0 B13R1.337 CC(=O)CCOCC1=CC=CC=C1 CS-0204232 [0,0,0,0,0,0|2,0,0]=2 1 B13R1.337 CC(=O)OCCCC1=CC=CC=C1 CS-0196601 [0,0,0,0,0,0|0,0,0]=0 2 B13R1.337 CC(=O)OC\C=C\C1=CC=CC=C1 CS-W017407 [0,0,0,0,0,0|0,0,2]=2 3 B13R1.337 CN(C)CCNCC1=CC=CC=C1 CS-0214641 [0,0,0,0,0,0|4,0,0]=4 4 B13R1.337 O=C(O)CCCSC1=CC=CC=C1 CS-0074135 [0,0,0,0,0,0|3,0,0]=3 5 B13R1.337 O=C(O)CCNCC1=CC=CC=C1 CS-0246025 [0,0,0,0,0,0|3,0,0]=3 6 B13R1.337 O=C(O)CCOCC1=CC=CC=C1 CS-0067527 [0,0,0,0,0,0|3,0,0]=3 7 B13R1.337 O=C(O)\C=N\OCC1=CC=CC=C1 CS-0161688 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.8 BrCCCCCC1=CC=CC=C1 CS-0186084 [1,0,0,0,0,0|2,0,1]=4 9 B12R1.8 CCCCCC[N+]1=CC=CC=C1 CS-0152323 [1,0,0,0,0,0|2,0,1]=4 10 B12R1.8 CCCCCC[N+]1=CC=CC=C1 CS-0378406 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.8 CCCCCNC1=CC=CC=C1 CS-0152133 [1,0,0,0,0,0|2,0,1]=4 12 B12R1.8 NCCCCCC1=CC=CC=C1 CS-0096226 [1,0,0,0,0,0|2,0,1]=4 13 B14R1.148 O=C(O)CCCOC1=CC(Br)=CC=C1 CS-0307662 [0,1,0,0,0,0|3,0,0]=4 14 B14R1.159 O=C(O)CCNCC1=CC=CC=C1Cl CS-0346099 [0,1,0,0,0,0|3,0,0]=4 15 B14R1.420 O=C(O)CCCC(=O)C1=CC=CC=C1 CS-W004848 [0,1,0,0,0,0|2,0,1]=4 16 B14R1.423 CC(=O)CCN(C)CC1=CC=CC=C1 CS-0514478 [0,1,0,0,0,0|2,0,0]=3 17 B14R1.677 O=C(O)CCCCC1=CC=C(Br)C=C1 CS-0216437 [0,1,0,0,0,0|2,0,0]=3 18 B14R1.677 O=C(O)CCCCC1=CC=C(I)C=C1 CS-0700589 [0,1,0,0,0,0|2,0,0]=3 19 B14R1.677 O=C(O)CCCCC1=CC=C(O)C=C1 CS-0158393 [0,1,0,0,0,0|2,0,0]=3 20 B14R1.677 O=C(O)CCCOC1=CC=C(Br)C=C1 CS-0059799 [0,1,0,0,0,0|3,0,0]=4 21 B14R1.677 O=C(O)CCCOC1=CC=C(Cl)C=C1 CS-0158409 [0,1,0,0,0,0|3,0,0]=4 22 B14R1.677 O=C(O)CCNCC1=CC=C(Cl)C=C1 CS-0249351 [0,1,0,0,0,0|3,0,0]=4 23 B14R1.677 O=C(O)CCNCC1=CC=C(Cl)C=C1 CS-0346096 [0,1,0,0,0,0|3,0,0]=4 24 B14R1.716 COC(=O)CCCCC1=CC=CC=C1 CS-0213167 [0,1,0,0,0,0|1,0,0]=2 25 B14R1.716 O=C(CCl)NCCOC1=CC=CC=C1 CS-0225952 [0,1,0,0,0,0|2,0,0]=3 26 B14R1.818 CC(=O)CC(=O)NCC1=CC=CC=C1 CS-W015848 [0,1,0,0,0,0|2,0,1]=4 27 B14R1.818 CC(=O)CC(=O)OCC1=CC=CC=C1 CS-0071955 [0,1,0,0,0,0|2,0,1]=4 28 B14R1.6449 C=C(C)C(=O)OCCC1=CC=CC=C1 CS-0167826 [0,1,0,0,0,0|3,0,0]=4 29 B14R1.6449 NC(COCC1=CC=CC=C1)C(=O)O CS-0127982 [0,1,0,0,0,0|3,0,0]=4 30 B14R1.6449 N[C@@H](COCC1=CC=CC=C1)C(=O)O CS-0041807 [0,1,0,0,0,0|3,0,0]=4 31 B14R1.6449 N[C@H](CCCC1=CC=CC=C1)C(=O)O CS-0005262 [0,1,0,0,0,0|2,0,0]=3 32 B14R1.6449 N[C@H](COCC1=CC=CC=C1)C(=O)O CS-0109322 [0,1,0,0,0,0|3,0,0]=4 33 B14R1.6449 N[C@H](COCC1=CC=CC=C1)C(=O)O CS-W010624 [0,1,0,0,0,0|3,0,0]=4 34 B14R1.6449 [C@H](N)(COCC1=CC=CC=C1)C(=O)O CS-W008308 [0,1,0,0,0,0|3,0,0]=4 35 B14R1.6449 [C@H](N)(CSCC1=CC=CC=C1)C(=O)O CS-W015045 [0,1,0,0,0,0|3,0,0]=4 36 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 CS-0142563 [0,0,0,1,0,0|1,0,2]=4 37 B14R2.2 CC(=O)OC1CCC2=C1N=CC=C2 CS-0028380 [0,0,0,1,0,0|1,0,0]=2 38 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 CS-W001967 [0,0,0,1,0,0|2,0,0]=3 39 B14R2.19 O=C1NC(CC2=CC=CC=C2)CO1 CS-0452270 [0,0,0,1,0,0|1,0,0]=2 40 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 CS-D1593 [0,0,0,1,0,0|1,0,0]=2 41 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 CS-W007664 [0,0,0,1,0,0|1,0,0]=2 42 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CO1 CS-W010677 [0,0,0,1,0,0|1,1,0]=3 43 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CS1 CS-W015151 [0,0,0,1,0,0|1,2,0]=4 44 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CO1 CS-W010678 [0,0,0,1,0,0|1,1,0]=3 45 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 CS-W015150 [0,0,0,1,0,0|1,2,0]=4 46 B14R2.21 O=C1CCCC(C2=CC=CC=C2)C1 CS-0341801 [0,0,0,1,0,0|1,0,0]=2 47 B14R2.21 O=C1CCOC(C2=CC=CC=C2)C1 CS-W021744 [0,0,0,1,0,0|2,0,0]=3 48 B14R2.21 O=C1COCC(C2=CC=CC=C2)N1 CS-W003896 [0,0,0,1,0,0|3,0,0]=4 49 B14R2.21 O=C1COC[C@@H](C2=CC=CC=C2)N1 CS-D1768 [0,0,0,1,0,0|3,0,0]=4 50 B14R2.21 O=C1COC[C@H](C2=CC=CC=C2)N1 CS-0062218 [0,0,0,1,0,0|3,0,0]=4 51 B14R2.436 O=C1CC(OCC2=CC=CC=C2)C1 CS-W008851 [0,0,0,1,0,0|2,0,0]=3 52 B14R2.31359 CC(=O)N1CCCC2=CC=CC=C21 CS-0206919 [0,0,0,1,0,0|1,0,0]=2 53 B14R2.31359 O=C(O)C1CCCC2=CC=CC=C21 CS-W019746 [0,0,0,1,0,0|2,0,0]=3 54 B14R2.31359 O=C(O)C1CCOC2=CC=CC=C21 CS-0183232 [0,0,0,1,0,0|3,0,0]=4 55 B14R2.31359 O=C(O)C1NCCC2=C1C=CC=C2 CS-0005330 [0,0,0,1,0,0|3,0,0]=4 56 B14R2.31359 O=C(O)C1NCCC2=CC=CC=C21 CS-0155920 [0,0,0,1,0,0|3,0,0]=4 57 B14R2.31359 O=C(O)C1OCCC2=C1C=CC=C2 CS-0075082 [0,0,0,1,0,0|3,0,0]=4 58 B14R2.31359 O=C(O)[C@@H]1NCCC2=C1C=CC=C2 CS-D0737 [0,0,0,1,0,0|3,0,0]=4 59 B14R2.31359 O=C(O)[C@H]1CCCC2=C1C=CC=C2 CS-W020725 [0,0,0,1,0,0|2,0,0]=3 60 B12R1.252 CC(C)CNCC1=CC=CC=C1 CS-0116902 [0,0,0,0,1,0|2,0,1]=4 61 B12R1.252 CC(C)OCCC1=NC=CC=C1 CS-0101421 [0,0,0,0,1,0|2,0,1]=4 62 B12R1.252 CC(O)COCC1=CC=CC=C1 CS-W017858 [0,0,0,0,1,0|1,0,2]=4 63 B12R1.252 CN(C)CCNC1=CC=CC=C1 CS-0252231 [0,0,0,0,1,0|3,0,0]=4 64 B12R1.252 NC(=O)CNCC1=CC=CC=C1 CS-0217488 [0,0,0,0,1,0|2,0,0]=3 65 B12R1.252 NC(=O)COCC1=CC=CC=C1 CS-0186437 [0,0,0,0,1,0|2,0,0]=3 66 B12R1.252 O=C(O)CCCC1=CC=CC=C1 CS-D1686 [0,0,0,0,1,0|1,0,0]=2 67 B12R1.252 O=C(O)CCCC1=CC=NC=C1 CS-0059802 [0,0,0,0,1,0|2,0,0]=3 68 B12R1.252 O=C(O)CCNC1=CC=CC=C1 CS-W021779 [0,0,0,0,1,0|2,0,0]=3 69 B12R1.252 O=C(O)CCOC1=CC=CC=C1 CS-W004102 [0,0,0,0,1,0|2,0,0]=3 70 B12R1.252 O=C(O)CNCC1=CC=CC=C1 CS-0015734 [0,0,0,0,1,0|2,0,0]=3 71 B12R1.252 O=C(O)CNCC1=CC=CC=C1 CS-W016075 [0,0,0,0,1,0|2,0,0]=3 72 B12R1.252 O=C(O)COCC1=CC=CC=C1 CS-W002601 [0,0,0,0,1,0|2,0,0]=3 73 B12R1.252 O=C(O)CSCC1=CC=CC=C1 CS-0076541 [0,0,0,0,1,0|2,0,0]=3 74 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 CS-0156615 [0,0,0,0,1,0|1,0,2]=4 75 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 CS-0166913 [0,0,0,0,1,0|1,0,2]=4 76 B12R1.252 [C@@H](C)(O)COCC1=CC=CC=C1 CS-W017736 [0,0,0,0,1,0|1,0,2]=4 77 B12R1.252 [C@H](C)(O)COCC1=CC=CC=C1 CS-W017860 [0,0,0,0,1,0|1,0,2]=4 78 B12R1.255 O=C(O)CCCCC1=CC=CS1 CS-0324015 [0,0,0,0,1,0|3,0,0]=4 79 B14R1.422 O=C(O)CCCCCC1=CC=CC=C1 CS-0181820 [0,0,0,0,0,1|2,0,0]=3 80 B14R1.422 O=C(O)CCCOCC1=CC=CC=C1 CS-W022004 [0,0,0,0,0,1|2,0,0]=3 81 B11R1.28 BrCCCCC1=CC=CC=C1 CS-W014977 [2,0,0,0,0,0|1,0,1]=4 82 B11R1.28 C=CCNCC1=CC=CC=C1 CS-0132091 [2,0,0,0,0,0|1,0,1]=4 83 B11R1.28 C=CCOCC1=CC=CC=C1 CS-0157968 [2,0,0,0,0,0|1,0,1]=4 84 B11R1.28 CCCCCC1=CC=CC=N1 CS-W018168 [2,0,0,0,0,0|1,0,1]=4 85 B11R1.28 CCCCCC1=CC=NC=C1 CS-0182155 [2,0,0,0,0,0|1,0,1]=4 86 B11R1.28 CCCNCC1=CC=CC=C1 CS-0152067 [2,0,0,0,0,0|1,0,1]=4 87 B11R1.28 CCOCCC1=CC=CC=N1 CS-W018112 [2,0,0,0,0,0|1,0,1]=4 88 B11R1.28 ClCCCCC1=CC=CC=C1 CS-0128930 [2,0,0,0,0,0|1,0,1]=4 89 B11R1.28 O=CNCCC1=CC=CC=C1 CS-0213371 [2,0,0,0,0,0|1,0,0]=3 90 B11R1.28 OCCCCC1=CC=CC=C1 CS-W018137 [2,0,0,0,0,0|0,0,2]=4 91 B13R1.9 CCCCCCC1=CC=C(Br)C=C1 CS-0020120 [1,1,0,0,0,0|1,0,1]=4 92 B13R1.9 CCCCCCC1=CC=C(N)C=C1 CS-W019284 [1,1,0,0,0,0|1,0,1]=4 93 B13R1.24 CCCCCC(O)C1=CC=CC=C1 CS-0198344 [1,1,0,0,0,0|1,0,1]=4 94 B13R1.28 BrCCCCCCC1=CC=CC=C1 CS-0158389 [1,1,0,0,0,0|1,0,1]=4 95 B13R1.28 OCCCCCCC1=CC=CC=C1 CS-0204723 [1,1,0,0,0,0|1,0,1]=4 96 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 CS-W002049 [1,1,0,0,0,0|0,0,2]=4 97 B13R1.718 COC(=O)CCCC1=CC=CC=C1 CS-D0496 [1,1,0,0,0,0|2,0,0]=4 98 B13R1.45 N[C@@H](CCC(=O)O)C1=CC=CC=C1 CS-0197291 [0,1,0,0,1,0|1,0,0]=3 99 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 CS-W001943 [0,1,0,0,1,0|1,0,1]=4 100 B13R1.149 NC1=CC=CC(CCCC(=O)O)=C1 CS-0269173 [0,1,0,0,1,0|1,0,0]=3 101 B13R1.149 O=C(O)CCCC1=CC=CC(Br)=C1 CS-W021989 [0,1,0,0,1,0|1,0,0]=3 102 B13R1.149 O=C(O)CCOC1=CC=CC(Cl)=C1 CS-0005243 [0,1,0,0,1,0|2,0,0]=4 103 B13R1.149 O=C(O)CCOC1=CC=CC(F)=C1 CS-0156872 [0,1,0,0,1,0|2,0,0]=4 104 B13R1.158 O=C(O)CCCC1=CC=CC=C1Cl CS-0031171 [0,1,0,0,1,0|1,0,0]=3 105 B13R1.158 O=C(O)CCOC1=CC=CC=C1Cl CS-0038126 [0,1,0,0,1,0|2,0,0]=4 106 B13R1.158 O=C(O)CCOC1=CC=CC=C1F CS-0117023 [0,1,0,0,1,0|2,0,0]=4 107 B13R1.158 O=C(O)CCSC1=CC=CC=C1F CS-0235089 [0,1,0,0,1,0|2,0,0]=4 108 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 CS-0155067 [0,1,0,0,1,0|0,0,1]=3 109 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 CS-0156332 [0,1,0,0,1,0|1,0,0]=3 110 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 CS-0059946 [0,1,0,0,1,0|1,0,0]=3 111 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 CS-0186132 [0,1,0,0,1,0|1,0,0]=3 112 B13R1.348 [C@@H](N)(CC(=O)O)CC1=CC=CC=C1 CS-W013167 [0,1,0,0,1,0|1,0,0]=3 113 B13R1.351 C[C@@H](OCC1=CC=CC=C1)C(=O)O CS-M3394 [0,1,0,0,1,0|2,0,0]=4 114 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O CS-M0016 [0,1,0,0,1,0|2,0,0]=4 115 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O CS-M2900 [0,1,0,0,1,0|1,0,0]=3 116 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O CS-0033656 [0,1,0,0,1,0|2,0,0]=4 117 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 CS-W019322 [0,1,0,0,1,0|1,0,1]=4 118 B13R1.351 O=C(O)C(Br)CCC1=CC=CC=C1 CS-M0889 [0,1,0,0,1,0|1,0,0]=3 119 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 CS-W021166 [0,1,0,0,1,0|1,0,0]=3 120 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 CS-0030811 [0,1,0,0,1,0|1,0,0]=3 121 B13R1.351 [C@@H](N)(CCC1=CC=CC=C1)C(=O)O CS-W017272 [0,1,0,0,1,0|1,0,0]=3 122 B13R1.513 CC1=CC=C(CCCC(=O)O)C=C1 CS-W002126 [0,1,0,0,1,0|1,0,0]=3 123 B13R1.513 NC1=CC=C(CCCC(=O)O)C=C1 CS-W017265 [0,1,0,0,1,0|1,0,0]=3 124 B13R1.513 O=C(O)CCCC1=CC=C(Br)C=C1 CS-0009030 [0,1,0,0,1,0|1,0,0]=3 125 B13R1.513 O=C(O)CCCC1=CC=C(Cl)C=C1 CS-0158401 [0,1,0,0,1,0|1,0,0]=3 126 B13R1.513 O=C(O)CCCC1=CC=C(F)C=C1 CS-0022368 [0,1,0,0,1,0|1,0,0]=3 127 B13R1.513 O=C(O)CCCC1=CC=C(I)C=C1 CS-0148623 [0,1,0,0,1,0|1,0,0]=3 128 B13R1.513 O=C(O)CCCC1=CC=C(O)C=C1 CS-W019452 [0,1,0,0,1,0|1,0,0]=3 129 B13R1.513 O=C(O)CCOC1=CC=C(Cl)C=C1 CS-W015588 [0,1,0,0,1,0|2,0,0]=4 130 B13R1.513 O=C(O)CCOC1=CC=C(F)C=C1 CS-0204663 [0,1,0,0,1,0|2,0,0]=4 131 B15R1.119 O=C(O)CCCNCC1=CC=CC(F)=C1 CS-0346043 [0,1,0,0,0,1|2,0,0]=4 132 B15R1.497 O=C(O)CCCCC(=O)C1=CC=CC=C1 CS-0204574 [0,1,0,0,0,1|2,0,0]=4 133 B15R1.871 CC(C)OCCOCC1=CC=C(O)C=C1 CS-0448510 [0,1,0,0,0,1|1,0,1]=4 134 B15R1.871 O=C(O)CCCCCC1=CC=C(O)C=C1 CS-0258187 [0,1,0,0,0,1|2,0,0]=4 135 B15R1.3890 O=S(=O)(O)OCCNCC1=CC=CC=C1 CS-0080132 [0,1,0,0,0,1|2,0,0]=4 136 B15R1.9084 CC(COCC1=CC=CC=C1)CC(=O)O CS-0469218 [0,1,0,0,0,1|2,0,0]=4 137 B15R1.959 COC(=O)CCCC(=O)C1=CC=CC=C1 CS-0150697 [0,2,0,0,0,0|1,0,1]=4 138 B15R1.111 CC(=O)OCC(=O)CC1=CC=C(Cl)C=C1 CS-M3572 [0,2,0,0,0,0|0,0,1]=3 139 B15R1.4 COC1=CC=C(CCCCC(=O)O)C=C1 CS-W015212 [0,2,0,0,0,0|2,0,0]=4 140 B15R1.778 CCOC(=O)CCCOC1=CC=CC=C1 CS-0179390 [0,2,0,0,0,0|2,0,0]=4 141 B15R1.778 CCOC(=O)CCNCC1=CC=CC=C1 CS-W015263 [0,2,0,0,0,0|2,0,0]=4 142 B15R1.1321 COC(=O)[C@@H](O)COCC1=CC=CC=C1 CS-0173379 [0,2,0,0,0,0|2,0,0]=4 143 B15R1.1321 [C@H](N)(COCC1=CC=CC=C1)C(=O)OC CS-W012708 [0,2,0,0,0,0|2,0,0]=4 144 B15R1.1321 [C@H](N)(CSCC1=CC=CC=C1)C(=O)OC CS-W012489 [0,2,0,0,0,0|2,0,0]=4 145 B13R2.3 C1=CC=C(C2CC=CCC2)C=C1 CS-0453050 [1,0,0,1,0,0|1,0,0]=3 146 B13R2.3 C1=CC=C(C2CCCCC2)C=C1 CS-W016155 [1,0,0,1,0,0|1,0,1]=4 147 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 CS-D0605 [1,0,0,1,0,0|1,0,1]=4 148 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 CS-W001274 [1,0,0,1,0,0|1,0,1]=4 149 B13R2.3 C1=CC=C(N2CCOCC2)C=C1 CS-W014318 [1,0,0,1,0,0|1,0,1]=4 150 B13R2.3 C1=CC=C([C@H]2CCCNC2)C=C1 CS-0045017 [1,0,0,1,0,0|2,0,0]=4 151 B13R2.15 O=C1CCCN1C2=CC=CC=C2 CS-0156105 [1,0,0,1,0,0|2,0,0]=4 152 B13R2.15 O=C1NCCN1C2=CC=CC=C2 CS-0045323 [1,0,0,1,0,0|2,0,0]=4 153 B13R2.64 C1=CC=C(CN2CC=CC2)C=C1 CS-W001618 [1,0,0,1,0,0|2,0,0]=4 154 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 CS-0070941 [1,0,0,1,0,0|1,0,0]=3 155 B13R2.5252 O=C1CCCNC2=CC=CC=C12 CS-W003071 [1,0,0,1,0,0|2,0,0]=4 156 B13R2.5252 O=C1CCNCC2=CC=CC=C12 CS-B0972 [1,0,0,1,0,0|2,0,0]=4 157 B13R2.5252 O=C1NCCCC2=CC=CC=C12 CS-0071404 [1,0,0,1,0,0|1,0,0]=3 158 B13R2.5252 O=C1NCCNC2=CC=CC=C12 CS-W021798 [1,0,0,1,0,0|2,0,0]=4 159 B13R2.5252 O=C1NCCOC2=C1C=CC=C2 CS-0038100 [1,0,0,1,0,0|2,0,0]=4 160 B13R2.10 O=C1CC(C2=CC=CC=C2)=NO1 CS-0114110 [0,0,0,1,1,0|1,0,1]=4 161 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 CS-W018637 [0,0,0,1,1,0|1,0,0]=3 162 B13R2.10 O=C1CC(C2=CN=CC=C2)CN1 CS-0071885 [0,0,0,1,1,0|2,0,0]=4 163 B13R2.10 O=C1CCC(C2=CC=CC=C2)C1 CS-0139334 [0,0,0,1,1,0|0,0,0]=2 164 B13R2.10 O=C1CCN(C2=CC=CC=C2)N1 CS-W010860 [0,0,0,1,1,0|2,0,0]=4 165 B13R2.10 O=C1CC[C@H](C2=CC=CC=C2)N1 CS-0098324 [0,0,0,1,1,0|1,0,0]=3 166 B13R2.10 O=C1NC(C2=CC=CC=C2)CO1 CS-0039132 [0,0,0,1,1,0|1,0,0]=3 167 B13R2.10 O=C1NC(C2=CC=CC=C2)CS1 CS-0050784 [0,0,0,1,1,0|1,1,0]=4 168 B13R2.10 O=C1NCC(C2=CC=CC=C2)O1 CS-0455553 [0,0,0,1,1,0|2,0,0]=4 169 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 CS-0031471 [0,0,0,1,1,0|1,0,0]=3 170 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 CS-W017924 [0,0,0,1,1,0|1,0,0]=3 171 B13R2.10 O=C1OCC(C2=CC=CC=C2)O1 CS-0697972 [0,0,0,1,1,0|1,0,0]=3 172 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 CS-0093692 [0,0,0,1,1,0|1,1,0]=4 173 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CO1 CS-W017256 [0,0,0,1,1,0|1,1,0]=4 174 B13R2.72 CC(=O)N1CCC2=CC=CC=C21 CS-W010870 [0,0,0,1,1,0|1,0,0]=3 175 B13R2.72 CC(=O)N1CCC2=CC=CN=C21 CS-0145217 [0,0,0,1,1,0|2,0,0]=4 176 B13R2.72 O=C(O)C1CCC2=C1C=CC=C2 CS-W018638 [0,0,0,1,1,0|1,0,0]=3 177 B13R2.72 O=C(O)C1CNC2=C1C=CC=C2 CS-0139342 [0,0,0,1,1,0|2,0,0]=4 178 B13R2.163 O=C1CC2=CC=CC=C2CCN1 CS-W000444 [0,0,0,1,1,0|1,0,0]=3 179 B13R2.163 O=C1CCCC2=CC=CC=C2N1 CS-D0727 [0,0,0,1,1,0|1,0,0]=3 180 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 CS-W021743 [0,0,0,1,1,0|1,0,0]=3 181 B13R2.423 O=C(O)C1CC1C2=CC=NC=C2 CS-0465634 [0,0,0,1,1,0|2,0,0]=4 182 B13R2.423 O=C(O)C1CC1C2=CN=CC=C2 CS-0196456 [0,0,0,1,1,0|2,0,0]=4 183 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 CS-0058721 [0,0,0,1,1,0|1,0,0]=3 184 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 CS-W008367 [0,0,0,1,1,0|1,0,0]=3 185 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 CS-0053575 [0,0,0,1,1,0|1,0,0]=3 186 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=NC=CC=C2 CS-0056007 [0,0,0,1,1,0|2,0,0]=4 187 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 CS-0043871 [0,0,0,1,1,0|1,0,0]=3 188 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 CS-W009502 [0,0,0,1,0,1|1,0,0]=3 189 B15R2.31 O=C1CN(CC2=CC=CC=C2)CCO1 CS-W001898 [0,0,0,1,0,1|0,0,0]=2 190 B15R2.31 OC1=NCCN(CC2=CC=CC=C2)C1 CS-W015882 [0,0,0,1,0,1|1,0,1]=4 191 B15R2.617 O=C1CC(COCC2=CC=CC=C2)C1 CS-0051580 [0,0,0,1,0,1|1,0,0]=3 192 B15R2.68122 O=C(O)CC1OCCC2=CC=CC=C21 CS-0060595 [0,0,0,1,0,1|2,0,0]=4 193 B15R2.384 CC(=O)N1CCCC2=CC(Br)=CC=C21 CS-0155038 [0,1,0,1,0,0|1,0,0]=3 194 B15R2.29 O=C1CCN(CC2=CC=CC=C2)CC1 CS-W007822 [0,1,0,1,0,0|2,0,0]=4 195 B15R2.79765 COC(=O)C1NCCC2=CC=CC=C21 CS-0217976 [0,1,0,1,0,0|2,0,0]=4 196 B15R2.79765 O=C(CCl)N1CCSC2=CC=CC=C21 CS-0308772 [0,1,0,1,0,0|2,0,0]=4 197 B15R2.325 O=C1N[C@@H](CC2=CC=CC=C2)C(=O)O1 CS-W022769 [0,1,0,1,0,0|1,0,1]=4 198 B15R3.2009 [C@@H]12NC(=O)O[C@@H]1CC3=C2C=CC=C3 CS-0098288 [0,0,0,2,0,0|2,0,0]=4 199 B15R3.2009 [C@H]12CC3=C(C=CC=C3)[C@H]1NC(=O)O2 CS-0093685 [0,0,0,2,0,0|2,0,0]=4 200 B15R3.2025 O=C1CC2CC(C1)C3=CC=CC=C32 CS-0155869 [0,0,0,2,0,0|1,0,0]=3 201 B11R1.91 CC(=O)C#CC1=CC=CC=C1 CS-W004450 [0,0,0,0,2,0|0,0,2]=4 202 B11R1.91 CC(=O)CCC1=CC=CC=C1 CS-W016332 [0,0,0,0,2,0|0,0,0]=2 203 B11R1.91 CC(=O)COC1=CC=CC=C1 CS-0066530 [0,0,0,0,2,0|1,0,0]=3 204 B11R1.91 CC(=O)NCC1=CC=CC=C1 CS-0044769 [0,0,0,0,2,0|1,0,0]=3 205 B11R1.91 CC(=O)NNC1=CC=CC=C1 CS-W018141 [0,0,0,0,2,0|2,0,0]=4 206 B11R1.91 CC(=O)OCC1=CC=CC=C1 CS-W018145 [0,0,0,0,2,0|0,0,0]=2 207 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 CS-0031350 [0,0,0,0,2,0|0,0,2]=4 208 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 CS-W013311 [0,0,0,0,2,0|0,0,2]=4 209 B11R1.91 CC(Br)CCC1=CC=CC=C1 CS-0250579 [0,0,0,0,2,0|1,0,1]=4 210 B11R1.91 CC(N)CCC1=CC=CC=C1 CS-0022291 [0,0,0,0,2,0|1,0,1]=4 211 B11R1.91 CC(O)CCC1=CC=CC=C1 CS-0154052 [0,0,0,0,2,0|0,0,2]=4 212 B11R1.91 C[C@@H](N)CCC1=CC=CC=C1 CS-0029877 [0,0,0,0,2,0|1,0,1]=4 213 B11R1.91 C[C@@H](O)CCC1=CC=CC=C1 CS-0179418 [0,0,0,0,2,0|0,0,2]=4 214 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 CS-0179429 [0,0,0,0,2,0|0,0,2]=4 215 B11R1.91 NC(=O)CCC1=CC=CC=C1 CS-0037177 [0,0,0,0,2,0|1,0,0]=3 216 B11R1.91 NC(=O)COC1=CC=CC=C1 CS-0149937 [0,0,0,0,2,0|2,0,0]=4 217 B11R1.91 NC(=O)OCC1=CC=CC=C1 CS-W004984 [0,0,0,0,2,0|1,0,0]=3 218 B11R1.91 NC(=S)CCC1=CC=CC=C1 CS-0250775 [0,0,0,0,2,0|1,1,0]=4 219 B11R1.91 O=C(O)CCC1=CC=CC=C1 CS-W019781 [0,0,0,0,2,0|1,0,0]=3 220 B11R1.91 O=C(O)CCC1=CC=CC=N1 CS-0060616 [0,0,0,0,2,0|2,0,0]=4 221 B11R1.91 O=C(O)CCC1=CC=NC=C1 CS-0140245 [0,0,0,0,2,0|2,0,0]=4 222 B11R1.91 O=C(O)CCC1=CN=CC=C1 CS-W018123 [0,0,0,0,2,0|2,0,0]=4 223 B11R1.91 O=C(O)CNC1=CC=CC=C1 CS-W016312 [0,0,0,0,2,0|2,0,0]=4 224 B11R1.91 O=C(O)COC1=CC=CC=C1 CS-0013736 [0,0,0,0,2,0|2,0,0]=4 225 B11R1.91 O=C(O)CSC1=CC=CC=C1 CS-W016037 [0,0,0,0,2,0|2,0,0]=4 226 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 CS-W021067 [0,0,0,0,2,0|2,0,0]=4 227 B11R1.172 CC(=O)CSCC1=CC=CO1 CS-0363276 [0,0,0,0,2,0|2,0,0]=4 228 B11R1.172 O=C(O)CCCC1=CC=CS1 CS-W020036 [0,0,0,0,2,0|2,0,0]=4 229 B15R1.504 O=C(O)COCCOCC1=CC=CC=C1 CS-0083759 [0,0,0,0,0,2|1,0,0]=3