0 B9R1.35 CC(=O)C1=CC(Br)=NO1 AT19699 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC(=O)C1=CC=C(Br)N1 C90268 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.35 CC(=O)C1=CC=C(Br)O1 O10305 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.35 CC(=O)C1=CN(C)C=N1 AT21668 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 CC(=O)C1=NC(C)=CN1 I10088 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.35 CC(=O)N1C=CC(N)=C1 AC4901 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.35 CC(C)C1=CN=C(Br)O1 AT18460 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.35 CC(C)C1=CN=C(Cl)O1 AT18556 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.35 CC(C)C1=CN=C(N)O1 AT18720 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.35 CC(C)C1=NC=C(Br)O1 AT18554 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.35 CC1=CC(C(N)=O)=NN1 N12273 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.35 CC1=CC=C([C@H](C)N)O1 N12562 [0,0,0,0,0,0|1,0,1]=2 12 B9R1.35 CC1=CC=C([C@H](C)N)O1 Y12182 [0,0,0,0,0,0|1,0,1]=2 13 B9R1.35 CC1=CN=C([C@H](C)N)O1 F53855 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.35 CC1=NC(C(=O)O)=NO1 A10653 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.35 CC1=NC(C(N)=O)=NO1 E72463 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.35 CC1=NC([C@H](C)N)=CS1 N14678 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.35 CC1=NN=C([C@H](C)Cl)O1 C77624 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.35 CC1=NN=C([C@H](C)O)O1 AT18796 [0,0,0,0,0,0|2,0,2]=4 19 B9R1.35 CC1=NN=C([C@H](C)O)O1 AT18797 [0,0,0,0,0,0|2,0,2]=4 20 B9R1.35 CC1=NN=C([C@H](C)O)O1 AT18798 [0,0,0,0,0,0|2,0,2]=4 21 B9R1.35 CC1=NOC(C(=O)O)=N1 72017 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 CC1=NOC(C(=O)[O-])=N1 D87501 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.35 CC1=NOC(C(N)=O)=C1 C11163 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.35 CC1=NSC(C(=O)O)=C1 AT21155 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.35 CN1C=C(C(=O)Cl)C=N1 AT16091 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.35 CN1C=CC(C(=O)Cl)=N1 79491 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.35 CN1C=CC([N+](=O)[O-])=C1 97918 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.35 CN1C=NC(C(N)=O)=C1 24458 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.35 CN1CC(C(=O)O)=CO1 F12190 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.35 C[C@H](Cl)C1=CC=C(Cl)O1 55261 [0,0,0,0,0,0|2,0,1]=3 31 B9R1.35 C[C@H](N)C1=CC=C(Br)O1 Y12846 [0,0,0,0,0,0|2,0,1]=3 32 B9R1.35 C[C@H](N)C1=CC=C(Cl)S1 30561 [0,0,0,0,0,0|2,1,1]=4 33 B9R1.35 C[C@H](N)C1=NN(C)C=C1 AT14351 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.35 C[C@H](N)C1=NN(C)C=C1 D96322 [0,0,0,0,0,0|3,0,1]=4 35 B9R1.35 C[C@H](O)C1=CC=C(Cl)O1 55260 [0,0,0,0,0,0|1,0,2]=3 36 B9R1.35 C[C@H](O)C1=NN(C)C=C1 AT14463 [0,0,0,0,0,0|2,0,2]=4 37 B9R1.35 FC(F)C1=CC=C(I)O1 AT17270 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.35 NC(=O)C1=CC(Br)=CS1 C76680 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.35 NC1=CN=C(C(=O)O)S1 38504 [0,0,0,0,0,0|3,1,0]=4 40 B9R1.35 NC1=CN=C(C(=O)O)S1 70896 [0,0,0,0,0,0|3,1,0]=4 41 B9R1.35 NC1=CSC(C(=O)O)=C1 AC7156 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.35 NC1=NN=C(C(=O)O)O1 D74010 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.35 NC1=NN=C(C(=O)[O-])O1 AT24496 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.35 O=C(Cl)C1=CC=C(Cl)O1 AT17320 [0,0,0,0,0,0|2,0,0]=2 45 B9R1.35 O=C(O)C1=CC(O)=CS1 AT16393 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.35 O=C(O)C1=CC=C(Br)N1 O11354 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.35 O=C(O)C1=CC=C(Cl)N1 AT16176 [0,0,0,0,0,0|3,0,0]=3 48 B9R1.35 O=C(O)C1=CN=C(Cl)N1 AT15386 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.35 O=C(O)C1=CN=C(I)O1 C91097 [0,0,0,0,0,0|3,0,0]=3 50 B9R1.35 O=C(O)C1=CSC(S)=N1 AT14870 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.35 O=C(O)C1=NC(Cl)=CS1 AT14689 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.35 O=C([O-])C1=NC=C(Br)S1 AT14693 [0,0,0,0,0,0|3,1,0]=4 53 B9R1.35 O=[N+]([O-])C1=CC=C(Cl)S1 W15255 [0,0,0,0,0,0|3,1,0]=4 54 B8R1.1 BrCC1=CC=C(Br)O1 55253 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.1 CC1=CN=C(C=O)O1 AT17128 [1,0,0,0,0,0|1,0,0]=2 56 B8R1.1 CC1=CN=C(CCl)O1 AT18576 [1,0,0,0,0,0|2,0,1]=4 57 B8R1.1 CC1=CN=C(CN)O1 P18975 [1,0,0,0,0,0|2,0,1]=4 58 B8R1.1 CC1=CN=C(CO)O1 AT18512 [1,0,0,0,0,0|1,0,2]=4 59 B8R1.1 CC1=NC=C(CCl)O1 C77476 [1,0,0,0,0,0|2,0,1]=4 60 B8R1.1 CC1=NC=C(CO)O1 F12980 [1,0,0,0,0,0|1,0,2]=4 61 B8R1.1 CC1=NNC(C=O)=C1 79805 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.1 CC1=NSC(C=O)=C1 C16590 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.1 CCC1=CC=C(S)S1 AT16555 [1,0,0,0,0,0|1,1,1]=4 64 B8R1.1 CCC1=NN(C)C=C1 C91459 [1,0,0,0,0,0|2,0,1]=4 65 B8R1.1 CNC1=NN(C)C=C1 AT14076 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.1 COC1=CC=C(Br)S1 N10622 [1,0,0,0,0,0|2,1,0]=4 67 B8R1.1 COC1=NN(C)C=C1 AT24917 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.1 N#CC1=CC=C(Cl)O1 AT17409 [1,0,0,0,0,0|2,0,1]=4 69 B8R1.1 NCC1=CC=C(Br)O1 79914 [1,0,0,0,0,0|2,0,1]=4 70 B8R1.1 NCC1=CC=C(Br)O1 94512 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.1 O=CC1=CC(Cl)=CO1 50491 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.1 O=CC1=CC(Cl)=CS1 P11080 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.1 O=CC1=CN=C(O)S1 AT14773 [1,0,0,0,0,0|2,1,0]=4 74 B8R1.1 O=CC1=COC(Br)=C1 AT17110 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.1 O=CC1=NC(Cl)=CS1 P12467 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.1 O=CC1=NC=C(I)S1 S10281 [1,0,0,0,0,0|2,1,0]=4 77 B8R1.7 C=C(C)C1=NC=CS1 T71747 [1,0,0,0,0,0|2,1,0]=4 78 B8R1.7 CC(=O)C1=CN=CO1 F19037 [1,0,0,0,0,0|1,0,0]=2 79 B8R1.7 CC(=O)C1=COC=N1 AT18593 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.7 CC(=O)C1=CSN=C1 AT21129 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.7 CC(=O)C1=NNC=N1 AT12117 [1,0,0,0,0,0|3,0,0]=4 82 B8R1.7 C[C@H](N)C1=CC=CO1 74860 [1,0,0,0,0,0|1,0,1]=3 83 B8R1.7 C[C@H](N)C1=CC=CO1 F16901 [1,0,0,0,0,0|1,0,1]=3 84 B8R1.7 C[C@H](N)C1=CC=CO1 N12744 [1,0,0,0,0,0|1,0,1]=3 85 B8R1.7 C[C@H](O)C1=CC=CS1 71923 [1,0,0,0,0,0|0,1,2]=4 86 B8R1.7 C[C@H](O)C1=CC=CS1 AT16382 [1,0,0,0,0,0|0,1,2]=4 87 B8R1.7 C[C@H](O)C1=CC=CS1 AT16384 [1,0,0,0,0,0|0,1,2]=4 88 B8R1.7 N=C(N)C1=CC=CN1 F18689 [1,0,0,0,0,0|3,0,0]=4 89 B8R1.7 NC(=O)C1=NOC=C1 AT19826 [1,0,0,0,0,0|3,0,0]=4 90 B8R1.7 NC(=S)C1=CC=CO1 F11945 [1,0,0,0,0,0|1,1,0]=3 91 B8R1.7 O=C(Cl)C1=COC=N1 D78648 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.7 O=C([O-])C1=NC=CO1 AT18513 [1,0,0,0,0,0|2,0,0]=3 93 B8R1.7 O=[S@](O)C1=CC=CS1 AT16558 [1,0,0,0,0,0|2,1,0]=4 94 B10R1.14 C=C[C@H](N)C1=CC=C(C)O1 N16764 [0,1,0,0,0,0|1,0,2]=4 95 B10R1.14 C=C[C@H](N)C1=CC=C(C)O1 N16766 [0,1,0,0,0,0|1,0,2]=4 96 B10R1.14 C=C[C@H](N)C1=CC=C(C)O1 N16767 [0,1,0,0,0,0|1,0,2]=4 97 B10R1.14 CC1=CC=C(C(=O)CO)O1 AC5801 [0,1,0,0,0,0|0,0,0]=1 98 B10R1.14 CC1=CC=C(C(=O)CO)S1 AC3828 [0,1,0,0,0,0|0,1,0]=2 99 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16761 [0,1,0,0,0,0|1,0,1]=3 100 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16762 [0,1,0,0,0,0|1,0,1]=3 101 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16763 [0,1,0,0,0,0|1,0,1]=3 102 B10R1.14 CCC(=O)C1=CC=C(Br)O1 N14292 [0,1,0,0,0,0|1,0,0]=2 103 B10R1.14 CNC(=O)C1=CC=C(N)S1 92880 [0,1,0,0,0,0|1,1,0]=3 104 B10R1.14 COC(=O)C1=CC=C(F)S1 D87046 [0,1,0,0,0,0|1,1,0]=3 105 B10R1.14 COC(=O)C1=CN=C(S)S1 SC1359 [0,1,0,0,0,0|2,1,0]=4 106 B10R1.14 COC(=O)C1=CNC(=S)N1 S11050 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.14 COC(=O)C1=CNC(C)=C1 AT21660 [0,1,0,0,0,0|2,0,0]=3 108 B10R1.14 COC(=O)C1=CNC(Cl)=C1 AC6843 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.14 COC(=O)C1=COC(I)=N1 O11880 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.14 COC(=O)C1=CSC(I)=C1 74713 [0,1,0,0,0,0|3,0,0]=4 111 B10R1.14 NC[C@H](N)C1=CC=C(Br)O1 N14886 [0,1,0,0,0,0|2,0,1]=4 112 B10R1.31 C=CC1=CSC(C(C)=O)=C1 A51005 [0,1,0,0,0,0|2,0,1]=4 113 B10R1.31 CC(=O)C1=CC=C(C#N)O1 AT17433 [0,1,0,0,0,0|0,0,1]=2 114 B10R1.31 CC(C)C1=CC=C(C=O)O1 F53542 [0,1,0,0,0,0|1,0,2]=4 115 B10R1.31 CC(C)C1=CN=C(CBr)O1 AT18561 [0,1,0,0,0,0|2,0,1]=4 116 B10R1.31 CC(C)C1=CN=C(CCl)O1 AT18580 [0,1,0,0,0,0|2,0,1]=4 117 B10R1.31 CCC1=CC=C(C(=O)O)O1 AT17158 [0,1,0,0,0,0|1,0,0]=2 118 B10R1.31 CCC1=CSC(C(=O)O)=N1 C71580 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.31 CNC1=NC=C(C(=O)O)O1 AT18685 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.31 COC1=CC=C(C(=O)O)O1 AT17094 [0,1,0,0,0,0|1,0,0]=2 121 B10R1.31 COC1=NC(C(=O)O)=CO1 AT18455 [0,1,0,0,0,0|3,0,0]=4 122 B10R1.31 CSC1=CC(C(=O)O)=CO1 AT17277 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.31 CSC1=CC=C(C(=O)O)O1 AT17280 [0,1,0,0,0,0|1,0,0]=2 124 B10R1.31 FC(F)C1=CC=C(CBr)O1 55263 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.31 NCC1=CC=C(C(=O)O)O1 AT17184 [0,1,0,0,0,0|1,0,0]=2 126 B10R1.31 NCC1=CC=C(C(=O)O)S1 AT24853 [0,1,0,0,0,0|1,1,0]=3 127 B10R1.31 O=C(O)C1=COC(CBr)=N1 AT18565 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.31 O=C(O)C1=COC(CO)=C1 AT17501 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.31 OCC1=CC=C(C(F)F)O1 55262 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.55 CC1=CC=C(S(=O)(=O)Cl)S1 H10930 [0,1,0,0,0,0|2,1,0]=4 131 B10R1.55 CC1=NC(S(C)(=O)=O)=CN1 A50866 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.55 CS(=O)(=O)C1=CC=C(Br)S1 P10552 [0,1,0,0,0,0|2,1,0]=4 133 B10R1.58 CC(=O)C1=CC(Br)=C(Br)O1 AT15595 [0,1,0,0,0,0|1,0,0]=2 134 B10R1.58 CC1=C(C)SC(C(=O)O)=C1 W10228 [0,1,0,0,0,0|1,1,0]=3 135 B10R1.58 CC1=C(Cl)N=C(C(=O)O)N1 96260 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.58 CC1=NC(C(=O)O)=CN1C AC8449 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.58 CN1C=C(C(=O)O)C=C1Br C91432 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.58 CN1N=C(C(=O)O)C=C1N AT14203 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 27225 [0,1,0,0,0,0|2,1,0]=4 140 B10R1.59 CC(=O)C1=C(C)NC(=O)N1 F18115 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.59 CC(=O)C1=CC(N)=CN1C 97921 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.59 CC(=O)C1=NN(C)C=C1C AT13574 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.59 CC(=O)C1=NN(C)C=C1N W12223 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.59 CC1=CC(C(=O)O)=C(Br)S1 92997 [0,1,0,0,0,0|3,0,0]=4 145 B10R1.59 CC1=CC(C)=C(C(=O)O)O1 AT17163 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.59 CC1=CC(C)=C(C(=O)O)S1 AT16400 [0,1,0,0,0,0|1,1,0]=3 147 B10R1.59 CC1=CN(C)C=C1C(=O)O AT10393 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.59 CC1=CN(C)N=C1C(=O)O AT14198 [0,1,0,0,0,0|3,0,0]=4 149 B10R1.59 CC1=NC(C(=O)O)=C(Br)O1 27242 [0,1,0,0,0,0|3,0,0]=4 150 B10R1.59 CC1=NC(C(=O)O)=C(C)N1 AT15391 [0,1,0,0,0,0|3,0,0]=4 151 B10R1.59 CC1=NC(C(=O)O)=C(C)S1 AT21448 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.59 NC(=O)C1=C(F)C=C(N)S1 92878 [0,1,0,0,0,0|2,1,0]=4 153 B10R1.59 NC1=C(C(=O)O)SC(Br)=C1 58229 [0,1,0,0,0,0|2,1,0]=4 154 B10R1.194 CC(=O)C1=C(C)N(C)N=C1 71437 [0,1,0,0,0,0|3,0,0]=4 155 B10R1.194 CC1=COC(C(=O)O)=C1C AT17164 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.194 CC1=CSC(C(=O)O)=C1Br AT11772 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.13 CC(=O)C1=CN=C(C)N=C1 32219 [0,0,0,0,0,1|2,0,0]=3 158 B10R1.13 CC(=O)C1=NN=C(C)C=C1 P12332 [0,0,0,0,0,1|1,0,0]=2 159 B10R1.13 CC1=CC=C(N(C)N)N=N1 20185 [0,0,0,0,0,1|3,0,0]=4 160 B10R1.13 CC1=CC=C([S@@](=O)Cl)C=C1 C14066 [0,0,0,0,0,1|3,0,0]=4 161 B10R1.13 CC1=CN=C(C(=N)N)C=C1 W19131 [0,0,0,0,0,1|3,0,0]=4 162 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10705 [0,0,0,0,0,1|2,0,1]=4 163 B10R1.13 CC1=NC=C(C(=O)Cl)C=C1 C90488 [0,0,0,0,0,1|2,0,0]=3 164 B10R1.13 CC1=NC=C(C(N)=O)C=N1 81927 [0,0,0,0,0,1|3,0,0]=4 165 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56564 [0,0,0,0,0,1|2,0,1]=4 166 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56569 [0,0,0,0,0,1|2,0,1]=4 167 B10R1.13 NC(=O)C1=NN=C(Br)C=C1 D76262 [0,0,0,0,0,1|3,0,0]=4 168 B10R1.13 NC(=O)C1=NNC(=O)C=C1 AC6451 [0,0,0,0,0,1|3,0,0]=4 169 B10R1.54 CC(=O)NC1=CC=C(Br)S1 27544 [0,0,0,0,0,1|1,1,0]=3 170 B10R1.54 CC(=O)NC1=NC(C)=CN1 72448 [0,0,0,0,0,1|2,0,0]=3 171 B10R1.54 CC(=O)NC1=NC(Cl)=CS1 F19659 [0,0,0,0,0,1|3,0,0]=4 172 B10R1.54 CC1=CSC(CC(=O)O)=N1 F13736 [0,0,0,0,0,1|3,0,0]=4 173 B10R1.54 CC1=NC=C(CC(=O)O)S1 W18595 [0,0,0,0,0,1|2,1,0]=4 174 B10R1.54 CC1=NN(CC(=O)O)C=C1 C15138 [0,0,0,0,0,1|3,0,0]=4 175 B10R1.54 CN1C=CC(CC(=O)O)=N1 72291 [0,0,0,0,0,1|3,0,0]=4 176 B10R1.54 O=C(Cl)CC1=CC=C(Br)S1 AC8730 [0,0,0,0,0,1|2,1,0]=4 177 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [0,0,0,0,0,1|3,0,0]=4 178 B10R1.113 CC(=O)C1=CC(=O)NC=C1 90624 [0,0,0,0,0,1|2,0,0]=3 179 B10R1.113 CC(=O)C1=CC(Cl)=NC=N1 91059 [0,0,0,0,0,1|3,0,0]=4 180 B10R1.113 CC(=O)C1=CN=NC(C)=C1 E71800 [0,0,0,0,0,1|2,0,0]=3 181 B10R1.113 CC(=O)C1=NC(N)=CC=C1 N14723 [0,0,0,0,0,1|2,0,0]=3 182 B10R1.113 CC1=CC=CC(C(=N)N)=N1 74734 [0,0,0,0,0,1|3,0,0]=4 183 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [0,0,0,0,0,1|2,0,1]=4 184 B10R1.113 CC1=CC=CC(N(C)C)=N1 N10110 [0,0,0,0,0,1|3,0,0]=4 185 B10R1.113 CC1=CC=CC([C@H](C)N)=N1 N13137 [0,0,0,0,0,1|2,0,1]=4 186 B10R1.113 CC1=CC=NC(C(=N)N)=N1 38082 [0,0,0,0,0,1|3,0,0]=4 187 B10R1.113 CC1=NC=CC(C(C)C)=N1 O11252 [0,0,0,0,0,1|2,0,1]=4 188 B10R1.113 CC1=NC=CC([C@H](C)O)=C1 F13150 [0,0,0,0,0,1|1,0,2]=4 189 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [0,0,0,0,0,1|3,0,0]=4 190 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [0,0,0,0,0,1|3,0,0]=4 191 B10R1.113 NC(=O)C1=CN=CC(Br)=N1 W17936 [0,0,0,0,0,1|3,0,0]=4 192 B10R1.113 NC1=CC=NC(C(=O)O)=N1 AT18255 [0,0,0,0,0,1|3,0,0]=4 193 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=N1 C14874 [0,0,0,0,0,1|3,0,0]=4 194 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 D84548 [0,0,0,0,0,1|3,0,0]=4 195 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AC3399 [0,0,0,0,0,1|3,0,0]=4 196 B10R1.113 O=C([O-])C1=CC=CC(Cl)=C1 I11436 [0,0,0,0,0,1|3,0,0]=4 197 B7R1.1 CCC1=CN=CO1 C77473 [2,0,0,0,0,0|1,0,1]=4 198 B7R1.2 CC1=CC=C(S)S1 AT16550 [2,0,0,0,0,0|0,2,0]=4 199 B7R1.2 CC1=CN=C(C)O1 AC5679 [2,0,0,0,0,0|1,0,0]=3 200 B7R1.2 CC1=CN=C(Cl)O1 AT18559 [2,0,0,0,0,0|2,0,0]=4 201 B7R1.2 CC1=NC=C(Br)O1 AT18670 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.7 CC1=CC=C(CCN)S1 31616 [1,1,0,0,0,0|0,1,1]=4 203 B9R1.7 CNCC1=CC=C(C)S1 75578 [1,1,0,0,0,0|0,1,1]=4 204 B9R1.21 CCC1=CN=C(CCl)O1 AT18577 [1,1,0,0,0,0|1,0,1]=4 205 B9R1.21 CCC1=NC(C=O)=CS1 AT15240 [1,1,0,0,0,0|2,0,0]=4 206 B9R1.21 CCN1C=CC(C=O)=C1 AT16331 [1,1,0,0,0,0|2,0,0]=4 207 B9R1.21 CCN1C=CC(C=O)=N1 F14621 [1,1,0,0,0,0|2,0,0]=4 208 B9R1.21 COC1=CC=C(C=O)O1 AT17092 [1,1,0,0,0,0|0,0,0]=2 209 B9R1.21 COC1=CC=C(C=O)S1 F53534 [1,1,0,0,0,0|0,1,0]=3 210 B9R1.21 COC1=NC(C=O)=CS1 AT15252 [1,1,0,0,0,0|2,0,0]=4 211 B9R1.21 CSC1=CC=C(C=O)O1 AT17272 [1,1,0,0,0,0|0,0,0]=2 212 B9R1.21 CSC1=CC=C(C=O)S1 T72147 [1,1,0,0,0,0|0,1,0]=3 213 B9R1.21 CSC1=NC=C(C=O)S1 AT15087 [1,1,0,0,0,0|1,1,0]=4 214 B9R1.21 N#CC1=CC=C(CCl)O1 AT17436 [1,1,0,0,0,0|1,0,1]=4 215 B9R1.21 NCC1=CC=C(CO)O1 AT17200 [1,1,0,0,0,0|0,0,2]=4 216 B9R1.21 O=CC1=CC(CCl)=CS1 AT17066 [1,1,0,0,0,0|2,0,0]=4 217 B9R1.21 O=CC1=CC=C(CCl)O1 F11818 [1,1,0,0,0,0|0,0,0]=2 218 B9R1.21 O=CC1=NC(CO)=CS1 AT14686 [1,1,0,0,0,0|2,0,0]=4 219 B9R1.22 CC1=CC(C=O)=C(C)O1 AT17481 [1,1,0,0,0,0|2,0,0]=4 220 B9R1.22 CC1=NC(C=O)=C(Br)S1 C15352 [1,1,0,0,0,0|2,0,0]=4 221 B9R1.22 CC1=NC(C=O)=C(C)O1 S11308 [1,1,0,0,0,0|2,0,0]=4 222 B9R1.22 CC1=NC(C=O)=C(C)S1 AT15238 [1,1,0,0,0,0|2,0,0]=4 223 B9R1.22 CN1C=C(I)C(C=O)=N1 AT14258 [1,1,0,0,0,0|2,0,0]=4 224 B9R1.23 CC1=C(C)OC(C=O)=C1 F30227 [1,1,0,0,0,0|0,0,0]=2 225 B9R1.23 CC1=C(C)OC(C=O)=N1 AT18582 [1,1,0,0,0,0|1,0,0]=3 226 B9R1.23 O=CC1=CC(Br)=C(Br)O1 I10154 [1,1,0,0,0,0|1,0,0]=3 227 B9R1.132 CC1=C(C)C(C=O)=CS1 AT17088 [1,1,0,0,0,0|2,0,0]=4 228 B9R1.132 CC1=CN=C(C=O)N1C AT15705 [1,1,0,0,0,0|2,0,0]=4 229 B9R1.132 CN1C(Cl)=CC=C1C=O AT16174 [1,1,0,0,0,0|2,0,0]=4 230 B9R1.11 COC(=O)C1=NOC=C1 AT19828 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.11 COC(=O)C1=NSC=C1 AT21127 [1,1,0,0,0,0|2,0,0]=4 232 B9R1.11 C\C(=N/O)C1=CC=CS1 W18710 [1,1,0,0,0,0|0,1,1]=4 233 B9R1.11 N[C@@H](CO)C1=CC=CO1 C78116 [1,1,0,0,0,0|1,0,1]=4 234 B9R1.11 O=C(CBr)C1=CN=CS1 D74482 [1,1,0,0,0,0|1,1,0]=4 235 B9R1.11 O=C(CBr)C1=CSC=N1 79583 [1,1,0,0,0,0|2,0,0]=4 236 B9R1.11 O=C(CBr)C1=NC=CS1 AC5165 [1,1,0,0,0,0|1,1,0]=4 237 B9R1.11 O=C(CCl)C1=CC=NS1 AT21156 [1,1,0,0,0,0|1,1,0]=4 238 B9R1.11 O=C(CCl)C1=CN=CO1 AT18682 [1,1,0,0,0,0|1,0,0]=3 239 B9R1.11 O=C(CCl)C1=NOC=C1 AT19853 [1,1,0,0,0,0|2,0,0]=4 240 B9R1.11 O=C(CO)C1=CC=CS1 AC7083 [1,1,0,0,0,0|0,1,0]=3 241 B9R1.19 O=S(=O)(Cl)C1=CC=CO1 H10563 [1,1,0,0,0,0|2,0,0]=4 242 B9R1.41 CC(=O)C1=C(Br)C=CO1 AT17466 [1,1,0,0,0,0|0,0,0]=2 243 B9R1.41 CC(=O)C1=C(O)C=CS1 AT16388 [1,1,0,0,0,0|0,1,0]=3 244 B9R1.41 CC1=C(C(=O)Cl)OC=N1 AT23456 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.41 NC(=O)C1=C(F)C=CS1 92876 [1,1,0,0,0,0|1,1,0]=4 246 B9R1.41 NC(=O)C1=C(N)C=CO1 AC5297 [1,1,0,0,0,0|1,0,0]=3 247 B9R1.41 NC(=O)C1=C(O)C=CS1 75845 [1,1,0,0,0,0|1,1,0]=4 248 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 D87575 [0,1,0,0,0,1|1,0,0]=3 249 B11R1.3 CCC1=NC=C(C(C)=O)C=C1 P12273 [0,1,0,0,0,1|1,0,0]=3 250 B11R1.3 CNC1=CN=C(C(=O)O)C=C1 AT13629 [0,1,0,0,0,1|2,0,0]=4 251 B11R1.3 CNC1=NN=C(C(=O)O)C=C1 AC2109 [0,1,0,0,0,1|2,0,0]=4 252 B11R1.3 COC1=CN=C(C(C)=O)C=C1 P10973 [0,1,0,0,0,1|1,0,0]=3 253 B11R1.3 COC1=CN=C(C(N)=O)C=C1 D74451 [0,1,0,0,0,1|2,0,0]=4 254 B11R1.3 [2H]C(=O)C1=CC=C(OC)C=C1 D98577 [0,1,0,0,0,1|2,0,0]=4 255 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 69909 [0,1,0,0,0,1|2,0,0]=4 256 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 C75563 [0,1,0,0,0,1|1,0,0]=3 257 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 AC6089 [0,1,0,0,0,1|1,0,0]=3 258 B11R1.22 CC1=CN=C(C(=O)CBr)N=C1 F50744 [0,1,0,0,0,1|2,0,0]=4 259 B11R1.22 CC1=CN=C(\C(C)=N\O)C=C1 AB10298 [0,1,0,0,0,1|1,0,1]=4 260 B11R1.22 CCC(=O)C1=CN=C(Br)C=C1 F50479 [0,1,0,0,0,1|2,0,0]=4 261 B11R1.22 CCC(=O)C1=CN=C(C)C=C1 N14278 [0,1,0,0,0,1|1,0,0]=3 262 B11R1.22 CCC(=O)C1=CN=C(F)C=C1 N14274 [0,1,0,0,0,1|2,0,0]=4 263 B11R1.22 CNC(=O)C1=NC=C(N)C=C1 AT26730 [0,1,0,0,0,1|2,0,0]=4 264 B11R1.22 COC(=O)C1=CN=C(C)N=C1 P11085 [0,1,0,0,0,1|2,0,0]=4 265 B11R1.22 CO[S@@](=O)C1=CC=C(C)C=C1 D92807 [0,1,0,0,0,1|2,0,0]=4 266 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 24831 [0,1,0,0,0,1|2,0,0]=4 267 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 F14651 [0,1,0,0,0,1|2,0,0]=4 268 B11R1.22 NCC(=O)C1=NC=C(Br)C=C1 90935 [0,1,0,0,0,1|2,0,0]=4 269 B11R1.22 O=C(CF)C1=CC=C(Br)C=C1 W17424 [0,1,0,0,0,1|2,0,0]=4 270 B11R1.22 O=C(CO)C1=CC=C(O)C=C1 D87702 [0,1,0,0,0,1|2,0,0]=4 271 B11R1.22 O=C([13CH2]Br)C1=CC=C(Br)C=C1 D97990 [0,1,0,0,0,1|2,0,0]=4 272 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=N1 BL010230 [0,1,0,0,0,1|2,0,0]=4 273 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=N1 D79871 [0,1,0,0,0,1|2,0,0]=4 274 B11R1.166 CC(=O)C1=C(Cl)C=C(C)C=C1 AT15339 [0,1,0,0,0,1|1,0,0]=3 275 B11R1.166 CC(=O)C1=C(O)C=C(I)C=C1 62926 [0,1,0,0,0,1|2,0,0]=4 276 B11R1.166 CC(=O)C1=CN=C(Br)C=C1C D80175 [0,1,0,0,0,1|2,0,0]=4 277 B11R1.166 CC(=O)C1=NC=C(Br)C=C1F 83702 [0,1,0,0,0,1|2,0,0]=4 278 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 N17088 [0,1,0,0,0,1|2,0,0]=4 279 B11R1.166 CC1=CC(N)=C(C(=O)O)C=N1 25712 [0,1,0,0,0,1|2,0,0]=4 280 B11R1.166 CC1=CC=C(C(=O)O)C(Br)=N1 N12689 [0,1,0,0,0,1|2,0,0]=4 281 B11R1.39 COC(=O)CC1=CC=C(C)S1 94300 [0,1,0,0,0,1|0,1,0]=3 282 B11R1.43 CC(=O)NC1=CC=C(C=O)S1 78291 [0,1,0,0,0,1|0,1,1]=4 283 B11R1.43 CC(=O)NC1=NC(CCl)=CS1 78371 [0,1,0,0,0,1|2,0,0]=4 284 B11R1.43 CN(C)CC1=CC=C(CO)O1 C10626 [0,1,0,0,0,1|2,0,0]=4 285 B11R1.314 CC1=CC=C(C(N)C(C)O)O1 N16780 [0,1,0,0,0,1|0,0,2]=4 286 B11R1.314 CC1=CC=C([C@@H](N)C(C)C)O1 N16756 [0,1,0,0,0,1|1,0,1]=4 287 B11R1.314 CC1=CC=C([C@@H](N)C(C)C)O1 N16757 [0,1,0,0,0,1|1,0,1]=4 288 B11R1.314 CC1=CC=C([C@@H](N)C(C)C)O1 N16758 [0,1,0,0,0,1|1,0,1]=4 289 B11R1.314 CC1=CC=C([C@@H](N)[C@@H](C)O)O1 N16781 [0,1,0,0,0,1|0,0,2]=4 290 B11R1.314 CC1=CC=C([C@@H](N)[C@@H](C)O)O1 N16783 [0,1,0,0,0,1|0,0,2]=4 291 B11R1.314 CC1=CC=C([C@@H](N)[C@H](C)O)O1 N16782 [0,1,0,0,0,1|0,0,2]=4 292 B11R1.314 CC1=CC=C([C@@H](N)[C@H](C)O)O1 N16784 [0,1,0,0,0,1|0,0,2]=4 293 B11R1.23 CC1=CC(\C(C)=N\O)=NC=C1 D87307 [0,1,0,0,0,1|1,0,1]=4 294 B11R1.23 CC1=CC=CC(C(=O)CO)=C1 AC3231 [0,1,0,0,0,1|1,0,0]=3 295 B11R1.23 CCC(=O)C1=CC(Br)=CN=C1 N14270 [0,1,0,0,0,1|2,0,0]=4 296 B11R1.23 CCC(=O)C1=CC(Cl)=NC=C1 N13049 [0,1,0,0,0,1|2,0,0]=4 297 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 34175 [0,1,0,0,0,1|2,0,0]=4 298 B11R1.23 CNC(=O)C1=NC=CC(O)=C1 N13116 [0,1,0,0,0,1|2,0,0]=4 299 B11R1.23 COC(=O)C1=CC(N)=NC=C1 W17825 [0,1,0,0,0,1|2,0,0]=4 300 B11R1.23 COC(=O)C1=CC(S)=NC=C1 F18003 [0,1,0,0,0,1|2,0,0]=4 301 B11R1.23 COC(=O)C1=CC=CC(I)=N1 C16472 [0,1,0,0,0,1|2,0,0]=4 302 B11R1.23 COC(=O)C1=CN=CC(=O)N1 72441 [0,1,0,0,0,1|2,0,0]=4 303 B11R1.23 COC(=O)C1=NC=CC(O)=C1 AC3417 [0,1,0,0,0,1|2,0,0]=4 304 B11R1.23 NCC(=O)C1=CC(O)=CC=C1 C77908 [0,1,0,0,0,1|2,0,0]=4 305 B11R1.23 O=C(CBr)C1=CC(Br)=NC=C1 AT22740 [0,1,0,0,0,1|2,0,0]=4 306 B11R1.23 O=C(CBr)C1=NC(Cl)=NC=C1 89644 [0,1,0,0,0,1|2,0,0]=4 307 B11R1.23 O=C(CBr)C1=NC=CC(Cl)=C1 C16275 [0,1,0,0,0,1|2,0,0]=4 308 B11R1.23 O=C(CO)C1=CC=CC(Br)=C1 AC6088 [0,1,0,0,0,1|2,0,0]=4 309 B11R1.23 O=C(CO)C1=CC=CC(F)=C1 AC5675 [0,1,0,0,0,1|2,0,0]=4 310 B11R1.74 CC(=O)C1=CC(C)=NC(C)=C1 90618 [0,1,0,0,0,1|1,0,0]=3 311 B11R1.74 CC(=O)C1=CC(F)=CC(O)=C1 C90880 [0,1,0,0,0,1|2,0,0]=4 312 B11R1.74 CC1=CC(Br)=NC(C(=O)O)=C1 H11547 [0,1,0,0,0,1|2,0,0]=4 313 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 39217 [0,1,0,0,0,1|2,0,0]=4 314 B11R1.74 CC1=CC(C(N)=O)=CC(C)=N1 F12421 [0,1,0,0,0,1|2,0,0]=4 315 B11R1.74 CC1=NC(O)=CC(C(=O)O)=N1 W10241 [0,1,0,0,0,1|2,0,0]=4 316 B11R1.155 CC1=CC=NC(S(C)(=O)=O)=N1 C76468 [0,1,0,0,0,1|2,0,0]=4 317 B11R1.159 C=C(C)C1=C(N)C(C)=CC=C1 F18673 [0,1,0,0,0,1|2,0,0]=4 318 B11R1.159 CC(=O)C1=C(C)C(N)=CC=C1 O10268 [0,1,0,0,0,1|2,0,0]=4 319 B11R1.159 CC(=O)C1=C(C)C(O)=CC=C1 C76227 [0,1,0,0,0,1|2,0,0]=4 320 B11R1.159 CC(=O)C1=C(F)C(Cl)=NC=C1 AT26683 [0,1,0,0,0,1|2,0,0]=4 321 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1I 94553 [0,1,0,0,0,1|2,0,0]=4 322 B11R1.159 CC(=O)C1=CC=CC(O)=C1F AT11003 [0,1,0,0,0,1|2,0,0]=4 323 B11R1.159 CC1=CC=CC(C(N)=O)=C1Cl D87582 [0,1,0,0,0,1|2,0,0]=4 324 B11R1.159 CC1=CC=CC(C(N)=O)=C1O AC4144 [0,1,0,0,0,1|2,0,0]=4 325 B11R1.159 CC1=CN=CC(C(=O)O)=C1O AT13143 [0,1,0,0,0,1|2,0,0]=4 326 B11R1.159 CC1=NC=CC(C(=O)O)=C1C D87767 [0,1,0,0,0,1|2,0,0]=4 327 B11R1.167 CC(=O)C1=C(C)C=CC(Cl)=C1 F52542 [0,1,0,0,0,1|2,0,0]=4 328 B11R1.167 CC(=O)C1=C(N)C=CC(O)=C1 32344 [0,1,0,0,0,1|2,0,0]=4 329 B11R1.167 CC(=O)C1=CC(C)=CN=C1F N13305 [0,1,0,0,0,1|1,0,0]=3 330 B11R1.167 CC(=O)C1=CC(Cl)=NC=C1F AT18807 [0,1,0,0,0,1|2,0,0]=4 331 B11R1.167 CC(=O)C1=CC(Cl)=NC=C1N 92761 [0,1,0,0,0,1|2,0,0]=4 332 B11R1.167 CC1=CN=C(Br)C(C(=O)O)=C1 C16185 [0,1,0,0,0,1|2,0,0]=4 333 B11R1.167 CC1=NC(C(=O)O)=C(F)C=C1 FD10677 [0,1,0,0,0,1|2,0,0]=4 334 B11R1.266 C#CC1=CC=CC(C(C)=O)=C1 C77890 [0,1,0,0,0,1|1,0,1]=4 335 B11R1.266 C=CC1=CC=CC(C(C)=O)=C1 75088 [0,1,0,0,0,1|1,0,1]=4 336 B11R1.266 CC(=O)C1=CC(C=O)=CC=C1 CL9709 [0,1,0,0,0,1|1,0,1]=4 337 B11R1.266 CC(=O)C1=CC=CC(CBr)=C1 72814 [0,1,0,0,0,1|1,0,0]=3 338 B11R1.266 CC(=O)C1=NC=CC(C#N)=C1 50485 [0,1,0,0,0,1|1,0,1]=4 339 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 AC8491 [0,1,0,0,0,1|2,0,0]=4 340 B11R1.266 CNC1=NC=CC(C(=O)O)=C1 AT13630 [0,1,0,0,0,1|2,0,0]=4 341 B11R1.266 COC1=CC=NC(C(=O)O)=N1 F10461 [0,1,0,0,0,1|2,0,0]=4 342 B11R1.266 COC1=CN=CC(C(N)=O)=N1 D75899 [0,1,0,0,0,1|2,0,0]=4 343 B11R1.266 NCC1=CC=CC(C(=O)O)=N1 C14979 [0,1,0,0,0,1|2,0,0]=4 344 B11R1.266 NCC1=CC=CC(C(=O)O)=N1 N10456 [0,1,0,0,0,1|2,0,0]=4 345 B11R1.266 NCC1=CC=CC(C(N)=O)=C1 S11363 [0,1,0,0,0,1|2,0,0]=4 346 B11R1.266 NCC1=NC=CC(C(=O)O)=C1 AT13155 [0,1,0,0,0,1|2,0,0]=4 347 B11R1.15 C=CC[C@H](N)C1=CC=C(C)O1 N16768 [0,2,0,0,0,0|1,0,1]=4 348 B11R1.15 C=CC[C@H](N)C1=CC=C(C)O1 N16769 [0,2,0,0,0,0|1,0,1]=4 349 B11R1.15 C=CC[C@H](N)C1=CC=C(C)O1 N16770 [0,2,0,0,0,0|1,0,1]=4 350 B11R1.15 CC1=CC=C([C@@H](N)CCO)O1 N16777 [0,2,0,0,0,0|1,0,1]=4 351 B11R1.15 CC1=CC=C([C@@H](N)CCO)O1 N16778 [0,2,0,0,0,0|1,0,1]=4 352 B11R1.15 CC1=CC=C([C@@H](N)CCO)O1 N16779 [0,2,0,0,0,0|1,0,1]=4 353 B11R1.15 CCCC(=O)C1=CC=C(Cl)S1 L10051 [0,2,0,0,0,0|1,1,0]=4 354 B11R1.15 CCC[C@H](N)C1=CC=C(C)O1 N16750 [0,2,0,0,0,0|1,0,1]=4 355 B11R1.15 CCC[C@H](N)C1=CC=C(C)O1 N16751 [0,2,0,0,0,0|1,0,1]=4 356 B11R1.15 CCC[C@H](N)C1=CC=C(C)O1 N16752 [0,2,0,0,0,0|1,0,1]=4 357 B11R1.15 CCOC(=O)C1=CN=C(C)O1 F14065 [0,2,0,0,0,0|1,0,0]=3 358 B11R1.15 N#CCC(=O)C1=CC=C(Cl)S1 94322 [0,2,0,0,0,0|1,1,0]=4 359 B11R1.44 CCN1C=CC(C(=O)OC)=N1 78770 [0,2,0,0,0,0|2,0,0]=4 360 B11R1.44 COC(=O)C1=CC(CBr)=CS1 C15971 [0,2,0,0,0,0|2,0,0]=4 361 B11R1.44 COC(=O)C1=CC=C(CBr)S1 94428 [0,2,0,0,0,0|0,1,0]=3 362 B11R1.44 COC(=O)C1=CC=C(CN)S1 C90538 [0,2,0,0,0,0|0,1,0]=3 363 B11R1.44 COC(=O)C1=CC=C(CO)N1 D76272 [0,2,0,0,0,0|1,0,0]=3 364 B11R1.44 COC(=O)C1=CC=C(CO)O1 AT17170 [0,2,0,0,0,0|0,0,0]=2 365 B11R1.44 COC(=O)C1=COC(CBr)=N1 D77664 [0,2,0,0,0,0|2,0,0]=4 366 B11R1.44 COC(=O)C1=COC(CCl)=C1 AT17456 [0,2,0,0,0,0|2,0,0]=4 367 B11R1.225 CC1=CC(C(=O)CO)=C(C)S1 AC4311 [0,2,0,0,0,0|2,0,0]=4 368 B11R1.225 CC1=NC(C)=C(C(=O)CO)S1 AC3257 [0,2,0,0,0,0|1,1,0]=4 369 B11R1.225 COC(=O)C1=C(C)OC(C)=N1 84741 [0,2,0,0,0,0|2,0,0]=4 370 B11R1.225 COC(=O)C1=NN(C)C=C1C AT24707 [0,2,0,0,0,0|2,0,0]=4 371 B11R1.226 COC(=O)C1=CC(Br)=C(Br)S1 I10064 [0,2,0,0,0,0|1,1,0]=4 372 B11R1.226 COC(=O)C1=CC(Br)=C(Cl)N1 AC8289 [0,2,0,0,0,0|2,0,0]=4 373 B11R1.226 COC(=O)C1=CC(C)=C(C)N1 F30543 [0,2,0,0,0,0|1,0,0]=3 374 B11R1.226 COC(=O)C1=CC(Cl)=C(Cl)N1 72393 [0,2,0,0,0,0|2,0,0]=4 375 B11R1.226 COC(=O)C1=CC(N)=C(C)S1 S11695 [0,2,0,0,0,0|0,1,0]=3 376 B11R1.226 COC(=O)C1=CC(N)=C(Cl)S1 24651 [0,2,0,0,0,0|1,1,0]=4 377 B11R1.226 COC(=O)C1=CC(N)=C(N)S1 FD10494 [0,2,0,0,0,0|1,1,0]=4 378 B11R1.226 COC(=O)C1=CN(C)C(Br)=C1 C91431 [0,2,0,0,0,0|2,0,0]=4 379 B11R1.226 COC(=O)C1=NC(C)=C(Br)S1 AT10265 [0,2,0,0,0,0|2,0,0]=4 380 B11R1.865 COC(=O)C1=C(C)C(C)=CN1 O11895 [0,2,0,0,0,0|2,0,0]=4 381 B11R1.865 COC(=O)C1=CC=C(N)N1C F18362 [0,2,0,0,0,0|2,0,0]=4 382 B11R1.45 CC(C)(C)C1=CC=C(CN)O1 AT17202 [0,2,0,0,0,0|1,0,1]=4 383 B11R1.45 CCC1=CC=C(S(=O)(=O)Cl)O1 AT17342 [0,2,0,0,0,0|2,0,0]=4 384 B11R1.50 CC1=C(C(=O)O)OC(CO)=C1 AT17171 [0,2,0,0,0,0|1,0,0]=3 385 B11R1.50 CCC1=NC(C)=C(C(=O)O)O1 C14203 [0,2,0,0,0,0|2,0,0]=4 386 B11R1.50 CCC1=NC(C)=C(C(C)=O)S1 AT14683 [0,2,0,0,0,0|1,1,0]=4 387 B11R1.50 CSC1=CC(C)=C(C(=O)O)O1 AT17283 [0,2,0,0,0,0|1,0,0]=3 388 B11R1.124 CCCC1=CC=C(C(=O)O)S1 AT16415 [0,2,0,0,0,0|1,1,0]=4 389 B11R1.124 CCOC1=CC=C(C(=O)O)S1 AC3902 [0,2,0,0,0,0|1,1,0]=4 390 B11R1.124 COCC1=CC=C(C(=O)O)O1 78079 [0,2,0,0,0,0|1,0,0]=3 391 B11R1.124 O=C(O)C1=CC=C(CCO)S1 F19738 [0,2,0,0,0,0|1,1,0]=4 392 B11R1.175 CC(=O)C1=CC=C(C(=O)O)O1 AT17166 [0,2,0,0,0,0|0,0,1]=3 393 B11R1.175 CC(=O)C1=CC=C([N+](=O)[O-])S1 O10308 [0,2,0,0,0,0|1,1,0]=4 394 B11R1.175 CC(C)C1=CC=C(C(=O)O)O1 81689 [0,2,0,0,0,0|1,0,0]=3 395 B11R1.175 CC(C)C1=CC=C(C(=O)O)S1 AT16423 [0,2,0,0,0,0|1,1,0]=4 396 B11R1.175 O=C(O)C1=CC=C(C(F)F)O1 AT17241 [0,2,0,0,0,0|1,0,0]=3 397 B11R1.672 CC(=O)C1=NN(C)C(C)=C1Br F16008 [0,2,0,0,0,0|2,0,0]=4 398 B9R1.69 CC1=CC=C(I)C(=O)N1 93733 [0,0,1,1,0,0|2,0,0]=4 399 B9R1.2 CC1=CC(C=O)=NC=N1 AT18315 [1,0,0,0,0,1|2,0,0]=4 400 B9R1.2 COC1=CCC=C(C)C1 AC4015 [1,0,0,0,0,1|2,0,0]=4 401 B9R1.2 C\N=C1\C=C(C)C=CN1 W18359 [1,0,0,0,0,1|2,0,0]=4 402 B9R1.2 NC1=NC=CC(C=O)=C1 O10660 [1,0,0,0,0,1|2,0,0]=4 403 B9R1.2 O=CC1=CC(I)=CN=C1 H10413 [1,0,0,0,0,1|2,0,0]=4 404 B9R1.13 CC(=O)CC1=CSC=C1 66590 [1,0,0,0,0,1|2,0,0]=4 405 B9R1.13 CC(=O)CN1C=CC=N1 AT23998 [1,0,0,0,0,1|2,0,0]=4 406 B9R1.13 C[C@H](O)CC1=CC=CO1 W11911 [1,0,0,0,0,1|0,0,2]=4 407 B9R1.13 NC(=O)CC1=CC=CN1 72456 [1,0,0,0,0,1|2,0,0]=4 408 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 N11494 [0,0,0,0,0,2|2,0,0]=4 409 B11R1.20 CC(=O)O[C@@H]1C=CC(=O)CO1 W10954 [0,0,0,0,0,2|1,0,1]=4 410 B11R1.20 CC1=CN=C(CC(=O)[O-])C=C1 R10046 [0,0,0,0,0,2|2,0,0]=4 411 B11R1.75 O=C(O)\C=C\C1=CC=C(Br)O1 F12977 [0,0,0,0,0,2|2,0,0]=4 412 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 N12785 [0,0,0,0,0,2|1,0,0]=3 413 B11R1.157 CC(=O)NC1=CC=CC(Cl)=N1 F17978 [0,0,0,0,0,2|2,0,0]=4 414 B11R1.157 CC(=O)NC1=NC(N)=NC=C1 CS2583 [0,0,0,0,0,2|2,0,0]=4 415 B11R1.157 CC(=O)NC1=NC=CC(Cl)=N1 AC6062 [0,0,0,0,0,2|2,0,0]=4 416 B11R1.157 CC(=O)NC1=NN=CC(C)=C1 AC7585 [0,0,0,0,0,2|2,0,0]=4 417 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 AC5601 [0,0,0,0,0,2|2,0,0]=4