0 B11R1.12 COC(OC)C1=CC=CC=C1 HY-Z0041 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.15 CC(CN)C1=CC=CC=C1 HY-W005394 [1,0,0,0,0,0|1,0,2]=4 2 B10R1.15 CCC(O)C1=CC=CC=C1 HY-W012618 [1,0,0,0,0,0|0,0,3]=4 3 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-135848 [1,0,0,0,0,0|1,0,0]=2 4 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-KE7004 [1,0,0,0,0,0|1,0,0]=2 5 B10R1.15 CNC(=O)C1=CC=CN=C1 HY-124124 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.15 COC(=O)C1=CC=CC=N1 HY-W005458 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.15 COC(=O)C1=NC=CC=N1 HY-78337 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.15 NNC(=O)C1=CC=CN=C1 HY-W012617 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.15 NNC(=O)C1=CC=NC=C1 HY-B0329 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.15 NNC(=O)C1=CC=NC=C1 HY-B0329R [1,0,0,0,0,0|3,0,0]=4 11 B10R1.15 NNC(=O)C1=NC=CC=C1 HY-W010341 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.15 O=C(NO)C1=CC=CC=C1 HY-Y1058 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.15 O=C(O[K])C1=CC=CC=C1 HY-W103932 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.15 O=C(O[Na])C1=CC=CC=C1 HY-Y1316 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.15 O=S(O[Na])C1=CC=CC=C1 HY-W013598 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.15 [Li]OC(=O)C1=CC=CC=C1 HY-N0216A [1,0,0,0,0,0|2,0,0]=3 17 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 HY-W017194 [0,1,0,0,0,0|0,0,2]=3 18 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 HY-W041194 [0,1,0,0,0,0|1,0,2]=4 19 B12R2.1 O=CC1=CNC2=CC=CC=C12 HY-W007376 [0,0,0,1,0,0|1,0,0]=2 20 B12R2.1 O=CC1=COC2=CC=CC=C12 HY-W004801 [0,0,0,1,0,0|1,0,0]=2 21 B12R2.1 O=CC1=CSC2=C1C=CC=C2 HY-W002251 [0,0,0,1,0,0|1,0,0]=2 22 B12R2.1 OCC1=CNC2=C1C=CC=C2 HY-N0170 [0,0,0,1,0,0|1,0,2]=4 23 B12R2.2 C1=CC=C(C2=CN=CN2)C=C1 HY-W015671 [0,0,0,1,0,0|2,0,1]=4 24 B12R2.2 C1=CC=C(C2=CN=NN2)C=C1 HY-W113615 [0,0,0,1,0,0|3,0,0]=4 25 B12R2.2 C1=CC=C(C2=NNC=C2)C=C1 HY-W002461 [0,0,0,1,0,0|2,0,1]=4 26 B12R2.2 C1=CC=C(N2C=CC=C2)C=C1 HY-124891 [0,0,0,1,0,0|2,0,1]=4 27 B9R1.6 CC(=O)C1=CC=CC=C1 HY-Y0989 [2,0,0,0,0,0|0,0,0]=2 28 B9R1.6 CC(=O)C1=CC=NC=C1 HY-Y0179 [2,0,0,0,0,0|1,0,0]=3 29 B9R1.6 CC(=O)C1=CN=CC=N1 HY-W007692 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.6 CC(N)C1=CC=CC=C1 HY-W012848 [2,0,0,0,0,0|1,0,1]=4 31 B9R1.6 C[C@H](N)C1=CC=CC=C1 HY-75095 [2,0,0,0,0,0|1,0,1]=4 32 B9R1.6 N=C(N)C1=CC=CC=C1 HY-125913 [2,0,0,0,0,0|2,0,0]=4 33 B9R1.6 N=C(N)C1=CC=CC=C1 HY-W018781 [2,0,0,0,0,0|2,0,0]=4 34 B9R1.6 N=C(N)C1=CC=CC=C1 HY-W087937 [2,0,0,0,0,0|2,0,0]=4 35 B9R1.6 NC(=O)C1=CC=CC=C1 HY-Z0283 [2,0,0,0,0,0|1,0,0]=3 36 B9R1.6 NC(=O)C1=CC=CN=C1 HY-B0150 [2,0,0,0,0,0|2,0,0]=4 37 B9R1.6 NC(=O)C1=CC=CN=C1 HY-B0150R [2,0,0,0,0,0|2,0,0]=4 38 B9R1.6 NC(=O)C1=CC=NC=C1 HY-W012843 [2,0,0,0,0,0|2,0,0]=4 39 B9R1.6 NC(=O)C1=CC=NC=C1 HY-W012843R [2,0,0,0,0,0|2,0,0]=4 40 B9R1.6 NC(=O)C1=NC=CC=C1 HY-101020 [2,0,0,0,0,0|2,0,0]=4 41 B9R1.6 O=C(O)C1=CC=CC=C1 HY-N0216 [2,0,0,0,0,0|1,0,0]=3 42 B9R1.6 O=C(O)C1=CC=CC=C1 HY-N0216R [2,0,0,0,0,0|1,0,0]=3 43 B9R1.6 O=C(O)C1=CC=CC=C1 HY-W015761 [2,0,0,0,0,0|1,0,0]=3 44 B9R1.6 O=C(O)C1=CC=CC=N1 HY-I0660 [2,0,0,0,0,0|2,0,0]=4 45 B9R1.6 O=C(O)C1=CC=CC=N1 HY-I0660R [2,0,0,0,0,0|2,0,0]=4 46 B9R1.6 O=C(O)C1=CC=CN=C1 HY-B0143 [2,0,0,0,0,0|2,0,0]=4 47 B9R1.6 O=C(O)C1=CC=CN=C1 HY-B0143R [2,0,0,0,0,0|2,0,0]=4 48 B9R1.6 O=C(O)C1=CC=NC=C1 HY-I0736 [2,0,0,0,0,0|2,0,0]=4 49 B9R1.6 O=[PH](O)C1=CC=CC=C1 HY-116210 [2,0,0,0,0,0|2,0,0]=4 50 B9R1.6 [15NH2]C(=O)C1=CC=CC=C1 HY-Z0283S [2,0,0,0,0,0|1,0,0]=3 51 B9R1.8 CCOC1=CC=CC=C1 HY-Y1207 [2,0,0,0,0,0|1,0,1]=4 52 B9R1.8 CNCC1=CC=CC=C1 HY-W007426 [2,0,0,0,0,0|1,0,1]=4 53 B11R1.16 CCCC(=O)C1=CC=CC=C1 HY-W010265 [1,1,0,0,0,0|0,0,1]=3 54 B11R1.16 CCOC(=O)C1=CC=CC=C1 HY-W017439 [1,1,0,0,0,0|0,0,1]=3 55 B11R1.16 O=C(CCCl)C1=CC=CC=C1 HY-107857 [1,1,0,0,0,0|0,0,1]=3 56 B11R1.16 O=C(NCO)C1=CC=CN=C1 HY-116993 [1,1,0,0,0,0|2,0,0]=4 57 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 HY-B1353 [1,1,0,0,0,0|0,0,1]=3 58 B11R1.22 COC(=O)C1=CC=C(O)C=C1 HY-N0349 [1,1,0,0,0,0|1,0,0]=3 59 B11R1.22 COC(=O)C1=CC=C(O)C=C1 HY-N0349R [1,1,0,0,0,0|1,0,0]=3 60 B11R1.22 COC(=O)C1=CN=C(C)C=C1 HY-76047 [1,1,0,0,0,0|2,0,0]=4 61 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 HY-32778 [1,1,0,0,0,0|2,0,0]=4 62 B11R1.22 COC(=O)C1=NC=C(O)C=C1 HY-W005963 [1,1,0,0,0,0|2,0,0]=4 63 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 HY-135325 [1,1,0,0,0,0|1,0,1]=4 64 B11R1.22 NC1=CC=C(C(=O)O[Na])C=C1 HY-W010169 [1,1,0,0,0,0|2,0,0]=4 65 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 HY-B0880 [1,1,0,0,0,0|2,0,0]=4 66 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 HY-W008598 [1,1,0,0,0,0|1,0,1]=4 67 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 HY-W002314 [1,1,0,0,0,0|1,0,1]=4 68 B11R1.22 O=C(O[Na])C1=CC=C(O)C=C1 HY-W010164 [1,1,0,0,0,0|2,0,0]=4 69 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 HY-W015318 [1,1,0,0,0,0|0,0,1]=3 70 B11R1.23 COC(=O)C1=CC(N)=NC=C1 HY-W003145 [1,1,0,0,0,0|2,0,0]=4 71 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 HY-Z0690 [1,1,0,0,0,0|1,0,0]=3 72 B11R1.23 COC(=O)C1=CC=CC(O)=C1 HY-90004 [1,1,0,0,0,0|1,0,0]=3 73 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 HY-76562 [1,1,0,0,0,0|2,0,0]=4 74 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 HY-W018758 [1,1,0,0,0,0|0,0,0]=2 75 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 HY-W015608 [1,1,0,0,0,0|0,0,1]=3 76 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 HY-W010248 [1,1,0,0,0,0|1,0,1]=4 77 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 HY-W017406 [1,1,0,0,0,0|1,0,1]=4 78 B11R1.36 O=C(C1=CC=CC=C1)C(O)O HY-128407 [1,1,0,0,0,0|1,0,1]=4 79 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 HY-W010255 [1,1,0,0,0,0|1,0,0]=3 80 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 HY-W010255R [1,1,0,0,0,0|1,0,0]=3 81 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 HY-W015591 [1,1,0,0,0,0|1,0,1]=4 82 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 HY-129629 [1,1,0,0,0,0|1,0,1]=4 83 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 HY-Y0816 [1,1,0,0,0,0|1,0,1]=4 84 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 HY-Y0585 [1,1,0,0,0,0|1,0,1]=4 85 B11R1.36 [C@H](N)(C(=O)O)C1=CC=CC=C1 HY-W010249 [1,1,0,0,0,0|1,0,1]=4 86 B11R1.222 COC(=O)C1=C(N)C=NC=C1 HY-W002874 [1,1,0,0,0,0|2,0,0]=4 87 B11R1.222 COC(=O)C1=CC=CC=C1O HY-Y0189 [1,1,0,0,0,0|1,0,0]=3 88 B11R1.222 COC(=O)C1=CC=CC=C1O HY-Y0189R [1,1,0,0,0,0|1,0,0]=3 89 B11R1.222 COC(=O)C1=CC=CN=C1N HY-76735 [1,1,0,0,0,0|2,0,0]=4 90 B11R1.222 O=C(CBr)C1=CC=CC=C1F HY-W004082 [1,1,0,0,0,0|1,0,1]=4 91 B11R1.222 O=C(NO)C1=CC=CC=C1O HY-18721 [1,1,0,0,0,0|2,0,0]=4 92 B11R1.222 O=C(O[Na])C1=CC=CC=C1O HY-B0167A [1,1,0,0,0,0|2,0,0]=4 93 B13R1.418 [C@@H](CC1=CC=CC=C1)(NC)C(=O)O HY-W005388 [0,1,0,0,0,1|1,0,1]=4 94 B11R2.1 CC1=CNC2=CC=CC=C12 HY-W007355 [1,0,0,1,0,0|1,0,0]=3 95 B11R2.1 CC1=CNC2=CC=CC=C12 HY-W007355R [1,0,0,1,0,0|1,0,0]=3 96 B11R2.1 CN1C=CC2=C1C=CC=C2 HY-Y1162 [1,0,0,1,0,0|2,0,0]=4 97 B11R2.1 ClC1=CNC2=C1C=CC=C2 HY-65119 [1,0,0,1,0,0|2,0,0]=4 98 B11R2.1 O=C1CCC2=C1C=CC=C2 HY-W004333 [1,0,0,1,0,0|0,0,1]=3 99 B11R2.1 O=C1NCC2=C1C=CC=C2 HY-W004767 [1,0,0,1,0,0|1,0,0]=3 100 B11R2.1 O=C1NSC2=C1C=CC=C2 HY-W017401 [1,0,0,1,0,0|2,0,0]=4 101 B11R2.1 O=C1OCC2=CC=CC=C12 HY-W015820 [1,0,0,1,0,0|1,0,0]=3 102 B13R2.45 N\C=C1\CC2=C(C=CC=C2)C1=O HY-119864 [0,0,0,1,0,1|1,0,0]=3 103 B13R2.57 C=CC1=CC2=CC=CC=C2C=C1 HY-W015553 [0,0,0,1,0,1|1,0,1]=4 104 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 HY-W010179 [0,0,0,1,0,1|2,0,0]=4 105 B13R2.57 O=CC1=CC2=C(C=CC=C2)C=C1 HY-Y0075 [0,0,0,1,0,1|0,0,1]=3 106 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 HY-W008168 [0,0,0,1,0,1|0,0,1]=3 107 B13R2.1 NCCC1=CNC2=C1C=CC=C2 HY-B2132 [0,1,0,1,0,0|1,0,1]=4 108 B13R2.1 NCCC1=CNC2=C1C=CC=C2 HY-B2132R [0,1,0,1,0,0|1,0,1]=4 109 B13R2.1 OCCC1=CNC2=CC=CC=C12 HY-W010155 [0,1,0,1,0,0|1,0,1]=4 110 B13R2.1 OCCC1=CNC2=CC=CC=C12 HY-W010155R [0,1,0,1,0,0|1,0,1]=4 111 B13R2.10 NC1=NC(C2=CC=CC=C2)=CS1 HY-W016689 [0,1,0,1,0,0|1,1,0]=4 112 B13R2.10 O=C1CCN(C2=CC=CC=C2)N1 HY-W010144 [0,1,0,1,0,0|1,0,1]=4 113 B13R2.15 O=C1CCCN1C2=CC=CC=C2 HY-W103463 [0,1,0,1,0,0|1,0,1]=4 114 B13R2.1613 COC1=CC=CC2=CC=CC=C21 HY-W012568 [0,1,0,1,0,0|2,0,0]=4 115 B13R2.662 O=CC1=CNC2=C1C=CC(Br)=C2 HY-W012361 [0,1,0,1,0,0|1,0,0]=3 116 B13R2.9 CC1=C2NC=C(C=O)C2=CC=C1 HY-W007980 [0,1,0,1,0,0|1,0,0]=3 117 B13R2.135 CCN1C(=O)NC2=CC=CC=C21 HY-101360 [0,1,0,1,0,0|1,0,1]=4 118 B13R2.2091 O=CC1=CNC2=C1C(O)=CC=C2 HY-W091541 [0,1,0,1,0,0|1,0,0]=3 119 B13R2.72 CC(=O)C1=CNC2=C1C=CC=C2 HY-W018667 [0,1,0,1,0,0|1,0,0]=3 120 B13R2.72 O=C(O)C1=CNC2=CC=CC=C21 HY-40161 [0,1,0,1,0,0|1,0,0]=3 121 B13R2.72 O=C(O)C1=CNC2=CC=CC=C21 HY-40161R [0,1,0,1,0,0|1,0,0]=3 122 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 HY-W002518 [0,1,0,1,0,0|2,0,0]=4 123 B9R1.11 COC(=O)C1=CC=CN1 HY-W012802 [1,0,0,0,1,0|2,0,0]=4 124 B9R1.11 COC(=O)C1=CC=CO1 HY-Y0949 [1,0,0,0,1,0|2,0,0]=4 125 B11R1.40 C=CC(=O)NC1=CC=CC=C1 HY-W018582 [1,0,0,0,0,1|0,0,1]=3 126 B11R1.40 O=C(CBr)OC1=CC=CC=C1 HY-41413 [1,0,0,0,0,1|1,0,1]=4