0 B12R1.77 C#C[C@@H](O)C1=C(OC)C=CC=C1 AC4743 [0,0,0,0,0,0|1,0,3]=4 1 B12R1.77 C=C[C@H](N)C1=C(OC)C=CC=C1 N15283 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.77 C=C[C@H](N)C1=C(OC)C=CC=C1 N15284 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.77 C=C[C@H](N)C1=C(OC)C=CC=C1 N15285 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.77 CC[C@H](N)C1=C(OC)C=CC=N1 N14894 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.77 CC[C@H](O)C1=C(OC)C=CC=C1 N14415 [0,0,0,0,0,0|1,0,2]=3 6 B12R1.77 COC(=O)C1=C(C#N)C=CN=C1 D87572 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.77 COC(=O)C1=C(C=O)C=CN=C1 W18508 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.77 COC(=O)C1=C(CBr)C=CN=C1 D80980 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.77 COC(=O)C1=C(CCl)C=NC=C1 90031 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.77 COC(=O)C1=C(CN)N=CC=C1 D87629 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.77 COC(=O)C1=C(OC)C=NC=C1 S10378 [0,0,0,0,0,0|1,0,0]=1 12 B12R1.77 COC(=O)C1=C(OC)N=CN=C1 AC6904 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.77 COC(=O)C1=C(OC)N=NC=C1 F30440 [0,0,0,0,0,0|2,0,0]=2 14 B12R1.77 COC(=O)C1=CC=CN=C1CBr 90029 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.77 COC(=O)C1=NC=CN=C1C#N F51594 [0,0,0,0,0,0|4,0,0]=4 16 B12R1.77 COC1=C(C(=O)CN)C=CC=C1 C74781 [0,0,0,0,0,0|2,0,0]=2 17 B12R1.77 COC1=C(C(=O)CO)C=CC=C1 AC5663 [0,0,0,0,0,0|2,0,0]=2 18 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N12819 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N13475 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N13476 [0,0,0,0,0,0|3,0,1]=4 21 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N13483 [0,0,0,0,0,0|3,0,1]=4 22 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N13484 [0,0,0,0,0,0|3,0,1]=4 23 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 D81510 [0,0,0,0,0,0|3,0,1]=4 24 B12R1.77 COC1=C([C@@H](O)CO)C=CC=C1 W15251 [0,0,0,0,0,0|2,0,2]=4 25 B12R1.77 N#CC1=C(C(=O)NN)C=CC=C1 O10762 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.41 CCNC1=C(OC)C=CC=N1 76883 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.41 COC1=C(CNN)C=CC=C1 P10476 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.53 C=C(Br)C1=C(OC)C=CC=C1 F18312 [1,0,0,0,0,0|1,0,1]=3 29 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 O10854 [1,0,0,0,0,0|1,0,1]=3 30 B11R1.53 CCC1=C(C(C)=O)C=CN=C1 CL0371 [1,0,0,0,0,0|2,0,0]=3 31 B11R1.53 CCC1=C(C(N)=S)C=CC=C1 F13433 [1,0,0,0,0,0|2,1,0]=4 32 B11R1.53 COC1=C(B(O)O)C=CN=C1 AT14617 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.53 COC1=C(C(=N)N)N=CC=C1 S10482 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.53 COC1=C(C(N)=O)C=CC=N1 D87306 [1,0,0,0,0,0|2,0,0]=3 35 B11R1.53 COC1=C([C@H](C)N)C=NC=C1 Y12493 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.53 COC1=C([C@H](C)N)N=CC=C1 90521 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 AC5882 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.53 COC1=CC=CN=C1C(N)=O D87880 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.53 CSC1=C(C(=O)O)N=CC=C1 AT16224 [1,0,0,0,0,0|1,1,0]=3 40 B11R1.53 N#CC1=C(C(=O)Cl)C=CC=C1 D87858 [1,0,0,0,0,0|3,0,0]=4 41 B11R1.53 N#CC1=C(C(N)=O)C=CC=C1 T70416 [1,0,0,0,0,0|3,0,0]=4 42 B11R1.53 O=C(O)C1=NC=CC=C1CO D77137 [1,0,0,0,0,0|3,0,0]=4 43 B11R1.53 O=CC1=C(C(=O)O)C=CC=N1 O10788 [1,0,0,0,0,0|3,0,0]=4 44 B11R1.53 O=CC1=CC=CN=C1C(=O)O D87924 [1,0,0,0,0,0|3,0,0]=4 45 B11R1.222 CC1=C(C(=O)CO)C=CC=C1 AC4310 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.222 CCC(=O)C1=C(Br)C=CC=C1 72058 [1,0,0,0,0,0|2,0,0]=3 47 B11R1.222 CCC(=O)C1=C(Br)C=NC=C1 N14286 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.222 CCC(=O)C1=C(Cl)C=CN=C1 N14267 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.222 CCC(=O)C1=C(F)C=CC=N1 N14248 [1,0,0,0,0,0|3,0,0]=4 50 B11R1.222 CCC(=O)C1=C(F)C=NC=C1 N14283 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.222 CCC(=O)C1=CC=CN=C1Br N14264 [1,0,0,0,0,0|3,0,0]=4 52 B11R1.222 CCC(=O)C1=CC=CN=C1Cl N14262 [1,0,0,0,0,0|3,0,0]=4 53 B11R1.222 CCC(=O)C1=CC=CN=C1F N14261 [1,0,0,0,0,0|3,0,0]=4 54 B11R1.222 CCC(=O)C1=NC=CC=C1C N12289 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [1,0,0,0,0,0|1,0,2]=4 56 B11R1.222 CNC(=O)C1=C(I)C=CC=C1 E72599 [1,0,0,0,0,0|2,0,0]=3 57 B11R1.222 CNC(=O)C1=NC=CC=C1O C71661 [1,0,0,0,0,0|2,0,0]=3 58 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [1,0,0,0,0,0|2,0,1]=4 59 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.222 COC(=N)C1=C(Br)C=CC=C1 AC5256 [1,0,0,0,0,0|2,0,0]=3 61 B11R1.222 COC(=O)C1=C(C)C=NC=C1 CS1425 [1,0,0,0,0,0|1,0,0]=2 62 B11R1.222 COC(=O)C1=C(Cl)C=NC=N1 67177 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.222 COC(=O)C1=CN=CN=C1Cl 31492 [1,0,0,0,0,0|3,0,0]=4 64 B11R1.222 COC(=O)C1=NC=NC=C1C F53212 [1,0,0,0,0,0|2,0,0]=3 65 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W12757 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.222 NC1=C(C(=O)CCl)C=CC=C1 72272 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 W17616 [1,0,0,0,0,0|3,0,0]=4 68 B11R1.222 O=C(CCl)C1=C(Cl)C=CC=C1 D71120 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.222 O=C(CO)C1=C(Br)C=CC=C1 AC7495 [1,0,0,0,0,0|3,0,0]=4 70 B11R1.222 O=C(CO)C1=C(F)C=CC=C1 AC5617 [1,0,0,0,0,0|3,0,0]=4 71 B11R1.222 O=C(CO)C1=C(I)C=CC=C1 AC7053 [1,0,0,0,0,0|3,0,0]=4 72 B13R1.89 CCC1=C(C(=O)C(C)C)C=CC=C1 N13977 [0,1,0,0,0,0|2,0,0]=3 73 B13R1.89 COC1=C(C(=O)C(=O)O)C=CC=C1 AT10835 [0,1,0,0,0,0|2,0,0]=3 74 B13R1.89 COC1=C(C(=O)C(C)C)C=CC=C1 N13989 [0,1,0,0,0,0|1,0,0]=2 75 B13R1.89 COC1=C(C(N)C(C)O)C=CC=C1 N15587 [0,1,0,0,0,0|2,0,1]=4 76 B13R1.89 COC1=C([C@@H](N)C(C)=O)C=CC=C1 N15588 [0,1,0,0,0,0|2,0,1]=4 77 B13R1.89 COC1=C([C@@H](N)C(C)O)C=CC=C1 N15586 [0,1,0,0,0,0|2,0,1]=4 78 B13R1.89 COC1=C([C@@H](N)[C@@H](C)O)C=CC=C1 N15583 [0,1,0,0,0,0|2,0,1]=4 79 B13R1.89 COC1=C([C@@H](N)[C@@H](C)O)C=CC=C1 N15585 [0,1,0,0,0,0|2,0,1]=4 80 B13R1.89 COC1=C([C@@H](N)[C@H](C)O)C=CC=C1 N15582 [0,1,0,0,0,0|2,0,1]=4 81 B13R1.107 COC(=O)C1=C(C=O)C(O)=CC=C1 AT18068 [0,1,0,0,0,0|2,0,0]=3 82 B13R1.107 COC(=O)C1=C(OC)C(Cl)=NC=N1 AT18376 [0,1,0,0,0,0|2,0,0]=3 83 B13R1.107 COC(=O)C1=CC=CC(Br)=C1C#N C10057 [0,1,0,0,0,0|2,0,0]=3 84 B13R1.107 COC(=O)C1=CC=CC(I)=C1CBr AT18696 [0,1,0,0,0,0|2,0,0]=3 85 B13R1.107 COC(=O)C1=NC=NC(N)=C1OC AT18374 [0,1,0,0,0,0|2,0,0]=3 86 B13R1.107 COC1=C(C(=O)CBr)C=CC=C1F F13575 [0,1,0,0,0,0|2,0,0]=3 87 B13R1.382 C=CCC1=C(C(=O)NC)C=CC=C1 AC4508 [0,1,0,0,0,0|2,0,1]=4 88 B13R1.382 CCOC1=C([C@@H](N)CC)C=CC=C1 N12645 [0,1,0,0,0,0|2,0,1]=4 89 B13R1.382 COC(=O)C1=C(CCN)C=CC=C1 34926 [0,1,0,0,0,0|1,0,0]=2 90 B13R1.464 CCCC(=O)C1=C(CC)C=CC=C1 N13975 [0,1,0,0,0,0|2,0,0]=3 91 B13R1.464 CCCC(=O)C1=C(OC)C=CC=C1 N13987 [0,1,0,0,0,0|1,0,0]=2 92 B13R1.464 CCOC(=O)C1=C(C=O)C=CC=C1 C74750 [0,1,0,0,0,0|2,0,0]=3 93 B13R1.464 CCOC(=O)C1=C(CBr)C=NC=C1 90034 [0,1,0,0,0,0|3,0,0]=4 94 B13R1.464 CCOC(=O)C1=C(OC)N=CN=C1 F30436 [0,1,0,0,0,0|2,0,0]=3 95 B13R1.464 CCOC(=O)C1=NC=CC=C1C#N C16848 [0,1,0,0,0,0|3,0,0]=4 96 B13R1.464 COC1=C(\C(C)=C\C#N)C=CC=C1 W15658 [0,1,0,0,0,0|2,0,1]=4 97 B13R1.547 COC(=O)C1=C(C(=O)O)C=CN=C1 AT17431 [0,1,0,0,0,0|3,0,0]=4 98 B13R1.547 COC(=O)C1=C(C(=O)O)N=CC=C1 AB9542 [0,1,0,0,0,0|3,0,0]=4 99 B13R1.547 COC(=O)C1=C(C(F)F)C=CC=C1 CK2184 [0,1,0,0,0,0|2,0,0]=3 100 B13R1.547 COC(=O)C1=NC=CC=C1C(N)=O AC5704 [0,1,0,0,0,0|3,0,0]=4 101 B13R1.2065 CCC1=C(C(=O)OC)C=CC(F)=C1 E72108 [0,1,0,0,0,0|1,0,0]=2 102 B13R1.2065 CNC(=O)C1=C(OC)N=C(Br)C=C1 C92975 [0,1,0,0,0,0|2,0,0]=3 103 B13R1.2065 CNC1=CC(Cl)=NC=C1C(=O)OC AT20081 [0,1,0,0,0,0|2,0,0]=3 104 B13R1.2065 COC(=O)C1=C(CCl)C=C(Br)C=C1 AT18695 [0,1,0,0,0,0|2,0,0]=3 105 B13R1.2065 COC(=O)C1=C(OC)N=C(C)C=C1 AC9086 [0,1,0,0,0,0|1,0,0]=2 106 B13R1.2065 COC(=O)C1=CN=C(Br)C=C1OC C91419 [0,1,0,0,0,0|1,0,0]=2 107 B13R1.2209 COC(=O)C1=C(OC)C=NC(N)=C1 97632 [0,1,0,0,0,0|1,0,0]=2 108 B13R1.2209 COC(=O)C1=C(OC)N=CC(Br)=N1 N12955 [0,1,0,0,0,0|2,0,0]=3 109 B13R1.2209 COC(=O)C1=C(SC)C=CC(Br)=C1 93491 [0,1,0,0,0,0|0,1,0]=2 110 B13R1.2209 COC(=O)C1=CC(Br)=NC=C1OC 97631 [0,1,0,0,0,0|1,0,0]=2 111 B13R1.2209 COC(=O)C1=CC(F)=CN=C1OC 85044 [0,1,0,0,0,0|1,0,0]=2 112 B13R1.2209 COC1=C(C(=O)CO)C=C(F)C=C1 AC3357 [0,1,0,0,0,0|2,0,0]=3 113 B13R1.2357 CNC(=O)C1=C(F)C=CN=C1OC E71695 [0,1,0,0,0,0|2,0,0]=3 114 B13R1.2357 COC(=O)C1=C(C#N)C=CN=C1Cl 94321 [0,1,0,0,0,0|3,0,0]=4 115 B13R1.2357 COC(=O)C1=C(Cl)C=CN=C1CBr C92969 [0,1,0,0,0,0|3,0,0]=4 116 B13R1.2357 COC(=O)C1=C(OC)N=CC=C1C 91447 [0,1,0,0,0,0|1,0,0]=2 117 B13R2.32 CN1N=CC2=C(C=CC=C2)C1=O N16864 [0,0,0,1,0,0|3,0,0]=4 118 B13R2.32 C[C@H]1C=NC2=C(C=CC=C2)C1=O AC4882 [0,0,0,1,0,0|2,0,1]=4 119 B13R2.32 C[C@H]1COC2=C(C=CC=C2)C1=O N13022 [0,0,0,1,0,0|1,0,0]=2 120 B13R2.32 O=C1C2=C(C=CC=C2)CC[C@@H]1Cl 51879 [0,0,0,1,0,0|3,0,0]=4 121 B13R2.91 COC1=C(C2(N)CC2)C=CC=C1 79155 [0,0,0,1,0,0|2,0,1]=4 122 B13R2.371 CN1C=CC(=O)C2=C1C=CC=C2 D86440 [0,0,0,1,0,0|2,0,1]=4 123 B13R2.371 CN1CCC(=O)C2=C1C=CC=C2 93242 [0,0,0,1,0,0|2,0,0]=3 124 B13R2.371 N[C@H]1CCC(=O)C2=C1C=CC=C2 73528 [0,0,0,1,0,0|3,0,0]=4 125 B13R2.371 O=C1CC[C@H](Br)C2=C1C=CC=C2 AT21616 [0,0,0,1,0,0|3,0,0]=4 126 B13R2.582 COC1=C2C(=CC=C1)NN=C2I F17790 [0,0,0,1,0,0|3,0,0]=4 127 B13R2.582 COC1=C2C(=CC=C1)NN=C2N 59858 [0,0,0,1,0,0|3,0,0]=4 128 B13R2.582 COC1=C2C(=O)NNC2=CC=C1 F18745 [0,0,0,1,0,0|2,0,0]=3 129 B13R2.582 N#CC1=C2C(=O)NCC2=CC=C1 F18514 [0,0,0,1,0,0|3,0,0]=4 130 B13R2.582 O=CC1=C2C(=O)NCC2=CC=C1 F17992 [0,0,0,1,0,0|3,0,0]=4 131 B13R2.1613 COC1=NC=CC2=CC=CC=C21 C15382 [0,0,0,1,0,0|2,0,1]=4 132 B13R2.5252 C=C1CCCCC2=C1C=CC=C2 O11475 [0,0,0,1,0,0|3,0,0]=4 133 B13R2.5252 O=C1CCC=CC2=C1C=CC=C2 92612 [0,0,0,1,0,0|2,0,1]=4 134 B11R1.59 CCC1=C(C(=O)OC)C=CN1 F17904 [0,0,0,0,1,0|2,0,0]=3 135 B11R1.59 CCC1=C(C(=O)OC)C=NO1 F30617 [0,0,0,0,1,0|3,0,0]=4 136 B11R1.59 CCC1=C(C(=O)OC)SC=N1 87848 [0,0,0,0,1,0|3,0,0]=4 137 B11R1.59 CCN1C=NC=C1C(=O)OC F51540 [0,0,0,0,1,0|3,0,0]=4 138 B11R1.59 COC(=O)C1=C(C=O)OC=C1 91173 [0,0,0,0,1,0|3,0,0]=4 139 B11R1.59 COC(=O)C1=C(CCl)OC=C1 AT17457 [0,0,0,0,1,0|3,0,0]=4 140 B11R1.59 COC(=O)C1=CSC=C1C=O F53461 [0,0,0,0,1,0|3,0,0]=4 141 B13R1.91 CCC(=O)CC1=C(OC)C=CC=C1 N14171 [0,0,0,0,0,1|1,0,0]=2 142 B13R1.91 CC[C@H](N)CC1=C(OC)C=CC=C1 N14517 [0,0,0,0,0,1|2,0,1]=4 143 B13R1.91 CN[C@@H](C)CC1=C(OC)C=CC=C1 N10866 [0,0,0,0,0,1|2,0,1]=4 144 B13R1.91 COC(=O)CC1=C(CBr)C=CC=C1 AC9687 [0,0,0,0,0,1|2,0,0]=3 145 B13R1.91 COC(=O)CC1=C(CO)C=CC=C1 N13290 [0,0,0,0,0,1|2,0,0]=3 146 B13R1.91 COC(=O)CC1=NC=CC=C1OC 82614 [0,0,0,0,0,1|1,0,0]=2 147 B13R1.91 COC1=C(NC(=O)CN)C=CC=C1 F21120 [0,0,0,0,0,1|2,0,0]=3 148 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [2,0,0,0,0,0|1,0,1]=4 149 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [2,0,0,0,0,0|1,0,1]=4 150 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [2,0,0,0,0,0|2,0,0]=4 151 B10R1.20 CNC1=C(CO)C=CC=C1 C74490 [2,0,0,0,0,0|1,0,1]=4 152 B10R1.20 CNC1=C(OC)C=CC=N1 77471 [2,0,0,0,0,0|2,0,0]=4 153 B10R1.20 CNC1=C(SC)C=CC=C1 AT20832 [2,0,0,0,0,0|1,1,0]=4 154 B10R1.20 COC1=C(CO)C=CN=C1 P11879 [2,0,0,0,0,0|1,0,1]=4 155 B10R1.20 COC1=C(NN)C=CC=C1 71208 [2,0,0,0,0,0|2,0,0]=4 156 B10R1.20 COC1=C(SC)C=CC=N1 F50798 [2,0,0,0,0,0|1,1,0]=4 157 B10R1.20 COC1=NC=CN=C1C=O P10873 [2,0,0,0,0,0|2,0,0]=4 158 B10R1.61 C=C(C)C1=C(I)C=CC=C1 E72643 [2,0,0,0,0,0|2,0,0]=4 159 B10R1.61 CC(=O)C1=C(C)C=CN=C1 69949 [2,0,0,0,0,0|1,0,0]=3 160 B10R1.61 CC(=O)C1=C(C)C=NC=C1 28203 [2,0,0,0,0,0|1,0,0]=3 161 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 86430 [2,0,0,0,0,0|2,0,0]=4 162 B10R1.61 CC(=O)C1=C(N)C=NC=C1 W18377 [2,0,0,0,0,0|2,0,0]=4 163 B10R1.61 CC(=O)C1=C(S)C=CC=C1 93483 [2,0,0,0,0,0|0,1,0]=3 164 B10R1.61 CC(=O)C1=CC=CNC1=O C10188 [2,0,0,0,0,0|1,0,1]=4 165 B10R1.61 CC(=O)C1=NC=NC=C1C O10307 [2,0,0,0,0,0|2,0,0]=4 166 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [2,0,0,0,0,0|1,0,1]=4 167 B10R1.61 CC1=[13C](C(=O)O)C=CC=C1 D98685 [2,0,0,0,0,0|0,0,0]=2 168 B10R1.61 NC(=O)C1=C(O)N=CC=C1 D74336 [2,0,0,0,0,0|2,0,0]=4 169 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 78917 [2,0,0,0,0,0|2,0,0]=4 170 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 I11424 [2,0,0,0,0,0|1,0,1]=4 171 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 FD10574 [2,0,0,0,0,0|0,0,1]=3 172 B10R1.15 CCC(=O)C1=CC=NC=C1 N12310 [2,0,0,0,0,0|2,0,0]=4 173 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [2,0,0,0,0,0|1,0,0]=3 174 B10R1.15 COC(=N)C1=CC=NC=C1 D87808 [2,0,0,0,0,0|2,0,0]=4 175 B10R1.15 COC(=O)N1C=CC=CC1 F21432 [2,0,0,0,0,0|1,0,1]=4 176 B12R1.75 COC1=C(C[C@H](C)N)C=CC=C1 N11278 [1,1,0,0,0,0|1,0,1]=4 177 B12R1.75 COC1=C(C[C@H](C)N)C=CC=C1 N11279 [1,1,0,0,0,0|1,0,1]=4 178 B12R1.75 COC1=C(NC(C)=S)C=CC=C1 81285 [1,1,0,0,0,0|2,0,0]=4 179 B12R1.121 CNCCC1=C(OC)C=CC=C1 C77728 [1,1,0,0,0,0|1,0,1]=4 180 B12R1.121 COC1=C(CCCBr)C=CC=C1 C78175 [1,1,0,0,0,0|1,0,1]=4 181 B12R1.169 COCC1=C(CCO)C=CC=C1 C14460 [1,1,0,0,0,0|1,0,1]=4 182 B12R1.46 CNC1=C(C(=O)O)C=C(C)C=C1 69952 [1,1,0,0,0,0|1,0,0]=3 183 B12R1.46 COC1=C(B(O)O)C=C(O)C=C1 I12049 [1,1,0,0,0,0|1,0,1]=4 184 B12R1.46 COC1=C(C(N)=O)N=C(Cl)C=C1 AT12678 [1,1,0,0,0,0|2,0,0]=4 185 B12R1.46 COC1=C([C@H](C)N)C=C(C)C=C1 N12589 [1,1,0,0,0,0|1,0,1]=4 186 B12R1.46 COC1=C([C@H](C)O)C=C(Br)C=C1 W19098 [1,1,0,0,0,0|0,0,2]=4 187 B12R1.46 COC1=C([C@H](C)O)C=C(F)C=C1 70727 [1,1,0,0,0,0|0,0,2]=4 188 B12R1.46 CSC1=C(C(=O)O)C=C(Br)C=C1 95569 [1,1,0,0,0,0|0,1,0]=3 189 B12R1.46 CSC1=C(C(=O)O)C=C(Cl)C=C1 AT16919 [1,1,0,0,0,0|0,1,0]=3 190 B12R1.46 N#CC1=C(C(=O)O)C=C(F)C=C1 CK2182 [1,1,0,0,0,0|2,0,0]=4 191 B12R1.46 N#CC1=C(C(=O)O)C=C(N)C=C1 D96199 [1,1,0,0,0,0|2,0,0]=4 192 B12R1.57 CC(=O)C1=C(C#N)C=C(F)C=C1 F13350 [1,1,0,0,0,0|2,0,0]=4 193 B12R1.57 CCC1=C(C(C)=O)C=CC(O)=C1 D88175 [1,1,0,0,0,0|1,0,0]=3 194 B12R1.57 CNC1=C(C(=O)O)C=CC(Br)=C1 D87579 [1,1,0,0,0,0|1,0,0]=3 195 B12R1.57 CNC1=C(C(=O)O)C=CC(Cl)=C1 C15968 [1,1,0,0,0,0|1,0,0]=3 196 B12R1.57 CNC1=C(C(=O)O)C=CC(F)=C1 S11455 [1,1,0,0,0,0|1,0,0]=3 197 B12R1.57 CNC1=CC(Cl)=NC=C1C(=O)O AT15547 [1,1,0,0,0,0|2,0,0]=4 198 B12R1.57 COC1=C(C(=O)O)C=CC(O)=C1 AT19378 [1,1,0,0,0,0|0,0,0]=2 199 B12R1.57 COC1=C(C(=O)O)C=NC(C)=N1 AT18392 [1,1,0,0,0,0|2,0,0]=4 200 B12R1.57 COC1=C(C(C)=O)C=CC(Br)=N1 N13947 [1,1,0,0,0,0|1,0,0]=3 201 B12R1.57 COC1=C(C(C)=O)C=CC(O)=C1 W17789 [1,1,0,0,0,0|0,0,0]=2 202 B12R1.57 COC1=C(C(N)=O)C=CC(N)=C1 92906 [1,1,0,0,0,0|1,0,0]=3 203 B12R1.57 COC1=C([C@H](C)N)C=CC(F)=C1 N13112 [1,1,0,0,0,0|1,0,1]=4 204 B12R1.57 CSC1=C(C(=O)O)C=CC(Br)=C1 AT10168 [1,1,0,0,0,0|0,1,0]=3 205 B12R1.76 COC1=C(S(C)(=O)=O)C=CC=N1 F50797 [1,1,0,0,0,0|2,0,0]=4 206 B12R1.76 COC1=C(S(N)(=O)=O)C=CC=C1 F53497 [1,1,0,0,0,0|1,0,1]=4 207 B12R1.87 COC1=C(Br)C=CC=C1[C@H](C)O F50434 [1,1,0,0,0,0|0,0,2]=4 208 B12R1.87 CSC1=C(Cl)C=CC=C1C(=O)O D85880 [1,1,0,0,0,0|0,1,0]=3 209 B12R1.87 N#CC1=C(F)C=CC=C1C(=O)O 98175 [1,1,0,0,0,0|2,0,0]=4 210 B12R1.87 O=CC1=C(C(=O)O)C=CC=C1O AT18072 [1,1,0,0,0,0|2,0,0]=4 211 B12R1.261 CC(=O)C1=C(C(=O)O)C=CC=N1 O10637 [1,1,0,0,0,0|2,0,0]=4 212 B12R1.261 CN(C)C1=C(C(=O)O)C=NC=C1 D72071 [1,1,0,0,0,0|2,0,0]=4 213 B12R1.437 COC1=C([N+](=O)[O-])C(O)=CC=C1 97459 [1,1,0,0,0,0|1,0,1]=4 214 B12R1.437 COC1=CC=CC(F)=C1C(N)=O C78284 [1,1,0,0,0,0|1,0,0]=3 215 B12R1.437 COC1=CC=CC(F)=C1[C@H](C)N D81661 [1,1,0,0,0,0|1,0,1]=4 216 B12R1.437 COC1=CC=NC(N)=C1C(=O)O N12993 [1,1,0,0,0,0|1,0,0]=3 217 B12R1.437 COC1=NC=CC(Br)=C1C(=O)O C71764 [1,1,0,0,0,0|1,0,0]=3 218 B12R1.24 CC1=CC=CC(C(=O)CCl)=C1O AC6764 [1,1,0,0,0,0|2,0,0]=4 219 B12R1.24 CCC(=O)C1=C(C)C(C)=CC=C1 N14095 [1,1,0,0,0,0|1,0,0]=3 220 B12R1.24 CCC(=O)C1=C(Cl)C(C)=CC=C1 N14078 [1,1,0,0,0,0|2,0,0]=4 221 B12R1.24 CCC(=O)C1=C(F)C(C)=CC=C1 N14020 [1,1,0,0,0,0|2,0,0]=4 222 B12R1.24 CCC(=O)C1=CC=CC(Br)=C1F N14019 [1,1,0,0,0,0|2,0,0]=4 223 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1Cl N14074 [1,1,0,0,0,0|2,0,0]=4 224 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1F 97466 [1,1,0,0,0,0|2,0,0]=4 225 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1O P17540 [1,1,0,0,0,0|1,0,0]=3 226 B12R1.24 CNC(=O)C1=C(O)C(N)=CC=C1 F19753 [1,1,0,0,0,0|1,0,0]=3 227 B12R1.24 CNC(=O)C1=CC=CC(Br)=C1F AT22330 [1,1,0,0,0,0|2,0,0]=4 228 B12R1.24 CNC(=O)C1=CC=CC(Br)=C1N F15703 [1,1,0,0,0,0|2,0,0]=4 229 B12R1.24 COC(=O)C1=C(S)C(C)=CC=C1 AT20789 [1,1,0,0,0,0|0,1,0]=3 230 B12R1.24 COC(=O)C1=CC=CC(F)=C1Br D75737 [1,1,0,0,0,0|1,0,0]=3 231 B12R1.24 COC(=O)C1=CC=CC(O)=C1I 89862 [1,1,0,0,0,0|1,0,0]=3 232 B12R1.24 COC(=O)C1=CN=CC([O-])=C1Cl D81651 [1,1,0,0,0,0|2,0,0]=4 233 B12R1.24 COC(=O)C1=NC=NC(O)=C1O C90304 [1,1,0,0,0,0|2,0,0]=4 234 B12R1.24 O=C(CBr)C1=C(O)C(F)=CC=C1 F13388 [1,1,0,0,0,0|2,0,0]=4 235 B12R1.124 CC(C)C(=O)C1=C(Br)C=CC=C1 N13960 [1,1,0,0,0,0|2,0,0]=4 236 B12R1.124 CC1=C(C(=O)C(C)C)C=CC=C1 N12569 [1,1,0,0,0,0|1,0,0]=3 237 B12R1.124 CC1=CC=CN=C1C(=O)C(C)C N12211 [1,1,0,0,0,0|2,0,0]=4 238 B12R1.124 CN(C)C(=O)C1=C(S)C=CC=C1 AC9832 [1,1,0,0,0,0|1,1,0]=4 239 B12R1.308 C=COC(=O)C1=C(Cl)C=CC=C1 T70344 [1,1,0,0,0,0|1,0,1]=4 240 B12R1.308 CCCC(=O)C1=C(Br)C=CC=C1 N13959 [1,1,0,0,0,0|2,0,0]=4 241 B12R1.308 CCCC(=O)C1=C(C)C=CC=C1 N13966 [1,1,0,0,0,0|1,0,0]=3 242 B12R1.308 CCCC(=O)C1=C(Cl)C=CC=C1 N12776 [1,1,0,0,0,0|2,0,0]=4 243 B12R1.308 CCCC(=O)C1=C(F)C=CC=C1 N13948 [1,1,0,0,0,0|2,0,0]=4 244 B12R1.308 CCOC(=N)C1=C(F)C=CC=C1 AC6130 [1,1,0,0,0,0|2,0,0]=4 245 B12R1.308 CCOC(=O)C1=C(C)C=NC=C1 90030 [1,1,0,0,0,0|1,0,0]=3 246 B12R1.308 CCOC(=O)C1=C(Cl)C=CN=C1 25333 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.308 CCOC(=O)C1=CC=CN=C1F 91498 [1,1,0,0,0,0|2,0,0]=4 248 B12R1.308 CCOC(=O)C1=NC=CC=C1O AC5369 [1,1,0,0,0,0|1,0,0]=3 249 B12R1.308 CCOC(=O)C1=NC=NC=C1C F53194 [1,1,0,0,0,0|2,0,0]=4 250 B12R1.354 CC1=CC(C(=O)NN)=C(C)C=C1 W15991 [1,1,0,0,0,0|2,0,0]=4 251 B12R1.354 CCC(=O)C1=C(Br)C=CC(Br)=C1 N14118 [1,1,0,0,0,0|2,0,0]=4 252 B12R1.354 CCC(=O)C1=C(Cl)C=CC(Cl)=C1 N14112 [1,1,0,0,0,0|2,0,0]=4 253 B12R1.354 CCC(=O)C1=C(F)C=CC(C)=C1 N14035 [1,1,0,0,0,0|2,0,0]=4 254 B12R1.354 CCC(=O)C1=C(F)C=CC(Cl)=C1 N14033 [1,1,0,0,0,0|2,0,0]=4 255 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=N1 85646 [1,1,0,0,0,0|2,0,0]=4 256 B12R1.354 COC(=O)C1=C(C)N=CC(N)=C1 F14199 [1,1,0,0,0,0|1,0,0]=3 257 B12R1.354 COC(=O)C1=C(I)C=CC(O)=C1 A10040 [1,1,0,0,0,0|1,0,0]=3 258 B12R1.354 COC(=O)C1=C(S)C=CC(Br)=C1 93490 [1,1,0,0,0,0|0,1,0]=3 259 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1Br D76941 [1,1,0,0,0,0|2,0,0]=4 260 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1F 21049 [1,1,0,0,0,0|2,0,0]=4 261 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1C AT21682 [1,1,0,0,0,0|1,0,0]=3 262 B12R1.354 COC(=O)C1=CC(F)=CN=C1N F30089 [1,1,0,0,0,0|2,0,0]=4 263 B12R1.354 COC(=O)C1=NC(C)=CN=C1C O11898 [1,1,0,0,0,0|2,0,0]=4 264 B12R1.1703 CCC(=O)C1=C(Br)C=C(Br)C=C1 N14094 [1,1,0,0,0,0|2,0,0]=4 265 B12R1.1703 CCC(=O)C1=C(C)C=C(C)C=C1 N12084 [1,1,0,0,0,0|1,0,0]=3 266 B12R1.1703 CCC(=O)C1=C(C)C=C(O)C=C1 91379 [1,1,0,0,0,0|1,0,0]=3 267 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Br)C=C1 98264 [1,1,0,0,0,0|2,0,0]=4 268 B12R1.1703 CCC(=O)C1=C(Cl)C=C(C)C=C1 N14082 [1,1,0,0,0,0|2,0,0]=4 269 B12R1.1703 CCC(=O)C1=C(F)C=C(C)C=C1 N14029 [1,1,0,0,0,0|2,0,0]=4 270 B12R1.1703 CCC(=O)C1=C(O)C=C(Cl)C=C1 98266 [1,1,0,0,0,0|1,0,0]=3 271 B12R1.1703 CNC(=O)C1=C(Cl)C=C(N)C=C1 92895 [1,1,0,0,0,0|2,0,0]=4 272 B12R1.1703 COC(=O)C1=C(C)OC(=O)C=C1 C16199 [1,1,0,0,0,0|1,0,0]=3 273 B12R1.1703 COC(=O)C1=C(Cl)N=C(Br)C=C1 D74278 [1,1,0,0,0,0|2,0,0]=4 274 B12R1.1703 COC(=O)C1=C(S)C=C(Cl)C=C1 AT20785 [1,1,0,0,0,0|0,1,0]=3 275 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1Br F17566 [1,1,0,0,0,0|2,0,0]=4 276 B12R1.1703 O=C(CCl)C1=C(O)C=C(F)C=C1 AC4164 [1,1,0,0,0,0|2,0,0]=4 277 B12R1.3441 CCC(=O)C1=C(Br)C=CC=C1F N14041 [1,1,0,0,0,0|2,0,0]=4 278 B12R1.3441 CCC(=O)C1=C(C)C=CC=C1C N14109 [1,1,0,0,0,0|1,0,0]=3 279 B12R1.3441 CCC(=O)C1=C(Cl)C=CC=C1Cl N12942 [1,1,0,0,0,0|2,0,0]=4 280 B12R1.3441 CCC(=O)C1=C(Cl)C=CC=C1F N12941 [1,1,0,0,0,0|2,0,0]=4 281 B12R1.3441 CCC(=O)C1=C(F)C=CC=C1C N14043 [1,1,0,0,0,0|1,0,0]=3 282 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1Br N11752 [1,1,0,0,0,0|1,0,0]=3 283 B12R1.3441 COC(=O)C1=C(Br)C=CN=C1Cl 55293 [1,1,0,0,0,0|2,0,0]=4 284 B12R1.3441 COC(=O)C1=C(Br)C=NC=C1F AT10438 [1,1,0,0,0,0|2,0,0]=4 285 B12R1.3441 COC(=O)C1=C(C)C=CN=C1Br 90162 [1,1,0,0,0,0|1,0,0]=3 286 B12R1.3441 COC(=O)C1=C(C)C=CN=C1Cl 82626 [1,1,0,0,0,0|1,0,0]=3 287 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1N 51169 [1,1,0,0,0,0|1,0,0]=3 288 B12R1.3441 COC(=O)C1=C(O)N=CC=C1C 82630 [1,1,0,0,0,0|1,0,0]=3 289 B12R1.743 CCN1C(N)=CC=C1C(=O)OC F18443 [0,1,0,0,1,0|2,0,0]=4 290 B14R1.95 COC(=O)C(=O)C1=C(CBr)C=CC=C1 AC3556 [0,1,0,0,0,1|2,0,0]=4 291 B14R1.965 CCCC(=O)CC1=C(OC)C=CC=C1 N14172 [0,1,0,0,0,1|1,0,0]=3 292 B14R1.3135 COC1=C(CC(=O)C(=O)O)C=CC=C1 C91207 [0,1,0,0,0,1|2,0,0]=4 293 B14R1.3135 COC1=C(CC(=O)C(C)C)C=CC=C1 N14174 [0,1,0,0,0,1|1,0,0]=3 294 B14R1.3135 COC1=C(NC(=O)C(=O)O)C=CC=C1 AT24760 [0,1,0,0,0,1|2,0,0]=4 295 B14R1.3279 COC(=O)CC1=C(C#N)C=CC(F)=C1 C90917 [0,1,0,0,0,1|2,0,0]=4 296 B14R1.3417 COC(=O)CC1=NC=C(Br)C=C1OC 59800 [0,1,0,0,0,1|1,0,0]=3 297 B14R1.839 CCC1=C(C(=O)C(C)(C)C)C=CC=C1 N13978 [0,2,0,0,0,0|2,0,0]=4 298 B14R1.839 COC1=C(C(=O)C(C)(C)C)C=CC=C1 N12681 [0,2,0,0,0,0|1,0,0]=3 299 B14R1.1867 COC1=C(C(=O)C(Br)Br)C=C(Cl)C=C1 D88029 [0,2,0,0,0,0|2,0,0]=4 300 B14R1.2171 CCC(=O)C1=C(OC)C(OC)=CC=C1 N12780 [0,2,0,0,0,0|1,0,0]=3 301 B14R1.3101 C=CCC1=C(C(=O)OC)C=CC=C1O F14163 [0,2,0,0,0,0|1,0,1]=4 302 B14R1.7255 CCOC(=O)C1=CC=CC(Br)=C1CBr F30876 [0,2,0,0,0,0|2,0,0]=4 303 B14R1.7255 CCOC(=O)C1=CC=CC(F)=C1CBr 94868 [0,2,0,0,0,0|2,0,0]=4 304 B14R1.12435 COC(=O)C1=C(OC)C(C)=C(C)N=C1 96851 [0,2,0,0,0,0|1,0,0]=3 305 B14R1.12435 COC(=O)C1=CC=C(F)C(F)=C1CBr AT10750 [0,2,0,0,0,0|2,0,0]=4 306 B14R1.12530 COC(=O)C1=CC(Br)=CC(Br)=C1OC N12109 [0,2,0,0,0,0|0,0,0]=2 307 B14R1.12530 COC(=O)C1=CC(Br)=CC(I)=C1OC AT22677 [0,2,0,0,0,0|0,0,0]=2 308 B14R1.12530 COC(=O)C1=CC(Cl)=CC(Cl)=C1CBr F18262 [0,2,0,0,0,0|2,0,0]=4 309 B14R1.12530 COC(=O)C1=CC(N)=CC(F)=C1C#N F18707 [0,2,0,0,0,0|2,0,0]=4 310 B14R1.746 COC(=N)C1=C(C(=O)OC)C=CC=C1 AC4922 [0,2,0,0,0,0|0,0,0]=2 311 B14R1.746 COC(=O)C1=C([C@@H](N)CO)C=CC=C1 N14352 [0,2,0,0,0,0|1,0,0]=3 312 B14R1.789 C#CCOC1=C(C(=O)OC)C=CC=C1 C91344 [0,2,0,0,0,0|0,0,0]=2 313 B14R1.789 COCCC1=C(C(=O)OC)C=CC=C1 93001 [0,2,0,0,0,0|0,0,0]=2 314 B14R1.789 CO\C=C\C1=C(C(=O)OC)C=CC=C1 93000 [0,2,0,0,0,0|0,0,0]=2 315 B14R1.623 CCOC(=O)C1=C(C(C)=O)N=CC=C1 74538 [0,2,0,0,0,0|2,0,0]=4 316 B14R1.939 CCCCC(=O)C1=C(CC)C=CC=C1 N13976 [0,2,0,0,0,0|2,0,0]=4 317 B14R1.939 CCCCC(=O)C1=C(OC)C=CC=C1 N13988 [0,2,0,0,0,0|1,0,0]=3 318 B14R1.939 COC1=C(C(=O)NCCBr)C=CC=C1 C12376 [0,2,0,0,0,0|1,0,0]=3 319 B14R1.939 COCC[C@H](N)C1=C(OC)C=CC=C1 N13832 [0,2,0,0,0,0|1,0,1]=4 320 B14R1.7233 CCOC(=O)C1=C(CCl)C=C(Br)C=C1 F30875 [0,2,0,0,0,0|2,0,0]=4 321 B14R1.7233 CCOC(=O)C1=C(SC)C=C(Br)C=C1 94652 [0,2,0,0,0,0|0,1,0]=3 322 B14R1.7233 CCOC(=O)C1=CN=C(Cl)C=C1NC AT15829 [0,2,0,0,0,0|2,0,0]=4 323 B14R1.7276 CCOC(=O)C1=C(Cl)C=CC=C1C=O 60728 [0,2,0,0,0,0|2,0,0]=4 324 B14R1.707 COC(=O)C1=C(B(O)O)C=CC(C)=C1 AC3405 [0,2,0,0,0,0|2,0,0]=4 325 B14R1.707 COC(=O)C1=C([C@H](C)Br)C=CC(Br)=C1 94185 [0,2,0,0,0,0|1,0,0]=3 326 B14R1.1126 COC(=O)C1=C(B(O)O)C=C(N)C=C1 95765 [0,2,0,0,0,0|2,0,0]=4 327 B14R1.2287 COC(=O)C1=C(OC)C=C(N)C(N)=C1 F19609 [0,2,0,0,0,0|0,0,0]=2 328 B14R1.2287 COC(=O)C1=CC(Br)=C(C)C=C1CCl C92395 [0,2,0,0,0,0|2,0,0]=4 329 B14R1.2287 COC(=O)C1=CC(C)=C(Cl)C=C1OC AC2438 [0,2,0,0,0,0|0,0,0]=2 330 B14R1.2287 COC(=O)C1=CC(Cl)=C(C)C=C1OC D79815 [0,2,0,0,0,0|0,0,0]=2 331 B14R1.2287 COC(=O)C1=CC(F)=C(C)N=C1OC 92221 [0,2,0,0,0,0|1,0,0]=3 332 B14R1.2287 COC(=O)C1=CC(F)=C(N)C=C1OC D86928 [0,2,0,0,0,0|0,0,0]=2 333 B14R1.2334 COC(=O)C1=C(OC)C=C(CO)C=C1 95944 [0,2,0,0,0,0|0,0,0]=2 334 B14R1.2334 COC(=O)C1=C(OC)N=C(OC)N=C1 27186 [0,2,0,0,0,0|2,0,0]=4 335 B14R1.2334 COC1=CC(OC)=C(C(=O)CO)C=C1 AC7032 [0,2,0,0,0,0|2,0,0]=4 336 B14R1.2315 COC(=O)C1=C(OC)C=CC(CO)=C1 D71994 [0,2,0,0,0,0|0,0,0]=2 337 B14R1.2167 CCC(=O)C1=C(OC)C=CC=C1OC N14125 [0,2,0,0,0,0|1,0,0]=3 338 B14R1.2167 COC(=O)C1=C(CBr)C=CC=C1OC F17793 [0,2,0,0,0,0|0,0,0]=2 339 B12R2.1 COC1=NNC2=C1C=CC=C2 P11898 [1,0,0,1,0,0|2,0,0]=4 340 B12R2.41 C1=CC2=C(C=C1)NCCC=C2 74521 [1,0,0,1,0,0|2,0,0]=4 341 B12R2.41 C1=CC2=C(C=C1)NCCOC2 98337 [1,0,0,1,0,0|1,0,1]=4 342 B12R2.41 C1=CC2=C(C=C1)OCCCN2 VT1384 [1,0,0,1,0,0|2,0,0]=4 343 B12R2.41 C1=CC2=C(C=C1)OCCNC2 C80018 [1,0,0,1,0,0|1,0,1]=4 344 B12R2.315 COC1=C2CCCC2=CC=C1 C15321 [1,0,0,1,0,0|1,0,1]=4 345 B12R2.2048 COC1=C(C2CC2)C=CC=C1 AC8615 [1,0,0,1,0,0|1,0,1]=4 346 B12R2.2028 O=C1C[C@H](O)C2=C1C=CC=C2 93243 [1,0,0,1,0,0|2,0,0]=4 347 B12R2.203 CC1=C2C(=O)NCC2=CC=C1 O11662 [1,0,0,1,0,0|1,0,0]=3 348 B12R2.203 CC1=C2C(=O)OCC2=CC=C1 I11580 [1,0,0,1,0,0|0,0,0]=2 349 B14R2.95 COC(=O)[C@@H]1COC2=C1C=CC=C2 AT19700 [0,0,0,1,0,1|0,0,0]=2 350 B14R2.11645 COC1=C2N=C(N)N(C)C2=CC=C1 AC5917 [0,0,0,1,0,1|2,0,0]=4 351 B14R2.11684 COC1=CC=CC2=C1NC(=O)OC2 AC4764 [0,0,0,1,0,1|0,0,0]=2 352 B14R2.3348 CCC1=C(C(=O)C2CC2)C=CC=C1 N13979 [0,1,0,1,0,0|2,0,0]=4 353 B14R2.3348 COC1=C(C(=O)C2CC2)C=CC=C1 N13990 [0,1,0,1,0,0|1,0,0]=3 354 B14R2.6175 CC1(C)COC2=C(C=CC=C2)C1=O AT21204 [0,1,0,1,0,0|1,0,0]=3 355 B14R2.3358 COC1=C(C2(C=O)CC2)C=CC=C1 79256 [0,1,0,1,0,0|1,0,1]=4 356 B14R2.685 O=C1CCCOC2=C(Cl)C=CC=C12 N12722 [0,1,0,1,0,0|1,0,0]=3 357 B14R2.3822 COC1=C(Br)C=CC2=C1C(=O)CC2 F52799 [0,1,0,1,0,0|1,0,0]=3 358 B14R2.3822 COC1=C(F)C=CC2=C1C(=O)CC2 F52788 [0,1,0,1,0,0|1,0,0]=3 359 B14R2.3822 COC1=C2C(=O)CCC2=CC=C1C F52794 [0,1,0,1,0,0|1,0,0]=3 360 B14R2.8038 C[C@H]1CCC2=C(F)C=CC=C2C1=O N13068 [0,1,0,1,0,0|2,0,0]=4 361 B14R2.10782 COC(=O)C1=C2CCOC2=NC=C1 D79415 [0,1,0,1,0,0|2,0,0]=4 362 B14R2.10782 COC(=O)C1=C2OC=CC2=CC=C1 W19440 [0,1,0,1,0,0|0,0,1]=3 363 B14R2.10782 COC(=O)C1=CC=CC2=C1N=CS2 98409 [0,1,0,1,0,0|1,0,1]=4 364 B14R2.10782 COC(=O)C1=CC=CC2=NSN=C12 AC6132 [0,1,0,1,0,0|1,1,0]=4 365 B14R2.536 CCOC1=C2C(=O)CCC2=CC=C1 F52810 [0,1,0,1,0,0|1,0,0]=3 366 B14R2.24101 O=C1CCCCCC2=C1C=CC=C2 92621 [0,1,0,1,0,0|2,0,0]=4 367 B14R2.52 O=C1COC2=C(C=CC=C2)C(=O)N1 AT25864 [0,1,0,1,0,0|1,0,1]=4 368 B14R2.92 CO[C@H]1COC2=C(C=CC=C2)C1=O N15515 [0,1,0,1,0,0|0,0,0]=2 369 B14R2.11635 COC1=C2C(=O)NC=CC2=CC=C1 F19023 [0,1,0,1,0,0|1,0,1]=4 370 B14R2.24350 O=C1OCC2=CC=CC([N+](=O)[O-])=C12 W17593 [0,1,0,1,0,0|2,0,0]=4 371 B14R2.1948 COC1=C2C(=O)CCC2=CC(Br)=C1 F52798 [0,1,0,1,0,0|1,0,0]=3 372 B14R2.8719 NC1=CC2=C(C=C1)C(=O)CCCC2 F13364 [0,1,0,1,0,0|2,0,0]=4 373 B14R2.8719 O=C1CCCNC2=C1C=CC(Cl)=C2 D76734 [0,1,0,1,0,0|2,0,0]=4 374 B14R2.8719 O=C1CCCOC2=C1C=CC(F)=C2 N12810 [0,1,0,1,0,0|1,0,0]=3 375 B14R2.8751 C[C@H]1CCC(=O)C2=C1C=CC(Cl)=C2 H11227 [0,1,0,1,0,0|2,0,0]=4 376 B14R2.1759 CSC1=C2C(=O)CCC2=C(O)C=C1 E71295 [0,1,0,1,0,0|1,1,0]=4 377 B14R2.4513 C[C@H]1CCC2=C(C=C(Br)C=C2)C1=O D86937 [0,1,0,1,0,0|2,0,0]=4 378 B14R2.4513 C[C@H]1COC2=C(C=C(F)C=C2)C1=O N14245 [0,1,0,1,0,0|1,0,0]=3 379 B14R2.5637 CC1=CC2=C(C=C1)OCCCC2=O N12586 [0,1,0,1,0,0|1,0,0]=3 380 B14R2.5637 NC1=CC2=C(C=C1)CCCCC2=O 53981 [0,1,0,1,0,0|2,0,0]=4 381 B14R2.5637 O=C1CCCOC2=C1C=C(F)C=C2 N12500 [0,1,0,1,0,0|1,0,0]=3 382 B14R2.5637 O=C1CCCSC2=C1C=C(O)C=C2 D73655 [0,1,0,1,0,0|1,1,0]=4 383 B14R2.5637 O=C1NCCNC2=C1C=C(Br)C=C2 AT21569 [0,1,0,1,0,0|2,0,0]=4 384 B14R2.5637 O=C1NCCOC2=C1C=C(Cl)C=C2 AT15360 [0,1,0,1,0,0|1,0,0]=3 385 B10R1.39 CCC1=C(C(=O)O)C=CO1 AT17500 [1,0,0,0,1,0|2,0,0]=4 386 B10R1.39 CCC1=C(C(=O)O)SC=C1 AT16411 [1,0,0,0,1,0|2,0,0]=4 387 B10R1.39 CSC1=C(C(=O)O)SC=C1 AT16424 [1,0,0,0,1,0|1,1,0]=4 388 B10R1.149 COC(=O)C1=C(C)C=NN1 D86990 [1,0,0,0,1,0|2,0,0]=4 389 B10R1.149 COC(=O)C1=C(F)C=CN1 91532 [1,0,0,0,1,0|2,0,0]=4 390 B10R1.149 COC(=O)C1=C(N)C=CN1 D86691 [1,0,0,0,1,0|2,0,0]=4 391 B10R1.149 COC(=O)C1=CSC=C1C 57777 [1,0,0,0,1,0|1,0,0]=3