0 B12R2.2 C1=C(CCC1)c2ccccc2 AIFCHEM-94590916958 [1,0,0,0,0,0|2,0,1]=4 1 B12R1.8 CCCCCNc1cnccn1 AIFCHEM-94551433700 [0,0,1,0,0,0|3,0,0]=4 2 B12R1.8 CCCCNCc1cnccn1 AIFCHEM-5751587140 [0,0,1,0,0,0|3,0,0]=4 3 B12R1.8 CCNCCCc1cccnc1 AIFCHEM-94537421400 [0,0,1,0,0,0|2,0,0]=3 4 B12R1.8 CCNCCOc1cccnc1 AIFCHEM-94537420048 [0,0,1,0,0,0|3,0,0]=4 5 B12R1.8 CSCCNCc1cccnc1 AIFCHEM-94598922606 [0,0,1,0,0,0|2,0,0]=3 6 B12R1.8 CSCCNCc1cccnn1 AIFCHEM-94598923257 [0,0,1,0,0,0|3,0,0]=4 7 B12R1.8 OCCCNCc1cccnc1 AIFCHEM-94523164274 [0,0,1,0,0,0|3,0,0]=4 8 B12R1.32 CCCN(C)Cc1ccccn1 AIFCHEM-5860218756 [0,0,1,0,0,0|2,0,0]=3 9 B12R1.32 CN(CC#N)Cc1cnccn1 AIFCHEM-94589149597 [0,0,1,0,0,0|2,0,1]=4 10 B12R1.32 CN(CCO)Cc1cccnc1 AIFCHEM-94548505566 [0,0,1,0,0,0|1,0,0]=2 11 B12R1.32 CN(CCO)Cc1cnccn1 AIFCHEM-94548506077 [0,0,1,0,0,0|2,0,0]=3 12 B12R1.34 CCN(C)C(=O)c1cncnc1 AIFCHEM-94563267528 [0,0,1,0,0,0|2,0,1]=4 13 B14R2.21 CN1CCC=C(C1)c2cccnc2 AIFCHEM-6411994923 [0,0,0,0,0,1|0,0,2]=3 14 B11R1.16 CCNC(C)c1cccnc1 AIFCHEM-94537412581 [1,0,1,0,0,0|0,0,0]=2 15 B11R1.16 CCN[C@@H](C)c1cccnc1 AIFCHEM-94593286246 [1,0,1,0,0,0|0,0,0]=2 16 B11R1.16 CCN[C@H](C)c1cccnc1 AIFCHEM-94529449831 [1,0,1,0,0,0|0,0,0]=2 17 B11R1.28 CCCNCc1ccncc1 AIFCHEM-5790435281 [1,0,1,0,0,0|2,0,0]=4 18 B11R1.28 FCCNCc1cccnn1 AIFCHEM-5801265591 [1,0,1,0,0,0|2,0,0]=4 19 B11R1.40 CCN(C)Cc1ccccc1 AIFCHEM-94537411577 [1,0,1,0,0,0|1,0,0]=3 20 B11R1.40 CCN(C)Cc1cccnc1 AIFCHEM-94537417880 [1,0,1,0,0,0|0,0,0]=2 21 B13R1.26 CCCCN(CC)c1cccnc1 AIFCHEM-94523036530 [0,1,1,0,0,0|2,0,0]=4 22 B13R1.398 CCN[C@@H](COC)c1ccccc1 AIFCHEM-94537424022 [0,1,1,0,0,0|2,0,0]=4 23 B13R1.398 CCN[C@H](COC)c1ccccc1 AIFCHEM-94522829725 [0,1,1,0,0,0|2,0,0]=4 24 B13R1.6 COCCNCc1cncc(c1)Br AIFCHEM-6047882748 [0,1,1,0,0,0|2,0,0]=4 25 B13R1.6 CSCCCNc1cncc(c1)C AIFCHEM-94524186371 [0,1,1,0,0,0|2,0,0]=4 26 B13R1.6 CSCCCNc1cncc(c1)I AIFCHEM-94546180478 [0,1,1,0,0,0|2,0,0]=4 27 B13R1.6 CSCCNCc1cncc(c1)C AIFCHEM-5882398075 [0,1,1,0,0,0|2,0,0]=4 28 B13R1.9 CCCCCNc1ccc(nc1)C AIFCHEM-94551431984 [0,1,1,0,0,0|2,0,0]=4 29 B13R1.9 CCCCCNc1ccc(nc1)I AIFCHEM-94551431439 [0,1,1,0,0,0|2,0,0]=4 30 B13R1.9 CCCCNCc1ccc(nc1)Br AIFCHEM-5751581878 [0,1,1,0,0,0|2,0,0]=4 31 B13R1.9 CCCCNCc1ccc(nc1)F AIFCHEM-5695336978 [0,1,1,0,0,0|2,0,0]=4 32 B13R1.9 COCCNCc1ccc(nc1)Br AIFCHEM-6048501992 [0,1,1,0,0,0|2,0,0]=4 33 B13R1.9 CSCCCNc1ccc(nc1)Br AIFCHEM-94546175956 [0,1,1,0,0,0|2,0,0]=4 34 B13R1.9 CSCCNCc1ccc(nc1)F AIFCHEM-94598923687 [0,1,1,0,0,0|2,0,0]=4 35 B13R1.24 CSCCNC(C)c1cccnc1 AIFCHEM-94598921912 [0,1,1,0,0,0|2,0,0]=4 36 B13R1.28 CCCNCCCc1ccccc1 AIFCHEM-5790560469 [0,1,1,0,0,0|2,0,0]=4 37 B13R1.28 CCNCCCCc1ccccc1 AIFCHEM-94537420007 [0,1,1,0,0,0|1,0,0]=3 38 B13R1.28 CCOCCNCc1cccnc1 AIFCHEM-94548606577 [0,1,1,0,0,0|2,0,0]=4 39 B13R1.28 COCCCNCc1cccnn1 AIFCHEM-5624702599 [0,1,1,0,0,0|2,0,0]=4 40 B13R1.28 CSCCCNCc1cncnc1 AIFCHEM-94529050375 [0,1,1,0,0,0|2,0,0]=4 41 B13R1.42 CCCC(C)NCc1cccnc1 AIFCHEM-94606117628 [0,1,1,0,0,0|2,0,0]=4 42 B13R1.42 CCC[C@@H](C)NCc1cccnc1 AIFCHEM-6010943982 [0,1,1,0,0,0|2,0,0]=4 43 B13R1.42 CCC[C@H](C)NCc1cccnc1 AIFCHEM-5628664617 [0,1,1,0,0,0|2,0,0]=4 44 B13R1.44 COCCN(C)Cc1cccnc1 AIFCHEM-6083994748 [0,1,1,0,0,0|2,0,0]=4 45 B13R1.337 CN(C)CCNCc1cnccn1 AIFCHEM-5915076036 [0,1,1,0,0,0|2,0,0]=4 46 B13R1.555 CCCCCNc1cccnc1I AIFCHEM-94551429695 [0,1,1,0,0,0|2,0,0]=4 47 B13R1.555 CCCCCNc1cnccc1C AIFCHEM-94551431987 [0,1,1,0,0,0|2,0,0]=4 48 B13R1.555 CCCCNCc1cccnc1Cl AIFCHEM-5695417963 [0,1,1,0,0,0|2,0,0]=4 49 B13R1.555 CCCCNCc1cnccc1O AIFCHEM-94570975591 [0,1,1,0,0,0|2,0,0]=4 50 B13R1.555 COCCNCc1cccnc1Br AIFCHEM-5990106086 [0,1,1,0,0,0|2,0,0]=4 51 B13R1.555 CSCCCNc1cnccc1Cl AIFCHEM-94546179224 [0,1,1,0,0,0|2,0,0]=4 52 B13R1.19 CCCN(C)Cc1ccc(cc1)Br AIFCHEM-94538720467 [0,1,1,0,0,0|1,0,0]=3 53 B13R1.19 CCCN(C)Cc1ccc(cc1)C AIFCHEM-94569021655 [0,1,1,0,0,0|1,0,0]=3 54 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl AIFCHEM-5860345714 [0,1,1,0,0,0|1,0,0]=3 55 B13R1.19 CN(CCO)Cc1cnc(nc1)Cl AIFCHEM-6448855827 [0,1,1,0,0,0|2,0,0]=4 56 B13R1.19 Cc1ccc(cn1)CN(C)CC#N AIFCHEM-94589149271 [0,1,1,0,0,0|1,0,1]=4 57 B13R1.19 Cc1ncc(cn1)CN(C)CCO AIFCHEM-6475014102 [0,1,1,0,0,0|2,0,0]=4 58 B13R1.20 CCCC(C)Nc1cncc(c1)Cl AIFCHEM-94606115408 [0,1,1,0,0,0|2,0,0]=4 59 B13R1.20 CCCN(C)Cc1cc(ccn1)Cl AIFCHEM-5808634289 [0,1,1,0,0,0|2,0,0]=4 60 B13R1.20 CCCN(C)Cc1ccnc(c1)C AIFCHEM-5808634290 [0,1,1,0,0,0|2,0,0]=4 61 B13R1.20 CCCN(C)Cc1cncc(c1)Br AIFCHEM-5878782662 [0,1,1,0,0,0|0,0,0]=2 62 B13R1.20 CCCN(C)Cc1cncc(c1)Cl AIFCHEM-5825225205 [0,1,1,0,0,0|0,0,0]=2 63 B13R1.20 CN(CC#N)Cc1cncc(c1)F AIFCHEM-94589148675 [0,1,1,0,0,0|1,0,1]=4 64 B13R1.47 CCCN(C)C(=O)c1ccccc1 AIFCHEM-94565582921 [0,1,1,0,0,0|1,0,1]=4 65 B13R1.47 CCCN(C)C(=O)c1cccnc1 AIFCHEM-5809080333 [0,1,1,0,0,0|0,0,1]=3 66 B13R1.47 CCCN(C)C(=O)c1cccnn1 AIFCHEM-5825573475 [0,1,1,0,0,0|1,0,1]=4 67 B13R1.47 CCCN(C)C(=O)c1ccnnc1 AIFCHEM-5802370955 [0,1,1,0,0,0|1,0,1]=4 68 B13R1.47 CCCN(C)C(=O)c1cnccn1 AIFCHEM-5802423192 [0,1,1,0,0,0|1,0,1]=4 69 B13R1.79 CCN(CCO)Cc1cccnn1 AIFCHEM-6502709704 [0,1,1,0,0,0|2,0,0]=4 70 B13R1.79 OCCN(CO)Cc1cncnc1 AIFCHEM-94574942715 [0,1,1,0,0,0|2,0,0]=4 71 B13R1.135 CC(CO)N(C)Cc1cccnc1 AIFCHEM-6466472087 [0,1,1,0,0,0|1,0,0]=3 72 B13R1.135 CC(CO)N(C)Cc1cncnc1 AIFCHEM-6402688650 [0,1,1,0,0,0|2,0,0]=4 73 B13R1.135 CCC(=O)N(C)Cc1ccccc1 AIFCHEM-94536109342 [0,1,1,0,0,0|1,0,1]=4 74 B13R1.135 CCC(C)N(C)Cc1ccccn1 AIFCHEM-6202707966 [0,1,1,0,0,0|2,0,0]=4 75 B13R1.135 CCC(C)N(C)Cc1cccnc1 AIFCHEM-6240797708 [0,1,1,0,0,0|0,0,0]=2 76 B13R1.135 CCC(C)N(C)Cc1cccnn1 AIFCHEM-6272088622 [0,1,1,0,0,0|1,0,0]=3 77 B13R1.135 C[C@@H](CO)N(C)Cc1cccnc1 AIFCHEM-94590939334 [0,1,1,0,0,0|1,0,0]=3 78 B13R1.135 C[C@@H](CO)N(C)Cc1cncnc1 AIFCHEM-94590935184 [0,1,1,0,0,0|2,0,0]=4 79 B13R1.135 C[C@H](CO)N(C)Cc1cccnc1 AIFCHEM-6438012936 [0,1,1,0,0,0|1,0,0]=3 80 B13R1.135 C[C@H](CO)N(C)Cc1cncnc1 AIFCHEM-6417442641 [0,1,1,0,0,0|2,0,0]=4 81 B13R1.348 CC(C)CN(C)Cc1cccnc1 AIFCHEM-5722438368 [0,1,1,0,0,0|0,0,0]=2 82 B13R1.348 CC(C)CN(C)Cc1cnccn1 AIFCHEM-5782327662 [0,1,1,0,0,0|1,0,0]=3 83 B13R1.348 CC(C)CN(C)Cc1cncnc1 AIFCHEM-5736289770 [0,1,1,0,0,0|1,0,0]=3 84 B13R1.348 CN(CC(=O)N)Cc1cccnc1 AIFCHEM-94564510415 [0,1,1,0,0,0|1,0,1]=4 85 B13R1.348 CN(Cc1cncnc1)CC(F)F AIFCHEM-5955768233 [0,1,1,0,0,0|2,0,0]=4 86 B13R1.470 CCCN(C)Cc1ccccc1Cl AIFCHEM-94569024444 [0,1,1,0,0,0|1,0,0]=3 87 B13R1.470 CCCN(C)Cc1ccccc1F AIFCHEM-5878765147 [0,1,1,0,0,0|1,0,0]=3 88 B13R1.470 CCCN(C)Cc1ccccc1O AIFCHEM-94532467853 [0,1,1,0,0,0|1,0,0]=3 89 B13R1.470 CCCN(C)Cc1cccnc1Br AIFCHEM-5825087423 [0,1,1,0,0,0|0,0,0]=2 90 B13R1.470 CCCN(C)Cc1ccncc1Br AIFCHEM-5802137196 [0,1,1,0,0,0|2,0,0]=4 91 B13R1.470 CCCN(C)Cc1ccncc1Cl AIFCHEM-5801921193 [0,1,1,0,0,0|2,0,0]=4 92 B13R1.470 CCCN(C)Cc1ccncc1F AIFCHEM-5808765944 [0,1,1,0,0,0|2,0,0]=4 93 B13R1.470 CCCN(C)Cc1cnccc1Br AIFCHEM-5878892533 [0,1,1,0,0,0|0,0,0]=2 94 B13R1.470 CCCN(C)Cc1nccnc1Cl AIFCHEM-5808956654 [0,1,1,0,0,0|1,0,0]=3 95 B13R1.470 CN(CC#N)Cc1cccnc1F AIFCHEM-94589148492 [0,1,1,0,0,0|1,0,1]=4 96 B13R1.470 CN(CCO)Cc1ccccc1I AIFCHEM-6408505971 [0,1,1,0,0,0|2,0,0]=4 97 B13R1.470 CN(CCO)Cc1ccccc1O AIFCHEM-94532456195 [0,1,1,0,0,0|2,0,0]=4 98 B13R1.470 CN(CCO)Cc1cccnc1O AIFCHEM-94541094068 [0,1,1,0,0,0|1,0,0]=3 99 B13R1.470 CN(CCO)Cc1cnccc1O AIFCHEM-94548507626 [0,1,1,0,0,0|1,0,0]=3 100 B13R1.470 Cc1ccncc1CN(C)CCO AIFCHEM-6475124385 [0,1,1,0,0,0|1,0,0]=3 101 B13R1.21 CCN(C)[C@@H](C)c1ccc(cc1)Cl AIFCHEM-94537418041 [0,1,1,0,0,0|1,0,0]=3 102 B13R1.22 CCN(C)C(=O)c1cncc(c1)Br AIFCHEM-6125636344 [0,1,1,0,0,0|1,0,1]=4 103 B13R1.152 CC(C)N(C)C(=O)c1cccnc1 AIFCHEM-94547948982 [0,1,1,0,0,0|1,0,1]=4 104 B13R2.13 Oc1cncc(c1)C2=CCCC2 AIFCHEM-6391086130 [1,1,0,0,0,0|1,0,1]=4 105 B13R2.18 Nc1ccncc1C2=CCCC2 AIFCHEM-5821394232 [1,1,0,0,0,0|1,0,1]=4 106 B15R2.28 CN1CCC=C(C1)c2ccc(nc2)N AIFCHEM-5762214663 [0,1,0,0,0,1|0,0,2]=4 107 B15R2.28 CN1CCC=C(C1)c2ccc(nc2)O AIFCHEM-94542526853 [0,1,0,0,0,1|0,0,2]=4 108 B15R2.332 CN1CCC=C(C1)c2cccnc2N AIFCHEM-5929488049 [0,1,0,0,0,1|0,0,2]=4 109 B15R2.21 CCN1CCCCC1c2ccccc2 AIFCHEM-94537420532 [0,1,0,0,0,1|1,0,0]=3 110 B15R2.21 CCN1CCCCC1c2cccnc2 AIFCHEM-94537414347 [0,1,0,0,0,1|0,0,0]=2 111 B15R2.21 CCN1CCCC[C@@H]1c2ccccc2 AIFCHEM-94537423226 [0,1,0,0,0,1|1,0,0]=3 112 B15R2.21 CCN1CCCC[C@H]1c2ccccc2 AIFCHEM-94537424631 [0,1,0,0,0,1|1,0,0]=3 113 B15R2.118 CCC1CCCC1Nc2ccccc2 AIFCHEM-94552035882 [0,1,0,0,0,1|2,0,0]=4 114 B15R2.335 CC1CCCC1Nc2cncc(c2)Br AIFCHEM-6196149806 [0,1,0,0,0,1|1,0,0]=3 115 B15R2.335 CC1CCCN1Cc2cncc(c2)Br AIFCHEM-94592632692 [0,1,0,0,0,1|2,0,0]=4 116 B15R2.335 CC1CCCN1Cc2cncc(c2)O AIFCHEM-94592632467 [0,1,0,0,0,1|2,0,0]=4 117 B15R2.335 C[C@@H]1CCCN1Cc2cncc(c2)Br AIFCHEM-6052736144 [0,1,0,0,0,1|2,0,0]=4 118 B15R2.335 C[C@@H]1CCCN1Cc2cncc(c2)O AIFCHEM-6065742391 [0,1,0,0,0,1|2,0,0]=4 119 B15R2.335 C[C@H]1CCCN1Cc2cncc(c2)Br AIFCHEM-5676416237 [0,1,0,0,0,1|2,0,0]=4 120 B15R2.335 C[C@H]1CCCN1Cc2cncc(c2)O AIFCHEM-94569861156 [0,1,0,0,0,1|2,0,0]=4 121 B15R2.335 Cc1cncc(c1)CN2CCCC2C AIFCHEM-94592632249 [0,1,0,0,0,1|2,0,0]=4 122 B15R2.335 Cc1cncc(c1)CN2CCC[C@@H]2C AIFCHEM-5676539672 [0,1,0,0,0,1|2,0,0]=4 123 B15R2.335 Cc1cncc(c1)CN2CCC[C@H]2C AIFCHEM-6065845386 [0,1,0,0,0,1|2,0,0]=4 124 B15R2.359 CC1CCCC1Nc2ccccc2F AIFCHEM-6021947408 [0,1,0,0,0,1|2,0,0]=4 125 B15R2.359 CC1CCCN1Cc2cccnc2O AIFCHEM-5780121761 [0,1,0,0,0,1|2,0,0]=4 126 B15R2.359 CC1CCCN1Cc2cnccc2Br AIFCHEM-94592632734 [0,1,0,0,0,1|2,0,0]=4 127 B15R2.359 CC1CCCN1Cc2cnccc2Cl AIFCHEM-94592632715 [0,1,0,0,0,1|2,0,0]=4 128 B15R2.359 C[C@@H]1CCCN1Cc2cccnc2O AIFCHEM-6077822215 [0,1,0,0,0,1|2,0,0]=4 129 B15R2.359 C[C@@H]1CCCN1Cc2cnccc2Br AIFCHEM-94548508585 [0,1,0,0,0,1|2,0,0]=4 130 B15R2.359 C[C@@H]1CCCN1Cc2cnccc2Cl AIFCHEM-94548508566 [0,1,0,0,0,1|2,0,0]=4 131 B15R2.359 C[C@H]1CCCN1Cc2cccnc2O AIFCHEM-94541098798 [0,1,0,0,0,1|2,0,0]=4 132 B15R2.359 C[C@H]1CCCN1Cc2cnccc2Br AIFCHEM-94569861423 [0,1,0,0,0,1|2,0,0]=4 133 B15R2.359 C[C@H]1CCCN1Cc2cnccc2Cl AIFCHEM-94569861404 [0,1,0,0,0,1|2,0,0]=4 134 B15R2.359 Cc1ncccc1NC2CCCC2C AIFCHEM-5850802008 [0,1,0,0,0,1|1,0,0]=3 135 B15R2.1510 CC1CCCC1Nc2ccc(cc2)F AIFCHEM-94540060868 [0,1,0,0,0,1|2,0,0]=4 136 B15R2.22 CCN1CCCC1c2ccc(cc2)Cl AIFCHEM-94537413158 [0,2,0,0,0,0|1,0,0]=3 137 B15R2.22 CCN1CCC[C@@H]1c2ccc(cc2)Cl AIFCHEM-94537413464 [0,2,0,0,0,0|1,0,0]=3 138 B15R2.22 CCN1CCC[C@H]1c2ccc(cc2)Cl AIFCHEM-94537413609 [0,2,0,0,0,0|1,0,0]=3 139 B15R2.63 CC(=O)N1CCCC1c2ccccc2 AIFCHEM-94535587997 [0,2,0,0,0,0|1,0,0]=3 140 B15R2.63 CC(=O)N1CCC[C@@H]1c2ccccc2 AIFCHEM-5702072090 [0,2,0,0,0,0|1,0,0]=3 141 B15R2.63 CC(=O)N1CCC[C@H]1c2ccccc2 AIFCHEM-5959995798 [0,2,0,0,0,0|1,0,0]=3 142 B15R2.72 CCCN1CCCC1c2ccncc2 AIFCHEM-94569011313 [0,2,0,0,0,0|2,0,0]=4 143 B15R2.72 CCCN1CCC[C@H]1c2ccncc2 AIFCHEM-94569016623 [0,2,0,0,0,0|2,0,0]=4 144 B15R2.2188 CCN1CCCC1c2cccc(c2)Br AIFCHEM-94537421009 [0,2,0,0,0,0|1,0,0]=3 145 B15R2.2188 CCN1CCC[C@H]1c2cccc(c2)Br AIFCHEM-94537415077 [0,2,0,0,0,0|1,0,0]=3 146 B15R2.2348 CCN1CCCC1c2ccccc2Br AIFCHEM-94537413075 [0,2,0,0,0,0|1,0,0]=3 147 B15R2.2348 CCN1CCCC1c2ccccc2C AIFCHEM-94537414275 [0,2,0,0,0,0|1,0,0]=3 148 B15R2.2348 CCN1CCC[C@@H]1c2ccccc2C AIFCHEM-94537414983 [0,2,0,0,0,0|1,0,0]=3 149 B15R2.2348 CCN1CCC[C@H]1c2ccccc2Br AIFCHEM-94537413450 [0,2,0,0,0,0|1,0,0]=3 150 B13R2.64 c1cncc(c1)CN2CCSC2 AIFCHEM-5624219579 [0,0,1,1,0,0|2,0,0]=4 151 B13R2.2383 c1cncc(c1)CNC2CSC2 AIFCHEM-6276866088 [0,0,1,1,0,0|2,0,0]=4 152 B13R2.26 CCCN1Cc2cncnc2C1 AIFCHEM-94568733596 [0,0,1,1,0,0|1,0,0]=3 153 B13R2.31 FC1CN(C1)Cc2cnccn2 AIFCHEM-5599980217 [0,0,1,1,0,0|2,0,0]=4 154 B13R2.31 FC1CN(C1)Cc2cncnc2 AIFCHEM-5600028189 [0,0,1,1,0,0|2,0,0]=4 155 B13R2.444 CC(=Cc1cccnc1)C2CC2 AIFCHEM-6317718122 [0,0,1,1,0,0|1,0,1]=4 156 B13R2.444 CN(Cc1cnccn1)C2CC2 AIFCHEM-94542481855 [0,0,1,1,0,0|1,0,0]=3 157 B13R2.8137 CC(c1ccccn1)N2CCC2 AIFCHEM-94604918966 [0,0,1,1,0,0|2,0,0]=4 158 B11R1.30 CCCN(C)Cc1ccsc1 AIFCHEM-5860062278 [0,0,1,0,1,0|1,0,0]=3 159 B11R1.30 CCCN(C)Cc1cn[nH]c1 AIFCHEM-94528444078 [0,0,1,0,1,0|1,0,0]=3 160 B11R1.30 CCCN(C)Cc1ncco1 AIFCHEM-5878772510 [0,0,1,0,1,0|1,0,0]=3 161 B11R1.30 CN(CCO)Cc1c[nH]cn1 AIFCHEM-94548504570 [0,0,1,0,1,0|2,0,0]=4 162 B11R1.30 CN(CCO)Cc1cc[nH]n1 AIFCHEM-94524655251 [0,0,1,0,1,0|2,0,0]=4 163 B11R1.30 CN(CCO)Cc1cccs1 AIFCHEM-6388930207 [0,0,1,0,1,0|2,0,0]=4 164 B11R1.30 CN(CCO)Cc1ccsc1 AIFCHEM-6475062972 [0,0,1,0,1,0|2,0,0]=4 165 B11R1.30 CN(CCO)Cc1cn[nH]c1 AIFCHEM-6448891093 [0,0,1,0,1,0|2,0,0]=4 166 B13R1.11 CC(CO)NC(C)c1cccnc1 AIFCHEM-94523871213 [0,0,1,0,0,1|2,0,0]=4 167 B13R1.11 CC(CO)N[C@@H](C)c1cccnc1 AIFCHEM-94593281198 [0,0,1,0,0,1|2,0,0]=4 168 B13R1.11 CC(CO)N[C@H](C)c1cccnc1 AIFCHEM-94529444783 [0,0,1,0,0,1|2,0,0]=4 169 B13R1.11 CC(N[C@@H](C)CF)c1cccnc1 AIFCHEM-6011365850 [0,0,1,0,0,1|2,0,0]=4 170 B13R1.11 CC(N[C@@H](C)CO)c1cccnc1 AIFCHEM-6446510979 [0,0,1,0,0,1|2,0,0]=4 171 B13R1.11 CC(N[C@H](C)CO)c1cccnc1 AIFCHEM-6394434017 [0,0,1,0,0,1|2,0,0]=4 172 B15R2.31 CN1CCCC(C1)Nc2ccccc2 AIFCHEM-94552035594 [0,0,0,0,0,2|1,0,0]=3 173 B15R2.38 C[C@@H]1CCCCN1Cc2cccnc2 AIFCHEM-5743160370 [0,0,0,0,0,2|2,0,0]=4 174 B15R2.38 C[C@H]1CCCCN1Cc2cccnc2 AIFCHEM-94588085762 [0,0,0,0,0,2|2,0,0]=4 175 B15R2.38 OC1CCCCC1Nc2cccnc2 AIFCHEM-94531005630 [0,0,0,0,0,2|2,0,0]=4 176 B15R2.55 CC1CCCC1NCc2ccccc2 AIFCHEM-94539145124 [0,0,0,0,0,2|2,0,0]=4 177 B15R2.55 CC1CCCC1NCc2cnccn2 AIFCHEM-94604412654 [0,0,0,0,0,2|2,0,0]=4