc2cc[nH]n2 207a_100011207237_100000738523 [0,1,1,0,0,0|2,0,0]=4 4149 B17R2.3430 Oc1ccccc1CCNCc2cc[nH]n2 270004a_100011207237_100000738523 [0,1,1,0,0,0|2,0,0]=4 4150 B17R2.3430 Oc1ccccc1CCNCc2ccco2 207a_100011207237_100000186105 [0,1,1,0,0,0|2,0,0]=4 4151 B17R2.3430 Oc1ccccc1CCNCc2ccco2 270004a_100011207237_100000186105 [0,1,1,0,0,0|2,0,0]=4 4152 B17R2.3430 Oc1ccccc1CCNCc2ccco2 34a_100000185738_100000722297 [0,1,1,0,0,0|2,0,0]=4 4153 B17R2.3430 Oc1ccccc1CCNCc2cccs2 207a_100011207237_100000209959 [0,1,1,0,0,0|2,0,0]=4 4154 B17R2.3430 Oc1ccccc1CCNCc2cccs2 270004a_100011207237_100000209959 [0,1,1,0,0,0|2,0,0]=4 4155 B17R2.3430 Oc1ccccc1CCNCc2ccoc2 207a_100011207237_100011215517 [0,1,1,0,0,0|2,0,0]=4 4156 B17R2.3430 Oc1ccccc1CCNCc2ccoc2 270004a_100011207237_100011215517 [0,1,1,0,0,0|2,0,0]=4 4157 B17R2.3430 Oc1ccccc1CCNCc2ccoc2 34a_100015206860_100000722297 [0,1,1,0,0,0|2,0,0]=4 4158 B17R2.3430 Oc1ccccc1CCNCc2ccon2 34a_100011207237_100000234950 [0,1,1,0,0,0|2,0,0]=4 4159 B17R2.3430 Oc1ccccc1CCNCc2ccsc2 207a_100011207237_100000188534 [0,1,1,0,0,0|2,0,0]=4 4160 B17R2.3430 Oc1ccccc1CCNCc2ccsc2 270004a_100011207237_100000188534 [0,1,1,0,0,0|2,0,0]=4 4161 B17R2.3430 Oc1ccccc1CCNCc2ccsc2 34a_100000186416_100000722297 [0,1,1,0,0,0|2,0,0]=4 4162 B17R2.3430 Oc1ccccc1CCNCc2ccsc2 34a_100011207237_100011261437 [0,1,1,0,0,0|2,0,0]=4 4163 B17R2.3430 Oc1ccccc1CCNCc2cn[nH]c2 207a_100011207237_100016992096 [0,1,1,0,0,0|2,0,0]=4 4164 B17R2.3430 Oc1ccccc1CCNCc2cn[nH]c2 270004a_100011207237_100016992096 [0,1,1,0,0,0|2,0,0]=4 4165 B17R2.3430 Oc1ccccc1CCNCc2cnc[nH]2 207a_100011207237_100000742939 [0,1,1,0,0,0|0,0,2]=4 4166 B17R2.3430 Oc1ccccc1CCNCc2cnco2 270004a_100011207237_100000064291 [0,1,1,0,0,0|1,0,1]=4 4167 B17R2.3430 Oc1ccccc1CCNCc2cncs2 207a_100011207237_100000749870 [0,1,1,0,0,0|1,0,1]=4 4168 B17R2.3430 Oc1ccccc1CCNCc2cncs2 270004a_100011207237_100000749870 [0,1,1,0,0,0|1,0,1]=4 4169 B17R2.3430 Oc1ccccc1CCNCc2cncs2 34a_100011207237_100015185245 [0,1,1,0,0,0|1,0,1]=4 4170 B17R2.3430 Oc1ccccc1CCNCc2cocn2 270004a_100011207237_100000050382 [0,1,1,0,0,0|1,0,0]=3 4171 B17R2.3430 Oc1ccccc1CCNCc2cscn2 207a_100011207237_100000743575 [0,1,1,0,0,0|1,0,0]=3 4172 B17R2.3430 Oc1ccccc1CCNCc2cscn2 270004a_100011207237_100000743575 [0,1,1,0,0,0|1,0,0]=3 4173 B17R2.3430 Oc1ccccc1CCNCc2cscn2 34a_100011207237_100000205941 [0,1,1,0,0,0|1,0,0]=3 4174 B17R2.3430 Oc1ccccc1CCNCc2csnn2 270004a_100011207237_100000738508 [0,1,1,0,0,0|2,0,0]=4 4175 B17R2.3430 Oc1ccccc1CCNCc2ncc[nH]2 207a_100011207237_100000743867 [0,1,1,0,0,0|2,0,0]=4 4176 B17R2.3430 Oc1ccccc1CCNCc2ncc[nH]2 34a_100011207237_100016991755 [0,1,1,0,0,0|2,0,0]=4 4177 B17R2.3430 Oc1ccccc1CCNCc2ncco2 270004a_100011207237_100000064290 [0,1,1,0,0,0|2,0,0]=4 4178 B17R2.3430 Oc1ccccc1CCNCc2ncco2 34a_100011207237_103436540062 [0,1,1,0,0,0|2,0,0]=4 4179 B17R2.3430 Oc1ccccc1CCNCc2nccs2 207a_100011207237_100000750902 [0,1,1,0,0,0|2,0,0]=4 4180 B17R2.3430 Oc1ccccc1CCNCc2nccs2 270004a_100011207237_100000750902 [0,1,1,0,0,0|2,0,0]=4 4181 B17R2.3430 Oc1ccccc1CCNCc2nccs2 34a_100011207237_100015184050 [0,1,1,0,0,0|2,0,0]=4 4182 B17R2.3430 Oc1ccccc1CCNCc2ncon2 34a_100011207237_100000233494 [0,1,1,0,0,0|2,0,0]=4 4183 B17R2.3430 Oc1ccccc1CCNCn2cncn2 34a_100011207237_200020645497 [0,1,1,0,0,0|1,0,1]=4 4184 B17R2.3430 Oc1ccccc1CCSCc2c[nH]cn2 62a_100000707719_100000722297 [0,1,1,0,0,0|1,0,0]=3 4185 B17R2.3430 Oc1ccccc1CCSCc2c[nH]cn2 62a_100000722297_100000707719 [0,1,1,0,0,0|1,0,0]=3 4186 B17R2.3430 Oc1ccccc1CCSCc2cscn2 62a_100000205941_100000722297 [0,1,1,0,0,0|2,0,0]=4 4187 B17R2.3430 Oc1ccccc1CCSCc2cscn2 62a_100000722297_100000205941 [0,1,1,0,0,0|2,0,0]=4 4188 B17R2.3513 Brc1ccoc1CNCCc2ccccc2 270004a_100000106460_100000756499 [0,1,1,0,0,0|2,0,0]=4 4189 B17R2.3513 Brc1ccsc1CNCCc2ccccc2 207a_100000106460_100000766043 [0,1,1,0,0,0|2,0,0]=4 4190 B17R2.3513 Brc1ccsc1CNCCc2ccccc2 270004a_100000106460_100000766043 [0,1,1,0,0,0|2,0,0]=4 4191 B17R2.3513 Brc1cscc1CNCCc2ccccc2 207a_100000106460_100000685484 [0,1,1,0,0,0|2,0,0]=4 4192 B17R2.3513 Brc1cscc1CNCCc2ccccc2 270004a_100000106460_100000685484 [0,1,1,0,0,0|2,0,0]=4 4193 B17R2.3513 Brc1sccc1CNCCc2ccccc2 207a_100000106460_100009816921 [0,1,1,0,0,0|2,0,0]=4 4194 B17R2.3513 Brc1sccc1CNCCc2ccccc2 2230a_100000106460_100009814289 [0,1,1,0,0,0|2,0,0]=4 4195 B17R2.3513 Brc1sccc1CNCCc2ccccc2 2230a_100000727803_100000765856 [0,1,1,0,0,0|2,0,0]=4 4196 B17R2.3513 Brc1sccc1CNCCc2ccccc2 270004a_100000106460_100009816921 [0,1,1,0,0,0|2,0,0]=4 4197 B17R2.3513 Brc1sccc1CNCCc2ccccc2 34a_100000106460_100009814289 [0,1,1,0,0,0|2,0,0]=4 4198 B17R2.3513 Brc1sccc1CNCCc2ccccc2 34a_100000727803_100000765856 [0,1,1,0,0,0|2,0,0]=4 4199 B17R2.3513 Cc1[nH]cnc1CNCCc2ccccc2 207a_100000106460_100000032982 [0,1,1,0,0,0|0,0,0]=2 4200 B17R2.3513 Cc1[nH]cnc1CNCCc2ccccc2 2230a_100000106460_100000751220 [0,1,1,0,0,0|0,0,0]=2 4201 B17R2.3513 Cc1[nH]cnc1CNCCc2ccccn2 207a_100000211156_100000032982 [0,1,1,0,0,0|1,0,0]=3 4202 B17R2.3513 Cc1[nH]cnc1CNCCc2cccnc2 207a_100000736294_100000032982 [0,1,1,0,0,0|1,0,0]=3 4203 B17R2.3513 Cc1[nH]cnc1CNCCc2cccnc2 2230a_100000736294_100000751220 [0,1,1,0,0,0|1,0,0]=3 4204 B17R2.3513 Cc1[nH]cnc1CNCCc2ccncc2 207a_100000742849_100000032982 [0,1,1,0,0,0|1,0,0]=3 4205 B17R2.3513 Cc1[nH]cnc1CNCCc2cnccn2 207a_100000723456_100000032982 [0,1,1,0,0,0|2,0,0]=4 4206 B17R2.3513 Cc1[nH]cnc1CSCCc2ccccc2 62a_100000751220_100011218657 [0,1,1,0,0,0|1,0,0]=3 4207 B17R2.3513 Cc1[nH]cnc1CSCCc2ccccc2 62a_100000765856_100000751220 [0,1,1,0,0,0|1,0,0]=3 4208 B17R2.3513 Cc1[nH]cnc1CSCCc2ccccn2 62a_100000751220_100015183660 [0,1,1,0,0,0|2,0,0]=4 4209 B17R2.3513 Cc1[nH]cnc1CSCCc2ccccn2 62a_100015183660_100000751220 [0,1,1,0,0,0|2,0,0]=4 4210 B17R2.3513 Cc1[nH]cnc1CSCCc2cccnc2 62a_100000751220_200011713674 [0,1,1,0,0,0|2,0,0]=4 4211 B17R2.3513 Cc1[nH]cnc1CSCCc2cccnc2 62a_200011713674_100000751220 [0,1,1,0,0,0|2,0,0]=4 4212 B17R2.3513 Cc1[nH]cnc1CSCCc2ccncc2 62a_100000723409_100000751220 [0,1,1,0,0,0|2,0,0]=4 4213 B17R2.3513 Cc1[nH]cnc1CSCCc2ccncc2 62a_100000751220_100000723409 [0,1,1,0,0,0|2,0,0]=4 4214 B17R2.3513 Cc1[nH]cnc1CSCSc2ccccc2 62a_100000751220_100011218342 [0,1,1,0,0,0|2,0,0]=4 4215 B17R2.3513 Cc1[nH]cnc1CSCSc2ccccc2 62a_100011218342_100000751220 [0,1,1,0,0,0|2,0,0]=4 4216 B17R2.3513 Cc1[nH]cnc1SCCCc2ccccc2 62a_100000211621_100010186451 [0,1,1,0,0,0|2,0,0]=4 4217 B17R2.3513 Cc1[nH]cnc1SCCCc2ccccc2 62a_100010186451_100000211621 [0,1,1,0,0,0|2,0,0]=4 4218 B17R2.3513 Cc1ccoc1CNCCc2ccccc2 207a_100000106460_100000763527 [0,1,1,0,0,0|2,0,0]=4 4219 B17R2.3513 Cc1ccoc1CNCCc2ccccc2 270004a_100000106460_100000763527 [0,1,1,0,0,0|2,0,0]=4 4220 B17R2.3513 Cc1ccsc1CNCCc2ccccc2 207a_100000106460_100000210881 [0,1,1,0,0,0|2,0,0]=4 4221 B17R2.3513 Cc1ccsc1CNCCc2ccccc2 2230a_100000238519_100000765856 [0,1,1,0,0,0|2,0,0]=4 4222 B17R2.3513 Cc1ccsc1CNCCc2ccccc2 270004a_100000106460_100000210881 [0,1,1,0,0,0|2,0,0]=4 4223 B17R2.3513 Cc1ccsc1CNCCc2ccccc2 34a_100000238519_100000765856 [0,1,1,0,0,0|2,0,0]=4 4224 B17R2.3513 Cc1n[nH]cc1CNCCc2ccccc2 207a_100000106460_100000737037 [0,1,1,0,0,0|2,0,0]=4 4225 B17R2.3513 Cc1ncsc1CNCCc2ccccc2 207a_100000106460_100000764165 [0,1,1,0,0,0|1,0,1]=4 4226 B17R2.3513 Cc1ncsc1CNCCc2ccccc2 2230a_100000752186_100000765856 [0,1,1,0,0,0|1,0,1]=4 4227 B17R2.3513 Cc1nonc1CNCCc2ccccc2 2230a_100000106460_200000044682 [0,1,1,0,0,0|1,0,1]=4 4228 B17R2.3513 Cc1nonc1CNCCc2ccccc2 34a_100000106460_200000044682 [0,1,1,0,0,0|1,0,1]=4 4229 B17R2.3513 Cc1ocnc1CNCCc2ccccc2 2230a_100000106460_200000693990 [0,1,1,0,0,0|1,0,0]=3 4230 B17R2.3513 Cc1ocnc1CNCCc2ccccc2 34a_100000106460_200000693990 [0,1,1,0,0,0|1,0,0]=3 4231 B17R2.3513 Cc1ocnc1CNCCc2cccnc2 2230a_100000736294_200000693990 [0,1,1,0,0,0|2,0,0]=4 4232 B17R2.3513 Cc1ocnc1COCCc2ccccc2 34a_100000210268_200000693990 [0,1,1,0,0,0|2,0,0]=4 4233 B17R2.3513 Cc1ocnc1COCCc2ccccc2 34a_100012017639_100000765856 [0,1,1,0,0,0|2,0,0]=4 4234 B17R2.3513 Cc1ocnc1COCCc2ccccc2 7a_100000210268_200000693990 [0,1,1,0,0,0|2,0,0]=4 4235 B17R2.3513 Cc1ocnc1CSCCc2ccccc2 62a_100000765856_200000693990 [0,1,1,0,0,0|2,0,0]=4 4236 B17R2.3513 Cc1ocnc1CSCCc2ccccc2 62a_200000693990_100011218657 [0,1,1,0,0,0|2,0,0]=4 4237 B17R2.3513 Clc1c[nH]nc1CNCCc2ccccc2 207a_100000106460_100000040271 [0,1,1,0,0,0|2,0,0]=4 4238 B17R2.3513 Clc1c[nH]nc1CNCCc2ccccc2 270004a_100000106460_100000040271 [0,1,1,0,0,0|2,0,0]=4 4239 B17R2.3513 Clc1ccsc1CNCCc2ccccc2 207a_100000106460_100000722334 [0,1,1,0,0,0|2,0,0]=4 4240 B17R2.3513 Clc1ccsc1CNCCc2ccccc2 2230a_100011934584_100000765856 [0,1,1,0,0,0|2,0,0]=4 4241 B17R2.3513 Clc1ccsc1CNCCc2ccccc2 270004a_100000106460_100000722334 [0,1,1,0,0,0|2,0,0]=4 4242 B17R2.3513 Clc1ccsc1CNCCc2ccccc2 34a_100011934584_100000765856 [0,1,1,0,0,0|2,0,0]=4 4243 B17R2.3513 Clc1sccc1CNCCc2ccccc2 207a_100000106460_100000089901 [0,1,1,0,0,0|2,0,0]=4 4244 B17R2.3513 Clc1sccc1CNCCc2ccccc2 2230a_100000106460_100010167017 [0,1,1,0,0,0|2,0,0]=4 4245 B17R2.3513 Clc1sccc1CNCCc2ccccc2 270004a_100000106460_100000089901 [0,1,1,0,0,0|2,0,0]=4 4246 B17R2.3513 Clc1sccc1CNCCc2ccccc2 34a_100000106460_100010167017 [0,1,1,0,0,0|2,0,0]=4 4247 B17R2.3513 Clc1snnc1CNCCc2ccccc2 2230a_100000106460_100000018852 [0,1,1,0,0,0|2,0,0]=4 4248 B17R2.3513 Cn1cccc1CNCCc2ccccc2 270004a_100000106460_100000211633 [0,1,1,0,0,0|1,0,1]=4 4249 B17R2.3513 Cn1cccc1CNCCc2ccccc2 34a_100011219357_100000765856 [0,1,1,0,0,0|1,0,1]=4 4250 B17R2.3513 Cn1ccnc1CNCCc2ccccc2 207a_100000106460_100000748660 [0,1,1,0,0,0|2,0,0]=4 4251 B17R2.3513 Cn1ccnc1CNCCc2ccccc2 2230a_100000106460_100000700302 [0,1,1,0,0,0|2,0,0]=4 4252 B17R2.3513 Cn1ccnc1CNCCc2ccccc2 2230a_100015186572_100000765856 [0,1,1,0,0,0|2,0,0]=4 4253 B17R2.3513 Cn1ccnc1CNCCc2ccccc2 270004a_100000106460_100000748660 [0,1,1,0,0,0|2,0,0]=4 4254 B17R2.3513 Cn1ccnc1CNCCc2ccccc2 34a_100000106460_100000700302 [0,1,1,0,0,0|2,0,0]=4 4255 B17R2.3513 Cn1cncc1CNCCc2ccccc2 207a_100000106460_100000750899 [0,1,1,0,0,0|0,0,2]=4 4256 B17R2.3513 Cn1cncc1CNCCc2ccccc2 270004a_100000106460_100000750899 [0,1,1,0,0,0|0,0,2]=4 4257 B17R2.5714 CC(NCCc1ccccc1)c2cc[nH]c2 269862a_100000106460_100000753940 [0,1,1,0,0,0|1,0,0]=3 4258 B17R2.5714 CC(NCCc1ccccc1)c2ccc[nH]2 269862a_100000106460_100000183661 [0,1,1,0,0,0|1,0,1]=4 4259 B17R2.5714 CC(NCCc1ccccc1)c2cccs2 2230a_100000703493_100000765856 [0,1,1,0,0,0|2,0,0]=4 4260 B17R2.5714 CC(NCCc1ccccc1)c2cccs2 269862a_100000106460_100000185736 [0,1,1,0,0,0|2,0,0]=4 4261 B17R2.5714 CC(NCCc1ccccc1)c2ccoc2 2230a_100000690049_100000765856 [0,1,1,0,0,0|2,0,0]=4 4262 B17R2.5714 CC(NCCc1ccccc1)c2ccsc2 2230a_100000748604_100000765856 [0,1,1,0,0,0|2,0,0]=4 4263 B17R2.5714 CC(NCCc1ccccc1)c2ccsc2 269862a_100000106460_100000747891 [0,1,1,0,0,0|2,0,0]=4 4264 B17R2.5714 CC(NCCc1ccccc1)c2cn[nH]c2 269862a_100000106460_100000725364 [0,1,1,0,0,0|2,0,0]=4 4265 B17R2.5714 CC(NCCc1ccccc1)c2cscn2 269862a_100000106460_100000693406 [0,1,1,0,0,0|1,0,0]=3 4266 B17R2.5714 CC(NCCc1ccccc1)c2ncc[nH]2 269862a_100000106460_100000718901 [0,1,1,0,0,0|2,0,0]=4 4267 B17R2.5714 CC(NCCc1ccccc1)c2nccs2 2230a_100000725601_100000765856 [0,1,1,0,0,0|2,0,0]=4 4268 B17R2.5714 CC(NCCc1ccccn1)c2cc[nH]c2 269862a_100000211156_100000753940 [0,1,1,0,0,0|2,0,0]=4 4269 B17R2.5714 CC(NCCc1ccccn1)c2cscn2 269862a_100000211156_100000693406 [0,1,1,0,0,0|2,0,0]=4 4270 B17R2.5714 CC(NCCc1cccnc1)c2cc[nH]c2 269862a_100000736294_100000753940 [0,1,1,0,0,0|2,0,0]=4 4271 B17R2.5714 CC(NCCc1cccnc1)c2cscn2 269862a_100000736294_100000693406 [0,1,1,0,0,0|2,0,0]=4 4272 B17R2.5714 CC(NCCc1ccncc1)c2cc[nH]c2 269862a_100000742849_100000753940 [0,1,1,0,0,0|2,0,0]=4 4273 B17R2.5714 CC(NCCc1ccncc1)c2cscn2 269862a_100000742849_100000693406 [0,1,1,0,0,0|2,0,0]=4 4274 B17R2.5714 C[C@@H](NCCc1ccccc1)c2ccco2 2230a_100160469435_100000765856 [0,1,1,0,0,0|2,0,0]=4 4275 B17R2.8341 CC(C[n+]1ccccc1)NCc2c[nH]nn2 270004a_100020620823_100000034229 [0,1,1,0,0,0|2,0,0]=4 4276 B17R2.8341 CC(C[n+]1ccccc1)NCc2cocn2 270004a_100015188801_100000034229 [0,1,1,0,0,0|2,0,0]=4 4277 B17R2.8341 CC(Cc1ccccc1)NCc2ccco2 34a_100000185738_200011218536 [0,1,1,0,0,0|2,0,0]=4 4278 B17R2.8341 CC(Cc1ccccc1)NCc2ccoc2 34a_100015206860_200011218536 [0,1,1,0,0,0|2,0,0]=4 4279 B17R2.8341 CC(Cc1ccccc1)NCc2ccsc2 34a_100000186416_200011218536 [0,1,1,0,0,0|2,0,0]=4 4280 B17R2.8341 CC(Cc1ccccc1)OCc2c[nH]cn2 34a_100000748627_100000707719 [0,1,1,0,0,0|1,0,0]=3 4281 B17R2.8341 CC(Cc1ccccc1)OCc2cscn2 34a_100000748627_100000205941 [0,1,1,0,0,0|2,0,0]=4 4282 B17R2.8341 CC(Cc1ccccc1)OCc2cscn2 7a_100000748627_100000205941 [0,1,1,0,0,0|2,0,0]=4 4283 B17R2.8341 CC(Cc1ccccc1)SCc2c[nH]cn2 62a_100000707719_200011218536 [0,1,1,0,0,0|1,0,0]=3 4284 B17R2.8341 CC(Cc1ccccc1)SCc2c[nH]cn2 62a_200011218536_100000707719 [0,1,1,0,0,0|1,0,0]=3 4285 B17R2.8341 CC(Cc1ccccc1)SCc2cscn2 62a_100000205941_200011218536 [0,1,1,0,0,0|2,0,0]=4 4286 B17R2.8341 CC(Cc1ccccc1)SCc2cscn2 62a_200011218536_100000205941 [0,1,1,0,0,0|2,0,0]=4 4287 B17R2.8341 CC(Cc1ccccn1)NCc2c[nH]cn2 2230a_100000238496_100000707719 [0,1,1,0,0,0|1,0,0]=3 4288 B17R2.8341 CC(Cc1ccccn1)NCc2cocn2 270004a_100000238496_100000050382 [0,1,1,0,0,0|2,0,0]=4 4289 B17R2.8341 CC(Cc1ccccn1)NCc2cscn2 207a_100000238496_100000743575 [0,1,1,0,0,0|2,0,0]=4 4290 B17R2.8341 CC(Cc1ccccn1)NCc2cscn2 2230a_100000238496_100000205941 [0,1,1,0,0,0|2,0,0]=4 4291 B17R2.8341 CC(Cc1ccccn1)NCc2cscn2 270004a_100000238496_100000743575 [0,1,1,0,0,0|2,0,0]=4 4292 B17R2.8341 CC(Cc1cccnc1)NCc2c[nH]cn2 2230a_100011207255_100000707719 [0,1,1,0,0,0|1,0,0]=3 4293 B17R2.8341 CC(Cc1cccnc1)NCc2c[nH]nn2 270004a_100020620823_100015187140 [0,1,1,0,0,0|2,0,0]=4 4294 B17R2.8341 CC(Cc1cccnc1)NCc2cocn2 270004a_100011207255_100000050382 [0,1,1,0,0,0|2,0,0]=4 4295 B17R2.8341 CC(Cc1cccnc1)NCc2cocn2 270004a_100015188801_100015187140 [0,1,1,0,0,0|2,0,0]=4 4296 B17R2.8341 CC(Cc1cccnc1)NCc2cscn2 207a_100011207255_100000743575 [0,1,1,0,0,0|2,0,0]=4 4297 B17R2.8341 CC(Cc1cccnc1)NCc2cscn2 2230a_100011207255_100000205941 [0,1,1,0,0,0|2,0,0]=4 4298 B17R2.8341 CC(Cc1cccnc1)NCc2cscn2 270004a_100011207255_100000743575 [0,1,1,0,0,0|2,0,0]=4 4299 B17R2.8341 CC(Cc1ccncc1)NCc2c[nH]nn2 270004a_100020620823_100000238508 [0,1,1,0,0,0|2,0,0]=4 4300 B17R2.8341 CC(Cc1ccncc1)NCc2cocn2 270004a_100015188801_100000238508 [0,1,1,0,0,0|2,0,0]=4 4301 B17R2.8341 CC(Cc1cnccn1)NCc2c[nH]cn2 2230a_100011277835_100000707719 [0,1,1,0,0,0|2,0,0]=4 4302 B17R2.8341 CN(CCc1c[nH]cn1)Cc2ccccc2 2230a_100000186898_100020628418 [0,1,1,0,0,0|2,0,0]=4 4303 B17R2.8341 CN(CCc1c[nH]cn1)Cc2ccccc2 269982a_100000186898_100020628418 [0,1,1,0,0,0|2,0,0]=4 4304 B17R2.8341 O=C(C[n+]1ccccc1)NCc2c[nH]cn2 11a_100000758547_200000086051 [0,1,1,0,0,0|1,0,1]=4 4305 B17R2.8341 O=C(C[n+]1ccccc1)NCc2c[nH]cn2 240690a_100000758547_200000086051 [0,1,1,0,0,0|1,0,1]=4 4306 B17R2.8341 O=C(C[n+]1ccccc1)NCc2c[nH]cn2 527a_100000758547_200000086051 [0,1,1,0,0,0|1,0,1]=4 4307 B17R2.8341 O=C(Cc1ccccn1)NCc2c[nH]cn2 11a_100000758547_100000233486 [0,1,1,0,0,0|1,0,1]=4 4308 B17R2.8341 O=C(Cc1cccnc1)NCc2c[nH]cn2 11a_100000758547_100000737805 [0,1,1,0,0,0|1,0,1]=4 4309 B17R2.8341 O=C(Cc1cccnc1)NCc2c[nH]cn2 240690a_100000758547_100000737805 [0,1,1,0,0,0|1,0,1]=4 4310 B17R2.8341 O=C(Cc1cccnc1)NCc2c[nH]cn2 527a_100000758547_100000737805 [0,1,1,0,0,0|1,0,1]=4 4311 B17R2.8341 O=C(Cc1ccncc1)NCc2c[nH]cn2 11a_100000758547_100011201483 [0,1,1,0,0,0|1,0,1]=4 4312 B17R2.8341 O=C(Cc1ccncc1)NCc2c[nH]cn2 240690a_100000758547_100011201483 [0,1,1,0,0,0|1,0,1]=4 4313 B17R2.8341 O=C(NCc1c[nH]cn1)Nc2ccccc2 2430a_100000106764_100000758547 [0,1,1,0,0,0|1,0,1]=4 4314 B17R2.8341 O[C@H](CSc1c[nH]cn1)Cc2ccccc2 62a_100000729385_100000756875 [0,1,1,0,0,0|2,0,0]=4 4315 B17R2.8341 O[C@H](CSc1c[nH]cn1)Cc2ccccc2 62a_100000756875_100000729385 [0,1,1,0,0,0|2,0,0]=4 4316 B17R2.8343 CN(CCc1ccccc1)Cc2c[nH]cn2 2230a_100000207497_100000707719 [0,1,1,0,0,0|0,0,0]=2 4317 B17R2.8343 CN(CCc1ccccc1)Cc2c[nH]cn2 269982a_100000207497_100000707719 [0,1,1,0,0,0|0,0,0]=2 4318 B17R2.8343 CN(CCc1ccccc1)Cc2cc[nH]n2 270004a_100000207497_100000738523 [0,1,1,0,0,0|2,0,0]=4 4319 B17R2.8343 CN(CCc1ccccc1)Cc2ccco2 2230a_100000185268_100000765856 [0,1,1,0,0,0|2,0,0]=4 4320 B17R2.8343 CN(CCc1ccccc1)Cc2ccco2 2230a_100015184001_200000210301 [0,1,1,0,0,0|2,0,0]=4 4321 B17R2.8343 CN(CCc1ccccc1)Cc2ccco2 269982a_100000185268_100000765856 [0,1,1,0,0,0|2,0,0]=4 4322 B17R2.8343 CN(CCc1ccccc1)Cc2ccco2 269982a_100015184001_200000210301 [0,1,1,0,0,0|2,0,0]=4 4323 B17R2.8343 CN(CCc1ccccc1)Cc2ccco2 270004a_100000207497_100000186105 [0,1,1,0,0,0|2,0,0]=4 4324 B17R2.8343 CN(CCc1ccccc1)Cc2ccco2 34a_100015184001_200000210301 [0,1,1,0,0,0|2,0,0]=4 4325 B17R2.8343 CN(CCc1ccccc1)Cc2cccs2 2230a_100000184426_100000765856 [0,1,1,0,0,0|2,0,0]=4 4326 B17R2.8343 CN(CCc1ccccc1)Cc2cccs2 2230a_100025750244_200000210301 [0,1,1,0,0,0|2,0,0]=4 4327 B17R2.8343 CN(CCc1ccccc1)Cc2cccs2 269982a_100000184426_100000765856 [0,1,1,0,0,0|2,0,0]=4 4328 B17R2.8343 CN(CCc1ccccc1)Cc2cccs2 269982a_100025750244_200000210301 [0,1,1,0,0,0|2,0,0]=4 4329 B17R2.8343 CN(CCc1ccccc1)Cc2cccs2 270004a_100000207497_100000209959 [0,1,1,0,0,0|2,0,0]=4 4330 B17R2.8343 CN(CCc1ccccc1)Cc2cccs2 34a_100025750244_200000210301 [0,1,1,0,0,0|2,0,0]=4 4331 B17R2.8343 CN(CCc1ccccc1)Cc2ccoc2 270004a_100000207497_100011215517 [0,1,1,0,0,0|2,0,0]=4 4332 B17R2.8343 CN(CCc1ccccc1)Cc2ccon2 2230a_100000207497_100000234950 [0,1,1,0,0,0|2,0,0]=4 4333 B17R2.8343 CN(CCc1ccccc1)Cc2ccon2 2230a_100000757864_100000765856 [0,1,1,0,0,0|2,0,0]=4 4334 B17R2.8343 CN(CCc1ccccc1)Cc2ccon2 269982a_100000207497_100000234950 [0,1,1,0,0,0|2,0,0]=4 4335 B17R2.8343 CN(CCc1ccccc1)Cc2ccon2 269982a_100000757864_100000765856 [0,1,1,0,0,0|2,0,0]=4 4336 B17R2.8343 CN(CCc1ccccc1)Cc2ccsc2 2230a_100000207497_100011261437 [0,1,1,0,0,0|2,0,0]=4 4337 B17R2.8343 CN(CCc1ccccc1)Cc2ccsc2 2230a_100020654213_100000765856 [0,1,1,0,0,0|2,0,0]=4 4338 B17R2.8343 CN(CCc1ccccc1)Cc2ccsc2 269982a_100000207497_100011233845 [0,1,1,0,0,0|2,0,0]=4 4339 B17R2.8343 CN(CCc1ccccc1)Cc2ccsc2 269982a_100020654213_100000765856 [0,1,1,0,0,0|2,0,0]=4 4340 B17R2.8343 CN(CCc1ccccc1)Cc2ccsc2 270004a_100000207497_100000188534 [0,1,1,0,0,0|2,0,0]=4 4341 B17R2.8343 CN(CCc1ccccc1)Cc2cn[nH]c2 270004a_100000207497_100016992096 [0,1,1,0,0,0|2,0,0]=4 4342 B17R2.8343 CN(CCc1ccccc1)Cc2cnco2 270004a_100000207497_100000064291 [0,1,1,0,0,0|1,0,1]=4 4343 B17R2.8343 CN(CCc1ccccc1)Cc2cncs2 2230a_100000207497_100015185245 [0,1,1,0,0,0|1,0,1]=4 4344 B17R2.8343 CN(CCc1ccccc1)Cc2cncs2 269982a_100000207497_100015185245 [0,1,1,0,0,0|1,0,1]=4 4345 B17R2.8343 CN(CCc1ccccc1)Cc2cncs2 270004a_100000207497_100000749870 [0,1,1,0,0,0|1,0,1]=4 4346 B17R2.8343 CN(CCc1ccccc1)Cc2cocn2 270004a_100000207497_100000050382 [0,1,1,0,0,0|1,0,0]=3 4347 B17R2.8343 CN(CCc1ccccc1)Cc2cscn2 2230a_100000207497_100000205941 [0,1,1,0,0,0|1,0,0]=3 4348 B17R2.8343 CN(CCc1ccccc1)Cc2cscn2 2230a_100000225794_100000765856 [0,1,1,0,0,0|1,0,0]=3 4349 B17R2.8343 CN(CCc1ccccc1)Cc2cscn2 269982a_100000207497_100000205941 [0,1,1,0,0,0|1,0,0]=3 4350 B17R2.8343 CN(CCc1ccccc1)Cc2cscn2 269982a_100000225794_100000765856 [0,1,1,0,0,0|1,0,0]=3 4351 B17R2.8343 CN(CCc1ccccc1)Cc2cscn2 270004a_100000207497_100000743575 [0,1,1,0,0,0|1,0,0]=3 4352 B17R2.8343 CN(CCc1ccccc1)Cc2csnn2 270004a_100000207497_100000738508 [0,1,1,0,0,0|2,0,0]=4 4353 B17R2.8343 CN(CCc1ccccc1)Cc2ncc[nH]2 2230a_100000207497_100016991755 [0,1,1,0,0,0|2,0,0]=4 4354 B17R2.8343 CN(CCc1ccccc1)Cc2ncc[nH]2 2230a_100015184136_100000765856 [0,1,1,0,0,0|2,0,0]=4 4355 B17R2.8343 CN(CCc1ccccc1)Cc2ncc[nH]2 269982a_100000207497_100016991755 [0,1,1,0,0,0|2,0,0]=4 4356 B17R2.8343 CN(CCc1ccccc1)Cc2ncc[nH]2 269982a_100015184136_100000765856 [0,1,1,0,0,0|2,0,0]=4 4357 B17R2.8343 CN(CCc1ccccc1)Cc2ncco2 2230a_100000207497_103436540062 [0,1,1,0,0,0|2,0,0]=4 4358 B17R2.8343 CN(CCc1ccccc1)Cc2ncco2 269982a_100000207497_103436540062 [0,1,1,0,0,0|2,0,0]=4 4359 B17R2.8343 CN(CCc1ccccc1)Cc2ncco2 270004a_100000207497_100000064290 [0,1,1,0,0,0|2,0,0]=4 4360 B17R2.8343 CN(CCc1ccccc1)Cc2nccs2 2230a_100000207497_100015184050 [0,1,1,0,0,0|2,0,0]=4 4361 B17R2.8343 CN(CCc1ccccc1)Cc2nccs2 2230a_100000765864_100000765856 [0,1,1,0,0,0|2,0,0]=4 4362 B17R2.8343 CN(CCc1ccccc1)Cc2nccs2 269982a_100000207497_100015184050 [0,1,1,0,0,0|2,0,0]=4 4363 B17R2.8343 CN(CCc1ccccc1)Cc2nccs2 269982a_100000765864_100000765856 [0,1,1,0,0,0|2,0,0]=4 4364 B17R2.8343 CN(CCc1ccccc1)Cc2nccs2 270004a_100000207497_100000750902 [0,1,1,0,0,0|2,0,0]=4 4365 B17R2.8343 CN(CCc1ccccc1)Cc2ncon2 269982a_100000207497_100000233494 [0,1,1,0,0,0|2,0,0]=4 4366 B17R2.8343 CN(CCc1ccccc1)Cc2ncon2 269982a_100000697192_100000765856 [0,1,1,0,0,0|2,0,0]=4 4367 B17R2.8343 CN(CCc1ccccc1)Cn2cncn2 2230a_100000207497_200020645497 [0,1,1,0,0,0|1,0,1]=4 4368 B17R2.8343 CN(CCc1ccccc1)Cn2cncn2 269982a_100000207497_200020645497 [0,1,1,0,0,0|1,0,1]=4 4369 B17R2.8343 CN(CCc1ccccn1)Cc2c[nH]cn2 2230a_100000737206_100000707719 [0,1,1,0,0,0|1,0,0]=3 4370 B17R2.8343 CN(CCc1ccccn1)Cc2c[nH]cn2 269982a_100000737206_100000707719 [0,1,1,0,0,0|1,0,0]=3 4371 B17R2.8343 CN(CCc1ccccn1)Cc2cocn2 270004a_100000737206_100000050382 [0,1,1,0,0,0|2,0,0]=4 4372 B17R2.8343 CN(CCc1ccccn1)Cc2cscn2 2230a_100000225794_100015183660 [0,1,1,0,0,0|2,0,0]=4 4373 B17R2.8343 CN(CCc1ccccn1)Cc2cscn2 2230a_100000737206_100000205941 [0,1,1,0,0,0|2,0,0]=4 4374 B17R2.8343 CN(CCc1ccccn1)Cc2cscn2 269982a_100000225794_100015183660 [0,1,1,0,0,0|2,0,0]=4 4375 B17R2.8343 CN(CCc1ccccn1)Cc2cscn2 269982a_100000737206_100000205941 [0,1,1,0,0,0|2,0,0]=4 4376 B17R2.8343 CN(CCc1ccccn1)Cc2cscn2 270004a_100000737206_100000743575 [0,1,1,0,0,0|2,0,0]=4 4377 B17R2.8343 CN(CCc1cccnc1)Cc2c[nH]cn2 2230a_100000763209_100000707719 [0,1,1,0,0,0|1,0,0]=3 4378 B17R2.8343 CN(CCc1cccnc1)Cc2c[nH]cn2 269982a_100000763209_100000707719 [0,1,1,0,0,0|1,0,0]=3 4379 B17R2.8343 CN(CCc1cccnc1)Cc2cocn2 270004a_100000763209_100000050382 [0,1,1,0,0,0|2,0,0]=4 4380 B17R2.8343 CN(CCc1cccnc1)Cc2cscn2 2230a_100000225794_200011713674 [0,1,1,0,0,0|2,0,0]=4 4381 B17R2.8343 CN(CCc1cccnc1)Cc2cscn2 2230a_100000763209_100000205941 [0,1,1,0,0,0|2,0,0]=4 4382 B17R2.8343 CN(CCc1cccnc1)Cc2cscn2 269982a_100000225794_200011713674 [0,1,1,0,0,0|2,0,0]=4 4383 B17R2.8343 CN(CCc1cccnc1)Cc2cscn2 269982a_100000763209_100000205941 [0,1,1,0,0,0|2,0,0]=4 4384 B17R2.8343 CN(CCc1cccnc1)Cc2cscn2 270004a_100000763209_100000743575 [0,1,1,0,0,0|2,0,0]=4 4385 B17R2.8343 CN(CCc1ccncc1)Cc2c[nH]cn2 2230a_100000742850_100000707719 [0,1,1,0,0,0|1,0,0]=3 4386 B17R2.8343 CN(CCc1ccncc1)Cc2c[nH]cn2 269982a_100000742850_100000707719 [0,1,1,0,0,0|1,0,0]=3 4387 B17R2.8343 CN(CCc1ccncc1)Cc2cocn2 270004a_100000742850_100000050382 [0,1,1,0,0,0|2,0,0]=4 4388 B17R2.8343 CN(CCc1ccncc1)Cc2cscn2 2230a_100000225794_100000723409 [0,1,1,0,0,0|2,0,0]=4 4389 B17R2.8343 CN(CCc1ccncc1)Cc2cscn2 2230a_100000742850_100000205941 [0,1,1,0,0,0|2,0,0]=4 4390 B17R2.8343 CN(CCc1ccncc1)Cc2cscn2 269982a_100000225794_100000723409 [0,1,1,0,0,0|2,0,0]=4 4391 B17R2.8343 CN(CCc1ccncc1)Cc2cscn2 269982a_100000742850_100000205941 [0,1,1,0,0,0|2,0,0]=4 4392 B17R2.8343 CN(CCc1ccncc1)Cc2cscn2 270004a_100000742850_100000743575 [0,1,1,0,0,0|2,0,0]=4 4393 B17R2.8343 CN(CSc1ccccc1)Cc2cscn2 2230a_100000225794_100011218342 [0,1,1,0,0,0|2,0,0]=4 4394 B17R2.8343 CN(CSc1ccccc1)Cc2cscn2 269982a_100000225794_100011218342 [0,1,1,0,0,0|2,0,0]=4 4395 B17R2.8343 O=C(CCc1ccccc1)Cc2c[nH]cn2 1458a_100000185753_100000707719 [0,1,1,0,0,0|1,0,0]=3 4396 B17R2.8343 O=C(CCc1ccccc1)Cc2c[nH]cn2 1458a_100015291406_100000765856 [0,1,1,0,0,0|1,0,0]=3 4397 B17R2.8343 O=C(CCc1ccccc1)Cc2cscn2 1458a_100000185753_100000205941 [0,1,1,0,0,0|2,0,0]=4 4398 B17R2.8343 O=C(CCc1ccccc1)Cc2cscn2 1458a_100011438297_100000765856 [0,1,1,0,0,0|2,0,0]=4 4399 B17R2.8343 O=C(CCc1ccccn1)Cc2c[nH]cn2 1458a_100015195070_100000707719 [0,1,1,0,0,0|2,0,0]=4 4400 B17R2.8343 O=C(CCc1ccccn1)Cc2c[nH]cn2 1458a_100015291406_100015183660 [0,1,1,0,0,0|2,0,0]=4 4401 B17R2.8343 O=C(CCc1cccnc1)Cc2c[nH]cn2 1458a_100000198484_100000707719 [0,1,1,0,0,0|2,0,0]=4 4402 B17R2.8343 O=C(CCc1cccnc1)Cc2c[nH]cn2 1458a_100015291406_200011713674 [0,1,1,0,0,0|2,0,0]=4 4403 B17R2.8343 O=C(CCc1ccncc1)Cc2c[nH]cn2 1458a_100011225043_100000707719 [0,1,1,0,0,0|2,0,0]=4 4404 B17R2.8343 O=C(CCc1ccncc1)Cc2c[nH]cn2 1458a_100015291406_100000723409 [0,1,1,0,0,0|2,0,0]=4 4405 B17R2.8343 O=C(COc1ccccc1)Cc2c[nH]cn2 1458a_100000186222_100000707719 [0,1,1,0,0,0|2,0,0]=4 4406 B17R2.8343 O=C(CSc1ccccc1)Cc2c[nH]cn2 1458a_100000211596_100000707719 [0,1,1,0,0,0|2,0,0]=4 4407 B17R2.8343 O=C(Cc1c[nH]cn1)NCc2ccccc2 240690a_100015324214_100015291406 [0,1,1,0,0,0|2,0,0]=4 4408 B17R2.8343 [13CH3]N(CCc1ccccc1)Cc2ccco2 2230a_100015184001_200025704644 [0,1,1,0,0,0|2,0,0]=4 4409 B17R2.8343 [13CH3]N(CCc1ccccc1)Cc2ccco2 269982a_100015184001_200025704644 [0,1,1,0,0,0|2,0,0]=4 4410 B17R2.8343 [13CH3]N(CCc1ccccc1)Cc2ccco2 34a_100015184001_200025704644 [0,1,1,0,0,0|2,0,0]=4 4411 B17R2.8343 [13CH3]N(CCc1ccccc1)Cc2cccs2 2230a_100025750244_200025704644 [0,1,1,0,0,0|2,0,0]=4 4412 B17R2.8343 [13CH3]N(CCc1ccccc1)Cc2cccs2 269982a_100025750244_200025704644 [0,1,1,0,0,0|2,0,0]=4 4413 B17R2.8343 [13CH3]N(CCc1ccccc1)Cc2cccs2 34a_100025750244_200025704644 [0,1,1,0,0,0|2,0,0]=4 4414 B17R2.45544 CC(CNCc1c[nH]cn1)c2ccccc2 2230a_100000701038_100000707719 [0,1,1,0,0,0|0,0,0]=2 4415 B17R2.45544 CC(CNCc1c[nH]cn1)c2ccccc2 34a_100000701038_100000707719 [0,1,1,0,0,0|0,0,0]=2 4416 B17R2.45544 CC(CNCc1c[nH]nn1)c2ccccc2 270004a_100020620823_100000212034 [0,1,1,0,0,0|1,0,0]=3 4417 B17R2.45544 CC(CNCc1cc[nH]n1)c2ccccc2 207a_100000701038_100000738523 [0,1,1,0,0,0|2,0,0]=4 4418 B17R2.45544 CC(CNCc1cc[nH]n1)c2ccccc2 270004a_100000701038_100000738523 [0,1,1,0,0,0|2,0,0]=4 4419 B17R2.45544 CC(CNCc1ccco1)c2ccccc2 207a_100000701038_100000186105 [0,1,1,0,0,0|2,0,0]=4 4420 B17R2.45544 CC(CNCc1ccco1)c2ccccc2 2230a_100000185738_100000756946 [0,1,1,0,0,0|2,0,0]=4 4421 B17R2.45544 CC(CNCc1ccco1)c2ccccc2 270004a_100000185738_100000212034 [0,1,1,0,0,0|2,0,0]=4 4422 B17R2.45544 CC(CNCc1ccco1)c2ccccc2 270004a_100000701038_100000186105 [0,1,1,0,0,0|2,0,0]=4 4423 B17R2.45544 CC(CNCc1ccco1)c2ccccc2 34a_100000185738_100000756946 [0,1,1,0,0,0|2,0,0]=4 4424 B17R2.45544 CC(CNCc1cccs1)c2ccccc2 207a_100000701038_100000209959 [0,1,1,0,0,0|2,0,0]=4 4425 B17R2.45544 CC(CNCc1cccs1)c2ccccc2 2230a_100000211653_100000756946 [0,1,1,0,0,0|2,0,0]=4 4426 B17R2.45544 CC(CNCc1cccs1)c2ccccc2 270004a_100000211653_100000212034 [0,1,1,0,0,0|2,0,0]=4 4427 B17R2.45544 CC(CNCc1cccs1)c2ccccc2 270004a_100000701038_100000209959 [0,1,1,0,0,0|2,0,0]=4 4428 B17R2.45544 CC(CNCc1ccoc1)c2ccccc2 207a_100000701038_100011215517 [0,1,1,0,0,0|2,0,0]=4 4429 B17R2.45544 CC(CNCc1ccoc1)c2ccccc2 2230a_100015206860_100000756946 [0,1,1,0,0,0|2,0,0]=4 4430 B17R2.45544 CC(CNCc1ccoc1)c2ccccc2 270004a_100000701038_100011215517 [0,1,1,0,0,0|2,0,0]=4 4431 B17R2.45544 CC(CNCc1ccoc1)c2ccccc2 270004a_100015206860_100000212034 [0,1,1,0,0,0|2,0,0]=4 4432 B17R2.45544 CC(CNCc1ccoc1)c2ccccc2 34a_100015206860_100000756946 [0,1,1,0,0,0|2,0,0]=4 4433 B17R2.45544 CC(CNCc1ccon1)c2ccccc2 2230a_100000701038_100000234950 [0,1,1,0,0,0|2,0,0]=4 4434 B17R2.45544 CC(CNCc1ccon1)c2ccccc2 270004a_100000688301_100000212034 [0,1,1,0,0,0|2,0,0]=4 4435 B17R2.45544 CC(CNCc1ccon1)c2ccccc2 34a_100000701038_100000234950 [0,1,1,0,0,0|2,0,0]=4 4436 B17R2.45544 CC(CNCc1ccsc1)c2ccccc2 207a_100000701038_100000188534 [0,1,1,0,0,0|2,0,0]=4 4437 B17R2.45544 CC(CNCc1ccsc1)c2ccccc2 2230a_100000186416_100000756946 [0,1,1,0,0,0|2,0,0]=4 4438 B17R2.45544 CC(CNCc1ccsc1)c2ccccc2 2230a_100000701038_100011261437 [0,1,1,0,0,0|2,0,0]=4 4439 B17R2.45544 CC(CNCc1ccsc1)c2ccccc2 270004a_100000186416_100000212034 [0,1,1,0,0,0|2,0,0]=4 4440 B17R2.45544 CC(CNCc1ccsc1)c2ccccc2 270004a_100000701038_100000188534 [0,1,1,0,0,0|2,0,0]=4 4441 B17R2.45544 CC(CNCc1ccsc1)c2ccccc2 34a_100000186416_100000756946 [0,1,1,0,0,0|2,0,0]=4 4442 B17R2.45544 CC(CNCc1ccsc1)c2ccccc2 34a_100000701038_100011261437 [0,1,1,0,0,0|2,0,0]=4 4443 B17R2.45544 CC(CNCc1cn[nH]c1)c2ccccc2 207a_100000701038_100016992096 [0,1,1,0,0,0|2,0,0]=4 4444 B17R2.45544 CC(CNCc1cn[nH]c1)c2ccccc2 270004a_100000701038_100016992096 [0,1,1,0,0,0|2,0,0]=4 4445 B17R2.45544 CC(CNCc1cn[nH]c1)c2ccccc2 270004a_100000737208_100000212034 [0,1,1,0,0,0|2,0,0]=4 4446 B17R2.45544 CC(CNCc1cnc[nH]1)c2ccccc2 207a_100000701038_100000742939 [0,1,1,0,0,0|0,0,2]=4 4447 B17R2.45544 CC(CNCc1cnco1)c2ccccc2 270004a_100000701038_100000064291 [0,1,1,0,0,0|1,0,1]=4 4448 B17R2.45544 CC(CNCc1cnco1)c2ccccc2 270004a_100020634212_100000212034 [0,1,1,0,0,0|1,0,1]=4 4449 B17R2.45544 CC(CNCc1cncs1)c2ccccc2 207a_100000701038_100000749870 [0,1,1,0,0,0|1,0,1]=4 4450 B17R2.45544 CC(CNCc1cncs1)c2ccccc2 2230a_100000701038_100015185245 [0,1,1,0,0,0|1,0,1]=4 4451 B17R2.45544 CC(CNCc1cncs1)c2ccccc2 2230a_100016987365_100000756946 [0,1,1,0,0,0|1,0,1]=4 4452 B17R2.45544 CC(CNCc1cncs1)c2ccccc2 270004a_100000701038_100000749870 [0,1,1,0,0,0|1,0,1]=4 4453 B17R2.45544 CC(CNCc1cncs1)c2ccccc2 270004a_100016987365_100000212034 [0,1,1,0,0,0|1,0,1]=4 4454 B17R2.45544 CC(CNCc1cncs1)c2ccccc2 34a_100000701038_100015185245 [0,1,1,0,0,0|1,0,1]=4 4455 B17R2.45544 CC(CNCc1cocn1)c2ccccc2 270004a_100000701038_100000050382 [0,1,1,0,0,0|1,0,0]=3 4456 B17R2.45544 CC(CNCc1cocn1)c2ccccc2 270004a_100015188801_100000212034 [0,1,1,0,0,0|1,0,0]=3 4457 B17R2.45544 CC(CNCc1cscn1)c2ccccc2 207a_100000701038_100000743575 [0,1,1,0,0,0|1,0,0]=3 4458 B17R2.45544 CC(CNCc1cscn1)c2ccccc2 2230a_100000701038_100000205941 [0,1,1,0,0,0|1,0,0]=3 4459 B17R2.45544 CC(CNCc1cscn1)c2ccccc2 2230a_100015185402_100000756946 [0,1,1,0,0,0|1,0,0]=3 4460 B17R2.45544 CC(CNCc1cscn1)c2ccccc2 270004a_100000701038_100000743575 [0,1,1,0,0,0|1,0,0]=3 4461 B17R2.45544 CC(CNCc1cscn1)c2ccccc2 34a_100000701038_100000205941 [0,1,1,0,0,0|1,0,0]=3 4462 B17R2.45544 CC(CNCc1csnn1)c2ccccc2 270004a_100000701038_100000738508 [0,1,1,0,0,0|2,0,0]=4 4463 B17R2.45544 CC(CNCc1ncc[nH]1)c2ccccc2 207a_100000701038_100000743867 [0,1,1,0,0,0|2,0,0]=4 4464 B17R2.45544 CC(CNCc1ncc[nH]1)c2ccccc2 2230a_100000701038_100016991755 [0,1,1,0,0,0|2,0,0]=4 4465 B17R2.45544 CC(CNCc1ncc[nH]1)c2ccccc2 270004a_100000754540_100000212034 [0,1,1,0,0,0|2,0,0]=4 4466 B17R2.45544 CC(CNCc1ncc[nH]1)c2ccccc2 34a_100000701038_100016991755 [0,1,1,0,0,0|2,0,0]=4 4467 B17R2.45544 CC(CNCc1ncco1)c2ccccc2 2230a_100000701038_103436540062 [0,1,1,0,0,0|2,0,0]=4 4468 B17R2.45544 CC(CNCc1ncco1)c2ccccc2 2230a_100016994969_100000756946 [0,1,1,0,0,0|2,0,0]=4 4469 B17R2.45544 CC(CNCc1ncco1)c2ccccc2 270004a_100000701038_100000064290 [0,1,1,0,0,0|2,0,0]=4 4470 B17R2.45544 CC(CNCc1ncco1)c2ccccc2 34a_100000701038_103436540062 [0,1,1,0,0,0|2,0,0]=4 4471 B17R2.45544 CC(CNCc1nccs1)c2ccccc2 207a_100000701038_100000750902 [0,1,1,0,0,0|2,0,0]=4 4472 B17R2.45544 CC(CNCc1nccs1)c2ccccc2 2230a_100000701038_100015184050 [0,1,1,0,0,0|2,0,0]=4 4473 B17R2.45544 CC(CNCc1nccs1)c2ccccc2 2230a_100000740555_100000756946 [0,1,1,0,0,0|2,0,0]=4 4474 B17R2.45544 CC(CNCc1nccs1)c2ccccc2 270004a_100000701038_100000750902 [0,1,1,0,0,0|2,0,0]=4 4475 B17R2.45544 CC(CNCc1nccs1)c2ccccc2 270004a_100000740555_100000212034 [0,1,1,0,0,0|2,0,0]=4 4476 B17R2.45544 CC(CNCc1nccs1)c2ccccc2 34a_100000701038_100015184050 [0,1,1,0,0,0|2,0,0]=4 4477 B17R2.45544 CC(CNCc1ncon1)c2ccccc2 34a_100000701038_100000233494 [0,1,1,0,0,0|2,0,0]=4 4478 B17R2.45544 CC(CNCn1cncn1)c2ccccc2 2230a_100000701038_200020645497 [0,1,1,0,0,0|1,0,1]=4 4479 B17R2.45544 CC(CNCn1cncn1)c2ccccc2 34a_100000701038_200020645497 [0,1,1,0,0,0|1,0,1]=4 4480 B17R2.45544 CC(COCc1c[nH]cn1)c2ccccc2 34a_100011215166_100000707719 [0,1,1,0,0,0|1,0,0]=3 4481 B17R2.45544 CC(COCc1cscn1)c2ccccc2 34a_100011215166_100000205941 [0,1,1,0,0,0|2,0,0]=4 4482 B17R2.45544 CC(COCc1cscn1)c2ccccc2 7a_100011215166_100000205941 [0,1,1,0,0,0|2,0,0]=4 4483 B17R2.45544 CC(CSCc1c[nH]cn1)c2ccccc2 62a_100000707719_100000756946 [0,1,1,0,0,0|1,0,0]=3 4484 B17R2.45544 CC(CSCc1c[nH]cn1)c2ccccc2 62a_100000756946_100000707719 [0,1,1,0,0,0|1,0,0]=3 4485 B17R2.45544 CC(CSCc1cscn1)c2ccccc2 62a_100000205941_100000756946 [0,1,1,0,0,0|2,0,0]=4 4486 B17R2.45544 CC(CSCc1cscn1)c2ccccc2 62a_100000756946_100000205941 [0,1,1,0,0,0|2,0,0]=4 4487 B17R2.45544 CC(SCCc1c[nH]cn1)c2ccccc2 62a_100000230085_100020628418 [0,1,1,0,0,0|2,0,0]=4 4488 B17R2.45544 CC(SCCc1c[nH]cn1)c2ccccc2 62a_100020628418_100000230085 [0,1,1,0,0,0|2,0,0]=4 4489 B17R2.45544 C[C@@H](NCCc1c[nH]cn1)c2ccccc2 2230a_100000751104_100020628418 [0,1,1,0,0,0|2,0,0]=4 4490 B17R2.45544 C[C@@H](OCCc1c[nH]cn1)c2ccccc2 7a_100000761318_100020628418 [0,1,1,0,0,0|2,0,0]=4 4491 B17R2.45544 N[C@H](COCc1c[nH]cn1)c2ccccc2 34a_100000751927_100000707719 [0,1,1,0,0,0|1,0,0]=3 4492 B17R2.45544 N[C@H](COCc1c[nH]cn1)c2ccncc2 34a_100138412524_100000707719 [0,1,1,0,0,0|2,0,0]=4 4493 B17R2.45544 N[C@H](COCc1cscn1)c2ccccc2 34a_100000751927_100000205941 [0,1,1,0,0,0|2,0,0]=4 4494 B17R2.45544 O=C(CSCc1c[nH]cn1)c2ccccc2 62a_100000211460_100000707719 [0,1,1,0,0,0|1,0,1]=4 4495 B17R2.45544 O=C(CSCc1c[nH]cn1)c2ccccc2 62a_100000707719_100000211460 [0,1,1,0,0,0|1,0,1]=4 4496 B17R2.45544 O=S(CSCc1c[nH]cn1)c2ccccc2 62a_100000707719_100000031784 [0,1,1,0,0,0|2,0,0]=4 4497 B17R2.45544 OC(CNCc1c[nH]cn1)c2ccccc2 2230a_100000210709_100000707719 [0,1,1,0,0,0|0,0,0]=2 4498 B17R2.45544 OC(CNCc1c[nH]cn1)c2ccccn2 2230a_100000691469_100000707719 [0,1,1,0,0,0|1,0,0]=3 4499 B17R2.45544 OC(CNCc1c[nH]cn1)c2cccnc2 2230a_100020605170_100000707719 [0,1,1,0,0,0|1,0,0]=3 4500 B17R2.45544 OC(CNCc1cc[nH]n1)c2ccccc2 207a_100000210709_100000738523 [0,1,1,0,0,0|2,0,0]=4 4501 B17R2.45544 OC(CNCc1cc[nH]n1)c2ccccc2 270004a_100000210709_100000738523 [0,1,1,0,0,0|2,0,0]=4 4502 B17R2.45544 OC(CNCc1ccco1)c2ccccc2 207a_100000210709_100000186105 [0,1,1,0,0,0|2,0,0]=4 4503 B17R2.45544 OC(CNCc1ccco1)c2ccccc2 2230a_100000185738_100000185958 [0,1,1,0,0,0|2,0,0]=4 4504 B17R2.45544 OC(CNCc1ccco1)c2ccccc2 270004a_100000210709_100000186105 [0,1,1,0,0,0|2,0,0]=4 4505 B17R2.45544 OC(CNCc1ccco1)c2ccccc2 34a_100000185738_100000185958 [0,1,1,0,0,0|2,0,0]=4 4506 B17R2.45544 OC(CNCc1cccs1)c2ccccc2 207a_100000210709_100000209959 [0,1,1,0,0,0|2,0,0]=4 4507 B17R2.45544 OC(CNCc1cccs1)c2ccccc2 2230a_100000211653_100000185958 [0,1,1,0,0,0|2,0,0]=4 4508 B17R2.45544 OC(CNCc1cccs1)c2ccccc2 270004a_100000210709_100000209959 [0,1,1,0,0,0|2,0,0]=4 4509 B17R2.45544 OC(CNCc1ccoc1)c2ccccc2 207a_100000210709_100011215517 [0,1,1,0,0,0|2,0,0]=4 4510 B17R2.45544 OC(CNCc1ccoc1)c2ccccc2 2230a_100015206860_100000185958 [0,1,1,0,0,0|2,0,0]=4 4511 B17R2.45544 OC(CNCc1ccoc1)c2ccccc2 270004a_100000210709_100011215517 [0,1,1,0,0,0|2,0,0]=4 4512 B17R2.45544 OC(CNCc1ccoc1)c2ccccc2 34a_100015206860_100000185958 [0,1,1,0,0,0|2,0,0]=4 4513 B17R2.45544 OC(CNCc1ccon1)c2ccccc2 2230a_100000210709_100000234950 [0,1,1,0,0,0|2,0,0]=4 4514 B17R2.45544 OC(CNCc1ccsc1)c2ccccc2 207a_100000210709_100000188534 [0,1,1,0,0,0|2,0,0]=4 4515 B17R2.45544 OC(CNCc1ccsc1)c2ccccc2 2230a_100000186416_100000185958 [0,1,1,0,0,0|2,0,0]=4 4516 B17R2.45544 OC(CNCc1ccsc1)c2ccccc2 2230a_100000210709_100011261437 [0,1,1,0,0,0|2,0,0]=4 4517 B17R2.45544 OC(CNCc1ccsc1)c2ccccc2 270004a_100000210709_100000188534 [0,1,1,0,0,0|2,0,0]=4 4518 B17R2.45544 OC(CNCc1ccsc1)c2ccccc2 34a_100000186416_100000185958 [0,1,1,0,0,0|2,0,0]=4 4519 B17R2.45544 OC(CNCc1cn[nH]c1)c2ccccc2 207a_100000210709_100016992096 [0,1,1,0,0,0|2,0,0]=4 4520 B17R2.45544 OC(CNCc1cn[nH]c1)c2ccccc2 270004a_100000210709_100016992096 [0,1,1,0,0,0|2,0,0]=4 4521 B17R2.45544 OC(CNCc1cnc[nH]1)c2ccccc2 207a_100000210709_100000742939 [0,1,1,0,0,0|0,0,2]=4 4522 B17R2.45544 OC(CNCc1cnco1)c2ccccc2 270004a_100000210709_100000064291 [0,1,1,0,0,0|1,0,1]=4 4523 B17R2.45544 OC(CNCc1cncs1)c2ccccc2 207a_100000210709_100000749870 [0,1,1,0,0,0|1,0,1]=4 4524 B17R2.45544 OC(CNCc1cncs1)c2ccccc2 2230a_100000210709_100015185245 [0,1,1,0,0,0|1,0,1]=4 4525 B17R2.45544 OC(CNCc1cncs1)c2ccccc2 2230a_100016987365_100000185958 [0,1,1,0,0,0|1,0,1]=4 4526 B17R2.45544 OC(CNCc1cncs1)c2ccccc2 270004a_100000210709_100000749870 [0,1,1,0,0,0|1,0,1]=4 4527 B17R2.45544 OC(CNCc1cocn1)c2ccccc2 270004a_100000210709_100000050382 [0,1,1,0,0,0|1,0,0]=3 4528 B17R2.45544 OC(CNCc1cocn1)c2ccccn2 270004a_100000691469_100000050382 [0,1,1,0,0,0|2,0,0]=4 4529 B17R2.45544 OC(CNCc1cocn1)c2cccnc2 270004a_100020605170_100000050382 [0,1,1,0,0,0|2,0,0]=4 4530 B17R2.45544 OC(CNCc1cscn1)c2ccccc2 207a_100000210709_100000743575 [0,1,1,0,0,0|1,0,0]=3 4531 B17R2.45544 OC(CNCc1cscn1)c2ccccc2 2230a_100000210709_100000205941 [0,1,1,0,0,0|1,0,0]=3 4532 B17R2.45544 OC(CNCc1cscn1)c2ccccc2 2230a_100015185402_100000185958 [0,1,1,0,0,0|1,0,0]=3 4533 B17R2.45544 OC(CNCc1cscn1)c2ccccc2 270004a_100000210709_100000743575 [0,1,1,0,0,0|1,0,0]=3 4534 B17R2.45544 OC(CNCc1cscn1)c2ccccn2 207a_100000691469_100000743575 [0,1,1,0,0,0|2,0,0]=4 4535 B17R2.45544 OC(CNCc1cscn1)c2ccccn2 2230a_100000691469_100000205941 [0,1,1,0,0,0|2,0,0]=4 4536 B17R2.45544 OC(CNCc1cscn1)c2ccccn2 270004a_100000691469_100000743575 [0,1,1,0,0,0|2,0,0]=4 4537 B17R2.45544 OC(CNCc1cscn1)c2cccnc2 207a_100020605170_100000743575 [0,1,1,0,0,0|2,0,0]=4 4538 B17R2.45544 OC(CNCc1cscn1)c2cccnc2 2230a_100020605170_100000205941 [0,1,1,0,0,0|2,0,0]=4 4539 B17R2.45544 OC(CNCc1cscn1)c2cccnc2 270004a_100020605170_100000743575 [0,1,1,0,0,0|2,0,0]=4 4540 B17R2.45544 OC(CNCc1csnn1)c2ccccc2 270004a_100000210709_100000738508 [0,1,1,0,0,0|2,0,0]=4 4541 B17R2.45544 OC(CNCc1ncc[nH]1)c2ccccc2 207a_100000210709_100000743867 [0,1,1,0,0,0|2,0,0]=4 4542 B17R2.45544 OC(CNCc1ncc[nH]1)c2ccccc2 2230a_100000210709_100016991755 [0,1,1,0,0,0|2,0,0]=4 4543 B17R2.45544 OC(CNCc1ncco1)c2ccccc2 2230a_100000210709_103436540062 [0,1,1,0,0,0|2,0,0]=4 4544 B17R2.45544 OC(CNCc1ncco1)c2ccccc2 2230a_100016994969_100000185958 [0,1,1,0,0,0|2,0,0]=4 4545 B17R2.45544 OC(CNCc1ncco1)c2ccccc2 270004a_100000210709_100000064290 [0,1,1,0,0,0|2,0,0]=4 4546 B17R2.45544 OC(CNCc1nccs1)c2ccccc2 207a_100000210709_100000750902 [0,1,1,0,0,0|2,0,0]=4 4547 B17R2.45544 OC(CNCc1nccs1)c2ccccc2 2230a_100000210709_100015184050 [0,1,1,0,0,0|2,0,0]=4 4548 B17R2.45544 OC(CNCc1nccs1)c2ccccc2 2230a_100000740555_100000185958 [0,1,1,0,0,0|2,0,0]=4 4549 B17R2.45544 OC(CNCc1nccs1)c2ccccc2 270004a_100000210709_100000750902 [0,1,1,0,0,0|2,0,0]=4 4550 B17R2.45544 OC(CNCn1cncn1)c2ccccc2 2230a_100000210709_200020645497 [0,1,1,0,0,0|1,0,1]=4 4551 B17R2.45544 OC(CSCc1c[nH]cn1)c2ccccc2 62a_100000185958_100000707719 [0,1,1,0,0,0|1,0,0]=3 4552 B17R2.45544 OC(CSCc1c[nH]cn1)c2ccccc2 62a_100000707719_100000185958 [0,1,1,0,0,0|1,0,0]=3 4553 B17R2.45544 OC(CSCc1cscn1)c2ccccc2 62a_100000185958_100000205941 [0,1,1,0,0,0|2,0,0]=4 4554 B17R2.45544 OC(CSCc1cscn1)c2ccccc2 62a_100000205941_100000185958 [0,1,1,0,0,0|2,0,0]=4 4555 B17R2.45544 O[C@H](CCSc1c[nH]cn1)c2ccccc2 62a_100000729684_100000756875 [0,1,1,0,0,0|2,0,0]=4 4556 B17R2.45544 O[C@H](CCSc1c[nH]cn1)c2ccccc2 62a_100000756875_100000729684 [0,1,1,0,0,0|2,0,0]=4 4557 B17R2.45544 O[C@H](CNCc1ccco1)c2ccccc2 2230a_100000185738_100011933945 [0,1,1,0,0,0|2,0,0]=4 4558 B17R2.45544 O[C@H](CNCc1ccco1)c2ccccc2 34a_100000185738_100011933945 [0,1,1,0,0,0|2,0,0]=4 4559 B17R2.45544 O[C@H](CNCc1cccs1)c2ccccc2 2230a_100000211653_100011933945 [0,1,1,0,0,0|2,0,0]=4 4560 B17R2.45544 O[C@H](CNCc1ccoc1)c2ccccc2 2230a_100015206860_100011933945 [0,1,1,0,0,0|2,0,0]=4 4561 B17R2.45544 O[C@H](CNCc1ccoc1)c2ccccc2 34a_100015206860_100011933945 [0,1,1,0,0,0|2,0,0]=4 4562 B17R2.45544 O[C@H](CNCc1ccsc1)c2ccccc2 2230a_100000186416_100011933945 [0,1,1,0,0,0|2,0,0]=4 4563 B17R2.45544 O[C@H](CNCc1ccsc1)c2ccccc2 34a_100000186416_100011933945 [0,1,1,0,0,0|2,0,0]=4 4564 B17R2.45544 O[C@H](CNCc1cncs1)c2ccccc2 2230a_100016987365_100011933945 [0,1,1,0,0,0|1,0,1]=4 4565 B17R2.45544 O[C@H](CNCc1cscn1)c2ccccc2 2230a_100015185402_100011933945 [0,1,1,0,0,0|1,0,0]=3 4566 B17R2.45544 O[C@H](CNCc1ncco1)c2ccccc2 2230a_100016994969_100011933945 [0,1,1,0,0,0|2,0,0]=4 4567 B17R2.45544 O[C@H](CNCc1nccs1)c2ccccc2 2230a_100000740555_100011933945 [0,1,1,0,0,0|2,0,0]=4 4568 B17R2.45544 O[C@H](CSCc1c[nH]cn1)c2ccccc2 62a_100000707719_100011933945 [0,1,1,0,0,0|1,0,0]=3 4569 B17R2.45544 O[C@H](CSCc1c[nH]cn1)c2ccccc2 62a_100011933945_100000707719 [0,1,1,0,0,0|1,0,0]=3 4570 B17R2.45544 O[C@H](CSCc1cscn1)c2ccccc2 62a_100000205941_100011933945 [0,1,1,0,0,0|2,0,0]=4 4571 B17R2.45544 O[C@H](CSCc1cscn1)c2ccccc2 62a_100011933945_100000205941 [0,1,1,0,0,0|2,0,0]=4 4572 B17R2.3383 CN(Cc1c[nH]cn1)c2cccc(c2Cl)Cl 2230a_100000742713_100000707719 [0,1,1,0,0,0|1,0,0]=3 4573 B17R2.3383 CN(Cc1c[nH]cn1)c2cccc(c2Cl)Cl 269982a_100000742713_100000707719 [0,1,1,0,0,0|1,0,0]=3 4574 B17R2.3383 CN(Cc1c[nH]cn1)c2cccc(c2Cl)Cl 34a_100000742713_100000707719 [0,1,1,0,0,0|1,0,0]=3 4575 B17R2.3383 CN(Cc1c[nH]cn1)c2cccc(c2F)Cl 2230a_100020633735_100000707719 [0,1,1,0,0,0|1,0,0]=3 4576 B17R2.3383 CN(Cc1c[nH]cn1)c2cccc(c2F)Cl 269982a_100020633735_100000707719 [0,1,1,0,0,0|1,0,0]=3 4577 B17R2.3383 CN(Cc1c[nH]cn1)c2cccc(c2F)Cl 34a_100020633735_100000707719 [0,1,1,0,0,0|1,0,0]=3 4578 B17R2.3383 CN(Cc1c[nH]cn1)c2cccc(c2F)Cl 38a_100020633735_100000707719 [0,1,1,0,0,0|1,0,0]=3 4579 B17R2.3383 CN(Cc1cscn1)c2cccc(c2Cl)Cl 2230a_100000742713_100000205941 [0,1,1,0,0,0|2,0,0]=4 4580 B17R2.3383 CN(Cc1cscn1)c2cccc(c2Cl)Cl 269982a_100000742713_100000205941 [0,1,1,0,0,0|2,0,0]=4 4581 B17R2.3383 CN(Cc1cscn1)c2cccc(c2Cl)Cl 34a_100000742713_100000205941 [0,1,1,0,0,0|2,0,0]=4 4582 B17R2.3383 CN(Cc1cscn1)c2cccc(c2F)Cl 2230a_100020633735_100000205941 [0,1,1,0,0,0|2,0,0]=4 4583 B17R2.3383 CN(Cc1cscn1)c2cccc(c2F)Cl 269982a_100020633735_100000205941 [0,1,1,0,0,0|2,0,0]=4 4584 B17R2.3383 CN(Cc1cscn1)c2cccc(c2F)Cl 34a_100020633735_100000205941 [0,1,1,0,0,0|2,0,0]=4 4585 B17R2.3383 Cc1c(cccc1C(=O)Cc2c[nH]cn2)Br 1458a_100000760464_100000707719 [0,1,1,0,0,0|2,0,0]=4 4586 B17R2.3383 Cc1c(cccc1C(=O)Cc2c[nH]cn2)Cl 1458a_100000690184_100000707719 [0,1,1,0,0,0|2,0,0]=4 4587 B17R2.3383 Cc1c(cccc1C(=O)Cc2c[nH]cn2)F 1458a_100011218272_100000707719 [0,1,1,0,0,0|2,0,0]=4 4588 B17R2.3383 Cc1c(cccc1C(=O)Cc2c[nH]cn2)I 1458a_100000751865_100000707719 [0,1,1,0,0,0|2,0,0]=4 4589 B17R2.3383 Cc1c(cccc1C(=O)Cc2c[nH]cn2)O 1458a_100000766327_100000707719 [0,1,1,0,0,0|2,0,0]=4 4590 B17R2.3383 Cc1c(cccc1N(C)Cc2c[nH]cn2)Cl 2230a_100020606106_100000707719 [0,1,1,0,0,0|0,0,0]=2 4591 B17R2.3383 Cc1c(cccc1N(C)Cc2c[nH]cn2)Cl 269982a_100020606106_100000707719 [0,1,1,0,0,0|0,0,0]=2 4592 B17R2.3383 Cc1c(cccc1N(C)Cc2c[nH]cn2)Cl 34a_100020606106_100000707719 [0,1,1,0,0,0|0,0,0]=2 4593 B17R2.3383 Cc1c(cccc1N(C)Cc2c[nH]cn2)Cl 38a_100020606106_100000707719 [0,1,1,0,0,0|0,0,0]=2 4594 B17R2.3383 Cc1c(cccc1N(C)Cc2ccon2)Cl 2230a_100020606106_100000234950 [0,1,1,0,0,0|2,0,0]=4 4595 B17R2.3383 Cc1c(cccc1N(C)Cc2ccon2)Cl 269982a_100020606106_100000234950 [0,1,1,0,0,0|2,0,0]=4 4596 B17R2.3383 Cc1c(cccc1N(C)Cc2ccon2)Cl 34a_100020606106_100000234950 [0,1,1,0,0,0|2,0,0]=4 4597 B17R2.3383 Cc1c(cccc1N(C)Cc2ccon2)Cl 38a_100020606106_100000234950 [0,1,1,0,0,0|2,0,0]=4 4598 B17R2.3383 Cc1c(cccc1N(C)Cc2ccsc2)Cl 2230a_100020606106_100011261437 [0,1,1,0,0,0|2,0,0]=4 4599 B17R2.3383 Cc1c(cccc1N(C)Cc2ccsc2)Cl 269982a_100020606106_100011233845 [0,1,1,0,0,0|2,0,0]=4 4600 B17R2.3383 Cc1c(cccc1N(C)Cc2ccsc2)Cl 34a_100020606106_100011261437 [0,1,1,0,0,0|2,0,0]=4 4601 B17R2.3383 Cc1c(cccc1N(C)Cc2ccsc2)Cl 38a_100020606106_100011233845 [0,1,1,0,0,0|2,0,0]=4 4602 B17R2.3383 Cc1c(cccc1N(C)Cc2cncs2)Cl 2230a_100020606106_100015185245 [0,1,1,0,0,0|1,0,1]=4 4603 B17R2.3383 Cc1c(cccc1N(C)Cc2cncs2)Cl 269982a_100020606106_100015185245 [0,1,1,0,0,0|1,0,1]=4 4604 B17R2.3383 Cc1c(cccc1N(C)Cc2cncs2)Cl 34a_100020606106_100015185245 [0,1,1,0,0,0|1,0,1]=4 4605 B17R2.3383 Cc1c(cccc1N(C)Cc2cscn2)Cl 2230a_100020606106_100000205941 [0,1,1,0,0,0|1,0,0]=3 4606 B17R2.3383 Cc1c(cccc1N(C)Cc2cscn2)Cl 269982a_100020606106_100000205941 [0,1,1,0,0,0|1,0,0]=3 4607 B17R2.3383 Cc1c(cccc1N(C)Cc2cscn2)Cl 34a_100020606106_100000205941 [0,1,1,0,0,0|1,0,0]=3 4608 B17R2.3383 Cc1c(cccc1N(C)Cc2ncc[nH]2)Cl 2230a_100020606106_100016991755 [0,1,1,0,0,0|2,0,0]=4 4609 B17R2.3383 Cc1c(cccc1N(C)Cc2ncc[nH]2)Cl 269982a_100020606106_100016991755 [0,1,1,0,0,0|2,0,0]=4 4610 B17R2.3383 Cc1c(cccc1N(C)Cc2ncc[nH]2)Cl 34a_100020606106_100016991755 [0,1,1,0,0,0|2,0,0]=4 4611 B17R2.3383 Cc1c(cccc1N(C)Cc2ncc[nH]2)Cl 38a_100020606106_100016991755 [0,1,1,0,0,0|2,0,0]=4 4612 B17R2.3383 Cc1c(cccc1N(C)Cc2ncco2)Cl 2230a_100020606106_103436540062 [0,1,1,0,0,0|2,0,0]=4 4613 B17R2.3383 Cc1c(cccc1N(C)Cc2ncco2)Cl 269982a_100020606106_103436540062 [0,1,1,0,0,0|2,0,0]=4 4614 B17R2.3383 Cc1c(cccc1N(C)Cc2ncco2)Cl 34a_100020606106_103436540062 [0,1,1,0,0,0|2,0,0]=4 4615 B17R2.3383 Cc1c(cccc1N(C)Cc2ncco2)Cl 38a_100020606106_103436540062 [0,1,1,0,0,0|2,0,0]=4 4616 B17R2.3383 Cc1c(cccc1N(C)Cc2nccs2)Cl 2230a_100020606106_100015184050 [0,1,1,0,0,0|2,0,0]=4 4617 B17R2.3383 Cc1c(cccc1N(C)Cc2nccs2)Cl 269982a_100020606106_100015184050 [0,1,1,0,0,0|2,0,0]=4 4618 B17R2.3383 Cc1c(cccc1N(C)Cc2nccs2)Cl 34a_100020606106_100015184050 [0,1,1,0,0,0|2,0,0]=4 4619 B17R2.3383 Cc1c(cccc1N(C)Cc2nccs2)Cl 38a_100020606106_100015184050 [0,1,1,0,0,0|2,0,0]=4 4620 B17R2.3383 Cc1c(cccc1N(C)Cc2ncon2)Cl 269982a_100020606106_100000233494 [0,1,1,0,0,0|2,0,0]=4 4621 B17R2.3383 Cc1c(cccc1N(C)Cc2ncon2)Cl 34a_100020606106_100000233494 [0,1,1,0,0,0|2,0,0]=4 4622 B17R2.3383 Cc1c(cccc1N(C)Cc2ncon2)Cl 38a_100020606106_100000233494 [0,1,1,0,0,0|2,0,0]=4 4623 B17R2.3383 Cc1c(cccc1N(C)Cn2cncn2)Cl 2230a_100020606106_200020645497 [0,1,1,0,0,0|1,0,1]=4 4624 B17R2.3383 Cc1c(cccc1N(C)Cn2cncn2)Cl 269982a_100020606106_200020645497 [0,1,1,0,0,0|1,0,1]=4 4625 B17R2.3383 Cc1c(cccc1N(C)Cn2cncn2)Cl 34a_100020606106_200020645497 [0,1,1,0,0,0|1,0,1]=4 4626 B17R2.3383 Cc1c(cccc1N(C)Cn2cncn2)Cl 38a_100020606106_200020645497 [0,1,1,0,0,0|1,0,1]=4 4627 B17R2.3383 Cc1c(ccnc1F)N(C)Cc2cscn2 27a_100000225794_100010006593 [0,1,1,0,0,0|2,0,0]=4 4628 B17R2.3383 Cc1c(ccnc1N(C)Cc2cscn2)F 27a_100000225794_100009846374 [0,1,1,0,0,0|2,0,0]=4 4629 B17R2.3383 Cc1cccc(c1C)C(=O)Cc2c[nH]cn2 1458a_100000183679_100000707719 [0,1,1,0,0,0|2,0,0]=4 4630 B17R2.3383 Cc1cccc(c1C)C(C)Sc2c[nH]cn2 62a_100000756875_100012183177 [0,1,1,0,0,0|2,0,0]=4 4631 B17R2.3383 Cc1cccc(c1C)C(C)Sc2c[nH]cn2 62a_100012183177_100000756875 [0,1,1,0,0,0|2,0,0]=4 4632 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Br)Br 269982a_200000221195_100000707719 [0,1,1,0,0,0|1,0,0]=3 4633 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Br)Br 34a_200000221195_100000707719 [0,1,1,0,0,0|1,0,0]=3 4634 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Br)Cl 269982a_100020633009_100000707719 [0,1,1,0,0,0|1,0,0]=3 4635 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Br)Cl 34a_100020633009_100000707719 [0,1,1,0,0,0|1,0,0]=3 4636 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Br)F 269982a_100011246292_100000707719 [0,1,1,0,0,0|1,0,0]=3 4637 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Br)F 34a_100011246292_100000707719 [0,1,1,0,0,0|1,0,0]=3 4638 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Cl)Br 269982a_100000221650_100000707719 [0,1,1,0,0,0|1,0,0]=3 4639 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Cl)Br 34a_100000221650_100000707719 [0,1,1,0,0,0|1,0,0]=3 4640 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Cl)Cl 269982a_114849113696_100000707719 [0,1,1,0,0,0|1,0,0]=3 4641 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2Cl)Cl 34a_114849113696_100000707719 [0,1,1,0,0,0|1,0,0]=3 4642 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)Br 2230a_100000743884_100000707719 [0,1,1,0,0,0|1,0,0]=3 4643 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)Br 269982a_100000743884_100000707719 [0,1,1,0,0,0|1,0,0]=3 4644 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)Br 34a_100000743884_100000707719 [0,1,1,0,0,0|1,0,0]=3 4645 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)F 2230a_100020633734_100000707719 [0,1,1,0,0,0|1,0,0]=3 4646 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)F 269982a_100020633734_100000707719 [0,1,1,0,0,0|1,0,0]=3 4647 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)F 34a_100020633734_100000707719 [0,1,1,0,0,0|1,0,0]=3 4648 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)F 38a_100020633734_100000707719 [0,1,1,0,0,0|1,0,0]=3 4649 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)I 269982a_114948340911_100000707719 [0,1,1,0,0,0|1,0,0]=3 4650 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)I 34a_114948340911_100000707719 [0,1,1,0,0,0|1,0,0]=3 4651 B17R2.3478 CN(Cc1c[nH]cn1)c2ccc(cc2F)I 38a_114948340911_100000707719 [0,1,1,0,0,0|1,0,0]=3 4652 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Br)Br 269982a_200000221195_100000205941 [0,1,1,0,0,0|2,0,0]=4 4653 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Br)Br 34a_200000221195_100000205941 [0,1,1,0,0,0|2,0,0]=4 4654 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Br)Cl 269982a_100020633009_100000205941 [0,1,1,0,0,0|2,0,0]=4 4655 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Br)Cl 34a_100020633009_100000205941 [0,1,1,0,0,0|2,0,0]=4 4656 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Br)F 269982a_100011246292_100000205941 [0,1,1,0,0,0|2,0,0]=4 4657 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Br)F 34a_100011246292_100000205941 [0,1,1,0,0,0|2,0,0]=4 4658 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Cl)Br 269982a_100000221650_100000205941 [0,1,1,0,0,0|2,0,0]=4 4659 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Cl)Br 34a_100000221650_100000205941 [0,1,1,0,0,0|2,0,0]=4 4660 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Cl)Cl 269982a_114849113696_100000205941 [0,1,1,0,0,0|2,0,0]=4 4661 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2Cl)Cl 34a_114849113696_100000205941 [0,1,1,0,0,0|2,0,0]=4 4662 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2F)Br 2230a_100000743884_100000205941 [0,1,1,0,0,0|2,0,0]=4 4663 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2F)Br 269982a_100000743884_100000205941 [0,1,1,0,0,0|2,0,0]=4 4664 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2F)Br 34a_100000743884_100000205941 [0,1,1,0,0,0|2,0,0]=4 4665 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2F)F 2230a_100020633734_100000205941 [0,1,1,0,0,0|2,0,0]=4 4666 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2F)F 269982a_100020633734_100000205941 [0,1,1,0,0,0|2,0,0]=4 4667 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2F)F 34a_100020633734_100000205941 [0,1,1,0,0,0|2,0,0]=4 4668 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2F)I 269982a_114948340911_100000205941 [0,1,1,0,0,0|2,0,0]=4 4669 B17R2.3478 CN(Cc1cscn1)c2ccc(cc2F)I 34a_114948340911_100000205941 [0,1,1,0,0,0|2,0,0]=4 4670 B17R2.3478 Cc1cc(ccc1C(=O)Cc2c[nH]cn2)Br 1458a_100000741311_100000707719 [0,1,1,0,0,0|2,0,0]=4 4671 B17R2.3478 Cc1cc(ccc1C(=O)Cc2c[nH]cn2)Cl 1458a_100000688705_100000707719 [0,1,1,0,0,0|2,0,0]=4 4672 B17R2.3478 Cc1cc(ccc1C(=O)Cc2c[nH]cn2)F 1458a_100000686989_100000707719 [0,1,1,0,0,0|2,0,0]=4 4673 B17R2.3478 Cc1cc(ccc1C(=O)Cc2c[nH]cn2)I 1458a_100010189873_100000707719 [0,1,1,0,0,0|2,0,0]=4 4674 B17R2.3478 Cc1cc(ccc1C(=O)Cc2c[nH]cn2)O 1458a_100000692822_100000707719 [0,1,1,0,0,0|2,0,0]=4 4675 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)Br 2230a_100000221803_100000707719 [0,1,1,0,0,0|0,0,0]=2 4676 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)Br 269982a_100000221803_100000707719 [0,1,1,0,0,0|0,0,0]=2 4677 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)Br 34a_100000221803_100000707719 [0,1,1,0,0,0|0,0,0]=2 4678 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)Cl 2230a_114849113698_100000707719 [0,1,1,0,0,0|0,0,0]=2 4679 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)Cl 269982a_114849113698_100000707719 [0,1,1,0,0,0|0,0,0]=2 4680 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)Cl 34a_114849113698_100000707719 [0,1,1,0,0,0|0,0,0]=2 4681 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)Cl 38a_114849113698_100000707719 [0,1,1,0,0,0|0,0,0]=2 4682 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)O 269982a_100161107805_100000707719 [0,1,1,0,0,0|0,0,0]=2 4683 B17R2.3478 Cc1cc(ccc1N(C)Cc2c[nH]cn2)O 34a_100161107805_100000707719 [0,1,1,0,0,0|0,0,0]=2 4684 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccco2)F 2230a_100011231892_200000210301 [0,1,1,0,0,0|2,0,0]=4 4685 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccco2)F 269982a_100011231892_200000210301 [0,1,1,0,0,0|2,0,0]=4 4686 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccco2)F 34a_100011231892_200000210301 [0,1,1,0,0,0|2,0,0]=4 4687 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)Br 2230a_100000221803_100000234950 [0,1,1,0,0,0|2,0,0]=4 4688 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)Br 269982a_100000221803_100000234950 [0,1,1,0,0,0|2,0,0]=4 4689 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)Br 34a_100000221803_100000234950 [0,1,1,0,0,0|2,0,0]=4 4690 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)Cl 2230a_114849113698_100000234950 [0,1,1,0,0,0|2,0,0]=4 4691 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)Cl 269982a_114849113698_100000234950 [0,1,1,0,0,0|2,0,0]=4 4692 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)Cl 34a_114849113698_100000234950 [0,1,1,0,0,0|2,0,0]=4 4693 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)Cl 38a_114849113698_100000234950 [0,1,1,0,0,0|2,0,0]=4 4694 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)O 269982a_100161107805_100000234950 [0,1,1,0,0,0|2,0,0]=4 4695 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccon2)O 34a_100161107805_100000234950 [0,1,1,0,0,0|2,0,0]=4 4696 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)Br 2230a_100000221803_100011261437 [0,1,1,0,0,0|2,0,0]=4 4697 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)Br 269982a_100000221803_100011233845 [0,1,1,0,0,0|2,0,0]=4 4698 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)Br 34a_100000221803_100011261437 [0,1,1,0,0,0|2,0,0]=4 4699 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)Cl 2230a_114849113698_100011261437 [0,1,1,0,0,0|2,0,0]=4 4700 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)Cl 269982a_114849113698_100011233845 [0,1,1,0,0,0|2,0,0]=4 4701 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)Cl 34a_114849113698_100011261437 [0,1,1,0,0,0|2,0,0]=4 4702 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)Cl 38a_114849113698_100011233845 [0,1,1,0,0,0|2,0,0]=4 4703 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)O 269982a_100161107805_100011233845 [0,1,1,0,0,0|2,0,0]=4 4704 B17R2.3478 Cc1cc(ccc1N(C)Cc2ccsc2)O 34a_100161107805_100011261437 [0,1,1,0,0,0|2,0,0]=4 4705 B17R2.3478 Cc1cc(ccc1N(C)Cc2cncs2)Br 2230a_100000221803_100015185245 [0,1,1,0,0,0|1,0,1]=4 4706 B17R2.3478 Cc1cc(ccc1N(C)Cc2cncs2)Br 269982a_100000221803_100015185245 [0,1,1,0,0,0|1,0,1]=4 4707 B17R2.3478 Cc1cc(ccc1N(C)Cc2cncs2)Br 34a_100000221803_100015185245 [0,1,1,0,0,0|1,0,1]=4 4708 B17R2.3478 Cc1cc(ccc1N(C)Cc2cncs2)Cl 2230a_114849113698_100015185245 [0,1,1,0,0,0|1,0,1]=4 4709 B17R2.3478 Cc1cc(ccc1N(C)Cc2cncs2)Cl 269982a_114849113698_100015185245 [0,1,1,0,0,0|1,0,1]=4 4710 B17R2.3478 Cc1cc(ccc1N(C)Cc2cncs2)Cl 34a_114849113698_100015185245 [0,1,1,0,0,0|1,0,1]=4 4711 B17R2.3478 Cc1cc(ccc1N(C)Cc2cncs2)O 269982a_100161107805_100015185245 [0,1,1,0,0,0|1,0,1]=4 4712 B17R2.3478 Cc1cc(ccc1N(C)Cc2cncs2)O 34a_100161107805_100015185245 [0,1,1,0,0,0|1,0,1]=4 4713 B17R2.3478 Cc1cc(ccc1N(C)Cc2cscn2)Br 2230a_100000221803_100000205941 [0,1,1,0,0,0|1,0,0]=3 4714 B17R2.3478 Cc1cc(ccc1N(C)Cc2cscn2)Br 269982a_100000221803_100000205941 [0,1,1,0,0,0|1,0,0]=3 4715 B17R2.3478 Cc1cc(ccc1N(C)Cc2cscn2)Br 34a_100000221803_100000205941 [0,1,1,0,0,0|1,0,0]=3 4716 B17R2.3478 Cc1cc(ccc1N(C)Cc2cscn2)Cl 2230a_114849113698_100000205941 [0,1,1,0,0,0|1,0,0]=3 4717 B17R2.3478 Cc1cc(ccc1N(C)Cc2cscn2)Cl 269982a_114849113698_100000205941 [0,1,1,0,0,0|1,0,0]=3 4718 B17R2.3478 Cc1cc(ccc1N(C)Cc2cscn2)Cl 34a_114849113698_100000205941 [0,1,1,0,0,0|1,0,0]=3 4719 B17R2.3478 Cc1cc(ccc1N(C)Cc2cscn2)O 269982a_100161107805_100000205941 [0,1,1,0,0,0|1,0,0]=3 4720 B17R2.3478 Cc1cc(ccc1N(C)Cc2cscn2)O 34a_100161107805_100000205941 [0,1,1,0,0,0|1,0,0]=3 4721 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)Br 2230a_100000221803_100016991755 [0,1,1,0,0,0|2,0,0]=4 4722 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)Br 269982a_100000221803_100016991755 [0,1,1,0,0,0|2,0,0]=4 4723 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)Br 34a_100000221803_100016991755 [0,1,1,0,0,0|2,0,0]=4 4724 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)Cl 2230a_114849113698_100016991755 [0,1,1,0,0,0|2,0,0]=4 4725 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)Cl 269982a_114849113698_100016991755 [0,1,1,0,0,0|2,0,0]=4 4726 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)Cl 34a_114849113698_100016991755 [0,1,1,0,0,0|2,0,0]=4 4727 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)Cl 38a_114849113698_100016991755 [0,1,1,0,0,0|2,0,0]=4 4728 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)O 269982a_100161107805_100016991755 [0,1,1,0,0,0|2,0,0]=4 4729 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncc[nH]2)O 34a_100161107805_100016991755 [0,1,1,0,0,0|2,0,0]=4 4730 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)Br 2230a_100000221803_103436540062 [0,1,1,0,0,0|2,0,0]=4 4731 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)Br 269982a_100000221803_103436540062 [0,1,1,0,0,0|2,0,0]=4 4732 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)Br 34a_100000221803_103436540062 [0,1,1,0,0,0|2,0,0]=4 4733 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)Cl 2230a_114849113698_103436540062 [0,1,1,0,0,0|2,0,0]=4 4734 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)Cl 269982a_114849113698_103436540062 [0,1,1,0,0,0|2,0,0]=4 4735 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)Cl 34a_114849113698_103436540062 [0,1,1,0,0,0|2,0,0]=4 4736 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)Cl 38a_114849113698_103436540062 [0,1,1,0,0,0|2,0,0]=4 4737 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)O 269982a_100161107805_103436540062 [0,1,1,0,0,0|2,0,0]=4 4738 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncco2)O 34a_100161107805_103436540062 [0,1,1,0,0,0|2,0,0]=4 4739 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)Br 2230a_100000221803_100015184050 [0,1,1,0,0,0|2,0,0]=4 4740 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)Br 269982a_100000221803_100015184050 [0,1,1,0,0,0|2,0,0]=4 4741 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)Br 34a_100000221803_100015184050 [0,1,1,0,0,0|2,0,0]=4 4742 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)Cl 2230a_114849113698_100015184050 [0,1,1,0,0,0|2,0,0]=4 4743 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)Cl 269982a_114849113698_100015184050 [0,1,1,0,0,0|2,0,0]=4 4744 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)Cl 34a_114849113698_100015184050 [0,1,1,0,0,0|2,0,0]=4 4745 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)Cl 38a_114849113698_100015184050 [0,1,1,0,0,0|2,0,0]=4 4746 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)O 269982a_100161107805_100015184050 [0,1,1,0,0,0|2,0,0]=4 4747 B17R2.3478 Cc1cc(ccc1N(C)Cc2nccs2)O 34a_100161107805_100015184050 [0,1,1,0,0,0|2,0,0]=4 4748 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncon2)Br 269982a_100000221803_100000233494 [0,1,1,0,0,0|2,0,0]=4 4749 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncon2)Br 34a_100000221803_100000233494 [0,1,1,0,0,0|2,0,0]=4 4750 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncon2)Cl 269982a_114849113698_100000233494 [0,1,1,0,0,0|2,0,0]=4 4751 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncon2)Cl 34a_114849113698_100000233494 [0,1,1,0,0,0|2,0,0]=4 4752 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncon2)Cl 38a_114849113698_100000233494 [0,1,1,0,0,0|2,0,0]=4 4753 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncon2)O 269982a_100161107805_100000233494 [0,1,1,0,0,0|2,0,0]=4 4754 B17R2.3478 Cc1cc(ccc1N(C)Cc2ncon2)O 34a_100161107805_100000233494 [0,1,1,0,0,0|2,0,0]=4 4755 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)Br 2230a_100000221803_200020645497 [0,1,1,0,0,0|1,0,1]=4 4756 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)Br 269982a_100000221803_200020645497 [0,1,1,0,0,0|1,0,1]=4 4757 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)Br 34a_100000221803_200020645497 [0,1,1,0,0,0|1,0,1]=4 4758 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)Cl 2230a_114849113698_200020645497 [0,1,1,0,0,0|1,0,1]=4 4759 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)Cl 269982a_114849113698_200020645497 [0,1,1,0,0,0|1,0,1]=4 4760 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)Cl 34a_114849113698_200020645497 [0,1,1,0,0,0|1,0,1]=4 4761 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)Cl 38a_114849113698_200020645497 [0,1,1,0,0,0|1,0,1]=4 4762 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)O 269982a_100161107805_200020645497 [0,1,1,0,0,0|1,0,1]=4 4763 B17R2.3478 Cc1cc(ccc1N(C)Cn2cncn2)O 34a_100161107805_200020645497 [0,1,1,0,0,0|1,0,1]=4 4764 B17R2.3478 Cc1cc(ccc1N([13CH3])Cc2ccco2)F 2230a_100011231892_200025704644 [0,1,1,0,0,0|2,0,0]=4 4765 B17R2.3478 Cc1cc(ccc1N([13CH3])Cc2ccco2)F 269982a_100011231892_200025704644 [0,1,1,0,0,0|2,0,0]=4 4766 B17R2.3478 Cc1cc(ccc1N([13CH3])Cc2ccco2)F 34a_100011231892_200025704644 [0,1,1,0,0,0|2,0,0]=4 4767 B17R2.3478 Cc1ccc(c(c1)Br)N(C)Cc2c[nH]cn2 2230a_100000221369_100000707719 [0,1,1,0,0,0|1,0,0]=3 4768 B17R2.3478 Cc1ccc(c(c1)Br)N(C)Cc2c[nH]cn2 269982a_100000221369_100000707719 [0,1,1,0,0,0|1,0,0]=3 4769 B17R2.3478 Cc1ccc(c(c1)Br)N(C)Cc2c[nH]cn2 34a_100000221369_100000707719 [0,1,1,0,0,0|1,0,0]=3 4770 B17R2.3478 Cc1ccc(c(c1)Br)N(C)Cc2cscn2 2230a_100000221369_100000205941 [0,1,1,0,0,0|2,0,0]=4 4771 B17R2.3478 Cc1ccc(c(c1)Br)N(C)Cc2cscn2 269982a_100000221369_100000205941 [0,1,1,0,0,0|2,0,0]=4 4772 B17R2.3478 Cc1ccc(c(c1)Br)N(C)Cc2cscn2 34a_100000221369_100000205941 [0,1,1,0,0,0|2,0,0]=4 4773 B17R2.3478 Cc1ccc(c(c1)C)C(=O)Cc2c[nH]cn2 1458a_100000211164_100000707719 [0,1,1,0,0,0|2,0,0]=4 4774 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2Br 2230a_100020606079_100000717665 [0,1,1,0,0,0|1,0,0]=3 4775 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2Br 269982a_100020606079_100000717665 [0,1,1,0,0,0|1,0,0]=3 4776 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2Br 34a_100020606079_100000717665 [0,1,1,0,0,0|1,0,0]=3 4777 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2Cl 2230a_100000219374_100000717665 [0,1,1,0,0,0|1,0,0]=3 4778 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2Cl 269982a_100000219374_100000717665 [0,1,1,0,0,0|1,0,0]=3 4779 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2Cl 34a_100000219374_100000717665 [0,1,1,0,0,0|1,0,0]=3 4780 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2F 2230a_100000220357_100000717665 [0,1,1,0,0,0|1,0,0]=3 4781 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2F 269982a_100000220357_100000717665 [0,1,1,0,0,0|1,0,0]=3 4782 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2F 34a_100000220357_100000717665 [0,1,1,0,0,0|1,0,0]=3 4783 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2F 38a_100000220357_100000717665 [0,1,1,0,0,0|1,0,0]=3 4784 B17R2.18632 CN(Cc1cn(cn1)C)c2ccccc2O 269982a_100000033821_100000717665 [0,1,1,0,0,0|1,0,0]=3 4785 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2Br 2230a_100020606079_100000024076 [0,1,1,0,0,0|2,0,0]=4 4786 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2Br 269982a_100020606079_100000024076 [0,1,1,0,0,0|2,0,0]=4 4787 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2Br 34a_100020606079_100000024076 [0,1,1,0,0,0|2,0,0]=4 4788 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2Cl 2230a_100000219374_100000024076 [0,1,1,0,0,0|2,0,0]=4 4789 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2Cl 269982a_100000219374_100000024076 [0,1,1,0,0,0|2,0,0]=4 4790 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2Cl 34a_100000219374_100000024076 [0,1,1,0,0,0|2,0,0]=4 4791 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2F 2230a_100000220357_100000024076 [0,1,1,0,0,0|2,0,0]=4 4792 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2F 269982a_100000220357_100000024076 [0,1,1,0,0,0|2,0,0]=4 4793 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2F 34a_100000220357_100000024076 [0,1,1,0,0,0|2,0,0]=4 4794 B17R2.18632 CN(Cc1csc(n1)Cl)c2ccccc2O 269982a_100000033821_100000024076 [0,1,1,0,0,0|2,0,0]=4 4795 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2Br 2230a_100020606079_100016995526 [0,1,1,0,0,0|2,0,0]=4 4796 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2Br 269982a_100020606079_100016995526 [0,1,1,0,0,0|2,0,0]=4 4797 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2Br 34a_100020606079_100016995526 [0,1,1,0,0,0|2,0,0]=4 4798 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2Cl 2230a_100000219374_100016995526 [0,1,1,0,0,0|2,0,0]=4 4799 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2Cl 269982a_100000219374_100016995526 [0,1,1,0,0,0|2,0,0]=4 4800 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2Cl 34a_100000219374_100016995526 [0,1,1,0,0,0|2,0,0]=4 4801 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2F 2230a_100000220357_100016995526 [0,1,1,0,0,0|2,0,0]=4 4802 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2F 269982a_100000220357_100016995526 [0,1,1,0,0,0|2,0,0]=4 4803 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2F 34a_100000220357_100016995526 [0,1,1,0,0,0|2,0,0]=4 4804 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2F 38a_100000220357_100016995526 [0,1,1,0,0,0|2,0,0]=4 4805 B17R2.18632 CN(Cc1ncn(n1)C)c2ccccc2O 269982a_100000033821_100016995526 [0,1,1,0,0,0|2,0,0]=4 4806 B17R2.18632 Cc1cc(no1)CN(C)c2ccccc2C 2230a_100000219699_100000199038 [0,1,1,0,0,0|2,0,0]=4 4807 B17R2.18632 Cc1cc(no1)CN(C)c2ccccc2C 269982a_100000219699_100000199038 [0,1,1,0,0,0|2,0,0]=4 4808 B17R2.18632 Cc1cc(no1)CN(C)c2ccccc2C 34a_100000219699_100000199038 [0,1,1,0,0,0|2,0,0]=4 4809 B17R2.18632 Cc1ccccc1C(=O)Cc2cn(cn2)C 1458a_100000212026_100000717665 [0,1,1,0,0,0|2,0,0]=4 4810 B17R2.18632 Cc1ccccc1N(C)Cc2cc(cs2)Br 2230a_100000219699_100000746031 [0,1,1,0,0,0|2,0,0]=4 4811 B17R2.18632 Cc1ccccc1N(C)Cc2cc(cs2)Br 269982a_100000219699_100000746031 [0,1,1,0,0,0|2,0,0]=4 4812 B17R2.18632 Cc1ccccc1N(C)Cc2cc(cs2)Br 34a_100000219699_100000746031 [0,1,1,0,0,0|2,0,0]=4 4813 B17R2.18632 Cc1ccccc1N(C)Cc2ccc(s2)Br 2230a_100000219699_100000708592 [0,1,1,0,0,0|2,0,0]=4 4814 B17R2.18632 Cc1ccccc1N(C)Cc2ccc(s2)Br 269982a_100000219699_100000708592 [0,1,1,0,0,0|2,0,0]=4 4815 B17R2.18632 Cc1ccccc1N(C)Cc2ccc(s2)Br 34a_100000219699_100000708592 [0,1,1,0,0,0|2,0,0]=4 4816 B17R2.18632 Cc1ccccc1N(C)Cc2ccc(s2)Cl 2230a_100000219699_100000185097 [0,1,1,0,0,0|2,0,0]=4 4817 B17R2.18632 Cc1ccccc1N(C)Cc2ccc(s2)Cl 269982a_100000219699_100000185097 [0,1,1,0,0,0|2,0,0]=4 4818 B17R2.18632 Cc1ccccc1N(C)Cc2ccc(s2)Cl 34a_100000219699_100000185097 [0,1,1,0,0,0|2,0,0]=4 4819 B17R2.18632 Cc1ccccc1N(C)Cc2ccn(n2)C 2230a_100000219699_100000726502 [0,1,1,0,0,0|2,0,0]=4 4820 B17R2.18632 Cc1ccccc1N(C)Cc2ccn(n2)C 269982a_100000219699_100000726502 [0,1,1,0,0,0|2,0,0]=4 4821 B17R2.18632 Cc1ccccc1N(C)Cc2ccn(n2)C 34a_100000219699_100000726502 [0,1,1,0,0,0|2,0,0]=4 4822 B17R2.18632 Cc1ccccc1N(C)Cc2cn(cn2)C 2230a_100000219699_100000717665 [0,1,1,0,0,0|0,0,0]=2 4823 B17R2.18632 Cc1ccccc1N(C)Cc2cn(cn2)C 269982a_100000219699_100000717665 [0,1,1,0,0,0|0,0,0]=2 4824 B17R2.18632 Cc1ccccc1N(C)Cc2cn(cn2)C 34a_100000219699_100000717665 [0,1,1,0,0,0|0,0,0]=2 4825 B17R2.18632 Cc1ccccc1N(C)Cc2cnc(s2)Br 2230a_100000219699_100000717027 [0,1,1,0,0,0|1,0,1]=4 4826 B17R2.18632 Cc1ccccc1N(C)Cc2cnc(s2)Br 269982a_100000219699_100000717027 [0,1,1,0,0,0|1,0,1]=4 4827 B17R2.18632 Cc1ccccc1N(C)Cc2cnc(s2)Br 34a_100000219699_100000717027 [0,1,1,0,0,0|1,0,1]=4 4828 B17R2.18632 Cc1ccccc1N(C)Cc2cnc(s2)Cl 2230a_100000219699_100000058068 [0,1,1,0,0,0|1,0,1]=4 4829 B17R2.18632 Cc1ccccc1N(C)Cc2cnc(s2)Cl 269982a_100000219699_100000058068 [0,1,1,0,0,0|1,0,1]=4 4830 B17R2.18632 Cc1ccccc1N(C)Cc2cnc(s2)Cl 34a_100000219699_100000058068 [0,1,1,0,0,0|1,0,1]=4 4831 B17R2.18632 Cc1ccccc1N(C)Cc2cnn(c2)C 2230a_100000219699_100000744441 [0,1,1,0,0,0|2,0,0]=4 4832 B17R2.18632 Cc1ccccc1N(C)Cc2cnn(c2)C 269982a_100000219699_100000744441 [0,1,1,0,0,0|2,0,0]=4 4833 B17R2.18632 Cc1ccccc1N(C)Cc2cnn(c2)C 34a_100000219699_100000744441 [0,1,1,0,0,0|2,0,0]=4 4834 B17R2.18632 Cc1ccccc1N(C)Cc2csc(n2)Cl 2230a_100000219699_100000024076 [0,1,1,0,0,0|1,0,0]=3 4835 B17R2.18632 Cc1ccccc1N(C)Cc2csc(n2)Cl 269982a_100000219699_100000024076 [0,1,1,0,0,0|1,0,0]=3 4836 B17R2.18632 Cc1ccccc1N(C)Cc2csc(n2)Cl 34a_100000219699_100000024076 [0,1,1,0,0,0|1,0,0]=3 4837 B17R2.18632 Cc1ccccc1N(C)Cc2n[nH]c(=O)[nH]2 2230a_100000219699_100000754189 [0,1,1,0,0,0|1,0,1]=4 4838 B17R2.18632 Cc1ccccc1N(C)Cc2n[nH]c(=O)[nH]2 269982a_100000219699_100000754189 [0,1,1,0,0,0|1,0,1]=4 4839 B17R2.18632 Cc1ccccc1N(C)Cc2ncn(n2)C 2230a_100000219699_100016995526 [0,1,1,0,0,0|1,0,0]=3 4840 B17R2.18632 Cc1ccccc1N(C)Cc2ncn(n2)C 269982a_100000219699_100016995526 [0,1,1,0,0,0|1,0,0]=3 4841 B17R2.18632 Cc1ccccc1N(C)Cc2ncn(n2)C 34a_100000219699_100016995526 [0,1,1,0,0,0|1,0,0]=3 4842 B17R2.18632 Cc1ccccc1N(C)Cc2nsc(n2)Cl 2230a_100000219699_100000043760 [0,1,1,0,0,0|2,0,0]=4 4843 B17R2.18632 Cc1ccccc1N(C)Cc2nsc(n2)Cl 269982a_100000219699_100000043760 [0,1,1,0,0,0|2,0,0]=4 4844 B17R2.18632 Cc1ccccc1N(C)Cc2nsc(n2)Cl 34a_100000219699_100000043760 [0,1,1,0,0,0|2,0,0]=4 4845 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2Br 2230a_100020606079_100015186478 [0,1,1,0,0,0|2,0,0]=4 4846 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2Br 269982a_100020606079_100015186478 [0,1,1,0,0,0|2,0,0]=4 4847 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2Br 34a_100020606079_100015186478 [0,1,1,0,0,0|2,0,0]=4 4848 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2C 2230a_100000219699_100015186478 [0,1,1,0,0,0|1,0,0]=3 4849 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2C 269982a_100000219699_100015186478 [0,1,1,0,0,0|1,0,0]=3 4850 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2C 34a_100000219699_100015186478 [0,1,1,0,0,0|1,0,0]=3 4851 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2Cl 2230a_100000219374_100015186478 [0,1,1,0,0,0|2,0,0]=4 4852 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2Cl 269982a_100000219374_100015186478 [0,1,1,0,0,0|2,0,0]=4 4853 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2Cl 34a_100000219374_100015186478 [0,1,1,0,0,0|2,0,0]=4 4854 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2F 2230a_100000220357_100015186478 [0,1,1,0,0,0|2,0,0]=4 4855 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2F 269982a_100000220357_100015186478 [0,1,1,0,0,0|2,0,0]=4 4856 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2F 34a_100000220357_100015186478 [0,1,1,0,0,0|2,0,0]=4 4857 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2F 38a_100000220357_100015186478 [0,1,1,0,0,0|2,0,0]=4 4858 B17R2.18632 Cc1nc(cs1)CN(C)c2ccccc2O 269982a_100000033821_100015186478 [0,1,1,0,0,0|2,0,0]=4 4859 B17R2.18632 Cc1nc(cs1)CN(C)c2ccncc2C 27a_100000207643_100000765111 [0,1,1,0,0,0|2,0,0]=4 4860 B17R2.18632 Cc1nc(no1)CN(C)c2ccccc2C 2230a_100000219699_100000231061 [0,1,1,0,0,0|2,0,0]=4 4861 B17R2.18632 Cc1nc(no1)CN(C)c2ccccc2C 269982a_100000219699_100000231061 [0,1,1,0,0,0|2,0,0]=4 4862 B17R2.18632 Cc1nc(no1)CN(C)c2ccccc2C 34a_100000219699_100000231061 [0,1,1,0,0,0|2,0,0]=4 4863 B17R2.18632 Cc1ncc(s1)CN(C)c2ccccc2C 2230a_100000219699_100020635045 [0,1,1,0,0,0|1,0,1]=4 4864 B17R2.18632 Cc1ncc(s1)CN(C)c2ccccc2C 269982a_100000219699_100020635045 [0,1,1,0,0,0|1,0,1]=4 4865 B17R2.18632 Cc1ncc(s1)CN(C)c2ccccc2C 34a_100000219699_100020635045 [0,1,1,0,0,0|1,0,1]=4 4866 B17R2.18632 Cc1noc(n1)CN(C)c2ccccc2C 2230a_100000219699_100000735555 [0,1,1,0,0,0|1,0,1]=4 4867 B17R2.18632 Cc1noc(n1)CN(C)c2ccccc2C 269982a_100000219699_100000735555 [0,1,1,0,0,0|1,0,1]=4 4868 B17R2.18632 Cc1noc(n1)CN(C)c2ccccc2C 34a_100000219699_100000735555 [0,1,1,0,0,0|1,0,1]=4 4869 B17R2.37118 Cc1[nH]cnc1CN(C)c2ccccc2Br 2230a_100020606079_100000751220 [0,1,1,0,0,0|1,0,0]=3 4870 B17R2.37118 Cc1[nH]cnc1CN(C)c2ccccc2Br 269982a_100020606079_100000751220 [0,1,1,0,0,0|1,0,0]=3 4871 B17R2.37118 Cc1[nH]cnc1CN(C)c2ccccc2Cl 2230a_100000219374_100000751220 [0,1,1,0,0,0|1,0,0]=3 4872 B17R2.37118 Cc1[nH]cnc1CN(C)c2ccccc2Cl 269982a_100000219374_100000751220 [0,1,1,0,0,0|1,0,0]=3 4873 B17R2.37118 Cc1[nH]cnc1CN(C)c2ccccc2F 2230a_100000220357_100000751220 [0,1,1,0,0,0|1,0,0]=3 4874 B17R2.37118 Cc1[nH]cnc1CN(C)c2ccccc2F 269982a_100000220357_100000751220 [0,1,1,0,0,0|1,0,0]=3 4875 B17R2.37118 Cc1[nH]cnc1CN(C)c2ccccc2F 38a_100000220357_100000751220 [0,1,1,0,0,0|1,0,0]=3 4876 B17R2.37118 Cc1[nH]cnc1CN(C)c2ccccc2O 269982a_100000033821_100000751220 [0,1,1,0,0,0|1,0,0]=3 4877 B17R2.37118 Cc1ccccc1C(=O)Cc2nc[nH]c2C 1458a_100000212026_100000751220 [0,1,1,0,0,0|2,0,0]=4 4878 B17R2.37118 Cc1ccccc1N(C)Cc2ccsc2Br 2230a_100000219699_100009814289 [0,1,1,0,0,0|2,0,0]=4 4879 B17R2.37118 Cc1ccccc1N(C)Cc2ccsc2Br 269982a_100000219699_100009814289 [0,1,1,0,0,0|2,0,0]=4 4880 B17R2.37118 Cc1ccccc1N(C)Cc2ccsc2Br 34a_100000219699_100009814289 [0,1,1,0,0,0|2,0,0]=4 4881 B17R2.37118 Cc1ccccc1N(C)Cc2ccsc2Cl 2230a_100000219699_100010167017 [0,1,1,0,0,0|2,0,0]=4 4882 B17R2.37118 Cc1ccccc1N(C)Cc2ccsc2Cl 269982a_100000219699_100010167017 [0,1,1,0,0,0|2,0,0]=4 4883 B17R2.37118 Cc1ccccc1N(C)Cc2ccsc2Cl 34a_100000219699_100010167017 [0,1,1,0,0,0|2,0,0]=4 4884 B17R2.37118 Cc1ccccc1N(C)Cc2nc[nH]c2C 2230a_100000219699_100000751220 [0,1,1,0,0,0|0,0,0]=2 4885 B17R2.37118 Cc1ccccc1N(C)Cc2nc[nH]c2C 269982a_100000219699_100000751220 [0,1,1,0,0,0|0,0,0]=2 4886 B17R2.37118 Cc1ccccc1N(C)Cc2nccn2C 2230a_100000219699_100000700302 [0,1,1,0,0,0|2,0,0]=4 4887 B17R2.37118 Cc1ccccc1N(C)Cc2nccn2C 269982a_100000219699_100000700302 [0,1,1,0,0,0|2,0,0]=4 4888 B17R2.37118 Cc1ccccc1N(C)Cc2nccn2C 34a_100000219699_100000700302 [0,1,1,0,0,0|2,0,0]=4 4889 B17R2.37118 Cc1ccccc1N(C)Cc2ncoc2C 2230a_100000219699_200000693990 [0,1,1,0,0,0|1,0,0]=3 4890 B17R2.37118 Cc1ccccc1N(C)Cc2ncoc2C 34a_100000219699_200000693990 [0,1,1,0,0,0|1,0,0]=3 4891 B17R2.37118 Cc1ccccc1N(C)Cc2nnsc2Cl 2230a_100000219699_100000018852 [0,1,1,0,0,0|2,0,0]=4 4892 B17R2.37118 Cc1ccccc1N(C)Cc2nnsc2Cl 269982a_100000219699_100000018852 [0,1,1,0,0,0|2,0,0]=4 4893 B17R2.37118 Cc1ccccc1N(C)Cc2nonc2C 2230a_100000219699_200000044682 [0,1,1,0,0,0|1,0,1]=4 4894 B17R2.37118 Cc1ccccc1N(C)Cc2nonc2C 269982a_100000219699_200000044682 [0,1,1,0,0,0|1,0,1]=4 4895 B17R2.37118 Cc1ccccc1N(C)Cc2nonc2C 34a_100000219699_200000044682 [0,1,1,0,0,0|1,0,1]=4 4896 B17R2.37118 Cc1ocnc1CN(C)c2ccccc2Br 2230a_100020606079_200000693990 [0,1,1,0,0,0|2,0,0]=4 4897 B17R2.37118 Cc1ocnc1CN(C)c2ccccc2Br 34a_100020606079_200000693990 [0,1,1,0,0,0|2,0,0]=4 4898 B17R2.37118 Cc1ocnc1CN(C)c2ccccc2Cl 2230a_100000219374_200000693990 [0,1,1,0,0,0|2,0,0]=4 4899 B17R2.37118 Cc1ocnc1CN(C)c2ccccc2Cl 34a_100000219374_200000693990 [0,1,1,0,0,0|2,0,0]=4 4900 B17R2.37118 Cc1ocnc1CN(C)c2ccccc2F 2230a_100000220357_200000693990 [0,1,1,0,0,0|2,0,0]=4 4901 B17R2.37118 Cc1ocnc1CN(C)c2ccccc2F 34a_100000220357_200000693990 [0,1,1,0,0,0|2,0,0]=4 4902 B17R2.37118 Cc1ocnc1CN(C)c2ccccc2F 38a_100000220357_200000693990 [0,1,1,0,0,0|2,0,0]=4 4903 B17R2.41886 CN(Cc1c[nH]cn1)c2c(cccc2Cl)Cl 269982a_100000691019_100000707719 [0,1,1,0,0,0|1,0,0]=3 4904 B17R2.41886 CN(Cc1c[nH]cn1)c2c(cccc2Cl)Cl 34a_100000691019_100000707719 [0,1,1,0,0,0|1,0,0]=3 4905 B17R2.41886 CN(Cc1c[nH]cn1)c2c(cccc2F)F 2230a_100000743377_100000707719 [0,1,1,0,0,0|1,0,0]=3 4906 B17R2.41886 CN(Cc1c[nH]cn1)c2c(cccc2F)F 269982a_100000743377_100000707719 [0,1,1,0,0,0|1,0,0]=3 4907 B17R2.41886 CN(Cc1c[nH]cn1)c2c(cccc2F)F 34a_100000743377_100000707719 [0,1,1,0,0,0|1,0,0]=3 4908 B17R2.41886 CN(Cc1c[nH]cn1)c2c(cccc2F)F 38a_100000743377_100000707719 [0,1,1,0,0,0|1,0,0]=3 4909 B17R2.41886 CN(Cc1cscn1)c2c(cccc2Cl)Cl 269982a_100000691019_100000205941 [0,1,1,0,0,0|2,0,0]=4 4910 B17R2.41886 CN(Cc1cscn1)c2c(cccc2Cl)Cl 34a_100000691019_100000205941 [0,1,1,0,0,0|2,0,0]=4 4911 B17R2.41886 CN(Cc1cscn1)c2c(cccc2F)F 2230a_100000743377_100000205941 [0,1,1,0,0,0|2,0,0]=4 4912 B17R2.41886 CN(Cc1cscn1)c2c(cccc2F)F 269982a_100000743377_100000205941 [0,1,1,0,0,0|2,0,0]=4 4913 B17R2.41886 CN(Cc1cscn1)c2c(cccc2F)F 34a_100000743377_100000205941 [0,1,1,0,0,0|2,0,0]=4 4914 B17R2.41886 Cc1cccc(c1C(=O)Cc2c[nH]cn2)Br 1458a_100000701904_100000707719 [0,1,1,0,0,0|2,0,0]=4 4915 B17R2.41886 Cc1cccc(c1C(=O)Cc2c[nH]cn2)C 1458a_100000758298_100000707719 [0,1,1,0,0,0|2,0,0]=4 4916 B17R2.41886 Cc1cccc(c1C(=O)Cc2c[nH]cn2)Cl 1458a_100000692601_100000707719 [0,1,1,0,0,0|2,0,0]=4 4917 B17R2.41886 Cc1cccc(c1C(=O)Cc2c[nH]cn2)F 1458a_100000762013_100000707719 [0,1,1,0,0,0|2,0,0]=4 4918 B17R2.41886 Cc1cccc(c1C(=O)Cc2c[nH]cn2)I 1458a_100000688020_100000707719 [0,1,1,0,0,0|2,0,0]=4 4919 B17R2.41886 Cc1cccc(c1C(=O)Cc2c[nH]cn2)O 1458a_100011934116_100000707719 [0,1,1,0,0,0|2,0,0]=4 4920 B17R2.41886 Cc1cccc(c1N(C)Cc2c[nH]cn2)C 2230a_100011645471_100000707719 [0,1,1,0,0,0|0,0,0]=2 4921 B17R2.41886 Cc1cccc(c1N(C)Cc2c[nH]cn2)C 269982a_100011645471_100000707719 [0,1,1,0,0,0|0,0,0]=2 4922 B17R2.41886 Cc1cccc(c1N(C)Cc2c[nH]cn2)C 34a_100011645471_100000707719 [0,1,1,0,0,0|0,0,0]=2 4923 B17R2.41886 Cc1cccc(c1N(C)Cc2ccon2)C 2230a_100011645471_100000234950 [0,1,1,0,0,0|2,0,0]=4 4924 B17R2.41886 Cc1cccc(c1N(C)Cc2ccon2)C 269982a_100011645471_100000234950 [0,1,1,0,0,0|2,0,0]=4 4925 B17R2.41886 Cc1cccc(c1N(C)Cc2ccon2)C 34a_100011645471_100000234950 [0,1,1,0,0,0|2,0,0]=4 4926 B17R2.41886 Cc1cccc(c1N(C)Cc2ccsc2)C 2230a_100011645471_100011261437 [0,1,1,0,0,0|2,0,0]=4 4927 B17R2.41886 Cc1cccc(c1N(C)Cc2ccsc2)C 269982a_100011645471_100011233845 [0,1,1,0,0,0|2,0,0]=4 4928 B17R2.41886 Cc1cccc(c1N(C)Cc2ccsc2)C 34a_100011645471_100011261437 [0,1,1,0,0,0|2,0,0]=4 4929 B17R2.41886 Cc1cccc(c1N(C)Cc2cncs2)C 2230a_100011645471_100015185245 [0,1,1,0,0,0|1,0,1]=4 4930 B17R2.41886 Cc1cccc(c1N(C)Cc2cncs2)C 269982a_100011645471_100015185245 [0,1,1,0,0,0|1,0,1]=4 4931 B17R2.41886 Cc1cccc(c1N(C)Cc2cncs2)C 34a_100011645471_100015185245 [0,1,1,0,0,0|1,0,1]=4 4932 B17R2.41886 Cc1cccc(c1N(C)Cc2cscn2)C 2230a_100011645471_100000205941 [0,1,1,0,0,0|1,0,0]=3 4933 B17R2.41886 Cc1cccc(c1N(C)Cc2cscn2)C 269982a_100011645471_100000205941 [0,1,1,0,0,0|1,0,0]=3 4934 B17R2.41886 Cc1cccc(c1N(C)Cc2cscn2)C 34a_100011645471_100000205941 [0,1,1,0,0,0|1,0,0]=3 4935 B17R2.41886 Cc1cccc(c1N(C)Cc2ncc[nH]2)C 2230a_100011645471_100016991755 [0,1,1,0,0,0|2,0,0]=4 4936 B17R2.41886 Cc1cccc(c1N(C)Cc2ncc[nH]2)C 269982a_100011645471_100016991755 [0,1,1,0,0,0|2,0,0]=4 4937 B17R2.41886 Cc1cccc(c1N(C)Cc2ncc[nH]2)C 34a_100011645471_100016991755 [0,1,1,0,0,0|2,0,0]=4 4938 B17R2.41886 Cc1cccc(c1N(C)Cc2ncco2)C 2230a_100011645471_103436540062 [0,1,1,0,0,0|2,0,0]=4 4939 B17R2.41886 Cc1cccc(c1N(C)Cc2ncco2)C 269982a_100011645471_103436540062 [0,1,1,0,0,0|2,0,0]=4 4940 B17R2.41886 Cc1cccc(c1N(C)Cc2ncco2)C 34a_100011645471_103436540062 [0,1,1,0,0,0|2,0,0]=4 4941 B17R2.41886 Cc1cccc(c1N(C)Cc2nccs2)C 2230a_100011645471_100015184050 [0,1,1,0,0,0|2,0,0]=4 4942 B17R2.41886 Cc1cccc(c1N(C)Cc2nccs2)C 269982a_100011645471_100015184050 [0,1,1,0,0,0|2,0,0]=4 4943 B17R2.41886 Cc1cccc(c1N(C)Cc2nccs2)C 34a_100011645471_100015184050 [0,1,1,0,0,0|2,0,0]=4 4944 B17R2.41886 Cc1cccc(c1N(C)Cc2ncon2)C 269982a_100011645471_100000233494 [0,1,1,0,0,0|2,0,0]=4 4945 B17R2.41886 Cc1cccc(c1N(C)Cc2ncon2)C 34a_100011645471_100000233494 [0,1,1,0,0,0|2,0,0]=4 4946 B17R2.41886 Cc1cccc(c1N(C)Cn2cncn2)C 2230a_100011645471_200020645497 [0,1,1,0,0,0|1,0,1]=4 4947 B17R2.41886 Cc1cccc(c1N(C)Cn2cncn2)C 269982a_100011645471_200020645497 [0,1,1,0,0,0|1,0,1]=4 4948 B17R2.41886 Cc1cccc(c1N(C)Cn2cncn2)C 34a_100011645471_200020645497 [0,1,1,0,0,0|1,0,1]=4 4949 B17R2.41886 Cc1ccnc(c1N(C)Cc2cscn2)F 27a_100000225794_100009818256 [0,1,1,0,0,0|2,0,0]=4 4950 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Br)Cl 269982a_100020633006_100000707719 [0,1,1,0,0,0|1,0,0]=3 4951 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Br)Cl 34a_100020633006_100000707719 [0,1,1,0,0,0|1,0,0]=3 4952 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Br)F 2230a_100020633008_100000707719 [0,1,1,0,0,0|1,0,0]=3 4953 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Br)F 269982a_100020633008_100000707719 [0,1,1,0,0,0|1,0,0]=3 4954 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Br)F 34a_100020633008_100000707719 [0,1,1,0,0,0|1,0,0]=3 4955 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Cl)Br 269982a_100011772073_100000707719 [0,1,1,0,0,0|1,0,0]=3 4956 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Cl)Br 34a_100011772073_100000707719 [0,1,1,0,0,0|1,0,0]=3 4957 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Cl)Cl 269982a_100000742562_100000707719 [0,1,1,0,0,0|1,0,0]=3 4958 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2Cl)Cl 34a_100000742562_100000707719 [0,1,1,0,0,0|1,0,0]=3 4959 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2F)Br 2230a_100011314990_100000707719 [0,1,1,0,0,0|1,0,0]=3 4960 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2F)Br 269982a_100011314990_100000707719 [0,1,1,0,0,0|1,0,0]=3 4961 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2F)Br 34a_100011314990_100000707719 [0,1,1,0,0,0|1,0,0]=3 4962 B17R2.42552 CN(Cc1c[nH]cn1)c2cc(ccc2F)Br 38a_100011314990_100000707719 [0,1,1,0,0,0|1,0,0]=3 4963 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Br)Cl 269982a_100020633006_100000205941 [0,1,1,0,0,0|2,0,0]=4 4964 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Br)Cl 34a_100020633006_100000205941 [0,1,1,0,0,0|2,0,0]=4 4965 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Br)F 2230a_100020633008_100000205941 [0,1,1,0,0,0|2,0,0]=4 4966 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Br)F 269982a_100020633008_100000205941 [0,1,1,0,0,0|2,0,0]=4 4967 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Br)F 34a_100020633008_100000205941 [0,1,1,0,0,0|2,0,0]=4 4968 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Cl)Br 269982a_100011772073_100000205941 [0,1,1,0,0,0|2,0,0]=4 4969 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Cl)Br 34a_100011772073_100000205941 [0,1,1,0,0,0|2,0,0]=4 4970 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Cl)Cl 269982a_100000742562_100000205941 [0,1,1,0,0,0|2,0,0]=4 4971 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2Cl)Cl 34a_100000742562_100000205941 [0,1,1,0,0,0|2,0,0]=4 4972 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2F)Br 2230a_100011314990_100000205941 [0,1,1,0,0,0|2,0,0]=4 4973 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2F)Br 269982a_100011314990_100000205941 [0,1,1,0,0,0|2,0,0]=4 4974 B17R2.42552 CN(Cc1cscn1)c2cc(ccc2F)Br 34a_100011314990_100000205941 [0,1,1,0,0,0|2,0,0]=4 4975 B17R2.42552 Cc1ccc(c(c1)C(=O)Cc2c[nH]cn2)C 1458a_100000195421_100000707719 [0,1,1,0,0,0|2,0,0]=4 4976 B17R2.42552 Cc1ccc(cc1C(=O)Cc2c[nH]cn2)Br 1458a_100000759961_100000707719 [0,1,1,0,0,0|2,0,0]=4 4977 B17R2.42552 Cc1ccc(cc1C(=O)Cc2c[nH]cn2)Cl 1458a_100000692595_100000707719 [0,1,1,0,0,0|2,0,0]=4 4978 B17R2.42552 Cc1ccc(cc1C(=O)Cc2c[nH]cn2)F 1458a_100000240043_100000707719 [0,1,1,0,0,0|2,0,0]=4 4979 B17R2.42552 Cc1ccc(cc1C(=O)Cc2c[nH]cn2)I 1458a_100000688012_100000707719 [0,1,1,0,0,0|2,0,0]=4 4980 B17R2.42552 Cc1ccc(cc1C(=O)Cc2c[nH]cn2)O 1458a_100000687834_100000707719 [0,1,1,0,0,0|2,0,0]=4 4981 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)Br 2230a_100020629602_100000707719 [0,1,1,0,0,0|0,0,0]=2 4982 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)Br 269982a_100020629602_100000707719 [0,1,1,0,0,0|0,0,0]=2 4983 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)Br 34a_100020629602_100000707719 [0,1,1,0,0,0|0,0,0]=2 4984 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)Br 38a_100020629602_100000707719 [0,1,1,0,0,0|0,0,0]=2 4985 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)Cl 2230a_100000221440_100000707719 [0,1,1,0,0,0|0,0,0]=2 4986 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)Cl 269982a_100000221440_100000707719 [0,1,1,0,0,0|0,0,0]=2 4987 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)Cl 34a_100000221440_100000707719 [0,1,1,0,0,0|0,0,0]=2 4988 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)Cl 38a_100000221440_100000707719 [0,1,1,0,0,0|0,0,0]=2 4989 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)F 2230a_114849113390_100000707719 [0,1,1,0,0,0|0,0,0]=2 4990 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)F 269982a_114849113390_100000707719 [0,1,1,0,0,0|0,0,0]=2 4991 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)F 34a_114849113390_100000707719 [0,1,1,0,0,0|0,0,0]=2 4992 B17R2.42552 Cc1ccc(cc1N(C)Cc2c[nH]cn2)F 38a_114849113390_100000707719 [0,1,1,0,0,0|0,0,0]=2 4993 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)Br 2230a_100020629602_100000234950 [0,1,1,0,0,0|2,0,0]=4 4994 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)Br 269982a_100020629602_100000234950 [0,1,1,0,0,0|2,0,0]=4 4995 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)Br 34a_100020629602_100000234950 [0,1,1,0,0,0|2,0,0]=4 4996 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)Br 38a_100020629602_100000234950 [0,1,1,0,0,0|2,0,0]=4 4997 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)Cl 2230a_100000221440_100000234950 [0,1,1,0,0,0|2,0,0]=4 4998 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)Cl 269982a_100000221440_100000234950 [0,1,1,0,0,0|2,0,0]=4 4999 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)Cl 34a_100000221440_100000234950 [0,1,1,0,0,0|2,0,0]=4 5000 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)Cl 38a_100000221440_100000234950 [0,1,1,0,0,0|2,0,0]=4 5001 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)F 2230a_114849113390_100000234950 [0,1,1,0,0,0|2,0,0]=4 5002 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)F 269982a_114849113390_100000234950 [0,1,1,0,0,0|2,0,0]=4 5003 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)F 34a_114849113390_100000234950 [0,1,1,0,0,0|2,0,0]=4 5004 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccon2)F 38a_114849113390_100000234950 [0,1,1,0,0,0|2,0,0]=4 5005 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)Br 2230a_100020629602_100011261437 [0,1,1,0,0,0|2,0,0]=4 5006 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)Br 269982a_100020629602_100011233845 [0,1,1,0,0,0|2,0,0]=4 5007 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)Br 34a_100020629602_100011261437 [0,1,1,0,0,0|2,0,0]=4 5008 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)Br 38a_100020629602_100011233845 [0,1,1,0,0,0|2,0,0]=4 5009 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)Cl 2230a_100000221440_100011261437 [0,1,1,0,0,0|2,0,0]=4 5010 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)Cl 269982a_100000221440_100011233845 [0,1,1,0,0,0|2,0,0]=4 5011 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)Cl 34a_100000221440_100011261437 [0,1,1,0,0,0|2,0,0]=4 5012 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)Cl 38a_100000221440_100011233845 [0,1,1,0,0,0|2,0,0]=4 5013 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)F 2230a_114849113390_100011261437 [0,1,1,0,0,0|2,0,0]=4 5014 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)F 269982a_114849113390_100011233845 [0,1,1,0,0,0|2,0,0]=4 5015 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)F 34a_114849113390_100011261437 [0,1,1,0,0,0|2,0,0]=4 5016 B17R2.42552 Cc1ccc(cc1N(C)Cc2ccsc2)F 38a_114849113390_100011233845 [0,1,1,0,0,0|2,0,0]=4 5017 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)Br 2230a_100020629602_100015185245 [0,1,1,0,0,0|1,0,1]=4 5018 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)Br 269982a_100020629602_100015185245 [0,1,1,0,0,0|1,0,1]=4 5019 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)Br 34a_100020629602_100015185245 [0,1,1,0,0,0|1,0,1]=4 5020 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)Cl 2230a_100000221440_100015185245 [0,1,1,0,0,0|1,0,1]=4 5021 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)Cl 269982a_100000221440_100015185245 [0,1,1,0,0,0|1,0,1]=4 5022 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)Cl 34a_100000221440_100015185245 [0,1,1,0,0,0|1,0,1]=4 5023 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)F 2230a_114849113390_100015185245 [0,1,1,0,0,0|1,0,1]=4 5024 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)F 269982a_114849113390_100015185245 [0,1,1,0,0,0|1,0,1]=4 5025 B17R2.42552 Cc1ccc(cc1N(C)Cc2cncs2)F 34a_114849113390_100015185245 [0,1,1,0,0,0|1,0,1]=4 5026 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)Br 2230a_100020629602_100000205941 [0,1,1,0,0,0|1,0,0]=3 5027 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)Br 269982a_100020629602_100000205941 [0,1,1,0,0,0|1,0,0]=3 5028 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)Br 34a_100020629602_100000205941 [0,1,1,0,0,0|1,0,0]=3 5029 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)Cl 2230a_100000221440_100000205941 [0,1,1,0,0,0|1,0,0]=3 5030 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)Cl 269982a_100000221440_100000205941 [0,1,1,0,0,0|1,0,0]=3 5031 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)Cl 34a_100000221440_100000205941 [0,1,1,0,0,0|1,0,0]=3 5032 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)F 2230a_114849113390_100000205941 [0,1,1,0,0,0|1,0,0]=3 5033 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)F 269982a_114849113390_100000205941 [0,1,1,0,0,0|1,0,0]=3 5034 B17R2.42552 Cc1ccc(cc1N(C)Cc2cscn2)F 34a_114849113390_100000205941 [0,1,1,0,0,0|1,0,0]=3 5035 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)Br 2230a_100020629602_100016991755 [0,1,1,0,0,0|2,0,0]=4 5036 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)Br 269982a_100020629602_100016991755 [0,1,1,0,0,0|2,0,0]=4 5037 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)Br 34a_100020629602_100016991755 [0,1,1,0,0,0|2,0,0]=4 5038 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)Br 38a_100020629602_100016991755 [0,1,1,0,0,0|2,0,0]=4 5039 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)Cl 2230a_100000221440_100016991755 [0,1,1,0,0,0|2,0,0]=4 5040 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)Cl 269982a_100000221440_100016991755 [0,1,1,0,0,0|2,0,0]=4 5041 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)Cl 34a_100000221440_100016991755 [0,1,1,0,0,0|2,0,0]=4 5042 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)Cl 38a_100000221440_100016991755 [0,1,1,0,0,0|2,0,0]=4 5043 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)F 2230a_114849113390_100016991755 [0,1,1,0,0,0|2,0,0]=4 5044 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)F 269982a_114849113390_100016991755 [0,1,1,0,0,0|2,0,0]=4 5045 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)F 34a_114849113390_100016991755 [0,1,1,0,0,0|2,0,0]=4 5046 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncc[nH]2)F 38a_114849113390_100016991755 [0,1,1,0,0,0|2,0,0]=4 5047 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)Br 2230a_100020629602_103436540062 [0,1,1,0,0,0|2,0,0]=4 5048 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)Br 269982a_100020629602_103436540062 [0,1,1,0,0,0|2,0,0]=4 5049 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)Br 34a_100020629602_103436540062 [0,1,1,0,0,0|2,0,0]=4 5050 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)Br 38a_100020629602_103436540062 [0,1,1,0,0,0|2,0,0]=4 5051 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)Cl 2230a_100000221440_103436540062 [0,1,1,0,0,0|2,0,0]=4 5052 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)Cl 269982a_100000221440_103436540062 [0,1,1,0,0,0|2,0,0]=4 5053 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)Cl 34a_100000221440_103436540062 [0,1,1,0,0,0|2,0,0]=4 5054 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)Cl 38a_100000221440_103436540062 [0,1,1,0,0,0|2,0,0]=4 5055 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)F 2230a_114849113390_103436540062 [0,1,1,0,0,0|2,0,0]=4 5056 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)F 269982a_114849113390_103436540062 [0,1,1,0,0,0|2,0,0]=4 5057 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)F 34a_114849113390_103436540062 [0,1,1,0,0,0|2,0,0]=4 5058 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncco2)F 38a_114849113390_103436540062 [0,1,1,0,0,0|2,0,0]=4 5059 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)Br 2230a_100020629602_100015184050 [0,1,1,0,0,0|2,0,0]=4 5060 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)Br 269982a_100020629602_100015184050 [0,1,1,0,0,0|2,0,0]=4 5061 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)Br 34a_100020629602_100015184050 [0,1,1,0,0,0|2,0,0]=4 5062 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)Br 38a_100020629602_100015184050 [0,1,1,0,0,0|2,0,0]=4 5063 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)Cl 2230a_100000221440_100015184050 [0,1,1,0,0,0|2,0,0]=4 5064 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)Cl 269982a_100000221440_100015184050 [0,1,1,0,0,0|2,0,0]=4 5065 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)Cl 34a_100000221440_100015184050 [0,1,1,0,0,0|2,0,0]=4 5066 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)Cl 38a_100000221440_100015184050 [0,1,1,0,0,0|2,0,0]=4 5067 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)F 2230a_114849113390_100015184050 [0,1,1,0,0,0|2,0,0]=4 5068 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)F 269982a_114849113390_100015184050 [0,1,1,0,0,0|2,0,0]=4 5069 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)F 34a_114849113390_100015184050 [0,1,1,0,0,0|2,0,0]=4 5070 B17R2.42552 Cc1ccc(cc1N(C)Cc2nccs2)F 38a_114849113390_100015184050 [0,1,1,0,0,0|2,0,0]=4 5071 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)Br 269982a_100020629602_100000233494 [0,1,1,0,0,0|2,0,0]=4 5072 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)Br 34a_100020629602_100000233494 [0,1,1,0,0,0|2,0,0]=4 5073 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)Br 38a_100020629602_100000233494 [0,1,1,0,0,0|2,0,0]=4 5074 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)Cl 269982a_100000221440_100000233494 [0,1,1,0,0,0|2,0,0]=4 5075 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)Cl 34a_100000221440_100000233494 [0,1,1,0,0,0|2,0,0]=4 5076 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)Cl 38a_100000221440_100000233494 [0,1,1,0,0,0|2,0,0]=4 5077 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)F 269982a_114849113390_100000233494 [0,1,1,0,0,0|2,0,0]=4 5078 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)F 34a_114849113390_100000233494 [0,1,1,0,0,0|2,0,0]=4 5079 B17R2.42552 Cc1ccc(cc1N(C)Cc2ncon2)F 38a_114849113390_100000233494 [0,1,1,0,0,0|2,0,0]=4 5080 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)Br 2230a_100020629602_200020645497 [0,1,1,0,0,0|1,0,1]=4 5081 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)Br 269982a_100020629602_200020645497 [0,1,1,0,0,0|1,0,1]=4 5082 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)Br 34a_100020629602_200020645497 [0,1,1,0,0,0|1,0,1]=4 5083 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)Br 38a_100020629602_200020645497 [0,1,1,0,0,0|1,0,1]=4 5084 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)Cl 2230a_100000221440_200020645497 [0,1,1,0,0,0|1,0,1]=4 5085 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)Cl 269982a_100000221440_200020645497 [0,1,1,0,0,0|1,0,1]=4 5086 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)Cl 34a_100000221440_200020645497 [0,1,1,0,0,0|1,0,1]=4 5087 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)Cl 38a_100000221440_200020645497 [0,1,1,0,0,0|1,0,1]=4 5088 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)F 2230a_114849113390_200020645497 [0,1,1,0,0,0|1,0,1]=4 5089 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)F 269982a_114849113390_200020645497 [0,1,1,0,0,0|1,0,1]=4 5090 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)F 34a_114849113390_200020645497 [0,1,1,0,0,0|1,0,1]=4 5091 B17R2.42552 Cc1ccc(cc1N(C)Cn2cncn2)F 38a_114849113390_200020645497 [0,1,1,0,0,0|1,0,1]=4 5092 B17R2.42552 Cc1cnc(cc1N(C)Cc2cscn2)F 27a_100000225794_100000049870 [0,1,1,0,0,0|2,0,0]=4 5093 B17R3.2396 Cc1nc(c[nH]1)SC2Cc3c2cccc3 62a_100009813401_100009814057 [0,1,0,0,1,0|2,0,0]=4 5094 B17R3.2396 Cc1nc(c[nH]1)SC2Cc3c2cccc3 62a_100009814057_100009813401 [0,1,0,0,1,0|2,0,0]=4 5095 B17R3.2396 Cn1cnc(c1)SC2Cc3c2cccc3 62a_100000040308_100009813401 [0,1,0,0,1,0|2,0,0]=4 5096 B17R3.2396 Cn1cnc(c1)SC2Cc3c2cccc3 62a_100009813401_100000040308 [0,1,0,0,1,0|2,0,0]=4 5097 B17R3.4699 Cc1[nH]cnc1SC2Cc3c2cccc3 62a_100009813401_100010186451 [0,1,0,0,1,0|2,0,0]=4 5098 B17R3.4699 Cc1[nH]cnc1SC2Cc3c2cccc3 62a_100010186451_100009813401 [0,1,0,0,1,0|2,0,0]=4 5099 B19R3.434 O=c1ncc(c[nH]1)SC2CCc3c2cccc3 62a_102495366499_200000721974 [0,1,0,0,0,1|2,0,0]=4 5100 B19R3.9780 O=c1cc(nc[nH]1)SC2CCc3c2cccc3 62a_100012002517_200000721974 [0,1,0,0,0,1|2,0,0]=4 5101 B19R3.9780 O=c1nc(cc[nH]1)N[C@H]2CCc3c2cccc3 27a_100016989578_200000134032 [0,1,0,0,0,1|2,0,0]=4 5102 B19R3.2488 CC(N[C@H]1CCc2c1cccc2)c3cc[nH]c3 269862a_100016989578_100000753940 [0,1,0,0,0,1|2,0,0]=4 5103 B19R3.2488 CC(N[C@H]1CCc2c1cccc2)c3cscn3 269862a_100016989578_100000693406 [0,1,0,0,0,1|2,0,0]=4 5104 B19R3.3759 Brc1nc(cs1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100009816748 [0,1,0,0,0,1|2,0,0]=4 5105 B19R3.3759 Cc1nc(c[nH]1)CNC2COc3c2cccc3 207a_100000747519_100011219055 [0,1,0,0,0,1|2,0,0]=4 5106 B19R3.3759 Cc1nc(c[nH]1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100011219055 [0,1,0,0,0,1|1,0,0]=3 5107 B19R3.3759 Cc1nc(c[nH]1)SCn2nnc3c2cccc3 62a_100009814057_100000033166 [0,1,0,0,0,1|2,0,0]=4 5108 B19R3.3759 Cc1nc(co1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100011361629 [0,1,0,0,0,1|2,0,0]=4 5109 B19R3.3759 Cc1nc(co1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100011361629 [0,1,0,0,0,1|2,0,0]=4 5110 B19R3.3759 Cc1nc(cs1)CNC2CCc3c2cccc3 269862a_100000707933_100000212051 [0,1,0,0,0,1|2,0,0]=4 5111 B19R3.3759 Cc1nc(cs1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100000203724 [0,1,0,0,0,1|2,0,0]=4 5112 B19R3.3759 Cc1nc(cs1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100015186478 [0,1,0,0,0,1|2,0,0]=4 5113 B19R3.3759 Cc1nc(cs1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100000203724 [0,1,0,0,0,1|2,0,0]=4 5114 B19R3.3759 Cc1nc(cs1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100015186478 [0,1,0,0,0,1|2,0,0]=4 5115 B19R3.3759 Cc1nc(cs1)COC2CCc3c2cccc3 34a_100000212247_100015186478 [0,1,0,0,0,1|2,0,0]=4 5116 B19R3.3759 Cc1nc(cs1)COC2CCc3c2cccc3 7a_100000212247_100015186478 [0,1,0,0,0,1|2,0,0]=4 5117 B19R3.3759 Cc1nc(cs1)CSC2CCc3c2cccc3 62a_100015186478_200000721974 [0,1,0,0,0,1|2,0,0]=4 5118 B19R3.3759 Cc1nc(n[nH]1)CNC2CCc3c2cccc3 2230a_100000752542_200000721974 [0,1,0,0,0,1|2,0,0]=4 5119 B19R3.3759 Clc1nc(cs1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100000024076 [0,1,0,0,0,1|2,0,0]=4 5120 B19R3.3759 Clc1nc(cs1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100011935135 [0,1,0,0,0,1|2,0,0]=4 5121 B19R3.3759 Clc1nc(cs1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100000024076 [0,1,0,0,0,1|2,0,0]=4 5122 B19R3.3759 Clc1nc(cs1)COC2CCc3c2cccc3 34a_100000212247_100000024076 [0,1,0,0,0,1|2,0,0]=4 5123 B19R3.3759 Clc1nc(cs1)COC2CCc3c2cccc3 7a_100000212247_100000024076 [0,1,0,0,0,1|2,0,0]=4 5124 B19R3.3759 Clc1nc(cs1)CSC2CCc3c2cccc3 62a_100000024076_200000721974 [0,1,0,0,0,1|2,0,0]=4 5125 B19R3.3759 Cn1cc(nn1)CNC2CCc3c2cccc3 274090a_200000210301_100000740409 [0,1,0,0,0,1|2,0,0]=4 5126 B19R3.3759 Cn1cc(nn1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100000749909 [0,1,0,0,0,1|2,0,0]=4 5127 B19R3.3759 Cn1cc(nn1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100000749909 [0,1,0,0,0,1|2,0,0]=4 5128 B19R3.3759 Cn1cnc(c1)CNC2CCc3c2cccc3 269862a_100011834058_100000212051 [0,1,0,0,0,1|1,0,0]=3 5129 B19R3.3759 Cn1cnc(c1)CNC2COc3c2cccc3 207a_100000747519_100000684808 [0,1,0,0,0,1|2,0,0]=4 5130 B19R3.3759 Cn1cnc(c1)CNC2COc3c2cccc3 2230a_100000747519_100000717665 [0,1,0,0,0,1|2,0,0]=4 5131 B19R3.3759 Cn1cnc(c1)CNC2COc3c2cccc3 270004a_100000747519_100000684808 [0,1,0,0,0,1|2,0,0]=4 5132 B19R3.3759 Cn1cnc(c1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100000684808 [0,1,0,0,0,1|1,0,0]=3 5133 B19R3.3759 Cn1cnc(c1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100000717665 [0,1,0,0,0,1|1,0,0]=3 5134 B19R3.3759 Cn1cnc(c1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100000684808 [0,1,0,0,0,1|1,0,0]=3 5135 B19R3.3759 Cn1cnc(c1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100000717665 [0,1,0,0,0,1|1,0,0]=3 5136 B19R3.3759 Cn1cnc(c1)COC2CCc3c2cccc3 34a_100000212247_100000717665 [0,1,0,0,0,1|1,0,0]=3 5137 B19R3.3759 Cn1cnc(c1)COC2CCc3c2cccc3 7a_100000212247_100000717665 [0,1,0,0,0,1|1,0,0]=3 5138 B19R3.3759 Cn1cnc(c1)CSC2CCc3c2cccc3 62a_100000717665_200000721974 [0,1,0,0,0,1|1,0,0]=3 5139 B19R3.3759 Cn1cnc(c1)SCn2nnc3c2cccc3 62a_100000040308_100000033166 [0,1,0,0,0,1|2,0,0]=4 5140 B19R3.3759 Cn1cnc(n1)CNC2CCc3c2cccc3 2230a_100000695864_200000721974 [0,1,0,0,0,1|2,0,0]=4 5141 B19R3.3759 Cn1cnc(n1)CNC2CCc3c2cccc3 269862a_100000695864_100000212051 [0,1,0,0,0,1|2,0,0]=4 5142 B19R3.3759 Cn1cnc(n1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100010630104 [0,1,0,0,0,1|2,0,0]=4 5143 B19R3.3759 Cn1cnc(n1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100016995526 [0,1,0,0,0,1|2,0,0]=4 5144 B19R3.3759 Cn1cnc(n1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100010630104 [0,1,0,0,0,1|2,0,0]=4 5145 B19R3.3759 Cn1cnc(n1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100016995526 [0,1,0,0,0,1|2,0,0]=4 5146 B19R3.3759 Cn1cnc(n1)COC2CCc3c2cccc3 34a_100000212247_100016995526 [0,1,0,0,0,1|2,0,0]=4 5147 B19R3.3759 Cn1cnc(n1)COC2CCc3c2cccc3 7a_100000212247_100016995526 [0,1,0,0,0,1|2,0,0]=4 5148 B19R3.3759 Cn1cnc(n1)CSC2CCc3c2cccc3 62a_100016995526_200000721974 [0,1,0,0,0,1|2,0,0]=4 5149 B19R3.3759 [13CH3]n1cc(nn1)CNC2CCc3c2cccc3 274090a_200025704644_100000740409 [0,1,0,0,0,1|2,0,0]=4 5150 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3c[nH]cn3 2230a_100000744021_100000707719 [0,1,0,0,0,1|1,0,0]=3 5151 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3c[nH]cn3 34a_100000744021_100000707719 [0,1,0,0,0,1|1,0,0]=3 5152 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3cocn3 269862a_100015188801_100000737041 [0,1,0,0,0,1|2,0,0]=4 5153 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3cocn3 270004a_100000744021_100000050382 [0,1,0,0,0,1|2,0,0]=4 5154 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3cscn3 207a_100000744021_100000743575 [0,1,0,0,0,1|2,0,0]=4 5155 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3cscn3 2230a_100000744021_100000205941 [0,1,0,0,0,1|2,0,0]=4 5156 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3cscn3 269862a_100015185402_100000737041 [0,1,0,0,0,1|2,0,0]=4 5157 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3cscn3 270004a_100000744021_100000743575 [0,1,0,0,0,1|2,0,0]=4 5158 B19R3.4207 Brc1ccc2c(c1)CCC2NCc3cscn3 34a_100000744021_100000205941 [0,1,0,0,0,1|2,0,0]=4 5159 B19R3.4207 Brc1ccc2c(c1)CCC2OCc3c[nH]cn3 34a_100000747877_100000707719 [0,1,0,0,0,1|1,0,0]=3 5160 B19R3.4207 Brc1ccc2c(c1)CCC2OCc3cscn3 34a_100000747877_100000205941 [0,1,0,0,0,1|2,0,0]=4 5161 B19R3.4207 Brc1ccc2c(c1)CCC2OCc3cscn3 7a_100000747877_100000205941 [0,1,0,0,0,1|2,0,0]=4 5162 B19R3.4207 Brc1ccc2c(c1)OCC2NCc3c[nH]cn3 2230a_100020628175_100000707719 [0,1,0,0,0,1|2,0,0]=4 5163 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3c[nH]cn3 2230a_200000746848_100000707719 [0,1,0,0,0,1|1,0,0]=3 5164 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3c[nH]cn3 34a_200000746848_100000707719 [0,1,0,0,0,1|1,0,0]=3 5165 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3cocn3 269862a_100015188801_100000743249 [0,1,0,0,0,1|2,0,0]=4 5166 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3cocn3 270004a_200000746848_100000050382 [0,1,0,0,0,1|2,0,0]=4 5167 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3cscn3 207a_200000746848_100000743575 [0,1,0,0,0,1|2,0,0]=4 5168 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3cscn3 2230a_200000746848_100000205941 [0,1,0,0,0,1|2,0,0]=4 5169 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3cscn3 269862a_100015185402_100000743249 [0,1,0,0,0,1|2,0,0]=4 5170 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3cscn3 270004a_200000746848_100000743575 [0,1,0,0,0,1|2,0,0]=4 5171 B19R3.4207 Cc1ccc2c(c1)CCC2NCc3cscn3 34a_200000746848_100000205941 [0,1,0,0,0,1|2,0,0]=4 5172 B19R3.4207 Cc1ccc2c(c1)CCC2OCc3c[nH]cn3 34a_100000103036_100000707719 [0,1,0,0,0,1|1,0,0]=3 5173 B19R3.4207 Cc1ccc2c(c1)CCC2OCc3cscn3 34a_100000103036_100000205941 [0,1,0,0,0,1|2,0,0]=4 5174 B19R3.4207 Cc1ccc2c(c1)CCC2OCc3cscn3 7a_100000103036_100000205941 [0,1,0,0,0,1|2,0,0]=4 5175 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3c[nH]cn3 2230a_100000743821_100000707719 [0,1,0,0,0,1|1,0,0]=3 5176 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3c[nH]cn3 34a_100000743821_100000707719 [0,1,0,0,0,1|1,0,0]=3 5177 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3cocn3 269862a_100015188801_100000751102 [0,1,0,0,0,1|2,0,0]=4 5178 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3cocn3 270004a_100000743821_100000050382 [0,1,0,0,0,1|2,0,0]=4 5179 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3cscn3 207a_100000743821_100000743575 [0,1,0,0,0,1|2,0,0]=4 5180 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3cscn3 2230a_100000743821_100000205941 [0,1,0,0,0,1|2,0,0]=4 5181 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3cscn3 269862a_100015185402_100000751102 [0,1,0,0,0,1|2,0,0]=4 5182 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3cscn3 270004a_100000743821_100000743575 [0,1,0,0,0,1|2,0,0]=4 5183 B19R3.4207 Clc1ccc2c(c1)CCC2NCc3cscn3 34a_100000743821_100000205941 [0,1,0,0,0,1|2,0,0]=4 5184 B19R3.4207 Clc1ccc2c(c1)CCC2OCc3c[nH]cn3 34a_100012002497_100000707719 [0,1,0,0,0,1|1,0,0]=3 5185 B19R3.4207 Clc1ccc2c(c1)CCC2OCc3cscn3 34a_100012002497_100000205941 [0,1,0,0,0,1|2,0,0]=4 5186 B19R3.4207 Clc1ccc2c(c1)CCC2OCc3cscn3 7a_100012002497_100000205941 [0,1,0,0,0,1|2,0,0]=4 5187 B19R3.4207 Clc1ccc2c(c1)OC[C@H]2NCc3c[nH]cn3 2230a_100138412546_100000707719 [0,1,0,0,0,1|2,0,0]=4 5188 B19R3.4207 Fc1ccc2c(c1)CCC2NCc3cocn3 269862a_100015188801_100000035798 [0,1,0,0,0,1|2,0,0]=4 5189 B19R3.4207 Fc1ccc2c(c1)CCC2NCc3cscn3 269862a_100015185402_100000035798 [0,1,0,0,0,1|2,0,0]=4 5190 B19R3.4207 Fc1ccc2c(c1)CCC2OCc3c[nH]cn3 34a_100012002498_100000707719 [0,1,0,0,0,1|1,0,0]=3 5191 B19R3.4207 Fc1ccc2c(c1)CCC2OCc3cscn3 34a_100012002498_100000205941 [0,1,0,0,0,1|2,0,0]=4 5192 B19R3.4207 Fc1ccc2c(c1)CCC2OCc3cscn3 7a_100012002498_100000205941 [0,1,0,0,0,1|2,0,0]=4 5193 B19R3.4207 Fc1ccc2c(c1)CC[C@H]2NCc3c[nH]cn3 2230a_100025717273_100000707719 [0,1,0,0,0,1|1,0,0]=3 5194 B19R3.4207 Fc1ccc2c(c1)CC[C@H]2NCc3c[nH]cn3 34a_100025717273_100000707719 [0,1,0,0,0,1|1,0,0]=3 5195 B19R3.4207 Fc1ccc2c(c1)CC[C@H]2NCc3cocn3 270004a_100025717273_100000050382 [0,1,0,0,0,1|2,0,0]=4 5196 B19R3.4207 Fc1ccc2c(c1)CC[C@H]2NCc3cscn3 207a_100025717273_100000743575 [0,1,0,0,0,1|2,0,0]=4 5197 B19R3.4207 Fc1ccc2c(c1)CC[C@H]2NCc3cscn3 2230a_100025717273_100000205941 [0,1,0,0,0,1|2,0,0]=4 5198 B19R3.4207 Fc1ccc2c(c1)CC[C@H]2NCc3cscn3 270004a_100025717273_100000743575 [0,1,0,0,0,1|2,0,0]=4 5199 B19R3.4207 Fc1ccc2c(c1)CC[C@H]2NCc3cscn3 34a_100025717273_100000205941 [0,1,0,0,0,1|2,0,0]=4 5200 B19R3.4207 Fc1ccc2c(c1)OC[C@@H]2NCc3c[nH]cn3 2230a_100102463760_100000707719 [0,1,0,0,0,1|2,0,0]=4 5201 B19R3.4207 Fc1ccc2c(c1)OC[C@@H]2NCc3c[nH]cn3 34a_100102463760_100000707719 [0,1,0,0,0,1|2,0,0]=4 5202 B19R3.4207 Ic1ccc2c(c1)CCC2NCc3cocn3 269862a_100015188801_100000049573 [0,1,0,0,0,1|2,0,0]=4 5203 B19R3.4207 Ic1ccc2c(c1)CCC2NCc3cscn3 269862a_100015185402_100000049573 [0,1,0,0,0,1|2,0,0]=4 5204 B19R3.5407 Cc1[nH]cnc1CNC2COc3c2cccc3 207a_100000747519_100000032982 [0,1,0,0,0,1|2,0,0]=4 5205 B19R3.5407 Cc1[nH]cnc1CNC2COc3c2cccc3 2230a_100000747519_100000751220 [0,1,0,0,0,1|2,0,0]=4 5206 B19R3.5407 Cc1[nH]cnc1CN[C@H]2CCc3c2cccc3 207a_100016989578_100000032982 [0,1,0,0,0,1|1,0,0]=3 5207 B19R3.5407 Cc1[nH]cnc1CN[C@H]2CCc3c2cccc3 2230a_100016989578_100000751220 [0,1,0,0,0,1|1,0,0]=3 5208 B19R3.5407 Cc1[nH]cnc1CSC2CCc3c2cccc3 62a_100000751220_200000721974 [0,1,0,0,0,1|1,0,0]=3 5209 B19R3.5407 Cc1[nH]cnc1SCn2nnc3c2cccc3 62a_100010186451_100000033166 [0,1,0,0,0,1|2,0,0]=4 5210 B19R3.5407 Cc1ocnc1CN[C@H]2CCc3c2cccc3 2230a_100016989578_200000693990 [0,1,0,0,0,1|2,0,0]=4 5211 B19R3.5407 Cc1ocnc1CN[C@H]2CCc3c2cccc3 34a_100016989578_200000693990 [0,1,0,0,0,1|2,0,0]=4 5212 B19R3.5407 Cc1ocnc1COC2CCc3c2cccc3 34a_100000212247_200000693990 [0,1,0,0,0,1|2,0,0]=4 5213 B19R3.5407 Cc1ocnc1COC2CCc3c2cccc3 7a_100000212247_200000693990 [0,1,0,0,0,1|2,0,0]=4 5214 B19R3.5407 Cc1ocnc1CSC2CCc3c2cccc3 62a_200000693990_200000721974 [0,1,0,0,0,1|2,0,0]=4 5215 B19R3.8943 O[C@@H]1Cc2ccccc2[C@@H]1NCc3c[nH]cn3 2230a_100000744645_100000707719 [0,1,0,0,0,1|1,0,0]=3 5216 B19R3.8943 O[C@@H]1Cc2ccccc2[C@@H]1NCc3cocn3 270004a_100000744645_100000050382 [0,1,0,0,0,1|2,0,0]=4 5217 B19R3.8943 O[C@@H]1Cc2ccccc2[C@@H]1NCc3cscn3 207a_100000744645_100000743575 [0,1,0,0,0,1|2,0,0]=4 5218 B19R3.8943 O[C@@H]1Cc2ccccc2[C@@H]1NCc3cscn3 2230a_100000744645_100000205941 [0,1,0,0,0,1|2,0,0]=4 5219 B19R3.8943 O[C@@H]1Cc2ccccc2[C@@H]1NCc3cscn3 270004a_100000744645_100000743575 [0,1,0,0,0,1|2,0,0]=4 5220 B19R3.10818 CN(Cc1cscn1)C2CCc3c2cccc3 2230a_100000225794_200000721974 [0,1,0,0,0,1|2,0,0]=4 5221 B19R3.10818 CN(Cc1cscn1)C2CCc3c2cccc3 269982a_100000225794_200000721974 [0,1,0,0,0,1|2,0,0]=4 5222 B19R3.10818 O=C(Cc1c[nH]cn1)C2=CCc3c2cccc3 1458a_100000037392_100000707719 [0,1,0,0,0,1|1,0,1]=4 5223 B19R3.10818 O=C(Cc1c[nH]cn1)C2CCc3c2cccc3 1458a_100000750891_100000707719 [0,1,0,0,0,1|1,0,0]=3 5224 B19R3.10818 O=C(Cc1cscn1)C2CCc3c2cccc3 1458a_100000750891_100000205941 [0,1,0,0,0,1|2,0,0]=4 5225 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3c[nH]cn3 2230a_100011435097_100000707719 [0,1,0,0,0,1|1,0,0]=3 5226 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3c[nH]cn3 34a_100011435097_100000707719 [0,1,0,0,0,1|1,0,0]=3 5227 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3cocn3 269862a_100015188801_100000759401 [0,1,0,0,0,1|2,0,0]=4 5228 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3cocn3 270004a_100011435097_100000050382 [0,1,0,0,0,1|2,0,0]=4 5229 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3cscn3 207a_100011435097_100000743575 [0,1,0,0,0,1|2,0,0]=4 5230 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3cscn3 2230a_100011435097_100000205941 [0,1,0,0,0,1|2,0,0]=4 5231 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3cscn3 269862a_100015185402_100000759401 [0,1,0,0,0,1|2,0,0]=4 5232 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3cscn3 270004a_100011435097_100000743575 [0,1,0,0,0,1|2,0,0]=4 5233 B19R3.90762 Brc1ccc2c(c1)C(CC2)NCc3cscn3 34a_100011435097_100000205941 [0,1,0,0,0,1|2,0,0]=4 5234 B19R3.90762 Brc1ccc2c(c1)C(CC2)OCc3c[nH]cn3 34a_100011836024_100000707719 [0,1,0,0,0,1|1,0,0]=3 5235 B19R3.90762 Brc1ccc2c(c1)C(CC2)OCc3cscn3 34a_100011836024_100000205941 [0,1,0,0,0,1|2,0,0]=4 5236 B19R3.90762 Brc1ccc2c(c1)C(CC2)OCc3cscn3 7a_100011836024_100000205941 [0,1,0,0,0,1|2,0,0]=4 5237 B19R3.90762 Cc1ccc2c(c1)C(CC2)NCc3cocn3 269862a_100015188801_100000753597 [0,1,0,0,0,1|2,0,0]=4 5238 B19R3.90762 Cc1ccc2c(c1)C(CC2)NCc3cscn3 269862a_100015185402_100000753597 [0,1,0,0,0,1|2,0,0]=4 5239 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3c[nH]cn3 2230a_100016987686_100000707719 [0,1,0,0,0,1|1,0,0]=3 5240 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3c[nH]cn3 34a_100016987686_100000707719 [0,1,0,0,0,1|1,0,0]=3 5241 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3cocn3 269862a_100015188801_100000759629 [0,1,0,0,0,1|2,0,0]=4 5242 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3cocn3 270004a_100016987686_100000050382 [0,1,0,0,0,1|2,0,0]=4 5243 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3cscn3 207a_100016987686_100000743575 [0,1,0,0,0,1|2,0,0]=4 5244 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3cscn3 2230a_100016987686_100000205941 [0,1,0,0,0,1|2,0,0]=4 5245 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3cscn3 269862a_100015185402_100000759629 [0,1,0,0,0,1|2,0,0]=4 5246 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3cscn3 270004a_100016987686_100000743575 [0,1,0,0,0,1|2,0,0]=4 5247 B19R3.90762 Clc1ccc2c(c1)C(CC2)NCc3cscn3 34a_100016987686_100000205941 [0,1,0,0,0,1|2,0,0]=4 5248 B19R3.90762 Clc1ccc2c(c1)C(CO2)NCc3c[nH]cn3 2230a_100000705955_100000707719 [0,1,0,0,0,1|2,0,0]=4 5249 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3c[nH]cn3 2230a_100000752734_100000707719 [0,1,0,0,0,1|1,0,0]=3 5250 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3c[nH]cn3 34a_100000752734_100000707719 [0,1,0,0,0,1|1,0,0]=3 5251 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3cocn3 269862a_100015188801_100000759630 [0,1,0,0,0,1|2,0,0]=4 5252 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3cocn3 270004a_100000752734_100000050382 [0,1,0,0,0,1|2,0,0]=4 5253 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3cscn3 207a_100000752734_100000743575 [0,1,0,0,0,1|2,0,0]=4 5254 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3cscn3 2230a_100000752734_100000205941 [0,1,0,0,0,1|2,0,0]=4 5255 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3cscn3 269862a_100015185402_100000759630 [0,1,0,0,0,1|2,0,0]=4 5256 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3cscn3 270004a_100000752734_100000743575 [0,1,0,0,0,1|2,0,0]=4 5257 B19R3.90762 Fc1ccc2c(c1)C(CC2)NCc3cscn3 34a_100000752734_100000205941 [0,1,0,0,0,1|2,0,0]=4 5258 B19R3.90762 Fc1ccc2c(c1)[C@@H](CO2)NCc3c[nH]cn3 2230a_100161114692_100000707719 [0,1,0,0,0,1|2,0,0]=4 5259 B19R3.90762 Fc1ccc2c(c1)[C@@H](CO2)NCc3c[nH]cn3 34a_100161114692_100000707719 [0,1,0,0,0,1|2,0,0]=4 5260 B19R3.90762 Ic1ccc2c(c1)C(CC2)NCc3cocn3 269862a_100015188801_100011356848 [0,1,0,0,0,1|2,0,0]=4 5261 B19R3.90762 Ic1ccc2c(c1)C(CC2)NCc3cscn3 269862a_100015185402_100011356848 [0,1,0,0,0,1|2,0,0]=4 5262 B19R3.152087 Brc1cccc2c1CCC2NCc3c[nH]cn3 2230a_100000751068_100000707719 [0,1,0,0,0,1|1,0,0]=3 5263 B19R3.152087 Brc1cccc2c1CCC2NCc3c[nH]cn3 34a_100000751068_100000707719 [0,1,0,0,0,1|1,0,0]=3 5264 B19R3.152087 Brc1cccc2c1CCC2NCc3cocn3 269862a_100015188801_100000744605 [0,1,0,0,0,1|2,0,0]=4 5265 B19R3.152087 Brc1cccc2c1CCC2NCc3cocn3 270004a_100000751068_100000050382 [0,1,0,0,0,1|2,0,0]=4 5266 B19R3.152087 Brc1cccc2c1CCC2NCc3cscn3 207a_100000751068_100000743575 [0,1,0,0,0,1|2,0,0]=4 5267 B19R3.152087 Brc1cccc2c1CCC2NCc3cscn3 2230a_100000751068_100000205941 [0,1,0,0,0,1|2,0,0]=4 5268 B19R3.152087 Brc1cccc2c1CCC2NCc3cscn3 269862a_100015185402_100000744605 [0,1,0,0,0,1|2,0,0]=4 5269 B19R3.152087 Brc1cccc2c1CCC2NCc3cscn3 270004a_100000751068_100000743575 [0,1,0,0,0,1|2,0,0]=4 5270 B19R3.152087 Brc1cccc2c1CCC2NCc3cscn3 34a_100000751068_100000205941 [0,1,0,0,0,1|2,0,0]=4 5271 B19R3.152087 Brc1cccc2c1CC[C@@H]2OCc3c[nH]cn3 34a_100010080924_100000707719 [0,1,0,0,0,1|1,0,0]=3 5272 B19R3.152087 Brc1cccc2c1CC[C@@H]2OCc3cscn3 34a_100010080924_100000205941 [0,1,0,0,0,1|2,0,0]=4 5273 B19R3.152087 Brc1cccc2c1CC[C@@H]2OCc3cscn3 7a_100010080924_100000205941 [0,1,0,0,0,1|2,0,0]=4 5274 B19R3.152087 Brc1cccc2c1OCC2NCc3c[nH]cn3 2230a_100025715106_100000707719 [0,1,0,0,0,1|2,0,0]=4 5275 B19R3.152087 Cc1cccc2c1CCC2NCc3cocn3 269862a_100015188801_100000752022 [0,1,0,0,0,1|2,0,0]=4 5276 B19R3.152087 Cc1cccc2c1CCC2NCc3cscn3 269862a_100015185402_100000752022 [0,1,0,0,0,1|2,0,0]=4 5277 B19R3.152087 Cc1cccc2c1CCC2OCc3c[nH]cn3 34a_100011467954_100000707719 [0,1,0,0,0,1|1,0,0]=3 5278 B19R3.152087 Cc1cccc2c1CCC2OCc3cscn3 34a_100011467954_100000205941 [0,1,0,0,0,1|2,0,0]=4 5279 B19R3.152087 Cc1cccc2c1CCC2OCc3cscn3 7a_100011467954_100000205941 [0,1,0,0,0,1|2,0,0]=4 5280 B19R3.152087 Cc1cccc2c1CC[C@@H]2NCc3c[nH]cn3 2230a_100134618347_100000707719 [0,1,0,0,0,1|1,0,0]=3 5281 B19R3.152087 Cc1cccc2c1CC[C@@H]2NCc3c[nH]cn3 34a_100134618347_100000707719 [0,1,0,0,0,1|1,0,0]=3 5282 B19R3.152087 Cc1cccc2c1CC[C@@H]2NCc3cocn3 270004a_100134618347_100000050382 [0,1,0,0,0,1|2,0,0]=4 5283 B19R3.152087 Cc1cccc2c1CC[C@@H]2NCc3cscn3 207a_100134618347_100000743575 [0,1,0,0,0,1|2,0,0]=4 5284 B19R3.152087 Cc1cccc2c1CC[C@@H]2NCc3cscn3 2230a_100134618347_100000205941 [0,1,0,0,0,1|2,0,0]=4 5285 B19R3.152087 Cc1cccc2c1CC[C@@H]2NCc3cscn3 270004a_100134618347_100000743575 [0,1,0,0,0,1|2,0,0]=4 5286 B19R3.152087 Cc1cccc2c1CC[C@@H]2NCc3cscn3 34a_100134618347_100000205941 [0,1,0,0,0,1|2,0,0]=4 5287 B19R3.152087 Clc1cccc2c1CCC2NCc3c[nH]cn3 2230a_100000743989_100000707719 [0,1,0,0,0,1|1,0,0]=3 5288 B19R3.152087 Clc1cccc2c1CCC2NCc3c[nH]cn3 34a_100000743989_100000707719 [0,1,0,0,0,1|1,0,0]=3 5289 B19R3.152087 Clc1cccc2c1CCC2NCc3cocn3 269862a_100015188801_100000743251 [0,1,0,0,0,1|2,0,0]=4 5290 B19R3.152087 Clc1cccc2c1CCC2NCc3cocn3 270004a_100000743989_100000050382 [0,1,0,0,0,1|2,0,0]=4 5291 B19R3.152087 Clc1cccc2c1CCC2NCc3cscn3 207a_100000743989_100000743575 [0,1,0,0,0,1|2,0,0]=4 5292 B19R3.152087 Clc1cccc2c1CCC2NCc3cscn3 2230a_100000743989_100000205941 [0,1,0,0,0,1|2,0,0]=4 5293 B19R3.152087 Clc1cccc2c1CCC2NCc3cscn3 269862a_100015185402_100000743251 [0,1,0,0,0,1|2,0,0]=4 5294 B19R3.152087 Clc1cccc2c1CCC2NCc3cscn3 270004a_100000743989_100000743575 [0,1,0,0,0,1|2,0,0]=4 5295 B19R3.152087 Clc1cccc2c1CCC2NCc3cscn3 34a_100000743989_100000205941 [0,1,0,0,0,1|2,0,0]=4 5296 B19R3.152087 Clc1cccc2c1OC[C@@H]2NCc3c[nH]cn3 2230a_100102463758_100000707719 [0,1,0,0,0,1|2,0,0]=4 5297 B19R3.152087 Clc1cccc2c1OC[C@@H]2NCc3c[nH]cn3 34a_100102463758_100000707719 [0,1,0,0,0,1|2,0,0]=4 5298 B19R3.152087 Fc1cccc2c1CCC2NCc3cocn3 269862a_100015188801_100000743250 [0,1,0,0,0,1|2,0,0]=4 5299 B19R3.152087 Fc1cccc2c1CCC2NCc3cscn3 269862a_100015185402_100000743250 [0,1,0,0,0,1|2,0,0]=4 5300 B19R3.152087 Fc1cccc2c1CC[C@@H]2NCc3c[nH]cn3 2230a_100015193782_100000707719 [0,1,0,0,0,1|1,0,0]=3 5301 B19R3.152087 Fc1cccc2c1CC[C@@H]2NCc3c[nH]cn3 34a_100015193782_100000707719 [0,1,0,0,0,1|1,0,0]=3 5302 B19R3.152087 Fc1cccc2c1CC[C@@H]2NCc3cocn3 270004a_100015193782_100000050382 [0,1,0,0,0,1|2,0,0]=4 5303 B19R3.152087 Fc1cccc2c1CC[C@@H]2NCc3cscn3 207a_100015193782_100000743575 [0,1,0,0,0,1|2,0,0]=4 5304 B19R3.152087 Fc1cccc2c1CC[C@@H]2NCc3cscn3 2230a_100015193782_100000205941 [0,1,0,0,0,1|2,0,0]=4 5305 B19R3.152087 Fc1cccc2c1CC[C@@H]2NCc3cscn3 270004a_100015193782_100000743575 [0,1,0,0,0,1|2,0,0]=4 5306 B19R3.152087 Fc1cccc2c1CC[C@@H]2NCc3cscn3 34a_100015193782_100000205941 [0,1,0,0,0,1|2,0,0]=4 5307 B19R3.152087 Fc1cccc2c1OCC2NCc3c[nH]cn3 2230a_200011230594_100000707719 [0,1,0,0,0,1|2,0,0]=4 5308 B19R3.152087 Fc1cccc2c1OCC2NCc3c[nH]cn3 34a_200011230594_100000707719 [0,1,0,0,0,1|2,0,0]=4 5309 B19R3.152087 Ic1cccc2c1CCC2NCc3cocn3 269862a_100015188801_100000049675 [0,1,0,0,0,1|2,0,0]=4 5310 B19R3.152087 Ic1cccc2c1CCC2NCc3cscn3 269862a_100015185402_100000049675 [0,1,0,0,0,1|2,0,0]=4 5311 B19R3.152087 Oc1cccc2c1CC[C@@H]2NCc3c[nH]cn3 2230a_100134616730_100000707719 [0,1,0,0,0,1|1,0,0]=3 5312 B19R3.152087 Oc1cccc2c1CC[C@@H]2NCc3c[nH]cn3 34a_100134616730_100000707719 [0,1,0,0,0,1|1,0,0]=3 5313 B19R3.152087 Oc1cccc2c1CC[C@@H]2NCc3cocn3 270004a_100134616730_100000050382 [0,1,0,0,0,1|2,0,0]=4 5314 B19R3.152087 Oc1cccc2c1CC[C@@H]2NCc3cscn3 207a_100134616730_100000743575 [0,1,0,0,0,1|2,0,0]=4 5315 B19R3.152087 Oc1cccc2c1CC[C@@H]2NCc3cscn3 2230a_100134616730_100000205941 [0,1,0,0,0,1|2,0,0]=4 5316 B19R3.152087 Oc1cccc2c1CC[C@@H]2NCc3cscn3 270004a_100134616730_100000743575 [0,1,0,0,0,1|2,0,0]=4 5317 B19R3.152087 Oc1cccc2c1CC[C@@H]2NCc3cscn3 34a_100134616730_100000205941 [0,1,0,0,0,1|2,0,0]=4 5318 B19R3.152748 Brc1cccc2c1C(CC2)NCc3c[nH]cn3 2230a_100103168669_100000707719 [0,1,0,0,0,1|1,0,0]=3 5319 B19R3.152748 Brc1cccc2c1C(CC2)NCc3c[nH]cn3 34a_100103168669_100000707719 [0,1,0,0,0,1|1,0,0]=3 5320 B19R3.152748 Brc1cccc2c1C(CC2)NCc3cocn3 270004a_100103168669_100000050382 [0,1,0,0,0,1|2,0,0]=4 5321 B19R3.152748 Brc1cccc2c1C(CC2)NCc3cscn3 207a_100103168669_100000743575 [0,1,0,0,0,1|2,0,0]=4 5322 B19R3.152748 Brc1cccc2c1C(CC2)NCc3cscn3 2230a_100103168669_100000205941 [0,1,0,0,0,1|2,0,0]=4 5323 B19R3.152748 Brc1cccc2c1C(CC2)NCc3cscn3 270004a_100103168669_100000743575 [0,1,0,0,0,1|2,0,0]=4 5324 B19R3.152748 Brc1cccc2c1C(CC2)NCc3cscn3 34a_100103168669_100000205941 [0,1,0,0,0,1|2,0,0]=4 5325 B19R3.152748 Fc1cccc2c1[C@@H](CO2)NCc3c[nH]cn3 2230a_200015272058_100000707719 [0,1,0,0,0,1|2,0,0]=4 5326 B19R3.152748 Fc1cccc2c1[C@@H](CO2)NCc3c[nH]cn3 34a_200015272058_100000707719 [0,1,0,0,0,1|2,0,0]=4 5327 B19R3.2246648 CC1(CCc2c1cccc2)OCc3c[nH]cn3 34a_100000685031_100000707719 [0,1,0,0,0,1|1,0,0]=3 5328 B19R3.2246648 CC1(CCc2c1cccc2)OCc3cscn3 34a_100000685031_100000205941 [0,1,0,0,0,1|2,0,0]=4 5329 B19R3.2246648 CC1(CCc2c1cccc2)OCc3cscn3 7a_100000685031_100000205941 [0,1,0,0,0,1|2,0,0]=4 5330 B19R3.2538729 CC1CC(c2c1cccc2)NCc3cocn3 269862a_100015188801_100000750356 [0,1,0,0,0,1|2,0,0]=4 5331 B19R3.2538729 CC1CC(c2c1cccc2)NCc3cscn3 269862a_100015185402_100000750356 [0,1,0,0,0,1|2,0,0]=4 5332 B19R3.2538729 O=C1CC(c2c1cccc2)SCc3c[nH]cn3 62a_100000707719_100010208147 [0,1,0,0,0,1|1,0,1]=4 5333 B19R3.2538729 O=C1CC(c2c1cccc2)SCc3c[nH]cn3 62a_100010208147_100000707719 [0,1,0,0,0,1|1,0,1]=4 5334 B19R3.8809 Brc1ccoc1CN2CCc3ccccc3C2 270004a_100000188457_100000756499 [0,1,0,0,0,1|2,0,0]=4 5335 B19R3.8809 Brc1ccsc1CN2CCc3ccccc3C2 270004a_100000188457_100000766043 [0,1,0,0,0,1|2,0,0]=4 5336 B19R3.8809 Brc1cscc1CN2CCc3ccccc3C2 270004a_100000188457_100000685484 [0,1,0,0,0,1|2,0,0]=4 5337 B19R3.8809 Brc1sccc1CN2CCc3ccccc3C2 2230a_100000188457_100009814289 [0,1,0,0,0,1|2,0,0]=4 5338 B19R3.8809 Brc1sccc1CN2CCc3ccccc3C2 269982a_100000188457_100009814289 [0,1,0,0,0,1|2,0,0]=4 5339 B19R3.8809 Brc1sccc1CN2CCc3ccccc3C2 270004a_100000188457_100009816921 [0,1,0,0,0,1|2,0,0]=4 5340 B19R3.8809 Brc1sccc1CN2CCc3ccccc3C2 34a_100000188457_100009814289 [0,1,0,0,0,1|2,0,0]=4 5341 B19R3.8809 Cc1[nH]cnc1CN2CCc3ccccc3C2 2230a_100000188457_100000751220 [0,1,0,0,0,1|0,0,0]=2 5342 B19R3.8809 Cc1[nH]cnc1CN2CCc3ccccc3C2 269982a_100000188457_100000751220 [0,1,0,0,0,1|0,0,0]=2 5343 B19R3.8809 Cc1[nH]cnc1CN2CCc3cccnc3C2 2230a_100015206102_100000751220 [0,1,0,0,0,1|1,0,0]=3 5344 B19R3.8809 Cc1[nH]cnc1CN2CCc3cccnc3C2 269982a_100015206102_100000751220 [0,1,0,0,0,1|1,0,0]=3 5345 B19R3.8809 Cc1[nH]cnc1CN2CCc3ccncc3C2 2230a_100015190008_100000751220 [0,1,0,0,0,1|1,0,0]=3 5346 B19R3.8809 Cc1[nH]cnc1CN2CCc3ccncc3C2 269982a_100015190008_100000751220 [0,1,0,0,0,1|1,0,0]=3 5347 B19R3.8809 Cc1[nH]cnc1CN2CCc3cnccc3C2 2230a_100020645890_100000751220 [0,1,0,0,0,1|1,0,0]=3 5348 B19R3.8809 Cc1[nH]cnc1CN2CCc3cnccc3C2 269982a_100020645890_100000751220 [0,1,0,0,0,1|1,0,0]=3 5349 B19R3.8809 Cc1[nH]cnc1CN2CCc3ncccc3C2 2230a_100000699647_100000751220 [0,1,0,0,0,1|1,0,0]=3 5350 B19R3.8809 Cc1[nH]cnc1CN2CCc3ncccc3C2 269982a_100000699647_100000751220 [0,1,0,0,0,1|1,0,0]=3 5351 B19R3.8809 Cc1[nH]cnc1CN2CCc3ncncc3C2 2230a_100012000121_100000751220 [0,1,0,0,0,1|2,0,0]=4 5352 B19R3.8809 Cc1[nH]cnc1CN2CCc3ncncc3C2 269982a_100012000121_100000751220 [0,1,0,0,0,1|2,0,0]=4 5353 B19R3.8809 Cc1ccoc1CN2CCc3ccccc3C2 270004a_100000188457_100000763527 [0,1,0,0,0,1|2,0,0]=4 5354 B19R3.8809 Cc1ccsc1CN2CCc3ccccc3C2 270004a_100000188457_100000210881 [0,1,0,0,0,1|2,0,0]=4 5355 B19R3.8809 Cc1nonc1CN2CCc3ccccc3C2 2230a_100000188457_200000044682 [0,1,0,0,0,1|1,0,1]=4 5356 B19R3.8809 Cc1nonc1CN2CCc3ccccc3C2 269982a_100000188457_200000044682 [0,1,0,0,0,1|1,0,1]=4 5357 B19R3.8809 Cc1nonc1CN2CCc3ccccc3C2 34a_100000188457_200000044682 [0,1,0,0,0,1|1,0,1]=4 5358 B19R3.8809 Cc1ocnc1CN2CCc3ccccc3C2 2230a_100000188457_200000693990 [0,1,0,0,0,1|1,0,0]=3 5359 B19R3.8809 Cc1ocnc1CN2CCc3ccccc3C2 34a_100000188457_200000693990 [0,1,0,0,0,1|1,0,0]=3 5360 B19R3.8809 Cc1ocnc1CN2CCc3cccnc3C2 2230a_100015206102_200000693990 [0,1,0,0,0,1|2,0,0]=4 5361 B19R3.8809 Cc1ocnc1CN2CCc3ccncc3C2 2230a_100015190008_200000693990 [0,1,0,0,0,1|2,0,0]=4 5362 B19R3.8809 Cc1ocnc1CN2CCc3cnccc3C2 2230a_100020645890_200000693990 [0,1,0,0,0,1|2,0,0]=4 5363 B19R3.8809 Cc1ocnc1CN2CCc3ncccc3C2 2230a_100000699647_200000693990 [0,1,0,0,0,1|2,0,0]=4 5364 B19R3.8809 Clc1c[nH]nc1CN2CCc3ccccc3C2 270004a_100000188457_100000040271 [0,1,0,0,0,1|2,0,0]=4 5365 B19R3.8809 Clc1ccsc1CN2CCc3ccccc3C2 270004a_100000188457_100000722334 [0,1,0,0,0,1|2,0,0]=4 5366 B19R3.8809 Clc1sccc1CN2CCc3ccccc3C2 2230a_100000188457_100010167017 [0,1,0,0,0,1|2,0,0]=4 5367 B19R3.8809 Clc1sccc1CN2CCc3ccccc3C2 269982a_100000188457_100010167017 [0,1,0,0,0,1|2,0,0]=4 5368 B19R3.8809 Clc1sccc1CN2CCc3ccccc3C2 270004a_100000188457_100000089901 [0,1,0,0,0,1|2,0,0]=4 5369 B19R3.8809 Clc1sccc1CN2CCc3ccccc3C2 34a_100000188457_100010167017 [0,1,0,0,0,1|2,0,0]=4 5370 B19R3.8809 Clc1snnc1CN2CCc3ccccc3C2 2230a_100000188457_100000018852 [0,1,0,0,0,1|2,0,0]=4 5371 B19R3.8809 Clc1snnc1CN2CCc3ccccc3C2 269982a_100000188457_100000018852 [0,1,0,0,0,1|2,0,0]=4 5372 B19R3.8809 Cn1cccc1CN2CCc3ccccc3C2 270004a_100000188457_100000211633 [0,1,0,0,0,1|1,0,1]=4 5373 B19R3.8809 Cn1ccnc1CN2CCc3ccccc3C2 2230a_100000188457_100000700302 [0,1,0,0,0,1|2,0,0]=4 5374 B19R3.8809 Cn1ccnc1CN2CCc3ccccc3C2 269982a_100000188457_100000700302 [0,1,0,0,0,1|2,0,0]=4 5375 B19R3.8809 Cn1ccnc1CN2CCc3ccccc3C2 270004a_100000188457_100000748660 [0,1,0,0,0,1|2,0,0]=4 5376 B19R3.8809 Cn1ccnc1CN2CCc3ccccc3C2 34a_100000188457_100000700302 [0,1,0,0,0,1|2,0,0]=4 5377 B19R3.8809 Cn1cncc1CN2CCc3ccccc3C2 270004a_100000188457_100000750899 [0,1,0,0,0,1|0,0,2]=4 5378 B19R3.50998 Brc1c[nH]c(c1)CN2CCc3ccccc3C2 270004a_100000188457_100000720742 [0,1,0,0,0,1|1,0,1]=4 5379 B19R3.50998 Brc1cc(cs1)CN2CCc3ccccc3C2 270004a_100000188457_100000737087 [0,1,0,0,0,1|2,0,0]=4 5380 B19R3.50998 Brc1ccc(o1)CN2CCc3ccccc3C2 270004a_100000188457_100000185145 [0,1,0,0,0,1|2,0,0]=4 5381 B19R3.50998 Brc1ccc(s1)CN2CCc3ccccc3C2 2230a_100000188457_100000708592 [0,1,0,0,0,1|2,0,0]=4 5382 B19R3.50998 Brc1ccc(s1)CN2CCc3ccccc3C2 269982a_100000188457_100000708592 [0,1,0,0,0,1|2,0,0]=4 5383 B19R3.50998 Brc1ccc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100000179771 [0,1,0,0,0,1|2,0,0]=4 5384 B19R3.50998 Brc1ccc(s1)CN2CCc3ccccc3C2 34a_100000188457_100000708592 [0,1,0,0,0,1|2,0,0]=4 5385 B19R3.50998 Brc1cnc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100000699580 [0,1,0,0,0,1|2,0,0]=4 5386 B19R3.50998 Brc1coc(c1)CN2CCc3ccccc3C2 270004a_100000188457_100000747035 [0,1,0,0,0,1|2,0,0]=4 5387 B19R3.50998 Brc1csc(c1)CN2CCc3ccccc3C2 2230a_100000188457_100000746031 [0,1,0,0,0,1|2,0,0]=4 5388 B19R3.50998 Brc1csc(c1)CN2CCc3ccccc3C2 269982a_100000188457_100000746031 [0,1,0,0,0,1|2,0,0]=4 5389 B19R3.50998 Brc1csc(c1)CN2CCc3ccccc3C2 270004a_100000188457_100000211722 [0,1,0,0,0,1|2,0,0]=4 5390 B19R3.50998 Brc1csc(c1)CN2CCc3ccccc3C2 34a_100000188457_100000746031 [0,1,0,0,0,1|2,0,0]=4 5391 B19R3.50998 Brc1csc(n1)CN2CCc3ccccc3C2 270004a_100000188457_100009816814 [0,1,0,0,0,1|2,0,0]=4 5392 B19R3.50998 Brc1nc(cs1)CN2CCc3ccccc3C2 270004a_100000188457_100009816748 [0,1,0,0,0,1|1,0,0]=3 5393 B19R3.50998 Brc1nc(cs1)CN2CCc3cccnc3C2 270004a_100015206102_100009816748 [0,1,0,0,0,1|2,0,0]=4 5394 B19R3.50998 Brc1nc(cs1)CN2CCc3ccncc3C2 270004a_100015190008_100009816748 [0,1,0,0,0,1|2,0,0]=4 5395 B19R3.50998 Brc1nc(cs1)CN2CCc3cnccc3C2 270004a_100020645890_100009816748 [0,1,0,0,0,1|2,0,0]=4 5396 B19R3.50998 Brc1nc(cs1)CN2CCc3ncccc3C2 270004a_100000699647_100009816748 [0,1,0,0,0,1|2,0,0]=4 5397 B19R3.50998 Brc1ncc(s1)CN2CCc3ccccc3C2 2230a_100000188457_100000717027 [0,1,0,0,0,1|1,0,1]=4 5398 B19R3.50998 Brc1ncc(s1)CN2CCc3ccccc3C2 269982a_100000188457_100000717027 [0,1,0,0,0,1|1,0,1]=4 5399 B19R3.50998 Brc1ncc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100009814069 [0,1,0,0,0,1|1,0,1]=4 5400 B19R3.50998 Brc1ncc(s1)CN2CCc3ccccc3C2 34a_100000188457_100000717027 [0,1,0,0,0,1|1,0,1]=4 5401 B19R3.50998 Cc1c[nH]c(n1)CN2CCc3ccccc3C2 270004a_100000188457_100000082322 [0,1,0,0,0,1|2,0,0]=4 5402 B19R3.50998 Cc1cc(cs1)CN2CCc3ccccc3C2 270004a_100000188457_100011998532 [0,1,0,0,0,1|2,0,0]=4 5403 B19R3.50998 Cc1cc(no1)CN2CCc3ccccc3C2 2230a_100000188457_100000199038 [0,1,0,0,0,1|2,0,0]=4 5404 B19R3.50998 Cc1cc(no1)CN2CCc3ccccc3C2 269982a_100000188457_100000199038 [0,1,0,0,0,1|2,0,0]=4 5405 B19R3.50998 Cc1cc(no1)CN2CCc3ccccc3C2 270004a_100000188457_100011217994 [0,1,0,0,0,1|2,0,0]=4 5406 B19R3.50998 Cc1cc(no1)CN2CCc3ccccc3C2 34a_100000188457_100000199038 [0,1,0,0,0,1|2,0,0]=4 5407 B19R3.50998 Cc1cc(ns1)CN2CCc3ccccc3C2 270004a_100000188457_200000100279 [0,1,0,0,0,1|2,0,0]=4 5408 B19R3.50998 Cc1ccc(o1)CN2CCc3ccccc3C2 270004a_100000188457_100000183696 [0,1,0,0,0,1|2,0,0]=4 5409 B19R3.50998 Cc1ccc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100000211121 [0,1,0,0,0,1|2,0,0]=4 5410 B19R3.50998 Cc1cnc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100011361622 [0,1,0,0,0,1|2,0,0]=4 5411 B19R3.50998 Cc1csc(c1)CN2CCc3ccccc3C2 270004a_100000188457_100102525248 [0,1,0,0,0,1|2,0,0]=4 5412 B19R3.50998 Cc1csc(n1)CN2CCc3ccccc3C2 270004a_100000188457_100000756994 [0,1,0,0,0,1|2,0,0]=4 5413 B19R3.50998 Cc1nc(co1)CN2CCc3ccccc3C2 270004a_100000188457_100011361629 [0,1,0,0,0,1|1,0,0]=3 5414 B19R3.50998 Cc1nc(co1)CN2CCc3cccnc3C2 270004a_100015206102_100011361629 [0,1,0,0,0,1|2,0,0]=4 5415 B19R3.50998 Cc1nc(co1)CN2CCc3ccncc3C2 270004a_100015190008_100011361629 [0,1,0,0,0,1|2,0,0]=4 5416 B19R3.50998 Cc1nc(co1)CN2CCc3cnccc3C2 270004a_100020645890_100011361629 [0,1,0,0,0,1|2,0,0]=4 5417 B19R3.50998 Cc1nc(co1)CN2CCc3ncccc3C2 270004a_100000699647_100011361629 [0,1,0,0,0,1|2,0,0]=4 5418 B19R3.50998 Cc1nc(cs1)CN2CCc3ccccc3C2 2230a_100000188457_100015186478 [0,1,0,0,0,1|1,0,0]=3 5419 B19R3.50998 Cc1nc(cs1)CN2CCc3ccccc3C2 269982a_100000188457_100015186478 [0,1,0,0,0,1|1,0,0]=3 5420 B19R3.50998 Cc1nc(cs1)CN2CCc3ccccc3C2 270004a_100000188457_100000203724 [0,1,0,0,0,1|1,0,0]=3 5421 B19R3.50998 Cc1nc(cs1)CN2CCc3ccccc3C2 34a_100000188457_100015186478 [0,1,0,0,0,1|1,0,0]=3 5422 B19R3.50998 Cc1nc(cs1)CN2CCc3cccnc3C2 2230a_100015206102_100015186478 [0,1,0,0,0,1|2,0,0]=4 5423 B19R3.50998 Cc1nc(cs1)CN2CCc3cccnc3C2 269982a_100015206102_100015186478 [0,1,0,0,0,1|2,0,0]=4 5424 B19R3.50998 Cc1nc(cs1)CN2CCc3cccnc3C2 270004a_100015206102_100000203724 [0,1,0,0,0,1|2,0,0]=4 5425 B19R3.50998 Cc1nc(cs1)CN2CCc3ccncc3C2 2230a_100015190008_100015186478 [0,1,0,0,0,1|2,0,0]=4 5426 B19R3.50998 Cc1nc(cs1)CN2CCc3ccncc3C2 269982a_100015190008_100015186478 [0,1,0,0,0,1|2,0,0]=4 5427 B19R3.50998 Cc1nc(cs1)CN2CCc3ccncc3C2 270004a_100015190008_100000203724 [0,1,0,0,0,1|2,0,0]=4 5428 B19R3.50998 Cc1nc(cs1)CN2CCc3cnccc3C2 2230a_100020645890_100015186478 [0,1,0,0,0,1|2,0,0]=4 5429 B19R3.50998 Cc1nc(cs1)CN2CCc3cnccc3C2 269982a_100020645890_100015186478 [0,1,0,0,0,1|2,0,0]=4 5430 B19R3.50998 Cc1nc(cs1)CN2CCc3cnccc3C2 270004a_100020645890_100000203724 [0,1,0,0,0,1|2,0,0]=4 5431 B19R3.50998 Cc1nc(cs1)CN2CCc3ncccc3C2 2230a_100000699647_100015186478 [0,1,0,0,0,1|2,0,0]=4 5432 B19R3.50998 Cc1nc(cs1)CN2CCc3ncccc3C2 269982a_100000699647_100015186478 [0,1,0,0,0,1|2,0,0]=4 5433 B19R3.50998 Cc1nc(cs1)CN2CCc3ncccc3C2 270004a_100000699647_100000203724 [0,1,0,0,0,1|2,0,0]=4 5434 B19R3.50998 Cc1nc(no1)CN2CCc3ccccc3C2 2230a_100000188457_100000231061 [0,1,0,0,0,1|2,0,0]=4 5435 B19R3.50998 Cc1nc(no1)CN2CCc3ccccc3C2 269982a_100000188457_100000231061 [0,1,0,0,0,1|2,0,0]=4 5436 B19R3.50998 Cc1nc(no1)CN2CCc3ccccc3C2 34a_100000188457_100000231061 [0,1,0,0,0,1|2,0,0]=4 5437 B19R3.50998 Cc1ncc(o1)CN2CCc3ccccc3C2 270004a_100000188457_100000084308 [0,1,0,0,0,1|1,0,1]=4 5438 B19R3.50998 Cc1ncc(s1)CN2CCc3ccccc3C2 2230a_100000188457_100020635045 [0,1,0,0,0,1|1,0,1]=4 5439 B19R3.50998 Cc1ncc(s1)CN2CCc3ccccc3C2 269982a_100000188457_100020635045 [0,1,0,0,0,1|1,0,1]=4 5440 B19R3.50998 Cc1ncc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100000740557 [0,1,0,0,0,1|1,0,1]=4 5441 B19R3.50998 Cc1ncc(s1)CN2CCc3ccccc3C2 34a_100000188457_100020635045 [0,1,0,0,0,1|1,0,1]=4 5442 B19R3.50998 Cc1noc(n1)CN2CCc3ccccc3C2 2230a_100000188457_100000735555 [0,1,0,0,0,1|1,0,1]=4 5443 B19R3.50998 Cc1noc(n1)CN2CCc3ccccc3C2 269982a_100000188457_100000735555 [0,1,0,0,0,1|1,0,1]=4 5444 B19R3.50998 Cc1noc(n1)CN2CCc3ccccc3C2 270196a_100000212224_100015184552 [0,1,0,0,0,1|1,0,1]=4 5445 B19R3.50998 Cc1noc(n1)CN2CCc3ccccc3C2 34a_100000188457_100000735555 [0,1,0,0,0,1|1,0,1]=4 5446 B19R3.50998 Clc1cc(cs1)CN2CCc3ccccc3C2 270004a_100000188457_100009844934 [0,1,0,0,0,1|2,0,0]=4 5447 B19R3.50998 Clc1ccc(o1)CN2CCc3ccccc3C2 270004a_100000188457_100000188459 [0,1,0,0,0,1|2,0,0]=4 5448 B19R3.50998 Clc1ccc(s1)CN2CCc3ccccc3C2 2230a_100000188457_100000185097 [0,1,0,0,0,1|2,0,0]=4 5449 B19R3.50998 Clc1ccc(s1)CN2CCc3ccccc3C2 269982a_100000188457_100000185097 [0,1,0,0,0,1|2,0,0]=4 5450 B19R3.50998 Clc1ccc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100000242774 [0,1,0,0,0,1|2,0,0]=4 5451 B19R3.50998 Clc1ccc(s1)CN2CCc3ccccc3C2 34a_100000188457_100000185097 [0,1,0,0,0,1|2,0,0]=4 5452 B19R3.50998 Clc1cnc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100000699884 [0,1,0,0,0,1|2,0,0]=4 5453 B19R3.50998 Clc1csc(c1)CN2CCc3ccccc3C2 270004a_100000188457_100000102487 [0,1,0,0,0,1|2,0,0]=4 5454 B19R3.50998 Clc1nc(cs1)CN2CCc3ccccc3C2 2230a_100000188457_100000024076 [0,1,0,0,0,1|1,0,0]=3 5455 B19R3.50998 Clc1nc(cs1)CN2CCc3ccccc3C2 269982a_100000188457_100000024076 [0,1,0,0,0,1|1,0,0]=3 5456 B19R3.50998 Clc1nc(cs1)CN2CCc3ccccc3C2 270004a_100000188457_100011935135 [0,1,0,0,0,1|1,0,0]=3 5457 B19R3.50998 Clc1nc(cs1)CN2CCc3ccccc3C2 34a_100000188457_100000024076 [0,1,0,0,0,1|1,0,0]=3 5458 B19R3.50998 Clc1nc(cs1)CN2CCc3cccnc3C2 2230a_100015206102_100000024076 [0,1,0,0,0,1|2,0,0]=4 5459 B19R3.50998 Clc1nc(cs1)CN2CCc3cccnc3C2 269982a_100015206102_100000024076 [0,1,0,0,0,1|2,0,0]=4 5460 B19R3.50998 Clc1nc(cs1)CN2CCc3cccnc3C2 270004a_100015206102_100011935135 [0,1,0,0,0,1|2,0,0]=4 5461 B19R3.50998 Clc1nc(cs1)CN2CCc3ccncc3C2 2230a_100015190008_100000024076 [0,1,0,0,0,1|2,0,0]=4 5462 B19R3.50998 Clc1nc(cs1)CN2CCc3ccncc3C2 269982a_100015190008_100000024076 [0,1,0,0,0,1|2,0,0]=4 5463 B19R3.50998 Clc1nc(cs1)CN2CCc3ccncc3C2 270004a_100015190008_100011935135 [0,1,0,0,0,1|2,0,0]=4 5464 B19R3.50998 Clc1nc(cs1)CN2CCc3cnccc3C2 2230a_100020645890_100000024076 [0,1,0,0,0,1|2,0,0]=4 5465 B19R3.50998 Clc1nc(cs1)CN2CCc3cnccc3C2 269982a_100020645890_100000024076 [0,1,0,0,0,1|2,0,0]=4 5466 B19R3.50998 Clc1nc(cs1)CN2CCc3cnccc3C2 270004a_100020645890_100011935135 [0,1,0,0,0,1|2,0,0]=4 5467 B19R3.50998 Clc1nc(cs1)CN2CCc3ncccc3C2 2230a_100000699647_100000024076 [0,1,0,0,0,1|2,0,0]=4 5468 B19R3.50998 Clc1nc(cs1)CN2CCc3ncccc3C2 269982a_100000699647_100000024076 [0,1,0,0,0,1|2,0,0]=4 5469 B19R3.50998 Clc1nc(cs1)CN2CCc3ncccc3C2 270004a_100000699647_100011935135 [0,1,0,0,0,1|2,0,0]=4 5470 B19R3.50998 Clc1nc(ns1)CN2CCc3ccccc3C2 2230a_100000188457_100000043760 [0,1,0,0,0,1|2,0,0]=4 5471 B19R3.50998 Clc1nc(ns1)CN2CCc3ccccc3C2 269982a_100000188457_100000043760 [0,1,0,0,0,1|2,0,0]=4 5472 B19R3.50998 Clc1nc(ns1)CN2CCc3ccccc3C2 34a_100000188457_100000043760 [0,1,0,0,0,1|2,0,0]=4 5473 B19R3.50998 Clc1ncc(s1)CN2CCc3ccccc3C2 2230a_100000188457_100000058068 [0,1,0,0,0,1|1,0,1]=4 5474 B19R3.50998 Clc1ncc(s1)CN2CCc3ccccc3C2 269982a_100000188457_100000058068 [0,1,0,0,0,1|1,0,1]=4 5475 B19R3.50998 Clc1ncc(s1)CN2CCc3ccccc3C2 270004a_100000188457_100000696999 [0,1,0,0,0,1|1,0,1]=4 5476 B19R3.50998 Clc1ncc(s1)CN2CCc3ccccc3C2 34a_100000188457_100000058068 [0,1,0,0,0,1|1,0,1]=4 5477 B19R3.50998 Cn1cc(cn1)CN2CCc3ccccc3C2 2230a_100000188457_100000744441 [0,1,0,0,0,1|2,0,0]=4 5478 B19R3.50998 Cn1cc(cn1)CN2CCc3ccccc3C2 269982a_100000188457_100000744441 [0,1,0,0,0,1|2,0,0]=4 5479 B19R3.50998 Cn1cc(cn1)CN2CCc3ccccc3C2 270004a_100000188457_100000206001 [0,1,0,0,0,1|2,0,0]=4 5480 B19R3.50998 Cn1cc(cn1)CN2CCc3ccccc3C2 34a_100000188457_100000744441 [0,1,0,0,0,1|2,0,0]=4 5481 B19R3.50998 Cn1cc(nn1)CN2CCc3ccccc3C2 270004a_100000188457_100000749909 [0,1,0,0,0,1|1,0,0]=3 5482 B19R3.50998 Cn1cc(nn1)CN2CCc3cccnc3C2 270004a_100015206102_100000749909 [0,1,0,0,0,1|2,0,0]=4 5483 B19R3.50998 Cn1cc(nn1)CN2CCc3ccncc3C2 270004a_100015190008_100000749909 [0,1,0,0,0,1|2,0,0]=4 5484 B19R3.50998 Cn1cc(nn1)CN2CCc3cnccc3C2 270004a_100020645890_100000749909 [0,1,0,0,0,1|2,0,0]=4 5485 B19R3.50998 Cn1cc(nn1)CN2CCc3ncccc3C2 270004a_100000699647_100000749909 [0,1,0,0,0,1|2,0,0]=4 5486 B19R3.50998 Cn1ccc(n1)CN2CCc3ccccc3C2 2230a_100000188457_100000726502 [0,1,0,0,0,1|2,0,0]=4 5487 B19R3.50998 Cn1ccc(n1)CN2CCc3ccccc3C2 269982a_100000188457_100000726502 [0,1,0,0,0,1|2,0,0]=4 5488 B19R3.50998 Cn1ccc(n1)CN2CCc3ccccc3C2 270004a_100000188457_100000750880 [0,1,0,0,0,1|2,0,0]=4 5489 B19R3.50998 Cn1ccc(n1)CN2CCc3ccccc3C2 34a_100000188457_100000726502 [0,1,0,0,0,1|2,0,0]=4 5490 B19R3.50998 Cn1cnc(c1)CN2CCc3ccccc3C2 2230a_100000188457_100000717665 [0,1,0,0,0,1|0,0,0]=2 5491 B19R3.50998 Cn1cnc(c1)CN2CCc3ccccc3C2 269982a_100000188457_100000717665 [0,1,0,0,0,1|0,0,0]=2 5492 B19R3.50998 Cn1cnc(c1)CN2CCc3ccccc3C2 270004a_100000188457_100000684808 [0,1,0,0,0,1|0,0,0]=2 5493 B19R3.50998 Cn1cnc(c1)CN2CCc3ccccc3C2 34a_100000188457_100000717665 [0,1,0,0,0,1|0,0,0]=2 5494 B19R3.50998 Cn1cnc(c1)CN2CCc3cccnc3C2 2230a_100015206102_100000717665 [0,1,0,0,0,1|1,0,0]=3 5495 B19R3.50998 Cn1cnc(c1)CN2CCc3cccnc3C2 269982a_100015206102_100000717665 [0,1,0,0,0,1|1,0,0]=3 5496 B19R3.50998 Cn1cnc(c1)CN2CCc3cccnc3C2 270004a_100015206102_100000684808 [0,1,0,0,0,1|1,0,0]=3 5497 B19R3.50998 Cn1cnc(c1)CN2CCc3ccncc3C2 2230a_100015190008_100000717665 [0,1,0,0,0,1|1,0,0]=3 5498 B19R3.50998 Cn1cnc(c1)CN2CCc3ccncc3C2 269982a_100015190008_100000717665 [0,1,0,0,0,1|1,0,0]=3 5499 B19R3.50998 Cn1cnc(c1)CN2CCc3ccncc3C2 270004a_100015190008_100000684808 [0,1,0,0,0,1|1,0,0]=3 5500 B19R3.50998 Cn1cnc(c1)CN2CCc3cnccc3C2 2230a_100020645890_100000717665 [0,1,0,0,0,1|1,0,0]=3 5501 B19R3.50998 Cn1cnc(c1)CN2CCc3cnccc3C2 269982a_100020645890_100000717665 [0,1,0,0,0,1|1,0,0]=3 5502 B19R3.50998 Cn1cnc(c1)CN2CCc3cnccc3C2 270004a_100020645890_100000684808 [0,1,0,0,0,1|1,0,0]=3 5503 B19R3.50998 Cn1cnc(c1)CN2CCc3ncccc3C2 2230a_100000699647_100000717665 [0,1,0,0,0,1|1,0,0]=3 5504 B19R3.50998 Cn1cnc(c1)CN2CCc3ncccc3C2 269982a_100000699647_100000717665 [0,1,0,0,0,1|1,0,0]=3 5505 B19R3.50998 Cn1cnc(c1)CN2CCc3ncccc3C2 270004a_100000699647_100000684808 [0,1,0,0,0,1|1,0,0]=3 5506 B19R3.50998 Cn1cnc(c1)CN2CCc3ncncc3C2 2230a_100012000121_100000717665 [0,1,0,0,0,1|2,0,0]=4 5507 B19R3.50998 Cn1cnc(c1)CN2CCc3ncncc3C2 269982a_100012000121_100000717665 [0,1,0,0,0,1|2,0,0]=4 5508 B19R3.50998 Cn1cnc(c1)CN2CCc3ncncc3C2 270004a_100012000121_100000684808 [0,1,0,0,0,1|2,0,0]=4 5509 B19R3.50998 Cn1cnc(n1)CN2CCc3ccccc3C2 2230a_100000188457_100016995526 [0,1,0,0,0,1|1,0,0]=3 5510 B19R3.50998 Cn1cnc(n1)CN2CCc3ccccc3C2 269982a_100000188457_100016995526 [0,1,0,0,0,1|1,0,0]=3 5511 B19R3.50998 Cn1cnc(n1)CN2CCc3ccccc3C2 270004a_100000188457_100010630104 [0,1,0,0,0,1|1,0,0]=3 5512 B19R3.50998 Cn1cnc(n1)CN2CCc3ccccc3C2 34a_100000188457_100016995526 [0,1,0,0,0,1|1,0,0]=3 5513 B19R3.50998 Cn1cnc(n1)CN2CCc3cccnc3C2 2230a_100015206102_100016995526 [0,1,0,0,0,1|2,0,0]=4 5514 B19R3.50998 Cn1cnc(n1)CN2CCc3cccnc3C2 269982a_100015206102_100016995526 [0,1,0,0,0,1|2,0,0]=4 5515 B19R3.50998 Cn1cnc(n1)CN2CCc3cccnc3C2 270004a_100015206102_100010630104 [0,1,0,0,0,1|2,0,0]=4 5516 B19R3.50998 Cn1cnc(n1)CN2CCc3ccncc3C2 2230a_100015190008_100016995526 [0,1,0,0,0,1|2,0,0]=4 5517 B19R3.50998 Cn1cnc(n1)CN2CCc3ccncc3C2 269982a_100015190008_100016995526 [0,1,0,0,0,1|2,0,0]=4 5518 B19R3.50998 Cn1cnc(n1)CN2CCc3ccncc3C2 270004a_100015190008_100010630104 [0,1,0,0,0,1|2,0,0]=4 5519 B19R3.50998 Cn1cnc(n1)CN2CCc3cnccc3C2 2230a_100020645890_100016995526 [0,1,0,0,0,1|2,0,0]=4 5520 B19R3.50998 Cn1cnc(n1)CN2CCc3cnccc3C2 269982a_100020645890_100016995526 [0,1,0,0,0,1|2,0,0]=4 5521 B19R3.50998 Cn1cnc(n1)CN2CCc3cnccc3C2 270004a_100020645890_100010630104 [0,1,0,0,0,1|2,0,0]=4 5522 B19R3.50998 Cn1cnc(n1)CN2CCc3ncccc3C2 2230a_100000699647_100016995526 [0,1,0,0,0,1|2,0,0]=4 5523 B19R3.50998 Cn1cnc(n1)CN2CCc3ncccc3C2 269982a_100000699647_100016995526 [0,1,0,0,0,1|2,0,0]=4 5524 B19R3.50998 Cn1cnc(n1)CN2CCc3ncccc3C2 270004a_100000699647_100010630104 [0,1,0,0,0,1|2,0,0]=4 5525 B19R3.50998 O=c1[nH]nc([nH]1)CN2CCc3ccccc3C2 2230a_100000188457_100000754189 [0,1,0,0,0,1|1,0,1]=4 5526 B19R3.50998 O=c1[nH]nc([nH]1)CN2CCc3ccccc3C2 269982a_100000188457_100000754189 [0,1,0,0,0,1|1,0,1]=4 5527 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 2230a_100015189961_100000707719 [0,1,0,0,0,1|0,0,0]=2 5528 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 269982a_100015189961_100000707719 [0,1,0,0,0,1|0,0,0]=2 5529 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 34a_100015189961_100000707719 [0,1,0,0,0,1|0,0,0]=2 5530 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cc[nH]n3 270004a_100015189961_100000738523 [0,1,0,0,0,1|2,0,0]=4 5531 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccco3 270004a_100015189961_100000186105 [0,1,0,0,0,1|2,0,0]=4 5532 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cccs3 270004a_100015189961_100000209959 [0,1,0,0,0,1|2,0,0]=4 5533 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccoc3 270004a_100015189961_100011215517 [0,1,0,0,0,1|2,0,0]=4 5534 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccon3 2230a_100015189961_100000234950 [0,1,0,0,0,1|2,0,0]=4 5535 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccon3 269982a_100015189961_100000234950 [0,1,0,0,0,1|2,0,0]=4 5536 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccon3 34a_100015189961_100000234950 [0,1,0,0,0,1|2,0,0]=4 5537 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccsc3 2230a_100015189961_100011261437 [0,1,0,0,0,1|2,0,0]=4 5538 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccsc3 269982a_100015189961_100011233845 [0,1,0,0,0,1|2,0,0]=4 5539 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccsc3 270004a_100015189961_100000188534 [0,1,0,0,0,1|2,0,0]=4 5540 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ccsc3 34a_100015189961_100011261437 [0,1,0,0,0,1|2,0,0]=4 5541 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cn[nH]c3 270004a_100015189961_100016992096 [0,1,0,0,0,1|2,0,0]=4 5542 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cnco3 270004a_100015189961_100000064291 [0,1,0,0,0,1|1,0,1]=4 5543 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cncs3 2230a_100015189961_100015185245 [0,1,0,0,0,1|1,0,1]=4 5544 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cncs3 269982a_100015189961_100015185245 [0,1,0,0,0,1|1,0,1]=4 5545 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cncs3 270004a_100015189961_100000749870 [0,1,0,0,0,1|1,0,1]=4 5546 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cncs3 34a_100015189961_100015185245 [0,1,0,0,0,1|1,0,1]=4 5547 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cocn3 270004a_100015189961_100000050382 [0,1,0,0,0,1|1,0,0]=3 5548 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cscn3 2230a_100015189961_100000205941 [0,1,0,0,0,1|1,0,0]=3 5549 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cscn3 269982a_100015189961_100000205941 [0,1,0,0,0,1|1,0,0]=3 5550 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cscn3 270004a_100015189961_100000743575 [0,1,0,0,0,1|1,0,0]=3 5551 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3cscn3 34a_100015189961_100000205941 [0,1,0,0,0,1|1,0,0]=3 5552 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3csnn3 270004a_100015189961_100000738508 [0,1,0,0,0,1|2,0,0]=4 5553 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 2230a_100015189961_100016991755 [0,1,0,0,0,1|2,0,0]=4 5554 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 269982a_100015189961_100016991755 [0,1,0,0,0,1|2,0,0]=4 5555 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 34a_100015189961_100016991755 [0,1,0,0,0,1|2,0,0]=4 5556 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncco3 2230a_100015189961_103436540062 [0,1,0,0,0,1|2,0,0]=4 5557 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncco3 269982a_100015189961_103436540062 [0,1,0,0,0,1|2,0,0]=4 5558 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncco3 270004a_100015189961_100000064290 [0,1,0,0,0,1|2,0,0]=4 5559 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncco3 34a_100015189961_103436540062 [0,1,0,0,0,1|2,0,0]=4 5560 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3nccs3 2230a_100015189961_100015184050 [0,1,0,0,0,1|2,0,0]=4 5561 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3nccs3 269982a_100015189961_100015184050 [0,1,0,0,0,1|2,0,0]=4 5562 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3nccs3 270004a_100015189961_100000750902 [0,1,0,0,0,1|2,0,0]=4 5563 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3nccs3 34a_100015189961_100015184050 [0,1,0,0,0,1|2,0,0]=4 5564 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncon3 269982a_100015189961_100000233494 [0,1,0,0,0,1|2,0,0]=4 5565 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cc3ncon3 34a_100015189961_100000233494 [0,1,0,0,0,1|2,0,0]=4 5566 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cn3cncn3 2230a_100015189961_200020645497 [0,1,0,0,0,1|1,0,1]=4 5567 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cn3cncn3 269982a_100015189961_200020645497 [0,1,0,0,0,1|1,0,1]=4 5568 B19R3.54903 Brc1ccc2c(c1)CN(CC2)Cn3cncn3 34a_100015189961_200020645497 [0,1,0,0,0,1|1,0,1]=4 5569 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 2230a_100011255368_100000707719 [0,1,0,0,0,1|0,0,0]=2 5570 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 269982a_100011255368_100000707719 [0,1,0,0,0,1|0,0,0]=2 5571 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 34a_100011255368_100000707719 [0,1,0,0,0,1|0,0,0]=2 5572 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cc[nH]n3 270004a_100011255368_100000738523 [0,1,0,0,0,1|2,0,0]=4 5573 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccco3 270004a_100011255368_100000186105 [0,1,0,0,0,1|2,0,0]=4 5574 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cccs3 270004a_100011255368_100000209959 [0,1,0,0,0,1|2,0,0]=4 5575 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccoc3 270004a_100011255368_100011215517 [0,1,0,0,0,1|2,0,0]=4 5576 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccon3 2230a_100011255368_100000234950 [0,1,0,0,0,1|2,0,0]=4 5577 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccon3 269982a_100011255368_100000234950 [0,1,0,0,0,1|2,0,0]=4 5578 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccon3 34a_100011255368_100000234950 [0,1,0,0,0,1|2,0,0]=4 5579 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccsc3 2230a_100011255368_100011261437 [0,1,0,0,0,1|2,0,0]=4 5580 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccsc3 269982a_100011255368_100011233845 [0,1,0,0,0,1|2,0,0]=4 5581 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccsc3 270004a_100011255368_100000188534 [0,1,0,0,0,1|2,0,0]=4 5582 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ccsc3 34a_100011255368_100011261437 [0,1,0,0,0,1|2,0,0]=4 5583 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cn[nH]c3 270004a_100011255368_100016992096 [0,1,0,0,0,1|2,0,0]=4 5584 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cnco3 270004a_100011255368_100000064291 [0,1,0,0,0,1|1,0,1]=4 5585 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cncs3 2230a_100011255368_100015185245 [0,1,0,0,0,1|1,0,1]=4 5586 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cncs3 269982a_100011255368_100015185245 [0,1,0,0,0,1|1,0,1]=4 5587 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cncs3 270004a_100011255368_100000749870 [0,1,0,0,0,1|1,0,1]=4 5588 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cncs3 34a_100011255368_100015185245 [0,1,0,0,0,1|1,0,1]=4 5589 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cocn3 270004a_100011255368_100000050382 [0,1,0,0,0,1|1,0,0]=3 5590 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cscn3 2230a_100011255368_100000205941 [0,1,0,0,0,1|1,0,0]=3 5591 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cscn3 269982a_100011255368_100000205941 [0,1,0,0,0,1|1,0,0]=3 5592 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cscn3 270004a_100011255368_100000743575 [0,1,0,0,0,1|1,0,0]=3 5593 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3cscn3 34a_100011255368_100000205941 [0,1,0,0,0,1|1,0,0]=3 5594 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3csnn3 270004a_100011255368_100000738508 [0,1,0,0,0,1|2,0,0]=4 5595 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 2230a_100011255368_100016991755 [0,1,0,0,0,1|2,0,0]=4 5596 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 269982a_100011255368_100016991755 [0,1,0,0,0,1|2,0,0]=4 5597 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 34a_100011255368_100016991755 [0,1,0,0,0,1|2,0,0]=4 5598 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncco3 2230a_100011255368_103436540062 [0,1,0,0,0,1|2,0,0]=4 5599 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncco3 269982a_100011255368_103436540062 [0,1,0,0,0,1|2,0,0]=4 5600 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncco3 270004a_100011255368_100000064290 [0,1,0,0,0,1|2,0,0]=4 5601 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncco3 34a_100011255368_103436540062 [0,1,0,0,0,1|2,0,0]=4 5602 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3nccs3 2230a_100011255368_100015184050 [0,1,0,0,0,1|2,0,0]=4 5603 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3nccs3 269982a_100011255368_100015184050 [0,1,0,0,0,1|2,0,0]=4 5604 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3nccs3 270004a_100011255368_100000750902 [0,1,0,0,0,1|2,0,0]=4 5605 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3nccs3 34a_100011255368_100015184050 [0,1,0,0,0,1|2,0,0]=4 5606 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncon3 269982a_100011255368_100000233494 [0,1,0,0,0,1|2,0,0]=4 5607 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cc3ncon3 34a_100011255368_100000233494 [0,1,0,0,0,1|2,0,0]=4 5608 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cn3cncn3 2230a_100011255368_200020645497 [0,1,0,0,0,1|1,0,1]=4 5609 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cn3cncn3 269982a_100011255368_200020645497 [0,1,0,0,0,1|1,0,1]=4 5610 B19R3.54903 Cc1ccc2c(c1)CN(CC2)Cn3cncn3 34a_100011255368_200020645497 [0,1,0,0,0,1|1,0,1]=4 5611 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 2230a_100000690163_100000707719 [0,1,0,0,0,1|0,0,0]=2 5612 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 269982a_100000690163_100000707719 [0,1,0,0,0,1|0,0,0]=2 5613 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 34a_100000690163_100000707719 [0,1,0,0,0,1|0,0,0]=2 5614 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cc[nH]n3 270004a_100000690163_100000738523 [0,1,0,0,0,1|2,0,0]=4 5615 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccco3 270004a_100000690163_100000186105 [0,1,0,0,0,1|2,0,0]=4 5616 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cccs3 270004a_100000690163_100000209959 [0,1,0,0,0,1|2,0,0]=4 5617 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccoc3 270004a_100000690163_100011215517 [0,1,0,0,0,1|2,0,0]=4 5618 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccon3 2230a_100000690163_100000234950 [0,1,0,0,0,1|2,0,0]=4 5619 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccon3 269982a_100000690163_100000234950 [0,1,0,0,0,1|2,0,0]=4 5620 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccon3 34a_100000690163_100000234950 [0,1,0,0,0,1|2,0,0]=4 5621 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccsc3 2230a_100000690163_100011261437 [0,1,0,0,0,1|2,0,0]=4 5622 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccsc3 269982a_100000690163_100011233845 [0,1,0,0,0,1|2,0,0]=4 5623 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccsc3 270004a_100000690163_100000188534 [0,1,0,0,0,1|2,0,0]=4 5624 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ccsc3 34a_100000690163_100011261437 [0,1,0,0,0,1|2,0,0]=4 5625 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cn[nH]c3 270004a_100000690163_100016992096 [0,1,0,0,0,1|2,0,0]=4 5626 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cnco3 270004a_100000690163_100000064291 [0,1,0,0,0,1|1,0,1]=4 5627 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cncs3 2230a_100000690163_100015185245 [0,1,0,0,0,1|1,0,1]=4 5628 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cncs3 269982a_100000690163_100015185245 [0,1,0,0,0,1|1,0,1]=4 5629 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cncs3 270004a_100000690163_100000749870 [0,1,0,0,0,1|1,0,1]=4 5630 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cncs3 34a_100000690163_100015185245 [0,1,0,0,0,1|1,0,1]=4 5631 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cocn3 270004a_100000690163_100000050382 [0,1,0,0,0,1|1,0,0]=3 5632 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cscn3 2230a_100000690163_100000205941 [0,1,0,0,0,1|1,0,0]=3 5633 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cscn3 269982a_100000690163_100000205941 [0,1,0,0,0,1|1,0,0]=3 5634 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cscn3 270004a_100000690163_100000743575 [0,1,0,0,0,1|1,0,0]=3 5635 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3cscn3 34a_100000690163_100000205941 [0,1,0,0,0,1|1,0,0]=3 5636 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3csnn3 270004a_100000690163_100000738508 [0,1,0,0,0,1|2,0,0]=4 5637 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 2230a_100000690163_100016991755 [0,1,0,0,0,1|2,0,0]=4 5638 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 269982a_100000690163_100016991755 [0,1,0,0,0,1|2,0,0]=4 5639 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 34a_100000690163_100016991755 [0,1,0,0,0,1|2,0,0]=4 5640 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncco3 2230a_100000690163_103436540062 [0,1,0,0,0,1|2,0,0]=4 5641 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncco3 269982a_100000690163_103436540062 [0,1,0,0,0,1|2,0,0]=4 5642 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncco3 270004a_100000690163_100000064290 [0,1,0,0,0,1|2,0,0]=4 5643 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncco3 34a_100000690163_103436540062 [0,1,0,0,0,1|2,0,0]=4 5644 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3nccs3 2230a_100000690163_100015184050 [0,1,0,0,0,1|2,0,0]=4 5645 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3nccs3 269982a_100000690163_100015184050 [0,1,0,0,0,1|2,0,0]=4 5646 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3nccs3 270004a_100000690163_100000750902 [0,1,0,0,0,1|2,0,0]=4 5647 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3nccs3 34a_100000690163_100015184050 [0,1,0,0,0,1|2,0,0]=4 5648 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncon3 269982a_100000690163_100000233494 [0,1,0,0,0,1|2,0,0]=4 5649 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cc3ncon3 34a_100000690163_100000233494 [0,1,0,0,0,1|2,0,0]=4 5650 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cn3cncn3 2230a_100000690163_200020645497 [0,1,0,0,0,1|1,0,1]=4 5651 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cn3cncn3 269982a_100000690163_200020645497 [0,1,0,0,0,1|1,0,1]=4 5652 B19R3.54903 Clc1ccc2c(c1)CN(CC2)Cn3cncn3 34a_100000690163_200020645497 [0,1,0,0,0,1|1,0,1]=4 5653 B19R3.54903 Clc1cnc2c(c1)CN(CC2)Cc3c[nH]cn3 2230a_100016987718_100000707719 [0,1,0,0,0,1|1,0,0]=3 5654 B19R3.54903 Clc1cnc2c(c1)CN(CC2)Cc3c[nH]cn3 269982a_100016987718_100000707719 [0,1,0,0,0,1|1,0,0]=3 5655 B19R3.54903 Clc1cnc2c(c1)CN(CC2)Cc3cocn3 270004a_100016987718_100000050382 [0,1,0,0,0,1|2,0,0]=4 5656 B19R3.54903 Clc1cnc2c(c1)CN(CC2)Cc3cscn3 2230a_100016987718_100000205941 [0,1,0,0,0,1|2,0,0]=4 5657 B19R3.54903 Clc1cnc2c(c1)CN(CC2)Cc3cscn3 269982a_100016987718_100000205941 [0,1,0,0,0,1|2,0,0]=4 5658 B19R3.54903 Clc1cnc2c(c1)CN(CC2)Cc3cscn3 270004a_100016987718_100000743575 [0,1,0,0,0,1|2,0,0]=4 5659 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 2230a_100000755980_100000707719 [0,1,0,0,0,1|0,0,0]=2 5660 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 269982a_100000755980_100000707719 [0,1,0,0,0,1|0,0,0]=2 5661 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 34a_100000755980_100000707719 [0,1,0,0,0,1|0,0,0]=2 5662 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cc[nH]n3 270004a_100000755980_100000738523 [0,1,0,0,0,1|2,0,0]=4 5663 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccco3 270004a_100000755980_100000186105 [0,1,0,0,0,1|2,0,0]=4 5664 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cccs3 270004a_100000755980_100000209959 [0,1,0,0,0,1|2,0,0]=4 5665 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccoc3 270004a_100000755980_100011215517 [0,1,0,0,0,1|2,0,0]=4 5666 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccon3 2230a_100000755980_100000234950 [0,1,0,0,0,1|2,0,0]=4 5667 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccon3 269982a_100000755980_100000234950 [0,1,0,0,0,1|2,0,0]=4 5668 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccon3 34a_100000755980_100000234950 [0,1,0,0,0,1|2,0,0]=4 5669 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccsc3 2230a_100000755980_100011261437 [0,1,0,0,0,1|2,0,0]=4 5670 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccsc3 269982a_100000755980_100011233845 [0,1,0,0,0,1|2,0,0]=4 5671 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccsc3 270004a_100000755980_100000188534 [0,1,0,0,0,1|2,0,0]=4 5672 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ccsc3 34a_100000755980_100011261437 [0,1,0,0,0,1|2,0,0]=4 5673 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cn[nH]c3 270004a_100000755980_100016992096 [0,1,0,0,0,1|2,0,0]=4 5674 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cnco3 270004a_100000755980_100000064291 [0,1,0,0,0,1|1,0,1]=4 5675 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cncs3 2230a_100000755980_100015185245 [0,1,0,0,0,1|1,0,1]=4 5676 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cncs3 269982a_100000755980_100015185245 [0,1,0,0,0,1|1,0,1]=4 5677 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cncs3 270004a_100000755980_100000749870 [0,1,0,0,0,1|1,0,1]=4 5678 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cncs3 34a_100000755980_100015185245 [0,1,0,0,0,1|1,0,1]=4 5679 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cocn3 270004a_100000755980_100000050382 [0,1,0,0,0,1|1,0,0]=3 5680 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cscn3 2230a_100000755980_100000205941 [0,1,0,0,0,1|1,0,0]=3 5681 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cscn3 269982a_100000755980_100000205941 [0,1,0,0,0,1|1,0,0]=3 5682 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cscn3 270004a_100000755980_100000743575 [0,1,0,0,0,1|1,0,0]=3 5683 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3cscn3 34a_100000755980_100000205941 [0,1,0,0,0,1|1,0,0]=3 5684 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3csnn3 270004a_100000755980_100000738508 [0,1,0,0,0,1|2,0,0]=4 5685 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 2230a_100000755980_100016991755 [0,1,0,0,0,1|2,0,0]=4 5686 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 269982a_100000755980_100016991755 [0,1,0,0,0,1|2,0,0]=4 5687 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 34a_100000755980_100016991755 [0,1,0,0,0,1|2,0,0]=4 5688 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncco3 2230a_100000755980_103436540062 [0,1,0,0,0,1|2,0,0]=4 5689 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncco3 269982a_100000755980_103436540062 [0,1,0,0,0,1|2,0,0]=4 5690 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncco3 270004a_100000755980_100000064290 [0,1,0,0,0,1|2,0,0]=4 5691 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncco3 34a_100000755980_103436540062 [0,1,0,0,0,1|2,0,0]=4 5692 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3nccs3 2230a_100000755980_100015184050 [0,1,0,0,0,1|2,0,0]=4 5693 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3nccs3 269982a_100000755980_100015184050 [0,1,0,0,0,1|2,0,0]=4 5694 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3nccs3 270004a_100000755980_100000750902 [0,1,0,0,0,1|2,0,0]=4 5695 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3nccs3 34a_100000755980_100015184050 [0,1,0,0,0,1|2,0,0]=4 5696 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncon3 269982a_100000755980_100000233494 [0,1,0,0,0,1|2,0,0]=4 5697 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cc3ncon3 34a_100000755980_100000233494 [0,1,0,0,0,1|2,0,0]=4 5698 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cn3cncn3 2230a_100000755980_200020645497 [0,1,0,0,0,1|1,0,1]=4 5699 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cn3cncn3 269982a_100000755980_200020645497 [0,1,0,0,0,1|1,0,1]=4 5700 B19R3.54903 Fc1ccc2c(c1)CN(CC2)Cn3cncn3 34a_100000755980_200020645497 [0,1,0,0,0,1|1,0,1]=4 5701 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 2230a_100015185785_100000707719 [0,1,0,0,0,1|0,0,0]=2 5702 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 269982a_100015185785_100000707719 [0,1,0,0,0,1|0,0,0]=2 5703 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3c[nH]cn3 34a_100015185785_100000707719 [0,1,0,0,0,1|0,0,0]=2 5704 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cc[nH]n3 270004a_100015185785_100000738523 [0,1,0,0,0,1|2,0,0]=4 5705 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccco3 270004a_100015185785_100000186105 [0,1,0,0,0,1|2,0,0]=4 5706 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cccs3 270004a_100015185785_100000209959 [0,1,0,0,0,1|2,0,0]=4 5707 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccoc3 270004a_100015185785_100011215517 [0,1,0,0,0,1|2,0,0]=4 5708 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccon3 2230a_100015185785_100000234950 [0,1,0,0,0,1|2,0,0]=4 5709 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccon3 269982a_100015185785_100000234950 [0,1,0,0,0,1|2,0,0]=4 5710 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccon3 34a_100015185785_100000234950 [0,1,0,0,0,1|2,0,0]=4 5711 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccsc3 2230a_100015185785_100011261437 [0,1,0,0,0,1|2,0,0]=4 5712 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccsc3 269982a_100015185785_100011233845 [0,1,0,0,0,1|2,0,0]=4 5713 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccsc3 270004a_100015185785_100000188534 [0,1,0,0,0,1|2,0,0]=4 5714 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ccsc3 34a_100015185785_100011261437 [0,1,0,0,0,1|2,0,0]=4 5715 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cn[nH]c3 270004a_100015185785_100016992096 [0,1,0,0,0,1|2,0,0]=4 5716 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cnco3 270004a_100015185785_100000064291 [0,1,0,0,0,1|1,0,1]=4 5717 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cncs3 2230a_100015185785_100015185245 [0,1,0,0,0,1|1,0,1]=4 5718 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cncs3 269982a_100015185785_100015185245 [0,1,0,0,0,1|1,0,1]=4 5719 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cncs3 270004a_100015185785_100000749870 [0,1,0,0,0,1|1,0,1]=4 5720 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cncs3 34a_100015185785_100015185245 [0,1,0,0,0,1|1,0,1]=4 5721 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cocn3 270004a_100015185785_100000050382 [0,1,0,0,0,1|1,0,0]=3 5722 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cscn3 2230a_100015185785_100000205941 [0,1,0,0,0,1|1,0,0]=3 5723 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cscn3 269982a_100015185785_100000205941 [0,1,0,0,0,1|1,0,0]=3 5724 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cscn3 270004a_100015185785_100000743575 [0,1,0,0,0,1|1,0,0]=3 5725 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3cscn3 34a_100015185785_100000205941 [0,1,0,0,0,1|1,0,0]=3 5726 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3csnn3 270004a_100015185785_100000738508 [0,1,0,0,0,1|2,0,0]=4 5727 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 2230a_100015185785_100016991755 [0,1,0,0,0,1|2,0,0]=4 5728 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 269982a_100015185785_100016991755 [0,1,0,0,0,1|2,0,0]=4 5729 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncc[nH]3 34a_100015185785_100016991755 [0,1,0,0,0,1|2,0,0]=4 5730 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncco3 2230a_100015185785_103436540062 [0,1,0,0,0,1|2,0,0]=4 5731 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncco3 269982a_100015185785_103436540062 [0,1,0,0,0,1|2,0,0]=4 5732 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncco3 270004a_100015185785_100000064290 [0,1,0,0,0,1|2,0,0]=4 5733 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncco3 34a_100015185785_103436540062 [0,1,0,0,0,1|2,0,0]=4 5734 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3nccs3 2230a_100015185785_100015184050 [0,1,0,0,0,1|2,0,0]=4 5735 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3nccs3 269982a_100015185785_100015184050 [0,1,0,0,0,1|2,0,0]=4 5736 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3nccs3 270004a_100015185785_100000750902 [0,1,0,0,0,1|2,0,0]=4 5737 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3nccs3 34a_100015185785_100015184050 [0,1,0,0,0,1|2,0,0]=4 5738 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncon3 269982a_100015185785_100000233494 [0,1,0,0,0,1|2,0,0]=4 5739 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cc3ncon3 34a_100015185785_100000233494 [0,1,0,0,0,1|2,0,0]=4 5740 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cn3cncn3 2230a_100015185785_200020645497 [0,1,0,0,0,1|1,0,1]=4 5741 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cn3cncn3 269982a_100015185785_200020645497 [0,1,0,0,0,1|1,0,1]=4 5742 B19R3.54903 Oc1ccc2c(c1)CN(CC2)Cn3cncn3 34a_100015185785_200020645497 [0,1,0,0,0,1|1,0,1]=4 5743 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 2230a_100000686056_100000707719 [0,1,0,0,0,1|0,0,0]=2 5744 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 269982a_100000686056_100000707719 [0,1,0,0,0,1|0,0,0]=2 5745 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 34a_100000686056_100000707719 [0,1,0,0,0,1|0,0,0]=2 5746 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cc[nH]n3 270004a_100000686056_100000738523 [0,1,0,0,0,1|2,0,0]=4 5747 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccco3 270004a_100000686056_100000186105 [0,1,0,0,0,1|2,0,0]=4 5748 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cccs3 270004a_100000686056_100000209959 [0,1,0,0,0,1|2,0,0]=4 5749 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccoc3 270004a_100000686056_100011215517 [0,1,0,0,0,1|2,0,0]=4 5750 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccon3 2230a_100000686056_100000234950 [0,1,0,0,0,1|2,0,0]=4 5751 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccon3 269982a_100000686056_100000234950 [0,1,0,0,0,1|2,0,0]=4 5752 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccon3 34a_100000686056_100000234950 [0,1,0,0,0,1|2,0,0]=4 5753 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccsc3 2230a_100000686056_100011261437 [0,1,0,0,0,1|2,0,0]=4 5754 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccsc3 269982a_100000686056_100011233845 [0,1,0,0,0,1|2,0,0]=4 5755 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccsc3 270004a_100000686056_100000188534 [0,1,0,0,0,1|2,0,0]=4 5756 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ccsc3 34a_100000686056_100011261437 [0,1,0,0,0,1|2,0,0]=4 5757 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cn[nH]c3 270004a_100000686056_100016992096 [0,1,0,0,0,1|2,0,0]=4 5758 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cnco3 270004a_100000686056_100000064291 [0,1,0,0,0,1|1,0,1]=4 5759 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cncs3 2230a_100000686056_100015185245 [0,1,0,0,0,1|1,0,1]=4 5760 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cncs3 269982a_100000686056_100015185245 [0,1,0,0,0,1|1,0,1]=4 5761 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cncs3 270004a_100000686056_100000749870 [0,1,0,0,0,1|1,0,1]=4 5762 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cncs3 34a_100000686056_100015185245 [0,1,0,0,0,1|1,0,1]=4 5763 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cocn3 270004a_100000686056_100000050382 [0,1,0,0,0,1|1,0,0]=3 5764 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cscn3 2230a_100000686056_100000205941 [0,1,0,0,0,1|1,0,0]=3 5765 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cscn3 269982a_100000686056_100000205941 [0,1,0,0,0,1|1,0,0]=3 5766 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cscn3 270004a_100000686056_100000743575 [0,1,0,0,0,1|1,0,0]=3 5767 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3cscn3 34a_100000686056_100000205941 [0,1,0,0,0,1|1,0,0]=3 5768 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3csnn3 270004a_100000686056_100000738508 [0,1,0,0,0,1|2,0,0]=4 5769 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 2230a_100000686056_100016991755 [0,1,0,0,0,1|2,0,0]=4 5770 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 269982a_100000686056_100016991755 [0,1,0,0,0,1|2,0,0]=4 5771 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 34a_100000686056_100016991755 [0,1,0,0,0,1|2,0,0]=4 5772 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncco3 2230a_100000686056_103436540062 [0,1,0,0,0,1|2,0,0]=4 5773 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncco3 269982a_100000686056_103436540062 [0,1,0,0,0,1|2,0,0]=4 5774 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncco3 270004a_100000686056_100000064290 [0,1,0,0,0,1|2,0,0]=4 5775 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncco3 34a_100000686056_103436540062 [0,1,0,0,0,1|2,0,0]=4 5776 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3nccs3 2230a_100000686056_100015184050 [0,1,0,0,0,1|2,0,0]=4 5777 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3nccs3 269982a_100000686056_100015184050 [0,1,0,0,0,1|2,0,0]=4 5778 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3nccs3 270004a_100000686056_100000750902 [0,1,0,0,0,1|2,0,0]=4 5779 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3nccs3 34a_100000686056_100015184050 [0,1,0,0,0,1|2,0,0]=4 5780 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncon3 269982a_100000686056_100000233494 [0,1,0,0,0,1|2,0,0]=4 5781 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cc3ncon3 34a_100000686056_100000233494 [0,1,0,0,0,1|2,0,0]=4 5782 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cn3cncn3 2230a_100000686056_200020645497 [0,1,0,0,0,1|1,0,1]=4 5783 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cn3cncn3 269982a_100000686056_200020645497 [0,1,0,0,0,1|1,0,1]=4 5784 B19R3.55014 Brc1ccc2c(c1)CCN(C2)Cn3cncn3 34a_100000686056_200020645497 [0,1,0,0,0,1|1,0,1]=4 5785 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 2230a_100000718575_100000707719 [0,1,0,0,0,1|0,0,0]=2 5786 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 269982a_100000718575_100000707719 [0,1,0,0,0,1|0,0,0]=2 5787 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 34a_100000718575_100000707719 [0,1,0,0,0,1|0,0,0]=2 5788 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cc[nH]n3 270004a_100000718575_100000738523 [0,1,0,0,0,1|2,0,0]=4 5789 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccco3 270004a_100000718575_100000186105 [0,1,0,0,0,1|2,0,0]=4 5790 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cccs3 270004a_100000718575_100000209959 [0,1,0,0,0,1|2,0,0]=4 5791 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccoc3 270004a_100000718575_100011215517 [0,1,0,0,0,1|2,0,0]=4 5792 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccon3 2230a_100000718575_100000234950 [0,1,0,0,0,1|2,0,0]=4 5793 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccon3 269982a_100000718575_100000234950 [0,1,0,0,0,1|2,0,0]=4 5794 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccon3 34a_100000718575_100000234950 [0,1,0,0,0,1|2,0,0]=4 5795 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccsc3 2230a_100000718575_100011261437 [0,1,0,0,0,1|2,0,0]=4 5796 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccsc3 269982a_100000718575_100011233845 [0,1,0,0,0,1|2,0,0]=4 5797 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccsc3 270004a_100000718575_100000188534 [0,1,0,0,0,1|2,0,0]=4 5798 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ccsc3 34a_100000718575_100011261437 [0,1,0,0,0,1|2,0,0]=4 5799 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cn[nH]c3 270004a_100000718575_100016992096 [0,1,0,0,0,1|2,0,0]=4 5800 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cnco3 270004a_100000718575_100000064291 [0,1,0,0,0,1|1,0,1]=4 5801 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cncs3 2230a_100000718575_100015185245 [0,1,0,0,0,1|1,0,1]=4 5802 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cncs3 269982a_100000718575_100015185245 [0,1,0,0,0,1|1,0,1]=4 5803 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cncs3 270004a_100000718575_100000749870 [0,1,0,0,0,1|1,0,1]=4 5804 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cncs3 34a_100000718575_100015185245 [0,1,0,0,0,1|1,0,1]=4 5805 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cocn3 270004a_100000718575_100000050382 [0,1,0,0,0,1|1,0,0]=3 5806 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cscn3 2230a_100000718575_100000205941 [0,1,0,0,0,1|1,0,0]=3 5807 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cscn3 269982a_100000718575_100000205941 [0,1,0,0,0,1|1,0,0]=3 5808 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cscn3 270004a_100000718575_100000743575 [0,1,0,0,0,1|1,0,0]=3 5809 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3cscn3 34a_100000718575_100000205941 [0,1,0,0,0,1|1,0,0]=3 5810 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3csnn3 270004a_100000718575_100000738508 [0,1,0,0,0,1|2,0,0]=4 5811 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 2230a_100000718575_100016991755 [0,1,0,0,0,1|2,0,0]=4 5812 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 269982a_100000718575_100016991755 [0,1,0,0,0,1|2,0,0]=4 5813 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 34a_100000718575_100016991755 [0,1,0,0,0,1|2,0,0]=4 5814 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncco3 2230a_100000718575_103436540062 [0,1,0,0,0,1|2,0,0]=4 5815 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncco3 269982a_100000718575_103436540062 [0,1,0,0,0,1|2,0,0]=4 5816 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncco3 270004a_100000718575_100000064290 [0,1,0,0,0,1|2,0,0]=4 5817 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncco3 34a_100000718575_103436540062 [0,1,0,0,0,1|2,0,0]=4 5818 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3nccs3 2230a_100000718575_100015184050 [0,1,0,0,0,1|2,0,0]=4 5819 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3nccs3 269982a_100000718575_100015184050 [0,1,0,0,0,1|2,0,0]=4 5820 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3nccs3 270004a_100000718575_100000750902 [0,1,0,0,0,1|2,0,0]=4 5821 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3nccs3 34a_100000718575_100015184050 [0,1,0,0,0,1|2,0,0]=4 5822 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncon3 269982a_100000718575_100000233494 [0,1,0,0,0,1|2,0,0]=4 5823 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cc3ncon3 34a_100000718575_100000233494 [0,1,0,0,0,1|2,0,0]=4 5824 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cn3cncn3 2230a_100000718575_200020645497 [0,1,0,0,0,1|1,0,1]=4 5825 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cn3cncn3 269982a_100000718575_200020645497 [0,1,0,0,0,1|1,0,1]=4 5826 B19R3.55014 Cc1ccc2c(c1)CCN(C2)Cn3cncn3 34a_100000718575_200020645497 [0,1,0,0,0,1|1,0,1]=4 5827 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 2230a_100011273784_100000707719 [0,1,0,0,0,1|0,0,0]=2 5828 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 269982a_100011273784_100000707719 [0,1,0,0,0,1|0,0,0]=2 5829 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 34a_100011273784_100000707719 [0,1,0,0,0,1|0,0,0]=2 5830 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cc[nH]n3 270004a_100011273784_100000738523 [0,1,0,0,0,1|2,0,0]=4 5831 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccco3 270004a_100011273784_100000186105 [0,1,0,0,0,1|2,0,0]=4 5832 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cccs3 270004a_100011273784_100000209959 [0,1,0,0,0,1|2,0,0]=4 5833 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccoc3 270004a_100011273784_100011215517 [0,1,0,0,0,1|2,0,0]=4 5834 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccon3 2230a_100011273784_100000234950 [0,1,0,0,0,1|2,0,0]=4 5835 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccon3 269982a_100011273784_100000234950 [0,1,0,0,0,1|2,0,0]=4 5836 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccon3 34a_100011273784_100000234950 [0,1,0,0,0,1|2,0,0]=4 5837 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccsc3 2230a_100011273784_100011261437 [0,1,0,0,0,1|2,0,0]=4 5838 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccsc3 269982a_100011273784_100011233845 [0,1,0,0,0,1|2,0,0]=4 5839 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccsc3 270004a_100011273784_100000188534 [0,1,0,0,0,1|2,0,0]=4 5840 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ccsc3 34a_100011273784_100011261437 [0,1,0,0,0,1|2,0,0]=4 5841 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cn[nH]c3 270004a_100011273784_100016992096 [0,1,0,0,0,1|2,0,0]=4 5842 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cnco3 270004a_100011273784_100000064291 [0,1,0,0,0,1|1,0,1]=4 5843 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cncs3 2230a_100011273784_100015185245 [0,1,0,0,0,1|1,0,1]=4 5844 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cncs3 269982a_100011273784_100015185245 [0,1,0,0,0,1|1,0,1]=4 5845 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cncs3 270004a_100011273784_100000749870 [0,1,0,0,0,1|1,0,1]=4 5846 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cncs3 34a_100011273784_100015185245 [0,1,0,0,0,1|1,0,1]=4 5847 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cocn3 270004a_100011273784_100000050382 [0,1,0,0,0,1|1,0,0]=3 5848 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cscn3 2230a_100011273784_100000205941 [0,1,0,0,0,1|1,0,0]=3 5849 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cscn3 269982a_100011273784_100000205941 [0,1,0,0,0,1|1,0,0]=3 5850 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cscn3 270004a_100011273784_100000743575 [0,1,0,0,0,1|1,0,0]=3 5851 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3cscn3 34a_100011273784_100000205941 [0,1,0,0,0,1|1,0,0]=3 5852 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3csnn3 270004a_100011273784_100000738508 [0,1,0,0,0,1|2,0,0]=4 5853 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 2230a_100011273784_100016991755 [0,1,0,0,0,1|2,0,0]=4 5854 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 269982a_100011273784_100016991755 [0,1,0,0,0,1|2,0,0]=4 5855 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 34a_100011273784_100016991755 [0,1,0,0,0,1|2,0,0]=4 5856 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncco3 2230a_100011273784_103436540062 [0,1,0,0,0,1|2,0,0]=4 5857 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncco3 269982a_100011273784_103436540062 [0,1,0,0,0,1|2,0,0]=4 5858 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncco3 270004a_100011273784_100000064290 [0,1,0,0,0,1|2,0,0]=4 5859 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncco3 34a_100011273784_103436540062 [0,1,0,0,0,1|2,0,0]=4 5860 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3nccs3 2230a_100011273784_100015184050 [0,1,0,0,0,1|2,0,0]=4 5861 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3nccs3 269982a_100011273784_100015184050 [0,1,0,0,0,1|2,0,0]=4 5862 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3nccs3 270004a_100011273784_100000750902 [0,1,0,0,0,1|2,0,0]=4 5863 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3nccs3 34a_100011273784_100015184050 [0,1,0,0,0,1|2,0,0]=4 5864 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncon3 269982a_100011273784_100000233494 [0,1,0,0,0,1|2,0,0]=4 5865 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cc3ncon3 34a_100011273784_100000233494 [0,1,0,0,0,1|2,0,0]=4 5866 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cn3cncn3 2230a_100011273784_200020645497 [0,1,0,0,0,1|1,0,1]=4 5867 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cn3cncn3 269982a_100011273784_200020645497 [0,1,0,0,0,1|1,0,1]=4 5868 B19R3.55014 Clc1ccc2c(c1)CCN(C2)Cn3cncn3 34a_100011273784_200020645497 [0,1,0,0,0,1|1,0,1]=4 5869 B19R3.55014 Clc1ccc2c(n1)CCN(C2)Cc3c[nH]cn3 2230a_100015190003_100000707719 [0,1,0,0,0,1|1,0,0]=3 5870 B19R3.55014 Clc1ccc2c(n1)CCN(C2)Cc3c[nH]cn3 269982a_100015190003_100000707719 [0,1,0,0,0,1|1,0,0]=3 5871 B19R3.55014 Clc1ccc2c(n1)CCN(C2)Cc3c[nH]cn3 34a_100015190003_100000707719 [0,1,0,0,0,1|1,0,0]=3 5872 B19R3.55014 Clc1ccc2c(n1)CCN(C2)Cc3cscn3 2230a_100015190003_100000205941 [0,1,0,0,0,1|2,0,0]=4 5873 B19R3.55014 Clc1ccc2c(n1)CCN(C2)Cc3cscn3 269982a_100015190003_100000205941 [0,1,0,0,0,1|2,0,0]=4 5874 B19R3.55014 Clc1ccc2c(n1)CCN(C2)Cc3cscn3 34a_100015190003_100000205941 [0,1,0,0,0,1|2,0,0]=4 5875 B19R3.55014 Clc1ncc2c(n1)CCN(C2)Cc3c[nH]cn3 2230a_100020629273_100000707719 [0,1,0,0,0,1|2,0,0]=4 5876 B19R3.55014 Clc1ncc2c(n1)CCN(C2)Cc3c[nH]cn3 269982a_100020629273_100000707719 [0,1,0,0,0,1|2,0,0]=4 5877 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 2230a_100011273785_100000707719 [0,1,0,0,0,1|0,0,0]=2 5878 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 269982a_100011273785_100000707719 [0,1,0,0,0,1|0,0,0]=2 5879 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 34a_100011273785_100000707719 [0,1,0,0,0,1|0,0,0]=2 5880 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cc[nH]n3 270004a_100011273785_100000738523 [0,1,0,0,0,1|2,0,0]=4 5881 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccco3 270004a_100011273785_100000186105 [0,1,0,0,0,1|2,0,0]=4 5882 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cccs3 270004a_100011273785_100000209959 [0,1,0,0,0,1|2,0,0]=4 5883 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccoc3 270004a_100011273785_100011215517 [0,1,0,0,0,1|2,0,0]=4 5884 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccon3 2230a_100011273785_100000234950 [0,1,0,0,0,1|2,0,0]=4 5885 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccon3 269982a_100011273785_100000234950 [0,1,0,0,0,1|2,0,0]=4 5886 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccon3 34a_100011273785_100000234950 [0,1,0,0,0,1|2,0,0]=4 5887 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccsc3 2230a_100011273785_100011261437 [0,1,0,0,0,1|2,0,0]=4 5888 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccsc3 269982a_100011273785_100011233845 [0,1,0,0,0,1|2,0,0]=4 5889 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccsc3 270004a_100011273785_100000188534 [0,1,0,0,0,1|2,0,0]=4 5890 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ccsc3 34a_100011273785_100011261437 [0,1,0,0,0,1|2,0,0]=4 5891 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cn[nH]c3 270004a_100011273785_100016992096 [0,1,0,0,0,1|2,0,0]=4 5892 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cnco3 270004a_100011273785_100000064291 [0,1,0,0,0,1|1,0,1]=4 5893 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cncs3 2230a_100011273785_100015185245 [0,1,0,0,0,1|1,0,1]=4 5894 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cncs3 269982a_100011273785_100015185245 [0,1,0,0,0,1|1,0,1]=4 5895 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cncs3 270004a_100011273785_100000749870 [0,1,0,0,0,1|1,0,1]=4 5896 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cncs3 34a_100011273785_100015185245 [0,1,0,0,0,1|1,0,1]=4 5897 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cocn3 270004a_100011273785_100000050382 [0,1,0,0,0,1|1,0,0]=3 5898 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cscn3 2230a_100011273785_100000205941 [0,1,0,0,0,1|1,0,0]=3 5899 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cscn3 269982a_100011273785_100000205941 [0,1,0,0,0,1|1,0,0]=3 5900 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cscn3 270004a_100011273785_100000743575 [0,1,0,0,0,1|1,0,0]=3 5901 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3cscn3 34a_100011273785_100000205941 [0,1,0,0,0,1|1,0,0]=3 5902 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3csnn3 270004a_100011273785_100000738508 [0,1,0,0,0,1|2,0,0]=4 5903 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 2230a_100011273785_100016991755 [0,1,0,0,0,1|2,0,0]=4 5904 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 269982a_100011273785_100016991755 [0,1,0,0,0,1|2,0,0]=4 5905 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 34a_100011273785_100016991755 [0,1,0,0,0,1|2,0,0]=4 5906 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncco3 2230a_100011273785_103436540062 [0,1,0,0,0,1|2,0,0]=4 5907 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncco3 269982a_100011273785_103436540062 [0,1,0,0,0,1|2,0,0]=4 5908 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncco3 270004a_100011273785_100000064290 [0,1,0,0,0,1|2,0,0]=4 5909 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncco3 34a_100011273785_103436540062 [0,1,0,0,0,1|2,0,0]=4 5910 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3nccs3 2230a_100011273785_100015184050 [0,1,0,0,0,1|2,0,0]=4 5911 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3nccs3 269982a_100011273785_100015184050 [0,1,0,0,0,1|2,0,0]=4 5912 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3nccs3 270004a_100011273785_100000750902 [0,1,0,0,0,1|2,0,0]=4 5913 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3nccs3 34a_100011273785_100015184050 [0,1,0,0,0,1|2,0,0]=4 5914 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncon3 269982a_100011273785_100000233494 [0,1,0,0,0,1|2,0,0]=4 5915 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cc3ncon3 34a_100011273785_100000233494 [0,1,0,0,0,1|2,0,0]=4 5916 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cn3cncn3 2230a_100011273785_200020645497 [0,1,0,0,0,1|1,0,1]=4 5917 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cn3cncn3 269982a_100011273785_200020645497 [0,1,0,0,0,1|1,0,1]=4 5918 B19R3.55014 Fc1ccc2c(c1)CCN(C2)Cn3cncn3 34a_100011273785_200020645497 [0,1,0,0,0,1|1,0,1]=4 5919 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 2230a_100000077532_100000707719 [0,1,0,0,0,1|0,0,0]=2 5920 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 269982a_100000077532_100000707719 [0,1,0,0,0,1|0,0,0]=2 5921 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3c[nH]cn3 34a_100000077532_100000707719 [0,1,0,0,0,1|0,0,0]=2 5922 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cc[nH]n3 270004a_100000077532_100000738523 [0,1,0,0,0,1|2,0,0]=4 5923 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccco3 270004a_100000077532_100000186105 [0,1,0,0,0,1|2,0,0]=4 5924 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cccs3 270004a_100000077532_100000209959 [0,1,0,0,0,1|2,0,0]=4 5925 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccoc3 270004a_100000077532_100011215517 [0,1,0,0,0,1|2,0,0]=4 5926 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccon3 2230a_100000077532_100000234950 [0,1,0,0,0,1|2,0,0]=4 5927 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccon3 269982a_100000077532_100000234950 [0,1,0,0,0,1|2,0,0]=4 5928 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccon3 34a_100000077532_100000234950 [0,1,0,0,0,1|2,0,0]=4 5929 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccsc3 2230a_100000077532_100011261437 [0,1,0,0,0,1|2,0,0]=4 5930 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccsc3 269982a_100000077532_100011233845 [0,1,0,0,0,1|2,0,0]=4 5931 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccsc3 270004a_100000077532_100000188534 [0,1,0,0,0,1|2,0,0]=4 5932 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ccsc3 34a_100000077532_100011261437 [0,1,0,0,0,1|2,0,0]=4 5933 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cn[nH]c3 270004a_100000077532_100016992096 [0,1,0,0,0,1|2,0,0]=4 5934 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cnco3 270004a_100000077532_100000064291 [0,1,0,0,0,1|1,0,1]=4 5935 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cncs3 2230a_100000077532_100015185245 [0,1,0,0,0,1|1,0,1]=4 5936 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cncs3 269982a_100000077532_100015185245 [0,1,0,0,0,1|1,0,1]=4 5937 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cncs3 270004a_100000077532_100000749870 [0,1,0,0,0,1|1,0,1]=4 5938 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cncs3 34a_100000077532_100015185245 [0,1,0,0,0,1|1,0,1]=4 5939 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cocn3 270004a_100000077532_100000050382 [0,1,0,0,0,1|1,0,0]=3 5940 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cscn3 2230a_100000077532_100000205941 [0,1,0,0,0,1|1,0,0]=3 5941 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cscn3 269982a_100000077532_100000205941 [0,1,0,0,0,1|1,0,0]=3 5942 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cscn3 270004a_100000077532_100000743575 [0,1,0,0,0,1|1,0,0]=3 5943 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3cscn3 34a_100000077532_100000205941 [0,1,0,0,0,1|1,0,0]=3 5944 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3csnn3 270004a_100000077532_100000738508 [0,1,0,0,0,1|2,0,0]=4 5945 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 2230a_100000077532_100016991755 [0,1,0,0,0,1|2,0,0]=4 5946 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 269982a_100000077532_100016991755 [0,1,0,0,0,1|2,0,0]=4 5947 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncc[nH]3 34a_100000077532_100016991755 [0,1,0,0,0,1|2,0,0]=4 5948 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncco3 2230a_100000077532_103436540062 [0,1,0,0,0,1|2,0,0]=4 5949 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncco3 269982a_100000077532_103436540062 [0,1,0,0,0,1|2,0,0]=4 5950 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncco3 270004a_100000077532_100000064290 [0,1,0,0,0,1|2,0,0]=4 5951 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncco3 34a_100000077532_103436540062 [0,1,0,0,0,1|2,0,0]=4 5952 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3nccs3 2230a_100000077532_100015184050 [0,1,0,0,0,1|2,0,0]=4 5953 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3nccs3 269982a_100000077532_100015184050 [0,1,0,0,0,1|2,0,0]=4 5954 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3nccs3 270004a_100000077532_100000750902 [0,1,0,0,0,1|2,0,0]=4 5955 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3nccs3 34a_100000077532_100015184050 [0,1,0,0,0,1|2,0,0]=4 5956 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncon3 269982a_100000077532_100000233494 [0,1,0,0,0,1|2,0,0]=4 5957 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cc3ncon3 34a_100000077532_100000233494 [0,1,0,0,0,1|2,0,0]=4 5958 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cn3cncn3 2230a_100000077532_200020645497 [0,1,0,0,0,1|1,0,1]=4 5959 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cn3cncn3 269982a_100000077532_200020645497 [0,1,0,0,0,1|1,0,1]=4 5960 B19R3.55014 Oc1ccc2c(c1)CCN(C2)Cn3cncn3 34a_100000077532_200020645497 [0,1,0,0,0,1|1,0,1]=4 5961 B19R3.55014 Oc1ncc2c(n1)CCN(C2)Cc3c[nH]cn3 2230a_200025716142_100000707719 [0,1,0,0,0,1|2,0,0]=4 5962 B19R3.55014 Oc1ncc2c(n1)CCN(C2)Cc3c[nH]cn3 269982a_200025716142_100000707719 [0,1,0,0,0,1|2,0,0]=4 5963 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3c[nH]cn3 2230a_100000756787_100000707719 [0,1,0,0,0,1|0,0,0]=2 5964 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3c[nH]cn3 269982a_100000756787_100000707719 [0,1,0,0,0,1|0,0,0]=2 5965 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3c[nH]cn3 34a_100000756787_100000707719 [0,1,0,0,0,1|0,0,0]=2 5966 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cc[nH]n3 270004a_100000756787_100000738523 [0,1,0,0,0,1|2,0,0]=4 5967 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccco3 270004a_100000756787_100000186105 [0,1,0,0,0,1|2,0,0]=4 5968 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cccs3 270004a_100000756787_100000209959 [0,1,0,0,0,1|2,0,0]=4 5969 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccoc3 270004a_100000756787_100011215517 [0,1,0,0,0,1|2,0,0]=4 5970 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccon3 2230a_100000756787_100000234950 [0,1,0,0,0,1|2,0,0]=4 5971 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccon3 269982a_100000756787_100000234950 [0,1,0,0,0,1|2,0,0]=4 5972 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccon3 34a_100000756787_100000234950 [0,1,0,0,0,1|2,0,0]=4 5973 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccsc3 2230a_100000756787_100011261437 [0,1,0,0,0,1|2,0,0]=4 5974 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccsc3 269982a_100000756787_100011233845 [0,1,0,0,0,1|2,0,0]=4 5975 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccsc3 270004a_100000756787_100000188534 [0,1,0,0,0,1|2,0,0]=4 5976 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ccsc3 34a_100000756787_100011261437 [0,1,0,0,0,1|2,0,0]=4 5977 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cn[nH]c3 270004a_100000756787_100016992096 [0,1,0,0,0,1|2,0,0]=4 5978 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cnco3 270004a_100000756787_100000064291 [0,1,0,0,0,1|1,0,1]=4 5979 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cncs3 2230a_100000756787_100015185245 [0,1,0,0,0,1|1,0,1]=4 5980 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cncs3 269982a_100000756787_100015185245 [0,1,0,0,0,1|1,0,1]=4 5981 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cncs3 270004a_100000756787_100000749870 [0,1,0,0,0,1|1,0,1]=4 5982 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cncs3 34a_100000756787_100015185245 [0,1,0,0,0,1|1,0,1]=4 5983 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cocn3 270004a_100000756787_100000050382 [0,1,0,0,0,1|1,0,0]=3 5984 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cscn3 2230a_100000756787_100000205941 [0,1,0,0,0,1|1,0,0]=3 5985 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cscn3 269982a_100000756787_100000205941 [0,1,0,0,0,1|1,0,0]=3 5986 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cscn3 270004a_100000756787_100000743575 [0,1,0,0,0,1|1,0,0]=3 5987 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3cscn3 34a_100000756787_100000205941 [0,1,0,0,0,1|1,0,0]=3 5988 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3csnn3 270004a_100000756787_100000738508 [0,1,0,0,0,1|2,0,0]=4 5989 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncc[nH]3 2230a_100000756787_100016991755 [0,1,0,0,0,1|2,0,0]=4 5990 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncc[nH]3 269982a_100000756787_100016991755 [0,1,0,0,0,1|2,0,0]=4 5991 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncc[nH]3 34a_100000756787_100016991755 [0,1,0,0,0,1|2,0,0]=4 5992 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncco3 2230a_100000756787_103436540062 [0,1,0,0,0,1|2,0,0]=4 5993 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncco3 269982a_100000756787_103436540062 [0,1,0,0,0,1|2,0,0]=4 5994 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncco3 270004a_100000756787_100000064290 [0,1,0,0,0,1|2,0,0]=4 5995 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncco3 34a_100000756787_103436540062 [0,1,0,0,0,1|2,0,0]=4 5996 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3nccs3 2230a_100000756787_100015184050 [0,1,0,0,0,1|2,0,0]=4 5997 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3nccs3 269982a_100000756787_100015184050 [0,1,0,0,0,1|2,0,0]=4 5998 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3nccs3 270004a_100000756787_100000750902 [0,1,0,0,0,1|2,0,0]=4 5999 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3nccs3 34a_100000756787_100015184050 [0,1,0,0,0,1|2,0,0]=4 6000 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncon3 269982a_100000756787_100000233494 [0,1,0,0,0,1|2,0,0]=4 6001 B19R3.152263 Brc1cccc2c1CCN(C2)Cc3ncon3 34a_100000756787_100000233494 [0,1,0,0,0,1|2,0,0]=4 6002 B19R3.152263 Brc1cccc2c1CCN(C2)Cn3cncn3 2230a_100000756787_200020645497 [0,1,0,0,0,1|1,0,1]=4 6003 B19R3.152263 Brc1cccc2c1CCN(C2)Cn3cncn3 269982a_100000756787_200020645497 [0,1,0,0,0,1|1,0,1]=4 6004 B19R3.152263 Brc1cccc2c1CCN(C2)Cn3cncn3 34a_100000756787_200020645497 [0,1,0,0,0,1|1,0,1]=4 6005 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3c[nH]cn3 2230a_200000752276_100000707719 [0,1,0,0,0,1|0,0,0]=2 6006 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3c[nH]cn3 269982a_200000752276_100000707719 [0,1,0,0,0,1|0,0,0]=2 6007 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3c[nH]cn3 34a_200000752276_100000707719 [0,1,0,0,0,1|0,0,0]=2 6008 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cc[nH]n3 270004a_200000752276_100000738523 [0,1,0,0,0,1|2,0,0]=4 6009 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccco3 270004a_200000752276_100000186105 [0,1,0,0,0,1|2,0,0]=4 6010 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cccs3 270004a_200000752276_100000209959 [0,1,0,0,0,1|2,0,0]=4 6011 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccoc3 270004a_200000752276_100011215517 [0,1,0,0,0,1|2,0,0]=4 6012 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccon3 2230a_200000752276_100000234950 [0,1,0,0,0,1|2,0,0]=4 6013 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccon3 269982a_200000752276_100000234950 [0,1,0,0,0,1|2,0,0]=4 6014 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccon3 34a_200000752276_100000234950 [0,1,0,0,0,1|2,0,0]=4 6015 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccsc3 2230a_200000752276_100011261437 [0,1,0,0,0,1|2,0,0]=4 6016 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccsc3 269982a_200000752276_100011233845 [0,1,0,0,0,1|2,0,0]=4 6017 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccsc3 270004a_200000752276_100000188534 [0,1,0,0,0,1|2,0,0]=4 6018 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ccsc3 34a_200000752276_100011261437 [0,1,0,0,0,1|2,0,0]=4 6019 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cn[nH]c3 270004a_200000752276_100016992096 [0,1,0,0,0,1|2,0,0]=4 6020 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cnco3 270004a_200000752276_100000064291 [0,1,0,0,0,1|1,0,1]=4 6021 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cncs3 2230a_200000752276_100015185245 [0,1,0,0,0,1|1,0,1]=4 6022 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cncs3 269982a_200000752276_100015185245 [0,1,0,0,0,1|1,0,1]=4 6023 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cncs3 270004a_200000752276_100000749870 [0,1,0,0,0,1|1,0,1]=4 6024 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cncs3 34a_200000752276_100015185245 [0,1,0,0,0,1|1,0,1]=4 6025 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cocn3 270004a_200000752276_100000050382 [0,1,0,0,0,1|1,0,0]=3 6026 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cscn3 2230a_200000752276_100000205941 [0,1,0,0,0,1|1,0,0]=3 6027 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cscn3 269982a_200000752276_100000205941 [0,1,0,0,0,1|1,0,0]=3 6028 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cscn3 270004a_200000752276_100000743575 [0,1,0,0,0,1|1,0,0]=3 6029 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3cscn3 34a_200000752276_100000205941 [0,1,0,0,0,1|1,0,0]=3 6030 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3csnn3 270004a_200000752276_100000738508 [0,1,0,0,0,1|2,0,0]=4 6031 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncc[nH]3 2230a_200000752276_100016991755 [0,1,0,0,0,1|2,0,0]=4 6032 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncc[nH]3 269982a_200000752276_100016991755 [0,1,0,0,0,1|2,0,0]=4 6033 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncc[nH]3 34a_200000752276_100016991755 [0,1,0,0,0,1|2,0,0]=4 6034 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncco3 2230a_200000752276_103436540062 [0,1,0,0,0,1|2,0,0]=4 6035 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncco3 269982a_200000752276_103436540062 [0,1,0,0,0,1|2,0,0]=4 6036 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncco3 270004a_200000752276_100000064290 [0,1,0,0,0,1|2,0,0]=4 6037 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncco3 34a_200000752276_103436540062 [0,1,0,0,0,1|2,0,0]=4 6038 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3nccs3 2230a_200000752276_100015184050 [0,1,0,0,0,1|2,0,0]=4 6039 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3nccs3 269982a_200000752276_100015184050 [0,1,0,0,0,1|2,0,0]=4 6040 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3nccs3 270004a_200000752276_100000750902 [0,1,0,0,0,1|2,0,0]=4 6041 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3nccs3 34a_200000752276_100015184050 [0,1,0,0,0,1|2,0,0]=4 6042 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncon3 269982a_200000752276_100000233494 [0,1,0,0,0,1|2,0,0]=4 6043 B19R3.152263 Cc1cccc2c1CCN(C2)Cc3ncon3 34a_200000752276_100000233494 [0,1,0,0,0,1|2,0,0]=4 6044 B19R3.152263 Cc1cccc2c1CCN(C2)Cn3cncn3 2230a_200000752276_200020645497 [0,1,0,0,0,1|1,0,1]=4 6045 B19R3.152263 Cc1cccc2c1CCN(C2)Cn3cncn3 269982a_200000752276_200020645497 [0,1,0,0,0,1|1,0,1]=4 6046 B19R3.152263 Cc1cccc2c1CCN(C2)Cn3cncn3 34a_200000752276_200020645497 [0,1,0,0,0,1|1,0,1]=4 6047 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3c[nH]cn3 2230a_100015184967_100000707719 [0,1,0,0,0,1|0,0,0]=2 6048 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3c[nH]cn3 269982a_100015184967_100000707719 [0,1,0,0,0,1|0,0,0]=2 6049 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3c[nH]cn3 34a_100015184967_100000707719 [0,1,0,0,0,1|0,0,0]=2 6050 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cc[nH]n3 270004a_100015184967_100000738523 [0,1,0,0,0,1|2,0,0]=4 6051 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccco3 270004a_100015184967_100000186105 [0,1,0,0,0,1|2,0,0]=4 6052 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cccs3 270004a_100015184967_100000209959 [0,1,0,0,0,1|2,0,0]=4 6053 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccoc3 270004a_100015184967_100011215517 [0,1,0,0,0,1|2,0,0]=4 6054 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccon3 2230a_100015184967_100000234950 [0,1,0,0,0,1|2,0,0]=4 6055 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccon3 269982a_100015184967_100000234950 [0,1,0,0,0,1|2,0,0]=4 6056 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccon3 34a_100015184967_100000234950 [0,1,0,0,0,1|2,0,0]=4 6057 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccsc3 2230a_100015184967_100011261437 [0,1,0,0,0,1|2,0,0]=4 6058 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccsc3 269982a_100015184967_100011233845 [0,1,0,0,0,1|2,0,0]=4 6059 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccsc3 270004a_100015184967_100000188534 [0,1,0,0,0,1|2,0,0]=4 6060 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ccsc3 34a_100015184967_100011261437 [0,1,0,0,0,1|2,0,0]=4 6061 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cn[nH]c3 270004a_100015184967_100016992096 [0,1,0,0,0,1|2,0,0]=4 6062 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cnco3 270004a_100015184967_100000064291 [0,1,0,0,0,1|1,0,1]=4 6063 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cncs3 2230a_100015184967_100015185245 [0,1,0,0,0,1|1,0,1]=4 6064 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cncs3 269982a_100015184967_100015185245 [0,1,0,0,0,1|1,0,1]=4 6065 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cncs3 270004a_100015184967_100000749870 [0,1,0,0,0,1|1,0,1]=4 6066 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cncs3 34a_100015184967_100015185245 [0,1,0,0,0,1|1,0,1]=4 6067 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cocn3 270004a_100015184967_100000050382 [0,1,0,0,0,1|1,0,0]=3 6068 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cscn3 2230a_100015184967_100000205941 [0,1,0,0,0,1|1,0,0]=3 6069 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cscn3 269982a_100015184967_100000205941 [0,1,0,0,0,1|1,0,0]=3 6070 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cscn3 270004a_100015184967_100000743575 [0,1,0,0,0,1|1,0,0]=3 6071 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3cscn3 34a_100015184967_100000205941 [0,1,0,0,0,1|1,0,0]=3 6072 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3csnn3 270004a_100015184967_100000738508 [0,1,0,0,0,1|2,0,0]=4 6073 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncc[nH]3 2230a_100015184967_100016991755 [0,1,0,0,0,1|2,0,0]=4 6074 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncc[nH]3 269982a_100015184967_100016991755 [0,1,0,0,0,1|2,0,0]=4 6075 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncc[nH]3 34a_100015184967_100016991755 [0,1,0,0,0,1|2,0,0]=4 6076 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncco3 2230a_100015184967_103436540062 [0,1,0,0,0,1|2,0,0]=4 6077 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncco3 269982a_100015184967_103436540062 [0,1,0,0,0,1|2,0,0]=4 6078 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncco3 270004a_100015184967_100000064290 [0,1,0,0,0,1|2,0,0]=4 6079 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncco3 34a_100015184967_103436540062 [0,1,0,0,0,1|2,0,0]=4 6080 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3nccs3 2230a_100015184967_100015184050 [0,1,0,0,0,1|2,0,0]=4 6081 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3nccs3 269982a_100015184967_100015184050 [0,1,0,0,0,1|2,0,0]=4 6082 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3nccs3 270004a_100015184967_100000750902 [0,1,0,0,0,1|2,0,0]=4 6083 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3nccs3 34a_100015184967_100015184050 [0,1,0,0,0,1|2,0,0]=4 6084 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncon3 269982a_100015184967_100000233494 [0,1,0,0,0,1|2,0,0]=4 6085 B19R3.152263 Clc1cccc2c1CCN(C2)Cc3ncon3 34a_100015184967_100000233494 [0,1,0,0,0,1|2,0,0]=4 6086 B19R3.152263 Clc1cccc2c1CCN(C2)Cn3cncn3 2230a_100015184967_200020645497 [0,1,0,0,0,1|1,0,1]=4 6087 B19R3.152263 Clc1cccc2c1CCN(C2)Cn3cncn3 269982a_100015184967_200020645497 [0,1,0,0,0,1|1,0,1]=4 6088 B19R3.152263 Clc1cccc2c1CCN(C2)Cn3cncn3 34a_100015184967_200020645497 [0,1,0,0,0,1|1,0,1]=4 6089 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3c[nH]cn3 2230a_100016987532_100000707719 [0,1,0,0,0,1|0,0,0]=2 6090 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3c[nH]cn3 269982a_100016987532_100000707719 [0,1,0,0,0,1|0,0,0]=2 6091 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3c[nH]cn3 34a_100016987532_100000707719 [0,1,0,0,0,1|0,0,0]=2 6092 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cc[nH]n3 270004a_100016987532_100000738523 [0,1,0,0,0,1|2,0,0]=4 6093 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccco3 270004a_100016987532_100000186105 [0,1,0,0,0,1|2,0,0]=4 6094 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cccs3 270004a_100016987532_100000209959 [0,1,0,0,0,1|2,0,0]=4 6095 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccoc3 270004a_100016987532_100011215517 [0,1,0,0,0,1|2,0,0]=4 6096 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccon3 2230a_100016987532_100000234950 [0,1,0,0,0,1|2,0,0]=4 6097 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccon3 269982a_100016987532_100000234950 [0,1,0,0,0,1|2,0,0]=4 6098 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccon3 34a_100016987532_100000234950 [0,1,0,0,0,1|2,0,0]=4 6099 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccsc3 2230a_100016987532_100011261437 [0,1,0,0,0,1|2,0,0]=4 6100 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccsc3 269982a_100016987532_100011233845 [0,1,0,0,0,1|2,0,0]=4 6101 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccsc3 270004a_100016987532_100000188534 [0,1,0,0,0,1|2,0,0]=4 6102 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ccsc3 34a_100016987532_100011261437 [0,1,0,0,0,1|2,0,0]=4 6103 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cn[nH]c3 270004a_100016987532_100016992096 [0,1,0,0,0,1|2,0,0]=4 6104 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cnco3 270004a_100016987532_100000064291 [0,1,0,0,0,1|1,0,1]=4 6105 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cncs3 2230a_100016987532_100015185245 [0,1,0,0,0,1|1,0,1]=4 6106 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cncs3 269982a_100016987532_100015185245 [0,1,0,0,0,1|1,0,1]=4 6107 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cncs3 270004a_100016987532_100000749870 [0,1,0,0,0,1|1,0,1]=4 6108 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cncs3 34a_100016987532_100015185245 [0,1,0,0,0,1|1,0,1]=4 6109 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cocn3 270004a_100016987532_100000050382 [0,1,0,0,0,1|1,0,0]=3 6110 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cscn3 2230a_100016987532_100000205941 [0,1,0,0,0,1|1,0,0]=3 6111 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cscn3 269982a_100016987532_100000205941 [0,1,0,0,0,1|1,0,0]=3 6112 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cscn3 270004a_100016987532_100000743575 [0,1,0,0,0,1|1,0,0]=3 6113 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3cscn3 34a_100016987532_100000205941 [0,1,0,0,0,1|1,0,0]=3 6114 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3csnn3 270004a_100016987532_100000738508 [0,1,0,0,0,1|2,0,0]=4 6115 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncc[nH]3 2230a_100016987532_100016991755 [0,1,0,0,0,1|2,0,0]=4 6116 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncc[nH]3 269982a_100016987532_100016991755 [0,1,0,0,0,1|2,0,0]=4 6117 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncc[nH]3 34a_100016987532_100016991755 [0,1,0,0,0,1|2,0,0]=4 6118 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncco3 2230a_100016987532_103436540062 [0,1,0,0,0,1|2,0,0]=4 6119 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncco3 269982a_100016987532_103436540062 [0,1,0,0,0,1|2,0,0]=4 6120 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncco3 270004a_100016987532_100000064290 [0,1,0,0,0,1|2,0,0]=4 6121 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncco3 34a_100016987532_103436540062 [0,1,0,0,0,1|2,0,0]=4 6122 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3nccs3 2230a_100016987532_100015184050 [0,1,0,0,0,1|2,0,0]=4 6123 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3nccs3 269982a_100016987532_100015184050 [0,1,0,0,0,1|2,0,0]=4 6124 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3nccs3 270004a_100016987532_100000750902 [0,1,0,0,0,1|2,0,0]=4 6125 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3nccs3 34a_100016987532_100015184050 [0,1,0,0,0,1|2,0,0]=4 6126 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncon3 269982a_100016987532_100000233494 [0,1,0,0,0,1|2,0,0]=4 6127 B19R3.152263 Fc1cccc2c1CCN(C2)Cc3ncon3 34a_100016987532_100000233494 [0,1,0,0,0,1|2,0,0]=4 6128 B19R3.152263 Fc1cccc2c1CCN(C2)Cn3cncn3 2230a_100016987532_200020645497 [0,1,0,0,0,1|1,0,1]=4 6129 B19R3.152263 Fc1cccc2c1CCN(C2)Cn3cncn3 269982a_100016987532_200020645497 [0,1,0,0,0,1|1,0,1]=4 6130 B19R3.152263 Fc1cccc2c1CCN(C2)Cn3cncn3 34a_100016987532_200020645497 [0,1,0,0,0,1|1,0,1]=4 6131 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3c[nH]cn3 2230a_100020635587_100000707719 [0,1,0,0,0,1|0,0,0]=2 6132 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3c[nH]cn3 269982a_100020635587_100000707719 [0,1,0,0,0,1|0,0,0]=2 6133 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3c[nH]cn3 34a_100020635587_100000707719 [0,1,0,0,0,1|0,0,0]=2 6134 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cc[nH]n3 270004a_100020635587_100000738523 [0,1,0,0,0,1|2,0,0]=4 6135 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccco3 270004a_100020635587_100000186105 [0,1,0,0,0,1|2,0,0]=4 6136 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cccs3 270004a_100020635587_100000209959 [0,1,0,0,0,1|2,0,0]=4 6137 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccoc3 270004a_100020635587_100011215517 [0,1,0,0,0,1|2,0,0]=4 6138 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccon3 2230a_100020635587_100000234950 [0,1,0,0,0,1|2,0,0]=4 6139 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccon3 269982a_100020635587_100000234950 [0,1,0,0,0,1|2,0,0]=4 6140 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccon3 34a_100020635587_100000234950 [0,1,0,0,0,1|2,0,0]=4 6141 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccsc3 2230a_100020635587_100011261437 [0,1,0,0,0,1|2,0,0]=4 6142 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccsc3 269982a_100020635587_100011233845 [0,1,0,0,0,1|2,0,0]=4 6143 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccsc3 270004a_100020635587_100000188534 [0,1,0,0,0,1|2,0,0]=4 6144 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ccsc3 34a_100020635587_100011261437 [0,1,0,0,0,1|2,0,0]=4 6145 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cn[nH]c3 270004a_100020635587_100016992096 [0,1,0,0,0,1|2,0,0]=4 6146 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cnco3 270004a_100020635587_100000064291 [0,1,0,0,0,1|1,0,1]=4 6147 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cncs3 2230a_100020635587_100015185245 [0,1,0,0,0,1|1,0,1]=4 6148 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cncs3 269982a_100020635587_100015185245 [0,1,0,0,0,1|1,0,1]=4 6149 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cncs3 270004a_100020635587_100000749870 [0,1,0,0,0,1|1,0,1]=4 6150 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cncs3 34a_100020635587_100015185245 [0,1,0,0,0,1|1,0,1]=4 6151 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cocn3 270004a_100020635587_100000050382 [0,1,0,0,0,1|1,0,0]=3 6152 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cscn3 2230a_100020635587_100000205941 [0,1,0,0,0,1|1,0,0]=3 6153 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cscn3 269982a_100020635587_100000205941 [0,1,0,0,0,1|1,0,0]=3 6154 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cscn3 270004a_100020635587_100000743575 [0,1,0,0,0,1|1,0,0]=3 6155 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3cscn3 34a_100020635587_100000205941 [0,1,0,0,0,1|1,0,0]=3 6156 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3csnn3 270004a_100020635587_100000738508 [0,1,0,0,0,1|2,0,0]=4 6157 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncc[nH]3 2230a_100020635587_100016991755 [0,1,0,0,0,1|2,0,0]=4 6158 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncc[nH]3 269982a_100020635587_100016991755 [0,1,0,0,0,1|2,0,0]=4 6159 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncc[nH]3 34a_100020635587_100016991755 [0,1,0,0,0,1|2,0,0]=4 6160 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncco3 2230a_100020635587_103436540062 [0,1,0,0,0,1|2,0,0]=4 6161 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncco3 269982a_100020635587_103436540062 [0,1,0,0,0,1|2,0,0]=4 6162 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncco3 270004a_100020635587_100000064290 [0,1,0,0,0,1|2,0,0]=4 6163 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncco3 34a_100020635587_103436540062 [0,1,0,0,0,1|2,0,0]=4 6164 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3nccs3 2230a_100020635587_100015184050 [0,1,0,0,0,1|2,0,0]=4 6165 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3nccs3 269982a_100020635587_100015184050 [0,1,0,0,0,1|2,0,0]=4 6166 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3nccs3 270004a_100020635587_100000750902 [0,1,0,0,0,1|2,0,0]=4 6167 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3nccs3 34a_100020635587_100015184050 [0,1,0,0,0,1|2,0,0]=4 6168 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncon3 269982a_100020635587_100000233494 [0,1,0,0,0,1|2,0,0]=4 6169 B19R3.152263 Oc1cccc2c1CCN(C2)Cc3ncon3 34a_100020635587_100000233494 [0,1,0,0,0,1|2,0,0]=4 6170 B19R3.152263 Oc1cccc2c1CCN(C2)Cn3cncn3 2230a_100020635587_200020645497 [0,1,0,0,0,1|1,0,1]=4 6171 B19R3.152263 Oc1cccc2c1CCN(C2)Cn3cncn3 269982a_100020635587_200020645497 [0,1,0,0,0,1|1,0,1]=4 6172 B19R3.152263 Oc1cccc2c1CCN(C2)Cn3cncn3 34a_100020635587_200020645497 [0,1,0,0,0,1|1,0,1]=4 6173 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3c[nH]cn3 2230a_100015190047_100000707719 [0,1,0,0,0,1|0,0,0]=2 6174 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3c[nH]cn3 269982a_100015190047_100000707719 [0,1,0,0,0,1|0,0,0]=2 6175 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3c[nH]cn3 34a_100015190047_100000707719 [0,1,0,0,0,1|0,0,0]=2 6176 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cc[nH]n3 270004a_100015190047_100000738523 [0,1,0,0,0,1|2,0,0]=4 6177 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccco3 270004a_100015190047_100000186105 [0,1,0,0,0,1|2,0,0]=4 6178 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cccs3 270004a_100015190047_100000209959 [0,1,0,0,0,1|2,0,0]=4 6179 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccoc3 270004a_100015190047_100011215517 [0,1,0,0,0,1|2,0,0]=4 6180 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccon3 2230a_100015190047_100000234950 [0,1,0,0,0,1|2,0,0]=4 6181 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccon3 269982a_100015190047_100000234950 [0,1,0,0,0,1|2,0,0]=4 6182 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccon3 34a_100015190047_100000234950 [0,1,0,0,0,1|2,0,0]=4 6183 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccsc3 2230a_100015190047_100011261437 [0,1,0,0,0,1|2,0,0]=4 6184 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccsc3 269982a_100015190047_100011233845 [0,1,0,0,0,1|2,0,0]=4 6185 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccsc3 270004a_100015190047_100000188534 [0,1,0,0,0,1|2,0,0]=4 6186 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ccsc3 34a_100015190047_100011261437 [0,1,0,0,0,1|2,0,0]=4 6187 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cn[nH]c3 270004a_100015190047_100016992096 [0,1,0,0,0,1|2,0,0]=4 6188 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cnco3 270004a_100015190047_100000064291 [0,1,0,0,0,1|1,0,1]=4 6189 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cncs3 2230a_100015190047_100015185245 [0,1,0,0,0,1|1,0,1]=4 6190 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cncs3 269982a_100015190047_100015185245 [0,1,0,0,0,1|1,0,1]=4 6191 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cncs3 270004a_100015190047_100000749870 [0,1,0,0,0,1|1,0,1]=4 6192 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cncs3 34a_100015190047_100015185245 [0,1,0,0,0,1|1,0,1]=4 6193 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cocn3 270004a_100015190047_100000050382 [0,1,0,0,0,1|1,0,0]=3 6194 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cscn3 2230a_100015190047_100000205941 [0,1,0,0,0,1|1,0,0]=3 6195 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cscn3 269982a_100015190047_100000205941 [0,1,0,0,0,1|1,0,0]=3 6196 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cscn3 270004a_100015190047_100000743575 [0,1,0,0,0,1|1,0,0]=3 6197 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3cscn3 34a_100015190047_100000205941 [0,1,0,0,0,1|1,0,0]=3 6198 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3csnn3 270004a_100015190047_100000738508 [0,1,0,0,0,1|2,0,0]=4 6199 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncc[nH]3 2230a_100015190047_100016991755 [0,1,0,0,0,1|2,0,0]=4 6200 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncc[nH]3 269982a_100015190047_100016991755 [0,1,0,0,0,1|2,0,0]=4 6201 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncc[nH]3 34a_100015190047_100016991755 [0,1,0,0,0,1|2,0,0]=4 6202 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncco3 2230a_100015190047_103436540062 [0,1,0,0,0,1|2,0,0]=4 6203 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncco3 269982a_100015190047_103436540062 [0,1,0,0,0,1|2,0,0]=4 6204 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncco3 270004a_100015190047_100000064290 [0,1,0,0,0,1|2,0,0]=4 6205 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncco3 34a_100015190047_103436540062 [0,1,0,0,0,1|2,0,0]=4 6206 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3nccs3 2230a_100015190047_100015184050 [0,1,0,0,0,1|2,0,0]=4 6207 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3nccs3 269982a_100015190047_100015184050 [0,1,0,0,0,1|2,0,0]=4 6208 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3nccs3 270004a_100015190047_100000750902 [0,1,0,0,0,1|2,0,0]=4 6209 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3nccs3 34a_100015190047_100015184050 [0,1,0,0,0,1|2,0,0]=4 6210 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncon3 269982a_100015190047_100000233494 [0,1,0,0,0,1|2,0,0]=4 6211 B19R3.171666 CC1CN(Cc2c1cccc2)Cc3ncon3 34a_100015190047_100000233494 [0,1,0,0,0,1|2,0,0]=4 6212 B19R3.171666 CC1CN(Cc2c1cccc2)Cn3cncn3 2230a_100015190047_200020645497 [0,1,0,0,0,1|1,0,1]=4 6213 B19R3.171666 CC1CN(Cc2c1cccc2)Cn3cncn3 269982a_100015190047_200020645497 [0,1,0,0,0,1|1,0,1]=4 6214 B19R3.171666 CC1CN(Cc2c1cccc2)Cn3cncn3 34a_100015190047_200020645497 [0,1,0,0,0,1|1,0,1]=4 6215 B19R3.2183900 CC1c2ccccc2CCN1Cc3c[nH]cn3 2230a_100011660714_100000707719 [0,1,0,0,0,1|0,0,0]=2 6216 B19R3.2183900 CC1c2ccccc2CCN1Cc3c[nH]cn3 269982a_100011660714_100000707719 [0,1,0,0,0,1|0,0,0]=2 6217 B19R3.2183900 CC1c2ccccc2CCN1Cc3c[nH]cn3 34a_100011660714_100000707719 [0,1,0,0,0,1|0,0,0]=2 6218 B19R3.2183900 CC1c2ccccc2CCN1Cc3cc[nH]n3 270004a_100011660714_100000738523 [0,1,0,0,0,1|2,0,0]=4 6219 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccco3 270004a_100011660714_100000186105 [0,1,0,0,0,1|2,0,0]=4 6220 B19R3.2183900 CC1c2ccccc2CCN1Cc3cccs3 270004a_100011660714_100000209959 [0,1,0,0,0,1|2,0,0]=4 6221 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccoc3 270004a_100011660714_100011215517 [0,1,0,0,0,1|2,0,0]=4 6222 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccon3 2230a_100011660714_100000234950 [0,1,0,0,0,1|2,0,0]=4 6223 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccon3 269982a_100011660714_100000234950 [0,1,0,0,0,1|2,0,0]=4 6224 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccon3 34a_100011660714_100000234950 [0,1,0,0,0,1|2,0,0]=4 6225 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccsc3 2230a_100011660714_100011261437 [0,1,0,0,0,1|2,0,0]=4 6226 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccsc3 269982a_100011660714_100011233845 [0,1,0,0,0,1|2,0,0]=4 6227 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccsc3 270004a_100011660714_100000188534 [0,1,0,0,0,1|2,0,0]=4 6228 B19R3.2183900 CC1c2ccccc2CCN1Cc3ccsc3 34a_100011660714_100011261437 [0,1,0,0,0,1|2,0,0]=4 6229 B19R3.2183900 CC1c2ccccc2CCN1Cc3cn[nH]c3 270004a_100011660714_100016992096 [0,1,0,0,0,1|2,0,0]=4 6230 B19R3.2183900 CC1c2ccccc2CCN1Cc3cnco3 270004a_100011660714_100000064291 [0,1,0,0,0,1|1,0,1]=4 6231 B19R3.2183900 CC1c2ccccc2CCN1Cc3cncs3 2230a_100011660714_100015185245 [0,1,0,0,0,1|1,0,1]=4 6232 B19R3.2183900 CC1c2ccccc2CCN1Cc3cncs3 269982a_100011660714_100015185245 [0,1,0,0,0,1|1,0,1]=4 6233 B19R3.2183900 CC1c2ccccc2CCN1Cc3cncs3 270004a_100011660714_100000749870 [0,1,0,0,0,1|1,0,1]=4 6234 B19R3.2183900 CC1c2ccccc2CCN1Cc3cncs3 34a_100011660714_100015185245 [0,1,0,0,0,1|1,0,1]=4 6235 B19R3.2183900 CC1c2ccccc2CCN1Cc3cocn3 270004a_100011660714_100000050382 [0,1,0,0,0,1|1,0,0]=3 6236 B19R3.2183900 CC1c2ccccc2CCN1Cc3cscn3 2230a_100011660714_100000205941 [0,1,0,0,0,1|1,0,0]=3 6237 B19R3.2183900 CC1c2ccccc2CCN1Cc3cscn3 269982a_100011660714_100000205941 [0,1,0,0,0,1|1,0,0]=3 6238 B19R3.2183900 CC1c2ccccc2CCN1Cc3cscn3 270004a_100011660714_100000743575 [0,1,0,0,0,1|1,0,0]=3 6239 B19R3.2183900 CC1c2ccccc2CCN1Cc3cscn3 34a_100011660714_100000205941 [0,1,0,0,0,1|1,0,0]=3 6240 B19R3.2183900 CC1c2ccccc2CCN1Cc3csnn3 270004a_100011660714_100000738508 [0,1,0,0,0,1|2,0,0]=4 6241 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncc[nH]3 2230a_100011660714_100016991755 [0,1,0,0,0,1|2,0,0]=4 6242 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncc[nH]3 269982a_100011660714_100016991755 [0,1,0,0,0,1|2,0,0]=4 6243 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncc[nH]3 34a_100011660714_100016991755 [0,1,0,0,0,1|2,0,0]=4 6244 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncco3 2230a_100011660714_103436540062 [0,1,0,0,0,1|2,0,0]=4 6245 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncco3 269982a_100011660714_103436540062 [0,1,0,0,0,1|2,0,0]=4 6246 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncco3 270004a_100011660714_100000064290 [0,1,0,0,0,1|2,0,0]=4 6247 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncco3 34a_100011660714_103436540062 [0,1,0,0,0,1|2,0,0]=4 6248 B19R3.2183900 CC1c2ccccc2CCN1Cc3nccs3 2230a_100011660714_100015184050 [0,1,0,0,0,1|2,0,0]=4 6249 B19R3.2183900 CC1c2ccccc2CCN1Cc3nccs3 269982a_100011660714_100015184050 [0,1,0,0,0,1|2,0,0]=4 6250 B19R3.2183900 CC1c2ccccc2CCN1Cc3nccs3 270004a_100011660714_100000750902 [0,1,0,0,0,1|2,0,0]=4 6251 B19R3.2183900 CC1c2ccccc2CCN1Cc3nccs3 34a_100011660714_100015184050 [0,1,0,0,0,1|2,0,0]=4 6252 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncon3 269982a_100011660714_100000233494 [0,1,0,0,0,1|2,0,0]=4 6253 B19R3.2183900 CC1c2ccccc2CCN1Cc3ncon3 34a_100011660714_100000233494 [0,1,0,0,0,1|2,0,0]=4 6254 B19R3.2183900 CC1c2ccccc2CCN1Cn3cncn3 2230a_100011660714_200020645497 [0,1,0,0,0,1|1,0,1]=4 6255 B19R3.2183900 CC1c2ccccc2CCN1Cn3cncn3 269982a_100011660714_200020645497 [0,1,0,0,0,1|1,0,1]=4 6256 B19R3.2183900 CC1c2ccccc2CCN1Cn3cncn3 34a_100011660714_200020645497 [0,1,0,0,0,1|1,0,1]=4 6257 B19R3.2183900 O=C1c2ccccc2CCC1Sc3c[nH]cn3 62a_100000229917_100000756875 [0,1,0,0,0,1|2,0,0]=4 6258 B19R3.2183900 O=C1c2ccccc2CCC1Sc3c[nH]cn3 62a_100000756875_100000229917 [0,1,0,0,0,1|2,0,0]=4 6259 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3c[nH]cn3 2230a_100000687140_100000707719 [0,1,0,0,0,1|0,0,0]=2 6260 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3c[nH]cn3 269982a_100000687140_100000707719 [0,1,0,0,0,1|0,0,0]=2 6261 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3c[nH]cn3 34a_100000687140_100000707719 [0,1,0,0,0,1|0,0,0]=2 6262 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cc[nH]n3 270004a_100000687140_100000738523 [0,1,0,0,0,1|2,0,0]=4 6263 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccco3 270004a_100000687140_100000186105 [0,1,0,0,0,1|2,0,0]=4 6264 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cccs3 270004a_100000687140_100000209959 [0,1,0,0,0,1|2,0,0]=4 6265 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccoc3 270004a_100000687140_100011215517 [0,1,0,0,0,1|2,0,0]=4 6266 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccon3 2230a_100000687140_100000234950 [0,1,0,0,0,1|2,0,0]=4 6267 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccon3 269982a_100000687140_100000234950 [0,1,0,0,0,1|2,0,0]=4 6268 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccon3 34a_100000687140_100000234950 [0,1,0,0,0,1|2,0,0]=4 6269 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccsc3 2230a_100000687140_100011261437 [0,1,0,0,0,1|2,0,0]=4 6270 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccsc3 269982a_100000687140_100011233845 [0,1,0,0,0,1|2,0,0]=4 6271 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccsc3 270004a_100000687140_100000188534 [0,1,0,0,0,1|2,0,0]=4 6272 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ccsc3 34a_100000687140_100011261437 [0,1,0,0,0,1|2,0,0]=4 6273 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cn[nH]c3 270004a_100000687140_100016992096 [0,1,0,0,0,1|2,0,0]=4 6274 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cnco3 270004a_100000687140_100000064291 [0,1,0,0,0,1|1,0,1]=4 6275 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cncs3 2230a_100000687140_100015185245 [0,1,0,0,0,1|1,0,1]=4 6276 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cncs3 269982a_100000687140_100015185245 [0,1,0,0,0,1|1,0,1]=4 6277 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cncs3 270004a_100000687140_100000749870 [0,1,0,0,0,1|1,0,1]=4 6278 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cncs3 34a_100000687140_100015185245 [0,1,0,0,0,1|1,0,1]=4 6279 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cocn3 270004a_100000687140_100000050382 [0,1,0,0,0,1|1,0,0]=3 6280 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cscn3 2230a_100000687140_100000205941 [0,1,0,0,0,1|1,0,0]=3 6281 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cscn3 269982a_100000687140_100000205941 [0,1,0,0,0,1|1,0,0]=3 6282 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cscn3 270004a_100000687140_100000743575 [0,1,0,0,0,1|1,0,0]=3 6283 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3cscn3 34a_100000687140_100000205941 [0,1,0,0,0,1|1,0,0]=3 6284 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3csnn3 270004a_100000687140_100000738508 [0,1,0,0,0,1|2,0,0]=4 6285 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncc[nH]3 2230a_100000687140_100016991755 [0,1,0,0,0,1|2,0,0]=4 6286 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncc[nH]3 269982a_100000687140_100016991755 [0,1,0,0,0,1|2,0,0]=4 6287 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncc[nH]3 34a_100000687140_100016991755 [0,1,0,0,0,1|2,0,0]=4 6288 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncco3 2230a_100000687140_103436540062 [0,1,0,0,0,1|2,0,0]=4 6289 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncco3 269982a_100000687140_103436540062 [0,1,0,0,0,1|2,0,0]=4 6290 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncco3 270004a_100000687140_100000064290 [0,1,0,0,0,1|2,0,0]=4 6291 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncco3 34a_100000687140_103436540062 [0,1,0,0,0,1|2,0,0]=4 6292 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3nccs3 2230a_100000687140_100015184050 [0,1,0,0,0,1|2,0,0]=4 6293 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3nccs3 269982a_100000687140_100015184050 [0,1,0,0,0,1|2,0,0]=4 6294 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3nccs3 270004a_100000687140_100000750902 [0,1,0,0,0,1|2,0,0]=4 6295 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3nccs3 34a_100000687140_100015184050 [0,1,0,0,0,1|2,0,0]=4 6296 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncon3 269982a_100000687140_100000233494 [0,1,0,0,0,1|2,0,0]=4 6297 B19R3.2991659 Brc1cccc2c1CN(CC2)Cc3ncon3 34a_100000687140_100000233494 [0,1,0,0,0,1|2,0,0]=4 6298 B19R3.2991659 Brc1cccc2c1CN(CC2)Cn3cncn3 2230a_100000687140_200020645497 [0,1,0,0,0,1|1,0,1]=4 6299 B19R3.2991659 Brc1cccc2c1CN(CC2)Cn3cncn3 269982a_100000687140_200020645497 [0,1,0,0,0,1|1,0,1]=4 6300 B19R3.2991659 Brc1cccc2c1CN(CC2)Cn3cncn3 34a_100000687140_200020645497 [0,1,0,0,0,1|1,0,1]=4 6301 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3c[nH]cn3 2230a_100011273781_100000707719 [0,1,0,0,0,1|0,0,0]=2 6302 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3c[nH]cn3 269982a_100011273781_100000707719 [0,1,0,0,0,1|0,0,0]=2 6303 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3c[nH]cn3 34a_100011273781_100000707719 [0,1,0,0,0,1|0,0,0]=2 6304 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cc[nH]n3 270004a_100011273781_100000738523 [0,1,0,0,0,1|2,0,0]=4 6305 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccco3 270004a_100011273781_100000186105 [0,1,0,0,0,1|2,0,0]=4 6306 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cccs3 270004a_100011273781_100000209959 [0,1,0,0,0,1|2,0,0]=4 6307 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccoc3 270004a_100011273781_100011215517 [0,1,0,0,0,1|2,0,0]=4 6308 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccon3 2230a_100011273781_100000234950 [0,1,0,0,0,1|2,0,0]=4 6309 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccon3 269982a_100011273781_100000234950 [0,1,0,0,0,1|2,0,0]=4 6310 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccon3 34a_100011273781_100000234950 [0,1,0,0,0,1|2,0,0]=4 6311 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccsc3 2230a_100011273781_100011261437 [0,1,0,0,0,1|2,0,0]=4 6312 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccsc3 269982a_100011273781_100011233845 [0,1,0,0,0,1|2,0,0]=4 6313 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccsc3 270004a_100011273781_100000188534 [0,1,0,0,0,1|2,0,0]=4 6314 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ccsc3 34a_100011273781_100011261437 [0,1,0,0,0,1|2,0,0]=4 6315 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cn[nH]c3 270004a_100011273781_100016992096 [0,1,0,0,0,1|2,0,0]=4 6316 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cnco3 270004a_100011273781_100000064291 [0,1,0,0,0,1|1,0,1]=4 6317 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cncs3 2230a_100011273781_100015185245 [0,1,0,0,0,1|1,0,1]=4 6318 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cncs3 269982a_100011273781_100015185245 [0,1,0,0,0,1|1,0,1]=4 6319 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cncs3 270004a_100011273781_100000749870 [0,1,0,0,0,1|1,0,1]=4 6320 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cncs3 34a_100011273781_100015185245 [0,1,0,0,0,1|1,0,1]=4 6321 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cocn3 270004a_100011273781_100000050382 [0,1,0,0,0,1|1,0,0]=3 6322 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cscn3 2230a_100011273781_100000205941 [0,1,0,0,0,1|1,0,0]=3 6323 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cscn3 269982a_100011273781_100000205941 [0,1,0,0,0,1|1,0,0]=3 6324 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cscn3 270004a_100011273781_100000743575 [0,1,0,0,0,1|1,0,0]=3 6325 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3cscn3 34a_100011273781_100000205941 [0,1,0,0,0,1|1,0,0]=3 6326 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3csnn3 270004a_100011273781_100000738508 [0,1,0,0,0,1|2,0,0]=4 6327 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncc[nH]3 2230a_100011273781_100016991755 [0,1,0,0,0,1|2,0,0]=4 6328 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncc[nH]3 269982a_100011273781_100016991755 [0,1,0,0,0,1|2,0,0]=4 6329 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncc[nH]3 34a_100011273781_100016991755 [0,1,0,0,0,1|2,0,0]=4 6330 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncco3 2230a_100011273781_103436540062 [0,1,0,0,0,1|2,0,0]=4 6331 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncco3 269982a_100011273781_103436540062 [0,1,0,0,0,1|2,0,0]=4 6332 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncco3 270004a_100011273781_100000064290 [0,1,0,0,0,1|2,0,0]=4 6333 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncco3 34a_100011273781_103436540062 [0,1,0,0,0,1|2,0,0]=4 6334 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3nccs3 2230a_100011273781_100015184050 [0,1,0,0,0,1|2,0,0]=4 6335 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3nccs3 269982a_100011273781_100015184050 [0,1,0,0,0,1|2,0,0]=4 6336 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3nccs3 270004a_100011273781_100000750902 [0,1,0,0,0,1|2,0,0]=4 6337 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3nccs3 34a_100011273781_100015184050 [0,1,0,0,0,1|2,0,0]=4 6338 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncon3 269982a_100011273781_100000233494 [0,1,0,0,0,1|2,0,0]=4 6339 B19R3.2991659 Clc1cccc2c1CN(CC2)Cc3ncon3 34a_100011273781_100000233494 [0,1,0,0,0,1|2,0,0]=4 6340 B19R3.2991659 Clc1cccc2c1CN(CC2)Cn3cncn3 2230a_100011273781_200020645497 [0,1,0,0,0,1|1,0,1]=4 6341 B19R3.2991659 Clc1cccc2c1CN(CC2)Cn3cncn3 269982a_100011273781_200020645497 [0,1,0,0,0,1|1,0,1]=4 6342 B19R3.2991659 Clc1cccc2c1CN(CC2)Cn3cncn3 34a_100011273781_200020645497 [0,1,0,0,0,1|1,0,1]=4 6343 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3c[nH]cn3 2230a_100000695702_100000707719 [0,1,0,0,0,1|0,0,0]=2 6344 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3c[nH]cn3 269982a_100000695702_100000707719 [0,1,0,0,0,1|0,0,0]=2 6345 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3c[nH]cn3 34a_100000695702_100000707719 [0,1,0,0,0,1|0,0,0]=2 6346 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cc[nH]n3 270004a_100000695702_100000738523 [0,1,0,0,0,1|2,0,0]=4 6347 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccco3 270004a_100000695702_100000186105 [0,1,0,0,0,1|2,0,0]=4 6348 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cccs3 270004a_100000695702_100000209959 [0,1,0,0,0,1|2,0,0]=4 6349 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccoc3 270004a_100000695702_100011215517 [0,1,0,0,0,1|2,0,0]=4 6350 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccon3 2230a_100000695702_100000234950 [0,1,0,0,0,1|2,0,0]=4 6351 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccon3 269982a_100000695702_100000234950 [0,1,0,0,0,1|2,0,0]=4 6352 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccon3 34a_100000695702_100000234950 [0,1,0,0,0,1|2,0,0]=4 6353 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccsc3 2230a_100000695702_100011261437 [0,1,0,0,0,1|2,0,0]=4 6354 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccsc3 269982a_100000695702_100011233845 [0,1,0,0,0,1|2,0,0]=4 6355 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccsc3 270004a_100000695702_100000188534 [0,1,0,0,0,1|2,0,0]=4 6356 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ccsc3 34a_100000695702_100011261437 [0,1,0,0,0,1|2,0,0]=4 6357 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cn[nH]c3 270004a_100000695702_100016992096 [0,1,0,0,0,1|2,0,0]=4 6358 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cnco3 270004a_100000695702_100000064291 [0,1,0,0,0,1|1,0,1]=4 6359 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cncs3 2230a_100000695702_100015185245 [0,1,0,0,0,1|1,0,1]=4 6360 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cncs3 269982a_100000695702_100015185245 [0,1,0,0,0,1|1,0,1]=4 6361 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cncs3 270004a_100000695702_100000749870 [0,1,0,0,0,1|1,0,1]=4 6362 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cncs3 34a_100000695702_100015185245 [0,1,0,0,0,1|1,0,1]=4 6363 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cocn3 270004a_100000695702_100000050382 [0,1,0,0,0,1|1,0,0]=3 6364 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cscn3 2230a_100000695702_100000205941 [0,1,0,0,0,1|1,0,0]=3 6365 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cscn3 269982a_100000695702_100000205941 [0,1,0,0,0,1|1,0,0]=3 6366 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cscn3 270004a_100000695702_100000743575 [0,1,0,0,0,1|1,0,0]=3 6367 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3cscn3 34a_100000695702_100000205941 [0,1,0,0,0,1|1,0,0]=3 6368 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3csnn3 270004a_100000695702_100000738508 [0,1,0,0,0,1|2,0,0]=4 6369 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncc[nH]3 2230a_100000695702_100016991755 [0,1,0,0,0,1|2,0,0]=4 6370 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncc[nH]3 269982a_100000695702_100016991755 [0,1,0,0,0,1|2,0,0]=4 6371 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncc[nH]3 34a_100000695702_100016991755 [0,1,0,0,0,1|2,0,0]=4 6372 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncco3 2230a_100000695702_103436540062 [0,1,0,0,0,1|2,0,0]=4 6373 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncco3 269982a_100000695702_103436540062 [0,1,0,0,0,1|2,0,0]=4 6374 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncco3 270004a_100000695702_100000064290 [0,1,0,0,0,1|2,0,0]=4 6375 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncco3 34a_100000695702_103436540062 [0,1,0,0,0,1|2,0,0]=4 6376 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3nccs3 2230a_100000695702_100015184050 [0,1,0,0,0,1|2,0,0]=4 6377 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3nccs3 269982a_100000695702_100015184050 [0,1,0,0,0,1|2,0,0]=4 6378 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3nccs3 270004a_100000695702_100000750902 [0,1,0,0,0,1|2,0,0]=4 6379 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3nccs3 34a_100000695702_100015184050 [0,1,0,0,0,1|2,0,0]=4 6380 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncon3 269982a_100000695702_100000233494 [0,1,0,0,0,1|2,0,0]=4 6381 B19R3.2991659 Fc1cccc2c1CN(CC2)Cc3ncon3 34a_100000695702_100000233494 [0,1,0,0,0,1|2,0,0]=4 6382 B19R3.2991659 Fc1cccc2c1CN(CC2)Cn3cncn3 2230a_100000695702_200020645497 [0,1,0,0,0,1|1,0,1]=4 6383 B19R3.2991659 Fc1cccc2c1CN(CC2)Cn3cncn3 269982a_100000695702_200020645497 [0,1,0,0,0,1|1,0,1]=4 6384 B19R3.2991659 Fc1cccc2c1CN(CC2)Cn3cncn3 34a_100000695702_200020645497 [0,1,0,0,0,1|1,0,1]=4 6385 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3c[nH]cn3 2230a_100016995156_100000707719 [0,1,0,0,0,1|0,0,0]=2 6386 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3c[nH]cn3 269982a_100016995156_100000707719 [0,1,0,0,0,1|0,0,0]=2 6387 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3c[nH]cn3 34a_100016995156_100000707719 [0,1,0,0,0,1|0,0,0]=2 6388 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cc[nH]n3 270004a_100016995156_100000738523 [0,1,0,0,0,1|2,0,0]=4 6389 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccco3 270004a_100016995156_100000186105 [0,1,0,0,0,1|2,0,0]=4 6390 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cccs3 270004a_100016995156_100000209959 [0,1,0,0,0,1|2,0,0]=4 6391 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccoc3 270004a_100016995156_100011215517 [0,1,0,0,0,1|2,0,0]=4 6392 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccon3 2230a_100016995156_100000234950 [0,1,0,0,0,1|2,0,0]=4 6393 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccon3 269982a_100016995156_100000234950 [0,1,0,0,0,1|2,0,0]=4 6394 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccon3 34a_100016995156_100000234950 [0,1,0,0,0,1|2,0,0]=4 6395 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccsc3 2230a_100016995156_100011261437 [0,1,0,0,0,1|2,0,0]=4 6396 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccsc3 269982a_100016995156_100011233845 [0,1,0,0,0,1|2,0,0]=4 6397 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccsc3 270004a_100016995156_100000188534 [0,1,0,0,0,1|2,0,0]=4 6398 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ccsc3 34a_100016995156_100011261437 [0,1,0,0,0,1|2,0,0]=4 6399 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cn[nH]c3 270004a_100016995156_100016992096 [0,1,0,0,0,1|2,0,0]=4 6400 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cnco3 270004a_100016995156_100000064291 [0,1,0,0,0,1|1,0,1]=4 6401 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cncs3 2230a_100016995156_100015185245 [0,1,0,0,0,1|1,0,1]=4 6402 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cncs3 269982a_100016995156_100015185245 [0,1,0,0,0,1|1,0,1]=4 6403 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cncs3 270004a_100016995156_100000749870 [0,1,0,0,0,1|1,0,1]=4 6404 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cncs3 34a_100016995156_100015185245 [0,1,0,0,0,1|1,0,1]=4 6405 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cocn3 270004a_100016995156_100000050382 [0,1,0,0,0,1|1,0,0]=3 6406 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cscn3 2230a_100016995156_100000205941 [0,1,0,0,0,1|1,0,0]=3 6407 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cscn3 269982a_100016995156_100000205941 [0,1,0,0,0,1|1,0,0]=3 6408 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cscn3 270004a_100016995156_100000743575 [0,1,0,0,0,1|1,0,0]=3 6409 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3cscn3 34a_100016995156_100000205941 [0,1,0,0,0,1|1,0,0]=3 6410 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3csnn3 270004a_100016995156_100000738508 [0,1,0,0,0,1|2,0,0]=4 6411 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncc[nH]3 2230a_100016995156_100016991755 [0,1,0,0,0,1|2,0,0]=4 6412 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncc[nH]3 269982a_100016995156_100016991755 [0,1,0,0,0,1|2,0,0]=4 6413 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncc[nH]3 34a_100016995156_100016991755 [0,1,0,0,0,1|2,0,0]=4 6414 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncco3 2230a_100016995156_103436540062 [0,1,0,0,0,1|2,0,0]=4 6415 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncco3 269982a_100016995156_103436540062 [0,1,0,0,0,1|2,0,0]=4 6416 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncco3 270004a_100016995156_100000064290 [0,1,0,0,0,1|2,0,0]=4 6417 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncco3 34a_100016995156_103436540062 [0,1,0,0,0,1|2,0,0]=4 6418 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3nccs3 2230a_100016995156_100015184050 [0,1,0,0,0,1|2,0,0]=4 6419 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3nccs3 269982a_100016995156_100015184050 [0,1,0,0,0,1|2,0,0]=4 6420 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3nccs3 270004a_100016995156_100000750902 [0,1,0,0,0,1|2,0,0]=4 6421 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3nccs3 34a_100016995156_100015184050 [0,1,0,0,0,1|2,0,0]=4 6422 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncon3 269982a_100016995156_100000233494 [0,1,0,0,0,1|2,0,0]=4 6423 B19R3.2991659 Oc1cccc2c1CN(CC2)Cc3ncon3 34a_100016995156_100000233494 [0,1,0,0,0,1|2,0,0]=4 6424 B19R3.2991659 Oc1cccc2c1CN(CC2)Cn3cncn3 2230a_100016995156_200020645497 [0,1,0,0,0,1|1,0,1]=4 6425 B19R3.2991659 Oc1cccc2c1CN(CC2)Cn3cncn3 269982a_100016995156_200020645497 [0,1,0,0,0,1|1,0,1]=4 6426 B19R3.2991659 Oc1cccc2c1CN(CC2)Cn3cncn3 34a_100016995156_200020645497 [0,1,0,0,0,1|1,0,1]=4 6427 B19R3.53823 Cc1nc(c([nH]1)C)SC2CCc3c2cccc3 62a_200009820778_200000721974 [0,2,0,0,0,0|2,0,0]=4 6428 B19R3.2542 CCc1noc(n1)CN2CCc3c2cccc3 270196a_200000212204_100000742689 [0,2,0,0,0,0|1,0,1]=4 6429 B19R3.2542 CCn1cnc(c1)SC2CCc3c2cccc3 62a_100010368372_200000721974 [0,2,0,0,0,0|2,0,0]=4 6430 B19R3.2542 FCc1noc(n1)CN2CCc3c2cccc3 270196a_200000032654_100000742689 [0,2,0,0,0,0|1,0,1]=4 6431 B19R3.3884 Cc1nc(cn1C)SC2CCc3c2cccc3 62a_100000684932_200000721974 [0,2,0,0,0,0|2,0,0]=4 6432 B19R3.3884 Cn1cc(nc1N)SC2CCc3c2cccc3 62a_100025756272_200000721974 [0,2,0,0,0,0|2,0,0]=4 6433 B17R3.8685 c1ccc2c(c1)CN(C2)Cc3c[nH]cn3 2230a_100000752595_100000707719 [0,0,1,1,0,0|0,0,2]=4 6434 B17R3.8685 c1ccc2c(c1)CN(C2)Cc3c[nH]cn3 269982a_100000752595_100000707719 [0,0,1,1,0,0|0,0,2]=4 6435 B17R3.8685 c1ccc2c(c1)CN(C2)Cc3c[nH]cn3 34a_100000752595_100000707719 [0,0,1,1,0,0|0,0,2]=4 6436 B17R3.1898 c1ccc2c(c1)CC2SCc3c[nH]cn3 62a_100000707719_100009813401 [0,0,1,1,0,0|1,0,0]=3 6437 B17R3.1898 c1ccc2c(c1)CC2SCc3c[nH]cn3 62a_100009813401_100000707719 [0,0,1,1,0,0|1,0,0]=3 6438 B17R3.1898 c1ccc2c(c1)CC2SCc3cscn3 62a_100000205941_100009813401 [0,0,1,1,0,0|2,0,0]=4 6439 B17R3.1898 c1ccc2c(c1)CC2SCc3cscn3 62a_100009813401_100000205941 [0,0,1,1,0,0|2,0,0]=4 6440 B17R3.21035 c1nc(c[nH]1)CN2CCc3ccsc3C2 2230a_100000694341_100000707719 [0,0,1,1,0,0|1,0,1]=4 6441 B17R3.21035 c1nc(c[nH]1)CN2CCc3ccsc3C2 269982a_100000694341_100000707719 [0,0,1,1,0,0|1,0,1]=4 6442 B17R3.21035 c1nc(c[nH]1)CN2CCc3ccsc3C2 34a_100000694341_100000707719 [0,0,1,1,0,0|1,0,1]=4 6443 B17R3.21035 c1nc(c[nH]1)CN2CCc3sccc3C2 2230a_100015185043_100000707719 [0,0,1,1,0,0|1,0,1]=4 6444 B17R3.21035 c1nc(c[nH]1)CN2CCc3sccc3C2 269982a_100015185043_100000707719 [0,0,1,1,0,0|1,0,1]=4 6445 B17R3.21035 c1nc(c[nH]1)CN2CCc3sccc3C2 34a_100015185043_100000707719 [0,0,1,1,0,0|1,0,1]=4 6446 B15R2.131 CCN(c1ccccc1)c2ncns2 27a_100000210013_100000693119 [0,0,1,0,1,0|1,0,1]=4 6447 B15R2.123 CCc1ccccc1Nc2ncns2 27a_100000212081_100000693119 [0,0,1,0,1,0|1,0,1]=4 6448 B15R2.123 CCc1ccccc1Sc2c[nH]cn2 62a_100000756875_100011215823 [0,0,1,0,1,0|1,0,0]=3 6449 B15R2.123 CCc1ccccc1Sc2c[nH]cn2 62a_100011215823_100000756875 [0,0,1,0,1,0|1,0,0]=3 6450 B15R2.123 CCc1ccccc1Sc2c[nH]nn2 62a_100009819707_100011215823 [0,0,1,0,1,0|2,0,0]=4 6451 B15R2.123 CCc1ccccc1Sc2c[nH]nn2 62a_100011215823_100009819707 [0,0,1,0,1,0|2,0,0]=4 6452 B15R2.123 CCc1ccccc1Sc2cscn2 62a_100000751502_100011215823 [0,0,1,0,1,0|2,0,0]=4 6453 B15R2.123 CCc1ccccc1Sc2cscn2 62a_100011215823_100000751502 [0,0,1,0,1,0|2,0,0]=4 6454 B15R2.123 CCc1ccccc1Sc2nc[nH]n2 62a_100000761765_100011215823 [0,0,1,0,1,0|2,0,0]=4 6455 B15R2.123 CCc1ccccc1Sc2nc[nH]n2 62a_100011215823_100000761765 [0,0,1,0,1,0|2,0,0]=4 6456 B15R2.123 CCc1ccncc1Sc2c[nH]cn2 62a_100000756875_100009819861 [0,0,1,0,1,0|2,0,0]=4 6457 B15R2.123 CCc1ccncc1Sc2c[nH]cn2 62a_100009819861_100000756875 [0,0,1,0,1,0|2,0,0]=4 6458 B15R2.123 CCc1cnccc1Sc2c[nH]cn2 62a_100000756875_100025704421 [0,0,1,0,1,0|2,0,0]=4 6459 B15R2.123 CCc1cnccc1Sc2c[nH]cn2 62a_100025704421_100000756875 [0,0,1,0,1,0|2,0,0]=4 6460 B15R2.123 CCc1ncccc1Sc2c[nH]cn2 62a_100000756875_100009877225 [0,0,1,0,1,0|2,0,0]=4 6461 B15R2.123 CCc1ncccc1Sc2c[nH]cn2 62a_100009877225_100000756875 [0,0,1,0,1,0|2,0,0]=4 6462 B15R2.123 CNc1ccccc1Sc2c[nH]cn2 62a_100000756875_100020606079 [0,0,1,0,1,0|2,0,0]=4 6463 B15R2.123 CNc1ccccc1Sc2c[nH]cn2 62a_100020606079_100000756875 [0,0,1,0,1,0|2,0,0]=4 6464 B15R2.123 COc1ccccc1Sc2c[nH]cn2 62a_100000210334_100000756875 [0,0,1,0,1,0|2,0,0]=4 6465 B15R2.123 COc1ccccc1Sc2c[nH]cn2 62a_100000756875_100000210334 [0,0,1,0,1,0|2,0,0]=4 6466 B15R2.123 CSc1ccccc1Sc2c[nH]cn2 62a_100000756875_100011217816 [0,0,1,0,1,0|2,0,0]=4 6467 B15R2.123 CSc1ccccc1Sc2c[nH]cn2 62a_100011217816_100000756875 [0,0,1,0,1,0|2,0,0]=4 6468 B15R2.123 NCc1ccccc1Sc2c[nH]cn2 62a_100000689332_100000756875 [0,0,1,0,1,0|2,0,0]=4 6469 B15R2.123 NCc1ccccc1Sc2c[nH]cn2 62a_100000756875_100000689332 [0,0,1,0,1,0|2,0,0]=4 6470 B15R2.123 OCc1ccccc1Sc2c[nH]cn2 62a_100000187465_100000756875 [0,0,1,0,1,0|2,0,0]=4 6471 B15R2.123 OCc1ccccc1Sc2c[nH]cn2 62a_100000756875_100000187465 [0,0,1,0,1,0|2,0,0]=4 6472 B15R2.1787 CCc1ccsc1SCc2c[nH]cn2 62a_100000707719_200009875468 [0,0,1,0,1,0|2,0,0]=4 6473 B15R2.1787 CCc1ccsc1SCc2c[nH]cn2 62a_200009875468_100000707719 [0,0,1,0,1,0|2,0,0]=4 6474 B15R2.1787 CCc1cscc1SCc2c[nH]cn2 62a_100000707719_100011068457 [0,0,1,0,1,0|2,0,0]=4 6475 B15R2.1787 CCc1cscc1SCc2c[nH]cn2 62a_100011068457_100000707719 [0,0,1,0,1,0|2,0,0]=4 6476 B15R2.2194 c1cc(cs1)CCNCc2cscn2 207a_100000692642_100000743575 [0,0,1,0,1,0|2,0,0]=4 6477 B15R2.2194 c1cc(cs1)CCNCc2cscn2 2230a_100000692642_100000205941 [0,0,1,0,1,0|2,0,0]=4 6478 B15R2.2194 c1cc(cs1)CCNCc2cscn2 270004a_100000692642_100000743575 [0,0,1,0,1,0|2,0,0]=4 6479 B15R2.2194 c1cc(cs1)CCNCc2cscn2 34a_100000692642_100000205941 [0,0,1,0,1,0|2,0,0]=4 6480 B15R2.2194 c1ccn(c1)CCNCc2c[nH]cn2 34a_100011368172_100000707719 [0,0,1,0,1,0|1,0,0]=3 6481 B15R2.2194 c1ccn(c1)CCNCc2cocn2 270004a_100011368172_100000050382 [0,0,1,0,1,0|2,0,0]=4 6482 B15R2.2194 c1ccn(c1)CCNCc2cscn2 207a_100011368172_100000743575 [0,0,1,0,1,0|2,0,0]=4 6483 B15R2.2194 c1ccn(c1)CCNCc2cscn2 2230a_100015185402_200009811947 [0,0,1,0,1,0|2,0,0]=4 6484 B15R2.2194 c1ccn(c1)CCNCc2cscn2 270004a_100011368172_100000743575 [0,0,1,0,1,0|2,0,0]=4 6485 B15R2.2194 c1ccn(c1)CCNCc2cscn2 34a_100011368172_100000205941 [0,0,1,0,1,0|2,0,0]=4 6486 B15R2.2194 c1ccn(c1)CCOCc2c[nH]cn2 34a_100000179382_100000707719 [0,0,1,0,1,0|2,0,0]=4 6487 B15R2.2194 c1ccn(c1)CCSCc2c[nH]cn2 62a_100000707719_200000035178 [0,0,1,0,1,0|2,0,0]=4 6488 B15R2.2194 c1ccn(c1)CCSCc2c[nH]cn2 62a_200009811947_100000707719 [0,0,1,0,1,0|2,0,0]=4 6489 B15R2.2194 c1cnn(c1)CCNCc2c[nH]cn2 2230a_100011200920_100000707719 [0,0,1,0,1,0|2,0,0]=4 6490 B15R2.2194 c1coc(c1)CCNCc2c[nH]cn2 2230a_100000694680_100000707719 [0,0,1,0,1,0|1,0,0]=3 6491 B15R2.2194 c1coc(c1)CCNCc2c[nH]cn2 34a_100000694680_100000707719 [0,0,1,0,1,0|1,0,0]=3 6492 B15R2.2194 c1coc(c1)CCNCc2cocn2 270004a_100000694680_100000050382 [0,0,1,0,1,0|2,0,0]=4 6493 B15R2.2194 c1coc(c1)CCNCc2cscn2 207a_100000694680_100000743575 [0,0,1,0,1,0|2,0,0]=4 6494 B15R2.2194 c1coc(c1)CCNCc2cscn2 2230a_100000694680_100000205941 [0,0,1,0,1,0|2,0,0]=4 6495 B15R2.2194 c1coc(c1)CCNCc2cscn2 270004a_100000694680_100000743575 [0,0,1,0,1,0|2,0,0]=4 6496 B15R2.2194 c1coc(c1)CCNCc2cscn2 34a_100000694680_100000205941 [0,0,1,0,1,0|2,0,0]=4 6497 B15R2.2194 c1csc(c1)CCNCc2c[nH]cn2 2230a_100000203755_100000707719 [0,0,1,0,1,0|1,0,0]=3 6498 B15R2.2194 c1csc(c1)CCNCc2c[nH]cn2 34a_100000203755_100000707719 [0,0,1,0,1,0|1,0,0]=3 6499 B15R2.2194 c1csc(c1)CCNCc2cocn2 270004a_100000203755_100000050382 [0,0,1,0,1,0|2,0,0]=4 6500 B15R2.2194 c1csc(c1)CCNCc2cscn2 207a_100000203755_100000743575 [0,0,1,0,1,0|2,0,0]=4 6501 B15R2.2194 c1csc(c1)CCNCc2cscn2 2230a_100000203755_100000205941 [0,0,1,0,1,0|2,0,0]=4 6502 B15R2.2194 c1csc(c1)CCNCc2cscn2 2230a_100015185402_100000748579 [0,0,1,0,1,0|2,0,0]=4 6503 B15R2.2194 c1csc(c1)CCNCc2cscn2 270004a_100000203755_100000743575 [0,0,1,0,1,0|2,0,0]=4 6504 B15R2.2194 c1csc(c1)CCNCc2cscn2 34a_100000203755_100000205941 [0,0,1,0,1,0|2,0,0]=4 6505 B15R2.2194 c1csc(c1)CCOCc2c[nH]cn2 34a_100011216825_100000707719 [0,0,1,0,1,0|2,0,0]=4 6506 B15R2.2194 c1csc(c1)CCSCc2c[nH]cn2 62a_100000707719_100000748579 [0,0,1,0,1,0|2,0,0]=4 6507 B15R2.2194 c1csc(c1)CCSCc2c[nH]cn2 62a_100000748579_100000707719 [0,0,1,0,1,0|2,0,0]=4 6508 B15R2.2194 c1csc(n1)CCNCc2c[nH]cn2 2230a_100015186391_100000707719 [0,0,1,0,1,0|2,0,0]=4 6509 B15R2.2194 c1nc(c[nH]1)CNCCc2ccsc2 2230a_100000692642_100000707719 [0,0,1,0,1,0|1,0,0]=3 6510 B15R2.2194 c1nc(c[nH]1)CNCCc2ccsc2 34a_100000692642_100000707719 [0,0,1,0,1,0|1,0,0]=3 6511 B15R2.2194 c1nc(c[nH]1)CNCCc2cn[nH]c2 2230a_100000732747_100000707719 [0,0,1,0,1,0|2,0,0]=4 6512 B15R2.2194 c1nc(c[nH]1)CNCCc2cncs2 2230a_100016991637_100000707719 [0,0,1,0,1,0|2,0,0]=4 6513 B15R2.2194 c1nc(c[nH]1)COCCc2ccsc2 34a_100000748821_100000707719 [0,0,1,0,1,0|2,0,0]=4 6514 B15R2.2194 c1nc(co1)CNCCc2ccsc2 270004a_100000692642_100000050382 [0,0,1,0,1,0|2,0,0]=4 6515 B15R2.2196 C(=Cc1c[nH]cn1)Cc2ccccc2 271570a_200016263579_100000756875 [0,0,1,0,1,0|0,0,2]=4 6516 B15R2.2196 c1cc(ccn1)CCSc2c[nH]cn2 62a_100000723409_100000756875 [0,0,1,0,1,0|2,0,0]=4 6517 B15R2.2196 c1cc(ccn1)CCSc2c[nH]cn2 62a_100000756875_100000723409 [0,0,1,0,1,0|2,0,0]=4 6518 B15R2.2196 c1cc(ccn1)CNCc2c[nH]cn2 207a_100000758547_100000186114 [0,0,1,0,1,0|1,0,0]=3 6519 B15R2.2196 c1cc(ccn1)CNCc2c[nH]nn2 207a_100020620823_100000186114 [0,0,1,0,1,0|2,0,0]=4 6520 B15R2.2196 c1cc(ccn1)CNCc2cocn2 207a_100015188801_100000186114 [0,0,1,0,1,0|2,0,0]=4 6521 B15R2.2196 c1cc(ccn1)CNCc2cscn2 207a_100015185402_100000186114 [0,0,1,0,1,0|2,0,0]=4 6522 B15R2.2196 c1cc(ccn1)CNCc2cscn2 2230a_100015185402_100015193705 [0,0,1,0,1,0|2,0,0]=4 6523 B15R2.2196 c1cc(ccn1)CSCc2c[nH]cn2 62a_100000707719_100015193705 [0,0,1,0,1,0|2,0,0]=4 6524 B15R2.2196 c1cc(ccn1)CSCc2c[nH]cn2 62a_100015193705_100000707719 [0,0,1,0,1,0|2,0,0]=4 6525 B15R2.2196 c1cc(ccn1)SCCc2c[nH]cn2 62a_100000728582_100020628418 [0,0,1,0,1,0|2,0,0]=4 6526 B15R2.2196 c1cc(ccn1)SCCc2c[nH]cn2 62a_100020628418_100000728582 [0,0,1,0,1,0|2,0,0]=4 6527 B15R2.2196 c1ccc(cc1)CCNc2ncns2 27a_100000106460_100000693119 [0,0,1,0,1,0|1,0,1]=4 6528 B15R2.2196 c1ccc(cc1)CCSc2c[nH]cn2 62a_100000756875_100011218657 [0,0,1,0,1,0|1,0,0]=3 6529 B15R2.2196 c1ccc(cc1)CCSc2c[nH]cn2 62a_100000765856_100000756875 [0,0,1,0,1,0|1,0,0]=3 6530 B15R2.2196 c1ccc(cc1)CCSc2c[nH]nn2 62a_100000765856_100009819707 [0,0,1,0,1,0|2,0,0]=4 6531 B15R2.2196 c1ccc(cc1)CCSc2c[nH]nn2 62a_100009819707_100011218657 [0,0,1,0,1,0|2,0,0]=4 6532 B15R2.2196 c1ccc(cc1)CCSc2cscn2 62a_100000751502_100011218657 [0,0,1,0,1,0|2,0,0]=4 6533 B15R2.2196 c1ccc(cc1)CCSc2cscn2 62a_100000765856_100000751502 [0,0,1,0,1,0|2,0,0]=4 6534 B15R2.2196 c1ccc(cc1)CCSc2nc[nH]n2 62a_100000761765_100011218657 [0,0,1,0,1,0|2,0,0]=4 6535 B15R2.2196 c1ccc(cc1)CCSc2nc[nH]n2 62a_100000765856_100000761765 [0,0,1,0,1,0|2,0,0]=4 6536 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 207a_100000758547_100015611070 [0,0,1,0,1,0|0,0,0]=2 6537 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 2230a_100015324214_100000707719 [0,0,1,0,1,0|0,0,0]=2 6538 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 34a_100015324214_100000707719 [0,0,1,0,1,0|0,0,0]=2 6539 B15R2.2196 c1ccc(cc1)CNCc2c[nH]nn2 207a_100020620823_100015611070 [0,0,1,0,1,0|1,0,0]=3 6540 B15R2.2196 c1ccc(cc1)CNCc2c[nH]nn2 270004a_100020620823_100015611070 [0,0,1,0,1,0|1,0,0]=3 6541 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 207a_100000739516_100015611070 [0,0,1,0,1,0|2,0,0]=4 6542 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 207a_100015324214_100000738523 [0,0,1,0,1,0|2,0,0]=4 6543 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 270004a_100015324214_100000738523 [0,0,1,0,1,0|2,0,0]=4 6544 B15R2.2196 c1ccc(cc1)CNCc2ccco2 207a_100000185738_100015611070 [0,0,1,0,1,0|2,0,0]=4 6545 B15R2.2196 c1ccc(cc1)CNCc2ccco2 207a_100015324214_100000186105 [0,0,1,0,1,0|2,0,0]=4 6546 B15R2.2196 c1ccc(cc1)CNCc2ccco2 2230a_100000185738_100015291786 [0,0,1,0,1,0|2,0,0]=4 6547 B15R2.2196 c1ccc(cc1)CNCc2ccco2 270004a_100000185738_100015611070 [0,0,1,0,1,0|2,0,0]=4 6548 B15R2.2196 c1ccc(cc1)CNCc2ccco2 270004a_100015324214_100000186105 [0,0,1,0,1,0|2,0,0]=4 6549 B15R2.2196 c1ccc(cc1)CNCc2ccco2 34a_100000185738_100015291786 [0,0,1,0,1,0|2,0,0]=4 6550 B15R2.2196 c1ccc(cc1)CNCc2cccs2 207a_100000211653_100015611070 [0,0,1,0,1,0|2,0,0]=4 6551 B15R2.2196 c1ccc(cc1)CNCc2cccs2 207a_100015324214_100000209959 [0,0,1,0,1,0|2,0,0]=4 6552 B15R2.2196 c1ccc(cc1)CNCc2cccs2 2230a_100000211653_100015291786 [0,0,1,0,1,0|2,0,0]=4 6553 B15R2.2196 c1ccc(cc1)CNCc2cccs2 270004a_100000211653_100015611070 [0,0,1,0,1,0|2,0,0]=4 6554 B15R2.2196 c1ccc(cc1)CNCc2cccs2 270004a_100015324214_100000209959 [0,0,1,0,1,0|2,0,0]=4 6555 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 207a_100015206860_100015611070 [0,0,1,0,1,0|2,0,0]=4 6556 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 207a_100015324214_100011215517 [0,0,1,0,1,0|2,0,0]=4 6557 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100015291786 [0,0,1,0,1,0|2,0,0]=4 6558 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100015611070 [0,0,1,0,1,0|2,0,0]=4 6559 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 270004a_100015324214_100011215517 [0,0,1,0,1,0|2,0,0]=4 6560 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 34a_100015206860_100015291786 [0,0,1,0,1,0|2,0,0]=4 6561 B15R2.2196 c1ccc(cc1)CNCc2ccon2 207a_100000688301_100015611070 [0,0,1,0,1,0|2,0,0]=4 6562 B15R2.2196 c1ccc(cc1)CNCc2ccon2 2230a_100015324214_100000234950 [0,0,1,0,1,0|2,0,0]=4 6563 B15R2.2196 c1ccc(cc1)CNCc2ccon2 270004a_100000688301_100015611070 [0,0,1,0,1,0|2,0,0]=4 6564 B15R2.2196 c1ccc(cc1)CNCc2ccon2 34a_100015324214_100000234950 [0,0,1,0,1,0|2,0,0]=4 6565 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 207a_100000186416_100015611070 [0,0,1,0,1,0|2,0,0]=4 6566 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 207a_100015324214_100000188534 [0,0,1,0,1,0|2,0,0]=4 6567 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100015291786 [0,0,1,0,1,0|2,0,0]=4 6568 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 2230a_100015324214_100011261437 [0,0,1,0,1,0|2,0,0]=4 6569 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100015611070 [0,0,1,0,1,0|2,0,0]=4 6570 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 270004a_100015324214_100000188534 [0,0,1,0,1,0|2,0,0]=4 6571 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 34a_100000186416_100015291786 [0,0,1,0,1,0|2,0,0]=4 6572 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 34a_100015324214_100011261437 [0,0,1,0,1,0|2,0,0]=4 6573 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 207a_100000737208_100015611070 [0,0,1,0,1,0|2,0,0]=4 6574 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 207a_100015324214_100016992096 [0,0,1,0,1,0|2,0,0]=4 6575 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 270004a_100000737208_100015611070 [0,0,1,0,1,0|2,0,0]=4 6576 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 270004a_100015324214_100016992096 [0,0,1,0,1,0|2,0,0]=4 6577 B15R2.2196 c1ccc(cc1)CNCc2cnc[nH]2 207a_100015324214_100000742939 [0,0,1,0,1,0|0,0,2]=4 6578 B15R2.2196 c1ccc(cc1)CNCc2cnco2 207a_100020634212_100015611070 [0,0,1,0,1,0|1,0,1]=4 6579 B15R2.2196 c1ccc(cc1)CNCc2cnco2 270004a_100015324214_100000064291 [0,0,1,0,1,0|1,0,1]=4 6580 B15R2.2196 c1ccc(cc1)CNCc2cnco2 270004a_100020634212_100015611070 [0,0,1,0,1,0|1,0,1]=4 6581 B15R2.2196 c1ccc(cc1)CNCc2cncs2 207a_100015324214_100000749870 [0,0,1,0,1,0|1,0,1]=4 6582 B15R2.2196 c1ccc(cc1)CNCc2cncs2 207a_100016987365_100015611070 [0,0,1,0,1,0|1,0,1]=4 6583 B15R2.2196 c1ccc(cc1)CNCc2cncs2 2230a_100015324214_100015185245 [0,0,1,0,1,0|1,0,1]=4 6584 B15R2.2196 c1ccc(cc1)CNCc2cncs2 2230a_100016987365_100015291786 [0,0,1,0,1,0|1,0,1]=4 6585 B15R2.2196 c1ccc(cc1)CNCc2cncs2 270004a_100015324214_100000749870 [0,0,1,0,1,0|1,0,1]=4 6586 B15R2.2196 c1ccc(cc1)CNCc2cncs2 270004a_100016987365_100015611070 [0,0,1,0,1,0|1,0,1]=4 6587 B15R2.2196 c1ccc(cc1)CNCc2cncs2 34a_100015324214_100015185245 [0,0,1,0,1,0|1,0,1]=4 6588 B15R2.2196 c1ccc(cc1)CNCc2cocn2 207a_100015188801_100015611070 [0,0,1,0,1,0|1,0,0]=3 6589 B15R2.2196 c1ccc(cc1)CNCc2cocn2 270004a_100015188801_100015611070 [0,0,1,0,1,0|1,0,0]=3 6590 B15R2.2196 c1ccc(cc1)CNCc2cocn2 270004a_100015324214_100000050382 [0,0,1,0,1,0|1,0,0]=3 6591 B15R2.2196 c1ccc(cc1)CNCc2cscn2 207a_100015185402_100015611070 [0,0,1,0,1,0|1,0,0]=3 6592 B15R2.2196 c1ccc(cc1)CNCc2cscn2 207a_100015324214_100000743575 [0,0,1,0,1,0|1,0,0]=3 6593 B15R2.2196 c1ccc(cc1)CNCc2cscn2 2230a_100015185402_100015291786 [0,0,1,0,1,0|1,0,0]=3 6594 B15R2.2196 c1ccc(cc1)CNCc2cscn2 2230a_100015324214_100000205941 [0,0,1,0,1,0|1,0,0]=3 6595 B15R2.2196 c1ccc(cc1)CNCc2cscn2 270004a_100015324214_100000743575 [0,0,1,0,1,0|1,0,0]=3 6596 B15R2.2196 c1ccc(cc1)CNCc2cscn2 34a_100015324214_100000205941 [0,0,1,0,1,0|1,0,0]=3 6597 B15R2.2196 c1ccc(cc1)CNCc2csnn2 270004a_100015324214_100000738508 [0,0,1,0,1,0|2,0,0]=4 6598 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 207a_100000754540_100015611070 [0,0,1,0,1,0|2,0,0]=4 6599 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 207a_100015324214_100000743867 [0,0,1,0,1,0|2,0,0]=4 6600 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 2230a_100015324214_100016991755 [0,0,1,0,1,0|2,0,0]=4 6601 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 270004a_100000754540_100015611070 [0,0,1,0,1,0|2,0,0]=4 6602 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 34a_100015324214_100016991755 [0,0,1,0,1,0|2,0,0]=4 6603 B15R2.2196 c1ccc(cc1)CNCc2ncco2 207a_100016994969_100015611070 [0,0,1,0,1,0|2,0,0]=4 6604 B15R2.2196 c1ccc(cc1)CNCc2ncco2 2230a_100015324214_103436540062 [0,0,1,0,1,0|2,0,0]=4 6605 B15R2.2196 c1ccc(cc1)CNCc2ncco2 2230a_100016994969_100015291786 [0,0,1,0,1,0|2,0,0]=4 6606 B15R2.2196 c1ccc(cc1)CNCc2ncco2 270004a_100015324214_100000064290 [0,0,1,0,1,0|2,0,0]=4 6607 B15R2.2196 c1ccc(cc1)CNCc2ncco2 34a_100015324214_103436540062 [0,0,1,0,1,0|2,0,0]=4 6608 B15R2.2196 c1ccc(cc1)CNCc2nccs2 207a_100000740555_100015611070 [0,0,1,0,1,0|2,0,0]=4 6609 B15R2.2196 c1ccc(cc1)CNCc2nccs2 207a_100015324214_100000750902 [0,0,1,0,1,0|2,0,0]=4 6610 B15R2.2196 c1ccc(cc1)CNCc2nccs2 2230a_100000740555_100015291786 [0,0,1,0,1,0|2,0,0]=4 6611 B15R2.2196 c1ccc(cc1)CNCc2nccs2 2230a_100015324214_100015184050 [0,0,1,0,1,0|2,0,0]=4 6612 B15R2.2196 c1ccc(cc1)CNCc2nccs2 270004a_100000740555_100015611070 [0,0,1,0,1,0|2,0,0]=4 6613 B15R2.2196 c1ccc(cc1)CNCc2nccs2 270004a_100015324214_100000750902 [0,0,1,0,1,0|2,0,0]=4 6614 B15R2.2196 c1ccc(cc1)CNCc2nccs2 34a_100015324214_100015184050 [0,0,1,0,1,0|2,0,0]=4 6615 B15R2.2196 c1ccc(cc1)CNCc2ncon2 34a_100015324214_100000233494 [0,0,1,0,1,0|2,0,0]=4 6616 B15R2.2196 c1ccc(cc1)CNCn2cncn2 2230a_100015324214_200020645497 [0,0,1,0,1,0|1,0,1]=4 6617 B15R2.2196 c1ccc(cc1)CNCn2cncn2 34a_100015324214_200020645497 [0,0,1,0,1,0|1,0,1]=4 6618 B15R2.2196 c1ccc(cc1)COCc2c[nH]cn2 34a_100000210790_100000707719 [0,0,1,0,1,0|1,0,0]=3 6619 B15R2.2196 c1ccc(cc1)COCc2cscn2 34a_100000210790_100000205941 [0,0,1,0,1,0|2,0,0]=4 6620 B15R2.2196 c1ccc(cc1)COCc2cscn2 7a_100000210790_100000205941 [0,0,1,0,1,0|2,0,0]=4 6621 B15R2.2196 c1ccc(cc1)CSCc2c[nH]cn2 62a_100000211182_100000707719 [0,0,1,0,1,0|1,0,0]=3 6622 B15R2.2196 c1ccc(cc1)CSCc2c[nH]cn2 62a_100000707719_100015291786 [0,0,1,0,1,0|1,0,0]=3 6623 B15R2.2196 c1ccc(cc1)CSCc2cscn2 62a_100000205941_100015291786 [0,0,1,0,1,0|2,0,0]=4 6624 B15R2.2196 c1ccc(cc1)CSCc2cscn2 62a_100000211182_100000205941 [0,0,1,0,1,0|2,0,0]=4 6625 B15R2.2196 c1ccc(cc1)OCCc2c[nH]cn2 7a_100000210340_100020628418 [0,0,1,0,1,0|1,0,0]=3 6626 B15R2.2196 c1ccc(cc1)SCCc2c[nH]cn2 62a_100000719477_100020628418 [0,0,1,0,1,0|1,0,0]=3 6627 B15R2.2196 c1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000041952 [0,0,1,0,1,0|1,0,0]=3 6628 B15R2.2196 c1ccc(cc1)SCSc2c[nH]cn2 62a_100000756875_100011218342 [0,0,1,0,1,0|2,0,0]=4 6629 B15R2.2196 c1ccc(cc1)SCSc2c[nH]cn2 62a_100011218342_100000756875 [0,0,1,0,1,0|2,0,0]=4 6630 B15R2.2196 c1ccc(nc1)CCSc2c[nH]cn2 62a_100000756875_100015183660 [0,0,1,0,1,0|2,0,0]=4 6631 B15R2.2196 c1ccc(nc1)CCSc2c[nH]cn2 62a_100015183660_100000756875 [0,0,1,0,1,0|2,0,0]=4 6632 B15R2.2196 c1ccc(nc1)CNCc2c[nH]cn2 207a_100000758547_100000209966 [0,0,1,0,1,0|1,0,0]=3 6633 B15R2.2196 c1ccc(nc1)CNCc2c[nH]nn2 207a_100020620823_100000209966 [0,0,1,0,1,0|2,0,0]=4 6634 B15R2.2196 c1ccc(nc1)CNCc2c[nH]nn2 270004a_100020620823_100000209966 [0,0,1,0,1,0|2,0,0]=4 6635 B15R2.2196 c1ccc(nc1)CNCc2cocn2 207a_100015188801_100000209966 [0,0,1,0,1,0|2,0,0]=4 6636 B15R2.2196 c1ccc(nc1)CNCc2cocn2 270004a_100000210449_100000050382 [0,0,1,0,1,0|2,0,0]=4 6637 B15R2.2196 c1ccc(nc1)CNCc2cocn2 270004a_100015188801_100000209966 [0,0,1,0,1,0|2,0,0]=4 6638 B15R2.2196 c1ccc(nc1)CNCc2cscn2 207a_100015185402_100000209966 [0,0,1,0,1,0|2,0,0]=4 6639 B15R2.2196 c1ccc(nc1)CNCc2cscn2 2230a_100015185402_100000721315 [0,0,1,0,1,0|2,0,0]=4 6640 B15R2.2196 c1ccc(nc1)CNCc2cscn2 270004a_100000210449_100000743575 [0,0,1,0,1,0|2,0,0]=4 6641 B15R2.2196 c1ccc(nc1)CSCc2c[nH]cn2 62a_100000707719_100000721315 [0,0,1,0,1,0|2,0,0]=4 6642 B15R2.2196 c1ccc(nc1)CSCc2c[nH]cn2 62a_100000721315_100000707719 [0,0,1,0,1,0|2,0,0]=4 6643 B15R2.2196 c1ccc(nc1)SCCc2c[nH]cn2 62a_100011216584_100020628418 [0,0,1,0,1,0|2,0,0]=4 6644 B15R2.2196 c1ccc(nc1)SCCc2c[nH]cn2 62a_100020628418_100011216584 [0,0,1,0,1,0|2,0,0]=4 6645 B15R2.2196 c1cncc(c1)CCSc2c[nH]cn2 62a_100000756875_200011713674 [0,0,1,0,1,0|2,0,0]=4 6646 B15R2.2196 c1cncc(c1)CCSc2c[nH]cn2 62a_200011713674_100000756875 [0,0,1,0,1,0|2,0,0]=4 6647 B15R2.2196 c1cncc(c1)CNCc2c[nH]cn2 207a_100000758547_100000209961 [0,0,1,0,1,0|1,0,0]=3 6648 B15R2.2196 c1cncc(c1)CNCc2c[nH]nn2 207a_100020620823_100000209961 [0,0,1,0,1,0|2,0,0]=4 6649 B15R2.2196 c1cncc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000209961 [0,0,1,0,1,0|2,0,0]=4 6650 B15R2.2196 c1cncc(c1)CNCc2cocn2 207a_100015188801_100000209961 [0,0,1,0,1,0|2,0,0]=4 6651 B15R2.2196 c1cncc(c1)CNCc2cocn2 270004a_100000210453_100000050382 [0,0,1,0,1,0|2,0,0]=4 6652 B15R2.2196 c1cncc(c1)CNCc2cocn2 270004a_100015188801_100000209961 [0,0,1,0,1,0|2,0,0]=4 6653 B15R2.2196 c1cncc(c1)CNCc2cscn2 207a_100000210453_100000743575 [0,0,1,0,1,0|2,0,0]=4 6654 B15R2.2196 c1cncc(c1)CNCc2cscn2 207a_100015185402_100000209961 [0,0,1,0,1,0|2,0,0]=4 6655 B15R2.2196 c1cncc(c1)CNCc2cscn2 2230a_100015185402_100000741622 [0,0,1,0,1,0|2,0,0]=4 6656 B15R2.2196 c1cncc(c1)CNCc2cscn2 270004a_100000210453_100000743575 [0,0,1,0,1,0|2,0,0]=4 6657 B15R2.2196 c1cncc(c1)CSCc2c[nH]cn2 62a_100000707719_100000741622 [0,0,1,0,1,0|2,0,0]=4 6658 B15R2.2196 c1cncc(c1)CSCc2c[nH]cn2 62a_100000741622_100000707719 [0,0,1,0,1,0|2,0,0]=4 6659 B15R2.2196 c1cncc(c1)OCCc2c[nH]cn2 7a_100000210849_100020628418 [0,0,1,0,1,0|2,0,0]=4 6660 B15R2.2196 c1cncc(c1)SCCc2c[nH]cn2 62a_100000210063_100020628418 [0,0,1,0,1,0|2,0,0]=4 6661 B15R2.2196 c1cncc(c1)SCCc2c[nH]cn2 62a_100020628418_100000210063 [0,0,1,0,1,0|2,0,0]=4 6662 B15R2.2196 c1cnnc(c1)CNCc2c[nH]cn2 2230a_100159270163_100000707719 [0,0,1,0,1,0|2,0,0]=4 6663 B15R2.2196 c1ncc(cn1)CNCc2c[nH]cn2 2230a_100011243677_100000707719 [0,0,1,0,1,0|2,0,0]=4 6664 B15R2.358 Cc1ccccc1N(C)c2ncns2 27a_100000219699_100000693119 [0,0,1,0,1,0|1,0,1]=4 6665 B17R2.162 CCN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100000210202 [0,0,1,0,0,1|2,0,0]=4 6666 B17R2.162 CCN(Cc1ccccc1)c2ccccc2 2230a_100000210013_100015291786 [0,0,1,0,0,1|2,0,0]=4 6667 B17R2.162 CCN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000204670 [0,0,1,0,0,1|2,0,0]=4 6668 B17R2.162 CCN(Cc1ccccc1)c2ccccc2 269982a_100000210013_100000211182 [0,0,1,0,0,1|2,0,0]=4 6669 B17R2.162 CCN(Cc1ccccc1)c2ccccc2 34a_100000188819_100000210202 [0,0,1,0,0,1|2,0,0]=4 6670 B17R2.162 CCN(Cc1ccccc1)c2ccccc2 34a_100000210013_100015291786 [0,0,1,0,0,1|2,0,0]=4 6671 B17R2.162 CCN(Cc1ccccn1)c2ccccc2 2230a_100000210013_100000721315 [0,0,1,0,0,1|1,0,0]=3 6672 B17R2.162 CCN(Cc1ccccn1)c2ccccc2 269982a_100000210013_100000721315 [0,0,1,0,0,1|1,0,0]=3 6673 B17R2.162 CCN(Cc1ccccn1)c2ccccc2 34a_100000210013_100000721315 [0,0,1,0,0,1|1,0,0]=3 6674 B17R2.162 CCN(Cc1cccnc1)c2ccccc2 2230a_100000210013_100000741622 [0,0,1,0,0,1|1,0,0]=3 6675 B17R2.162 CCN(Cc1cccnc1)c2ccccc2 269982a_100000210013_100000733263 [0,0,1,0,0,1|1,0,0]=3 6676 B17R2.162 CCN(Cc1cccnc1)c2ccccc2 34a_100000210013_100000733263 [0,0,1,0,0,1|1,0,0]=3 6677 B17R2.162 CCN(Cc1cccnn1)c2ccccc2 2230a_100000210013_100016990269 [0,0,1,0,0,1|1,0,0]=3 6678 B17R2.162 CCN(Cc1cccnn1)c2ccccc2 34a_100000210013_100016990269 [0,0,1,0,0,1|1,0,0]=3 6679 B17R2.162 CCN(Cc1ccncc1)c2ccccc2 2230a_100000210013_100015193705 [0,0,1,0,0,1|1,0,1]=4 6680 B17R2.162 CCN(Cc1ccncc1)c2ccccc2 269982a_100000210013_100015193705 [0,0,1,0,0,1|1,0,1]=4 6681 B17R2.162 CCN(Cc1cnccn1)c2ccccc2 2230a_100000210013_100016995436 [0,0,1,0,0,1|0,0,1]=3 6682 B17R2.162 CCN(Cc1cnccn1)c2ccccc2 269982a_100000210013_100016995436 [0,0,1,0,0,1|0,0,1]=3 6683 B17R2.162 CCN(Cc1cnccn1)c2ccccc2 34a_100000210013_100016995436 [0,0,1,0,0,1|0,0,1]=3 6684 B17R2.162 CCN(Cc1cncnc1)c2ccccc2 2230a_100000210013_100015196519 [0,0,1,0,0,1|0,0,1]=3 6685 B17R2.162 CCN(Cc1cncnc1)c2ccccc2 269982a_100000210013_100016991940 [0,0,1,0,0,1|0,0,1]=3 6686 B17R2.162 CCN(Cc1cncnc1)c2ccccc2 34a_100000210013_100015196519 [0,0,1,0,0,1|0,0,1]=3 6687 B17R2.162 CCN(Cc1ncccn1)c2ccccc2 2230a_100000210013_100000703007 [0,0,1,0,0,1|1,0,0]=3 6688 B17R2.162 CCN(Cc1ncccn1)c2ccccc2 269982a_100000210013_100000703007 [0,0,1,0,0,1|1,0,0]=3 6689 B17R2.162 CCN(Cc1ncccn1)c2ccccc2 34a_100000210013_100000703007 [0,0,1,0,0,1|1,0,0]=3 6690 B17R2.6053 CCN(Cc1ccccc1)Cc2c[nH]cn2 2230a_100000186914_100000707719 [0,0,1,0,0,1|0,0,0]=2 6691 B17R2.6053 CCN(Cc1ccccc1)Cc2c[nH]cn2 269982a_100000186914_100000707719 [0,0,1,0,0,1|0,0,0]=2 6692 B17R2.6053 CCN(Cc1ccccc1)Cc2cc[nH]n2 270004a_100000186914_100000738523 [0,0,1,0,0,1|2,0,0]=4 6693 B17R2.6053 CCN(Cc1ccccc1)Cc2ccco2 2230a_100000184096_100000210202 [0,0,1,0,0,1|2,0,0]=4 6694 B17R2.6053 CCN(Cc1ccccc1)Cc2ccco2 2230a_100000739255_100015291786 [0,0,1,0,0,1|2,0,0]=4 6695 B17R2.6053 CCN(Cc1ccccc1)Cc2ccco2 269982a_100000184096_100000204670 [0,0,1,0,0,1|2,0,0]=4 6696 B17R2.6053 CCN(Cc1ccccc1)Cc2ccco2 269982a_100000739255_100000211182 [0,0,1,0,0,1|2,0,0]=4 6697 B17R2.6053 CCN(Cc1ccccc1)Cc2ccco2 270004a_100000186914_100000186105 [0,0,1,0,0,1|2,0,0]=4 6698 B17R2.6053 CCN(Cc1ccccc1)Cc2ccco2 270004a_100000739255_100015611070 [0,0,1,0,0,1|2,0,0]=4 6699 B17R2.6053 CCN(Cc1ccccc1)Cc2cccs2 2230a_100025770963_100015291786 [0,0,1,0,0,1|2,0,0]=4 6700 B17R2.6053 CCN(Cc1ccccc1)Cc2cccs2 269982a_100025770963_100000211182 [0,0,1,0,0,1|2,0,0]=4 6701 B17R2.6053 CCN(Cc1ccccc1)Cc2cccs2 270004a_100000186914_100000209959 [0,0,1,0,0,1|2,0,0]=4 6702 B17R2.6053 CCN(Cc1ccccc1)Cc2cccs2 270004a_100025770963_100015611070 [0,0,1,0,0,1|2,0,0]=4 6703 B17R2.6053 CCN(Cc1ccccc1)Cc2ccoc2 270004a_100000186914_100011215517 [0,0,1,0,0,1|2,0,0]=4 6704 B17R2.6053 CCN(Cc1ccccc1)Cc2ccon2 2230a_100000186914_100000234950 [0,0,1,0,0,1|2,0,0]=4 6705 B17R2.6053 CCN(Cc1ccccc1)Cc2ccon2 269982a_100000186914_100000234950 [0,0,1,0,0,1|2,0,0]=4 6706 B17R2.6053 CCN(Cc1ccccc1)Cc2ccsc2 2230a_100000186914_100011261437 [0,0,1,0,0,1|2,0,0]=4 6707 B17R2.6053 CCN(Cc1ccccc1)Cc2ccsc2 269982a_100000186914_100011233845 [0,0,1,0,0,1|2,0,0]=4 6708 B17R2.6053 CCN(Cc1ccccc1)Cc2ccsc2 270004a_100000186914_100000188534 [0,0,1,0,0,1|2,0,0]=4 6709 B17R2.6053 CCN(Cc1ccccc1)Cc2cn[nH]c2 270004a_100000186914_100016992096 [0,0,1,0,0,1|2,0,0]=4 6710 B17R2.6053 CCN(Cc1ccccc1)Cc2cnco2 270004a_100000186914_100000064291 [0,0,1,0,0,1|1,0,1]=4 6711 B17R2.6053 CCN(Cc1ccccc1)Cc2cncs2 2230a_100000186914_100015185245 [0,0,1,0,0,1|1,0,1]=4 6712 B17R2.6053 CCN(Cc1ccccc1)Cc2cncs2 269982a_100000186914_100015185245 [0,0,1,0,0,1|1,0,1]=4 6713 B17R2.6053 CCN(Cc1ccccc1)Cc2cncs2 270004a_100000186914_100000749870 [0,0,1,0,0,1|1,0,1]=4 6714 B17R2.6053 CCN(Cc1ccccc1)Cc2cocn2 270004a_100000186914_100000050382 [0,0,1,0,0,1|1,0,0]=3 6715 B17R2.6053 CCN(Cc1ccccc1)Cc2cscn2 2230a_100000186914_100000205941 [0,0,1,0,0,1|1,0,0]=3 6716 B17R2.6053 CCN(Cc1ccccc1)Cc2cscn2 269982a_100000186914_100000205941 [0,0,1,0,0,1|1,0,0]=3 6717 B17R2.6053 CCN(Cc1ccccc1)Cc2cscn2 270004a_100000186914_100000743575 [0,0,1,0,0,1|1,0,0]=3 6718 B17R2.6053 CCN(Cc1ccccc1)Cc2csnn2 270004a_100000186914_100000738508 [0,0,1,0,0,1|2,0,0]=4 6719 B17R2.6053 CCN(Cc1ccccc1)Cc2ncc[nH]2 2230a_100000186914_100016991755 [0,0,1,0,0,1|2,0,0]=4 6720 B17R2.6053 CCN(Cc1ccccc1)Cc2ncc[nH]2 269982a_100000186914_100016991755 [0,0,1,0,0,1|2,0,0]=4 6721 B17R2.6053 CCN(Cc1ccccc1)Cc2ncco2 2230a_100000186914_103436540062 [0,0,1,0,0,1|2,0,0]=4 6722 B17R2.6053 CCN(Cc1ccccc1)Cc2ncco2 269982a_100000186914_103436540062 [0,0,1,0,0,1|2,0,0]=4 6723 B17R2.6053 CCN(Cc1ccccc1)Cc2ncco2 270004a_100000186914_100000064290 [0,0,1,0,0,1|2,0,0]=4 6724 B17R2.6053 CCN(Cc1ccccc1)Cc2nccs2 2230a_100000186914_100015184050 [0,0,1,0,0,1|2,0,0]=4 6725 B17R2.6053 CCN(Cc1ccccc1)Cc2nccs2 2230a_200020666727_100000210202 [0,0,1,0,0,1|2,0,0]=4 6726 B17R2.6053 CCN(Cc1ccccc1)Cc2nccs2 269982a_100000186914_100015184050 [0,0,1,0,0,1|2,0,0]=4 6727 B17R2.6053 CCN(Cc1ccccc1)Cc2nccs2 269982a_200020666727_100000204670 [0,0,1,0,0,1|2,0,0]=4 6728 B17R2.6053 CCN(Cc1ccccc1)Cc2nccs2 270004a_100000186914_100000750902 [0,0,1,0,0,1|2,0,0]=4 6729 B17R2.6053 CCN(Cc1ccccc1)Cc2ncon2 269982a_100000186914_100000233494 [0,0,1,0,0,1|2,0,0]=4 6730 B17R2.6053 CCN(Cc1ccccc1)Cn2cncn2 2230a_100000186914_200020645497 [0,0,1,0,0,1|1,0,1]=4 6731 B17R2.6053 CCN(Cc1ccccc1)Cn2cncn2 269982a_100000186914_200020645497 [0,0,1,0,0,1|1,0,1]=4 6732 B17R2.6053 CCN(Cc1ccccn1)Cc2c[nH]cn2 2230a_100000201164_100000707719 [0,0,1,0,0,1|1,0,0]=3 6733 B17R2.6053 CCN(Cc1ccccn1)Cc2c[nH]cn2 269982a_100000201164_100000707719 [0,0,1,0,0,1|1,0,0]=3 6734 B17R2.6053 CCN(Cc1ccccn1)Cc2cocn2 270004a_100000201164_100000050382 [0,0,1,0,0,1|2,0,0]=4 6735 B17R2.6053 CCN(Cc1ccccn1)Cc2cscn2 2230a_100000201164_100000205941 [0,0,1,0,0,1|2,0,0]=4 6736 B17R2.6053 CCN(Cc1ccccn1)Cc2cscn2 269982a_100000201164_100000205941 [0,0,1,0,0,1|2,0,0]=4 6737 B17R2.6053 CCN(Cc1ccccn1)Cc2cscn2 270004a_100000201164_100000743575 [0,0,1,0,0,1|2,0,0]=4 6738 B17R2.6053 CCN(Cc1cccnc1)Cc2c[nH]cn2 2230a_100000186920_100000707719 [0,0,1,0,0,1|1,0,0]=3 6739 B17R2.6053 CCN(Cc1cccnc1)Cc2c[nH]cn2 269982a_100000186920_100000707719 [0,0,1,0,0,1|1,0,0]=3 6740 B17R2.6053 CCN(Cc1cccnc1)Cc2cocn2 270004a_100000186920_100000050382 [0,0,1,0,0,1|2,0,0]=4 6741 B17R2.6053 CCN(Cc1cccnc1)Cc2cscn2 2230a_100000186920_100000205941 [0,0,1,0,0,1|2,0,0]=4 6742 B17R2.6053 CCN(Cc1cccnc1)Cc2cscn2 269982a_100000186920_100000205941 [0,0,1,0,0,1|2,0,0]=4 6743 B17R2.6053 CCN(Cc1cccnc1)Cc2cscn2 270004a_100000186920_100000743575 [0,0,1,0,0,1|2,0,0]=4 6744 B17R2.6053 CCN(Cc1ccncc1)Cc2c[nH]cn2 2230a_100000186919_100000707719 [0,0,1,0,0,1|1,0,0]=3 6745 B17R2.6053 CCN(Cc1ccncc1)Cc2c[nH]cn2 269982a_100000186919_100000707719 [0,0,1,0,0,1|1,0,0]=3 6746 B17R2.6053 CCN(Cc1ccncc1)Cc2cocn2 270004a_100000186919_100000050382 [0,0,1,0,0,1|2,0,0]=4 6747 B17R2.6053 CCN(Cc1ccncc1)Cc2cscn2 2230a_100000186919_100000205941 [0,0,1,0,0,1|2,0,0]=4 6748 B17R2.6053 CCN(Cc1ccncc1)Cc2cscn2 269982a_100000186919_100000205941 [0,0,1,0,0,1|2,0,0]=4 6749 B17R2.6053 CCN(Cc1ccncc1)Cc2cscn2 270004a_100000186919_100000743575 [0,0,1,0,0,1|2,0,0]=4 6750 B17R2.17880 CCC(NCc1c[nH]cn1)c2ccccc2 2230a_100000737752_100000707719 [0,0,1,0,0,1|1,0,0]=3 6751 B17R2.17880 CCC(NCc1c[nH]cn1)c2ccccn2 2230a_100015186561_100000707719 [0,0,1,0,0,1|2,0,0]=4 6752 B17R2.17880 CCC(NCc1c[nH]cn1)c2cccnc2 2230a_100000246009_100000707719 [0,0,1,0,0,1|2,0,0]=4 6753 B17R2.17880 CCC(NCc1cocn1)c2ccccc2 269862a_100015188801_100000210124 [0,0,1,0,0,1|2,0,0]=4 6754 B17R2.17880 CCC(NCc1cocn1)c2ccccc2 270004a_100000737752_100000050382 [0,0,1,0,0,1|2,0,0]=4 6755 B17R2.17880 CCC(NCc1cscn1)c2ccccc2 207a_100000737752_100000743575 [0,0,1,0,0,1|2,0,0]=4 6756 B17R2.17880 CCC(NCc1cscn1)c2ccccc2 2230a_100000737752_100000205941 [0,0,1,0,0,1|2,0,0]=4 6757 B17R2.17880 CCC(NCc1cscn1)c2ccccc2 269862a_100015185402_100000210124 [0,0,1,0,0,1|2,0,0]=4 6758 B17R2.17880 CCC(NCc1cscn1)c2ccccc2 270004a_100000737752_100000743575 [0,0,1,0,0,1|2,0,0]=4 6759 B17R2.17880 CCC(OCc1c[nH]cn1)c2ccccc2 34a_100000698172_100000707719 [0,0,1,0,0,1|1,0,0]=3 6760 B17R2.17880 CCC(OCc1cscn1)c2ccccc2 34a_100000698172_100000205941 [0,0,1,0,0,1|2,0,0]=4 6761 B17R2.17880 CCC(OCc1cscn1)c2ccccc2 7a_100000698172_100000205941 [0,0,1,0,0,1|2,0,0]=4 6762 B17R2.17880 CCN(CCc1c[nH]cn1)c2ccccc2 2230a_100000210013_100020628418 [0,0,1,0,0,1|0,0,0]=2 6763 B17R2.17880 CCN(CCc1c[nH]cn1)c2ccccc2 269982a_100000210013_100020628418 [0,0,1,0,0,1|0,0,0]=2 6764 B17R2.17880 CCN(CCc1cccs1)c2ccccc2 2230a_100000210013_100000748579 [0,0,1,0,0,1|2,0,0]=4 6765 B17R2.17880 CCN(CCc1cccs1)c2ccccc2 269982a_100000210013_100000748579 [0,0,1,0,0,1|2,0,0]=4 6766 B17R2.17880 CCN(CCc1cccs1)c2ccccc2 34a_100000210013_100000748579 [0,0,1,0,0,1|2,0,0]=4 6767 B17R2.17880 CCN(CCc1cn[nH]c1)c2ccccc2 2230a_100000210013_100000743252 [0,0,1,0,0,1|2,0,0]=4 6768 B17R2.17880 CCN(CCc1cn[nH]c1)c2ccccc2 269982a_100000210013_100000743252 [0,0,1,0,0,1|2,0,0]=4 6769 B17R2.17880 CCN(CCn1cccn1)c2ccccc2 2230a_100000210013_100000685285 [0,0,1,0,0,1|2,0,0]=4 6770 B17R2.17880 CCN(CCn1cccn1)c2ccccc2 269982a_100000210013_100000685285 [0,0,1,0,0,1|2,0,0]=4 6771 B17R2.17880 CCN(CCn1cccn1)c2ccccc2 34a_100000210013_100015204718 [0,0,1,0,0,1|2,0,0]=4 6772 B17R2.17880 CCN(CCn1cncn1)c2ccccc2 2230a_100000210013_100000731791 [0,0,1,0,0,1|1,0,1]=4 6773 B17R2.17880 CCN(CCn1cncn1)c2ccccc2 269982a_100000210013_100000731791 [0,0,1,0,0,1|1,0,1]=4 6774 B17R2.17880 CCN(CCn1cncn1)c2ccccc2 34a_100000210013_200000749826 [0,0,1,0,0,1|1,0,1]=4 6775 B17R2.17880 ClC[C@@H](OCc1c[nH]cn1)c2ccccc2 34a_100011933945_100000707719 [0,0,1,0,0,1|2,0,0]=4 6776 B17R2.17880 NCC(OCc1c[nH]cn1)c2ccccc2 34a_100000210709_100000707719 [0,0,1,0,0,1|2,0,0]=4 6777 B17R2.17880 OC[C@@H](NCc1c[nH]cn1)c2ccccc2 2230a_100000751927_100000707719 [0,0,1,0,0,1|2,0,0]=4 6778 B17R2.17880 OC[C@@H](NCc1c[nH]cn1)c2ccccc2 34a_100000751927_100000707719 [0,0,1,0,0,1|2,0,0]=4 6779 B17R2.262 CCc1ccccc1NCc2ccccc2 207a_100000212081_100015611070 [0,0,1,0,0,1|2,0,0]=4 6780 B17R2.262 CCc1ccccc1NCc2ccccc2 2230a_100000212081_100015291786 [0,0,1,0,0,1|2,0,0]=4 6781 B17R2.262 CCc1ccccc1NCc2ccccc2 270302a_100000212081_100015611070 [0,0,1,0,0,1|2,0,0]=4 6782 B17R2.262 CCc1ccccc1NCc2ccccc2 34a_100000212081_100015291786 [0,0,1,0,0,1|2,0,0]=4 6783 B17R2.262 CCc1ccccc1NCc2ccccc2 7a_100000212081_100000211182 [0,0,1,0,0,1|2,0,0]=4 6784 B17R2.262 CCc1ccccc1NCc2ccccn2 207a_100000212081_100000209966 [0,0,1,0,0,1|1,0,0]=3 6785 B17R2.262 CCc1ccccc1NCc2ccccn2 2230a_100000212081_100000721315 [0,0,1,0,0,1|1,0,0]=3 6786 B17R2.262 CCc1ccccc1NCc2ccccn2 270302a_100000212081_100000209966 [0,0,1,0,0,1|1,0,0]=3 6787 B17R2.262 CCc1ccccc1NCc2ccccn2 34a_100000212081_100000721315 [0,0,1,0,0,1|1,0,0]=3 6788 B17R2.262 CCc1ccccc1NCc2ccccn2 7a_100000212081_100000721315 [0,0,1,0,0,1|1,0,0]=3 6789 B17R2.262 CCc1ccccc1NCc2cccnc2 207a_100000212081_100000209961 [0,0,1,0,0,1|1,0,0]=3 6790 B17R2.262 CCc1ccccc1NCc2cccnc2 2230a_100000212081_100000741622 [0,0,1,0,0,1|1,0,0]=3 6791 B17R2.262 CCc1ccccc1NCc2cccnc2 270302a_100000212081_100000209961 [0,0,1,0,0,1|1,0,0]=3 6792 B17R2.262 CCc1ccccc1NCc2cccnc2 34a_100000212081_100000733263 [0,0,1,0,0,1|1,0,0]=3 6793 B17R2.262 CCc1ccccc1NCc2cccnc2 7a_100000212081_100000741622 [0,0,1,0,0,1|1,0,0]=3 6794 B17R2.262 CCc1ccccc1NCc2cccnn2 2230a_100000212081_100016990269 [0,0,1,0,0,1|1,0,0]=3 6795 B17R2.262 CCc1ccccc1NCc2cccnn2 34a_100000212081_100016990269 [0,0,1,0,0,1|1,0,0]=3 6796 B17R2.262 CCc1ccccc1NCc2cccnn2 7a_100000212081_100016990269 [0,0,1,0,0,1|1,0,0]=3 6797 B17R2.262 CCc1ccccc1NCc2ccncc2 207a_100000212081_100000186114 [0,0,1,0,0,1|1,0,1]=4 6798 B17R2.262 CCc1ccccc1NCc2ccncc2 2230a_100000212081_100015193705 [0,0,1,0,0,1|1,0,1]=4 6799 B17R2.262 CCc1ccccc1NCc2ccncc2 7a_100000212081_100015193705 [0,0,1,0,0,1|1,0,1]=4 6800 B17R2.262 CCc1ccccc1NCc2ccnnc2 270302a_100000212081_100011934578 [0,0,1,0,0,1|1,0,1]=4 6801 B17R2.262 CCc1ccccc1NCc2cnccn2 2230a_100000212081_100016995436 [0,0,1,0,0,1|0,0,1]=3 6802 B17R2.262 CCc1ccccc1NCc2cnccn2 34a_100000212081_100016995436 [0,0,1,0,0,1|0,0,1]=3 6803 B17R2.262 CCc1ccccc1NCc2cnccn2 7a_100000212081_100016995436 [0,0,1,0,0,1|0,0,1]=3 6804 B17R2.262 CCc1ccccc1NCc2cncnc2 2230a_100000212081_100015196519 [0,0,1,0,0,1|0,0,1]=3 6805 B17R2.262 CCc1ccccc1NCc2cncnc2 270302a_100000212081_100000749868 [0,0,1,0,0,1|0,0,1]=3 6806 B17R2.262 CCc1ccccc1NCc2cncnc2 34a_100000212081_100015196519 [0,0,1,0,0,1|0,0,1]=3 6807 B17R2.262 CCc1ccccc1NCc2cncnc2 7a_100000212081_100015196519 [0,0,1,0,0,1|0,0,1]=3 6808 B17R2.262 CCc1ccccc1NCc2ncccn2 2230a_100000212081_100000703007 [0,0,1,0,0,1|1,0,0]=3 6809 B17R2.262 CCc1ccccc1NCc2ncccn2 34a_100000212081_100000703007 [0,0,1,0,0,1|1,0,0]=3 6810 B17R2.262 CCc1ccccc1NCc2ncccn2 7a_100000212081_100000703007 [0,0,1,0,0,1|1,0,0]=3 6811 B17R2.262 CCc1ccccc1OCc2ccccn2 34a_100000210936_100000721315 [0,0,1,0,0,1|2,0,0]=4 6812 B17R2.262 CCc1ccccc1OCc2ccccn2 7a_100000210936_100000721315 [0,0,1,0,0,1|2,0,0]=4 6813 B17R2.262 CCc1ccccc1OCc2cccnc2 34a_100000210936_100000733263 [0,0,1,0,0,1|2,0,0]=4 6814 B17R2.262 CCc1ccccc1OCc2cccnc2 7a_100000210936_100000741622 [0,0,1,0,0,1|2,0,0]=4 6815 B17R2.262 CCc1ccccc1OCc2cccnn2 34a_100000210936_100016990269 [0,0,1,0,0,1|2,0,0]=4 6816 B17R2.262 CCc1ccccc1OCc2cccnn2 7a_100000210936_100016990269 [0,0,1,0,0,1|2,0,0]=4 6817 B17R2.262 CCc1ccccc1OCc2cnccn2 34a_100000210936_100016995436 [0,0,1,0,0,1|1,0,1]=4 6818 B17R2.262 CCc1ccccc1OCc2cnccn2 7a_100000210936_100016995436 [0,0,1,0,0,1|1,0,1]=4 6819 B17R2.262 CCc1ccccc1OCc2cncnc2 34a_100000210936_100015196519 [0,0,1,0,0,1|1,0,1]=4 6820 B17R2.262 CCc1ccccc1OCc2cncnc2 7a_100000210936_100015196519 [0,0,1,0,0,1|1,0,1]=4 6821 B17R2.262 CCc1ccccc1OCc2ncccn2 34a_100000210936_100000703007 [0,0,1,0,0,1|2,0,0]=4 6822 B17R2.262 CCc1ccccc1OCc2ncccn2 7a_100000210936_100000703007 [0,0,1,0,0,1|2,0,0]=4 6823 B17R2.262 CCc1ccccc1SCc2ccccn2 62a_100000721315_100011215823 [0,0,1,0,0,1|2,0,0]=4 6824 B17R2.262 CCc1ccccc1SCc2ccccn2 62a_100011215823_100000721315 [0,0,1,0,0,1|2,0,0]=4 6825 B17R2.262 CCc1ccccc1SCc2cccnc2 62a_100000741622_100011215823 [0,0,1,0,0,1|2,0,0]=4 6826 B17R2.262 CCc1ccccc1SCc2cccnc2 62a_100011215823_100000741622 [0,0,1,0,0,1|2,0,0]=4 6827 B17R2.262 CCc1ccccc1SCc2cccnn2 62a_100011215823_100016990269 [0,0,1,0,0,1|2,0,0]=4 6828 B17R2.262 CCc1ccccc1SCc2cccnn2 62a_100016990269_100011215823 [0,0,1,0,0,1|2,0,0]=4 6829 B17R2.262 CCc1ccccc1SCc2cnccn2 62a_100011215823_100016995436 [0,0,1,0,0,1|1,0,1]=4 6830 B17R2.262 CCc1ccccc1SCc2cnccn2 62a_100016995436_100011215823 [0,0,1,0,0,1|1,0,1]=4 6831 B17R2.262 CCc1ccccc1SCc2cncnc2 62a_100011215823_100015196519 [0,0,1,0,0,1|1,0,1]=4 6832 B17R2.262 CCc1ccccc1SCc2cncnc2 62a_100015196519_100011215823 [0,0,1,0,0,1|1,0,1]=4 6833 B17R2.262 CCc1ccccc1SCc2ncccn2 62a_100000703007_100011215823 [0,0,1,0,0,1|2,0,0]=4 6834 B17R2.262 CCc1ccccc1SCc2ncccn2 62a_100011215823_100000703007 [0,0,1,0,0,1|2,0,0]=4 6835 B17R2.262 COc1ccccc1NCc2ccccn2 207a_100000210025_100000209966 [0,0,1,0,0,1|2,0,0]=4 6836 B17R2.262 COc1ccccc1NCc2ccccn2 270302a_100000210025_100000209966 [0,0,1,0,0,1|2,0,0]=4 6837 B17R2.262 COc1ccccc1NCc2ccccn2 34a_100000210025_100000721315 [0,0,1,0,0,1|2,0,0]=4 6838 B17R2.262 COc1ccccc1NCc2cccnc2 207a_100000210025_100000209961 [0,0,1,0,0,1|2,0,0]=4 6839 B17R2.262 COc1ccccc1NCc2cccnc2 270302a_100000210025_100000209961 [0,0,1,0,0,1|2,0,0]=4 6840 B17R2.262 COc1ccccc1NCc2cccnc2 34a_100000210025_100000733263 [0,0,1,0,0,1|2,0,0]=4 6841 B17R2.262 COc1ccccc1NCc2cccnn2 34a_100000210025_100016990269 [0,0,1,0,0,1|2,0,0]=4 6842 B17R2.262 COc1ccccc1NCc2cnccn2 34a_100000210025_100016995436 [0,0,1,0,0,1|1,0,1]=4 6843 B17R2.262 COc1ccccc1NCc2cncnc2 270302a_100000210025_100000749868 [0,0,1,0,0,1|1,0,1]=4 6844 B17R2.262 COc1ccccc1NCc2cncnc2 34a_100000210025_100015196519 [0,0,1,0,0,1|1,0,1]=4 6845 B17R2.262 COc1ccccc1NCc2ncccn2 34a_100000210025_100000703007 [0,0,1,0,0,1|2,0,0]=4 6846 B17R2.262 CSc1ccccc1NCc2ccccn2 207a_100000211160_100000209966 [0,0,1,0,0,1|2,0,0]=4 6847 B17R2.262 CSc1ccccc1NCc2ccccn2 270302a_100000211160_100000209966 [0,0,1,0,0,1|2,0,0]=4 6848 B17R2.262 CSc1ccccc1NCc2ccccn2 34a_100000211160_100000721315 [0,0,1,0,0,1|2,0,0]=4 6849 B17R2.262 CSc1ccccc1NCc2cccnc2 207a_100000211160_100000209961 [0,0,1,0,0,1|2,0,0]=4 6850 B17R2.262 CSc1ccccc1NCc2cccnc2 270302a_100000211160_100000209961 [0,0,1,0,0,1|2,0,0]=4 6851 B17R2.262 CSc1ccccc1NCc2cccnc2 34a_100000211160_100000733263 [0,0,1,0,0,1|2,0,0]=4 6852 B17R2.262 CSc1ccccc1NCc2cccnn2 34a_100000211160_100016990269 [0,0,1,0,0,1|2,0,0]=4 6853 B17R2.262 CSc1ccccc1NCc2cnccn2 34a_100000211160_100016995436 [0,0,1,0,0,1|1,0,1]=4 6854 B17R2.262 CSc1ccccc1NCc2cncnc2 270302a_100000211160_100000749868 [0,0,1,0,0,1|1,0,1]=4 6855 B17R2.262 CSc1ccccc1NCc2cncnc2 34a_100000211160_100015196519 [0,0,1,0,0,1|1,0,1]=4 6856 B17R2.262 CSc1ccccc1NCc2ncccn2 34a_100000211160_100000703007 [0,0,1,0,0,1|2,0,0]=4 6857 B17R2.262 OCc1ccccc1NCc2ccccn2 207a_100000212039_100000209966 [0,0,1,0,0,1|2,0,0]=4 6858 B17R2.262 OCc1ccccc1NCc2ccccn2 270302a_100000212039_100000209966 [0,0,1,0,0,1|2,0,0]=4 6859 B17R2.262 OCc1ccccc1NCc2ccccn2 34a_100000212039_100000721315 [0,0,1,0,0,1|2,0,0]=4 6860 B17R2.262 OCc1ccccc1NCc2cccnc2 207a_100000212039_100000209961 [0,0,1,0,0,1|2,0,0]=4 6861 B17R2.262 OCc1ccccc1NCc2cccnc2 270302a_100000212039_100000209961 [0,0,1,0,0,1|2,0,0]=4 6862 B17R2.262 OCc1ccccc1NCc2cccnc2 34a_100000212039_100000733263 [0,0,1,0,0,1|2,0,0]=4 6863 B17R2.262 OCc1ccccc1NCc2cccnn2 34a_100000212039_100016990269 [0,0,1,0,0,1|2,0,0]=4 6864 B17R2.262 OCc1ccccc1NCc2cnccn2 34a_100000212039_100016995436 [0,0,1,0,0,1|1,0,1]=4 6865 B17R2.262 OCc1ccccc1NCc2cncnc2 270302a_100000212039_100000749868 [0,0,1,0,0,1|1,0,1]=4 6866 B17R2.262 OCc1ccccc1NCc2cncnc2 34a_100000212039_100015196519 [0,0,1,0,0,1|1,0,1]=4 6867 B17R2.262 OCc1ccccc1NCc2ncccn2 34a_100000212039_100000703007 [0,0,1,0,0,1|2,0,0]=4 6868 B17R2.2739 BrCc1ccccc1COCc2c[nH]cn2 34a_100009816955_100000707719 [0,0,1,0,0,1|2,0,0]=4 6869 B17R2.2739 C#Cc1ccccc1CNCc2c[nH]cn2 34a_100020634229_100000707719 [0,0,1,0,0,1|0,0,2]=4 6870 B17R2.2739 CCc1ccccc1CNCc2c[nH]cn2 207a_100000758547_100011219594 [0,0,1,0,0,1|0,0,0]=2 6871 B17R2.2739 CCc1ccccc1CNCc2c[nH]nn2 207a_100020620823_100011219594 [0,0,1,0,0,1|1,0,0]=3 6872 B17R2.2739 CCc1ccccc1CNCc2c[nH]nn2 270004a_100020620823_100011219594 [0,0,1,0,0,1|1,0,0]=3 6873 B17R2.2739 CCc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100011219594 [0,0,1,0,0,1|2,0,0]=4 6874 B17R2.2739 CCc1ccccc1CNCc2ccco2 207a_100000185738_100011219594 [0,0,1,0,0,1|2,0,0]=4 6875 B17R2.2739 CCc1ccccc1CNCc2ccco2 270004a_100000185738_100011219594 [0,0,1,0,0,1|2,0,0]=4 6876 B17R2.2739 CCc1ccccc1CNCc2cccs2 207a_100000211653_100011219594 [0,0,1,0,0,1|2,0,0]=4 6877 B17R2.2739 CCc1ccccc1CNCc2cccs2 270004a_100000211653_100011219594 [0,0,1,0,0,1|2,0,0]=4 6878 B17R2.2739 CCc1ccccc1CNCc2ccoc2 207a_100015206860_100011219594 [0,0,1,0,0,1|2,0,0]=4 6879 B17R2.2739 CCc1ccccc1CNCc2ccoc2 270004a_100015206860_100011219594 [0,0,1,0,0,1|2,0,0]=4 6880 B17R2.2739 CCc1ccccc1CNCc2ccon2 207a_100000688301_100011219594 [0,0,1,0,0,1|2,0,0]=4 6881 B17R2.2739 CCc1ccccc1CNCc2ccon2 270004a_100000688301_100011219594 [0,0,1,0,0,1|2,0,0]=4 6882 B17R2.2739 CCc1ccccc1CNCc2ccsc2 207a_100000186416_100011219594 [0,0,1,0,0,1|2,0,0]=4 6883 B17R2.2739 CCc1ccccc1CNCc2ccsc2 270004a_100000186416_100011219594 [0,0,1,0,0,1|2,0,0]=4 6884 B17R2.2739 CCc1ccccc1CNCc2cn[nH]c2 207a_100000737208_100011219594 [0,0,1,0,0,1|2,0,0]=4 6885 B17R2.2739 CCc1ccccc1CNCc2cn[nH]c2 270004a_100000737208_100011219594 [0,0,1,0,0,1|2,0,0]=4 6886 B17R2.2739 CCc1ccccc1CNCc2cnco2 207a_100020634212_100011219594 [0,0,1,0,0,1|1,0,1]=4 6887 B17R2.2739 CCc1ccccc1CNCc2cnco2 270004a_100020634212_100011219594 [0,0,1,0,0,1|1,0,1]=4 6888 B17R2.2739 CCc1ccccc1CNCc2cncs2 207a_100016987365_100011219594 [0,0,1,0,0,1|1,0,1]=4 6889 B17R2.2739 CCc1ccccc1CNCc2cncs2 270004a_100016987365_100011219594 [0,0,1,0,0,1|1,0,1]=4 6890 B17R2.2739 CCc1ccccc1CNCc2cocn2 207a_100015188801_100011219594 [0,0,1,0,0,1|1,0,0]=3 6891 B17R2.2739 CCc1ccccc1CNCc2cocn2 270004a_100015188801_100011219594 [0,0,1,0,0,1|1,0,0]=3 6892 B17R2.2739 CCc1ccccc1CNCc2cscn2 207a_100015185402_100011219594 [0,0,1,0,0,1|1,0,0]=3 6893 B17R2.2739 CCc1ccccc1CNCc2ncc[nH]2 207a_100000754540_100011219594 [0,0,1,0,0,1|2,0,0]=4 6894 B17R2.2739 CCc1ccccc1CNCc2ncc[nH]2 270004a_100000754540_100011219594 [0,0,1,0,0,1|2,0,0]=4 6895 B17R2.2739 CCc1ccccc1CNCc2ncco2 207a_100016994969_100011219594 [0,0,1,0,0,1|2,0,0]=4 6896 B17R2.2739 CCc1ccccc1CNCc2nccs2 207a_100000740555_100011219594 [0,0,1,0,0,1|2,0,0]=4 6897 B17R2.2739 CCc1ccccc1CNCc2nccs2 270004a_100000740555_100011219594 [0,0,1,0,0,1|2,0,0]=4 6898 B17R2.2739 CCc1ccccc1COCc2c[nH]cn2 34a_100011663872_100000707719 [0,0,1,0,0,1|1,0,0]=3 6899 B17R2.2739 CCc1ccccc1COCc2cscn2 34a_100011663872_100000205941 [0,0,1,0,0,1|2,0,0]=4 6900 B17R2.2739 CCc1ccccc1COCc2cscn2 7a_100011663872_100000205941 [0,0,1,0,0,1|2,0,0]=4 6901 B17R2.2739 CCc1ccccc1NCCc2c[nH]cn2 2230a_100000212081_100020628418 [0,0,1,0,0,1|0,0,0]=2 6902 B17R2.2739 CCc1ccccc1NCCc2c[nH]cn2 7a_100000212081_100020628418 [0,0,1,0,0,1|0,0,0]=2 6903 B17R2.2739 CCc1ccccc1NCCc2cccs2 2230a_100000212081_100000748579 [0,0,1,0,0,1|2,0,0]=4 6904 B17R2.2739 CCc1ccccc1NCCc2cccs2 34a_100000212081_100000748579 [0,0,1,0,0,1|2,0,0]=4 6905 B17R2.2739 CCc1ccccc1NCCc2cccs2 7a_100000212081_100000748579 [0,0,1,0,0,1|2,0,0]=4 6906 B17R2.2739 CCc1ccccc1NCCc2cn[nH]c2 2230a_100000212081_100000743252 [0,0,1,0,0,1|2,0,0]=4 6907 B17R2.2739 CCc1ccccc1NCCc2cn[nH]c2 7a_100000212081_100000743252 [0,0,1,0,0,1|2,0,0]=4 6908 B17R2.2739 CCc1ccccc1NCCn2cccn2 2230a_100000212081_100000685285 [0,0,1,0,0,1|2,0,0]=4 6909 B17R2.2739 CCc1ccccc1NCCn2cccn2 34a_100000212081_100015204718 [0,0,1,0,0,1|2,0,0]=4 6910 B17R2.2739 CCc1ccccc1NCCn2cccn2 7a_100000212081_100000685285 [0,0,1,0,0,1|2,0,0]=4 6911 B17R2.2739 CCc1ccccc1NCCn2cncn2 2230a_100000212081_100000731791 [0,0,1,0,0,1|1,0,1]=4 6912 B17R2.2739 CCc1ccccc1NCCn2cncn2 34a_100000212081_200000749826 [0,0,1,0,0,1|1,0,1]=4 6913 B17R2.2739 CCc1ccccc1NCCn2cncn2 7a_100000212081_100000731791 [0,0,1,0,0,1|1,0,1]=4 6914 B17R2.2739 CCc1ccccc1NN=Cc2cc[nH]c2 4a_100000737054_100000760201 [0,0,1,0,0,1|1,0,1]=4 6915 B17R2.2739 CCc1ccccc1NN=Cc2cocn2 4a_100000737054_100000050382 [0,0,1,0,0,1|1,0,1]=4 6916 B17R2.2739 CCc1ccccc1NN=Cc2cscn2 4a_100000737054_100000743575 [0,0,1,0,0,1|1,0,1]=4 6917 B17R2.2739 CCc1ccccc1OCCc2c[nH]cn2 7a_100000210936_100020628418 [0,0,1,0,0,1|1,0,0]=3 6918 B17R2.2739 CCc1ccccc1SCCc2c[nH]cn2 62a_100011215823_100020628418 [0,0,1,0,0,1|1,0,0]=3 6919 B17R2.2739 CCc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100011215823 [0,0,1,0,0,1|1,0,0]=3 6920 B17R2.2739 CCc1ccncc1SCCc2c[nH]cn2 62a_100009819861_100020628418 [0,0,1,0,0,1|2,0,0]=4 6921 B17R2.2739 CCc1ccncc1SCCc2c[nH]cn2 62a_100020628418_100009819861 [0,0,1,0,0,1|2,0,0]=4 6922 B17R2.2739 CCc1cnccc1SCCc2c[nH]cn2 62a_100020628418_100025704421 [0,0,1,0,0,1|2,0,0]=4 6923 B17R2.2739 CCc1cnccc1SCCc2c[nH]cn2 62a_100025704421_100020628418 [0,0,1,0,0,1|2,0,0]=4 6924 B17R2.2739 CCc1cncnc1NCCc2c[nH]cn2 27a_100000755092_200000100055 [0,0,1,0,0,1|2,0,0]=4 6925 B17R2.2739 CCc1ncccc1SCCc2c[nH]cn2 62a_100009877225_100020628418 [0,0,1,0,0,1|2,0,0]=4 6926 B17R2.2739 CCc1ncccc1SCCc2c[nH]cn2 62a_100020628418_100009877225 [0,0,1,0,0,1|2,0,0]=4 6927 B17R2.2739 CCc1nccnc1NCCc2c[nH]cn2 27a_100000755092_100011995844 [0,0,1,0,0,1|2,0,0]=4 6928 B17R2.2739 CCc1ncncc1NCCc2c[nH]cn2 27a_100000755092_100009816992 [0,0,1,0,0,1|2,0,0]=4 6929 B17R2.2739 CNc1ccccc1SCCc2c[nH]cn2 62a_100020606079_100020628418 [0,0,1,0,0,1|2,0,0]=4 6930 B17R2.2739 CNc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100020606079 [0,0,1,0,0,1|2,0,0]=4 6931 B17R2.2739 COc1ccccc1CCSc2c[nH]cn2 62a_100000756875_100011713687 [0,0,1,0,0,1|2,0,0]=4 6932 B17R2.2739 COc1ccccc1CCSc2c[nH]cn2 62a_100011713687_100000756875 [0,0,1,0,0,1|2,0,0]=4 6933 B17R2.2739 COc1ccccc1CNCc2c[nH]cn2 207a_100000758547_100000169842 [0,0,1,0,0,1|1,0,0]=3 6934 B17R2.2739 COc1ccccc1CNCc2c[nH]cn2 34a_100000188900_100000707719 [0,0,1,0,0,1|1,0,0]=3 6935 B17R2.2739 COc1ccccc1CNCc2c[nH]nn2 207a_100020620823_100000169842 [0,0,1,0,0,1|2,0,0]=4 6936 B17R2.2739 COc1ccccc1CNCc2c[nH]nn2 270004a_100020620823_100000169842 [0,0,1,0,0,1|2,0,0]=4 6937 B17R2.2739 COc1ccccc1CNCc2cocn2 207a_100015188801_100000169842 [0,0,1,0,0,1|2,0,0]=4 6938 B17R2.2739 COc1ccccc1CNCc2cocn2 270004a_100000188900_100000050382 [0,0,1,0,0,1|2,0,0]=4 6939 B17R2.2739 COc1ccccc1CNCc2cocn2 270004a_100015188801_100000169842 [0,0,1,0,0,1|2,0,0]=4 6940 B17R2.2739 COc1ccccc1CNCc2cscn2 207a_100000188900_100000743575 [0,0,1,0,0,1|2,0,0]=4 6941 B17R2.2739 COc1ccccc1CNCc2cscn2 207a_100015185402_100000169842 [0,0,1,0,0,1|2,0,0]=4 6942 B17R2.2739 COc1ccccc1CNCc2cscn2 2230a_100015185402_100000210004 [0,0,1,0,0,1|2,0,0]=4 6943 B17R2.2739 COc1ccccc1CNCc2cscn2 270004a_100000188900_100000743575 [0,0,1,0,0,1|2,0,0]=4 6944 B17R2.2739 COc1ccccc1CNCc2cscn2 34a_100000188900_100000205941 [0,0,1,0,0,1|2,0,0]=4 6945 B17R2.2739 COc1ccccc1COCc2c[nH]cn2 34a_100000211301_100000707719 [0,0,1,0,0,1|2,0,0]=4 6946 B17R2.2739 COc1ccccc1CSCc2c[nH]cn2 62a_100000210004_100000707719 [0,0,1,0,0,1|2,0,0]=4 6947 B17R2.2739 COc1ccccc1CSCc2c[nH]cn2 62a_100000707719_100000210004 [0,0,1,0,0,1|2,0,0]=4 6948 B17R2.2739 COc1ccccc1SCCc2c[nH]cn2 62a_100000210334_100020628418 [0,0,1,0,0,1|2,0,0]=4 6949 B17R2.2739 COc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000210334 [0,0,1,0,0,1|2,0,0]=4 6950 B17R2.2739 COc1cccnc1CNCc2c[nH]cn2 207a_100000758547_100011912573 [0,0,1,0,0,1|2,0,0]=4 6951 B17R2.2739 COc1ccncc1CNCc2c[nH]cn2 207a_100000758547_200011997045 [0,0,1,0,0,1|2,0,0]=4 6952 B17R2.2739 COc1cnccc1CNCc2c[nH]cn2 207a_100000758547_100011361505 [0,0,1,0,0,1|2,0,0]=4 6953 B17R2.2739 COc1ncccc1CNCc2c[nH]cn2 207a_100000758547_100011290804 [0,0,1,0,0,1|2,0,0]=4 6954 B17R2.2739 CSc1ccccc1CNCc2c[nH]cn2 207a_100000758547_100011217347 [0,0,1,0,0,1|1,0,0]=3 6955 B17R2.2739 CSc1ccccc1CNCc2c[nH]cn2 34a_102495365025_100000707719 [0,0,1,0,0,1|1,0,0]=3 6956 B17R2.2739 CSc1ccccc1CNCc2c[nH]nn2 207a_100020620823_100011217347 [0,0,1,0,0,1|2,0,0]=4 6957 B17R2.2739 CSc1ccccc1CNCc2c[nH]nn2 270004a_100020620823_100011217347 [0,0,1,0,0,1|2,0,0]=4 6958 B17R2.2739 CSc1ccccc1CNCc2cocn2 207a_100015188801_100011217347 [0,0,1,0,0,1|2,0,0]=4 6959 B17R2.2739 CSc1ccccc1CNCc2cocn2 270004a_100015188801_100011217347 [0,0,1,0,0,1|2,0,0]=4 6960 B17R2.2739 CSc1ccccc1CNCc2cocn2 270004a_102495365025_100000050382 [0,0,1,0,0,1|2,0,0]=4 6961 B17R2.2739 CSc1ccccc1CNCc2cscn2 207a_100015185402_100011217347 [0,0,1,0,0,1|2,0,0]=4 6962 B17R2.2739 CSc1ccccc1CNCc2cscn2 207a_102495365025_100000743575 [0,0,1,0,0,1|2,0,0]=4 6963 B17R2.2739 CSc1ccccc1CNCc2cscn2 2230a_100015185402_100000699184 [0,0,1,0,0,1|2,0,0]=4 6964 B17R2.2739 CSc1ccccc1CNCc2cscn2 270004a_102495365025_100000743575 [0,0,1,0,0,1|2,0,0]=4 6965 B17R2.2739 CSc1ccccc1CNCc2cscn2 34a_102495365025_100000205941 [0,0,1,0,0,1|2,0,0]=4 6966 B17R2.2739 CSc1ccccc1COCc2c[nH]cn2 34a_100000699167_100000707719 [0,0,1,0,0,1|2,0,0]=4 6967 B17R2.2739 CSc1ccccc1CSCc2c[nH]cn2 62a_100000699184_100000707719 [0,0,1,0,0,1|2,0,0]=4 6968 B17R2.2739 CSc1ccccc1CSCc2c[nH]cn2 62a_100000707719_100000699184 [0,0,1,0,0,1|2,0,0]=4 6969 B17R2.2739 CSc1ccccc1SCCc2c[nH]cn2 62a_100011217816_100020628418 [0,0,1,0,0,1|2,0,0]=4 6970 B17R2.2739 CSc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100011217816 [0,0,1,0,0,1|2,0,0]=4 6971 B17R2.2739 N#Cc1ccccc1CNCc2c[nH]cn2 34a_100016989011_100000707719 [0,0,1,0,0,1|1,0,1]=4 6972 B17R2.2739 NCc1ccccc1COCc2c[nH]cn2 34a_100000743596_100000707719 [0,0,1,0,0,1|2,0,0]=4 6973 B17R2.2739 NCc1ccccc1SCCc2c[nH]cn2 62a_100000689332_100020628418 [0,0,1,0,0,1|2,0,0]=4 6974 B17R2.2739 NCc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000689332 [0,0,1,0,0,1|2,0,0]=4 6975 B17R2.2739 OCc1ccccc1CNCc2cocn2 270004a_100000743596_100000050382 [0,0,1,0,0,1|2,0,0]=4 6976 B17R2.2739 OCc1ccccc1CNCc2cscn2 207a_100000743596_100000743575 [0,0,1,0,0,1|2,0,0]=4 6977 B17R2.2739 OCc1ccccc1CNCc2cscn2 2230a_100015185402_100009816955 [0,0,1,0,0,1|2,0,0]=4 6978 B17R2.2739 OCc1ccccc1CNCc2cscn2 270004a_100000743596_100000743575 [0,0,1,0,0,1|2,0,0]=4 6979 B17R2.2739 OCc1ccccc1CSCc2c[nH]cn2 62a_100000707719_100009816955 [0,0,1,0,0,1|2,0,0]=4 6980 B17R2.2739 OCc1ccccc1CSCc2c[nH]cn2 62a_100009816955_100000707719 [0,0,1,0,0,1|2,0,0]=4 6981 B17R2.2739 OCc1ccccc1SCCc2c[nH]cn2 62a_100000187465_100020628418 [0,0,1,0,0,1|2,0,0]=4 6982 B17R2.2739 OCc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000187465 [0,0,1,0,0,1|2,0,0]=4 6983 B17R2.2739 OCc1cnccc1NCCc2c[nH]cn2 27a_100000755092_100000117392 [0,0,1,0,0,1|2,0,0]=4 6984 B17R2.2382 c1cc(ccn1)CCNCc2cnccn2 270004a_100000742849_100000749867 [0,0,1,0,0,1|1,0,1]=4 6985 B17R2.2382 c1cc(ccn1)CCNCc2cncnc2 2230a_100011243677_100000723409 [0,0,1,0,0,1|1,0,1]=4 6986 B17R2.2382 c1cc(ccn1)CCNCc2cncnc2 270004a_100000742849_100000749868 [0,0,1,0,0,1|1,0,1]=4 6987 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 207a_100000106460_100015611070 [0,0,1,0,0,1|2,0,0]=4 6988 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 2230a_100000106460_100015291786 [0,0,1,0,0,1|2,0,0]=4 6989 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 2230a_100015324214_100000765856 [0,0,1,0,0,1|2,0,0]=4 6990 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 270004a_100000106460_100015611070 [0,0,1,0,0,1|2,0,0]=4 6991 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 34a_100000106460_100015291786 [0,0,1,0,0,1|2,0,0]=4 6992 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 34a_100015324214_100000765856 [0,0,1,0,0,1|2,0,0]=4 6993 B17R2.2382 c1ccc(cc1)CCNCc2ccccn2 207a_100000106460_100000209966 [0,0,1,0,0,1|1,0,0]=3 6994 B17R2.2382 c1ccc(cc1)CCNCc2ccccn2 2230a_100000106460_100000721315 [0,0,1,0,0,1|1,0,0]=3 6995 B17R2.2382 c1ccc(cc1)CCNCc2ccccn2 270004a_100000106460_100000209966 [0,0,1,0,0,1|1,0,0]=3 6996 B17R2.2382 c1ccc(cc1)CCNCc2ccccn2 34a_100000106460_100000721315 [0,0,1,0,0,1|1,0,0]=3 6997 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 207a_100000106460_100000209961 [0,0,1,0,0,1|1,0,0]=3 6998 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 2230a_100000106460_100000741622 [0,0,1,0,0,1|1,0,0]=3 6999 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 270004a_100000106460_100000209961 [0,0,1,0,0,1|1,0,0]=3 7000 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 34a_100000106460_100000733263 [0,0,1,0,0,1|1,0,0]=3 7001 B17R2.2382 c1ccc(cc1)CCNCc2cccnn2 2230a_100000106460_100016990269 [0,0,1,0,0,1|1,0,0]=3 7002 B17R2.2382 c1ccc(cc1)CCNCc2cccnn2 2230a_100159270163_100000765856 [0,0,1,0,0,1|1,0,0]=3 7003 B17R2.2382 c1ccc(cc1)CCNCc2cccnn2 34a_100000106460_100016990269 [0,0,1,0,0,1|1,0,0]=3 7004 B17R2.2382 c1ccc(cc1)CCNCc2ccncc2 207a_100000106460_100000186114 [0,0,1,0,0,1|1,0,1]=4 7005 B17R2.2382 c1ccc(cc1)CCNCc2ccncc2 2230a_100000106460_100015193705 [0,0,1,0,0,1|1,0,1]=4 7006 B17R2.2382 c1ccc(cc1)CCNCc2ccnnc2 270004a_100000106460_100011934578 [0,0,1,0,0,1|1,0,1]=4 7007 B17R2.2382 c1ccc(cc1)CCNCc2cnccn2 2230a_100000106460_100016995436 [0,0,1,0,0,1|0,0,1]=3 7008 B17R2.2382 c1ccc(cc1)CCNCc2cnccn2 270004a_100000106460_100000749867 [0,0,1,0,0,1|0,0,1]=3 7009 B17R2.2382 c1ccc(cc1)CCNCc2cnccn2 34a_100000106460_100016995436 [0,0,1,0,0,1|0,0,1]=3 7010 B17R2.2382 c1ccc(cc1)CCNCc2cncnc2 2230a_100000106460_100015196519 [0,0,1,0,0,1|0,0,1]=3 7011 B17R2.2382 c1ccc(cc1)CCNCc2cncnc2 2230a_100011243677_100000765856 [0,0,1,0,0,1|0,0,1]=3 7012 B17R2.2382 c1ccc(cc1)CCNCc2cncnc2 270004a_100000106460_100000749868 [0,0,1,0,0,1|0,0,1]=3 7013 B17R2.2382 c1ccc(cc1)CCNCc2cncnc2 34a_100000106460_100015196519 [0,0,1,0,0,1|0,0,1]=3 7014 B17R2.2382 c1ccc(cc1)CCNCc2ncccn2 2230a_100000106460_100000703007 [0,0,1,0,0,1|1,0,0]=3 7015 B17R2.2382 c1ccc(cc1)CCNCc2ncccn2 270004a_100000106460_100011532527 [0,0,1,0,0,1|1,0,0]=3 7016 B17R2.2382 c1ccc(cc1)CCNCc2ncccn2 34a_100000106460_100000703007 [0,0,1,0,0,1|1,0,0]=3 7017 B17R2.2382 c1ccc(cc1)CCOCc2ccccn2 34a_100000210268_100000721315 [0,0,1,0,0,1|2,0,0]=4 7018 B17R2.2382 c1ccc(cc1)CCOCc2ccccn2 7a_100000210268_100000721315 [0,0,1,0,0,1|2,0,0]=4 7019 B17R2.2382 c1ccc(cc1)CCOCc2cccnc2 34a_100000210268_100000733263 [0,0,1,0,0,1|2,0,0]=4 7020 B17R2.2382 c1ccc(cc1)CCOCc2cccnc2 7a_100000210268_100000741622 [0,0,1,0,0,1|2,0,0]=4 7021 B17R2.2382 c1ccc(cc1)CCOCc2cccnn2 34a_100000210268_100016990269 [0,0,1,0,0,1|2,0,0]=4 7022 B17R2.2382 c1ccc(cc1)CCOCc2cccnn2 7a_100000210268_100016990269 [0,0,1,0,0,1|2,0,0]=4 7023 B17R2.2382 c1ccc(cc1)CCOCc2cnccn2 34a_100000210268_100016995436 [0,0,1,0,0,1|1,0,1]=4 7024 B17R2.2382 c1ccc(cc1)CCOCc2cnccn2 7a_100000210268_100016995436 [0,0,1,0,0,1|1,0,1]=4 7025 B17R2.2382 c1ccc(cc1)CCOCc2cncnc2 34a_100000210268_100015196519 [0,0,1,0,0,1|1,0,1]=4 7026 B17R2.2382 c1ccc(cc1)CCOCc2cncnc2 7a_100000210268_100015196519 [0,0,1,0,0,1|1,0,1]=4 7027 B17R2.2382 c1ccc(cc1)CCOCc2ncccn2 34a_100000210268_100000703007 [0,0,1,0,0,1|2,0,0]=4 7028 B17R2.2382 c1ccc(cc1)CCOCc2ncccn2 7a_100000210268_100000703007 [0,0,1,0,0,1|2,0,0]=4 7029 B17R2.2382 c1ccc(cc1)CCSCc2ccccn2 62a_100000721315_100011218657 [0,0,1,0,0,1|2,0,0]=4 7030 B17R2.2382 c1ccc(cc1)CCSCc2ccccn2 62a_100000765856_100000721315 [0,0,1,0,0,1|2,0,0]=4 7031 B17R2.2382 c1ccc(cc1)CCSCc2cccnc2 62a_100000741622_100011218657 [0,0,1,0,0,1|2,0,0]=4 7032 B17R2.2382 c1ccc(cc1)CCSCc2cccnc2 62a_100000765856_100000741622 [0,0,1,0,0,1|2,0,0]=4 7033 B17R2.2382 c1ccc(cc1)CCSCc2cccnn2 62a_100000765856_100016990269 [0,0,1,0,0,1|2,0,0]=4 7034 B17R2.2382 c1ccc(cc1)CCSCc2cccnn2 62a_100016990269_100011218657 [0,0,1,0,0,1|2,0,0]=4 7035 B17R2.2382 c1ccc(cc1)CCSCc2cnccn2 62a_100000765856_100016995436 [0,0,1,0,0,1|1,0,1]=4 7036 B17R2.2382 c1ccc(cc1)CCSCc2cnccn2 62a_100016995436_100011218657 [0,0,1,0,0,1|1,0,1]=4 7037 B17R2.2382 c1ccc(cc1)CCSCc2cncnc2 62a_100000765856_100015196519 [0,0,1,0,0,1|1,0,1]=4 7038 B17R2.2382 c1ccc(cc1)CCSCc2cncnc2 62a_100015196519_100011218657 [0,0,1,0,0,1|1,0,1]=4 7039 B17R2.2382 c1ccc(cc1)CCSCc2ncccn2 62a_100000703007_100011218657 [0,0,1,0,0,1|2,0,0]=4 7040 B17R2.2382 c1ccc(cc1)CCSCc2ncccn2 62a_100000765856_100000703007 [0,0,1,0,0,1|2,0,0]=4 7041 B17R2.2382 c1ccc(cc1)SCNCc2cccnn2 2230a_100159270163_100011218342 [0,0,1,0,0,1|2,0,0]=4 7042 B17R2.2382 c1ccc(cc1)SCNCc2cncnc2 2230a_100011243677_100011218342 [0,0,1,0,0,1|1,0,1]=4 7043 B17R2.2382 c1ccc(nc1)CCNCc2ccccn2 207a_100000211156_100000209966 [0,0,1,0,0,1|2,0,0]=4 7044 B17R2.2382 c1ccc(nc1)CCNCc2ccccn2 270004a_100000211156_100000209966 [0,0,1,0,0,1|2,0,0]=4 7045 B17R2.2382 c1ccc(nc1)CCNCc2cccnc2 207a_100000211156_100000209961 [0,0,1,0,0,1|2,0,0]=4 7046 B17R2.2382 c1ccc(nc1)CCNCc2cccnc2 270004a_100000211156_100000209961 [0,0,1,0,0,1|2,0,0]=4 7047 B17R2.2382 c1ccc(nc1)CCNCc2cccnn2 2230a_100159270163_100015183660 [0,0,1,0,0,1|2,0,0]=4 7048 B17R2.2382 c1ccc(nc1)CCNCc2cnccn2 270004a_100000211156_100000749867 [0,0,1,0,0,1|1,0,1]=4 7049 B17R2.2382 c1ccc(nc1)CCNCc2cncnc2 2230a_100011243677_100015183660 [0,0,1,0,0,1|1,0,1]=4 7050 B17R2.2382 c1ccc(nc1)CCNCc2cncnc2 270004a_100000211156_100000749868 [0,0,1,0,0,1|1,0,1]=4 7051 B17R2.2382 c1ccc(nc1)CCNCc2ncccn2 270004a_100000211156_100011532527 [0,0,1,0,0,1|2,0,0]=4 7052 B17R2.2382 c1ccc(nc1)CNCCc2cccnc2 207a_100000736294_100000209966 [0,0,1,0,0,1|2,0,0]=4 7053 B17R2.2382 c1ccc(nc1)CNCCc2cccnc2 2230a_100000736294_100000721315 [0,0,1,0,0,1|2,0,0]=4 7054 B17R2.2382 c1ccc(nc1)CNCCc2cccnc2 270004a_100000736294_100000209966 [0,0,1,0,0,1|2,0,0]=4 7055 B17R2.2382 c1ccc(nc1)CNCCc2ccncc2 207a_100000742849_100000209966 [0,0,1,0,0,1|2,0,0]=4 7056 B17R2.2382 c1ccc(nc1)CNCCc2ccncc2 270004a_100000742849_100000209966 [0,0,1,0,0,1|2,0,0]=4 7057 B17R2.2382 c1cnc(nc1)CNCCc2cccnc2 2230a_100000736294_100000703007 [0,0,1,0,0,1|2,0,0]=4 7058 B17R2.2382 c1cnc(nc1)CNCCc2cccnc2 270004a_100000736294_100011532527 [0,0,1,0,0,1|2,0,0]=4 7059 B17R2.2382 c1cnc(nc1)CNCCc2ccncc2 270004a_100000742849_100011532527 [0,0,1,0,0,1|2,0,0]=4 7060 B17R2.2382 c1cncc(c1)CCNCc2cccnc2 207a_100000736294_100000209961 [0,0,1,0,0,1|2,0,0]=4 7061 B17R2.2382 c1cncc(c1)CCNCc2cccnc2 2230a_100000736294_100000741622 [0,0,1,0,0,1|2,0,0]=4 7062 B17R2.2382 c1cncc(c1)CCNCc2cccnc2 270004a_100000736294_100000209961 [0,0,1,0,0,1|2,0,0]=4 7063 B17R2.2382 c1cncc(c1)CCNCc2cccnn2 2230a_100000736294_100016990269 [0,0,1,0,0,1|2,0,0]=4 7064 B17R2.2382 c1cncc(c1)CCNCc2cccnn2 2230a_100159270163_200011713674 [0,0,1,0,0,1|2,0,0]=4 7065 B17R2.2382 c1cncc(c1)CCNCc2cnccn2 2230a_100000736294_100016995436 [0,0,1,0,0,1|1,0,1]=4 7066 B17R2.2382 c1cncc(c1)CCNCc2cnccn2 270004a_100000736294_100000749867 [0,0,1,0,0,1|1,0,1]=4 7067 B17R2.2382 c1cncc(c1)CCNCc2cncnc2 2230a_100000736294_100015196519 [0,0,1,0,0,1|1,0,1]=4 7068 B17R2.2382 c1cncc(c1)CCNCc2cncnc2 2230a_100011243677_200011713674 [0,0,1,0,0,1|1,0,1]=4 7069 B17R2.2382 c1cncc(c1)CCNCc2cncnc2 270004a_100000736294_100000749868 [0,0,1,0,0,1|1,0,1]=4 7070 B17R2.2382 c1cncc(c1)CNCCc2ccncc2 207a_100000742849_100000209961 [0,0,1,0,0,1|2,0,0]=4 7071 B17R2.2382 c1cncc(c1)CNCCc2ccncc2 270004a_100000742849_100000209961 [0,0,1,0,0,1|2,0,0]=4 7072 B17R2.2382 c1cnnc(c1)CNCCc2ccncc2 2230a_100159270163_100000723409 [0,0,1,0,0,1|2,0,0]=4 7073 B17R2.2383 C(#Cc1ccccc1)CNCc2c[nH]cn2 34a_100000735379_100000707719 [0,0,1,0,0,1|0,0,1]=3 7074 B17R2.2383 C(#Cc1ccccc1)CNCc2cscn2 2230a_100015185402_100011352542 [0,0,1,0,0,1|1,0,1]=4 7075 B17R2.2383 C(#Cc1ccccc1)CNCc2cscn2 34a_100000735379_100000205941 [0,0,1,0,0,1|1,0,1]=4 7076 B17R2.2383 C(#Cc1ccccc1)COCc2c[nH]cn2 34a_100011217464_100000707719 [0,0,1,0,0,1|1,0,1]=4 7077 B17R2.2383 C(#Cc1ccccc1)CSCc2c[nH]cn2 62a_100000707719_100011352542 [0,0,1,0,0,1|1,0,1]=4 7078 B17R2.2383 C(=C/c1ccccc1)\CNCc2c[nH]cn2 2230a_100020603302_100000707719 [0,0,1,0,0,1|0,0,1]=3 7079 B17R2.2383 C(=C/c1ccccc1)\CNCc2c[nH]cn2 34a_100020603302_100000707719 [0,0,1,0,0,1|0,0,1]=3 7080 B17R2.2383 C(=C/c1ccccc1)\CNCc2cocn2 270004a_100020603302_100000050382 [0,0,1,0,0,1|1,0,1]=4 7081 B17R2.2383 C(=C/c1ccccc1)\CNCc2cscn2 2230a_100015185402_100016265936 [0,0,1,0,0,1|1,0,1]=4 7082 B17R2.2383 C(=C/c1ccccc1)\CNCc2cscn2 2230a_100020603302_100000205941 [0,0,1,0,0,1|1,0,1]=4 7083 B17R2.2383 C(=C/c1ccccc1)\CNCc2cscn2 270004a_100020603302_100000743575 [0,0,1,0,0,1|1,0,1]=4 7084 B17R2.2383 C(=C/c1ccccc1)\CNCc2cscn2 34a_100020603302_100000205941 [0,0,1,0,0,1|1,0,1]=4 7085 B17R2.2383 C(=C/c1ccccc1)\COCc2c[nH]cn2 34a_100000210256_100000707719 [0,0,1,0,0,1|1,0,1]=4 7086 B17R2.2383 C(=C/c1ccccc1)\CSCc2c[nH]cn2 62a_100000707719_100016265936 [0,0,1,0,0,1|1,0,1]=4 7087 B17R2.2383 C(=C/c1ccccc1)\CSCc2c[nH]cn2 62a_100016265936_100000707719 [0,0,1,0,0,1|1,0,1]=4 7088 B17R2.2383 C(=Cc1c[nH]cn1)COCc2ccccc2 271570a_200011106559_100000756875 [0,0,1,0,0,1|1,0,1]=4 7089 B17R2.2383 C(=Cc1ccccc1)CNCc2c[nH]nn2 270004a_100020620823_100000210105 [0,0,1,0,0,1|1,0,1]=4 7090 B17R2.2383 C(=Cc1ccccc1)CNCc2cocn2 270004a_100015188801_100000210105 [0,0,1,0,0,1|1,0,1]=4 7091 B17R2.2383 C(=NNCCc1ccccc1)c2cc[nH]c2 4a_100000740470_100000760201 [0,0,1,0,0,1|1,0,1]=4 7092 B17R2.2383 C(=NNCCc1ccccc1)c2cocn2 4a_100000740470_100000050382 [0,0,1,0,0,1|1,0,1]=4 7093 B17R2.2383 C(=NNCCc1ccccc1)c2cscn2 4a_100000740470_100000743575 [0,0,1,0,0,1|1,0,1]=4 7094 B17R2.2383 c1cc(ccn1)CCCCSc2c[nH]cn2 62a_100000756875_100020630000 [0,0,1,0,0,1|2,0,0]=4 7095 B17R2.2383 c1cc(ccn1)CCCCSc2c[nH]cn2 62a_100020630000_100000756875 [0,0,1,0,0,1|2,0,0]=4 7096 B17R2.2383 c1cc(ccn1)CCCNCc2c[nH]cn2 2230a_100011275580_100000707719 [0,0,1,0,0,1|1,0,0]=3 7097 B17R2.2383 c1cc(ccn1)CCCNCc2cocn2 270004a_100011275580_100000050382 [0,0,1,0,0,1|2,0,0]=4 7098 B17R2.2383 c1cc(ccn1)CCCNCc2cscn2 207a_100011275580_100000743575 [0,0,1,0,0,1|2,0,0]=4 7099 B17R2.2383 c1cc(ccn1)CCCNCc2cscn2 2230a_100011275580_100000205941 [0,0,1,0,0,1|2,0,0]=4 7100 B17R2.2383 c1cc(ccn1)CCCNCc2cscn2 270004a_100011275580_100000743575 [0,0,1,0,0,1|2,0,0]=4 7101 B17R2.2383 c1cc(ccn1)CCCOCc2c[nH]cn2 34a_100000210659_100000707719 [0,0,1,0,0,1|2,0,0]=4 7102 B17R2.2383 c1cc(ccn1)CCSCCc2c[nH]cn2 62a_100000723409_100020628418 [0,0,1,0,0,1|2,0,0]=4 7103 B17R2.2383 c1cc(ccn1)CCSCCc2c[nH]cn2 62a_100020628418_100000723409 [0,0,1,0,0,1|2,0,0]=4 7104 B17R2.2383 c1cc(ccn1)NCCOCc2c[nH]cn2 34a_200011243140_100000707719 [0,0,1,0,0,1|2,0,0]=4 7105 B17R2.2383 c1cc(ccn1)OCCNCc2cocn2 270004a_100025717301_100000050382 [0,0,1,0,0,1|2,0,0]=4 7106 B17R2.2383 c1cc(ccn1)OCCNCc2cscn2 207a_100025717301_100000743575 [0,0,1,0,0,1|2,0,0]=4 7107 B17R2.2383 c1cc(ccn1)OCCNCc2cscn2 270004a_100025717301_100000743575 [0,0,1,0,0,1|2,0,0]=4 7108 B17R2.2383 c1ccc(cc1)CCCCSc2c[nH]cn2 62a_100000701786_100000756875 [0,0,1,0,0,1|1,0,0]=3 7109 B17R2.2383 c1ccc(cc1)CCCCSc2c[nH]cn2 62a_100000756875_100000701786 [0,0,1,0,0,1|1,0,0]=3 7110 B17R2.2383 c1ccc(cc1)CCCCSc2c[nH]nn2 62a_100000701786_100009819707 [0,0,1,0,0,1|2,0,0]=4 7111 B17R2.2383 c1ccc(cc1)CCCCSc2c[nH]nn2 62a_100009819707_100000701786 [0,0,1,0,0,1|2,0,0]=4 7112 B17R2.2383 c1ccc(cc1)CCCCSc2cscn2 62a_100000701786_100000751502 [0,0,1,0,0,1|2,0,0]=4 7113 B17R2.2383 c1ccc(cc1)CCCCSc2cscn2 62a_100000751502_100000701786 [0,0,1,0,0,1|2,0,0]=4 7114 B17R2.2383 c1ccc(cc1)CCCCSc2nc[nH]n2 62a_100000701786_100000761765 [0,0,1,0,0,1|2,0,0]=4 7115 B17R2.2383 c1ccc(cc1)CCCCSc2nc[nH]n2 62a_100000761765_100000701786 [0,0,1,0,0,1|2,0,0]=4 7116 B17R2.2383 c1ccc(cc1)CCCNCc2c[nH]cn2 2230a_100000211184_100000707719 [0,0,1,0,0,1|0,0,0]=2 7117 B17R2.2383 c1ccc(cc1)CCCNCc2c[nH]cn2 34a_100000211184_100000707719 [0,0,1,0,0,1|0,0,0]=2 7118 B17R2.2383 c1ccc(cc1)CCCNCc2cc[nH]n2 207a_100000211184_100000738523 [0,0,1,0,0,1|2,0,0]=4 7119 B17R2.2383 c1ccc(cc1)CCCNCc2cc[nH]n2 270004a_100000211184_100000738523 [0,0,1,0,0,1|2,0,0]=4 7120 B17R2.2383 c1ccc(cc1)CCCNCc2ccco2 207a_100000211184_100000186105 [0,0,1,0,0,1|2,0,0]=4 7121 B17R2.2383 c1ccc(cc1)CCCNCc2ccco2 2230a_100000185738_100000211621 [0,0,1,0,0,1|2,0,0]=4 7122 B17R2.2383 c1ccc(cc1)CCCNCc2ccco2 270004a_100000211184_100000186105 [0,0,1,0,0,1|2,0,0]=4 7123 B17R2.2383 c1ccc(cc1)CCCNCc2ccco2 34a_100000185738_100000211621 [0,0,1,0,0,1|2,0,0]=4 7124 B17R2.2383 c1ccc(cc1)CCCNCc2cccs2 207a_100000211184_100000209959 [0,0,1,0,0,1|2,0,0]=4 7125 B17R2.2383 c1ccc(cc1)CCCNCc2cccs2 2230a_100000211653_100000211621 [0,0,1,0,0,1|2,0,0]=4 7126 B17R2.2383 c1ccc(cc1)CCCNCc2cccs2 270004a_100000211184_100000209959 [0,0,1,0,0,1|2,0,0]=4 7127 B17R2.2383 c1ccc(cc1)CCCNCc2ccoc2 207a_100000211184_100011215517 [0,0,1,0,0,1|2,0,0]=4 7128 B17R2.2383 c1ccc(cc1)CCCNCc2ccoc2 2230a_100015206860_100000211621 [0,0,1,0,0,1|2,0,0]=4 7129 B17R2.2383 c1ccc(cc1)CCCNCc2ccoc2 270004a_100000211184_100011215517 [0,0,1,0,0,1|2,0,0]=4 7130 B17R2.2383 c1ccc(cc1)CCCNCc2ccoc2 34a_100015206860_100000211621 [0,0,1,0,0,1|2,0,0]=4 7131 B17R2.2383 c1ccc(cc1)CCCNCc2ccon2 2230a_100000211184_100000234950 [0,0,1,0,0,1|2,0,0]=4 7132 B17R2.2383 c1ccc(cc1)CCCNCc2ccon2 34a_100000211184_100000234950 [0,0,1,0,0,1|2,0,0]=4 7133 B17R2.2383 c1ccc(cc1)CCCNCc2ccsc2 207a_100000211184_100000188534 [0,0,1,0,0,1|2,0,0]=4 7134 B17R2.2383 c1ccc(cc1)CCCNCc2ccsc2 2230a_100000186416_100000211621 [0,0,1,0,0,1|2,0,0]=4 7135 B17R2.2383 c1ccc(cc1)CCCNCc2ccsc2 2230a_100000211184_100011261437 [0,0,1,0,0,1|2,0,0]=4 7136 B17R2.2383 c1ccc(cc1)CCCNCc2ccsc2 270004a_100000211184_100000188534 [0,0,1,0,0,1|2,0,0]=4 7137 B17R2.2383 c1ccc(cc1)CCCNCc2ccsc2 34a_100000186416_100000211621 [0,0,1,0,0,1|2,0,0]=4 7138 B17R2.2383 c1ccc(cc1)CCCNCc2ccsc2 34a_100000211184_100011261437 [0,0,1,0,0,1|2,0,0]=4 7139 B17R2.2383 c1ccc(cc1)CCCNCc2cn[nH]c2 207a_100000211184_100016992096 [0,0,1,0,0,1|2,0,0]=4 7140 B17R2.2383 c1ccc(cc1)CCCNCc2cn[nH]c2 270004a_100000211184_100016992096 [0,0,1,0,0,1|2,0,0]=4 7141 B17R2.2383 c1ccc(cc1)CCCNCc2cnc[nH]2 207a_100000211184_100000742939 [0,0,1,0,0,1|0,0,2]=4 7142 B17R2.2383 c1ccc(cc1)CCCNCc2cnco2 270004a_100000211184_100000064291 [0,0,1,0,0,1|1,0,1]=4 7143 B17R2.2383 c1ccc(cc1)CCCNCc2cncs2 207a_100000211184_100000749870 [0,0,1,0,0,1|1,0,1]=4 7144 B17R2.2383 c1ccc(cc1)CCCNCc2cncs2 2230a_100000211184_100015185245 [0,0,1,0,0,1|1,0,1]=4 7145 B17R2.2383 c1ccc(cc1)CCCNCc2cncs2 2230a_100016987365_100000211621 [0,0,1,0,0,1|1,0,1]=4 7146 B17R2.2383 c1ccc(cc1)CCCNCc2cncs2 270004a_100000211184_100000749870 [0,0,1,0,0,1|1,0,1]=4 7147 B17R2.2383 c1ccc(cc1)CCCNCc2cncs2 34a_100000211184_100015185245 [0,0,1,0,0,1|1,0,1]=4 7148 B17R2.2383 c1ccc(cc1)CCCNCc2cocn2 270004a_100000211184_100000050382 [0,0,1,0,0,1|1,0,0]=3 7149 B17R2.2383 c1ccc(cc1)CCCNCc2cscn2 207a_100000211184_100000743575 [0,0,1,0,0,1|1,0,0]=3 7150 B17R2.2383 c1ccc(cc1)CCCNCc2cscn2 2230a_100000211184_100000205941 [0,0,1,0,0,1|1,0,0]=3 7151 B17R2.2383 c1ccc(cc1)CCCNCc2cscn2 2230a_100015185402_100000211621 [0,0,1,0,0,1|1,0,0]=3 7152 B17R2.2383 c1ccc(cc1)CCCNCc2cscn2 270004a_100000211184_100000743575 [0,0,1,0,0,1|1,0,0]=3 7153 B17R2.2383 c1ccc(cc1)CCCNCc2cscn2 34a_100000211184_100000205941 [0,0,1,0,0,1|1,0,0]=3 7154 B17R2.2383 c1ccc(cc1)CCCNCc2csnn2 270004a_100000211184_100000738508 [0,0,1,0,0,1|2,0,0]=4 7155 B17R2.2383 c1ccc(cc1)CCCNCc2ncc[nH]2 207a_100000211184_100000743867 [0,0,1,0,0,1|2,0,0]=4 7156 B17R2.2383 c1ccc(cc1)CCCNCc2ncc[nH]2 2230a_100000211184_100016991755 [0,0,1,0,0,1|2,0,0]=4 7157 B17R2.2383 c1ccc(cc1)CCCNCc2ncc[nH]2 34a_100000211184_100016991755 [0,0,1,0,0,1|2,0,0]=4 7158 B17R2.2383 c1ccc(cc1)CCCNCc2ncco2 2230a_100000211184_103436540062 [0,0,1,0,0,1|2,0,0]=4 7159 B17R2.2383 c1ccc(cc1)CCCNCc2ncco2 2230a_100016994969_100000211621 [0,0,1,0,0,1|2,0,0]=4 7160 B17R2.2383 c1ccc(cc1)CCCNCc2ncco2 270004a_100000211184_100000064290 [0,0,1,0,0,1|2,0,0]=4 7161 B17R2.2383 c1ccc(cc1)CCCNCc2ncco2 34a_100000211184_103436540062 [0,0,1,0,0,1|2,0,0]=4 7162 B17R2.2383 c1ccc(cc1)CCCNCc2nccs2 207a_100000211184_100000750902 [0,0,1,0,0,1|2,0,0]=4 7163 B17R2.2383 c1ccc(cc1)CCCNCc2nccs2 2230a_100000211184_100015184050 [0,0,1,0,0,1|2,0,0]=4 7164 B17R2.2383 c1ccc(cc1)CCCNCc2nccs2 2230a_100000740555_100000211621 [0,0,1,0,0,1|2,0,0]=4 7165 B17R2.2383 c1ccc(cc1)CCCNCc2nccs2 270004a_100000211184_100000750902 [0,0,1,0,0,1|2,0,0]=4 7166 B17R2.2383 c1ccc(cc1)CCCNCc2nccs2 34a_100000211184_100015184050 [0,0,1,0,0,1|2,0,0]=4 7167 B17R2.2383 c1ccc(cc1)CCCNCc2ncon2 34a_100000211184_100000233494 [0,0,1,0,0,1|2,0,0]=4 7168 B17R2.2383 c1ccc(cc1)CCCNCn2cncn2 2230a_100000211184_200020645497 [0,0,1,0,0,1|1,0,1]=4 7169 B17R2.2383 c1ccc(cc1)CCCNCn2cncn2 34a_100000211184_200020645497 [0,0,1,0,0,1|1,0,1]=4 7170 B17R2.2383 c1ccc(cc1)CCCOCc2c[nH]cn2 34a_100000210828_100000707719 [0,0,1,0,0,1|1,0,0]=3 7171 B17R2.2383 c1ccc(cc1)CCCOCc2cscn2 34a_100000210828_100000205941 [0,0,1,0,0,1|2,0,0]=4 7172 B17R2.2383 c1ccc(cc1)CCCOCc2cscn2 7a_100000210828_100000205941 [0,0,1,0,0,1|2,0,0]=4 7173 B17R2.2383 c1ccc(cc1)CCCSCc2c[nH]cn2 62a_100000211621_100000707719 [0,0,1,0,0,1|1,0,0]=3 7174 B17R2.2383 c1ccc(cc1)CCCSCc2c[nH]cn2 62a_100000707719_100000211621 [0,0,1,0,0,1|1,0,0]=3 7175 B17R2.2383 c1ccc(cc1)CCCSCc2cscn2 62a_100000205941_100000211621 [0,0,1,0,0,1|2,0,0]=4 7176 B17R2.2383 c1ccc(cc1)CCCSCc2cscn2 62a_100000211621_100000205941 [0,0,1,0,0,1|2,0,0]=4 7177 B17R2.2383 c1ccc(cc1)CCNCCc2c[nH]cn2 2230a_100000106460_100020628418 [0,0,1,0,0,1|0,0,0]=2 7178 B17R2.2383 c1ccc(cc1)CCNCCc2ccco2 2230a_100000694680_100000765856 [0,0,1,0,0,1|2,0,0]=4 7179 B17R2.2383 c1ccc(cc1)CCNCCc2ccco2 34a_100000694680_100000765856 [0,0,1,0,0,1|2,0,0]=4 7180 B17R2.2383 c1ccc(cc1)CCNCCc2cccs2 2230a_100000106460_100000748579 [0,0,1,0,0,1|2,0,0]=4 7181 B17R2.2383 c1ccc(cc1)CCNCCc2cccs2 2230a_100000203755_100000765856 [0,0,1,0,0,1|2,0,0]=4 7182 B17R2.2383 c1ccc(cc1)CCNCCc2cccs2 34a_100000106460_100000748579 [0,0,1,0,0,1|2,0,0]=4 7183 B17R2.2383 c1ccc(cc1)CCNCCc2cccs2 34a_100000203755_100000765856 [0,0,1,0,0,1|2,0,0]=4 7184 B17R2.2383 c1ccc(cc1)CCNCCc2ccsc2 2230a_100000692642_100000765856 [0,0,1,0,0,1|2,0,0]=4 7185 B17R2.2383 c1ccc(cc1)CCNCCc2ccsc2 34a_100000692642_100000765856 [0,0,1,0,0,1|2,0,0]=4 7186 B17R2.2383 c1ccc(cc1)CCNCCc2cn[nH]c2 2230a_100000106460_100000743252 [0,0,1,0,0,1|2,0,0]=4 7187 B17R2.2383 c1ccc(cc1)CCNCCc2cn[nH]c2 2230a_100000732747_100000765856 [0,0,1,0,0,1|2,0,0]=4 7188 B17R2.2383 c1ccc(cc1)CCNCCc2cncs2 2230a_100016991637_100000765856 [0,0,1,0,0,1|1,0,1]=4 7189 B17R2.2383 c1ccc(cc1)CCNCCc2nccs2 2230a_100015186391_100000765856 [0,0,1,0,0,1|2,0,0]=4 7190 B17R2.2383 c1ccc(cc1)CCNCCn2cccn2 2230a_100000106460_100000685285 [0,0,1,0,0,1|2,0,0]=4 7191 B17R2.2383 c1ccc(cc1)CCNCCn2cccn2 2230a_100011200920_100000765856 [0,0,1,0,0,1|2,0,0]=4 7192 B17R2.2383 c1ccc(cc1)CCNCCn2cccn2 34a_100000106460_100015204718 [0,0,1,0,0,1|2,0,0]=4 7193 B17R2.2383 c1ccc(cc1)CCNCCn2cncn2 2230a_100000106460_100000731791 [0,0,1,0,0,1|1,0,1]=4 7194 B17R2.2383 c1ccc(cc1)CCNCCn2cncn2 2230a_200000738561_100000765856 [0,0,1,0,0,1|1,0,1]=4 7195 B17R2.2383 c1ccc(cc1)CCNCCn2cncn2 34a_100000106460_200000749826 [0,0,1,0,0,1|1,0,1]=4 7196 B17R2.2383 c1ccc(cc1)CCOCCc2c[nH]cn2 7a_100000210268_100020628418 [0,0,1,0,0,1|1,0,0]=3 7197 B17R2.2383 c1ccc(cc1)CCSCCc2c[nH]cn2 62a_100000765856_100020628418 [0,0,1,0,0,1|1,0,0]=3 7198 B17R2.2383 c1ccc(cc1)CCSCCc2c[nH]cn2 62a_100020628418_100011218657 [0,0,1,0,0,1|1,0,0]=3 7199 B17R2.2383 c1ccc(cc1)COCCSc2c[nH]cn2 62a_100000234347_100000756875 [0,0,1,0,0,1|2,0,0]=4 7200 B17R2.2383 c1ccc(cc1)COCCSc2c[nH]cn2 62a_100000756875_100000234347 [0,0,1,0,0,1|2,0,0]=4 7201 B17R2.2383 c1ccc(cc1)COCNCc2ccco2 2230a_100000185738_100000763385 [0,0,1,0,0,1|2,0,0]=4 7202 B17R2.2383 c1ccc(cc1)COCNCc2ccco2 34a_100000185738_100000763385 [0,0,1,0,0,1|2,0,0]=4 7203 B17R2.2383 c1ccc(cc1)COCNCc2cccs2 2230a_100000211653_100000763385 [0,0,1,0,0,1|2,0,0]=4 7204 B17R2.2383 c1ccc(cc1)COCNCc2ccoc2 2230a_100015206860_100000763385 [0,0,1,0,0,1|2,0,0]=4 7205 B17R2.2383 c1ccc(cc1)COCNCc2ccoc2 34a_100015206860_100000763385 [0,0,1,0,0,1|2,0,0]=4 7206 B17R2.2383 c1ccc(cc1)COCNCc2ccsc2 2230a_100000186416_100000763385 [0,0,1,0,0,1|2,0,0]=4 7207 B17R2.2383 c1ccc(cc1)COCNCc2ccsc2 34a_100000186416_100000763385 [0,0,1,0,0,1|2,0,0]=4 7208 B17R2.2383 c1ccc(cc1)COCNCc2cncs2 2230a_100016987365_100000763385 [0,0,1,0,0,1|1,0,1]=4 7209 B17R2.2383 c1ccc(cc1)COCNCc2cscn2 2230a_100015185402_100000763385 [0,0,1,0,0,1|1,0,0]=3 7210 B17R2.2383 c1ccc(cc1)COCNCc2ncco2 2230a_100016994969_100000763385 [0,0,1,0,0,1|2,0,0]=4 7211 B17R2.2383 c1ccc(cc1)COCNCc2nccs2 2230a_100000740555_100000763385 [0,0,1,0,0,1|2,0,0]=4 7212 B17R2.2383 c1ccc(cc1)COCSCc2c[nH]cn2 62a_100000707719_100000763385 [0,0,1,0,0,1|1,0,0]=3 7213 B17R2.2383 c1ccc(cc1)COCSCc2c[nH]cn2 62a_100000763385_100000707719 [0,0,1,0,0,1|1,0,0]=3 7214 B17R2.2383 c1ccc(cc1)COCSCc2cscn2 62a_100000205941_100000763385 [0,0,1,0,0,1|2,0,0]=4 7215 B17R2.2383 c1ccc(cc1)COCSCc2cscn2 62a_100000763385_100000205941 [0,0,1,0,0,1|2,0,0]=4 7216 B17R2.2383 c1ccc(cc1)CSCCSc2c[nH]cn2 62a_100000756875_200011297719 [0,0,1,0,0,1|2,0,0]=4 7217 B17R2.2383 c1ccc(cc1)CSCCSc2c[nH]cn2 62a_200011297719_100000756875 [0,0,1,0,0,1|2,0,0]=4 7218 B17R2.2383 c1ccc(cc1)CSCNCc2ccco2 2230a_100000185738_200011217039 [0,0,1,0,0,1|2,0,0]=4 7219 B17R2.2383 c1ccc(cc1)CSCNCc2ccco2 34a_100000185738_200011217039 [0,0,1,0,0,1|2,0,0]=4 7220 B17R2.2383 c1ccc(cc1)CSCNCc2cccs2 2230a_100000211653_200011217039 [0,0,1,0,0,1|2,0,0]=4 7221 B17R2.2383 c1ccc(cc1)CSCNCc2ccoc2 2230a_100015206860_200011217039 [0,0,1,0,0,1|2,0,0]=4 7222 B17R2.2383 c1ccc(cc1)CSCNCc2ccoc2 34a_100015206860_200011217039 [0,0,1,0,0,1|2,0,0]=4 7223 B17R2.2383 c1ccc(cc1)CSCNCc2ccsc2 2230a_100000186416_200011217039 [0,0,1,0,0,1|2,0,0]=4 7224 B17R2.2383 c1ccc(cc1)CSCNCc2ccsc2 34a_100000186416_200011217039 [0,0,1,0,0,1|2,0,0]=4 7225 B17R2.2383 c1ccc(cc1)CSCNCc2cncs2 2230a_100016987365_200011217039 [0,0,1,0,0,1|1,0,1]=4 7226 B17R2.2383 c1ccc(cc1)CSCNCc2cscn2 2230a_100015185402_200011217039 [0,0,1,0,0,1|1,0,0]=3 7227 B17R2.2383 c1ccc(cc1)CSCNCc2ncco2 2230a_100016994969_200011217039 [0,0,1,0,0,1|2,0,0]=4 7228 B17R2.2383 c1ccc(cc1)CSCNCc2nccs2 2230a_100000740555_200011217039 [0,0,1,0,0,1|2,0,0]=4 7229 B17R2.2383 c1ccc(cc1)CSCSCc2c[nH]cn2 62a_100000707719_200011217039 [0,0,1,0,0,1|1,0,0]=3 7230 B17R2.2383 c1ccc(cc1)CSCSCc2c[nH]cn2 62a_200011217039_100000707719 [0,0,1,0,0,1|1,0,0]=3 7231 B17R2.2383 c1ccc(cc1)CSCSCc2cscn2 62a_100000205941_200011217039 [0,0,1,0,0,1|2,0,0]=4 7232 B17R2.2383 c1ccc(cc1)CSCSCc2cscn2 62a_200011217039_100000205941 [0,0,1,0,0,1|2,0,0]=4 7233 B17R2.2383 c1ccc(cc1)NCCOCc2c[nH]cn2 34a_100000211345_100000707719 [0,0,1,0,0,1|1,0,0]=3 7234 B17R2.2383 c1ccc(cc1)NCCOCc2cscn2 34a_100000211345_100000205941 [0,0,1,0,0,1|2,0,0]=4 7235 B17R2.2383 c1ccc(cc1)OCCCSc2c[nH]cn2 62a_100000199009_100000756875 [0,0,1,0,0,1|2,0,0]=4 7236 B17R2.2383 c1ccc(cc1)OCCCSc2c[nH]cn2 62a_100000756875_100000199009 [0,0,1,0,0,1|2,0,0]=4 7237 B17R2.2383 c1ccc(cc1)OCCNCc2c[nH]cn2 2230a_100000174943_100000707719 [0,0,1,0,0,1|0,0,0]=2 7238 B17R2.2383 c1ccc(cc1)OCCNCc2c[nH]cn2 34a_100000174943_100000707719 [0,0,1,0,0,1|0,0,0]=2 7239 B17R2.2383 c1ccc(cc1)OCCNCc2c[nH]nn2 270004a_100020620823_100000758736 [0,0,1,0,0,1|1,0,0]=3 7240 B17R2.2383 c1ccc(cc1)OCCNCc2cc[nH]n2 207a_100000174943_100000738523 [0,0,1,0,0,1|2,0,0]=4 7241 B17R2.2383 c1ccc(cc1)OCCNCc2cc[nH]n2 270004a_100000174943_100000738523 [0,0,1,0,0,1|2,0,0]=4 7242 B17R2.2383 c1ccc(cc1)OCCNCc2ccco2 207a_100000174943_100000186105 [0,0,1,0,0,1|2,0,0]=4 7243 B17R2.2383 c1ccc(cc1)OCCNCc2ccco2 2230a_100000185738_100000184471 [0,0,1,0,0,1|2,0,0]=4 7244 B17R2.2383 c1ccc(cc1)OCCNCc2ccco2 270004a_100000174943_100000186105 [0,0,1,0,0,1|2,0,0]=4 7245 B17R2.2383 c1ccc(cc1)OCCNCc2ccco2 270004a_100000185738_100000758736 [0,0,1,0,0,1|2,0,0]=4 7246 B17R2.2383 c1ccc(cc1)OCCNCc2ccco2 34a_100000185738_100000184471 [0,0,1,0,0,1|2,0,0]=4 7247 B17R2.2383 c1ccc(cc1)OCCNCc2cccs2 207a_100000174943_100000209959 [0,0,1,0,0,1|2,0,0]=4 7248 B17R2.2383 c1ccc(cc1)OCCNCc2cccs2 2230a_100000211653_100000184471 [0,0,1,0,0,1|2,0,0]=4 7249 B17R2.2383 c1ccc(cc1)OCCNCc2cccs2 270004a_100000174943_100000209959 [0,0,1,0,0,1|2,0,0]=4 7250 B17R2.2383 c1ccc(cc1)OCCNCc2cccs2 270004a_100000211653_100000758736 [0,0,1,0,0,1|2,0,0]=4 7251 B17R2.2383 c1ccc(cc1)OCCNCc2ccoc2 207a_100000174943_100011215517 [0,0,1,0,0,1|2,0,0]=4 7252 B17R2.2383 c1ccc(cc1)OCCNCc2ccoc2 2230a_100015206860_100000184471 [0,0,1,0,0,1|2,0,0]=4 7253 B17R2.2383 c1ccc(cc1)OCCNCc2ccoc2 270004a_100000174943_100011215517 [0,0,1,0,0,1|2,0,0]=4 7254 B17R2.2383 c1ccc(cc1)OCCNCc2ccoc2 270004a_100015206860_100000758736 [0,0,1,0,0,1|2,0,0]=4 7255 B17R2.2383 c1ccc(cc1)OCCNCc2ccoc2 34a_100015206860_100000184471 [0,0,1,0,0,1|2,0,0]=4 7256 B17R2.2383 c1ccc(cc1)OCCNCc2ccon2 2230a_100000174943_100000234950 [0,0,1,0,0,1|2,0,0]=4 7257 B17R2.2383 c1ccc(cc1)OCCNCc2ccon2 270004a_100000688301_100000758736 [0,0,1,0,0,1|2,0,0]=4 7258 B17R2.2383 c1ccc(cc1)OCCNCc2ccon2 34a_100000174943_100000234950 [0,0,1,0,0,1|2,0,0]=4 7259 B17R2.2383 c1ccc(cc1)OCCNCc2ccsc2 207a_100000174943_100000188534 [0,0,1,0,0,1|2,0,0]=4 7260 B17R2.2383 c1ccc(cc1)OCCNCc2ccsc2 2230a_100000174943_100011261437 [0,0,1,0,0,1|2,0,0]=4 7261 B17R2.2383 c1ccc(cc1)OCCNCc2ccsc2 2230a_100000186416_100000184471 [0,0,1,0,0,1|2,0,0]=4 7262 B17R2.2383 c1ccc(cc1)OCCNCc2ccsc2 270004a_100000174943_100000188534 [0,0,1,0,0,1|2,0,0]=4 7263 B17R2.2383 c1ccc(cc1)OCCNCc2ccsc2 270004a_100000186416_100000758736 [0,0,1,0,0,1|2,0,0]=4 7264 B17R2.2383 c1ccc(cc1)OCCNCc2ccsc2 34a_100000174943_100011261437 [0,0,1,0,0,1|2,0,0]=4 7265 B17R2.2383 c1ccc(cc1)OCCNCc2ccsc2 34a_100000186416_100000184471 [0,0,1,0,0,1|2,0,0]=4 7266 B17R2.2383 c1ccc(cc1)OCCNCc2cn[nH]c2 207a_100000174943_100016992096 [0,0,1,0,0,1|2,0,0]=4 7267 B17R2.2383 c1ccc(cc1)OCCNCc2cn[nH]c2 270004a_100000174943_100016992096 [0,0,1,0,0,1|2,0,0]=4 7268 B17R2.2383 c1ccc(cc1)OCCNCc2cn[nH]c2 270004a_100000737208_100000758736 [0,0,1,0,0,1|2,0,0]=4 7269 B17R2.2383 c1ccc(cc1)OCCNCc2cnc[nH]2 207a_100000174943_100000742939 [0,0,1,0,0,1|0,0,2]=4 7270 B17R2.2383 c1ccc(cc1)OCCNCc2cnco2 270004a_100000174943_100000064291 [0,0,1,0,0,1|1,0,1]=4 7271 B17R2.2383 c1ccc(cc1)OCCNCc2cnco2 270004a_100020634212_100000758736 [0,0,1,0,0,1|1,0,1]=4 7272 B17R2.2383 c1ccc(cc1)OCCNCc2cncs2 207a_100000174943_100000749870 [0,0,1,0,0,1|1,0,1]=4 7273 B17R2.2383 c1ccc(cc1)OCCNCc2cncs2 2230a_100000174943_100015185245 [0,0,1,0,0,1|1,0,1]=4 7274 B17R2.2383 c1ccc(cc1)OCCNCc2cncs2 2230a_100016987365_100000184471 [0,0,1,0,0,1|1,0,1]=4 7275 B17R2.2383 c1ccc(cc1)OCCNCc2cncs2 270004a_100000174943_100000749870 [0,0,1,0,0,1|1,0,1]=4 7276 B17R2.2383 c1ccc(cc1)OCCNCc2cncs2 270004a_100016987365_100000758736 [0,0,1,0,0,1|1,0,1]=4 7277 B17R2.2383 c1ccc(cc1)OCCNCc2cncs2 34a_100000174943_100015185245 [0,0,1,0,0,1|1,0,1]=4 7278 B17R2.2383 c1ccc(cc1)OCCNCc2cocn2 270004a_100000174943_100000050382 [0,0,1,0,0,1|1,0,0]=3 7279 B17R2.2383 c1ccc(cc1)OCCNCc2cocn2 270004a_100015188801_100000758736 [0,0,1,0,0,1|1,0,0]=3 7280 B17R2.2383 c1ccc(cc1)OCCNCc2cscn2 207a_100000174943_100000743575 [0,0,1,0,0,1|1,0,0]=3 7281 B17R2.2383 c1ccc(cc1)OCCNCc2cscn2 2230a_100000174943_100000205941 [0,0,1,0,0,1|1,0,0]=3 7282 B17R2.2383 c1ccc(cc1)OCCNCc2cscn2 2230a_100015185402_100000184471 [0,0,1,0,0,1|1,0,0]=3 7283 B17R2.2383 c1ccc(cc1)OCCNCc2cscn2 270004a_100000174943_100000743575 [0,0,1,0,0,1|1,0,0]=3 7284 B17R2.2383 c1ccc(cc1)OCCNCc2cscn2 34a_100000174943_100000205941 [0,0,1,0,0,1|1,0,0]=3 7285 B17R2.2383 c1ccc(cc1)OCCNCc2csnn2 270004a_100000174943_100000738508 [0,0,1,0,0,1|2,0,0]=4 7286 B17R2.2383 c1ccc(cc1)OCCNCc2ncc[nH]2 207a_100000174943_100000743867 [0,0,1,0,0,1|2,0,0]=4 7287 B17R2.2383 c1ccc(cc1)OCCNCc2ncc[nH]2 2230a_100000174943_100016991755 [0,0,1,0,0,1|2,0,0]=4 7288 B17R2.2383 c1ccc(cc1)OCCNCc2ncc[nH]2 270004a_100000754540_100000758736 [0,0,1,0,0,1|2,0,0]=4 7289 B17R2.2383 c1ccc(cc1)OCCNCc2ncc[nH]2 34a_100000174943_100016991755 [0,0,1,0,0,1|2,0,0]=4 7290 B17R2.2383 c1ccc(cc1)OCCNCc2ncco2 2230a_100000174943_103436540062 [0,0,1,0,0,1|2,0,0]=4 7291 B17R2.2383 c1ccc(cc1)OCCNCc2ncco2 2230a_100016994969_100000184471 [0,0,1,0,0,1|2,0,0]=4 7292 B17R2.2383 c1ccc(cc1)OCCNCc2ncco2 270004a_100000174943_100000064290 [0,0,1,0,0,1|2,0,0]=4 7293 B17R2.2383 c1ccc(cc1)OCCNCc2ncco2 34a_100000174943_103436540062 [0,0,1,0,0,1|2,0,0]=4 7294 B17R2.2383 c1ccc(cc1)OCCNCc2nccs2 207a_100000174943_100000750902 [0,0,1,0,0,1|2,0,0]=4 7295 B17R2.2383 c1ccc(cc1)OCCNCc2nccs2 2230a_100000174943_100015184050 [0,0,1,0,0,1|2,0,0]=4 7296 B17R2.2383 c1ccc(cc1)OCCNCc2nccs2 2230a_100000740555_100000184471 [0,0,1,0,0,1|2,0,0]=4 7297 B17R2.2383 c1ccc(cc1)OCCNCc2nccs2 270004a_100000174943_100000750902 [0,0,1,0,0,1|2,0,0]=4 7298 B17R2.2383 c1ccc(cc1)OCCNCc2nccs2 270004a_100000740555_100000758736 [0,0,1,0,0,1|2,0,0]=4 7299 B17R2.2383 c1ccc(cc1)OCCNCc2nccs2 34a_100000174943_100015184050 [0,0,1,0,0,1|2,0,0]=4 7300 B17R2.2383 c1ccc(cc1)OCCNCc2ncon2 34a_100000174943_100000233494 [0,0,1,0,0,1|2,0,0]=4 7301 B17R2.2383 c1ccc(cc1)OCCNCn2cncn2 2230a_100000174943_200020645497 [0,0,1,0,0,1|1,0,1]=4 7302 B17R2.2383 c1ccc(cc1)OCCNCn2cncn2 34a_100000174943_200020645497 [0,0,1,0,0,1|1,0,1]=4 7303 B17R2.2383 c1ccc(cc1)OCCOCc2c[nH]cn2 34a_100000210260_100000707719 [0,0,1,0,0,1|1,0,0]=3 7304 B17R2.2383 c1ccc(cc1)OCCOCc2cscn2 34a_100000210260_100000205941 [0,0,1,0,0,1|2,0,0]=4 7305 B17R2.2383 c1ccc(cc1)OCCOCc2cscn2 7a_100000210260_100000205941 [0,0,1,0,0,1|2,0,0]=4 7306 B17R2.2383 c1ccc(cc1)OCCSCc2c[nH]cn2 62a_100000184471_100000707719 [0,0,1,0,0,1|1,0,0]=3 7307 B17R2.2383 c1ccc(cc1)OCCSCc2c[nH]cn2 62a_100000707719_100000184471 [0,0,1,0,0,1|1,0,0]=3 7308 B17R2.2383 c1ccc(cc1)OCCSCc2cscn2 62a_100000184471_100000205941 [0,0,1,0,0,1|2,0,0]=4 7309 B17R2.2383 c1ccc(cc1)OCCSCc2cscn2 62a_100000205941_100000184471 [0,0,1,0,0,1|2,0,0]=4 7310 B17R2.2383 c1ccc(cc1)SCCCSc2c[nH]cn2 62a_100000756875_200011203293 [0,0,1,0,0,1|2,0,0]=4 7311 B17R2.2383 c1ccc(cc1)SCCCSc2c[nH]cn2 62a_200011203293_100000756875 [0,0,1,0,0,1|2,0,0]=4 7312 B17R2.2383 c1ccc(cc1)SCCNCc2c[nH]cn2 2230a_100000189519_100000707719 [0,0,1,0,0,1|0,0,0]=2 7313 B17R2.2383 c1ccc(cc1)SCCNCc2cc[nH]n2 207a_100000189519_100000738523 [0,0,1,0,0,1|2,0,0]=4 7314 B17R2.2383 c1ccc(cc1)SCCNCc2cc[nH]n2 270004a_100000189519_100000738523 [0,0,1,0,0,1|2,0,0]=4 7315 B17R2.2383 c1ccc(cc1)SCCNCc2ccco2 207a_100000189519_100000186105 [0,0,1,0,0,1|2,0,0]=4 7316 B17R2.2383 c1ccc(cc1)SCCNCc2ccco2 2230a_100000185738_100000246102 [0,0,1,0,0,1|2,0,0]=4 7317 B17R2.2383 c1ccc(cc1)SCCNCc2ccco2 270004a_100000189519_100000186105 [0,0,1,0,0,1|2,0,0]=4 7318 B17R2.2383 c1ccc(cc1)SCCNCc2ccco2 34a_100000185738_100000246102 [0,0,1,0,0,1|2,0,0]=4 7319 B17R2.2383 c1ccc(cc1)SCCNCc2cccs2 207a_100000189519_100000209959 [0,0,1,0,0,1|2,0,0]=4 7320 B17R2.2383 c1ccc(cc1)SCCNCc2cccs2 2230a_100000211653_100000246102 [0,0,1,0,0,1|2,0,0]=4 7321 B17R2.2383 c1ccc(cc1)SCCNCc2cccs2 270004a_100000189519_100000209959 [0,0,1,0,0,1|2,0,0]=4 7322 B17R2.2383 c1ccc(cc1)SCCNCc2ccoc2 207a_100000189519_100011215517 [0,0,1,0,0,1|2,0,0]=4 7323 B17R2.2383 c1ccc(cc1)SCCNCc2ccoc2 2230a_100015206860_100000246102 [0,0,1,0,0,1|2,0,0]=4 7324 B17R2.2383 c1ccc(cc1)SCCNCc2ccoc2 270004a_100000189519_100011215517 [0,0,1,0,0,1|2,0,0]=4 7325 B17R2.2383 c1ccc(cc1)SCCNCc2ccoc2 34a_100015206860_100000246102 [0,0,1,0,0,1|2,0,0]=4 7326 B17R2.2383 c1ccc(cc1)SCCNCc2ccon2 2230a_100000189519_100000234950 [0,0,1,0,0,1|2,0,0]=4 7327 B17R2.2383 c1ccc(cc1)SCCNCc2ccsc2 207a_100000189519_100000188534 [0,0,1,0,0,1|2,0,0]=4 7328 B17R2.2383 c1ccc(cc1)SCCNCc2ccsc2 2230a_100000186416_100000246102 [0,0,1,0,0,1|2,0,0]=4 7329 B17R2.2383 c1ccc(cc1)SCCNCc2ccsc2 2230a_100000189519_100011261437 [0,0,1,0,0,1|2,0,0]=4 7330 B17R2.2383 c1ccc(cc1)SCCNCc2ccsc2 270004a_100000189519_100000188534 [0,0,1,0,0,1|2,0,0]=4 7331 B17R2.2383 c1ccc(cc1)SCCNCc2ccsc2 34a_100000186416_100000246102 [0,0,1,0,0,1|2,0,0]=4 7332 B17R2.2383 c1ccc(cc1)SCCNCc2cn[nH]c2 207a_100000189519_100016992096 [0,0,1,0,0,1|2,0,0]=4 7333 B17R2.2383 c1ccc(cc1)SCCNCc2cn[nH]c2 270004a_100000189519_100016992096 [0,0,1,0,0,1|2,0,0]=4 7334 B17R2.2383 c1ccc(cc1)SCCNCc2cnc[nH]2 207a_100000189519_100000742939 [0,0,1,0,0,1|0,0,2]=4 7335 B17R2.2383 c1ccc(cc1)SCCNCc2cnco2 270004a_100000189519_100000064291 [0,0,1,0,0,1|1,0,1]=4 7336 B17R2.2383 c1ccc(cc1)SCCNCc2cncs2 207a_100000189519_100000749870 [0,0,1,0,0,1|1,0,1]=4 7337 B17R2.2383 c1ccc(cc1)SCCNCc2cncs2 2230a_100000189519_100015185245 [0,0,1,0,0,1|1,0,1]=4 7338 B17R2.2383 c1ccc(cc1)SCCNCc2cncs2 2230a_100016987365_100000246102 [0,0,1,0,0,1|1,0,1]=4 7339 B17R2.2383 c1ccc(cc1)SCCNCc2cncs2 270004a_100000189519_100000749870 [0,0,1,0,0,1|1,0,1]=4 7340 B17R2.2383 c1ccc(cc1)SCCNCc2cocn2 270004a_100000189519_100000050382 [0,0,1,0,0,1|1,0,0]=3 7341 B17R2.2383 c1ccc(cc1)SCCNCc2cscn2 207a_100000189519_100000743575 [0,0,1,0,0,1|1,0,0]=3 7342 B17R2.2383 c1ccc(cc1)SCCNCc2cscn2 2230a_100000189519_100000205941 [0,0,1,0,0,1|1,0,0]=3 7343 B17R2.2383 c1ccc(cc1)SCCNCc2cscn2 2230a_100015185402_100000246102 [0,0,1,0,0,1|1,0,0]=3 7344 B17R2.2383 c1ccc(cc1)SCCNCc2cscn2 270004a_100000189519_100000743575 [0,0,1,0,0,1|1,0,0]=3 7345 B17R2.2383 c1ccc(cc1)SCCNCc2csnn2 270004a_100000189519_100000738508 [0,0,1,0,0,1|2,0,0]=4 7346 B17R2.2383 c1ccc(cc1)SCCNCc2ncc[nH]2 207a_100000189519_100000743867 [0,0,1,0,0,1|2,0,0]=4 7347 B17R2.2383 c1ccc(cc1)SCCNCc2ncc[nH]2 2230a_100000189519_100016991755 [0,0,1,0,0,1|2,0,0]=4 7348 B17R2.2383 c1ccc(cc1)SCCNCc2ncco2 2230a_100000189519_103436540062 [0,0,1,0,0,1|2,0,0]=4 7349 B17R2.2383 c1ccc(cc1)SCCNCc2ncco2 2230a_100016994969_100000246102 [0,0,1,0,0,1|2,0,0]=4 7350 B17R2.2383 c1ccc(cc1)SCCNCc2ncco2 270004a_100000189519_100000064290 [0,0,1,0,0,1|2,0,0]=4 7351 B17R2.2383 c1ccc(cc1)SCCNCc2nccs2 207a_100000189519_100000750902 [0,0,1,0,0,1|2,0,0]=4 7352 B17R2.2383 c1ccc(cc1)SCCNCc2nccs2 2230a_100000189519_100015184050 [0,0,1,0,0,1|2,0,0]=4 7353 B17R2.2383 c1ccc(cc1)SCCNCc2nccs2 2230a_100000740555_100000246102 [0,0,1,0,0,1|2,0,0]=4 7354 B17R2.2383 c1ccc(cc1)SCCNCc2nccs2 270004a_100000189519_100000750902 [0,0,1,0,0,1|2,0,0]=4 7355 B17R2.2383 c1ccc(cc1)SCCNCn2cncn2 2230a_100000189519_200020645497 [0,0,1,0,0,1|1,0,1]=4 7356 B17R2.2383 c1ccc(cc1)SCCOCc2cscn2 7a_100000230494_100000205941 [0,0,1,0,0,1|2,0,0]=4 7357 B17R2.2383 c1ccc(cc1)SCCSCc2c[nH]cn2 62a_100000246102_100000707719 [0,0,1,0,0,1|1,0,0]=3 7358 B17R2.2383 c1ccc(cc1)SCCSCc2c[nH]cn2 62a_100000707719_100000246102 [0,0,1,0,0,1|1,0,0]=3 7359 B17R2.2383 c1ccc(cc1)SCCSCc2cscn2 62a_100000205941_100000246102 [0,0,1,0,0,1|2,0,0]=4 7360 B17R2.2383 c1ccc(cc1)SCCSCc2cscn2 62a_100000246102_100000205941 [0,0,1,0,0,1|2,0,0]=4 7361 B17R2.2383 c1ccc(cc1)SCSCCc2c[nH]cn2 62a_100011218342_100020628418 [0,0,1,0,0,1|2,0,0]=4 7362 B17R2.2383 c1ccc(cc1)SCSCCc2c[nH]cn2 62a_100020628418_100011218342 [0,0,1,0,0,1|2,0,0]=4 7363 B17R2.2383 c1ccc(nc1)CCCNCc2cocn2 270004a_100000689020_100000050382 [0,0,1,0,0,1|2,0,0]=4 7364 B17R2.2383 c1ccc(nc1)CCCNCc2cscn2 207a_100000689020_100000743575 [0,0,1,0,0,1|2,0,0]=4 7365 B17R2.2383 c1ccc(nc1)CCCNCc2cscn2 270004a_100000689020_100000743575 [0,0,1,0,0,1|2,0,0]=4 7366 B17R2.2383 c1ccc(nc1)CCCOCc2c[nH]cn2 34a_100011215068_100000707719 [0,0,1,0,0,1|2,0,0]=4 7367 B17R2.2383 c1ccc(nc1)CCSCCc2c[nH]cn2 62a_100015183660_100020628418 [0,0,1,0,0,1|2,0,0]=4 7368 B17R2.2383 c1ccc(nc1)CCSCCc2c[nH]cn2 62a_100020628418_100015183660 [0,0,1,0,0,1|2,0,0]=4 7369 B17R2.2383 c1ccc(nc1)OCCNCc2c[nH]cn2 2230a_106741647558_100000707719 [0,0,1,0,0,1|1,0,0]=3 7370 B17R2.2383 c1ccc(nc1)OCCNCc2cocn2 270004a_106741647558_100000050382 [0,0,1,0,0,1|2,0,0]=4 7371 B17R2.2383 c1ccc(nc1)OCCNCc2cscn2 207a_106741647558_100000743575 [0,0,1,0,0,1|2,0,0]=4 7372 B17R2.2383 c1ccc(nc1)OCCNCc2cscn2 2230a_106741647558_100000205941 [0,0,1,0,0,1|2,0,0]=4 7373 B17R2.2383 c1ccc(nc1)OCCNCc2cscn2 270004a_106741647558_100000743575 [0,0,1,0,0,1|2,0,0]=4 7374 B17R2.2383 c1cncc(c1)CCCNCc2c[nH]cn2 2230a_100011532358_100000707719 [0,0,1,0,0,1|1,0,0]=3 7375 B17R2.2383 c1cncc(c1)CCCNCc2c[nH]cn2 34a_100011532358_100000707719 [0,0,1,0,0,1|1,0,0]=3 7376 B17R2.2383 c1cncc(c1)CCCNCc2cocn2 270004a_100011532358_100000050382 [0,0,1,0,0,1|2,0,0]=4 7377 B17R2.2383 c1cncc(c1)CCCNCc2cscn2 207a_100011532358_100000743575 [0,0,1,0,0,1|2,0,0]=4 7378 B17R2.2383 c1cncc(c1)CCCNCc2cscn2 2230a_100011532358_100000205941 [0,0,1,0,0,1|2,0,0]=4 7379 B17R2.2383 c1cncc(c1)CCCNCc2cscn2 270004a_100011532358_100000743575 [0,0,1,0,0,1|2,0,0]=4 7380 B17R2.2383 c1cncc(c1)CCCNCc2cscn2 34a_100011532358_100000205941 [0,0,1,0,0,1|2,0,0]=4 7381 B17R2.2383 c1cncc(c1)CCCOCc2c[nH]cn2 34a_100000211284_100000707719 [0,0,1,0,0,1|2,0,0]=4 7382 B17R2.2383 c1cncc(c1)CCNCCc2c[nH]cn2 2230a_100000736294_100020628418 [0,0,1,0,0,1|1,0,0]=3 7383 B17R2.2383 c1cncc(c1)CCSCCc2c[nH]cn2 62a_100020628418_200011713674 [0,0,1,0,0,1|2,0,0]=4 7384 B17R2.2383 c1cncc(c1)CCSCCc2c[nH]cn2 62a_200011713674_100020628418 [0,0,1,0,0,1|2,0,0]=4 7385 B17R2.2383 c1cncc(c1)OCCNCc2c[nH]cn2 2230a_100000754688_100000707719 [0,0,1,0,0,1|1,0,0]=3 7386 B17R2.2383 c1cncc(c1)OCCNCc2cocn2 270004a_100000754688_100000050382 [0,0,1,0,0,1|2,0,0]=4 7387 B17R2.2383 c1cncc(c1)OCCNCc2cscn2 207a_100000754688_100000743575 [0,0,1,0,0,1|2,0,0]=4 7388 B17R2.2383 c1cncc(c1)OCCNCc2cscn2 2230a_100000754688_100000205941 [0,0,1,0,0,1|2,0,0]=4 7389 B17R2.2383 c1cncc(c1)OCCNCc2cscn2 270004a_100000754688_100000743575 [0,0,1,0,0,1|2,0,0]=4 7390 B17R2.3417 CN(Cc1ccccn1)c2ccccc2Br 2230a_100020606079_100000721315 [0,0,1,0,0,1|2,0,0]=4 7391 B17R2.3417 CN(Cc1ccccn1)c2ccccc2Br 269982a_100020606079_100000721315 [0,0,1,0,0,1|2,0,0]=4 7392 B17R2.3417 CN(Cc1ccccn1)c2ccccc2Br 34a_100020606079_100000721315 [0,0,1,0,0,1|2,0,0]=4 7393 B17R2.3417 CN(Cc1ccccn1)c2ccccc2Cl 2230a_100000219374_100000721315 [0,0,1,0,0,1|2,0,0]=4 7394 B17R2.3417 CN(Cc1ccccn1)c2ccccc2Cl 269982a_100000219374_100000721315 [0,0,1,0,0,1|2,0,0]=4 7395 B17R2.3417 CN(Cc1ccccn1)c2ccccc2Cl 34a_100000219374_100000721315 [0,0,1,0,0,1|2,0,0]=4 7396 B17R2.3417 CN(Cc1ccccn1)c2ccccc2F 2230a_100000220357_100000721315 [0,0,1,0,0,1|2,0,0]=4 7397 B17R2.3417 CN(Cc1ccccn1)c2ccccc2F 269982a_100000220357_100000721315 [0,0,1,0,0,1|2,0,0]=4 7398 B17R2.3417 CN(Cc1ccccn1)c2ccccc2F 34a_100000220357_100000721315 [0,0,1,0,0,1|2,0,0]=4 7399 B17R2.3417 CN(Cc1ccccn1)c2ccccc2F 38a_100000220357_100000721315 [0,0,1,0,0,1|2,0,0]=4 7400 B17R2.3417 CN(Cc1ccccn1)c2ccccc2O 269982a_100000033821_100000721315 [0,0,1,0,0,1|2,0,0]=4 7401 B17R2.3417 CN(Cc1cccnc1)c2ccccc2Br 2230a_100020606079_100000741622 [0,0,1,0,0,1|2,0,0]=4 7402 B17R2.3417 CN(Cc1cccnc1)c2ccccc2Br 269982a_100020606079_100000733263 [0,0,1,0,0,1|2,0,0]=4 7403 B17R2.3417 CN(Cc1cccnc1)c2ccccc2Br 34a_100020606079_100000733263 [0,0,1,0,0,1|2,0,0]=4 7404 B17R2.3417 CN(Cc1cccnc1)c2ccccc2Cl 2230a_100000219374_100000741622 [0,0,1,0,0,1|2,0,0]=4 7405 B17R2.3417 CN(Cc1cccnc1)c2ccccc2Cl 269982a_100000219374_100000733263 [0,0,1,0,0,1|2,0,0]=4 7406 B17R2.3417 CN(Cc1cccnc1)c2ccccc2Cl 34a_100000219374_100000733263 [0,0,1,0,0,1|2,0,0]=4 7407 B17R2.3417 CN(Cc1cccnc1)c2ccccc2F 2230a_100000220357_100000741622 [0,0,1,0,0,1|2,0,0]=4 7408 B17R2.3417 CN(Cc1cccnc1)c2ccccc2F 269982a_100000220357_100000733263 [0,0,1,0,0,1|2,0,0]=4 7409 B17R2.3417 CN(Cc1cccnc1)c2ccccc2F 34a_100000220357_100000733263 [0,0,1,0,0,1|2,0,0]=4 7410 B17R2.3417 CN(Cc1cccnc1)c2ccccc2F 38a_100000220357_100000733263 [0,0,1,0,0,1|2,0,0]=4 7411 B17R2.3417 CN(Cc1cccnc1)c2ccccc2O 269982a_100000033821_100000733263 [0,0,1,0,0,1|2,0,0]=4 7412 B17R2.3417 CN(Cc1cccnn1)c2ccccc2Br 2230a_100020606079_100016990269 [0,0,1,0,0,1|2,0,0]=4 7413 B17R2.3417 CN(Cc1cccnn1)c2ccccc2Br 34a_100020606079_100016990269 [0,0,1,0,0,1|2,0,0]=4 7414 B17R2.3417 CN(Cc1cccnn1)c2ccccc2Cl 2230a_100000219374_100016990269 [0,0,1,0,0,1|2,0,0]=4 7415 B17R2.3417 CN(Cc1cccnn1)c2ccccc2Cl 34a_100000219374_100016990269 [0,0,1,0,0,1|2,0,0]=4 7416 B17R2.3417 CN(Cc1cccnn1)c2ccccc2F 2230a_100000220357_100016990269 [0,0,1,0,0,1|2,0,0]=4 7417 B17R2.3417 CN(Cc1cccnn1)c2ccccc2F 34a_100000220357_100016990269 [0,0,1,0,0,1|2,0,0]=4 7418 B17R2.3417 CN(Cc1cnccn1)c2ccccc2Br 2230a_100020606079_100016995436 [0,0,1,0,0,1|1,0,1]=4 7419 B17R2.3417 CN(Cc1cnccn1)c2ccccc2Br 269982a_100020606079_100016995436 [0,0,1,0,0,1|1,0,1]=4 7420 B17R2.3417 CN(Cc1cnccn1)c2ccccc2Br 34a_100020606079_100016995436 [0,0,1,0,0,1|1,0,1]=4 7421 B17R2.3417 CN(Cc1cnccn1)c2ccccc2Cl 2230a_100000219374_100016995436 [0,0,1,0,0,1|1,0,1]=4 7422 B17R2.3417 CN(Cc1cnccn1)c2ccccc2Cl 269982a_100000219374_100016995436 [0,0,1,0,0,1|1,0,1]=4 7423 B17R2.3417 CN(Cc1cnccn1)c2ccccc2Cl 34a_100000219374_100016995436 [0,0,1,0,0,1|1,0,1]=4 7424 B17R2.3417 CN(Cc1cnccn1)c2ccccc2F 2230a_100000220357_100016995436 [0,0,1,0,0,1|1,0,1]=4 7425 B17R2.3417 CN(Cc1cnccn1)c2ccccc2F 269982a_100000220357_100016995436 [0,0,1,0,0,1|1,0,1]=4 7426 B17R2.3417 CN(Cc1cnccn1)c2ccccc2F 34a_100000220357_100016995436 [0,0,1,0,0,1|1,0,1]=4 7427 B17R2.3417 CN(Cc1cnccn1)c2ccccc2F 38a_100000220357_100016995436 [0,0,1,0,0,1|1,0,1]=4 7428 B17R2.3417 CN(Cc1cnccn1)c2ccccc2O 269982a_100000033821_100016995436 [0,0,1,0,0,1|1,0,1]=4 7429 B17R2.3417 CN(Cc1cncnc1)c2ccccc2Br 2230a_100020606079_100015196519 [0,0,1,0,0,1|1,0,1]=4 7430 B17R2.3417 CN(Cc1cncnc1)c2ccccc2Br 269982a_100020606079_100016991940 [0,0,1,0,0,1|1,0,1]=4 7431 B17R2.3417 CN(Cc1cncnc1)c2ccccc2Br 34a_100020606079_100015196519 [0,0,1,0,0,1|1,0,1]=4 7432 B17R2.3417 CN(Cc1cncnc1)c2ccccc2Cl 2230a_100000219374_100015196519 [0,0,1,0,0,1|1,0,1]=4 7433 B17R2.3417 CN(Cc1cncnc1)c2ccccc2Cl 269982a_100000219374_100016991940 [0,0,1,0,0,1|1,0,1]=4 7434 B17R2.3417 CN(Cc1cncnc1)c2ccccc2Cl 34a_100000219374_100015196519 [0,0,1,0,0,1|1,0,1]=4 7435 B17R2.3417 CN(Cc1cncnc1)c2ccccc2F 2230a_100000220357_100015196519 [0,0,1,0,0,1|1,0,1]=4 7436 B17R2.3417 CN(Cc1cncnc1)c2ccccc2F 269982a_100000220357_100016991940 [0,0,1,0,0,1|1,0,1]=4 7437 B17R2.3417 CN(Cc1cncnc1)c2ccccc2F 34a_100000220357_100015196519 [0,0,1,0,0,1|1,0,1]=4 7438 B17R2.3417 CN(Cc1cncnc1)c2ccccc2F 38a_100000220357_100015196519 [0,0,1,0,0,1|1,0,1]=4 7439 B17R2.3417 CN(Cc1cncnc1)c2ccccc2O 269982a_100000033821_100016991940 [0,0,1,0,0,1|1,0,1]=4 7440 B17R2.3417 CN(Cc1ncccn1)c2ccccc2Br 2230a_100020606079_100000703007 [0,0,1,0,0,1|2,0,0]=4 7441 B17R2.3417 CN(Cc1ncccn1)c2ccccc2Br 269982a_100020606079_100000703007 [0,0,1,0,0,1|2,0,0]=4 7442 B17R2.3417 CN(Cc1ncccn1)c2ccccc2Br 34a_100020606079_100000703007 [0,0,1,0,0,1|2,0,0]=4 7443 B17R2.3417 CN(Cc1ncccn1)c2ccccc2Cl 2230a_100000219374_100000703007 [0,0,1,0,0,1|2,0,0]=4 7444 B17R2.3417 CN(Cc1ncccn1)c2ccccc2Cl 269982a_100000219374_100000703007 [0,0,1,0,0,1|2,0,0]=4 7445 B17R2.3417 CN(Cc1ncccn1)c2ccccc2Cl 34a_100000219374_100000703007 [0,0,1,0,0,1|2,0,0]=4 7446 B17R2.3417 CN(Cc1ncccn1)c2ccccc2F 2230a_100000220357_100000703007 [0,0,1,0,0,1|2,0,0]=4 7447 B17R2.3417 CN(Cc1ncccn1)c2ccccc2F 269982a_100000220357_100000703007 [0,0,1,0,0,1|2,0,0]=4 7448 B17R2.3417 CN(Cc1ncccn1)c2ccccc2F 34a_100000220357_100000703007 [0,0,1,0,0,1|2,0,0]=4 7449 B17R2.3417 CN(Cc1ncccn1)c2ccccc2F 38a_100000220357_100000703007 [0,0,1,0,0,1|2,0,0]=4 7450 B17R2.3417 CN(Cc1ncccn1)c2ccccc2O 269982a_100000033821_100000703007 [0,0,1,0,0,1|2,0,0]=4 7451 B17R2.3417 Cc1ccccc1N(C)Cc2ccccc2 2230a_100000219699_100015291786 [0,0,1,0,0,1|2,0,0]=4 7452 B17R2.3417 Cc1ccccc1N(C)Cc2ccccc2 2230a_100102946366_200000210301 [0,0,1,0,0,1|2,0,0]=4 7453 B17R2.3417 Cc1ccccc1N(C)Cc2ccccc2 269982a_100000219699_100000211182 [0,0,1,0,0,1|2,0,0]=4 7454 B17R2.3417 Cc1ccccc1N(C)Cc2ccccc2 269982a_100102946366_200000210301 [0,0,1,0,0,1|2,0,0]=4 7455 B17R2.3417 Cc1ccccc1N(C)Cc2ccccc2 34a_100000219699_100015291786 [0,0,1,0,0,1|2,0,0]=4 7456 B17R2.3417 Cc1ccccc1N(C)Cc2ccccc2 34a_100102946366_200000210301 [0,0,1,0,0,1|2,0,0]=4 7457 B17R2.3417 Cc1ccccc1N(C)Cc2ccccn2 2230a_100000219699_100000721315 [0,0,1,0,0,1|1,0,0]=3 7458 B17R2.3417 Cc1ccccc1N(C)Cc2ccccn2 269982a_100000219699_100000721315 [0,0,1,0,0,1|1,0,0]=3 7459 B17R2.3417 Cc1ccccc1N(C)Cc2ccccn2 34a_100000219699_100000721315 [0,0,1,0,0,1|1,0,0]=3 7460 B17R2.3417 Cc1ccccc1N(C)Cc2cccnc2 2230a_100000219699_100000741622 [0,0,1,0,0,1|1,0,0]=3 7461 B17R2.3417 Cc1ccccc1N(C)Cc2cccnc2 269982a_100000219699_100000733263 [0,0,1,0,0,1|1,0,0]=3 7462 B17R2.3417 Cc1ccccc1N(C)Cc2cccnc2 34a_100000219699_100000733263 [0,0,1,0,0,1|1,0,0]=3 7463 B17R2.3417 Cc1ccccc1N(C)Cc2cccnn2 2230a_100000219699_100016990269 [0,0,1,0,0,1|1,0,0]=3 7464 B17R2.3417 Cc1ccccc1N(C)Cc2cccnn2 34a_100000219699_100016990269 [0,0,1,0,0,1|1,0,0]=3 7465 B17R2.3417 Cc1ccccc1N(C)Cc2ccncc2 2230a_100000219699_100015193705 [0,0,1,0,0,1|1,0,1]=4 7466 B17R2.3417 Cc1ccccc1N(C)Cc2ccncc2 269982a_100000219699_100015193705 [0,0,1,0,0,1|1,0,1]=4 7467 B17R2.3417 Cc1ccccc1N(C)Cc2cnccn2 2230a_100000219699_100016995436 [0,0,1,0,0,1|0,0,1]=3 7468 B17R2.3417 Cc1ccccc1N(C)Cc2cnccn2 269982a_100000219699_100016995436 [0,0,1,0,0,1|0,0,1]=3 7469 B17R2.3417 Cc1ccccc1N(C)Cc2cnccn2 34a_100000219699_100016995436 [0,0,1,0,0,1|0,0,1]=3 7470 B17R2.3417 Cc1ccccc1N(C)Cc2cncnc2 2230a_100000219699_100015196519 [0,0,1,0,0,1|0,0,1]=3 7471 B17R2.3417 Cc1ccccc1N(C)Cc2cncnc2 269982a_100000219699_100016991940 [0,0,1,0,0,1|0,0,1]=3 7472 B17R2.3417 Cc1ccccc1N(C)Cc2cncnc2 34a_100000219699_100015196519 [0,0,1,0,0,1|0,0,1]=3 7473 B17R2.3417 Cc1ccccc1N(C)Cc2ncccn2 2230a_100000219699_100000703007 [0,0,1,0,0,1|1,0,0]=3 7474 B17R2.3417 Cc1ccccc1N(C)Cc2ncccn2 269982a_100000219699_100000703007 [0,0,1,0,0,1|1,0,0]=3 7475 B17R2.3417 Cc1ccccc1N(C)Cc2ncccn2 34a_100000219699_100000703007 [0,0,1,0,0,1|1,0,0]=3 7476 B17R2.3417 Cc1ccccc1N([13CH3])Cc2ccccc2 2230a_100102946366_200025704644 [0,0,1,0,0,1|2,0,0]=4 7477 B17R2.3417 Cc1ccccc1N([13CH3])Cc2ccccc2 269982a_100102946366_200025704644 [0,0,1,0,0,1|2,0,0]=4 7478 B17R2.3417 Cc1ccccc1N([13CH3])Cc2ccccc2 34a_100102946366_200025704644 [0,0,1,0,0,1|2,0,0]=4 7479 B17R2.3417 Cc1cnccc1N(C)Cc2ccccn2 27a_100000207498_100000765111 [0,0,1,0,0,1|2,0,0]=4 7480 B17R2.3417 Cc1cnccc1N(C)Cc2cccnc2 27a_100000184577_100000765111 [0,0,1,0,0,1|2,0,0]=4 7481 B17R2.3417 Cc1cnccc1N(C)Cc2cnccn2 27a_100011269079_100000765111 [0,0,1,0,0,1|1,0,1]=4 7482 B17R2.3417 Cc1cnccc1N(C)Cc2ncccn2 27a_100025716638_100000765111 [0,0,1,0,0,1|2,0,0]=4 7483 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2Br 2230a_100000184654_100000707719 [0,0,1,0,0,1|1,0,0]=3 7484 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2Br 269982a_100000184654_100000707719 [0,0,1,0,0,1|1,0,0]=3 7485 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2Cl 2230a_100000184507_100000707719 [0,0,1,0,0,1|1,0,0]=3 7486 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2Cl 269982a_100000184507_100000707719 [0,0,1,0,0,1|1,0,0]=3 7487 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2F 2230a_100000742528_100000707719 [0,0,1,0,0,1|1,0,0]=3 7488 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2F 269982a_100000742528_100000707719 [0,0,1,0,0,1|1,0,0]=3 7489 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2F 34a_100000742528_100000707719 [0,0,1,0,0,1|1,0,0]=3 7490 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2O 2230a_100015189988_100000707719 [0,0,1,0,0,1|1,0,0]=3 7491 B17R2.3431 CN(Cc1c[nH]cn1)Cc2ccccc2O 269982a_100015189988_100000707719 [0,0,1,0,0,1|1,0,0]=3 7492 B17R2.3431 CN(Cc1c[nH]cn1)Cc2cccnc2Cl 2230a_103496529121_100000707719 [0,0,1,0,0,1|2,0,0]=4 7493 B17R2.3431 CN(Cc1c[nH]cn1)Cc2cccnc2Cl 269982a_103496529121_100000707719 [0,0,1,0,0,1|2,0,0]=4 7494 B17R2.3431 CN(Cc1cocn1)Cc2ccccc2Br 270004a_100000184654_100000050382 [0,0,1,0,0,1|2,0,0]=4 7495 B17R2.3431 CN(Cc1cocn1)Cc2ccccc2Cl 270004a_100000184507_100000050382 [0,0,1,0,0,1|2,0,0]=4 7496 B17R2.3431 CN(Cc1cocn1)Cc2ccccc2F 270004a_100000742528_100000050382 [0,0,1,0,0,1|2,0,0]=4 7497 B17R2.3431 CN(Cc1cocn1)Cc2ccccc2O 270004a_100015189988_100000050382 [0,0,1,0,0,1|2,0,0]=4 7498 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Br 2230a_100000184654_100000205941 [0,0,1,0,0,1|2,0,0]=4 7499 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Br 2230a_100000225794_100000184730 [0,0,1,0,0,1|2,0,0]=4 7500 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Br 269982a_100000184654_100000205941 [0,0,1,0,0,1|2,0,0]=4 7501 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Br 269982a_100000225794_100000184730 [0,0,1,0,0,1|2,0,0]=4 7502 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Br 270004a_100000184654_100000743575 [0,0,1,0,0,1|2,0,0]=4 7503 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Br 270004a_100000225794_100000211189 [0,0,1,0,0,1|2,0,0]=4 7504 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Cl 2230a_100000184507_100000205941 [0,0,1,0,0,1|2,0,0]=4 7505 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Cl 2230a_100000225794_100000187162 [0,0,1,0,0,1|2,0,0]=4 7506 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Cl 269982a_100000184507_100000205941 [0,0,1,0,0,1|2,0,0]=4 7507 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Cl 269982a_100000225794_100000187162 [0,0,1,0,0,1|2,0,0]=4 7508 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Cl 270004a_100000184507_100000743575 [0,0,1,0,0,1|2,0,0]=4 7509 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2Cl 270004a_100000225794_100000210073 [0,0,1,0,0,1|2,0,0]=4 7510 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2F 2230a_100000225794_100000211605 [0,0,1,0,0,1|2,0,0]=4 7511 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2F 2230a_100000742528_100000205941 [0,0,1,0,0,1|2,0,0]=4 7512 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2F 269982a_100000225794_100000211605 [0,0,1,0,0,1|2,0,0]=4 7513 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2F 269982a_100000742528_100000205941 [0,0,1,0,0,1|2,0,0]=4 7514 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2F 270004a_100000225794_100000210811 [0,0,1,0,0,1|2,0,0]=4 7515 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2F 270004a_100000742528_100000743575 [0,0,1,0,0,1|2,0,0]=4 7516 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2F 34a_100000742528_100000205941 [0,0,1,0,0,1|2,0,0]=4 7517 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2I 2230a_100000225794_100011215278 [0,0,1,0,0,1|2,0,0]=4 7518 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2I 269982a_100000225794_100011215278 [0,0,1,0,0,1|2,0,0]=4 7519 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2I 270004a_100000225794_100000010305 [0,0,1,0,0,1|2,0,0]=4 7520 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2O 2230a_100015189988_100000205941 [0,0,1,0,0,1|2,0,0]=4 7521 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2O 269982a_100015189988_100000205941 [0,0,1,0,0,1|2,0,0]=4 7522 B17R2.3431 CN(Cc1cscn1)Cc2ccccc2O 270004a_100015189988_100000743575 [0,0,1,0,0,1|2,0,0]=4 7523 B17R2.3431 Cc1ccccc1CC(=O)Cc2c[nH]cn2 1458a_100000212180_100000707719 [0,0,1,0,0,1|2,0,0]=4 7524 B17R2.3431 Cc1ccccc1CC(=O)Cc2c[nH]cn2 1458a_100015291406_100000211839 [0,0,1,0,0,1|2,0,0]=4 7525 B17R2.3431 Cc1ccccc1CN(C)Cc2c[nH]cn2 2230a_100000184421_100000707719 [0,0,1,0,0,1|0,0,0]=2 7526 B17R2.3431 Cc1ccccc1CN(C)Cc2c[nH]cn2 269982a_100000184421_100000707719 [0,0,1,0,0,1|0,0,0]=2 7527 B17R2.3431 Cc1ccccc1CN(C)Cc2cc[nH]n2 270004a_100000184421_100000738523 [0,0,1,0,0,1|2,0,0]=4 7528 B17R2.3431 Cc1ccccc1CN(C)Cc2ccco2 2230a_100000185268_100000211839 [0,0,1,0,0,1|2,0,0]=4 7529 B17R2.3431 Cc1ccccc1CN(C)Cc2ccco2 269982a_100000185268_100000211839 [0,0,1,0,0,1|2,0,0]=4 7530 B17R2.3431 Cc1ccccc1CN(C)Cc2ccco2 270004a_100000184421_100000186105 [0,0,1,0,0,1|2,0,0]=4 7531 B17R2.3431 Cc1ccccc1CN(C)Cc2ccco2 270004a_100000185268_100000211143 [0,0,1,0,0,1|2,0,0]=4 7532 B17R2.3431 Cc1ccccc1CN(C)Cc2cccs2 2230a_100000184426_100000211839 [0,0,1,0,0,1|2,0,0]=4 7533 B17R2.3431 Cc1ccccc1CN(C)Cc2cccs2 269982a_100000184426_100000211839 [0,0,1,0,0,1|2,0,0]=4 7534 B17R2.3431 Cc1ccccc1CN(C)Cc2cccs2 270004a_100000184421_100000209959 [0,0,1,0,0,1|2,0,0]=4 7535 B17R2.3431 Cc1ccccc1CN(C)Cc2cccs2 270004a_100000184426_100000211143 [0,0,1,0,0,1|2,0,0]=4 7536 B17R2.3431 Cc1ccccc1CN(C)Cc2ccoc2 270004a_100000184421_100011215517 [0,0,1,0,0,1|2,0,0]=4 7537 B17R2.3431 Cc1ccccc1CN(C)Cc2ccon2 2230a_100000184421_100000234950 [0,0,1,0,0,1|2,0,0]=4 7538 B17R2.3431 Cc1ccccc1CN(C)Cc2ccon2 2230a_100000757864_100000211839 [0,0,1,0,0,1|2,0,0]=4 7539 B17R2.3431 Cc1ccccc1CN(C)Cc2ccon2 269982a_100000184421_100000234950 [0,0,1,0,0,1|2,0,0]=4 7540 B17R2.3431 Cc1ccccc1CN(C)Cc2ccon2 269982a_100000757864_100000211839 [0,0,1,0,0,1|2,0,0]=4 7541 B17R2.3431 Cc1ccccc1CN(C)Cc2ccon2 270004a_100000757864_100000211143 [0,0,1,0,0,1|2,0,0]=4 7542 B17R2.3431 Cc1ccccc1CN(C)Cc2ccsc2 2230a_100000184421_100011261437 [0,0,1,0,0,1|2,0,0]=4 7543 B17R2.3431 Cc1ccccc1CN(C)Cc2ccsc2 2230a_100020654213_100000211839 [0,0,1,0,0,1|2,0,0]=4 7544 B17R2.3431 Cc1ccccc1CN(C)Cc2ccsc2 269982a_100000184421_100011233845 [0,0,1,0,0,1|2,0,0]=4 7545 B17R2.3431 Cc1ccccc1CN(C)Cc2ccsc2 269982a_100020654213_100000211839 [0,0,1,0,0,1|2,0,0]=4 7546 B17R2.3431 Cc1ccccc1CN(C)Cc2ccsc2 270004a_100000184421_100000188534 [0,0,1,0,0,1|2,0,0]=4 7547 B17R2.3431 Cc1ccccc1CN(C)Cc2ccsc2 270004a_100020654213_100000211143 [0,0,1,0,0,1|2,0,0]=4 7548 B17R2.3431 Cc1ccccc1CN(C)Cc2cn[nH]c2 270004a_100000184421_100016992096 [0,0,1,0,0,1|2,0,0]=4 7549 B17R2.3431 Cc1ccccc1CN(C)Cc2cnco2 270004a_100000184421_100000064291 [0,0,1,0,0,1|1,0,1]=4 7550 B17R2.3431 Cc1ccccc1CN(C)Cc2cncs2 2230a_100000184421_100015185245 [0,0,1,0,0,1|1,0,1]=4 7551 B17R2.3431 Cc1ccccc1CN(C)Cc2cncs2 269982a_100000184421_100015185245 [0,0,1,0,0,1|1,0,1]=4 7552 B17R2.3431 Cc1ccccc1CN(C)Cc2cncs2 270004a_100000184421_100000749870 [0,0,1,0,0,1|1,0,1]=4 7553 B17R2.3431 Cc1ccccc1CN(C)Cc2cocn2 270004a_100000184421_100000050382 [0,0,1,0,0,1|1,0,0]=3 7554 B17R2.3431 Cc1ccccc1CN(C)Cc2cscn2 2230a_100000184421_100000205941 [0,0,1,0,0,1|1,0,0]=3 7555 B17R2.3431 Cc1ccccc1CN(C)Cc2cscn2 2230a_100000225794_100000211839 [0,0,1,0,0,1|1,0,0]=3 7556 B17R2.3431 Cc1ccccc1CN(C)Cc2cscn2 269982a_100000184421_100000205941 [0,0,1,0,0,1|1,0,0]=3 7557 B17R2.3431 Cc1ccccc1CN(C)Cc2cscn2 269982a_100000225794_100000211839 [0,0,1,0,0,1|1,0,0]=3 7558 B17R2.3431 Cc1ccccc1CN(C)Cc2cscn2 270004a_100000184421_100000743575 [0,0,1,0,0,1|1,0,0]=3 7559 B17R2.3431 Cc1ccccc1CN(C)Cc2cscn2 270004a_100000225794_100000211143 [0,0,1,0,0,1|1,0,0]=3 7560 B17R2.3431 Cc1ccccc1CN(C)Cc2csnn2 270004a_100000184421_100000738508 [0,0,1,0,0,1|2,0,0]=4 7561 B17R2.3431 Cc1ccccc1CN(C)Cc2ncc[nH]2 2230a_100000184421_100016991755 [0,0,1,0,0,1|2,0,0]=4 7562 B17R2.3431 Cc1ccccc1CN(C)Cc2ncc[nH]2 2230a_100015184136_100000211839 [0,0,1,0,0,1|2,0,0]=4 7563 B17R2.3431 Cc1ccccc1CN(C)Cc2ncc[nH]2 269982a_100000184421_100016991755 [0,0,1,0,0,1|2,0,0]=4 7564 B17R2.3431 Cc1ccccc1CN(C)Cc2ncc[nH]2 269982a_100015184136_100000211839 [0,0,1,0,0,1|2,0,0]=4 7565 B17R2.3431 Cc1ccccc1CN(C)Cc2ncc[nH]2 270004a_100015184136_100000211143 [0,0,1,0,0,1|2,0,0]=4 7566 B17R2.3431 Cc1ccccc1CN(C)Cc2ncco2 2230a_100000184421_103436540062 [0,0,1,0,0,1|2,0,0]=4 7567 B17R2.3431 Cc1ccccc1CN(C)Cc2ncco2 269982a_100000184421_103436540062 [0,0,1,0,0,1|2,0,0]=4 7568 B17R2.3431 Cc1ccccc1CN(C)Cc2ncco2 270004a_100000184421_100000064290 [0,0,1,0,0,1|2,0,0]=4 7569 B17R2.3431 Cc1ccccc1CN(C)Cc2nccs2 2230a_100000184421_100015184050 [0,0,1,0,0,1|2,0,0]=4 7570 B17R2.3431 Cc1ccccc1CN(C)Cc2nccs2 2230a_100000765864_100000211839 [0,0,1,0,0,1|2,0,0]=4 7571 B17R2.3431 Cc1ccccc1CN(C)Cc2nccs2 269982a_100000184421_100015184050 [0,0,1,0,0,1|2,0,0]=4 7572 B17R2.3431 Cc1ccccc1CN(C)Cc2nccs2 269982a_100000765864_100000211839 [0,0,1,0,0,1|2,0,0]=4 7573 B17R2.3431 Cc1ccccc1CN(C)Cc2nccs2 270004a_100000184421_100000750902 [0,0,1,0,0,1|2,0,0]=4 7574 B17R2.3431 Cc1ccccc1CN(C)Cc2nccs2 270004a_100000765864_100000211143 [0,0,1,0,0,1|2,0,0]=4 7575 B17R2.3431 Cc1ccccc1CN(C)Cc2ncon2 269982a_100000184421_100000233494 [0,0,1,0,0,1|2,0,0]=4 7576 B17R2.3431 Cc1ccccc1CN(C)Cc2ncon2 269982a_100000697192_100000211839 [0,0,1,0,0,1|2,0,0]=4 7577 B17R2.3431 Cc1ccccc1CN(C)Cn2cncn2 2230a_100000184421_200020645497 [0,0,1,0,0,1|1,0,1]=4 7578 B17R2.3431 Cc1ccccc1CN(C)Cn2cncn2 269982a_100000184421_200020645497 [0,0,1,0,0,1|1,0,1]=4 7579 B17R2.3431 Cc1ccccc1NC(=O)Cc2c[nH]cn2 22a_100015192222_100015291406 [0,0,1,0,0,1|2,0,0]=4 7580 B17R2.3431 Cc1cccnc1CN(C)Cc2cscn2 2230a_100000225794_100000696600 [0,0,1,0,0,1|2,0,0]=4 7581 B17R2.3431 Cc1cccnc1CN(C)Cc2cscn2 269982a_100000225794_100000696600 [0,0,1,0,0,1|2,0,0]=4 7582 B17R2.3431 Cc1cccnc1CN(C)Cc2cscn2 270004a_100000225794_100000698913 [0,0,1,0,0,1|2,0,0]=4 7583 B17R2.3431 Cc1ccncc1CN(C)Cc2cscn2 2230a_100000225794_100000690890 [0,0,1,0,0,1|2,0,0]=4 7584 B17R2.3431 Cc1ccncc1CN(C)Cc2cscn2 269982a_100000225794_100000690890 [0,0,1,0,0,1|2,0,0]=4 7585 B17R2.3431 Cc1ccncc1CN(C)Cc2cscn2 270004a_100000225794_100000685662 [0,0,1,0,0,1|2,0,0]=4 7586 B17R2.3431 Cc1cnccc1CN(C)Cc2c[nH]cn2 2230a_100015187836_100000707719 [0,0,1,0,0,1|1,0,0]=3 7587 B17R2.3431 Cc1cnccc1CN(C)Cc2c[nH]cn2 269982a_100015187836_100000707719 [0,0,1,0,0,1|1,0,0]=3 7588 B17R2.3431 Cc1cnccc1CN(C)Cc2cocn2 270004a_100015187836_100000050382 [0,0,1,0,0,1|2,0,0]=4 7589 B17R2.3431 Cc1cnccc1CN(C)Cc2cscn2 2230a_100000225794_100020672808 [0,0,1,0,0,1|2,0,0]=4 7590 B17R2.3431 Cc1cnccc1CN(C)Cc2cscn2 2230a_100015187836_100000205941 [0,0,1,0,0,1|2,0,0]=4 7591 B17R2.3431 Cc1cnccc1CN(C)Cc2cscn2 269982a_100000225794_100020672808 [0,0,1,0,0,1|2,0,0]=4 7592 B17R2.3431 Cc1cnccc1CN(C)Cc2cscn2 269982a_100015187836_100000205941 [0,0,1,0,0,1|2,0,0]=4 7593 B17R2.3431 Cc1cnccc1CN(C)Cc2cscn2 270004a_100015187836_100000743575 [0,0,1,0,0,1|2,0,0]=4 7594 B17R2.3431 Cc1ncccc1CN(C)Cc2c[nH]cn2 2230a_200011875998_100000707719 [0,0,1,0,0,1|1,0,0]=3 7595 B17R2.3431 Cc1ncccc1CN(C)Cc2c[nH]cn2 269982a_200011875998_100000707719 [0,0,1,0,0,1|1,0,0]=3 7596 B17R2.3431 Cc1ncccc1CN(C)Cc2cocn2 270004a_200011875998_100000050382 [0,0,1,0,0,1|2,0,0]=4 7597 B17R2.3431 Cc1ncccc1CN(C)Cc2cscn2 2230a_100000225794_100000732876 [0,0,1,0,0,1|2,0,0]=4 7598 B17R2.3431 Cc1ncccc1CN(C)Cc2cscn2 2230a_200011875998_100000205941 [0,0,1,0,0,1|2,0,0]=4 7599 B17R2.3431 Cc1ncccc1CN(C)Cc2cscn2 269982a_100000225794_100000732876 [0,0,1,0,0,1|2,0,0]=4 7600 B17R2.3431 Cc1ncccc1CN(C)Cc2cscn2 269982a_200011875998_100000205941 [0,0,1,0,0,1|2,0,0]=4 7601 B17R2.3431 Cc1ncccc1CN(C)Cc2cscn2 270004a_100000225794_100000751968 [0,0,1,0,0,1|2,0,0]=4 7602 B17R2.3431 Cc1ncccc1CN(C)Cc2cscn2 270004a_200011875998_100000743575 [0,0,1,0,0,1|2,0,0]=4 7603 B17R2.3950 CC(NCc1c[nH]cn1)c2ccccc2Br 2230a_100000181357_100000707719 [0,0,1,0,0,1|2,0,0]=4 7604 B17R2.3950 CC(NCc1c[nH]cn1)c2ccccc2Cl 2230a_100000174978_100000707719 [0,0,1,0,0,1|2,0,0]=4 7605 B17R2.3950 CC(NCc1c[nH]cn1)c2ccccc2Cl 34a_100000174978_100000707719 [0,0,1,0,0,1|2,0,0]=4 7606 B17R2.3950 CC(NCc1c[nH]cn1)c2ccccc2F 2230a_100000181408_100000707719 [0,0,1,0,0,1|2,0,0]=4 7607 B17R2.3950 CC(NCc1c[nH]cn1)c2ccccc2F 34a_100000181408_100000707719 [0,0,1,0,0,1|2,0,0]=4 7608 B17R2.3950 CC(OCc1c[nH]cn1)c2ccccc2Br 34a_100000702211_100000707719 [0,0,1,0,0,1|2,0,0]=4 7609 B17R2.3950 CC(OCc1c[nH]cn1)c2ccccc2Cl 34a_100000740796_100000707719 [0,0,1,0,0,1|2,0,0]=4 7610 B17R2.3950 CC(OCc1c[nH]cn1)c2ccccc2F 34a_100000697922_100000707719 [0,0,1,0,0,1|2,0,0]=4 7611 B17R2.3950 CC(SCc1c[nH]cn1)c2ccccc2Cl 62a_100000181259_100000707719 [0,0,1,0,0,1|2,0,0]=4 7612 B17R2.3950 CC(SCc1c[nH]cn1)c2ccccc2Cl 62a_100000707719_100000181259 [0,0,1,0,0,1|2,0,0]=4 7613 B17R2.3950 CC(SCc1c[nH]cn1)c2ccccc2F 62a_100000707719_200000741388 [0,0,1,0,0,1|2,0,0]=4 7614 B17R2.3950 CC(SCc1c[nH]cn1)c2ccccc2F 62a_200000741388_100000707719 [0,0,1,0,0,1|2,0,0]=4 7615 B17R2.3950 CN(CCc1c[nH]cn1)c2ccccc2Br 2230a_100020606079_100020628418 [0,0,1,0,0,1|1,0,0]=3 7616 B17R2.3950 CN(CCc1c[nH]cn1)c2ccccc2Br 269982a_100020606079_100020628418 [0,0,1,0,0,1|1,0,0]=3 7617 B17R2.3950 CN(CCc1c[nH]cn1)c2ccccc2Cl 2230a_100000219374_100020628418 [0,0,1,0,0,1|1,0,0]=3 7618 B17R2.3950 CN(CCc1c[nH]cn1)c2ccccc2Cl 269982a_100000219374_100020628418 [0,0,1,0,0,1|1,0,0]=3 7619 B17R2.3950 CN(CCc1c[nH]cn1)c2ccccc2F 2230a_100000220357_100020628418 [0,0,1,0,0,1|1,0,0]=3 7620 B17R2.3950 CN(CCc1c[nH]cn1)c2ccccc2F 269982a_100000220357_100020628418 [0,0,1,0,0,1|1,0,0]=3 7621 B17R2.3950 CN(CCc1c[nH]cn1)c2ccccc2O 269982a_100000033821_100020628418 [0,0,1,0,0,1|1,0,0]=3 7622 B17R2.3950 C[C@@H](NCc1c[nH]cn1)c2ccccc2O 2230a_100025703389_100000707719 [0,0,1,0,0,1|2,0,0]=4 7623 B17R2.3950 Cc1ccccc1C(=O)CCc2c[nH]cn2 1458a_100000212026_100020628418 [0,0,1,0,0,1|2,0,0]=4 7624 B17R2.3950 Cc1ccccc1C(=O)CSc2c[nH]cn2 62a_100000741374_100000756875 [0,0,1,0,0,1|2,0,0]=4 7625 B17R2.3950 Cc1ccccc1C(=O)CSc2c[nH]cn2 62a_100000756875_100000741374 [0,0,1,0,0,1|2,0,0]=4 7626 B17R2.3950 Cc1ccccc1C(=O)NCc2c[nH]cn2 11a_100000758547_100000212026 [0,0,1,0,0,1|2,0,0]=4 7627 B17R2.3950 Cc1ccccc1C(=O)NCc2c[nH]cn2 240690a_100000758547_100000212026 [0,0,1,0,0,1|2,0,0]=4 7628 B17R2.3950 Cc1ccccc1C(=O)NCc2c[nH]cn2 527a_100000758547_100000212026 [0,0,1,0,0,1|2,0,0]=4 7629 B17R2.3950 Cc1ccccc1C(C)NCc2c[nH]cn2 2230a_100000181355_100000707719 [0,0,1,0,0,1|1,0,0]=3 7630 B17R2.3950 Cc1ccccc1C(C)NCc2c[nH]cn2 34a_100000181355_100000707719 [0,0,1,0,0,1|1,0,0]=3 7631 B17R2.3950 Cc1ccccc1C(C)NCc2cocn2 269862a_100015188801_100000211656 [0,0,1,0,0,1|2,0,0]=4 7632 B17R2.3950 Cc1ccccc1C(C)NCc2cocn2 270004a_100000181355_100000050382 [0,0,1,0,0,1|2,0,0]=4 7633 B17R2.3950 Cc1ccccc1C(C)NCc2cscn2 207a_100000181355_100000743575 [0,0,1,0,0,1|2,0,0]=4 7634 B17R2.3950 Cc1ccccc1C(C)NCc2cscn2 2230a_100000181355_100000205941 [0,0,1,0,0,1|2,0,0]=4 7635 B17R2.3950 Cc1ccccc1C(C)NCc2cscn2 269862a_100015185402_100000211656 [0,0,1,0,0,1|2,0,0]=4 7636 B17R2.3950 Cc1ccccc1C(C)NCc2cscn2 270004a_100000181355_100000743575 [0,0,1,0,0,1|2,0,0]=4 7637 B17R2.3950 Cc1ccccc1C(C)NCc2cscn2 34a_100000181355_100000205941 [0,0,1,0,0,1|2,0,0]=4 7638 B17R2.3950 Cc1ccccc1C(C)OCc2c[nH]cn2 34a_100000742021_100000707719 [0,0,1,0,0,1|1,0,0]=3 7639 B17R2.3950 Cc1ccccc1C(C)OCc2cscn2 34a_100000742021_100000205941 [0,0,1,0,0,1|2,0,0]=4 7640 B17R2.3950 Cc1ccccc1C(C)OCc2cscn2 7a_100000742021_100000205941 [0,0,1,0,0,1|2,0,0]=4 7641 B17R2.3950 Cc1ccccc1N(C)CCc2c[nH]cn2 2230a_100000219699_100020628418 [0,0,1,0,0,1|0,0,0]=2 7642 B17R2.3950 Cc1ccccc1N(C)CCc2c[nH]cn2 269982a_100000219699_100020628418 [0,0,1,0,0,1|0,0,0]=2 7643 B17R2.3950 Cc1ccccc1N(C)CCc2cccs2 2230a_100000219699_100000748579 [0,0,1,0,0,1|2,0,0]=4 7644 B17R2.3950 Cc1ccccc1N(C)CCc2cccs2 269982a_100000219699_100000748579 [0,0,1,0,0,1|2,0,0]=4 7645 B17R2.3950 Cc1ccccc1N(C)CCc2cccs2 34a_100000219699_100000748579 [0,0,1,0,0,1|2,0,0]=4 7646 B17R2.3950 Cc1ccccc1N(C)CCc2cn[nH]c2 2230a_100000219699_100000743252 [0,0,1,0,0,1|2,0,0]=4 7647 B17R2.3950 Cc1ccccc1N(C)CCc2cn[nH]c2 269982a_100000219699_100000743252 [0,0,1,0,0,1|2,0,0]=4 7648 B17R2.3950 Cc1ccccc1N(C)CCn2cccn2 2230a_100000219699_100000685285 [0,0,1,0,0,1|2,0,0]=4 7649 B17R2.3950 Cc1ccccc1N(C)CCn2cccn2 269982a_100000219699_100000685285 [0,0,1,0,0,1|2,0,0]=4 7650 B17R2.3950 Cc1ccccc1N(C)CCn2cccn2 34a_100000219699_100015204718 [0,0,1,0,0,1|2,0,0]=4 7651 B17R2.3950 Cc1ccccc1N(C)CCn2cncn2 2230a_100000219699_100000731791 [0,0,1,0,0,1|1,0,1]=4 7652 B17R2.3950 Cc1ccccc1N(C)CCn2cncn2 269982a_100000219699_100000731791 [0,0,1,0,0,1|1,0,1]=4 7653 B17R2.3950 Cc1ccccc1N(C)CCn2cncn2 34a_100000219699_200000749826 [0,0,1,0,0,1|1,0,1]=4 7654 B17R2.3950 Cc1cccnc1C(C)NCc2c[nH]cn2 2230a_100011536111_100000707719 [0,0,1,0,0,1|2,0,0]=4 7655 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3c[nH]cn3 2230a_100000059810_100000707719 [0,0,0,0,0,2|0,0,0]=2 7656 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3c[nH]cn3 269982a_100000059810_100000707719 [0,0,0,0,0,2|0,0,0]=2 7657 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3c[nH]cn3 34a_100000059810_100000707719 [0,0,0,0,0,2|0,0,0]=2 7658 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cc[nH]n3 270004a_100000059810_100000738523 [0,0,0,0,0,2|2,0,0]=4 7659 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ccoc3 270004a_100000059810_100011215517 [0,0,0,0,0,2|2,0,0]=4 7660 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ccon3 2230a_100000059810_100000234950 [0,0,0,0,0,2|2,0,0]=4 7661 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ccon3 269982a_100000059810_100000234950 [0,0,0,0,0,2|2,0,0]=4 7662 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ccon3 34a_100000059810_100000234950 [0,0,0,0,0,2|2,0,0]=4 7663 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ccsc3 2230a_100000059810_100011261437 [0,0,0,0,0,2|2,0,0]=4 7664 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ccsc3 269982a_100000059810_100011233845 [0,0,0,0,0,2|2,0,0]=4 7665 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ccsc3 270004a_100000059810_100000188534 [0,0,0,0,0,2|2,0,0]=4 7666 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ccsc3 34a_100000059810_100011261437 [0,0,0,0,0,2|2,0,0]=4 7667 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cn[nH]c3 270004a_100000059810_100016992096 [0,0,0,0,0,2|2,0,0]=4 7668 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cnco3 270004a_100000059810_100000064291 [0,0,0,0,0,2|1,0,1]=4 7669 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cncs3 2230a_100000059810_100015185245 [0,0,0,0,0,2|1,0,1]=4 7670 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cncs3 269982a_100000059810_100015185245 [0,0,0,0,0,2|1,0,1]=4 7671 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cncs3 270004a_100000059810_100000749870 [0,0,0,0,0,2|1,0,1]=4 7672 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cncs3 34a_100000059810_100015185245 [0,0,0,0,0,2|1,0,1]=4 7673 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cocn3 270004a_100000059810_100000050382 [0,0,0,0,0,2|1,0,0]=3 7674 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cscn3 2230a_100000059810_100000205941 [0,0,0,0,0,2|1,0,0]=3 7675 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cscn3 269982a_100000059810_100000205941 [0,0,0,0,0,2|1,0,0]=3 7676 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cscn3 270004a_100000059810_100000743575 [0,0,0,0,0,2|1,0,0]=3 7677 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3cscn3 34a_100000059810_100000205941 [0,0,0,0,0,2|1,0,0]=3 7678 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3csnn3 270004a_100000059810_100000738508 [0,0,0,0,0,2|2,0,0]=4 7679 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncc[nH]3 2230a_100000059810_100016991755 [0,0,0,0,0,2|2,0,0]=4 7680 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncc[nH]3 269982a_100000059810_100016991755 [0,0,0,0,0,2|2,0,0]=4 7681 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncc[nH]3 34a_100000059810_100016991755 [0,0,0,0,0,2|2,0,0]=4 7682 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncco3 2230a_100000059810_103436540062 [0,0,0,0,0,2|2,0,0]=4 7683 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncco3 269982a_100000059810_103436540062 [0,0,0,0,0,2|2,0,0]=4 7684 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncco3 270004a_100000059810_100000064290 [0,0,0,0,0,2|2,0,0]=4 7685 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncco3 34a_100000059810_103436540062 [0,0,0,0,0,2|2,0,0]=4 7686 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3nccs3 2230a_100000059810_100015184050 [0,0,0,0,0,2|2,0,0]=4 7687 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3nccs3 269982a_100000059810_100015184050 [0,0,0,0,0,2|2,0,0]=4 7688 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3nccs3 270004a_100000059810_100000750902 [0,0,0,0,0,2|2,0,0]=4 7689 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3nccs3 34a_100000059810_100015184050 [0,0,0,0,0,2|2,0,0]=4 7690 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncon3 269982a_100000059810_100000233494 [0,0,0,0,0,2|2,0,0]=4 7691 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cc3ncon3 34a_100000059810_100000233494 [0,0,0,0,0,2|2,0,0]=4 7692 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cn3cncn3 2230a_100000059810_200020645497 [0,0,0,0,0,2|1,0,1]=4 7693 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cn3cncn3 269982a_100000059810_200020645497 [0,0,0,0,0,2|1,0,1]=4 7694 B19R3.2360 c1ccc2c(c1)CCCN(C2)Cn3cncn3 34a_100000059810_200020645497 [0,0,0,0,0,2|1,0,1]=4 7695 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3c[nH]cn3 2230a_100000744108_100000707719 [0,0,0,0,0,2|0,0,0]=2 7696 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3c[nH]cn3 269982a_100000744108_100000707719 [0,0,0,0,0,2|0,0,0]=2 7697 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3c[nH]cn3 34a_100000744108_100000707719 [0,0,0,0,0,2|0,0,0]=2 7698 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cc[nH]n3 270004a_100000744108_100000738523 [0,0,0,0,0,2|2,0,0]=4 7699 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ccoc3 270004a_100000744108_100011215517 [0,0,0,0,0,2|2,0,0]=4 7700 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ccon3 2230a_100000744108_100000234950 [0,0,0,0,0,2|2,0,0]=4 7701 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ccon3 269982a_100000744108_100000234950 [0,0,0,0,0,2|2,0,0]=4 7702 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ccon3 34a_100000744108_100000234950 [0,0,0,0,0,2|2,0,0]=4 7703 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ccsc3 2230a_100000744108_100011261437 [0,0,0,0,0,2|2,0,0]=4 7704 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ccsc3 269982a_100000744108_100011233845 [0,0,0,0,0,2|2,0,0]=4 7705 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ccsc3 270004a_100000744108_100000188534 [0,0,0,0,0,2|2,0,0]=4 7706 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ccsc3 34a_100000744108_100011261437 [0,0,0,0,0,2|2,0,0]=4 7707 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cn[nH]c3 270004a_100000744108_100016992096 [0,0,0,0,0,2|2,0,0]=4 7708 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cnco3 270004a_100000744108_100000064291 [0,0,0,0,0,2|1,0,1]=4 7709 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cncs3 2230a_100000744108_100015185245 [0,0,0,0,0,2|1,0,1]=4 7710 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cncs3 269982a_100000744108_100015185245 [0,0,0,0,0,2|1,0,1]=4 7711 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cncs3 270004a_100000744108_100000749870 [0,0,0,0,0,2|1,0,1]=4 7712 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cncs3 34a_100000744108_100015185245 [0,0,0,0,0,2|1,0,1]=4 7713 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cocn3 270004a_100000744108_100000050382 [0,0,0,0,0,2|1,0,0]=3 7714 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cscn3 2230a_100000744108_100000205941 [0,0,0,0,0,2|1,0,0]=3 7715 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cscn3 269982a_100000744108_100000205941 [0,0,0,0,0,2|1,0,0]=3 7716 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cscn3 270004a_100000744108_100000743575 [0,0,0,0,0,2|1,0,0]=3 7717 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3cscn3 34a_100000744108_100000205941 [0,0,0,0,0,2|1,0,0]=3 7718 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3csnn3 270004a_100000744108_100000738508 [0,0,0,0,0,2|2,0,0]=4 7719 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncc[nH]3 2230a_100000744108_100016991755 [0,0,0,0,0,2|2,0,0]=4 7720 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncc[nH]3 269982a_100000744108_100016991755 [0,0,0,0,0,2|2,0,0]=4 7721 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncc[nH]3 34a_100000744108_100016991755 [0,0,0,0,0,2|2,0,0]=4 7722 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncco3 2230a_100000744108_103436540062 [0,0,0,0,0,2|2,0,0]=4 7723 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncco3 269982a_100000744108_103436540062 [0,0,0,0,0,2|2,0,0]=4 7724 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncco3 270004a_100000744108_100000064290 [0,0,0,0,0,2|2,0,0]=4 7725 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncco3 34a_100000744108_103436540062 [0,0,0,0,0,2|2,0,0]=4 7726 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3nccs3 2230a_100000744108_100015184050 [0,0,0,0,0,2|2,0,0]=4 7727 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3nccs3 269982a_100000744108_100015184050 [0,0,0,0,0,2|2,0,0]=4 7728 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3nccs3 270004a_100000744108_100000750902 [0,0,0,0,0,2|2,0,0]=4 7729 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3nccs3 34a_100000744108_100015184050 [0,0,0,0,0,2|2,0,0]=4 7730 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncon3 269982a_100000744108_100000233494 [0,0,0,0,0,2|2,0,0]=4 7731 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cc3ncon3 34a_100000744108_100000233494 [0,0,0,0,0,2|2,0,0]=4 7732 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cn3cncn3 2230a_100000744108_200020645497 [0,0,0,0,0,2|1,0,1]=4 7733 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cn3cncn3 269982a_100000744108_200020645497 [0,0,0,0,0,2|1,0,1]=4 7734 B19R3.2360 c1ccc2c(c1)CN(CCO2)Cn3cncn3 34a_100000744108_200020645497 [0,0,0,0,0,2|1,0,1]=4 7735 B19R3.2360 c1coc(c1)CN2CCCc3ccccc3C2 270004a_100000059810_100000186105 [0,0,0,0,0,2|2,0,0]=4 7736 B19R3.2360 c1coc(c1)CN2CCOc3ccccc3C2 270004a_100000744108_100000186105 [0,0,0,0,0,2|2,0,0]=4 7737 B19R3.2360 c1csc(c1)CN2CCCc3ccccc3C2 270004a_100000059810_100000209959 [0,0,0,0,0,2|2,0,0]=4 7738 B19R3.2360 c1csc(c1)CN2CCOc3ccccc3C2 270004a_100000744108_100000209959 [0,0,0,0,0,2|2,0,0]=4 7739 B19R3.4444 c1cc2c(cn1)CCCC2NCc3c[nH]cn3 2230a_100020634316_100000707719 [0,0,0,0,0,2|2,0,0]=4 7740 B19R3.4444 c1ccc2c(c1)CCCC2NCc3cocn3 269862a_100015188801_100000210882 [0,0,0,0,0,2|2,0,0]=4 7741 B19R3.4444 c1ccc2c(c1)CCCC2NCc3cscn3 269862a_100015185402_100000210882 [0,0,0,0,0,2|2,0,0]=4 7742 B19R3.4444 c1ccc2c(c1)CCCC2OCc3c[nH]cn3 34a_100000183665_100000707719 [0,0,0,0,0,2|1,0,0]=3 7743 B19R3.4444 c1ccc2c(c1)CCCC2OCc3cscn3 34a_100000183665_100000205941 [0,0,0,0,0,2|2,0,0]=4 7744 B19R3.4444 c1ccc2c(c1)CCCC2OCc3cscn3 7a_100000183665_100000205941 [0,0,0,0,0,2|2,0,0]=4 7745 B19R3.4444 c1ccc2c(c1)CCC[C@@H]2NCc3c[nH]cn3 34a_100020654734_100000707719 [0,0,0,0,0,2|1,0,0]=3 7746 B19R3.4444 c1ccc2c(c1)CCC[C@@H]2NCc3cocn3 270004a_100020654734_100000050382 [0,0,0,0,0,2|2,0,0]=4 7747 B19R3.4444 c1ccc2c(c1)CCC[C@@H]2NCc3cscn3 207a_100020654734_100000743575 [0,0,0,0,0,2|2,0,0]=4 7748 B19R3.4444 c1ccc2c(c1)CCC[C@@H]2NCc3cscn3 270004a_100020654734_100000743575 [0,0,0,0,0,2|2,0,0]=4 7749 B19R3.4444 c1ccc2c(c1)CCC[C@@H]2NCc3cscn3 34a_100020654734_100000205941 [0,0,0,0,0,2|2,0,0]=4 7750 B19R3.4444 c1ccc2c(c1)COCC2NCc3cocn3 269862a_100015188801_100000117393 [0,0,0,0,0,2|2,0,0]=4 7751 B19R3.4444 c1ccc2c(c1)COCC2NCc3cscn3 269862a_100015185402_100000117393 [0,0,0,0,0,2|2,0,0]=4 7752 B19R3.4444 c1ccc2c(c1)COCC2OCc3c[nH]cn3 34a_100012179175_100000707719 [0,0,0,0,0,2|1,0,0]=3 7753 B19R3.4444 c1ccc2c(c1)COCC2OCc3cscn3 34a_100012179175_100000205941 [0,0,0,0,0,2|2,0,0]=4 7754 B19R3.4444 c1ccc2c(c1)OCCC2NCc3c[nH]cn3 2230a_100015190321_100000707719 [0,0,0,0,0,2|1,0,0]=3 7755 B19R3.4444 c1ccc2c(c1)OCCC2NCc3cocn3 270004a_100015190321_100000050382 [0,0,0,0,0,2|2,0,0]=4 7756 B19R3.4444 c1ccc2c(c1)OCCC2NCc3cscn3 207a_100015190321_100000743575 [0,0,0,0,0,2|2,0,0]=4 7757 B19R3.4444 c1ccc2c(c1)OCCC2NCc3cscn3 2230a_100015190321_100000205941 [0,0,0,0,0,2|2,0,0]=4 7758 B19R3.4444 c1ccc2c(c1)OCCC2NCc3cscn3 270004a_100015190321_100000743575 [0,0,0,0,0,2|2,0,0]=4 7759 B19R3.4444 c1ccc2c(c1)OCCC2OCc3cscn3 7a_100000708930_100000205941 [0,0,0,0,0,2|2,0,0]=4 7760 B19R3.4444 c1ccc2c(c1)SCCC2NCc3cocn3 269862a_100015188801_100000183853 [0,0,0,0,0,2|2,0,0]=4 7761 B19R3.4444 c1ccc2c(c1)SCCC2NCc3cscn3 269862a_100015185402_100000183853 [0,0,0,0,0,2|2,0,0]=4 7762 B19R3.4444 c1cnc2c(c1)CCCC2NCc3c[nH]cn3 2230a_100011259139_100000707719 [0,0,0,0,0,2|2,0,0]=4 7763 B19R3.4444 c1cnc2c(c1)OCCC2NCc3c[nH]cn3 2230a_100009852857_100000707719 [0,0,0,0,0,2|2,0,0]=4 7764 B19R3.2370 c1ccc(nc1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100000209966 [0,0,0,0,0,2|2,0,0]=4 7765 B19R3.2370 c1ccc(nc1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100000721315 [0,0,0,0,0,2|2,0,0]=4 7766 B19R3.2370 c1ccc(nc1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100000209966 [0,0,0,0,0,2|2,0,0]=4 7767 B19R3.2370 c1ccc(nc1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100000721315 [0,0,0,0,0,2|2,0,0]=4 7768 B19R3.2370 c1ccc(nc1)COC2CCc3c2cccc3 34a_100000212247_100000721315 [0,0,0,0,0,2|2,0,0]=4 7769 B19R3.2370 c1ccc(nc1)COC2CCc3c2cccc3 7a_100000212247_100000721315 [0,0,0,0,0,2|2,0,0]=4 7770 B19R3.2370 c1ccc(nc1)CSC2CCc3c2cccc3 62a_100000721315_200000721974 [0,0,0,0,0,2|2,0,0]=4 7771 B19R3.2370 c1ccc2c(c1)CCC2CNc3ccncn3 27a_100020632452_100000703185 [0,0,0,0,0,2|1,0,1]=4 7772 B19R3.2370 c1ccc2c(c1)CCC2CNc3cnccn3 27a_100020632452_100000211759 [0,0,0,0,0,2|1,0,1]=4 7773 B19R3.2370 c1ccc2c(c1)CCC2NCc3cncnc3 2230a_100011243677_200000721974 [0,0,0,0,0,2|1,0,1]=4 7774 B19R3.2370 c1ccc2c(c1)CCC2NCc3cncnc3 269862a_100011243677_100000212051 [0,0,0,0,0,2|1,0,1]=4 7775 B19R3.2370 c1ccc2c(c1)CCC2OCc3cnccn3 34a_100000212247_100016995436 [0,0,0,0,0,2|1,0,1]=4 7776 B19R3.2370 c1ccc2c(c1)CCC2OCc3cnccn3 7a_100000212247_100016995436 [0,0,0,0,0,2|1,0,1]=4 7777 B19R3.2370 c1ccc2c(c1)CCC2OCc3cncnc3 34a_100000212247_100015196519 [0,0,0,0,0,2|1,0,1]=4 7778 B19R3.2370 c1ccc2c(c1)CCC2OCc3cncnc3 7a_100000212247_100015196519 [0,0,0,0,0,2|1,0,1]=4 7779 B19R3.2370 c1ccc2c(c1)CCC2SCc3cnccn3 62a_100016995436_200000721974 [0,0,0,0,0,2|1,0,1]=4 7780 B19R3.2370 c1ccc2c(c1)CCC2SCc3cncnc3 62a_100015196519_200000721974 [0,0,0,0,0,2|1,0,1]=4 7781 B19R3.2370 c1ccc2c(c1)CC[C@@H]2NCc3cnccn3 2230a_100016989578_100016995436 [0,0,0,0,0,2|1,0,1]=4 7782 B19R3.2370 c1ccc2c(c1)CC[C@@H]2NCc3cnccn3 270004a_100016989578_100000749867 [0,0,0,0,0,2|1,0,1]=4 7783 B19R3.2370 c1ccc2c(c1)CC[C@@H]2NCc3cnccn3 34a_100016989578_100016995436 [0,0,0,0,0,2|1,0,1]=4 7784 B19R3.2370 c1ccc2c(c1)CC[C@@H]2NCc3cncnc3 2230a_100016989578_100015196519 [0,0,0,0,0,2|1,0,1]=4 7785 B19R3.2370 c1ccc2c(c1)CC[C@@H]2NCc3cncnc3 270004a_100016989578_100000749868 [0,0,0,0,0,2|1,0,1]=4 7786 B19R3.2370 c1ccc2c(c1)CC[C@@H]2NCc3cncnc3 34a_100016989578_100015196519 [0,0,0,0,0,2|1,0,1]=4 7787 B19R3.2370 c1cnc(nc1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100000703007 [0,0,0,0,0,2|2,0,0]=4 7788 B19R3.2370 c1cnc(nc1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100011532527 [0,0,0,0,0,2|2,0,0]=4 7789 B19R3.2370 c1cnc(nc1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100000703007 [0,0,0,0,0,2|2,0,0]=4 7790 B19R3.2370 c1cnc(nc1)COC2CCc3c2cccc3 34a_100000212247_100000703007 [0,0,0,0,0,2|2,0,0]=4 7791 B19R3.2370 c1cnc(nc1)COC2CCc3c2cccc3 7a_100000212247_100000703007 [0,0,0,0,0,2|2,0,0]=4 7792 B19R3.2370 c1cnc(nc1)CSC2CCc3c2cccc3 62a_100000703007_200000721974 [0,0,0,0,0,2|2,0,0]=4 7793 B19R3.2370 c1cnc(nc1)NCC2CCc3c2cccc3 27a_100020632452_100000211032 [0,0,0,0,0,2|2,0,0]=4 7794 B19R3.2370 c1cncc(c1)CNC2CCc3c2cccc3 269862a_100000210453_100000212051 [0,0,0,0,0,2|2,0,0]=4 7795 B19R3.2370 c1cncc(c1)CN[C@H]2CCc3c2cccc3 207a_100016989578_100000209961 [0,0,0,0,0,2|2,0,0]=4 7796 B19R3.2370 c1cncc(c1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100000741622 [0,0,0,0,0,2|2,0,0]=4 7797 B19R3.2370 c1cncc(c1)CN[C@H]2CCc3c2cccc3 270004a_100016989578_100000209961 [0,0,0,0,0,2|2,0,0]=4 7798 B19R3.2370 c1cncc(c1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100000733263 [0,0,0,0,0,2|2,0,0]=4 7799 B19R3.2370 c1cncc(c1)COC2CCc3c2cccc3 34a_100000212247_100000733263 [0,0,0,0,0,2|2,0,0]=4 7800 B19R3.2370 c1cncc(c1)COC2CCc3c2cccc3 7a_100000212247_100000741622 [0,0,0,0,0,2|2,0,0]=4 7801 B19R3.2370 c1cncc(c1)CSC2CCc3c2cccc3 62a_100000741622_200000721974 [0,0,0,0,0,2|2,0,0]=4 7802 B19R3.2370 c1cnnc(c1)CNC2CCc3c2cccc3 2230a_100159270163_200000721974 [0,0,0,0,0,2|2,0,0]=4 7803 B19R3.2370 c1cnnc(c1)CNC2CCc3c2cccc3 269862a_100159270163_100000212051 [0,0,0,0,0,2|2,0,0]=4 7804 B19R3.2370 c1cnnc(c1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100016990269 [0,0,0,0,0,2|2,0,0]=4 7805 B19R3.2370 c1cnnc(c1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100016990269 [0,0,0,0,0,2|2,0,0]=4 7806 B19R3.2370 c1cnnc(c1)COC2CCc3c2cccc3 34a_100000212247_100016990269 [0,0,0,0,0,2|2,0,0]=4 7807 B19R3.2370 c1cnnc(c1)COC2CCc3c2cccc3 7a_100000212247_100016990269 [0,0,0,0,0,2|2,0,0]=4 7808 B19R3.2370 c1cnnc(c1)CSC2CCc3c2cccc3 62a_100016990269_200000721974 [0,0,0,0,0,2|2,0,0]=4 7809 B19R3.2370 c1cnnc(c1)NCC2CCc3c2cccc3 27a_100020632452_100016991348 [0,0,0,0,0,2|2,0,0]=4 7810 B19R3.19215 c1cc2c(cn1)CCN(C2)Cc3cncnc3 2230a_100020645890_100015196519 [0,0,0,0,0,2|1,0,1]=4 7811 B19R3.19215 c1cc2c(cn1)CCN(C2)Cc3cncnc3 269982a_100020645890_100016991940 [0,0,0,0,0,2|1,0,1]=4 7812 B19R3.19215 c1cc2c(cn1)CCN(C2)Cc3cncnc3 270004a_100020645890_100000749868 [0,0,0,0,0,2|1,0,1]=4 7813 B19R3.19215 c1cc2c(cn1)CN(CC2)Cc3cncnc3 2230a_100015190008_100015196519 [0,0,0,0,0,2|1,0,1]=4 7814 B19R3.19215 c1cc2c(cn1)CN(CC2)Cc3cncnc3 269982a_100015190008_100016991940 [0,0,0,0,0,2|1,0,1]=4 7815 B19R3.19215 c1cc2c(cn1)CN(CC2)Cc3cncnc3 270004a_100015190008_100000749868 [0,0,0,0,0,2|1,0,1]=4 7816 B19R3.19215 c1ccc(cc1)CN2CCc3ccccc3C2 2230a_100000188457_100015291786 [0,0,0,0,0,2|2,0,0]=4 7817 B19R3.19215 c1ccc(cc1)CN2CCc3ccccc3C2 269982a_100000188457_100000211182 [0,0,0,0,0,2|2,0,0]=4 7818 B19R3.19215 c1ccc(cc1)CN2CCc3ccccc3C2 270004a_100000188457_100015611070 [0,0,0,0,0,2|2,0,0]=4 7819 B19R3.19215 c1ccc(cc1)CN2CCc3ccccc3C2 34a_100000188457_100015291786 [0,0,0,0,0,2|2,0,0]=4 7820 B19R3.19215 c1ccc(nc1)CN2CCc3ccccc3C2 2230a_100000188457_100000721315 [0,0,0,0,0,2|1,0,0]=3 7821 B19R3.19215 c1ccc(nc1)CN2CCc3ccccc3C2 269982a_100000188457_100000721315 [0,0,0,0,0,2|1,0,0]=3 7822 B19R3.19215 c1ccc(nc1)CN2CCc3ccccc3C2 270004a_100000188457_100000209966 [0,0,0,0,0,2|1,0,0]=3 7823 B19R3.19215 c1ccc(nc1)CN2CCc3ccccc3C2 34a_100000188457_100000721315 [0,0,0,0,0,2|1,0,0]=3 7824 B19R3.19215 c1ccc(nc1)CN2CCc3cccnc3C2 2230a_100015206102_100000721315 [0,0,0,0,0,2|2,0,0]=4 7825 B19R3.19215 c1ccc(nc1)CN2CCc3cccnc3C2 269982a_100015206102_100000721315 [0,0,0,0,0,2|2,0,0]=4 7826 B19R3.19215 c1ccc(nc1)CN2CCc3cccnc3C2 270004a_100015206102_100000209966 [0,0,0,0,0,2|2,0,0]=4 7827 B19R3.19215 c1ccc(nc1)CN2CCc3ccncc3C2 2230a_100015190008_100000721315 [0,0,0,0,0,2|2,0,0]=4 7828 B19R3.19215 c1ccc(nc1)CN2CCc3ccncc3C2 269982a_100015190008_100000721315 [0,0,0,0,0,2|2,0,0]=4 7829 B19R3.19215 c1ccc(nc1)CN2CCc3ccncc3C2 270004a_100015190008_100000209966 [0,0,0,0,0,2|2,0,0]=4 7830 B19R3.19215 c1ccc(nc1)CN2CCc3cnccc3C2 2230a_100020645890_100000721315 [0,0,0,0,0,2|2,0,0]=4 7831 B19R3.19215 c1ccc(nc1)CN2CCc3cnccc3C2 269982a_100020645890_100000721315 [0,0,0,0,0,2|2,0,0]=4 7832 B19R3.19215 c1ccc(nc1)CN2CCc3cnccc3C2 270004a_100020645890_100000209966 [0,0,0,0,0,2|2,0,0]=4 7833 B19R3.19215 c1ccc(nc1)CN2CCc3ncccc3C2 2230a_100000699647_100000721315 [0,0,0,0,0,2|2,0,0]=4 7834 B19R3.19215 c1ccc(nc1)CN2CCc3ncccc3C2 269982a_100000699647_100000721315 [0,0,0,0,0,2|2,0,0]=4 7835 B19R3.19215 c1ccc(nc1)CN2CCc3ncccc3C2 270004a_100000699647_100000209966 [0,0,0,0,0,2|2,0,0]=4 7836 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3ccncc3 2230a_100000188457_100015193705 [0,0,0,0,0,2|1,0,1]=4 7837 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3ccncc3 269982a_100000188457_100015193705 [0,0,0,0,0,2|1,0,1]=4 7838 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3ccnnc3 270004a_100000188457_100011934578 [0,0,0,0,0,2|1,0,1]=4 7839 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3cnccn3 2230a_100000188457_100016995436 [0,0,0,0,0,2|0,0,1]=3 7840 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3cnccn3 269982a_100000188457_100016995436 [0,0,0,0,0,2|0,0,1]=3 7841 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3cnccn3 270004a_100000188457_100000749867 [0,0,0,0,0,2|0,0,1]=3 7842 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3cnccn3 34a_100000188457_100016995436 [0,0,0,0,0,2|0,0,1]=3 7843 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3cncnc3 2230a_100000188457_100015196519 [0,0,0,0,0,2|0,0,1]=3 7844 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3cncnc3 269982a_100000188457_100016991940 [0,0,0,0,0,2|0,0,1]=3 7845 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3cncnc3 270004a_100000188457_100000749868 [0,0,0,0,0,2|0,0,1]=3 7846 B19R3.19215 c1ccc2c(c1)CCN(C2)Cc3cncnc3 34a_100000188457_100015196519 [0,0,0,0,0,2|0,0,1]=3 7847 B19R3.19215 c1cnc(cn1)CN2CCc3ccncc3C2 2230a_100015190008_100016995436 [0,0,0,0,0,2|1,0,1]=4 7848 B19R3.19215 c1cnc(cn1)CN2CCc3ccncc3C2 269982a_100015190008_100016995436 [0,0,0,0,0,2|1,0,1]=4 7849 B19R3.19215 c1cnc(cn1)CN2CCc3ccncc3C2 270004a_100015190008_100000749867 [0,0,0,0,0,2|1,0,1]=4 7850 B19R3.19215 c1cnc(cn1)CN2CCc3cnccc3C2 2230a_100020645890_100016995436 [0,0,0,0,0,2|1,0,1]=4 7851 B19R3.19215 c1cnc(cn1)CN2CCc3cnccc3C2 269982a_100020645890_100016995436 [0,0,0,0,0,2|1,0,1]=4 7852 B19R3.19215 c1cnc(cn1)CN2CCc3cnccc3C2 270004a_100020645890_100000749867 [0,0,0,0,0,2|1,0,1]=4 7853 B19R3.19215 c1cnc(nc1)CN2CCc3ccccc3C2 2230a_100000188457_100000703007 [0,0,0,0,0,2|1,0,0]=3 7854 B19R3.19215 c1cnc(nc1)CN2CCc3ccccc3C2 269982a_100000188457_100000703007 [0,0,0,0,0,2|1,0,0]=3 7855 B19R3.19215 c1cnc(nc1)CN2CCc3ccccc3C2 270004a_100000188457_100011532527 [0,0,0,0,0,2|1,0,0]=3 7856 B19R3.19215 c1cnc(nc1)CN2CCc3ccccc3C2 34a_100000188457_100000703007 [0,0,0,0,0,2|1,0,0]=3 7857 B19R3.19215 c1cnc(nc1)CN2CCc3cccnc3C2 2230a_100015206102_100000703007 [0,0,0,0,0,2|2,0,0]=4 7858 B19R3.19215 c1cnc(nc1)CN2CCc3cccnc3C2 269982a_100015206102_100000703007 [0,0,0,0,0,2|2,0,0]=4 7859 B19R3.19215 c1cnc(nc1)CN2CCc3cccnc3C2 270004a_100015206102_100011532527 [0,0,0,0,0,2|2,0,0]=4 7860 B19R3.19215 c1cnc(nc1)CN2CCc3ccncc3C2 2230a_100015190008_100000703007 [0,0,0,0,0,2|2,0,0]=4 7861 B19R3.19215 c1cnc(nc1)CN2CCc3ccncc3C2 269982a_100015190008_100000703007 [0,0,0,0,0,2|2,0,0]=4 7862 B19R3.19215 c1cnc(nc1)CN2CCc3ccncc3C2 270004a_100015190008_100011532527 [0,0,0,0,0,2|2,0,0]=4 7863 B19R3.19215 c1cnc(nc1)CN2CCc3cnccc3C2 2230a_100020645890_100000703007 [0,0,0,0,0,2|2,0,0]=4 7864 B19R3.19215 c1cnc(nc1)CN2CCc3cnccc3C2 269982a_100020645890_100000703007 [0,0,0,0,0,2|2,0,0]=4 7865 B19R3.19215 c1cnc(nc1)CN2CCc3cnccc3C2 270004a_100020645890_100011532527 [0,0,0,0,0,2|2,0,0]=4 7866 B19R3.19215 c1cnc(nc1)CN2CCc3ncccc3C2 2230a_100000699647_100000703007 [0,0,0,0,0,2|2,0,0]=4 7867 B19R3.19215 c1cnc(nc1)CN2CCc3ncccc3C2 269982a_100000699647_100000703007 [0,0,0,0,0,2|2,0,0]=4 7868 B19R3.19215 c1cnc(nc1)CN2CCc3ncccc3C2 270004a_100000699647_100011532527 [0,0,0,0,0,2|2,0,0]=4 7869 B19R3.19215 c1cnc2c(c1)CCN(C2)Cc3cnccn3 2230a_100015206102_100016995436 [0,0,0,0,0,2|1,0,1]=4 7870 B19R3.19215 c1cnc2c(c1)CCN(C2)Cc3cnccn3 269982a_100015206102_100016995436 [0,0,0,0,0,2|1,0,1]=4 7871 B19R3.19215 c1cnc2c(c1)CCN(C2)Cc3cnccn3 270004a_100015206102_100000749867 [0,0,0,0,0,2|1,0,1]=4 7872 B19R3.19215 c1cnc2c(c1)CCN(C2)Cc3cncnc3 2230a_100015206102_100015196519 [0,0,0,0,0,2|1,0,1]=4 7873 B19R3.19215 c1cnc2c(c1)CCN(C2)Cc3cncnc3 269982a_100015206102_100016991940 [0,0,0,0,0,2|1,0,1]=4 7874 B19R3.19215 c1cnc2c(c1)CCN(C2)Cc3cncnc3 270004a_100015206102_100000749868 [0,0,0,0,0,2|1,0,1]=4 7875 B19R3.19215 c1cnc2c(c1)CN(CC2)Cc3cnccn3 2230a_100000699647_100016995436 [0,0,0,0,0,2|1,0,1]=4 7876 B19R3.19215 c1cnc2c(c1)CN(CC2)Cc3cnccn3 269982a_100000699647_100016995436 [0,0,0,0,0,2|1,0,1]=4 7877 B19R3.19215 c1cnc2c(c1)CN(CC2)Cc3cnccn3 270004a_100000699647_100000749867 [0,0,0,0,0,2|1,0,1]=4 7878 B19R3.19215 c1cnc2c(c1)CN(CC2)Cc3cncnc3 2230a_100000699647_100015196519 [0,0,0,0,0,2|1,0,1]=4 7879 B19R3.19215 c1cnc2c(c1)CN(CC2)Cc3cncnc3 269982a_100000699647_100016991940 [0,0,0,0,0,2|1,0,1]=4 7880 B19R3.19215 c1cnc2c(c1)CN(CC2)Cc3cncnc3 270004a_100000699647_100000749868 [0,0,0,0,0,2|1,0,1]=4 7881 B19R3.19215 c1cncc(c1)CN2CCc3ccccc3C2 2230a_100000188457_100000741622 [0,0,0,0,0,2|1,0,0]=3 7882 B19R3.19215 c1cncc(c1)CN2CCc3ccccc3C2 269982a_100000188457_100000733263 [0,0,0,0,0,2|1,0,0]=3 7883 B19R3.19215 c1cncc(c1)CN2CCc3ccccc3C2 270004a_100000188457_100000209961 [0,0,0,0,0,2|1,0,0]=3 7884 B19R3.19215 c1cncc(c1)CN2CCc3ccccc3C2 34a_100000188457_100000733263 [0,0,0,0,0,2|1,0,0]=3 7885 B19R3.19215 c1cncc(c1)CN2CCc3cccnc3C2 2230a_100015206102_100000741622 [0,0,0,0,0,2|2,0,0]=4 7886 B19R3.19215 c1cncc(c1)CN2CCc3cccnc3C2 269982a_100015206102_100000733263 [0,0,0,0,0,2|2,0,0]=4 7887 B19R3.19215 c1cncc(c1)CN2CCc3cccnc3C2 270004a_100015206102_100000209961 [0,0,0,0,0,2|2,0,0]=4 7888 B19R3.19215 c1cncc(c1)CN2CCc3ccncc3C2 2230a_100015190008_100000741622 [0,0,0,0,0,2|2,0,0]=4 7889 B19R3.19215 c1cncc(c1)CN2CCc3ccncc3C2 269982a_100015190008_100000733263 [0,0,0,0,0,2|2,0,0]=4 7890 B19R3.19215 c1cncc(c1)CN2CCc3ccncc3C2 270004a_100015190008_100000209961 [0,0,0,0,0,2|2,0,0]=4 7891 B19R3.19215 c1cncc(c1)CN2CCc3cnccc3C2 2230a_100020645890_100000741622 [0,0,0,0,0,2|2,0,0]=4 7892 B19R3.19215 c1cncc(c1)CN2CCc3cnccc3C2 269982a_100020645890_100000733263 [0,0,0,0,0,2|2,0,0]=4 7893 B19R3.19215 c1cncc(c1)CN2CCc3cnccc3C2 270004a_100020645890_100000209961 [0,0,0,0,0,2|2,0,0]=4 7894 B19R3.19215 c1cncc(c1)CN2CCc3ncccc3C2 2230a_100000699647_100000741622 [0,0,0,0,0,2|2,0,0]=4 7895 B19R3.19215 c1cncc(c1)CN2CCc3ncccc3C2 269982a_100000699647_100000733263 [0,0,0,0,0,2|2,0,0]=4 7896 B19R3.19215 c1cncc(c1)CN2CCc3ncccc3C2 270004a_100000699647_100000209961 [0,0,0,0,0,2|2,0,0]=4 7897 B19R3.19215 c1cnnc(c1)CN2CCc3ccccc3C2 2230a_100000188457_100016990269 [0,0,0,0,0,2|1,0,0]=3 7898 B19R3.19215 c1cnnc(c1)CN2CCc3ccccc3C2 34a_100000188457_100016990269 [0,0,0,0,0,2|1,0,0]=3 7899 B19R3.19215 c1cnnc(c1)CN2CCc3cccnc3C2 2230a_100015206102_100016990269 [0,0,0,0,0,2|2,0,0]=4 7900 B19R3.19215 c1cnnc(c1)CN2CCc3ccncc3C2 2230a_100015190008_100016990269 [0,0,0,0,0,2|2,0,0]=4 7901 B19R3.19215 c1cnnc(c1)CN2CCc3cnccc3C2 2230a_100020645890_100016990269 [0,0,0,0,0,2|2,0,0]=4 7902 B19R3.19215 c1cnnc(c1)CN2CCc3ncccc3C2 2230a_100000699647_100016990269 [0,0,0,0,0,2|2,0,0]=4 7903 B19R3.4447 c1ccc2c(c1)CCC2CNCc3c[nH]cn3 2230a_100020632452_100000707719 [0,0,0,0,0,2|1,0,0]=3 7904 B19R3.4447 c1ccc2c(c1)CCC2CNCc3c[nH]cn3 34a_100020632452_100000707719 [0,0,0,0,0,2|1,0,0]=3 7905 B19R3.4447 c1ccc2c(c1)CCC2CNCc3cocn3 270004a_100020632452_100000050382 [0,0,0,0,0,2|2,0,0]=4 7906 B19R3.4447 c1ccc2c(c1)CCC2CNCc3cscn3 207a_100020632452_100000743575 [0,0,0,0,0,2|2,0,0]=4 7907 B19R3.4447 c1ccc2c(c1)CCC2CNCc3cscn3 2230a_100020632452_100000205941 [0,0,0,0,0,2|2,0,0]=4 7908 B19R3.4447 c1ccc2c(c1)CCC2CNCc3cscn3 270004a_100020632452_100000743575 [0,0,0,0,0,2|2,0,0]=4 7909 B19R3.4447 c1ccc2c(c1)CCC2CNCc3cscn3 34a_100020632452_100000205941 [0,0,0,0,0,2|2,0,0]=4 7910 B19R3.4447 c1ccc2c(c1)CCC2OCCc3c[nH]cn3 7a_100000212247_100020628418 [0,0,0,0,0,2|1,0,0]=3 7911 B19R3.4447 c1ccc2c(c1)CCC2SCCc3c[nH]cn3 62a_100020628418_200000721974 [0,0,0,0,0,2|1,0,0]=3 7912 B19R3.4447 c1ccc2c(c1)CCN2CCNc3ncns3 27a_100000741946_100000693119 [0,0,0,0,0,2|1,0,1]=4 7913 B19R3.4447 c1ccc2c(c1)CC[C@@H]2NCCc3c[nH]cn3 2230a_100016989578_100020628418 [0,0,0,0,0,2|1,0,0]=3 7914 B19R3.4447 c1ccc2c(c1)OCC2NCCc3c[nH]cn3 2230a_100000747519_100020628418 [0,0,0,0,0,2|2,0,0]=4 7915 B19R3.4447 c1ccc2c(c1)nnn2CSCc3c[nH]cn3 62a_100000707719_100000033166 [0,0,0,0,0,2|2,0,0]=4 7916 B19R3.62425 c1cc2c(cn1)CCN(C2)CCc3c[nH]cn3 2230a_100020645890_100020628418 [0,0,0,0,0,2|1,0,0]=3 7917 B19R3.62425 c1cc2c(cn1)CCN(C2)CCc3c[nH]cn3 269982a_100020645890_100020628418 [0,0,0,0,0,2|1,0,0]=3 7918 B19R3.62425 c1cc2c(cn1)CN(CC2)CCc3c[nH]cn3 2230a_100015190008_100020628418 [0,0,0,0,0,2|1,0,0]=3 7919 B19R3.62425 c1cc2c(cn1)CN(CC2)CCc3c[nH]cn3 269982a_100015190008_100020628418 [0,0,0,0,0,2|1,0,0]=3 7920 B19R3.62425 c1ccc2c(c1)CC(CO2)NCc3c[nH]cn3 2230a_100000739546_100000707719 [0,0,0,0,0,2|2,0,0]=4 7921 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3c[nH]cn3 2230a_100000748446_100000707719 [0,0,0,0,0,2|1,0,0]=3 7922 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3c[nH]cn3 34a_100000748446_100000707719 [0,0,0,0,0,2|1,0,0]=3 7923 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3c[nH]nn3 270004a_100020620823_100000212018 [0,0,0,0,0,2|2,0,0]=4 7924 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3cocn3 270004a_100000748446_100000050382 [0,0,0,0,0,2|2,0,0]=4 7925 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3cocn3 270004a_100015188801_100000212018 [0,0,0,0,0,2|2,0,0]=4 7926 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3cscn3 207a_100000748446_100000743575 [0,0,0,0,0,2|2,0,0]=4 7927 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3cscn3 2230a_100000748446_100000205941 [0,0,0,0,0,2|2,0,0]=4 7928 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3cscn3 270004a_100000748446_100000743575 [0,0,0,0,0,2|2,0,0]=4 7929 B19R3.62425 c1ccc2c(c1)CCC(C2)NCc3cscn3 34a_100000748446_100000205941 [0,0,0,0,0,2|2,0,0]=4 7930 B19R3.62425 c1ccc2c(c1)CCC(C2)OCc3c[nH]cn3 34a_100011216300_100000707719 [0,0,0,0,0,2|1,0,0]=3 7931 B19R3.62425 c1ccc2c(c1)CCC(C2)OCc3cscn3 34a_100011216300_100000205941 [0,0,0,0,0,2|2,0,0]=4 7932 B19R3.62425 c1ccc2c(c1)CCC(C2)OCc3cscn3 7a_100011216300_100000205941 [0,0,0,0,0,2|2,0,0]=4 7933 B19R3.62425 c1ccc2c(c1)CCN(C2)CCc3c[nH]cn3 2230a_100000188457_100020628418 [0,0,0,0,0,2|0,0,0]=2 7934 B19R3.62425 c1ccc2c(c1)CCN(C2)CCc3c[nH]cn3 269982a_100000188457_100020628418 [0,0,0,0,0,2|0,0,0]=2 7935 B19R3.62425 c1ccc2c(c1)CCN(C2)CCc3cn[nH]c3 2230a_100000188457_100000743252 [0,0,0,0,0,2|2,0,0]=4 7936 B19R3.62425 c1ccc2c(c1)CCN(C2)CCc3cn[nH]c3 269982a_100000188457_100000743252 [0,0,0,0,0,2|2,0,0]=4 7937 B19R3.62425 c1ccc2c(c1)CCN(C2)CCn3cccn3 2230a_100000188457_100000685285 [0,0,0,0,0,2|2,0,0]=4 7938 B19R3.62425 c1ccc2c(c1)CCN(C2)CCn3cccn3 269982a_100000188457_100000685285 [0,0,0,0,0,2|2,0,0]=4 7939 B19R3.62425 c1ccc2c(c1)CCN(C2)CCn3cccn3 34a_100000188457_100015204718 [0,0,0,0,0,2|2,0,0]=4 7940 B19R3.62425 c1ccc2c(c1)CCN(C2)CCn3cncn3 2230a_100000188457_100000731791 [0,0,0,0,0,2|1,0,1]=4 7941 B19R3.62425 c1ccc2c(c1)CCN(C2)CCn3cncn3 269982a_100000188457_100000731791 [0,0,0,0,0,2|1,0,1]=4 7942 B19R3.62425 c1ccc2c(c1)CCN(C2)CCn3cncn3 34a_100000188457_200000749826 [0,0,0,0,0,2|1,0,1]=4 7943 B19R3.62425 c1ccc2c(c1)COC(C2)OCc3c[nH]cn3 34a_200000095866_100000707719 [0,0,0,0,0,2|2,0,0]=4 7944 B19R3.62425 c1ccc2c(c1)OCC(O2)CSc3c[nH]cn3 62a_100000756875_100011215957 [0,0,0,0,0,2|2,0,0]=4 7945 B19R3.62425 c1ccc2c(c1)OCC(O2)CSc3c[nH]cn3 62a_100011215957_100000756875 [0,0,0,0,0,2|2,0,0]=4 7946 B19R3.62425 c1cnc2c(c1)CCN(C2)CCc3c[nH]cn3 2230a_100015206102_100020628418 [0,0,0,0,0,2|1,0,0]=3 7947 B19R3.62425 c1cnc2c(c1)CCN(C2)CCc3c[nH]cn3 269982a_100015206102_100020628418 [0,0,0,0,0,2|1,0,0]=3 7948 B19R3.62425 c1cnc2c(c1)CN(CC2)CCc3c[nH]cn3 2230a_100000699647_100020628418 [0,0,0,0,0,2|1,0,0]=3 7949 B19R3.62425 c1cnc2c(c1)CN(CC2)CCc3c[nH]cn3 269982a_100000699647_100020628418 [0,0,0,0,0,2|1,0,0]=3 7950 B19R3.62425 c1csc(c1)CCN2CCc3ccccc3C2 2230a_100000188457_100000748579 [0,0,0,0,0,2|2,0,0]=4 7951 B19R3.62425 c1csc(c1)CCN2CCc3ccccc3C2 269982a_100000188457_100000748579 [0,0,0,0,0,2|2,0,0]=4 7952 B19R3.62425 c1csc(c1)CCN2CCc3ccccc3C2 34a_100000188457_100000748579 [0,0,0,0,0,2|2,0,0]=4 7953 B19R3.62425 c1ncc2c(n1)CCN(C2)CCc3c[nH]cn3 2230a_100012000121_100020628418 [0,0,0,0,0,2|2,0,0]=4 7954 B19R3.62425 c1ncc2c(n1)CCN(C2)CCc3c[nH]cn3 269982a_100012000121_100020628418 [0,0,0,0,0,2|2,0,0]=4 7955 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3c[nH]cn3 2230a_100000044199_100000707719 [0,0,0,0,0,2|0,0,0]=2 7956 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3c[nH]cn3 269982a_100000044199_100000707719 [0,0,0,0,0,2|0,0,0]=2 7957 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3c[nH]cn3 34a_100000044199_100000707719 [0,0,0,0,0,2|0,0,0]=2 7958 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cc[nH]n3 270004a_100000044199_100000738523 [0,0,0,0,0,2|2,0,0]=4 7959 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ccoc3 270004a_100000044199_100011215517 [0,0,0,0,0,2|2,0,0]=4 7960 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ccon3 2230a_100000044199_100000234950 [0,0,0,0,0,2|2,0,0]=4 7961 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ccon3 269982a_100000044199_100000234950 [0,0,0,0,0,2|2,0,0]=4 7962 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ccon3 34a_100000044199_100000234950 [0,0,0,0,0,2|2,0,0]=4 7963 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ccsc3 2230a_100000044199_100011261437 [0,0,0,0,0,2|2,0,0]=4 7964 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ccsc3 269982a_100000044199_100011233845 [0,0,0,0,0,2|2,0,0]=4 7965 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ccsc3 270004a_100000044199_100000188534 [0,0,0,0,0,2|2,0,0]=4 7966 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ccsc3 34a_100000044199_100011261437 [0,0,0,0,0,2|2,0,0]=4 7967 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cn[nH]c3 270004a_100000044199_100016992096 [0,0,0,0,0,2|2,0,0]=4 7968 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cnco3 270004a_100000044199_100000064291 [0,0,0,0,0,2|1,0,1]=4 7969 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cncs3 2230a_100000044199_100015185245 [0,0,0,0,0,2|1,0,1]=4 7970 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cncs3 269982a_100000044199_100015185245 [0,0,0,0,0,2|1,0,1]=4 7971 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cncs3 270004a_100000044199_100000749870 [0,0,0,0,0,2|1,0,1]=4 7972 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cncs3 34a_100000044199_100015185245 [0,0,0,0,0,2|1,0,1]=4 7973 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cocn3 270004a_100000044199_100000050382 [0,0,0,0,0,2|1,0,0]=3 7974 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cscn3 2230a_100000044199_100000205941 [0,0,0,0,0,2|1,0,0]=3 7975 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cscn3 269982a_100000044199_100000205941 [0,0,0,0,0,2|1,0,0]=3 7976 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cscn3 270004a_100000044199_100000743575 [0,0,0,0,0,2|1,0,0]=3 7977 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3cscn3 34a_100000044199_100000205941 [0,0,0,0,0,2|1,0,0]=3 7978 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3csnn3 270004a_100000044199_100000738508 [0,0,0,0,0,2|2,0,0]=4 7979 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncc[nH]3 2230a_100000044199_100016991755 [0,0,0,0,0,2|2,0,0]=4 7980 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncc[nH]3 269982a_100000044199_100016991755 [0,0,0,0,0,2|2,0,0]=4 7981 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncc[nH]3 34a_100000044199_100016991755 [0,0,0,0,0,2|2,0,0]=4 7982 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncco3 2230a_100000044199_103436540062 [0,0,0,0,0,2|2,0,0]=4 7983 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncco3 269982a_100000044199_103436540062 [0,0,0,0,0,2|2,0,0]=4 7984 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncco3 270004a_100000044199_100000064290 [0,0,0,0,0,2|2,0,0]=4 7985 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncco3 34a_100000044199_103436540062 [0,0,0,0,0,2|2,0,0]=4 7986 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3nccs3 2230a_100000044199_100015184050 [0,0,0,0,0,2|2,0,0]=4 7987 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3nccs3 269982a_100000044199_100015184050 [0,0,0,0,0,2|2,0,0]=4 7988 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3nccs3 270004a_100000044199_100000750902 [0,0,0,0,0,2|2,0,0]=4 7989 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3nccs3 34a_100000044199_100015184050 [0,0,0,0,0,2|2,0,0]=4 7990 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncon3 269982a_100000044199_100000233494 [0,0,0,0,0,2|2,0,0]=4 7991 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cc3ncon3 34a_100000044199_100000233494 [0,0,0,0,0,2|2,0,0]=4 7992 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cn3cncn3 2230a_100000044199_200020645497 [0,0,0,0,0,2|1,0,1]=4 7993 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cn3cncn3 269982a_100000044199_200020645497 [0,0,0,0,0,2|1,0,1]=4 7994 B19R3.2217923 c1ccc2c(c1)CCN(CC2)Cn3cncn3 34a_100000044199_200020645497 [0,0,0,0,0,2|1,0,1]=4 7995 B19R3.2217923 c1coc(c1)CN2CCc3ccccc3CC2 270004a_100000044199_100000186105 [0,0,0,0,0,2|2,0,0]=4 7996 B19R3.2217923 c1csc(c1)CN2CCc3ccccc3CC2 270004a_100000044199_100000209959 [0,0,0,0,0,2|2,0,0]=4