0 B11R1.86 CC(C)Cc1ccccc1O TS40918 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.86 CC(C)Nc1c(cccn1)N TS10088 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.86 CC(C)Oc1c(cccn1)I TS29880 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.86 CC(C)Oc1ccccc1Br TS21828 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.86 CC(C)Oc1ccccc1O TS10184 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.86 CN(C)Cc1c(cccn1)O TS10196 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.86 CN(C)Cc1ccccc1Br TS21621 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.86 CN(C)Cc1ccccc1N TS09933 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.86 Cc1c(nccn1)CC(C)C TS09939 [0,0,0,0,0,0|0,0,0]=0 9 B11R1.86 Cc1c(nccn1)OC(C)C TS41161 [0,0,0,0,0,0|1,0,0]=1 10 B11R1.86 Cc1ccccc1CC(=O)C TS40648 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.86 c1cnc(c(n1)CC(=O)O)Cl TS92109 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.4 CCCc1ccccc1C TS05927 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.4 CCCc1ccccc1N TS36961 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.4 CCCc1ccccc1O TS06077 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.4 CCNc1ccccc1C TS06011 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.4 CCOc1c(cccn1)Br TS19321 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.4 CCOc1c(cccn1)I TS27857 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.4 CCOc1c(nccn1)C TS37192 [1,0,0,0,0,0|1,0,0]=2 19 B10R1.4 CCOc1cccnc1Br TS19312 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.4 CCOc1cccnc1N TS37190 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.4 CNCc1c(cccn1)F TS86149 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.4 Cc1c(cccn1)CCO TS37129 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.4 Cc1ccccc1CCBr TS54167 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.4 Cc1ccccc1CCO TS37017 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.4 Cc1ccccc1CNC TS36965 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.4 c1cc(c(nc1)CCN)Br TS86650 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.4 c1cnc(c(n1)CC#N)Cl TS85791 [1,0,0,0,0,0|2,0,1]=4 28 B10R1.18 CC(=O)Cc1ccccn1 TS47028 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.18 CC(=O)Cc1cccnc1 TS36918 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.18 CC(=O)Cc1cccnc1 TS45385 [1,0,0,0,0,0|2,0,1]=4 31 B10R1.18 CC(C)Cc1ccccc1 TS74509 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.18 CC(C)Cc1ccccn1 TS36960 [1,0,0,0,0,0|1,0,0]=2 33 B10R1.18 CC(C)Cc1cccnc1 TS06005 [1,0,0,0,0,0|1,0,0]=2 34 B10R1.18 CC(C)Cc1ccncc1 TS06006 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.18 CC(C)Cc1cnccn1 TS06100 [1,0,0,0,0,0|0,0,0]=1 36 B10R1.18 CC(C)Nc1ccccc1 TS56404 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.18 CC(C)Nc1cccnc1 TS64905 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.18 CC(C)Sc1ccccc1 TS41201 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.18 CC(Cc1ccccc1)Br TS55076 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.18 CC(Cc1ccccc1)N TS06010 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.18 CC(Cc1ccccc1)O TS47018 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.18 CC(Cc1ccccn1)N TS46983 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.18 CC(Cc1cccnc1)N TS00050 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.18 CN(C)Cc1ccccc1 TS06009 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.18 CN(C)Cc1ccccc1 TS45394 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.18 C[C@@H](Cc1ccccc1)N TS36940 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.18 C[C@@H](Cc1ccccc1)N TS66757 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.18 C[SiH](C)Cc1ccccc1 TS40934 [1,0,0,0,0,0|2,1,0]=4 49 B10R1.18 c1cnc(cn1)CC(=O)O TS02465 [1,0,0,0,0,0|2,0,1]=4 50 B12R1.75 CC(C)Cc1c(nccn1)OC TS43126 [0,1,0,0,0,0|0,0,0]=1 51 B12R1.75 CC(C)Oc1c(cccn1)C=O TS07728 [0,1,0,0,0,0|2,0,1]=4 52 B12R1.75 CC(C)Oc1c(cccn1)CO TS12400 [0,1,0,0,0,0|2,0,0]=3 53 B12R1.75 CC(Cc1ccccc1OC)N TS39991 [0,1,0,0,0,0|3,0,0]=4 54 B12R1.127 Cc1ccc(c(c1)CC(C)C)C TS42510 [0,1,0,0,0,0|2,0,0]=3 55 B12R1.151 CC(C)(C)Sc1cccnc1N TS15038 [0,1,0,0,0,0|3,0,0]=4 56 B12R1.233 CC(C)Oc1c(cc(cn1)Br)I TS78569 [0,1,0,0,0,0|3,0,0]=4 57 B12R2.24 CC1CCc2ccccc2N1 TS59877 [0,0,0,1,0,0|3,0,0]=4 58 B12R2.24 CC1Cc2ccccc2CN1 TS40571 [0,0,0,1,0,0|3,0,0]=4 59 B12R2.24 c1ccc2c(c1)CCC(C2)N TS08739 [0,0,0,1,0,0|3,0,0]=4 60 B12R2.24 c1ccc2c(c1)CCC(C2)N TS46761 [0,0,0,1,0,0|3,0,0]=4 61 B12R2.24 c1ccc2c(c1)CCC(C2)O TS07471 [0,0,0,1,0,0|3,0,0]=4 62 B12R2.24 c1ccc2c(c1)CC[C@@H](C2)N TS07859 [0,0,0,1,0,0|3,0,0]=4 63 B12R2.225 c1cc(c(nc1)NC2CC2)N TS01589 [0,0,0,1,0,0|3,0,0]=4 64 B10R1.61 CC(=O)c1c(nccn1)Cl TS90872 [0,0,0,0,1,0|2,0,1]=4 65 B10R1.61 CC(=O)c1c(nccn1)N TS87446 [0,0,0,0,1,0|2,0,1]=4 66 B10R1.61 CC(C)c1ccccc1Br TS46918 [0,0,0,0,1,0|3,0,0]=4 67 B10R1.61 CC(C)c1ccccc1F TS06286 [0,0,0,0,1,0|3,0,0]=4 68 B10R1.61 CC(C)c1ccccc1I TS27403 [0,0,0,0,1,0|3,0,0]=4 69 B10R1.61 CC(C)c1ccccc1N TS06016 [0,0,0,0,1,0|3,0,0]=4 70 B10R1.61 CC(C)c1ccccc1O TS06094 [0,0,0,0,1,0|3,0,0]=4 71 B10R1.61 CC(C)c1ccccc1S TS41199 [0,0,0,0,1,0|3,0,0]=4 72 B10R1.61 CC(C)c1ccccc1[Zn+] TS60954 [0,0,0,0,1,0|3,0,0]=4 73 B10R1.61 CC(c1c(cccn1)F)O TS06577 [0,0,0,0,1,0|3,0,0]=4 74 B10R1.61 CC(c1cccnc1Br)N TS19152 [0,0,0,0,1,0|3,0,0]=4 75 B10R1.61 CC(c1cccnc1N)O TS37203 [0,0,0,0,1,0|3,0,0]=4 76 B10R1.61 Cc1c(nccn1)C(=O)C TS06062 [0,0,0,0,1,0|1,0,1]=3 77 B10R1.61 Cc1c(nccn1)C(=O)O TS70673 [0,0,0,0,1,0|2,0,1]=4 78 B10R1.61 Cc1ccccc1C(C)N TS36951 [0,0,0,0,1,0|3,0,0]=4 79 B10R1.61 Cc1ccccc1C(C)O TS37021 [0,0,0,0,1,0|3,0,0]=4 80 B10R1.61 Cc1ccccc1N(C)C TS06004 [0,0,0,0,1,0|3,0,0]=4 81 B10R1.61 Cc1ccccc1[C@@H](C)N TS45398 [0,0,0,0,1,0|3,0,0]=4 82 B10R1.61 Cc1ccccc1[C@H](C)N TS45395 [0,0,0,0,1,0|3,0,0]=4 83 B10R1.64 Cn1cccc1CN(C)C TS37228 [0,0,0,0,1,0|3,0,0]=4 84 B12R1.125 Cc1ccccc1OCC(C)O TS12256 [0,0,0,0,0,1|3,0,0]=4 85 B9R1.8 CCCc1ccccc1 TS04832 [2,0,0,0,0,0|2,0,0]=4 86 B9R1.8 CCCc1ccccn1 TS85359 [2,0,0,0,0,0|1,0,0]=3 87 B9R1.8 CCCc1cnccn1 TS59984 [2,0,0,0,0,0|0,0,0]=2 88 B9R1.8 CCOc1ccccn1 TS55309 [2,0,0,0,0,0|2,0,0]=4 89 B9R1.8 CCOc1cnccn1 TS05010 [2,0,0,0,0,0|1,0,0]=3 90 B9R1.8 CNCc1ccccn1 TS51966 [2,0,0,0,0,0|2,0,0]=4 91 B9R1.8 CNCc1cccnc1 TS02609 [2,0,0,0,0,0|2,0,0]=4 92 B9R1.8 CNCc1cnccn1 TS01556 [2,0,0,0,0,0|1,0,0]=3 93 B9R1.8 COCc1ccccn1 TS00518 [2,0,0,0,0,0|2,0,0]=4 94 B9R1.8 c1cc(cnc1)CCN TS41995 [2,0,0,0,0,0|2,0,0]=4 95 B9R1.8 c1cc(cnc1)CCN TS65667 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.8 c1cc(cnc1)CCO TS39614 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.8 c1ccnc(c1)CCCl TS37532 [2,0,0,0,0,0|2,0,0]=4 98 B9R1.8 c1ccnc(c1)CCN TS04914 [2,0,0,0,0,0|2,0,0]=4 99 B9R1.8 c1ccnc(c1)CCN TS17997 [2,0,0,0,0,0|2,0,0]=4 100 B9R1.8 c1ccnc(c1)CCO TS04967 [2,0,0,0,0,0|2,0,0]=4 101 B9R1.8 c1cnc(cn1)CC#N TS87071 [2,0,0,0,0,0|1,0,1]=4 102 B9R1.8 c1cnc(cn1)CCN TS32564 [2,0,0,0,0,0|1,0,0]=3 103 B9R1.8 c1cnc(cn1)CCS TS37406 [2,0,0,0,0,0|1,0,0]=3 104 B9R1.8 c1cnc(cn1)CNN TS88060 [2,0,0,0,0,0|2,0,0]=4 105 B9R1.15 CCc1c(nccn1)C TS04922 [2,0,0,0,0,0|0,0,0]=2 106 B9R1.15 CCc1ccccc1C TS16337 [2,0,0,0,0,0|2,0,0]=4 107 B9R1.15 CCc1cccnc1C TS32475 [2,0,0,0,0,0|1,0,0]=3 108 B9R1.15 COc1c(nccn1)Cl TS55197 [2,0,0,0,0,0|2,0,0]=4 109 B9R1.15 COc1c(nccn1)N TS47372 [2,0,0,0,0,0|2,0,0]=4 110 B9R1.15 Cc1c(cccn1)CBr TS87803 [2,0,0,0,0,0|2,0,0]=4 111 B9R1.15 Cc1c(cccn1)CCl TS90028 [2,0,0,0,0,0|2,0,0]=4 112 B9R1.15 Cc1c(cccn1)CN TS32520 [2,0,0,0,0,0|2,0,0]=4 113 B9R1.15 Cc1c(cccn1)CO TS04969 [2,0,0,0,0,0|2,0,0]=4 114 B9R1.15 Cc1c(cccn1)OC TS04964 [2,0,0,0,0,0|2,0,0]=4 115 B9R1.15 Cc1c(nccn1)C=O TS86293 [2,0,0,0,0,0|1,0,1]=4 116 B9R1.15 Cc1c(nccn1)CCl TS88673 [2,0,0,0,0,0|1,0,0]=3 117 B9R1.15 Cc1c(nccn1)CN TS92714 [2,0,0,0,0,0|1,0,0]=3 118 B9R1.15 Cc1c(nccn1)CO TS88558 [2,0,0,0,0,0|1,0,0]=3 119 B9R1.15 Cc1c(nccn1)OC TS55427 [2,0,0,0,0,0|1,0,0]=3 120 B9R1.15 Cc1c(nccn1)SC TS37401 [2,0,0,0,0,0|1,0,0]=3 121 B9R1.15 Cc1cccnc1CCl TS91176 [2,0,0,0,0,0|2,0,0]=4 122 B9R1.15 Cc1cccnc1CN TS32513 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.15 Cc1cccnc1CO TS04977 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.15 Cc1cccnc1OC TS04965 [2,0,0,0,0,0|2,0,0]=4 125 B9R1.15 c1cnc(c(n1)CCl)Cl TS88674 [2,0,0,0,0,0|2,0,0]=4 126 B9R1.15 c1cnc(c(n1)CN)Cl TS49175 [2,0,0,0,0,0|2,0,0]=4 127 B9R1.15 c1cnc(c(n1)CN)Cl TS86197 [2,0,0,0,0,0|2,0,0]=4 128 B9R1.15 c1cnc(c(n1)CO)Cl TS64972 [2,0,0,0,0,0|2,0,0]=4 129 B11R1.17 CCCCc1c(nccn1)C TS09951 [1,1,0,0,0,0|0,0,0]=2 130 B11R1.17 c1cnc(c(n1)NCCO)Cl TS13417 [1,1,0,0,0,0|2,0,0]=4 131 B11R1.41 CCCc1c(nccn1)OC TS41162 [1,1,0,0,0,0|0,0,0]=2 132 B11R1.41 CCc1c(nccn1)OCC TS41156 [1,1,0,0,0,0|1,0,0]=3 133 B11R1.81 CCOc1ccc(nc1C)N TS03291 [1,1,0,0,0,0|2,0,0]=4 134 B11R1.20 CC(C)Cc1ccc(cc1)Br TS44298 [1,1,0,0,0,0|2,0,0]=4 135 B11R1.20 CC(C)Cc1ccc(cc1)N TS07610 [1,1,0,0,0,0|2,0,0]=4 136 B11R1.20 CC(C)Oc1ccc(cn1)Br TS85279 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.20 CC(C)Oc1ccc(cn1)N TS10201 [1,1,0,0,0,0|2,0,0]=4 138 B11R1.36 CC(C)C(=O)c1ccccn1 TS07567 [1,1,0,0,0,0|1,0,1]=4 139 B11R1.36 CC(C)C(C)c1ccccc1 TS40688 [1,1,0,0,0,0|2,0,0]=4 140 B11R1.36 CC(C)C(c1ccccc1)N TS40783 [1,1,0,0,0,0|2,0,0]=4 141 B11R1.36 CC(C)C(c1ccccc1)O TS40912 [1,1,0,0,0,0|2,0,0]=4 142 B11R1.36 CC(C)[C@@H](c1ccccc1)O TS09919 [1,1,0,0,0,0|2,0,0]=4 143 B11R1.36 CC(C)[C@H](c1ccccc1)O TS09912 [1,1,0,0,0,0|2,0,0]=4 144 B11R1.40 CC(Cc1ccccc1)NC TS07600 [1,1,0,0,0,0|2,0,0]=4 145 B11R1.40 CCC(C)Cc1ccccc1 TS40686 [1,1,0,0,0,0|2,0,0]=4 146 B11R1.40 COC(=O)Cc1cnccn1 TS88028 [1,1,0,0,0,0|1,0,1]=4 147 B11R1.40 C[C@@H](Cc1ccccc1)NC TS40789 [1,1,0,0,0,0|2,0,0]=4 148 B11R1.40 C[C@H](Cc1ccccc1)NC TS40784 [1,1,0,0,0,0|2,0,0]=4 149 B11R1.509 CC(C)(C)Cc1ccccc1 TS40684 [1,1,0,0,0,0|2,0,0]=4 150 B11R1.509 CC(C)(Cc1ccccc1)O TS40900 [1,1,0,0,0,0|2,0,0]=4 151 B11R1.53 CC(C)c1c(nccn1)SC TS44909 [0,1,0,0,1,0|0,0,0]=2 152 B11R1.53 CC(C)c1ccccc1OC TS40899 [0,1,0,0,1,0|2,0,0]=4 153 B11R1.53 CCc1c(nccn1)C(=O)C TS09880 [0,1,0,0,1,0|1,0,1]=4 154 B11R1.87 Cc1ccccc1C(C)(C)C TS07504 [0,1,0,0,1,0|2,0,0]=4 155 B11R1.166 Cc1cc(ccc1C(C)C)N TS15547 [0,1,0,0,1,0|2,0,0]=4 156 B11R1.166 Cc1cc(ccc1C(C)C)O TS40896 [0,1,0,0,1,0|2,0,0]=4 157 B11R1.166 Cc1cnc(c(n1)C)C(=O)C TS09884 [0,1,0,0,1,0|1,0,1]=4 158 B11R1.167 Cc1ccc(cc1C(C)C)N TS40778 [0,1,0,0,1,0|2,0,0]=4 159 B13R1.91 CC(Cc1ccccc1OC)NC TS21951 [0,2,0,0,0,0|2,0,0]=4 160 B11R1.561 CC1=CC=CC(CC1=O)(C)C TS09927 [0,0,1,1,0,0|2,0,0]=4 161 B11R2.20 C1CCC2=C(C1)CC=CC2 TS36861 [1,0,0,1,0,0|2,0,0]=4 162 B11R2.20 c1cc2c(nc1)CCCC2 TS71334 [1,0,0,1,0,0|1,0,0]=3 163 B11R2.20 c1cc2c(nc1)CCCN2 TS05910 [1,0,0,1,0,0|2,0,0]=4 164 B11R2.20 c1cc2c(nc1)CCNC2 TS16957 [1,0,0,1,0,0|2,0,0]=4 165 B11R2.20 c1cc2c(nc1)CCNC2 TS94341 [1,0,0,1,0,0|2,0,0]=4 166 B11R2.20 c1cc2c(nc1)CNCC2 TS02254 [1,0,0,1,0,0|2,0,0]=4 167 B11R2.20 c1cc2c(nc1)CNCC2 TS86659 [1,0,0,1,0,0|2,0,0]=4 168 B11R2.20 c1cc2c(nc1)NCCC2 TS05909 [1,0,0,1,0,0|2,0,0]=4 169 B11R2.20 c1ccc2c(c1)CCCC2 TS36696 [1,0,0,1,0,0|2,0,0]=4 170 B11R2.20 c1ccc2c(c1)CCCC2 TS73725 [1,0,0,1,0,0|2,0,0]=4 171 B11R2.20 c1cnc2c(n1)CCCC2 TS71335 [1,0,0,1,0,0|0,0,0]=2 172 B11R2.4 CC1CC1c2ccccc2 TS36705 [1,0,0,1,0,0|2,0,0]=4 173 B11R2.238 c1ccc(cc1)CC2CC2 TS36695 [1,0,0,1,0,0|2,0,0]=4 174 B11R2.1 CC1CCc2c1nccn2 TS05914 [0,0,0,1,1,0|0,0,0]=2 175 B11R2.1 c1cc2c(nc1)C(CC2)O TS36915 [0,0,0,1,1,0|2,0,0]=4 176 B11R2.1 c1cc2c(nc1)CCC2N TS59726 [0,0,0,1,1,0|2,0,0]=4 177 B13R2.3587 c1cc(c(nc1)OCC2CC2)I TS33668 [0,0,0,1,0,1|2,0,0]=4 178 B13R2.155 CN1CCc2c(cc(cn2)N)C1 TS16960 [0,1,0,1,0,0|2,0,0]=4 179 B13R2.155 Cc1ccc2c(c1)CC(CC2)C TS42213 [0,1,0,1,0,0|2,0,0]=4 180 B13R2.3683 Cc1ccc2c(c1)CCC(C2)C TS42209 [0,1,0,1,0,0|2,0,0]=4 181 B13R2.57 CCC1CCc2ccccc2C1 TS42212 [0,1,0,1,0,0|2,0,0]=4 182 B13R2.57 c1ccc2c(c1)CCC(C2)CN TS42347 [0,1,0,1,0,0|2,0,0]=4 183 B9R1.33 CCOc1c(nco1)C TS36218 [1,0,0,0,1,0|2,0,0]=4 184 B9R1.33 CNCc1nccn1C TS05094 [1,0,0,0,1,0|2,0,0]=4 185 B9R1.33 Cc1c(non1)CNC TS36232 [1,0,0,0,1,0|2,0,0]=4 186 B9R1.33 Cc1c(scn1)CCCl TS42365 [1,0,0,0,1,0|2,0,0]=4 187 B9R1.33 Cc1c(scn1)CCN TS37631 [1,0,0,0,1,0|2,0,0]=4 188 B9R1.33 Cc1c(scn1)CCO TS03166 [1,0,0,0,1,0|2,0,0]=4 189 B9R1.33 Cc1ccsc1CNC TS06621 [1,0,0,0,1,0|2,0,0]=4 190 B9R1.33 Cc1nccn1CCO TS05169 [1,0,0,0,1,0|2,0,0]=4 191 B9R1.6 CC(=O)c1cnccn1 TS55718 [1,0,0,0,1,0|1,0,1]=4 192 B9R1.6 CC(C)c1ccccn1 TS32479 [1,0,0,0,1,0|1,0,0]=3 193 B9R1.6 CC(C)c1ccccn1 TS49188 [1,0,0,0,1,0|1,0,0]=3 194 B9R1.6 CC(C)c1cnccn1 TS04911 [1,0,0,0,1,0|0,0,0]=2 195 B9R1.6 CC(c1ccccn1)N TS47025 [1,0,0,0,1,0|2,0,0]=4 196 B9R1.6 CC(c1ccccn1)N TS59503 [1,0,0,0,1,0|2,0,0]=4 197 B9R1.6 CC(c1ccccn1)O TS08930 [1,0,0,0,1,0|2,0,0]=4 198 B9R1.6 CC(c1cccnc1)N TS59573 [1,0,0,0,1,0|2,0,0]=4 199 B9R1.6 CC(c1cnccn1)N TS86731 [1,0,0,0,1,0|1,0,0]=3 200 B9R1.6 CN(C)c1ccccn1 TS04916 [1,0,0,0,1,0|2,0,0]=4 201 B9R1.6 CN(C)c1cccnc1 TS32521 [1,0,0,0,1,0|2,0,0]=4 202 B9R1.6 C[C@@H](c1ccccn1)O TS04971 [1,0,0,0,1,0|2,0,0]=4 203 B9R1.6 C[C@@H](c1cccnc1)O TS04970 [1,0,0,0,1,0|2,0,0]=4 204 B9R1.6 C[C@H](c1ccccn1)O TS04976 [1,0,0,0,1,0|2,0,0]=4 205 B9R1.6 C[C@H](c1cccnc1)O TS04956 [1,0,0,0,1,0|2,0,0]=4 206 B9R1.13 CC(C)Cc1nccs1 TS06620 [1,0,0,0,1,0|1,0,0]=3 207 B9R1.13 CC(Cc1cccs1)O TS37625 [1,0,0,0,1,0|2,0,0]=4 208 B9R1.13 CC(Cn1ccnc1)O TS05171 [1,0,0,0,1,0|2,0,0]=4 209 B9R1.13 CN(C)Cc1cccs1 TS06616 [1,0,0,0,1,0|2,0,0]=4 210 B9R1.13 C[C@@H](Cc1c[nH]cn1)N TS35022 [1,0,0,0,1,0|1,0,1]=4 211 B9R1.13 C[C@H](Cc1c[nH]cn1)N TS35021 [1,0,0,0,1,0|1,0,1]=4