0 B11R1.24 CCCOc1cccc(c1)N A2Z00056908 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.24 Cc1cccc(c1)CCC#N A2Z00048894 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.24 Cc1cccc(c1)CCCN A2Z00093999 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.24 Cc1cccc(c1)OCC#N A2Z00093937 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.24 Cc1cccc(c1)OCCN A2Z00038377 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.24 c1cc(cc(c1)Br)OCCN A2Z00038575 [0,0,0,0,0,0|3,1,0]=4 6 B11R1.24 c1cc(cc(c1)Cl)CCC#N A2Z00048896 [0,0,0,0,0,0|2,1,0]=3 7 B11R1.24 c1cc(cc(c1)Cl)CCCN A2Z00046195 [0,0,0,0,0,0|2,1,0]=3 8 B11R1.24 c1cc(cc(c1)O)CCCN A2Z00047984 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.10 CNCc1cccc(c1)O A2Z00038697 [1,0,0,0,0,0|1,0,0]=2 10 B10R1.10 Cc1cccc(c1)CCN A2Z00046191 [1,0,0,0,0,0|1,0,0]=2 11 B10R1.10 c1cc(cc(c1)Cl)CCN A2Z00093997 [1,0,0,0,0,0|0,1,0]=2 12 B10R1.17 CCNCc1ccccc1 A2Z00093459 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.17 CNCCc1ccncc1 A2Z00061328 [1,0,0,0,0,0|1,0,0]=2 14 B10R1.17 c1cc(cnc1)CCCN A2Z00046192 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.17 c1ccc(cc1)CCNN A2Z00095988 [1,0,0,0,0,0|1,0,0]=2 16 B10R1.17 c1ccc(cc1)CCNN A2Z00096724 [1,0,0,0,0,0|1,0,0]=2 17 B10R1.17 c1ccc(cc1)CN=C=O A2Z00094082 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.17 c1ccc(cc1)CN=[N+]=[N-] A2Z00096066 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.17 c1ccc(cc1)OCC#N A2Z00093923 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.17 c1ccc(cc1)OCCO A2Z00038602 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.17 c1ccc(cc1)OCCS A2Z00049974 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.17 c1ccnc(c1)CCC#N A2Z00094742 [1,0,0,0,0,0|3,0,0]=4 23 B12R1.17 CNCC(c1cccc(c1)Cl)O A2Z00046552 [0,1,0,0,0,0|0,1,0]=2 24 B12R1.28 COCCOc1cccc(c1)O A2Z00048084 [0,1,0,0,0,0|2,0,0]=3 25 B12R1.28 Cc1cccc(c1)OCCC#N A2Z00097974 [0,1,0,0,0,0|3,0,0]=4 26 B12R1.28 c1cc(cc(c1)Br)OCCC#N A2Z00096149 [0,1,0,0,0,0|2,1,0]=4 27 B12R1.28 c1cc(cc(c1)Cl)CCCCN A2Z00046208 [0,1,0,0,0,0|1,1,0]=3 28 B12R1.226 CC(=O)CCc1cccc(c1)Cl A2Z00094749 [0,1,0,0,0,0|1,1,0]=3 29 B12R1.226 CC(=O)COc1cccc(c1)Br A2Z00094586 [0,1,0,0,0,0|2,1,0]=4 30 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O A2Z00095187 [0,1,0,0,0,0|2,1,0]=4 31 B12R1.226 c1cc(cc(c1)F)CCC(=O)O A2Z00094264 [0,1,0,0,0,0|2,0,0]=3 32 B12R1.382 COc1cccc(c1)CCC#N A2Z00048895 [0,1,0,0,0,0|3,0,0]=4 33 B12R1.382 COc1cccc(c1)CCCN A2Z00046193 [0,1,0,0,0,0|3,0,0]=4 34 B12R2.24 c1cc2c(cc1F)OCCO2 A2Z00057051 [0,0,0,1,0,0|3,0,0]=4 35 B12R2.24 c1cc2c(cc1N)CCCN2 A2Z00047925 [0,0,0,1,0,0|3,0,0]=4 36 B12R2.24 c1cc2c(cc1N)CNCC2 A2Z00049912 [0,0,0,1,0,0|3,0,0]=4 37 B12R2.24 c1cc2c(cc1N)CNCC2 A2Z00095970 [0,0,0,1,0,0|3,0,0]=4 38 B12R2.24 c1cc2c(cc1N)NCCC2 A2Z00047924 [0,0,0,1,0,0|3,0,0]=4 39 B12R2.1081 c1cc2c(c(c1)N)NCCC2 A2Z00046541 [0,0,0,1,0,0|3,0,0]=4 40 B12R2.1081 c1cc2c(c(c1)O)CCCC2 A2Z00094829 [0,0,0,1,0,0|2,0,0]=3 41 B9R1.2 CCc1cccc(c1)O A2Z00038644 [2,0,0,0,0,0|1,0,0]=3 42 B9R1.2 CNc1cccc(c1)O A2Z00057021 [2,0,0,0,0,0|1,0,0]=3 43 B9R1.2 COc1cccc(c1)O A2Z00093458 [2,0,0,0,0,0|2,0,0]=4 44 B9R1.2 c1cc(cc(c1)Br)ON A2Z00096321 [2,0,0,0,0,0|1,1,0]=4 45 B9R1.2 c1cc(cc(c1)N)CN A2Z00095152 [2,0,0,0,0,0|1,0,0]=3 46 B9R1.8 CNCc1ccccc1 A2Z00093451 [2,0,0,0,0,0|0,0,0]=2 47 B9R1.8 [C]=NCc1ccccc1 A2Z00049869 [2,0,0,0,0,0|0,0,2]=4 48 B9R1.8 c1ccc(cc1)CC#N A2Z00093470 [2,0,0,0,0,0|0,0,2]=4 49 B9R1.8 c1ccc(cc1)CCBr A2Z00093579 [2,0,0,0,0,0|1,0,0]=3 50 B9R1.8 c1ccc(cc1)CCN A2Z00046190 [2,0,0,0,0,0|0,0,0]=2 51 B9R1.8 c1ccc(cc1)CNN A2Z00062153 [2,0,0,0,0,0|1,0,0]=3 52 B11R1.23 c1cc(cc(c1)Br)C(CO)N A2Z00049261 [1,1,0,0,0,0|1,1,0]=4 53 B11R1.23 c1cc(cc(c1)Cl)C(=O)CN A2Z00096028 [1,1,0,0,0,0|0,1,1]=4 54 B11R1.23 c1cc(cc(c1)Cl)C(CN)O A2Z00094086 [1,1,0,0,0,0|0,1,0]=3 55 B11R1.157 CC(=O)Cc1cccc(c1)Br A2Z00095995 [1,1,0,0,0,0|0,1,1]=4 56 B11R1.157 CC(C)Cc1cccc(c1)N A2Z00048066 [1,1,0,0,0,0|1,0,0]=3 57 B11R1.157 CN(C)Cc1cccc(c1)O A2Z00049745 [1,1,0,0,0,0|1,0,0]=3 58 B11R1.157 Cc1cccc(c1)CC(=O)C A2Z00046562 [1,1,0,0,0,0|1,0,1]=4 59 B11R1.1 CCCCc1ccc(cc1)N A2Z00038653 [1,1,0,0,0,0|1,0,0]=3 60 B11R1.1 Cc1ccc(cc1)CCCO A2Z00056898 [1,1,0,0,0,0|2,0,0]=4 61 B11R1.1 c1cc(ccc1CCCCl)Br A2Z00048006 [1,1,0,0,0,0|2,0,0]=4 62 B11R1.1 c1cc(ccc1CCCN)O A2Z00047983 [1,1,0,0,0,0|2,0,0]=4 63 B11R1.16 CC(CCN)c1ccccc1 A2Z00046307 [1,1,0,0,0,0|2,0,0]=4 64 B11R1.16 CNCC(c1ccncc1)O A2Z00048067 [1,1,0,0,0,0|1,0,0]=3 65 B11R1.28 CCNCCc1ccncc1 A2Z00061329 [1,1,0,0,0,0|1,0,0]=3 66 B11R1.28 c1ccc(cc1)CNCCO A2Z00065097 [1,1,0,0,0,0|2,0,0]=4 67 B11R1.28 c1ccc(cc1)OCCCN A2Z00077141 [1,1,0,0,0,0|2,0,0]=4 68 B11R1.28 c1ccc(cc1)OCCON A2Z00047939 [1,1,0,0,0,0|2,0,0]=4 69 B11R1.28 c1cnccc1CCCCN A2Z00061546 [1,1,0,0,0,0|2,0,0]=4 70 B11R1.40 CC(Cc1ccccc1)CN A2Z00046432 [1,1,0,0,0,0|2,0,0]=4 71 B11R1.40 c1ccc(cc1)CC(CO)N A2Z00045068 [1,1,0,0,0,0|2,0,0]=4 72 B11R1.91 CC(C)NCc1ccccc1 A2Z00093460 [1,1,0,0,0,0|2,0,0]=4 73 B13R1.460 CNCC(c1cccc(c1)OC)O A2Z00049951 [0,2,0,0,0,0|1,0,0]=3 74 B13R1.666 COc1cccc(c1)CCCCN A2Z00046205 [0,2,0,0,0,0|2,0,0]=4 75 B13R1.838 CC(C)(CCc1cccc(c1)Cl)N A2Z00049406 [0,2,0,0,0,0|1,1,0]=4 76 B13R1.838 CC(C)(CCc1cccc(c1)Cl)O A2Z00094727 [0,2,0,0,0,0|1,1,0]=4 77 B11R2.36 c1cc2c(cc1Br)CCN2 A2Z00094288 [1,0,0,1,0,0|0,1,0]=3 78 B11R2.10 c1c2c([nH]c1Br)CCNC2 A2Z00050459 [0,0,0,1,1,0|1,1,0]=4 79 B13R2.13 c1cc(cc(c1)N2CCCC2)N A2Z00048077 [0,1,0,1,0,0|2,0,0]=4 80 B13R2.162 c1cc2c(cc1Cl)C(CCC2)Cl A2Z00094231 [0,1,0,1,0,0|1,1,0]=4 81 B13R2.162 c1cc2c(cc1Cl)C(CCC2)O A2Z00094230 [0,1,0,1,0,0|1,1,0]=4 82 B13R2.162 c1cc2c(cc1F)C(=O)CCC2 A2Z00094218 [0,1,0,1,0,0|1,0,1]=4 83 B13R2.342 c1cc2c(c(c1)O)CCCC2O A2Z00096116 [0,1,0,1,0,0|2,0,0]=4 84 B13R2.662 c1cc2c(cc1Br)CCN2CO A2Z00097669 [0,1,0,1,0,0|0,1,0]=3 85 B13R2.3729 c1cc2c(cc1Cl)CNCCC2 A2Z00049478 [0,1,0,1,0,0|1,1,0]=4 86 B13R2.3729 c1cc2c(cc1F)CNCCC2 A2Z00049473 [0,1,0,1,0,0|1,0,0]=3 87 B13R2.5179 CN1CCCc2c1ccc(c2)Br A2Z00061803 [0,1,0,1,0,0|0,1,0]=3 88 B13R2.3108 C[N+]1(CCc2c1ccc(c2)Br)C A2Z00097664 [0,1,0,1,0,0|0,1,1]=4 89 B13R2.57 c1cc2c(cc1CO)CCCC2 A2Z00049188 [0,1,0,1,0,0|2,0,0]=4 90 B13R2.1613 COc1cccc2c1CNCC2 A2Z00062415 [0,1,0,1,0,0|1,0,0]=3 91 B13R2.2130 CN1CCc2c1ccc(c2)C=O A2Z00061678 [0,1,0,1,0,0|1,0,0]=3 92 B9R1.12 CNCCc1c[nH]cn1 A2Z00049843 [1,0,0,0,1,0|2,0,0]=4 93 B9R1.12 CNCCc1cnc[nH]1 A2Z00049842 [1,0,0,0,1,0|2,0,0]=4