0 B17R3.54615 Oc1cc2ccccc2c3c1cccc3 271570a_203496583355_100009813645 [0,0,0,0,0,0|1,0,0]=1 1 B17R3.54615 Oc1cc2cccnc2c3c1cccc3 271570a_203496583355_100050056114 [0,0,0,0,0,0|2,0,0]=2 2 B17R3.54615 Oc1cc2cccnc2c3c1cccn3 271570a_203496583355_100009991584 [0,0,0,0,0,0|3,0,0]=3 3 B17R3.54615 Oc1nc2ccccc2c3c1cccc3 271570a_203496583355_100000028652 [0,0,0,0,0,0|2,0,0]=2 4 B18R3.159486 C=Cc1cc2ccccc2c3c1cccc3 271570a_100011290941_100009813645 [0,1,0,0,0,0|1,0,0]=2 5 B18R3.159486 C=Cc1cc2cccnc2c3c1cccc3 271570a_100011290941_100050056114 [0,1,0,0,0,0|2,0,0]=3 6 B18R3.159486 C=Cc1cc2cccnc2c3c1cccn3 271570a_100011290941_100009991584 [0,1,0,0,0,0|3,0,0]=4 7 B18R3.159486 C=Cc1nc2ccccc2c3c1cccc3 271570a_100011290941_100000028652 [0,1,0,0,0,0|2,0,0]=3 8 B18R3.159486 CNc1cc2ccccc2c3c1cccc3 34a_100000029970_200000210301 [0,1,0,0,0,0|0,0,0]=1 9 B18R3.159486 CNc1cc2cccnc2c3c1cccn3 27a_100102657272_100009991584 [0,1,0,0,0,0|2,0,0]=3 10 B18R3.159486 CNc1nc2ccccc2c3c1cccc3 27a_100102657272_100000028652 [0,1,0,0,0,0|1,0,0]=2 11 B18R3.159486 COc1cc2ccccc2c3c1cccc3 34a_100000036577_200000210301 [0,1,0,0,0,0|1,0,0]=2 12 B18R3.159486 COc1cc2ccccc2c3c1cccc3 7a_100000036577_200000210301 [0,1,0,0,0,0|1,0,0]=2 13 B18R3.159486 CSc1cc2ccccc2c3c1cccc3 62a_200000210301_100009813645 [0,1,0,0,0,0|1,0,0]=2 14 B18R3.159486 CSc1cc2cccnc2c3c1cccc3 62a_200000210301_100050056114 [0,1,0,0,0,0|2,0,0]=3 15 B18R3.159486 CSc1cc2cccnc2c3c1cccn3 62a_200000210301_100009991584 [0,1,0,0,0,0|3,0,0]=4 16 B18R3.159486 CSc1nc2ccccc2c3c1cccc3 62a_200000210301_100000028652 [0,1,0,0,0,0|2,0,0]=3 17 B18R3.159486 [13CH3]Nc1cc2ccccc2c3c1cccc3 34a_100000029970_200025704644 [0,1,0,0,0,0|0,0,0]=1 18 B18R3.159486 [13CH3]Oc1cc2ccccc2c3c1cccc3 34a_100000036577_200025704644 [0,1,0,0,0,0|1,0,0]=2 19 B18R3.159486 [13CH3]Oc1cc2ccccc2c3c1cccc3 7a_100000036577_200025704644 [0,1,0,0,0,0|1,0,0]=2 20 B18R3.159486 [13CH3]Sc1cc2ccccc2c3c1cccc3 62a_200025704644_100009813645 [0,1,0,0,0,0|1,0,0]=2 21 B18R3.159486 [13CH3]Sc1cc2cccnc2c3c1cccc3 62a_200025704644_100050056114 [0,1,0,0,0,0|2,0,0]=3 22 B18R3.159486 [13CH3]Sc1cc2cccnc2c3c1cccn3 62a_200025704644_100009991584 [0,1,0,0,0,0|3,0,0]=4 23 B18R3.159486 [13CH3]Sc1nc2ccccc2c3c1cccc3 62a_200025704644_100000028652 [0,1,0,0,0,0|2,0,0]=3 24 B16R2.87 C=C(C)c1ccccc1c2ccccc2 271570a_100000694244_100000033479 [0,0,1,0,0,0|1,0,0]=2 25 B16R2.87 C=C(C)c1ccccc1c2ccccn2 271570a_100000694244_100010202516 [0,0,1,0,0,0|2,0,0]=3 26 B16R2.87 C=C(C)c1ccccc1c2ccncc2 271570a_100000694244_100010154595 [0,0,1,0,0,0|2,0,0]=3 27 B16R2.87 C=C(C)c1cccnc1c2ccccc2 271570a_100000694244_100010138707 [0,0,1,0,0,0|2,0,0]=3 28 B16R2.87 C=C(C)c1cnccc1c2ccccc2 271570a_100000694244_100009816686 [0,0,1,0,0,0|2,0,0]=3 29 B16R2.87 C=C(C)c1cncnc1c2ccccc2 271570a_100000694244_200009816525 [0,0,1,0,0,0|3,0,0]=4 30 B16R2.87 CC(=O)c1ccccc1c2ccccc2 1458a_100000211553_200000210301 [0,0,1,0,0,0|1,0,1]=3 31 B16R2.87 CC(=O)c1ccccc1c2ccccc2 271570a_100010158976_100000210277 [0,0,1,0,0,0|1,0,1]=3 32 B16R2.87 CC(=O)c1ccccc1c2ccccc2 271570a_100011218836_100000751169 [0,0,1,0,0,0|1,0,1]=3 33 B16R2.87 CC(=O)c1ccccc1c2ccccn2 1458a_200011894344_200000210301 [0,0,1,0,0,0|2,0,1]=4 34 B16R2.87 CC(=O)c1ccccc1c2ccccn2 271570a_100010158976_100011216584 [0,0,1,0,0,0|2,0,1]=4 35 B16R2.87 CC(=O)c1ccccc1c2ccccn2 271570a_100011264011_100000751169 [0,0,1,0,0,0|2,0,1]=4 36 B16R2.87 CC(=O)c1ccccc1c2cccnc2 1458a_100011399806_200000210301 [0,0,1,0,0,0|2,0,1]=4 37 B16R2.87 CC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000751169 [0,0,1,0,0,0|2,0,1]=4 38 B16R2.87 CC(=O)c1ccccc1c2cccnc2 271570a_100010158976_100000752921 [0,0,1,0,0,0|2,0,1]=4 39 B16R2.87 CC(=O)c1ccccc1c2ccncc2 1458a_100025775821_200000210301 [0,0,1,0,0,0|2,0,1]=4 40 B16R2.87 CC(=O)c1ccccc1c2ccncc2 271570a_100000752145_100000751169 [0,0,1,0,0,0|2,0,1]=4 41 B16R2.87 CC(=O)c1ccccc1c2ccncc2 271570a_100010158976_100000035832 [0,0,1,0,0,0|2,0,1]=4 42 B16R2.87 CC(=O)c1cccnc1c2ccccc2 271570a_100011218836_100000753718 [0,0,1,0,0,0|2,0,1]=4 43 B16R2.87 CC(=O)c1ccncc1c2ccccc2 271570a_100011218836_100009993184 [0,0,1,0,0,0|2,0,1]=4 44 B16R2.87 CC(=O)c1cnccc1c2ccccc2 271570a_100011218836_100160469449 [0,0,1,0,0,0|2,0,1]=4 45 B16R2.87 CC(=O)c1ncccc1c2ccccc2 271570a_100011218836_100012348690 [0,0,1,0,0,0|2,0,1]=4 46 B16R2.87 CC(C)c1ccccc1c2ccccc2 271570a_100011218836_100011218076 [0,0,1,0,0,0|1,0,2]=4 47 B16R2.87 CC(C)c1ccccc1c2ccccc2 271570a_100011218925_100000210277 [0,0,1,0,0,0|1,0,2]=4 48 B16R2.87 CC(N)c1ccccc1c2ccccc2 271570a_100011218836_100000181357 [0,0,1,0,0,0|0,0,2]=3 49 B16R2.87 CC(N)c1ccccc1c2ccccn2 271570a_100011264011_100000181357 [0,0,1,0,0,0|1,0,2]=4 50 B16R2.87 CC(N)c1ccccc1c2cccnc2 271570a_100000757648_100000181357 [0,0,1,0,0,0|1,0,2]=4 51 B16R2.87 CC(N)c1ccccc1c2ccncc2 271570a_100000752145_100000181357 [0,0,1,0,0,0|1,0,2]=4 52 B16R2.87 CC(N)c1ncccc1c2ccccc2 271570a_100011218836_100159271932 [0,0,1,0,0,0|1,0,2]=4 53 B16R2.87 CC(O)c1ccccc1c2ccccc2 271570a_100011218836_100000702211 [0,0,1,0,0,0|1,0,2]=4 54 B16R2.87 CN(C)c1ccccc1c2ccccc2 2230a_100000745565_200000210301 [0,0,1,0,0,0|2,0,1]=4 55 B16R2.87 CN(C)c1ccccc1c2ccccc2 269982a_100000745565_200000210301 [0,0,1,0,0,0|2,0,1]=4 56 B16R2.87 CN(C)c1ccccc1c2ccccc2 271570a_100000698014_100000210277 [0,0,1,0,0,0|2,0,1]=4 57 B16R2.87 CN(C)c1ccccc1c2ccccc2 271570a_100011218836_100011290883 [0,0,1,0,0,0|2,0,1]=4 58 B16R2.87 CN(C)c1ccccc1c2ccccc2 34a_100000745565_200000210301 [0,0,1,0,0,0|2,0,1]=4 59 B16R2.87 CN([13CH3])c1ccccc1c2ccccc2 2230a_100000745565_200025704644 [0,0,1,0,0,0|2,0,1]=4 60 B16R2.87 CN([13CH3])c1ccccc1c2ccccc2 269982a_100000745565_200025704644 [0,0,1,0,0,0|2,0,1]=4 61 B16R2.87 CN([13CH3])c1ccccc1c2ccccc2 34a_100000745565_200025704644 [0,0,1,0,0,0|2,0,1]=4 62 B16R2.87 CS(=O)c1ccccc1c2ccccc2 271570a_100000040274_100000210277 [0,0,1,0,0,0|2,0,1]=4 63 B16R2.87 CS(=O)c1ccccc1c2ccccc2 271570a_100011218836_100000734199 [0,0,1,0,0,0|2,0,1]=4 64 B16R2.87 FC(F)c1ccccc1c2ccccc2 271570a_100011218836_100010169824 [0,0,1,0,0,0|2,0,1]=4 65 B16R2.87 NC(=O)c1ccccc1c2ccccc2 271570a_100000041535_100000210277 [0,0,1,0,0,0|1,0,0]=2 66 B16R2.87 NC(=O)c1ccccc1c2ccccc2 271570a_100011218836_100000162227 [0,0,1,0,0,0|1,0,0]=2 67 B16R2.87 NC(=O)c1ccccc1c2ccccn2 271570a_100000041535_100011216584 [0,0,1,0,0,0|2,0,0]=3 68 B16R2.87 NC(=O)c1ccccc1c2ccccn2 271570a_100011264011_100000162227 [0,0,1,0,0,0|2,0,0]=3 69 B16R2.87 NC(=O)c1ccccc1c2cccnc2 271570a_100000041535_100000752921 [0,0,1,0,0,0|2,0,0]=3 70 B16R2.87 NC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000162227 [0,0,1,0,0,0|2,0,0]=3 71 B16R2.87 NC(=O)c1ccccc1c2cccnn2 271570a_100000041535_100016991348 [0,0,1,0,0,0|3,0,0]=4 72 B16R2.87 NC(=O)c1ccccc1c2ccncc2 271570a_100000041535_100000035832 [0,0,1,0,0,0|2,0,0]=3 73 B16R2.87 NC(=O)c1ccccc1c2ccncc2 271570a_100000752145_100000162227 [0,0,1,0,0,0|2,0,0]=3 74 B16R2.87 NC(=O)c1ccccc1c2ccncn2 271570a_100000041535_100000703185 [0,0,1,0,0,0|3,0,0]=4 75 B16R2.87 NC(=O)c1ccccc1c2ccnnc2 271570a_100000041535_100000732662 [0,0,1,0,0,0|3,0,0]=4 76 B16R2.87 NC(=O)c1ccccc1c2cnccn2 271570a_100000041535_100000758340 [0,0,1,0,0,0|3,0,0]=4 77 B16R2.87 NC(=O)c1ccccc1c2cnccn2 271570a_100011962566_100000162227 [0,0,1,0,0,0|3,0,0]=4 78 B16R2.87 NC(=O)c1ccccc1c2cncnc2 271570a_100000041535_100011206942 [0,0,1,0,0,0|3,0,0]=4 79 B16R2.87 NC(=O)c1ccccc1c2cncnc2 271570a_100000707473_100000162227 [0,0,1,0,0,0|3,0,0]=4 80 B16R2.87 NC(=O)c1ccccc1c2ncccn2 271570a_100000041535_100000211032 [0,0,1,0,0,0|3,0,0]=4 81 B16R2.87 NC(=O)c1cccnc1c2ccccc2 271570a_100011218836_100000162199 [0,0,1,0,0,0|2,0,0]=3 82 B16R2.87 NC(=O)c1cccnc1c2ccccn2 271570a_100011264011_100000162199 [0,0,1,0,0,0|3,0,0]=4 83 B16R2.87 NC(=O)c1cccnc1c2cccnc2 271570a_100000757648_100000162199 [0,0,1,0,0,0|3,0,0]=4 84 B16R2.87 NC(=O)c1cccnc1c2ccncc2 271570a_100000752145_100000162199 [0,0,1,0,0,0|3,0,0]=4 85 B16R2.87 NC(=O)c1ccncc1c2ccccc2 271570a_100011218836_100010205435 [0,0,1,0,0,0|2,0,0]=3 86 B16R2.87 NC(=O)c1ccncc1c2ccccn2 271570a_100011264011_100010205435 [0,0,1,0,0,0|3,0,0]=4 87 B16R2.87 NC(=O)c1ccncc1c2cccnc2 271570a_100000757648_100010205435 [0,0,1,0,0,0|3,0,0]=4 88 B16R2.87 NC(=O)c1ccncc1c2ccncc2 271570a_100000752145_100010205435 [0,0,1,0,0,0|3,0,0]=4 89 B16R2.87 NC(=O)c1cnccc1c2ccccc2 271570a_100011218836_100000697804 [0,0,1,0,0,0|2,0,0]=3 90 B16R2.87 NC(=O)c1cnccc1c2ccccn2 271570a_100011264011_100000697804 [0,0,1,0,0,0|3,0,0]=4 91 B16R2.87 NC(=O)c1cnccc1c2cccnc2 271570a_100000757648_100000697804 [0,0,1,0,0,0|3,0,0]=4 92 B16R2.87 NC(=O)c1cnccc1c2ccncc2 271570a_100000752145_100000697804 [0,0,1,0,0,0|3,0,0]=4 93 B16R2.87 NC(=O)c1ncccc1c2ccccc2 271570a_100011218836_200012359670 [0,0,1,0,0,0|2,0,0]=3 94 B16R2.87 NC(=O)c1ncccc1c2ccccn2 271570a_100011264011_200012359670 [0,0,1,0,0,0|3,0,0]=4 95 B16R2.87 NC(=O)c1ncccc1c2cccnc2 271570a_100000757648_200012359670 [0,0,1,0,0,0|3,0,0]=4 96 B16R2.87 NC(=O)c1ncccc1c2ccncc2 271570a_100000752145_200012359670 [0,0,1,0,0,0|3,0,0]=4 97 B16R2.87 NC(=O)c1nccnc1c2ccccc2 271570a_100011218836_100000094861 [0,0,1,0,0,0|3,0,0]=4 98 B16R2.87 O=[N+]([O-])c1ccccc1c2ccccc2 271570a_100000043317_100000210277 [0,0,1,0,0,0|3,0,0]=4 99 B16R2.87 OB(O)c1ccccc1c2ccccc2 271570a_100011218836_100000693059 [0,0,1,0,0,0|3,0,0]=4 100 B16R2.87 [13CH3]C(=O)c1ccccc1c2ccccc2 1458a_100000211553_200025704644 [0,0,1,0,0,0|1,0,1]=3 101 B16R2.87 [13CH3]C(=O)c1ccccc1c2ccccn2 1458a_200011894344_200025704644 [0,0,1,0,0,0|2,0,1]=4 102 B16R2.87 [13CH3]C(=O)c1ccccc1c2cccnc2 1458a_100011399806_200025704644 [0,0,1,0,0,0|2,0,1]=4 103 B16R2.87 [13CH3]C(=O)c1ccccc1c2ccncc2 1458a_100025775821_200025704644 [0,0,1,0,0,0|2,0,1]=4 104 B16R2.88 CC(Cc1ccccc1)c2ccccc2 271570a_100000062452_100000210277 [0,0,1,0,0,0|1,0,2]=4 105 B16R2.88 CC(Nc1ccccc1)c2ccccc2 34a_100000106764_100000211855 [0,0,1,0,0,0|2,0,1]=4 106 B16R2.88 CC(Oc1ccccc1)c2ccccc2 34a_100000210340_100000211855 [0,0,1,0,0,0|2,0,1]=4 107 B16R2.88 CC(Oc1ccccc1)c2ccccc2 7a_100000210340_100000230085 [0,0,1,0,0,0|2,0,1]=4 108 B16R2.88 CC(Sc1ccccc1)c2ccccc2 62a_100000230085_100000041952 [0,0,1,0,0,0|2,0,1]=4 109 B16R2.88 CC(Sc1ccccc1)c2ccccc2 62a_100000719477_100000230085 [0,0,1,0,0,0|2,0,1]=4 110 B16R2.88 CN(Cc1ccccc1)c2ccccc2 2230a_100000188819_200000210301 [0,0,1,0,0,0|2,0,1]=4 111 B16R2.88 CN(Cc1ccccc1)c2ccccc2 2230a_100000210012_100015291786 [0,0,1,0,0,0|2,0,1]=4 112 B16R2.88 CN(Cc1ccccc1)c2ccccc2 269982a_100000188819_200000210301 [0,0,1,0,0,0|2,0,1]=4 113 B16R2.88 CN(Cc1ccccc1)c2ccccc2 269982a_100000210012_100000211182 [0,0,1,0,0,0|2,0,1]=4 114 B16R2.88 CN(Cc1ccccc1)c2ccccc2 34a_100000188819_200000210301 [0,0,1,0,0,0|2,0,1]=4 115 B16R2.88 CN(Cc1ccccc1)c2ccccc2 34a_100000210012_100015291786 [0,0,1,0,0,0|2,0,1]=4 116 B16R2.88 O=C(Cc1ccccc1)c2ccccc2 1458a_100000185807_100015291786 [0,0,1,0,0,0|1,0,1]=3 117 B16R2.88 O=C(Cc1ccccn1)c2ccccc2 1458a_100000185807_100000721315 [0,0,1,0,0,0|2,0,1]=4 118 B16R2.88 O=C(Cc1cccnc1)c2ccccc2 1458a_100000185807_100000733263 [0,0,1,0,0,0|2,0,1]=4 119 B16R2.88 O=C(Cc1ccncc1)c2ccccc2 1458a_100000185807_100000705612 [0,0,1,0,0,0|2,0,1]=4 120 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 11a_100000106764_100000185807 [0,0,1,0,0,0|2,0,0]=3 121 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 1626a_100000106764_100000185807 [0,0,1,0,0,0|2,0,0]=3 122 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 22a_100000106764_100000185807 [0,0,1,0,0,0|2,0,0]=3 123 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 527a_100000106764_100000185807 [0,0,1,0,0,0|2,0,0]=3 124 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 2230a_100000188819_200025704644 [0,0,1,0,0,0|2,0,1]=4 125 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 269982a_100000188819_200025704644 [0,0,1,0,0,0|2,0,1]=4 126 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 34a_100000188819_200025704644 [0,0,1,0,0,0|2,0,1]=4 127 B16R2.98 C=C=Cc1ccccc1c2ccccc2 271570a_100015277604_100000033479 [0,0,1,0,0,0|1,0,1]=3 128 B16R2.98 C=C=Cc1ccccc1c2ccccn2 271570a_100015277604_100010202516 [0,0,1,0,0,0|2,0,1]=4 129 B16R2.98 C=C=Cc1ccccc1c2ccncc2 271570a_100015277604_100010154595 [0,0,1,0,0,0|2,0,1]=4 130 B16R2.98 C=C=Cc1cccnc1c2ccccc2 271570a_100015277604_100010138707 [0,0,1,0,0,0|2,0,1]=4 131 B16R2.98 C=C=Cc1cnccc1c2ccccc2 271570a_100015277604_100009816686 [0,0,1,0,0,0|2,0,1]=4 132 B16R2.98 C=CCc1ccccc1c2ccccc2 271570a_100011218836_100009828059 [0,0,1,0,0,0|1,0,1]=3 133 B16R2.98 C=CCc1ccccc1c2ccccc2 271570a_200010742005_100000210277 [0,0,1,0,0,0|1,0,1]=3 134 B16R2.98 C=CCc1ccccc1c2ccccn2 271570a_100011264011_100009828059 [0,0,1,0,0,0|2,0,1]=4 135 B16R2.98 C=CCc1ccccc1c2ccccn2 271570a_200010742005_100011216584 [0,0,1,0,0,0|2,0,1]=4 136 B16R2.98 C=CCc1ccccc1c2cccnc2 271570a_100000757648_100009828059 [0,0,1,0,0,0|2,0,1]=4 137 B16R2.98 C=CCc1ccccc1c2cccnc2 271570a_200010742005_100000752921 [0,0,1,0,0,0|2,0,1]=4 138 B16R2.98 C=CCc1ccccc1c2ccncc2 271570a_100000752145_100009828059 [0,0,1,0,0,0|2,0,1]=4 139 B16R2.98 C=CCc1ccccc1c2ccncc2 271570a_200010742005_100000035832 [0,0,1,0,0,0|2,0,1]=4 140 B16R2.98 CC=Cc1ccccc1c2ccccc2 271570a_100016259895_100000033479 [0,0,1,0,0,0|1,0,0]=2 141 B16R2.98 CC=Cc1ccccc1c2ccccn2 271570a_100016259895_100010202516 [0,0,1,0,0,0|2,0,0]=3 142 B16R2.98 CC=Cc1ccccc1c2ccncc2 271570a_100016259895_100010154595 [0,0,1,0,0,0|2,0,0]=3 143 B16R2.98 CC=Cc1cccnc1c2ccccc2 271570a_100016259895_100010138707 [0,0,1,0,0,0|2,0,0]=3 144 B16R2.98 CC=Cc1cnccc1c2ccccc2 271570a_100016259895_100009816686 [0,0,1,0,0,0|2,0,0]=3 145 B16R2.98 CC=Cc1cncnc1c2ccccc2 271570a_100016259895_200009816525 [0,0,1,0,0,0|3,0,0]=4 146 B16R2.98 CCNc1ccccc1c2ccccc2 271570a_100011218836_114873767003 [0,0,1,0,0,0|2,0,1]=4 147 B16R2.98 CCNc1ccccc1c2ccccc2 34a_100000210918_100000210202 [0,0,1,0,0,0|2,0,1]=4 148 B16R2.98 CCOc1ccccc1c2ccccc2 271570a_100011217569_100000210277 [0,0,1,0,0,0|2,0,1]=4 149 B16R2.98 CCOc1ccccc1c2ccccc2 271570a_100011218836_100000230754 [0,0,1,0,0,0|2,0,1]=4 150 B16R2.98 CCOc1ccccc1c2ccccc2 34a_100000210297_100000210202 [0,0,1,0,0,0|2,0,1]=4 151 B16R2.98 CCOc1ccccc1c2ccccc2 7a_100000210297_100000210202 [0,0,1,0,0,0|2,0,1]=4 152 B16R2.98 CCSc1ccccc1c2ccccc2 271570a_100011218836_100000230856 [0,0,1,0,0,0|2,0,1]=4 153 B16R2.98 CCSc1ccccc1c2ccccc2 271570a_200000040582_100000210277 [0,0,1,0,0,0|2,0,1]=4 154 B16R2.98 CCSc1ccccc1c2ccccc2 62a_100000033479_100000210202 [0,0,1,0,0,0|2,0,1]=4 155 B16R2.98 CCSc1ccccc1c2ccccc2 62a_100000210202_100000033479 [0,0,1,0,0,0|2,0,1]=4 156 B16R2.98 CNCc1ccccc1c2ccccc2 207a_100102657272_100011219292 [0,0,1,0,0,0|2,0,1]=4 157 B16R2.98 CNCc1ccccc1c2ccccc2 2230a_106832991635_100009813379 [0,0,1,0,0,0|2,0,1]=4 158 B16R2.98 CNCc1ccccc1c2ccccc2 270004a_106832991635_100011219292 [0,0,1,0,0,0|2,0,1]=4 159 B16R2.98 CNCc1ccccc1c2ccccc2 271570a_100011218836_100000184654 [0,0,1,0,0,0|2,0,1]=4 160 B16R2.98 CNCc1ccccc1c2ccccc2 34a_100000071662_200000210301 [0,0,1,0,0,0|2,0,1]=4 161 B16R2.98 CNCc1ccccc1c2ccccc2 34a_100102657272_100009813379 [0,0,1,0,0,0|2,0,1]=4 162 B16R2.98 CNCc1ccccc1c2ccccc2 7a_106832991635_100009813379 [0,0,1,0,0,0|2,0,1]=4 163 B16R2.98 COCc1ccccc1c2ccccc2 271570a_100011216666_100000210277 [0,0,1,0,0,0|2,0,1]=4 164 B16R2.98 COCc1ccccc1c2ccccc2 271570a_100011218836_100011493684 [0,0,1,0,0,0|2,0,1]=4 165 B16R2.98 COCc1ccccc1c2ccccc2 34a_100000032370_200000210301 [0,0,1,0,0,0|2,0,1]=4 166 B16R2.98 COCc1ccccc1c2ccccc2 34a_100138415774_100009813379 [0,0,1,0,0,0|2,0,1]=4 167 B16R2.98 COCc1ccccc1c2ccccc2 7a_100000032370_200000210301 [0,0,1,0,0,0|2,0,1]=4 168 B16R2.98 CSCc1ccccc1c2ccccc2 271570a_100011218836_100000148299 [0,0,1,0,0,0|2,0,1]=4 169 B16R2.98 CSCc1ccccc1c2ccccc2 62a_100009813379_200000210301 [0,0,1,0,0,0|2,0,1]=4 170 B16R2.98 CSCc1ccccc1c2ccccc2 62a_200000210301_100009813379 [0,0,1,0,0,0|2,0,1]=4 171 B16R2.98 FCNc1ccccc1c2ccccc2 34a_100000210918_100015361967 [0,0,1,0,0,0|2,0,1]=4 172 B16R2.98 FCOc1ccccc1c2ccccc2 34a_100000210297_100015361967 [0,0,1,0,0,0|2,0,1]=4 173 B16R2.98 FCOc1ccccc1c2ccccc2 7a_100000210297_100015361967 [0,0,1,0,0,0|2,0,1]=4 174 B16R2.98 FCSc1ccccc1c2ccccc2 62a_100000033479_100015361967 [0,0,1,0,0,0|2,0,1]=4 175 B16R2.98 FCSc1ccccc1c2ccccc2 62a_100015361967_100000033479 [0,0,1,0,0,0|2,0,1]=4 176 B16R2.98 N#CCc1ccccc1c2ccccc2 271570a_100000066961_100000210277 [0,0,1,0,0,0|0,0,3]=4 177 B16R2.98 N#CCc1ccccc1c2ccccc2 271570a_100011218836_100000033512 [0,0,1,0,0,0|0,0,3]=4 178 B16R2.98 NCCc1ccccc1c2ccccc2 271570a_100011218836_100000747383 [0,0,1,0,0,0|0,0,2]=3 179 B16R2.98 NCCc1ccccc1c2ccccn2 271570a_100011264011_100000747383 [0,0,1,0,0,0|1,0,2]=4 180 B16R2.98 NCCc1ccccc1c2cccnc2 271570a_100000757648_100000747383 [0,0,1,0,0,0|1,0,2]=4 181 B16R2.98 NCCc1ccccc1c2ccncc2 271570a_100000752145_100000747383 [0,0,1,0,0,0|1,0,2]=4 182 B16R2.98 NNCc1ccccc1c2ccccc2 271570a_100011218836_200016993956 [0,0,1,0,0,0|1,0,1]=3 183 B16R2.98 NNCc1ccccc1c2ccccn2 271570a_100011264011_200016993956 [0,0,1,0,0,0|2,0,1]=4 184 B16R2.98 NNCc1ccccc1c2cccnc2 271570a_100000757648_200016993956 [0,0,1,0,0,0|2,0,1]=4 185 B16R2.98 NNCc1ccccc1c2ccncc2 271570a_100000752145_200016993956 [0,0,1,0,0,0|2,0,1]=4 186 B16R2.98 O=CNc1ccccc1c2ccccc2 271570a_200000040256_100000210277 [0,0,1,0,0,0|2,0,0]=3 187 B16R2.98 O=CNc1ccccc1c2ccccn2 271570a_200000040256_100011216584 [0,0,1,0,0,0|3,0,0]=4 188 B16R2.98 O=CNc1ccccc1c2cccnc2 271570a_200000040256_100000752921 [0,0,1,0,0,0|3,0,0]=4 189 B16R2.98 O=CNc1ccccc1c2ccncc2 271570a_200000040256_100000035832 [0,0,1,0,0,0|3,0,0]=4 190 B16R2.98 OCCc1ccccc1c2ccccc2 271570a_100011218836_100000731337 [0,0,1,0,0,0|1,0,2]=4 191 B16R2.98 [13CH3]NCc1ccccc1c2ccccc2 34a_100000071662_200025704644 [0,0,1,0,0,0|2,0,1]=4 192 B16R2.98 [13CH3]OCc1ccccc1c2ccccc2 34a_100000032370_200025704644 [0,0,1,0,0,0|2,0,1]=4 193 B16R2.98 [13CH3]OCc1ccccc1c2ccccc2 7a_100000032370_200025704644 [0,0,1,0,0,0|2,0,1]=4 194 B16R2.98 [13CH3]SCc1ccccc1c2ccccc2 62a_100009813379_200025704644 [0,0,1,0,0,0|2,0,1]=4 195 B16R2.98 [13CH3]SCc1ccccc1c2ccccc2 62a_200025704644_100009813379 [0,0,1,0,0,0|2,0,1]=4 196 B16R2.98 [N-]=[N+]=Nc1ccccc1c2ccccc2 271570a_100011218836_100000762926 [0,0,1,0,0,0|2,0,1]=4 197 B16R2.1054 C=CCNc1cc(c2ccccc2c1)Br 34a_100010089974_100015514636 [0,0,1,0,0,0|2,0,1]=4 198 B16R2.1054 C=CCNc1cc(c2ccccc2c1)Br 7a_100010089974_100015514636 [0,0,1,0,0,0|2,0,1]=4 199 B16R2.1054 C=CCOc1cc(c2ccccc2c1)Br 34a_100010001680_100015514636 [0,0,1,0,0,0|2,0,1]=4 200 B16R2.1054 C=CCOc1cc(c2ccccc2c1)Br 7a_100010001680_100015514636 [0,0,1,0,0,0|2,0,1]=4 201 B16R2.1054 C=CCOc1cc(c2ncccc2c1)N 34a_100000083691_100015514636 [0,0,1,0,0,0|2,0,1]=4 202 B16R2.1054 C=CCSc1cc(c2ccccc2c1)N 62a_100000210623_100010171453 [0,0,1,0,0,0|1,0,1]=3 203 B16R2.1054 C=CCSc1cc(c2ccccc2c1)N 62a_100010171453_100000210623 [0,0,1,0,0,0|1,0,1]=3 204 B16R2.1054 C=CCSc1cc(c2ccccc2c1)O 62a_100000210623_100010089979 [0,0,1,0,0,0|2,0,1]=4 205 B16R2.1054 C=CCSc1cc(c2ccccc2n1)N 62a_100010197925_100000210623 [0,0,1,0,0,0|2,0,1]=4 206 B16R2.1054 C=CCSc1cc(c2cccnc2c1)N 62a_100000210623_200010263263 [0,0,1,0,0,0|2,0,1]=4 207 B16R2.1054 C=CCSc1cc(c2cccnc2c1)N 62a_200010263263_100000210623 [0,0,1,0,0,0|2,0,1]=4 208 B16R2.1054 C=CCSc1cc(c2ncccc2c1)N 62a_100000210623_100009814519 [0,0,1,0,0,0|2,0,1]=4 209 B16R2.1054 C=CCSc1cc2ccccc2c(n1)N 62a_100000210623_100009957331 [0,0,1,0,0,0|2,0,1]=4 210 B16R2.1054 C=CCSc1cc2ccccc2c(n1)N 62a_100009957331_100000210623 [0,0,1,0,0,0|2,0,1]=4 211 B16R2.1054 Nc1cc(cc2c1cccc2)SCC=O 62a_100010171453_200015260668 [0,0,1,0,0,0|2,0,1]=4 212 B16R2.1054 Nc1cc(cc2c1cccc2)SCC=O 62a_200015260668_100010171453 [0,0,1,0,0,0|2,0,1]=4 213 B16R2.1056 C=CCNc1cc2ccccc2cc1Br 34a_100009991566_100015514636 [0,0,1,0,0,0|2,0,1]=4 214 B16R2.1056 C=CCNc1cc2ccccc2cc1Br 7a_100009991566_100015514636 [0,0,1,0,0,0|2,0,1]=4 215 B16R2.1056 C=CCOc1cc2ccccc2cc1Br 34a_100009817189_100015514636 [0,0,1,0,0,0|2,0,1]=4 216 B16R2.1056 C=CCOc1cc2ccccc2cc1Br 7a_100009817189_100015514636 [0,0,1,0,0,0|2,0,1]=4 217 B16R2.1056 C=CCOc1cc2ccccc2cc1C 34a_100000091601_100015514636 [0,0,1,0,0,0|2,0,1]=4 218 B16R2.1056 C=CCOc1cc2ccccc2cc1C 7a_100000091601_100015514636 [0,0,1,0,0,0|2,0,1]=4 219 B16R2.1056 C=CCOc1cc2ccccc2cc1N 34a_106744474703_100015514636 [0,0,1,0,0,0|1,0,1]=3 220 B16R2.1056 C=CCOc1cc2ccccc2cc1N 7a_106744474703_100015514636 [0,0,1,0,0,0|1,0,1]=3 221 B16R2.1056 C=CCSc1cc2ccccc2cc1Br 62a_100000210623_200010169544 [0,0,1,0,0,0|2,0,1]=4 222 B16R2.1056 C=CCSc1cc2ccccc2cc1Br 62a_200010169544_100000210623 [0,0,1,0,0,0|2,0,1]=4 223 B16R2.1056 C=CCSc1cc2ccccc2cc1Cl 62a_100000210623_100010152806 [0,0,1,0,0,0|2,0,1]=4 224 B16R2.1056 C=CCSc1cc2ccccc2cc1Cl 62a_100010152806_100000210623 [0,0,1,0,0,0|2,0,1]=4 225 B16R2.1056 C=CCSc1cc2ccccc2cc1N 62a_100000210623_100009991566 [0,0,1,0,0,0|1,0,1]=3 226 B16R2.1056 C=CCSc1cc2ccccc2cc1N 62a_100009991566_100000210623 [0,0,1,0,0,0|1,0,1]=3 227 B16R2.1056 C=CCSc1cc2ccccc2cc1O 62a_100000210623_100009817189 [0,0,1,0,0,0|2,0,1]=4 228 B16R2.1056 C=CCSc1cc2ccccc2nc1N 62a_100010135404_100000210623 [0,0,1,0,0,0|2,0,1]=4 229 B16R2.1056 Nc1cc2ccccc2cc1OCC=O 34a_106744474703_200009817547 [0,0,1,0,0,0|2,0,1]=4 230 B16R2.1056 Nc1cc2ccccc2cc1OCC=O 7a_106744474703_200015260668 [0,0,1,0,0,0|2,0,1]=4 231 B16R2.1056 Nc1cc2ccccc2cc1SCC=O 62a_100009991566_200015260668 [0,0,1,0,0,0|2,0,1]=4 232 B16R2.1056 Nc1cc2ccccc2cc1SCC=O 62a_200015260668_100009991566 [0,0,1,0,0,0|2,0,1]=4 233 B16R2.2474 C#Cc1ccccc1c2ccccc2Br 271570a_100000099761_100000695589 [0,0,1,0,0,0|2,0,1]=4 234 B16R2.2474 C#Cc1ccccc1c2ccccc2C 271570a_100000099761_100000210755 [0,0,1,0,0,0|1,0,2]=4 235 B16R2.2474 C#Cc1ccccc1c2ccccc2Cl 271570a_100000099761_100000764095 [0,0,1,0,0,0|2,0,1]=4 236 B16R2.2474 C#Cc1ccccc1c2ccccc2F 271570a_100000099761_100011215700 [0,0,1,0,0,0|2,0,1]=4 237 B16R2.2474 C#Cc1ccccc1c2ccccc2N 271570a_100000099761_100000210017 [0,0,1,0,0,0|2,0,1]=4 238 B16R2.2474 C#Cc1ccccc1c2ccccc2O 271570a_100000099761_100000739446 [0,0,1,0,0,0|2,0,1]=4 239 B16R2.2474 C=Cc1ccccc1c2c[nH]ccc2=O 271570a_100000037480_100009998708 [0,0,1,0,0,0|3,0,0]=4 240 B16R2.2474 C=Cc1ccccc1c2c[nH]ccc2=S 271570a_100000037480_200012280681 [0,0,1,0,0,0|3,0,0]=4 241 B16R2.2474 C=Cc1ccccc1c2ccc[nH]c2=O 271570a_100000037480_100000050042 [0,0,1,0,0,0|3,0,0]=4 242 B16R2.2474 C=Cc1ccccc1c2cccc[n+]2C 271570a_100000037480_100000212160 [0,0,1,0,0,0|2,0,1]=4 243 B16R2.2474 C=Cc1ccccc1c2cccc[n+]2[O-] 271570a_100000037480_200000042595 [0,0,1,0,0,0|3,0,0]=4 244 B16R2.2474 C=Cc1ccccc1c2ccccc2Br 271570a_100000037480_100000695589 [0,0,1,0,0,0|2,0,0]=3 245 B16R2.2474 C=Cc1ccccc1c2ccccc2C 271570a_100000037480_100000210755 [0,0,1,0,0,0|1,0,1]=3 246 B16R2.2474 C=Cc1ccccc1c2ccccc2Cl 271570a_100000037480_100000764095 [0,0,1,0,0,0|2,0,0]=3 247 B16R2.2474 C=Cc1ccccc1c2ccccc2F 271570a_100000037480_100011215700 [0,0,1,0,0,0|2,0,0]=3 248 B16R2.2474 C=Cc1ccccc1c2ccccc2N 271570a_100000037480_100000210017 [0,0,1,0,0,0|2,0,0]=3 249 B16R2.2474 C=Cc1ccccc1c2ccccc2O 271570a_100000037480_100000739446 [0,0,1,0,0,0|2,0,0]=3 250 B16R2.2474 C=Cc1ccccc1c2cccnc2Br 271570a_100000037480_100010202626 [0,0,1,0,0,0|3,0,0]=4 251 B16R2.2474 C=Cc1ccccc1c2cccnc2C 271570a_100000037480_100000751574 [0,0,1,0,0,0|2,0,1]=4 252 B16R2.2474 C=Cc1ccccc1c2cccnc2Cl 271570a_100000037480_100000036424 [0,0,1,0,0,0|3,0,0]=4 253 B16R2.2474 C=Cc1ccccc1c2cccnc2F 271570a_100000037480_100009816115 [0,0,1,0,0,0|3,0,0]=4 254 B16R2.2474 C=Cc1ccccc1c2cccnc2N 271570a_100000037480_100000045569 [0,0,1,0,0,0|3,0,0]=4 255 B16R2.2474 C=Cc1ccccc1c2ccncc2Br 271570a_100000037480_100000726257 [0,0,1,0,0,0|3,0,0]=4 256 B16R2.2474 C=Cc1ccccc1c2ccncc2C 271570a_100000037480_100015191297 [0,0,1,0,0,0|2,0,1]=4 257 B16R2.2474 C=Cc1ccccc1c2ccncc2Cl 271570a_100000037480_100000708259 [0,0,1,0,0,0|3,0,0]=4 258 B16R2.2474 C=Cc1ccccc1c2ccncc2F 271570a_100000037480_100000047030 [0,0,1,0,0,0|3,0,0]=4 259 B16R2.2474 C=Cc1ccccc1c2ccncc2N 271570a_100000037480_100009815883 [0,0,1,0,0,0|3,0,0]=4 260 B16R2.2474 C=Cc1ccccc1c2ccncc2O 271570a_100000037480_100009817591 [0,0,1,0,0,0|3,0,0]=4 261 B16R2.2474 C=Cc1ccccc1c2cnccc2Br 271570a_100000037480_100010138639 [0,0,1,0,0,0|3,0,0]=4 262 B16R2.2474 C=Cc1ccccc1c2cnccc2C 271570a_100000037480_100000761580 [0,0,1,0,0,0|2,0,1]=4 263 B16R2.2474 C=Cc1ccccc1c2cnccc2Cl 271570a_100000037480_100009995489 [0,0,1,0,0,0|3,0,0]=4 264 B16R2.2474 C=Cc1ccccc1c2cnccc2F 271570a_100000037480_100009820683 [0,0,1,0,0,0|3,0,0]=4 265 B16R2.2474 C=Cc1ccccc1c2cnccc2N 271570a_100000037480_100000047001 [0,0,1,0,0,0|3,0,0]=4 266 B16R2.2474 C=Cc1ccccc1c2ncccc2Br 271570a_100000037480_100000696092 [0,0,1,0,0,0|3,0,0]=4 267 B16R2.2474 C=Cc1ccccc1c2ncccc2C 271570a_100000037480_100000751373 [0,0,1,0,0,0|2,0,1]=4 268 B16R2.2474 C=Cc1ccccc1c2ncccc2Cl 271570a_100000037480_100011356963 [0,0,1,0,0,0|3,0,0]=4 269 B16R2.2474 C=Cc1ccccc1c2ncccc2F 271570a_100000037480_100000685392 [0,0,1,0,0,0|3,0,0]=4 270 B16R2.2474 C=Cc1ccccc1c2ncccc2N 271570a_100000037480_100000688686 [0,0,1,0,0,0|3,0,0]=4 271 B16R2.2474 C=Cc1ccccc1c2ncccc2O 271570a_100000037480_100000034122 [0,0,1,0,0,0|3,0,0]=4 272 B16R2.2474 CCc1ccccc1c2ccccc2Br 271570a_100011216252_100000695589 [0,0,1,0,0,0|2,0,1]=4 273 B16R2.2474 CCc1ccccc1c2ccccc2C 271570a_100000747142_100011215823 [0,0,1,0,0,0|1,0,2]=4 274 B16R2.2474 CCc1ccccc1c2ccccc2C 271570a_100011216252_100000210755 [0,0,1,0,0,0|1,0,2]=4 275 B16R2.2474 CCc1ccccc1c2ccccc2Cl 271570a_100011216252_100000764095 [0,0,1,0,0,0|2,0,1]=4 276 B16R2.2474 CCc1ccccc1c2ccccc2Cl 271570a_100011934419_100011215823 [0,0,1,0,0,0|2,0,1]=4 277 B16R2.2474 CCc1ccccc1c2ccccc2F 271570a_100000761933_100011215823 [0,0,1,0,0,0|2,0,1]=4 278 B16R2.2474 CCc1ccccc1c2ccccc2F 271570a_100011216252_100011215700 [0,0,1,0,0,0|2,0,1]=4 279 B16R2.2474 CCc1ccccc1c2ccccc2I 271570a_100000069755_100011215823 [0,0,1,0,0,0|2,0,1]=4 280 B16R2.2474 CCc1ccccc1c2ccccc2N 271570a_100000034411_100011215823 [0,0,1,0,0,0|2,0,1]=4 281 B16R2.2474 CCc1ccccc1c2ccccc2N 271570a_100011216252_100000210017 [0,0,1,0,0,0|2,0,1]=4 282 B16R2.2474 CCc1ccccc1c2ccccc2O 271570a_100000035170_100011215823 [0,0,1,0,0,0|2,0,1]=4 283 B16R2.2474 CCc1ccccc1c2ccccc2O 271570a_100011216252_100000739446 [0,0,1,0,0,0|2,0,1]=4 284 B16R2.2474 CNc1ccccc1c2ccccc2C 271570a_100000747142_100020606079 [0,0,1,0,0,0|2,0,1]=4 285 B16R2.2474 CNc1ccccc1c2ccccc2C 34a_100020605195_200000210301 [0,0,1,0,0,0|2,0,1]=4 286 B16R2.2474 CNc1ccccc1c2ccccc2Cl 271570a_100011934419_100020606079 [0,0,1,0,0,0|3,0,0]=4 287 B16R2.2474 CNc1ccccc1c2ccccc2F 271570a_100000761933_100020606079 [0,0,1,0,0,0|3,0,0]=4 288 B16R2.2474 CNc1ccccc1c2ccccc2I 271570a_100000069755_100020606079 [0,0,1,0,0,0|3,0,0]=4 289 B16R2.2474 CNc1ccccc1c2ccccc2N 271570a_100000034411_100020606079 [0,0,1,0,0,0|3,0,0]=4 290 B16R2.2474 CNc1ccccc1c2ccccc2O 271570a_100000035170_100020606079 [0,0,1,0,0,0|3,0,0]=4 291 B16R2.2474 COc1ccccc1c2ccccc2Br 271570a_100000756652_100000695589 [0,0,1,0,0,0|3,0,0]=4 292 B16R2.2474 COc1ccccc1c2ccccc2C 271570a_100000747142_100000174000 [0,0,1,0,0,0|2,0,1]=4 293 B16R2.2474 COc1ccccc1c2ccccc2C 271570a_100000756652_100000210755 [0,0,1,0,0,0|2,0,1]=4 294 B16R2.2474 COc1ccccc1c2ccccc2C 34a_200011997984_200000210301 [0,0,1,0,0,0|2,0,1]=4 295 B16R2.2474 COc1ccccc1c2ccccc2C 7a_200011997984_200000210301 [0,0,1,0,0,0|2,0,1]=4 296 B16R2.2474 COc1ccccc1c2ccccc2Cl 271570a_100000756652_100000764095 [0,0,1,0,0,0|3,0,0]=4 297 B16R2.2474 COc1ccccc1c2ccccc2Cl 271570a_100011934419_100000174000 [0,0,1,0,0,0|3,0,0]=4 298 B16R2.2474 COc1ccccc1c2ccccc2F 271570a_100000756652_100011215700 [0,0,1,0,0,0|3,0,0]=4 299 B16R2.2474 COc1ccccc1c2ccccc2F 271570a_100000761933_100000174000 [0,0,1,0,0,0|3,0,0]=4 300 B16R2.2474 COc1ccccc1c2ccccc2I 271570a_100000069755_100000174000 [0,0,1,0,0,0|3,0,0]=4 301 B16R2.2474 COc1ccccc1c2ccccc2N 271570a_100000034411_100000174000 [0,0,1,0,0,0|3,0,0]=4 302 B16R2.2474 COc1ccccc1c2ccccc2N 271570a_100000756652_100000210017 [0,0,1,0,0,0|3,0,0]=4 303 B16R2.2474 COc1ccccc1c2ccccc2O 271570a_100000035170_100000174000 [0,0,1,0,0,0|3,0,0]=4 304 B16R2.2474 COc1ccccc1c2ccccc2O 271570a_100000756652_100000739446 [0,0,1,0,0,0|3,0,0]=4 305 B16R2.2474 COc1ccccc1c2ccccc2O 271570a_203496583355_100010074709 [0,0,1,0,0,0|3,0,0]=4 306 B16R2.2474 CSc1ccccc1c2ccccc2Br 271570a_100011218165_100000695589 [0,0,1,0,0,0|3,0,0]=4 307 B16R2.2474 CSc1ccccc1c2ccccc2C 271570a_100000747142_100011217816 [0,0,1,0,0,0|2,0,1]=4 308 B16R2.2474 CSc1ccccc1c2ccccc2C 271570a_100011218165_100000210755 [0,0,1,0,0,0|2,0,1]=4 309 B16R2.2474 CSc1ccccc1c2ccccc2Cl 271570a_100011218165_100000764095 [0,0,1,0,0,0|3,0,0]=4 310 B16R2.2474 CSc1ccccc1c2ccccc2Cl 271570a_100011934419_100011217816 [0,0,1,0,0,0|3,0,0]=4 311 B16R2.2474 CSc1ccccc1c2ccccc2F 271570a_100000761933_100011217816 [0,0,1,0,0,0|3,0,0]=4 312 B16R2.2474 CSc1ccccc1c2ccccc2F 271570a_100011218165_100011215700 [0,0,1,0,0,0|3,0,0]=4 313 B16R2.2474 CSc1ccccc1c2ccccc2I 271570a_100000069755_100011217816 [0,0,1,0,0,0|3,0,0]=4 314 B16R2.2474 CSc1ccccc1c2ccccc2N 271570a_100000034411_100011217816 [0,0,1,0,0,0|3,0,0]=4 315 B16R2.2474 CSc1ccccc1c2ccccc2N 271570a_100011218165_100000210017 [0,0,1,0,0,0|3,0,0]=4 316 B16R2.2474 CSc1ccccc1c2ccccc2O 271570a_100000035170_100011217816 [0,0,1,0,0,0|3,0,0]=4 317 B16R2.2474 CSc1ccccc1c2ccccc2O 271570a_100011218165_100000739446 [0,0,1,0,0,0|3,0,0]=4 318 B16R2.2474 C[n+]1ccccc1c2ccccc2C=O 271570a_100000740022_100000212160 [0,0,1,0,0,0|2,0,1]=4 319 B16R2.2474 C[n+]1ccccc1c2ccccc2CN 271570a_100020632975_100000212160 [0,0,1,0,0,0|1,0,2]=4 320 B16R2.2474 Cc1ccccc1c2ccccc2C#N 271570a_100000043008_100000210755 [0,0,1,0,0,0|0,0,3]=4 321 B16R2.2474 Cc1ccccc1c2ccccc2C#N 271570a_100000747142_100000188569 [0,0,1,0,0,0|0,0,3]=4 322 B16R2.2474 Cc1ccccc1c2ccccc2C=O 271570a_100000740022_100000210755 [0,0,1,0,0,0|1,0,1]=3 323 B16R2.2474 Cc1ccccc1c2ccccc2C=O 271570a_100000747142_100000211189 [0,0,1,0,0,0|1,0,1]=3 324 B16R2.2474 Cc1ccccc1c2ccccc2CN 271570a_100000747142_100000689332 [0,0,1,0,0,0|0,0,2]=3 325 B16R2.2474 Cc1ccccc1c2ccccc2CN 271570a_100020632975_100000210755 [0,0,1,0,0,0|0,0,2]=3 326 B16R2.2474 Cc1ccccc1c2ccccc2CO 271570a_100000066922_100000210755 [0,0,1,0,0,0|1,0,2]=4 327 B16R2.2474 Cc1ccccc1c2ccccc2CO 271570a_100000747142_100000187465 [0,0,1,0,0,0|1,0,2]=4 328 B16R2.2474 Cc1ccccc1c2ccccc2NN 271570a_100000747142_100000241748 [0,0,1,0,0,0|1,0,1]=3 329 B16R2.2474 Cc1ccccc1c2ccccc2N[13CH3] 34a_100020605195_200025704644 [0,0,1,0,0,0|2,0,1]=4 330 B16R2.2474 Cc1ccccc1c2ccccc2O[13CH3] 34a_200011997984_200025704644 [0,0,1,0,0,0|2,0,1]=4 331 B16R2.2474 Cc1ccccc1c2ccccc2O[13CH3] 7a_200011997984_200025704644 [0,0,1,0,0,0|2,0,1]=4 332 B16R2.2474 Cc1ccccc1c2cccnc2C=O 271570a_100000747142_100011934733 [0,0,1,0,0,0|2,0,1]=4 333 B16R2.2474 Cc1ccccc1c2cccnc2CN 271570a_100000747142_100020591323 [0,0,1,0,0,0|1,0,2]=4 334 B16R2.2474 Cc1ccccc1c2cccnc2NN 271570a_100000747142_100011464834 [0,0,1,0,0,0|2,0,1]=4 335 B16R2.2474 Cc1ccccc1c2ccncc2C=O 271570a_100000747142_100000050567 [0,0,1,0,0,0|2,0,1]=4 336 B16R2.2474 Cc1ccccc1c2cnccc2C=O 271570a_100000747142_100011934409 [0,0,1,0,0,0|2,0,1]=4 337 B16R2.2474 Cc1ccccc1c2cnccc2CN 271570a_100000747142_100020640021 [0,0,1,0,0,0|1,0,2]=4 338 B16R2.2474 Cc1ccccc1c2cnccc2NN 271570a_100000747142_100013404636 [0,0,1,0,0,0|2,0,1]=4 339 B16R2.2474 Cc1ccccc1c2ncccc2C=O 271570a_100000747142_100009816751 [0,0,1,0,0,0|2,0,1]=4 340 B16R2.2474 Cc1ccccc1c2ncccc2CN 271570a_100000747142_100015189234 [0,0,1,0,0,0|1,0,2]=4 341 B16R2.2474 Cc1cccnc1c2ccccc2C=O 271570a_100000740022_100000751373 [0,0,1,0,0,0|2,0,1]=4 342 B16R2.2474 Cc1cccnc1c2ccccc2CN 271570a_100020632975_100000751373 [0,0,1,0,0,0|1,0,2]=4 343 B16R2.2474 Cc1ccncc1c2ccccc2C=O 271570a_100000740022_100000761580 [0,0,1,0,0,0|2,0,1]=4 344 B16R2.2474 Cc1ccncc1c2ccccc2C=O 271570a_100011935247_100000211189 [0,0,1,0,0,0|2,0,1]=4 345 B16R2.2474 Cc1ccncc1c2ccccc2CN 271570a_100011935247_100000689332 [0,0,1,0,0,0|1,0,2]=4 346 B16R2.2474 Cc1ccncc1c2ccccc2CN 271570a_100020632975_100000761580 [0,0,1,0,0,0|1,0,2]=4 347 B16R2.2474 Cc1ccncc1c2ccccc2NN 271570a_100011935247_100000241748 [0,0,1,0,0,0|2,0,1]=4 348 B16R2.2474 Cc1cnccc1c2ccccc2C=O 271570a_100000701363_100000211189 [0,0,1,0,0,0|2,0,1]=4 349 B16R2.2474 Cc1cnccc1c2ccccc2C=O 271570a_100000740022_100015191297 [0,0,1,0,0,0|2,0,1]=4 350 B16R2.2474 Cc1cnccc1c2ccccc2CN 271570a_100000701363_100000689332 [0,0,1,0,0,0|1,0,2]=4 351 B16R2.2474 Cc1cnccc1c2ccccc2CN 271570a_100020632975_100015191297 [0,0,1,0,0,0|1,0,2]=4 352 B16R2.2474 Cc1cnccc1c2ccccc2NN 271570a_100000701363_100000241748 [0,0,1,0,0,0|2,0,1]=4 353 B16R2.2474 Cc1ncccc1c2ccccc2C=O 271570a_100000740022_100000751574 [0,0,1,0,0,0|2,0,1]=4 354 B16R2.2474 Cc1ncccc1c2ccccc2C=O 271570a_100011934933_100000211189 [0,0,1,0,0,0|2,0,1]=4 355 B16R2.2474 Cc1ncccc1c2ccccc2CN 271570a_100011934933_100000689332 [0,0,1,0,0,0|1,0,2]=4 356 B16R2.2474 Cc1ncccc1c2ccccc2CN 271570a_100020632975_100000751574 [0,0,1,0,0,0|1,0,2]=4 357 B16R2.2474 Cc1ncccc1c2ccccc2NN 271570a_100011934933_100000241748 [0,0,1,0,0,0|2,0,1]=4 358 B16R2.2474 N#Cc1ccccc1c2ccccc2Br 271570a_100000043008_100000695589 [0,0,1,0,0,0|1,0,2]=4 359 B16R2.2474 N#Cc1ccccc1c2ccccc2Cl 271570a_100000043008_100000764095 [0,0,1,0,0,0|1,0,2]=4 360 B16R2.2474 N#Cc1ccccc1c2ccccc2Cl 271570a_100011934419_100000188569 [0,0,1,0,0,0|1,0,2]=4 361 B16R2.2474 N#Cc1ccccc1c2ccccc2F 271570a_100000043008_100011215700 [0,0,1,0,0,0|1,0,2]=4 362 B16R2.2474 N#Cc1ccccc1c2ccccc2F 271570a_100000761933_100000188569 [0,0,1,0,0,0|1,0,2]=4 363 B16R2.2474 N#Cc1ccccc1c2ccccc2I 271570a_100000069755_100000188569 [0,0,1,0,0,0|1,0,2]=4 364 B16R2.2474 N#Cc1ccccc1c2ccccc2N 271570a_100000034411_100000188569 [0,0,1,0,0,0|1,0,2]=4 365 B16R2.2474 N#Cc1ccccc1c2ccccc2N 271570a_100000043008_100000210017 [0,0,1,0,0,0|1,0,2]=4 366 B16R2.2474 N#Cc1ccccc1c2ccccc2O 271570a_100000035170_100000188569 [0,0,1,0,0,0|1,0,2]=4 367 B16R2.2474 N#Cc1ccccc1c2ccccc2O 271570a_100000043008_100000739446 [0,0,1,0,0,0|1,0,2]=4 368 B16R2.2474 NCc1ccccc1c2c[nH]ccc2=O 271570a_100020632975_100009998708 [0,0,1,0,0,0|2,0,1]=4 369 B16R2.2474 NCc1ccccc1c2c[nH]ccc2=S 271570a_100020632975_200012280681 [0,0,1,0,0,0|2,0,1]=4 370 B16R2.2474 NCc1ccccc1c2ccc[nH]c2=O 271570a_100000099769_100000689332 [0,0,1,0,0,0|2,0,1]=4 371 B16R2.2474 NCc1ccccc1c2ccc[nH]c2=O 271570a_100020632975_100000050042 [0,0,1,0,0,0|2,0,1]=4 372 B16R2.2474 NCc1ccccc1c2cccc[n+]2[O-] 271570a_100020632975_200000042595 [0,0,1,0,0,0|2,0,1]=4 373 B16R2.2474 NCc1ccccc1c2ccccc2Br 271570a_100020632975_100000695589 [0,0,1,0,0,0|1,0,1]=3 374 B16R2.2474 NCc1ccccc1c2ccccc2Cl 271570a_100011934419_100000689332 [0,0,1,0,0,0|1,0,1]=3 375 B16R2.2474 NCc1ccccc1c2ccccc2Cl 271570a_100020632975_100000764095 [0,0,1,0,0,0|1,0,1]=3 376 B16R2.2474 NCc1ccccc1c2ccccc2F 271570a_100000761933_100000689332 [0,0,1,0,0,0|1,0,1]=3 377 B16R2.2474 NCc1ccccc1c2ccccc2F 271570a_100020632975_100011215700 [0,0,1,0,0,0|1,0,1]=3 378 B16R2.2474 NCc1ccccc1c2ccccc2I 271570a_100000069755_100000689332 [0,0,1,0,0,0|1,0,1]=3 379 B16R2.2474 NCc1ccccc1c2ccccc2N 271570a_100000034411_100000689332 [0,0,1,0,0,0|1,0,1]=3 380 B16R2.2474 NCc1ccccc1c2ccccc2N 271570a_100020632975_100000210017 [0,0,1,0,0,0|1,0,1]=3 381 B16R2.2474 NCc1ccccc1c2ccccc2O 271570a_100000035170_100000689332 [0,0,1,0,0,0|1,0,1]=3 382 B16R2.2474 NCc1ccccc1c2ccccc2O 271570a_100020632975_100000739446 [0,0,1,0,0,0|1,0,1]=3 383 B16R2.2474 NCc1ccccc1c2cccnc2Br 271570a_100020632975_100010202626 [0,0,1,0,0,0|2,0,1]=4 384 B16R2.2474 NCc1ccccc1c2cccnc2Cl 271570a_100000047009_100000689332 [0,0,1,0,0,0|2,0,1]=4 385 B16R2.2474 NCc1ccccc1c2cccnc2Cl 271570a_100020632975_100000036424 [0,0,1,0,0,0|2,0,1]=4 386 B16R2.2474 NCc1ccccc1c2cccnc2F 271570a_100000042387_100000689332 [0,0,1,0,0,0|2,0,1]=4 387 B16R2.2474 NCc1ccccc1c2cccnc2F 271570a_100020632975_100009816115 [0,0,1,0,0,0|2,0,1]=4 388 B16R2.2474 NCc1ccccc1c2cccnc2N 271570a_100000071976_100000689332 [0,0,1,0,0,0|2,0,1]=4 389 B16R2.2474 NCc1ccccc1c2cccnc2N 271570a_100020632975_100000045569 [0,0,1,0,0,0|2,0,1]=4 390 B16R2.2474 NCc1ccccc1c2ccncc2Br 271570a_100020632975_100000726257 [0,0,1,0,0,0|2,0,1]=4 391 B16R2.2474 NCc1ccccc1c2ccncc2Cl 271570a_100000062318_100000689332 [0,0,1,0,0,0|2,0,1]=4 392 B16R2.2474 NCc1ccccc1c2ccncc2Cl 271570a_100020632975_100000708259 [0,0,1,0,0,0|2,0,1]=4 393 B16R2.2474 NCc1ccccc1c2ccncc2F 271570a_100011290801_100000689332 [0,0,1,0,0,0|2,0,1]=4 394 B16R2.2474 NCc1ccccc1c2ccncc2F 271570a_100020632975_100000047030 [0,0,1,0,0,0|2,0,1]=4 395 B16R2.2474 NCc1ccccc1c2ccncc2N 271570a_100020632975_100009815883 [0,0,1,0,0,0|2,0,1]=4 396 B16R2.2474 NCc1ccccc1c2ccncc2O 271570a_100020632975_100009817591 [0,0,1,0,0,0|2,0,1]=4 397 B16R2.2474 NCc1ccccc1c2cnccc2Br 271570a_100020632975_100010138639 [0,0,1,0,0,0|2,0,1]=4 398 B16R2.2474 NCc1ccccc1c2cnccc2Cl 271570a_100000062317_100000689332 [0,0,1,0,0,0|2,0,1]=4 399 B16R2.2474 NCc1ccccc1c2cnccc2Cl 271570a_100020632975_100009995489 [0,0,1,0,0,0|2,0,1]=4 400 B16R2.2474 NCc1ccccc1c2cnccc2F 271570a_100020632975_100009820683 [0,0,1,0,0,0|2,0,1]=4 401 B16R2.2474 NCc1ccccc1c2cnccc2N 271570a_100020632975_100000047001 [0,0,1,0,0,0|2,0,1]=4 402 B16R2.2474 NCc1ccccc1c2cnccc2N 271570a_200010248739_100000689332 [0,0,1,0,0,0|2,0,1]=4 403 B16R2.2474 NCc1ccccc1c2ncccc2Br 271570a_100020632975_100000696092 [0,0,1,0,0,0|2,0,1]=4 404 B16R2.2474 NCc1ccccc1c2ncccc2Cl 271570a_100009857861_100000689332 [0,0,1,0,0,0|2,0,1]=4 405 B16R2.2474 NCc1ccccc1c2ncccc2Cl 271570a_100020632975_100011356963 [0,0,1,0,0,0|2,0,1]=4 406 B16R2.2474 NCc1ccccc1c2ncccc2F 271570a_100020632975_100000685392 [0,0,1,0,0,0|2,0,1]=4 407 B16R2.2474 NCc1ccccc1c2ncccc2N 271570a_100020632975_100000688686 [0,0,1,0,0,0|2,0,1]=4 408 B16R2.2474 NCc1ccccc1c2ncccc2O 271570a_100020632975_100000034122 [0,0,1,0,0,0|2,0,1]=4 409 B16R2.2474 NCc1cccnc1c2ccccc2Cl 271570a_100011934419_100015189234 [0,0,1,0,0,0|2,0,1]=4 410 B16R2.2474 NCc1cccnc1c2ccccc2F 271570a_100000761933_100015189234 [0,0,1,0,0,0|2,0,1]=4 411 B16R2.2474 NCc1cccnc1c2ccccc2I 271570a_100000069755_100015189234 [0,0,1,0,0,0|2,0,1]=4 412 B16R2.2474 NCc1cccnc1c2ccccc2N 271570a_100000034411_100015189234 [0,0,1,0,0,0|2,0,1]=4 413 B16R2.2474 NCc1cccnc1c2ccccc2O 271570a_100000035170_100015189234 [0,0,1,0,0,0|2,0,1]=4 414 B16R2.2474 NCc1ccncc1c2ccccc2Cl 271570a_100011934419_100020640021 [0,0,1,0,0,0|2,0,1]=4 415 B16R2.2474 NCc1ccncc1c2ccccc2F 271570a_100000761933_100020640021 [0,0,1,0,0,0|2,0,1]=4 416 B16R2.2474 NCc1ccncc1c2ccccc2I 271570a_100000069755_100020640021 [0,0,1,0,0,0|2,0,1]=4 417 B16R2.2474 NCc1ccncc1c2ccccc2N 271570a_100000034411_100020640021 [0,0,1,0,0,0|2,0,1]=4 418 B16R2.2474 NCc1ccncc1c2ccccc2O 271570a_100000035170_100020640021 [0,0,1,0,0,0|2,0,1]=4 419 B16R2.2474 NCc1ncccc1c2ccccc2Cl 271570a_100011934419_100020591323 [0,0,1,0,0,0|2,0,1]=4 420 B16R2.2474 NCc1ncccc1c2ccccc2F 271570a_100000761933_100020591323 [0,0,1,0,0,0|2,0,1]=4 421 B16R2.2474 NCc1ncccc1c2ccccc2I 271570a_100000069755_100020591323 [0,0,1,0,0,0|2,0,1]=4 422 B16R2.2474 NCc1ncccc1c2ccccc2N 271570a_100000034411_100020591323 [0,0,1,0,0,0|2,0,1]=4 423 B16R2.2474 NCc1ncccc1c2ccccc2O 271570a_100000035170_100020591323 [0,0,1,0,0,0|2,0,1]=4 424 B16R2.2474 NNc1ccccc1c2ccc[nH]c2=O 271570a_100000099769_100000241748 [0,0,1,0,0,0|3,0,0]=4 425 B16R2.2474 NNc1ccccc1c2ccccc2Cl 271570a_100011934419_100000241748 [0,0,1,0,0,0|2,0,0]=3 426 B16R2.2474 NNc1ccccc1c2ccccc2F 271570a_100000761933_100000241748 [0,0,1,0,0,0|2,0,0]=3 427 B16R2.2474 NNc1ccccc1c2ccccc2I 271570a_100000069755_100000241748 [0,0,1,0,0,0|2,0,0]=3 428 B16R2.2474 NNc1ccccc1c2ccccc2N 271570a_100000034411_100000241748 [0,0,1,0,0,0|2,0,0]=3 429 B16R2.2474 NNc1ccccc1c2ccccc2O 271570a_100000035170_100000241748 [0,0,1,0,0,0|2,0,0]=3 430 B16R2.2474 NNc1ccccc1c2cccnc2Cl 271570a_100000047009_100000241748 [0,0,1,0,0,0|3,0,0]=4 431 B16R2.2474 NNc1ccccc1c2cccnc2F 271570a_100000042387_100000241748 [0,0,1,0,0,0|3,0,0]=4 432 B16R2.2474 NNc1ccccc1c2cccnc2N 271570a_100000071976_100000241748 [0,0,1,0,0,0|3,0,0]=4 433 B16R2.2474 NNc1ccccc1c2ccncc2Cl 271570a_100000062318_100000241748 [0,0,1,0,0,0|3,0,0]=4 434 B16R2.2474 NNc1ccccc1c2ccncc2F 271570a_100011290801_100000241748 [0,0,1,0,0,0|3,0,0]=4 435 B16R2.2474 NNc1ccccc1c2cnccc2Cl 271570a_100000062317_100000241748 [0,0,1,0,0,0|3,0,0]=4 436 B16R2.2474 NNc1ccccc1c2cnccc2N 271570a_200010248739_100000241748 [0,0,1,0,0,0|3,0,0]=4 437 B16R2.2474 NNc1ccccc1c2ncccc2Cl 271570a_100009857861_100000241748 [0,0,1,0,0,0|3,0,0]=4 438 B16R2.2474 NNc1ccncc1c2ccccc2Cl 271570a_100011934419_100013404636 [0,0,1,0,0,0|3,0,0]=4 439 B16R2.2474 NNc1ccncc1c2ccccc2F 271570a_100000761933_100013404636 [0,0,1,0,0,0|3,0,0]=4 440 B16R2.2474 NNc1ccncc1c2ccccc2I 271570a_100000069755_100013404636 [0,0,1,0,0,0|3,0,0]=4 441 B16R2.2474 NNc1ccncc1c2ccccc2N 271570a_100000034411_100013404636 [0,0,1,0,0,0|3,0,0]=4 442 B16R2.2474 NNc1ccncc1c2ccccc2O 271570a_100000035170_100013404636 [0,0,1,0,0,0|3,0,0]=4 443 B16R2.2474 NNc1ncccc1c2ccccc2Cl 271570a_100011934419_100011464834 [0,0,1,0,0,0|3,0,0]=4 444 B16R2.2474 NNc1ncccc1c2ccccc2F 271570a_100000761933_100011464834 [0,0,1,0,0,0|3,0,0]=4 445 B16R2.2474 NNc1ncccc1c2ccccc2I 271570a_100000069755_100011464834 [0,0,1,0,0,0|3,0,0]=4 446 B16R2.2474 NNc1ncccc1c2ccccc2N 271570a_100000034411_100011464834 [0,0,1,0,0,0|3,0,0]=4 447 B16R2.2474 NNc1ncccc1c2ccccc2O 271570a_100000035170_100011464834 [0,0,1,0,0,0|3,0,0]=4 448 B16R2.2474 Nc1ccccc1c2ccccc2C=O 271570a_100000034411_100000211189 [0,0,1,0,0,0|2,0,0]=3 449 B16R2.2474 Nc1ccccc1c2ccccc2C=O 271570a_100000740022_100000210017 [0,0,1,0,0,0|2,0,0]=3 450 B16R2.2474 Nc1ccccc1c2ccccc2CO 271570a_100000034411_100000187465 [0,0,1,0,0,0|2,0,1]=4 451 B16R2.2474 Nc1ccccc1c2ccccc2CO 271570a_100000066922_100000210017 [0,0,1,0,0,0|2,0,1]=4 452 B16R2.2474 Nc1ccccc1c2cccnc2C=O 271570a_100000034411_100011934733 [0,0,1,0,0,0|3,0,0]=4 453 B16R2.2474 Nc1ccccc1c2ccncc2C=O 271570a_100000034411_100000050567 [0,0,1,0,0,0|3,0,0]=4 454 B16R2.2474 Nc1ccccc1c2cnccc2C=O 271570a_100000034411_100011934409 [0,0,1,0,0,0|3,0,0]=4 455 B16R2.2474 Nc1ccccc1c2ncccc2C=O 271570a_100000034411_100009816751 [0,0,1,0,0,0|3,0,0]=4 456 B16R2.2474 Nc1cccnc1c2ccccc2C=O 271570a_100000740022_100000688686 [0,0,1,0,0,0|3,0,0]=4 457 B16R2.2474 Nc1ccncc1c2ccccc2C=O 271570a_100000740022_100000047001 [0,0,1,0,0,0|3,0,0]=4 458 B16R2.2474 Nc1ccncc1c2ccccc2C=O 271570a_200010248739_100000211189 [0,0,1,0,0,0|3,0,0]=4 459 B16R2.2474 Nc1cnccc1c2ccccc2C=O 271570a_100000740022_100009815883 [0,0,1,0,0,0|3,0,0]=4 460 B16R2.2474 Nc1ncccc1c2ccccc2C=O 271570a_100000071976_100000211189 [0,0,1,0,0,0|3,0,0]=4 461 B16R2.2474 Nc1ncccc1c2ccccc2C=O 271570a_100000740022_100000045569 [0,0,1,0,0,0|3,0,0]=4 462 B16R2.2474 O=Cc1ccccc1c2c[nH]ccc2=O 271570a_100000740022_100009998708 [0,0,1,0,0,0|3,0,0]=4 463 B16R2.2474 O=Cc1ccccc1c2c[nH]ccc2=S 271570a_100000740022_200012280681 [0,0,1,0,0,0|3,0,0]=4 464 B16R2.2474 O=Cc1ccccc1c2ccc[nH]c2=O 271570a_100000099769_100000211189 [0,0,1,0,0,0|3,0,0]=4 465 B16R2.2474 O=Cc1ccccc1c2ccc[nH]c2=O 271570a_100000740022_100000050042 [0,0,1,0,0,0|3,0,0]=4 466 B16R2.2474 O=Cc1ccccc1c2cccc[n+]2[O-] 271570a_100000740022_200000042595 [0,0,1,0,0,0|3,0,0]=4 467 B16R2.2474 O=Cc1ccccc1c2ccccc2Br 271570a_100000740022_100000695589 [0,0,1,0,0,0|2,0,0]=3 468 B16R2.2474 O=Cc1ccccc1c2ccccc2Cl 271570a_100000740022_100000764095 [0,0,1,0,0,0|2,0,0]=3 469 B16R2.2474 O=Cc1ccccc1c2ccccc2Cl 271570a_100011934419_100000211189 [0,0,1,0,0,0|2,0,0]=3 470 B16R2.2474 O=Cc1ccccc1c2ccccc2F 271570a_100000740022_100011215700 [0,0,1,0,0,0|2,0,0]=3 471 B16R2.2474 O=Cc1ccccc1c2ccccc2F 271570a_100000761933_100000211189 [0,0,1,0,0,0|2,0,0]=3 472 B16R2.2474 O=Cc1ccccc1c2ccccc2I 271570a_100000069755_100000211189 [0,0,1,0,0,0|2,0,0]=3 473 B16R2.2474 O=Cc1ccccc1c2ccccc2O 271570a_100000035170_100000211189 [0,0,1,0,0,0|2,0,0]=3 474 B16R2.2474 O=Cc1ccccc1c2ccccc2O 271570a_100000740022_100000739446 [0,0,1,0,0,0|2,0,0]=3 475 B16R2.2474 O=Cc1ccccc1c2cccnc2Br 271570a_100000740022_100010202626 [0,0,1,0,0,0|3,0,0]=4 476 B16R2.2474 O=Cc1ccccc1c2cccnc2Cl 271570a_100000047009_100000211189 [0,0,1,0,0,0|3,0,0]=4 477 B16R2.2474 O=Cc1ccccc1c2cccnc2Cl 271570a_100000740022_100000036424 [0,0,1,0,0,0|3,0,0]=4 478 B16R2.2474 O=Cc1ccccc1c2cccnc2F 271570a_100000042387_100000211189 [0,0,1,0,0,0|3,0,0]=4 479 B16R2.2474 O=Cc1ccccc1c2cccnc2F 271570a_100000740022_100009816115 [0,0,1,0,0,0|3,0,0]=4 480 B16R2.2474 O=Cc1ccccc1c2ccncc2Br 271570a_100000740022_100000726257 [0,0,1,0,0,0|3,0,0]=4 481 B16R2.2474 O=Cc1ccccc1c2ccncc2Cl 271570a_100000062318_100000211189 [0,0,1,0,0,0|3,0,0]=4 482 B16R2.2474 O=Cc1ccccc1c2ccncc2Cl 271570a_100000740022_100000708259 [0,0,1,0,0,0|3,0,0]=4 483 B16R2.2474 O=Cc1ccccc1c2ccncc2F 271570a_100000740022_100000047030 [0,0,1,0,0,0|3,0,0]=4 484 B16R2.2474 O=Cc1ccccc1c2ccncc2F 271570a_100011290801_100000211189 [0,0,1,0,0,0|3,0,0]=4 485 B16R2.2474 O=Cc1ccccc1c2ccncc2O 271570a_100000740022_100009817591 [0,0,1,0,0,0|3,0,0]=4 486 B16R2.2474 O=Cc1ccccc1c2cnccc2Br 271570a_100000740022_100010138639 [0,0,1,0,0,0|3,0,0]=4 487 B16R2.2474 O=Cc1ccccc1c2cnccc2Cl 271570a_100000062317_100000211189 [0,0,1,0,0,0|3,0,0]=4 488 B16R2.2474 O=Cc1ccccc1c2cnccc2Cl 271570a_100000740022_100009995489 [0,0,1,0,0,0|3,0,0]=4 489 B16R2.2474 O=Cc1ccccc1c2cnccc2F 271570a_100000740022_100009820683 [0,0,1,0,0,0|3,0,0]=4 490 B16R2.2474 O=Cc1ccccc1c2ncccc2Br 271570a_100000740022_100000696092 [0,0,1,0,0,0|3,0,0]=4 491 B16R2.2474 O=Cc1ccccc1c2ncccc2Cl 271570a_100000740022_100011356963 [0,0,1,0,0,0|3,0,0]=4 492 B16R2.2474 O=Cc1ccccc1c2ncccc2Cl 271570a_100009857861_100000211189 [0,0,1,0,0,0|3,0,0]=4 493 B16R2.2474 O=Cc1ccccc1c2ncccc2F 271570a_100000740022_100000685392 [0,0,1,0,0,0|3,0,0]=4 494 B16R2.2474 O=Cc1ccccc1c2ncccc2O 271570a_100000740022_100000034122 [0,0,1,0,0,0|3,0,0]=4 495 B16R2.2474 O=Cc1cccnc1c2ccccc2Cl 271570a_100011934419_100009816751 [0,0,1,0,0,0|3,0,0]=4 496 B16R2.2474 O=Cc1cccnc1c2ccccc2F 271570a_100000761933_100009816751 [0,0,1,0,0,0|3,0,0]=4 497 B16R2.2474 O=Cc1cccnc1c2ccccc2I 271570a_100000069755_100009816751 [0,0,1,0,0,0|3,0,0]=4 498 B16R2.2474 O=Cc1cccnc1c2ccccc2O 271570a_100000035170_100009816751 [0,0,1,0,0,0|3,0,0]=4 499 B16R2.2474 O=Cc1ccncc1c2ccccc2Cl 271570a_100011934419_100011934409 [0,0,1,0,0,0|3,0,0]=4 500 B16R2.2474 O=Cc1ccncc1c2ccccc2F 271570a_100000761933_100011934409 [0,0,1,0,0,0|3,0,0]=4 501 B16R2.2474 O=Cc1ccncc1c2ccccc2I 271570a_100000069755_100011934409 [0,0,1,0,0,0|3,0,0]=4 502 B16R2.2474 O=Cc1ccncc1c2ccccc2O 271570a_100000035170_100011934409 [0,0,1,0,0,0|3,0,0]=4 503 B16R2.2474 O=Cc1cnccc1c2ccccc2Cl 271570a_100011934419_100000050567 [0,0,1,0,0,0|3,0,0]=4 504 B16R2.2474 O=Cc1cnccc1c2ccccc2F 271570a_100000761933_100000050567 [0,0,1,0,0,0|3,0,0]=4 505 B16R2.2474 O=Cc1cnccc1c2ccccc2I 271570a_100000069755_100000050567 [0,0,1,0,0,0|3,0,0]=4 506 B16R2.2474 O=Cc1cnccc1c2ccccc2O 271570a_100000035170_100000050567 [0,0,1,0,0,0|3,0,0]=4 507 B16R2.2474 O=Cc1ncccc1c2ccccc2Cl 271570a_100011934419_100011934733 [0,0,1,0,0,0|3,0,0]=4 508 B16R2.2474 O=Cc1ncccc1c2ccccc2F 271570a_100000761933_100011934733 [0,0,1,0,0,0|3,0,0]=4 509 B16R2.2474 O=Cc1ncccc1c2ccccc2I 271570a_100000069755_100011934733 [0,0,1,0,0,0|3,0,0]=4 510 B16R2.2474 O=Cc1ncccc1c2ccccc2O 271570a_100000035170_100011934733 [0,0,1,0,0,0|3,0,0]=4 511 B16R2.2474 OCc1ccccc1c2ccccc2Br 271570a_100000066922_100000695589 [0,0,1,0,0,0|2,0,1]=4 512 B16R2.2474 OCc1ccccc1c2ccccc2Cl 271570a_100000066922_100000764095 [0,0,1,0,0,0|2,0,1]=4 513 B16R2.2474 OCc1ccccc1c2ccccc2Cl 271570a_100011934419_100000187465 [0,0,1,0,0,0|2,0,1]=4 514 B16R2.2474 OCc1ccccc1c2ccccc2F 271570a_100000066922_100011215700 [0,0,1,0,0,0|2,0,1]=4 515 B16R2.2474 OCc1ccccc1c2ccccc2F 271570a_100000761933_100000187465 [0,0,1,0,0,0|2,0,1]=4 516 B16R2.2474 OCc1ccccc1c2ccccc2I 271570a_100000069755_100000187465 [0,0,1,0,0,0|2,0,1]=4 517 B16R2.2474 OCc1ccccc1c2ccccc2O 271570a_100000035170_100000187465 [0,0,1,0,0,0|2,0,1]=4 518 B16R2.2474 OCc1ccccc1c2ccccc2O 271570a_100000066922_100000739446 [0,0,1,0,0,0|2,0,1]=4 519 B16R2.2802 C=Cc1c(c(=O)oc2c1cccc2)C=O 271570a_100011290941_100000046281 [0,0,1,0,0,0|3,0,0]=4 520 B16R2.12192 C=CCNc1ccc(c2c1cccc2)Br 34a_100000766797_100015514636 [0,0,1,0,0,0|2,0,1]=4 521 B16R2.12192 C=CCNc1ccc(c2c1cccc2)Cl 34a_100011216319_100015514636 [0,0,1,0,0,0|2,0,1]=4 522 B16R2.12192 C=CCNc1ccc(c2c1cccc2)F 34a_100011988692_100015514636 [0,0,1,0,0,0|2,0,1]=4 523 B16R2.12192 C=CCNc1ccc(c2c1cccc2)O 34a_100000705857_100015514636 [0,0,1,0,0,0|2,0,1]=4 524 B16R2.12192 C=CCOc1ccc(c2c1cccc2)Br 34a_100000186334_100015514636 [0,0,1,0,0,0|2,0,1]=4 525 B16R2.12192 C=CCOc1ccc(c2c1cccc2)Br 7a_100000186334_100015514636 [0,0,1,0,0,0|2,0,1]=4 526 B16R2.12192 C=CCOc1ccc(c2c1cccc2)C 34a_100000074455_100015514636 [0,0,1,0,0,0|2,0,1]=4 527 B16R2.12192 C=CCOc1ccc(c2c1cccc2)C 7a_100000074455_100015514636 [0,0,1,0,0,0|2,0,1]=4 528 B16R2.12192 C=CCOc1ccc(c2c1cccc2)Cl 34a_100000211000_100015514636 [0,0,1,0,0,0|2,0,1]=4 529 B16R2.12192 C=CCOc1ccc(c2c1cccc2)Cl 7a_100000211000_100015514636 [0,0,1,0,0,0|2,0,1]=4 530 B16R2.12192 C=CCOc1ccc(c2c1cccc2)F 34a_100000100223_100015514636 [0,0,1,0,0,0|2,0,1]=4 531 B16R2.12192 C=CCOc1ccc(c2c1cccc2)F 7a_100000100223_100015514636 [0,0,1,0,0,0|2,0,1]=4 532 B16R2.12192 C=CCOc1ccc(c2c1cccc2)N 34a_100000705857_100015514636 [0,0,1,0,0,0|1,0,1]=3 533 B16R2.12192 C=CCOc1ccc(c2c1cccc2)N 7a_100000705857_100015514636 [0,0,1,0,0,0|1,0,1]=3 534 B16R2.12192 C=CCOc1ccc(c2c1nccc2)N 34a_100000188197_100015514636 [0,0,1,0,0,0|2,0,1]=4 535 B16R2.12192 C=CCSc1ccc(c2c1cccc2)Br 62a_100000210623_100012339872 [0,0,1,0,0,0|2,0,1]=4 536 B16R2.12192 C=CCSc1ccc(c2c1cccc2)Br 62a_100012339872_100000210623 [0,0,1,0,0,0|2,0,1]=4 537 B16R2.12192 C=CCSc1ccc(c2c1cccc2)C 62a_100000210623_100011215156 [0,0,1,0,0,0|2,0,1]=4 538 B16R2.12192 C=CCSc1ccc(c2c1cccc2)C 62a_100011215156_100000210623 [0,0,1,0,0,0|2,0,1]=4 539 B16R2.12192 C=CCSc1ccc(c2c1cccc2)F 62a_100000210623_100011218216 [0,0,1,0,0,0|2,0,1]=4 540 B16R2.12192 C=CCSc1ccc(c2c1cccc2)F 62a_100011218216_100000210623 [0,0,1,0,0,0|2,0,1]=4 541 B16R2.12192 C=CCSc1ccc(c2c1cccc2)N 62a_100000766797_100000210623 [0,0,1,0,0,0|1,0,1]=3 542 B16R2.12192 C=CCSc1ccc(c2c1cccc2)O 62a_100000210623_100000186334 [0,0,1,0,0,0|2,0,1]=4 543 B16R2.12192 C=CCSc1ccc(c2c1cccn2)N 62a_100000210623_100000726955 [0,0,1,0,0,0|2,0,1]=4 544 B16R2.12192 C=CCSc1ccc(c2c1cccn2)N 62a_100000726955_100000210623 [0,0,1,0,0,0|2,0,1]=4 545 B16R2.12192 C=CCSc1ccc(c2c1ccnc2)N 62a_100000210623_100011218454 [0,0,1,0,0,0|2,0,1]=4 546 B16R2.12192 C=CCSc1ccc(c2c1ccnc2)N 62a_100011218454_100000210623 [0,0,1,0,0,0|2,0,1]=4 547 B16R2.12192 C=CCSc1ccc(c2c1cncc2)N 62a_100000210623_200012344021 [0,0,1,0,0,0|2,0,1]=4 548 B16R2.12192 C=CCSc1ccc(c2c1cncc2)N 62a_200012344021_100000210623 [0,0,1,0,0,0|2,0,1]=4 549 B16R2.12192 C=CCSc1ccc(c2c1nccc2)N 62a_100000210623_100012360041 [0,0,1,0,0,0|2,0,1]=4 550 B16R2.12192 C=CCSc1ccc(c2c1nccc2)N 62a_100012360041_100000210623 [0,0,1,0,0,0|2,0,1]=4 551 B16R2.12192 C=CCSc1cnc(c2c1cccc2)N 62a_100000210623_100010158575 [0,0,1,0,0,0|2,0,1]=4 552 B16R2.12192 C=CCSc1cnc(c2c1cccc2)N 62a_100010158575_100000210623 [0,0,1,0,0,0|2,0,1]=4 553 B16R2.12192 C=CCSc1ncc(c2c1cccc2)N 62a_100000210623_200009868590 [0,0,1,0,0,0|2,0,1]=4 554 B16R2.12192 Nc1ccc(c2c1cccc2)OCC=O 34a_100000705857_200009817547 [0,0,1,0,0,0|2,0,1]=4 555 B16R2.12192 Nc1ccc(c2c1cccc2)OCC=O 7a_100000705857_200015260668 [0,0,1,0,0,0|2,0,1]=4 556 B16R2.12192 Nc1ccc(c2c1cccc2)SCC=O 62a_100000766797_200015260668 [0,0,1,0,0,0|2,0,1]=4 557 B16R2.12202 C=CCNc1cc(cc2c1cccc2)Br 34a_100010171453_100015514636 [0,0,1,0,0,0|2,0,1]=4 558 B16R2.12202 C=CCOc1cc(cc2c1cccc2)Br 34a_100010089979_100015514636 [0,0,1,0,0,0|2,0,1]=4 559 B16R2.12202 C=CCOc1cc(cc2c1cccc2)Br 7a_100010089979_100015514636 [0,0,1,0,0,0|2,0,1]=4 560 B16R2.12202 C=CCSc1cc(cc2c1cccc2)N 62a_100000210623_100010089974 [0,0,1,0,0,0|1,0,1]=3 561 B16R2.12202 C=CCSc1cc(cc2c1cccc2)N 62a_100010089974_100000210623 [0,0,1,0,0,0|1,0,1]=3 562 B16R2.12202 C=CCSc1cc(cc2c1cccc2)O 62a_100000210623_100010001680 [0,0,1,0,0,0|2,0,1]=4 563 B16R2.12202 C=CCSc1nc(cc2c1cccc2)N 62a_100000210623_100009814382 [0,0,1,0,0,0|2,0,1]=4 564 B16R2.12202 C=CCSc1nc(cc2c1cccc2)N 62a_100009814382_100000210623 [0,0,1,0,0,0|2,0,1]=4 565 B16R2.12202 Nc1cc(c2ccccc2c1)SCC=O 62a_100010089974_200015260668 [0,0,1,0,0,0|2,0,1]=4 566 B16R2.12202 Nc1cc(c2ccccc2c1)SCC=O 62a_200015260668_100010089974 [0,0,1,0,0,0|2,0,1]=4 567 B16R3.3510 Oc1nc2ccccc2c3c1cco3 271570a_203496583355_200010025853 [0,0,0,0,1,0|3,0,0]=4 568 B15R2.21 C#Cc1ccccc1c2ccccc2 271570a_100000099761_100000210277 [1,0,1,0,0,0|0,0,2]=4 569 B15R2.21 C=Cc1ccccc1c2ccccc2 271570a_100000037480_100000210277 [1,0,1,0,0,0|0,0,0]=2 570 B15R2.21 C=Cc1ccccc1c2ccccc2 271570a_100011290941_100000033479 [1,0,1,0,0,0|0,0,0]=2 571 B15R2.21 C=Cc1ccccc1c2ccccn2 271570a_100000037480_100011216584 [1,0,1,0,0,0|1,0,0]=3 572 B15R2.21 C=Cc1ccccc1c2ccccn2 271570a_100011290941_100010202516 [1,0,1,0,0,0|1,0,0]=3 573 B15R2.21 C=Cc1ccccc1c2cccnc2 271570a_100000037480_100000752921 [1,0,1,0,0,0|1,0,0]=3 574 B15R2.21 C=Cc1ccccc1c2cccnn2 271570a_100000037480_100016991348 [1,0,1,0,0,0|2,0,0]=4 575 B15R2.21 C=Cc1ccccc1c2ccncc2 271570a_100000037480_100000035832 [1,0,1,0,0,0|1,0,0]=3 576 B15R2.21 C=Cc1ccccc1c2ccncc2 271570a_100011290941_100010154595 [1,0,1,0,0,0|1,0,0]=3 577 B15R2.21 C=Cc1ccccc1c2ccncn2 271570a_100000037480_100000703185 [1,0,1,0,0,0|2,0,0]=4 578 B15R2.21 C=Cc1ccccc1c2ccnnc2 271570a_100000037480_100000732662 [1,0,1,0,0,0|2,0,0]=4 579 B15R2.21 C=Cc1ccccc1c2cnccn2 271570a_100000037480_100000758340 [1,0,1,0,0,0|2,0,0]=4 580 B15R2.21 C=Cc1ccccc1c2cncnc2 271570a_100000037480_100011206942 [1,0,1,0,0,0|2,0,0]=4 581 B15R2.21 C=Cc1ccccc1c2ncccn2 271570a_100000037480_100000211032 [1,0,1,0,0,0|2,0,0]=4 582 B15R2.21 C=Cc1cccnc1c2ccccc2 271570a_100011290941_100010138707 [1,0,1,0,0,0|1,0,0]=3 583 B15R2.21 C=Cc1cnccc1c2ccccc2 271570a_100011290941_100009816686 [1,0,1,0,0,0|1,0,0]=3 584 B15R2.21 C=Cc1cncnc1c2ccccc2 271570a_100011290941_200009816525 [1,0,1,0,0,0|2,0,0]=4 585 B15R2.21 CCc1ccccc1c2ccccc2 271570a_100011216252_100000210277 [1,0,1,0,0,0|0,0,2]=4 586 B15R2.21 CCc1ccccc1c2ccccc2 271570a_100011218836_100011215823 [1,0,1,0,0,0|0,0,2]=4 587 B15R2.21 CNc1ccccc1c2ccccc2 271570a_100011218836_100020606079 [1,0,1,0,0,0|1,0,1]=4 588 B15R2.21 CNc1ccccc1c2ccccc2 34a_100000210918_200000210301 [1,0,1,0,0,0|1,0,1]=4 589 B15R2.21 COc1ccccc1c2ccccc2 271570a_100000756652_100000210277 [1,0,1,0,0,0|1,0,1]=4 590 B15R2.21 COc1ccccc1c2ccccc2 271570a_100011218836_100000174000 [1,0,1,0,0,0|1,0,1]=4 591 B15R2.21 COc1ccccc1c2ccccc2 34a_100000210297_200000210301 [1,0,1,0,0,0|1,0,1]=4 592 B15R2.21 COc1ccccc1c2ccccc2 7a_100000210297_200000210301 [1,0,1,0,0,0|1,0,1]=4 593 B15R2.21 CSc1ccccc1c2ccccc2 271570a_100011218165_100000210277 [1,0,1,0,0,0|1,0,1]=4 594 B15R2.21 CSc1ccccc1c2ccccc2 271570a_100011218836_100011217816 [1,0,1,0,0,0|1,0,1]=4 595 B15R2.21 CSc1ccccc1c2ccccc2 62a_100000033479_200000210301 [1,0,1,0,0,0|1,0,1]=4 596 B15R2.21 CSc1ccccc1c2ccccc2 62a_200000210301_100000033479 [1,0,1,0,0,0|1,0,1]=4 597 B15R2.21 N#Cc1ccccc1c2ccccc2 271570a_100000043008_100000210277 [1,0,1,0,0,0|0,0,2]=4 598 B15R2.21 N#Cc1ccccc1c2ccccc2 271570a_100011218836_100000188569 [1,0,1,0,0,0|0,0,2]=4 599 B15R2.21 NCc1ccccc1c2ccccc2 271570a_100011218836_100000689332 [1,0,1,0,0,0|0,0,1]=3 600 B15R2.21 NCc1ccccc1c2ccccc2 271570a_100020632975_100000210277 [1,0,1,0,0,0|0,0,1]=3 601 B15R2.21 NCc1ccccc1c2ccccn2 271570a_100011264011_100000689332 [1,0,1,0,0,0|1,0,1]=4 602 B15R2.21 NCc1ccccc1c2ccccn2 271570a_100020632975_100011216584 [1,0,1,0,0,0|1,0,1]=4 603 B15R2.21 NCc1ccccc1c2cccnc2 271570a_100000757648_100000689332 [1,0,1,0,0,0|1,0,1]=4 604 B15R2.21 NCc1ccccc1c2cccnc2 271570a_100020632975_100000752921 [1,0,1,0,0,0|1,0,1]=4 605 B15R2.21 NCc1ccccc1c2ccncc2 271570a_100000752145_100000689332 [1,0,1,0,0,0|1,0,1]=4 606 B15R2.21 NCc1ccccc1c2ccncc2 271570a_100020632975_100000035832 [1,0,1,0,0,0|1,0,1]=4 607 B15R2.21 NCc1cccnc1c2ccccc2 271570a_100011218836_100015189234 [1,0,1,0,0,0|1,0,1]=4 608 B15R2.21 NCc1ccncc1c2ccccc2 271570a_100011218836_100020640021 [1,0,1,0,0,0|1,0,1]=4 609 B15R2.21 NCc1ncccc1c2ccccc2 271570a_100011218836_100020591323 [1,0,1,0,0,0|1,0,1]=4 610 B15R2.21 NNc1ccccc1c2ccccc2 271570a_100011218836_100000241748 [1,0,1,0,0,0|1,0,0]=3 611 B15R2.21 NNc1ccccc1c2ccccn2 271570a_100011264011_100000241748 [1,0,1,0,0,0|2,0,0]=4 612 B15R2.21 NNc1ccccc1c2cccnc2 271570a_100000757648_100000241748 [1,0,1,0,0,0|2,0,0]=4 613 B15R2.21 NNc1ccccc1c2ccncc2 271570a_100000752145_100000241748 [1,0,1,0,0,0|2,0,0]=4 614 B15R2.21 NNc1ccncc1c2ccccc2 271570a_100011218836_100013404636 [1,0,1,0,0,0|2,0,0]=4 615 B15R2.21 NNc1ncccc1c2ccccc2 271570a_100011218836_100011464834 [1,0,1,0,0,0|2,0,0]=4 616 B15R2.21 O=Cc1ccccc1c2ccccc2 271570a_100000740022_100000210277 [1,0,1,0,0,0|1,0,0]=3 617 B15R2.21 O=Cc1ccccc1c2ccccc2 271570a_100011218836_100000211189 [1,0,1,0,0,0|1,0,0]=3 618 B15R2.21 O=Cc1ccccc1c2ccccn2 271570a_100000740022_100011216584 [1,0,1,0,0,0|2,0,0]=4 619 B15R2.21 O=Cc1ccccc1c2ccccn2 271570a_100011264011_100000211189 [1,0,1,0,0,0|2,0,0]=4 620 B15R2.21 O=Cc1ccccc1c2cccnc2 271570a_100000740022_100000752921 [1,0,1,0,0,0|2,0,0]=4 621 B15R2.21 O=Cc1ccccc1c2cccnc2 271570a_100000757648_100000211189 [1,0,1,0,0,0|2,0,0]=4 622 B15R2.21 O=Cc1ccccc1c2ccncc2 271570a_100000740022_100000035832 [1,0,1,0,0,0|2,0,0]=4 623 B15R2.21 O=Cc1ccccc1c2ccncc2 271570a_100000752145_100000211189 [1,0,1,0,0,0|2,0,0]=4 624 B15R2.21 O=Cc1cccnc1c2ccccc2 271570a_100011218836_100009816751 [1,0,1,0,0,0|2,0,0]=4 625 B15R2.21 O=Cc1ccncc1c2ccccc2 271570a_100011218836_100011934409 [1,0,1,0,0,0|2,0,0]=4 626 B15R2.21 O=Cc1cnccc1c2ccccc2 271570a_100011218836_100000050567 [1,0,1,0,0,0|2,0,0]=4 627 B15R2.21 O=Cc1ncccc1c2ccccc2 271570a_100011218836_100011934733 [1,0,1,0,0,0|2,0,0]=4 628 B15R2.21 OCc1ccccc1c2ccccc2 271570a_100000066922_100000210277 [1,0,1,0,0,0|1,0,1]=4 629 B15R2.21 OCc1ccccc1c2ccccc2 271570a_100011218836_100000187465 [1,0,1,0,0,0|1,0,1]=4 630 B15R2.21 [13CH3]Nc1ccccc1c2ccccc2 34a_100000210918_200025704644 [1,0,1,0,0,0|1,0,1]=4 631 B15R2.21 [13CH3]Oc1ccccc1c2ccccc2 34a_100000210297_200025704644 [1,0,1,0,0,0|1,0,1]=4 632 B15R2.21 [13CH3]Oc1ccccc1c2ccccc2 7a_100000210297_200025704644 [1,0,1,0,0,0|1,0,1]=4 633 B15R2.21 [13CH3]Sc1ccccc1c2ccccc2 62a_100000033479_200025704644 [1,0,1,0,0,0|1,0,1]=4 634 B15R2.21 [13CH3]Sc1ccccc1c2ccccc2 62a_200025704644_100000033479 [1,0,1,0,0,0|1,0,1]=4 635 B15R2.2195 C(#Cc1ccccc1)c2ccccc2 271570a_100000069678_100000210277 [1,0,1,0,0,0|0,0,2]=4 636 B15R2.2195 C(=Cc1ccccc1)c2ccccc2 271570a_100102527694_100000210277 [1,0,1,0,0,0|0,0,0]=2 637 B15R2.2195 C(=Cc1ccccn1)c2ccccc2 271570a_100102527694_100011216584 [1,0,1,0,0,0|1,0,0]=3 638 B15R2.2195 C(=Cc1ccccn1)c2cccnc2 271570a_100102525586_100011216584 [1,0,1,0,0,0|2,0,0]=4 639 B15R2.2195 C(=Cc1cccnc1)c2ccccc2 271570a_100102525586_100000210277 [1,0,1,0,0,0|1,0,0]=3 640 B15R2.2195 C(=Cc1cccnc1)c2ccccc2 271570a_100102527694_100000752921 [1,0,1,0,0,0|1,0,0]=3 641 B15R2.2195 C(=Cc1cccnc1)c2cccnc2 271570a_100102525586_100000752921 [1,0,1,0,0,0|2,0,0]=4 642 B15R2.2195 C(=Cc1cccnc1)c2ccncc2 271570a_100102525586_100000035832 [1,0,1,0,0,0|2,0,0]=4 643 B15R2.2195 C(=Cc1cccnn1)c2ccccc2 271570a_100102527694_100016991348 [1,0,1,0,0,0|2,0,0]=4 644 B15R2.2195 C(=Cc1ccncc1)c2ccccc2 271570a_100102527694_100000035832 [1,0,1,0,0,0|1,0,0]=3 645 B15R2.2195 C(=Cc1ccncn1)c2ccccc2 271570a_100102527694_100000703185 [1,0,1,0,0,0|2,0,0]=4 646 B15R2.2195 C(=Cc1ccnnc1)c2ccccc2 271570a_100102527694_100000732662 [1,0,1,0,0,0|2,0,0]=4 647 B15R2.2195 C(=Cc1cnccn1)c2ccccc2 271570a_100102527694_100000758340 [1,0,1,0,0,0|2,0,0]=4 648 B15R2.2195 C(=Cc1cncnc1)c2ccccc2 271570a_100102527694_100011206942 [1,0,1,0,0,0|2,0,0]=4 649 B15R2.2195 C(=Cc1ncccn1)c2ccccc2 271570a_100102527694_100000211032 [1,0,1,0,0,0|2,0,0]=4 650 B15R2.2195 c1ccc(cc1)CNc2ccccc2 207a_100000106764_100015611070 [1,0,1,0,0,0|1,0,1]=4 651 B15R2.2195 c1ccc(cc1)CNc2ccccc2 270302a_100000106764_100015611070 [1,0,1,0,0,0|1,0,1]=4 652 B15R2.2195 c1ccc(cc1)CNc2ccccc2 34a_100000106764_100015291786 [1,0,1,0,0,0|1,0,1]=4 653 B15R2.2195 c1ccc(cc1)COc2ccccc2 34a_100000210340_100015291786 [1,0,1,0,0,0|1,0,1]=4 654 B15R2.2195 c1ccc(cc1)COc2ccccc2 7a_100000210340_100000211182 [1,0,1,0,0,0|1,0,1]=4 655 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000211182_100000041952 [1,0,1,0,0,0|1,0,1]=4 656 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000719477_100015291786 [1,0,1,0,0,0|1,0,1]=4 657 B15R2.352 C=CCNc1ccc2ccccc2c1 34a_100000211940_100015514636 [1,0,1,0,0,0|1,0,1]=4 658 B15R2.352 C=CCNc1ccc2ccccc2c1 7a_100000211940_100015514636 [1,0,1,0,0,0|1,0,1]=4 659 B15R2.352 C=CCOc1ccc2ccccc2c1 34a_100000185828_100015514636 [1,0,1,0,0,0|1,0,1]=4 660 B15R2.352 C=CCOc1ccc2ccccc2c1 7a_100000185828_100015514636 [1,0,1,0,0,0|1,0,1]=4 661 B15R2.352 C=CCSc1ccc2ccccc2c1 62a_100000210623_100000233703 [1,0,1,0,0,0|1,0,1]=4 662 B15R2.886 C=C=Cc1cc(c2ccccc2c1)N 271570a_100015277604_100010171453 [1,0,1,0,0,0|0,0,1]=3 663 B15R2.886 C=C=Cc1cc(c2ccccc2c1)O 271570a_100015277604_100010089979 [1,0,1,0,0,0|1,0,1]=4 664 B15R2.886 C=C=Cc1cc(c2ccccc2n1)N 271570a_100015277604_100010197925 [1,0,1,0,0,0|1,0,1]=4 665 B15R2.886 C=C=Cc1cc(c2cccnc2c1)N 271570a_100015277604_200010263263 [1,0,1,0,0,0|1,0,1]=4 666 B15R2.886 C=C=Cc1cc(c2ncccc2c1)N 271570a_100015277604_100009814519 [1,0,1,0,0,0|1,0,1]=4 667 B15R2.886 C=C=Cc1cc2ccccc2c(n1)N 271570a_100015277604_100009957331 [1,0,1,0,0,0|1,0,1]=4 668 B15R2.886 CC=Cc1cc(c2ccccc2c1)N 271570a_100016259895_100010171453 [1,0,1,0,0,0|0,0,1]=3 669 B15R2.886 CC=Cc1cc(c2ccccc2c1)O 271570a_100016259895_100010089979 [1,0,1,0,0,0|1,0,1]=4 670 B15R2.886 CC=Cc1cc(c2ccccc2n1)N 271570a_100016259895_100010197925 [1,0,1,0,0,0|1,0,1]=4 671 B15R2.886 CC=Cc1cc(c2cccnc2c1)N 271570a_100016259895_200010263263 [1,0,1,0,0,0|1,0,1]=4 672 B15R2.886 CC=Cc1cc(c2ncccc2c1)N 271570a_100016259895_100009814519 [1,0,1,0,0,0|1,0,1]=4 673 B15R2.886 CC=Cc1cc2ccccc2c(n1)N 271570a_100016259895_100009957331 [1,0,1,0,0,0|1,0,1]=4 674 B15R2.888 C=C=Cc1cc2ccccc2cc1Br 271570a_100015277604_200010169544 [1,0,1,0,0,0|1,0,1]=4 675 B15R2.888 C=C=Cc1cc2ccccc2cc1Cl 271570a_100015277604_100010152806 [1,0,1,0,0,0|1,0,1]=4 676 B15R2.888 C=C=Cc1cc2ccccc2cc1N 271570a_100015277604_100009991566 [1,0,1,0,0,0|0,0,1]=3 677 B15R2.888 C=C=Cc1cc2ccccc2cc1O 271570a_100015277604_100009817189 [1,0,1,0,0,0|1,0,1]=4 678 B15R2.888 C=C=Cc1cc2ccccc2nc1N 271570a_100015277604_100010135404 [1,0,1,0,0,0|1,0,1]=4 679 B15R2.888 CC=Cc1cc2ccccc2cc1Br 271570a_100016259895_200010169544 [1,0,1,0,0,0|1,0,1]=4 680 B15R2.888 CC=Cc1cc2ccccc2cc1Cl 271570a_100016259895_100010152806 [1,0,1,0,0,0|1,0,1]=4 681 B15R2.888 CC=Cc1cc2ccccc2cc1N 271570a_100016259895_100009991566 [1,0,1,0,0,0|0,0,1]=3 682 B15R2.888 CC=Cc1cc2ccccc2cc1O 271570a_100016259895_100009817189 [1,0,1,0,0,0|1,0,1]=4 683 B15R2.888 CC=Cc1cc2ccccc2nc1N 271570a_100016259895_100010135404 [1,0,1,0,0,0|1,0,1]=4 684 B15R2.555 Brc1ccccc1c2ccccc2I 271570a_100000069755_100000695589 [1,0,1,0,0,0|2,0,0]=4 685 B15R2.555 C[n+]1ccccc1c2ccccc2N 271570a_100000034411_100000212160 [1,0,1,0,0,0|1,0,1]=4 686 B15R2.555 Cc1ccccc1c2ccccc2Br 271570a_100000747142_100000695589 [1,0,1,0,0,0|1,0,1]=4 687 B15R2.555 Cc1ccccc1c2ccccc2C 271570a_100000747142_100000210755 [1,0,1,0,0,0|0,0,2]=4 688 B15R2.555 Cc1ccccc1c2ccccc2Cl 271570a_100000747142_100000764095 [1,0,1,0,0,0|1,0,1]=4 689 B15R2.555 Cc1ccccc1c2ccccc2Cl 271570a_100011934419_100000210755 [1,0,1,0,0,0|1,0,1]=4 690 B15R2.555 Cc1ccccc1c2ccccc2F 271570a_100000747142_100011215700 [1,0,1,0,0,0|1,0,1]=4 691 B15R2.555 Cc1ccccc1c2ccccc2F 271570a_100000761933_100000210755 [1,0,1,0,0,0|1,0,1]=4 692 B15R2.555 Cc1ccccc1c2ccccc2I 271570a_100000069755_100000210755 [1,0,1,0,0,0|1,0,1]=4 693 B15R2.555 Cc1ccccc1c2ccccc2N 271570a_100000034411_100000210755 [1,0,1,0,0,0|0,0,1]=3 694 B15R2.555 Cc1ccccc1c2ccccc2N 271570a_100000747142_100000210017 [1,0,1,0,0,0|0,0,1]=3 695 B15R2.555 Cc1ccccc1c2ccccc2O 271570a_100000035170_100000210755 [1,0,1,0,0,0|1,0,1]=4 696 B15R2.555 Cc1ccccc1c2ccccc2O 271570a_100000747142_100000739446 [1,0,1,0,0,0|1,0,1]=4 697 B15R2.555 Cc1ccccc1c2cccnc2N 271570a_100000071976_100000210755 [1,0,1,0,0,0|1,0,1]=4 698 B15R2.555 Cc1ccccc1c2cccnc2N 271570a_100000747142_100000045569 [1,0,1,0,0,0|1,0,1]=4 699 B15R2.555 Cc1ccccc1c2ccncc2N 271570a_100000747142_100009815883 [1,0,1,0,0,0|1,0,1]=4 700 B15R2.555 Cc1ccccc1c2cnccc2N 271570a_100000747142_100000047001 [1,0,1,0,0,0|1,0,1]=4 701 B15R2.555 Cc1ccccc1c2cnccc2N 271570a_200010248739_100000210755 [1,0,1,0,0,0|1,0,1]=4 702 B15R2.555 Cc1ccccc1c2ncccc2N 271570a_100000747142_100000688686 [1,0,1,0,0,0|1,0,1]=4 703 B15R2.555 Cc1cccnc1c2ccccc2N 271570a_100000034411_100000751373 [1,0,1,0,0,0|1,0,1]=4 704 B15R2.555 Cc1ccncc1c2ccccc2N 271570a_100000034411_100000761580 [1,0,1,0,0,0|1,0,1]=4 705 B15R2.555 Cc1ccncc1c2ccccc2N 271570a_100011935247_100000210017 [1,0,1,0,0,0|1,0,1]=4 706 B15R2.555 Cc1cnccc1c2ccccc2N 271570a_100000034411_100015191297 [1,0,1,0,0,0|1,0,1]=4 707 B15R2.555 Cc1cnccc1c2ccccc2N 271570a_100000701363_100000210017 [1,0,1,0,0,0|1,0,1]=4 708 B15R2.555 Cc1ncccc1c2ccccc2N 271570a_100000034411_100000751574 [1,0,1,0,0,0|1,0,1]=4 709 B15R2.555 Cc1ncccc1c2ccccc2N 271570a_100011934933_100000210017 [1,0,1,0,0,0|1,0,1]=4 710 B15R2.555 Clc1ccccc1c2ccccc2Br 271570a_100011934419_100000695589 [1,0,1,0,0,0|2,0,0]=4 711 B15R2.555 Clc1ccccc1c2ccccc2Cl 271570a_100011934419_100000764095 [1,0,1,0,0,0|2,0,0]=4 712 B15R2.555 Clc1ccccc1c2ccccc2I 271570a_100000069755_100000764095 [1,0,1,0,0,0|2,0,0]=4 713 B15R2.555 Fc1ccccc1c2ccccc2Br 271570a_100000761933_100000695589 [1,0,1,0,0,0|2,0,0]=4 714 B15R2.555 Fc1ccccc1c2ccccc2Cl 271570a_100000761933_100000764095 [1,0,1,0,0,0|2,0,0]=4 715 B15R2.555 Fc1ccccc1c2ccccc2Cl 271570a_100011934419_100011215700 [1,0,1,0,0,0|2,0,0]=4 716 B15R2.555 Fc1ccccc1c2ccccc2F 271570a_100000761933_100011215700 [1,0,1,0,0,0|2,0,0]=4 717 B15R2.555 Fc1ccccc1c2ccccc2I 271570a_100000069755_100011215700 [1,0,1,0,0,0|2,0,0]=4 718 B15R2.555 Nc1ccccc1c2c[nH]ccc2=O 271570a_100000034411_100009998708 [1,0,1,0,0,0|2,0,0]=4 719 B15R2.555 Nc1ccccc1c2c[nH]ccc2=S 271570a_100000034411_200012280681 [1,0,1,0,0,0|2,0,0]=4 720 B15R2.555 Nc1ccccc1c2ccc[nH]c2=O 271570a_100000034411_100000050042 [1,0,1,0,0,0|2,0,0]=4 721 B15R2.555 Nc1ccccc1c2ccc[nH]c2=O 271570a_100000099769_100000210017 [1,0,1,0,0,0|2,0,0]=4 722 B15R2.555 Nc1ccccc1c2cccc[n+]2[O-] 271570a_100000034411_200000042595 [1,0,1,0,0,0|2,0,0]=4 723 B15R2.555 Nc1ccccc1c2ccccc2Br 271570a_100000034411_100000695589 [1,0,1,0,0,0|1,0,0]=3 724 B15R2.555 Nc1ccccc1c2ccccc2Cl 271570a_100000034411_100000764095 [1,0,1,0,0,0|1,0,0]=3 725 B15R2.555 Nc1ccccc1c2ccccc2Cl 271570a_100011934419_100000210017 [1,0,1,0,0,0|1,0,0]=3 726 B15R2.555 Nc1ccccc1c2ccccc2F 271570a_100000034411_100011215700 [1,0,1,0,0,0|1,0,0]=3 727 B15R2.555 Nc1ccccc1c2ccccc2F 271570a_100000761933_100000210017 [1,0,1,0,0,0|1,0,0]=3 728 B15R2.555 Nc1ccccc1c2ccccc2I 271570a_100000069755_100000210017 [1,0,1,0,0,0|1,0,0]=3 729 B15R2.555 Nc1ccccc1c2ccccc2N 271570a_100000034411_100000210017 [1,0,1,0,0,0|1,0,0]=3 730 B15R2.555 Nc1ccccc1c2ccccc2O 271570a_100000034411_100000739446 [1,0,1,0,0,0|1,0,0]=3 731 B15R2.555 Nc1ccccc1c2ccccc2O 271570a_100000035170_100000210017 [1,0,1,0,0,0|1,0,0]=3 732 B15R2.555 Nc1ccccc1c2cccnc2Br 271570a_100000034411_100010202626 [1,0,1,0,0,0|2,0,0]=4 733 B15R2.555 Nc1ccccc1c2cccnc2Cl 271570a_100000034411_100000036424 [1,0,1,0,0,0|2,0,0]=4 734 B15R2.555 Nc1ccccc1c2cccnc2Cl 271570a_100000047009_100000210017 [1,0,1,0,0,0|2,0,0]=4 735 B15R2.555 Nc1ccccc1c2cccnc2F 271570a_100000034411_100009816115 [1,0,1,0,0,0|2,0,0]=4 736 B15R2.555 Nc1ccccc1c2cccnc2F 271570a_100000042387_100000210017 [1,0,1,0,0,0|2,0,0]=4 737 B15R2.555 Nc1ccccc1c2cccnc2N 271570a_100000034411_100000045569 [1,0,1,0,0,0|2,0,0]=4 738 B15R2.555 Nc1ccccc1c2cccnc2N 271570a_100000071976_100000210017 [1,0,1,0,0,0|2,0,0]=4 739 B15R2.555 Nc1ccccc1c2ccncc2Br 271570a_100000034411_100000726257 [1,0,1,0,0,0|2,0,0]=4 740 B15R2.555 Nc1ccccc1c2ccncc2Cl 271570a_100000034411_100000708259 [1,0,1,0,0,0|2,0,0]=4 741 B15R2.555 Nc1ccccc1c2ccncc2Cl 271570a_100000062318_100000210017 [1,0,1,0,0,0|2,0,0]=4 742 B15R2.555 Nc1ccccc1c2ccncc2F 271570a_100000034411_100000047030 [1,0,1,0,0,0|2,0,0]=4 743 B15R2.555 Nc1ccccc1c2ccncc2F 271570a_100011290801_100000210017 [1,0,1,0,0,0|2,0,0]=4 744 B15R2.555 Nc1ccccc1c2ccncc2N 271570a_100000034411_100009815883 [1,0,1,0,0,0|2,0,0]=4 745 B15R2.555 Nc1ccccc1c2ccncc2O 271570a_100000034411_100009817591 [1,0,1,0,0,0|2,0,0]=4 746 B15R2.555 Nc1ccccc1c2cnccc2Br 271570a_100000034411_100010138639 [1,0,1,0,0,0|2,0,0]=4 747 B15R2.555 Nc1ccccc1c2cnccc2Cl 271570a_100000034411_100009995489 [1,0,1,0,0,0|2,0,0]=4 748 B15R2.555 Nc1ccccc1c2cnccc2Cl 271570a_100000062317_100000210017 [1,0,1,0,0,0|2,0,0]=4 749 B15R2.555 Nc1ccccc1c2cnccc2F 271570a_100000034411_100009820683 [1,0,1,0,0,0|2,0,0]=4 750 B15R2.555 Nc1ccccc1c2cnccc2N 271570a_100000034411_100000047001 [1,0,1,0,0,0|2,0,0]=4 751 B15R2.555 Nc1ccccc1c2cnccc2N 271570a_200010248739_100000210017 [1,0,1,0,0,0|2,0,0]=4 752 B15R2.555 Nc1ccccc1c2ncccc2Br 271570a_100000034411_100000696092 [1,0,1,0,0,0|2,0,0]=4 753 B15R2.555 Nc1ccccc1c2ncccc2Cl 271570a_100000034411_100011356963 [1,0,1,0,0,0|2,0,0]=4 754 B15R2.555 Nc1ccccc1c2ncccc2Cl 271570a_100009857861_100000210017 [1,0,1,0,0,0|2,0,0]=4 755 B15R2.555 Nc1ccccc1c2ncccc2F 271570a_100000034411_100000685392 [1,0,1,0,0,0|2,0,0]=4 756 B15R2.555 Nc1ccccc1c2ncccc2N 271570a_100000034411_100000688686 [1,0,1,0,0,0|2,0,0]=4 757 B15R2.555 Nc1ccccc1c2ncccc2O 271570a_100000034411_100000034122 [1,0,1,0,0,0|2,0,0]=4 758 B15R2.555 Nc1cccnc1c2ccccc2Cl 271570a_100011934419_100000688686 [1,0,1,0,0,0|2,0,0]=4 759 B15R2.555 Nc1cccnc1c2ccccc2F 271570a_100000761933_100000688686 [1,0,1,0,0,0|2,0,0]=4 760 B15R2.555 Nc1cccnc1c2ccccc2I 271570a_100000069755_100000688686 [1,0,1,0,0,0|2,0,0]=4 761 B15R2.555 Nc1cccnc1c2ccccc2O 271570a_100000035170_100000688686 [1,0,1,0,0,0|2,0,0]=4 762 B15R2.555 Nc1ccncc1c2ccccc2Br 271570a_200010248739_100000695589 [1,0,1,0,0,0|2,0,0]=4 763 B15R2.555 Nc1ccncc1c2ccccc2Cl 271570a_100011934419_100000047001 [1,0,1,0,0,0|2,0,0]=4 764 B15R2.555 Nc1ccncc1c2ccccc2Cl 271570a_200010248739_100000764095 [1,0,1,0,0,0|2,0,0]=4 765 B15R2.555 Nc1ccncc1c2ccccc2F 271570a_100000761933_100000047001 [1,0,1,0,0,0|2,0,0]=4 766 B15R2.555 Nc1ccncc1c2ccccc2F 271570a_200010248739_100011215700 [1,0,1,0,0,0|2,0,0]=4 767 B15R2.555 Nc1ccncc1c2ccccc2I 271570a_100000069755_100000047001 [1,0,1,0,0,0|2,0,0]=4 768 B15R2.555 Nc1ccncc1c2ccccc2O 271570a_100000035170_100000047001 [1,0,1,0,0,0|2,0,0]=4 769 B15R2.555 Nc1ccncc1c2ccccc2O 271570a_200010248739_100000739446 [1,0,1,0,0,0|2,0,0]=4 770 B15R2.555 Nc1cnccc1c2ccccc2Cl 271570a_100011934419_100009815883 [1,0,1,0,0,0|2,0,0]=4 771 B15R2.555 Nc1cnccc1c2ccccc2F 271570a_100000761933_100009815883 [1,0,1,0,0,0|2,0,0]=4 772 B15R2.555 Nc1cnccc1c2ccccc2I 271570a_100000069755_100009815883 [1,0,1,0,0,0|2,0,0]=4 773 B15R2.555 Nc1cnccc1c2ccccc2O 271570a_100000035170_100009815883 [1,0,1,0,0,0|2,0,0]=4 774 B15R2.555 Nc1ncccc1c2ccccc2Br 271570a_100000071976_100000695589 [1,0,1,0,0,0|2,0,0]=4 775 B15R2.555 Nc1ncccc1c2ccccc2Cl 271570a_100000071976_100000764095 [1,0,1,0,0,0|2,0,0]=4 776 B15R2.555 Nc1ncccc1c2ccccc2Cl 271570a_100011934419_100000045569 [1,0,1,0,0,0|2,0,0]=4 777 B15R2.555 Nc1ncccc1c2ccccc2F 271570a_100000071976_100011215700 [1,0,1,0,0,0|2,0,0]=4 778 B15R2.555 Nc1ncccc1c2ccccc2F 271570a_100000761933_100000045569 [1,0,1,0,0,0|2,0,0]=4 779 B15R2.555 Nc1ncccc1c2ccccc2I 271570a_100000069755_100000045569 [1,0,1,0,0,0|2,0,0]=4 780 B15R2.555 Nc1ncccc1c2ccccc2O 271570a_100000035170_100000045569 [1,0,1,0,0,0|2,0,0]=4 781 B15R2.555 Nc1ncccc1c2ccccc2O 271570a_100000071976_100000739446 [1,0,1,0,0,0|2,0,0]=4 782 B15R2.555 Oc1ccccc1c2ccccc2Br 271570a_100000035170_100000695589 [1,0,1,0,0,0|2,0,0]=4 783 B15R2.555 Oc1ccccc1c2ccccc2Cl 271570a_100000035170_100000764095 [1,0,1,0,0,0|2,0,0]=4 784 B15R2.555 Oc1ccccc1c2ccccc2Cl 271570a_100011934419_100000739446 [1,0,1,0,0,0|2,0,0]=4 785 B15R2.555 Oc1ccccc1c2ccccc2F 271570a_100000035170_100011215700 [1,0,1,0,0,0|2,0,0]=4 786 B15R2.555 Oc1ccccc1c2ccccc2F 271570a_100000761933_100000739446 [1,0,1,0,0,0|2,0,0]=4 787 B15R2.555 Oc1ccccc1c2ccccc2I 271570a_100000069755_100000739446 [1,0,1,0,0,0|2,0,0]=4 788 B15R2.555 Oc1ccccc1c2ccccc2O 271570a_100000035170_100000739446 [1,0,1,0,0,0|2,0,0]=4 789 B15R2.2115 C=Cc1c(ccc2c1cccc2)C=O 271570a_100011290941_100009813496 [1,0,1,0,0,0|1,0,0]=3 790 B15R2.2115 C=Cc1c(ccc2c1cccc2)OC 271570a_100011290941_100000173347 [1,0,1,0,0,0|1,0,1]=4 791 B15R2.2115 C=Cc1ccc2ccccc2c1C=O 271570a_100011290941_100010090029 [1,0,1,0,0,0|1,0,0]=3 792 B15R2.2115 C=Cc1ccc2ccccc2c1OC 271570a_100011290941_100010089960 [1,0,1,0,0,0|1,0,1]=4 793 B15R2.2220 C=C=Cc1ccc2ccccc2c1Br 271570a_100015277604_200010089984 [1,0,1,0,0,0|1,0,1]=4 794 B15R2.2220 C=C=Cc1ccc2ccccc2c1C 271570a_100015277604_100010221197 [1,0,1,0,0,0|0,0,2]=4 795 B15R2.2220 C=C=Cc1ccc2ccccc2c1F 271570a_100015277604_100009832041 [1,0,1,0,0,0|1,0,1]=4 796 B15R2.2220 C=C=Cc1ccc2ccccc2c1N 271570a_100015277604_100009817101 [1,0,1,0,0,0|1,0,1]=4 797 B15R2.2220 C=C=Cc1ccc2ccccc2c1O 271570a_100015277604_100009996032 [1,0,1,0,0,0|1,0,1]=4 798 B15R2.2220 CC=Cc1ccc2ccccc2c1Br 271570a_100016259895_200010089984 [1,0,1,0,0,0|1,0,1]=4 799 B15R2.2220 CC=Cc1ccc2ccccc2c1C 271570a_100016259895_100010221197 [1,0,1,0,0,0|0,0,2]=4 800 B15R2.2220 CC=Cc1ccc2ccccc2c1F 271570a_100016259895_100009832041 [1,0,1,0,0,0|1,0,1]=4 801 B15R2.2220 CC=Cc1ccc2ccccc2c1N 271570a_100016259895_100009817101 [1,0,1,0,0,0|1,0,1]=4 802 B15R2.2220 CC=Cc1ccc2ccccc2c1O 271570a_100016259895_100009996032 [1,0,1,0,0,0|1,0,1]=4 803 B15R2.4382 C=C=Cc1ccc(c2c1cccc2)Br 271570a_100015277604_100012339872 [1,0,1,0,0,0|1,0,1]=4 804 B15R2.4382 C=C=Cc1ccc(c2c1cccc2)C 271570a_100015277604_100011215156 [1,0,1,0,0,0|1,0,1]=4 805 B15R2.4382 C=C=Cc1ccc(c2c1cccc2)F 271570a_100015277604_100011218216 [1,0,1,0,0,0|1,0,1]=4 806 B15R2.4382 C=C=Cc1ccc(c2c1cccc2)N 271570a_100015277604_100000766797 [1,0,1,0,0,0|0,0,1]=3 807 B15R2.4382 C=C=Cc1ccc(c2c1cccc2)O 271570a_100015277604_100000186334 [1,0,1,0,0,0|1,0,1]=4 808 B15R2.4382 C=C=Cc1ccc(c2c1cccn2)N 271570a_100015277604_100000726955 [1,0,1,0,0,0|1,0,1]=4 809 B15R2.4382 C=C=Cc1ccc(c2c1ccnc2)N 271570a_100015277604_100011218454 [1,0,1,0,0,0|1,0,1]=4 810 B15R2.4382 C=C=Cc1ccc(c2c1cncc2)N 271570a_100015277604_200012344021 [1,0,1,0,0,0|1,0,1]=4 811 B15R2.4382 C=C=Cc1ccc(c2c1nccc2)N 271570a_100015277604_100012360041 [1,0,1,0,0,0|1,0,1]=4 812 B15R2.4382 C=C=Cc1cnc(c2c1cccc2)N 271570a_100015277604_100010158575 [1,0,1,0,0,0|1,0,1]=4 813 B15R2.4382 C=C=Cc1ncc(c2c1cccc2)N 271570a_100015277604_200009868590 [1,0,1,0,0,0|1,0,1]=4 814 B15R2.4382 CC=Cc1ccc(c2c1cccc2)Br 271570a_100016259895_100012339872 [1,0,1,0,0,0|1,0,1]=4 815 B15R2.4382 CC=Cc1ccc(c2c1cccc2)C 271570a_100016259895_100011215156 [1,0,1,0,0,0|1,0,1]=4 816 B15R2.4382 CC=Cc1ccc(c2c1cccc2)F 271570a_100016259895_100011218216 [1,0,1,0,0,0|1,0,1]=4 817 B15R2.4382 CC=Cc1ccc(c2c1cccc2)N 271570a_100016259895_100000766797 [1,0,1,0,0,0|0,0,1]=3 818 B15R2.4382 CC=Cc1ccc(c2c1cccc2)O 271570a_100016259895_100000186334 [1,0,1,0,0,0|1,0,1]=4 819 B15R2.4382 CC=Cc1ccc(c2c1cccn2)N 271570a_100016259895_100000726955 [1,0,1,0,0,0|1,0,1]=4 820 B15R2.4382 CC=Cc1ccc(c2c1ccnc2)N 271570a_100016259895_100011218454 [1,0,1,0,0,0|1,0,1]=4 821 B15R2.4382 CC=Cc1ccc(c2c1cncc2)N 271570a_100016259895_200012344021 [1,0,1,0,0,0|1,0,1]=4 822 B15R2.4382 CC=Cc1ccc(c2c1nccc2)N 271570a_100016259895_100012360041 [1,0,1,0,0,0|1,0,1]=4 823 B15R2.4382 CC=Cc1cnc(c2c1cccc2)N 271570a_100016259895_100010158575 [1,0,1,0,0,0|1,0,1]=4 824 B15R2.4382 CC=Cc1ncc(c2c1cccc2)N 271570a_100016259895_200009868590 [1,0,1,0,0,0|1,0,1]=4 825 B15R2.18471 C=CCNc1cccc2c1cccc2 34a_100000185869_100015514636 [1,0,1,0,0,0|1,0,1]=4 826 B15R2.18471 C=CCOc1cccc2c1cccc2 34a_100000210388_100015514636 [1,0,1,0,0,0|1,0,1]=4 827 B15R2.18471 C=CCOc1cccc2c1cccc2 7a_100000210388_100015514636 [1,0,1,0,0,0|1,0,1]=4 828 B15R2.18471 C=CCSc1cccc2c1cccc2 62a_100000210623_100000210605 [1,0,1,0,0,0|1,0,1]=4 829 B15R2.4392 C=C=Cc1cc(cc2c1cccc2)N 271570a_100015277604_100010089974 [1,0,1,0,0,0|0,0,1]=3 830 B15R2.4392 C=C=Cc1cc(cc2c1cccc2)O 271570a_100015277604_100010001680 [1,0,1,0,0,0|1,0,1]=4 831 B15R2.4392 C=C=Cc1nc(cc2c1cccc2)N 271570a_100015277604_100009814382 [1,0,1,0,0,0|1,0,1]=4 832 B15R2.4392 CC=Cc1cc(cc2c1cccc2)N 271570a_100016259895_100010089974 [1,0,1,0,0,0|0,0,1]=3 833 B15R2.4392 CC=Cc1cc(cc2c1cccc2)O 271570a_100016259895_100010001680 [1,0,1,0,0,0|1,0,1]=4 834 B15R2.4392 CC=Cc1nc(cc2c1cccc2)N 271570a_100016259895_100009814382 [1,0,1,0,0,0|1,0,1]=4 835 B15R2.9941 C=C=Cc1c(ccc2c1cccc2)Br 271570a_100015277604_100010090040 [1,0,1,0,0,0|1,0,1]=4 836 B15R2.9941 C=C=Cc1c(ccc2c1cccc2)C 271570a_100015277604_100000759710 [1,0,1,0,0,0|0,0,2]=4 837 B15R2.9941 C=C=Cc1c(ccc2c1cccc2)N 271570a_100015277604_100000705303 [1,0,1,0,0,0|1,0,1]=4 838 B15R2.9941 C=C=Cc1c(ccc2c1cccc2)O 271570a_100015277604_100000183829 [1,0,1,0,0,0|1,0,1]=4 839 B15R2.9941 CC=Cc1c(ccc2c1cccc2)Br 271570a_100016259895_100010090040 [1,0,1,0,0,0|1,0,1]=4 840 B15R2.9941 CC=Cc1c(ccc2c1cccc2)C 271570a_100016259895_100000759710 [1,0,1,0,0,0|0,0,2]=4 841 B15R2.9941 CC=Cc1c(ccc2c1cccc2)N 271570a_100016259895_100000705303 [1,0,1,0,0,0|1,0,1]=4 842 B15R2.9941 CC=Cc1c(ccc2c1cccc2)O 271570a_100016259895_100000183829 [1,0,1,0,0,0|1,0,1]=4 843 B17R2.231 CCC(=O)c1ccccc1c2ccccc2 1458a_100000211553_100000210202 [0,1,1,0,0,0|1,0,1]=4 844 B17R2.231 CNC(=O)c1ccccc1c2ccccc2 11a_106832991635_100000211553 [0,1,1,0,0,0|1,0,0]=3 845 B17R2.231 CNC(=O)c1ccccc1c2ccccc2 1626a_100102657272_100000211553 [0,1,1,0,0,0|1,0,0]=3 846 B17R2.231 CNC(=O)c1ccccc1c2ccccc2 240690a_100102657272_100000211553 [0,1,1,0,0,0|1,0,0]=3 847 B17R2.231 CNC(=O)c1ccccc1c2ccccc2 271570a_100010369252_100000210277 [0,1,1,0,0,0|1,0,0]=3 848 B17R2.231 CNC(=O)c1ccccc1c2ccccc2 271570a_100011218836_100000155073 [0,1,1,0,0,0|1,0,0]=3 849 B17R2.231 CNC(=O)c1ccccc1c2ccccn2 1626a_100102657272_200011894344 [0,1,1,0,0,0|2,0,0]=4 850 B17R2.231 CNC(=O)c1ccccc1c2ccccn2 240690a_100102657272_200011894344 [0,1,1,0,0,0|2,0,0]=4 851 B17R2.231 CNC(=O)c1ccccc1c2ccccn2 271570a_100010369252_100011216584 [0,1,1,0,0,0|2,0,0]=4 852 B17R2.231 CNC(=O)c1ccccc1c2ccccn2 271570a_100011264011_100000155073 [0,1,1,0,0,0|2,0,0]=4 853 B17R2.231 CNC(=O)c1ccccc1c2ccccn2 527a_100102657272_200011894344 [0,1,1,0,0,0|2,0,0]=4 854 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 1626a_100102657272_100011399806 [0,1,1,0,0,0|2,0,0]=4 855 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 240690a_100102657272_100011399806 [0,1,1,0,0,0|2,0,0]=4 856 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000155073 [0,1,1,0,0,0|2,0,0]=4 857 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 271570a_100010369252_100000752921 [0,1,1,0,0,0|2,0,0]=4 858 B17R2.231 CNC(=O)c1ccccc1c2cccnc2 527a_100102657272_100011399806 [0,1,1,0,0,0|2,0,0]=4 859 B17R2.231 CNC(=O)c1ccccc1c2ccncc2 11a_106832991635_100025775821 [0,1,1,0,0,0|2,0,0]=4 860 B17R2.231 CNC(=O)c1ccccc1c2ccncc2 1626a_100102657272_100025775821 [0,1,1,0,0,0|2,0,0]=4 861 B17R2.231 CNC(=O)c1ccccc1c2ccncc2 240690a_100102657272_100025775821 [0,1,1,0,0,0|2,0,0]=4 862 B17R2.231 CNC(=O)c1ccccc1c2ccncc2 271570a_100000752145_100000155073 [0,1,1,0,0,0|2,0,0]=4 863 B17R2.231 CNC(=O)c1ccccc1c2ccncc2 271570a_100010369252_100000035832 [0,1,1,0,0,0|2,0,0]=4 864 B17R2.231 CNC(=O)c1cccnc1c2ccccc2 271570a_100011218836_100000159833 [0,1,1,0,0,0|2,0,0]=4 865 B17R2.231 CNC(C)c1ccccc1c2ccccc2 269862a_106832991636_100011191951 [0,1,1,0,0,0|0,0,2]=4 866 B17R2.231 CNC(C)c1ccccc1c2ccccc2 271570a_100011218836_100000692418 [0,1,1,0,0,0|0,0,2]=4 867 B17R2.231 COC(=O)c1ccccc1c2ccccc2 271570a_100000034818_100000210277 [0,1,1,0,0,0|1,0,1]=4 868 B17R2.231 COC(=O)c1ccccc1c2ccccc2 271570a_100011218836_100000148710 [0,1,1,0,0,0|1,0,1]=4 869 B17R2.231 NCC(O)c1ccccc1c2ccccc2 271570a_100011218836_100011236429 [0,1,1,0,0,0|1,0,1]=4 870 B17R2.231 NNC(=O)c1ccccc1c2ccccc2 271570a_100011218836_100000190081 [0,1,1,0,0,0|1,0,0]=3 871 B17R2.231 NNC(=O)c1ccccc1c2ccccn2 271570a_100011264011_100000190081 [0,1,1,0,0,0|2,0,0]=4 872 B17R2.231 NNC(=O)c1ccccc1c2cccnc2 271570a_100000757648_100000190081 [0,1,1,0,0,0|2,0,0]=4 873 B17R2.231 NNC(=O)c1ccccc1c2ccncc2 271570a_100000752145_100000190081 [0,1,1,0,0,0|2,0,0]=4 874 B17R2.231 N[C@H](CO)c1ccccc1c2ccccc2 271570a_100011218836_100161155918 [0,1,1,0,0,0|0,0,2]=4 875 B17R2.231 O=C(CF)c1ccccc1c2ccccc2 1458a_100000211553_100015361967 [0,1,1,0,0,0|1,0,1]=4 876 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)Br 1458a_200011941434_200000210301 [0,1,1,0,0,0|1,0,1]=4 877 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)Br 271570a_100010158976_100000752885 [0,1,1,0,0,0|1,0,1]=4 878 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)Br 271570a_100010235827_100000751169 [0,1,1,0,0,0|1,0,1]=4 879 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)C 1458a_100000183608_200000210301 [0,1,1,0,0,0|1,0,1]=4 880 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)C 271570a_100000708704_100000751169 [0,1,1,0,0,0|1,0,1]=4 881 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)C 271570a_100010158976_100000186775 [0,1,1,0,0,0|1,0,1]=4 882 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)Cl 1458a_100011219874_200000210301 [0,1,1,0,0,0|1,0,1]=4 883 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)Cl 271570a_100010158976_100000755918 [0,1,1,0,0,0|1,0,1]=4 884 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)Cl 271570a_100011213355_100000751169 [0,1,1,0,0,0|1,0,1]=4 885 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)F 1458a_100011217319_200000210301 [0,1,1,0,0,0|1,0,1]=4 886 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)F 271570a_100010158976_100000211213 [0,1,1,0,0,0|1,0,1]=4 887 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)F 271570a_100011934326_100000751169 [0,1,1,0,0,0|1,0,1]=4 888 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)I 271570a_100000033156_100000751169 [0,1,1,0,0,0|1,0,1]=4 889 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)N 271570a_100010158976_100000185761 [0,1,1,0,0,0|1,0,1]=4 890 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)N 271570a_100015188457_100000751169 [0,1,1,0,0,0|1,0,1]=4 891 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)O 271570a_100010158976_100000185759 [0,1,1,0,0,0|1,0,1]=4 892 B17R2.350 CC(=O)c1ccccc1c2ccc(cc2)O 271570a_100015205159_100000751169 [0,1,1,0,0,0|1,0,1]=4 893 B17R2.350 CC(N)c1ccccc1c2ccc(cc2)Br 271570a_100010235827_100000181357 [0,1,1,0,0,0|0,0,2]=4 894 B17R2.350 CC(N)c1ccccc1c2ccc(cc2)Cl 271570a_100011213355_100000181357 [0,1,1,0,0,0|0,0,2]=4 895 B17R2.350 CC(N)c1ccccc1c2ccc(cc2)F 271570a_100011934326_100000181357 [0,1,1,0,0,0|0,0,2]=4 896 B17R2.350 CC(N)c1ccccc1c2ccc(cc2)I 271570a_100000033156_100000181357 [0,1,1,0,0,0|0,0,2]=4 897 B17R2.350 CC(N)c1ccccc1c2ccc(cc2)N 271570a_100015188457_100000181357 [0,1,1,0,0,0|0,0,2]=4 898 B17R2.350 CC(N)c1ccccc1c2ccc(cc2)O 271570a_100015205159_100000181357 [0,1,1,0,0,0|0,0,2]=4 899 B17R2.350 C[n+]1ccc(cc1)c2ccccc2C(=O)N 271570a_100010897472_100000162227 [0,1,1,0,0,0|2,0,0]=4 900 B17R2.350 Cc1ccc(cc1)c2ccccc2C(=O)N 271570a_100000041535_100000186775 [0,1,1,0,0,0|1,0,0]=3 901 B17R2.350 Cc1ccc(cc1)c2ccccc2C(=O)N 271570a_100000708704_100000162227 [0,1,1,0,0,0|1,0,0]=3 902 B17R2.350 Cc1ccc(cc1)c2ccccc2C(=O)[13CH3] 1458a_100000183608_200025704644 [0,1,1,0,0,0|1,0,1]=4 903 B17R2.350 Cc1ccc(cc1)c2ccccc2C(C)N 271570a_100000708704_100000181357 [0,1,1,0,0,0|0,0,2]=4 904 B17R2.350 Cc1ccc(cc1)c2cccnc2C(=O)N 271570a_100000708704_200012359670 [0,1,1,0,0,0|2,0,0]=4 905 B17R2.350 Cc1ccc(cc1)c2ccncc2C(=O)N 271570a_100000708704_100000697804 [0,1,1,0,0,0|2,0,0]=4 906 B17R2.350 Cc1ccc(cc1)c2cnccc2C(=O)N 271570a_100000708704_100010205435 [0,1,1,0,0,0|2,0,0]=4 907 B17R2.350 Cc1ccc(cc1)c2ncccc2C(=O)N 271570a_100000708704_100000162199 [0,1,1,0,0,0|2,0,0]=4 908 B17R2.350 Cc1ccc(cn1)c2ccccc2C(=O)N 271570a_100000041535_100000751577 [0,1,1,0,0,0|2,0,0]=4 909 B17R2.350 Cc1ccc(cn1)c2ccccc2C(=O)N 271570a_100012354835_100000162227 [0,1,1,0,0,0|2,0,0]=4 910 B17R2.350 Cc1ccc(nc1)c2ccccc2C(=O)N 271570a_100000041535_100000754016 [0,1,1,0,0,0|2,0,0]=4 911 B17R2.350 Cc1ccc(nc1)c2ccccc2C(=O)N 271570a_100000066433_100000162227 [0,1,1,0,0,0|2,0,0]=4 912 B17R2.350 NC(=O)c1ccccc1c2cc[n+](cc2)[O-] 271570a_100000041535_100000039755 [0,1,1,0,0,0|2,0,0]=4 913 B17R2.350 NC(=O)c1ccccc1c2ccc(=O)[nH]c2 271570a_100000041535_100000212171 [0,1,1,0,0,0|2,0,0]=4 914 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)Br 271570a_100000041535_100000752885 [0,1,1,0,0,0|1,0,0]=3 915 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)Br 271570a_100010235827_100000162227 [0,1,1,0,0,0|1,0,0]=3 916 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)Cl 271570a_100000041535_100000755918 [0,1,1,0,0,0|1,0,0]=3 917 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)Cl 271570a_100011213355_100000162227 [0,1,1,0,0,0|1,0,0]=3 918 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)F 271570a_100000041535_100000211213 [0,1,1,0,0,0|1,0,0]=3 919 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)F 271570a_100011934326_100000162227 [0,1,1,0,0,0|1,0,0]=3 920 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)I 271570a_100000033156_100000162227 [0,1,1,0,0,0|1,0,0]=3 921 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)N 271570a_100000041535_100000185761 [0,1,1,0,0,0|1,0,0]=3 922 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)N 271570a_100015188457_100000162227 [0,1,1,0,0,0|1,0,0]=3 923 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)O 271570a_100000041535_100000185759 [0,1,1,0,0,0|1,0,0]=3 924 B17R2.350 NC(=O)c1ccccc1c2ccc(cc2)O 271570a_100015205159_100000162227 [0,1,1,0,0,0|1,0,0]=3 925 B17R2.350 NC(=O)c1ccccc1c2ccc(cn2)Br 271570a_100000041535_100000686858 [0,1,1,0,0,0|2,0,0]=4 926 B17R2.350 NC(=O)c1ccccc1c2ccc(cn2)Cl 271570a_100000041535_100011356976 [0,1,1,0,0,0|2,0,0]=4 927 B17R2.350 NC(=O)c1ccccc1c2ccc(cn2)Cl 271570a_200000049369_100000162227 [0,1,1,0,0,0|2,0,0]=4 928 B17R2.350 NC(=O)c1ccccc1c2ccc(cn2)F 271570a_100000041535_100000744514 [0,1,1,0,0,0|2,0,0]=4 929 B17R2.350 NC(=O)c1ccccc1c2ccc(cn2)F 271570a_100000117362_100000162227 [0,1,1,0,0,0|2,0,0]=4 930 B17R2.350 NC(=O)c1ccccc1c2ccc(cn2)N 271570a_100000041535_100000744251 [0,1,1,0,0,0|2,0,0]=4 931 B17R2.350 NC(=O)c1ccccc1c2ccc(cn2)O 271570a_100000041535_100000685995 [0,1,1,0,0,0|2,0,0]=4 932 B17R2.350 NC(=O)c1ccccc1c2ccc(nc2)Br 271570a_100000041535_100009814638 [0,1,1,0,0,0|2,0,0]=4 933 B17R2.350 NC(=O)c1ccccc1c2ccc(nc2)Cl 271570a_100000037156_100000162227 [0,1,1,0,0,0|2,0,0]=4 934 B17R2.350 NC(=O)c1ccccc1c2ccc(nc2)Cl 271570a_100000041535_100000034144 [0,1,1,0,0,0|2,0,0]=4 935 B17R2.350 NC(=O)c1ccccc1c2ccc(nc2)F 271570a_100000041535_100000748661 [0,1,1,0,0,0|2,0,0]=4 936 B17R2.350 NC(=O)c1ccccc1c2ccc(nc2)F 271570a_100000041719_100000162227 [0,1,1,0,0,0|2,0,0]=4 937 B17R2.350 NC(=O)c1ccccc1c2ccc(nc2)N 271570a_100000041535_100000187370 [0,1,1,0,0,0|2,0,0]=4 938 B17R2.350 NC(=O)c1ccccc1c2ccc(nc2)N 271570a_100000062249_100000162227 [0,1,1,0,0,0|2,0,0]=4 939 B17R2.350 NC(=O)c1ccccc1c2ccc(nc2)O 271570a_100000062254_100000162227 [0,1,1,0,0,0|2,0,0]=4 940 B17R2.350 NC(=O)c1cccnc1c2ccc(cc2)Br 271570a_100010235827_100000162199 [0,1,1,0,0,0|2,0,0]=4 941 B17R2.350 NC(=O)c1cccnc1c2ccc(cc2)Cl 271570a_100011213355_100000162199 [0,1,1,0,0,0|2,0,0]=4 942 B17R2.350 NC(=O)c1cccnc1c2ccc(cc2)F 271570a_100011934326_100000162199 [0,1,1,0,0,0|2,0,0]=4 943 B17R2.350 NC(=O)c1cccnc1c2ccc(cc2)I 271570a_100000033156_100000162199 [0,1,1,0,0,0|2,0,0]=4 944 B17R2.350 NC(=O)c1cccnc1c2ccc(cc2)N 271570a_100015188457_100000162199 [0,1,1,0,0,0|2,0,0]=4 945 B17R2.350 NC(=O)c1cccnc1c2ccc(cc2)O 271570a_100015205159_100000162199 [0,1,1,0,0,0|2,0,0]=4 946 B17R2.350 NC(=O)c1ccncc1c2ccc(cc2)Br 271570a_100010235827_100010205435 [0,1,1,0,0,0|2,0,0]=4 947 B17R2.350 NC(=O)c1ccncc1c2ccc(cc2)Cl 271570a_100011213355_100010205435 [0,1,1,0,0,0|2,0,0]=4 948 B17R2.350 NC(=O)c1ccncc1c2ccc(cc2)F 271570a_100011934326_100010205435 [0,1,1,0,0,0|2,0,0]=4 949 B17R2.350 NC(=O)c1ccncc1c2ccc(cc2)I 271570a_100000033156_100010205435 [0,1,1,0,0,0|2,0,0]=4 950 B17R2.350 NC(=O)c1ccncc1c2ccc(cc2)N 271570a_100015188457_100010205435 [0,1,1,0,0,0|2,0,0]=4 951 B17R2.350 NC(=O)c1ccncc1c2ccc(cc2)O 271570a_100015205159_100010205435 [0,1,1,0,0,0|2,0,0]=4 952 B17R2.350 NC(=O)c1cnccc1c2ccc(cc2)Br 271570a_100010235827_100000697804 [0,1,1,0,0,0|2,0,0]=4 953 B17R2.350 NC(=O)c1cnccc1c2ccc(cc2)Cl 271570a_100011213355_100000697804 [0,1,1,0,0,0|2,0,0]=4 954 B17R2.350 NC(=O)c1cnccc1c2ccc(cc2)F 271570a_100011934326_100000697804 [0,1,1,0,0,0|2,0,0]=4 955 B17R2.350 NC(=O)c1cnccc1c2ccc(cc2)I 271570a_100000033156_100000697804 [0,1,1,0,0,0|2,0,0]=4 956 B17R2.350 NC(=O)c1cnccc1c2ccc(cc2)N 271570a_100015188457_100000697804 [0,1,1,0,0,0|2,0,0]=4 957 B17R2.350 NC(=O)c1cnccc1c2ccc(cc2)O 271570a_100015205159_100000697804 [0,1,1,0,0,0|2,0,0]=4 958 B17R2.350 NC(=O)c1ncccc1c2ccc(cc2)Br 271570a_100010235827_200012359670 [0,1,1,0,0,0|2,0,0]=4 959 B17R2.350 NC(=O)c1ncccc1c2ccc(cc2)Cl 271570a_100011213355_200012359670 [0,1,1,0,0,0|2,0,0]=4 960 B17R2.350 NC(=O)c1ncccc1c2ccc(cc2)F 271570a_100011934326_200012359670 [0,1,1,0,0,0|2,0,0]=4 961 B17R2.350 NC(=O)c1ncccc1c2ccc(cc2)I 271570a_100000033156_200012359670 [0,1,1,0,0,0|2,0,0]=4 962 B17R2.350 NC(=O)c1ncccc1c2ccc(cc2)N 271570a_100015188457_200012359670 [0,1,1,0,0,0|2,0,0]=4 963 B17R2.350 NC(=O)c1ncccc1c2ccc(cc2)O 271570a_100015205159_200012359670 [0,1,1,0,0,0|2,0,0]=4 964 B17R2.350 [13CH3]C(=O)c1ccccc1c2ccc(cc2)Br 1458a_200011941434_200025704644 [0,1,1,0,0,0|1,0,1]=4 965 B17R2.350 [13CH3]C(=O)c1ccccc1c2ccc(cc2)Cl 1458a_100011219874_200025704644 [0,1,1,0,0,0|1,0,1]=4 966 B17R2.350 [13CH3]C(=O)c1ccccc1c2ccc(cc2)F 1458a_100011217319_200025704644 [0,1,1,0,0,0|1,0,1]=4 967 B17R2.2466 CC(C)(N)c1ccccc1c2ccccc2 271570a_100011218836_100020606264 [0,1,1,0,0,0|0,0,2]=4 968 B17R2.2466 NS(=O)(=O)c1ccccc1c2ccccc2 271570a_100011218836_100000735520 [0,1,1,0,0,0|2,0,0]=4 969 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)Br 271570a_100010158976_100000691529 [0,1,1,0,0,0|1,0,1]=4 970 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)C 1458a_100000736333_200000210301 [0,1,1,0,0,0|1,0,1]=4 971 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)C 271570a_100000749446_100000751169 [0,1,1,0,0,0|1,0,1]=4 972 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)C 271570a_100010158976_100011215228 [0,1,1,0,0,0|1,0,1]=4 973 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)Cl 1458a_100011217320_200000210301 [0,1,1,0,0,0|1,0,1]=4 974 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)Cl 271570a_100010158976_100000699651 [0,1,1,0,0,0|1,0,1]=4 975 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)Cl 271570a_100011214927_100000751169 [0,1,1,0,0,0|1,0,1]=4 976 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)F 1458a_100011219949_200000210301 [0,1,1,0,0,0|1,0,1]=4 977 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)F 271570a_100010158976_100000685547 [0,1,1,0,0,0|1,0,1]=4 978 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)F 271570a_100012349223_100000751169 [0,1,1,0,0,0|1,0,1]=4 979 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)I 271570a_100000043368_100000751169 [0,1,1,0,0,0|1,0,1]=4 980 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)N 271570a_100000699968_100000751169 [0,1,1,0,0,0|1,0,1]=4 981 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)N 271570a_100010158976_100000210019 [0,1,1,0,0,0|1,0,1]=4 982 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)O 1458a_200010140796_200000210301 [0,1,1,0,0,0|1,0,1]=4 983 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)O 271570a_100000693801_100000751169 [0,1,1,0,0,0|1,0,1]=4 984 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)O 271570a_100010158976_100000211634 [0,1,1,0,0,0|1,0,1]=4 985 B17R2.3363 CC(=O)c1ccccc1c2cccc(c2)[S] 271570a_100010158976_114929384022 [0,1,1,0,0,0|1,0,1]=4 986 B17R2.3363 CC(N)c1ccccc1c2cccc(c2)Cl 271570a_100011214927_100000181357 [0,1,1,0,0,0|0,0,2]=4 987 B17R2.3363 CC(N)c1ccccc1c2cccc(c2)F 271570a_100012349223_100000181357 [0,1,1,0,0,0|0,0,2]=4 988 B17R2.3363 CC(N)c1ccccc1c2cccc(c2)I 271570a_100000043368_100000181357 [0,1,1,0,0,0|0,0,2]=4 989 B17R2.3363 CC(N)c1ccccc1c2cccc(c2)N 271570a_100000699968_100000181357 [0,1,1,0,0,0|0,0,2]=4 990 B17R2.3363 CC(N)c1ccccc1c2cccc(c2)O 271570a_100000693801_100000181357 [0,1,1,0,0,0|0,0,2]=4 991 B17R2.3363 C[n+]1cccc(c1)c2ccccc2C(=O)N 271570a_100000041535_100009996589 [0,1,1,0,0,0|2,0,0]=4 992 B17R2.3363 Cc1cc(ccn1)c2ccccc2C(=O)N 271570a_100000041535_100000758586 [0,1,1,0,0,0|2,0,0]=4 993 B17R2.3363 Cc1cc(ccn1)c2ccccc2C(=O)N 271570a_100011830414_100000162227 [0,1,1,0,0,0|2,0,0]=4 994 B17R2.3363 Cc1cccc(c1)c2ccccc2C(=O)N 271570a_100000041535_100011215228 [0,1,1,0,0,0|1,0,0]=3 995 B17R2.3363 Cc1cccc(c1)c2ccccc2C(=O)N 271570a_100000749446_100000162227 [0,1,1,0,0,0|1,0,0]=3 996 B17R2.3363 Cc1cccc(c1)c2ccccc2C(=O)[13CH3] 1458a_100000736333_200025704644 [0,1,1,0,0,0|1,0,1]=4 997 B17R2.3363 Cc1cccc(c1)c2ccccc2C(C)N 271570a_100000749446_100000181357 [0,1,1,0,0,0|0,0,2]=4 998 B17R2.3363 Cc1cccc(c1)c2cccnc2C(=O)N 271570a_100000749446_200012359670 [0,1,1,0,0,0|2,0,0]=4 999 B17R2.3363 Cc1cccc(c1)c2ccncc2C(=O)N 271570a_100000749446_100000697804 [0,1,1,0,0,0|2,0,0]=4 1000 B17R2.3363 Cc1cccc(c1)c2cnccc2C(=O)N 271570a_100000749446_100010205435 [0,1,1,0,0,0|2,0,0]=4 1001 B17R2.3363 Cc1cccc(c1)c2ncccc2C(=O)N 271570a_100000749446_100000162199 [0,1,1,0,0,0|2,0,0]=4 1002 B17R2.3363 Cc1cccc(n1)c2ccccc2C(=O)N 271570a_100000041535_100000742759 [0,1,1,0,0,0|2,0,0]=4 1003 B17R2.3363 Cc1cccc(n1)c2ccccc2C(=O)N 271570a_100000046275_100000162227 [0,1,1,0,0,0|2,0,0]=4 1004 B17R2.3363 Cc1ccnc(c1)c2ccccc2C(=O)N 271570a_100000041535_100000750283 [0,1,1,0,0,0|2,0,0]=4 1005 B17R2.3363 Cc1ccnc(c1)c2ccccc2C(=O)N 271570a_100000049243_100000162227 [0,1,1,0,0,0|2,0,0]=4 1006 B17R2.3363 Cc1cncc(c1)c2ccccc2C(=O)N 271570a_100000041535_100000760492 [0,1,1,0,0,0|2,0,0]=4 1007 B17R2.3363 Cc1cncc(c1)c2ccccc2C(=O)N 271570a_100012355712_100000162227 [0,1,1,0,0,0|2,0,0]=4 1008 B17R2.3363 NC(=O)c1ccccc1c2cc(ccn2)Cl 271570a_100000041535_100010167805 [0,1,1,0,0,0|2,0,0]=4 1009 B17R2.3363 NC(=O)c1ccccc1c2cc(ccn2)F 271570a_100000041535_100009817058 [0,1,1,0,0,0|2,0,0]=4 1010 B17R2.3363 NC(=O)c1ccccc1c2cc(ccn2)F 271570a_200000087102_100000162227 [0,1,1,0,0,0|2,0,0]=4 1011 B17R2.3363 NC(=O)c1ccccc1c2cc(ccn2)N 271570a_100000041535_100009814236 [0,1,1,0,0,0|2,0,0]=4 1012 B17R2.3363 NC(=O)c1ccccc1c2cc(ccn2)O 271570a_100000041535_100000762945 [0,1,1,0,0,0|2,0,0]=4 1013 B17R2.3363 NC(=O)c1ccccc1c2cc[nH]c(=O)c2 271570a_100000041535_100009816521 [0,1,1,0,0,0|2,0,0]=4 1014 B17R2.3363 NC(=O)c1ccccc1c2ccc[n+](c2)[O-] 271570a_100000041535_100009815978 [0,1,1,0,0,0|2,0,0]=4 1015 B17R2.3363 NC(=O)c1ccccc1c2cccc(=O)[nH]2 271570a_100000041535_100000761760 [0,1,1,0,0,0|2,0,0]=4 1016 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)Br 271570a_100000041535_100000691529 [0,1,1,0,0,0|1,0,0]=3 1017 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)Cl 271570a_100000041535_100000699651 [0,1,1,0,0,0|1,0,0]=3 1018 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)Cl 271570a_100011214927_100000162227 [0,1,1,0,0,0|1,0,0]=3 1019 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)F 271570a_100000041535_100000685547 [0,1,1,0,0,0|1,0,0]=3 1020 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)F 271570a_100012349223_100000162227 [0,1,1,0,0,0|1,0,0]=3 1021 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)I 271570a_100000043368_100000162227 [0,1,1,0,0,0|1,0,0]=3 1022 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)N 271570a_100000041535_100000210019 [0,1,1,0,0,0|1,0,0]=3 1023 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)N 271570a_100000699968_100000162227 [0,1,1,0,0,0|1,0,0]=3 1024 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)O 271570a_100000041535_100000211634 [0,1,1,0,0,0|1,0,0]=3 1025 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)O 271570a_100000693801_100000162227 [0,1,1,0,0,0|1,0,0]=3 1026 B17R2.3363 NC(=O)c1ccccc1c2cccc(c2)[S] 271570a_100000041535_114929384022 [0,1,1,0,0,0|1,0,0]=3 1027 B17R2.3363 NC(=O)c1ccccc1c2cccc(n2)Br 271570a_100000041535_100000684672 [0,1,1,0,0,0|2,0,0]=4 1028 B17R2.3363 NC(=O)c1ccccc1c2cccc(n2)Cl 271570a_100000062326_100000162227 [0,1,1,0,0,0|2,0,0]=4 1029 B17R2.3363 NC(=O)c1ccccc1c2cccc(n2)F 271570a_100000041535_100009815982 [0,1,1,0,0,0|2,0,0]=4 1030 B17R2.3363 NC(=O)c1ccccc1c2cccc(n2)F 271570a_100000090185_100000162227 [0,1,1,0,0,0|2,0,0]=4 1031 B17R2.3363 NC(=O)c1ccccc1c2cccc(n2)N 271570a_100000041535_100000740741 [0,1,1,0,0,0|2,0,0]=4 1032 B17R2.3363 NC(=O)c1ccccc1c2cccc(n2)O 271570a_100010195584_100000162227 [0,1,1,0,0,0|2,0,0]=4 1033 B17R2.3363 NC(=O)c1ccccc1c2ccnc(c2)Br 271570a_100000041535_100009814637 [0,1,1,0,0,0|2,0,0]=4 1034 B17R2.3363 NC(=O)c1ccccc1c2ccnc(c2)Cl 271570a_100000041535_100000035001 [0,1,1,0,0,0|2,0,0]=4 1035 B17R2.3363 NC(=O)c1ccccc1c2ccnc(c2)Cl 271570a_100000049459_100000162227 [0,1,1,0,0,0|2,0,0]=4 1036 B17R2.3363 NC(=O)c1ccccc1c2ccnc(c2)F 271570a_100000041535_100009816116 [0,1,1,0,0,0|2,0,0]=4 1037 B17R2.3363 NC(=O)c1ccccc1c2ccnc(c2)F 271570a_100000062321_100000162227 [0,1,1,0,0,0|2,0,0]=4 1038 B17R2.3363 NC(=O)c1ccccc1c2ccnc(c2)N 271570a_100000041535_100000744379 [0,1,1,0,0,0|2,0,0]=4 1039 B17R2.3363 NC(=O)c1ccccc1c2ccnc(c2)N 271570a_102125402725_100000162227 [0,1,1,0,0,0|2,0,0]=4 1040 B17R2.3363 NC(=O)c1ccccc1c2ccnc(c2)O 271570a_100010237957_100000162227 [0,1,1,0,0,0|2,0,0]=4 1041 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)Br 271570a_100000041535_100000728054 [0,1,1,0,0,0|2,0,0]=4 1042 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)Br 271570a_200009814628_100000162227 [0,1,1,0,0,0|2,0,0]=4 1043 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)Cl 271570a_100000041535_100000049639 [0,1,1,0,0,0|2,0,0]=4 1044 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)Cl 271570a_100000049213_100000162227 [0,1,1,0,0,0|2,0,0]=4 1045 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)F 271570a_100000041535_100000744099 [0,1,1,0,0,0|2,0,0]=4 1046 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)F 271570a_100000757375_100000162227 [0,1,1,0,0,0|2,0,0]=4 1047 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)N 271570a_100000041535_100000687067 [0,1,1,0,0,0|2,0,0]=4 1048 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)N 271570a_100000069896_100000162227 [0,1,1,0,0,0|2,0,0]=4 1049 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)O 271570a_100000041535_100000754920 [0,1,1,0,0,0|2,0,0]=4 1050 B17R2.3363 NC(=O)c1ccccc1c2cncc(c2)O 271570a_100010248756_100000162227 [0,1,1,0,0,0|2,0,0]=4 1051 B17R2.3363 NC(=O)c1cccnc1c2cccc(c2)Cl 271570a_100011214927_100000162199 [0,1,1,0,0,0|2,0,0]=4 1052 B17R2.3363 NC(=O)c1cccnc1c2cccc(c2)F 271570a_100012349223_100000162199 [0,1,1,0,0,0|2,0,0]=4 1053 B17R2.3363 NC(=O)c1cccnc1c2cccc(c2)I 271570a_100000043368_100000162199 [0,1,1,0,0,0|2,0,0]=4 1054 B17R2.3363 NC(=O)c1cccnc1c2cccc(c2)N 271570a_100000699968_100000162199 [0,1,1,0,0,0|2,0,0]=4 1055 B17R2.3363 NC(=O)c1cccnc1c2cccc(c2)O 271570a_100000693801_100000162199 [0,1,1,0,0,0|2,0,0]=4 1056 B17R2.3363 NC(=O)c1ccncc1c2cccc(c2)Cl 271570a_100011214927_100010205435 [0,1,1,0,0,0|2,0,0]=4 1057 B17R2.3363 NC(=O)c1ccncc1c2cccc(c2)F 271570a_100012349223_100010205435 [0,1,1,0,0,0|2,0,0]=4 1058 B17R2.3363 NC(=O)c1ccncc1c2cccc(c2)I 271570a_100000043368_100010205435 [0,1,1,0,0,0|2,0,0]=4 1059 B17R2.3363 NC(=O)c1ccncc1c2cccc(c2)N 271570a_100000699968_100010205435 [0,1,1,0,0,0|2,0,0]=4 1060 B17R2.3363 NC(=O)c1ccncc1c2cccc(c2)O 271570a_100000693801_100010205435 [0,1,1,0,0,0|2,0,0]=4 1061 B17R2.3363 NC(=O)c1cnccc1c2cccc(c2)Cl 271570a_100011214927_100000697804 [0,1,1,0,0,0|2,0,0]=4 1062 B17R2.3363 NC(=O)c1cnccc1c2cccc(c2)F 271570a_100012349223_100000697804 [0,1,1,0,0,0|2,0,0]=4 1063 B17R2.3363 NC(=O)c1cnccc1c2cccc(c2)I 271570a_100000043368_100000697804 [0,1,1,0,0,0|2,0,0]=4 1064 B17R2.3363 NC(=O)c1cnccc1c2cccc(c2)N 271570a_100000699968_100000697804 [0,1,1,0,0,0|2,0,0]=4 1065 B17R2.3363 NC(=O)c1cnccc1c2cccc(c2)O 271570a_100000693801_100000697804 [0,1,1,0,0,0|2,0,0]=4 1066 B17R2.3363 NC(=O)c1ncccc1c2cccc(c2)Cl 271570a_100011214927_200012359670 [0,1,1,0,0,0|2,0,0]=4 1067 B17R2.3363 NC(=O)c1ncccc1c2cccc(c2)F 271570a_100012349223_200012359670 [0,1,1,0,0,0|2,0,0]=4 1068 B17R2.3363 NC(=O)c1ncccc1c2cccc(c2)I 271570a_100000043368_200012359670 [0,1,1,0,0,0|2,0,0]=4 1069 B17R2.3363 NC(=O)c1ncccc1c2cccc(c2)N 271570a_100000699968_200012359670 [0,1,1,0,0,0|2,0,0]=4 1070 B17R2.3363 NC(=O)c1ncccc1c2cccc(c2)O 271570a_100000693801_200012359670 [0,1,1,0,0,0|2,0,0]=4 1071 B17R2.3363 [13CH3]C(=O)c1ccccc1c2cccc(c2)Cl 1458a_100011217320_200025704644 [0,1,1,0,0,0|1,0,1]=4 1072 B17R2.3363 [13CH3]C(=O)c1ccccc1c2cccc(c2)F 1458a_100011219949_200025704644 [0,1,1,0,0,0|1,0,1]=4 1073 B17R2.3363 [13CH3]C(=O)c1ccccc1c2cccc(c2)O 1458a_200010140796_200025704644 [0,1,1,0,0,0|1,0,1]=4 1074 B17R2.3445 CC(=O)c1ccccc1c2ccccc2Br 271570a_100010158976_100000695589 [0,1,1,0,0,0|1,0,1]=4 1075 B17R2.3445 CC(=O)c1ccccc1c2ccccc2C 1458a_100011218600_200000210301 [0,1,1,0,0,0|1,0,1]=4 1076 B17R2.3445 CC(=O)c1ccccc1c2ccccc2C 271570a_100000747142_100000751169 [0,1,1,0,0,0|1,0,1]=4 1077 B17R2.3445 CC(=O)c1ccccc1c2ccccc2C 271570a_100010158976_100000210755 [0,1,1,0,0,0|1,0,1]=4 1078 B17R2.3445 CC(=O)c1ccccc1c2ccccc2Cl 1458a_200011217321_200000210301 [0,1,1,0,0,0|1,0,1]=4 1079 B17R2.3445 CC(=O)c1ccccc1c2ccccc2Cl 271570a_100010158976_100000764095 [0,1,1,0,0,0|1,0,1]=4 1080 B17R2.3445 CC(=O)c1ccccc1c2ccccc2Cl 271570a_100011934419_100000751169 [0,1,1,0,0,0|1,0,1]=4 1081 B17R2.3445 CC(=O)c1ccccc1c2ccccc2F 1458a_100011689210_200000210301 [0,1,1,0,0,0|1,0,1]=4 1082 B17R2.3445 CC(=O)c1ccccc1c2ccccc2F 271570a_100000761933_100000751169 [0,1,1,0,0,0|1,0,1]=4 1083 B17R2.3445 CC(=O)c1ccccc1c2ccccc2F 271570a_100010158976_100011215700 [0,1,1,0,0,0|1,0,1]=4 1084 B17R2.3445 CC(=O)c1ccccc1c2ccccc2I 271570a_100000069755_100000751169 [0,1,1,0,0,0|1,0,1]=4 1085 B17R2.3445 CC(=O)c1ccccc1c2ccccc2N 271570a_100000034411_100000751169 [0,1,1,0,0,0|1,0,1]=4 1086 B17R2.3445 CC(=O)c1ccccc1c2ccccc2N 271570a_100010158976_100000210017 [0,1,1,0,0,0|1,0,1]=4 1087 B17R2.3445 CC(=O)c1ccccc1c2ccccc2O 1458a_200009992749_200000210301 [0,1,1,0,0,0|1,0,1]=4 1088 B17R2.3445 CC(=O)c1ccccc1c2ccccc2O 271570a_100000035170_100000751169 [0,1,1,0,0,0|1,0,1]=4 1089 B17R2.3445 CC(=O)c1ccccc1c2ccccc2O 271570a_100010158976_100000739446 [0,1,1,0,0,0|1,0,1]=4 1090 B17R2.3445 CC(N)c1ccccc1c2ccccc2Cl 271570a_100011934419_100000181357 [0,1,1,0,0,0|0,0,2]=4 1091 B17R2.3445 CC(N)c1ccccc1c2ccccc2F 271570a_100000761933_100000181357 [0,1,1,0,0,0|0,0,2]=4 1092 B17R2.3445 CC(N)c1ccccc1c2ccccc2I 271570a_100000069755_100000181357 [0,1,1,0,0,0|0,0,2]=4 1093 B17R2.3445 CC(N)c1ccccc1c2ccccc2N 271570a_100000034411_100000181357 [0,1,1,0,0,0|0,0,2]=4 1094 B17R2.3445 CC(N)c1ccccc1c2ccccc2O 271570a_100000035170_100000181357 [0,1,1,0,0,0|0,0,2]=4 1095 B17R2.3445 C[n+]1ccccc1c2ccccc2C(=O)N 271570a_100000041535_100000212160 [0,1,1,0,0,0|2,0,0]=4 1096 B17R2.3445 Cc1ccccc1c2ccccc2C(=O)N 271570a_100000041535_100000210755 [0,1,1,0,0,0|1,0,0]=3 1097 B17R2.3445 Cc1ccccc1c2ccccc2C(=O)N 271570a_100000747142_100000162227 [0,1,1,0,0,0|1,0,0]=3 1098 B17R2.3445 Cc1ccccc1c2ccccc2C(=O)[13CH3] 1458a_100011218600_200025704644 [0,1,1,0,0,0|1,0,1]=4 1099 B17R2.3445 Cc1ccccc1c2ccccc2C(C)N 271570a_100000747142_100000181357 [0,1,1,0,0,0|0,0,2]=4 1100 B17R2.3445 Cc1ccccc1c2cccnc2C(=O)N 271570a_100000747142_200012359670 [0,1,1,0,0,0|2,0,0]=4 1101 B17R2.3445 Cc1ccccc1c2ccncc2C(=O)N 271570a_100000747142_100000697804 [0,1,1,0,0,0|2,0,0]=4 1102 B17R2.3445 Cc1ccccc1c2cnccc2C(=O)N 271570a_100000747142_100010205435 [0,1,1,0,0,0|2,0,0]=4 1103 B17R2.3445 Cc1ccccc1c2ncccc2C(=O)N 271570a_100000747142_100000162199 [0,1,1,0,0,0|2,0,0]=4 1104 B17R2.3445 Cc1cccnc1c2ccccc2C(=O)N 271570a_100000041535_100000751373 [0,1,1,0,0,0|2,0,0]=4 1105 B17R2.3445 Cc1ccncc1c2ccccc2C(=O)N 271570a_100000041535_100000761580 [0,1,1,0,0,0|2,0,0]=4 1106 B17R2.3445 Cc1ccncc1c2ccccc2C(=O)N 271570a_100011935247_100000162227 [0,1,1,0,0,0|2,0,0]=4 1107 B17R2.3445 Cc1cnccc1c2ccccc2C(=O)N 271570a_100000041535_100015191297 [0,1,1,0,0,0|2,0,0]=4 1108 B17R2.3445 Cc1cnccc1c2ccccc2C(=O)N 271570a_100000701363_100000162227 [0,1,1,0,0,0|2,0,0]=4 1109 B17R2.3445 Cc1ncccc1c2ccccc2C(=O)N 271570a_100000041535_100000751574 [0,1,1,0,0,0|2,0,0]=4 1110 B17R2.3445 Cc1ncccc1c2ccccc2C(=O)N 271570a_100011934933_100000162227 [0,1,1,0,0,0|2,0,0]=4 1111 B17R2.3445 NC(=O)c1ccccc1c2c[nH]ccc2=O 271570a_100000041535_100009998708 [0,1,1,0,0,0|2,0,0]=4 1112 B17R2.3445 NC(=O)c1ccccc1c2c[nH]ccc2=S 271570a_100000041535_200012280681 [0,1,1,0,0,0|2,0,0]=4 1113 B17R2.3445 NC(=O)c1ccccc1c2ccc[nH]c2=O 271570a_100000041535_100000050042 [0,1,1,0,0,0|2,0,0]=4 1114 B17R2.3445 NC(=O)c1ccccc1c2ccc[nH]c2=O 271570a_100000099769_100000162227 [0,1,1,0,0,0|2,0,0]=4 1115 B17R2.3445 NC(=O)c1ccccc1c2cccc[n+]2[O-] 271570a_100000041535_200000042595 [0,1,1,0,0,0|2,0,0]=4 1116 B17R2.3445 NC(=O)c1ccccc1c2ccccc2Br 271570a_100000041535_100000695589 [0,1,1,0,0,0|1,0,0]=3 1117 B17R2.3445 NC(=O)c1ccccc1c2ccccc2Cl 271570a_100000041535_100000764095 [0,1,1,0,0,0|1,0,0]=3 1118 B17R2.3445 NC(=O)c1ccccc1c2ccccc2Cl 271570a_100011934419_100000162227 [0,1,1,0,0,0|1,0,0]=3 1119 B17R2.3445 NC(=O)c1ccccc1c2ccccc2F 271570a_100000041535_100011215700 [0,1,1,0,0,0|1,0,0]=3 1120 B17R2.3445 NC(=O)c1ccccc1c2ccccc2F 271570a_100000761933_100000162227 [0,1,1,0,0,0|1,0,0]=3 1121 B17R2.3445 NC(=O)c1ccccc1c2ccccc2I 271570a_100000069755_100000162227 [0,1,1,0,0,0|1,0,0]=3 1122 B17R2.3445 NC(=O)c1ccccc1c2ccccc2N 271570a_100000034411_100000162227 [0,1,1,0,0,0|1,0,0]=3 1123 B17R2.3445 NC(=O)c1ccccc1c2ccccc2N 271570a_100000041535_100000210017 [0,1,1,0,0,0|1,0,0]=3 1124 B17R2.3445 NC(=O)c1ccccc1c2ccccc2O 271570a_100000035170_100000162227 [0,1,1,0,0,0|1,0,0]=3 1125 B17R2.3445 NC(=O)c1ccccc1c2ccccc2O 271570a_100000041535_100000739446 [0,1,1,0,0,0|1,0,0]=3 1126 B17R2.3445 NC(=O)c1ccccc1c2cccnc2Br 271570a_100000041535_100010202626 [0,1,1,0,0,0|2,0,0]=4 1127 B17R2.3445 NC(=O)c1ccccc1c2cccnc2Cl 271570a_100000041535_100000036424 [0,1,1,0,0,0|2,0,0]=4 1128 B17R2.3445 NC(=O)c1ccccc1c2cccnc2Cl 271570a_100000047009_100000162227 [0,1,1,0,0,0|2,0,0]=4 1129 B17R2.3445 NC(=O)c1ccccc1c2cccnc2F 271570a_100000041535_100009816115 [0,1,1,0,0,0|2,0,0]=4 1130 B17R2.3445 NC(=O)c1ccccc1c2cccnc2F 271570a_100000042387_100000162227 [0,1,1,0,0,0|2,0,0]=4 1131 B17R2.3445 NC(=O)c1ccccc1c2cccnc2N 271570a_100000041535_100000045569 [0,1,1,0,0,0|2,0,0]=4 1132 B17R2.3445 NC(=O)c1ccccc1c2cccnc2N 271570a_100000071976_100000162227 [0,1,1,0,0,0|2,0,0]=4 1133 B17R2.3445 NC(=O)c1ccccc1c2ccncc2Br 271570a_100000041535_100000726257 [0,1,1,0,0,0|2,0,0]=4 1134 B17R2.3445 NC(=O)c1ccccc1c2ccncc2Cl 271570a_100000041535_100000708259 [0,1,1,0,0,0|2,0,0]=4 1135 B17R2.3445 NC(=O)c1ccccc1c2ccncc2Cl 271570a_100000062318_100000162227 [0,1,1,0,0,0|2,0,0]=4 1136 B17R2.3445 NC(=O)c1ccccc1c2ccncc2F 271570a_100000041535_100000047030 [0,1,1,0,0,0|2,0,0]=4 1137 B17R2.3445 NC(=O)c1ccccc1c2ccncc2F 271570a_100011290801_100000162227 [0,1,1,0,0,0|2,0,0]=4 1138 B17R2.3445 NC(=O)c1ccccc1c2ccncc2N 271570a_100000041535_100009815883 [0,1,1,0,0,0|2,0,0]=4 1139 B17R2.3445 NC(=O)c1ccccc1c2ccncc2O 271570a_100000041535_100009817591 [0,1,1,0,0,0|2,0,0]=4 1140 B17R2.3445 NC(=O)c1ccccc1c2cnccc2Br 271570a_100000041535_100010138639 [0,1,1,0,0,0|2,0,0]=4 1141 B17R2.3445 NC(=O)c1ccccc1c2cnccc2Cl 271570a_100000041535_100009995489 [0,1,1,0,0,0|2,0,0]=4 1142 B17R2.3445 NC(=O)c1ccccc1c2cnccc2Cl 271570a_100000062317_100000162227 [0,1,1,0,0,0|2,0,0]=4 1143 B17R2.3445 NC(=O)c1ccccc1c2cnccc2F 271570a_100000041535_100009820683 [0,1,1,0,0,0|2,0,0]=4 1144 B17R2.3445 NC(=O)c1ccccc1c2cnccc2N 271570a_100000041535_100000047001 [0,1,1,0,0,0|2,0,0]=4 1145 B17R2.3445 NC(=O)c1ccccc1c2cnccc2N 271570a_200010248739_100000162227 [0,1,1,0,0,0|2,0,0]=4 1146 B17R2.3445 NC(=O)c1ccccc1c2ncccc2Br 271570a_100000041535_100000696092 [0,1,1,0,0,0|2,0,0]=4 1147 B17R2.3445 NC(=O)c1ccccc1c2ncccc2Cl 271570a_100000041535_100011356963 [0,1,1,0,0,0|2,0,0]=4 1148 B17R2.3445 NC(=O)c1ccccc1c2ncccc2Cl 271570a_100009857861_100000162227 [0,1,1,0,0,0|2,0,0]=4 1149 B17R2.3445 NC(=O)c1ccccc1c2ncccc2F 271570a_100000041535_100000685392 [0,1,1,0,0,0|2,0,0]=4 1150 B17R2.3445 NC(=O)c1ccccc1c2ncccc2N 271570a_100000041535_100000688686 [0,1,1,0,0,0|2,0,0]=4 1151 B17R2.3445 NC(=O)c1ccccc1c2ncccc2O 271570a_100000041535_100000034122 [0,1,1,0,0,0|2,0,0]=4 1152 B17R2.3445 NC(=O)c1cccnc1c2ccccc2Cl 271570a_100011934419_100000162199 [0,1,1,0,0,0|2,0,0]=4 1153 B17R2.3445 NC(=O)c1cccnc1c2ccccc2F 271570a_100000761933_100000162199 [0,1,1,0,0,0|2,0,0]=4 1154 B17R2.3445 NC(=O)c1cccnc1c2ccccc2I 271570a_100000069755_100000162199 [0,1,1,0,0,0|2,0,0]=4 1155 B17R2.3445 NC(=O)c1cccnc1c2ccccc2N 271570a_100000034411_100000162199 [0,1,1,0,0,0|2,0,0]=4 1156 B17R2.3445 NC(=O)c1cccnc1c2ccccc2O 271570a_100000035170_100000162199 [0,1,1,0,0,0|2,0,0]=4 1157 B17R2.3445 NC(=O)c1ccncc1c2ccccc2Cl 271570a_100011934419_100010205435 [0,1,1,0,0,0|2,0,0]=4 1158 B17R2.3445 NC(=O)c1ccncc1c2ccccc2F 271570a_100000761933_100010205435 [0,1,1,0,0,0|2,0,0]=4 1159 B17R2.3445 NC(=O)c1ccncc1c2ccccc2I 271570a_100000069755_100010205435 [0,1,1,0,0,0|2,0,0]=4 1160 B17R2.3445 NC(=O)c1ccncc1c2ccccc2N 271570a_100000034411_100010205435 [0,1,1,0,0,0|2,0,0]=4 1161 B17R2.3445 NC(=O)c1ccncc1c2ccccc2O 271570a_100000035170_100010205435 [0,1,1,0,0,0|2,0,0]=4 1162 B17R2.3445 NC(=O)c1cnccc1c2ccccc2Cl 271570a_100011934419_100000697804 [0,1,1,0,0,0|2,0,0]=4 1163 B17R2.3445 NC(=O)c1cnccc1c2ccccc2F 271570a_100000761933_100000697804 [0,1,1,0,0,0|2,0,0]=4 1164 B17R2.3445 NC(=O)c1cnccc1c2ccccc2I 271570a_100000069755_100000697804 [0,1,1,0,0,0|2,0,0]=4 1165 B17R2.3445 NC(=O)c1cnccc1c2ccccc2N 271570a_100000034411_100000697804 [0,1,1,0,0,0|2,0,0]=4 1166 B17R2.3445 NC(=O)c1cnccc1c2ccccc2O 271570a_100000035170_100000697804 [0,1,1,0,0,0|2,0,0]=4 1167 B17R2.3445 NC(=O)c1ncccc1c2ccccc2Cl 271570a_100011934419_200012359670 [0,1,1,0,0,0|2,0,0]=4 1168 B17R2.3445 NC(=O)c1ncccc1c2ccccc2F 271570a_100000761933_200012359670 [0,1,1,0,0,0|2,0,0]=4 1169 B17R2.3445 NC(=O)c1ncccc1c2ccccc2I 271570a_100000069755_200012359670 [0,1,1,0,0,0|2,0,0]=4 1170 B17R2.3445 NC(=O)c1ncccc1c2ccccc2N 271570a_100000034411_200012359670 [0,1,1,0,0,0|2,0,0]=4 1171 B17R2.3445 NC(=O)c1ncccc1c2ccccc2O 271570a_100000035170_200012359670 [0,1,1,0,0,0|2,0,0]=4 1172 B17R2.3445 [13CH3]C(=O)c1ccccc1c2ccccc2Cl 1458a_200011217321_200025704644 [0,1,1,0,0,0|1,0,1]=4 1173 B17R2.3445 [13CH3]C(=O)c1ccccc1c2ccccc2F 1458a_100011689210_200025704644 [0,1,1,0,0,0|1,0,1]=4 1174 B17R2.3445 [13CH3]C(=O)c1ccccc1c2ccccc2O 1458a_200009992749_200025704644 [0,1,1,0,0,0|1,0,1]=4 1175 B17R2.3479 C=C(C)c1ccc(cc1c2ccccc2)N 271570a_100000694244_200010239565 [0,1,1,0,0,0|1,0,0]=3 1176 B17R2.3479 CC(=O)c1ccc(cc1c2ccccc2)C 1458a_200012354240_200000210301 [0,1,1,0,0,0|1,0,1]=4 1177 B17R2.3479 CC(=O)c1ccc(cc1c2ccccc2)C 271570a_100011218836_100012353930 [0,1,1,0,0,0|1,0,1]=4 1178 B17R2.3479 CC(=O)c1ccc(cc1c2ccccc2)F 271570a_100011218836_100000686192 [0,1,1,0,0,0|1,0,1]=4 1179 B17R2.3479 CC(=O)c1ccc(cc1c2ccccc2)O 271570a_100011218836_100012340537 [0,1,1,0,0,0|1,0,1]=4 1180 B17R2.3479 C[C@@H](N)c1ccc(cc1c2ccccc2)F 271570a_100011218836_100025704064 [0,1,1,0,0,0|0,0,2]=4 1181 B17R2.3479 Cc1ccc(c(c1)c2ccccc2)C(=O)[13CH3] 1458a_200012354240_200025704644 [0,1,1,0,0,0|1,0,1]=4 1182 B17R2.3479 Cc1ccc(c(n1)c2ccccc2)C(=O)N 271570a_100011218836_100000041523 [0,1,1,0,0,0|2,0,0]=4 1183 B17R2.3479 NC(=O)c1ccc(cc1c2ccccc2)Br 271570a_100011218836_100009815748 [0,1,1,0,0,0|1,0,0]=3 1184 B17R2.3479 NC(=O)c1ccc(cc1c2ccccc2)Cl 271570a_200000106908_100000210277 [0,1,1,0,0,0|1,0,0]=3 1185 B17R2.3479 NC(=O)c1ccc(cc1c2ccccc2)F 271570a_100011218836_100000206404 [0,1,1,0,0,0|1,0,0]=3 1186 B17R2.3479 NC(=O)c1ccc(cc1c2ccccn2)Br 271570a_100011264011_100009815748 [0,1,1,0,0,0|2,0,0]=4 1187 B17R2.3479 NC(=O)c1ccc(cc1c2ccccn2)Cl 271570a_200000106908_100011216584 [0,1,1,0,0,0|2,0,0]=4 1188 B17R2.3479 NC(=O)c1ccc(cc1c2ccccn2)F 271570a_100011264011_100000206404 [0,1,1,0,0,0|2,0,0]=4 1189 B17R2.3479 NC(=O)c1ccc(cc1c2cccnc2)Br 271570a_100000757648_100009815748 [0,1,1,0,0,0|2,0,0]=4 1190 B17R2.3479 NC(=O)c1ccc(cc1c2cccnc2)Cl 271570a_200000106908_100000752921 [0,1,1,0,0,0|2,0,0]=4 1191 B17R2.3479 NC(=O)c1ccc(cc1c2cccnc2)F 271570a_100000757648_100000206404 [0,1,1,0,0,0|2,0,0]=4 1192 B17R2.3479 NC(=O)c1ccc(cc1c2ccncc2)Br 271570a_100000752145_100009815748 [0,1,1,0,0,0|2,0,0]=4 1193 B17R2.3479 NC(=O)c1ccc(cc1c2ccncc2)Cl 271570a_200000106908_100000035832 [0,1,1,0,0,0|2,0,0]=4 1194 B17R2.3479 NC(=O)c1ccc(cc1c2ccncc2)F 271570a_100000752145_100000206404 [0,1,1,0,0,0|2,0,0]=4 1195 B17R2.5291 CC(=O)c1c(cccc1c2ccccc2)F 271570a_100011218836_100012351873 [0,1,1,0,0,0|1,0,1]=4 1196 B17R2.5291 CC(=O)c1c(cccc1c2ccccc2)O 271570a_100011218836_100010174959 [0,1,1,0,0,0|1,0,1]=4 1197 B17R2.5291 NC(=O)c1c(cccc1c2ccccc2)Cl 271570a_100011218836_100010147686 [0,1,1,0,0,0|1,0,0]=3 1198 B17R2.5291 NC(=O)c1c(cccc1c2ccccc2)F 271570a_100011218836_100011219063 [0,1,1,0,0,0|1,0,0]=3 1199 B17R2.5291 NC(=O)c1c(cccc1c2ccccn2)Cl 271570a_100011264011_100010147686 [0,1,1,0,0,0|2,0,0]=4 1200 B17R2.5291 NC(=O)c1c(cccc1c2ccccn2)F 271570a_100011264011_100011219063 [0,1,1,0,0,0|2,0,0]=4 1201 B17R2.5291 NC(=O)c1c(cccc1c2cccnc2)Cl 271570a_100000757648_100010147686 [0,1,1,0,0,0|2,0,0]=4 1202 B17R2.5291 NC(=O)c1c(cccc1c2cccnc2)F 271570a_100000757648_100011219063 [0,1,1,0,0,0|2,0,0]=4 1203 B17R2.5291 NC(=O)c1c(cccc1c2ccncc2)Cl 271570a_100000752145_100010147686 [0,1,1,0,0,0|2,0,0]=4 1204 B17R2.5291 NC(=O)c1c(cccc1c2ccncc2)F 271570a_100000752145_100011219063 [0,1,1,0,0,0|2,0,0]=4 1205 B17R2.5291 NC(=O)c1c(cncc1c2ccccc2)F 271570a_100011218836_100010271514 [0,1,1,0,0,0|2,0,0]=4 1206 B17R2.5306 CC(=O)c1cccc(c1c2ccccc2)F 271570a_100011218836_100012362612 [0,1,1,0,0,0|1,0,1]=4 1207 B17R2.5306 Cc1cccc(c1c2ccccc2)C(=O)N 271570a_100011218836_200011409216 [0,1,1,0,0,0|1,0,0]=3 1208 B17R2.5306 Cc1cccc(c1c2ccccn2)C(=O)N 271570a_100011264011_200011409216 [0,1,1,0,0,0|2,0,0]=4 1209 B17R2.5306 Cc1cccc(c1c2cccnc2)C(=O)N 271570a_100000757648_200011409216 [0,1,1,0,0,0|2,0,0]=4 1210 B17R2.5306 Cc1cccc(c1c2ccncc2)C(=O)N 271570a_100000752145_200011409216 [0,1,1,0,0,0|2,0,0]=4 1211 B17R2.5306 NC(=O)c1cccc(c1c2ccccc2)F 271570a_100011218836_200012351544 [0,1,1,0,0,0|1,0,0]=3 1212 B17R2.5306 NC(=O)c1cccc(c1c2ccccn2)F 271570a_100011264011_200012351544 [0,1,1,0,0,0|2,0,0]=4 1213 B17R2.5306 NC(=O)c1cccc(c1c2cccnc2)F 271570a_100000757648_200012351544 [0,1,1,0,0,0|2,0,0]=4 1214 B17R2.5306 NC(=O)c1cccc(c1c2ccncc2)F 271570a_100000752145_200012351544 [0,1,1,0,0,0|2,0,0]=4 1215 B17R2.5366 CC(=O)c1cc(ccc1c2ccccc2)Br 271570a_100011218836_100012349576 [0,1,1,0,0,0|1,0,1]=4 1216 B17R2.5366 CC(=O)c1cc(ccc1c2ccccc2)C 271570a_100011218836_100012361225 [0,1,1,0,0,0|1,0,1]=4 1217 B17R2.5366 CC(=O)c1cc(ccc1c2ccccc2)F 1458a_100000741215_200000210301 [0,1,1,0,0,0|1,0,1]=4 1218 B17R2.5366 CC(=O)c1cc(ccc1c2ccccc2)F 271570a_100011218836_100012353695 [0,1,1,0,0,0|1,0,1]=4 1219 B17R2.5366 CC(=O)c1cc(ccc1c2ccccc2)N 271570a_100011218836_100012349454 [0,1,1,0,0,0|1,0,1]=4 1220 B17R2.5366 CC(N)c1cc(ccc1c2ccccc2)F 271570a_100011218836_100012343209 [0,1,1,0,0,0|0,0,2]=4 1221 B17R2.5366 Cc1ccc(c(c1)C(=O)N)c2ccccc2 271570a_100011218836_200012349609 [0,1,1,0,0,0|1,0,0]=3 1222 B17R2.5366 Cc1ccc(c(c1)C(=O)N)c2ccccn2 271570a_100011264011_200012349609 [0,1,1,0,0,0|2,0,0]=4 1223 B17R2.5366 Cc1ccc(c(c1)C(=O)N)c2cccnc2 271570a_100000757648_200012349609 [0,1,1,0,0,0|2,0,0]=4 1224 B17R2.5366 Cc1ccc(c(c1)C(=O)N)c2ccncc2 271570a_100000752145_200012349609 [0,1,1,0,0,0|2,0,0]=4 1225 B17R2.5366 NC(=O)c1cc(ccc1c2ccccc2)Br 271570a_100011218836_200000162314 [0,1,1,0,0,0|1,0,0]=3 1226 B17R2.5366 NC(=O)c1cc(ccc1c2ccccc2)F 271570a_100011218836_100000206434 [0,1,1,0,0,0|1,0,0]=3 1227 B17R2.5366 NC(=O)c1cc(ccc1c2ccccc2)N 271570a_100011218836_100015186447 [0,1,1,0,0,0|1,0,0]=3 1228 B17R2.5366 NC(=O)c1cc(ccc1c2ccccn2)Br 271570a_100011264011_200000162314 [0,1,1,0,0,0|2,0,0]=4 1229 B17R2.5366 NC(=O)c1cc(ccc1c2ccccn2)F 271570a_100011264011_100000206434 [0,1,1,0,0,0|2,0,0]=4 1230 B17R2.5366 NC(=O)c1cc(ccc1c2ccccn2)N 271570a_100011264011_100015186447 [0,1,1,0,0,0|2,0,0]=4 1231 B17R2.5366 NC(=O)c1cc(ccc1c2cccnc2)Br 271570a_100000757648_200000162314 [0,1,1,0,0,0|2,0,0]=4 1232 B17R2.5366 NC(=O)c1cc(ccc1c2cccnc2)F 271570a_100000757648_100000206434 [0,1,1,0,0,0|2,0,0]=4 1233 B17R2.5366 NC(=O)c1cc(ccc1c2cccnc2)N 271570a_100000757648_100015186447 [0,1,1,0,0,0|2,0,0]=4 1234 B17R2.5366 NC(=O)c1cc(ccc1c2ccncc2)Br 271570a_100000752145_200000162314 [0,1,1,0,0,0|2,0,0]=4 1235 B17R2.5366 NC(=O)c1cc(ccc1c2ccncc2)F 271570a_100000752145_100000206434 [0,1,1,0,0,0|2,0,0]=4 1236 B17R2.5366 NC(=O)c1cc(ccc1c2ccncc2)N 271570a_100000752145_100015186447 [0,1,1,0,0,0|2,0,0]=4 1237 B17R2.5366 NC(=O)c1cc(cnc1c2ccccc2)F 271570a_100011218836_100012183597 [0,1,1,0,0,0|2,0,0]=4 1238 B17R2.5366 [13CH3]C(=O)c1cc(ccc1c2ccccc2)F 1458a_100000741215_200025704644 [0,1,1,0,0,0|1,0,1]=4 1239 B17R2.162 CNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_200000210301 [0,1,1,0,0,0|0,0,2]=4 1240 B17R2.162 [13CH3]NC(Cc1ccccc1)c2ccccc2 2230a_100025772854_200025704644 [0,1,1,0,0,0|0,0,2]=4 1241 B17R2.192 Cc1ccc(cc1)C(=O)Cc2ccccc2 1458a_100000188618_100015291786 [0,1,1,0,0,0|1,0,1]=4 1242 B17R2.192 Cc1ccc(cc1)C(=O)Nc2ccccc2 11a_100000106764_100000188618 [0,1,1,0,0,0|2,0,0]=4 1243 B17R2.192 Cc1ccc(cc1)C(=O)Nc2ccccc2 1626a_100000106764_100000188618 [0,1,1,0,0,0|2,0,0]=4 1244 B17R2.192 Cc1ccc(cc1)C(=O)Nc2ccccc2 22a_100000106764_100000188618 [0,1,1,0,0,0|2,0,0]=4 1245 B17R2.192 Cc1ccc(cc1)C(=O)Nc2ccccc2 527a_100000106764_100000188618 [0,1,1,0,0,0|2,0,0]=4 1246 B17R2.192 O=C(Cc1ccccc1)c2ccc(cc2)Br 1458a_100000185839_100015291786 [0,1,1,0,0,0|1,0,1]=4 1247 B17R2.192 O=C(Cc1ccccc1)c2ccc(cc2)Cl 1458a_100000210187_100015291786 [0,1,1,0,0,0|1,0,1]=4 1248 B17R2.192 O=C(Cc1ccccc1)c2ccc(cc2)F 1458a_100000187176_100015291786 [0,1,1,0,0,0|1,0,1]=4 1249 B17R2.192 O=C(Cc1ccccc1)c2ccc(cc2)I 1458a_100000187904_100015291786 [0,1,1,0,0,0|1,0,1]=4 1250 B17R2.192 O=C(Cc1ccccc1)c2ccc(cc2)O 1458a_100000212099_100015291786 [0,1,1,0,0,0|1,0,1]=4 1251 B17R2.192 O=C(Cc1ccccc1)c2ccc(cc2)O 271570a_203496583355_100000185893 [0,1,1,0,0,0|1,0,1]=4 1252 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)Br 11a_100000106764_100000185839 [0,1,1,0,0,0|2,0,0]=4 1253 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)Br 1626a_100000106764_100000185839 [0,1,1,0,0,0|2,0,0]=4 1254 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)Br 22a_100000106764_100000185839 [0,1,1,0,0,0|2,0,0]=4 1255 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)Br 527a_100000106764_100000185839 [0,1,1,0,0,0|2,0,0]=4 1256 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)Cl 11a_100000106764_100000210187 [0,1,1,0,0,0|2,0,0]=4 1257 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)Cl 1626a_100000106764_100000210187 [0,1,1,0,0,0|2,0,0]=4 1258 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)Cl 22a_100000106764_100000210187 [0,1,1,0,0,0|2,0,0]=4 1259 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)Cl 527a_100000106764_100000210187 [0,1,1,0,0,0|2,0,0]=4 1260 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)F 11a_100000106764_100000187176 [0,1,1,0,0,0|2,0,0]=4 1261 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)F 1626a_100000106764_100000187176 [0,1,1,0,0,0|2,0,0]=4 1262 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)F 22a_100000106764_100000187176 [0,1,1,0,0,0|2,0,0]=4 1263 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)F 527a_100000106764_100000187176 [0,1,1,0,0,0|2,0,0]=4 1264 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)I 11a_100000106764_100000187904 [0,1,1,0,0,0|2,0,0]=4 1265 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)I 1626a_100000106764_100000187904 [0,1,1,0,0,0|2,0,0]=4 1266 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)I 22a_100000106764_100000187904 [0,1,1,0,0,0|2,0,0]=4 1267 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)I 527a_100000106764_100000187904 [0,1,1,0,0,0|2,0,0]=4 1268 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)O 22a_100000106764_100000212099 [0,1,1,0,0,0|2,0,0]=4 1269 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)O 271570a_203496583355_200000153473 [0,1,1,0,0,0|2,0,0]=4 1270 B17R2.192 O=C(Nc1ccccc1)c2ccc(cc2)O 527a_100000106764_100000212099 [0,1,1,0,0,0|2,0,0]=4 1271 B17R2.192 O=C(Oc1ccccc1)c2ccc(cc2)O 271570a_203496583355_100029575162 [0,1,1,0,0,0|2,0,0]=4 1272 B17R2.209 Cc1ccc(cc1)CC(=O)c2ccccc2 1458a_100000185807_100000210814 [0,1,1,0,0,0|1,0,1]=4 1273 B17R2.209 Cc1ccc(cc1)NC(=O)c2ccccc2 11a_100000124888_100000185807 [0,1,1,0,0,0|2,0,0]=4 1274 B17R2.209 Cc1ccc(cc1)NC(=O)c2ccccc2 1626a_100000124888_100000185807 [0,1,1,0,0,0|2,0,0]=4 1275 B17R2.209 Cc1ccc(cc1)NC(=O)c2ccccc2 22a_100000124888_100000185807 [0,1,1,0,0,0|2,0,0]=4 1276 B17R2.209 Cc1ccc(cc1)NC(=O)c2ccccc2 527a_100000124888_100000185807 [0,1,1,0,0,0|2,0,0]=4 1277 B17R2.209 O=C(Cc1ccc(cc1)Br)c2ccccc2 1458a_100000185807_100000189115 [0,1,1,0,0,0|1,0,1]=4 1278 B17R2.209 O=C(Cc1ccc(cc1)Cl)c2ccccc2 1458a_100000185807_100000694040 [0,1,1,0,0,0|1,0,1]=4 1279 B17R2.209 O=C(Cc1ccc(cc1)F)c2ccccc2 1458a_100000185807_100000198546 [0,1,1,0,0,0|1,0,1]=4 1280 B17R2.209 O=C(Cc1ccc(cc1)I)c2ccccc2 1458a_100000185807_100000189116 [0,1,1,0,0,0|1,0,1]=4 1281 B17R2.209 O=C(Cc1ccc(cc1)O)c2ccccc2 271570a_203496583355_100011267665 [0,1,1,0,0,0|1,0,1]=4 1282 B17R2.209 O=C(Nc1ccc(cc1)Br)c2ccccc2 11a_100000210018_100000185807 [0,1,1,0,0,0|2,0,0]=4 1283 B17R2.209 O=C(Nc1ccc(cc1)Br)c2ccccc2 1626a_100000210018_100000185807 [0,1,1,0,0,0|2,0,0]=4 1284 B17R2.209 O=C(Nc1ccc(cc1)Br)c2ccccc2 22a_100000210018_100000185807 [0,1,1,0,0,0|2,0,0]=4 1285 B17R2.209 O=C(Nc1ccc(cc1)Br)c2ccccc2 527a_100000210018_100000185807 [0,1,1,0,0,0|2,0,0]=4 1286 B17R2.209 O=C(Nc1ccc(cc1)Cl)c2ccccc2 11a_100000210052_100000185807 [0,1,1,0,0,0|2,0,0]=4 1287 B17R2.209 O=C(Nc1ccc(cc1)Cl)c2ccccc2 1626a_100000210052_100000185807 [0,1,1,0,0,0|2,0,0]=4 1288 B17R2.209 O=C(Nc1ccc(cc1)Cl)c2ccccc2 22a_100000210052_100000185807 [0,1,1,0,0,0|2,0,0]=4 1289 B17R2.209 O=C(Nc1ccc(cc1)Cl)c2ccccc2 527a_100000210052_100000185807 [0,1,1,0,0,0|2,0,0]=4 1290 B17R2.209 O=C(Nc1ccc(cc1)F)c2ccccc2 11a_100000185862_100000185807 [0,1,1,0,0,0|2,0,0]=4 1291 B17R2.209 O=C(Nc1ccc(cc1)F)c2ccccc2 1626a_100000185862_100000185807 [0,1,1,0,0,0|2,0,0]=4 1292 B17R2.209 O=C(Nc1ccc(cc1)F)c2ccccc2 22a_100000185862_100000185807 [0,1,1,0,0,0|2,0,0]=4 1293 B17R2.209 O=C(Nc1ccc(cc1)F)c2ccccc2 527a_100000185862_100000185807 [0,1,1,0,0,0|2,0,0]=4 1294 B17R2.209 O=C(Nc1ccc(cc1)I)c2ccccc2 11a_100000185761_100000185807 [0,1,1,0,0,0|2,0,0]=4 1295 B17R2.209 O=C(Nc1ccc(cc1)I)c2ccccc2 1626a_100000185761_100000185807 [0,1,1,0,0,0|2,0,0]=4 1296 B17R2.209 O=C(Nc1ccc(cc1)I)c2ccccc2 22a_100000185761_100000185807 [0,1,1,0,0,0|2,0,0]=4 1297 B17R2.209 O=C(Nc1ccc(cc1)I)c2ccccc2 527a_100000185761_100000185807 [0,1,1,0,0,0|2,0,0]=4 1298 B17R2.209 O=C(Nc1ccc(cc1)O)c2ccccc2 22a_100000185829_100000185807 [0,1,1,0,0,0|2,0,0]=4 1299 B17R2.209 O=C(Nc1ccc(cc1)O)c2ccccc2 271570a_203496583355_100000155230 [0,1,1,0,0,0|2,0,0]=4 1300 B17R2.3417 Cc1ccccc1C(=O)Cc2ccccc2 1458a_100000212026_100015291786 [0,1,1,0,0,0|1,0,1]=4 1301 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 11a_100000106764_100000212026 [0,1,1,0,0,0|2,0,0]=4 1302 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100000212026 [0,1,1,0,0,0|2,0,0]=4 1303 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100000212026 [0,1,1,0,0,0|2,0,0]=4 1304 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 527a_100000106764_100000212026 [0,1,1,0,0,0|2,0,0]=4 1305 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2Br 1458a_100000188424_100015291786 [0,1,1,0,0,0|1,0,1]=4 1306 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2Cl 1458a_100000185844_100015291786 [0,1,1,0,0,0|1,0,1]=4 1307 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2F 1458a_100000188656_100015291786 [0,1,1,0,0,0|1,0,1]=4 1308 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2I 1458a_100000187884_100015291786 [0,1,1,0,0,0|1,0,1]=4 1309 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2O 1458a_100015234032_100015291786 [0,1,1,0,0,0|1,0,1]=4 1310 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2[O-] 1458a_100009911694_100015291786 [0,1,1,0,0,0|1,0,1]=4 1311 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br 11a_100000106764_100000188424 [0,1,1,0,0,0|2,0,0]=4 1312 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br 1626a_100000106764_100000188424 [0,1,1,0,0,0|2,0,0]=4 1313 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br 22a_100000106764_100000188424 [0,1,1,0,0,0|2,0,0]=4 1314 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br 527a_100000106764_100000188424 [0,1,1,0,0,0|2,0,0]=4 1315 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl 11a_100000106764_100000185844 [0,1,1,0,0,0|2,0,0]=4 1316 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl 1626a_100000106764_100000185844 [0,1,1,0,0,0|2,0,0]=4 1317 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl 22a_100000106764_100000185844 [0,1,1,0,0,0|2,0,0]=4 1318 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl 527a_100000106764_100000185844 [0,1,1,0,0,0|2,0,0]=4 1319 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F 11a_100000106764_100000188656 [0,1,1,0,0,0|2,0,0]=4 1320 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F 1626a_100000106764_100000188656 [0,1,1,0,0,0|2,0,0]=4 1321 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F 22a_100000106764_100000188656 [0,1,1,0,0,0|2,0,0]=4 1322 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F 527a_100000106764_100000188656 [0,1,1,0,0,0|2,0,0]=4 1323 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I 11a_100000106764_100000187884 [0,1,1,0,0,0|2,0,0]=4 1324 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I 1626a_100000106764_100000187884 [0,1,1,0,0,0|2,0,0]=4 1325 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I 22a_100000106764_100000187884 [0,1,1,0,0,0|2,0,0]=4 1326 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I 527a_100000106764_100000187884 [0,1,1,0,0,0|2,0,0]=4 1327 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2O 22a_100000106764_100015234032 [0,1,1,0,0,0|2,0,0]=4 1328 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2[O-] 1626a_100000106764_100009911694 [0,1,1,0,0,0|2,0,0]=4 1329 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2[O-] 22a_100000106764_100009911694 [0,1,1,0,0,0|2,0,0]=4 1330 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2[O-] 527a_100000106764_100009911694 [0,1,1,0,0,0|2,0,0]=4 1331 B17R2.3426 Cc1ccccc1CC(=O)c2ccccc2 1458a_100000185807_100000211839 [0,1,1,0,0,0|1,0,1]=4 1332 B17R2.3426 Cc1ccccc1NC(=O)c2ccccc2 11a_100015192222_100000185807 [0,1,1,0,0,0|2,0,0]=4 1333 B17R2.3426 Cc1ccccc1NC(=O)c2ccccc2 1626a_100015192222_100000185807 [0,1,1,0,0,0|2,0,0]=4 1334 B17R2.3426 Cc1ccccc1NC(=O)c2ccccc2 22a_100015192222_100000185807 [0,1,1,0,0,0|2,0,0]=4 1335 B17R2.3426 Cc1ccccc1NC(=O)c2ccccc2 527a_100015192222_100000185807 [0,1,1,0,0,0|2,0,0]=4 1336 B17R2.3426 O=C(Cc1ccccc1Br)c2ccccc2 1458a_100000185807_100000184730 [0,1,1,0,0,0|1,0,1]=4 1337 B17R2.3426 O=C(Cc1ccccc1Cl)c2ccccc2 1458a_100000185807_100000187162 [0,1,1,0,0,0|1,0,1]=4 1338 B17R2.3426 O=C(Cc1ccccc1F)c2ccccc2 1458a_100000185807_100000187165 [0,1,1,0,0,0|1,0,1]=4 1339 B17R2.3426 O=C(Cc1ccccc1I)c2ccccc2 1458a_100000185807_100011216222 [0,1,1,0,0,0|1,0,1]=4 1340 B17R2.3426 O=C(Nc1ccccc1Br)c2ccccc2 11a_100000210017_100000185807 [0,1,1,0,0,0|2,0,0]=4 1341 B17R2.3426 O=C(Nc1ccccc1Br)c2ccccc2 1626a_100000210017_100000185807 [0,1,1,0,0,0|2,0,0]=4 1342 B17R2.3426 O=C(Nc1ccccc1Cl)c2ccccc2 11a_100000185783_100000185807 [0,1,1,0,0,0|2,0,0]=4 1343 B17R2.3426 O=C(Nc1ccccc1Cl)c2ccccc2 1626a_100000185783_100000185807 [0,1,1,0,0,0|2,0,0]=4 1344 B17R2.3426 O=C(Nc1ccccc1Cl)c2ccccc2 22a_100000185783_100000185807 [0,1,1,0,0,0|2,0,0]=4 1345 B17R2.3426 O=C(Nc1ccccc1Cl)c2ccccc2 527a_100000185783_100000185807 [0,1,1,0,0,0|2,0,0]=4 1346 B17R2.3426 O=C(Nc1ccccc1F)c2ccccc2 11a_100000210422_100000185807 [0,1,1,0,0,0|2,0,0]=4 1347 B17R2.3426 O=C(Nc1ccccc1F)c2ccccc2 1626a_100000210422_100000185807 [0,1,1,0,0,0|2,0,0]=4 1348 B17R2.3426 O=C(Nc1ccccc1F)c2ccccc2 22a_100000210422_100000185807 [0,1,1,0,0,0|2,0,0]=4 1349 B17R2.3426 O=C(Nc1ccccc1F)c2ccccc2 527a_100000210422_100000185807 [0,1,1,0,0,0|2,0,0]=4 1350 B17R2.3426 O=C(Nc1ccccc1I)c2ccccc2 11a_100000210053_100000185807 [0,1,1,0,0,0|2,0,0]=4 1351 B17R2.3426 O=C(Nc1ccccc1I)c2ccccc2 1626a_100000210053_100000185807 [0,1,1,0,0,0|2,0,0]=4 1352 B17R2.3426 O=C(Nc1ccccc1O)c2ccccc2 22a_100000185747_100000185807 [0,1,1,0,0,0|2,0,0]=4 1353 B17R2.3426 O=C(Nc1ccccc1O)c2ccccc2 527a_100000185747_100000185807 [0,1,1,0,0,0|2,0,0]=4 1354 B17R2.5273 Cc1cccc(c1)C(=O)Cc2ccccc2 1458a_100000189346_100015291786 [0,1,1,0,0,0|1,0,1]=4 1355 B17R2.5273 Cc1cccc(c1)C(=O)Nc2ccccc2 11a_100000106764_100000189346 [0,1,1,0,0,0|2,0,0]=4 1356 B17R2.5273 Cc1cccc(c1)C(=O)Nc2ccccc2 1626a_100000106764_100000189346 [0,1,1,0,0,0|2,0,0]=4 1357 B17R2.5273 Cc1cccc(c1)C(=O)Nc2ccccc2 22a_100000106764_100000189346 [0,1,1,0,0,0|2,0,0]=4 1358 B17R2.5273 Cc1cccc(c1)C(=O)Nc2ccccc2 527a_100000106764_100000189346 [0,1,1,0,0,0|2,0,0]=4 1359 B17R2.5273 O=C(Cc1ccccc1)c2cccc(c2)Br 1458a_100000210664_100015291786 [0,1,1,0,0,0|1,0,1]=4 1360 B17R2.5273 O=C(Cc1ccccc1)c2cccc(c2)Cl 1458a_100000210390_100015291786 [0,1,1,0,0,0|1,0,1]=4 1361 B17R2.5273 O=C(Cc1ccccc1)c2cccc(c2)F 1458a_100000210950_100015291786 [0,1,1,0,0,0|1,0,1]=4 1362 B17R2.5273 O=C(Cc1ccccc1)c2cccc(c2)I 1458a_100000184098_100015291786 [0,1,1,0,0,0|1,0,1]=4 1363 B17R2.5273 O=C(Cc1ccccc1)c2cccc(c2)O 1458a_100000183914_100015291786 [0,1,1,0,0,0|1,0,1]=4 1364 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)Br 11a_100000106764_100000210664 [0,1,1,0,0,0|2,0,0]=4 1365 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)Br 1626a_100000106764_100000210664 [0,1,1,0,0,0|2,0,0]=4 1366 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)Br 22a_100000106764_100000210664 [0,1,1,0,0,0|2,0,0]=4 1367 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)Br 527a_100000106764_100000210664 [0,1,1,0,0,0|2,0,0]=4 1368 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)Cl 11a_100000106764_100000210390 [0,1,1,0,0,0|2,0,0]=4 1369 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)Cl 1626a_100000106764_100000210390 [0,1,1,0,0,0|2,0,0]=4 1370 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)Cl 22a_100000106764_100000210390 [0,1,1,0,0,0|2,0,0]=4 1371 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)Cl 527a_100000106764_100000210390 [0,1,1,0,0,0|2,0,0]=4 1372 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)F 11a_100000106764_100000210950 [0,1,1,0,0,0|2,0,0]=4 1373 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)F 1626a_100000106764_100000210950 [0,1,1,0,0,0|2,0,0]=4 1374 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)F 22a_100000106764_100000210950 [0,1,1,0,0,0|2,0,0]=4 1375 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)F 527a_100000106764_100000210950 [0,1,1,0,0,0|2,0,0]=4 1376 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)I 11a_100000106764_100000184098 [0,1,1,0,0,0|2,0,0]=4 1377 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)I 1626a_100000106764_100000184098 [0,1,1,0,0,0|2,0,0]=4 1378 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)I 22a_100000106764_100000184098 [0,1,1,0,0,0|2,0,0]=4 1379 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)I 527a_100000106764_100000184098 [0,1,1,0,0,0|2,0,0]=4 1380 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)O 22a_100000106764_100000183914 [0,1,1,0,0,0|2,0,0]=4 1381 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)O 271570a_203496583355_200000153492 [0,1,1,0,0,0|2,0,0]=4 1382 B17R2.5273 O=C(Nc1ccccc1)c2cccc(c2)O 527a_100000106764_100000183914 [0,1,1,0,0,0|2,0,0]=4 1383 B17R2.5293 C/C(=C\c1cc(ccn1)Cl)/c2ccccc2 271570a_106741698533_100000210277 [0,1,1,0,0,0|2,0,0]=4 1384 B17R2.5293 Cc1cccc(c1)CC(=O)c2ccccc2 1458a_100000185807_100000211840 [0,1,1,0,0,0|1,0,1]=4 1385 B17R2.5293 Cc1cccc(c1)NC(=O)c2ccccc2 11a_100000188690_100000185807 [0,1,1,0,0,0|2,0,0]=4 1386 B17R2.5293 Cc1cccc(c1)NC(=O)c2ccccc2 1626a_100000188690_100000185807 [0,1,1,0,0,0|2,0,0]=4 1387 B17R2.5293 Cc1cccc(c1)NC(=O)c2ccccc2 22a_100000188690_100000185807 [0,1,1,0,0,0|2,0,0]=4 1388 B17R2.5293 Cc1cccc(c1)NC(=O)c2ccccc2 527a_100000188690_100000185807 [0,1,1,0,0,0|2,0,0]=4 1389 B17R2.5293 O=C(Cc1cccc(c1)Br)c2ccccc2 1458a_100000185807_100000211773 [0,1,1,0,0,0|1,0,1]=4 1390 B17R2.5293 O=C(Cc1cccc(c1)Cl)c2ccccc2 1458a_100000185807_100000181238 [0,1,1,0,0,0|1,0,1]=4 1391 B17R2.5293 O=C(Cc1cccc(c1)F)c2ccccc2 1458a_100000185807_100000230114 [0,1,1,0,0,0|1,0,1]=4 1392 B17R2.5293 O=C(Cc1cccc(c1)I)c2ccccc2 1458a_100000185807_100011218688 [0,1,1,0,0,0|1,0,1]=4 1393 B17R2.5293 O=C(Cc1cccc(c1)O)c2ccccc2 1458a_100000185807_100011660834 [0,1,1,0,0,0|1,0,1]=4 1394 B17R2.5293 O=C(Nc1cccc(c1)Br)c2ccccc2 11a_100000210019_100000185807 [0,1,1,0,0,0|2,0,0]=4 1395 B17R2.5293 O=C(Nc1cccc(c1)Br)c2ccccc2 1626a_100000210019_100000185807 [0,1,1,0,0,0|2,0,0]=4 1396 B17R2.5293 O=C(Nc1cccc(c1)Br)c2ccccc2 22a_100000210019_100000185807 [0,1,1,0,0,0|2,0,0]=4 1397 B17R2.5293 O=C(Nc1cccc(c1)Br)c2ccccc2 527a_100000210019_100000185807 [0,1,1,0,0,0|2,0,0]=4 1398 B17R2.5293 O=C(Nc1cccc(c1)Cl)c2ccccc2 11a_100000185859_100000185807 [0,1,1,0,0,0|2,0,0]=4 1399 B17R2.5293 O=C(Nc1cccc(c1)Cl)c2ccccc2 1626a_100000185859_100000185807 [0,1,1,0,0,0|2,0,0]=4 1400 B17R2.5293 O=C(Nc1cccc(c1)Cl)c2ccccc2 22a_100000185859_100000185807 [0,1,1,0,0,0|2,0,0]=4 1401 B17R2.5293 O=C(Nc1cccc(c1)F)c2ccccc2 11a_100000210047_100000185807 [0,1,1,0,0,0|2,0,0]=4 1402 B17R2.5293 O=C(Nc1cccc(c1)F)c2ccccc2 1626a_100000210047_100000185807 [0,1,1,0,0,0|2,0,0]=4 1403 B17R2.5293 O=C(Nc1cccc(c1)F)c2ccccc2 22a_100000210047_100000185807 [0,1,1,0,0,0|2,0,0]=4 1404 B17R2.5293 O=C(Nc1cccc(c1)F)c2ccccc2 527a_100000210047_100000185807 [0,1,1,0,0,0|2,0,0]=4 1405 B17R2.5293 O=C(Nc1cccc(c1)I)c2ccccc2 11a_100000211102_100000185807 [0,1,1,0,0,0|2,0,0]=4 1406 B17R2.5293 O=C(Nc1cccc(c1)I)c2ccccc2 1626a_100000211102_100000185807 [0,1,1,0,0,0|2,0,0]=4 1407 B17R2.5293 O=C(Nc1cccc(c1)I)c2ccccc2 22a_100000211102_100000185807 [0,1,1,0,0,0|2,0,0]=4 1408 B17R2.5293 O=C(Nc1cccc(c1)I)c2ccccc2 527a_100000211102_100000185807 [0,1,1,0,0,0|2,0,0]=4 1409 B17R2.5293 O=C(Nc1cccc(c1)O)c2ccccc2 1626a_100000210217_100000185807 [0,1,1,0,0,0|2,0,0]=4 1410 B17R2.5293 O=C(Nc1cccc(c1)O)c2ccccc2 22a_100000210217_100000185807 [0,1,1,0,0,0|2,0,0]=4 1411 B17R2.5293 O=C(Nc1cccc(c1)O)c2ccccc2 271570a_203496583355_100000153631 [0,1,1,0,0,0|2,0,0]=4 1412 B17R2.5293 O=C(Nc1cccc(c1)O)c2ccccc2 527a_100000210217_100000185807 [0,1,1,0,0,0|2,0,0]=4 1413 B17R2.10205 CC(C(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100000230085 [0,1,1,0,0,0|1,0,1]=4 1414 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 11a_100000210012_100000185807 [0,1,1,0,0,0|2,0,0]=4 1415 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 1626a_100000210012_100000185807 [0,1,1,0,0,0|2,0,0]=4 1416 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 22a_100000210012_100000185807 [0,1,1,0,0,0|2,0,0]=4 1417 B17R2.86 C=CCc1ccccc1c2cccc(c2)Br 271570a_200010742005_100000691529 [0,1,1,0,0,0|1,0,1]=4 1418 B17R2.86 C=CCc1ccccc1c2cccc(c2)C 271570a_100000749446_100009828059 [0,1,1,0,0,0|1,0,1]=4 1419 B17R2.86 C=CCc1ccccc1c2cccc(c2)C 271570a_200010742005_100011215228 [0,1,1,0,0,0|1,0,1]=4 1420 B17R2.86 C=CCc1ccccc1c2cccc(c2)Cl 271570a_100011214927_100009828059 [0,1,1,0,0,0|1,0,1]=4 1421 B17R2.86 C=CCc1ccccc1c2cccc(c2)Cl 271570a_200010742005_100000699651 [0,1,1,0,0,0|1,0,1]=4 1422 B17R2.86 C=CCc1ccccc1c2cccc(c2)F 271570a_100012349223_100009828059 [0,1,1,0,0,0|1,0,1]=4 1423 B17R2.86 C=CCc1ccccc1c2cccc(c2)F 271570a_200010742005_100000685547 [0,1,1,0,0,0|1,0,1]=4 1424 B17R2.86 C=CCc1ccccc1c2cccc(c2)I 271570a_100000043368_100009828059 [0,1,1,0,0,0|1,0,1]=4 1425 B17R2.86 C=CCc1ccccc1c2cccc(c2)N 271570a_100000699968_100009828059 [0,1,1,0,0,0|1,0,1]=4 1426 B17R2.86 C=CCc1ccccc1c2cccc(c2)N 271570a_200010742005_100000210019 [0,1,1,0,0,0|1,0,1]=4 1427 B17R2.86 C=CCc1ccccc1c2cccc(c2)O 271570a_100000693801_100009828059 [0,1,1,0,0,0|1,0,1]=4 1428 B17R2.86 C=CCc1ccccc1c2cccc(c2)O 271570a_200010742005_100000211634 [0,1,1,0,0,0|1,0,1]=4 1429 B17R2.86 C=CCc1ccccc1c2cccc(c2)[S] 271570a_200010742005_114929384022 [0,1,1,0,0,0|1,0,1]=4 1430 B17R2.86 Cc1cccc(c1)c2ccccc2CCN 271570a_100000749446_100000747383 [0,1,1,0,0,0|0,0,2]=4 1431 B17R2.86 Cc1cccc(c1)c2ccccc2CNN 271570a_100000749446_200016993956 [0,1,1,0,0,0|1,0,1]=4 1432 B17R2.86 Cc1cccc(c1)c2ccccc2NC=O 271570a_200000040256_100011215228 [0,1,1,0,0,0|2,0,0]=4 1433 B17R2.86 NCCc1ccccc1c2cccc(c2)Cl 271570a_100011214927_100000747383 [0,1,1,0,0,0|0,0,2]=4 1434 B17R2.86 NCCc1ccccc1c2cccc(c2)F 271570a_100012349223_100000747383 [0,1,1,0,0,0|0,0,2]=4 1435 B17R2.86 NCCc1ccccc1c2cccc(c2)I 271570a_100000043368_100000747383 [0,1,1,0,0,0|0,0,2]=4 1436 B17R2.86 NCCc1ccccc1c2cccc(c2)N 271570a_100000699968_100000747383 [0,1,1,0,0,0|0,0,2]=4 1437 B17R2.86 NCCc1ccccc1c2cccc(c2)O 271570a_100000693801_100000747383 [0,1,1,0,0,0|0,0,2]=4 1438 B17R2.86 NNCc1ccccc1c2cccc(c2)Cl 271570a_100011214927_200016993956 [0,1,1,0,0,0|1,0,1]=4 1439 B17R2.86 NNCc1ccccc1c2cccc(c2)F 271570a_100012349223_200016993956 [0,1,1,0,0,0|1,0,1]=4 1440 B17R2.86 NNCc1ccccc1c2cccc(c2)I 271570a_100000043368_200016993956 [0,1,1,0,0,0|1,0,1]=4 1441 B17R2.86 NNCc1ccccc1c2cccc(c2)N 271570a_100000699968_200016993956 [0,1,1,0,0,0|1,0,1]=4 1442 B17R2.86 NNCc1ccccc1c2cccc(c2)O 271570a_100000693801_200016993956 [0,1,1,0,0,0|1,0,1]=4 1443 B17R2.86 Nc1cccc(c1)c2ccccc2NC=O 271570a_200000040256_100000210019 [0,1,1,0,0,0|2,0,0]=4 1444 B17R2.86 O=CNc1ccccc1c2cccc(c2)Br 271570a_200000040256_100000691529 [0,1,1,0,0,0|2,0,0]=4 1445 B17R2.86 O=CNc1ccccc1c2cccc(c2)Cl 271570a_200000040256_100000699651 [0,1,1,0,0,0|2,0,0]=4 1446 B17R2.86 O=CNc1ccccc1c2cccc(c2)F 271570a_200000040256_100000685547 [0,1,1,0,0,0|2,0,0]=4 1447 B17R2.86 O=CNc1ccccc1c2cccc(c2)O 271570a_200000040256_100000211634 [0,1,1,0,0,0|2,0,0]=4 1448 B17R2.86 O=CNc1ccccc1c2cccc(c2)[S] 271570a_200000040256_114929384022 [0,1,1,0,0,0|2,0,0]=4 1449 B17R2.157 C=CCc1ccccc1c2ccc(cc2)Br 271570a_100010235827_100009828059 [0,1,1,0,0,0|1,0,1]=4 1450 B17R2.157 C=CCc1ccccc1c2ccc(cc2)Br 271570a_200010742005_100000752885 [0,1,1,0,0,0|1,0,1]=4 1451 B17R2.157 C=CCc1ccccc1c2ccc(cc2)C 271570a_100000708704_100009828059 [0,1,1,0,0,0|1,0,1]=4 1452 B17R2.157 C=CCc1ccccc1c2ccc(cc2)C 271570a_200010742005_100000186775 [0,1,1,0,0,0|1,0,1]=4 1453 B17R2.157 C=CCc1ccccc1c2ccc(cc2)Cl 271570a_100011213355_100009828059 [0,1,1,0,0,0|1,0,1]=4 1454 B17R2.157 C=CCc1ccccc1c2ccc(cc2)Cl 271570a_200010742005_100000755918 [0,1,1,0,0,0|1,0,1]=4 1455 B17R2.157 C=CCc1ccccc1c2ccc(cc2)F 271570a_100011934326_100009828059 [0,1,1,0,0,0|1,0,1]=4 1456 B17R2.157 C=CCc1ccccc1c2ccc(cc2)F 271570a_200010742005_100000211213 [0,1,1,0,0,0|1,0,1]=4 1457 B17R2.157 C=CCc1ccccc1c2ccc(cc2)I 271570a_100000033156_100009828059 [0,1,1,0,0,0|1,0,1]=4 1458 B17R2.157 C=CCc1ccccc1c2ccc(cc2)N 271570a_100015188457_100009828059 [0,1,1,0,0,0|1,0,1]=4 1459 B17R2.157 C=CCc1ccccc1c2ccc(cc2)N 271570a_200010742005_100000185761 [0,1,1,0,0,0|1,0,1]=4 1460 B17R2.157 C=CCc1ccccc1c2ccc(cc2)O 271570a_100015205159_100009828059 [0,1,1,0,0,0|1,0,1]=4 1461 B17R2.157 C=CCc1ccccc1c2ccc(cc2)O 271570a_200010742005_100000185759 [0,1,1,0,0,0|1,0,1]=4 1462 B17R2.157 Cc1ccc(cc1)c2ccccc2CCN 271570a_100000708704_100000747383 [0,1,1,0,0,0|0,0,2]=4 1463 B17R2.157 Cc1ccc(cc1)c2ccccc2CNN 271570a_100000708704_200016993956 [0,1,1,0,0,0|1,0,1]=4 1464 B17R2.157 Cc1ccc(cc1)c2ccccc2NC=O 271570a_200000040256_100000186775 [0,1,1,0,0,0|2,0,0]=4 1465 B17R2.157 NCCc1ccccc1c2ccc(cc2)Br 271570a_100010235827_100000747383 [0,1,1,0,0,0|0,0,2]=4 1466 B17R2.157 NCCc1ccccc1c2ccc(cc2)Cl 271570a_100011213355_100000747383 [0,1,1,0,0,0|0,0,2]=4 1467 B17R2.157 NCCc1ccccc1c2ccc(cc2)F 271570a_100011934326_100000747383 [0,1,1,0,0,0|0,0,2]=4 1468 B17R2.157 NCCc1ccccc1c2ccc(cc2)I 271570a_100000033156_100000747383 [0,1,1,0,0,0|0,0,2]=4 1469 B17R2.157 NCCc1ccccc1c2ccc(cc2)N 271570a_100015188457_100000747383 [0,1,1,0,0,0|0,0,2]=4 1470 B17R2.157 NCCc1ccccc1c2ccc(cc2)O 271570a_100015205159_100000747383 [0,1,1,0,0,0|0,0,2]=4 1471 B17R2.157 NNCc1ccccc1c2ccc(cc2)Br 271570a_100010235827_200016993956 [0,1,1,0,0,0|1,0,1]=4 1472 B17R2.157 NNCc1ccccc1c2ccc(cc2)Cl 271570a_100011213355_200016993956 [0,1,1,0,0,0|1,0,1]=4 1473 B17R2.157 NNCc1ccccc1c2ccc(cc2)F 271570a_100011934326_200016993956 [0,1,1,0,0,0|1,0,1]=4 1474 B17R2.157 NNCc1ccccc1c2ccc(cc2)I 271570a_100000033156_200016993956 [0,1,1,0,0,0|1,0,1]=4 1475 B17R2.157 NNCc1ccccc1c2ccc(cc2)N 271570a_100015188457_200016993956 [0,1,1,0,0,0|1,0,1]=4 1476 B17R2.157 NNCc1ccccc1c2ccc(cc2)O 271570a_100015205159_200016993956 [0,1,1,0,0,0|1,0,1]=4 1477 B17R2.157 Nc1ccc(cc1)c2ccccc2NC=O 271570a_200000040256_100000185761 [0,1,1,0,0,0|2,0,0]=4 1478 B17R2.157 O=CNc1ccccc1c2ccc(cc2)Br 271570a_200000040256_100000752885 [0,1,1,0,0,0|2,0,0]=4 1479 B17R2.157 O=CNc1ccccc1c2ccc(cc2)Cl 271570a_200000040256_100000755918 [0,1,1,0,0,0|2,0,0]=4 1480 B17R2.157 O=CNc1ccccc1c2ccc(cc2)F 271570a_200000040256_100000211213 [0,1,1,0,0,0|2,0,0]=4 1481 B17R2.157 O=CNc1ccccc1c2ccc(cc2)O 271570a_200000040256_100000185759 [0,1,1,0,0,0|2,0,0]=4 1482 B17R2.242 C=CCNc1ccccc1c2ccccc2 34a_100000210918_100015514636 [0,1,1,0,0,0|1,0,1]=4 1483 B17R2.242 C=CCOc1ccccc1c2ccccc2 271570a_100011263033_100000210277 [0,1,1,0,0,0|1,0,1]=4 1484 B17R2.242 C=CCOc1ccccc1c2ccccc2 34a_100000210297_100015514636 [0,1,1,0,0,0|1,0,1]=4 1485 B17R2.242 C=CCOc1ccccc1c2ccccc2 7a_100000210297_100015514636 [0,1,1,0,0,0|1,0,1]=4 1486 B17R2.242 C=CCSc1ccccc1c2ccccc2 62a_100000033479_100000210623 [0,1,1,0,0,0|1,0,1]=4 1487 B17R2.242 C=CCSc1ccccc1c2ccccc2 62a_100000210623_100000033479 [0,1,1,0,0,0|1,0,1]=4 1488 B17R2.242 NCCOc1ccccc1c2ccccc2 271570a_100011218836_100000744007 [0,1,1,0,0,0|0,0,2]=4 1489 B17R2.242 O=CCCc1ccccc1c2ccccc2 271570a_100011218836_100011713448 [0,1,1,0,0,0|1,0,1]=4 1490 B17R2.242 O=CCNc1ccccc1c2ccccc2 34a_100000210918_200009817547 [0,1,1,0,0,0|1,0,1]=4 1491 B17R2.242 O=CCOc1ccccc1c2ccccc2 34a_100000210297_200009817547 [0,1,1,0,0,0|1,0,1]=4 1492 B17R2.242 O=CCOc1ccccc1c2ccccc2 7a_100000210297_200015260668 [0,1,1,0,0,0|1,0,1]=4 1493 B17R2.242 O=CCSc1ccccc1c2ccccc2 62a_100000033479_200015260668 [0,1,1,0,0,0|1,0,1]=4 1494 B17R2.242 O=CCSc1ccccc1c2ccccc2 62a_200015260668_100000033479 [0,1,1,0,0,0|1,0,1]=4 1495 B17R2.248 CC(=Cc1ccccc1c2ccccc2)C 271570a_100102525489_100000033479 [0,1,1,0,0,0|1,0,0]=3 1496 B17R2.248 CC(=Cc1ccccc1c2ccccn2)C 271570a_100102525489_100010202516 [0,1,1,0,0,0|2,0,0]=4 1497 B17R2.248 CC(=Cc1ccccc1c2ccncc2)C 271570a_100102525489_100010154595 [0,1,1,0,0,0|2,0,0]=4 1498 B17R2.248 CC(=Cc1cccnc1c2ccccc2)C 271570a_100102525489_100010138707 [0,1,1,0,0,0|2,0,0]=4 1499 B17R2.248 CC(=Cc1cnccc1c2ccccc2)C 271570a_100102525489_100009816686 [0,1,1,0,0,0|2,0,0]=4 1500 B17R2.248 CC(=O)Cc1ccccc1c2ccccc2 1458a_100000055146_200000210301 [0,1,1,0,0,0|1,0,1]=4 1501 B17R2.248 CC(=O)Cc1ccccc1c2ccccc2 1458a_100000070787_100009813379 [0,1,1,0,0,0|1,0,1]=4 1502 B17R2.248 CC(=O)Cc1ccccc1c2ccccc2 271570a_100011218836_100011350739 [0,1,1,0,0,0|1,0,1]=4 1503 B17R2.248 CC(=O)Nc1ccccc1c2ccccc2 11a_100000210918_100015343762 [0,1,1,0,0,0|2,0,0]=4 1504 B17R2.248 CC(=O)Nc1ccccc1c2ccccc2 1626a_100000210918_100015343762 [0,1,1,0,0,0|2,0,0]=4 1505 B17R2.248 CC(=O)Nc1ccccc1c2ccccc2 22a_100000210918_100000070787 [0,1,1,0,0,0|2,0,0]=4 1506 B17R2.248 CC(=O)Nc1ccccc1c2ccccc2 271570a_100000043321_100000210277 [0,1,1,0,0,0|2,0,0]=4 1507 B17R2.248 CC(=O)Nc1ccccc1c2ccccc2 271570a_100011218836_100000153524 [0,1,1,0,0,0|2,0,0]=4 1508 B17R2.248 CC(=O)Oc1ccccc1c2ccccc2 271570a_100011218836_100000051690 [0,1,1,0,0,0|2,0,0]=4 1509 B17R2.248 CC(=O)Oc1ccccc1c2ccccc2 271570a_200000040253_100000210277 [0,1,1,0,0,0|2,0,0]=4 1510 B17R2.248 NC(=O)Cc1ccccc1c2ccccc2 271570a_100011218836_200009814924 [0,1,1,0,0,0|0,0,1]=3 1511 B17R2.248 NC(=O)Cc1ccccc1c2ccccn2 271570a_100011264011_200009814924 [0,1,1,0,0,0|1,0,1]=4 1512 B17R2.248 NC(=O)Cc1ccccc1c2cccnc2 271570a_100000757648_200009814924 [0,1,1,0,0,0|1,0,1]=4 1513 B17R2.248 NC(=O)Cc1ccccc1c2ccncc2 271570a_100000752145_200009814924 [0,1,1,0,0,0|1,0,1]=4 1514 B17R2.248 NC(=O)Nc1ccccc1c2ccccc2 271570a_100011218836_100000742221 [0,1,1,0,0,0|1,0,0]=3 1515 B17R2.248 NC(=O)Nc1ccccc1c2ccccn2 271570a_100011264011_100000742221 [0,1,1,0,0,0|2,0,0]=4 1516 B17R2.248 NC(=O)Nc1ccccc1c2cccnc2 271570a_100000757648_100000742221 [0,1,1,0,0,0|2,0,0]=4 1517 B17R2.248 NC(=O)Nc1ccccc1c2ccncc2 271570a_100000752145_100000742221 [0,1,1,0,0,0|2,0,0]=4 1518 B17R2.248 O=C(O)Cc1ccccc1c2ccccc2 271570a_200010239615_100000210277 [0,1,1,0,0,0|1,0,1]=4 1519 B17R2.248 [13CH3]C(=O)Cc1ccccc1c2ccccc2 1458a_100000055146_200025704644 [0,1,1,0,0,0|1,0,1]=4 1520 B17R2.4286 C=CCc1ccccc1c2ccccc2Br 271570a_200010742005_100000695589 [0,1,1,0,0,0|1,0,1]=4 1521 B17R2.4286 C=CCc1ccccc1c2ccccc2C 271570a_100000747142_100009828059 [0,1,1,0,0,0|1,0,1]=4 1522 B17R2.4286 C=CCc1ccccc1c2ccccc2C 271570a_200010742005_100000210755 [0,1,1,0,0,0|1,0,1]=4 1523 B17R2.4286 C=CCc1ccccc1c2ccccc2Cl 271570a_100011934419_100009828059 [0,1,1,0,0,0|1,0,1]=4 1524 B17R2.4286 C=CCc1ccccc1c2ccccc2Cl 271570a_200010742005_100000764095 [0,1,1,0,0,0|1,0,1]=4 1525 B17R2.4286 C=CCc1ccccc1c2ccccc2F 271570a_100000761933_100009828059 [0,1,1,0,0,0|1,0,1]=4 1526 B17R2.4286 C=CCc1ccccc1c2ccccc2F 271570a_200010742005_100011215700 [0,1,1,0,0,0|1,0,1]=4 1527 B17R2.4286 C=CCc1ccccc1c2ccccc2I 271570a_100000069755_100009828059 [0,1,1,0,0,0|1,0,1]=4 1528 B17R2.4286 C=CCc1ccccc1c2ccccc2N 271570a_100000034411_100009828059 [0,1,1,0,0,0|1,0,1]=4 1529 B17R2.4286 C=CCc1ccccc1c2ccccc2N 271570a_200010742005_100000210017 [0,1,1,0,0,0|1,0,1]=4 1530 B17R2.4286 C=CCc1ccccc1c2ccccc2O 271570a_100000035170_100009828059 [0,1,1,0,0,0|1,0,1]=4 1531 B17R2.4286 C=CCc1ccccc1c2ccccc2O 271570a_200010742005_100000739446 [0,1,1,0,0,0|1,0,1]=4 1532 B17R2.4286 Cc1ccccc1c2ccccc2CCN 271570a_100000747142_100000747383 [0,1,1,0,0,0|0,0,2]=4 1533 B17R2.4286 Cc1ccccc1c2ccccc2CNN 271570a_100000747142_200016993956 [0,1,1,0,0,0|1,0,1]=4 1534 B17R2.4286 Cc1ccccc1c2ccccc2NC=O 271570a_200000040256_100000210755 [0,1,1,0,0,0|2,0,0]=4 1535 B17R2.4286 NCCc1ccccc1c2ccccc2Cl 271570a_100011934419_100000747383 [0,1,1,0,0,0|0,0,2]=4 1536 B17R2.4286 NCCc1ccccc1c2ccccc2F 271570a_100000761933_100000747383 [0,1,1,0,0,0|0,0,2]=4 1537 B17R2.4286 NCCc1ccccc1c2ccccc2I 271570a_100000069755_100000747383 [0,1,1,0,0,0|0,0,2]=4 1538 B17R2.4286 NCCc1ccccc1c2ccccc2N 271570a_100000034411_100000747383 [0,1,1,0,0,0|0,0,2]=4 1539 B17R2.4286 NCCc1ccccc1c2ccccc2O 271570a_100000035170_100000747383 [0,1,1,0,0,0|0,0,2]=4 1540 B17R2.4286 NNCc1ccccc1c2ccccc2Cl 271570a_100011934419_200016993956 [0,1,1,0,0,0|1,0,1]=4 1541 B17R2.4286 NNCc1ccccc1c2ccccc2F 271570a_100000761933_200016993956 [0,1,1,0,0,0|1,0,1]=4 1542 B17R2.4286 NNCc1ccccc1c2ccccc2I 271570a_100000069755_200016993956 [0,1,1,0,0,0|1,0,1]=4 1543 B17R2.4286 NNCc1ccccc1c2ccccc2N 271570a_100000034411_200016993956 [0,1,1,0,0,0|1,0,1]=4 1544 B17R2.4286 NNCc1ccccc1c2ccccc2O 271570a_100000035170_200016993956 [0,1,1,0,0,0|1,0,1]=4 1545 B17R2.4286 Nc1ccccc1c2ccccc2NC=O 271570a_200000040256_100000210017 [0,1,1,0,0,0|2,0,0]=4 1546 B17R2.4286 O=CNc1ccccc1c2ccccc2Br 271570a_200000040256_100000695589 [0,1,1,0,0,0|2,0,0]=4 1547 B17R2.4286 O=CNc1ccccc1c2ccccc2Cl 271570a_200000040256_100000764095 [0,1,1,0,0,0|2,0,0]=4 1548 B17R2.4286 O=CNc1ccccc1c2ccccc2F 271570a_200000040256_100011215700 [0,1,1,0,0,0|2,0,0]=4 1549 B17R2.4286 O=CNc1ccccc1c2ccccc2O 271570a_200000040256_100000739446 [0,1,1,0,0,0|2,0,0]=4 1550 B17R2.5881 C=C=Cc1ccc(cc1c2ccccc2)N 271570a_100015277604_200010239565 [0,1,1,0,0,0|1,0,1]=4 1551 B17R2.5881 CC=Cc1ccc(cc1c2ccccc2)N 271570a_100016259895_200010239565 [0,1,1,0,0,0|1,0,0]=3 1552 B17R2.12072 C/C=C/CSc1cc(c2ccccc2c1)N 62a_100010171453_100102629194 [0,1,1,0,0,0|0,0,2]=4 1553 B17R2.12072 C/C=C/CSc1cc(c2ccccc2c1)N 62a_100102629194_100010171453 [0,1,1,0,0,0|0,0,2]=4 1554 B17R2.12072 C=CCCSc1cc(c2ccccc2c1)N 62a_100000754431_100010171453 [0,1,1,0,0,0|0,0,2]=4 1555 B17R2.12072 C=CCCSc1cc(c2ccccc2c1)N 62a_100010171453_100000754431 [0,1,1,0,0,0|0,0,2]=4 1556 B17R2.12072 CC=CCSc1cc(c2ccccc2c1)N 62a_100000070051_100010171453 [0,1,1,0,0,0|0,0,2]=4 1557 B17R2.12072 CC=CCSc1cc(c2ccccc2c1)N 62a_100010171453_100000070051 [0,1,1,0,0,0|0,0,2]=4 1558 B17R2.12072 CCCC=Cc1cc(c2ccccc2c1)N 271570a_100016258520_100010171453 [0,1,1,0,0,0|0,0,2]=4 1559 B17R2.12072 CCOC=Cc1cc(c2ccccc2c1)N 271570a_100016256518_100010171453 [0,1,1,0,0,0|0,0,2]=4 1560 B17R2.12072 COCC=Cc1cc(c2ccccc2c1)N 271570a_100016286323_100010171453 [0,1,1,0,0,0|0,0,2]=4 1561 B17R2.40403 C=C(C)CSc1cc(c2ccccc2c1)N 62a_100000748629_100010171453 [0,1,1,0,0,0|1,0,1]=4 1562 B17R2.40403 C=C(C)CSc1cc(c2ccccc2c1)N 62a_100010171453_100000211660 [0,1,1,0,0,0|1,0,1]=4 1563 B17R2.40403 C=C(F)CSc1cc(c2ccccc2c1)N 62a_100000042424_100010171453 [0,1,1,0,0,0|1,0,1]=4 1564 B17R2.40403 C=C(F)CSc1cc(c2ccccc2c1)N 62a_100010171453_100000042424 [0,1,1,0,0,0|1,0,1]=4 1565 B17R2.40403 CC(C)C=Cc1cc(c2ccccc2c1)N 271570a_100016257149_100010171453 [0,1,1,0,0,0|0,0,2]=4 1566 B17R2.40403 CC(O)C=Cc1cc(c2ccccc2c1)N 271570a_200011019289_100010171453 [0,1,1,0,0,0|0,0,2]=4 1567 B17R2.57534 C=CC(=O)Nc1cc(c2ccccc2c1)Br 1626a_100010089974_100000185746 [0,1,1,0,0,0|2,0,0]=4 1568 B17R2.57534 C=CC(=O)Nc1cc(c2ccccc2c1)Br 22a_100010089974_100000185746 [0,1,1,0,0,0|2,0,0]=4 1569 B17R2.57534 C=CC(C)Sc1cc(c2ccccc2c1)N 62a_100011215867_100010171453 [0,1,1,0,0,0|1,0,1]=4 1570 B17R2.5006 C=C(C)COc1cc2ccccc2cc1N 34a_106744474703_100000748629 [0,1,1,0,0,0|1,0,1]=4 1571 B17R2.5006 C=C(C)COc1cc2ccccc2cc1N 7a_106744474703_100000748629 [0,1,1,0,0,0|1,0,1]=4 1572 B17R2.5006 C=C(C)CSc1cc2ccccc2cc1N 62a_100000748629_100009991566 [0,1,1,0,0,0|1,0,1]=4 1573 B17R2.5006 C=C(C)CSc1cc2ccccc2cc1N 62a_100009991566_100000211660 [0,1,1,0,0,0|1,0,1]=4 1574 B17R2.5006 C=C(F)COc1cc2ccccc2cc1N 34a_106744474703_100009893438 [0,1,1,0,0,0|1,0,1]=4 1575 B17R2.5006 C=C(F)COc1cc2ccccc2cc1N 7a_106744474703_100000042424 [0,1,1,0,0,0|1,0,1]=4 1576 B17R2.5006 C=C(F)CSc1cc2ccccc2cc1N 62a_100000042424_100009991566 [0,1,1,0,0,0|1,0,1]=4 1577 B17R2.5006 C=C(F)CSc1cc2ccccc2cc1N 62a_100009991566_100000042424 [0,1,1,0,0,0|1,0,1]=4 1578 B17R2.5006 CC(C)C=Cc1cc2ccccc2cc1N 271570a_100016257149_100009991566 [0,1,1,0,0,0|0,0,2]=4 1579 B17R2.5006 CC(O)C=Cc1cc2ccccc2cc1N 271570a_200011019289_100009991566 [0,1,1,0,0,0|0,0,2]=4 1580 B17R2.12116 C/C=C/COc1cc2ccccc2cc1N 34a_106744474703_100102629194 [0,1,1,0,0,0|0,0,2]=4 1581 B17R2.12116 C/C=C/COc1cc2ccccc2cc1N 7a_106744474703_100102629194 [0,1,1,0,0,0|0,0,2]=4 1582 B17R2.12116 C/C=C/CSc1cc2ccccc2cc1N 62a_100009991566_100102629194 [0,1,1,0,0,0|0,0,2]=4 1583 B17R2.12116 C/C=C/CSc1cc2ccccc2cc1N 62a_100102629194_100009991566 [0,1,1,0,0,0|0,0,2]=4 1584 B17R2.12116 C=CCCOc1cc2ccccc2cc1N 34a_106744474703_100000754431 [0,1,1,0,0,0|0,0,2]=4 1585 B17R2.12116 C=CCCOc1cc2ccccc2cc1N 7a_106744474703_100000754431 [0,1,1,0,0,0|0,0,2]=4 1586 B17R2.12116 C=CCCSc1cc2ccccc2cc1N 62a_100000754431_100009991566 [0,1,1,0,0,0|0,0,2]=4 1587 B17R2.12116 C=CCCSc1cc2ccccc2cc1N 62a_100009991566_100000754431 [0,1,1,0,0,0|0,0,2]=4 1588 B17R2.12116 CC=CCOc1cc2ccccc2cc1N 34a_106744474703_100000070051 [0,1,1,0,0,0|0,0,2]=4 1589 B17R2.12116 CC=CCOc1cc2ccccc2cc1N 7a_106744474703_100000070051 [0,1,1,0,0,0|0,0,2]=4 1590 B17R2.12116 CC=CCSc1cc2ccccc2cc1N 62a_100000070051_100009991566 [0,1,1,0,0,0|0,0,2]=4 1591 B17R2.12116 CC=CCSc1cc2ccccc2cc1N 62a_100009991566_100000070051 [0,1,1,0,0,0|0,0,2]=4 1592 B17R2.12116 CCCC=Cc1cc2ccccc2cc1N 271570a_100016258520_100009991566 [0,1,1,0,0,0|0,0,2]=4 1593 B17R2.12116 CCOC=Cc1cc2ccccc2cc1N 271570a_100016256518_100009991566 [0,1,1,0,0,0|0,0,2]=4 1594 B17R2.12116 COCC=Cc1cc2ccccc2cc1N 271570a_100016286323_100009991566 [0,1,1,0,0,0|0,0,2]=4 1595 B17R2.50008 C=CCC(=O)c1cc2ccccc2cc1Cl 1458a_100010003416_100000210623 [0,1,1,0,0,0|1,0,1]=4 1596 B17R2.50008 C=CCC(=O)c1cc2ccccc2cc1O 1458a_100000212107_100000210623 [0,1,1,0,0,0|1,0,1]=4 1597 B17R2.57536 C=CC(=O)Nc1cc2ccccc2cc1Br 1626a_100009991566_100000185746 [0,1,1,0,0,0|2,0,0]=4 1598 B17R2.57536 C=CC(=O)Nc1cc2ccccc2cc1I 1626a_100009892810_100000185746 [0,1,1,0,0,0|2,0,0]=4 1599 B17R2.57536 C=CC(=O)Nc1cc2ccccc2cc1O 22a_106744474703_100000185746 [0,1,1,0,0,0|2,0,0]=4 1600 B17R2.57536 C=CC(C)Sc1cc2ccccc2cc1N 62a_100011215867_100009991566 [0,1,1,0,0,0|1,0,1]=4 1601 B17R2.1837 Cc1ccccc1c2c(cccc2C=O)F 271570a_100000747142_100011998484 [0,1,1,0,0,0|1,0,1]=4 1602 B17R2.1837 Cc1ccccc1c2c(cccc2C=O)O 271570a_100000747142_100009816417 [0,1,1,0,0,0|1,0,1]=4 1603 B17R2.1837 Nc1ccccc1c2c(cccc2C=O)F 271570a_100000034411_100011998484 [0,1,1,0,0,0|2,0,0]=4 1604 B17R2.1837 Nc1ccccc1c2c(cccc2C=O)O 271570a_100000034411_100009816417 [0,1,1,0,0,0|2,0,0]=4 1605 B17R2.1837 O=Cc1cccc(c1c2ccccc2Cl)F 271570a_100011934419_100011998484 [0,1,1,0,0,0|2,0,0]=4 1606 B17R2.1837 O=Cc1cccc(c1c2ccccc2Cl)O 271570a_100011934419_100009816417 [0,1,1,0,0,0|2,0,0]=4 1607 B17R2.1837 O=Cc1cccc(c1c2ccccc2F)F 271570a_100000761933_100011998484 [0,1,1,0,0,0|2,0,0]=4 1608 B17R2.1837 O=Cc1cccc(c1c2ccccc2F)O 271570a_100000761933_100009816417 [0,1,1,0,0,0|2,0,0]=4 1609 B17R2.1837 O=Cc1cccc(c1c2ccccc2I)F 271570a_100000069755_100011998484 [0,1,1,0,0,0|2,0,0]=4 1610 B17R2.1837 O=Cc1cccc(c1c2ccccc2I)O 271570a_100000069755_100009816417 [0,1,1,0,0,0|2,0,0]=4 1611 B17R2.1837 O=Cc1cccc(c1c2ccccc2O)F 271570a_100000035170_100011998484 [0,1,1,0,0,0|2,0,0]=4 1612 B17R2.1837 O=Cc1cccc(c1c2ccccc2O)O 271570a_100000035170_100009816417 [0,1,1,0,0,0|2,0,0]=4 1613 B17R2.2440 Cc1ccc(c(c1)c2ccccc2Br)C=O 271570a_100000117001_100000695589 [0,1,1,0,0,0|2,0,0]=4 1614 B17R2.2440 Cc1ccc(c(c1)c2ccccc2C)C=O 271570a_100000117001_100000210755 [0,1,1,0,0,0|1,0,1]=4 1615 B17R2.2440 Cc1ccc(c(c1)c2ccccc2C)C=O 271570a_100000747142_100000692596 [0,1,1,0,0,0|1,0,1]=4 1616 B17R2.2440 Cc1ccc(c(c1)c2ccccc2C)NN 271570a_100000747142_100016996181 [0,1,1,0,0,0|1,0,1]=4 1617 B17R2.2440 Cc1ccc(c(c1)c2ccccc2Cl)C=O 271570a_100000117001_100000764095 [0,1,1,0,0,0|2,0,0]=4 1618 B17R2.2440 Cc1ccc(c(c1)c2ccccc2Cl)C=O 271570a_100011934419_100000692596 [0,1,1,0,0,0|2,0,0]=4 1619 B17R2.2440 Cc1ccc(c(c1)c2ccccc2Cl)NN 271570a_100011934419_100016996181 [0,1,1,0,0,0|2,0,0]=4 1620 B17R2.2440 Cc1ccc(c(c1)c2ccccc2F)C=O 271570a_100000117001_100011215700 [0,1,1,0,0,0|2,0,0]=4 1621 B17R2.2440 Cc1ccc(c(c1)c2ccccc2F)C=O 271570a_100000761933_100000692596 [0,1,1,0,0,0|2,0,0]=4 1622 B17R2.2440 Cc1ccc(c(c1)c2ccccc2F)NN 271570a_100000761933_100016996181 [0,1,1,0,0,0|2,0,0]=4 1623 B17R2.2440 Cc1ccc(c(c1)c2ccccc2I)C=O 271570a_100000069755_100000692596 [0,1,1,0,0,0|2,0,0]=4 1624 B17R2.2440 Cc1ccc(c(c1)c2ccccc2I)NN 271570a_100000069755_100016996181 [0,1,1,0,0,0|2,0,0]=4 1625 B17R2.2440 Cc1ccc(c(c1)c2ccccc2N)C=O 271570a_100000034411_100000692596 [0,1,1,0,0,0|2,0,0]=4 1626 B17R2.2440 Cc1ccc(c(c1)c2ccccc2N)C=O 271570a_100000117001_100000210017 [0,1,1,0,0,0|2,0,0]=4 1627 B17R2.2440 Cc1ccc(c(c1)c2ccccc2N)NN 271570a_100000034411_100016996181 [0,1,1,0,0,0|2,0,0]=4 1628 B17R2.2440 Cc1ccc(c(c1)c2ccccc2O)C=O 271570a_100000035170_100000692596 [0,1,1,0,0,0|2,0,0]=4 1629 B17R2.2440 Cc1ccc(c(c1)c2ccccc2O)C=O 271570a_100000117001_100000739446 [0,1,1,0,0,0|2,0,0]=4 1630 B17R2.2440 Cc1ccc(c(c1)c2ccccc2O)NN 271570a_100000035170_100016996181 [0,1,1,0,0,0|2,0,0]=4 1631 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)Br 271570a_100000747142_100010146562 [0,1,1,0,0,0|1,0,1]=4 1632 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)Cl 271570a_100010223337_100000210755 [0,1,1,0,0,0|1,0,1]=4 1633 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)F 271570a_100000097291_100000210755 [0,1,1,0,0,0|1,0,1]=4 1634 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)F 271570a_100000747142_100000752949 [0,1,1,0,0,0|1,0,1]=4 1635 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)O 271570a_100000747142_100011236494 [0,1,1,0,0,0|1,0,1]=4 1636 B17R2.2440 Cc1ccccc1c2cc(ccc2C=O)O 271570a_100010081635_100000210755 [0,1,1,0,0,0|1,0,1]=4 1637 B17R2.2440 Cc1ccccc1c2cc(ccc2CN)F 271570a_100000747142_100000708791 [0,1,1,0,0,0|0,0,2]=4 1638 B17R2.2440 Cc1ccccc1c2cc(ccc2CN)F 271570a_200010042773_100000210755 [0,1,1,0,0,0|0,0,2]=4 1639 B17R2.2440 NCc1ccc(cc1c2ccccc2Br)F 271570a_200010042773_100000695589 [0,1,1,0,0,0|1,0,1]=4 1640 B17R2.2440 NCc1ccc(cc1c2ccccc2Cl)F 271570a_100011934419_100000708791 [0,1,1,0,0,0|1,0,1]=4 1641 B17R2.2440 NCc1ccc(cc1c2ccccc2Cl)F 271570a_200010042773_100000764095 [0,1,1,0,0,0|1,0,1]=4 1642 B17R2.2440 NCc1ccc(cc1c2ccccc2F)F 271570a_100000761933_100000708791 [0,1,1,0,0,0|1,0,1]=4 1643 B17R2.2440 NCc1ccc(cc1c2ccccc2F)F 271570a_200010042773_100011215700 [0,1,1,0,0,0|1,0,1]=4 1644 B17R2.2440 NCc1ccc(cc1c2ccccc2I)F 271570a_100000069755_100000708791 [0,1,1,0,0,0|1,0,1]=4 1645 B17R2.2440 NCc1ccc(cc1c2ccccc2N)F 271570a_100000034411_100000708791 [0,1,1,0,0,0|1,0,1]=4 1646 B17R2.2440 NCc1ccc(cc1c2ccccc2N)F 271570a_200010042773_100000210017 [0,1,1,0,0,0|1,0,1]=4 1647 B17R2.2440 NCc1ccc(cc1c2ccccc2O)F 271570a_100000035170_100000708791 [0,1,1,0,0,0|1,0,1]=4 1648 B17R2.2440 NCc1ccc(cc1c2ccccc2O)F 271570a_200010042773_100000739446 [0,1,1,0,0,0|1,0,1]=4 1649 B17R2.2440 Nc1ccccc1c2cc(ccc2C=O)Br 271570a_100000034411_100010146562 [0,1,1,0,0,0|2,0,0]=4 1650 B17R2.2440 Nc1ccccc1c2cc(ccc2C=O)Cl 271570a_100010223337_100000210017 [0,1,1,0,0,0|2,0,0]=4 1651 B17R2.2440 Nc1ccccc1c2cc(ccc2C=O)F 271570a_100000034411_100000752949 [0,1,1,0,0,0|2,0,0]=4 1652 B17R2.2440 Nc1ccccc1c2cc(ccc2C=O)F 271570a_100000097291_100000210017 [0,1,1,0,0,0|2,0,0]=4 1653 B17R2.2440 Nc1ccccc1c2cc(ccc2C=O)O 271570a_100000034411_100011236494 [0,1,1,0,0,0|2,0,0]=4 1654 B17R2.2440 Nc1ccccc1c2cc(ccc2C=O)O 271570a_100010081635_100000210017 [0,1,1,0,0,0|2,0,0]=4 1655 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Br)Cl 271570a_100010223337_100000695589 [0,1,1,0,0,0|2,0,0]=4 1656 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Br)F 271570a_100000097291_100000695589 [0,1,1,0,0,0|2,0,0]=4 1657 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Br)O 271570a_100010081635_100000695589 [0,1,1,0,0,0|2,0,0]=4 1658 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Cl)Br 271570a_100011934419_100010146562 [0,1,1,0,0,0|2,0,0]=4 1659 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Cl)Cl 271570a_100010223337_100000764095 [0,1,1,0,0,0|2,0,0]=4 1660 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Cl)F 271570a_100000097291_100000764095 [0,1,1,0,0,0|2,0,0]=4 1661 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Cl)F 271570a_100011934419_100000752949 [0,1,1,0,0,0|2,0,0]=4 1662 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Cl)O 271570a_100010081635_100000764095 [0,1,1,0,0,0|2,0,0]=4 1663 B17R2.2440 O=Cc1ccc(cc1c2ccccc2Cl)O 271570a_100011934419_100011236494 [0,1,1,0,0,0|2,0,0]=4 1664 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)Br 271570a_100000761933_100010146562 [0,1,1,0,0,0|2,0,0]=4 1665 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)Cl 271570a_100010223337_100011215700 [0,1,1,0,0,0|2,0,0]=4 1666 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)F 271570a_100000097291_100011215700 [0,1,1,0,0,0|2,0,0]=4 1667 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)F 271570a_100000761933_100000752949 [0,1,1,0,0,0|2,0,0]=4 1668 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)O 271570a_100000761933_100011236494 [0,1,1,0,0,0|2,0,0]=4 1669 B17R2.2440 O=Cc1ccc(cc1c2ccccc2F)O 271570a_100010081635_100011215700 [0,1,1,0,0,0|2,0,0]=4 1670 B17R2.2440 O=Cc1ccc(cc1c2ccccc2I)Br 271570a_100000069755_100010146562 [0,1,1,0,0,0|2,0,0]=4 1671 B17R2.2440 O=Cc1ccc(cc1c2ccccc2I)F 271570a_100000069755_100000752949 [0,1,1,0,0,0|2,0,0]=4 1672 B17R2.2440 O=Cc1ccc(cc1c2ccccc2I)O 271570a_100000069755_100011236494 [0,1,1,0,0,0|2,0,0]=4 1673 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)Br 271570a_100000035170_100010146562 [0,1,1,0,0,0|2,0,0]=4 1674 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)Cl 271570a_100010223337_100000739446 [0,1,1,0,0,0|2,0,0]=4 1675 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)F 271570a_100000035170_100000752949 [0,1,1,0,0,0|2,0,0]=4 1676 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)F 271570a_100000097291_100000739446 [0,1,1,0,0,0|2,0,0]=4 1677 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)O 271570a_100000035170_100011236494 [0,1,1,0,0,0|2,0,0]=4 1678 B17R2.2440 O=Cc1ccc(cc1c2ccccc2O)O 271570a_100010081635_100000739446 [0,1,1,0,0,0|2,0,0]=4 1679 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2Br 271570a_100010043623_100000695589 [0,1,1,0,0,0|2,0,0]=4 1680 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2C 271570a_100000747142_100011551863 [0,1,1,0,0,0|1,0,1]=4 1681 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2C 271570a_100010043623_100000210755 [0,1,1,0,0,0|1,0,1]=4 1682 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2Cl 271570a_100010043623_100000764095 [0,1,1,0,0,0|2,0,0]=4 1683 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2Cl 271570a_100011934419_100011551863 [0,1,1,0,0,0|2,0,0]=4 1684 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2F 271570a_100000761933_100011551863 [0,1,1,0,0,0|2,0,0]=4 1685 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2F 271570a_100010043623_100011215700 [0,1,1,0,0,0|2,0,0]=4 1686 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2I 271570a_100000069755_100011551863 [0,1,1,0,0,0|2,0,0]=4 1687 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2N 271570a_100000034411_100011551863 [0,1,1,0,0,0|2,0,0]=4 1688 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2N 271570a_100010043623_100000210017 [0,1,1,0,0,0|2,0,0]=4 1689 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2O 271570a_100000035170_100011551863 [0,1,1,0,0,0|2,0,0]=4 1690 B17R2.2493 Cc1ccc(c(c1)C=O)c2ccccc2O 271570a_100010043623_100000739446 [0,1,1,0,0,0|2,0,0]=4 1691 B17R2.2493 Cc1ccccc1c2ccc(cc2C=O)Br 271570a_100000747142_100010185651 [0,1,1,0,0,0|1,0,1]=4 1692 B17R2.2493 Cc1ccccc1c2ccc(cc2C=O)Br 271570a_100021397726_100000210755 [0,1,1,0,0,0|1,0,1]=4 1693 B17R2.2493 Cc1ccccc1c2ccc(cc2C=O)Cl 271570a_100000069396_100000210755 [0,1,1,0,0,0|1,0,1]=4 1694 B17R2.2493 Cc1ccccc1c2ccc(cc2C=O)Cl 271570a_100000747142_100010254386 [0,1,1,0,0,0|1,0,1]=4 1695 B17R2.2493 Cc1ccccc1c2ccc(cc2C=O)F 271570a_100000747142_100011218309 [0,1,1,0,0,0|1,0,1]=4 1696 B17R2.2493 Cc1ccccc1c2ccc(cc2C=O)F 271570a_100010043619_100000210755 [0,1,1,0,0,0|1,0,1]=4 1697 B17R2.2493 Cc1ccccc1c2ccc(cc2C=O)O 271570a_100000747142_100000690577 [0,1,1,0,0,0|1,0,1]=4 1698 B17R2.2493 Cc1ccccc1c2ccc(cc2C=O)O 271570a_100010081631_100000210755 [0,1,1,0,0,0|1,0,1]=4 1699 B17R2.2493 Cc1ccccc1c2ccc(cc2CN)F 271570a_100000747142_100000742738 [0,1,1,0,0,0|0,0,2]=4 1700 B17R2.2493 Cc1ccccc1c2ccc(cc2CN)F 271570a_100020625080_100000210755 [0,1,1,0,0,0|0,0,2]=4 1701 B17R2.2493 Cc1ccccc1c2ccc(cc2NN)F 271570a_100000747142_100012362518 [0,1,1,0,0,0|1,0,1]=4 1702 B17R2.2493 NCc1cc(ccc1c2ccccc2Br)F 271570a_100020625080_100000695589 [0,1,1,0,0,0|1,0,1]=4 1703 B17R2.2493 NCc1cc(ccc1c2ccccc2Cl)F 271570a_100011934419_100000742738 [0,1,1,0,0,0|1,0,1]=4 1704 B17R2.2493 NCc1cc(ccc1c2ccccc2Cl)F 271570a_100020625080_100000764095 [0,1,1,0,0,0|1,0,1]=4 1705 B17R2.2493 NCc1cc(ccc1c2ccccc2F)F 271570a_100000761933_100000742738 [0,1,1,0,0,0|1,0,1]=4 1706 B17R2.2493 NCc1cc(ccc1c2ccccc2F)F 271570a_100020625080_100011215700 [0,1,1,0,0,0|1,0,1]=4 1707 B17R2.2493 NCc1cc(ccc1c2ccccc2I)F 271570a_100000069755_100000742738 [0,1,1,0,0,0|1,0,1]=4 1708 B17R2.2493 NCc1cc(ccc1c2ccccc2N)F 271570a_100000034411_100000742738 [0,1,1,0,0,0|1,0,1]=4 1709 B17R2.2493 NCc1cc(ccc1c2ccccc2N)F 271570a_100020625080_100000210017 [0,1,1,0,0,0|1,0,1]=4 1710 B17R2.2493 NCc1cc(ccc1c2ccccc2O)F 271570a_100000035170_100000742738 [0,1,1,0,0,0|1,0,1]=4 1711 B17R2.2493 NCc1cc(ccc1c2ccccc2O)F 271570a_100020625080_100000739446 [0,1,1,0,0,0|1,0,1]=4 1712 B17R2.2493 NNc1cc(ccc1c2ccccc2Cl)F 271570a_100011934419_100012362518 [0,1,1,0,0,0|2,0,0]=4 1713 B17R2.2493 NNc1cc(ccc1c2ccccc2F)F 271570a_100000761933_100012362518 [0,1,1,0,0,0|2,0,0]=4 1714 B17R2.2493 NNc1cc(ccc1c2ccccc2I)F 271570a_100000069755_100012362518 [0,1,1,0,0,0|2,0,0]=4 1715 B17R2.2493 NNc1cc(ccc1c2ccccc2N)F 271570a_100000034411_100012362518 [0,1,1,0,0,0|2,0,0]=4 1716 B17R2.2493 NNc1cc(ccc1c2ccccc2O)F 271570a_100000035170_100012362518 [0,1,1,0,0,0|2,0,0]=4 1717 B17R2.2493 Nc1ccccc1c2ccc(cc2C=O)Br 271570a_100000034411_100010185651 [0,1,1,0,0,0|2,0,0]=4 1718 B17R2.2493 Nc1ccccc1c2ccc(cc2C=O)Br 271570a_100021397726_100000210017 [0,1,1,0,0,0|2,0,0]=4 1719 B17R2.2493 Nc1ccccc1c2ccc(cc2C=O)Cl 271570a_100000034411_100010254386 [0,1,1,0,0,0|2,0,0]=4 1720 B17R2.2493 Nc1ccccc1c2ccc(cc2C=O)Cl 271570a_100000069396_100000210017 [0,1,1,0,0,0|2,0,0]=4 1721 B17R2.2493 Nc1ccccc1c2ccc(cc2C=O)F 271570a_100000034411_100011218309 [0,1,1,0,0,0|2,0,0]=4 1722 B17R2.2493 Nc1ccccc1c2ccc(cc2C=O)F 271570a_100010043619_100000210017 [0,1,1,0,0,0|2,0,0]=4 1723 B17R2.2493 Nc1ccccc1c2ccc(cc2C=O)O 271570a_100000034411_100000690577 [0,1,1,0,0,0|2,0,0]=4 1724 B17R2.2493 Nc1ccccc1c2ccc(cc2C=O)O 271570a_100010081631_100000210017 [0,1,1,0,0,0|2,0,0]=4 1725 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Br)Br 271570a_100021397726_100000695589 [0,1,1,0,0,0|2,0,0]=4 1726 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Br)Cl 271570a_100000069396_100000695589 [0,1,1,0,0,0|2,0,0]=4 1727 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Br)F 271570a_100010043619_100000695589 [0,1,1,0,0,0|2,0,0]=4 1728 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Br)O 271570a_100010081631_100000695589 [0,1,1,0,0,0|2,0,0]=4 1729 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Cl)Br 271570a_100011934419_100010185651 [0,1,1,0,0,0|2,0,0]=4 1730 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Cl)Br 271570a_100021397726_100000764095 [0,1,1,0,0,0|2,0,0]=4 1731 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Cl)Cl 271570a_100000069396_100000764095 [0,1,1,0,0,0|2,0,0]=4 1732 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Cl)Cl 271570a_100011934419_100010254386 [0,1,1,0,0,0|2,0,0]=4 1733 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Cl)F 271570a_100010043619_100000764095 [0,1,1,0,0,0|2,0,0]=4 1734 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Cl)F 271570a_100011934419_100011218309 [0,1,1,0,0,0|2,0,0]=4 1735 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Cl)O 271570a_100010081631_100000764095 [0,1,1,0,0,0|2,0,0]=4 1736 B17R2.2493 O=Cc1cc(ccc1c2ccccc2Cl)O 271570a_100011934419_100000690577 [0,1,1,0,0,0|2,0,0]=4 1737 B17R2.2493 O=Cc1cc(ccc1c2ccccc2F)Br 271570a_100000761933_100010185651 [0,1,1,0,0,0|2,0,0]=4 1738 B17R2.2493 O=Cc1cc(ccc1c2ccccc2F)Br 271570a_100021397726_100011215700 [0,1,1,0,0,0|2,0,0]=4 1739 B17R2.2493 O=Cc1cc(ccc1c2ccccc2F)Cl 271570a_100000069396_100011215700 [0,1,1,0,0,0|2,0,0]=4 1740 B17R2.2493 O=Cc1cc(ccc1c2ccccc2F)Cl 271570a_100000761933_100010254386 [0,1,1,0,0,0|2,0,0]=4 1741 B17R2.2493 O=Cc1cc(ccc1c2ccccc2F)F 271570a_100000761933_100011218309 [0,1,1,0,0,0|2,0,0]=4 1742 B17R2.2493 O=Cc1cc(ccc1c2ccccc2F)F 271570a_100010043619_100011215700 [0,1,1,0,0,0|2,0,0]=4 1743 B17R2.2493 O=Cc1cc(ccc1c2ccccc2F)O 271570a_100000761933_100000690577 [0,1,1,0,0,0|2,0,0]=4 1744 B17R2.2493 O=Cc1cc(ccc1c2ccccc2F)O 271570a_100010081631_100011215700 [0,1,1,0,0,0|2,0,0]=4 1745 B17R2.2493 O=Cc1cc(ccc1c2ccccc2I)Br 271570a_100000069755_100010185651 [0,1,1,0,0,0|2,0,0]=4 1746 B17R2.2493 O=Cc1cc(ccc1c2ccccc2I)Cl 271570a_100000069755_100010254386 [0,1,1,0,0,0|2,0,0]=4 1747 B17R2.2493 O=Cc1cc(ccc1c2ccccc2I)F 271570a_100000069755_100011218309 [0,1,1,0,0,0|2,0,0]=4 1748 B17R2.2493 O=Cc1cc(ccc1c2ccccc2I)O 271570a_100000069755_100000690577 [0,1,1,0,0,0|2,0,0]=4 1749 B17R2.2493 O=Cc1cc(ccc1c2ccccc2O)Br 271570a_100000035170_100010185651 [0,1,1,0,0,0|2,0,0]=4 1750 B17R2.2493 O=Cc1cc(ccc1c2ccccc2O)Br 271570a_100021397726_100000739446 [0,1,1,0,0,0|2,0,0]=4 1751 B17R2.2493 O=Cc1cc(ccc1c2ccccc2O)Cl 271570a_100000035170_100010254386 [0,1,1,0,0,0|2,0,0]=4 1752 B17R2.2493 O=Cc1cc(ccc1c2ccccc2O)Cl 271570a_100000069396_100000739446 [0,1,1,0,0,0|2,0,0]=4 1753 B17R2.2493 O=Cc1cc(ccc1c2ccccc2O)F 271570a_100000035170_100011218309 [0,1,1,0,0,0|2,0,0]=4 1754 B17R2.2493 O=Cc1cc(ccc1c2ccccc2O)F 271570a_100010043619_100000739446 [0,1,1,0,0,0|2,0,0]=4 1755 B17R2.2493 O=Cc1cc(ccc1c2ccccc2O)O 271570a_100000035170_100000690577 [0,1,1,0,0,0|2,0,0]=4 1756 B17R2.2493 O=Cc1cc(ccc1c2ccccc2O)O 271570a_100010081631_100000739446 [0,1,1,0,0,0|2,0,0]=4 1757 B17R2.2758 C#Cc1ccccc1c2ccccc2C=O 271570a_100000099761_100000211189 [0,1,1,0,0,0|1,0,1]=4 1758 B17R2.2758 C#Cc1ccccc1c2ccccc2CN 271570a_100000099761_100000689332 [0,1,1,0,0,0|0,0,2]=4 1759 B17R2.2758 C#Cc1ccccc1c2ccccc2NN 271570a_100000099761_100000241748 [0,1,1,0,0,0|1,0,1]=4 1760 B17R2.2758 C=Cc1ccccc1c2ccccc2C#N 271570a_100000037480_100000188569 [0,1,1,0,0,0|0,0,2]=4 1761 B17R2.2758 C=Cc1ccccc1c2ccccc2C=O 271570a_100000037480_100000211189 [0,1,1,0,0,0|1,0,0]=3 1762 B17R2.2758 C=Cc1ccccc1c2ccccc2CC 271570a_100000037480_100011215823 [0,1,1,0,0,0|1,0,1]=4 1763 B17R2.2758 C=Cc1ccccc1c2ccccc2CN 271570a_100000037480_100000689332 [0,1,1,0,0,0|0,0,1]=3 1764 B17R2.2758 C=Cc1ccccc1c2ccccc2CO 271570a_100000037480_100000187465 [0,1,1,0,0,0|1,0,1]=4 1765 B17R2.2758 C=Cc1ccccc1c2ccccc2NC 271570a_100000037480_100020606079 [0,1,1,0,0,0|1,0,1]=4 1766 B17R2.2758 C=Cc1ccccc1c2ccccc2NN 271570a_100000037480_100000241748 [0,1,1,0,0,0|1,0,0]=3 1767 B17R2.2758 C=Cc1ccccc1c2ccccc2OC 271570a_100000037480_100000174000 [0,1,1,0,0,0|1,0,1]=4 1768 B17R2.2758 C=Cc1ccccc1c2ccccc2OC 271570a_100011290941_100010074709 [0,1,1,0,0,0|1,0,1]=4 1769 B17R2.2758 C=Cc1ccccc1c2ccccc2SC 271570a_100000037480_100011217816 [0,1,1,0,0,0|1,0,1]=4 1770 B17R2.2758 C=Cc1ccccc1c2cccnc2C=O 271570a_100000037480_100011934733 [0,1,1,0,0,0|2,0,0]=4 1771 B17R2.2758 C=Cc1ccccc1c2cccnc2CN 271570a_100000037480_100020591323 [0,1,1,0,0,0|1,0,1]=4 1772 B17R2.2758 C=Cc1ccccc1c2cccnc2NN 271570a_100000037480_100011464834 [0,1,1,0,0,0|2,0,0]=4 1773 B17R2.2758 C=Cc1ccccc1c2ccncc2C=O 271570a_100000037480_100000050567 [0,1,1,0,0,0|2,0,0]=4 1774 B17R2.2758 C=Cc1ccccc1c2cnccc2C=O 271570a_100000037480_100011934409 [0,1,1,0,0,0|2,0,0]=4 1775 B17R2.2758 C=Cc1ccccc1c2cnccc2CN 271570a_100000037480_100020640021 [0,1,1,0,0,0|1,0,1]=4 1776 B17R2.2758 C=Cc1ccccc1c2cnccc2NN 271570a_100000037480_100013404636 [0,1,1,0,0,0|2,0,0]=4 1777 B17R2.2758 C=Cc1ccccc1c2ncccc2C=O 271570a_100000037480_100009816751 [0,1,1,0,0,0|2,0,0]=4 1778 B17R2.2758 C=Cc1ccccc1c2ncccc2CN 271570a_100000037480_100015189234 [0,1,1,0,0,0|1,0,1]=4 1779 B17R2.2758 CCc1ccccc1c2ccccc2C=O 271570a_100000740022_100011215823 [0,1,1,0,0,0|1,0,1]=4 1780 B17R2.2758 CCc1ccccc1c2ccccc2C=O 271570a_100011216252_100000211189 [0,1,1,0,0,0|1,0,1]=4 1781 B17R2.2758 CCc1ccccc1c2ccccc2CN 271570a_100011216252_100000689332 [0,1,1,0,0,0|0,0,2]=4 1782 B17R2.2758 CCc1ccccc1c2ccccc2CN 271570a_100020632975_100011215823 [0,1,1,0,0,0|0,0,2]=4 1783 B17R2.2758 CCc1ccccc1c2ccccc2NN 271570a_100011216252_100000241748 [0,1,1,0,0,0|1,0,1]=4 1784 B17R2.2758 CNc1ccccc1c2ccccc2C=O 271570a_100000740022_100020606079 [0,1,1,0,0,0|1,0,1]=4 1785 B17R2.2758 CNc1ccccc1c2ccccc2CN 271570a_100020632975_100020606079 [0,1,1,0,0,0|0,0,2]=4 1786 B17R2.2758 COc1ccccc1c2ccccc2C=O 271570a_100000740022_100000174000 [0,1,1,0,0,0|1,0,1]=4 1787 B17R2.2758 COc1ccccc1c2ccccc2C=O 271570a_100000756652_100000211189 [0,1,1,0,0,0|1,0,1]=4 1788 B17R2.2758 COc1ccccc1c2ccccc2CN 271570a_100000756652_100000689332 [0,1,1,0,0,0|0,0,2]=4 1789 B17R2.2758 COc1ccccc1c2ccccc2CN 271570a_100020632975_100000174000 [0,1,1,0,0,0|0,0,2]=4 1790 B17R2.2758 COc1ccccc1c2ccccc2NN 271570a_100000756652_100000241748 [0,1,1,0,0,0|1,0,1]=4 1791 B17R2.2758 CSc1ccccc1c2ccccc2C=O 271570a_100000740022_100011217816 [0,1,1,0,0,0|1,0,1]=4 1792 B17R2.2758 CSc1ccccc1c2ccccc2C=O 271570a_100011218165_100000211189 [0,1,1,0,0,0|1,0,1]=4 1793 B17R2.2758 CSc1ccccc1c2ccccc2CN 271570a_100011218165_100000689332 [0,1,1,0,0,0|0,0,2]=4 1794 B17R2.2758 CSc1ccccc1c2ccccc2CN 271570a_100020632975_100011217816 [0,1,1,0,0,0|0,0,2]=4 1795 B17R2.2758 CSc1ccccc1c2ccccc2NN 271570a_100011218165_100000241748 [0,1,1,0,0,0|1,0,1]=4 1796 B17R2.2758 N#Cc1ccccc1c2ccccc2C=O 271570a_100000043008_100000211189 [0,1,1,0,0,0|0,0,2]=4 1797 B17R2.2758 N#Cc1ccccc1c2ccccc2C=O 271570a_100000740022_100000188569 [0,1,1,0,0,0|0,0,2]=4 1798 B17R2.2758 N#Cc1ccccc1c2ccccc2CN 271570a_100000043008_100000689332 [0,1,1,0,0,0|0,0,2]=4 1799 B17R2.2758 N#Cc1ccccc1c2ccccc2CN 271570a_100020632975_100000188569 [0,1,1,0,0,0|0,0,2]=4 1800 B17R2.2758 N#Cc1ccccc1c2ccccc2NN 271570a_100000043008_100000241748 [0,1,1,0,0,0|1,0,1]=4 1801 B17R2.2758 NCc1ccccc1c2ccccc2C=O 271570a_100000740022_100000689332 [0,1,1,0,0,0|0,0,1]=3 1802 B17R2.2758 NCc1ccccc1c2ccccc2C=O 271570a_100020632975_100000211189 [0,1,1,0,0,0|0,0,1]=3 1803 B17R2.2758 NCc1ccccc1c2ccccc2CN 271570a_100020632975_100000689332 [0,1,1,0,0,0|0,0,2]=4 1804 B17R2.2758 NCc1ccccc1c2ccccc2CO 271570a_100000066922_100000689332 [0,1,1,0,0,0|0,0,2]=4 1805 B17R2.2758 NCc1ccccc1c2ccccc2CO 271570a_100020632975_100000187465 [0,1,1,0,0,0|0,0,2]=4 1806 B17R2.2758 NCc1ccccc1c2ccccc2NN 271570a_100020632975_100000241748 [0,1,1,0,0,0|1,0,1]=4 1807 B17R2.2758 NCc1ccccc1c2cccnc2C=O 271570a_100020632975_100011934733 [0,1,1,0,0,0|1,0,1]=4 1808 B17R2.2758 NCc1ccccc1c2ccncc2C=O 271570a_100020632975_100000050567 [0,1,1,0,0,0|1,0,1]=4 1809 B17R2.2758 NCc1ccccc1c2cnccc2C=O 271570a_100020632975_100011934409 [0,1,1,0,0,0|1,0,1]=4 1810 B17R2.2758 NCc1ccccc1c2ncccc2C=O 271570a_100020632975_100009816751 [0,1,1,0,0,0|1,0,1]=4 1811 B17R2.2758 NCc1cccnc1c2ccccc2C=O 271570a_100000740022_100015189234 [0,1,1,0,0,0|1,0,1]=4 1812 B17R2.2758 NCc1ccncc1c2ccccc2C=O 271570a_100000740022_100020640021 [0,1,1,0,0,0|1,0,1]=4 1813 B17R2.2758 NCc1ncccc1c2ccccc2C=O 271570a_100000740022_100020591323 [0,1,1,0,0,0|1,0,1]=4 1814 B17R2.2758 NNc1ccccc1c2ccccc2C=O 271570a_100000740022_100000241748 [0,1,1,0,0,0|1,0,0]=3 1815 B17R2.2758 NNc1ccccc1c2ccccc2CO 271570a_100000066922_100000241748 [0,1,1,0,0,0|1,0,1]=4 1816 B17R2.2758 NNc1ccncc1c2ccccc2C=O 271570a_100000740022_100013404636 [0,1,1,0,0,0|2,0,0]=4 1817 B17R2.2758 NNc1ncccc1c2ccccc2C=O 271570a_100000740022_100011464834 [0,1,1,0,0,0|2,0,0]=4 1818 B17R2.2758 O=Cc1ccccc1c2ccccc2C=O 271570a_100000740022_100000211189 [0,1,1,0,0,0|1,0,0]=3 1819 B17R2.2758 O=Cc1ccccc1c2ccccc2CO 271570a_100000066922_100000211189 [0,1,1,0,0,0|1,0,1]=4 1820 B17R2.2758 O=Cc1ccccc1c2ccccc2CO 271570a_100000740022_100000187465 [0,1,1,0,0,0|1,0,1]=4 1821 B17R2.2758 O=Cc1ccccc1c2cccnc2C=O 271570a_100000740022_100011934733 [0,1,1,0,0,0|2,0,0]=4 1822 B17R2.2758 O=Cc1ccccc1c2ccncc2C=O 271570a_100000740022_100000050567 [0,1,1,0,0,0|2,0,0]=4 1823 B17R2.2758 O=Cc1ccccc1c2cnccc2C=O 271570a_100000740022_100011934409 [0,1,1,0,0,0|2,0,0]=4 1824 B17R2.2758 O=Cc1ccccc1c2ncccc2C=O 271570a_100000740022_100009816751 [0,1,1,0,0,0|2,0,0]=4 1825 B17R2.8831 C=Cc1ccccc1c2ccc(cc2Br)F 271570a_100000037480_100011217111 [0,1,1,0,0,0|2,0,0]=4 1826 B17R2.8831 C=Cc1ccccc1c2ccc(cc2Br)N 271570a_100000037480_100000750458 [0,1,1,0,0,0|2,0,0]=4 1827 B17R2.8831 C=Cc1ccccc1c2ccc(cc2Br)O 271570a_100000037480_100000701344 [0,1,1,0,0,0|2,0,0]=4 1828 B17R2.8831 C=Cc1ccccc1c2ccc(cc2C)C 271570a_100000037480_100011217332 [0,1,1,0,0,0|1,0,1]=4 1829 B17R2.8831 C=Cc1ccccc1c2ccc(cc2C)Cl 271570a_100000037480_100011219607 [0,1,1,0,0,0|1,0,1]=4 1830 B17R2.8831 C=Cc1ccccc1c2ccc(cc2C)F 271570a_100000037480_100011205405 [0,1,1,0,0,0|1,0,1]=4 1831 B17R2.8831 C=Cc1ccccc1c2ccc(cc2C)N 271570a_100000037480_100000210723 [0,1,1,0,0,0|1,0,1]=4 1832 B17R2.8831 C=Cc1ccccc1c2ccc(cc2C)O 271570a_100000037480_100000729255 [0,1,1,0,0,0|1,0,1]=4 1833 B17R2.8831 C=Cc1ccccc1c2ccc(cc2Cl)C 271570a_100000037480_100011263221 [0,1,1,0,0,0|2,0,0]=4 1834 B17R2.8831 C=Cc1ccccc1c2ccc(cc2Cl)F 271570a_100000037480_100000733362 [0,1,1,0,0,0|2,0,0]=4 1835 B17R2.8831 C=Cc1ccccc1c2ccc(cc2Cl)N 271570a_100000037480_100000761885 [0,1,1,0,0,0|2,0,0]=4 1836 B17R2.8831 C=Cc1ccccc1c2ccc(cc2Cl)O 271570a_100000037480_100000047559 [0,1,1,0,0,0|2,0,0]=4 1837 B17R2.8831 C=Cc1ccccc1c2ccc(cc2F)Br 271570a_100000037480_100009814013 [0,1,1,0,0,0|2,0,0]=4 1838 B17R2.8831 C=Cc1ccccc1c2ccc(cc2F)C 271570a_100000037480_100011216119 [0,1,1,0,0,0|2,0,0]=4 1839 B17R2.8831 C=Cc1ccccc1c2ccc(cc2F)Cl 271570a_100000037480_100011216042 [0,1,1,0,0,0|2,0,0]=4 1840 B17R2.8831 C=Cc1ccccc1c2ccc(cc2F)F 271570a_100000037480_100000750030 [0,1,1,0,0,0|2,0,0]=4 1841 B17R2.8831 C=Cc1ccccc1c2ccc(cc2F)N 271570a_100000037480_100011356925 [0,1,1,0,0,0|2,0,0]=4 1842 B17R2.8831 C=Cc1ccccc1c2ccc(cc2F)O 271570a_100000037480_100000755031 [0,1,1,0,0,0|2,0,0]=4 1843 B17R2.8831 C=Cc1ccccc1c2ccc(cc2N)Br 271570a_100000037480_100000743836 [0,1,1,0,0,0|2,0,0]=4 1844 B17R2.8831 C=Cc1ccccc1c2ccc(cc2N)C 271570a_100000037480_100011216686 [0,1,1,0,0,0|2,0,0]=4 1845 B17R2.8831 C=Cc1ccccc1c2ccc(cc2N)Cl 271570a_100000037480_100000761886 [0,1,1,0,0,0|2,0,0]=4 1846 B17R2.8831 C=Cc1ccccc1c2ccc(cc2N)F 271570a_100000037480_100011218093 [0,1,1,0,0,0|2,0,0]=4 1847 B17R2.8831 C=Cc1ccccc1c2ccc(cc2N)N 271570a_100000037480_200012175722 [0,1,1,0,0,0|2,0,0]=4 1848 B17R2.8831 C=Cc1ccccc1c2ccc(cc2N)O 271570a_100000037480_100011999798 [0,1,1,0,0,0|2,0,0]=4 1849 B17R2.8831 C=Cc1ccccc1c2ccc(cc2O)Br 271570a_100000037480_100012344904 [0,1,1,0,0,0|2,0,0]=4 1850 B17R2.8831 C=Cc1ccccc1c2ccc(cc2O)C 271570a_100000037480_100012002257 [0,1,1,0,0,0|2,0,0]=4 1851 B17R2.8831 C=Cc1ccccc1c2ccc(cc2O)Cl 271570a_100000037480_100000050036 [0,1,1,0,0,0|2,0,0]=4 1852 B17R2.8831 C=Cc1ccccc1c2ccc(cc2O)F 271570a_100000037480_100000690578 [0,1,1,0,0,0|2,0,0]=4 1853 B17R2.8831 C=Cc1ccccc1c2ccc(cc2O)O 271570a_100000037480_100009813921 [0,1,1,0,0,0|2,0,0]=4 1854 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)Br 271570a_100000740022_100000701812 [0,1,1,0,0,0|1,0,1]=4 1855 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)Cl 271570a_100000740022_100011219607 [0,1,1,0,0,0|1,0,1]=4 1856 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)Cl 271570a_100011216725_100000211189 [0,1,1,0,0,0|1,0,1]=4 1857 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)F 271570a_100000740022_100011205405 [0,1,1,0,0,0|1,0,1]=4 1858 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)F 271570a_100011216746_100000211189 [0,1,1,0,0,0|1,0,1]=4 1859 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)N 271570a_100000069388_100000211189 [0,1,1,0,0,0|1,0,1]=4 1860 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)N 271570a_100000740022_100000210723 [0,1,1,0,0,0|1,0,1]=4 1861 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)O 271570a_100000040639_100000211189 [0,1,1,0,0,0|1,0,1]=4 1862 B17R2.8831 Cc1cc(ccc1c2ccccc2C=O)O 271570a_100000740022_100000729255 [0,1,1,0,0,0|1,0,1]=4 1863 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)Br 271570a_100020632975_100000701812 [0,1,1,0,0,0|0,0,2]=4 1864 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)Cl 271570a_100011216725_100000689332 [0,1,1,0,0,0|0,0,2]=4 1865 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)Cl 271570a_100020632975_100011219607 [0,1,1,0,0,0|0,0,2]=4 1866 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)F 271570a_100011216746_100000689332 [0,1,1,0,0,0|0,0,2]=4 1867 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)F 271570a_100020632975_100011205405 [0,1,1,0,0,0|0,0,2]=4 1868 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)N 271570a_100000069388_100000689332 [0,1,1,0,0,0|0,0,2]=4 1869 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)N 271570a_100020632975_100000210723 [0,1,1,0,0,0|0,0,2]=4 1870 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)O 271570a_100000040639_100000689332 [0,1,1,0,0,0|0,0,2]=4 1871 B17R2.8831 Cc1cc(ccc1c2ccccc2CN)O 271570a_100020632975_100000729255 [0,1,1,0,0,0|0,0,2]=4 1872 B17R2.8831 Cc1cc(ccc1c2ccccc2NN)Cl 271570a_100011216725_100000241748 [0,1,1,0,0,0|1,0,1]=4 1873 B17R2.8831 Cc1cc(ccc1c2ccccc2NN)F 271570a_100011216746_100000241748 [0,1,1,0,0,0|1,0,1]=4 1874 B17R2.8831 Cc1cc(ccc1c2ccccc2NN)N 271570a_100000069388_100000241748 [0,1,1,0,0,0|1,0,1]=4 1875 B17R2.8831 Cc1cc(ccc1c2ccccc2NN)O 271570a_100000040639_100000241748 [0,1,1,0,0,0|1,0,1]=4 1876 B17R2.8831 Cc1ccc(c(c1)Br)c2ccccc2C=O 271570a_100000740022_100009813563 [0,1,1,0,0,0|2,0,0]=4 1877 B17R2.8831 Cc1ccc(c(c1)Br)c2ccccc2CN 271570a_100020632975_100009813563 [0,1,1,0,0,0|1,0,1]=4 1878 B17R2.8831 Cc1ccc(c(c1)C)c2ccccc2C=O 271570a_100000740022_100011217332 [0,1,1,0,0,0|1,0,1]=4 1879 B17R2.8831 Cc1ccc(c(c1)C)c2ccccc2C=O 271570a_100011216325_100000211189 [0,1,1,0,0,0|1,0,1]=4 1880 B17R2.8831 Cc1ccc(c(c1)C)c2ccccc2CN 271570a_100011216325_100000689332 [0,1,1,0,0,0|0,0,2]=4 1881 B17R2.8831 Cc1ccc(c(c1)C)c2ccccc2CN 271570a_100020632975_100011217332 [0,1,1,0,0,0|0,0,2]=4 1882 B17R2.8831 Cc1ccc(c(c1)C)c2ccccc2NN 271570a_100011216325_100000241748 [0,1,1,0,0,0|1,0,1]=4 1883 B17R2.8831 Cc1ccc(c(c1)Cl)c2ccccc2C=O 271570a_100000740022_100011263221 [0,1,1,0,0,0|2,0,0]=4 1884 B17R2.8831 Cc1ccc(c(c1)Cl)c2ccccc2C=O 271570a_100011218894_100000211189 [0,1,1,0,0,0|2,0,0]=4 1885 B17R2.8831 Cc1ccc(c(c1)Cl)c2ccccc2CN 271570a_100011218894_100000689332 [0,1,1,0,0,0|1,0,1]=4 1886 B17R2.8831 Cc1ccc(c(c1)Cl)c2ccccc2CN 271570a_100020632975_100011263221 [0,1,1,0,0,0|1,0,1]=4 1887 B17R2.8831 Cc1ccc(c(c1)Cl)c2ccccc2NN 271570a_100011218894_100000241748 [0,1,1,0,0,0|2,0,0]=4 1888 B17R2.8831 Cc1ccc(c(c1)F)c2ccccc2C=O 271570a_100000740022_100011216119 [0,1,1,0,0,0|2,0,0]=4 1889 B17R2.8831 Cc1ccc(c(c1)F)c2ccccc2C=O 271570a_100011219514_100000211189 [0,1,1,0,0,0|2,0,0]=4 1890 B17R2.8831 Cc1ccc(c(c1)F)c2ccccc2CN 271570a_100011219514_100000689332 [0,1,1,0,0,0|1,0,1]=4 1891 B17R2.8831 Cc1ccc(c(c1)F)c2ccccc2CN 271570a_100020632975_100011216119 [0,1,1,0,0,0|1,0,1]=4 1892 B17R2.8831 Cc1ccc(c(c1)F)c2ccccc2NN 271570a_100011219514_100000241748 [0,1,1,0,0,0|2,0,0]=4 1893 B17R2.8831 Cc1ccc(c(c1)N)c2ccccc2C=O 271570a_100000068089_100000211189 [0,1,1,0,0,0|2,0,0]=4 1894 B17R2.8831 Cc1ccc(c(c1)N)c2ccccc2C=O 271570a_100000740022_100011216686 [0,1,1,0,0,0|2,0,0]=4 1895 B17R2.8831 Cc1ccc(c(c1)N)c2ccccc2CN 271570a_100000068089_100000689332 [0,1,1,0,0,0|1,0,1]=4 1896 B17R2.8831 Cc1ccc(c(c1)N)c2ccccc2CN 271570a_100020632975_100011216686 [0,1,1,0,0,0|1,0,1]=4 1897 B17R2.8831 Cc1ccc(c(c1)N)c2ccccc2NN 271570a_100000068089_100000241748 [0,1,1,0,0,0|2,0,0]=4 1898 B17R2.8831 Cc1ccc(c(c1)O)c2ccccc2C=O 271570a_100000740022_100012002257 [0,1,1,0,0,0|2,0,0]=4 1899 B17R2.8831 Cc1ccc(c(c1)O)c2ccccc2CN 271570a_100020632975_100012002257 [0,1,1,0,0,0|1,0,1]=4 1900 B17R2.8831 NCc1ccccc1c2ccc(cc2Br)Br 271570a_100020632975_100011484698 [0,1,1,0,0,0|1,0,1]=4 1901 B17R2.8831 NCc1ccccc1c2ccc(cc2Br)Cl 271570a_100020632975_100011219703 [0,1,1,0,0,0|1,0,1]=4 1902 B17R2.8831 NCc1ccccc1c2ccc(cc2Br)F 271570a_100020632975_100011217111 [0,1,1,0,0,0|1,0,1]=4 1903 B17R2.8831 NCc1ccccc1c2ccc(cc2Br)N 271570a_100020632975_100000750458 [0,1,1,0,0,0|1,0,1]=4 1904 B17R2.8831 NCc1ccccc1c2ccc(cc2Br)O 271570a_100020632975_100000701344 [0,1,1,0,0,0|1,0,1]=4 1905 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)Br 271570a_100020632975_100011216062 [0,1,1,0,0,0|1,0,1]=4 1906 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)Cl 271570a_100012352019_100000689332 [0,1,1,0,0,0|1,0,1]=4 1907 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)Cl 271570a_100020632975_100000699841 [0,1,1,0,0,0|1,0,1]=4 1908 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)F 271570a_100000693062_100000689332 [0,1,1,0,0,0|1,0,1]=4 1909 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)F 271570a_100020632975_100000733362 [0,1,1,0,0,0|1,0,1]=4 1910 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)N 271570a_100010211349_100000689332 [0,1,1,0,0,0|1,0,1]=4 1911 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)N 271570a_100020632975_100000761885 [0,1,1,0,0,0|1,0,1]=4 1912 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)O 271570a_100000079644_100000689332 [0,1,1,0,0,0|1,0,1]=4 1913 B17R2.8831 NCc1ccccc1c2ccc(cc2Cl)O 271570a_100020632975_100000047559 [0,1,1,0,0,0|1,0,1]=4 1914 B17R2.8831 NCc1ccccc1c2ccc(cc2F)Br 271570a_100020632975_100009814013 [0,1,1,0,0,0|1,0,1]=4 1915 B17R2.8831 NCc1ccccc1c2ccc(cc2F)Cl 271570a_100011263225_100000689332 [0,1,1,0,0,0|1,0,1]=4 1916 B17R2.8831 NCc1ccccc1c2ccc(cc2F)Cl 271570a_100020632975_100011216042 [0,1,1,0,0,0|1,0,1]=4 1917 B17R2.8831 NCc1ccccc1c2ccc(cc2F)F 271570a_100000693140_100000689332 [0,1,1,0,0,0|1,0,1]=4 1918 B17R2.8831 NCc1ccccc1c2ccc(cc2F)F 271570a_100020632975_100000750030 [0,1,1,0,0,0|1,0,1]=4 1919 B17R2.8831 NCc1ccccc1c2ccc(cc2F)I 271570a_200000037646_100000689332 [0,1,1,0,0,0|1,0,1]=4 1920 B17R2.8831 NCc1ccccc1c2ccc(cc2F)N 271570a_100000691922_100000689332 [0,1,1,0,0,0|1,0,1]=4 1921 B17R2.8831 NCc1ccccc1c2ccc(cc2F)N 271570a_100020632975_100011356925 [0,1,1,0,0,0|1,0,1]=4 1922 B17R2.8831 NCc1ccccc1c2ccc(cc2F)O 271570a_100009854227_100000689332 [0,1,1,0,0,0|1,0,1]=4 1923 B17R2.8831 NCc1ccccc1c2ccc(cc2F)O 271570a_100020632975_100000755031 [0,1,1,0,0,0|1,0,1]=4 1924 B17R2.8831 NCc1ccccc1c2ccc(cc2N)Br 271570a_100020632975_100000743836 [0,1,1,0,0,0|1,0,1]=4 1925 B17R2.8831 NCc1ccccc1c2ccc(cc2N)Cl 271570a_100010243654_100000689332 [0,1,1,0,0,0|1,0,1]=4 1926 B17R2.8831 NCc1ccccc1c2ccc(cc2N)Cl 271570a_100020632975_100000761886 [0,1,1,0,0,0|1,0,1]=4 1927 B17R2.8831 NCc1ccccc1c2ccc(cc2N)F 271570a_100010254564_100000689332 [0,1,1,0,0,0|1,0,1]=4 1928 B17R2.8831 NCc1ccccc1c2ccc(cc2N)F 271570a_100020632975_100011218093 [0,1,1,0,0,0|1,0,1]=4 1929 B17R2.8831 NCc1ccccc1c2ccc(cc2N)N 271570a_100020632975_200012175722 [0,1,1,0,0,0|1,0,1]=4 1930 B17R2.8831 NCc1ccccc1c2ccc(cc2N)O 271570a_100020632975_100011999798 [0,1,1,0,0,0|1,0,1]=4 1931 B17R2.8831 NCc1ccccc1c2ccc(cc2O)Br 271570a_100020632975_100012344904 [0,1,1,0,0,0|1,0,1]=4 1932 B17R2.8831 NCc1ccccc1c2ccc(cc2O)Cl 271570a_100010081499_100000689332 [0,1,1,0,0,0|1,0,1]=4 1933 B17R2.8831 NCc1ccccc1c2ccc(cc2O)Cl 271570a_100020632975_100000050036 [0,1,1,0,0,0|1,0,1]=4 1934 B17R2.8831 NCc1ccccc1c2ccc(cc2O)F 271570a_100010081493_100000689332 [0,1,1,0,0,0|1,0,1]=4 1935 B17R2.8831 NCc1ccccc1c2ccc(cc2O)F 271570a_100020632975_100000690578 [0,1,1,0,0,0|1,0,1]=4 1936 B17R2.8831 NCc1ccccc1c2ccc(cc2O)O 271570a_100020632975_100009813921 [0,1,1,0,0,0|1,0,1]=4 1937 B17R2.8831 NNc1ccccc1c2ccc(cc2Cl)Cl 271570a_100012352019_100000241748 [0,1,1,0,0,0|2,0,0]=4 1938 B17R2.8831 NNc1ccccc1c2ccc(cc2Cl)F 271570a_100000693062_100000241748 [0,1,1,0,0,0|2,0,0]=4 1939 B17R2.8831 NNc1ccccc1c2ccc(cc2Cl)N 271570a_100010211349_100000241748 [0,1,1,0,0,0|2,0,0]=4 1940 B17R2.8831 NNc1ccccc1c2ccc(cc2Cl)O 271570a_100000079644_100000241748 [0,1,1,0,0,0|2,0,0]=4 1941 B17R2.8831 NNc1ccccc1c2ccc(cc2F)Cl 271570a_100011263225_100000241748 [0,1,1,0,0,0|2,0,0]=4 1942 B17R2.8831 NNc1ccccc1c2ccc(cc2F)F 271570a_100000693140_100000241748 [0,1,1,0,0,0|2,0,0]=4 1943 B17R2.8831 NNc1ccccc1c2ccc(cc2F)I 271570a_200000037646_100000241748 [0,1,1,0,0,0|2,0,0]=4 1944 B17R2.8831 NNc1ccccc1c2ccc(cc2F)N 271570a_100000691922_100000241748 [0,1,1,0,0,0|2,0,0]=4 1945 B17R2.8831 NNc1ccccc1c2ccc(cc2F)O 271570a_100009854227_100000241748 [0,1,1,0,0,0|2,0,0]=4 1946 B17R2.8831 NNc1ccccc1c2ccc(cc2N)Cl 271570a_100010243654_100000241748 [0,1,1,0,0,0|2,0,0]=4 1947 B17R2.8831 NNc1ccccc1c2ccc(cc2N)F 271570a_100010254564_100000241748 [0,1,1,0,0,0|2,0,0]=4 1948 B17R2.8831 NNc1ccccc1c2ccc(cc2O)Cl 271570a_100010081499_100000241748 [0,1,1,0,0,0|2,0,0]=4 1949 B17R2.8831 NNc1ccccc1c2ccc(cc2O)F 271570a_100010081493_100000241748 [0,1,1,0,0,0|2,0,0]=4 1950 B17R2.8831 Nc1cc(ccc1c2ccccc2C=O)Br 271570a_100000740022_100000743836 [0,1,1,0,0,0|2,0,0]=4 1951 B17R2.8831 Nc1cc(ccc1c2ccccc2C=O)Cl 271570a_100000740022_100000761886 [0,1,1,0,0,0|2,0,0]=4 1952 B17R2.8831 Nc1cc(ccc1c2ccccc2C=O)Cl 271570a_100010243654_100000211189 [0,1,1,0,0,0|2,0,0]=4 1953 B17R2.8831 Nc1cc(ccc1c2ccccc2C=O)F 271570a_100000740022_100011218093 [0,1,1,0,0,0|2,0,0]=4 1954 B17R2.8831 Nc1cc(ccc1c2ccccc2C=O)F 271570a_100010254564_100000211189 [0,1,1,0,0,0|2,0,0]=4 1955 B17R2.8831 Nc1cc(ccc1c2ccccc2C=O)O 271570a_100000740022_100011999798 [0,1,1,0,0,0|2,0,0]=4 1956 B17R2.8831 Nc1ccc(c(c1)Br)c2ccccc2C=O 271570a_100000740022_100000750458 [0,1,1,0,0,0|2,0,0]=4 1957 B17R2.8831 Nc1ccc(c(c1)Cl)c2ccccc2C=O 271570a_100000740022_100000761885 [0,1,1,0,0,0|2,0,0]=4 1958 B17R2.8831 Nc1ccc(c(c1)Cl)c2ccccc2C=O 271570a_100010211349_100000211189 [0,1,1,0,0,0|2,0,0]=4 1959 B17R2.8831 Nc1ccc(c(c1)F)c2ccccc2C=O 271570a_100000691922_100000211189 [0,1,1,0,0,0|2,0,0]=4 1960 B17R2.8831 Nc1ccc(c(c1)F)c2ccccc2C=O 271570a_100000740022_100011356925 [0,1,1,0,0,0|2,0,0]=4 1961 B17R2.8831 Nc1ccc(c(c1)N)c2ccccc2C=O 271570a_100000740022_200012175722 [0,1,1,0,0,0|2,0,0]=4 1962 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Br)Br 271570a_100000740022_100011484698 [0,1,1,0,0,0|2,0,0]=4 1963 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Br)Cl 271570a_100000740022_100011219703 [0,1,1,0,0,0|2,0,0]=4 1964 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Br)F 271570a_100000740022_100011217111 [0,1,1,0,0,0|2,0,0]=4 1965 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Br)O 271570a_100000740022_100000701344 [0,1,1,0,0,0|2,0,0]=4 1966 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Cl)Br 271570a_100000740022_100011216062 [0,1,1,0,0,0|2,0,0]=4 1967 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Cl)Cl 271570a_100000740022_100000699841 [0,1,1,0,0,0|2,0,0]=4 1968 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Cl)Cl 271570a_100012352019_100000211189 [0,1,1,0,0,0|2,0,0]=4 1969 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Cl)F 271570a_100000693062_100000211189 [0,1,1,0,0,0|2,0,0]=4 1970 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Cl)F 271570a_100000740022_100000733362 [0,1,1,0,0,0|2,0,0]=4 1971 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Cl)O 271570a_100000079644_100000211189 [0,1,1,0,0,0|2,0,0]=4 1972 B17R2.8831 O=Cc1ccccc1c2ccc(cc2Cl)O 271570a_100000740022_100000047559 [0,1,1,0,0,0|2,0,0]=4 1973 B17R2.8831 O=Cc1ccccc1c2ccc(cc2F)Br 271570a_100000740022_100009814013 [0,1,1,0,0,0|2,0,0]=4 1974 B17R2.8831 O=Cc1ccccc1c2ccc(cc2F)Cl 271570a_100000740022_100011216042 [0,1,1,0,0,0|2,0,0]=4 1975 B17R2.8831 O=Cc1ccccc1c2ccc(cc2F)Cl 271570a_100011263225_100000211189 [0,1,1,0,0,0|2,0,0]=4 1976 B17R2.8831 O=Cc1ccccc1c2ccc(cc2F)F 271570a_100000693140_100000211189 [0,1,1,0,0,0|2,0,0]=4 1977 B17R2.8831 O=Cc1ccccc1c2ccc(cc2F)F 271570a_100000740022_100000750030 [0,1,1,0,0,0|2,0,0]=4 1978 B17R2.8831 O=Cc1ccccc1c2ccc(cc2F)I 271570a_200000037646_100000211189 [0,1,1,0,0,0|2,0,0]=4 1979 B17R2.8831 O=Cc1ccccc1c2ccc(cc2F)O 271570a_100000740022_100000755031 [0,1,1,0,0,0|2,0,0]=4 1980 B17R2.8831 O=Cc1ccccc1c2ccc(cc2F)O 271570a_100009854227_100000211189 [0,1,1,0,0,0|2,0,0]=4 1981 B17R2.8831 O=Cc1ccccc1c2ccc(cc2O)Br 271570a_100000740022_100012344904 [0,1,1,0,0,0|2,0,0]=4 1982 B17R2.8831 O=Cc1ccccc1c2ccc(cc2O)Cl 271570a_100000740022_100000050036 [0,1,1,0,0,0|2,0,0]=4 1983 B17R2.8831 O=Cc1ccccc1c2ccc(cc2O)Cl 271570a_100010081499_100000211189 [0,1,1,0,0,0|2,0,0]=4 1984 B17R2.8831 O=Cc1ccccc1c2ccc(cc2O)F 271570a_100000740022_100000690578 [0,1,1,0,0,0|2,0,0]=4 1985 B17R2.8831 O=Cc1ccccc1c2ccc(cc2O)F 271570a_100010081493_100000211189 [0,1,1,0,0,0|2,0,0]=4 1986 B17R2.8831 O=Cc1ccccc1c2ccc(cc2O)O 271570a_100000740022_100009813921 [0,1,1,0,0,0|2,0,0]=4 1987 B17R2.8833 C=Cc1ccccc1c2cc(ccc2Br)F 271570a_100000037480_100011217576 [0,1,1,0,0,0|2,0,0]=4 1988 B17R2.8833 C=Cc1ccccc1c2cc(ccc2Br)N 271570a_100000037480_100000750459 [0,1,1,0,0,0|2,0,0]=4 1989 B17R2.8833 C=Cc1ccccc1c2cc(ccc2Br)O 271570a_100000037480_100012339312 [0,1,1,0,0,0|2,0,0]=4 1990 B17R2.8833 C=Cc1ccccc1c2cc(ccc2C)C 271570a_100000037480_100000210833 [0,1,1,0,0,0|1,0,1]=4 1991 B17R2.8833 C=Cc1ccccc1c2cc(ccc2C)Cl 271570a_100000037480_100011263213 [0,1,1,0,0,0|1,0,1]=4 1992 B17R2.8833 C=Cc1ccccc1c2cc(ccc2C)F 271570a_100000037480_100011218078 [0,1,1,0,0,0|1,0,1]=4 1993 B17R2.8833 C=Cc1ccccc1c2cc(ccc2C)N 271570a_100000037480_100000736455 [0,1,1,0,0,0|1,0,1]=4 1994 B17R2.8833 C=Cc1ccccc1c2cc(ccc2C)O 271570a_100000037480_100011380479 [0,1,1,0,0,0|1,0,1]=4 1995 B17R2.8833 C=Cc1ccccc1c2cc(ccc2Cl)C 271570a_100000037480_100012356289 [0,1,1,0,0,0|2,0,0]=4 1996 B17R2.8833 C=Cc1ccccc1c2cc(ccc2Cl)F 271570a_100000037480_100011217299 [0,1,1,0,0,0|2,0,0]=4 1997 B17R2.8833 C=Cc1ccccc1c2cc(ccc2Cl)N 271570a_100000037480_100012360549 [0,1,1,0,0,0|2,0,0]=4 1998 B17R2.8833 C=Cc1ccccc1c2cc(ccc2Cl)O 271570a_100000037480_100000049588 [0,1,1,0,0,0|2,0,0]=4 1999 B17R2.8833 C=Cc1ccccc1c2cc(ccc2F)Br 271570a_100000037480_100011217312 [0,1,1,0,0,0|2,0,0]=4 2000 B17R2.8833 C=Cc1ccccc1c2cc(ccc2F)C 271570a_100000037480_100000736223 [0,1,1,0,0,0|2,0,0]=4 2001 B17R2.8833 C=Cc1ccccc1c2cc(ccc2F)Cl 271570a_100000037480_100011218116 [0,1,1,0,0,0|2,0,0]=4 2002 B17R2.8833 C=Cc1ccccc1c2cc(ccc2F)F 271570a_100000037480_100000750033 [0,1,1,0,0,0|2,0,0]=4 2003 B17R2.8833 C=Cc1ccccc1c2cc(ccc2F)N 271570a_100000037480_100000760356 [0,1,1,0,0,0|2,0,0]=4 2004 B17R2.8833 C=Cc1ccccc1c2cc(ccc2F)O 271570a_100000037480_100000693481 [0,1,1,0,0,0|2,0,0]=4 2005 B17R2.8833 C=Cc1ccccc1c2cc(ccc2N)Br 271570a_100000037480_100000187925 [0,1,1,0,0,0|2,0,0]=4 2006 B17R2.8833 C=Cc1ccccc1c2cc(ccc2N)C 271570a_100000037480_100000210942 [0,1,1,0,0,0|2,0,0]=4 2007 B17R2.8833 C=Cc1ccccc1c2cc(ccc2N)Cl 271570a_100000037480_100000761889 [0,1,1,0,0,0|2,0,0]=4 2008 B17R2.8833 C=Cc1ccccc1c2cc(ccc2N)F 271570a_100000037480_100000760547 [0,1,1,0,0,0|2,0,0]=4 2009 B17R2.8833 C=Cc1ccccc1c2cc(ccc2N)N 271570a_100000037480_100011534242 [0,1,1,0,0,0|2,0,0]=4 2010 B17R2.8833 C=Cc1ccccc1c2cc(ccc2N)O 271570a_100000037480_100012001276 [0,1,1,0,0,0|2,0,0]=4 2011 B17R2.8833 C=Cc1ccccc1c2cc(ccc2O)Br 271570a_100000037480_100012355227 [0,1,1,0,0,0|2,0,0]=4 2012 B17R2.8833 C=Cc1ccccc1c2cc(ccc2O)C 271570a_100000037480_100000765521 [0,1,1,0,0,0|2,0,0]=4 2013 B17R2.8833 C=Cc1ccccc1c2cc(ccc2O)Cl 271570a_100000037480_100011356953 [0,1,1,0,0,0|2,0,0]=4 2014 B17R2.8833 C=Cc1ccccc1c2cc(ccc2O)F 271570a_100000037480_100000211999 [0,1,1,0,0,0|2,0,0]=4 2015 B17R2.8833 C=Cc1ccccc1c2cc(ccc2O)N 271570a_100000037480_100011534360 [0,1,1,0,0,0|2,0,0]=4 2016 B17R2.8833 C=Cc1ccccc1c2cc(ccc2O)O 271570a_100000037480_100009813629 [0,1,1,0,0,0|2,0,0]=4 2017 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)Br 271570a_100000740022_100012353751 [0,1,1,0,0,0|2,0,0]=4 2018 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)C 271570a_100000695611_100000211189 [0,1,1,0,0,0|1,0,1]=4 2019 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)C 271570a_100000740022_100000210833 [0,1,1,0,0,0|1,0,1]=4 2020 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)Cl 271570a_100000740022_100012356289 [0,1,1,0,0,0|2,0,0]=4 2021 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)Cl 271570a_100011356805_100000211189 [0,1,1,0,0,0|2,0,0]=4 2022 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)F 271570a_100000740022_100000736223 [0,1,1,0,0,0|2,0,0]=4 2023 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)F 271570a_100011263228_100000211189 [0,1,1,0,0,0|2,0,0]=4 2024 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)N 271570a_100000068086_100000211189 [0,1,1,0,0,0|2,0,0]=4 2025 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)N 271570a_100000740022_100000210942 [0,1,1,0,0,0|2,0,0]=4 2026 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)O 271570a_100000740022_100000765521 [0,1,1,0,0,0|2,0,0]=4 2027 B17R2.8833 Cc1ccc(c(c1)c2ccccc2C=O)O 271570a_100009873282_100000211189 [0,1,1,0,0,0|2,0,0]=4 2028 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)Br 271570a_100020632975_100012353751 [0,1,1,0,0,0|1,0,1]=4 2029 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)C 271570a_100000695611_100000689332 [0,1,1,0,0,0|0,0,2]=4 2030 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)C 271570a_100020632975_100000210833 [0,1,1,0,0,0|0,0,2]=4 2031 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)Cl 271570a_100011356805_100000689332 [0,1,1,0,0,0|1,0,1]=4 2032 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)Cl 271570a_100020632975_100012356289 [0,1,1,0,0,0|1,0,1]=4 2033 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)F 271570a_100011263228_100000689332 [0,1,1,0,0,0|1,0,1]=4 2034 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)F 271570a_100020632975_100000736223 [0,1,1,0,0,0|1,0,1]=4 2035 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)N 271570a_100000068086_100000689332 [0,1,1,0,0,0|1,0,1]=4 2036 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)N 271570a_100020632975_100000210942 [0,1,1,0,0,0|1,0,1]=4 2037 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)O 271570a_100009873282_100000689332 [0,1,1,0,0,0|1,0,1]=4 2038 B17R2.8833 Cc1ccc(c(c1)c2ccccc2CN)O 271570a_100020632975_100000765521 [0,1,1,0,0,0|1,0,1]=4 2039 B17R2.8833 Cc1ccc(c(c1)c2ccccc2NN)C 271570a_100000695611_100000241748 [0,1,1,0,0,0|1,0,1]=4 2040 B17R2.8833 Cc1ccc(c(c1)c2ccccc2NN)Cl 271570a_100011356805_100000241748 [0,1,1,0,0,0|2,0,0]=4 2041 B17R2.8833 Cc1ccc(c(c1)c2ccccc2NN)F 271570a_100011263228_100000241748 [0,1,1,0,0,0|2,0,0]=4 2042 B17R2.8833 Cc1ccc(c(c1)c2ccccc2NN)N 271570a_100000068086_100000241748 [0,1,1,0,0,0|2,0,0]=4 2043 B17R2.8833 Cc1ccc(c(c1)c2ccccc2NN)O 271570a_100009873282_100000241748 [0,1,1,0,0,0|2,0,0]=4 2044 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)Br 271570a_100000740022_100011344865 [0,1,1,0,0,0|1,0,1]=4 2045 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)Cl 271570a_100000740022_100011263213 [0,1,1,0,0,0|1,0,1]=4 2046 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)Cl 271570a_100012343301_100000211189 [0,1,1,0,0,0|1,0,1]=4 2047 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)F 271570a_100000740022_100011218078 [0,1,1,0,0,0|1,0,1]=4 2048 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)F 271570a_100011219541_100000211189 [0,1,1,0,0,0|1,0,1]=4 2049 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)N 271570a_100000041745_100000211189 [0,1,1,0,0,0|1,0,1]=4 2050 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)N 271570a_100000740022_100000736455 [0,1,1,0,0,0|1,0,1]=4 2051 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)O 271570a_100000740022_100011380479 [0,1,1,0,0,0|1,0,1]=4 2052 B17R2.8833 Cc1ccc(cc1c2ccccc2C=O)O 271570a_100010081663_100000211189 [0,1,1,0,0,0|1,0,1]=4 2053 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)Br 271570a_100020632975_100011344865 [0,1,1,0,0,0|0,0,2]=4 2054 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)Cl 271570a_100012343301_100000689332 [0,1,1,0,0,0|0,0,2]=4 2055 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)Cl 271570a_100020632975_100011263213 [0,1,1,0,0,0|0,0,2]=4 2056 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)F 271570a_100011219541_100000689332 [0,1,1,0,0,0|0,0,2]=4 2057 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)F 271570a_100020632975_100011218078 [0,1,1,0,0,0|0,0,2]=4 2058 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)N 271570a_100000041745_100000689332 [0,1,1,0,0,0|0,0,2]=4 2059 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)N 271570a_100020632975_100000736455 [0,1,1,0,0,0|0,0,2]=4 2060 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)O 271570a_100010081663_100000689332 [0,1,1,0,0,0|0,0,2]=4 2061 B17R2.8833 Cc1ccc(cc1c2ccccc2CN)O 271570a_100020632975_100011380479 [0,1,1,0,0,0|0,0,2]=4 2062 B17R2.8833 Cc1ccc(cc1c2ccccc2NN)Cl 271570a_100012343301_100000241748 [0,1,1,0,0,0|1,0,1]=4 2063 B17R2.8833 Cc1ccc(cc1c2ccccc2NN)F 271570a_100011219541_100000241748 [0,1,1,0,0,0|1,0,1]=4 2064 B17R2.8833 Cc1ccc(cc1c2ccccc2NN)N 271570a_100000041745_100000241748 [0,1,1,0,0,0|1,0,1]=4 2065 B17R2.8833 Cc1ccc(cc1c2ccccc2NN)O 271570a_100010081663_100000241748 [0,1,1,0,0,0|1,0,1]=4 2066 B17R2.8833 NCc1ccccc1c2cc(ccc2Br)Br 271570a_100020632975_100011483371 [0,1,1,0,0,0|1,0,1]=4 2067 B17R2.8833 NCc1ccccc1c2cc(ccc2Br)Cl 271570a_100020632975_100012339723 [0,1,1,0,0,0|1,0,1]=4 2068 B17R2.8833 NCc1ccccc1c2cc(ccc2Br)F 271570a_100020632975_100011217576 [0,1,1,0,0,0|1,0,1]=4 2069 B17R2.8833 NCc1ccccc1c2cc(ccc2Br)N 271570a_100020632975_100000750459 [0,1,1,0,0,0|1,0,1]=4 2070 B17R2.8833 NCc1ccccc1c2cc(ccc2Br)O 271570a_100020632975_100012339312 [0,1,1,0,0,0|1,0,1]=4 2071 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)Br 271570a_100020632975_100011772130 [0,1,1,0,0,0|1,0,1]=4 2072 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)Cl 271570a_100011197477_100000689332 [0,1,1,0,0,0|1,0,1]=4 2073 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)Cl 271570a_100020632975_100000707729 [0,1,1,0,0,0|1,0,1]=4 2074 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)F 271570a_100011356765_100000689332 [0,1,1,0,0,0|1,0,1]=4 2075 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)F 271570a_100020632975_100011217299 [0,1,1,0,0,0|1,0,1]=4 2076 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)N 271570a_100020632975_100012360549 [0,1,1,0,0,0|1,0,1]=4 2077 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)N 271570a_200010284758_100000689332 [0,1,1,0,0,0|1,0,1]=4 2078 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)O 271570a_100010080142_100000689332 [0,1,1,0,0,0|1,0,1]=4 2079 B17R2.8833 NCc1ccccc1c2cc(ccc2Cl)O 271570a_100020632975_100000049588 [0,1,1,0,0,0|1,0,1]=4 2080 B17R2.8833 NCc1ccccc1c2cc(ccc2F)Br 271570a_100020632975_100011217312 [0,1,1,0,0,0|1,0,1]=4 2081 B17R2.8833 NCc1ccccc1c2cc(ccc2F)Cl 271570a_100011295458_100000689332 [0,1,1,0,0,0|1,0,1]=4 2082 B17R2.8833 NCc1ccccc1c2cc(ccc2F)Cl 271570a_100020632975_100011218116 [0,1,1,0,0,0|1,0,1]=4 2083 B17R2.8833 NCc1ccccc1c2cc(ccc2F)F 271570a_100011215768_100000689332 [0,1,1,0,0,0|1,0,1]=4 2084 B17R2.8833 NCc1ccccc1c2cc(ccc2F)F 271570a_100020632975_100000750033 [0,1,1,0,0,0|1,0,1]=4 2085 B17R2.8833 NCc1ccccc1c2cc(ccc2F)I 271570a_100021016697_100000689332 [0,1,1,0,0,0|1,0,1]=4 2086 B17R2.8833 NCc1ccccc1c2cc(ccc2F)N 271570a_100010082978_100000689332 [0,1,1,0,0,0|1,0,1]=4 2087 B17R2.8833 NCc1ccccc1c2cc(ccc2F)N 271570a_100020632975_100000760356 [0,1,1,0,0,0|1,0,1]=4 2088 B17R2.8833 NCc1ccccc1c2cc(ccc2F)O 271570a_100000117627_100000689332 [0,1,1,0,0,0|1,0,1]=4 2089 B17R2.8833 NCc1ccccc1c2cc(ccc2F)O 271570a_100020632975_100000693481 [0,1,1,0,0,0|1,0,1]=4 2090 B17R2.8833 NCc1ccccc1c2cc(ccc2N)Br 271570a_100020632975_100000187925 [0,1,1,0,0,0|1,0,1]=4 2091 B17R2.8833 NCc1ccccc1c2cc(ccc2N)Cl 271570a_100010175883_100000689332 [0,1,1,0,0,0|1,0,1]=4 2092 B17R2.8833 NCc1ccccc1c2cc(ccc2N)Cl 271570a_100020632975_100000761889 [0,1,1,0,0,0|1,0,1]=4 2093 B17R2.8833 NCc1ccccc1c2cc(ccc2N)F 271570a_100000094887_100000689332 [0,1,1,0,0,0|1,0,1]=4 2094 B17R2.8833 NCc1ccccc1c2cc(ccc2N)F 271570a_100020632975_100000760547 [0,1,1,0,0,0|1,0,1]=4 2095 B17R2.8833 NCc1ccccc1c2cc(ccc2N)N 271570a_100020632975_100011534242 [0,1,1,0,0,0|1,0,1]=4 2096 B17R2.8833 NCc1ccccc1c2cc(ccc2N)O 271570a_100020632975_100012001276 [0,1,1,0,0,0|1,0,1]=4 2097 B17R2.8833 NCc1ccccc1c2cc(ccc2O)Br 271570a_100020632975_100012355227 [0,1,1,0,0,0|1,0,1]=4 2098 B17R2.8833 NCc1ccccc1c2cc(ccc2O)Cl 271570a_100010081686_100000689332 [0,1,1,0,0,0|1,0,1]=4 2099 B17R2.8833 NCc1ccccc1c2cc(ccc2O)Cl 271570a_100020632975_100011356953 [0,1,1,0,0,0|1,0,1]=4 2100 B17R2.8833 NCc1ccccc1c2cc(ccc2O)F 271570a_100010081594_100000689332 [0,1,1,0,0,0|1,0,1]=4 2101 B17R2.8833 NCc1ccccc1c2cc(ccc2O)F 271570a_100020632975_100000211999 [0,1,1,0,0,0|1,0,1]=4 2102 B17R2.8833 NCc1ccccc1c2cc(ccc2O)N 271570a_100020632975_100011534360 [0,1,1,0,0,0|1,0,1]=4 2103 B17R2.8833 NCc1ccccc1c2cc(ccc2O)O 271570a_100020632975_100009813629 [0,1,1,0,0,0|1,0,1]=4 2104 B17R2.8833 NNc1ccccc1c2cc(ccc2Cl)Cl 271570a_100011197477_100000241748 [0,1,1,0,0,0|2,0,0]=4 2105 B17R2.8833 NNc1ccccc1c2cc(ccc2Cl)F 271570a_100011356765_100000241748 [0,1,1,0,0,0|2,0,0]=4 2106 B17R2.8833 NNc1ccccc1c2cc(ccc2Cl)N 271570a_200010284758_100000241748 [0,1,1,0,0,0|2,0,0]=4 2107 B17R2.8833 NNc1ccccc1c2cc(ccc2Cl)O 271570a_100010080142_100000241748 [0,1,1,0,0,0|2,0,0]=4 2108 B17R2.8833 NNc1ccccc1c2cc(ccc2F)Cl 271570a_100011295458_100000241748 [0,1,1,0,0,0|2,0,0]=4 2109 B17R2.8833 NNc1ccccc1c2cc(ccc2F)F 271570a_100011215768_100000241748 [0,1,1,0,0,0|2,0,0]=4 2110 B17R2.8833 NNc1ccccc1c2cc(ccc2F)I 271570a_100021016697_100000241748 [0,1,1,0,0,0|2,0,0]=4 2111 B17R2.8833 NNc1ccccc1c2cc(ccc2F)N 271570a_100010082978_100000241748 [0,1,1,0,0,0|2,0,0]=4 2112 B17R2.8833 NNc1ccccc1c2cc(ccc2F)O 271570a_100000117627_100000241748 [0,1,1,0,0,0|2,0,0]=4 2113 B17R2.8833 NNc1ccccc1c2cc(ccc2N)Cl 271570a_100010175883_100000241748 [0,1,1,0,0,0|2,0,0]=4 2114 B17R2.8833 NNc1ccccc1c2cc(ccc2N)F 271570a_100000094887_100000241748 [0,1,1,0,0,0|2,0,0]=4 2115 B17R2.8833 NNc1ccccc1c2cc(ccc2O)Cl 271570a_100010081686_100000241748 [0,1,1,0,0,0|2,0,0]=4 2116 B17R2.8833 NNc1ccccc1c2cc(ccc2O)F 271570a_100010081594_100000241748 [0,1,1,0,0,0|2,0,0]=4 2117 B17R2.8833 Nc1ccc(c(c1)c2ccccc2C=O)Br 271570a_100000740022_100000750459 [0,1,1,0,0,0|2,0,0]=4 2118 B17R2.8833 Nc1ccc(c(c1)c2ccccc2C=O)Cl 271570a_100000740022_100012360549 [0,1,1,0,0,0|2,0,0]=4 2119 B17R2.8833 Nc1ccc(c(c1)c2ccccc2C=O)Cl 271570a_200010284758_100000211189 [0,1,1,0,0,0|2,0,0]=4 2120 B17R2.8833 Nc1ccc(c(c1)c2ccccc2C=O)F 271570a_100000740022_100000760356 [0,1,1,0,0,0|2,0,0]=4 2121 B17R2.8833 Nc1ccc(c(c1)c2ccccc2C=O)F 271570a_100010082978_100000211189 [0,1,1,0,0,0|2,0,0]=4 2122 B17R2.8833 Nc1ccc(c(c1)c2ccccc2C=O)N 271570a_100000740022_100011534242 [0,1,1,0,0,0|2,0,0]=4 2123 B17R2.8833 Nc1ccc(c(c1)c2ccccc2C=O)O 271570a_100000740022_100011534360 [0,1,1,0,0,0|2,0,0]=4 2124 B17R2.8833 Nc1ccc(cc1c2ccccc2C=O)Br 271570a_100000740022_100000187925 [0,1,1,0,0,0|2,0,0]=4 2125 B17R2.8833 Nc1ccc(cc1c2ccccc2C=O)Cl 271570a_100000740022_100000761889 [0,1,1,0,0,0|2,0,0]=4 2126 B17R2.8833 Nc1ccc(cc1c2ccccc2C=O)Cl 271570a_100010175883_100000211189 [0,1,1,0,0,0|2,0,0]=4 2127 B17R2.8833 Nc1ccc(cc1c2ccccc2C=O)F 271570a_100000094887_100000211189 [0,1,1,0,0,0|2,0,0]=4 2128 B17R2.8833 Nc1ccc(cc1c2ccccc2C=O)F 271570a_100000740022_100000760547 [0,1,1,0,0,0|2,0,0]=4 2129 B17R2.8833 Nc1ccc(cc1c2ccccc2C=O)O 271570a_100000740022_100012001276 [0,1,1,0,0,0|2,0,0]=4 2130 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Br)Br 271570a_100000740022_100011483371 [0,1,1,0,0,0|2,0,0]=4 2131 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Br)Cl 271570a_100000740022_100012339723 [0,1,1,0,0,0|2,0,0]=4 2132 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Br)F 271570a_100000740022_100011217576 [0,1,1,0,0,0|2,0,0]=4 2133 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Br)O 271570a_100000740022_100012339312 [0,1,1,0,0,0|2,0,0]=4 2134 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Cl)Br 271570a_100000740022_100011772130 [0,1,1,0,0,0|2,0,0]=4 2135 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Cl)Cl 271570a_100000740022_100000707729 [0,1,1,0,0,0|2,0,0]=4 2136 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Cl)Cl 271570a_100011197477_100000211189 [0,1,1,0,0,0|2,0,0]=4 2137 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Cl)F 271570a_100000740022_100011217299 [0,1,1,0,0,0|2,0,0]=4 2138 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Cl)F 271570a_100011356765_100000211189 [0,1,1,0,0,0|2,0,0]=4 2139 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Cl)O 271570a_100000740022_100000049588 [0,1,1,0,0,0|2,0,0]=4 2140 B17R2.8833 O=Cc1ccccc1c2cc(ccc2Cl)O 271570a_100010080142_100000211189 [0,1,1,0,0,0|2,0,0]=4 2141 B17R2.8833 O=Cc1ccccc1c2cc(ccc2F)Br 271570a_100000740022_100011217312 [0,1,1,0,0,0|2,0,0]=4 2142 B17R2.8833 O=Cc1ccccc1c2cc(ccc2F)Cl 271570a_100000740022_100011218116 [0,1,1,0,0,0|2,0,0]=4 2143 B17R2.8833 O=Cc1ccccc1c2cc(ccc2F)Cl 271570a_100011295458_100000211189 [0,1,1,0,0,0|2,0,0]=4 2144 B17R2.8833 O=Cc1ccccc1c2cc(ccc2F)F 271570a_100000740022_100000750033 [0,1,1,0,0,0|2,0,0]=4 2145 B17R2.8833 O=Cc1ccccc1c2cc(ccc2F)F 271570a_100011215768_100000211189 [0,1,1,0,0,0|2,0,0]=4 2146 B17R2.8833 O=Cc1ccccc1c2cc(ccc2F)I 271570a_100021016697_100000211189 [0,1,1,0,0,0|2,0,0]=4 2147 B17R2.8833 O=Cc1ccccc1c2cc(ccc2F)O 271570a_100000117627_100000211189 [0,1,1,0,0,0|2,0,0]=4 2148 B17R2.8833 O=Cc1ccccc1c2cc(ccc2F)O 271570a_100000740022_100000693481 [0,1,1,0,0,0|2,0,0]=4 2149 B17R2.8833 O=Cc1ccccc1c2cc(ccc2O)Br 271570a_100000740022_100012355227 [0,1,1,0,0,0|2,0,0]=4 2150 B17R2.8833 O=Cc1ccccc1c2cc(ccc2O)Cl 271570a_100000740022_100011356953 [0,1,1,0,0,0|2,0,0]=4 2151 B17R2.8833 O=Cc1ccccc1c2cc(ccc2O)Cl 271570a_100010081686_100000211189 [0,1,1,0,0,0|2,0,0]=4 2152 B17R2.8833 O=Cc1ccccc1c2cc(ccc2O)F 271570a_100000740022_100000211999 [0,1,1,0,0,0|2,0,0]=4 2153 B17R2.8833 O=Cc1ccccc1c2cc(ccc2O)F 271570a_100010081594_100000211189 [0,1,1,0,0,0|2,0,0]=4 2154 B17R2.8833 O=Cc1ccccc1c2cc(ccc2O)O 271570a_100000740022_100009813629 [0,1,1,0,0,0|2,0,0]=4 2155 B17R2.8844 C=Cc1ccccc1c2cccc(c2Br)O 271570a_100000037480_100010187914 [0,1,1,0,0,0|2,0,0]=4 2156 B17R2.8844 C=Cc1ccccc1c2cccc(c2C)C 271570a_100000037480_100011214922 [0,1,1,0,0,0|1,0,1]=4 2157 B17R2.8844 C=Cc1ccccc1c2cccc(c2C)Cl 271570a_100000037480_100000726075 [0,1,1,0,0,0|1,0,1]=4 2158 B17R2.8844 C=Cc1ccccc1c2cccc(c2C)F 271570a_100000037480_100011216893 [0,1,1,0,0,0|1,0,1]=4 2159 B17R2.8844 C=Cc1ccccc1c2cccc(c2C)N 271570a_100000037480_100000761887 [0,1,1,0,0,0|1,0,1]=4 2160 B17R2.8844 C=Cc1ccccc1c2cccc(c2C)O 271570a_100000037480_100012002258 [0,1,1,0,0,0|1,0,1]=4 2161 B17R2.8844 C=Cc1ccccc1c2cccc(c2Cl)C 271570a_100000037480_200012352035 [0,1,1,0,0,0|2,0,0]=4 2162 B17R2.8844 C=Cc1ccccc1c2cccc(c2Cl)F 271570a_100000037480_200010234923 [0,1,1,0,0,0|2,0,0]=4 2163 B17R2.8844 C=Cc1ccccc1c2cccc(c2Cl)O 271570a_100000037480_100000049636 [0,1,1,0,0,0|2,0,0]=4 2164 B17R2.8844 C=Cc1ccccc1c2cccc(c2F)Br 271570a_100000037480_100000702267 [0,1,1,0,0,0|2,0,0]=4 2165 B17R2.8844 C=Cc1ccccc1c2cccc(c2F)C 271570a_100000037480_100000717567 [0,1,1,0,0,0|2,0,0]=4 2166 B17R2.8844 C=Cc1ccccc1c2cccc(c2F)Cl 271570a_100000037480_100011217346 [0,1,1,0,0,0|2,0,0]=4 2167 B17R2.8844 C=Cc1ccccc1c2cccc(c2F)F 271570a_100000037480_100000694657 [0,1,1,0,0,0|2,0,0]=4 2168 B17R2.8844 C=Cc1ccccc1c2cccc(c2F)N 271570a_100000037480_100011935091 [0,1,1,0,0,0|2,0,0]=4 2169 B17R2.8844 C=Cc1ccccc1c2cccc(c2F)O 271570a_100000037480_100009817021 [0,1,1,0,0,0|2,0,0]=4 2170 B17R2.8844 C=Cc1ccccc1c2cccc(c2N)Br 271570a_100000037480_100010146558 [0,1,1,0,0,0|2,0,0]=4 2171 B17R2.8844 C=Cc1ccccc1c2cccc(c2N)C 271570a_100000037480_100011834072 [0,1,1,0,0,0|2,0,0]=4 2172 B17R2.8844 C=Cc1ccccc1c2cccc(c2N)Cl 271570a_100000037480_100010190421 [0,1,1,0,0,0|2,0,0]=4 2173 B17R2.8844 C=Cc1ccccc1c2cccc(c2N)F 271570a_100000037480_100000042321 [0,1,1,0,0,0|2,0,0]=4 2174 B17R2.8844 C=Cc1ccccc1c2cccc(c2N)N 271570a_100000037480_100015191791 [0,1,1,0,0,0|2,0,0]=4 2175 B17R2.8844 C=Cc1ccccc1c2cccc(c2N)O 271570a_100000037480_100011934926 [0,1,1,0,0,0|2,0,0]=4 2176 B17R2.8844 C=Cc1ccccc1c2cccc(c2O)Br 271570a_100000037480_100010084509 [0,1,1,0,0,0|2,0,0]=4 2177 B17R2.8844 C=Cc1ccccc1c2cccc(c2O)C 271570a_100000037480_100009817157 [0,1,1,0,0,0|2,0,0]=4 2178 B17R2.8844 C=Cc1ccccc1c2cccc(c2O)Cl 271570a_100000037480_100010202889 [0,1,1,0,0,0|2,0,0]=4 2179 B17R2.8844 C=Cc1ccccc1c2cccc(c2O)F 271570a_100000037480_100009813666 [0,1,1,0,0,0|2,0,0]=4 2180 B17R2.8844 C=Cc1ccccc1c2cccc(c2O)N 271570a_100000037480_100011934915 [0,1,1,0,0,0|2,0,0]=4 2181 B17R2.8844 C=Cc1ccccc1c2cccc(c2O)O 271570a_100000037480_100009815950 [0,1,1,0,0,0|2,0,0]=4 2182 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)Br 271570a_100000724322_100000211189 [0,1,1,0,0,0|1,0,1]=4 2183 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)Br 271570a_100000740022_100012353703 [0,1,1,0,0,0|1,0,1]=4 2184 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)Cl 271570a_100000726799_100000211189 [0,1,1,0,0,0|1,0,1]=4 2185 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)Cl 271570a_100000740022_100000726075 [0,1,1,0,0,0|1,0,1]=4 2186 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)F 271570a_100000740022_100011216893 [0,1,1,0,0,0|1,0,1]=4 2187 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)F 271570a_100012343299_100000211189 [0,1,1,0,0,0|1,0,1]=4 2188 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)N 271570a_100000740022_100000761887 [0,1,1,0,0,0|1,0,1]=4 2189 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)N 271570a_100010234745_100000211189 [0,1,1,0,0,0|1,0,1]=4 2190 B17R2.8844 Cc1c(cccc1c2ccccc2C=O)O 271570a_100000740022_100012002258 [0,1,1,0,0,0|1,0,1]=4 2191 B17R2.8844 Cc1c(cccc1c2ccccc2CN)Br 271570a_100000724322_100000689332 [0,1,1,0,0,0|0,0,2]=4 2192 B17R2.8844 Cc1c(cccc1c2ccccc2CN)Br 271570a_100020632975_100012353703 [0,1,1,0,0,0|0,0,2]=4 2193 B17R2.8844 Cc1c(cccc1c2ccccc2CN)Cl 271570a_100000726799_100000689332 [0,1,1,0,0,0|0,0,2]=4 2194 B17R2.8844 Cc1c(cccc1c2ccccc2CN)Cl 271570a_100020632975_100000726075 [0,1,1,0,0,0|0,0,2]=4 2195 B17R2.8844 Cc1c(cccc1c2ccccc2CN)F 271570a_100012343299_100000689332 [0,1,1,0,0,0|0,0,2]=4 2196 B17R2.8844 Cc1c(cccc1c2ccccc2CN)F 271570a_100020632975_100011216893 [0,1,1,0,0,0|0,0,2]=4 2197 B17R2.8844 Cc1c(cccc1c2ccccc2CN)N 271570a_100010234745_100000689332 [0,1,1,0,0,0|0,0,2]=4 2198 B17R2.8844 Cc1c(cccc1c2ccccc2CN)N 271570a_100020632975_100000761887 [0,1,1,0,0,0|0,0,2]=4 2199 B17R2.8844 Cc1c(cccc1c2ccccc2CN)O 271570a_100020632975_100012002258 [0,1,1,0,0,0|0,0,2]=4 2200 B17R2.8844 Cc1c(cccc1c2ccccc2NN)Br 271570a_100000724322_100000241748 [0,1,1,0,0,0|1,0,1]=4 2201 B17R2.8844 Cc1c(cccc1c2ccccc2NN)Cl 271570a_100000726799_100000241748 [0,1,1,0,0,0|1,0,1]=4 2202 B17R2.8844 Cc1c(cccc1c2ccccc2NN)F 271570a_100012343299_100000241748 [0,1,1,0,0,0|1,0,1]=4 2203 B17R2.8844 Cc1c(cccc1c2ccccc2NN)N 271570a_100010234745_100000241748 [0,1,1,0,0,0|1,0,1]=4 2204 B17R2.8844 Cc1cccc(c1Br)c2ccccc2C=O 271570a_100046285795_100000211189 [0,1,1,0,0,0|2,0,0]=4 2205 B17R2.8844 Cc1cccc(c1Br)c2ccccc2CN 271570a_100046285795_100000689332 [0,1,1,0,0,0|1,0,1]=4 2206 B17R2.8844 Cc1cccc(c1Br)c2ccccc2NN 271570a_100046285795_100000241748 [0,1,1,0,0,0|2,0,0]=4 2207 B17R2.8844 Cc1cccc(c1C)c2ccccc2C=O 271570a_100000740022_100011214922 [0,1,1,0,0,0|1,0,1]=4 2208 B17R2.8844 Cc1cccc(c1C)c2ccccc2C=O 271570a_100000760475_100000211189 [0,1,1,0,0,0|1,0,1]=4 2209 B17R2.8844 Cc1cccc(c1C)c2ccccc2CN 271570a_100000760475_100000689332 [0,1,1,0,0,0|0,0,2]=4 2210 B17R2.8844 Cc1cccc(c1C)c2ccccc2CN 271570a_100020632975_100011214922 [0,1,1,0,0,0|0,0,2]=4 2211 B17R2.8844 Cc1cccc(c1C)c2ccccc2NN 271570a_100000760475_100000241748 [0,1,1,0,0,0|1,0,1]=4 2212 B17R2.8844 Cc1cccc(c1Cl)c2ccccc2C=O 271570a_100000740022_200012352035 [0,1,1,0,0,0|2,0,0]=4 2213 B17R2.8844 Cc1cccc(c1Cl)c2ccccc2C=O 271570a_100012343306_100000211189 [0,1,1,0,0,0|2,0,0]=4 2214 B17R2.8844 Cc1cccc(c1Cl)c2ccccc2CN 271570a_100012343306_100000689332 [0,1,1,0,0,0|1,0,1]=4 2215 B17R2.8844 Cc1cccc(c1Cl)c2ccccc2CN 271570a_100020632975_200012352035 [0,1,1,0,0,0|1,0,1]=4 2216 B17R2.8844 Cc1cccc(c1Cl)c2ccccc2NN 271570a_100012343306_100000241748 [0,1,1,0,0,0|2,0,0]=4 2217 B17R2.8844 Cc1cccc(c1F)c2ccccc2C=O 271570a_100000740022_100000717567 [0,1,1,0,0,0|2,0,0]=4 2218 B17R2.8844 Cc1cccc(c1F)c2ccccc2C=O 271570a_100011934588_100000211189 [0,1,1,0,0,0|2,0,0]=4 2219 B17R2.8844 Cc1cccc(c1F)c2ccccc2CN 271570a_100011934588_100000689332 [0,1,1,0,0,0|1,0,1]=4 2220 B17R2.8844 Cc1cccc(c1F)c2ccccc2CN 271570a_100020632975_100000717567 [0,1,1,0,0,0|1,0,1]=4 2221 B17R2.8844 Cc1cccc(c1F)c2ccccc2NN 271570a_100011934588_100000241748 [0,1,1,0,0,0|2,0,0]=4 2222 B17R2.8844 Cc1cccc(c1N)c2ccccc2C=O 271570a_100000740022_100011834072 [0,1,1,0,0,0|2,0,0]=4 2223 B17R2.8844 Cc1cccc(c1N)c2ccccc2CN 271570a_100020632975_100011834072 [0,1,1,0,0,0|1,0,1]=4 2224 B17R2.8844 Cc1cccc(c1O)c2ccccc2C=O 271570a_100000089634_100000211189 [0,1,1,0,0,0|2,0,0]=4 2225 B17R2.8844 Cc1cccc(c1O)c2ccccc2C=O 271570a_100000740022_100009817157 [0,1,1,0,0,0|2,0,0]=4 2226 B17R2.8844 Cc1cccc(c1O)c2ccccc2CN 271570a_100000089634_100000689332 [0,1,1,0,0,0|1,0,1]=4 2227 B17R2.8844 Cc1cccc(c1O)c2ccccc2CN 271570a_100020632975_100009817157 [0,1,1,0,0,0|1,0,1]=4 2228 B17R2.8844 Cc1cccc(c1O)c2ccccc2NN 271570a_100000089634_100000241748 [0,1,1,0,0,0|2,0,0]=4 2229 B17R2.8844 NCc1ccccc1c2cccc(c2Br)O 271570a_100020632975_100010187914 [0,1,1,0,0,0|1,0,1]=4 2230 B17R2.8844 NCc1ccccc1c2cccc(c2Cl)Br 271570a_100020632975_100010142854 [0,1,1,0,0,0|1,0,1]=4 2231 B17R2.8844 NCc1ccccc1c2cccc(c2Cl)Cl 271570a_100000693060_100000689332 [0,1,1,0,0,0|1,0,1]=4 2232 B17R2.8844 NCc1ccccc1c2cccc(c2Cl)Cl 271570a_100020632975_100011215384 [0,1,1,0,0,0|1,0,1]=4 2233 B17R2.8844 NCc1ccccc1c2cccc(c2Cl)F 271570a_100010082947_100000689332 [0,1,1,0,0,0|1,0,1]=4 2234 B17R2.8844 NCc1ccccc1c2cccc(c2Cl)F 271570a_100020632975_200010234923 [0,1,1,0,0,0|1,0,1]=4 2235 B17R2.8844 NCc1ccccc1c2cccc(c2Cl)N 271570a_100010365637_100000689332 [0,1,1,0,0,0|1,0,1]=4 2236 B17R2.8844 NCc1ccccc1c2cccc(c2Cl)O 271570a_100010081514_100000689332 [0,1,1,0,0,0|1,0,1]=4 2237 B17R2.8844 NCc1ccccc1c2cccc(c2Cl)O 271570a_100020632975_100000049636 [0,1,1,0,0,0|1,0,1]=4 2238 B17R2.8844 NCc1ccccc1c2cccc(c2F)Br 271570a_100020632975_100000702267 [0,1,1,0,0,0|1,0,1]=4 2239 B17R2.8844 NCc1ccccc1c2cccc(c2F)Cl 271570a_100011263229_100000689332 [0,1,1,0,0,0|1,0,1]=4 2240 B17R2.8844 NCc1ccccc1c2cccc(c2F)Cl 271570a_100020632975_100011217346 [0,1,1,0,0,0|1,0,1]=4 2241 B17R2.8844 NCc1ccccc1c2cccc(c2F)F 271570a_100011215769_100000689332 [0,1,1,0,0,0|1,0,1]=4 2242 B17R2.8844 NCc1ccccc1c2cccc(c2F)F 271570a_100020632975_100000694657 [0,1,1,0,0,0|1,0,1]=4 2243 B17R2.8844 NCc1ccccc1c2cccc(c2F)I 271570a_100010162516_100000689332 [0,1,1,0,0,0|1,0,1]=4 2244 B17R2.8844 NCc1ccccc1c2cccc(c2F)N 271570a_100020632975_100011935091 [0,1,1,0,0,0|1,0,1]=4 2245 B17R2.8844 NCc1ccccc1c2cccc(c2F)N 271570a_103549770947_100000689332 [0,1,1,0,0,0|1,0,1]=4 2246 B17R2.8844 NCc1ccccc1c2cccc(c2F)O 271570a_100010081509_100000689332 [0,1,1,0,0,0|1,0,1]=4 2247 B17R2.8844 NCc1ccccc1c2cccc(c2F)O 271570a_100020632975_100009817021 [0,1,1,0,0,0|1,0,1]=4 2248 B17R2.8844 NCc1ccccc1c2cccc(c2N)Br 271570a_100020632975_100010146558 [0,1,1,0,0,0|1,0,1]=4 2249 B17R2.8844 NCc1ccccc1c2cccc(c2N)Cl 271570a_100020632975_100010190421 [0,1,1,0,0,0|1,0,1]=4 2250 B17R2.8844 NCc1ccccc1c2cccc(c2N)F 271570a_100020632975_100000042321 [0,1,1,0,0,0|1,0,1]=4 2251 B17R2.8844 NCc1ccccc1c2cccc(c2N)N 271570a_100020632975_100015191791 [0,1,1,0,0,0|1,0,1]=4 2252 B17R2.8844 NCc1ccccc1c2cccc(c2N)N 271570a_200010712833_100000689332 [0,1,1,0,0,0|1,0,1]=4 2253 B17R2.8844 NCc1ccccc1c2cccc(c2N)O 271570a_100020632975_100011934926 [0,1,1,0,0,0|1,0,1]=4 2254 B17R2.8844 NCc1ccccc1c2cccc(c2O)Br 271570a_100020632975_100010084509 [0,1,1,0,0,0|1,0,1]=4 2255 B17R2.8844 NCc1ccccc1c2cccc(c2O)Cl 271570a_100000089635_100000689332 [0,1,1,0,0,0|1,0,1]=4 2256 B17R2.8844 NCc1ccccc1c2cccc(c2O)Cl 271570a_100020632975_100010202889 [0,1,1,0,0,0|1,0,1]=4 2257 B17R2.8844 NCc1ccccc1c2cccc(c2O)F 271570a_100000068784_100000689332 [0,1,1,0,0,0|1,0,1]=4 2258 B17R2.8844 NCc1ccccc1c2cccc(c2O)F 271570a_100020632975_100009813666 [0,1,1,0,0,0|1,0,1]=4 2259 B17R2.8844 NCc1ccccc1c2cccc(c2O)N 271570a_100020632975_100011934915 [0,1,1,0,0,0|1,0,1]=4 2260 B17R2.8844 NCc1ccccc1c2cccc(c2O)O 271570a_100020632975_100009815950 [0,1,1,0,0,0|1,0,1]=4 2261 B17R2.8844 NNc1ccccc1c2cccc(c2Cl)Cl 271570a_100000693060_100000241748 [0,1,1,0,0,0|2,0,0]=4 2262 B17R2.8844 NNc1ccccc1c2cccc(c2Cl)F 271570a_100010082947_100000241748 [0,1,1,0,0,0|2,0,0]=4 2263 B17R2.8844 NNc1ccccc1c2cccc(c2Cl)N 271570a_100010365637_100000241748 [0,1,1,0,0,0|2,0,0]=4 2264 B17R2.8844 NNc1ccccc1c2cccc(c2Cl)O 271570a_100010081514_100000241748 [0,1,1,0,0,0|2,0,0]=4 2265 B17R2.8844 NNc1ccccc1c2cccc(c2F)Cl 271570a_100011263229_100000241748 [0,1,1,0,0,0|2,0,0]=4 2266 B17R2.8844 NNc1ccccc1c2cccc(c2F)F 271570a_100011215769_100000241748 [0,1,1,0,0,0|2,0,0]=4 2267 B17R2.8844 NNc1ccccc1c2cccc(c2F)I 271570a_100010162516_100000241748 [0,1,1,0,0,0|2,0,0]=4 2268 B17R2.8844 NNc1ccccc1c2cccc(c2F)N 271570a_103549770947_100000241748 [0,1,1,0,0,0|2,0,0]=4 2269 B17R2.8844 NNc1ccccc1c2cccc(c2F)O 271570a_100010081509_100000241748 [0,1,1,0,0,0|2,0,0]=4 2270 B17R2.8844 NNc1ccccc1c2cccc(c2N)N 271570a_200010712833_100000241748 [0,1,1,0,0,0|2,0,0]=4 2271 B17R2.8844 NNc1ccccc1c2cccc(c2O)Cl 271570a_100000089635_100000241748 [0,1,1,0,0,0|2,0,0]=4 2272 B17R2.8844 NNc1ccccc1c2cccc(c2O)F 271570a_100000068784_100000241748 [0,1,1,0,0,0|2,0,0]=4 2273 B17R2.8844 Nc1c(cccc1c2ccccc2C=O)Br 271570a_100000740022_100010146558 [0,1,1,0,0,0|2,0,0]=4 2274 B17R2.8844 Nc1c(cccc1c2ccccc2C=O)Cl 271570a_100000740022_100010190421 [0,1,1,0,0,0|2,0,0]=4 2275 B17R2.8844 Nc1c(cccc1c2ccccc2C=O)F 271570a_100000740022_100000042321 [0,1,1,0,0,0|2,0,0]=4 2276 B17R2.8844 Nc1c(cccc1c2ccccc2C=O)O 271570a_100000740022_100011934926 [0,1,1,0,0,0|2,0,0]=4 2277 B17R2.8844 Nc1cccc(c1Cl)c2ccccc2C=O 271570a_100010365637_100000211189 [0,1,1,0,0,0|2,0,0]=4 2278 B17R2.8844 Nc1cccc(c1F)c2ccccc2C=O 271570a_100000740022_100011935091 [0,1,1,0,0,0|2,0,0]=4 2279 B17R2.8844 Nc1cccc(c1F)c2ccccc2C=O 271570a_103549770947_100000211189 [0,1,1,0,0,0|2,0,0]=4 2280 B17R2.8844 Nc1cccc(c1N)c2ccccc2C=O 271570a_100000740022_100015191791 [0,1,1,0,0,0|2,0,0]=4 2281 B17R2.8844 Nc1cccc(c1N)c2ccccc2C=O 271570a_200010712833_100000211189 [0,1,1,0,0,0|2,0,0]=4 2282 B17R2.8844 Nc1cccc(c1O)c2ccccc2C=O 271570a_100000740022_100011934915 [0,1,1,0,0,0|2,0,0]=4 2283 B17R2.8844 O=Cc1ccccc1c2cccc(c2Br)O 271570a_100000740022_100010187914 [0,1,1,0,0,0|2,0,0]=4 2284 B17R2.8844 O=Cc1ccccc1c2cccc(c2Cl)Br 271570a_100000740022_100010142854 [0,1,1,0,0,0|2,0,0]=4 2285 B17R2.8844 O=Cc1ccccc1c2cccc(c2Cl)Cl 271570a_100000693060_100000211189 [0,1,1,0,0,0|2,0,0]=4 2286 B17R2.8844 O=Cc1ccccc1c2cccc(c2Cl)Cl 271570a_100000740022_100011215384 [0,1,1,0,0,0|2,0,0]=4 2287 B17R2.8844 O=Cc1ccccc1c2cccc(c2Cl)F 271570a_100000740022_200010234923 [0,1,1,0,0,0|2,0,0]=4 2288 B17R2.8844 O=Cc1ccccc1c2cccc(c2Cl)F 271570a_100010082947_100000211189 [0,1,1,0,0,0|2,0,0]=4 2289 B17R2.8844 O=Cc1ccccc1c2cccc(c2Cl)O 271570a_100000740022_100000049636 [0,1,1,0,0,0|2,0,0]=4 2290 B17R2.8844 O=Cc1ccccc1c2cccc(c2Cl)O 271570a_100010081514_100000211189 [0,1,1,0,0,0|2,0,0]=4 2291 B17R2.8844 O=Cc1ccccc1c2cccc(c2F)Br 271570a_100000740022_100000702267 [0,1,1,0,0,0|2,0,0]=4 2292 B17R2.8844 O=Cc1ccccc1c2cccc(c2F)Cl 271570a_100000740022_100011217346 [0,1,1,0,0,0|2,0,0]=4 2293 B17R2.8844 O=Cc1ccccc1c2cccc(c2F)Cl 271570a_100011263229_100000211189 [0,1,1,0,0,0|2,0,0]=4 2294 B17R2.8844 O=Cc1ccccc1c2cccc(c2F)F 271570a_100000740022_100000694657 [0,1,1,0,0,0|2,0,0]=4 2295 B17R2.8844 O=Cc1ccccc1c2cccc(c2F)F 271570a_100011215769_100000211189 [0,1,1,0,0,0|2,0,0]=4 2296 B17R2.8844 O=Cc1ccccc1c2cccc(c2F)I 271570a_100010162516_100000211189 [0,1,1,0,0,0|2,0,0]=4 2297 B17R2.8844 O=Cc1ccccc1c2cccc(c2F)O 271570a_100000740022_100009817021 [0,1,1,0,0,0|2,0,0]=4 2298 B17R2.8844 O=Cc1ccccc1c2cccc(c2F)O 271570a_100010081509_100000211189 [0,1,1,0,0,0|2,0,0]=4 2299 B17R2.8844 O=Cc1ccccc1c2cccc(c2O)Br 271570a_100000740022_100010084509 [0,1,1,0,0,0|2,0,0]=4 2300 B17R2.8844 O=Cc1ccccc1c2cccc(c2O)Cl 271570a_100000089635_100000211189 [0,1,1,0,0,0|2,0,0]=4 2301 B17R2.8844 O=Cc1ccccc1c2cccc(c2O)Cl 271570a_100000740022_100010202889 [0,1,1,0,0,0|2,0,0]=4 2302 B17R2.8844 O=Cc1ccccc1c2cccc(c2O)F 271570a_100000068784_100000211189 [0,1,1,0,0,0|2,0,0]=4 2303 B17R2.8844 O=Cc1ccccc1c2cccc(c2O)F 271570a_100000740022_100009813666 [0,1,1,0,0,0|2,0,0]=4 2304 B17R2.8844 O=Cc1ccccc1c2cccc(c2O)O 271570a_100000740022_100009815950 [0,1,1,0,0,0|2,0,0]=4 2305 B17R2.12538 C=Cc1ccccc1c2c(cccc2Br)F 271570a_100000037480_100011219512 [0,1,1,0,0,0|2,0,0]=4 2306 B17R2.12538 C=Cc1ccccc1c2c(cccc2Br)N 271570a_100000037480_100020590159 [0,1,1,0,0,0|2,0,0]=4 2307 B17R2.12538 C=Cc1ccccc1c2c(cccc2Br)O 271570a_100000037480_100010187912 [0,1,1,0,0,0|2,0,0]=4 2308 B17R2.12538 C=Cc1ccccc1c2c(cccc2C)C 271570a_100000037480_100000033847 [0,1,1,0,0,0|1,0,1]=4 2309 B17R2.12538 C=Cc1ccccc1c2c(cccc2Cl)C 271570a_100000037480_100000043165 [0,1,1,0,0,0|1,0,1]=4 2310 B17R2.12538 C=Cc1ccccc1c2c(cccc2Cl)F 271570a_100000037480_100000050007 [0,1,1,0,0,0|2,0,0]=4 2311 B17R2.12538 C=Cc1ccccc1c2c(cccc2Cl)N 271570a_100000037480_100000049713 [0,1,1,0,0,0|2,0,0]=4 2312 B17R2.12538 C=Cc1ccccc1c2c(cccc2Cl)O 271570a_100000037480_100000050174 [0,1,1,0,0,0|2,0,0]=4 2313 B17R2.12538 C=Cc1ccccc1c2c(cccc2F)C 271570a_100000037480_100012349962 [0,1,1,0,0,0|1,0,1]=4 2314 B17R2.12538 C=Cc1ccccc1c2c(cccc2F)F 271570a_100000037480_100000693133 [0,1,1,0,0,0|2,0,0]=4 2315 B17R2.12538 C=Cc1ccccc1c2c(cccc2F)N 271570a_100000037480_100011934729 [0,1,1,0,0,0|2,0,0]=4 2316 B17R2.12538 C=Cc1ccccc1c2c(cccc2F)O 271570a_100000037480_100009820682 [0,1,1,0,0,0|2,0,0]=4 2317 B17R2.12538 C=Cc1ccccc1c2c(cccc2N)C 271570a_100000037480_100000684715 [0,1,1,0,0,0|1,0,1]=4 2318 B17R2.12538 C=Cc1ccccc1c2c(cccc2O)C 271570a_100000037480_100000686692 [0,1,1,0,0,0|1,0,1]=4 2319 B17R2.12538 C=Cc1ccccc1c2c(cccc2O)N 271570a_100000037480_100012183704 [0,1,1,0,0,0|2,0,0]=4 2320 B17R2.12538 C=Cc1ccccc1c2c(cccc2O)O 271570a_100000037480_100010205330 [0,1,1,0,0,0|2,0,0]=4 2321 B17R2.12538 Cc1cccc(c1c2ccccc2C=O)C 271570a_100000740022_100000033847 [0,1,1,0,0,0|1,0,1]=4 2322 B17R2.12538 Cc1cccc(c1c2ccccc2C=O)Cl 271570a_100000740022_100000043165 [0,1,1,0,0,0|1,0,1]=4 2323 B17R2.12538 Cc1cccc(c1c2ccccc2C=O)F 271570a_100000740022_100012349962 [0,1,1,0,0,0|1,0,1]=4 2324 B17R2.12538 Cc1cccc(c1c2ccccc2C=O)F 271570a_100010391573_100000211189 [0,1,1,0,0,0|1,0,1]=4 2325 B17R2.12538 Cc1cccc(c1c2ccccc2C=O)N 271570a_100000740022_100000684715 [0,1,1,0,0,0|1,0,1]=4 2326 B17R2.12538 Cc1cccc(c1c2ccccc2C=O)O 271570a_100000740022_100000686692 [0,1,1,0,0,0|1,0,1]=4 2327 B17R2.12538 Cc1cccc(c1c2ccccc2CN)C 271570a_100020632975_100000033847 [0,1,1,0,0,0|0,0,2]=4 2328 B17R2.12538 Cc1cccc(c1c2ccccc2CN)Cl 271570a_100020632975_100000043165 [0,1,1,0,0,0|0,0,2]=4 2329 B17R2.12538 Cc1cccc(c1c2ccccc2CN)F 271570a_100010391573_100000689332 [0,1,1,0,0,0|0,0,2]=4 2330 B17R2.12538 Cc1cccc(c1c2ccccc2CN)F 271570a_100020632975_100012349962 [0,1,1,0,0,0|0,0,2]=4 2331 B17R2.12538 Cc1cccc(c1c2ccccc2CN)N 271570a_100020632975_100000684715 [0,1,1,0,0,0|0,0,2]=4 2332 B17R2.12538 Cc1cccc(c1c2ccccc2CN)O 271570a_100020632975_100000686692 [0,1,1,0,0,0|0,0,2]=4 2333 B17R2.12538 Cc1cccc(c1c2ccccc2NN)F 271570a_100010391573_100000241748 [0,1,1,0,0,0|1,0,1]=4 2334 B17R2.12538 NCc1ccccc1c2c(cccc2Br)Br 271570a_100020632975_100009994525 [0,1,1,0,0,0|1,0,1]=4 2335 B17R2.12538 NCc1ccccc1c2c(cccc2Br)Cl 271570a_100020632975_100010214488 [0,1,1,0,0,0|1,0,1]=4 2336 B17R2.12538 NCc1ccccc1c2c(cccc2Br)F 271570a_100020632975_100011219512 [0,1,1,0,0,0|1,0,1]=4 2337 B17R2.12538 NCc1ccccc1c2c(cccc2Br)N 271570a_100020632975_100020590159 [0,1,1,0,0,0|1,0,1]=4 2338 B17R2.12538 NCc1ccccc1c2c(cccc2Br)O 271570a_100020632975_100010187912 [0,1,1,0,0,0|1,0,1]=4 2339 B17R2.12538 NCc1ccccc1c2c(cccc2Cl)Cl 271570a_100020632975_100000034237 [0,1,1,0,0,0|1,0,1]=4 2340 B17R2.12538 NCc1ccccc1c2c(cccc2Cl)F 271570a_100020632975_100000050007 [0,1,1,0,0,0|1,0,1]=4 2341 B17R2.12538 NCc1ccccc1c2c(cccc2Cl)N 271570a_100020632975_100000049713 [0,1,1,0,0,0|1,0,1]=4 2342 B17R2.12538 NCc1ccccc1c2c(cccc2Cl)O 271570a_100020632975_100000050174 [0,1,1,0,0,0|1,0,1]=4 2343 B17R2.12538 NCc1ccccc1c2c(cccc2F)F 271570a_100020632975_100000693133 [0,1,1,0,0,0|1,0,1]=4 2344 B17R2.12538 NCc1ccccc1c2c(cccc2F)N 271570a_100010769795_100000689332 [0,1,1,0,0,0|1,0,1]=4 2345 B17R2.12538 NCc1ccccc1c2c(cccc2F)N 271570a_100020632975_100011934729 [0,1,1,0,0,0|1,0,1]=4 2346 B17R2.12538 NCc1ccccc1c2c(cccc2F)O 271570a_100020632975_100009820682 [0,1,1,0,0,0|1,0,1]=4 2347 B17R2.12538 NCc1ccccc1c2c(cccc2O)N 271570a_100020632975_100012183704 [0,1,1,0,0,0|1,0,1]=4 2348 B17R2.12538 NCc1ccccc1c2c(cccc2O)O 271570a_100020632975_100010205330 [0,1,1,0,0,0|1,0,1]=4 2349 B17R2.12538 NNc1ccccc1c2c(cccc2F)N 271570a_100010769795_100000241748 [0,1,1,0,0,0|2,0,0]=4 2350 B17R2.12538 Nc1cccc(c1c2ccccc2C=O)Br 271570a_100000740022_100020590159 [0,1,1,0,0,0|2,0,0]=4 2351 B17R2.12538 Nc1cccc(c1c2ccccc2C=O)Cl 271570a_100000740022_100000049713 [0,1,1,0,0,0|2,0,0]=4 2352 B17R2.12538 Nc1cccc(c1c2ccccc2C=O)F 271570a_100000740022_100011934729 [0,1,1,0,0,0|2,0,0]=4 2353 B17R2.12538 Nc1cccc(c1c2ccccc2C=O)F 271570a_100010769795_100000211189 [0,1,1,0,0,0|2,0,0]=4 2354 B17R2.12538 Nc1cccc(c1c2ccccc2C=O)O 271570a_100000740022_100012183704 [0,1,1,0,0,0|2,0,0]=4 2355 B17R2.12538 O=Cc1ccccc1c2c(cccc2Br)Br 271570a_100000740022_100009994525 [0,1,1,0,0,0|2,0,0]=4 2356 B17R2.12538 O=Cc1ccccc1c2c(cccc2Br)Cl 271570a_100000740022_100010214488 [0,1,1,0,0,0|2,0,0]=4 2357 B17R2.12538 O=Cc1ccccc1c2c(cccc2Br)F 271570a_100000740022_100011219512 [0,1,1,0,0,0|2,0,0]=4 2358 B17R2.12538 O=Cc1ccccc1c2c(cccc2Br)O 271570a_100000740022_100010187912 [0,1,1,0,0,0|2,0,0]=4 2359 B17R2.12538 O=Cc1ccccc1c2c(cccc2Cl)Cl 271570a_100000740022_100000034237 [0,1,1,0,0,0|2,0,0]=4 2360 B17R2.12538 O=Cc1ccccc1c2c(cccc2Cl)F 271570a_100000740022_100000050007 [0,1,1,0,0,0|2,0,0]=4 2361 B17R2.12538 O=Cc1ccccc1c2c(cccc2Cl)O 271570a_100000740022_100000050174 [0,1,1,0,0,0|2,0,0]=4 2362 B17R2.12538 O=Cc1ccccc1c2c(cccc2F)F 271570a_100000740022_100000693133 [0,1,1,0,0,0|2,0,0]=4 2363 B17R2.12538 O=Cc1ccccc1c2c(cccc2F)O 271570a_100000740022_100009820682 [0,1,1,0,0,0|2,0,0]=4 2364 B17R2.12538 O=Cc1ccccc1c2c(cccc2O)O 271570a_100000740022_100010205330 [0,1,1,0,0,0|2,0,0]=4 2365 B17R2.13776 Cc1cccc(c1C=O)c2ccccc2Cl 271570a_100011934419_100000041122 [0,1,1,0,0,0|2,0,0]=4 2366 B17R2.13776 Cc1cccc(c1C=O)c2ccccc2F 271570a_100000761933_100000041122 [0,1,1,0,0,0|2,0,0]=4 2367 B17R2.13776 Cc1cccc(c1C=O)c2ccccc2I 271570a_100000069755_100000041122 [0,1,1,0,0,0|2,0,0]=4 2368 B17R2.13776 Cc1cccc(c1C=O)c2ccccc2N 271570a_100000034411_100000041122 [0,1,1,0,0,0|2,0,0]=4 2369 B17R2.13776 Cc1cccc(c1C=O)c2ccccc2O 271570a_100000035170_100000041122 [0,1,1,0,0,0|2,0,0]=4 2370 B17R2.13776 Cc1ccccc1c2cccc(c2C=O)C 271570a_100000747142_100000041122 [0,1,1,0,0,0|1,0,1]=4 2371 B17R2.13776 Cc1ccccc1c2cccc(c2C=O)Cl 271570a_100000747142_100010147682 [0,1,1,0,0,0|1,0,1]=4 2372 B17R2.13776 Cc1ccccc1c2cccc(c2C=O)Cl 271570a_100009861587_100000210755 [0,1,1,0,0,0|1,0,1]=4 2373 B17R2.13776 Cc1ccccc1c2cccc(c2C=O)F 271570a_100000747142_100000210083 [0,1,1,0,0,0|1,0,1]=4 2374 B17R2.13776 Cc1ccccc1c2cccc(c2C=O)F 271570a_100010144235_100000210755 [0,1,1,0,0,0|1,0,1]=4 2375 B17R2.13776 Cc1ccccc1c2cccc(c2C=O)N 271570a_100000747142_100010232536 [0,1,1,0,0,0|1,0,1]=4 2376 B17R2.13776 Cc1ccccc1c2cccc(c2C=O)O 271570a_100000747142_100009814793 [0,1,1,0,0,0|1,0,1]=4 2377 B17R2.13776 Cc1ccccc1c2cccc(c2CN)F 271570a_100000747142_100012349121 [0,1,1,0,0,0|0,0,2]=4 2378 B17R2.13776 Cc1ccccc1c2cccc(c2NN)F 271570a_100000747142_100016994982 [0,1,1,0,0,0|1,0,1]=4 2379 B17R2.13776 NCc1c(cccc1c2ccccc2Cl)F 271570a_100011934419_100012349121 [0,1,1,0,0,0|1,0,1]=4 2380 B17R2.13776 NCc1c(cccc1c2ccccc2F)F 271570a_100000761933_100012349121 [0,1,1,0,0,0|1,0,1]=4 2381 B17R2.13776 NCc1c(cccc1c2ccccc2I)F 271570a_100000069755_100012349121 [0,1,1,0,0,0|1,0,1]=4 2382 B17R2.13776 NCc1c(cccc1c2ccccc2N)F 271570a_100000034411_100012349121 [0,1,1,0,0,0|1,0,1]=4 2383 B17R2.13776 NCc1c(cccc1c2ccccc2O)F 271570a_100000035170_100012349121 [0,1,1,0,0,0|1,0,1]=4 2384 B17R2.13776 NNc1c(cccc1c2ccccc2Cl)F 271570a_100011934419_100016994982 [0,1,1,0,0,0|2,0,0]=4 2385 B17R2.13776 NNc1c(cccc1c2ccccc2F)F 271570a_100000761933_100016994982 [0,1,1,0,0,0|2,0,0]=4 2386 B17R2.13776 NNc1c(cccc1c2ccccc2I)F 271570a_100000069755_100016994982 [0,1,1,0,0,0|2,0,0]=4 2387 B17R2.13776 NNc1c(cccc1c2ccccc2N)F 271570a_100000034411_100016994982 [0,1,1,0,0,0|2,0,0]=4 2388 B17R2.13776 NNc1c(cccc1c2ccccc2O)F 271570a_100000035170_100016994982 [0,1,1,0,0,0|2,0,0]=4 2389 B17R2.13776 Nc1cccc(c1C=O)c2ccccc2Cl 271570a_100011934419_100010232536 [0,1,1,0,0,0|2,0,0]=4 2390 B17R2.13776 Nc1cccc(c1C=O)c2ccccc2F 271570a_100000761933_100010232536 [0,1,1,0,0,0|2,0,0]=4 2391 B17R2.13776 Nc1cccc(c1C=O)c2ccccc2I 271570a_100000069755_100010232536 [0,1,1,0,0,0|2,0,0]=4 2392 B17R2.13776 Nc1cccc(c1C=O)c2ccccc2O 271570a_100000035170_100010232536 [0,1,1,0,0,0|2,0,0]=4 2393 B17R2.13776 Nc1ccccc1c2cccc(c2C=O)Cl 271570a_100000034411_100010147682 [0,1,1,0,0,0|2,0,0]=4 2394 B17R2.13776 Nc1ccccc1c2cccc(c2C=O)Cl 271570a_100009861587_100000210017 [0,1,1,0,0,0|2,0,0]=4 2395 B17R2.13776 Nc1ccccc1c2cccc(c2C=O)F 271570a_100000034411_100000210083 [0,1,1,0,0,0|2,0,0]=4 2396 B17R2.13776 Nc1ccccc1c2cccc(c2C=O)F 271570a_100010144235_100000210017 [0,1,1,0,0,0|2,0,0]=4 2397 B17R2.13776 Nc1ccccc1c2cccc(c2C=O)N 271570a_100000034411_100010232536 [0,1,1,0,0,0|2,0,0]=4 2398 B17R2.13776 Nc1ccccc1c2cccc(c2C=O)O 271570a_100000034411_100009814793 [0,1,1,0,0,0|2,0,0]=4 2399 B17R2.13776 O=Cc1c(cccc1c2ccccc2Br)Cl 271570a_100009861587_100000695589 [0,1,1,0,0,0|2,0,0]=4 2400 B17R2.13776 O=Cc1c(cccc1c2ccccc2Br)F 271570a_100010144235_100000695589 [0,1,1,0,0,0|2,0,0]=4 2401 B17R2.13776 O=Cc1c(cccc1c2ccccc2Cl)Cl 271570a_100009861587_100000764095 [0,1,1,0,0,0|2,0,0]=4 2402 B17R2.13776 O=Cc1c(cccc1c2ccccc2Cl)Cl 271570a_100011934419_100010147682 [0,1,1,0,0,0|2,0,0]=4 2403 B17R2.13776 O=Cc1c(cccc1c2ccccc2Cl)F 271570a_100010144235_100000764095 [0,1,1,0,0,0|2,0,0]=4 2404 B17R2.13776 O=Cc1c(cccc1c2ccccc2Cl)F 271570a_100011934419_100000210083 [0,1,1,0,0,0|2,0,0]=4 2405 B17R2.13776 O=Cc1c(cccc1c2ccccc2Cl)O 271570a_100011934419_100009814793 [0,1,1,0,0,0|2,0,0]=4 2406 B17R2.13776 O=Cc1c(cccc1c2ccccc2F)Cl 271570a_100000761933_100010147682 [0,1,1,0,0,0|2,0,0]=4 2407 B17R2.13776 O=Cc1c(cccc1c2ccccc2F)Cl 271570a_100009861587_100011215700 [0,1,1,0,0,0|2,0,0]=4 2408 B17R2.13776 O=Cc1c(cccc1c2ccccc2F)F 271570a_100000761933_100000210083 [0,1,1,0,0,0|2,0,0]=4 2409 B17R2.13776 O=Cc1c(cccc1c2ccccc2F)F 271570a_100010144235_100011215700 [0,1,1,0,0,0|2,0,0]=4 2410 B17R2.13776 O=Cc1c(cccc1c2ccccc2F)O 271570a_100000761933_100009814793 [0,1,1,0,0,0|2,0,0]=4 2411 B17R2.13776 O=Cc1c(cccc1c2ccccc2I)Cl 271570a_100000069755_100010147682 [0,1,1,0,0,0|2,0,0]=4 2412 B17R2.13776 O=Cc1c(cccc1c2ccccc2I)F 271570a_100000069755_100000210083 [0,1,1,0,0,0|2,0,0]=4 2413 B17R2.13776 O=Cc1c(cccc1c2ccccc2I)O 271570a_100000069755_100009814793 [0,1,1,0,0,0|2,0,0]=4 2414 B17R2.13776 O=Cc1c(cccc1c2ccccc2O)Cl 271570a_100000035170_100010147682 [0,1,1,0,0,0|2,0,0]=4 2415 B17R2.13776 O=Cc1c(cccc1c2ccccc2O)Cl 271570a_100009861587_100000739446 [0,1,1,0,0,0|2,0,0]=4 2416 B17R2.13776 O=Cc1c(cccc1c2ccccc2O)F 271570a_100000035170_100000210083 [0,1,1,0,0,0|2,0,0]=4 2417 B17R2.13776 O=Cc1c(cccc1c2ccccc2O)F 271570a_100010144235_100000739446 [0,1,1,0,0,0|2,0,0]=4 2418 B17R2.13776 O=Cc1c(cccc1c2ccccc2O)O 271570a_100000035170_100009814793 [0,1,1,0,0,0|2,0,0]=4 2419 B17R2.12118 C/C=C/COc1ccc(c2c1cccc2)N 34a_100000705857_100102629194 [0,1,1,0,0,0|0,0,2]=4 2420 B17R2.12118 C/C=C/COc1ccc(c2c1cccc2)N 7a_100000705857_100102629194 [0,1,1,0,0,0|0,0,2]=4 2421 B17R2.12118 C/C=C/CSc1ccc(c2c1cccc2)N 62a_100000766797_100102629194 [0,1,1,0,0,0|0,0,2]=4 2422 B17R2.12118 C=CCCOc1ccc(c2c1cccc2)N 34a_100000705857_100000754431 [0,1,1,0,0,0|0,0,2]=4 2423 B17R2.12118 C=CCCOc1ccc(c2c1cccc2)N 7a_100000705857_100000754431 [0,1,1,0,0,0|0,0,2]=4 2424 B17R2.12118 C=CCCSc1ccc(c2c1cccc2)N 62a_100000766797_100000754431 [0,1,1,0,0,0|0,0,2]=4 2425 B17R2.12118 CC=CCOc1ccc(c2c1cccc2)N 34a_100000705857_100000070051 [0,1,1,0,0,0|0,0,2]=4 2426 B17R2.12118 CC=CCOc1ccc(c2c1cccc2)N 7a_100000705857_100000070051 [0,1,1,0,0,0|0,0,2]=4 2427 B17R2.12118 CC=CCSc1ccc(c2c1cccc2)N 62a_100000766797_100000070051 [0,1,1,0,0,0|0,0,2]=4 2428 B17R2.12118 CCCC=Cc1ccc(c2c1cccc2)N 271570a_100016258520_100000766797 [0,1,1,0,0,0|0,0,2]=4 2429 B17R2.12118 CCOC=Cc1ccc(c2c1cccc2)N 271570a_100016256518_100000766797 [0,1,1,0,0,0|0,0,2]=4 2430 B17R2.12118 COCC=Cc1ccc(c2c1cccc2)N 271570a_100016286323_100000766797 [0,1,1,0,0,0|0,0,2]=4 2431 B17R2.39629 C=C(C)COc1ccc(c2c1cccc2)N 34a_100000705857_100000748629 [0,1,1,0,0,0|1,0,1]=4 2432 B17R2.39629 C=C(C)COc1ccc(c2c1cccc2)N 7a_100000705857_100000748629 [0,1,1,0,0,0|1,0,1]=4 2433 B17R2.39629 C=C(C)CSc1ccc(c2c1cccc2)N 62a_100000766797_100000211660 [0,1,1,0,0,0|1,0,1]=4 2434 B17R2.39629 C=C(F)COc1ccc(c2c1cccc2)N 34a_100000705857_100009893438 [0,1,1,0,0,0|1,0,1]=4 2435 B17R2.39629 C=C(F)COc1ccc(c2c1cccc2)N 7a_100000705857_100000042424 [0,1,1,0,0,0|1,0,1]=4 2436 B17R2.39629 C=C(F)CSc1ccc(c2c1cccc2)N 62a_100000766797_100000042424 [0,1,1,0,0,0|1,0,1]=4 2437 B17R2.39629 CC(C)C=Cc1ccc(c2c1cccc2)N 271570a_100016257149_100000766797 [0,1,1,0,0,0|0,0,2]=4 2438 B17R2.39629 CC(O)C=Cc1ccc(c2c1cccc2)N 271570a_200011019289_100000766797 [0,1,1,0,0,0|0,0,2]=4 2439 B17R2.50010 C=CCC(=O)c1ccc(c2c1cccc2)Br 1458a_100012047197_100000210623 [0,1,1,0,0,0|1,0,1]=4 2440 B17R2.50010 C=CCC(=O)c1ccc(c2c1cccc2)C 1458a_100011217726_100000210623 [0,1,1,0,0,0|1,0,1]=4 2441 B17R2.50010 C=CCC(=O)c1ccc(c2c1cccc2)Cl 1458a_100012348593_100000210623 [0,1,1,0,0,0|1,0,1]=4 2442 B17R2.50010 C=CCC(=O)c1ccc(c2c1cccc2)F 1458a_100000186238_100000210623 [0,1,1,0,0,0|1,0,1]=4 2443 B17R2.345886 C=CCSc1ccc(c2c1cccc2)CN 62a_100000210623_100016995114 [0,1,1,0,0,0|1,0,1]=4 2444 B17R2.345886 C=CCSc1ccc(c2c1cccc2)CN 62a_100016995114_100000210623 [0,1,1,0,0,0|1,0,1]=4 2445 B17R2.451963 C=CC(=O)Cc1ccc(c2c1cccc2)Br 1458a_100000185746_100012352185 [0,1,1,0,0,0|1,0,1]=4 2446 B17R2.451963 C=CC(=O)Cc1ccc(c2c1cccc2)C 1458a_100000185746_100012073487 [0,1,1,0,0,0|1,0,1]=4 2447 B17R2.451963 C=CC(=O)Cc1ccc(c2c1cccc2)F 1458a_100000185746_100011988723 [0,1,1,0,0,0|1,0,1]=4 2448 B17R2.451963 C=CC(=O)Nc1ccc(c2c1cccc2)Br 1626a_100000766797_100000185746 [0,1,1,0,0,0|2,0,0]=4 2449 B17R2.451963 C=CC(=O)Nc1ccc(c2c1cccc2)Br 22a_100000766797_100000185746 [0,1,1,0,0,0|2,0,0]=4 2450 B17R2.451963 C=CC(=O)Nc1ccc(c2c1cccc2)Cl 1626a_100011216319_100000185746 [0,1,1,0,0,0|2,0,0]=4 2451 B17R2.451963 C=CC(=O)Nc1ccc(c2c1cccc2)Cl 22a_100011216319_100000185746 [0,1,1,0,0,0|2,0,0]=4 2452 B17R2.451963 C=CC(=O)Nc1ccc(c2c1cccc2)F 1626a_100011988692_100000185746 [0,1,1,0,0,0|2,0,0]=4 2453 B17R2.451963 C=CC(=O)Nc1ccc(c2c1cccc2)F 22a_100011988692_100000185746 [0,1,1,0,0,0|2,0,0]=4 2454 B17R2.451963 C=CC(=O)Nc1ccc(c2c1cccc2)O 22a_100000705857_100000185746 [0,1,1,0,0,0|2,0,0]=4 2455 B17R2.5014 C=C(C)CSc1cc(cc2c1cccc2)N 62a_100000748629_100010089974 [0,1,1,0,0,0|1,0,1]=4 2456 B17R2.5014 C=C(C)CSc1cc(cc2c1cccc2)N 62a_100010089974_100000211660 [0,1,1,0,0,0|1,0,1]=4 2457 B17R2.5014 C=C(F)CSc1cc(cc2c1cccc2)N 62a_100000042424_100010089974 [0,1,1,0,0,0|1,0,1]=4 2458 B17R2.5014 C=C(F)CSc1cc(cc2c1cccc2)N 62a_100010089974_100000042424 [0,1,1,0,0,0|1,0,1]=4 2459 B17R2.5014 CC(C)C=Cc1cc(cc2c1cccc2)N 271570a_100016257149_100010089974 [0,1,1,0,0,0|0,0,2]=4 2460 B17R2.5014 CC(O)C=Cc1cc(cc2c1cccc2)N 271570a_200011019289_100010089974 [0,1,1,0,0,0|0,0,2]=4 2461 B17R2.12128 C/C=C/CSc1cc(cc2c1cccc2)N 62a_100010089974_100102629194 [0,1,1,0,0,0|0,0,2]=4 2462 B17R2.12128 C/C=C/CSc1cc(cc2c1cccc2)N 62a_100102629194_100010089974 [0,1,1,0,0,0|0,0,2]=4 2463 B17R2.12128 C=CCCSc1cc(cc2c1cccc2)N 62a_100000754431_100010089974 [0,1,1,0,0,0|0,0,2]=4 2464 B17R2.12128 C=CCCSc1cc(cc2c1cccc2)N 62a_100010089974_100000754431 [0,1,1,0,0,0|0,0,2]=4 2465 B17R2.12128 CC=CCSc1cc(cc2c1cccc2)N 62a_100000070051_100010089974 [0,1,1,0,0,0|0,0,2]=4 2466 B17R2.12128 CC=CCSc1cc(cc2c1cccc2)N 62a_100010089974_100000070051 [0,1,1,0,0,0|0,0,2]=4 2467 B17R2.12128 CCCC=Cc1cc(cc2c1cccc2)N 271570a_100016258520_100010089974 [0,1,1,0,0,0|0,0,2]=4 2468 B17R2.12128 CCOC=Cc1cc(cc2c1cccc2)N 271570a_100016256518_100010089974 [0,1,1,0,0,0|0,0,2]=4 2469 B17R2.12128 COCC=Cc1cc(cc2c1cccc2)N 271570a_100016286323_100010089974 [0,1,1,0,0,0|0,0,2]=4 2470 B17R2.50020 C=CCC(=O)c1cc(cc2c1cccc2)Br 1458a_100000752674_100000210623 [0,1,1,0,0,0|1,0,1]=4 2471 B17R2.50020 C=CCC(=O)c1cc(cc2c1cccc2)O 1458a_100009841457_100000210623 [0,1,1,0,0,0|1,0,1]=4 2472 B17R2.451970 C=CC(=O)Nc1cc(cc2c1cccc2)Br 1626a_100010171453_100000185746 [0,1,1,0,0,0|2,0,0]=4 2473 B17R2.451970 C=CC(=O)Nc1cc(cc2c1cccc2)Br 22a_100010171453_100000185746 [0,1,1,0,0,0|2,0,0]=4 2474 B17R2.451970 C=CC(C)Sc1cc(cc2c1cccc2)N 62a_100011215867_100010089974 [0,1,1,0,0,0|1,0,1]=4 2475 B17R3.31 Oc1ccc2c(c1)ccc3c2cccc3 271570a_203496583355_100010174298 [1,1,0,0,0,0|0,0,0]=2 2476 B17R3.31 Oc1cnc2c(c1)ccc3c2nccc3 271570a_203496583355_100010188720 [1,1,0,0,0,0|2,0,0]=4 2477 B17R3.4465 Oc1ccnc2c1ccc3c2nccc3 271570a_203496583355_100010235877 [1,1,0,0,0,0|2,0,0]=4 2478 B17R3.18998 Oc1ccc2ccc3ccccc3c2c1 271570a_203496583355_100010175977 [1,1,0,0,0,0|0,0,0]=2 2479 B17R3.18998 Oc1ccc2ccc3cccnc3c2n1 271570a_203496583355_100000037118 [1,1,0,0,0,0|2,0,0]=4 2480 B17R3.865 CNc1nc2ccccc2c3c1cco3 27a_100102657272_200010025853 [0,1,0,0,1,0|2,0,0]=4 2481 B17R3.4408 O=C1c2ccccc2-c3c1cccc3O 271570a_203496583355_100010741556 [0,1,0,0,1,0|1,0,0]=3 2482 B17R3.31713 Cn1c2ccccc2c3c1ccc(c3)O 271570a_203496583355_100009996057 [0,1,0,0,1,0|2,0,0]=4 2483 B17R3.31713 O=C1c2ccccc2-c3c1ccc(c3)O 271570a_203496583355_100010293230 [0,1,0,0,1,0|1,0,0]=3 2484 B17R3.31819 O=C1c2ccccc2-c3c1cc(cc3)O 271570a_203496583355_100009812156 [0,1,0,0,1,0|1,0,0]=3 2485 B17R3.51174 O=C1c2ccccc2-c3c1c(ccc3)O 271570a_203496583355_100010704374 [0,1,0,0,1,0|1,0,0]=3 2486 B17R3.182920 CNC1c2ccccc2-c3c1cccc3 2230a_100000104097_200000210301 [0,1,0,0,1,0|0,0,1]=3 2487 B17R3.182920 CNC1c2ccccc2-c3c1cccc3 2230a_106832991635_100000211598 [0,1,0,0,1,0|0,0,1]=3 2488 B17R3.182920 CNC1c2ccccc2-c3c1cccc3 7a_106832991635_100000211598 [0,1,0,0,1,0|0,0,1]=3 2489 B17R3.182920 COC1c2ccccc2-c3c1cccc3 7a_100000211495_200000210301 [0,1,0,0,1,0|1,0,1]=4 2490 B17R3.182920 CSC1c2ccccc2-c3c1cccc3 62a_100000211598_200000210301 [0,1,0,0,1,0|1,0,1]=4 2491 B17R3.182920 [13CH3]NC1c2ccccc2-c3c1cccc3 2230a_100000104097_200025704644 [0,1,0,0,1,0|0,0,1]=3 2492 B17R3.182920 [13CH3]OC1c2ccccc2-c3c1cccc3 7a_100000211495_200025704644 [0,1,0,0,1,0|1,0,1]=4 2493 B17R3.182920 [13CH3]SC1c2ccccc2-c3c1cccc3 62a_100000211598_200025704644 [0,1,0,0,1,0|1,0,1]=4 2494 B19R3.309265 COc1ccc2c(c1)oc(=O)c3c2cccc3 34a_100000011518_200000210301 [0,2,0,0,0,0|2,0,0]=4 2495 B19R3.309265 COc1ccc2c(c1)oc(=O)c3c2cccc3 7a_100000011518_200000210301 [0,2,0,0,0,0|2,0,0]=4 2496 B19R3.309265 [13CH3]Oc1ccc2c(c1)oc(=O)c3c2cccc3 34a_100000011518_200025704644 [0,2,0,0,0,0|2,0,0]=4 2497 B19R3.309265 [13CH3]Oc1ccc2c(c1)oc(=O)c3c2cccc3 7a_100000011518_200025704644 [0,2,0,0,0,0|2,0,0]=4 2498 B19R3.444415 O=C1C(=O)c2ccc(cc2-c3c1cccc3)O 271570a_203496583355_100015191286 [0,2,0,0,0,0|1,0,0]=3 2499 B19R3.142008 C=C=Cc1cc2ccccc2c3c1cccc3 271570a_100015277604_100009813645 [0,2,0,0,0,0|1,0,0]=3 2500 B19R3.142008 C=C=Cc1cc2cccnc2c3c1cccc3 271570a_100015277604_100050056114 [0,2,0,0,0,0|2,0,0]=4 2501 B19R3.142008 C=C=Cc1nc2ccccc2c3c1cccc3 271570a_100015277604_100000028652 [0,2,0,0,0,0|2,0,0]=4 2502 B19R3.142008 CC=Cc1cc2cccnc2c3c1cccc3 271570a_100016259895_100050056114 [0,2,0,0,0,0|2,0,0]=4 2503 B19R3.142008 CC=Cc1nc2ccccc2c3c1cccc3 271570a_100016259895_100000028652 [0,2,0,0,0,0|2,0,0]=4 2504 B19R3.142008 CCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100000210202 [0,2,0,0,0,0|0,0,0]=2 2505 B19R3.142008 CCNc1cc2cccnc2c3c1cccn3 27a_100015525214_100009991584 [0,2,0,0,0,0|2,0,0]=4 2506 B19R3.142008 CCNc1nc2ccccc2c3c1cccc3 27a_100015525214_100000028652 [0,2,0,0,0,0|1,0,0]=3 2507 B19R3.142008 CCOc1cc2ccccc2c3c1cccc3 34a_100000036577_100000210202 [0,2,0,0,0,0|1,0,0]=3 2508 B19R3.142008 CCOc1cc2ccccc2c3c1cccc3 7a_100000036577_100000210202 [0,2,0,0,0,0|1,0,0]=3 2509 B19R3.142008 CCSc1cc2cccnc2c3c1cccc3 62a_100000210202_100050056114 [0,2,0,0,0,0|2,0,0]=4 2510 B19R3.142008 CCSc1nc2ccccc2c3c1cccc3 62a_100000210202_100000028652 [0,2,0,0,0,0|2,0,0]=4 2511 B19R3.142008 CNCc1cc2ccccc2c3c1cccc3 207a_100102657272_100000033530 [0,2,0,0,0,0|0,0,0]=2 2512 B19R3.142008 CNCc1cc2ccccc2c3c1cccc3 270004a_106832991635_100000033530 [0,2,0,0,0,0|0,0,0]=2 2513 B19R3.142008 CNCc1cc2cccnc2c3c1cccn3 207a_100102657272_100010272385 [0,2,0,0,0,0|2,0,0]=4 2514 B19R3.142008 CNCc1cc2cccnc2c3c1cccn3 270004a_106832991635_100010272385 [0,2,0,0,0,0|2,0,0]=4 2515 B19R3.142008 FCNc1cc2ccccc2c3c1cccc3 34a_100000029970_100015361967 [0,2,0,0,0,0|0,0,0]=2 2516 B19R3.142008 FCOc1cc2ccccc2c3c1cccc3 34a_100000036577_100015361967 [0,2,0,0,0,0|1,0,0]=3 2517 B19R3.142008 FCOc1cc2ccccc2c3c1cccc3 7a_100000036577_100015361967 [0,2,0,0,0,0|1,0,0]=3 2518 B19R3.142008 FCSc1cc2cccnc2c3c1cccc3 62a_100015361967_100050056114 [0,2,0,0,0,0|2,0,0]=4 2519 B19R3.142008 FCSc1nc2ccccc2c3c1cccc3 62a_100015361967_100000028652 [0,2,0,0,0,0|2,0,0]=4 2520 B19R3.657184 C=C(C)c1cc2cccnc2c3c1cccc3 271570a_100000694244_100050056114 [0,2,0,0,0,0|2,0,0]=4 2521 B19R3.657184 C=C(C)c1nc2ccccc2c3c1cccc3 271570a_100000694244_100000028652 [0,2,0,0,0,0|2,0,0]=4 2522 B19R3.657184 CC(=O)c1cc2ccccc2c3c1cccc3 1458a_100020586880_200000210301 [0,2,0,0,0,0|1,0,0]=3 2523 B19R3.657184 CN(C)c1cc2cccnc2c3c1cccn3 27a_100102631434_100009991584 [0,2,0,0,0,0|2,0,0]=4 2524 B19R3.657184 CN(C)c1nc2ccccc2c3c1cccc3 27a_100102631434_100000028652 [0,2,0,0,0,0|1,0,0]=3 2525 B19R3.657184 [13CH3]C(=O)c1cc2ccccc2c3c1cccc3 1458a_100020586880_200025704644 [0,2,0,0,0,0|1,0,0]=3 2526 B15R1.5925 C=CC=CC(=O)Nc1ccccc1C=C 1626a_100012022501_100016291481 [0,0,2,0,0,0|2,0,0]=4 2527 B15R1.5925 C=CC=CC(=O)Nc1ccccc1C=C 22a_100012022501_100016291481 [0,0,2,0,0,0|2,0,0]=4 2528 B17R3.8708 C1=C(Cc2c1cccc2)c3ccccc3 271570a_100010239756_100000210277 [0,0,1,1,0,0|1,0,0]=3 2529 B17R3.8708 C1=C(Cc2c1cccc2)c3ccccn3 271570a_100010239756_100011216584 [0,0,1,1,0,0|2,0,0]=4 2530 B17R3.8708 C1=C(Cc2c1cccc2)c3cccnc3 271570a_100010239756_100000752921 [0,0,1,1,0,0|2,0,0]=4 2531 B17R3.8708 C1=C(Cc2c1cccc2)c3ccncc3 271570a_100010239756_100000035832 [0,0,1,1,0,0|2,0,0]=4 2532 B17R3.8708 c1ccc(cc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000210277 [0,0,1,1,0,0|0,0,0]=2 2533 B17R3.8708 c1ccc(cc1)c2cc3ccccc3[nH]2 271570a_100011218836_100010232065 [0,0,1,1,0,0|0,0,0]=2 2534 B17R3.8708 c1ccc(cc1)c2cc3ccccc3o2 271570a_100011218836_100010159458 [0,0,1,1,0,0|1,0,0]=3 2535 B17R3.8708 c1ccc(cc1)c2cc3ccccc3o2 271570a_100011328764_100000210277 [0,0,1,1,0,0|1,0,0]=3 2536 B17R3.8708 c1ccc(cc1)c2cc3ccccc3s2 271570a_100000034353_100000210277 [0,0,1,1,0,0|1,0,0]=3 2537 B17R3.8708 c1ccc(cc1)c2cc3ccccc3s2 271570a_100011218836_100009816949 [0,0,1,1,0,0|1,0,0]=3 2538 B17R3.8708 c1ccc(cc1)c2cc3cccnc3[nH]2 271570a_100011218836_100010079843 [0,0,1,1,0,0|1,0,0]=3 2539 B17R3.8708 c1ccc(cc1)c2cn3ccccc3n2 271570a_100011218836_100009819586 [0,0,1,1,0,0|1,0,1]=4 2540 B17R3.8708 c1ccc(cc1)c2nc3ccccc3[nH]2 271570a_100011218836_100009814255 [0,0,1,1,0,0|1,0,0]=3 2541 B17R3.8708 c1ccc(cc1)c2nc3ccccc3s2 271570a_100011218836_100000751744 [0,0,1,1,0,0|1,0,1]=4 2542 B17R3.8708 c1ccc(cc1)c2nc3ccccc3s2 271570a_200000082171_100000210277 [0,0,1,1,0,0|1,0,1]=4 2543 B17R3.8708 c1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100011216584 [0,0,1,1,0,0|1,0,0]=3 2544 B17R3.8708 c1ccc(nc1)c2cc3ccccc3[nH]2 271570a_100011264011_100010232065 [0,0,1,1,0,0|1,0,0]=3 2545 B17R3.8708 c1ccc(nc1)c2cc3ccccc3o2 271570a_100011264011_100010159458 [0,0,1,1,0,0|2,0,0]=4 2546 B17R3.8708 c1ccc(nc1)c2cc3ccccc3o2 271570a_100011328764_100011216584 [0,0,1,1,0,0|2,0,0]=4 2547 B17R3.8708 c1ccc(nc1)c2cc3ccccc3s2 271570a_100000034353_100011216584 [0,0,1,1,0,0|2,0,0]=4 2548 B17R3.8708 c1ccc(nc1)c2cc3ccccc3s2 271570a_100011264011_100009816949 [0,0,1,1,0,0|2,0,0]=4 2549 B17R3.8708 c1ccc(nc1)c2cc3cccnc3[nH]2 271570a_100011264011_100010079843 [0,0,1,1,0,0|2,0,0]=4 2550 B17R3.8708 c1ccc(nc1)c2nc3ccccc3[nH]2 271570a_100011264011_100009814255 [0,0,1,1,0,0|2,0,0]=4 2551 B17R3.8708 c1ccc2[nH]c(cc2c1)c3ccncc3 271570a_100000752145_100010232065 [0,0,1,1,0,0|1,0,0]=3 2552 B17R3.8708 c1ccc2[nH]c(cc2c1)c3ccncc3 271570a_100010206980_100000035832 [0,0,1,1,0,0|1,0,0]=3 2553 B17R3.8708 c1ccc2[nH]c(cc2c1)c3ccncn3 271570a_100010206980_100000703185 [0,0,1,1,0,0|2,0,0]=4 2554 B17R3.8708 c1ccc2[nH]c(cc2c1)c3ccnnc3 271570a_100010206980_100000732662 [0,0,1,1,0,0|2,0,0]=4 2555 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cnccn3 271570a_100010206980_100000758340 [0,0,1,1,0,0|2,0,0]=4 2556 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cnccn3 271570a_100011962566_100010232065 [0,0,1,1,0,0|2,0,0]=4 2557 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cncnc3 271570a_100000707473_100010232065 [0,0,1,1,0,0|2,0,0]=4 2558 B17R3.8708 c1ccc2[nH]c(cc2c1)c3cncnc3 271570a_100010206980_100011206942 [0,0,1,1,0,0|2,0,0]=4 2559 B17R3.8708 c1ccc2[nH]c(nc2c1)c3ccncc3 271570a_100000752145_100009814255 [0,0,1,1,0,0|2,0,0]=4 2560 B17R3.8708 c1ccc2oc(cc2c1)c3ccncc3 271570a_100000752145_100010159458 [0,0,1,1,0,0|2,0,0]=4 2561 B17R3.8708 c1ccc2oc(cc2c1)c3ccncc3 271570a_100011328764_100000035832 [0,0,1,1,0,0|2,0,0]=4 2562 B17R3.8708 c1ccc2sc(cc2c1)c3ccncc3 271570a_100000034353_100000035832 [0,0,1,1,0,0|2,0,0]=4 2563 B17R3.8708 c1ccc2sc(cc2c1)c3ccncc3 271570a_100000752145_100009816949 [0,0,1,1,0,0|2,0,0]=4 2564 B17R3.8708 c1cnc(nc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000211032 [0,0,1,1,0,0|2,0,0]=4 2565 B17R3.8708 c1cnc2[nH]c(cc2c1)c3ccncc3 271570a_100000752145_100010079843 [0,0,1,1,0,0|2,0,0]=4 2566 B17R3.8708 c1cncc(c1)c2cc3ccccc3[nH]2 271570a_100000757648_100010232065 [0,0,1,1,0,0|1,0,0]=3 2567 B17R3.8708 c1cncc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100000752921 [0,0,1,1,0,0|1,0,0]=3 2568 B17R3.8708 c1cncc(c1)c2cc3ccccc3o2 271570a_100000757648_100010159458 [0,0,1,1,0,0|2,0,0]=4 2569 B17R3.8708 c1cncc(c1)c2cc3ccccc3o2 271570a_100011328764_100000752921 [0,0,1,1,0,0|2,0,0]=4 2570 B17R3.8708 c1cncc(c1)c2cc3ccccc3s2 271570a_100000034353_100000752921 [0,0,1,1,0,0|2,0,0]=4 2571 B17R3.8708 c1cncc(c1)c2cc3ccccc3s2 271570a_100000757648_100009816949 [0,0,1,1,0,0|2,0,0]=4 2572 B17R3.8708 c1cncc(c1)c2cc3cccnc3[nH]2 271570a_100000757648_100010079843 [0,0,1,1,0,0|2,0,0]=4 2573 B17R3.8708 c1cncc(c1)c2nc3ccccc3[nH]2 271570a_100000757648_100009814255 [0,0,1,1,0,0|2,0,0]=4 2574 B17R3.8708 c1cnnc(c1)c2cc3ccccc3[nH]2 271570a_100010206980_100016991348 [0,0,1,1,0,0|2,0,0]=4 2575 B17R3.8707 C1=Cc2cccc(c2C1)c3ccccc3 271570a_100011218836_100009844718 [0,0,1,1,0,0|1,0,1]=4 2576 B17R3.8707 c1cc(c2cc[nH]c2c1)c3ccncc3 271570a_100000069030_100000035832 [0,0,1,1,0,0|1,0,0]=3 2577 B17R3.8707 c1cc(c2cc[nH]c2c1)c3ccncc3 271570a_100000752145_100000685724 [0,0,1,1,0,0|1,0,0]=3 2578 B17R3.8707 c1cc(c2cc[nH]c2c1)c3ccncn3 271570a_100000069030_100000703185 [0,0,1,1,0,0|2,0,0]=4 2579 B17R3.8707 c1cc(c2cc[nH]c2c1)c3ccnnc3 271570a_100000069030_100000732662 [0,0,1,1,0,0|2,0,0]=4 2580 B17R3.8707 c1cc(c2cc[nH]c2c1)c3cnccn3 271570a_100000069030_100000758340 [0,0,1,1,0,0|2,0,0]=4 2581 B17R3.8707 c1cc(c2cc[nH]c2c1)c3cnccn3 271570a_100011962566_100000685724 [0,0,1,1,0,0|2,0,0]=4 2582 B17R3.8707 c1cc(c2cc[nH]c2c1)c3cncnc3 271570a_100000069030_100011206942 [0,0,1,1,0,0|2,0,0]=4 2583 B17R3.8707 c1cc(c2cc[nH]c2c1)c3cncnc3 271570a_100000707473_100000685724 [0,0,1,1,0,0|2,0,0]=4 2584 B17R3.8707 c1cc(c2ccoc2c1)c3ccncc3 271570a_100000752145_100000756496 [0,0,1,1,0,0|2,0,0]=4 2585 B17R3.8707 c1cc(c2ccsc2c1)c3ccncc3 271570a_100000752145_100009816950 [0,0,1,1,0,0|2,0,0]=4 2586 B17R3.8707 c1cc(c2ccsc2c1)c3ccncc3 271570a_100010179806_100000035832 [0,0,1,1,0,0|2,0,0]=4 2587 B17R3.8707 c1cc(c2cn[nH]c2c1)c3ccncc3 271570a_100000068625_100000035832 [0,0,1,1,0,0|2,0,0]=4 2588 B17R3.8707 c1cc(c2cn[nH]c2c1)c3ccncc3 271570a_100000752145_100000753301 [0,0,1,1,0,0|2,0,0]=4 2589 B17R3.8707 c1cc(c2nc[nH]c2c1)c3ccncc3 271570a_100000752145_100011935113 [0,0,1,1,0,0|2,0,0]=4 2590 B17R3.8707 c1cc(ccn1)c2ccnc3c2cc[nH]3 271570a_100000752145_100000049914 [0,0,1,1,0,0|2,0,0]=4 2591 B17R3.8707 c1cc(ccn1)c2ccnc3c2cc[nH]3 271570a_100000766216_100000035832 [0,0,1,1,0,0|2,0,0]=4 2592 B17R3.8707 c1cc(ccn1)c2cncc3c2cc[nH]3 271570a_100000752145_100009840476 [0,0,1,1,0,0|2,0,0]=4 2593 B17R3.8707 c1cc(ccn1)c2nccc3c2cc[nH]3 271570a_100000752145_100000086534 [0,0,1,1,0,0|2,0,0]=4 2594 B17R3.8707 c1ccc(cc1)c2cccc3c2CCN3 271570a_100011218836_100009817896 [0,0,1,1,0,0|0,0,2]=4 2595 B17R3.8707 c1ccc(cc1)c2cccc3c2[nH]cc3 271570a_100000069292_100000210277 [0,0,1,1,0,0|2,0,0]=4 2596 B17R3.8707 c1ccc(cc1)c2cccc3c2[nH]cc3 271570a_100011218836_100009813418 [0,0,1,1,0,0|2,0,0]=4 2597 B17R3.8707 c1ccc(cc1)c2cccc3c2cc[nH]3 271570a_100000069030_100000210277 [0,0,1,1,0,0|0,0,0]=2 2598 B17R3.8707 c1ccc(cc1)c2cccc3c2cc[nH]3 271570a_100011218836_100000685724 [0,0,1,1,0,0|0,0,0]=2 2599 B17R3.8707 c1ccc(cc1)c2cccc3c2cco3 271570a_100011218836_100000756496 [0,0,1,1,0,0|1,0,0]=3 2600 B17R3.8707 c1ccc(cc1)c2cccc3c2ccs3 271570a_100010179806_100000210277 [0,0,1,1,0,0|1,0,0]=3 2601 B17R3.8707 c1ccc(cc1)c2cccc3c2ccs3 271570a_100011218836_100009816950 [0,0,1,1,0,0|1,0,0]=3 2602 B17R3.8707 c1ccc(cc1)c2cccc3c2cn[nH]3 271570a_100000068625_100000210277 [0,0,1,1,0,0|1,0,0]=3 2603 B17R3.8707 c1ccc(cc1)c2cccc3c2cn[nH]3 271570a_100011218836_100000753301 [0,0,1,1,0,0|1,0,0]=3 2604 B17R3.8707 c1ccc(cc1)c2cccc3c2cno3 271570a_100011218836_100009818589 [0,0,1,1,0,0|2,0,0]=4 2605 B17R3.8707 c1ccc(cc1)c2cccc3c2nc[nH]3 271570a_100011218836_100011935113 [0,0,1,1,0,0|1,0,0]=3 2606 B17R3.8707 c1ccc(cc1)c2cccc3c2nco3 271570a_100011218836_100009816834 [0,0,1,1,0,0|2,0,0]=4 2607 B17R3.8707 c1ccc(cc1)c2cccc3c2ncs3 271570a_100011218836_100000726125 [0,0,1,1,0,0|2,0,0]=4 2608 B17R3.8707 c1ccc(cc1)c2cccc3c2occ3 271570a_100010270576_100000210277 [0,0,1,1,0,0|2,0,0]=4 2609 B17R3.8707 c1ccc(cc1)c2cccc3c2occ3 271570a_100011218836_100011935138 [0,0,1,1,0,0|2,0,0]=4 2610 B17R3.8707 c1ccc(cc1)c2cccc3c2ocn3 271570a_100010082643_100000210277 [0,0,1,1,0,0|1,0,1]=4 2611 B17R3.8707 c1ccc(cc1)c2cccc3c2ocn3 271570a_100011218836_100000728214 [0,0,1,1,0,0|1,0,1]=4 2612 B17R3.8707 c1ccc(cc1)c2cccc3c2scc3 271570a_100011218836_100000766737 [0,0,1,1,0,0|2,0,0]=4 2613 B17R3.8707 c1ccc(cc1)c2cccc3c2scc3 271570a_100011934518_100000210277 [0,0,1,1,0,0|2,0,0]=4 2614 B17R3.8707 c1ccc(cc1)c2cccc3c2scn3 271570a_100011218836_100010246326 [0,0,1,1,0,0|1,0,1]=4 2615 B17R3.8707 c1ccc(cc1)c2cccc3n2ccn3 271570a_100011218836_100000762677 [0,0,1,1,0,0|1,0,1]=4 2616 B17R3.8707 c1ccc(cc1)c2cccn3c2ccn3 271570a_100011218836_100010767162 [0,0,1,1,0,0|1,0,1]=4 2617 B17R3.8707 c1ccc(cc1)c2ccnc3c2cc[nH]3 271570a_100000766216_100000210277 [0,0,1,1,0,0|1,0,0]=3 2618 B17R3.8707 c1ccc(cc1)c2ccnc3c2cc[nH]3 271570a_100011218836_100000049914 [0,0,1,1,0,0|1,0,0]=3 2619 B17R3.8707 c1ccc(cc1)c2ccnc3c2ccs3 271570a_100011218836_100009861243 [0,0,1,1,0,0|2,0,0]=4 2620 B17R3.8707 c1ccc(cc1)c2ccnc3c2cn[nH]3 271570a_100011218836_100009819725 [0,0,1,1,0,0|2,0,0]=4 2621 B17R3.8707 c1ccc(cc1)c2ccnc3c2nc[nH]3 271570a_100011218836_100009820729 [0,0,1,1,0,0|2,0,0]=4 2622 B17R3.8707 c1ccc(cc1)c2cncc3c2cc[nH]3 271570a_100011218836_100009840476 [0,0,1,1,0,0|1,0,0]=3 2623 B17R3.8707 c1ccc(cc1)c2cncc3c2cn[nH]3 271570a_100011218836_100009819959 [0,0,1,1,0,0|2,0,0]=4 2624 B17R3.8707 c1ccc(cc1)c2nccc3c2cc[nH]3 271570a_100011218836_100000086534 [0,0,1,1,0,0|1,0,0]=3 2625 B17R3.8707 c1ccc(cc1)c2nccc3c2cco3 271570a_100011218836_100000041166 [0,0,1,1,0,0|2,0,0]=4 2626 B17R3.8707 c1ccc(cc1)c2nccc3c2ccs3 271570a_100011218836_100000047778 [0,0,1,1,0,0|2,0,0]=4 2627 B17R3.8707 c1ccc(cc1)c2nccc3c2cn[nH]3 271570a_100011218836_100102525074 [0,0,1,1,0,0|2,0,0]=4 2628 B17R3.8707 c1ccc(cc1)c2nccc3c2nc[nH]3 271570a_100011218836_100009820035 [0,0,1,1,0,0|2,0,0]=4 2629 B17R3.8707 c1ccc(nc1)c2cccc3c2cc[nH]3 271570a_100000069030_100011216584 [0,0,1,1,0,0|1,0,0]=3 2630 B17R3.8707 c1ccc(nc1)c2cccc3c2cc[nH]3 271570a_100011264011_100000685724 [0,0,1,1,0,0|1,0,0]=3 2631 B17R3.8707 c1ccc(nc1)c2cccc3c2cco3 271570a_100011264011_100000756496 [0,0,1,1,0,0|2,0,0]=4 2632 B17R3.8707 c1ccc(nc1)c2cccc3c2ccs3 271570a_100010179806_100011216584 [0,0,1,1,0,0|2,0,0]=4 2633 B17R3.8707 c1ccc(nc1)c2cccc3c2ccs3 271570a_100011264011_100009816950 [0,0,1,1,0,0|2,0,0]=4 2634 B17R3.8707 c1ccc(nc1)c2cccc3c2cn[nH]3 271570a_100000068625_100011216584 [0,0,1,1,0,0|2,0,0]=4 2635 B17R3.8707 c1ccc(nc1)c2cccc3c2cn[nH]3 271570a_100011264011_100000753301 [0,0,1,1,0,0|2,0,0]=4 2636 B17R3.8707 c1ccc(nc1)c2cccc3c2nc[nH]3 271570a_100011264011_100011935113 [0,0,1,1,0,0|2,0,0]=4 2637 B17R3.8707 c1ccc(nc1)c2ccnc3c2cc[nH]3 271570a_100000766216_100011216584 [0,0,1,1,0,0|2,0,0]=4 2638 B17R3.8707 c1ccc(nc1)c2ccnc3c2cc[nH]3 271570a_100011264011_100000049914 [0,0,1,1,0,0|2,0,0]=4 2639 B17R3.8707 c1ccc(nc1)c2cncc3c2cc[nH]3 271570a_100011264011_100009840476 [0,0,1,1,0,0|2,0,0]=4 2640 B17R3.8707 c1ccc(nc1)c2nccc3c2cc[nH]3 271570a_100011264011_100000086534 [0,0,1,1,0,0|2,0,0]=4 2641 B17R3.8707 c1cnc(nc1)c2cccc3c2cc[nH]3 271570a_100000069030_100000211032 [0,0,1,1,0,0|2,0,0]=4 2642 B17R3.8707 c1cncc(c1)c2cccc3c2cc[nH]3 271570a_100000069030_100000752921 [0,0,1,1,0,0|1,0,0]=3 2643 B17R3.8707 c1cncc(c1)c2cccc3c2cc[nH]3 271570a_100000757648_100000685724 [0,0,1,1,0,0|1,0,0]=3 2644 B17R3.8707 c1cncc(c1)c2cccc3c2cco3 271570a_100000757648_100000756496 [0,0,1,1,0,0|2,0,0]=4 2645 B17R3.8707 c1cncc(c1)c2cccc3c2ccs3 271570a_100000757648_100009816950 [0,0,1,1,0,0|2,0,0]=4 2646 B17R3.8707 c1cncc(c1)c2cccc3c2ccs3 271570a_100010179806_100000752921 [0,0,1,1,0,0|2,0,0]=4 2647 B17R3.8707 c1cncc(c1)c2cccc3c2cn[nH]3 271570a_100000068625_100000752921 [0,0,1,1,0,0|2,0,0]=4 2648 B17R3.8707 c1cncc(c1)c2cccc3c2cn[nH]3 271570a_100000757648_100000753301 [0,0,1,1,0,0|2,0,0]=4 2649 B17R3.8707 c1cncc(c1)c2cccc3c2nc[nH]3 271570a_100000757648_100011935113 [0,0,1,1,0,0|2,0,0]=4 2650 B17R3.8707 c1cncc(c1)c2ccnc3c2cc[nH]3 271570a_100000757648_100000049914 [0,0,1,1,0,0|2,0,0]=4 2651 B17R3.8707 c1cncc(c1)c2ccnc3c2cc[nH]3 271570a_100000766216_100000752921 [0,0,1,1,0,0|2,0,0]=4 2652 B17R3.8707 c1cncc(c1)c2cncc3c2cc[nH]3 271570a_100000757648_100009840476 [0,0,1,1,0,0|2,0,0]=4 2653 B17R3.8707 c1cncc(c1)c2nccc3c2cc[nH]3 271570a_100000757648_100000086534 [0,0,1,1,0,0|2,0,0]=4 2654 B17R3.8707 c1cnnc(c1)c2cccc3c2cc[nH]3 271570a_100000069030_100016991348 [0,0,1,1,0,0|2,0,0]=4 2655 B17R3.35227 Oc1c2ccccc2cc3c1cccc3 271570a_203496583355_100000185772 [0,0,1,1,0,0|1,0,0]=3 2656 B17R3.35227 Oc1c2ccccc2nc3c1cccc3 271570a_203496583355_100000044299 [0,0,1,1,0,0|2,0,0]=4 2657 B17R3.3205 Oc1ccc2cc3ccccc3cc2c1 271570a_203496583355_100010186462 [0,0,1,1,0,0|2,0,0]=4 2658 B17R3.83064 C=Cc1cccc2c1c3c([nH]2)cccc3 271570a_100011290941_100010159384 [0,0,1,1,0,0|2,0,0]=4 2659 B17R3.83064 C=Cc1cccc2c1c3c(o2)cccc3 271570a_100011290941_100010743613 [0,0,1,1,0,0|2,0,0]=4 2660 B17R3.83064 C=Cc1cccc2c1c3c(s2)cccc3 271570a_100011290941_100010159529 [0,0,1,1,0,0|2,0,0]=4 2661 B15R2.63 NC(=O)c1cscc1c2ccccc2 271570a_100011218836_100009817205 [0,0,1,0,1,0|2,0,0]=4 2662 B15R2.1221 C=C(C)c1ccccc1n2cccc2 271570a_100000694244_200000178846 [0,0,1,0,1,0|2,0,0]=4 2663 B15R2.1221 NC(=O)c1ccccc1c2cc[nH]c2 271570a_100000102155_100000162227 [0,0,1,0,1,0|2,0,0]=4 2664 B15R2.1221 NC(=O)c1ccccc1c2ccco2 271570a_100000041535_100009814098 [0,0,1,0,1,0|2,0,0]=4 2665 B15R2.1221 NC(=O)c1ccccc1c2ccco2 271570a_100000750936_100000162227 [0,0,1,0,1,0|2,0,0]=4 2666 B15R2.1221 NC(=O)c1ccccc1c2cccs2 271570a_100000041535_100011215356 [0,0,1,0,1,0|2,0,0]=4 2667 B15R2.1221 NC(=O)c1ccccc1c2cccs2 271570a_100000742291_100000162227 [0,0,1,0,1,0|2,0,0]=4 2668 B15R2.1221 NC(=O)c1ccccc1c2ccoc2 271570a_100000041535_100011215275 [0,0,1,0,1,0|2,0,0]=4 2669 B15R2.1221 NC(=O)c1ccccc1c2ccoc2 271570a_100011218838_100000162227 [0,0,1,0,1,0|2,0,0]=4 2670 B15R2.1221 NC(=O)c1ccccc1c2ccsc2 271570a_100000041535_100000738268 [0,0,1,0,1,0|2,0,0]=4 2671 B15R2.1221 NC(=O)c1ccccc1c2ccsc2 271570a_100011934443_100000162227 [0,0,1,0,1,0|2,0,0]=4 2672 B15R2.2226 C=C(c1ccccc1)c2ccccc2 271570a_100000068269_100000210277 [0,0,1,0,1,0|1,0,0]=3 2673 B15R2.2226 C=C(c1ccccc1)c2ccccn2 271570a_100000068269_100011216584 [0,0,1,0,1,0|2,0,0]=4 2674 B15R2.2226 C=C(c1ccccc1)c2cccnc2 271570a_100000068269_100000752921 [0,0,1,0,1,0|2,0,0]=4 2675 B15R2.2226 C=C(c1ccccc1)c2ccncc2 271570a_100000068269_100000035832 [0,0,1,0,1,0|2,0,0]=4 2676 B15R2.43 CC=Cc1ccccc1n2cccc2 271570a_100016259895_200000178846 [0,0,1,0,1,0|2,0,0]=4 2677 B17R2.5618 C=C(C)c1ccccc1Cc2ccccc2 271570a_100000694244_200011216382 [0,0,1,0,0,1|1,0,0]=3 2678 B17R2.5618 C=C(C)c1ccccc1Oc2ccccc2 271570a_100000694244_100000049502 [0,0,1,0,0,1|1,0,0]=3 2679 B17R2.5618 CC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_200000210301 [0,0,1,0,0,1|1,0,1]=4 2680 B17R2.5618 CC(=O)c1ccccc1Oc2ccccc2 1458a_100000185727_200000210301 [0,0,1,0,0,1|1,0,1]=4 2681 B17R2.5618 CC(=O)c1ccccc1Sc2ccccc2 1458a_100000187566_200000210301 [0,0,1,0,0,1|1,0,1]=4 2682 B17R2.5618 CC(=O)c1ccccc1Sc2ccccc2 62a_100000751169_100000041952 [0,0,1,0,0,1|1,0,1]=4 2683 B17R2.5618 CC(=O)c1ccccc1[I+]c2ccccc2 1458a_100015188722_200000210301 [0,0,1,0,0,1|1,0,1]=4 2684 B17R2.5618 CC(N)c1ccccc1Sc2ccccc2 62a_100000181357_100000041952 [0,0,1,0,0,1|0,0,2]=4 2685 B17R2.5618 CC(N)c1ccccc1Sc2ccccc2 62a_100000719477_100000181357 [0,0,1,0,0,1|0,0,2]=4 2686 B17R2.5618 NC(=O)c1ccccc1Sc2ccccc2 62a_100000162227_100000041952 [0,0,1,0,0,1|1,0,0]=3 2687 B17R2.5618 NC(=O)c1ccccc1Sc2ccccc2 62a_100000719477_100000162227 [0,0,1,0,0,1|1,0,0]=3 2688 B17R2.5618 NC(=O)c1ccccc1Sc2ccccn2 62a_100000162227_100011216584 [0,0,1,0,0,1|2,0,0]=4 2689 B17R2.5618 NC(=O)c1ccccc1Sc2ccccn2 62a_100011216584_100000162227 [0,0,1,0,0,1|2,0,0]=4 2690 B17R2.5618 NC(=O)c1ccccc1Sc2cccnc2 62a_100000162227_100000210063 [0,0,1,0,0,1|2,0,0]=4 2691 B17R2.5618 NC(=O)c1ccccc1Sc2cccnc2 62a_100000210063_100000162227 [0,0,1,0,0,1|2,0,0]=4 2692 B17R2.5618 NC(=O)c1ccccc1Sc2ccncc2 62a_100000162227_100000728582 [0,0,1,0,0,1|2,0,0]=4 2693 B17R2.5618 NC(=O)c1ccccc1Sc2ccncc2 62a_100000728582_100000162227 [0,0,1,0,0,1|2,0,0]=4 2694 B17R2.5618 NC(=O)c1cccnc1Nc2ccccc2 27a_100000106764_100000162199 [0,0,1,0,0,1|2,0,0]=4 2695 B17R2.5618 NC(=O)c1cccnc1Sc2ccccc2 62a_100000162199_100000041952 [0,0,1,0,0,1|2,0,0]=4 2696 B17R2.5618 NC(=O)c1cccnc1Sc2ccccc2 62a_100000719477_100000162199 [0,0,1,0,0,1|2,0,0]=4 2697 B17R2.5618 NC(=O)c1ccncc1Sc2ccccc2 62a_100000719477_100010205435 [0,0,1,0,0,1|2,0,0]=4 2698 B17R2.5618 NC(=O)c1ccncc1Sc2ccccc2 62a_100010205435_100000041952 [0,0,1,0,0,1|2,0,0]=4 2699 B17R2.5618 NC(=O)c1cnccc1Nc2ccccc2 27a_100000106764_100000697804 [0,0,1,0,0,1|2,0,0]=4 2700 B17R2.5618 NC(=O)c1cnccc1Sc2ccccc2 62a_100000697804_100000041952 [0,0,1,0,0,1|2,0,0]=4 2701 B17R2.5618 NC(=O)c1cnccc1Sc2ccccc2 62a_100000719477_100000697804 [0,0,1,0,0,1|2,0,0]=4 2702 B17R2.5618 NC(=O)c1ncccc1Nc2ccccc2 27a_100000106764_200012359670 [0,0,1,0,0,1|2,0,0]=4 2703 B17R2.5618 NC(=O)c1ncccc1Sc2ccccc2 62a_100000719477_200012359670 [0,0,1,0,0,1|2,0,0]=4 2704 B17R2.5618 NC(=O)c1ncccc1Sc2ccccc2 62a_200012359670_100000041952 [0,0,1,0,0,1|2,0,0]=4 2705 B17R2.5618 O=C(O)c1ccccc1Sc2ccccc2 62a_100000719477_100000734275 [0,0,1,0,0,1|2,0,0]=4 2706 B17R2.5618 O=C(O)c1ccccc1Sc2ccccc2 62a_202125556159_100000041952 [0,0,1,0,0,1|2,0,0]=4 2707 B17R2.5618 [13CH3]C(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_200025704644 [0,0,1,0,0,1|1,0,1]=4 2708 B17R2.5618 [13CH3]C(=O)c1ccccc1Oc2ccccc2 1458a_100000185727_200025704644 [0,0,1,0,0,1|1,0,1]=4 2709 B17R2.5618 [13CH3]C(=O)c1ccccc1Sc2ccccc2 1458a_100000187566_200025704644 [0,0,1,0,0,1|1,0,1]=4 2710 B17R2.5618 [13CH3]C(=O)c1ccccc1[I+]c2ccccc2 1458a_100015188722_200025704644 [0,0,1,0,0,1|1,0,1]=4 2711 B17R2.2342 CC(=NNc1ccccc1)c2ccccc2 4a_100015195140_100000185851 [0,0,1,0,0,1|2,0,0]=4 2712 B17R2.2342 O=C(CCc1ccccc1)c2ccccc2 1458a_100000185807_100000765856 [0,0,1,0,0,1|1,0,1]=4 2713 B17R2.2342 O=C(COc1ccccc1)c2ccccc2 7a_100000210340_100000211460 [0,0,1,0,0,1|1,0,1]=4 2714 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 62a_100000211460_100000041952 [0,0,1,0,0,1|1,0,1]=4 2715 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 62a_100000719477_100000211460 [0,0,1,0,0,1|1,0,1]=4 2716 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 11a_100015324214_100000185807 [0,0,1,0,0,1|1,0,1]=4 2717 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 1626a_100015324214_100000185807 [0,0,1,0,0,1|1,0,1]=4 2718 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 240690a_100015324214_100000185807 [0,0,1,0,0,1|1,0,1]=4 2719 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 527a_100015324214_100000185807 [0,0,1,0,0,1|1,0,1]=4 2720 B17R2.2342 O=C(NNc1ccccc1)c2ccccc2 22a_100015195140_100000185807 [0,0,1,0,0,1|2,0,0]=4 2721 B17R2.87 C=C=Cc1ccccc1Cc2ccccc2 271570a_100015277604_200011216382 [0,0,1,0,0,1|1,0,1]=4 2722 B17R2.87 C=C=Cc1ccccc1Oc2ccccc2 271570a_100015277604_100000049502 [0,0,1,0,0,1|1,0,1]=4 2723 B17R2.87 C=CCc1ccccc1Sc2ccccc2 62a_100000719477_100009828059 [0,0,1,0,0,1|1,0,1]=4 2724 B17R2.87 C=CCc1ccccc1Sc2ccccc2 62a_100009828059_100000041952 [0,0,1,0,0,1|1,0,1]=4 2725 B17R2.87 CC=Cc1ccccc1Cc2ccccc2 271570a_100016259895_200011216382 [0,0,1,0,0,1|1,0,0]=3 2726 B17R2.87 CC=Cc1ccccc1Oc2ccccc2 271570a_100016259895_100000049502 [0,0,1,0,0,1|1,0,0]=3 2727 B17R2.87 NCCc1ccccc1Sc2ccccc2 62a_100000719477_100000747383 [0,0,1,0,0,1|0,0,2]=4 2728 B17R2.87 NCCc1ccccc1Sc2ccccc2 62a_100000747383_100000041952 [0,0,1,0,0,1|0,0,2]=4 2729 B17R2.87 NNCc1ccccc1Sc2ccccc2 62a_100000719477_200016993956 [0,0,1,0,0,1|1,0,1]=4 2730 B17R2.87 NNCc1ccccc1Sc2ccccc2 62a_200016993956_100000041952 [0,0,1,0,0,1|1,0,1]=4 2731 B17R2.87 O=CNc1ccccc1Sc2ccccc2 62a_100000719477_200020615051 [0,0,1,0,0,1|2,0,0]=4 2732 B17R2.87 O=CNc1ccccc1Sc2ccccc2 62a_200020615051_100000041952 [0,0,1,0,0,1|2,0,0]=4 2733 B17R2.1470 C=Cc1ccccc1Sc2ccccc2C 62a_100000210755_100011218376 [0,0,1,0,0,1|1,0,1]=4 2734 B17R2.1470 C=Cc1ccccc1Sc2ccccc2C 62a_100011218376_100000210755 [0,0,1,0,0,1|1,0,1]=4 2735 B17R2.1470 C=Cc1ccccc1Sc2ccccc2F 62a_100011215700_100011218376 [0,0,1,0,0,1|2,0,0]=4 2736 B17R2.1470 C=Cc1ccccc1Sc2ccccc2F 62a_100011218376_100011215700 [0,0,1,0,0,1|2,0,0]=4 2737 B17R2.1470 C=Cc1ccccc1Sc2ccccc2N 62a_100000210017_100011218376 [0,0,1,0,0,1|2,0,0]=4 2738 B17R2.1470 C=Cc1ccccc1Sc2ccccc2N 62a_100011218376_100000210017 [0,0,1,0,0,1|2,0,0]=4 2739 B17R2.1470 C=Cc1ccccc1Sc2ccccc2O 62a_100000739446_100011218376 [0,0,1,0,0,1|2,0,0]=4 2740 B17R2.1470 C=Cc1ccccc1Sc2ccccc2O 62a_100011218376_100000739446 [0,0,1,0,0,1|2,0,0]=4 2741 B17R2.1470 Cc1ccccc1Sc2ccccc2C=O 62a_100000210073_100000210755 [0,0,1,0,0,1|1,0,1]=4 2742 B17R2.1470 Cc1ccccc1Sc2ccccc2C=O 62a_100000210755_100000210073 [0,0,1,0,0,1|1,0,1]=4 2743 B17R2.1470 Cc1ccccc1Sc2ccccc2CN 62a_100000210755_100000689332 [0,0,1,0,0,1|0,0,2]=4 2744 B17R2.1470 Cc1ccccc1Sc2ccccc2CN 62a_100000689332_100000210755 [0,0,1,0,0,1|0,0,2]=4 2745 B17R2.1470 Cc1ccccc1Sc2ccccc2NN 62a_100000210755_100000241748 [0,0,1,0,0,1|1,0,1]=4 2746 B17R2.1470 Cc1ccccc1Sc2ccccc2NN 62a_100000241748_100000210755 [0,0,1,0,0,1|1,0,1]=4 2747 B17R2.1470 NCc1ccccc1Sc2ccccc2Br 62a_100000689332_100000695589 [0,0,1,0,0,1|1,0,1]=4 2748 B17R2.1470 NCc1ccccc1Sc2ccccc2Br 62a_100000695589_100000689332 [0,0,1,0,0,1|1,0,1]=4 2749 B17R2.1470 NCc1ccccc1Sc2ccccc2Cl 62a_100000689332_100000764095 [0,0,1,0,0,1|1,0,1]=4 2750 B17R2.1470 NCc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000689332 [0,0,1,0,0,1|1,0,1]=4 2751 B17R2.1470 NCc1ccccc1Sc2ccccc2F 62a_100000689332_100011215700 [0,0,1,0,0,1|1,0,1]=4 2752 B17R2.1470 NCc1ccccc1Sc2ccccc2F 62a_100011215700_100000689332 [0,0,1,0,0,1|1,0,1]=4 2753 B17R2.1470 NCc1ccccc1Sc2ccccc2N 62a_100000210017_100000689332 [0,0,1,0,0,1|1,0,1]=4 2754 B17R2.1470 NCc1ccccc1Sc2ccccc2N 62a_100000689332_100000210017 [0,0,1,0,0,1|1,0,1]=4 2755 B17R2.1470 NCc1ccccc1Sc2ccccc2O 62a_100000689332_100000739446 [0,0,1,0,0,1|1,0,1]=4 2756 B17R2.1470 NCc1ccccc1Sc2ccccc2O 62a_100000739446_100000689332 [0,0,1,0,0,1|1,0,1]=4 2757 B17R2.1470 NNc1ccccc1Sc2ccccc2Br 62a_100000241748_100000695589 [0,0,1,0,0,1|2,0,0]=4 2758 B17R2.1470 NNc1ccccc1Sc2ccccc2Br 62a_100000695589_100000241748 [0,0,1,0,0,1|2,0,0]=4 2759 B17R2.1470 NNc1ccccc1Sc2ccccc2Cl 62a_100000241748_100000764095 [0,0,1,0,0,1|2,0,0]=4 2760 B17R2.1470 NNc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000241748 [0,0,1,0,0,1|2,0,0]=4 2761 B17R2.1470 NNc1ccccc1Sc2ccccc2F 62a_100000241748_100011215700 [0,0,1,0,0,1|2,0,0]=4 2762 B17R2.1470 NNc1ccccc1Sc2ccccc2F 62a_100011215700_100000241748 [0,0,1,0,0,1|2,0,0]=4 2763 B17R2.1470 NNc1ccccc1Sc2ccccc2N 62a_100000210017_100000241748 [0,0,1,0,0,1|2,0,0]=4 2764 B17R2.1470 NNc1ccccc1Sc2ccccc2N 62a_100000241748_100000210017 [0,0,1,0,0,1|2,0,0]=4 2765 B17R2.1470 NNc1ccccc1Sc2ccccc2O 62a_100000241748_100000739446 [0,0,1,0,0,1|2,0,0]=4 2766 B17R2.1470 NNc1ccccc1Sc2ccccc2O 62a_100000739446_100000241748 [0,0,1,0,0,1|2,0,0]=4 2767 B17R2.1470 Nc1ccccc1Sc2ccccc2C=O 62a_100000210017_100000210073 [0,0,1,0,0,1|2,0,0]=4 2768 B17R2.1470 Nc1ccccc1Sc2ccccc2C=O 62a_100000210073_100000210017 [0,0,1,0,0,1|2,0,0]=4 2769 B17R2.1470 O=Cc1ccccc1Sc2ccccc2Br 62a_100000210073_100000695589 [0,0,1,0,0,1|2,0,0]=4 2770 B17R2.1470 O=Cc1ccccc1Sc2ccccc2Br 62a_100000695589_100000210073 [0,0,1,0,0,1|2,0,0]=4 2771 B17R2.1470 O=Cc1ccccc1Sc2ccccc2Cl 62a_100000210073_100000764095 [0,0,1,0,0,1|2,0,0]=4 2772 B17R2.1470 O=Cc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000210073 [0,0,1,0,0,1|2,0,0]=4 2773 B17R2.1470 O=Cc1ccccc1Sc2ccccc2F 62a_100000210073_100011215700 [0,0,1,0,0,1|2,0,0]=4 2774 B17R2.1470 O=Cc1ccccc1Sc2ccccc2F 62a_100011215700_100000210073 [0,0,1,0,0,1|2,0,0]=4 2775 B17R2.1470 O=Cc1ccccc1Sc2ccccc2O 62a_100000210073_100000739446 [0,0,1,0,0,1|2,0,0]=4 2776 B17R2.1470 O=Cc1ccccc1Sc2ccccc2O 62a_100000739446_100000210073 [0,0,1,0,0,1|2,0,0]=4