0 B10R1.18 CC(=O)NC1=CC=CC=N1 HY-W101320 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.18 CC(=O)OC1=CC=CC=C1 HY-128733 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.18 CC(=O)OC1=CC=CC=C1 HY-128733R [0,0,0,0,0,0|2,0,1]=3 3 B10R1.18 CC(=S)NC1=CC=CC=C1 HY-129756 [0,0,0,0,0,0|2,1,0]=3 4 B10R1.18 CC(O)CC1=CC=CC=C1 HY-W101415 [0,0,0,0,0,0|1,0,1]=2 5 B10R1.18 NC(=O)CC1=CC=CC=C1 HY-W018197 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.18 NC(=O)NC1=CC=CC=C1 HY-W017044 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.18 NC(=S)NC1=CC=CC=C1 HY-Y0351 [0,0,0,0,0,0|3,1,0]=4 8 B10R1.18 O=C(O)CC1=CC=CC=N1 HY-W016825 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.18 O=C(O)CC1=CC=CN=C1 HY-W004515 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.18 O=C(O)CC1=CN=CC=C1 HY-W015806 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.8 BrCCC1=CC=CC=C1 HY-Y0199 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.8 CCOC1=CC=CC=C1 HY-Y1207 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.8 CNCC1=CC=CC=C1 HY-W007426 [1,0,0,0,0,0|1,0,0]=2 14 B9R1.8 NOCC1=CC=CC=C1 HY-41915 [1,0,0,0,0,0|1,1,0]=3 15 B9R1.8 OCCC1=CC=CC=C1 HY-B1290 [1,0,0,0,0,0|1,0,1]=3 16 B9R1.8 ONCC1=CC=CC=C1 HY-W002216 [1,0,0,0,0,0|1,0,1]=3 17 B9R1.8 [2H]OCC1=CC=CC=C1 HY-B0892S4 [1,0,0,0,0,0|1,1,0]=3 18 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 HY-66005 [0,1,0,0,0,0|2,0,1]=4 19 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 HY-66005R [0,1,0,0,0,0|2,0,1]=4 20 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 HY-30267 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 HY-75476 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 HY-W010062 [0,1,0,0,0,0|2,0,1]=4 23 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 HY-N1902 [0,1,0,0,0,0|2,0,1]=4 24 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 HY-N1902R [0,1,0,0,0,0|2,0,1]=4 25 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 HY-W018758 [0,1,0,0,0,0|1,0,2]=4 26 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 HY-W015608 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 HY-W010248 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 HY-W017406 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 HY-W015591 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 HY-129629 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 HY-Y0816 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 HY-Y0585 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.36 [C@H](N)(C(=O)O)C1=CC=CC=C1 HY-W010249 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 HY-Y0168 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.40 O=C(CBr)OC1=CC=CC=C1 HY-41413 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.40 [C@H](N)(CO)CC1=CC=CC=C1 HY-W017398 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 HY-W015600 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.86 O=C(O)CC1=CC=CC=C1F HY-Y0357 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.86 O=C(O)CC1=CC=CC=C1O HY-W015590 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.157 CC(=O)NC1=CC=CC(O)=C1 HY-B1309 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.157 CC(=O)OC1=CC=CC(O)=C1 HY-B0894 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.157 CC1=CC(CC(=O)O)=CC=C1 HY-W053507 [0,1,0,0,0,0|2,0,1]=4 43 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 HY-W004766 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 HY-W001083 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 HY-41685 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 HY-W018454 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 HY-W112005 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 HY-Y1818 [0,1,0,0,0,0|2,0,0]=3 49 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 HY-B0496 [0,1,0,0,0,0|1,0,2]=4 50 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 HY-17447A [0,0,0,1,0,0|2,0,0]=3 51 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 HY-B1496 [0,0,0,1,0,0|2,0,0]=3 52 B11R2.10 CC1=CC2=CC=CC=C2N1 HY-W007556 [0,0,0,1,0,0|2,0,1]=4 53 B11R2.10 CC1=NC2=CC=CC=C2O1 HY-W038287 [0,0,0,1,0,0|2,0,1]=4 54 B11R2.10 O=C1CC2=C(C=CC=C2)N1 HY-Y0061 [0,0,0,1,0,0|2,0,1]=4 55 B9R1.6 CC(=O)C1=CC=CC=C1 HY-Y0989 [0,0,0,0,1,0|1,0,1]=3 56 B9R1.6 CC(=O)C1=CC=NC=C1 HY-Y0179 [0,0,0,0,1,0|2,0,1]=4 57 B9R1.6 CC(N)C1=CC=CC=C1 HY-W012848 [0,0,0,0,1,0|2,0,0]=3 58 B9R1.6 CN(C)C1=CC=NC=C1 HY-Y1089 [0,0,0,0,1,0|3,0,0]=4 59 B9R1.6 C[C@H](N)C1=CC=CC=C1 HY-75095 [0,0,0,0,1,0|2,0,0]=3 60 B9R1.6 N=C(N)C1=CC=CC=C1 HY-125913 [0,0,0,0,1,0|3,0,0]=4 61 B9R1.6 N=C(N)C1=CC=CC=C1 HY-W018781 [0,0,0,0,1,0|3,0,0]=4 62 B9R1.6 N=C(N)C1=CC=CC=C1 HY-W087937 [0,0,0,0,1,0|3,0,0]=4 63 B9R1.6 NC(=O)C1=CC=CC=C1 HY-Z0283 [0,0,0,0,1,0|2,0,1]=4 64 B9R1.6 O=C(O)C1=CC=CC=C1 HY-N0216 [0,0,0,0,1,0|2,0,1]=4 65 B9R1.6 O=C(O)C1=CC=CC=C1 HY-N0216R [0,0,0,0,1,0|2,0,1]=4 66 B9R1.6 O=C(O)C1=CC=CC=C1 HY-W015761 [0,0,0,0,1,0|2,0,1]=4 67 B9R1.6 O=[PH](O)C1=CC=CC=C1 HY-116210 [0,0,0,0,1,0|2,0,1]=4 68 B9R1.6 OB(O)C1=CC=CC=C1 HY-W001090 [0,0,0,0,1,0|2,0,1]=4 69 B9R1.6 [15NH2]C(=O)C1=CC=CC=C1 HY-Z0283S [0,0,0,0,1,0|2,0,1]=4 70 B11R1.91 CC(=O)CCC1=CC=CC=C1 HY-W015616 [0,0,0,0,0,1|1,0,1]=3 71 B11R1.91 CC(=O)COC1=CC=CC=C1 HY-116792 [0,0,0,0,0,1|1,0,1]=3 72 B11R1.91 CC(=O)NCC1=CC=CC=C1 HY-W052051 [0,0,0,0,0,1|1,0,1]=3 73 B11R1.91 CC(=O)NNC1=CC=CC=C1 HY-W017425 [0,0,0,0,0,1|2,0,1]=4 74 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 HY-W012595A [0,0,0,0,0,1|1,0,2]=4 75 B11R1.91 CC(N)CCC1=CC=CC=C1 HY-21796 [0,0,0,0,0,1|2,0,0]=3 76 B11R1.91 CN(C)CCC1=CC=CC=N1 HY-W013654 [0,0,0,0,0,1|3,0,0]=4 77 B11R1.91 N=C(O)NCC1=CC=CC=C1 HY-W010253 [0,0,0,0,0,1|2,0,1]=4 78 B11R1.91 O=C(O)CCC1=CC=CC=C1 HY-Y1088 [0,0,0,0,0,1|2,0,1]=4 79 B11R1.91 O=C(O)COC1=CC=CC=C1 HY-Y0267 [0,0,0,0,0,1|2,0,1]=4 80 B8R1.2 BrCC1=CC=CN=C1 HY-W004131 [2,0,0,0,0,0|2,0,0]=4 81 B8R1.2 CCC1=NC=CN=C1 HY-W040948 [2,0,0,0,0,0|2,0,0]=4 82 B8R1.2 COC1=CC=NC=C1 HY-W007634 [2,0,0,0,0,0|1,1,0]=4 83 B8R1.2 COC1=CN=CC=C1 HY-W008119 [2,0,0,0,0,0|1,1,0]=4 84 B8R1.2 NCC1=CC=CC=C1 HY-76253 [2,0,0,0,0,0|1,0,0]=3 85 B8R1.2 NCC1=CC=CN=C1 HY-Y0047 [2,0,0,0,0,0|2,0,0]=4 86 B8R1.2 NCC1=CC=NC=C1 HY-W007632 [2,0,0,0,0,0|2,0,0]=4 87 B8R1.2 O=NC1=CC=CC=C1 HY-121641 [2,0,0,0,0,0|1,0,1]=4 88 B8R1.2 O=[As]C1=CC=CC=C1 HY-131901 [2,0,0,0,0,0|1,0,1]=4 89 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [2,0,0,0,0,0|0,0,1]=3 90 B8R1.2 OCC1=CC=CC=C1 HY-B0892R [2,0,0,0,0,0|0,0,1]=3 91 B8R1.2 OCC1=CC=CN=C1 HY-B0893 [2,0,0,0,0,0|1,0,1]=4 92 B8R1.2 OCC1=NC=CC=C1 HY-Y0004 [2,0,0,0,0,0|1,0,1]=4 93 B10R1.1 C=CCC1=CC=C(C)C=C1 HY-W074514 [1,1,0,0,0,0|1,0,1]=4 94 B10R1.1 C=CCC1=CC=C(O)C=C1 HY-W159754 [1,1,0,0,0,0|1,0,1]=4 95 B10R1.1 CCOC1=CC=C(O)C=C1 HY-W015786 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.1 CNCC1=CC=C(F)C=C1 HY-W114781 [1,1,0,0,0,0|1,0,0]=3 97 B10R1.1 N#CCC1=CC=C(Cl)C=C1 HY-W017390 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.1 N#CCC1=CC=C(O)C=C1 HY-W015823 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.1 NCCC1=CC=C(Br)C=C1 HY-42346 [1,1,0,0,0,0|2,0,0]=4 100 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W007606 [1,1,0,0,0,0|2,0,0]=4 101 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W007606R [1,1,0,0,0,0|2,0,0]=4 102 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W016823 [1,1,0,0,0,0|2,0,0]=4 103 B10R1.1 OCCC1=CC=C(O)C=C1 HY-N0474 [1,1,0,0,0,0|1,0,1]=4 104 B10R1.1 OCCC1=CC=C(O)C=C1 HY-N0474R [1,1,0,0,0,0|1,0,1]=4 105 B10R1.4 CCOC1=CC=CC=C1O HY-W022036 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.10 NCCC1=CC(O)=CC=C1 HY-128975 [1,1,0,0,0,0|2,0,0]=4 107 B10R1.15 CC(CN)C1=CC=CC=C1 HY-W005394 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.15 CCC(O)C1=CC=CC=C1 HY-W012618 [1,1,0,0,0,0|1,0,0]=3 109 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-135848 [1,1,0,0,0,0|1,0,1]=4 110 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-KE7004 [1,1,0,0,0,0|1,0,1]=4 111 B10R1.15 NCC(O)C1=CC=CC=C1 HY-59132 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 HY-W002038 [1,1,0,0,0,0|1,0,1]=4 113 B10R1.15 OCC(O)C1=CC=CC=C1 HY-W015788 [1,1,0,0,0,0|1,0,1]=4 114 B10R1.17 C=CCNC1=CC=CC=C1 HY-W087043 [1,1,0,0,0,0|1,0,1]=4 115 B10R1.17 CNCCC1=CC=CC=C1 HY-30170 [1,1,0,0,0,0|1,0,0]=3 116 B10R1.17 CNCCC1=CC=CC=N1 HY-B0524A [1,1,0,0,0,0|2,0,0]=4 117 B10R1.17 CNCCC1=NC=CC=C1 HY-B0524 [1,1,0,0,0,0|2,0,0]=4 118 B10R1.17 CNCCC1=NC=CC=C1 HY-D0237 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.17 OCCCC1=CC=CC=C1 HY-41304 [1,1,0,0,0,0|1,0,0]=3 120 B10R1.17 OCCOC1=CC=CC=C1 HY-B1729 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.17 OCCOC1=CC=CC=C1 HY-B1729R [1,1,0,0,0,0|1,0,1]=4 122 B10R1.17 OC\C=C\C1=CC=CC=C1 HY-N1867 [1,1,0,0,0,0|1,0,1]=4 123 B10R1.17 OC\C=C\C1=CC=CC=C1 HY-Y0078 [1,1,0,0,0,0|1,0,1]=4 124 B10R1.17 S=C=NCC1=CC=CC=C1 HY-77813 [1,1,0,0,0,0|1,0,1]=4 125 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HY-20436 [0,1,0,0,1,0|1,0,1]=4 126 B10R1.13 CC(=O)C1=CC=C(C)C=C1 HY-W012653 [0,1,0,0,1,0|1,0,1]=4 127 B10R1.13 CC(=O)C1=CC=C(F)C=C1 HY-Y0779 [0,1,0,0,1,0|1,0,1]=4 128 B10R1.13 CC(=O)C1=CC=C(N)C=C1 HY-W008818 [0,1,0,0,1,0|1,0,1]=4 129 B10R1.13 CC(=O)C1=CC=C(O)C=C1 HY-Y0073 [0,1,0,0,1,0|1,0,1]=4 130 B10R1.13 CC(=O)C1=CC=C(O)C=C1 HY-Y0073R [0,1,0,0,1,0|1,0,1]=4 131 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 HY-W074486 [0,1,0,0,1,0|1,0,1]=4 132 B10R1.13 CN(C)C1=CC=C(O)C=C1 HY-34154 [0,1,0,0,1,0|2,0,0]=4 133 B10R1.13 Cc1ccc(C(C)C)cc1 HY-79986 [0,1,0,0,1,0|2,0,0]=4 134 B10R1.28 CC(C)(O)C1=CC=CC=C1 HY-W015810 [0,1,0,0,1,0|1,0,1]=4 135 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 HY-Z0054 [0,1,0,0,1,0|0,0,2]=4 136 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 HY-W010221 [0,1,0,0,1,0|2,0,0]=4 137 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 HY-W016923 [0,1,0,0,1,0|2,0,0]=4 138 B10R1.61 CC(=O)C1=CC=CC=C1Br HY-W007689 [0,1,0,0,1,0|1,0,1]=4 139 B10R1.61 CC(=O)C1=CC=CC=C1F HY-Y1133 [0,1,0,0,1,0|1,0,1]=4 140 B10R1.61 CC(=O)C1=CC=CC=C1N HY-I0501R [0,1,0,0,1,0|1,0,1]=4 141 B10R1.61 CC(=O)C1=CC=CC=C1O HY-Y1426 [0,1,0,0,1,0|1,0,1]=4 142 B10R1.113 CC(=O)C1=CC(N)=CC=C1 HY-W012637 [0,1,0,0,1,0|1,0,1]=4 143 B10R1.113 CC(=O)C1=CC=CC(O)=C1 HY-Y0603 [0,1,0,0,1,0|1,0,1]=4 144 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 HY-N1426R [0,1,0,0,0,1|1,0,1]=4 145 B12R1.21 CC(O)CCC1=CC=C(O)C=C1 HY-136913 [0,1,0,0,0,1|1,0,1]=4 146 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 HY-N0113 [0,1,0,0,0,1|2,0,0]=4 147 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 HY-N0113B [0,1,0,0,0,1|2,0,0]=4 148 B12R1.27 COC(=O)CCC1=CC=CC=C1 HY-W007828 [0,1,0,0,0,1|1,0,1]=4 149 B12R1.27 NCC(=O)OCC1=CC=CC=C1 HY-W005117 [0,1,0,0,0,1|1,0,1]=4 150 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 HY-W013607 [0,1,0,0,0,1|1,0,1]=4 151 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 HY-W001084 [0,2,0,0,0,0|1,0,1]=4 152 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 HY-W001084R [0,2,0,0,0,0|1,0,1]=4 153 B12R1.34 COC(=O)[C@@H](N)C1=CC=CC=C1 HY-W019714 [0,2,0,0,0,0|1,0,1]=4 154 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 HY-W014824 [0,2,0,0,0,0|1,0,1]=4 155 B12R1.225 C[C@@H](C1=CC(O)=CC=C1)N(C)C HY-W020576 [0,2,0,0,0,0|2,0,0]=4 156 B12R1.225 C[C@H](N)[C@H](O)C1=CC(O)=CC=C1 HY-B1116 [0,2,0,0,0,0|2,0,0]=4 157 B12R1.32 C#CCN(C)CC1=CC=CC=C1 HY-A0091 [0,2,0,0,0,0|2,0,0]=4 158 B12R1.32 C#CCN(C)CC1=CC=CC=C1 HY-A0091A [0,2,0,0,0,0|2,0,0]=4 159 B12R1.194 CC[N+](C)(C)CC1=CC=CC=C1 HY-B2232 [0,2,0,0,0,0|2,0,0]=4 160 B10R2.7 C1=CC=C2OCCC2=C1 HY-75247 [1,0,0,1,0,0|1,0,1]=4 161 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 HY-I0348 [0,1,0,1,0,0|2,0,0]=4 162 B12R2.32 CNC1CC2=C(C=CC=C2)C1 HY-113833 [0,1,0,1,0,0|2,0,0]=4 163 B12R1.252 CC(=O)CCCC1=CC=CC=C1 HY-145613 [0,0,0,0,0,2|1,0,1]=4 164 B12R1.252 CC(=O)OCCC1=CC=CC=C1 HY-W102356 [0,0,0,0,0,2|1,0,1]=4