0 B16R2.1054 CCCCC1=Nc2ccccc2C(=O)O1 Amb21973218 [0,0,0,0,0,0|1,0,2]=3 1 B16R2.1054 CCCNC=1NC(=O)c2ccccc2N1 Amb18512408 [0,0,0,0,0,0|3,0,1]=4 2 B16R2.1054 CCCSC=1NC(=O)c2ccccc2N1 Amb18516573 [0,0,0,0,0,0|3,0,1]=4 3 B16R2.1054 CCCSC=1Nc2ccccc2C(=O)N1 Amb20030161 [0,0,0,0,0,0|3,0,1]=4 4 B16R2.1054 CCNCC=1NC(=O)c2ccccc2N1 Amb18288816 [0,0,0,0,0,0|3,0,1]=4 5 B16R2.1054 CCNCC=1NC(=O)c2ccccc2N1 Amb19372327 [0,0,0,0,0,0|3,0,1]=4 6 B15R2.352 BrC\C=C\c1cc2ccc[n]c2cc1 Amb24498669 [1,0,0,0,0,0|3,0,0]=4 7 B15R2.352 BrC\C=C\c1cc2ccccc2[n]c1 Amb24664694 [1,0,0,0,0,0|3,0,0]=4 8 B15R2.352 BrC\C=C\c1cc2ccccc2cc1 Amb25193475 [1,0,0,0,0,0|2,0,0]=3 9 B15R2.352 CCCCC1=Cc2ccccc2CO1 Amb24350496 [1,0,0,0,0,0|0,0,3]=4 10 B15R2.352 CCNCc1cc2ccccc2c[n]1 Amb25116683 [1,0,0,0,0,0|2,0,1]=4 11 B15R2.352 CN\C=N\c1cc2ccccc2cc1 Amb25061159 [1,0,0,0,0,0|3,0,0]=4 12 B15R2.352 NC\C=C\c1cc2ccccc2cc1 Amb25075783 [1,0,0,0,0,0|2,0,0]=3 13 B15R2.352 O=C\C=C/c1cc2ccccc2cc1 Amb24686371 [1,0,0,0,0,0|2,0,1]=4 14 B15R2.352 OC\C=C\C=1COc2ccccc2C1 Amb24431010 [1,0,0,0,0,0|3,0,0]=4 15 B15R2.352 OC\C=C\c1cc2ccccc2cc1 Amb24498552 [1,0,0,0,0,0|2,0,0]=3 16 B15R2.886 CCCC1=CC(=O)c2ccccc2N1 Amb19046468 [1,0,0,0,0,0|2,0,1]=4 17 B15R2.886 CCCC1=Cc2ccccc2C(=O)N1 Amb25366151 [1,0,0,0,0,0|1,0,1]=3 18 B15R2.886 CCCC1=Nc2ccccc2C(=O)O1 Amb21912814 [1,0,0,0,0,0|1,0,1]=3 19 B15R2.886 CCCC=1NC(=O)c2ccccc2N1 Amb20036216 [1,0,0,0,0,0|2,0,1]=4 20 B15R2.886 CCCc1cc2ccccc2c(N)c1 Amb25374124 [1,0,0,0,0,0|2,0,1]=4 21 B15R2.886 CCNC1=Cc2ccccc2C(=O)N1 Amb18950429 [1,0,0,0,0,0|2,0,0]=3 22 B15R2.886 CCNC=1NC(=O)c2ccccc2N1 Amb18512496 [1,0,0,0,0,0|3,0,0]=4 23 B15R2.886 CCNc1cc2ccccc2c(Cl)[n]1 Amb25051144 [1,0,0,0,0,0|3,0,0]=4 24 B15R2.886 CCOC1=CC(=O)c2ccccc2O1 Amb24756792 [1,0,0,0,0,0|3,0,0]=4 25 B15R2.886 CCOC1=Nc2ccccc2C(=O)O1 Amb21927635 [1,0,0,0,0,0|2,0,0]=3 26 B15R2.886 CCOC=1NC(=O)c2ccccc2N1 Amb21948875 [1,0,0,0,0,0|3,0,0]=4 27 B15R2.886 CCOc1cc2ccccc2c(Br)[n]1 Amb25360349 [1,0,0,0,0,0|3,0,0]=4 28 B15R2.886 CCOc1cc2ccccc2c(N)[n]1 Amb18649915 [1,0,0,0,0,0|3,0,0]=4 29 B15R2.886 CCOc1nc2ccccc2c(=O)[nH]1 Amb16204072 [1,0,0,0,0,0|3,0,0]=4 30 B15R2.886 CCSC1=Nc2ccccc2C(=O)O1 Amb25381329 [1,0,0,0,0,0|2,0,0]=3 31 B15R2.886 CCSC=1NC(=O)c2ccccc2N1 Amb17998296 [1,0,0,0,0,0|3,0,0]=4 32 B15R2.886 CCSC=1Nc2ccccc2C(=O)N1 Amb21997312 [1,0,0,0,0,0|3,0,0]=4 33 B15R2.886 CC[Se]C=1NC(=O)c2ccccc2N1 Amb21868039 [1,0,0,0,0,0|3,0,0]=4 34 B15R2.886 C\C=C\C1=CC(=O)c2ccccc2N1 Amb25234771 [1,0,0,0,0,0|2,0,0]=3 35 B15R2.886 O=C1N\C(=C\C=O)\Oc2ccccc12 Amb18650082 [1,0,0,0,0,0|3,0,0]=4 36 B15R2.886 OCCC1=Nc2ccccc2C(=O)O1 Amb25214583 [1,0,0,0,0,0|2,0,1]=4 37 B15R2.886 O\C=C\C1=NC(=O)c2ccccc2O1 Amb24379879 [1,0,0,0,0,0|3,0,0]=4 38 B17R2.12072 C\C=C\C=C\C1=Nc2ccccc2C(=O)O1 Amb19518369 [0,1,0,0,0,0|1,0,1]=3 39 B17R2.40403 CC(C)COC1=Nc2ccccc2C(=O)O1 Amb21923948 [0,1,0,0,0,0|2,0,1]=4 40 B17R2.40403 CC(C)COC1=[NH+]c2ccccc2C(=O)O1 Amb22554646 [0,1,0,0,0,0|2,0,1]=4 41 B17R2.49938 CCNC(=O)C1=Cc2ccccc2C(=O)N1 Amb21140568 [0,1,0,0,0,0|2,0,0]=3 42 B17R2.49938 CCNC(=O)C=1NC(=O)c2ccccc2N1 Amb19270912 [0,1,0,0,0,0|3,0,0]=4 43 B17R2.49938 CCNC(=O)c1cc2ccccc2c(O)c1 Amb18669804 [0,1,0,0,0,0|2,0,1]=4 44 B17R2.49938 CCOC(=O)C1=CC(=O)c2ccccc2N1 Amb20259623 [0,1,0,0,0,0|3,0,0]=4 45 B17R2.49938 CCOC(=O)C1=CC(=O)c2ccccc2O1 Amb19665772 [0,1,0,0,0,0|3,0,0]=4 46 B17R2.49938 CCOC(=O)C1=Cc2cc[n]cc2C(=O)O1 Amb19930094 [0,1,0,0,0,0|2,0,0]=3 47 B17R2.49938 CCOC(=O)C1=Cc2ccccc2C(=O)N1 Amb22498018 [0,1,0,0,0,0|2,0,0]=3 48 B17R2.49938 CCOC(=O)C1=Cc2ccccc2C(=O)O1 Amb22750237 [0,1,0,0,0,0|1,0,0]=2 49 B17R2.49938 CCOC(=O)C1=Cc2ccccc2C(=O)S1 Amb18003606 [0,1,0,0,0,0|1,1,0]=3 50 B17R2.49938 CCOC(=O)C1=Nc2[n]cccc2C(=O)O1 Amb22496093 [0,1,0,0,0,0|3,0,0]=4 51 B17R2.49938 CCOC(=O)C1=Nc2c[n]ccc2C(=O)O1 Amb22496092 [0,1,0,0,0,0|3,0,0]=4 52 B17R2.49938 CCOC(=O)C1OC(=O)c2c(C1)cccc2 Amb2481364 [0,1,0,0,0,0|1,0,2]=4 53 B17R2.49938 CCOC(=O)C=1NC(=O)c2ccccc2N1 Amb18000379 [0,1,0,0,0,0|3,0,0]=4 54 B17R2.49938 CCOC(=O)C=1Nc2ccccc2C(=O)N1 Amb22733828 [0,1,0,0,0,0|3,0,0]=4 55 B17R2.49938 CCOC(=O)c1cc2ccccc2c(=O)s1 Amb2480195 [0,1,0,0,0,0|1,1,0]=3 56 B17R2.49938 CCOC(=O)c1cc2ccccc2c(Br)[n]1 Amb22498019 [0,1,0,0,0,0|3,0,0]=4 57 B17R2.49938 CCOC(=O)c1cc2ccccc2c(Cl)[n]1 Amb22058786 [0,1,0,0,0,0|3,0,0]=4 58 B17R2.49938 CCOC(=O)c1cc2ccccc2c(O)c1 Amb18657936 [0,1,0,0,0,0|2,0,1]=4 59 B17R2.49938 CCOC(=O)c1nc2ccccc2c(=O)[nH]1 Amb1395750 [0,1,0,0,0,0|3,0,0]=4 60 B17R2.49938 CCSC(=O)C1=CC(=O)c2ccccc2O1 Amb21997843 [0,1,0,0,0,0|3,0,0]=4 61 B17R3.35227 O=C1c2ccccc2C=C3C=CC=CN31 Amb21948290 [0,0,0,1,0,0|1,0,2]=4 62 B17R3.54615 O=C1Nc2cc[n]cc2-c3ccccc31 Amb20246978 [0,0,0,1,0,0|2,0,1]=4 63 B17R3.54615 O=C1Nc2ccccc2-c3ccccc31 Amb19063347 [0,0,0,1,0,0|1,0,2]=4 64 B17R3.54615 O=C1Oc2ccccc2-c3ccccc31 Amb19766528 [0,0,0,1,0,0|0,0,2]=3 65 B15R2.89 CCN\C=C/1\Cc2ccccc2C1=O Amb24379532 [0,0,0,0,1,0|1,0,1]=3 66 B15R2.89 CCO\C=C/1\Cc2ccccc2C1=O Amb24472005 [0,0,0,0,1,0|1,0,1]=3 67 B15R2.89 CCO\N=C\1/Nc2ccccc2C1=O Amb25277138 [0,0,0,0,1,0|3,0,0]=4 68 B15R2.1428 CCCCC1OC(=O)c2ccccc21 Amb22002464 [0,0,0,0,1,0|0,0,3]=4 69 B15R2.1428 CCCNC1OC(=O)c2ccccc21 Amb18929422 [0,0,0,0,1,0|1,0,2]=4 70 B15R2.1428 CCC\C=C/1\NC(=O)c2ccccc21 Amb24669076 [0,0,0,0,1,0|1,0,1]=3 71 B15R2.1428 CCC\C=C/1\OC(=O)C2=C1CCC=C2 Amb10845273 [0,0,0,0,1,0|0,0,3]=4 72 B15R2.1428 CCC\C=C/1\OC(=O)c2ccccc21 Amb22169952 [0,0,0,0,1,0|0,0,1]=2 73 B15R2.1428 CCC\C=C\1/OC(=O)C=2C=CCCC21 Amb22739651 [0,0,0,0,1,0|0,0,3]=4 74 B15R2.1428 CCC\C=C\1/OC(=O)c2ccccc21 Amb22172905 [0,0,0,0,1,0|0,0,1]=2 75 B15R2.1428 OCC\N=C/1\OC(=O)c2ccccc21 Amb25725481 [0,0,0,0,1,0|2,0,1]=4 76 B14R1.38 CCO\C=C\NC(=O)c1ccccc1 Amb25733096 [1,0,1,0,0,0|2,0,0]=4 77 B14R1.903 CC\C=N\Nc1ccccc1C(O)=O Amb24574995 [1,0,1,0,0,0|2,0,0]=4 78 B14R1.903 C\C=C\CNc1ccccc1C(O)=O Amb18650848 [1,0,1,0,0,0|1,0,1]=4 79 B14R1.467 CCCC\C(\C=O)=C\c1ccccc1 Amb22732853 [1,0,1,0,0,0|0,0,2]=4 80 B14R1.1035 CCN\C=C\C(=O)c1ccccc1O Amb25087167 [1,0,1,0,0,0|2,0,0]=4 81 B14R1.1035 C\C=C\C=CC(=O)c1ccccc1O Amb24598968 [1,0,1,0,0,0|1,0,1]=4 82 B14R1.1035 C\C=C\C=C\C(=O)c1ccccc1O Amb25035751 [1,0,1,0,0,0|1,0,1]=4 83 B14R2.112 CCNc1cc2ccccc2cc1 Amb24325293 [2,0,0,0,0,0|2,0,0]=4 84 B14R2.112 CCSc1cc2ccccc2cc1 Amb24359866 [2,0,0,0,0,0|2,0,0]=4 85 B14R2.112 C\C=C\c1cc2ccccc2[n]c1 Amb24407222 [2,0,0,0,0,0|2,0,0]=4 86 B14R2.1019 C=CC1=NC(=O)c2ccccc2O1 Amb25822769 [2,0,0,0,0,0|2,0,0]=4 87 B14R2.1019 C=CC=1NC(=O)c2ccccc2N1 Amb19514354 [2,0,0,0,0,0|2,0,0]=4 88 B14R2.1019 CCC1=CC(=O)c2ccccc2N1 Amb18790004 [2,0,0,0,0,0|2,0,0]=4 89 B14R2.1019 CCC1=CC(=O)c2ccccc2O1 Amb18048528 [2,0,0,0,0,0|2,0,0]=4 90 B14R2.1019 CCC1=Cc2ccccc2C(=O)O1 Amb20247492 [2,0,0,0,0,0|0,0,0]=2 91 B14R2.1019 CCC1=NC(=O)c2ccccc2O1 Amb24449398 [2,0,0,0,0,0|2,0,0]=4 92 B14R2.1019 CCC1=Nc2[n]cccc2C(=O)O1 Amb22301541 [2,0,0,0,0,0|2,0,0]=4 93 B14R2.1019 CCC1=Nc2ccccc2C(=O)O1 Amb19944584 [2,0,0,0,0,0|1,0,0]=3 94 B14R2.1019 CCC1OC(=O)c2c(O1)cccc2 Amb10574229 [2,0,0,0,0,0|1,0,1]=4 95 B14R2.1019 CCC=1NC(=O)c2ccccc2N1 Amb19516119 [2,0,0,0,0,0|2,0,0]=4 96 B14R2.1019 CCC=1Nc2ccccc2C(=O)N1 Amb19958422 [2,0,0,0,0,0|2,0,0]=4 97 B14R2.1019 CCc1cc2ccccc2c(Br)[n]1 Amb25718132 [2,0,0,0,0,0|2,0,0]=4 98 B14R2.1019 CCc1cc2ccccc2c(Cl)[n]1 Amb24661522 [2,0,0,0,0,0|2,0,0]=4 99 B14R2.1019 CCc1cc2ccccc2c(N)c1 Amb18126820 [2,0,0,0,0,0|2,0,0]=4 100 B14R2.1019 CNC1=Cc2ccccc2C(=O)N1 Amb18278369 [2,0,0,0,0,0|2,0,0]=4 101 B14R2.1019 CNC1=Nc2ccccc2C(=O)O1 Amb24496823 [2,0,0,0,0,0|2,0,0]=4 102 B14R2.1019 COC1=Cc2ccccc2C(=O)N1 Amb24394335 [2,0,0,0,0,0|2,0,0]=4 103 B14R2.1019 COC1=Cc2ccccc2C(=O)O1 Amb24103762 [2,0,0,0,0,0|1,0,0]=3 104 B14R2.1019 CSC1=Nc2ccccc2C(=O)O1 Amb24491783 [2,0,0,0,0,0|2,0,0]=4 105 B14R2.1019 O=C1NC(=Cc2ccccc12)C=O Amb18127023 [2,0,0,0,0,0|2,0,0]=4 106 B14R2.1019 O=C1NC(CCl)=Cc2ccccc21 Amb19373152 [2,0,0,0,0,0|2,0,0]=4 107 B14R2.1019 O=C1OC(=Cc2ccccc12)C=O Amb18127146 [2,0,0,0,0,0|1,0,0]=3 108 B14R2.1019 O=C1OC(CCl)=Nc2ccccc21 Amb19081427 [2,0,0,0,0,0|2,0,0]=4 109 B14R2.1019 O=c1oc(CBr)[n]c2ccccc21 Amb24065431 [2,0,0,0,0,0|2,0,0]=4 110 B14R2.1019 OCC1=Cc2ccccc2C(=O)N1 Amb25245768 [2,0,0,0,0,0|2,0,0]=4 111 B16R1.273 COC(=O)c1ccccc1C=CC=CC=O Amb22442044 [0,1,1,0,0,0|1,0,1]=4 112 B16R1.7596 CC\C=C/CCOC(=O)c1ccccc1N Amb22734158 [0,1,1,0,0,0|1,0,1]=4 113 B16R2.477 CC(Br)\C=C\c1ccc2ccccc2[n]1 Amb25237180 [1,1,0,0,0,0|2,0,0]=4 114 B16R2.477 CC(Cl)\C=C\c1ccc2ccccc2[n]1 Amb24620576 [1,1,0,0,0,0|2,0,0]=4 115 B16R2.767 CCCC(=O)c1cc2ccccc2cc1 Amb19067000 [1,1,0,0,0,0|1,0,1]=4 116 B16R2.767 CCNC(=O)c1cc2ccccc2cc1 Amb22285015 [1,1,0,0,0,0|2,0,0]=4 117 B16R2.767 CCOC(=N)c1cc2ccccc2cc1 Amb19056471 [1,1,0,0,0,0|2,0,0]=4 118 B16R2.2441 BrCC\C=C\c1cc2cc[n]cc2cc1 Amb25027416 [1,1,0,0,0,0|2,0,0]=4 119 B16R2.2441 BrCC\C=C\c1cc2ccc[n]c2cc1 Amb25055896 [1,1,0,0,0,0|2,0,0]=4 120 B16R2.2441 ClCC\C=C\c1cc2[n]cccc2cc1 Amb25328161 [1,1,0,0,0,0|2,0,0]=4 121 B16R2.2441 ClCC\C=C\c1cc2cc[n]cc2cc1 Amb25789379 [1,1,0,0,0,0|2,0,0]=4 122 B16R2.2441 ClCC\C=C\c1cc2ccc[n]c2cc1 Amb25309212 [1,1,0,0,0,0|2,0,0]=4 123 B16R2.2441 ClCC\C=C\c1cc2ccccc2cc1 Amb25092291 [1,1,0,0,0,0|1,0,0]=3 124 B16R2.5347 CCC(=O)Cc1cc2ccccc2cc1 Amb18321928 [1,1,0,0,0,0|1,0,1]=4 125 B16R2.5347 C\C(\CCl)=C\c1cc2ccccc2cc1 Amb24345211 [1,1,0,0,0,0|2,0,0]=4 126 B16R2.21673 CCCC1=Nc2cc(Cl)ccc2C(=O)O1 Amb22264461 [1,1,0,0,0,0|1,0,1]=4 127 B16R2.21680 Cc1ccc2N=C(OC(=O)c2c1)OCC Amb19668389 [1,1,0,0,0,0|2,0,0]=4 128 B16R2.24933 CC(=O)CC1=Nc2ccccc2C(=O)O1 Amb22432432 [1,1,0,0,0,0|1,0,1]=4 129 B16R2.24933 CC(C)CC1=Nc2ccccc2C(=O)O1 Amb19767566 [1,1,0,0,0,0|1,0,1]=4 130 B16R2.33887 COC(=O)C1=Cc2ccccc2C(=O)N1 Amb19373984 [1,1,0,0,0,0|2,0,0]=4 131 B16R2.33887 COC(=O)C1=Cc2ccccc2C(=O)S1 Amb18003607 [1,1,0,0,0,0|1,1,0]=4 132 B16R2.33887 COC(=O)C=1CC(=O)c2ccccc2C1 Amb24087881 [1,1,0,0,0,0|2,0,0]=4 133 B16R2.33887 COC(=O)c1cc2ccccc2c(=O)s1 Amb1285367 [1,1,0,0,0,0|1,1,0]=4 134 B16R2.114016 CCOC1=Nc2cccc(F)c2C(=O)O1 Amb24079288 [1,1,0,0,0,0|2,0,0]=4 135 B16R2.757 CCO\C(\N)=C\1/Sc2ccccc2C1=O Amb24068337 [0,1,0,0,1,0|2,0,0]=4 136 B16R2.2272 CCCN\C=C/1\Cc2ccccc2C1=O Amb22455542 [0,1,0,0,1,0|0,0,2]=4 137 B16R2.2272 OCCN\C=C\1/Nc2ccccc2C1=O Amb19774007 [0,1,0,0,1,0|2,0,0]=4 138 B16R2.12165 CCO\C=C/1\Cc2ccc(Br)cc2C1=O Amb24727992 [0,1,0,0,1,0|1,0,1]=4 139 B16R2.12172 CCO\C=C/1\Cc2cc(Br)ccc2C1=O Amb25058680 [0,1,0,0,1,0|1,0,1]=4 140 B16R2.12172 CCO\C=C/1\Cc2cc(F)ccc2C1=O Amb25077429 [0,1,0,0,1,0|1,0,1]=4 141 B16R2.30052 CCOC=C1C(=O)c2c(C1=O)cccc2 Amb1789688 [0,1,0,0,1,0|1,0,0]=3 142 B16R2.31776 CCO\C=C/1\Cc2c(cccc2F)C1=O Amb24374325 [0,1,0,0,1,0|1,0,1]=4 143 B16R2.33556 CCC(O)\C=C\1/OC(=O)c2ccccc12 Amb22741235 [0,1,0,0,1,0|0,0,1]=3 144 B16R2.165527 CCC\C=C\1/OC(=O)c2ccc(O)cc21 Amb22741205 [0,1,0,0,1,0|0,0,1]=3 145 B18R2.123715 OCCNC(=O)C1=Cc2ccccc2C(=O)S1 Amb18373181 [0,2,0,0,0,0|1,1,0]=4 146 B18R2.124731 CCOC(=O)\C=c\1/sc2ccccc2c(=O)[nH]1 Amb1107737 [0,2,0,0,0,0|2,0,0]=4 147 B18R2.63528 CC(C)NC(=O)C1=Cc2ccccc2C(=O)S1 Amb19788194 [0,2,0,0,0,0|1,1,0]=4 148 B18R2.63528 CC(C)OC(=O)C1=Cc2ccccc2C(=O)S1 Amb18003608 [0,2,0,0,0,0|1,1,0]=4 149 B18R2.63528 CC(OC(=O)c1cc2ccccc2c(=O)s1)C Amb2480196 [0,2,0,0,0,0|1,1,0]=4 150 B18R2.629184 CCOC(=O)C=1NC(=O)c2ccccc2C1Cl Amb22500102 [0,2,0,0,0,0|2,0,0]=4 151 B18R2.629184 CCOC(=O)C=1NC(=O)c2ccccc2C1O Amb19653988 [0,2,0,0,0,0|2,0,0]=4 152 B18R2.92602 CCCOC=1OC(=O)c2cc(N)ccc2C1Cl Amb23556010 [0,2,0,0,0,0|1,0,1]=4 153 B16R2.88 O=C(c1ccccc1)Oc2ccccc2 Amb2389283 [0,0,1,1,0,0|0,0,2]=4 154 B16R2.88 O=C(c1ccccc1)Oc2ccncc2 Amb10554121 [0,0,1,1,0,0|1,0,1]=4 155 B16R2.87 OC(=O)c1ccccc1C=2CCCCC2 Amb25161614 [0,0,1,1,0,0|0,0,2]=4 156 B16R2.87 OC(=O)c1ccccc1N2CC=CCC2 Amb25721196 [0,0,1,1,0,0|1,0,1]=4 157 B16R2.87 OC(=O)c1ccccc1c2ccccn2 Amb17136670 [0,0,1,1,0,0|1,0,1]=4 158 B16R2.2308 CCOc1cc(=O)c2ccccc2cc1 Amb24092055 [0,0,1,1,0,0|2,0,0]=4 159 B16R2.3033 C[n]1[n]ccc1-c2ccccc2C(O)=O Amb24759954 [0,0,1,1,0,0|2,0,0]=4 160 B16R2.3033 Cc1cocc1-c2ccccc2C(O)=O Amb24548103 [0,0,1,1,0,0|1,0,1]=4 161 B16R2.36827 CCc1cccc2c1OCC=C2C(=O)O Amb17237981 [0,0,1,1,0,0|1,0,1]=4 162 B16R2.36827 CCc1cccc2c1[n]ccc2C(O)=O Amb23585705 [0,0,1,1,0,0|1,0,0]=3 163 B16R2.36827 COc1cccc2c(cccc21)C(O)=O Amb18653798 [0,0,1,1,0,0|1,0,0]=3 164 B16R2.36827 COc1cccc2c1[nH+]ccc2C(O)=O Amb24113229 [0,0,1,1,0,0|2,0,0]=4 165 B16R2.36827 COc1cccc2c1[n]ccc2C(O)=O Amb23592245 [0,0,1,1,0,0|2,0,0]=4 166 B16R2.36827 NNc1cccc2c(cccc21)C(O)=O Amb24106346 [0,0,1,1,0,0|2,0,0]=4 167 B16R3.9 C1C=Cc2ccc3ccccc3c2O1 Amb23441464 [1,0,0,1,0,0|2,0,0]=4 168 B16R3.1720 C1CC=Cc2cc3ccccc3cc21 Amb25183193 [1,0,0,1,0,0|1,0,0]=3 169 B16R3.2754 O=C1c2ccccc2C=C3NCCN31 Amb22802711 [1,0,0,1,0,0|2,0,0]=4 170 B16R3.2754 O=C1c2ccccc2N=C3C=CCN31 Amb22750089 [1,0,0,1,0,0|2,0,0]=4 171 B16R3.13490 O=C1NC=2CCCC2c3ccccc31 Amb24640294 [1,0,0,1,0,0|1,0,1]=4 172 B16R3.31922 O=C1OC(=Nc2ccccc21)C3CC3 Amb19668303 [1,0,0,1,0,0|1,0,1]=4 173 B16R3.20606 O=C1c2cc[n][n]c2-c3ccccc31 Amb24644136 [0,0,0,1,1,0|2,0,0]=4 174 B16R3.20606 O=C1c2ccccc2C=3CCCCC31 Amb25353584 [0,0,0,1,1,0|0,0,2]=4 175 B16R3.20606 O=C1c2ccccc2c3c1cccc3 Amb1021887 [0,0,0,1,1,0|0,0,2]=4 176 B16R3.20606 O=C1c2ccccc2c3c1cccn3 Amb1024671 [0,0,0,1,1,0|1,0,1]=4 177 B16R3.29373 O=C1Oc2ccc(Br)c3cccc1c32 Amb25165116 [0,0,0,1,1,0|1,0,1]=4 178 B16R3.29373 Oc1ccc2OC(=O)c3cccc1c32 Amb18649224 [0,0,0,1,1,0|1,0,1]=4 179 B18R3.5898 CC1=CC=CC2=Cc3ccccc3C(=O)N21 Amb21948300 [0,1,0,1,0,0|1,0,1]=4 180 B18R3.93442 Cc1ccc2c(n1)c3ccccc3c(=O)o2 Amb10554371 [0,1,0,1,0,0|0,0,1]=3 181 B18R3.93442 Nc1cc-2c(cc1)OC(=O)c3ccccc32 Amb20671997 [0,1,0,1,0,0|0,0,2]=4 182 B18R3.93442 Oc1cc-2c(cc1)OC(=O)c3ccccc32 Amb22447975 [0,1,0,1,0,0|0,0,2]=4 183 B18R3.4232 Nc1cc2C(=O)Oc3ccccc3-c2cc1 Amb24309757 [0,1,0,1,0,0|0,0,2]=4 184 B18R3.159729 CCc1cc2[s]c3ccccc3c(=O)c2o1 Amb24084093 [0,1,0,1,0,0|2,0,0]=4 185 B18R3.54014 Nc1cc2OC(=O)c3ccccc3-c2cc1 Amb22482827 [0,1,0,1,0,0|0,0,2]=4 186 B18R3.54014 Oc1cc2OC(=O)c3ccccc3-c2cc1 Amb17997159 [0,1,0,1,0,0|0,0,2]=4 187 B18R3.54014 Oc1ccc2c(c1)oc(=O)c3c2cccc3 Amb1395270 [0,1,0,1,0,0|0,0,2]=4 188 B14R2.3 CC\C=C/c1c[nH]c2ccccc21 Amb25713938 [1,0,0,0,1,0|2,0,0]=4 189 B14R2.3 N#C\C=C/c1occ2ccccc21 Amb25187734 [1,0,0,0,1,0|1,0,1]=4 190 B14R2.3 OC\C=C\c1occ2ccccc21 Amb25211857 [1,0,0,0,1,0|1,0,0]=3 191 B14R2.67 BrC\C=C\c1cc2ccccc2[s]1 Amb25270456 [1,0,0,0,1,0|1,1,0]=4 192 B14R2.67 CCNCc1cc2ccccc2o1 Amb20623588 [1,0,0,0,1,0|1,0,1]=4 193 B14R2.67 CC\C=C/c1[nH]c2ccccc2[n]1 Amb25046136 [1,0,0,0,1,0|2,0,0]=4 194 B14R2.67 CC\C=C\[b]1oc2ccccc2o1 Amb22054585 [1,0,0,0,1,0|2,0,0]=4 195 B14R2.67 CC\C=C\c1cc2ccccc2[nH]1 Amb25243003 [1,0,0,0,1,0|1,0,0]=3 196 B14R2.67 CO\N=C\c1cc2ccccc2o1 Amb25739546 [1,0,0,0,1,0|2,0,0]=4 197 B14R2.67 ClC\C=C\c1cc2ccccc2o1 Amb25138420 [1,0,0,0,1,0|1,0,0]=3 198 B14R2.67 N#C\C=C\c1cc2ccccc2o1 Amb24716730 [1,0,0,0,1,0|1,0,1]=4 199 B14R2.67 NC\C=C\c1cc2ccccc2o1 Amb25785344 [1,0,0,0,1,0|1,0,0]=3 200 B14R2.67 O=C\C=C\c1cc2ccccc2o1 Amb24423740 [1,0,0,0,1,0|1,0,1]=4 201 B14R2.67 OC\C=C\c1cc2ccccc2[nH]1 Amb25766442 [1,0,0,0,1,0|2,0,0]=4 202 B14R2.44 CCOC1=Nc2ccccc2C1=O Amb25370707 [1,0,0,0,1,0|2,0,0]=4 203 B14R2.44 CC\C=C/1\Cc2ccccc2C1=O Amb24647735 [1,0,0,0,1,0|0,0,1]=3 204 B14R2.44 CC\C=C/1\Oc2ccccc2C1=O Amb24491384 [1,0,0,0,1,0|1,0,0]=3 205 B14R2.44 CC\C=C\1/Cc2ccccc2C1=O Amb24467119 [1,0,0,0,1,0|0,0,1]=3 206 B14R2.44 CN\C=C\1/Cc2ccccc2C1=O Amb25821444 [1,0,0,0,1,0|1,0,1]=4 207 B14R2.44 CN\C=C\1/Sc2ccccc2C1=O Amb21869140 [1,0,0,0,1,0|2,0,0]=4 208 B14R2.44 CO\C=C/1\Cc2ccccc2C1=O Amb24492722 [1,0,0,0,1,0|1,0,1]=4 209 B14R2.44 CO\C=C\1/Cc2ccccc2C1=O Amb24686537 [1,0,0,0,1,0|1,0,1]=4 210 B14R2.510 C=C1O\C(=C\C=O)\c2ccccc21 Amb24580388 [1,0,0,0,1,0|2,0,0]=4 211 B14R2.510 C=C\C=C\1/NC(=O)c2ccccc21 Amb25790567 [1,0,0,0,1,0|1,0,1]=4 212 B14R2.510 CCNC1=NC(=O)c2ccccc21 Amb25309378 [1,0,0,0,1,0|2,0,0]=4 213 B14R2.510 CCNC1OC(=O)c2ccccc21 Amb18929415 [1,0,0,0,1,0|1,0,1]=4 214 B14R2.510 CC\C=C/1\CC(=O)c2ccccc21 Amb24575941 [1,0,0,0,1,0|1,0,0]=3 215 B14R2.510 CC\C=C\1/CC(=O)c2ccccc21 Amb24416713 [1,0,0,0,1,0|1,0,0]=3 216 B14R2.510 CC\C=C\1/OC(=O)c2ccccc21 Amb22730297 [1,0,0,0,1,0|0,0,0]=2 217 B14R2.510 N#C\C=C/1\OC(=O)c2ccccc12 Amb25332007 [1,0,0,0,1,0|1,0,1]=4 218 B14R2.510 O=C1N\C(=C/C=O)\c2ccccc12 Amb24490183 [1,0,0,0,1,0|2,0,0]=4 219 B14R2.510 O=C1N\C(=C\C=O)\c2ccccc12 Amb25300430 [1,0,0,0,1,0|2,0,0]=4 220 B16R1.700 O=C(\C=C\CBr)OCC(=O)c1ccccc1 Amb22049496 [0,0,1,0,0,1|2,0,0]=4