0 B13R1.337 CC(=O)CCCCC1=CC=CC=C1 HR117545 [0,0,0,0,0,0|1,0,0]=1 1 B13R1.337 CC(=O)OCCCC1=CC=CC=C1 HR141678 [0,0,0,0,0,0|0,0,0]=0 2 B13R1.337 CC(=O)OCCOC1=CC=CC=C1 HR102608 [0,0,0,0,0,0|1,0,0]=1 3 B13R1.337 CC(=O)OC\C=C\C1=CC=CC=C1 HR133225 [0,0,0,0,0,0|0,0,2]=2 4 B13R1.337 NC(=O)OCCCC1=CC=CC=C1 HR126320 [0,0,0,0,0,0|1,0,0]=1 5 B13R1.337 O=C(Cl)OCCOC1=CC=CC=C1 HR115619 [0,0,0,0,0,0|2,0,0]=2 6 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 HR126169 [0,0,0,0,0,0|2,0,0]=2 7 B13R1.337 O=C(O)CCCOC1=CC=CC=C1 HR136169 [0,0,0,0,0,0|3,0,0]=3 8 B13R1.337 O=C(O)CCOCC1=CC=CC=C1 HR33578 [0,0,0,0,0,0|3,0,0]=3 9 B13R1.337 O=C(O)CCSCC1=CC=CC=C1 HR120475 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.8 BrCCCCCC1=CC=CC=C1 HR125680 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.8 CCCCCCC1=CC=CC=C1 HR143920 [1,0,0,0,0,0|1,0,1]=3 12 B12R1.8 CCCCCCC1=NC=CC=C1 HR126066 [1,0,0,0,0,0|2,0,1]=4 13 B12R1.8 CCCCCC[N+]1=CC=CC=C1 HR102492 [1,0,0,0,0,0|2,0,1]=4 14 B12R1.8 CCCCOCC1=CC=CC=C1 HR130481 [1,0,0,0,0,0|2,0,1]=4 15 B12R1.8 O=COC\C=C\C1=CC=CC=C1 HR142069 [1,0,0,0,0,0|0,0,2]=3 16 B12R1.8 OCCCCCC1=CC=CC=C1 HR33287 [1,0,0,0,0,0|1,0,2]=4 17 B14R1.420 O=C(O)CCCC(=O)C1=CC=CC=C1 HR134785 [0,1,0,0,0,0|2,0,1]=4 18 B14R1.423 NC(=O)OCC(N)CC1=CC=CC=C1 R2CQ017 [0,1,0,0,0,0|1,0,0]=2 19 B14R1.677 O=C(O)CCCCC1=CC=C(O)C=C1 HR145785 [0,1,0,0,0,0|2,0,0]=3 20 B14R1.716 C=CC(=O)OCCOC1=CC=CC=C1 HR126940 [0,1,0,0,0,0|1,0,1]=3 21 B14R1.716 C=CC(=O)OCCSC1=CC=CC=C1 HR109510 [0,1,0,0,0,0|1,0,1]=3 22 B14R1.716 CCC(=O)OCCOC1=CC=CC=C1 HR145424 [0,1,0,0,0,0|1,0,0]=2 23 B14R1.716 CCC(=O)OC\C=C\C1=CC=CC=C1 HR125955 [0,1,0,0,0,0|0,0,2]=3 24 B14R1.818 CC(=O)CC(=O)NCC1=CC=CC=C1 HR134217 [0,1,0,0,0,0|2,0,1]=4 25 B14R1.818 NC(CCC1=CC=CC=C1)CC(=O)O HR110010 [0,1,0,0,0,0|2,0,0]=3 26 B14R1.818 NC(CCC1=CC=CC=C1)CC(=O)O HR110330 [0,1,0,0,0,0|2,0,0]=3 27 B14R1.6449 NC(CCCC1=CC=CC=C1)C(=O)O HR113171 [0,1,0,0,0,0|2,0,0]=3 28 B14R1.6449 NC(CCCC1=CC=CC=C1)C(=O)O HR113485 [0,1,0,0,0,0|2,0,0]=3 29 B14R1.6449 NC(CNCC1=CC=CC=C1)C(=O)O HR143608 [0,1,0,0,0,0|3,0,0]=4 30 B14R1.6449 NC(COCC1=CC=CC=C1)C(=O)O HR103056 [0,1,0,0,0,0|3,0,0]=4 31 B14R1.6449 NC(COCC1=CC=CC=C1)C(=O)O HR110206 [0,1,0,0,0,0|3,0,0]=4 32 B14R1.6449 NC(COCC1=CC=CC=C1)C(=O)O HR141212 [0,1,0,0,0,0|3,0,0]=4 33 B14R1.6449 NC(CSCC1=CC=CC=C1)C(=O)O HR125941 [0,1,0,0,0,0|3,0,0]=4 34 B14R2.2 CC(=O)OC1=COC2=C1C=CC=C2 HR104843 [0,0,0,1,0,0|1,0,2]=4 35 B14R2.2 O=C(O)CN1CCC2=CC=CC=C21 HR103830 [0,0,0,1,0,0|3,0,0]=4 36 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 HR132712 [0,0,0,1,0,0|2,0,0]=3 37 B14R2.19 O=C1CN(CC2=CC=CC=C2)CN1 HR113993 [0,0,0,1,0,0|2,0,0]=3 38 B14R2.19 O=C1NC(CC2=CC=CC=C2)CO1 HR127082 [0,0,0,1,0,0|1,0,0]=2 39 B14R2.19 O=C1NC(CC2=CC=CC=C2)CO1 HR6915 [0,0,0,1,0,0|1,0,0]=2 40 B14R2.21 O=C1CCCC(C2=CC=CC=C2)C1 HR108367 [0,0,0,1,0,0|1,0,0]=2 41 B14R2.21 O=C1CCNC(C2=CC=CC=C2)C1 HR121621 [0,0,0,1,0,0|2,0,0]=3 42 B14R2.21 O=C1CCOC(C2=CC=CC=C2)C1 HR107107 [0,0,0,1,0,0|2,0,0]=3 43 B14R2.436 O=C1CC(OCC2=CC=CC=C2)C1 HR117433 [0,0,0,1,0,0|2,0,0]=3 44 B14R2.31359 O=C(O)C1CCCC2=CC=CC=C21 HR123260 [0,0,0,1,0,0|2,0,0]=3 45 B14R2.31359 O=C(O)C1CCCC2=CC=CC=C21 HR124497 [0,0,0,1,0,0|2,0,0]=3 46 B14R2.31359 O=C(O)C1CCCC2=CC=CC=C21 HR124764 [0,0,0,1,0,0|2,0,0]=3 47 B14R2.31359 O=C(O)C1CCNC2=CC=CC=C21 HR116465 [0,0,0,1,0,0|3,0,0]=4 48 B14R2.31359 O=C(O)C1CNCC2=CC=CC=C21 HR117111 [0,0,0,1,0,0|3,0,0]=4 49 B14R2.31359 O=C(O)C1NCCC2=CC=CC=C21 HR108738 [0,0,0,1,0,0|3,0,0]=4 50 B14R2.31359 O=C(O)C1NCCC2=CC=CC=C21 HR147610 [0,0,0,1,0,0|3,0,0]=4 51 B12R1.252 CC(=O)CCCC1=CC=CC=C1 HR146298 [0,0,0,0,1,0|0,0,0]=1 52 B12R1.252 CC(=O)NCCC1=CC=CC=C1 HR109426 [0,0,0,0,1,0|1,0,0]=2 53 B12R1.252 CC(=O)OCCC1=CC=CC=C1 HR125515 [0,0,0,0,1,0|0,0,0]=1 54 B12R1.252 CC(O)COCc1ccccc1 HR109733 [0,0,0,0,1,0|1,0,2]=4 55 B12R1.252 Cl[SiH](Cl)CCCC1=CC=CC=C1 HR120329 [0,0,0,0,1,0|2,1,0]=4 56 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 HR115794 [0,0,0,0,1,0|1,0,0]=2 57 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 HR140519 [0,0,0,0,1,0|2,0,0]=3 58 B12R1.252 O=C(O)CCCC1=CC=CC=C1 HR124591 [0,0,0,0,1,0|1,0,0]=2 59 B12R1.252 O=C(O)CCCC1=NC=CC=C1 HR118250 [0,0,0,0,1,0|2,0,0]=3 60 B12R1.252 O=C(O)CCSC1=CC=CC=C1 HR111900 [0,0,0,0,1,0|2,0,0]=3 61 B12R1.252 O=C(O)CNCC1=CC=CC=C1 HR111018 [0,0,0,0,1,0|2,0,0]=3 62 B12R1.252 O=C(O)CNCC1=CC=CC=C1 HR132729 [0,0,0,0,1,0|2,0,0]=3 63 B12R1.252 O=C(O)COCC1=CC=CC=C1 HR136190 [0,0,0,0,1,0|2,0,0]=3 64 B12R1.252 O=C(O)CSCC1=CC=CC=C1 HR141291 [0,0,0,0,1,0|2,0,0]=3 65 B14R1.422 CC(C)CCOCCC1=CC=CC=C1 HR109585 [0,0,0,0,0,1|2,0,1]=4 66 B14R1.422 O=C(O)CCCOCC1=CC=CC=C1 HR147414 [0,0,0,0,0,1|2,0,0]=3 67 B11R1.28 BrCCCCC1=CC=CC=C1 HR127944 [2,0,0,0,0,0|1,0,1]=4 68 B11R1.28 CCCCCC1=CC=CC=C1 HR16788 [2,0,0,0,0,0|0,0,1]=3 69 B11R1.28 CCCCCC1=NC=CC=C1 HR126861 [2,0,0,0,0,0|1,0,1]=4 70 B11R1.28 CCCCCc1ccccc1 HR125033 [2,0,0,0,0,0|0,0,1]=3 71 B11R1.28 CCCCCc1ccccc1 HR144114 [2,0,0,0,0,0|0,0,1]=3 72 B11R1.28 CCCCOC1=CC=CC=C1 HR126122 [2,0,0,0,0,0|1,0,1]=4 73 B11R1.28 CCCNCC1=CC=CC=C1 HR116670 [2,0,0,0,0,0|1,0,1]=4 74 B11R1.28 CCOCCC1=CC=CC=C1 HR133449 [2,0,0,0,0,0|0,0,1]=3 75 B11R1.28 CNCCCC1=CC=CC=C1 HR143705 [2,0,0,0,0,0|1,0,0]=3 76 B11R1.28 CNCCCC1=NC=CC=C1 HR108234 [2,0,0,0,0,0|2,0,0]=4 77 B11R1.28 NCCCCC1=CC=CC=C1 HR135987 [2,0,0,0,0,0|1,0,1]=4 78 B11R1.28 O=CCOCC1=CC=CC=C1 HR124340 [2,0,0,0,0,0|1,0,0]=3 79 B11R1.28 O=COCCC1=CC=CC=C1 HR127546 [2,0,0,0,0,0|0,0,0]=2 80 B11R1.28 OCCCCC1=CC=CC=C1 HR124038 [2,0,0,0,0,0|0,0,2]=4 81 B13R1.9 CCCCCCC1=CC=C(Br)C=C1 HR116318 [1,1,0,0,0,0|1,0,1]=4 82 B13R1.9 CCCCCCC1=CC=C(N)C=C1 HR135774 [1,1,0,0,0,0|1,0,1]=4 83 B13R1.9 CCCCCCC1=CC=C(O)C=C1 HR137126 [1,1,0,0,0,0|1,0,1]=4 84 B13R1.9 CCOCCOC1=CC=C(Br)C=C1 HR115617 [1,1,0,0,0,0|1,0,1]=4 85 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 HR138449 [1,1,0,0,0,0|0,0,2]=4 86 B13R1.45 CC(=O)NCC(=O)C1=CC=CC=C1 HR112163 [0,1,0,0,1,0|1,0,1]=4 87 B13R1.45 CC(=O)OCC(=O)C1=CC=CC=C1 HR123231 [0,1,0,0,1,0|0,0,1]=3 88 B13R1.45 CC(=O)OCC(=O)C1=CC=CC=C1 HR143271 [0,1,0,0,1,0|0,0,1]=3 89 B13R1.45 CC(=O)OCC(C)C1=CC=CC=C1 HR130790 [0,1,0,0,1,0|0,0,0]=2 90 B13R1.45 CN(C)CCC(O)C1=CC=CC=C1 HR132440 [0,1,0,0,1,0|2,0,0]=4 91 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 HR123840 [0,1,0,0,1,0|1,0,1]=4 92 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 HR112648 [0,1,0,0,1,0|0,0,1]=3 93 B13R1.348 CC(=O)CC(=O)NC1=CC=CC=C1 HR133328 [0,1,0,0,1,0|1,0,1]=4 94 B13R1.348 CC(CC(=O)O)NC1=CC=CC=C1 HR115895 [0,1,0,0,1,0|2,0,0]=4 95 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 HR134956 [0,1,0,0,1,0|1,0,0]=3 96 B13R1.348 NC(CC(=O)O)Cc1ccccc1 HR135745 [0,1,0,0,1,0|1,0,0]=3 97 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O ECCQ01305 [0,1,0,0,1,0|1,0,0]=3 98 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O HR137202 [0,1,0,0,1,0|1,0,0]=3 99 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O HR138374 [0,1,0,0,1,0|1,0,0]=3 100 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O HR140113 [0,1,0,0,1,0|1,0,0]=3 101 B13R1.351 NC(CSC1=CC=CC=C1)C(=O)O HR143179 [0,1,0,0,1,0|2,0,0]=4 102 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 HR137491 [0,1,0,0,1,0|1,0,1]=4 103 B13R1.351 O=C(O)C(Br)CCC1=CC=CC=C1 HR121864 [0,1,0,0,1,0|1,0,0]=3 104 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 HR129544 [0,1,0,0,1,0|1,0,0]=3 105 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 HR143803 [0,1,0,0,1,0|1,0,0]=3 106 B13R1.513 CC(=O)NCCC1=CC=C(O)C=C1 HR103073 [0,1,0,0,1,0|1,0,0]=3 107 B13R1.513 CC1=CC=C(OCCC(=O)O)C=C1 HR126508 [0,1,0,0,1,0|2,0,0]=4 108 B13R1.513 NC1=CC=C(CCCC(=O)O)C=C1 HR123518 [0,1,0,0,1,0|1,0,0]=3 109 B13R1.513 O=C(O)CCCC1=CC=C(Br)C=C1 HR115474 [0,1,0,0,1,0|1,0,0]=3 110 B13R1.513 O=C(O)CCCC1=CC=C(O)C=C1 HR137313 [0,1,0,0,1,0|1,0,0]=3 111 B13R1.513 O=C(O)CCOC1=CC=C(Cl)C=C1 HR136297 [0,1,0,0,1,0|2,0,0]=4 112 B13R1.513 O=C(O)CCOC1=CC=C(F)C=C1 HR136559 [0,1,0,0,1,0|2,0,0]=4 113 B13R1.3523 C[Si](C)(Cl)CCCC1=CC=CC=C1 HR107486 [0,1,0,0,1,0|1,1,0]=4 114 B15R1.871 CC(C)OCCOCC1=CC=C(O)C=C1 HR124552 [0,1,0,0,0,1|1,0,1]=4 115 B15R1.962 COC(=O)CCCNCC1=CC=CC=C1 HR32203 [0,1,0,0,0,1|1,0,0]=3 116 B15R1.3664 C=C(C)C(=O)OCCOC1=CC=CC=C1 HR106639 [0,1,0,0,0,1|2,0,0]=4 117 B15R1.3664 NC(CCOCc1ccccc1)C(=O)O HR146180 [0,1,0,0,0,1|2,0,0]=4 118 B15R1.4008 CC(=O)OCC(CO)CC1=CC=CC=C1 DEJL02503 [0,2,0,0,0,0|0,0,0]=2 119 B15R1.778 CCCC(=O)OC\C=C\C1=CC=CC=C1 HR141387 [0,2,0,0,0,0|0,0,2]=4 120 B15R1.778 CCOC(=O)CCNCC1=CC=CC=C1 HR105903 [0,2,0,0,0,0|2,0,0]=4 121 B15R1.1321 COC(=O)C(N)CSCC1=CC=CC=C1 HR139474 [0,2,0,0,0,0|2,0,0]=4 122 B13R2.3 C1=CC=C(C2CC=CCC2)C=C1 HR103355 [1,0,0,1,0,0|1,0,0]=3 123 B13R2.3 C1=CC=C(C2CCCCC2)C=C1 HR132672 [1,0,0,1,0,0|1,0,1]=4 124 B13R2.3 C1=CC=C(C2CCCNC2)C=C1 HR105112 [1,0,0,1,0,0|2,0,0]=4 125 B13R2.3 C1=CC=C(C2CCCNC2)C=C1 HR105421 [1,0,0,1,0,0|2,0,0]=4 126 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 HR121195 [1,0,0,1,0,0|1,0,1]=4 127 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 HR129085 [1,0,0,1,0,0|1,0,1]=4 128 B13R2.3 C1=CC=C(N2CCOCC2)C=C1 HR136411 [1,0,0,1,0,0|1,0,1]=4 129 B13R2.15 CC1=NCCC1C2=CC=CC=C2 HR146358 [1,0,0,1,0,0|1,0,0]=3 130 B13R2.15 O=C1CCCN1C2=CC=CC=C2 HR131886 [1,0,0,1,0,0|2,0,0]=4 131 B13R2.64 C1=CC=C(CN2CC=CC2)C=C1 HR126953 [1,0,0,1,0,0|2,0,0]=4 132 B13R2.1613 CCN1CCCC2=CC=CC=C21 HR113380 [1,0,0,1,0,0|1,0,1]=4 133 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 HR125755 [1,0,0,1,0,0|1,0,0]=3 134 B13R2.5252 O=C1CCCNC2=C1C=CC=C2 HR110952 [1,0,0,1,0,0|2,0,0]=4 135 B13R2.5252 O=C1NCCCC2=C1C=CC=C2 HR109025 [1,0,0,1,0,0|1,0,0]=3 136 B13R2.5252 O=C1NCCNC2=C1C=CC=C2 HR147131 [1,0,0,1,0,0|2,0,0]=4 137 B13R2.5252 O=C1NCCOC2=C1C=CC=C2 HR144523 [1,0,0,1,0,0|2,0,0]=4 138 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 HR106876 [0,0,0,1,1,0|1,0,0]=3 139 B13R2.10 O=C1CCC(C2=CC=CC=C2)N1 HR120521 [0,0,0,1,1,0|1,0,0]=3 140 B13R2.10 O=C1CCN(C2=CC=CC=C2)C1 HR111672 [0,0,0,1,1,0|1,0,0]=3 141 B13R2.10 O=C1CCN(c2ccccc2)N1 HR131995 [0,0,0,1,1,0|2,0,0]=4 142 B13R2.10 O=C1NC(C2=CC=CC=C2)CO1 HR111027 [0,0,0,1,1,0|1,0,0]=3 143 B13R2.10 O=C1NC(c2ccccc2)CO1 HR119134 [0,0,0,1,1,0|1,0,0]=3 144 B13R2.10 O=C1NC(c2ccccc2)CO1 HR125246 [0,0,0,1,1,0|1,0,0]=3 145 B13R2.10 O=C1NC(c2ccccc2)CO1 HR125506 [0,0,0,1,1,0|1,0,0]=3 146 B13R2.31 O=C1CN(CC2=CC=CC=C2)C1 HR115820 [0,0,0,1,1,0|1,0,0]=3 147 B13R2.72 CC(=O)N1CCC2=CC=CC=C21 HR138386 [0,0,0,1,1,0|1,0,0]=3 148 B13R2.72 O=C(O)C1CCC2=CC=CC=C21 HR117548 [0,0,0,1,1,0|1,0,0]=3 149 B13R2.72 O=C(O)C1CNC2=CC=CC=C21 HR129680 [0,0,0,1,1,0|2,0,0]=4 150 B13R2.72 O=C(O)C1NCC2=CC=CC=C21 HR112630 [0,0,0,1,1,0|2,0,0]=4 151 B13R2.163 O=C1CC2=C(C=CC=C2)CCN1 HR102463 [0,0,0,1,1,0|1,0,0]=3 152 B13R2.163 O=C1CCCC2=C(C=CC=C2)N1 HR120217 [0,0,0,1,1,0|1,0,0]=3 153 B13R2.163 O=C1CCNC2=C(C=CC=C2)N1 HR147519 [0,0,0,1,1,0|2,0,0]=4 154 B13R2.423 O=C(O)C1OC1C2=CC=CC=C2 HR116845 [0,0,0,1,1,0|2,0,0]=4 155 B15R2.31 BrC1=CCCN(CC2=CC=CC=C2)C1 HR150915 [0,0,0,1,0,1|2,0,0]=4 156 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 HR126921 [0,0,0,1,0,1|1,0,0]=3 157 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 HR7726 [0,0,0,1,0,1|1,0,0]=3 158 B15R2.31 O=C1CN(CC2=CC=CC=C2)CCN1 HR114351 [0,0,0,1,0,1|1,0,0]=3 159 B15R2.31 O=C1CN(CC2=CC=CC=C2)CCO1 HR31968 [0,0,0,1,0,1|0,0,0]=2 160 B15R2.63 O=C(O)C1CNCC1C2=CC=CC=C2 HR102763 [0,0,0,1,0,1|2,0,0]=4 161 B15R2.63 O=C(O)C1CNCC1c2ccccc2 HR121639 [0,0,0,1,0,1|2,0,0]=4 162 B15R2.617 O=C1CC(COCC2=CC=CC=C2)C1 HR121769 [0,0,0,1,0,1|1,0,0]=3 163 B15R2.1241 NC(=O)C1CCN1CC2=CC=CC=C2 HR115263 [0,0,0,1,0,1|2,0,0]=4 164 B15R2.1241 O=C(O)C1CCN1CC2=CC=CC=C2 HR117355 [0,0,0,1,0,1|2,0,0]=4 165 B15R2.68122 CC(=O)NC1CCCC2=CC=CC=C21 DAJL01507 [0,0,0,1,0,1|1,0,0]=3 166 B15R2.1237 CC(=O)N1CCNC2=C(C=CC=C2)C1 HR122142 [0,1,0,1,0,0|2,0,0]=4 167 B15R2.13587 CC(=O)OC1CCC2=C(Cl)C=CN=C21 HR143034 [0,1,0,1,0,0|1,0,0]=3 168 B15R2.59 O=C(O)C1CCC(C2=CC=CC=C2)N1 HR112527 [0,1,0,1,0,0|2,0,0]=4 169 B15R2.548 O=C1CCC(C2=CC=CC=C2)CCN1 HR116963 [0,1,0,1,0,0|1,0,0]=3 170 B15R2.548 O=C1CCN(C2=CC=CC=C2)CCN1 HR105789 [0,1,0,1,0,0|2,0,0]=4 171 B15R2.29 O=C1CCN(CC2=CC=CC=C2)CC1 HR128594 [0,1,0,1,0,0|2,0,0]=4 172 B15R2.29 O=C1CCN(Cc2ccccc2)CC1 HR143506 [0,1,0,1,0,0|2,0,0]=4 173 B15R2.98 NC1=CC=C(CC2COC(=O)N2)C=C1 HR146523 [0,1,0,1,0,0|1,0,0]=3 174 B15R2.7268 CC(=O)N1CCCC2=CC=C(N)C=C21 HR107778 [0,1,0,1,0,0|1,0,0]=3 175 B15R2.79765 COC(=O)C1CCNC2=CC=CC=C21 HR155028 [0,1,0,1,0,0|2,0,0]=4 176 B15R2.79765 COC(=O)C1CNCC2=CC=CC=C21 HR119305 [0,1,0,1,0,0|2,0,0]=4 177 B15R2.27 O=C1CC(=O)CC(C2=CC=CC=C2)C1 HR142345 [0,1,0,1,0,0|1,0,1]=4 178 B15R2.314 CC1CN(CC2=CC=CC=C2)CC1=O HR116083 [0,1,0,1,0,0|2,0,0]=4 179 B15R3.2025 O=C1CC2CC(C1)c3ccccc32 HR106196 [0,0,0,2,0,0|1,0,0]=3 180 B11R1.91 CC(=O)CCC1=CC=CC=C1 HR131653 [0,0,0,0,2,0|0,0,0]=2 181 B11R1.91 CC(=O)NCC1=CC=CC=C1 HR101818 [0,0,0,0,2,0|1,0,0]=3 182 B11R1.91 CC(=O)NNC1=CC=CC=C1 HR123814 [0,0,0,0,2,0|2,0,0]=4 183 B11R1.91 CC(=O)OCC1=CC=CC=C1 HR124107 [0,0,0,0,2,0|0,0,0]=2 184 B11R1.91 CC(=O)SSC1=CC=CC=C1 HR138175 [0,0,0,0,2,0|1,1,0]=4 185 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 HR126722 [0,0,0,0,2,0|0,0,2]=4 186 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 HR129858 [0,0,0,0,2,0|0,0,2]=4 187 B11R1.91 CC(C)=CCC1=CC=CC=C1 HR143896 [0,0,0,0,2,0|1,0,1]=4 188 B11R1.91 CC(N)CCC1=CC=CC=C1 HR100540 [0,0,0,0,2,0|1,0,1]=4 189 B11R1.91 CC(N)CCC1=CC=CC=C1 HR129379 [0,0,0,0,2,0|1,0,1]=4 190 B11R1.91 CC(O)CCC1=CC=CC=C1 HR142083 [0,0,0,0,2,0|0,0,2]=4 191 B11R1.91 NC(=O)CCC1=CC=CC=C1 HR143750 [0,0,0,0,2,0|1,0,0]=3 192 B11R1.91 NC(=O)CNC1=CC=CC=C1 HR118147 [0,0,0,0,2,0|2,0,0]=4 193 B11R1.91 NC(=O)NCC1=CC=CC=C1 HR144984 [0,0,0,0,2,0|2,0,0]=4 194 B11R1.91 NC(=O)OCC1=CC=CC=C1 HR134339 [0,0,0,0,2,0|1,0,0]=3 195 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 HR125999 [0,0,0,0,2,0|1,0,0]=3 196 B11R1.91 O=C(Cl)COC1=CC=CC=C1 HR132060 [0,0,0,0,2,0|2,0,0]=4 197 B11R1.91 O=C(O)CCC1=CC=CC=C1 HR131731 [0,0,0,0,2,0|1,0,0]=3 198 B11R1.91 O=C(O)CCC1=CC=CN=C1 HR108389 [0,0,0,0,2,0|2,0,0]=4 199 B11R1.91 O=C(O)CCC1=NC=CC=C1 HR109593 [0,0,0,0,2,0|2,0,0]=4 200 B11R1.91 O=C(O)CNC1=CC=CC=C1 HR128051 [0,0,0,0,2,0|2,0,0]=4 201 B11R1.91 O=C(O)COC1=CC=CC=C1 HR130671 [0,0,0,0,2,0|2,0,0]=4 202 B11R1.91 O=C(O)CSC1=CC=CC=C1 HR135052 [0,0,0,0,2,0|2,0,0]=4 203 B11R1.91 O=C([O-])CNC1=CC=CC=C1 HR128317 [0,0,0,0,2,0|2,0,0]=4 204 B11R1.91 O=C([O-])COC1=CC=CC=C1 HR124172 [0,0,0,0,2,0|2,0,0]=4 205 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 HR105516 [0,0,0,0,2,0|2,0,0]=4 206 B11R1.172 CC(=O)CSCc1ccco1 HR100822 [0,0,0,0,2,0|2,0,0]=4 207 B11R1.172 O=C(O)CCCC1=CC=CS1 HR34165 [0,0,0,0,2,0|2,0,0]=4 208 B11R1.172 O=C(O)CCC[C-]1C=CC=C1 HR127071 [0,0,0,0,2,0|1,0,1]=4