0 B14R2.112 BrCCc1ccc2ccccc2c1 Amb8439759 [0,0,0,0,0,0|2,0,0]=2 1 B14R2.112 BrCCc1ccc2ccccc2n1 Amb25113626 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.112 BrCCc1ccc2cccnc2c1 Amb27436981 [0,0,0,0,0,0|3,0,0]=3 3 B14R2.112 BrCCc1ccc2cnccc2c1 Amb27421235 [0,0,0,0,0,0|3,0,0]=3 4 B14R2.112 BrCCc1ccc2ncccc2c1 Amb25056311 [0,0,0,0,0,0|3,0,0]=3 5 B14R2.112 BrCCc1ccc2nccnc2c1 Amb21927763 [0,0,0,0,0,0|4,0,0]=4 6 B14R2.112 BrCCc1cnc2ccccc2c1 Amb25847391 [0,0,0,0,0,0|3,0,0]=3 7 B14R2.112 BrCCc1cnc2ccccc2n1 Amb33227255 [0,0,0,0,0,0|4,0,0]=4 8 B14R2.112 Br\C=C\c1ccc2ccccc2c1 Amb8392462 [0,0,0,0,0,0|2,0,1]=3 9 B14R2.112 Br\C=C\c1ccc2ccccc2n1 Amb27195598 [0,0,0,0,0,0|3,0,1]=4 10 B14R2.112 Br\C=C\c1cnc2ccccc2c1 Amb27201759 [0,0,0,0,0,0|3,0,1]=4 11 B14R2.112 C#CCc1ccc2ccccc2c1 Amb33361948 [0,0,0,0,0,0|1,0,2]=3 12 B14R2.112 C#CCc1ccc2ccccc2n1 Amb25155087 [0,0,0,0,0,0|2,0,2]=4 13 B14R2.112 C#CCc1ccc2cccnc2c1 Amb32878870 [0,0,0,0,0,0|2,0,2]=4 14 B14R2.112 C#CCc1ccc2ncccc2c1 Amb28368587 [0,0,0,0,0,0|2,0,2]=4 15 B14R2.112 C#CCc1cnc2ccccc2c1 Amb33323975 [0,0,0,0,0,0|2,0,2]=4 16 B14R2.112 C=C=Cc1cnc2ccccc2c1 Amb28202667 [0,0,0,0,0,0|2,0,2]=4 17 B14R2.112 C=CC[n+]1ccc2ccccc2c1 Amb2705846 [0,0,0,0,0,0|2,0,2]=4 18 B14R2.112 C=CCc1ccc2ccccc2c1 Amb6299563 [0,0,0,0,0,0|1,0,2]=3 19 B14R2.112 C=CCc1ccc2ccccc2n1 Amb27434466 [0,0,0,0,0,0|2,0,2]=4 20 B14R2.112 C=CCc1ccc2cccnc2c1 Amb27765539 [0,0,0,0,0,0|2,0,2]=4 21 B14R2.112 C=CNc1ccc2ccccc2c1 Amb27482779 [0,0,0,0,0,0|1,0,2]=3 22 B14R2.112 C=COc1ccc2cccnc2c1 Amb27617590 [0,0,0,0,0,0|1,0,2]=3 23 B14R2.112 CC#Cc1ccc2ccccc2n1 Amb27208301 [0,0,0,0,0,0|2,0,1]=3 24 B14R2.112 CCC[n+]1ccc2ccccc2c1 Amb9825983 [0,0,0,0,0,0|2,0,0]=2 25 B14R2.112 CCCc1cc2ccccc2cn1 Amb27462348 [0,0,0,0,0,0|2,0,0]=2 26 B14R2.112 CCCc1ccc2ccccc2n1 Amb27265534 [0,0,0,0,0,0|2,0,0]=2 27 B14R2.112 CCCc1ccc2cccnc2n1 Amb27438611 [0,0,0,0,0,0|3,0,0]=3 28 B14R2.112 CCCc1ccc2ncccc2c1 Amb28067645 [0,0,0,0,0,0|2,0,0]=2 29 B14R2.112 CCNC1=Nc2ccccc2CO1 Amb28133417 [0,0,0,0,0,0|3,0,1]=4 30 B14R2.112 CCNC1=Nc2ccccc2CS1 Amb25856794 [0,0,0,0,0,0|3,0,1]=4 31 B14R2.112 CCNC1=Nc2ccccc2OC1 Amb27415637 [0,0,0,0,0,0|3,0,1]=4 32 B14R2.112 CCNc1ccc2ccccc2c1 Amb7759811 [0,0,0,0,0,0|1,0,0]=1 33 B14R2.112 CCNc1cnc2ccccc2n1 Amb18285469 [0,0,0,0,0,0|3,0,0]=3 34 B14R2.112 CCNc1nnc2ccccc2n1 Amb27972642 [0,0,0,0,0,0|4,0,0]=4 35 B14R2.112 CCOC1CCc2ccccc2C1 Amb24528095 [0,0,0,0,0,0|0,0,4]=4 36 B14R2.112 CCOC1CCc2ccccc2O1 Amb21963389 [0,0,0,0,0,0|1,0,3]=4 37 B14R2.112 CCOC1COc2ccccc2N1 Amb25101664 [0,0,0,0,0,0|2,0,2]=4 38 B14R2.112 CCOc1cc2ccccc2cn1 Amb2610107 [0,0,0,0,0,0|1,0,0]=1 39 B14R2.112 CCOc1ccc2c(c1)CCCN2 Amb33526503 [0,0,0,0,0,0|1,0,3]=4 40 B14R2.112 CCOc1ccc2c(c1)CCNC2 Amb18563090 [0,0,0,0,0,0|1,0,3]=4 41 B14R2.112 CCOc1ccc2c(c1)CNCC2 Amb13951595 [0,0,0,0,0,0|1,0,3]=4 42 B14R2.112 CCOc1ccc2c(c1)CNCC2 Amb7780240 [0,0,0,0,0,0|1,0,3]=4 43 B14R2.112 CCOc1ccc2ccccc2c1 Amb4017891 [0,0,0,0,0,0|0,0,0]=0 44 B14R2.112 CCOc1ccc2cccnc2c1 Amb27772101 [0,0,0,0,0,0|1,0,0]=1 45 B14R2.112 CCOc1ccc2cncnc2c1 Amb28291951 [0,0,0,0,0,0|2,0,0]=2 46 B14R2.112 CCOc1ccc2cnncc2c1 Amb27186341 [0,0,0,0,0,0|2,0,0]=2 47 B14R2.112 CCOc1ccc2ncccc2c1 Amb19106597 [0,0,0,0,0,0|1,0,0]=1 48 B14R2.112 CCOc1ccc2ncccc2n1 Amb25900314 [0,0,0,0,0,0|2,0,0]=2 49 B14R2.112 CCOc1ccc2ncncc2c1 Amb24476307 [0,0,0,0,0,0|2,0,0]=2 50 B14R2.112 CCOc1cnc2cccnc2n1 Amb27392564 [0,0,0,0,0,0|3,0,0]=3 51 B14R2.112 CCOc1cnc2ncccc2n1 Amb27392565 [0,0,0,0,0,0|3,0,0]=3 52 B14R2.112 CCSc1ccc2ccccc2c1 Amb24359866 [0,0,0,0,0,0|0,1,0]=1 53 B14R2.112 CCSc1ccc2ccccc2n1 Amb27972844 [0,0,0,0,0,0|1,1,0]=2 54 B14R2.112 CCSc1cnc2ccccc2n1 Amb27594469 [0,0,0,0,0,0|2,1,0]=3 55 B14R2.112 CNCc1cc2ccccc2cn1 Amb28137752 [0,0,0,0,0,0|3,0,0]=3 56 B14R2.112 CNCc1ccc2ccccc2c1 Amb1106022 [0,0,0,0,0,0|2,0,0]=2 57 B14R2.112 CNCc1ccc2ccccc2n1 Amb6742539 [0,0,0,0,0,0|3,0,0]=3 58 B14R2.112 CNCc1ccc2cccnc2c1 Amb25322012 [0,0,0,0,0,0|3,0,0]=3 59 B14R2.112 CNCc1ccc2cnccc2c1 Amb26625127 [0,0,0,0,0,0|3,0,0]=3 60 B14R2.112 CNCc1ccc2ncccc2c1 Amb1995118 [0,0,0,0,0,0|3,0,0]=3 61 B14R2.112 CNCc1ccc2ncccc2c1 Amb8503478 [0,0,0,0,0,0|3,0,0]=3 62 B14R2.112 CNCc1cnc2ccccc2c1 Amb1995108 [0,0,0,0,0,0|3,0,0]=3 63 B14R2.112 CNCc1cnc2ccccc2c1 Amb8503260 [0,0,0,0,0,0|3,0,0]=3 64 B14R2.112 CNCc1cnc2ccccc2n1 Amb3941205 [0,0,0,0,0,0|4,0,0]=4 65 B14R2.112 CNCc1cnc2ccccc2n1 Amb8503466 [0,0,0,0,0,0|4,0,0]=4 66 B14R2.112 COCc1cnc2ccccc2c1 Amb28422626 [0,0,0,0,0,0|3,0,0]=3 67 B14R2.112 CSCc1ccc2ccccc2c1 Amb4006802 [0,0,0,0,0,0|2,0,0]=2 68 B14R2.112 CSCc1ccc2ccccc2n1 Amb27836677 [0,0,0,0,0,0|3,0,0]=3 69 B14R2.112 CSCc1ccc2ccncc2c1 Amb27790291 [0,0,0,0,0,0|3,0,0]=3 70 B14R2.112 CSCc1cnc2ccccc2n1 Amb27971128 [0,0,0,0,0,0|4,0,0]=4 71 B14R2.112 C\C=C\c1cc2ccccc2cn1 Amb26928755 [0,0,0,0,0,0|2,0,1]=3 72 B14R2.112 C\N=C\c1ccc2ccccc2n1 Amb27642803 [0,0,0,0,0,0|3,0,0]=3 73 B14R2.112 C\N=C\c1cnc2ccccc2c1 Amb27444798 [0,0,0,0,0,0|3,0,0]=3 74 B14R2.112 ClCCc1ccc2cnccc2c1 Amb28456211 [0,0,0,0,0,0|3,0,0]=3 75 B14R2.112 ClCCc1ccc2nccnc2c1 Amb26981052 [0,0,0,0,0,0|4,0,0]=4 76 B14R2.112 ClCCc1cnc2ccccc2c1 Amb19073738 [0,0,0,0,0,0|3,0,0]=3 77 B14R2.112 ClCCc1ncc2ccccc2n1 Amb27423881 [0,0,0,0,0,0|4,0,0]=4 78 B14R2.112 ClCOc1cnc2ccccc2c1 Amb28195835 [0,0,0,0,0,0|2,0,0]=2 79 B14R2.112 Cl\C=C\c1ccc2ccccc2c1 Amb8392458 [0,0,0,0,0,0|2,0,1]=3 80 B14R2.112 F\C=C\c1ccc2ccccc2n1 Amb26630085 [0,0,0,0,0,0|3,0,1]=4 81 B14R2.112 IC#Cc1ccc2ccccc2c1 Amb27600905 [0,0,0,0,0,0|2,0,1]=3 82 B14R2.112 N#CC[n+]1ccc2ccccc2c1 Amb10553606 [0,0,0,0,0,0|3,0,1]=4 83 B14R2.112 N#CC[n+]1ccc2ccccc2c1 Amb2613486 [0,0,0,0,0,0|3,0,1]=4 84 B14R2.112 N#CCc1cc2ccccc2cn1 Amb23441358 [0,0,0,0,0,0|3,0,1]=4 85 B14R2.112 N#CCc1ccc2ccccc2c1 Amb2609980 [0,0,0,0,0,0|2,0,1]=3 86 B14R2.112 N#CCc1ccc2ccccc2n1 Amb6742677 [0,0,0,0,0,0|3,0,1]=4 87 B14R2.112 N#CCc1ccc2cccnc2c1 Amb22011582 [0,0,0,0,0,0|3,0,1]=4 88 B14R2.112 N#CCc1ccc2ccncc2c1 Amb28243346 [0,0,0,0,0,0|3,0,1]=4 89 B14R2.112 N#CCc1ccc2cnccc2c1 Amb26520998 [0,0,0,0,0,0|3,0,1]=4 90 B14R2.112 N#CCc1ccc2ncccc2c1 Amb6743306 [0,0,0,0,0,0|3,0,1]=4 91 B14R2.112 N#CCc1cnc2ccccc2c1 Amb22491006 [0,0,0,0,0,0|3,0,1]=4 92 B14R2.112 N#CNc1ccc2ccccc2c1 Amb18805829 [0,0,0,0,0,0|2,0,1]=3 93 B14R2.112 N#CNc1cnc2ccccc2c1 Amb27763361 [0,0,0,0,0,0|3,0,1]=4 94 B14R2.112 N#COc1ccc2ccccc2c1 Amb27445591 [0,0,0,0,0,0|1,0,1]=2 95 B14R2.112 N#CSc1ccc2ncccc2c1 Amb28453517 [0,0,0,0,0,0|2,1,1]=4 96 B14R2.112 NCCC1=COc2ccccc2O1 Amb28436814 [0,0,0,0,0,0|4,0,0]=4 97 B14R2.112 NCCC1=Cc2ccccc2OC1 Amb27444441 [0,0,0,0,0,0|3,0,1]=4 98 B14R2.112 NCCc1cc2ccccc2cn1 Amb23441235 [0,0,0,0,0,0|3,0,0]=3 99 B14R2.112 NCCc1cc2ccccc2nn1 Amb27638819 [0,0,0,0,0,0|4,0,0]=4 100 B14R2.112 NCCc1ccc2ccccc2c1 Amb6245305 [0,0,0,0,0,0|2,0,0]=2 101 B14R2.112 NCCc1ccc2ccccc2c1 Amb7969583 [0,0,0,0,0,0|2,0,0]=2 102 B14R2.112 NCCc1ccc2ccccc2n1 Amb6742401 [0,0,0,0,0,0|3,0,0]=3 103 B14R2.112 NCCc1ccc2ccccc2n1 Amb9182400 [0,0,0,0,0,0|3,0,0]=3 104 B14R2.112 NCCc1ccc2cccnc2c1 Amb18353295 [0,0,0,0,0,0|3,0,0]=3 105 B14R2.112 NCCc1ccc2cnccc2c1 Amb18353186 [0,0,0,0,0,0|3,0,0]=3 106 B14R2.112 NCCc1ccc2ncccc2c1 Amb32658737 [0,0,0,0,0,0|3,0,0]=3 107 B14R2.112 NCCc1ccc2ncccc2c1 Amb33528373 [0,0,0,0,0,0|3,0,0]=3 108 B14R2.112 NCCc1ccc2ncccc2n1 Amb28242399 [0,0,0,0,0,0|4,0,0]=4 109 B14R2.112 NCCc1ccc2nccnc2c1 Amb8011386 [0,0,0,0,0,0|4,0,0]=4 110 B14R2.112 NCCc1cnc2ccccc2c1 Amb18286590 [0,0,0,0,0,0|3,0,0]=3 111 B14R2.112 NCCc1cnc2ccccc2c1 Amb32668157 [0,0,0,0,0,0|3,0,0]=3 112 B14R2.112 NCCc1cnc2ccccc2n1 Amb18825284 [0,0,0,0,0,0|4,0,0]=4 113 B14R2.112 NCCc1ncc2ccccc2n1 Amb18136765 [0,0,0,0,0,0|4,0,0]=4 114 B14R2.112 NNCc1ccc2ccccc2c1 Amb21954060 [0,0,0,0,0,0|3,0,0]=3 115 B14R2.112 NNCc1ccc2ccccc2c1 Amb6249128 [0,0,0,0,0,0|3,0,0]=3 116 B14R2.112 NNCc1ccc2ccccc2c1 Amb8471152 [0,0,0,0,0,0|3,0,0]=3 117 B14R2.112 NNCc1ccc2ccccc2n1 Amb32660461 [0,0,0,0,0,0|4,0,0]=4 118 B14R2.112 NNCc1ccc2ccccc2n1 Amb6243381 [0,0,0,0,0,0|4,0,0]=4 119 B14R2.112 NNCc1ccc2cccnc2c1 Amb25936265 [0,0,0,0,0,0|4,0,0]=4 120 B14R2.112 NNCc1ccc2cnccc2c1 Amb28047110 [0,0,0,0,0,0|4,0,0]=4 121 B14R2.112 NNCc1ccc2ncccc2c1 Amb6743204 [0,0,0,0,0,0|4,0,0]=4 122 B14R2.112 NNCc1cnc2ccccc2c1 Amb10844879 [0,0,0,0,0,0|4,0,0]=4 123 B14R2.112 NNCc1cnc2ccccc2c1 Amb20669581 [0,0,0,0,0,0|4,0,0]=4 124 B14R2.112 NOCc1ccc2ccccc2c1 Amb33362172 [0,0,0,0,0,0|3,0,0]=3 125 B14R2.112 NOCc1ccc2ccccc2n1 Amb24466527 [0,0,0,0,0,0|4,0,0]=4 126 B14R2.112 NOCc1ccc2cccnc2c1 Amb32879182 [0,0,0,0,0,0|4,0,0]=4 127 B14R2.112 NOCc1ccc2ncccc2c1 Amb27750541 [0,0,0,0,0,0|4,0,0]=4 128 B14R2.112 NOCc1cnc2ccccc2c1 Amb26341250 [0,0,0,0,0,0|4,0,0]=4 129 B14R2.112 N\N=C\c1ccc2ccccc2c1 Amb28182926 [0,0,0,0,0,0|3,0,0]=3 130 B14R2.112 N\N=C\c1ccc2cnccc2c1 Amb28182928 [0,0,0,0,0,0|4,0,0]=4 131 B14R2.112 O=C=Cc1ccc2ccccc2n1 Amb27847660 [0,0,0,0,0,0|3,0,1]=4 132 B14R2.112 O=C=Cc1cnc2ccccc2c1 Amb27209239 [0,0,0,0,0,0|3,0,1]=4 133 B14R2.112 O=C=Nc1ccc2ccccc2c1 Amb3939256 [0,0,0,0,0,0|2,0,1]=3 134 B14R2.112 O=C=Nc1ccc2cccnc2c1 Amb27159783 [0,0,0,0,0,0|3,0,1]=4 135 B14R2.112 O=C=Nc1ccc2cnccc2c1 Amb24091735 [0,0,0,0,0,0|3,0,1]=4 136 B14R2.112 O=C=Nc1ccc2ncccc2c1 Amb2778982 [0,0,0,0,0,0|3,0,1]=4 137 B14R2.112 O=C=Nc1cnc2ccccc2c1 Amb19148806 [0,0,0,0,0,0|3,0,1]=4 138 B14R2.112 O=CCc1ccc2ccccc2c1 Amb18793599 [0,0,0,0,0,0|2,0,1]=3 139 B14R2.112 O=CCc1ccc2ccccc2n1 Amb3592051 [0,0,0,0,0,0|3,0,1]=4 140 B14R2.112 O=CCc1ccc2cccnc2c1 Amb24065247 [0,0,0,0,0,0|3,0,1]=4 141 B14R2.112 O=CCc1ccc2ncccc2c1 Amb24065245 [0,0,0,0,0,0|3,0,1]=4 142 B14R2.112 O=CCc1cnc2ccccc2c1 Amb18802212 [0,0,0,0,0,0|3,0,1]=4 143 B14R2.112 O=CNc1cc2ccccc2cn1 Amb27402635 [0,0,0,0,0,0|3,0,1]=4 144 B14R2.112 O=CNc1ccc2ccccc2n1 Amb27975445 [0,0,0,0,0,0|3,0,1]=4 145 B14R2.112 O=CNc1ccc2ncccc2c1 Amb27861671 [0,0,0,0,0,0|3,0,1]=4 146 B14R2.112 O=CNc1cnc2ccccc2c1 Amb27233111 [0,0,0,0,0,0|3,0,1]=4 147 B14R2.112 OCCC1=Cc2ccccc2CC1 Amb28248763 [0,0,0,0,0,0|2,0,2]=4 148 B14R2.112 OCCC1=Cc2ccccc2CO1 Amb28065904 [0,0,0,0,0,0|3,0,1]=4 149 B14R2.112 OCC[n+]1ccc2ccccc2c1 Amb21953406 [0,0,0,0,0,0|3,0,0]=3 150 B14R2.112 OCCc1ccc2ccccc2c1 Amb3939094 [0,0,0,0,0,0|2,0,0]=2 151 B14R2.112 OCCc1ccc2ccccc2n1 Amb4093502 [0,0,0,0,0,0|3,0,0]=3 152 B14R2.112 OCCc1ccc2cccnc2c1 Amb25160605 [0,0,0,0,0,0|3,0,0]=3 153 B14R2.112 OCCc1ccc2cnccc2c1 Amb25187947 [0,0,0,0,0,0|3,0,0]=3 154 B14R2.112 OCCc1ccc2ncccc2c1 Amb24065246 [0,0,0,0,0,0|3,0,0]=3 155 B14R2.112 OCCc1ccc2nccnc2c1 Amb21928074 [0,0,0,0,0,0|4,0,0]=4 156 B14R2.112 OCCc1cnc2ccccc2c1 Amb18803362 [0,0,0,0,0,0|3,0,0]=3 157 B14R2.112 OCCc1cnc2ccccc2n1 Amb24061361 [0,0,0,0,0,0|4,0,0]=4 158 B14R2.112 ONCc1ccc2ccccc2c1 Amb2441926 [0,0,0,0,0,0|3,0,0]=3 159 B14R2.112 ONCc1ccc2ccccc2n1 Amb27146002 [0,0,0,0,0,0|4,0,0]=4 160 B14R2.112 ONCc1ccc2cccnc2c1 Amb32879992 [0,0,0,0,0,0|4,0,0]=4 161 B14R2.112 ONCc1ccc2ncccc2c1 Amb24494636 [0,0,0,0,0,0|4,0,0]=4 162 B14R2.112 ONCc1cnc2ccccc2c1 Amb33325793 [0,0,0,0,0,0|4,0,0]=4 163 B14R2.112 O\N=C\c1ccc2ccccc2c1 Amb6346458 [0,0,0,0,0,0|3,0,0]=3 164 B14R2.112 O\N=C\c1ccc2ccccc2n1 Amb592735 [0,0,0,0,0,0|4,0,0]=4 165 B14R2.112 O\N=C\c1ccc2cccnc2c1 Amb27186089 [0,0,0,0,0,0|4,0,0]=4 166 B14R2.112 O\N=C\c1ccc2ncccc2c1 Amb27601565 [0,0,0,0,0,0|4,0,0]=4 167 B14R2.112 O\N=C\c1cnc2ccccc2c1 Amb24385393 [0,0,0,0,0,0|4,0,0]=4 168 B14R2.112 S=C=Nc1cc2ccccc2cn1 Amb26984187 [0,0,0,0,0,0|3,0,1]=4 169 B14R2.112 S=C=Nc1ccc2ccccc2c1 Amb4009135 [0,0,0,0,0,0|2,0,1]=3 170 B14R2.112 S=C=Nc1ccc2ccncc2c1 Amb27796479 [0,0,0,0,0,0|3,0,1]=4 171 B14R2.112 S=C=Nc1ccc2ncccc2c1 Amb19070002 [0,0,0,0,0,0|3,0,1]=4 172 B14R2.112 S=C=Nc1cnc2ccccc2c1 Amb19070003 [0,0,0,0,0,0|3,0,1]=4 173 B14R2.112 S=CNc1ccc2ncccc2c1 Amb27638131 [0,0,0,0,0,0|3,0,1]=4 174 B14R2.112 SCCc1ccc2ccccc2c1 Amb28346891 [0,0,0,0,0,0|2,0,0]=2 175 B14R2.112 SCCc1ccc2ccccc2n1 Amb26552663 [0,0,0,0,0,0|3,0,0]=3 176 B14R2.112 SCCc1ccc2cccnc2c1 Amb32878078 [0,0,0,0,0,0|3,0,0]=3 177 B14R2.112 SCCc1ccc2ncccc2c1 Amb33148372 [0,0,0,0,0,0|3,0,0]=3 178 B14R2.112 SCCc1cnc2ccccc2c1 Amb33320654 [0,0,0,0,0,0|3,0,0]=3 179 B14R2.112 SCCc1cnc2ccccc2n1 Amb33378880 [0,0,0,0,0,0|4,0,0]=4 180 B14R2.112 [C-]#[N+]Cc1ccc2ccccc2c1 Amb5351087 [0,0,0,0,0,0|2,0,1]=3 181 B14R2.112 [C-]#[N+]Cc1ccc2cccnc2c1 Amb32879193 [0,0,0,0,0,0|3,0,1]=4 182 B14R2.112 [C-]#[N+]Cc1ccc2ncccc2c1 Amb33143302 [0,0,0,0,0,0|3,0,1]=4 183 B14R2.112 [C-]#[N+]Cc1cnc2ccccc2c1 Amb33324497 [0,0,0,0,0,0|3,0,1]=4 184 B14R2.112 [N-]=[N+]=Nc1ccc2ccccc2c1 Amb8844873 [0,0,0,0,0,0|3,0,0]=3 185 B14R2.112 [N-]=[N+]=Nc1ccc2cccnc2c1 Amb24460789 [0,0,0,0,0,0|4,0,0]=4 186 B14R2.112 [N-]=[N+]=Nc1ccc2cnccc2c1 Amb27831449 [0,0,0,0,0,0|4,0,0]=4 187 B14R2.112 [N-]=[N+]=Nc1cnc2ccccc2c1 Amb23597495 [0,0,0,0,0,0|4,0,0]=4 188 B14R2.112 [NH3+]CCN1=Cc2ccccc2C=C1 Amb32454601 [0,0,0,0,0,0|3,0,0]=3 189 B14R2.112 [NH3+]CC[n+]1ccc2ccccc2c1 Amb24122601 [0,0,0,0,0,0|3,0,0]=3 190 B13R2.57 BrCc1ccc2ccccc2c1 Amb2609043 [1,0,0,0,0,0|1,0,0]=2 191 B13R2.57 BrCc1ccc2ccccc2n1 Amb21857522 [1,0,0,0,0,0|2,0,0]=3 192 B13R2.57 BrCc1ccc2ccccc2n1 Amb8397282 [1,0,0,0,0,0|2,0,0]=3 193 B13R2.57 BrCc1ccc2cccnc2c1 Amb21927780 [1,0,0,0,0,0|2,0,0]=3 194 B13R2.57 BrCc1ccc2cccnc2c1 Amb25202125 [1,0,0,0,0,0|2,0,0]=3 195 B13R2.57 BrCc1ccc2cccnc2n1 Amb28118296 [1,0,0,0,0,0|3,0,0]=4 196 B13R2.57 BrCc1ccc2ccncc2c1 Amb10070401 [1,0,0,0,0,0|2,0,0]=3 197 B13R2.57 BrCc1ccc2ccncc2c1 Amb13890504 [1,0,0,0,0,0|2,0,0]=3 198 B13R2.57 BrCc1ccc2cnccc2c1 Amb10070778 [1,0,0,0,0,0|2,0,0]=3 199 B13R2.57 BrCc1ccc2ncccc2c1 Amb22641432 [1,0,0,0,0,0|2,0,0]=3 200 B13R2.57 BrCc1ccc2ncccc2n1 Amb27616800 [1,0,0,0,0,0|3,0,0]=4 201 B13R2.57 BrCc1ccc2nccnc2c1 Amb17205206 [1,0,0,0,0,0|3,0,0]=4 202 B13R2.57 BrCc1cnc2ccccc2c1 Amb24061934 [1,0,0,0,0,0|2,0,0]=3 203 B13R2.57 BrCc1cnc2ccccc2c1 Amb32652350 [1,0,0,0,0,0|2,0,0]=3 204 B13R2.57 BrCc1cnc2ccccc2n1 Amb841851 [1,0,0,0,0,0|3,0,0]=4 205 B13R2.57 BrCc1ncc2ccccc2n1 Amb27172666 [1,0,0,0,0,0|3,0,0]=4 206 B13R2.57 C#Cc1ccc2ccccc2c1 Amb10071054 [1,0,0,0,0,0|0,0,2]=3 207 B13R2.57 C#Cc1ccc2ccccc2n1 Amb22490538 [1,0,0,0,0,0|1,0,2]=4 208 B13R2.57 C#Cc1ccc2cccnc2c1 Amb21857606 [1,0,0,0,0,0|1,0,2]=4 209 B13R2.57 C#Cc1ccc2cnccc2c1 Amb21857755 [1,0,0,0,0,0|1,0,2]=4 210 B13R2.57 C#Cc1ccc2ncccc2c1 Amb18787471 [1,0,0,0,0,0|1,0,2]=4 211 B13R2.57 C#Cc1cnc2ccccc2c1 Amb776988 [1,0,0,0,0,0|1,0,2]=4 212 B13R2.57 C=Cc1ccc2ccccc2c1 Amb8394029 [1,0,0,0,0,0|0,0,2]=3 213 B13R2.57 C=Cc1ccc2ccccc2n1 Amb10071967 [1,0,0,0,0,0|1,0,2]=4 214 B13R2.57 C=Cc1ccc2cccnc2c1 Amb32681920 [1,0,0,0,0,0|1,0,2]=4 215 B13R2.57 C=Cc1ccc2cnccc2c1 Amb28066715 [1,0,0,0,0,0|1,0,2]=4 216 B13R2.57 C=Cc1ccc2ncccc2c1 Amb26841127 [1,0,0,0,0,0|1,0,2]=4 217 B13R2.57 C=Cc1cnc2ccccc2c1 Amb8394032 [1,0,0,0,0,0|1,0,2]=4 218 B13R2.57 C=Nc1ccc2ncccc2c1 Amb27667186 [1,0,0,0,0,0|2,0,1]=4 219 B13R2.57 CCC1C=Cc2ccccc2N1 Amb27949234 [1,0,0,0,0,0|1,0,1]=3 220 B13R2.57 CC[n+]1ccc2ccccc2c1 Amb27649764 [1,0,0,0,0,0|1,0,0]=2 221 B13R2.57 CCc1ccc2c(c1)C=CCN2 Amb18559646 [1,0,0,0,0,0|1,0,1]=3 222 B13R2.57 CCc1ccc2c(c1)C=CCO2 Amb23441446 [1,0,0,0,0,0|1,0,1]=3 223 B13R2.57 CCc1ccc2ccccc2c1 Amb6298320 [1,0,0,0,0,0|0,0,0]=1 224 B13R2.57 CCc1ccc2ccccc2n1 Amb20667571 [1,0,0,0,0,0|1,0,0]=2 225 B13R2.57 CCc1ccc2cccnc2c1 Amb24436476 [1,0,0,0,0,0|1,0,0]=2 226 B13R2.57 CCc1ccc2cccnc2n1 Amb28141810 [1,0,0,0,0,0|2,0,0]=3 227 B13R2.57 CCc1ccc2ccncc2c1 Amb19100642 [1,0,0,0,0,0|1,0,0]=2 228 B13R2.57 CCc1ccc2cnccc2c1 Amb24091669 [1,0,0,0,0,0|1,0,0]=2 229 B13R2.57 CCc1ccc2cnccc2n1 Amb24648881 [1,0,0,0,0,0|2,0,0]=3 230 B13R2.57 CCc1ccc2ncccc2c1 Amb18355325 [1,0,0,0,0,0|1,0,0]=2 231 B13R2.57 CCc1ccc2ncncc2c1 Amb28435490 [1,0,0,0,0,0|2,0,0]=3 232 B13R2.57 CCc1cnc2ccccc2c1 Amb15691863 [1,0,0,0,0,0|1,0,0]=2 233 B13R2.57 CNc1ccc2ccccc2c1 Amb415893 [1,0,0,0,0,0|1,0,0]=2 234 B13R2.57 CNc1ccc2ccccc2n1 Amb6627062 [1,0,0,0,0,0|2,0,0]=3 235 B13R2.57 CNc1ccc2cccnc2c1 Amb5717611 [1,0,0,0,0,0|2,0,0]=3 236 B13R2.57 CNc1ccc2cnccc2c1 Amb19109233 [1,0,0,0,0,0|2,0,0]=3 237 B13R2.57 CNc1ccc2cnccc2c1 Amb33532500 [1,0,0,0,0,0|2,0,0]=3 238 B13R2.57 CNc1ccc2cnccc2c1 Amb35789161 [1,0,0,0,0,0|2,0,0]=3 239 B13R2.57 CNc1ccc2ncccc2c1 Amb18949283 [1,0,0,0,0,0|2,0,0]=3 240 B13R2.57 CNc1ccc2ncccc2n1 Amb22751196 [1,0,0,0,0,0|3,0,0]=4 241 B13R2.57 CNc1ccc2nnccc2c1 Amb22751177 [1,0,0,0,0,0|3,0,0]=4 242 B13R2.57 CNc1cnc2ccccc2c1 Amb18948972 [1,0,0,0,0,0|2,0,0]=3 243 B13R2.57 CNc1cnc2ccccc2n1 Amb18947325 [1,0,0,0,0,0|3,0,0]=4 244 B13R2.57 CNc1ncc2ccccc2n1 Amb25363322 [1,0,0,0,0,0|3,0,0]=4 245 B13R2.57 COC1=Nc2ccccc2CC1 Amb27179706 [1,0,0,0,0,0|1,0,2]=4 246 B13R2.57 COC1=Nc2ccccc2OC1 Amb33218462 [1,0,0,0,0,0|2,0,1]=4 247 B13R2.57 COC1=Nc2ccccc2SC1 Amb24116116 [1,0,0,0,0,0|2,0,1]=4 248 B13R2.57 COc1cc2ccccc2cn1 Amb25861237 [1,0,0,0,0,0|1,0,0]=2 249 B13R2.57 COc1cc2ccncc2cn1 Amb28250059 [1,0,0,0,0,0|2,0,0]=3 250 B13R2.57 COc1cc2ncccc2cn1 Amb27847145 [1,0,0,0,0,0|2,0,0]=3 251 B13R2.57 COc1cc2nccnc2cn1 Amb27605533 [1,0,0,0,0,0|3,0,0]=4 252 B13R2.57 COc1ccc2c(c1)C=CCC2 Amb2383773 [1,0,0,0,0,0|0,0,2]=3 253 B13R2.57 COc1ccc2c(c1)C=CCN2 Amb18062202 [1,0,0,0,0,0|1,0,1]=3 254 B13R2.57 COc1ccc2c(c1)C=CCO2 Amb23441461 [1,0,0,0,0,0|1,0,1]=3 255 B13R2.57 COc1ccc2c(c1)CCC=C2 Amb26651800 [1,0,0,0,0,0|0,0,2]=3 256 B13R2.57 COc1ccc2c(c1)CCN=C2 Amb22263073 [1,0,0,0,0,0|1,0,2]=4 257 B13R2.57 COc1ccc2c(c1)NCC=C2 Amb18559644 [1,0,0,0,0,0|1,0,1]=3 258 B13R2.57 COc1ccc2ccccc2c1 Amb2610832 [1,0,0,0,0,0|0,0,0]=1 259 B13R2.57 COc1ccc2ccccc2n1 Amb20171196 [1,0,0,0,0,0|1,0,0]=2 260 B13R2.57 COc1ccc2cccnc2c1 Amb17617089 [1,0,0,0,0,0|1,0,0]=2 261 B13R2.57 COc1ccc2cccnc2c1 Amb24183299 [1,0,0,0,0,0|1,0,0]=2 262 B13R2.57 COc1ccc2cccnc2n1 Amb27624881 [1,0,0,0,0,0|2,0,0]=3 263 B13R2.57 COc1ccc2ccncc2c1 Amb10610318 [1,0,0,0,0,0|1,0,0]=2 264 B13R2.57 COc1ccc2ccncc2c1 Amb5638098 [1,0,0,0,0,0|1,0,0]=2 265 B13R2.57 COc1ccc2cnccc2c1 Amb10071944 [1,0,0,0,0,0|1,0,0]=2 266 B13R2.57 COc1ccc2cnccc2c1 Amb22236031 [1,0,0,0,0,0|1,0,0]=2 267 B13R2.57 COc1ccc2cncnc2c1 Amb22745180 [1,0,0,0,0,0|2,0,0]=3 268 B13R2.57 COc1ccc2cnncc2c1 Amb26464081 [1,0,0,0,0,0|2,0,0]=3 269 B13R2.57 COc1ccc2ncccc2c1 Amb1156981 [1,0,0,0,0,0|1,0,0]=2 270 B13R2.57 COc1ccc2ncccc2n1 Amb27453648 [1,0,0,0,0,0|2,0,0]=3 271 B13R2.57 COc1ccc2nccnc2c1 Amb10068725 [1,0,0,0,0,0|2,0,0]=3 272 B13R2.57 COc1ccc2nccnc2n1 Amb22497790 [1,0,0,0,0,0|3,0,0]=4 273 B13R2.57 COc1cnc2ccccc2c1 Amb19957896 [1,0,0,0,0,0|1,0,0]=2 274 B13R2.57 COc1cnc2cccnc2c1 Amb21959422 [1,0,0,0,0,0|2,0,0]=3 275 B13R2.57 COc1cnc2nccnc2c1 Amb23401942 [1,0,0,0,0,0|3,0,0]=4 276 B13R2.57 COc1ncc2ccccc2n1 Amb22745160 [1,0,0,0,0,0|2,0,0]=3 277 B13R2.57 CSc1ccc2ccccc2c1 Amb2609071 [1,0,0,0,0,0|0,1,0]=2 278 B13R2.57 CSc1ccc2ccccc2n1 Amb6477854 [1,0,0,0,0,0|1,1,0]=3 279 B13R2.57 CSc1ccc2cccnc2n1 Amb27186169 [1,0,0,0,0,0|2,1,0]=4 280 B13R2.57 CSc1ccc2ccncc2c1 Amb27968016 [1,0,0,0,0,0|1,1,0]=3 281 B13R2.57 ClCC1=CCc2ccccc2O1 Amb27642028 [1,0,0,0,0,0|2,0,1]=4 282 B13R2.57 ClCC1=Cc2ccccc2OC1 Amb24470057 [1,0,0,0,0,0|2,0,1]=4 283 B13R2.57 ClCC1C=Cc2ccccc2O1 Amb27603401 [1,0,0,0,0,0|2,0,1]=4 284 B13R2.57 ClCc1c[nH+]c2ccccc2c1 Amb31273163 [1,0,0,0,0,0|2,0,0]=3 285 B13R2.57 ClCc1cc2ccccc2cn1 Amb20620761 [1,0,0,0,0,0|2,0,0]=3 286 B13R2.57 ClCc1cc2ccccc2cn1 Amb22235579 [1,0,0,0,0,0|2,0,0]=3 287 B13R2.57 ClCc1ccc2ccccc2[nH+]1 Amb24113853 [1,0,0,0,0,0|2,0,0]=3 288 B13R2.57 ClCc1ccc2ccccc2c1 Amb2796492 [1,0,0,0,0,0|1,0,0]=2 289 B13R2.57 ClCc1ccc2ccccc2n1 Amb6892745 [1,0,0,0,0,0|2,0,0]=3 290 B13R2.57 ClCc1ccc2cccnc2c1 Amb25259693 [1,0,0,0,0,0|2,0,0]=3 291 B13R2.57 ClCc1ccc2cccnc2c1 Amb32757719 [1,0,0,0,0,0|2,0,0]=3 292 B13R2.57 ClCc1ccc2cccnc2n1 Amb25321029 [1,0,0,0,0,0|3,0,0]=4 293 B13R2.57 ClCc1ccc2ccncc2c1 Amb27955828 [1,0,0,0,0,0|2,0,0]=3 294 B13R2.57 ClCc1ccc2cnccc2c1 Amb25138786 [1,0,0,0,0,0|2,0,0]=3 295 B13R2.57 ClCc1ccc2cnccc2c1 Amb32751753 [1,0,0,0,0,0|2,0,0]=3 296 B13R2.57 ClCc1ccc2ncccc2c1 Amb32685297 [1,0,0,0,0,0|2,0,0]=3 297 B13R2.57 ClCc1ccc2ncccc2c1 Amb9132860 [1,0,0,0,0,0|2,0,0]=3 298 B13R2.57 ClCc1cnc2ccccc2c1 Amb19375278 [1,0,0,0,0,0|2,0,0]=3 299 B13R2.57 ClCc1cnc2ccccc2n1 Amb10610683 [1,0,0,0,0,0|3,0,0]=4 300 B13R2.57 ClCc1cnc2ccccc2n1 Amb32666742 [1,0,0,0,0,0|3,0,0]=4 301 B13R2.57 ClCc1ncc2ccccc2n1 Amb24065130 [1,0,0,0,0,0|3,0,0]=4 302 B13R2.57 FCc1ccc2ccccc2c1 Amb28139672 [1,0,0,0,0,0|1,0,0]=2 303 B13R2.57 ICc1ccc2ccccc2n1 Amb28141827 [1,0,0,0,0,0|2,0,0]=3 304 B13R2.57 ICc1cnc2ccccc2n1 Amb35677850 [1,0,0,0,0,0|3,0,0]=4 305 B13R2.57 N#Cc1cc2ccccc2cn1 Amb8395995 [1,0,0,0,0,0|2,0,1]=4 306 B13R2.57 N#Cc1ccc2ccccc2c1 Amb4009131 [1,0,0,0,0,0|1,0,1]=3 307 B13R2.57 N#Cc1ccc2ccccc2n1 Amb1063463 [1,0,0,0,0,0|2,0,1]=4 308 B13R2.57 N#Cc1ccc2cccnc2c1 Amb9901753 [1,0,0,0,0,0|2,0,1]=4 309 B13R2.57 N#Cc1ccc2ccncc2c1 Amb10842296 [1,0,0,0,0,0|2,0,1]=4 310 B13R2.57 N#Cc1ccc2cnccc2c1 Amb10842295 [1,0,0,0,0,0|2,0,1]=4 311 B13R2.57 N#Cc1ccc2ncccc2c1 Amb18787501 [1,0,0,0,0,0|2,0,1]=4 312 B13R2.57 N#Cc1cnc2ccccc2c1 Amb2390028 [1,0,0,0,0,0|2,0,1]=4 313 B13R2.57 N#[N+]c1ccc2ncccc2c1 Amb27850516 [1,0,0,0,0,0|3,0,0]=4 314 B13R2.57 N=Cc1ccc2ccccc2n1 Amb27642853 [1,0,0,0,0,0|2,0,1]=4 315 B13R2.57 NCC1=COc2ccccc2O1 Amb18645814 [1,0,0,0,0,0|3,0,0]=4 316 B13R2.57 NCC1=Cc2ccccc2CC1 Amb18063880 [1,0,0,0,0,0|1,0,2]=4 317 B13R2.57 NCC1=Cc2ccccc2OC1 Amb22642376 [1,0,0,0,0,0|2,0,1]=4 318 B13R2.57 NCc1cc2ccccc2cn1 Amb22728928 [1,0,0,0,0,0|2,0,0]=3 319 B13R2.57 NCc1cc2ccccc2cn1 Amb8010863 [1,0,0,0,0,0|2,0,0]=3 320 B13R2.57 NCc1cc2ccccc2nn1 Amb18830354 [1,0,0,0,0,0|3,0,0]=4 321 B13R2.57 NCc1ccc2ccccc2c1 Amb1120053 [1,0,0,0,0,0|1,0,0]=2 322 B13R2.57 NCc1ccc2ccccc2c1 Amb19957972 [1,0,0,0,0,0|1,0,0]=2 323 B13R2.57 NCc1ccc2ccccc2c1 Amb7969859 [1,0,0,0,0,0|1,0,0]=2 324 B13R2.57 NCc1ccc2ccccc2n1 Amb1139476 [1,0,0,0,0,0|2,0,0]=3 325 B13R2.57 NCc1ccc2ccccc2n1 Amb15695438 [1,0,0,0,0,0|2,0,0]=3 326 B13R2.57 NCc1ccc2ccccc2n1 Amb7990033 [1,0,0,0,0,0|2,0,0]=3 327 B13R2.57 NCc1ccc2cccnc2c1 Amb16185723 [1,0,0,0,0,0|2,0,0]=3 328 B13R2.57 NCc1ccc2cccnc2c1 Amb21928073 [1,0,0,0,0,0|2,0,0]=3 329 B13R2.57 NCc1ccc2cccnc2n1 Amb8010532 [1,0,0,0,0,0|3,0,0]=4 330 B13R2.57 NCc1ccc2ccncc2c1 Amb8009846 [1,0,0,0,0,0|2,0,0]=3 331 B13R2.57 NCc1ccc2cnccc2c1 Amb22736520 [1,0,0,0,0,0|2,0,0]=3 332 B13R2.57 NCc1ccc2cnccc2c1 Amb33533285 [1,0,0,0,0,0|2,0,0]=3 333 B13R2.57 NCc1ccc2cnccc2n1 Amb25149929 [1,0,0,0,0,0|3,0,0]=4 334 B13R2.57 NCc1ccc2cncnc2c1 Amb8009755 [1,0,0,0,0,0|3,0,0]=4 335 B13R2.57 NCc1ccc2ncccc2c1 Amb10608799 [1,0,0,0,0,0|2,0,0]=3 336 B13R2.57 NCc1ccc2ncccc2c1 Amb10825274 [1,0,0,0,0,0|2,0,0]=3 337 B13R2.57 NCc1ccc2ncccc2c1 Amb1946047 [1,0,0,0,0,0|2,0,0]=3 338 B13R2.57 NCc1ccc2nccnc2c1 Amb22498126 [1,0,0,0,0,0|3,0,0]=4 339 B13R2.57 NCc1ccc2nccnc2c1 Amb8010534 [1,0,0,0,0,0|3,0,0]=4 340 B13R2.57 NCc1cnc2ccccc2c1 Amb10576326 [1,0,0,0,0,0|2,0,0]=3 341 B13R2.57 NCc1cnc2ccccc2c1 Amb17622269 [1,0,0,0,0,0|2,0,0]=3 342 B13R2.57 NCc1cnc2ccccc2c1 Amb33527281 [1,0,0,0,0,0|2,0,0]=3 343 B13R2.57 NCc1cnc2ccccc2c1 Amb33545553 [1,0,0,0,0,0|2,0,0]=3 344 B13R2.57 NCc1cnc2ccccc2n1 Amb22495299 [1,0,0,0,0,0|3,0,0]=4 345 B13R2.57 NCc1cnc2ccccc2n1 Amb9293987 [1,0,0,0,0,0|3,0,0]=4 346 B13R2.57 NCc1cnc2cccnc2c1 Amb32685158 [1,0,0,0,0,0|3,0,0]=4 347 B13R2.57 NCc1cnc2ccncc2c1 Amb27209078 [1,0,0,0,0,0|3,0,0]=4 348 B13R2.57 NCc1cnc2ncccc2c1 Amb8010530 [1,0,0,0,0,0|3,0,0]=4 349 B13R2.57 NCc1ncc2ccccc2n1 Amb18137485 [1,0,0,0,0,0|3,0,0]=4 350 B13R2.57 NNc1cc2ccccc2cn1 Amb5494121 [1,0,0,0,0,0|3,0,0]=4 351 B13R2.57 NNc1ccc2ccccc2c1 Amb1772358 [1,0,0,0,0,0|2,0,0]=3 352 B13R2.57 NNc1ccc2ccccc2c1 Amb6296513 [1,0,0,0,0,0|2,0,0]=3 353 B13R2.57 NNc1ccc2ccccc2n1 Amb1105542 [1,0,0,0,0,0|3,0,0]=4 354 B13R2.57 NNc1ccc2cccnc2c1 Amb18645204 [1,0,0,0,0,0|3,0,0]=4 355 B13R2.57 NNc1ccc2cccnc2c1 Amb22235093 [1,0,0,0,0,0|3,0,0]=4 356 B13R2.57 NNc1ccc2ccncc2c1 Amb24548856 [1,0,0,0,0,0|3,0,0]=4 357 B13R2.57 NNc1ccc2cnccc2c1 Amb10844883 [1,0,0,0,0,0|3,0,0]=4 358 B13R2.57 NNc1ccc2ncccc2c1 Amb18182419 [1,0,0,0,0,0|3,0,0]=4 359 B13R2.57 NNc1ccc2ncccc2c1 Amb21964376 [1,0,0,0,0,0|3,0,0]=4 360 B13R2.57 NNc1cnc2ccccc2c1 Amb18645202 [1,0,0,0,0,0|3,0,0]=4 361 B13R2.57 NNc1cnc2ccccc2c1 Amb28984102 [1,0,0,0,0,0|3,0,0]=4 362 B13R2.57 NOc1ccc2ncccc2c1 Amb24397483 [1,0,0,0,0,0|2,0,0]=3 363 B13R2.57 O=Cc1cc2ccccc2cn1 Amb8010573 [1,0,0,0,0,0|2,0,1]=4 364 B13R2.57 O=Cc1ccc2ccccc2c1 Amb3939951 [1,0,0,0,0,0|1,0,1]=3 365 B13R2.57 O=Cc1ccc2ccccc2n1 Amb533663 [1,0,0,0,0,0|2,0,1]=4 366 B13R2.57 O=Cc1ccc2cccnc2c1 Amb2548373 [1,0,0,0,0,0|2,0,1]=4 367 B13R2.57 O=Cc1ccc2ccncc2c1 Amb8010572 [1,0,0,0,0,0|2,0,1]=4 368 B13R2.57 O=Cc1ccc2cnccc2c1 Amb8010571 [1,0,0,0,0,0|2,0,1]=4 369 B13R2.57 O=Cc1ccc2ncccc2c1 Amb1266161 [1,0,0,0,0,0|2,0,1]=4 370 B13R2.57 O=Cc1cnc2ccccc2c1 Amb1995106 [1,0,0,0,0,0|2,0,1]=4 371 B13R2.57 O=Nc1ccc2ccccc2c1 Amb27170669 [1,0,0,0,0,0|2,0,0]=3 372 B13R2.57 OCC1=CNc2ccccc2N1 Amb24309070 [1,0,0,0,0,0|3,0,0]=4 373 B13R2.57 OCC1=Cc2ccccc2OC1 Amb2723365 [1,0,0,0,0,0|2,0,1]=4 374 B13R2.57 OCC1=Cc2ccccc2SS1 Amb27589744 [1,0,0,0,0,0|3,0,0]=4 375 B13R2.57 OCC1C=Cc2ccccc2O1 Amb27416664 [1,0,0,0,0,0|2,0,1]=4 376 B13R2.57 OCc1cc2ccccc2cn1 Amb8439028 [1,0,0,0,0,0|2,0,0]=3 377 B13R2.57 OCc1ccc2ccccc2c1 Amb2389960 [1,0,0,0,0,0|1,0,0]=2 378 B13R2.57 OCc1ccc2ccccc2n1 Amb1154605 [1,0,0,0,0,0|2,0,0]=3 379 B13R2.57 OCc1ccc2cccnc2c1 Amb19105058 [1,0,0,0,0,0|2,0,0]=3 380 B13R2.57 OCc1ccc2cccnc2n1 Amb28076129 [1,0,0,0,0,0|3,0,0]=4 381 B13R2.57 OCc1ccc2ccncc2c1 Amb19104916 [1,0,0,0,0,0|2,0,0]=3 382 B13R2.57 OCc1ccc2cnccc2c1 Amb10070398 [1,0,0,0,0,0|2,0,0]=3 383 B13R2.57 OCc1ccc2ncccc2c1 Amb1995120 [1,0,0,0,0,0|2,0,0]=3 384 B13R2.57 OCc1ccc2ncccc2n1 Amb27166704 [1,0,0,0,0,0|3,0,0]=4 385 B13R2.57 OCc1ccc2nccnc2c1 Amb13890528 [1,0,0,0,0,0|3,0,0]=4 386 B13R2.57 OCc1ccc2nnccc2c1 Amb24496368 [1,0,0,0,0,0|3,0,0]=4 387 B13R2.57 OCc1cnc2ccccc2c1 Amb1995109 [1,0,0,0,0,0|2,0,0]=3 388 B13R2.57 OCc1cnc2ccccc2c1 Amb20668047 [1,0,0,0,0,0|2,0,0]=3 389 B13R2.57 OCc1cnc2ccccc2n1 Amb33532423 [1,0,0,0,0,0|3,0,0]=4 390 B13R2.57 OCc1cnc2cccnc2c1 Amb21959456 [1,0,0,0,0,0|3,0,0]=4 391 B13R2.57 OCc1cnc2ncccc2c1 Amb25068002 [1,0,0,0,0,0|3,0,0]=4 392 B13R2.57 SCc1ccc2ccccc2c1 Amb21943705 [1,0,0,0,0,0|1,0,0]=2 393 B13R2.57 SCc1ccc2ccccc2n1 Amb28200238 [1,0,0,0,0,0|2,0,0]=3 394 B13R2.57 SCc1ccc2cccnc2c1 Amb32878081 [1,0,0,0,0,0|2,0,0]=3 395 B13R2.57 SCc1ccc2cnccc2c1 Amb32788552 [1,0,0,0,0,0|2,0,0]=3 396 B13R2.57 SCc1ccc2ncccc2c1 Amb26634583 [1,0,0,0,0,0|2,0,0]=3 397 B13R2.57 SCc1cnc2ccccc2c1 Amb25083301 [1,0,0,0,0,0|2,0,0]=3 398 B13R2.57 SCc1cnc2ccccc2n1 Amb32788758 [1,0,0,0,0,0|3,0,0]=4 399 B13R2.57 [C-]#[N+]c1ccc2ccccc2c1 Amb22348022 [1,0,0,0,0,0|1,0,1]=3 400 B13R2.57 [C-]#[N+]c1ccc2ccccc2n1 Amb33200400 [1,0,0,0,0,0|2,0,1]=4 401 B13R2.57 [C-]#[N+]c1ccc2cccnc2c1 Amb32880579 [1,0,0,0,0,0|2,0,1]=4 402 B13R2.57 [C-]#[N+]c1ccc2ncccc2c1 Amb26440687 [1,0,0,0,0,0|2,0,1]=4 403 B13R2.57 [C-]#[N+]c1cnc2ccccc2c1 Amb25320374 [1,0,0,0,0,0|2,0,1]=4 404 B15R2.352 BrCC#Cc1ccc2ncccc2c1 Amb27463493 [0,1,0,0,0,0|2,0,1]=4 405 B15R2.352 BrCCCc1ccc2ccccc2c1 Amb26339538 [0,1,0,0,0,0|1,0,0]=2 406 B15R2.352 BrCCCc1ccc2ccccc2n1 Amb33038200 [0,1,0,0,0,0|2,0,0]=3 407 B15R2.352 BrCCCc1ccc2cccnc2c1 Amb27417919 [0,1,0,0,0,0|2,0,0]=3 408 B15R2.352 BrCCCc1ccc2ncccc2c1 Amb24556548 [0,1,0,0,0,0|2,0,0]=3 409 B15R2.352 BrCCCc1cnc2ccccc2c1 Amb26862798 [0,1,0,0,0,0|2,0,0]=3 410 B15R2.352 BrCCCc1cnc2ccccc2n1 Amb33477468 [0,1,0,0,0,0|3,0,0]=4 411 B15R2.352 BrCCOc1ccc2ccccc2c1 Amb2610625 [0,1,0,0,0,0|0,0,0]=1 412 B15R2.352 BrCCOc1ccc2ccncc2c1 Amb24410986 [0,1,0,0,0,0|1,0,0]=2 413 B15R2.352 BrCCOc1ccc2ncccc2c1 Amb17262598 [0,1,0,0,0,0|1,0,0]=2 414 B15R2.352 BrCCSc1ccc2ccccc2n1 Amb27824842 [0,1,0,0,0,0|1,1,0]=3 415 B15R2.352 C#CCCc1ccc2ccccc2c1 Amb33362144 [0,1,0,0,0,0|1,0,1]=3 416 B15R2.352 C#CCCc1ccc2ccccc2n1 Amb33201077 [0,1,0,0,0,0|2,0,1]=4 417 B15R2.352 C#CCCc1ccc2cccnc2c1 Amb32878557 [0,1,0,0,0,0|2,0,1]=4 418 B15R2.352 C#CCCc1ccc2ncccc2c1 Amb33148380 [0,1,0,0,0,0|2,0,1]=4 419 B15R2.352 C#CCCc1cnc2ccccc2c1 Amb33323569 [0,1,0,0,0,0|2,0,1]=4 420 B15R2.352 C#CCNc1ccc2ccccc2n1 Amb18187137 [0,1,0,0,0,0|2,0,1]=4 421 B15R2.352 C#CCOc1ccc2ccccc2c1 Amb3836118 [0,1,0,0,0,0|0,0,1]=2 422 B15R2.352 C#CCOc1ccc2ncccc2c1 Amb24560031 [0,1,0,0,0,0|1,0,1]=3 423 B15R2.352 C=CCCc1ccc2ccccc2c1 Amb6299564 [0,1,0,0,0,0|1,0,1]=3 424 B15R2.352 C=CCCc1ccc2cccnc2c1 Amb35710867 [0,1,0,0,0,0|2,0,1]=4 425 B15R2.352 C=CCCc1ccc2cnccc2c1 Amb35710866 [0,1,0,0,0,0|2,0,1]=4 426 B15R2.352 C=CCCc1ccc2ncccc2c1 Amb35710719 [0,1,0,0,0,0|2,0,1]=4 427 B15R2.352 C=CCCc1cnc2ccccc2c1 Amb35710856 [0,1,0,0,0,0|2,0,1]=4 428 B15R2.352 C=CCNc1ccc2ccccc2c1 Amb18322577 [0,1,0,0,0,0|1,0,1]=3 429 B15R2.352 C=CCNc1cnc2ccccc2c1 Amb27814266 [0,1,0,0,0,0|2,0,1]=4 430 B15R2.352 C=CCOc1cc2ccccc2cn1 Amb27849143 [0,1,0,0,0,0|1,0,1]=3 431 B15R2.352 C=CCOc1ccc2ccccc2c1 Amb3836124 [0,1,0,0,0,0|0,0,1]=2 432 B15R2.352 C=CCOc1ccc2cccnc2c1 Amb27968130 [0,1,0,0,0,0|1,0,1]=3 433 B15R2.352 C=CCOc1ccc2cccnc2n1 Amb27237981 [0,1,0,0,0,0|2,0,1]=4 434 B15R2.352 C=CCOc1ccc2ncccc2c1 Amb27258974 [0,1,0,0,0,0|1,0,1]=3 435 B15R2.352 C=CCSc1ccc2ccccc2c1 Amb25676759 [0,1,0,0,0,0|0,1,1]=3 436 B15R2.352 C=CCSc1ccc2ccccc2n1 Amb27779275 [0,1,0,0,0,0|1,1,1]=4 437 B15R2.352 CCCCc1ccc2ccccc2c1 Amb9787702 [0,1,0,0,0,0|1,0,0]=2 438 B15R2.352 CCCCc1ccc2ccccc2n1 Amb4012109 [0,1,0,0,0,0|2,0,0]=3 439 B15R2.352 CCCCc1cnc2ccccc2c1 Amb27830570 [0,1,0,0,0,0|2,0,0]=3 440 B15R2.352 CCCOc1ccc2ccccc2c1 Amb4011084 [0,1,0,0,0,0|0,0,0]=1 441 B15R2.352 CCCOc1ccc2ccccc2n1 Amb20171237 [0,1,0,0,0,0|1,0,0]=2 442 B15R2.352 CCNCc1cc2ccccc2cn1 Amb25116683 [0,1,0,0,0,0|2,0,0]=3 443 B15R2.352 CCNCc1ccc2ccccc2c1 Amb6266033 [0,1,0,0,0,0|1,0,0]=2 444 B15R2.352 CCNCc1ccc2ccccc2n1 Amb19373560 [0,1,0,0,0,0|2,0,0]=3 445 B15R2.352 CCNCc1ccc2ccccc2n1 Amb6742542 [0,1,0,0,0,0|2,0,0]=3 446 B15R2.352 CCNCc1ccc2cccnc2c1 Amb28062622 [0,1,0,0,0,0|2,0,0]=3 447 B15R2.352 CCNCc1ccc2cccnc2n1 Amb35640744 [0,1,0,0,0,0|3,0,0]=4 448 B15R2.352 CCNCc1ccc2cnccc2c1 Amb27979430 [0,1,0,0,0,0|2,0,0]=3 449 B15R2.352 CCNCc1ccc2ncccc2c1 Amb1995119 [0,1,0,0,0,0|2,0,0]=3 450 B15R2.352 CCNCc1cnc2ccccc2c1 Amb1995113 [0,1,0,0,0,0|2,0,0]=3 451 B15R2.352 CCNSc1ccc2ccccc2n1 Amb27854234 [0,1,0,0,0,0|1,1,0]=3 452 B15R2.352 CCOCc1cc2ccccc2cn1 Amb28436269 [0,1,0,0,0,0|1,0,0]=2 453 B15R2.352 CCOCc1cnc2ccccc2n1 Amb27843681 [0,1,0,0,0,0|2,0,0]=3 454 B15R2.352 CNCCc1ccc2ccccc2c1 Amb8853663 [0,1,0,0,0,0|1,0,0]=2 455 B15R2.352 CNCCc1ccc2ccccc2n1 Amb18299521 [0,1,0,0,0,0|2,0,0]=3 456 B15R2.352 CNCCc1ccc2ccccc2n1 Amb32671506 [0,1,0,0,0,0|2,0,0]=3 457 B15R2.352 CNCCc1ccc2cccnc2c1 Amb26876872 [0,1,0,0,0,0|2,0,0]=3 458 B15R2.352 CNCCc1ccc2ncccc2c1 Amb18299522 [0,1,0,0,0,0|2,0,0]=3 459 B15R2.352 CNCCc1cnc2ccccc2c1 Amb18993609 [0,1,0,0,0,0|2,0,0]=3 460 B15R2.352 CNCCc1cnc2ccccc2n1 Amb25300763 [0,1,0,0,0,0|3,0,0]=4 461 B15R2.352 CNCCc1ncc2ccccc2n1 Amb27660830 [0,1,0,0,0,0|3,0,0]=4 462 B15R2.352 COCCc1cc2ccccc2cn1 Amb27446024 [0,1,0,0,0,0|2,0,0]=3 463 B15R2.352 COCOc1ccc2ccccc2n1 Amb28066084 [0,1,0,0,0,0|1,0,0]=2 464 B15R2.352 CONCc1ccc2ccccc2n1 Amb27213147 [0,1,0,0,0,0|3,0,0]=4 465 B15R2.352 CO\C=C\c1ccc2ccccc2c1 Amb27801069 [0,1,0,0,0,0|1,0,1]=3 466 B15R2.352 CO\C=C\c1cnc2ccccc2c1 Amb27959176 [0,1,0,0,0,0|2,0,1]=4 467 B15R2.352 CO\N=C\c1cnc2ccccc2c1 Amb27246701 [0,1,0,0,0,0|3,0,0]=4 468 B15R2.352 C\C=N\Nc1ccc2ccccc2n1 Amb27634591 [0,1,0,0,0,0|2,0,1]=4 469 B15R2.352 ClCC#Cc1ccc2ccccc2c1 Amb18320509 [0,1,0,0,0,0|1,0,1]=3 470 B15R2.352 ClCC#Cc1ccc2cccnc2c1 Amb27968781 [0,1,0,0,0,0|2,0,1]=4 471 B15R2.352 ClCC#Cc1cnc2ccccc2c1 Amb27958541 [0,1,0,0,0,0|2,0,1]=4 472 B15R2.352 ClCCCc1ccc2ccccc2c1 Amb27181357 [0,1,0,0,0,0|1,0,0]=2 473 B15R2.352 ClCCCc1ccc2ccccc2n1 Amb28293470 [0,1,0,0,0,0|2,0,0]=3 474 B15R2.352 ClCCCc1ncc2ccccc2n1 Amb27194807 [0,1,0,0,0,0|3,0,0]=4 475 B15R2.352 ClCCNc1ccc2ccccc2n1 Amb27247812 [0,1,0,0,0,0|2,0,0]=3 476 B15R2.352 ClCCOc1ccc2ccccc2c1 Amb8828442 [0,1,0,0,0,0|0,0,0]=1 477 B15R2.352 ClCCOc1ccc2ncccc2c1 Amb17239671 [0,1,0,0,0,0|1,0,0]=2 478 B15R2.352 ClCCSc1ccc2ccccc2c1 Amb9250177 [0,1,0,0,0,0|0,1,0]=2 479 B15R2.352 ClCCSc1cnc2ccccc2n1 Amb27169603 [0,1,0,0,0,0|2,1,0]=4 480 B15R2.352 ClC\C=C\c1ccc2ccccc2c1 Amb27462981 [0,1,0,0,0,0|1,0,1]=3 481 B15R2.352 FCCNc1ccc2ccccc2n1 Amb27251247 [0,1,0,0,0,0|2,0,0]=3 482 B15R2.352 FCCNc1ncc2ccccc2n1 Amb27412181 [0,1,0,0,0,0|3,0,0]=4 483 B15R2.352 FCCOc1ccc2ccccc2c1 Amb24562684 [0,1,0,0,0,0|0,0,0]=1 484 B15R2.352 ICCOc1ccc2ccccc2c1 Amb28454505 [0,1,0,0,0,0|0,0,0]=1 485 B15R2.352 IC\C=C\c1cnc2ccccc2c1 Amb28286884 [0,1,0,0,0,0|2,0,1]=4 486 B15R2.352 N#CC#Cc1ccc2ccccc2c1 Amb27194261 [0,1,0,0,0,0|1,0,2]=4 487 B15R2.352 N#CCCc1cc2ccccc2cn1 Amb25167726 [0,1,0,0,0,0|2,0,1]=4 488 B15R2.352 N#CCCc1ccc2ccccc2c1 Amb18648520 [0,1,0,0,0,0|1,0,1]=3 489 B15R2.352 N#CCCc1ccc2cccnc2c1 Amb33079191 [0,1,0,0,0,0|2,0,1]=4 490 B15R2.352 N#CCCc1ccc2ncccc2c1 Amb25183017 [0,1,0,0,0,0|2,0,1]=4 491 B15R2.352 N#CCCc1cnc2ccccc2c1 Amb24517038 [0,1,0,0,0,0|2,0,1]=4 492 B15R2.352 N#CCOc1ccc2ccccc2c1 Amb1395353 [0,1,0,0,0,0|0,0,1]=2 493 B15R2.352 N#CCOc1ccc2cccnc2c1 Amb25106805 [0,1,0,0,0,0|1,0,1]=3 494 B15R2.352 N#CCOc1ccc2ncccc2c1 Amb27778033 [0,1,0,0,0,0|1,0,1]=3 495 B15R2.352 N#CCOc1cnc2ccccc2c1 Amb27171186 [0,1,0,0,0,0|1,0,1]=3 496 B15R2.352 N#CCSc1ccc2ccccc2c1 Amb2724410 [0,1,0,0,0,0|0,1,1]=3 497 B15R2.352 NCC#Cc1ccc2cnccc2c1 Amb27765567 [0,1,0,0,0,0|2,0,1]=4 498 B15R2.352 NCCCc1cc2ccccc2nn1 Amb27666039 [0,1,0,0,0,0|3,0,0]=4 499 B15R2.352 NCCCc1ccc2ccccc2c1 Amb18981387 [0,1,0,0,0,0|1,0,0]=2 500 B15R2.352 NCCCc1ccc2ccccc2n1 Amb17578461 [0,1,0,0,0,0|2,0,0]=3 501 B15R2.352 NCCCc1ccc2cccnc2c1 Amb19105229 [0,1,0,0,0,0|2,0,0]=3 502 B15R2.352 NCCCc1ccc2cnccc2c1 Amb18353532 [0,1,0,0,0,0|2,0,0]=3 503 B15R2.352 NCCCc1ccc2ncccc2c1 Amb18224815 [0,1,0,0,0,0|2,0,0]=3 504 B15R2.352 NCCCc1ccc2nccnc2c1 Amb18562187 [0,1,0,0,0,0|3,0,0]=4 505 B15R2.352 NCCCc1cnc2ccccc2c1 Amb28046797 [0,1,0,0,0,0|2,0,0]=3 506 B15R2.352 NCCCc1cnc2ccccc2n1 Amb18981397 [0,1,0,0,0,0|3,0,0]=4 507 B15R2.352 NCCNc1ccc2ccccc2c1 Amb18992219 [0,1,0,0,0,0|1,0,0]=2 508 B15R2.352 NCCNc1ccc2ccccc2n1 Amb33526502 [0,1,0,0,0,0|2,0,0]=3 509 B15R2.352 NCCNc1ccc2ccccc2n1 Amb33552829 [0,1,0,0,0,0|2,0,0]=3 510 B15R2.352 NCCNc1ccc2cccnc2c1 Amb28186771 [0,1,0,0,0,0|2,0,0]=3 511 B15R2.352 NCCNc1ccc2nccnc2c1 Amb27650816 [0,1,0,0,0,0|3,0,0]=4 512 B15R2.352 NCCOc1ccc2ccccc2c1 Amb1069042 [0,1,0,0,0,0|0,0,0]=1 513 B15R2.352 NCCOc1ccc2ccccc2c1 Amb6859385 [0,1,0,0,0,0|0,0,0]=1 514 B15R2.352 NCCOc1ccc2ccccc2n1 Amb18296487 [0,1,0,0,0,0|1,0,0]=2 515 B15R2.352 NCCOc1ccc2cccnc2c1 Amb19107899 [0,1,0,0,0,0|1,0,0]=2 516 B15R2.352 NCCOc1ccc2ccncc2c1 Amb18355016 [0,1,0,0,0,0|1,0,0]=2 517 B15R2.352 NCCOc1ccc2ncccc2c1 Amb19107900 [0,1,0,0,0,0|1,0,0]=2 518 B15R2.352 NCCOc1ccc2ncccc2c1 Amb32662376 [0,1,0,0,0,0|1,0,0]=2 519 B15R2.352 NCCOc1ccc2nccnc2c1 Amb17513109 [0,1,0,0,0,0|2,0,0]=3 520 B15R2.352 NCCOc1ccc2nccnc2n1 Amb27256747 [0,1,0,0,0,0|3,0,0]=4 521 B15R2.352 NCCOc1cnc2ccccc2c1 Amb25701399 [0,1,0,0,0,0|1,0,0]=2 522 B15R2.352 NCCOc1cnc2ccccc2n1 Amb18297203 [0,1,0,0,0,0|2,0,0]=3 523 B15R2.352 NCCSc1ccc2ccncc2c1 Amb27234700 [0,1,0,0,0,0|1,1,0]=3 524 B15R2.352 NC\C=C\c1ccc2ccccc2c1 Amb33474972 [0,1,0,0,0,0|1,0,1]=3 525 B15R2.352 NC\C=C\c1ccc2ccccc2n1 Amb33448946 [0,1,0,0,0,0|2,0,1]=4 526 B15R2.352 NC\C=C\c1ccc2cccnc2c1 Amb32878858 [0,1,0,0,0,0|2,0,1]=4 527 B15R2.352 NC\C=C\c1ccc2ncccc2c1 Amb33448605 [0,1,0,0,0,0|2,0,1]=4 528 B15R2.352 NC\C=C\c1cnc2ccccc2c1 Amb33323968 [0,1,0,0,0,0|2,0,1]=4 529 B15R2.352 NNCCc1ccc2ccccc2c1 Amb6249538 [0,1,0,0,0,0|2,0,0]=3 530 B15R2.352 NOCCc1ccc2ccccc2c1 Amb33362171 [0,1,0,0,0,0|2,0,0]=3 531 B15R2.352 NOCCc1ccc2ccccc2n1 Amb26572113 [0,1,0,0,0,0|3,0,0]=4 532 B15R2.352 NOCCc1ccc2cccnc2c1 Amb27625302 [0,1,0,0,0,0|3,0,0]=4 533 B15R2.352 NOCCc1ccc2ncccc2c1 Amb27186213 [0,1,0,0,0,0|3,0,0]=4 534 B15R2.352 NOCCc1cnc2ccccc2c1 Amb25906706 [0,1,0,0,0,0|3,0,0]=4 535 B15R2.352 O=C=NCc1ccc2ccccc2c1 Amb24405612 [0,1,0,0,0,0|2,0,1]=4 536 B15R2.352 O=CC#Cc1ccc2ccccc2c1 Amb27873476 [0,1,0,0,0,0|1,0,2]=4 537 B15R2.352 O=CCCc1ccc2ccccc2c1 Amb25784867 [0,1,0,0,0,0|1,0,1]=3 538 B15R2.352 O=CCCc1ccc2ccccc2n1 Amb25355386 [0,1,0,0,0,0|2,0,1]=4 539 B15R2.352 O=CCCc1ccc2cccnc2c1 Amb25738385 [0,1,0,0,0,0|2,0,1]=4 540 B15R2.352 O=CCCc1cnc2ccccc2c1 Amb33546161 [0,1,0,0,0,0|2,0,1]=4 541 B15R2.352 O=CCNc1cnc2ccccc2c1 Amb28123742 [0,1,0,0,0,0|2,0,1]=4 542 B15R2.352 O=CCOc1ccc2ccccc2c1 Amb5731849 [0,1,0,0,0,0|0,0,1]=2 543 B15R2.352 O=CCSc1ccc2ccccc2c1 Amb26331085 [0,1,0,0,0,0|0,1,1]=3 544 B15R2.352 O=CCSc1ccc2ccccc2n1 Amb25781987 [0,1,0,0,0,0|1,1,1]=4 545 B15R2.352 O=CCSc1ccc2ncccc2c1 Amb27773061 [0,1,0,0,0,0|1,1,1]=4 546 B15R2.352 O=C\C=C\c1ccc2ccccc2c1 Amb33359232 [0,1,0,0,0,0|1,0,2]=4 547 B15R2.352 OCC#Cc1ccc2ccccc2n1 Amb27228829 [0,1,0,0,0,0|2,0,1]=4 548 B15R2.352 OCC#Cc1ccc2cccnc2c1 Amb27763263 [0,1,0,0,0,0|2,0,1]=4 549 B15R2.352 OCC#Cc1ccc2cnccc2c1 Amb28128229 [0,1,0,0,0,0|2,0,1]=4 550 B15R2.352 OCC#Cc1ccc2ncccc2c1 Amb27451107 [0,1,0,0,0,0|2,0,1]=4 551 B15R2.352 OCC#Cc1cnc2ccccc2c1 Amb544270 [0,1,0,0,0,0|2,0,1]=4 552 B15R2.352 OCCCC1C=Cc2ccccc2O1 Amb28345418 [0,1,0,0,0,0|2,0,1]=4 553 B15R2.352 OCCCc1ccc2ccccc2c1 Amb24401038 [0,1,0,0,0,0|1,0,0]=2 554 B15R2.352 OCCCc1ccc2ccccc2n1 Amb20669490 [0,1,0,0,0,0|2,0,0]=3 555 B15R2.352 OCCCc1ccc2cccnc2c1 Amb27810853 [0,1,0,0,0,0|2,0,0]=3 556 B15R2.352 OCCCc1ccc2cccnc2n1 Amb25711197 [0,1,0,0,0,0|3,0,0]=4 557 B15R2.352 OCCCc1ccc2ncccc2c1 Amb25113929 [0,1,0,0,0,0|2,0,0]=3 558 B15R2.352 OCCCc1cnc2ccccc2c1 Amb25365615 [0,1,0,0,0,0|2,0,0]=3 559 B15R2.352 OCCCc1cnc2ccccc2n1 Amb25209430 [0,1,0,0,0,0|3,0,0]=4 560 B15R2.352 OCCNc1cc2ccccc2cn1 Amb27230356 [0,1,0,0,0,0|2,0,0]=3 561 B15R2.352 OCCNc1ccc2ccccc2n1 Amb2618112 [0,1,0,0,0,0|2,0,0]=3 562 B15R2.352 OCCNc1ccc2ncccc2c1 Amb18933592 [0,1,0,0,0,0|2,0,0]=3 563 B15R2.352 OCCNc1cnc2ccccc2c1 Amb18270518 [0,1,0,0,0,0|2,0,0]=3 564 B15R2.352 OCCOc1ccc2ccccc2c1 Amb4034898 [0,1,0,0,0,0|0,0,0]=1 565 B15R2.352 OCCOc1ccc2ccccc2n1 Amb27981845 [0,1,0,0,0,0|1,0,0]=2 566 B15R2.352 OCCOc1ccc2ccncc2c1 Amb26891029 [0,1,0,0,0,0|1,0,0]=2 567 B15R2.352 OCCOc1ccc2ncccc2c1 Amb17105029 [0,1,0,0,0,0|1,0,0]=2 568 B15R2.352 OCCOc1cnc2ccccc2n1 Amb2445501 [0,1,0,0,0,0|2,0,0]=3 569 B15R2.352 OC\C=C\c1ccc2ccccc2c1 Amb33080350 [0,1,0,0,0,0|1,0,1]=3 570 B15R2.352 OC\C=C\c1ccc2ccccc2n1 Amb28396949 [0,1,0,0,0,0|2,0,1]=4 571 B15R2.352 OC\C=C\c1ccc2cccnc2c1 Amb32878859 [0,1,0,0,0,0|2,0,1]=4 572 B15R2.352 OC\C=C\c1ccc2ncccc2c1 Amb33224098 [0,1,0,0,0,0|2,0,1]=4 573 B15R2.352 OC\C=C\c1cnc2ccccc2c1 Amb33079575 [0,1,0,0,0,0|2,0,1]=4 574 B15R2.352 S=C=NCc1ccc2ccccc2c1 Amb27949940 [0,1,0,0,0,0|2,0,1]=4 575 B15R2.352 SCCCc1ccc2ccccc2c1 Amb31132725 [0,1,0,0,0,0|1,0,0]=2 576 B15R2.352 SCCCc1ccc2ccccc2n1 Amb33201029 [0,1,0,0,0,0|2,0,0]=3 577 B15R2.352 SCCCc1ccc2cccnc2c1 Amb32878077 [0,1,0,0,0,0|2,0,0]=3 578 B15R2.352 SCCCc1ccc2ncccc2c1 Amb27776894 [0,1,0,0,0,0|2,0,0]=3 579 B15R2.352 SCCCc1cnc2ccccc2c1 Amb33319773 [0,1,0,0,0,0|2,0,0]=3 580 B15R2.352 SCCCc1cnc2ccccc2n1 Amb33378879 [0,1,0,0,0,0|3,0,0]=4 581 B15R2.352 SCCOc1ccc2ccccc2c1 Amb17238164 [0,1,0,0,0,0|0,0,0]=1 582 B15R2.352 SCCOc1ccc2cccnc2c1 Amb27824036 [0,1,0,0,0,0|1,0,0]=2 583 B15R2.352 SCCOc1ccc2ncccc2c1 Amb17238467 [0,1,0,0,0,0|1,0,0]=2 584 B15R2.352 [C-]#[N+]CCc1ccc2ccccc2c1 Amb33362176 [0,1,0,0,0,0|1,0,1]=3 585 B15R2.352 [C-]#[N+]CCc1ccc2ccccc2n1 Amb33201644 [0,1,0,0,0,0|2,0,1]=4 586 B15R2.352 [C-]#[N+]CCc1ccc2cccnc2c1 Amb32879192 [0,1,0,0,0,0|2,0,1]=4 587 B15R2.352 [C-]#[N+]CCc1ccc2ncccc2c1 Amb33143300 [0,1,0,0,0,0|2,0,1]=4 588 B15R2.352 [C-]#[N+]CCc1cnc2ccccc2c1 Amb33324495 [0,1,0,0,0,0|2,0,1]=4 589 B15R2.352 [N-]=[N+]=NCc1ccc2ccccc2c1 Amb22411019 [0,1,0,0,0,0|3,0,0]=4 590 B15R2.886 CCCC1=CC(=O)c2ccccc2N1 Amb19046468 [0,1,0,0,0,0|2,0,0]=3 591 B15R2.886 CCCC1=Cc2ccccc2C(=O)O1 Amb28195300 [0,1,0,0,0,0|2,0,0]=3 592 B15R2.886 CCCC1=Nc2ccccc2C(=O)N1 Amb20036216 [0,1,0,0,0,0|3,0,0]=4 593 B15R2.886 CCCC1=Nc2ccccc2C(=O)O1 Amb21912814 [0,1,0,0,0,0|3,0,0]=4 594 B15R2.886 CCCc1cc(Br)c2ncccc2c1 Amb28051524 [0,1,0,0,0,0|2,0,0]=3 595 B15R2.886 CCCc1cc(Cl)c2ccccc2n1 Amb9533773 [0,1,0,0,0,0|2,0,0]=3 596 B15R2.886 CCCc1cc(N)c2ccccc2n1 Amb10240884 [0,1,0,0,0,0|2,0,0]=3 597 B15R2.886 CCCc1cc(O)c2ccccc2n1 Amb9134494 [0,1,0,0,0,0|2,0,0]=3 598 B15R2.886 CCCc1cc2ccccc2c(Cl)n1 Amb27442044 [0,1,0,0,0,0|2,0,0]=3 599 B15R2.886 CCCc1nc(Br)c2ccccc2n1 Amb20618761 [0,1,0,0,0,0|3,0,0]=4 600 B15R2.886 CCCc1nc(Cl)c2ccccc2n1 Amb20412846 [0,1,0,0,0,0|3,0,0]=4 601 B15R2.886 CCCc1nc(N)c2ccccc2n1 Amb18649649 [0,1,0,0,0,0|3,0,0]=4 602 B15R2.886 CCCc1nc(O)c2ccccc2n1 Amb18649928 [0,1,0,0,0,0|3,0,0]=4 603 B15R2.886 CCNC1=CC(=O)N2C=CC=CC2=N1 Amb28250624 [0,1,0,0,0,0|3,0,0]=4 604 B15R2.886 CCNC1=CC(=O)c2ccccc2O1 Amb28408793 [0,1,0,0,0,0|2,0,0]=3 605 B15R2.886 CCNc1nc(N)c2ccccc2n1 Amb27210104 [0,1,0,0,0,0|3,0,0]=4 606 B15R2.886 CCOC1=Cc2ccccc2C(=O)N1 Amb27827793 [0,1,0,0,0,0|1,0,0]=2 607 B15R2.886 CCOC1=Nc2ccccc2C(=O)N1 Amb21948875 [0,1,0,0,0,0|2,0,0]=3 608 B15R2.886 CCOC1=Nc2ccccc2C(=O)O1 Amb21927635 [0,1,0,0,0,0|2,0,0]=3 609 B15R2.886 CCOC1=Nc2ncccc2C(=O)N1 Amb28121839 [0,1,0,0,0,0|3,0,0]=4 610 B15R2.886 CCOc1cc(Br)c2ccccc2n1 Amb8438954 [0,1,0,0,0,0|1,0,0]=2 611 B15R2.886 CCOc1cc(C)c2ccccc2c1 Amb28200879 [0,1,0,0,0,0|0,0,0]=1 612 B15R2.886 CCOc1cc(Cl)c2ccccc2n1 Amb2615483 [0,1,0,0,0,0|1,0,0]=2 613 B15R2.886 CCOc1cc(N)c2ccccc2n1 Amb18649921 [0,1,0,0,0,0|1,0,0]=2 614 B15R2.886 CCOc1cc(N)c2ncccc2c1 Amb22899686 [0,1,0,0,0,0|1,0,0]=2 615 B15R2.886 CCOc1cc(O)c2ccccc2n1 Amb18650121 [0,1,0,0,0,0|1,0,0]=2 616 B15R2.886 CCOc1cc2ccccc2c(C)n1 Amb27983298 [0,1,0,0,0,0|1,0,0]=2 617 B15R2.886 CCOc1cc2cccnc2c(N)n1 Amb17594917 [0,1,0,0,0,0|2,0,0]=3 618 B15R2.886 CCOc1cc2cnccc2c(N)n1 Amb17594916 [0,1,0,0,0,0|2,0,0]=3 619 B15R2.886 CCOc1nc(Cl)c2ccccc2n1 Amb28135820 [0,1,0,0,0,0|2,0,0]=3 620 B15R2.886 CCSC1=NC(=O)c2ccccc2N1 Amb21997312 [0,1,0,0,0,0|2,1,0]=4 621 B15R2.886 CCSc1cc(C)c2ccccc2n1 Amb27491776 [0,1,0,0,0,0|1,1,0]=3 622 B15R2.886 CCSc1cc(O)c2ccccc2c1 Amb28122351 [0,1,0,0,0,0|0,1,0]=2 623 B15R2.886 CCSc1nc(Cl)c2ccccc2n1 Amb5382052 [0,1,0,0,0,0|2,1,0]=4 624 B15R2.886 CC\N=C1\NC(=O)c2ccccc2S1 Amb26954787 [0,1,0,0,0,0|3,0,0]=4 625 B15R2.886 CNCc1cc(C)c2ccccc2n1 Amb27750779 [0,1,0,0,0,0|3,0,0]=4 626 B15R2.886 COCC1=CC(=O)c2ccccc2N1 Amb18327743 [0,1,0,0,0,0|3,0,0]=4 627 B15R2.886 COCc1cc(Cl)c2ccccc2n1 Amb27806502 [0,1,0,0,0,0|3,0,0]=4 628 B15R2.886 COCc1cc(O)c2ccccc2c1 Amb27612819 [0,1,0,0,0,0|2,0,0]=3 629 B15R2.886 C\C=C\C1=Cc2ccccc2C(=O)N1 Amb27843591 [0,1,0,0,0,0|2,0,1]=4 630 B15R2.886 C\C=C\c1cc(N)c2ccccc2n1 Amb27386865 [0,1,0,0,0,0|2,0,1]=4 631 B15R2.886 Cc1cc(CC#N)cc2ccccc12 Amb26522351 [0,1,0,0,0,0|2,0,1]=4 632 B15R2.886 Cc1cc(CCN)cc2cccnc12 Amb18353267 [0,1,0,0,0,0|3,0,0]=4 633 B15R2.886 Cc1cc(CCO)nc2ccccc12 Amb24672473 [0,1,0,0,0,0|3,0,0]=4 634 B15R2.886 Cc1cc(SCCl)nc2ccccc12 Amb27824843 [0,1,0,0,0,0|2,1,0]=4 635 B15R2.886 Cc1nc(CCN)cc2ccccc12 Amb24405896 [0,1,0,0,0,0|3,0,0]=4 636 B15R2.886 Clc1nc(CCBr)cc2ccccc12 Amb33431649 [0,1,0,0,0,0|3,0,0]=4 637 B15R2.886 N#CCc1cc(Br)c2ccccc2c1 Amb22263703 [0,1,0,0,0,0|2,0,1]=4 638 B15R2.886 N#CCc1cc(F)c2ccccc2c1 Amb27243891 [0,1,0,0,0,0|2,0,1]=4 639 B15R2.886 N#CCc1cc(N)c2ccccc2c1 Amb25835329 [0,1,0,0,0,0|2,0,1]=4 640 B15R2.886 O=C1NC(CCO)=Cc2ccccc21 Amb27872166 [0,1,0,0,0,0|3,0,0]=4 641 B15R2.886 O=C1OC(CCO)=Cc2ccccc21 Amb27651846 [0,1,0,0,0,0|3,0,0]=4 642 B15R2.888 CC#CC1=Cc2ccccc2OC1=O Amb27971157 [0,1,0,0,0,0|2,0,1]=4 643 B15R2.888 CCCC1=Cc2ccccc2NC1=O Amb28058881 [0,1,0,0,0,0|2,0,0]=3 644 B15R2.888 CCCC1=Cc2ccccc2OC1=O Amb27962546 [0,1,0,0,0,0|2,0,0]=3 645 B15R2.888 CCCc1cc2ccccc2cc1Br Amb32650450 [0,1,0,0,0,0|1,0,0]=2 646 B15R2.888 CCCc1cc2ccccc2cc1Cl Amb32650451 [0,1,0,0,0,0|1,0,0]=2 647 B15R2.888 CCCc1cc2ccccc2cc1O Amb27612777 [0,1,0,0,0,0|1,0,0]=2 648 B15R2.888 CCCc1cc2ccccc2nc1C Amb27263662 [0,1,0,0,0,0|2,0,0]=3 649 B15R2.888 CCCc1cc2ccccc2nc1Cl Amb27391943 [0,1,0,0,0,0|2,0,0]=3 650 B15R2.888 CCCc1nc2ccccc2cc1O Amb33133842 [0,1,0,0,0,0|2,0,0]=3 651 B15R2.888 CCCc1nc2ccccc2nc1Cl Amb2140646 [0,1,0,0,0,0|3,0,0]=4 652 B15R2.888 CCNc1nc2ccccc2nc1Cl Amb20618618 [0,1,0,0,0,0|3,0,0]=4 653 B15R2.888 CCNc1nc2ccccc2nc1F Amb29853510 [0,1,0,0,0,0|3,0,0]=4 654 B15R2.888 CCNc1nc2ccccc2nc1N Amb27747175 [0,1,0,0,0,0|3,0,0]=4 655 B15R2.888 CCOC1=Nc2ccccc2NC1=O Amb19651674 [0,1,0,0,0,0|2,0,0]=3 656 B15R2.888 CCOC1=Nc2ccccc2SC1C Amb26995984 [0,1,0,0,0,0|2,0,1]=4 657 B15R2.888 CCOC1Sc2ccccc2N=C1N Amb25691577 [0,1,0,0,0,0|2,0,1]=4 658 B15R2.888 CCOC1Sc2ccccc2NC1=O Amb27841717 [0,1,0,0,0,0|2,0,1]=4 659 B15R2.888 CCOc1cc2ccccc2cc1Cl Amb27816650 [0,1,0,0,0,0|0,0,0]=1 660 B15R2.888 CCOc1cc2cccnc2cc1Br Amb23437332 [0,1,0,0,0,0|1,0,0]=2 661 B15R2.888 CCOc1nc2ccccc2nc1C Amb591495 [0,1,0,0,0,0|2,0,0]=3 662 B15R2.888 CCOc1nc2ccccc2nc1Cl Amb20618617 [0,1,0,0,0,0|2,0,0]=3 663 B15R2.888 CCOc1nc2ccccc2nc1F Amb35593851 [0,1,0,0,0,0|2,0,0]=3 664 B15R2.888 CCOc1nc2cccnc2cc1N Amb18650177 [0,1,0,0,0,0|2,0,0]=3 665 B15R2.888 CCOc1nc2ncccc2cc1N Amb32424341 [0,1,0,0,0,0|2,0,0]=3 666 B15R2.888 CCSc1nc2ccccc2nc1C Amb27490275 [0,1,0,0,0,0|2,1,0]=4 667 B15R2.888 CCSc1nc2ccccc2nc1Cl Amb29853521 [0,1,0,0,0,0|2,1,0]=4 668 B15R2.888 CCSc1nc2ccccc2nc1F Amb29853581 [0,1,0,0,0,0|2,1,0]=4 669 B15R2.888 CNCC1=Cc2ccccc2NC1=O Amb18563363 [0,1,0,0,0,0|3,0,0]=4 670 B15R2.888 CNCc1cc2ccccc2cc1N Amb18281957 [0,1,0,0,0,0|2,0,0]=3 671 B15R2.888 CNCc1cc2ccccc2nc1Cl Amb27191114 [0,1,0,0,0,0|3,0,0]=4 672 B15R2.888 CNCc1cc2ccccc2nc1O Amb732214 [0,1,0,0,0,0|3,0,0]=4 673 B15R2.888 CNCc1cc2cccnc2cc1Cl Amb27612130 [0,1,0,0,0,0|3,0,0]=4 674 B15R2.888 CNCc1nc2ccccc2cc1Br Amb27470593 [0,1,0,0,0,0|3,0,0]=4 675 B15R2.888 CNCc1nc2ccccc2cc1C Amb17578459 [0,1,0,0,0,0|3,0,0]=4 676 B15R2.888 CSCC1=Cc2ccccc2NC1=O Amb27145551 [0,1,0,0,0,0|3,0,0]=4 677 B15R2.888 CSCc1cc2ccccc2nc1Cl Amb27658438 [0,1,0,0,0,0|3,0,0]=4 678 B15R2.888 CSCc1cc2ccccc2nc1N Amb18959349 [0,1,0,0,0,0|3,0,0]=4 679 B15R2.888 Cc1cc2ccccc2c[n+]1CCO Amb22364428 [0,1,0,0,0,0|3,0,0]=4 680 B15R2.888 Cc1cc2ccccc2cc1CC#N Amb18648518 [0,1,0,0,0,0|2,0,1]=4 681 B15R2.888 Cc1cc2ccccc2nc1CCN Amb17578458 [0,1,0,0,0,0|3,0,0]=4 682 B15R2.888 Cc1nc2ccccc2cc1CCN Amb17578455 [0,1,0,0,0,0|3,0,0]=4 683 B15R2.888 ClCCc1cc2ccccc2nc1Cl Amb1994468 [0,1,0,0,0,0|3,0,0]=4 684 B15R2.888 Clc1nc2ccccc2cc1CCBr Amb27749729 [0,1,0,0,0,0|3,0,0]=4 685 B15R2.888 N#CCc1cc2ccccc2cc1Br Amb26974025 [0,1,0,0,0,0|2,0,1]=4 686 B15R2.888 N#CCc1cc2ccccc2cc1Cl Amb26335447 [0,1,0,0,0,0|2,0,1]=4 687 B15R2.888 N#CCc1cc2ccccc2cc1F Amb24725223 [0,1,0,0,0,0|2,0,1]=4 688 B15R2.888 N#CCc1cc2ccccc2cc1N Amb26494466 [0,1,0,0,0,0|2,0,1]=4 689 B15R2.888 N#CCc1cc2ccccc2cc1O Amb25828992 [0,1,0,0,0,0|2,0,1]=4 690 B15R2.888 NCCC1=Cc2ccccc2NC1=O Amb18010538 [0,1,0,0,0,0|3,0,0]=4 691 B15R2.888 NCCC1=Cc2ccccc2NC1=O Amb18909682 [0,1,0,0,0,0|3,0,0]=4 692 B15R2.888 NCCC1=Cc2ccccc2OC1=O Amb27263826 [0,1,0,0,0,0|3,0,0]=4 693 B15R2.888 NCCc1cc2ccccc2cc1N Amb25860800 [0,1,0,0,0,0|2,0,0]=3 694 B15R2.888 NCCc1cc2ccccc2nc1Cl Amb26561373 [0,1,0,0,0,0|3,0,0]=4 695 B15R2.888 NCCc1cc2cccnc2cc1Br Amb27425406 [0,1,0,0,0,0|3,0,0]=4 696 B15R2.888 NCCc1cc2cccnc2cc1Cl Amb28135471 [0,1,0,0,0,0|3,0,0]=4 697 B15R2.888 N\N=C\c1cc2ccccc2cc1O Amb598453 [0,1,0,0,0,0|3,0,0]=4 698 B15R2.888 O=C1Nc2ccccc2C=C1CCCl Amb22723323 [0,1,0,0,0,0|3,0,0]=4 699 B15R2.888 SCCc1cc2ccccc2nc1Cl Amb33057610 [0,1,0,0,0,0|3,0,0]=4 700 B15R2.1282 CCCc1ccc2ccc(O)cc2c1 Amb32751567 [0,1,0,0,0,0|1,0,0]=2 701 B15R2.1282 CCCc1ccc2ccc(O)cc2n1 Amb27256354 [0,1,0,0,0,0|2,0,0]=3 702 B15R2.1282 CCCc1ccc2ncc(N)cc2c1 Amb23580254 [0,1,0,0,0,0|2,0,0]=3 703 B15R2.1282 CCNc1ccc2ccc(=O)oc2c1 Amb4096006 [0,1,0,0,0,0|2,0,0]=3 704 B15R2.1282 CCNc1ccc2ccc(Cl)cc2n1 Amb28249457 [0,1,0,0,0,0|2,0,0]=3 705 B15R2.1282 CCOc1ccc2c(c1)NC(=O)CC2 Amb28409786 [0,1,0,0,0,0|1,0,2]=4 706 B15R2.1282 CCOc1ccc2c(c1)NC(=O)CS2 Amb10718 [0,1,0,0,0,0|2,0,1]=4 707 B15R2.1282 CCOc1ccc2c(c1)OC(=O)C=C2 Amb18511472 [0,1,0,0,0,0|1,0,0]=2 708 B15R2.1282 CCOc1ccc2ccc(Br)cc2c1 Amb28388711 [0,1,0,0,0,0|0,0,0]=1 709 B15R2.1282 CCOc1ccc2ccc(Br)cc2n1 Amb22494909 [0,1,0,0,0,0|1,0,0]=2 710 B15R2.1282 CCOc1ccc2ccc(C)cc2c1 Amb26510964 [0,1,0,0,0,0|0,0,0]=1 711 B15R2.1282 CCOc1ccc2ccc(O)cc2c1 Amb8837549 [0,1,0,0,0,0|0,0,0]=1 712 B15R2.1282 CCOc1ccc2cnc(Cl)cc2c1 Amb33309326 [0,1,0,0,0,0|1,0,0]=2 713 B15R2.1282 CCOc1ccc2cnc(Cl)nc2c1 Amb32428563 [0,1,0,0,0,0|2,0,0]=3 714 B15R2.1282 CCOc1ccc2cnc(O)cc2c1 Amb33309321 [0,1,0,0,0,0|1,0,0]=2 715 B15R2.1282 CCOc1ccc2ncc(Br)cc2c1 Amb23449326 [0,1,0,0,0,0|1,0,0]=2 716 B15R2.1282 CCOc1ccc2ncc(N)cc2c1 Amb17157140 [0,1,0,0,0,0|1,0,0]=2 717 B15R2.1282 CCOc1cnc2ccc(Br)cc2c1 Amb22494959 [0,1,0,0,0,0|1,0,0]=2 718 B15R2.1282 CCOc1ncc2ccc(Br)cc2n1 Amb27851626 [0,1,0,0,0,0|2,0,0]=3 719 B15R2.1282 CCSc1ncc2ccc(O)cc2n1 Amb28409140 [0,1,0,0,0,0|2,1,0]=4 720 B15R2.1282 CNCc1cc2cc(C)ccc2cn1 Amb27387061 [0,1,0,0,0,0|3,0,0]=4 721 B15R2.1282 CNCc1ccc2ccc(Cl)cc2n1 Amb17579185 [0,1,0,0,0,0|3,0,0]=4 722 B15R2.1282 CNCc1cnc2ccc(F)cc2c1 Amb17578518 [0,1,0,0,0,0|3,0,0]=4 723 B15R2.1282 COCc1ccc2ccc(O)cc2c1 Amb27612763 [0,1,0,0,0,0|2,0,0]=3 724 B15R2.1282 COCc1ccc2ncc(N)cc2c1 Amb32673400 [0,1,0,0,0,0|3,0,0]=4 725 B15R2.1282 Cc1ccc2ccc(CC#N)cc2c1 Amb28184014 [0,1,0,0,0,0|2,0,1]=4 726 B15R2.1282 Cc1ccc2ccc(CC=O)cc2c1 Amb28253640 [0,1,0,0,0,0|2,0,1]=4 727 B15R2.1282 Cc1ccc2ncc(CCN)cc2c1 Amb20669307 [0,1,0,0,0,0|3,0,0]=4 728 B15R2.1282 Cc1ccc2ncc(CCN)cc2c1 Amb32663670 [0,1,0,0,0,0|3,0,0]=4 729 B15R2.1282 N#CCc1ccc2ccc(Br)cc2c1 Amb27412369 [0,1,0,0,0,0|2,0,1]=4 730 B15R2.1282 N#CCc1ccc2ccc(Cl)cc2c1 Amb25364972 [0,1,0,0,0,0|2,0,1]=4 731 B15R2.1282 N#CCc1ccc2ccc(F)cc2c1 Amb27781103 [0,1,0,0,0,0|2,0,1]=4 732 B15R2.1282 N#CCc1ccc2ccc(I)cc2c1 Amb25764524 [0,1,0,0,0,0|2,0,1]=4 733 B15R2.1282 N#CCc1ccc2ccc(N)cc2c1 Amb27644299 [0,1,0,0,0,0|2,0,1]=4 734 B15R2.1282 NCCc1cnc2ccc(O)cc2c1 Amb20669298 [0,1,0,0,0,0|3,0,0]=4 735 B15R2.1282 O=C=Nc1ccc2ccc(O)cc2c1 Amb18649058 [0,1,0,0,0,0|2,0,1]=4 736 B15R2.1282 OCCc1ccc2ccc(F)cc2c1 Amb27221698 [0,1,0,0,0,0|2,0,0]=3 737 B15R2.1282 OCCc1ccc2ccc(F)cc2n1 Amb27421388 [0,1,0,0,0,0|3,0,0]=4 738 B15R2.1290 CCCc1ccc2c(c1)C(=O)NC=N2 Amb27407619 [0,1,0,0,0,0|3,0,0]=4 739 B15R2.1290 CCCc1ccc2cccc(S)c2n1 Amb27441551 [0,1,0,0,0,0|2,0,0]=3 740 B15R2.1290 CCCc1ccc2nccc(Cl)c2c1 Amb9393472 [0,1,0,0,0,0|2,0,0]=3 741 B15R2.1290 CCCc1ccc2ncnc(F)c2c1 Amb35642536 [0,1,0,0,0,0|3,0,0]=4 742 B15R2.1290 CCCc1ccc2ncnc(N)c2c1 Amb27965732 [0,1,0,0,0,0|3,0,0]=4 743 B15R2.1290 CCNc1cc2c(F)cccc2cn1 Amb32697392 [0,1,0,0,0,0|2,0,0]=3 744 B15R2.1290 CCNc1ccc2cccc(F)c2n1 Amb27805668 [0,1,0,0,0,0|2,0,0]=3 745 B15R2.1290 CCNc1ncc2cccc(Br)c2n1 Amb32791868 [0,1,0,0,0,0|3,0,0]=4 746 B15R2.1290 CCOc1ccc2c(c1)C(=O)C=CN2 Amb19047360 [0,1,0,0,0,0|1,0,0]=2 747 B15R2.1290 CCOc1ccc2c(c1)C(=O)C=NN2 Amb23559988 [0,1,0,0,0,0|2,0,0]=3 748 B15R2.1290 CCOc1ccc2c(c1)C(=O)CCC2 Amb5399096 [0,1,0,0,0,0|0,0,3]=4 749 B15R2.1290 CCOc1ccc2c(c1)C(=O)CCN2 Amb18818539 [0,1,0,0,0,0|1,0,2]=4 750 B15R2.1290 CCOc1ccc2c(c1)C(=O)CCO2 Amb33551036 [0,1,0,0,0,0|1,0,2]=4 751 B15R2.1290 CCOc1ccc2c(c1)C(=O)CNC2 Amb17194313 [0,1,0,0,0,0|1,0,2]=4 752 B15R2.1290 CCOc1ccc2c(c1)C(=O)CSC2 Amb27954892 [0,1,0,0,0,0|1,0,2]=4 753 B15R2.1290 CCOc1ccc2c(c1)C(=O)NC=C2 Amb24446932 [0,1,0,0,0,0|1,0,0]=2 754 B15R2.1290 CCOc1ccc2c(c1)C(=O)NC=N2 Amb19889104 [0,1,0,0,0,0|2,0,0]=3 755 B15R2.1290 CCOc1ccc2c(c1)C(=O)NCC2 Amb17205803 [0,1,0,0,0,0|1,0,2]=4 756 B15R2.1290 CCOc1ccc2c(c1)C(=S)C=CN2 Amb24111607 [0,1,0,0,0,0|1,0,0]=2 757 B15R2.1290 CCOc1ccc2cccc(C)c2n1 Amb20171156 [0,1,0,0,0,0|1,0,0]=2 758 B15R2.1290 CCOc1ccc2cccc(N)c2c1 Amb26494956 [0,1,0,0,0,0|0,0,0]=1 759 B15R2.1290 CCOc1ccc2cccc(O)c2c1 Amb35745231 [0,1,0,0,0,0|0,0,0]=1 760 B15R2.1290 CCOc1ccc2cccc(O)c2n1 Amb28123735 [0,1,0,0,0,0|1,0,0]=2 761 B15R2.1290 CCOc1ccc2ccnc(Br)c2c1 Amb32684073 [0,1,0,0,0,0|1,0,0]=2 762 B15R2.1290 CCOc1ccc2ccnc(Cl)c2c1 Amb27882459 [0,1,0,0,0,0|1,0,0]=2 763 B15R2.1290 CCOc1ccc2cncc(Br)c2c1 Amb28251453 [0,1,0,0,0,0|1,0,0]=2 764 B15R2.1290 CCOc1ccc2nccc(C)c2c1 Amb18354497 [0,1,0,0,0,0|1,0,0]=2 765 B15R2.1290 CCOc1ccc2nccc(Cl)c2c1 Amb1994631 [0,1,0,0,0,0|1,0,0]=2 766 B15R2.1290 CCOc1ccc2nccc(Cl)c2n1 Amb22490619 [0,1,0,0,0,0|2,0,0]=3 767 B15R2.1290 CCOc1ccc2nccc(N)c2c1 Amb1994595 [0,1,0,0,0,0|1,0,0]=2 768 B15R2.1290 CCOc1ccc2nccc(O)c2c1 Amb1994852 [0,1,0,0,0,0|1,0,0]=2 769 B15R2.1290 CCOc1ccc2ncnc(C)c2c1 Amb27638754 [0,1,0,0,0,0|2,0,0]=3 770 B15R2.1290 CCOc1ccc2ncnc(Cl)c2c1 Amb10602692 [0,1,0,0,0,0|2,0,0]=3 771 B15R2.1290 CCSc1ccc2c(c1)C(=O)NC=N2 Amb25972004 [0,1,0,0,0,0|2,1,0]=4 772 B15R2.1290 CCSc1ccc2ncnc(N)c2c1 Amb27670041 [0,1,0,0,0,0|2,1,0]=4 773 B15R2.1290 CNCc1ccc2cccc(Br)c2n1 Amb17583545 [0,1,0,0,0,0|3,0,0]=4 774 B15R2.1290 CNCc1ccc2cccc(C)c2n1 Amb17578451 [0,1,0,0,0,0|3,0,0]=4 775 B15R2.1290 CNCc1ccc2cccc(O)c2n1 Amb27813184 [0,1,0,0,0,0|3,0,0]=4 776 B15R2.1290 COCc1ccc2c(c1)C(=O)NC=C2 Amb27174063 [0,1,0,0,0,0|3,0,0]=4 777 B15R2.1290 COCc1ccc2nccc(Br)c2c1 Amb27978740 [0,1,0,0,0,0|3,0,0]=4 778 B15R2.1290 COCc1ccc2nccc(N)c2c1 Amb27250406 [0,1,0,0,0,0|3,0,0]=4 779 B15R2.1290 N#CCc1ccc2cccc(Br)c2c1 Amb26016273 [0,1,0,0,0,0|2,0,1]=4 780 B15R2.1290 N#CCc1ccc2cccc(Cl)c2c1 Amb27957352 [0,1,0,0,0,0|2,0,1]=4 781 B15R2.1290 N#CCc1ccc2cccc(F)c2c1 Amb27475984 [0,1,0,0,0,0|2,0,1]=4 782 B15R2.1290 N#CCc1ccc2cccc(N)c2c1 Amb26873261 [0,1,0,0,0,0|2,0,1]=4 783 B15R2.1290 N#CCc1ccc2cccc(O)c2c1 Amb26494405 [0,1,0,0,0,0|2,0,1]=4 784 B15R2.1290 NCCc1ccc2cccc(Br)c2n1 Amb17583553 [0,1,0,0,0,0|3,0,0]=4 785 B15R2.1290 NCCc1ccc2cccc(Cl)c2n1 Amb17579199 [0,1,0,0,0,0|3,0,0]=4 786 B15R2.1290 NCCc1ccc2cccc(O)c2n1 Amb27772193 [0,1,0,0,0,0|3,0,0]=4 787 B15R2.1290 Nc1cccc2ccc(N=C=O)cc12 Amb27796315 [0,1,0,0,0,0|2,0,1]=4 788 B15R2.1290 O=C=Nc1ccc2cccc(Cl)c2c1 Amb27792908 [0,1,0,0,0,0|2,0,1]=4 789 B15R2.1290 OCCc1ccc2cccc(F)c2c1 Amb28133188 [0,1,0,0,0,0|2,0,0]=3 790 B15R2.1601 C#CC(C)c1ccc2ccccc2c1 Amb33361945 [0,1,0,0,0,0|1,0,2]=4 791 B15R2.1601 C#CC(N)c1ccc2ccccc2c1 Amb23448717 [0,1,0,0,0,0|1,0,2]=4 792 B15R2.1601 C#CC(O)c1ccc2ccccc2c1 Amb26511200 [0,1,0,0,0,0|1,0,2]=4 793 B15R2.1601 C=C(CBr)c1ccc2ccccc2c1 Amb33451358 [0,1,0,0,0,0|2,0,0]=3 794 B15R2.1601 C=C(CBr)c1ccc2ccccc2n1 Amb33334259 [0,1,0,0,0,0|3,0,0]=4 795 B15R2.1601 C=C(CBr)c1ccc2cccnc2c1 Amb33433666 [0,1,0,0,0,0|3,0,0]=4 796 B15R2.1601 C=C(CBr)c1ccc2ncccc2c1 Amb33435511 [0,1,0,0,0,0|3,0,0]=4 797 B15R2.1601 C=C(CBr)c1cnc2ccccc2c1 Amb33433804 [0,1,0,0,0,0|3,0,0]=4 798 B15R2.1601 C=C(CCl)c1ccc2ccccc2c1 Amb33052561 [0,1,0,0,0,0|2,0,0]=3 799 B15R2.1601 C=C(CCl)c1ccc2ccccc2n1 Amb33257912 [0,1,0,0,0,0|3,0,0]=4 800 B15R2.1601 C=C(CCl)c1ccc2cccnc2c1 Amb33222942 [0,1,0,0,0,0|3,0,0]=4 801 B15R2.1601 C=C(CN)c1ccc2ccccc2c1 Amb33361942 [0,1,0,0,0,0|2,0,0]=3 802 B15R2.1601 C=C(CN)c1ccc2ccccc2n1 Amb33201366 [0,1,0,0,0,0|3,0,0]=4 803 B15R2.1601 C=C(CN)c1ccc2cccnc2c1 Amb32878861 [0,1,0,0,0,0|3,0,0]=4 804 B15R2.1601 C=C(CN)c1ccc2ncccc2c1 Amb33148685 [0,1,0,0,0,0|3,0,0]=4 805 B15R2.1601 C=C(CN)c1cnc2ccccc2c1 Amb33323970 [0,1,0,0,0,0|3,0,0]=4 806 B15R2.1601 C=C(CO)c1ccc2ccccc2c1 Amb28350200 [0,1,0,0,0,0|2,0,0]=3 807 B15R2.1601 C=CC(=O)c1ccc2ccccc2c1 Amb21856049 [0,1,0,0,0,0|1,0,2]=4 808 B15R2.1601 C=CC(O)c1ccc2ccccc2c1 Amb26854604 [0,1,0,0,0,0|1,0,2]=4 809 B15R2.1601 C=C[C@@H](O)c1ccc2ccccc2c1 Amb27835073 [0,1,0,0,0,0|1,0,2]=4 810 B15R2.1601 C=C[C@H](N)c1ccc2ccccc2c1 Amb27596065 [0,1,0,0,0,0|1,0,2]=4 811 B15R2.1601 CC(C#N)c1ccc2ccccc2c1 Amb8950024 [0,1,0,0,0,0|2,0,1]=4 812 B15R2.1601 CC(C=O)c1ccc2ccccc2c1 Amb24336340 [0,1,0,0,0,0|2,0,1]=4 813 B15R2.1601 CC(CBr)c1ccc2ccccc2c1 Amb28350443 [0,1,0,0,0,0|2,0,0]=3 814 B15R2.1601 CC(CBr)c1ccc2ccccc2n1 Amb33334254 [0,1,0,0,0,0|3,0,0]=4 815 B15R2.1601 CC(CBr)c1ccc2cccnc2c1 Amb33433335 [0,1,0,0,0,0|3,0,0]=4 816 B15R2.1601 CC(CBr)c1ccc2ncccc2c1 Amb33435498 [0,1,0,0,0,0|3,0,0]=4 817 B15R2.1601 CC(CBr)c1cnc2ccccc2c1 Amb33434154 [0,1,0,0,0,0|3,0,0]=4 818 B15R2.1601 CC(CCl)c1ccc2ccccc2c1 Amb27240366 [0,1,0,0,0,0|2,0,0]=3 819 B15R2.1601 CC(CN)c1ccc2ccccc2c1 Amb8950121 [0,1,0,0,0,0|2,0,0]=3 820 B15R2.1601 CC(CN)c1ccc2ccccc2n1 Amb33502500 [0,1,0,0,0,0|3,0,0]=4 821 B15R2.1601 CC(CN)c1ccc2cccnc2c1 Amb25675076 [0,1,0,0,0,0|3,0,0]=4 822 B15R2.1601 CC(CN)c1ccc2cnccc2c1 Amb25027446 [0,1,0,0,0,0|3,0,0]=4 823 B15R2.1601 CC(CN)c1ccc2ncccc2c1 Amb17321736 [0,1,0,0,0,0|3,0,0]=4 824 B15R2.1601 CC(CN)c1cnc2ccccc2c1 Amb17321735 [0,1,0,0,0,0|3,0,0]=4 825 B15R2.1601 CC(CO)c1ccc2ccccc2c1 Amb25110781 [0,1,0,0,0,0|2,0,0]=3 826 B15R2.1601 CC(CO)c1ccc2cccnc2c1 Amb33749207 [0,1,0,0,0,0|3,0,0]=4 827 B15R2.1601 CC(CO)c1ccc2cnccc2c1 Amb33745862 [0,1,0,0,0,0|3,0,0]=4 828 B15R2.1601 CC(CO)c1ccc2ncccc2c1 Amb33749209 [0,1,0,0,0,0|3,0,0]=4 829 B15R2.1601 CC(NO)c1ccc2ccccc2c1 Amb10606964 [0,1,0,0,0,0|3,0,0]=4 830 B15R2.1601 CC(ON)c1ccc2ccccc2c1 Amb33362168 [0,1,0,0,0,0|3,0,0]=4 831 B15R2.1601 CCC(=O)N1C=Cc2ccccc2C1 Amb24468547 [0,1,0,0,0,0|2,0,1]=4 832 B15R2.1601 CCC(=O)c1cc2ccccc2cn1 Amb27872482 [0,1,0,0,0,0|2,0,0]=3 833 B15R2.1601 CCC(=O)c1ccc2ccccc2c1 Amb4017274 [0,1,0,0,0,0|1,0,0]=2 834 B15R2.1601 CCC(=O)c1ccc2cccnc2n1 Amb35655577 [0,1,0,0,0,0|3,0,0]=4 835 B15R2.1601 CCC(=O)c1ccc2cnccc2c1 Amb25685033 [0,1,0,0,0,0|2,0,0]=3 836 B15R2.1601 CCC(=O)c1ccc2nccnc2c1 Amb18822143 [0,1,0,0,0,0|3,0,0]=4 837 B15R2.1601 CCC(=O)c1cnc2ccccc2n1 Amb27784833 [0,1,0,0,0,0|3,0,0]=4 838 B15R2.1601 CCC(C)c1ccc2ccccc2c1 Amb28133819 [0,1,0,0,0,0|1,0,0]=2 839 B15R2.1601 CCC(Cl)c1ccc2ncccc2c1 Amb27835514 [0,1,0,0,0,0|2,0,0]=3 840 B15R2.1601 CCC(Cl)c1cnc2ccccc2c1 Amb27982286 [0,1,0,0,0,0|2,0,0]=3 841 B15R2.1601 CCC(N)c1ccc2ccccc2c1 Amb18287330 [0,1,0,0,0,0|1,0,0]=2 842 B15R2.1601 CCC(N)c1ccc2cccnc2n1 Amb28346275 [0,1,0,0,0,0|3,0,0]=4 843 B15R2.1601 CCC(N)c1ccc2ccncc2c1 Amb27408487 [0,1,0,0,0,0|2,0,0]=3 844 B15R2.1601 CCC(N)c1ccc2cnccc2c1 Amb27817121 [0,1,0,0,0,0|2,0,0]=3 845 B15R2.1601 CCC(N)c1ccc2nccnc2c1 Amb27748362 [0,1,0,0,0,0|3,0,0]=4 846 B15R2.1601 CCC(N)c1cnc2ccccc2c1 Amb18950475 [0,1,0,0,0,0|2,0,0]=3 847 B15R2.1601 CCC(N)c1cnc2ccccc2n1 Amb27976532 [0,1,0,0,0,0|3,0,0]=4 848 B15R2.1601 CCC(O)c1ccc2ccccc2n1 Amb28342661 [0,1,0,0,0,0|2,0,0]=3 849 B15R2.1601 CCC(O)c1ccc2cccnc2n1 Amb35647267 [0,1,0,0,0,0|3,0,0]=4 850 B15R2.1601 CC[C@@H](N)c1ccc2ccccc2c1 Amb23440391 [0,1,0,0,0,0|1,0,0]=2 851 B15R2.1601 CC[C@@H](N)c1ccc2ccccc2c1 Amb27243952 [0,1,0,0,0,0|1,0,0]=2 852 B15R2.1601 CC[C@@H](N)c1ccc2ccccc2n1 Amb28457192 [0,1,0,0,0,0|2,0,0]=3 853 B15R2.1601 CC[C@@H](N)c1ccc2cnccc2c1 Amb27830515 [0,1,0,0,0,0|2,0,0]=3 854 B15R2.1601 CC[C@@H](N)c1ccc2nccnc2c1 Amb27948775 [0,1,0,0,0,0|3,0,0]=4 855 B15R2.1601 CC[C@@H](O)c1ccc2ccccc2c1 Amb27612746 [0,1,0,0,0,0|1,0,0]=2 856 B15R2.1601 CC[C@@H](O)c1cnc2ccccc2c1 Amb27969111 [0,1,0,0,0,0|2,0,0]=3 857 B15R2.1601 CC[C@H](N)c1cc2ccccc2cn1 Amb28292899 [0,1,0,0,0,0|2,0,0]=3 858 B15R2.1601 CC[C@H](N)c1ccc2ccccc2c1 Amb33802002 [0,1,0,0,0,0|1,0,0]=2 859 B15R2.1601 CC[C@H](N)c1ccc2cccnc2c1 Amb27170687 [0,1,0,0,0,0|2,0,0]=3 860 B15R2.1601 CC[C@H](N)c1ccc2ccncc2c1 Amb28283324 [0,1,0,0,0,0|2,0,0]=3 861 B15R2.1601 CC[C@H](O)c1ccc2ccccc2c1 Amb28200346 [0,1,0,0,0,0|1,0,0]=2 862 B15R2.1601 CNC(=N)c1cnc2ccccc2c1 Amb27784742 [0,1,0,0,0,0|3,0,0]=4 863 B15R2.1601 CNC(=O)c1ccc2ccccc2c1 Amb8333498 [0,1,0,0,0,0|2,0,0]=3 864 B15R2.1601 CNC(=O)c1cnc2ccccc2c1 Amb22584213 [0,1,0,0,0,0|3,0,0]=4 865 B15R2.1601 CNC(=S)c1ccc2ncccc2c1 Amb28315160 [0,1,0,0,0,0|3,0,0]=4 866 B15R2.1601 CNC(C)c1ccc2ccccc2c1 Amb10610054 [0,1,0,0,0,0|2,0,0]=3 867 B15R2.1601 CNC(C)c1ccc2ccccc2c1 Amb9705536 [0,1,0,0,0,0|2,0,0]=3 868 B15R2.1601 CNC(C)c1ccc2ncccc2c1 Amb24419658 [0,1,0,0,0,0|3,0,0]=4 869 B15R2.1601 CNC(C)c1cnc2ccccc2c1 Amb18950479 [0,1,0,0,0,0|3,0,0]=4 870 B15R2.1601 CN[C@@H](C)c1ccc2ccccc2c1 Amb25037602 [0,1,0,0,0,0|2,0,0]=3 871 B15R2.1601 CN[C@@H](C)c1ccc2ccccc2n1 Amb27468595 [0,1,0,0,0,0|3,0,0]=4 872 B15R2.1601 CN[C@@H](C)c1ccc2cccnc2c1 Amb27253150 [0,1,0,0,0,0|3,0,0]=4 873 B15R2.1601 CN[C@@H](C)c1cnc2ccccc2c1 Amb27440840 [0,1,0,0,0,0|3,0,0]=4 874 B15R2.1601 CN[C@H](C)c1ccc2ncccc2c1 Amb28046798 [0,1,0,0,0,0|3,0,0]=4 875 B15R2.1601 COC(=N)c1ccc2ccccc2c1 Amb18323196 [0,1,0,0,0,0|2,0,0]=3 876 B15R2.1601 COC(=N)c1ccc2cnccc2c1 Amb27623514 [0,1,0,0,0,0|3,0,0]=4 877 B15R2.1601 COC(=N)c1cnc2ccccc2c1 Amb27593742 [0,1,0,0,0,0|3,0,0]=4 878 B15R2.1601 COC(=O)c1cc2ccccc2cn1 Amb2722783 [0,1,0,0,0,0|3,0,0]=4 879 B15R2.1601 COC(=O)c1ccc2ccccc2c1 Amb5721993 [0,1,0,0,0,0|2,0,0]=3 880 B15R2.1601 COC(=O)c1ccc2ccccc2n1 Amb19373194 [0,1,0,0,0,0|3,0,0]=4 881 B15R2.1601 COC(=O)c1ccc2ccccc2n1 Amb6334851 [0,1,0,0,0,0|3,0,0]=4 882 B15R2.1601 COC(=O)c1ccc2cccnc2c1 Amb19103848 [0,1,0,0,0,0|3,0,0]=4 883 B15R2.1601 COC(=O)c1ccc2ccncc2c1 Amb18349241 [0,1,0,0,0,0|3,0,0]=4 884 B15R2.1601 COC(=O)c1ccc2cnccc2c1 Amb17933852 [0,1,0,0,0,0|3,0,0]=4 885 B15R2.1601 COC(=O)c1ccc2cnccc2c1 Amb22546432 [0,1,0,0,0,0|3,0,0]=4 886 B15R2.1601 COC(=O)c1ccc2ncccc2c1 Amb2644069 [0,1,0,0,0,0|3,0,0]=4 887 B15R2.1601 COC(=O)c1cnc2ccccc2c1 Amb9819003 [0,1,0,0,0,0|3,0,0]=4 888 B15R2.1601 CSC(=S)c1ccc2ccccc2c1 Amb2608991 [0,1,0,0,0,0|2,0,0]=3 889 B15R2.1601 C[C@@H](C=O)c1ccc2ccccc2c1 Amb27210903 [0,1,0,0,0,0|2,0,1]=4 890 B15R2.1601 C[C@@H](CN)c1ccc2ccccc2c1 Amb33731715 [0,1,0,0,0,0|2,0,0]=3 891 B15R2.1601 C[C@@H](CN)c1ccc2cccnc2c1 Amb33728846 [0,1,0,0,0,0|3,0,0]=4 892 B15R2.1601 C[C@@H](CN)c1ccc2cnccc2c1 Amb33728849 [0,1,0,0,0,0|3,0,0]=4 893 B15R2.1601 C[C@@H](CN)c1ccc2ncccc2c1 Amb33728856 [0,1,0,0,0,0|3,0,0]=4 894 B15R2.1601 C[C@@H](CO)c1ccc2ccccc2c1 Amb27751767 [0,1,0,0,0,0|2,0,0]=3 895 B15R2.1601 C[C@@H](CO)c1ccc2cccnc2c1 Amb33738936 [0,1,0,0,0,0|3,0,0]=4 896 B15R2.1601 C[C@@H](CO)c1ccc2cnccc2c1 Amb33747023 [0,1,0,0,0,0|3,0,0]=4 897 B15R2.1601 C[C@@H](CO)c1ccc2ncccc2c1 Amb33738943 [0,1,0,0,0,0|3,0,0]=4 898 B15R2.1601 C[C@@H](NO)c1ccc2ccccc2c1 Amb27206664 [0,1,0,0,0,0|3,0,0]=4 899 B15R2.1601 C[C@H](CCl)c1ccc2ccccc2c1 Amb27388001 [0,1,0,0,0,0|2,0,0]=3 900 B15R2.1601 C[C@H](CN)c1ccc2ccccc2c1 Amb33747135 [0,1,0,0,0,0|2,0,0]=3 901 B15R2.1601 C[C@H](CN)c1ccc2cccnc2c1 Amb33726998 [0,1,0,0,0,0|3,0,0]=4 902 B15R2.1601 C[C@H](CN)c1ccc2cnccc2c1 Amb33748011 [0,1,0,0,0,0|3,0,0]=4 903 B15R2.1601 C[C@H](CN)c1ccc2ncccc2c1 Amb33726996 [0,1,0,0,0,0|3,0,0]=4 904 B15R2.1601 C[C@H](CO)c1ccc2ccccc2c1 Amb27205699 [0,1,0,0,0,0|2,0,0]=3 905 B15R2.1601 C[C@H](CO)c1ccc2cccnc2c1 Amb33731299 [0,1,0,0,0,0|3,0,0]=4 906 B15R2.1601 C[C@H](CO)c1ccc2cnccc2c1 Amb33731286 [0,1,0,0,0,0|3,0,0]=4 907 B15R2.1601 C[C@H](CO)c1ccc2ncccc2c1 Amb33748161 [0,1,0,0,0,0|3,0,0]=4 908 B15R2.1601 C\C(=N/N)c1ccc2ccccc2c1 Amb2702751 [0,1,0,0,0,0|3,0,0]=4 909 B15R2.1601 C\C(=N\N)c1ccc2ccccc2c1 Amb28421793 [0,1,0,0,0,0|3,0,0]=4 910 B15R2.1601 C\C(=N\O)c1ccc2ccccc2c1 Amb3484959 [0,1,0,0,0,0|3,0,0]=4 911 B15R2.1601 N#CC(Cl)c1ccc2ccccc2c1 Amb27213128 [0,1,0,0,0,0|2,0,1]=4 912 B15R2.1601 N#CC(N)c1ccc2ccccc2c1 Amb33543198 [0,1,0,0,0,0|2,0,1]=4 913 B15R2.1601 NC(CF)c1ccc2ccccc2c1 Amb2372613 [0,1,0,0,0,0|2,0,0]=3 914 B15R2.1601 NC(CO)c1ccc2ccccc2c1 Amb2236212 [0,1,0,0,0,0|2,0,0]=3 915 B15R2.1601 NC(CO)c1ccc2ccccc2c1 Amb8854991 [0,1,0,0,0,0|2,0,0]=3 916 B15R2.1601 NC(CO)c1ccc2ccccc2n1 Amb24736528 [0,1,0,0,0,0|3,0,0]=4 917 B15R2.1601 NC(CO)c1ccc2cccnc2c1 Amb25102662 [0,1,0,0,0,0|3,0,0]=4 918 B15R2.1601 NC(CO)c1ccc2cnccc2c1 Amb27455147 [0,1,0,0,0,0|3,0,0]=4 919 B15R2.1601 NC(CO)c1ccc2ncccc2c1 Amb26939615 [0,1,0,0,0,0|3,0,0]=4 920 B15R2.1601 NC(CO)c1cnc2ccccc2c1 Amb28063034 [0,1,0,0,0,0|3,0,0]=4 921 B15R2.1601 NCC(=O)c1ccc2ccccc2c1 Amb16200345 [0,1,0,0,0,0|2,0,0]=3 922 B15R2.1601 NCC(=O)c1ccc2ccccc2c1 Amb21929148 [0,1,0,0,0,0|2,0,0]=3 923 B15R2.1601 NCC(=O)c1ccc2ccccc2n1 Amb27257595 [0,1,0,0,0,0|3,0,0]=4 924 B15R2.1601 NCC(=O)c1ccc2ccccc2n1 Amb35788248 [0,1,0,0,0,0|3,0,0]=4 925 B15R2.1601 NCC(=O)c1ccc2cccnc2c1 Amb25367057 [0,1,0,0,0,0|3,0,0]=4 926 B15R2.1601 NCC(=O)c1ccc2ncccc2c1 Amb25900848 [0,1,0,0,0,0|3,0,0]=4 927 B15R2.1601 NCC(=O)c1cnc2ccccc2c1 Amb10553604 [0,1,0,0,0,0|3,0,0]=4 928 B15R2.1601 NCC(F)c1ccc2ccccc2c1 Amb25843393 [0,1,0,0,0,0|2,0,0]=3 929 B15R2.1601 NCC(F)c1ccc2ccccc2n1 Amb33201642 [0,1,0,0,0,0|3,0,0]=4 930 B15R2.1601 NCC(F)c1ccc2cccnc2c1 Amb26395226 [0,1,0,0,0,0|3,0,0]=4 931 B15R2.1601 NCC(F)c1ccc2cnccc2c1 Amb27435539 [0,1,0,0,0,0|3,0,0]=4 932 B15R2.1601 NCC(F)c1ccc2ncccc2c1 Amb25228305 [0,1,0,0,0,0|3,0,0]=4 933 B15R2.1601 NCC(F)c1cnc2ccccc2c1 Amb25980671 [0,1,0,0,0,0|3,0,0]=4 934 B15R2.1601 NCC(N)c1ccc2cccnc2c1 Amb27413842 [0,1,0,0,0,0|3,0,0]=4 935 B15R2.1601 NCC(N)c1ccc2ncccc2c1 Amb27467344 [0,1,0,0,0,0|3,0,0]=4 936 B15R2.1601 NCC(O)c1ccc2ccccc2c1 Amb1108257 [0,1,0,0,0,0|2,0,0]=3 937 B15R2.1601 NCC(O)c1ccc2ccccc2n1 Amb25851660 [0,1,0,0,0,0|3,0,0]=4 938 B15R2.1601 NCC(O)c1ccc2cccnc2c1 Amb25689346 [0,1,0,0,0,0|3,0,0]=4 939 B15R2.1601 NCC(O)c1ccc2ncccc2c1 Amb2697541 [0,1,0,0,0,0|3,0,0]=4 940 B15R2.1601 NCC(O)c1cnc2ccccc2c1 Amb18562959 [0,1,0,0,0,0|3,0,0]=4 941 B15R2.1601 NC[C@@H](N)c1ccc2ccccc2n1 Amb27435632 [0,1,0,0,0,0|3,0,0]=4 942 B15R2.1601 NC[C@@H](O)c1ccc2ccccc2c1 Amb26433670 [0,1,0,0,0,0|2,0,0]=3 943 B15R2.1601 NC[C@@H](O)c1ccc2ccccc2n1 Amb33201641 [0,1,0,0,0,0|3,0,0]=4 944 B15R2.1601 NC[C@@H](O)c1ccc2cccnc2c1 Amb32879654 [0,1,0,0,0,0|3,0,0]=4 945 B15R2.1601 NC[C@@H](O)c1ccc2ncccc2c1 Amb33143327 [0,1,0,0,0,0|3,0,0]=4 946 B15R2.1601 NC[C@@H](O)c1cnc2ccccc2c1 Amb33324491 [0,1,0,0,0,0|3,0,0]=4 947 B15R2.1601 NC[C@H](N)c1ccc2ccccc2n1 Amb27748240 [0,1,0,0,0,0|3,0,0]=4 948 B15R2.1601 NC[C@H](N)c1ccc2cccnc2c1 Amb27881582 [0,1,0,0,0,0|3,0,0]=4 949 B15R2.1601 NC[C@H](N)c1ccc2ncccc2c1 Amb27164322 [0,1,0,0,0,0|3,0,0]=4 950 B15R2.1601 NC[C@H](O)c1ccc2ccccc2c1 Amb25836438 [0,1,0,0,0,0|2,0,0]=3 951 B15R2.1601 NC[C@H](O)c1ccc2ccccc2n1 Amb33201975 [0,1,0,0,0,0|3,0,0]=4 952 B15R2.1601 NC[C@H](O)c1ccc2cccnc2c1 Amb32879655 [0,1,0,0,0,0|3,0,0]=4 953 B15R2.1601 NC[C@H](O)c1ccc2ncccc2c1 Amb33143357 [0,1,0,0,0,0|3,0,0]=4 954 B15R2.1601 NC[C@H](O)c1cnc2ccccc2c1 Amb33324492 [0,1,0,0,0,0|3,0,0]=4 955 B15R2.1601 NNC(=O)c1ccc2ccccc2c1 Amb1133202 [0,1,0,0,0,0|3,0,0]=4 956 B15R2.1601 N[C@@H](CF)c1ccc2ccccc2c1 Amb27868655 [0,1,0,0,0,0|2,0,0]=3 957 B15R2.1601 N[C@@H](CO)c1cc2ccccc2cn1 Amb27169512 [0,1,0,0,0,0|3,0,0]=4 958 B15R2.1601 N[C@@H](CO)c1ccc2ccccc2c1 Amb23440423 [0,1,0,0,0,0|2,0,0]=3 959 B15R2.1601 N[C@@H](CO)c1ccc2ccccc2c1 Amb26509299 [0,1,0,0,0,0|2,0,0]=3 960 B15R2.1601 N[C@@H](CO)c1ccc2ccccc2n1 Amb25062966 [0,1,0,0,0,0|3,0,0]=4 961 B15R2.1601 N[C@@H](CO)c1ccc2cccnc2c1 Amb27955783 [0,1,0,0,0,0|3,0,0]=4 962 B15R2.1601 N[C@@H](CO)c1ccc2ccncc2c1 Amb27169514 [0,1,0,0,0,0|3,0,0]=4 963 B15R2.1601 N[C@@H](CO)c1ccc2ncccc2c1 Amb24578336 [0,1,0,0,0,0|3,0,0]=4 964 B15R2.1601 N[C@@H](CO)c1cnc2ccccc2c1 Amb26960340 [0,1,0,0,0,0|3,0,0]=4 965 B15R2.1601 N[C@H](CF)c1ccc2ccccc2c1 Amb27273188 [0,1,0,0,0,0|2,0,0]=3 966 B15R2.1601 N[C@H](CO)c1cc2ccccc2cn1 Amb27164270 [0,1,0,0,0,0|3,0,0]=4 967 B15R2.1601 N[C@H](CO)c1ccc2ccccc2c1 Amb25727246 [0,1,0,0,0,0|2,0,0]=3 968 B15R2.1601 N[C@H](CO)c1ccc2ccccc2n1 Amb24460310 [0,1,0,0,0,0|3,0,0]=4 969 B15R2.1601 N[C@H](CO)c1ccc2cccnc2c1 Amb25859242 [0,1,0,0,0,0|3,0,0]=4 970 B15R2.1601 N[C@H](CO)c1ccc2ncccc2c1 Amb27243953 [0,1,0,0,0,0|3,0,0]=4 971 B15R2.1601 N[C@H](CO)c1cnc2ccccc2c1 Amb26046328 [0,1,0,0,0,0|3,0,0]=4 972 B15R2.1601 N\C(=N/O)c1ccc2ccccc2c1 Amb2724905 [0,1,0,0,0,0|3,0,0]=4 973 B15R2.1601 O=C(CBr)c1ccc2ccccc2c1 Amb1229977 [0,1,0,0,0,0|2,0,0]=3 974 B15R2.1601 O=C(CBr)c1ccc2cnccc2c1 Amb25982731 [0,1,0,0,0,0|3,0,0]=4 975 B15R2.1601 O=C(CCl)c1cc2ccccc2cn1 Amb27957259 [0,1,0,0,0,0|3,0,0]=4 976 B15R2.1601 O=C(CCl)c1ccc2ccccc2c1 Amb24104160 [0,1,0,0,0,0|2,0,0]=3 977 B15R2.1601 O=C(CCl)c1ccc2ccccc2n1 Amb24521506 [0,1,0,0,0,0|3,0,0]=4 978 B15R2.1601 O=C(CCl)c1ccc2cccnc2c1 Amb33480523 [0,1,0,0,0,0|3,0,0]=4 979 B15R2.1601 O=C(CCl)c1ccc2ncccc2c1 Amb27393452 [0,1,0,0,0,0|3,0,0]=4 980 B15R2.1601 O=C(CCl)c1cnc2ccccc2c1 Amb25732423 [0,1,0,0,0,0|3,0,0]=4 981 B15R2.1601 O=C(CF)c1ccc2ccccc2c1 Amb26846092 [0,1,0,0,0,0|2,0,0]=3 982 B15R2.1601 O=C(CO)c1ccc2ccccc2c1 Amb27417478 [0,1,0,0,0,0|2,0,0]=3 983 B15R2.1601 O=C(NO)c1ccc2ccccc2c1 Amb6265054 [0,1,0,0,0,0|3,0,0]=4 984 B15R2.1601 O=CC(=O)c1ccc2ccccc2c1 Amb18129371 [0,1,0,0,0,0|2,0,1]=4 985 B15R2.1601 O=CC(=O)c1ccc2ccccc2c1 Amb19957417 [0,1,0,0,0,0|2,0,1]=4 986 B15R2.1601 O=CC(O)c1ccc2ccccc2c1 Amb28411630 [0,1,0,0,0,0|2,0,1]=4 987 B15R2.1601 O=CN(O)c1ccc2ccccc2c1 Amb27883163 [0,1,0,0,0,0|2,0,1]=4 988 B15R2.1601 OC(CBr)c1ccc2ccccc2c1 Amb27593387 [0,1,0,0,0,0|2,0,0]=3 989 B15R2.1601 OC(CBr)c1ccc2ccccc2n1 Amb33333399 [0,1,0,0,0,0|3,0,0]=4 990 B15R2.1601 OC(CBr)c1ccc2cccnc2c1 Amb33433362 [0,1,0,0,0,0|3,0,0]=4 991 B15R2.1601 OC(CBr)c1ccc2ncccc2c1 Amb33435506 [0,1,0,0,0,0|3,0,0]=4 992 B15R2.1601 OC(CBr)c1cnc2ccccc2c1 Amb33385131 [0,1,0,0,0,0|3,0,0]=4 993 B15R2.1601 OC(CCl)c1ccc2ccccc2c1 Amb27152327 [0,1,0,0,0,0|2,0,0]=3 994 B15R2.1601 OC(CCl)c1ccc2ccccc2n1 Amb33258246 [0,1,0,0,0,0|3,0,0]=4 995 B15R2.1601 OC(CCl)c1ccc2cccnc2c1 Amb33222937 [0,1,0,0,0,0|3,0,0]=4 996 B15R2.1601 OC(CF)c1ccc2ccccc2c1 Amb33361943 [0,1,0,0,0,0|2,0,0]=3 997 B15R2.1601 OC(CF)c1ccc2ccccc2n1 Amb33201369 [0,1,0,0,0,0|3,0,0]=4 998 B15R2.1601 OC(CF)c1ccc2cccnc2c1 Amb32878863 [0,1,0,0,0,0|3,0,0]=4 999 B15R2.1601 OC(CF)c1ccc2ncccc2c1 Amb33148687 [0,1,0,0,0,0|3,0,0]=4 1000 B15R2.1601 OC(CF)c1cnc2ccccc2c1 Amb33323974 [0,1,0,0,0,0|3,0,0]=4 1001 B15R2.1601 OCC(O)c1ccc2ccccc2c1 Amb27591423 [0,1,0,0,0,0|2,0,0]=3 1002 B15R2.1601 OCC(O)c1ccc2ccccc2n1 Amb24672737 [0,1,0,0,0,0|3,0,0]=4 1003 B15R2.1601 OCC(O)c1ccc2cccnc2c1 Amb32878864 [0,1,0,0,0,0|3,0,0]=4 1004 B15R2.1601 OCC(O)c1ccc2ncccc2c1 Amb27471435 [0,1,0,0,0,0|3,0,0]=4 1005 B15R2.1601 OCC(O)c1cnc2ccccc2c1 Amb33323976 [0,1,0,0,0,0|3,0,0]=4 1006 B15R2.1601 OC[C@@H](O)c1ccc2ccccc2c1 Amb22336664 [0,1,0,0,0,0|2,0,0]=3 1007 B15R2.1601 OC[C@@H](O)c1ccc2ccccc2n1 Amb27166845 [0,1,0,0,0,0|3,0,0]=4 1008 B15R2.1601 OC[C@H](O)c1ccc2ccccc2n1 Amb28320948 [0,1,0,0,0,0|3,0,0]=4 1009 B15R2.1601 O[C@H](CBr)c1ccc2ccccc2c1 Amb6893371 [0,1,0,0,0,0|2,0,0]=3 1010 B15R2.1601 O[C@H](CCl)c1ccc2ccccc2c1 Amb27248962 [0,1,0,0,0,0|2,0,0]=3 1011 B15R2.1601 O\N=C(\Cl)c1ccc2ccccc2c1 Amb28042479 [0,1,0,0,0,0|3,0,0]=4 1012 B15R2.1601 [C-]#[N+]C(C)c1ccc2ccccc2c1 Amb3973340 [0,1,0,0,0,0|2,0,1]=4 1013 B15R2.1668 C=C(C)Cc1cnc2ccccc2c1 Amb28067703 [0,1,0,0,0,0|2,0,1]=4 1014 B15R2.1668 CC(=O)Cc1cc2ccccc2cn1 Amb27842352 [0,1,0,0,0,0|2,0,1]=4 1015 B15R2.1668 CC(=O)Cc1ccc2ccccc2c1 Amb6674796 [0,1,0,0,0,0|1,0,1]=3 1016 B15R2.1668 CC(=O)Cc1ccc2ccccc2n1 Amb9205983 [0,1,0,0,0,0|2,0,1]=4 1017 B15R2.1668 CC(=O)Cc1ccc2cccnc2c1 Amb32879989 [0,1,0,0,0,0|2,0,1]=4 1018 B15R2.1668 CC(=O)Cc1ccc2ncccc2c1 Amb26618907 [0,1,0,0,0,0|2,0,1]=4 1019 B15R2.1668 CC(=O)Cc1cnc2ccccc2c1 Amb25819490 [0,1,0,0,0,0|2,0,1]=4 1020 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 Amb967535 [0,1,0,0,0,0|1,0,1]=3 1021 B15R2.1668 CC(=O)Nc1ccc2ccccc2n1 Amb404260 [0,1,0,0,0,0|2,0,1]=4 1022 B15R2.1668 CC(=O)Nc1ccc2ccncc2c1 Amb28130451 [0,1,0,0,0,0|2,0,1]=4 1023 B15R2.1668 CC(=O)Nc1ccc2ncccc2c1 Amb8495030 [0,1,0,0,0,0|2,0,1]=4 1024 B15R2.1668 CC(=O)Oc1cc2ccccc2cn1 Amb27642977 [0,1,0,0,0,0|1,0,1]=3 1025 B15R2.1668 CC(=O)Oc1ccc2ccccc2c1 Amb4065335 [0,1,0,0,0,0|0,0,1]=2 1026 B15R2.1668 CC(=O)Oc1ccc2nccnc2c1 Amb10553805 [0,1,0,0,0,0|2,0,1]=4 1027 B15R2.1668 CC(=S)Nc1ccc2ccccc2c1 Amb8505022 [0,1,0,0,0,0|1,0,1]=3 1028 B15R2.1668 CC(Br)Cc1ccc2ccccc2c1 Amb27836098 [0,1,0,0,0,0|1,0,0]=2 1029 B15R2.1668 CC(Br)Cc1ccc2ccccc2n1 Amb25731490 [0,1,0,0,0,0|2,0,0]=3 1030 B15R2.1668 CC(Br)Cc1ccc2cccnc2c1 Amb33433336 [0,1,0,0,0,0|2,0,0]=3 1031 B15R2.1668 CC(Br)Cc1ccc2ncccc2c1 Amb33435497 [0,1,0,0,0,0|2,0,0]=3 1032 B15R2.1668 CC(Br)Cc1cnc2ccccc2c1 Amb33434153 [0,1,0,0,0,0|2,0,0]=3 1033 B15R2.1668 CC(Br)Cc1cnc2ccccc2n1 Amb33242994 [0,1,0,0,0,0|3,0,0]=4 1034 B15R2.1668 CC(C)=Nc1cnc2ccccc2c1 Amb27843716 [0,1,0,0,0,0|2,0,1]=4 1035 B15R2.1668 CC(C)Cc1ccc2ccccc2n1 Amb8629133 [0,1,0,0,0,0|2,0,0]=3 1036 B15R2.1668 CC(C)Cc1ccc2ncccc2c1 Amb8629132 [0,1,0,0,0,0|2,0,0]=3 1037 B15R2.1668 CC(C)Nc1ccc2ncccc2c1 Amb18962797 [0,1,0,0,0,0|2,0,0]=3 1038 B15R2.1668 CC(C)Nc1cnc2ccccc2c1 Amb9556883 [0,1,0,0,0,0|2,0,0]=3 1039 B15R2.1668 CC(C)Nc1cnc2ccccc2n1 Amb18285467 [0,1,0,0,0,0|3,0,0]=4 1040 B15R2.1668 CC(C)Nc1ncc2ccccc2n1 Amb27865644 [0,1,0,0,0,0|3,0,0]=4 1041 B15R2.1668 CC(C)Oc1ccc2ccccc2c1 Amb24358848 [0,1,0,0,0,0|0,0,0]=1 1042 B15R2.1668 CC(C)Oc1ccc2ccccc2n1 Amb28206293 [0,1,0,0,0,0|1,0,0]=2 1043 B15R2.1668 CC(C)Oc1ccc2cccnc2c1 Amb27959081 [0,1,0,0,0,0|1,0,0]=2 1044 B15R2.1668 CC(C)Oc1cnc2ccccc2c1 Amb27657092 [0,1,0,0,0,0|1,0,0]=2 1045 B15R2.1668 CC(C)Oc1cnc2cccnc2n1 Amb27225091 [0,1,0,0,0,0|3,0,0]=4 1046 B15R2.1668 CC(C)Sc1ccc2ccccc2n1 Amb10665721 [0,1,0,0,0,0|1,1,0]=3 1047 B15R2.1668 CC(N)Cc1cc2ccccc2cn1 Amb27964318 [0,1,0,0,0,0|2,0,0]=3 1048 B15R2.1668 CC(N)Cc1cc2ccccc2nn1 Amb27968211 [0,1,0,0,0,0|3,0,0]=4 1049 B15R2.1668 CC(N)Cc1ccc2ccccc2c1 Amb9716016 [0,1,0,0,0,0|1,0,0]=2 1050 B15R2.1668 CC(N)Cc1ccc2ccccc2n1 Amb33550317 [0,1,0,0,0,0|2,0,0]=3 1051 B15R2.1668 CC(N)Cc1ccc2ccccc2n1 Amb9206046 [0,1,0,0,0,0|2,0,0]=3 1052 B15R2.1668 CC(N)Cc1ccc2cccnc2c1 Amb19105928 [0,1,0,0,0,0|2,0,0]=3 1053 B15R2.1668 CC(N)Cc1ccc2ccncc2c1 Amb19105763 [0,1,0,0,0,0|2,0,0]=3 1054 B15R2.1668 CC(N)Cc1ccc2cnccc2c1 Amb18353767 [0,1,0,0,0,0|2,0,0]=3 1055 B15R2.1668 CC(N)Cc1ccc2ncccc2c1 Amb19105926 [0,1,0,0,0,0|2,0,0]=3 1056 B15R2.1668 CC(N)Cc1ccc2nccnc2c1 Amb8011412 [0,1,0,0,0,0|3,0,0]=4 1057 B15R2.1668 CC(N)Cc1cnc2ccccc2c1 Amb24377651 [0,1,0,0,0,0|2,0,0]=3 1058 B15R2.1668 CC(N)Cc1cnc2ccccc2n1 Amb35686614 [0,1,0,0,0,0|3,0,0]=4 1059 B15R2.1668 CC(O)Cc1ccc2ccccc2c1 Amb18319261 [0,1,0,0,0,0|1,0,0]=2 1060 B15R2.1668 CC(O)Cc1ccc2ccccc2n1 Amb20623273 [0,1,0,0,0,0|2,0,0]=3 1061 B15R2.1668 CC(O)Cc1ccc2cccnc2c1 Amb32879493 [0,1,0,0,0,0|2,0,0]=3 1062 B15R2.1668 CC(O)Cc1ccc2ncccc2c1 Amb33143325 [0,1,0,0,0,0|2,0,0]=3 1063 B15R2.1668 CC(O)Cc1cnc2ccccc2c1 Amb28048145 [0,1,0,0,0,0|2,0,0]=3 1064 B15R2.1668 CC(O)Cc1cnc2ccccc2n1 Amb33448724 [0,1,0,0,0,0|3,0,0]=4 1065 B15R2.1668 CN(C)Cc1ccc2ccccc2c1 Amb26522356 [0,1,0,0,0,0|2,0,0]=3 1066 B15R2.1668 CN(C)Cc1ccc2ccccc2n1 Amb25672416 [0,1,0,0,0,0|3,0,0]=4 1067 B15R2.1668 CN(C)Cc1cnc2ccccc2c1 Amb27848429 [0,1,0,0,0,0|3,0,0]=4 1068 B15R2.1668 CN(C)Nc1ccc2ccccc2c1 Amb27968516 [0,1,0,0,0,0|2,0,0]=3 1069 B15R2.1668 CN(O)Cc1ccc2ccccc2c1 Amb33362186 [0,1,0,0,0,0|2,0,0]=3 1070 B15R2.1668 CN(O)Cc1ccc2ccccc2n1 Amb33201930 [0,1,0,0,0,0|3,0,0]=4 1071 B15R2.1668 CN(O)Cc1ccc2cccnc2c1 Amb32879523 [0,1,0,0,0,0|3,0,0]=4 1072 B15R2.1668 CN(O)Cc1ccc2ncccc2c1 Amb33143677 [0,1,0,0,0,0|3,0,0]=4 1073 B15R2.1668 CN(O)Cc1cnc2ccccc2c1 Amb33325132 [0,1,0,0,0,0|3,0,0]=4 1074 B15R2.1668 C[C@@H](N)Cc1ccc2ccccc2c1 Amb25213558 [0,1,0,0,0,0|1,0,0]=2 1075 B15R2.1668 C[C@@H](N)Cc1ccc2ccccc2n1 Amb33080324 [0,1,0,0,0,0|2,0,0]=3 1076 B15R2.1668 C[C@@H](N)Cc1ccc2cccnc2c1 Amb32878875 [0,1,0,0,0,0|2,0,0]=3 1077 B15R2.1668 C[C@@H](N)Cc1ccc2ncccc2c1 Amb33148693 [0,1,0,0,0,0|2,0,0]=3 1078 B15R2.1668 C[C@@H](N)Cc1cnc2ccccc2c1 Amb33428980 [0,1,0,0,0,0|2,0,0]=3 1079 B15R2.1668 C[C@@H](N)Cc1cnc2ccccc2n1 Amb33377327 [0,1,0,0,0,0|3,0,0]=4 1080 B15R2.1668 C[C@@H](O)Cc1ccc2ccccc2c1 Amb33361949 [0,1,0,0,0,0|1,0,0]=2 1081 B15R2.1668 C[C@@H](O)Cc1ccc2ccccc2n1 Amb33201374 [0,1,0,0,0,0|2,0,0]=3 1082 B15R2.1668 C[C@@H](O)Cc1ccc2cccnc2c1 Amb32878872 [0,1,0,0,0,0|2,0,0]=3 1083 B15R2.1668 C[C@@H](O)Cc1ccc2ncccc2c1 Amb33148691 [0,1,0,0,0,0|2,0,0]=3 1084 B15R2.1668 C[C@@H](O)Cc1cnc2ccccc2c1 Amb33323982 [0,1,0,0,0,0|2,0,0]=3 1085 B15R2.1668 C[C@@H](O)Cc1cnc2ccccc2n1 Amb33377323 [0,1,0,0,0,0|3,0,0]=4 1086 B15R2.1668 C[C@H](N)Cc1ccc2ccccc2c1 Amb28246444 [0,1,0,0,0,0|1,0,0]=2 1087 B15R2.1668 C[C@H](N)Cc1ccc2ccccc2n1 Amb33448716 [0,1,0,0,0,0|2,0,0]=3 1088 B15R2.1668 C[C@H](N)Cc1ccc2cccnc2c1 Amb32878874 [0,1,0,0,0,0|2,0,0]=3 1089 B15R2.1668 C[C@H](N)Cc1ccc2ncccc2c1 Amb33148745 [0,1,0,0,0,0|2,0,0]=3 1090 B15R2.1668 C[C@H](N)Cc1cnc2ccccc2c1 Amb33080151 [0,1,0,0,0,0|2,0,0]=3 1091 B15R2.1668 C[C@H](N)Cc1cnc2ccccc2n1 Amb33377326 [0,1,0,0,0,0|3,0,0]=4 1092 B15R2.1668 C[C@H](O)Cc1ccc2ccccc2c1 Amb33361951 [0,1,0,0,0,0|1,0,0]=2 1093 B15R2.1668 C[C@H](O)Cc1ccc2ccccc2n1 Amb33201375 [0,1,0,0,0,0|2,0,0]=3 1094 B15R2.1668 C[C@H](O)Cc1ccc2cccnc2c1 Amb32878873 [0,1,0,0,0,0|2,0,0]=3 1095 B15R2.1668 C[C@H](O)Cc1ccc2ncccc2c1 Amb33148692 [0,1,0,0,0,0|2,0,0]=3 1096 B15R2.1668 C[C@H](O)Cc1cnc2ccccc2c1 Amb33323983 [0,1,0,0,0,0|2,0,0]=3 1097 B15R2.1668 C[C@H](O)Cc1cnc2ccccc2n1 Amb33377325 [0,1,0,0,0,0|3,0,0]=4 1098 B15R2.1668 C\[N+]([O-])=C/c1ccc2ccccc2c1 Amb2441922 [0,1,0,0,0,0|2,0,0]=3 1099 B15R2.1668 C\[N+]([O-])=C\c1ccc2ccccc2c1 Amb27666333 [0,1,0,0,0,0|2,0,0]=3 1100 B15R2.1668 FC(F)Oc1ccc2ccccc2c1 Amb6331647 [0,1,0,0,0,0|1,0,0]=2 1101 B15R2.1668 FC(F)Oc1ccc2cccnc2c1 Amb27803988 [0,1,0,0,0,0|2,0,0]=3 1102 B15R2.1668 FC(F)Oc1ccc2ncccc2c1 Amb17236150 [0,1,0,0,0,0|2,0,0]=3 1103 B15R2.1668 FC(F)Oc1cnc2ccccc2c1 Amb25772193 [0,1,0,0,0,0|2,0,0]=3 1104 B15R2.1668 FC(F)Oc1cnc2ccccc2n1 Amb27959184 [0,1,0,0,0,0|3,0,0]=4 1105 B15R2.1668 N=C(N)Cc1ccc2ccccc2c1 Amb25072757 [0,1,0,0,0,0|2,0,1]=4 1106 B15R2.1668 N=C(N)Sc1ccc2ccccc2c1 Amb27748332 [0,1,0,0,0,0|1,1,1]=4 1107 B15R2.1668 NC(=O)Cc1ccc2ccccc2c1 Amb33551576 [0,1,0,0,0,0|2,0,1]=4 1108 B15R2.1668 NC(=O)Nc1ccc2ccccc2c1 Amb2613780 [0,1,0,0,0,0|2,0,1]=4 1109 B15R2.1668 NC(=S)Cc1ccc2ccccc2c1 Amb28248765 [0,1,0,0,0,0|2,0,1]=4 1110 B15R2.1668 NC(=S)Nc1ccc2ccccc2c1 Amb10810178 [0,1,0,0,0,0|2,0,1]=4 1111 B15R2.1668 O=C(Cl)Cc1ccc2ccccc2c1 Amb2689824 [0,1,0,0,0,0|2,0,1]=4 1112 B15R2.1668 O=C(Cl)Nc1ccc2ccccc2c1 Amb35637030 [0,1,0,0,0,0|2,0,1]=4 1113 B15R2.1668 O=C(Cl)Oc1ccc2ccccc2c1 Amb19930198 [0,1,0,0,0,0|1,0,1]=3 1114 B15R2.1668 O=C(O)Cc1ccc2ccccc2c1 Amb1195907 [0,1,0,0,0,0|2,0,1]=4 1115 B15R2.1668 O=S([O-])Cc1ccc2ccccc2c1 Amb32754427 [0,1,0,0,0,0|3,0,0]=4 1116 B15R2.1668 O=[N+]([O-])Cc1ccc2ccccc2c1 Amb33361941 [0,1,0,0,0,0|3,0,0]=4 1117 B15R2.1668 OB(O)Cc1ccc2ccccc2c1 Amb25759675 [0,1,0,0,0,0|3,0,0]=4 1118 B15R2.1668 OB(O)Oc1ccc2ccccc2c1 Amb27228000 [0,1,0,0,0,0|2,0,0]=3 1119 B15R2.1668 S=C(Cl)Oc1ccc2ccccc2c1 Amb8384466 [0,1,0,0,0,0|1,0,1]=3 1120 B15R2.1668 S=C(S)Nc1ccc2ccccc2c1 Amb27268453 [0,1,0,0,0,0|2,0,1]=4 1121 B15R2.2220 C=CCc1ccc2ccccc2c1F Amb24371373 [0,1,0,0,0,0|1,0,2]=4 1122 B15R2.2220 C=CCc1ccc2ccccc2c1N Amb18129276 [0,1,0,0,0,0|1,0,2]=4 1123 B15R2.2220 C=COc1ccc2ccccc2c1Br Amb27456923 [0,1,0,0,0,0|0,0,2]=3 1124 B15R2.2220 CCCN1C=Nc2ccccc2C1=O Amb20258665 [0,1,0,0,0,0|3,0,0]=4 1125 B15R2.2220 CCCc1ccc2ccccc2c1N Amb28121094 [0,1,0,0,0,0|1,0,0]=2 1126 B15R2.2220 CCCc1ccc2cccnc2c1N Amb27878686 [0,1,0,0,0,0|2,0,0]=3 1127 B15R2.2220 CCCc1cnc2ccccc2c1O Amb27183962 [0,1,0,0,0,0|2,0,0]=3 1128 B15R2.2220 CCCc1ncc2ccccc2c1F Amb28326226 [0,1,0,0,0,0|2,0,0]=3 1129 B15R2.2220 CCNc1ccc2ncccc2c1N Amb9676269 [0,1,0,0,0,0|2,0,0]=3 1130 B15R2.2220 CCO[C@H]1C=Cc2ccccc2[C@@H]1O Amb28194167 [0,1,0,0,0,0|0,0,2]=3 1131 B15R2.2220 CCOc1ccc2ccccc2c1Br Amb22490058 [0,1,0,0,0,0|0,0,0]=1 1132 B15R2.2220 CCOc1ccc2ccccc2c1C Amb25167822 [0,1,0,0,0,0|0,0,0]=1 1133 B15R2.2220 CCOc1ccc2ccccc2c1Cl Amb26331921 [0,1,0,0,0,0|0,0,0]=1 1134 B15R2.2220 CCOc1ccc2ccccc2c1F Amb26861348 [0,1,0,0,0,0|0,0,0]=1 1135 B15R2.2220 CCOc1ccc2ccccc2c1I Amb26857682 [0,1,0,0,0,0|0,0,0]=1 1136 B15R2.2220 CCOc1ccc2ccccc2c1N Amb17200241 [0,1,0,0,0,0|0,0,0]=1 1137 B15R2.2220 CCOc1ccc2ccccc2c1O Amb17200242 [0,1,0,0,0,0|0,0,0]=1 1138 B15R2.2220 CCOc1ccc2ccccc2c1S Amb26413934 [0,1,0,0,0,0|0,0,0]=1 1139 B15R2.2220 CCOc1ccc2ncccc2c1Br Amb23437323 [0,1,0,0,0,0|1,0,0]=2 1140 B15R2.2220 CCOc1ncc2ccccc2c1Cl Amb2609738 [0,1,0,0,0,0|1,0,0]=2 1141 B15R2.2220 CCSC1=CNc2ccccc2C1=O Amb26382867 [0,1,0,0,0,0|1,1,0]=3 1142 B15R2.2220 CCSc1ccc2cccnc2c1N Amb18654773 [0,1,0,0,0,0|1,1,0]=3 1143 B15R2.2220 CCSc1ncc2ccccc2c1N Amb18654775 [0,1,0,0,0,0|1,1,0]=3 1144 B15R2.2220 CNCc1ccc2ccccc2c1C Amb24696350 [0,1,0,0,0,0|2,0,0]=3 1145 B15R2.2220 CNCc1ccc2ccccc2c1F Amb28368002 [0,1,0,0,0,0|2,0,0]=3 1146 B15R2.2220 COCC1=COc2ccccc2C1=O Amb26641807 [0,1,0,0,0,0|3,0,0]=4 1147 B15R2.2220 COCc1ccc2ccccc2c1Br Amb3939644 [0,1,0,0,0,0|2,0,0]=3 1148 B15R2.2220 CSCc1cnc2ccccc2c1O Amb18655102 [0,1,0,0,0,0|3,0,0]=4 1149 B15R2.2220 Cc1c(CC#N)ccc2ccccc12 Amb2755887 [0,1,0,0,0,0|2,0,1]=4 1150 B15R2.2220 Cc1c(CCCl)ccc2ccccc12 Amb27776862 [0,1,0,0,0,0|2,0,0]=3 1151 B15R2.2220 Cc1c(CCN)ccc2ccccc12 Amb27199021 [0,1,0,0,0,0|2,0,0]=3 1152 B15R2.2220 N#CCc1ccc2ccccc2c1Br Amb28135482 [0,1,0,0,0,0|2,0,1]=4 1153 B15R2.2220 N#CCc1ccc2ccccc2c1Cl Amb26571947 [0,1,0,0,0,0|2,0,1]=4 1154 B15R2.2220 N#CCc1ccc2ccccc2c1F Amb24521156 [0,1,0,0,0,0|2,0,1]=4 1155 B15R2.2220 N#CCc1ccc2ccccc2c1I Amb25804664 [0,1,0,0,0,0|2,0,1]=4 1156 B15R2.2220 N#CCc1ccc2ccccc2c1N Amb25335372 [0,1,0,0,0,0|2,0,1]=4 1157 B15R2.2220 N#CSc1ccc2ccccc2c1N Amb19748643 [0,1,0,0,0,0|1,1,1]=4 1158 B15R2.2220 N=C1c2ccccc2C=CN1CCO Amb27191070 [0,1,0,0,0,0|3,0,0]=4 1159 B15R2.2220 NCCC1=COc2ccccc2C1=O Amb25865889 [0,1,0,0,0,0|3,0,0]=4 1160 B15R2.2220 NCCN1C=Cc2ccccc2C1=O Amb18537918 [0,1,0,0,0,0|3,0,0]=4 1161 B15R2.2220 NCCc1ccc2ccccc2c1F Amb28280797 [0,1,0,0,0,0|2,0,0]=3 1162 B15R2.2220 NCCc1ccc2ccccc2c1O Amb18191126 [0,1,0,0,0,0|2,0,0]=3 1163 B15R2.2220 NNCc1ccc2ccccc2c1Br Amb27794546 [0,1,0,0,0,0|3,0,0]=4 1164 B15R2.2220 O=C1c2ccccc2C=CN1CCBr Amb27594021 [0,1,0,0,0,0|3,0,0]=4 1165 B15R2.2220 O=C1c2ccccc2C=CN1CCCl Amb27210161 [0,1,0,0,0,0|3,0,0]=4 1166 B15R2.2220 O=C1c2ccccc2C=CN1CCO Amb18041270 [0,1,0,0,0,0|3,0,0]=4 1167 B15R2.2220 O=C=Nc1ccc2ccccc2c1Br Amb27195278 [0,1,0,0,0,0|2,0,1]=4 1168 B15R2.2220 O=CCc1ccc2ccccc2c1Br Amb28348495 [0,1,0,0,0,0|2,0,1]=4 1169 B15R2.2220 O=CNc1ccc2ccccc2c1O Amb27863624 [0,1,0,0,0,0|2,0,1]=4 1170 B15R2.2220 OCCc1ccc2ccccc2c1Br Amb27198535 [0,1,0,0,0,0|2,0,0]=3 1171 B15R2.10252 C=CCc1ccc2cc(O)ccc2c1 Amb27211953 [0,1,0,0,0,0|1,0,2]=4 1172 B15R2.10252 CCCc1ccc2cc(Br)ccc2n1 Amb8388526 [0,1,0,0,0,0|2,0,0]=3 1173 B15R2.10252 CCCc1ccc2cc(N)ccc2c1 Amb28066680 [0,1,0,0,0,0|1,0,0]=2 1174 B15R2.10252 CCCc1ccc2cc(O)ccc2c1 Amb2721343 [0,1,0,0,0,0|1,0,0]=2 1175 B15R2.10252 CCCc1ccc2nc(Br)ccc2c1 Amb27812117 [0,1,0,0,0,0|2,0,0]=3 1176 B15R2.10252 CCCc1ccc2nc(C)ccc2c1 Amb28194319 [0,1,0,0,0,0|2,0,0]=3 1177 B15R2.10252 CCCc1ccc2nc(Cl)ccc2c1 Amb27495214 [0,1,0,0,0,0|2,0,0]=3 1178 B15R2.10252 CCNc1ccc2cc(Br)ccc2c1 Amb27223771 [0,1,0,0,0,0|1,0,0]=2 1179 B15R2.10252 CCNc1ccc2cc(F)ccc2n1 Amb27804386 [0,1,0,0,0,0|2,0,0]=3 1180 B15R2.10252 CCNc1ccc2cc(I)ccc2n1 Amb27594263 [0,1,0,0,0,0|2,0,0]=3 1181 B15R2.10252 CCNc1ccc2cc(N)ccc2n1 Amb9310171 [0,1,0,0,0,0|2,0,0]=3 1182 B15R2.10252 CCNc1ncc2cc(Br)ccc2n1 Amb32791785 [0,1,0,0,0,0|3,0,0]=4 1183 B15R2.10252 CCOc1ccc2c(c1)C=CC(=O)N2 Amb18546024 [0,1,0,0,0,0|1,0,0]=2 1184 B15R2.10252 CCOc1ccc2c(c1)C=CC(=O)O2 Amb27847274 [0,1,0,0,0,0|1,0,0]=2 1185 B15R2.10252 CCOc1ccc2c(c1)CCC(=O)C2 Amb4296955 [0,1,0,0,0,0|0,0,3]=4 1186 B15R2.10252 CCOc1ccc2c(c1)CCC(=O)N2 Amb17545214 [0,1,0,0,0,0|1,0,2]=4 1187 B15R2.10252 CCOc1ccc2c(c1)CCC(=S)N2 Amb27481523 [0,1,0,0,0,0|1,0,2]=4 1188 B15R2.10252 CCOc1ccc2c(c1)N=CC(=O)N2 Amb25324999 [0,1,0,0,0,0|2,0,0]=3 1189 B15R2.10252 CCOc1ccc2c(c1)OCC(=S)N2 Amb28342354 [0,1,0,0,0,0|2,0,1]=4 1190 B15R2.10252 CCOc1ccc2c(c1)SCC(=O)N2 Amb1103424 [0,1,0,0,0,0|2,0,1]=4 1191 B15R2.10252 CCOc1ccc2c(c1)SCC(=S)N2 Amb2966764 [0,1,0,0,0,0|2,0,1]=4 1192 B15R2.10252 CCOc1ccc2c(n1)SC=C(N)N2 Amb25096407 [0,1,0,0,0,0|3,0,0]=4 1193 B15R2.10252 CCOc1ccc2cc(Br)ccc2c1 Amb1482232 [0,1,0,0,0,0|0,0,0]=1 1194 B15R2.10252 CCOc1ccc2cc(Br)ccc2n1 Amb25705255 [0,1,0,0,0,0|1,0,0]=2 1195 B15R2.10252 CCOc1ccc2cc(Br)cnc2c1 Amb24637031 [0,1,0,0,0,0|1,0,0]=2 1196 B15R2.10252 CCOc1ccc2cc(C)ccc2c1 Amb26873310 [0,1,0,0,0,0|0,0,0]=1 1197 B15R2.10252 CCOc1ccc2cc(Cl)ccc2c1 Amb27450094 [0,1,0,0,0,0|0,0,0]=1 1198 B15R2.10252 CCOc1ccc2cc(N)ccc2c1 Amb10070900 [0,1,0,0,0,0|0,0,0]=1 1199 B15R2.10252 CCOc1ccc2cc(N)cnc2c1 Amb23580255 [0,1,0,0,0,0|1,0,0]=2 1200 B15R2.10252 CCOc1ccc2cc(O)ccc2c1 Amb27611869 [0,1,0,0,0,0|0,0,0]=1 1201 B15R2.10252 CCOc1ccc2cc(O)ncc2c1 Amb27603685 [0,1,0,0,0,0|1,0,0]=2 1202 B15R2.10252 CCOc1ccc2cc(S)ccc2c1 Amb27182015 [0,1,0,0,0,0|0,0,0]=1 1203 B15R2.10252 CCOc1ccc2nc(Br)ccc2c1 Amb27166226 [0,1,0,0,0,0|1,0,0]=2 1204 B15R2.10252 CCOc1ccc2nc(C)ccc2c1 Amb4035127 [0,1,0,0,0,0|1,0,0]=2 1205 B15R2.10252 CCOc1ccc2nc(Cl)ccc2c1 Amb23449334 [0,1,0,0,0,0|1,0,0]=2 1206 B15R2.10252 CCOc1ccc2nc(Cl)cnc2c1 Amb23557654 [0,1,0,0,0,0|2,0,0]=3 1207 B15R2.10252 CCOc1ccc2nc(Cl)ncc2c1 Amb23412165 [0,1,0,0,0,0|2,0,0]=3 1208 B15R2.10252 CCOc1ccc2nc(N)ccc2c1 Amb24474585 [0,1,0,0,0,0|1,0,0]=2 1209 B15R2.10252 CCOc1ccc2nc(S)ccc2c1 Amb26876637 [0,1,0,0,0,0|1,0,0]=2 1210 B15R2.10252 CCOc1cnc2cc(F)ccc2n1 Amb27463519 [0,1,0,0,0,0|2,0,0]=3 1211 B15R2.10252 CCOc1cnc2cc(N)ccc2n1 Amb28135716 [0,1,0,0,0,0|2,0,0]=3 1212 B15R2.10252 CCSc1ccc2nc(C)ccc2c1 Amb27484890 [0,1,0,0,0,0|1,1,0]=3 1213 B15R2.10252 CCSc1cnc2cc(Cl)ccc2n1 Amb27186409 [0,1,0,0,0,0|2,1,0]=4 1214 B15R2.10252 CNCc1cc2ccc(Cl)cc2cn1 Amb28190759 [0,1,0,0,0,0|3,0,0]=4 1215 B15R2.10252 CNCc1ccc2cc(Br)ccc2n1 Amb17583544 [0,1,0,0,0,0|3,0,0]=4 1216 B15R2.10252 CNCc1ccc2cc(F)ccc2n1 Amb8010471 [0,1,0,0,0,0|3,0,0]=4 1217 B15R2.10252 CNCc1ccc2cc(O)ccc2c1 Amb27975485 [0,1,0,0,0,0|2,0,0]=3 1218 B15R2.10252 CNCc1ccc2nc(C)ccc2c1 Amb26858130 [0,1,0,0,0,0|3,0,0]=4 1219 B15R2.10252 CNCc1cnc2cc(C)ccc2c1 Amb26060610 [0,1,0,0,0,0|3,0,0]=4 1220 B15R2.10252 CNCc1cnc2cc(Cl)ccc2c1 Amb17579191 [0,1,0,0,0,0|3,0,0]=4 1221 B15R2.10252 CNCc1cnc2cc(F)ccc2c1 Amb24535037 [0,1,0,0,0,0|3,0,0]=4 1222 B15R2.10252 COCc1ccc2c(c1)C=CC(=O)N2 Amb27834935 [0,1,0,0,0,0|3,0,0]=4 1223 B15R2.10252 COCc1ccc2nc(Cl)ccc2c1 Amb28065041 [0,1,0,0,0,0|3,0,0]=4 1224 B15R2.10252 COCc1cnc2cc(C)ccc2c1 Amb28200922 [0,1,0,0,0,0|3,0,0]=4 1225 B15R2.10252 Cc1ccc2cc(CC#N)ccc2c1 Amb18648519 [0,1,0,0,0,0|2,0,1]=4 1226 B15R2.10252 Cc1ccc2cc(CCBr)ccc2n1 Amb25692632 [0,1,0,0,0,0|3,0,0]=4 1227 B15R2.10252 Cc1ccc2cc(CCCl)ccc2n1 Amb27418037 [0,1,0,0,0,0|3,0,0]=4 1228 B15R2.10252 Cc1ccc2cc(CCN)ccc2n1 Amb19104339 [0,1,0,0,0,0|3,0,0]=4 1229 B15R2.10252 Cc1ccc2cc(CCN)cnc2c1 Amb25869346 [0,1,0,0,0,0|3,0,0]=4 1230 B15R2.10252 Cc1ccc2cc(CCO)ccc2n1 Amb25814558 [0,1,0,0,0,0|3,0,0]=4 1231 B15R2.10252 Cc1ccc2cc(CCS)ccc2n1 Amb33200681 [0,1,0,0,0,0|3,0,0]=4 1232 B15R2.10252 N#CCc1ccc2cc(Br)ccc2c1 Amb22234432 [0,1,0,0,0,0|2,0,1]=4 1233 B15R2.10252 N#CCc1ccc2cc(Cl)ccc2c1 Amb27388840 [0,1,0,0,0,0|2,0,1]=4 1234 B15R2.10252 N#CCc1ccc2cc(F)ccc2c1 Amb26507954 [0,1,0,0,0,0|2,0,1]=4 1235 B15R2.10252 N#CCc1ccc2cc(O)ccc2c1 Amb18648748 [0,1,0,0,0,0|2,0,1]=4 1236 B15R2.10252 N#CNc1ccc2cc(Br)ccc2c1 Amb28398269 [0,1,0,0,0,0|2,0,1]=4 1237 B15R2.10252 NCCc1ccc2cc(Br)ccc2n1 Amb17583552 [0,1,0,0,0,0|3,0,0]=4 1238 B15R2.10252 NCCc1ccc2cc(Cl)ccc2n1 Amb17579201 [0,1,0,0,0,0|3,0,0]=4 1239 B15R2.10252 NCCc1ccc2cc(F)ccc2n1 Amb17578524 [0,1,0,0,0,0|3,0,0]=4 1240 B15R2.10252 NCCc1ccc2cc(I)ccc2n1 Amb17591621 [0,1,0,0,0,0|3,0,0]=4 1241 B15R2.10252 NCCc1cnc2cc(Cl)ccc2c1 Amb26081185 [0,1,0,0,0,0|3,0,0]=4 1242 B15R2.10252 NCCc1cnc2cc(F)ccc2c1 Amb25864563 [0,1,0,0,0,0|3,0,0]=4 1243 B15R2.10252 O=C1C=Cc2cc(CCO)ccc2O1 Amb27206103 [0,1,0,0,0,0|3,0,0]=4 1244 B15R2.10252 O=C=Nc1ccc2cc(Br)ccc2c1 Amb27417877 [0,1,0,0,0,0|2,0,1]=4 1245 B15R2.10252 O=CNc1ccc2cc(Br)ccc2c1 Amb27164988 [0,1,0,0,0,0|2,0,1]=4 1246 B15R2.10252 OCCc1ccc2cc(F)ccc2n1 Amb26339387 [0,1,0,0,0,0|3,0,0]=4 1247 B15R2.10252 S=C=Nc1ccc2cc(Br)ccc2c1 Amb27448055 [0,1,0,0,0,0|2,0,1]=4 1248 B15R2.10252 [N-]=[N+]=Nc1ccc2cc(Br)ccc2c1 Amb28074542 [0,1,0,0,0,0|3,0,0]=4 1249 B15R2.54379 CCCc1ccc2c(Br)nccc2c1 Amb18560409 [0,1,0,0,0,0|2,0,0]=3 1250 B15R2.54379 CCCc1ccc2c(C)cccc2n1 Amb27832922 [0,1,0,0,0,0|2,0,0]=3 1251 B15R2.54379 CCCc1ccc2c(Cl)nccc2c1 Amb18560382 [0,1,0,0,0,0|2,0,0]=3 1252 B15R2.54379 CCCc1ccc2c(N)nccc2c1 Amb18560442 [0,1,0,0,0,0|2,0,0]=3 1253 B15R2.54379 CCCc1ccc2c(O)nccc2c1 Amb18560348 [0,1,0,0,0,0|2,0,0]=3 1254 B15R2.54379 CCNc1ccc2c(Cl)cccc2n1 Amb28256616 [0,1,0,0,0,0|2,0,0]=3 1255 B15R2.54379 CCNc1ncc2c(Br)cccc2n1 Amb33100801 [0,1,0,0,0,0|3,0,0]=4 1256 B15R2.54379 CCOc1ccc2c(Br)nccc2c1 Amb18062822 [0,1,0,0,0,0|1,0,0]=2 1257 B15R2.54379 CCOc1ccc2c(Cl)nccc2c1 Amb17216945 [0,1,0,0,0,0|1,0,0]=2 1258 B15R2.54379 CCOc1ccc2c(N)cccc2c1 Amb24081670 [0,1,0,0,0,0|0,0,0]=1 1259 B15R2.54379 CCOc1ccc2c(N)nccc2c1 Amb17216966 [0,1,0,0,0,0|1,0,0]=2 1260 B15R2.54379 CCOc1ccc2c(O)ccnc2c1 Amb24111547 [0,1,0,0,0,0|1,0,0]=2 1261 B15R2.54379 CCOc1ccc2c(O)nccc2c1 Amb18062800 [0,1,0,0,0,0|1,0,0]=2 1262 B15R2.54379 CCOc1ccc2c(c1)CCCC2=O Amb5399101 [0,1,0,0,0,0|0,0,3]=4 1263 B15R2.54379 CCOc1ccc2c(c1)CCNC2=O Amb18563080 [0,1,0,0,0,0|1,0,2]=4 1264 B15R2.54379 CNCc1cnc2c(Br)cccc2c1 Amb17583547 [0,1,0,0,0,0|3,0,0]=4 1265 B15R2.54379 CNCc1cnc2c(C)cccc2c1 Amb17578453 [0,1,0,0,0,0|3,0,0]=4 1266 B15R2.54379 CNCc1cnc2c(Cl)cccc2c1 Amb17579190 [0,1,0,0,0,0|3,0,0]=4 1267 B15R2.54379 CNCc1cnc2c(F)cccc2c1 Amb17578517 [0,1,0,0,0,0|3,0,0]=4 1268 B15R2.54379 CNCc1cnc2c(O)cccc2c1 Amb28205406 [0,1,0,0,0,0|3,0,0]=4 1269 B15R2.54379 COCc1ccc2c(Cl)cncc2c1 Amb27442082 [0,1,0,0,0,0|3,0,0]=4 1270 B15R2.54379 COCc1ccc2c(c1)NC=CC2=S Amb27413574 [0,1,0,0,0,0|3,0,0]=4 1271 B15R2.54379 COCc1cnc2c(O)cccc2c1 Amb28194625 [0,1,0,0,0,0|3,0,0]=4 1272 B15R2.54379 Cc1cccc2cc(CC#N)ccc12 Amb18648517 [0,1,0,0,0,0|2,0,1]=4 1273 B15R2.54379 Cc1cccc2cc(CCN)cnc12 Amb20669308 [0,1,0,0,0,0|3,0,0]=4 1274 B15R2.54379 N#CCc1ccc2c(Br)cccc2c1 Amb25844496 [0,1,0,0,0,0|2,0,1]=4 1275 B15R2.54379 N#CCc1ccc2c(Cl)cccc2c1 Amb24417886 [0,1,0,0,0,0|2,0,1]=4 1276 B15R2.54379 N#CCc1ccc2c(F)cccc2c1 Amb27417606 [0,1,0,0,0,0|2,0,1]=4 1277 B15R2.54379 N#CCc1ccc2c(I)cccc2c1 Amb24727245 [0,1,0,0,0,0|2,0,1]=4 1278 B15R2.54379 N#CCc1ccc2c(N)cccc2c1 Amb26449690 [0,1,0,0,0,0|2,0,1]=4 1279 B15R2.54379 N#CCc1ccc2c(O)cccc2c1 Amb18648746 [0,1,0,0,0,0|2,0,1]=4 1280 B15R2.54379 O\N=C/c1ccc2c(Br)cccc2c1 Amb17777800 [0,1,0,0,0,0|3,0,0]=4 1281 B13R1.42 C=C(\C=C\c1ccccc1)CCN Amb33081079 [0,0,1,0,0,0|2,0,0]=3 1282 B13R1.42 CCNC(=O)\C=C\c1ccccc1 Amb3358403 [0,0,1,0,0,0|2,0,0]=3 1283 B13R1.42 CCOC(=O)C#Cc1ccccc1 Amb2721509 [0,0,1,0,0,0|1,0,2]=4 1284 B13R1.42 CCOC(=O)CCc1ccccc1 Amb3940133 [0,0,1,0,0,0|1,0,2]=4 1285 B13R1.42 CCOC(=O)CNc1ccccc1 Amb1025527 [0,0,1,0,0,0|2,0,1]=4 1286 B13R1.42 CCOC(=O)CNc1ccccc1 Amb21961619 [0,0,1,0,0,0|2,0,1]=4 1287 B13R1.42 CCOC(=O)COc1ccccc1 Amb2687923 [0,0,1,0,0,0|2,0,1]=4 1288 B13R1.42 CCOC(=O)CSc1ccccc1 Amb2408276 [0,0,1,0,0,0|2,0,1]=4 1289 B13R1.42 CCOC(=O)NCc1ccccc1 Amb2736961 [0,0,1,0,0,0|2,0,1]=4 1290 B13R1.42 CCOC(=O)OCc1ccccc1 Amb27166327 [0,0,1,0,0,0|2,0,1]=4 1291 B13R1.42 CCOC(=O)\C=C\c1ccccc1 Amb6296621 [0,0,1,0,0,0|1,0,0]=2 1292 B13R1.42 CCOC(=O)\C=C\c1ccccn1 Amb33996583 [0,0,1,0,0,0|2,0,0]=3 1293 B13R1.42 CCOC(=O)\C=C\c1cccnc1 Amb15695192 [0,0,1,0,0,0|2,0,0]=3 1294 B13R1.42 CCOC(=O)\C=C\c1ccncc1 Amb33870677 [0,0,1,0,0,0|2,0,0]=3 1295 B13R1.42 CCOC(=O)\C=N\c1ccccc1 Amb2609189 [0,0,1,0,0,0|2,0,0]=3 1296 B13R1.42 CNCC(=O)\C=C\c1ccccc1 Amb33081764 [0,0,1,0,0,0|3,0,0]=4 1297 B13R1.42 CONC(=O)\C=C\c1ccccc1 Amb28064704 [0,0,1,0,0,0|3,0,0]=4 1298 B13R1.42 C\C=C\C(=O)\C=C\c1ccccc1 Amb28074660 [0,0,1,0,0,0|2,0,1]=4 1299 B13R1.42 NCCC(=O)\C=C\c1ccccc1 Amb33081763 [0,0,1,0,0,0|3,0,0]=4 1300 B13R1.77 C=CCCc1ccc(OCC)cc1 Amb6299192 [0,0,1,0,0,0|0,0,2]=3 1301 B13R1.77 C=CCNc1ccc(OCC)cc1 Amb17306072 [0,0,1,0,0,0|1,0,1]=3 1302 B13R1.77 C=CCOc1ccc(NCC)cc1 Amb24102914 [0,0,1,0,0,0|2,0,1]=4 1303 B13R1.77 CCCc1ccc(\C=C\CN)cc1 Amb18065592 [0,0,1,0,0,0|2,0,1]=4 1304 B13R1.77 CCOc1ccc(CCC=O)cc1 Amb17081683 [0,0,1,0,0,0|1,0,2]=4 1305 B13R1.77 CCOc1ccc(OCC=O)cc1 Amb5731847 [0,0,1,0,0,0|2,0,1]=4 1306 B13R1.77 CCOc1ccc(\C=C\C=O)cc1 Amb17335119 [0,0,1,0,0,0|1,0,0]=2 1307 B13R1.77 CCOc1ccc(\C=C\CN)cc1 Amb18065702 [0,0,1,0,0,0|1,0,1]=3 1308 B13R1.77 CCOc1ccc(\C=C\CO)cc1 Amb23555650 [0,0,1,0,0,0|1,0,1]=3 1309 B13R1.77 COCc1ccc(\C=C\C=O)cc1 Amb33358838 [0,0,1,0,0,0|3,0,0]=4 1310 B13R1.79 CCO\C(C=O)=C/c1ccccc1 Amb22546895 [0,0,1,0,0,0|1,0,0]=2 1311 B13R1.384 C=CCc1cc(OCC)ccc1O Amb403057 [0,0,1,0,0,0|1,0,1]=3 1312 B13R1.384 CCOc1ccc(N)c(\C=N\O)c1 Amb27845386 [0,0,1,0,0,0|3,0,0]=4 1313 B13R1.384 CCOc1ccc(O)c(\C=C\Br)c1 Amb33134943 [0,0,1,0,0,0|2,0,0]=3 1314 B13R1.384 CCOc1ccc(O)c(\C=N\N)c1 Amb27750658 [0,0,1,0,0,0|3,0,0]=4 1315 B13R1.384 CCOc1ccc(O)c(\C=N\O)c1 Amb23569620 [0,0,1,0,0,0|3,0,0]=4 1316 B13R1.386 CCOc1ccc(C=O)c(OC)c1 Amb18128655 [0,0,1,0,0,0|2,0,1]=4 1317 B13R1.386 CCOc1ccc(NN)c(C=O)c1 Amb27669883 [0,0,1,0,0,0|3,0,0]=4 1318 B13R1.388 CCOc1ccc(CC=O)c(C)c1 Amb33226075 [0,0,1,0,0,0|1,0,2]=4 1319 B13R1.388 CCOc1ccc(\C=C\Br)c(C)c1 Amb33135324 [0,0,1,0,0,0|1,0,1]=3 1320 B13R1.388 CCOc1ccc(\C=C\Br)c(O)c1 Amb33134835 [0,0,1,0,0,0|2,0,0]=3 1321 B13R1.388 CCOc1ccc(\C=N\N)c(O)c1 Amb27769600 [0,0,1,0,0,0|3,0,0]=4 1322 B13R1.388 CCOc1ccc(\C=N\O)c(O)c1 Amb25307142 [0,0,1,0,0,0|3,0,0]=4 1323 B13R1.470 CCOC(=N)Cc1ccccc1C Amb20673147 [0,0,1,0,0,0|1,0,2]=4 1324 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb19083262 [0,0,1,0,0,0|2,0,1]=4 1325 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb20673156 [0,0,1,0,0,0|2,0,1]=4 1326 B13R1.470 CCOC(=N)Cc1ccccc1F Amb20673150 [0,0,1,0,0,0|2,0,1]=4 1327 B13R1.470 CCOC(=O)Cc1ccccc1Br Amb3429172 [0,0,1,0,0,0|2,0,1]=4 1328 B13R1.470 CCOC(=O)Cc1ccccc1C Amb3940131 [0,0,1,0,0,0|1,0,2]=4 1329 B13R1.470 CCOC(=O)Cc1ccccc1Cl Amb9243016 [0,0,1,0,0,0|2,0,1]=4 1330 B13R1.470 CCOC(=O)Cc1ccccc1F Amb6357916 [0,0,1,0,0,0|2,0,1]=4 1331 B13R1.470 CCOC(=O)Cc1ccccc1I Amb22475916 [0,0,1,0,0,0|2,0,1]=4 1332 B13R1.470 CCOC(=O)Cc1ccccc1N Amb2698942 [0,0,1,0,0,0|2,0,1]=4 1333 B13R1.470 CCOC(=O)Cc1ccccc1N Amb2699173 [0,0,1,0,0,0|2,0,1]=4 1334 B13R1.470 CCOC(=O)Cc1ccccc1O Amb17614081 [0,0,1,0,0,0|2,0,1]=4 1335 B13R1.470 CCOC(=O)Nc1ccccc1Br Amb6514657 [0,0,1,0,0,0|3,0,0]=4 1336 B13R1.470 CCOC(=O)Nc1ccccc1Cl Amb6514662 [0,0,1,0,0,0|3,0,0]=4 1337 B13R1.470 CCOC(=O)Nc1ccccc1I Amb27400466 [0,0,1,0,0,0|3,0,0]=4 1338 B13R1.470 CCOC(=S)Nc1ccccc1C Amb27947437 [0,0,1,0,0,0|2,0,1]=4 1339 B13R1.470 CCOC(=S)Nc1ccccc1Cl Amb28133428 [0,0,1,0,0,0|3,0,0]=4 1340 B13R1.567 C=CCOc1cccc(NCC)c1 Amb23539742 [0,0,1,0,0,0|2,0,1]=4 1341 B13R1.567 CCOc1cccc(C#CC=O)c1 Amb18117840 [0,0,1,0,0,0|1,0,2]=4 1342 B13R1.567 CCOc1cccc(CCC=O)c1 Amb17081682 [0,0,1,0,0,0|1,0,2]=4 1343 B13R1.567 CCOc1cccc(\C=C\C=O)c1 Amb17335118 [0,0,1,0,0,0|1,0,0]=2 1344 B13R1.567 CCOc1cccc(\C=C\CN)c1 Amb18564057 [0,0,1,0,0,0|1,0,1]=3 1345 B13R1.567 CCOc1cccc(\C=C\CO)c1 Amb33358399 [0,0,1,0,0,0|1,0,1]=3 1346 B13R1.567 COCc1cccc(\C=C\C=O)c1 Amb33449189 [0,0,1,0,0,0|3,0,0]=4 1347 B15R3.1739 C1=CN2CCN=C2c3ccccc31 Amb27953689 [0,0,0,1,0,0|3,0,0]=4 1348 B15R3.1739 C1=Cc2c(ccc3ccccc23)C1 Amb19887826 [0,0,0,1,0,0|1,0,2]=4 1349 B15R3.1739 C1=Cc2cccnc2C3=NCN=C13 Amb25830609 [0,0,0,1,0,0|3,0,0]=4 1350 B15R3.1739 C1=Cc2cnc3ccccc3c2C1 Amb28242950 [0,0,0,1,0,0|2,0,1]=4 1351 B15R3.1739 c1cc2ccc3c(c2cn1)OCO3 Amb28316410 [0,0,0,1,0,0|2,0,0]=3 1352 B15R3.1739 c1ccc2c(c1)ccc3ccsc32 Amb17666939 [0,0,0,1,0,0|2,0,1]=4 1353 B15R3.1739 c1ccc2c(c1)ccc3ncsc32 Amb2540147 [0,0,0,1,0,0|2,0,1]=4 1354 B15R3.1739 c1ccc2c(c1)ccc3nocc32 Amb25951882 [0,0,0,1,0,0|2,0,1]=4 1355 B15R3.1739 c1ccc2c(c1)ccc3nonc32 Amb27767951 [0,0,0,1,0,0|3,0,0]=4 1356 B15R3.1739 c1ccc2c(c1)ccc3nsnc32 Amb900713 [0,0,0,1,0,0|3,0,0]=4 1357 B15R3.1739 c1ccc2c(c1)cnc3occc32 Amb23437183 [0,0,0,1,0,0|1,0,2]=4 1358 B15R3.1739 c1ccc2c3c(ccc2c1)CCN3 Amb1138654 [0,0,0,1,0,0|2,0,0]=3 1359 B15R3.1739 c1ccc2c3c(ccc2c1)NCC3 Amb26616102 [0,0,0,1,0,0|1,0,0]=2 1360 B15R3.1739 c1cnc2cnc3c(c2c1)CCO3 Amb27179994 [0,0,0,1,0,0|2,0,0]=3 1361 B15R3.4266 c1cc2cc3c(cc2cn1)CCC3 Amb27251544 [0,0,0,1,0,0|2,0,0]=3 1362 B15R3.4266 c1cc2cc3c(cc2cn1)OCO3 Amb19100685 [0,0,0,1,0,0|2,0,0]=3 1363 B15R3.4266 c1ccc2c(c1)CC3CCOC3=N2 Amb27858303 [0,0,0,1,0,0|1,0,2]=4 1364 B15R3.4266 c1ccc2cc3c(cc2c1)CCC3 Amb20248692 [0,0,0,1,0,0|1,0,0]=2 1365 B15R3.4266 c1ccc2cc3c(cc2c1)COC3 Amb28292580 [0,0,0,1,0,0|2,0,0]=3 1366 B15R3.4266 c1ccc2cc3c(cc2c1)NCN3 Amb25694931 [0,0,0,1,0,0|2,0,0]=3 1367 B15R3.4266 c1ccc2cc3nocc3cc2c1 Amb25212657 [0,0,0,1,0,0|2,0,1]=4 1368 B15R3.4266 c1ccc2cc3nonc3cc2c1 Amb25918234 [0,0,0,1,0,0|3,0,0]=4 1369 B15R3.4266 c1ccc2cc3sccc3cc2c1 Amb2761581 [0,0,0,1,0,0|0,1,2]=4 1370 B15R3.4266 c1ccc2cc3scnc3cc2c1 Amb27264924 [0,0,0,1,0,0|1,1,1]=4 1371 B15R3.4266 c1ccc2nc3c(cc2c1)CCN3 Amb5723646 [0,0,0,1,0,0|2,0,0]=3 1372 B15R3.4266 c1ccc2nc3c(cc2c1)CCO3 Amb7101614 [0,0,0,1,0,0|1,0,0]=2 1373 B15R3.4266 c1ccc2nc3c(cc2c1)CCS3 Amb28193527 [0,0,0,1,0,0|1,1,0]=3 1374 B15R3.4266 c1ccc2nc3c(cc2c1)CNC3 Amb27240585 [0,0,0,1,0,0|3,0,0]=4 1375 B15R3.4266 c1ccc2nc3c(nc2c1)CCC3 Amb25791550 [0,0,0,1,0,0|3,0,0]=4 1376 B15R3.4266 c1ccc2nc3c(nc2c1)CCN3 Amb18825438 [0,0,0,1,0,0|3,0,0]=4 1377 B15R3.4266 c1ccc2nc3occc3cc2c1 Amb23437181 [0,0,0,1,0,0|1,0,2]=4 1378 B15R3.4266 c1cnc2cc3c(cc2c1)COC3 Amb28193304 [0,0,0,1,0,0|3,0,0]=4 1379 B15R3.4266 c1cnc2cc3c(cc2c1)OCO3 Amb28435929 [0,0,0,1,0,0|2,0,0]=3 1380 B15R3.4266 c1cnc2cc3c(cc2n1)CCC3 Amb26431467 [0,0,0,1,0,0|3,0,0]=4 1381 B15R3.4266 c1ncc2cc3c(cc2n1)OCO3 Amb23400322 [0,0,0,1,0,0|3,0,0]=4 1382 B15R3.15114 O=C1Cc2ccc3ccccc3c21 Amb17778713 [0,0,0,1,0,0|2,0,1]=4 1383 B15R3.15145 O=C1Nc2cc3ccccc3cc21 Amb27607801 [0,0,0,1,0,0|2,0,1]=4 1384 B15R3.15145 OC1Cc2cc3ccccc3cc21 Amb27197939 [0,0,0,1,0,0|2,0,0]=3 1385 B15R3.31603 c1cc2cc(C3CC3)ccc2cn1 Amb26479681 [0,0,0,1,0,0|2,0,0]=3 1386 B15R3.31603 c1ccc2cc(C3CC3)ncc2c1 Amb28193338 [0,0,0,1,0,0|2,0,0]=3 1387 B15R3.31603 c1ccc2cc(C3CO3)ccc2c1 Amb9706219 [0,0,0,1,0,0|2,0,0]=3 1388 B15R3.31603 c1ccc2cc([C@@H]3CO3)ccc2c1 Amb24491301 [0,0,0,1,0,0|2,0,0]=3 1389 B15R3.31603 c1ccc2cc([C@H]3CO3)ccc2c1 Amb24362283 [0,0,0,1,0,0|2,0,0]=3 1390 B15R3.31603 c1ccc2nc(C3CO3)ccc2c1 Amb26870051 [0,0,0,1,0,0|3,0,0]=4 1391 B15R3.31603 c1ccc2nc(N3CC3)cnc2c1 Amb24069936 [0,0,0,1,0,0|3,0,0]=4 1392 B15R3.31603 c1ccc2nc([C@@H]3CO3)ccc2c1 Amb33200721 [0,0,0,1,0,0|3,0,0]=4 1393 B15R3.31603 c1ccc2nc([C@H]3CO3)ccc2c1 Amb33200722 [0,0,0,1,0,0|3,0,0]=4 1394 B15R3.31603 c1ccc2ncc(C3CC3)cc2c1 Amb25073280 [0,0,0,1,0,0|2,0,0]=3 1395 B15R3.31603 c1ccc2ncc(C3CO3)cc2c1 Amb27148742 [0,0,0,1,0,0|3,0,0]=4 1396 B15R3.31603 c1ccc2ncc([C@@H]3CO3)cc2c1 Amb33417580 [0,0,0,1,0,0|3,0,0]=4 1397 B15R3.31603 c1ccc2ncc([C@H]3CO3)cc2c1 Amb33417632 [0,0,0,1,0,0|3,0,0]=4 1398 B15R3.31603 c1cnc2cc(C3CC3)ccc2c1 Amb27848622 [0,0,0,1,0,0|2,0,0]=3 1399 B15R3.31603 c1cnc2cc(C3CO3)ccc2c1 Amb32879509 [0,0,0,1,0,0|3,0,0]=4 1400 B15R3.31603 c1cnc2cc([C@@H]3CO3)ccc2c1 Amb32878058 [0,0,0,1,0,0|3,0,0]=4 1401 B15R3.31603 c1cnc2cc([C@H]3CO3)ccc2c1 Amb32878059 [0,0,0,1,0,0|3,0,0]=4 1402 B15R3.31603 c1cnc2ccc(C3CC3)cc2c1 Amb27962729 [0,0,0,1,0,0|2,0,0]=3 1403 B15R3.31603 c1cnc2ccc(C3CO3)cc2c1 Amb26851822 [0,0,0,1,0,0|3,0,0]=4 1404 B15R3.31603 c1cnc2ccc([C@@H]3CO3)cc2c1 Amb33148143 [0,0,0,1,0,0|3,0,0]=4 1405 B15R3.31603 c1cnc2ccc([C@H]3CO3)cc2c1 Amb33226669 [0,0,0,1,0,0|3,0,0]=4 1406 B13R2.1 BrCCC1=CCc2ccccc21 Amb27808546 [0,0,0,0,1,0|2,0,1]=4 1407 B13R2.1 BrCCc1coc2ccccc12 Amb25679155 [0,0,0,0,1,0|3,0,0]=4 1408 B13R2.1 BrCCc1csc2ccccc12 Amb25353248 [0,0,0,0,1,0|3,0,0]=4 1409 B13R2.1 CCC[n+]1csc2ccccc21 Amb3984862 [0,0,0,0,1,0|3,0,0]=4 1410 B13R2.1 CCCc1ccc2ccccn12 Amb28145853 [0,0,0,0,1,0|2,0,0]=3 1411 B13R2.1 CCCc1ncc2ccccn12 Amb17138510 [0,0,0,0,1,0|3,0,0]=4 1412 B13R2.1 CCCc1noc2ccccc12 Amb27225179 [0,0,0,0,1,0|3,0,0]=4 1413 B13R2.1 CCCn1ccc2cccnc21 Amb28051588 [0,0,0,0,1,0|3,0,0]=4 1414 B13R2.1 CCCn1ccc2ccncc21 Amb27613219 [0,0,0,0,1,0|3,0,0]=4 1415 B13R2.1 CCCn1cnc2ccccc21 Amb1104096 [0,0,0,0,1,0|3,0,0]=4 1416 B13R2.1 CCNc1coc2ccccc12 Amb25119969 [0,0,0,0,1,0|2,0,0]=3 1417 B13R2.1 CCNc1csc2ccccc12 Amb25820242 [0,0,0,0,1,0|2,0,0]=3 1418 B13R2.1 CCNc1noc2ccccc12 Amb27454266 [0,0,0,0,1,0|3,0,0]=4 1419 B13R2.1 CCNc1nsc2ccccc12 Amb24066790 [0,0,0,0,1,0|3,0,0]=4 1420 B13R2.1 CCNc1nsc2ccccc12 Amb24488581 [0,0,0,0,1,0|3,0,0]=4 1421 B13R2.1 CCNn1cnc2ccccc21 Amb27641833 [0,0,0,0,1,0|3,0,0]=4 1422 B13R2.1 CCOc1coc2cccnc12 Amb27954718 [0,0,0,0,1,0|2,0,0]=3 1423 B13R2.1 CCOc1nsc2ccccc12 Amb27962492 [0,0,0,0,1,0|2,0,0]=3 1424 B13R2.1 CCSc1ncc2ccccn12 Amb10665991 [0,0,0,0,1,0|2,1,0]=4 1425 B13R2.1 CCSc1ncn2ccccc12 Amb24582904 [0,0,0,0,1,0|2,1,0]=4 1426 B13R2.1 CCSc1snc2ccccc12 Amb28436328 [0,0,0,0,1,0|2,1,0]=4 1427 B13R2.1 CNCC1C=Cc2ccccc21 Amb27463630 [0,0,0,0,1,0|2,0,1]=4 1428 B13R2.1 CNCc1ccc2cccoc12 Amb25915335 [0,0,0,0,1,0|3,0,0]=4 1429 B13R2.1 CNCc1ccc2ccocc12 Amb26035297 [0,0,0,0,1,0|3,0,0]=4 1430 B13R2.1 CNCc1ccc2coccc12 Amb24473156 [0,0,0,0,1,0|3,0,0]=4 1431 B13R2.1 CNCc1coc2ccccc12 Amb19649828 [0,0,0,0,1,0|3,0,0]=4 1432 B13R2.1 CNCc1csc2ccccc12 Amb18286790 [0,0,0,0,1,0|3,0,0]=4 1433 B13R2.1 CNCc1csc2ccccc12 Amb9147582 [0,0,0,0,1,0|3,0,0]=4 1434 B13R2.1 COCn1ccc2ccccc21 Amb23401114 [0,0,0,0,1,0|3,0,0]=4 1435 B13R2.1 ICCc1csc2ccccc12 Amb27239170 [0,0,0,0,1,0|3,0,0]=4 1436 B13R2.1 ICCn1ccc2ccccc21 Amb27879704 [0,0,0,0,1,0|3,0,0]=4 1437 B13R2.1 NCCC1=CCc2ccccc21 Amb19149344 [0,0,0,0,1,0|2,0,1]=4 1438 B13R2.1 NCCC1=CCc2ccccc21 Amb21811903 [0,0,0,0,1,0|2,0,1]=4 1439 B13R2.1 NCCC1C=Cc2ccccc21 Amb18199855 [0,0,0,0,1,0|2,0,1]=4 1440 B13R2.1 NCCc1ccc2ccccn12 Amb18830177 [0,0,0,0,1,0|3,0,0]=4 1441 B13R2.1 NCCc1ccc2occcc12 Amb28188766 [0,0,0,0,1,0|3,0,0]=4 1442 B13R2.1 NCCc1coc2ccccc12 Amb2723681 [0,0,0,0,1,0|3,0,0]=4 1443 B13R2.1 NCCc1csc2ccccc12 Amb10603482 [0,0,0,0,1,0|3,0,0]=4 1444 B13R2.1 NCCc1csc2ccccc12 Amb10609034 [0,0,0,0,1,0|3,0,0]=4 1445 B13R2.1 NCCn1ccc2ccccc21 Amb1291613 [0,0,0,0,1,0|3,0,0]=4 1446 B13R2.1 NCCn1ccc2ccccc21 Amb22489718 [0,0,0,0,1,0|3,0,0]=4 1447 B13R2.1 NCCn1ccc2ccccc21 Amb31200118 [0,0,0,0,1,0|3,0,0]=4 1448 B13R2.1 NCCn1ccc2ccccc21 Amb8503244 [0,0,0,0,1,0|3,0,0]=4 1449 B13R2.1 OCCc1coc2ccccc12 Amb2723680 [0,0,0,0,1,0|3,0,0]=4 1450 B13R2.1 OCCc1csc2ccccc12 Amb24066376 [0,0,0,0,1,0|3,0,0]=4 1451 B13R2.1 OCCn1ccc2ccccc21 Amb17480906 [0,0,0,0,1,0|3,0,0]=4 1452 B13R2.1 OC\C=C1\C=Cc2ccccc21 Amb27651915 [0,0,0,0,1,0|2,0,0]=3 1453 B13R2.1 SCCc1coc2ccccc12 Amb26862256 [0,0,0,0,1,0|3,0,0]=4 1454 B13R2.1 SCCc1csc2ccccc12 Amb25045544 [0,0,0,0,1,0|3,0,0]=4 1455 B13R2.26 BrCCc1cc2ccccc2s1 Amb24596754 [0,0,0,0,1,0|3,0,0]=4 1456 B13R2.26 CCCC1=Cc2ccccc2C1 Amb15692407 [0,0,0,0,1,0|1,0,1]=3 1457 B13R2.26 CCCc1cc2ccccc2o1 Amb8503548 [0,0,0,0,1,0|2,0,0]=3 1458 B13R2.26 CCCc1cc2ccccc2s1 Amb27980510 [0,0,0,0,1,0|2,0,0]=3 1459 B13R2.26 CCCc1cc2ccncc2o1 Amb27796655 [0,0,0,0,1,0|3,0,0]=4 1460 B13R2.26 CCCc1nc2ccccc2o1 Amb17570040 [0,0,0,0,1,0|3,0,0]=4 1461 B13R2.26 CCNc1nc2ccccc2s1 Amb1106057 [0,0,0,0,1,0|3,0,0]=4 1462 B13R2.26 CCOC1Nc2ccccc2N1 Amb25700310 [0,0,0,0,1,0|2,0,1]=4 1463 B13R2.26 CCOc1cn2ncccc2n1 Amb27881749 [0,0,0,0,1,0|3,0,0]=4 1464 B13R2.26 CCOc1nc2cnccc2s1 Amb27789077 [0,0,0,0,1,0|3,0,0]=4 1465 B13R2.26 CCSC1=Nc2ccccc2C1 Amb28243039 [0,0,0,0,1,0|1,1,1]=4 1466 B13R2.26 CCSc1cc2ccccc2s1 Amb28130052 [0,0,0,0,1,0|1,1,0]=3 1467 B13R2.26 CCSc1cn2ccccc2n1 Amb25376137 [0,0,0,0,1,0|2,1,0]=4 1468 B13R2.26 CNCc1cc2ccccc2o1 Amb10813873 [0,0,0,0,1,0|3,0,0]=4 1469 B13R2.26 CNCc1cc2ccccc2o1 Amb5494061 [0,0,0,0,1,0|3,0,0]=4 1470 B13R2.26 CNCc1cc2ccccc2s1 Amb1792462 [0,0,0,0,1,0|3,0,0]=4 1471 B13R2.26 CNCc1cc2ccccc2s1 Amb6344858 [0,0,0,0,1,0|3,0,0]=4 1472 B13R2.26 COCc1cc2ccccc2s1 Amb27224969 [0,0,0,0,1,0|3,0,0]=4 1473 B13R2.26 CSCc1cc2ccccc2s1 Amb27451587 [0,0,0,0,1,0|3,0,0]=4 1474 B13R2.26 C\C=C\c1cc2ccccc2o1 Amb27209407 [0,0,0,0,1,0|2,0,1]=4 1475 B13R2.26 ClC[SiH2]C1=Cc2ccccc2C1 Amb28396661 [0,0,0,0,1,0|2,0,1]=4 1476 B13R2.26 ICCc1cc2ccccc2s1 Amb28133212 [0,0,0,0,1,0|3,0,0]=4 1477 B13R2.26 NCCC1=Cc2ccccc2C1 Amb27441993 [0,0,0,0,1,0|2,0,1]=4 1478 B13R2.26 NCCc1cc2ccccc2o1 Amb19374782 [0,0,0,0,1,0|3,0,0]=4 1479 B13R2.26 NCCc1cc2ccccc2o1 Amb7094240 [0,0,0,0,1,0|3,0,0]=4 1480 B13R2.26 NCCc1cc2ccccc2s1 Amb16187156 [0,0,0,0,1,0|3,0,0]=4 1481 B13R2.26 NCCc1cc2ccccc2s1 Amb21959883 [0,0,0,0,1,0|3,0,0]=4 1482 B13R2.26 NCCc1cc2ccccn2c1 Amb32667068 [0,0,0,0,1,0|3,0,0]=4 1483 B13R2.26 NCCc1cc2ccccn2c1 Amb5733281 [0,0,0,0,1,0|3,0,0]=4 1484 B13R2.26 OCCC1=Cc2ccccc2C1 Amb17594005 [0,0,0,0,1,0|2,0,1]=4 1485 B13R2.26 OCCc1cc2ccccc2o1 Amb25087334 [0,0,0,0,1,0|3,0,0]=4 1486 B13R2.26 OCCc1cc2ccccc2s1 Amb15692004 [0,0,0,0,1,0|3,0,0]=4 1487 B13R2.26 SCCc1cc2ccccc2s1 Amb24066375 [0,0,0,0,1,0|3,0,0]=4 1488 B13R2.449 BrCCc1ccc2occc2c1 Amb25952121 [0,0,0,0,1,0|3,0,0]=4 1489 B13R2.449 BrCCc1ccc2sccc2c1 Amb35627584 [0,0,0,0,1,0|3,0,0]=4 1490 B13R2.449 CCCc1ccc2ocnc2c1 Amb17570041 [0,0,0,0,1,0|3,0,0]=4 1491 B13R2.449 CCNc1ccc2ncoc2c1 Amb26563302 [0,0,0,0,1,0|3,0,0]=4 1492 B13R2.449 CCNc1ccc2sccc2n1 Amb28143903 [0,0,0,0,1,0|3,0,0]=4 1493 B13R2.449 CCNc1ccc2sncc2c1 Amb27448739 [0,0,0,0,1,0|3,0,0]=4 1494 B13R2.449 CCOc1ccc2c(c1)CCN2 Amb1108759 [0,0,0,0,1,0|1,0,2]=4 1495 B13R2.449 CCOc1ccc2c(c1)NCC2 Amb24067650 [0,0,0,0,1,0|1,0,2]=4 1496 B13R2.449 CCOc1ccc2c(c1)NCS2 Amb32659528 [0,0,0,0,1,0|2,0,1]=4 1497 B13R2.449 CCOc1ccc2cnsc2c1 Amb27670063 [0,0,0,0,1,0|2,0,0]=3 1498 B13R2.449 CCOc1ccc2nccn2n1 Amb21960967 [0,0,0,0,1,0|3,0,0]=4 1499 B13R2.449 CCOc1ccc2ncoc2c1 Amb27774650 [0,0,0,0,1,0|2,0,0]=3 1500 B13R2.449 CCOc1ccc2scnc2c1 Amb21857279 [0,0,0,0,1,0|2,0,0]=3 1501 B13R2.449 CNCc1ccc2c(c1)C=CC2 Amb27966119 [0,0,0,0,1,0|2,0,1]=4 1502 B13R2.449 CNCc1ccc2occc2c1 Amb24089263 [0,0,0,0,1,0|3,0,0]=4 1503 B13R2.449 CNCc1ccc2sccc2c1 Amb1995215 [0,0,0,0,1,0|3,0,0]=4 1504 B13R2.449 ClCCc1ccc2occc2c1 Amb22232561 [0,0,0,0,1,0|3,0,0]=4 1505 B13R2.449 ClCCc1ccc2sccc2c1 Amb35627676 [0,0,0,0,1,0|3,0,0]=4 1506 B13R2.449 ICCc1ccc2occc2c1 Amb28286864 [0,0,0,0,1,0|3,0,0]=4 1507 B13R2.449 NCCc1ccc2ccoc2c1 Amb18829960 [0,0,0,0,1,0|3,0,0]=4 1508 B13R2.449 NCCc1ccc2occc2c1 Amb18141998 [0,0,0,0,1,0|3,0,0]=4 1509 B13R2.449 NCCc1ccc2sccc2c1 Amb18675394 [0,0,0,0,1,0|3,0,0]=4 1510 B13R2.449 OCCc1cc2cccc2co1 Amb28453462 [0,0,0,0,1,0|3,0,0]=4 1511 B13R2.449 OCCc1ccc2ccoc2c1 Amb28244294 [0,0,0,0,1,0|3,0,0]=4 1512 B13R2.449 OCCc1ccc2occc2c1 Amb22886810 [0,0,0,0,1,0|3,0,0]=4 1513 B13R2.449 OCCc1ccc2sccc2c1 Amb5720103 [0,0,0,0,1,0|3,0,0]=4 1514 B13R2.449 SCCc1ccc2occc2c1 Amb33343236 [0,0,0,0,1,0|3,0,0]=4 1515 B12R1.8 BrC\C=C\C=C\c1ccccc1 Amb8394285 [1,0,1,0,0,0|2,0,0]=4 1516 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [1,0,1,0,0,0|1,0,1]=4 1517 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [1,0,1,0,0,0|1,0,1]=4 1518 B12R1.8 CCNC\C=C\c1ccccc1 Amb6864716 [1,0,1,0,0,0|1,0,1]=4 1519 B12R1.8 CCNC\C=C\c1ccccc1 Amb837817 [1,0,1,0,0,0|1,0,1]=4 1520 B12R1.8 CO\N=C\C=C\c1ccccc1 Amb27396673 [1,0,1,0,0,0|2,0,0]=4 1521 B12R1.8 NC\C=C\C=C\c1ccccc1 Amb32953332 [1,0,1,0,0,0|2,0,0]=4 1522 B12R1.8 OC\C=C\C=C\c1ccccc1 Amb33081530 [1,0,1,0,0,0|2,0,0]=4 1523 B12R1.27 C=C(\C=C\c1ccccc1)CBr Amb33081080 [1,0,1,0,0,0|1,0,0]=3 1524 B12R1.27 C=C(\C=C\c1ccccc1)CCl Amb33081096 [1,0,1,0,0,0|1,0,0]=3 1525 B12R1.27 C=C(\C=C\c1ccccc1)CN Amb33080787 [1,0,1,0,0,0|1,0,0]=3 1526 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [1,0,1,0,0,0|1,0,0]=3 1527 B12R1.27 CCC(=O)\C=C\c1ccncc1 Amb25962375 [1,0,1,0,0,0|2,0,0]=4 1528 B12R1.27 CCC(O)\C=C\c1ccccc1 Amb22546605 [1,0,1,0,0,0|1,0,1]=4 1529 B12R1.27 CC[C@H](O)\C=C\c1ccccc1 Amb27205385 [1,0,1,0,0,0|1,0,1]=4 1530 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb33716217 [1,0,1,0,0,0|1,0,0]=3 1531 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb8515074 [1,0,1,0,0,0|1,0,0]=3 1532 B12R1.27 COC(=O)\C=C\c1ccccn1 Amb25036096 [1,0,1,0,0,0|2,0,0]=4 1533 B12R1.27 COC(=O)\C=C\c1cccnc1 Amb17844385 [1,0,1,0,0,0|2,0,0]=4 1534 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb20668041 [1,0,1,0,0,0|2,0,0]=4 1535 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb24074160 [1,0,1,0,0,0|2,0,0]=4 1536 B12R1.27 COC(Cl)\C=C\c1ccccc1 Amb26371733 [1,0,1,0,0,0|1,0,1]=4 1537 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb32954851 [1,0,1,0,0,0|2,0,0]=4 1538 B12R1.27 O=C(\C=C\c1ccccc1)CBr Amb17596167 [1,0,1,0,0,0|2,0,0]=4 1539 B12R1.27 O=C(\C=C\c1ccccc1)CCl Amb17594640 [1,0,1,0,0,0|2,0,0]=4 1540 B12R1.71 C=CCCc1ccc(OC)cc1 Amb6299125 [1,0,1,0,0,0|0,0,2]=4 1541 B12R1.71 C=CCNc1ccc(CC)cc1 Amb17306600 [1,0,1,0,0,0|1,0,1]=4 1542 B12R1.71 C=CCNc1ccc(OC)cc1 Amb6360349 [1,0,1,0,0,0|1,0,1]=4 1543 B12R1.71 C=CCOc1ccc(OC)cc1 Amb4406979 [1,0,1,0,0,0|1,0,1]=4 1544 B12R1.71 C=COCc1ccc(OC)cc1 Amb32650209 [1,0,1,0,0,0|1,0,1]=4 1545 B12R1.71 C=C\C=C/c1ccc(C#N)cc1 Amb22546621 [1,0,1,0,0,0|1,0,1]=4 1546 B12R1.71 C=C\C=C/c1ccc(C=O)cc1 Amb24103176 [1,0,1,0,0,0|1,0,1]=4 1547 B12R1.71 C=C\C=C\c1ccc(OC)cc1 Amb22546592 [1,0,1,0,0,0|0,0,0]=2 1548 B12R1.71 CCc1ccc(\C=C\C#N)cc1 Amb17232215 [1,0,1,0,0,0|1,0,1]=4 1549 B12R1.71 CCc1ccc(\C=C\C=O)cc1 Amb17232321 [1,0,1,0,0,0|1,0,0]=3 1550 B12R1.71 CCc1ccc(\C=C\CN)cc1 Amb18563523 [1,0,1,0,0,0|1,0,1]=4 1551 B12R1.71 CCc1ccc(\C=C\CO)cc1 Amb23442835 [1,0,1,0,0,0|1,0,1]=4 1552 B12R1.71 COc1ccc(\C=C/CO)cc1 Amb27668023 [1,0,1,0,0,0|1,0,1]=4 1553 B12R1.71 COc1ccc(\C=C\C#N)cc1 Amb654037 [1,0,1,0,0,0|1,0,1]=4 1554 B12R1.71 COc1ccc(\C=C\C=O)cc1 Amb6296108 [1,0,1,0,0,0|1,0,0]=3 1555 B12R1.71 COc1ccc(\C=C\C=O)cn1 Amb32953972 [1,0,1,0,0,0|2,0,0]=4 1556 B12R1.71 COc1ccc(\C=C\C=O)nc1 Amb33204115 [1,0,1,0,0,0|2,0,0]=4 1557 B12R1.71 COc1ccc(\C=C\CN)cc1 Amb10560866 [1,0,1,0,0,0|1,0,1]=4 1558 B12R1.71 COc1ccc(\C=C\CO)cc1 Amb837391 [1,0,1,0,0,0|1,0,1]=4 1559 B12R1.71 COc1ccc(\C=C\SC)cc1 Amb2636932 [1,0,1,0,0,0|1,0,1]=4 1560 B12R1.71 CSc1ccc(\C=C\C=O)cc1 Amb33136432 [1,0,1,0,0,0|1,1,0]=4 1561 B12R1.116 C=CCc1ccc(CCC)cc1 Amb6299244 [1,0,1,0,0,0|1,0,1]=4 1562 B12R1.116 CCCc1ccc(\C=C\Br)cc1 Amb33134900 [1,0,1,0,0,0|2,0,0]=4 1563 B12R1.116 CCOc1ccc(CC=O)cc1 Amb17089534 [1,0,1,0,0,0|1,0,1]=4 1564 B12R1.116 CCOc1ccc(\C=C\Br)cc1 Amb33134849 [1,0,1,0,0,0|1,0,0]=3 1565 B12R1.116 CCOc1ccc(\C=N\O)cc1 Amb5774407 [1,0,1,0,0,0|2,0,0]=4 1566 B12R1.116 C\C=C\c1ccc(NCC)cc1 Amb27757112 [1,0,1,0,0,0|1,0,1]=4 1567 B12R1.32 CCC\C(I)=C/c1ccccc1 Amb22546627 [1,0,1,0,0,0|2,0,0]=4 1568 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [1,0,1,0,0,0|1,0,1]=4 1569 B12R1.32 CCOC(=N)Cc1ccccc1 Amb2612454 [1,0,1,0,0,0|1,0,1]=4 1570 B12R1.32 CCOC(=O)Cc1ccccc1 Amb3940130 [1,0,1,0,0,0|1,0,1]=4 1571 B12R1.32 CCOC(=O)Nc1ccccc1 Amb3101817 [1,0,1,0,0,0|2,0,0]=4 1572 B12R1.32 CCOC(=S)Nc1ccccc1 Amb4017698 [1,0,1,0,0,0|2,0,0]=4 1573 B12R1.32 CCO\C(C)=N\c1ccccc1 Amb17939699 [1,0,1,0,0,0|1,0,1]=4 1574 B12R1.118 C=C\C(=C/c1ccccc1)CO Amb27981982 [1,0,1,0,0,0|1,0,0]=3 1575 B12R1.118 CCC(=Cc1ccccc1)CC Amb27807779 [1,0,1,0,0,0|0,0,2]=4 1576 B12R1.118 CC\C(=C\Cl)Oc1ccccc1 Amb27425338 [1,0,1,0,0,0|2,0,0]=4 1577 B12R1.118 CC\C(=C\c1ccccc1)CO Amb27860945 [1,0,1,0,0,0|1,0,1]=4 1578 B12R1.118 CC\C(C=O)=C/c1ccccc1 Amb615951 [1,0,1,0,0,0|1,0,0]=3 1579 B12R1.118 CC\C(C=O)=C/c1ccccn1 Amb17334523 [1,0,1,0,0,0|2,0,0]=4 1580 B12R1.118 CC\C(C=O)=C/c1cccnc1 Amb17334524 [1,0,1,0,0,0|2,0,0]=4 1581 B12R1.118 CC\C(C=O)=C/c1ccncc1 Amb17334525 [1,0,1,0,0,0|2,0,0]=4 1582 B12R1.118 CC\C(C=O)=C\c1cccnc1 Amb28321082 [1,0,1,0,0,0|2,0,0]=4 1583 B12R1.118 CO\C(=C\c1ccccc1)CO Amb27457627 [1,0,1,0,0,0|1,0,1]=4 1584 B12R1.118 CO\C(C=O)=C\c1ccccc1 Amb17594035 [1,0,1,0,0,0|1,0,0]=3 1585 B12R1.118 CS\C(C=O)=C/c1ccccc1 Amb27614686 [1,0,1,0,0,0|1,1,0]=4 1586 B12R1.118 C\C=C(\CC)Nc1ccccc1 Amb26457549 [1,0,1,0,0,0|1,0,1]=4 1587 B12R1.118 O=C\C(=C/c1ccccc1)CCl Amb27640646 [1,0,1,0,0,0|2,0,0]=4 1588 B12R1.118 O=C\C(=C\c1ccccc1)CO Amb27769967 [1,0,1,0,0,0|2,0,0]=4 1589 B12R1.267 CCO\C=C\c1ccccc1Cl Amb24603799 [1,0,1,0,0,0|1,0,0]=3 1590 B12R1.267 CCO\N=C\c1ccccc1O Amb25817471 [1,0,1,0,0,0|2,0,0]=4 1591 B12R1.267 C\C=C/C=C\c1ccccc1O Amb28122369 [1,0,1,0,0,0|1,0,1]=4 1592 B12R1.270 C=CCc1cc(CC)ccc1O Amb4044322 [1,0,1,0,0,0|1,0,1]=4 1593 B12R1.270 C=CCc1cc(OC)ccc1O Amb419989 [1,0,1,0,0,0|1,0,1]=4 1594 B12R1.270 COc1ccc(F)c(\C=C\Br)c1 Amb33135016 [1,0,1,0,0,0|2,0,0]=4 1595 B12R1.270 COc1ccc(O)c(\C=C\Br)c1 Amb33134862 [1,0,1,0,0,0|2,0,0]=4 1596 B12R1.278 CCCc1cccc(\C=C\Br)c1 Amb33135422 [1,0,1,0,0,0|2,0,0]=4 1597 B12R1.278 CCOc1cccc(CC=O)c1 Amb17089533 [1,0,1,0,0,0|1,0,1]=4 1598 B12R1.278 CCOc1cccc(\C=C\Br)c1 Amb33134998 [1,0,1,0,0,0|1,0,0]=3 1599 B12R1.278 CCOc1cncc(\C=C\Br)c1 Amb33135434 [1,0,1,0,0,0|2,0,0]=4 1600 B12R1.278 CCSc1cccc(\C=C\Br)c1 Amb33135593 [1,0,1,0,0,0|1,1,0]=4 1601 B12R1.286 C=Cc1nc(OCC)ccc1N Amb24411782 [1,0,1,0,0,0|2,0,0]=4 1602 B12R1.286 CCOc1ccc(Br)c(C=O)c1 Amb24065405 [1,0,1,0,0,0|2,0,0]=4 1603 B12R1.286 CCOc1ccc(C)c(C=O)c1 Amb24704667 [1,0,1,0,0,0|1,0,1]=4 1604 B12R1.286 CCOc1ccc(N)c(C=O)c1 Amb25114468 [1,0,1,0,0,0|2,0,0]=4 1605 B12R1.286 CCOc1ccc(O)c(C=O)c1 Amb415923 [1,0,1,0,0,0|2,0,0]=4 1606 B12R1.78 C=Cc1cc(OC)ccc1C=O Amb25117921 [1,0,1,0,0,0|1,0,0]=3 1607 B12R1.78 C=Cc1cc(OC)ccc1CN Amb27396205 [1,0,1,0,0,0|1,0,1]=4 1608 B12R1.78 C=Cc1cc(OC)ccc1OC Amb24417601 [1,0,1,0,0,0|1,0,1]=4 1609 B12R1.78 C=Cc1cc(OC)cnc1C=O Amb27784147 [1,0,1,0,0,0|2,0,0]=4 1610 B12R1.78 C=Cc1cc(OC)ncc1C=O Amb27436859 [1,0,1,0,0,0|2,0,0]=4 1611 B12R1.78 C=Cc1ccc(OC)cc1C=O Amb18645651 [1,0,1,0,0,0|1,0,0]=3 1612 B12R1.78 C=Cc1ccc(OC)cc1OC Amb25151067 [1,0,1,0,0,0|1,0,1]=4 1613 B12R1.78 C=Cc1ccc(OC)cc1SC Amb28435338 [1,0,1,0,0,0|1,0,1]=4 1614 B12R1.78 C=Cc1ccc(OC)nc1C=O Amb27416661 [1,0,1,0,0,0|2,0,0]=4 1615 B12R1.78 C=Cc1cnc(OC)cc1C=O Amb26917534 [1,0,1,0,0,0|2,0,0]=4 1616 B12R1.78 C=Cc1nc(OC)ccc1C=O Amb25677511 [1,0,1,0,0,0|2,0,0]=4 1617 B12R1.78 COc1ccc(C=O)c(C=O)c1 Amb18645974 [1,0,1,0,0,0|2,0,0]=4 1618 B12R1.288 C=Cc1ccc(OCC)cc1C Amb33142246 [1,0,1,0,0,0|0,0,1]=3 1619 B12R1.288 C=Cc1ccc(OCC)nc1C Amb23445613 [1,0,1,0,0,0|1,0,1]=4 1620 B12R1.288 C=Cc1cnc(OCC)cc1C Amb23579401 [1,0,1,0,0,0|1,0,1]=4 1621 B12R1.288 C=Cc1ncc(OCC)cc1N Amb24471308 [1,0,1,0,0,0|2,0,0]=4 1622 B12R1.288 CCOc1ccc(C=O)c(C)c1 Amb18646072 [1,0,1,0,0,0|1,0,1]=4 1623 B12R1.288 CCOc1ccc(C=O)c(Cl)c1 Amb23402650 [1,0,1,0,0,0|2,0,0]=4 1624 B12R1.288 CCOc1ccc(C=O)c(F)c1 Amb21856534 [1,0,1,0,0,0|2,0,0]=4 1625 B12R1.288 CCOc1ccc(C=O)c(O)c1 Amb1103323 [1,0,1,0,0,0|2,0,0]=4 1626 B12R1.114 C=CCc1ccc(OC)cc1F Amb27480607 [1,0,1,0,0,0|1,0,1]=4 1627 B12R1.114 C=CCc1ccc(OC)cc1N Amb18645873 [1,0,1,0,0,0|1,0,1]=4 1628 B12R1.114 C=CCc1ccc(OC)cc1O Amb18646029 [1,0,1,0,0,0|1,0,1]=4 1629 B12R1.114 COc1ccc(\C=C\Br)c(F)c1 Amb33135019 [1,0,1,0,0,0|2,0,0]=4 1630 B12R1.114 COc1ccc(\C=C\Br)c(O)c1 Amb33134956 [1,0,1,0,0,0|2,0,0]=4 1631 B12R1.114 C\C=C\c1ccc(OC)cc1O Amb4090663 [1,0,1,0,0,0|1,0,1]=4 1632 B12R1.371 C=C(CC)Cc1ccccc1N Amb28398180 [1,0,1,0,0,0|1,0,1]=4 1633 B12R1.371 CC\C(C)=C/c1ccccc1O Amb28253700 [1,0,1,0,0,0|1,0,1]=4 1634 B12R1.382 C=CCCc1cccc(OC)c1 Amb6299119 [1,0,1,0,0,0|0,0,2]=4 1635 B12R1.382 C=CCNc1cccc(CC)c1 Amb18792395 [1,0,1,0,0,0|1,0,1]=4 1636 B12R1.382 C=C\C=C/c1cccc(C=O)c1 Amb24085624 [1,0,1,0,0,0|1,0,1]=4 1637 B12R1.382 CC\C=C\c1cccc(OC)c1 Amb28139566 [1,0,1,0,0,0|0,0,2]=4 1638 B12R1.382 CCc1cccc(\C=C\C=O)c1 Amb32875440 [1,0,1,0,0,0|1,0,0]=3 1639 B12R1.382 CCc1cccc(\C=C\CN)c1 Amb32875438 [1,0,1,0,0,0|1,0,1]=4 1640 B12R1.382 CCc1cccc(\C=C\CO)c1 Amb32875439 [1,0,1,0,0,0|1,0,1]=4 1641 B12R1.382 COc1cc(\C=C\C=O)ccn1 Amb32730059 [1,0,1,0,0,0|2,0,0]=4 1642 B12R1.382 COc1cccc(\C=C\C#N)c1 Amb17232287 [1,0,1,0,0,0|1,0,1]=4 1643 B12R1.382 COc1cccc(\C=C\C=O)c1 Amb17232402 [1,0,1,0,0,0|1,0,0]=3 1644 B12R1.382 COc1cccc(\C=C\C=O)n1 Amb33358721 [1,0,1,0,0,0|2,0,0]=4 1645 B12R1.382 COc1cccc(\C=C\CN)c1 Amb18563579 [1,0,1,0,0,0|1,0,1]=4 1646 B12R1.382 COc1cccc(\C=C\CO)c1 Amb23442965 [1,0,1,0,0,0|1,0,1]=4 1647 B12R1.382 COc1ccnc(\C=C\C=O)c1 Amb33418103 [1,0,1,0,0,0|2,0,0]=4 1648 B12R1.382 COc1cncc(\C=C\C=O)c1 Amb35667192 [1,0,1,0,0,0|2,0,0]=4 1649 B12R1.382 CSc1cccc(\C=C\C=O)c1 Amb33148825 [1,0,1,0,0,0|1,1,0]=4 1650 B12R2.24 Brc1cc2ccccc2cn1 Amb8438943 [2,0,0,0,0,0|2,0,0]=4 1651 B12R2.24 Brc1cc[n+]2ccccc2c1 Amb2613514 [2,0,0,0,0,0|2,0,0]=4 1652 B12R2.24 Brc1ccc2cccc[n+]2c1 Amb24392821 [2,0,0,0,0,0|2,0,0]=4 1653 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [2,0,0,0,0,0|1,0,0]=3 1654 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [2,0,0,0,0,0|2,0,0]=4 1655 B12R2.24 Brc1ccc2cccnc2c1 Amb8397712 [2,0,0,0,0,0|2,0,0]=4 1656 B12R2.24 Brc1ccc2ccncc2c1 Amb22276934 [2,0,0,0,0,0|2,0,0]=4 1657 B12R2.24 Brc1ccc2ccncc2c1 Amb7101503 [2,0,0,0,0,0|2,0,0]=4 1658 B12R2.24 Brc1ccc2cnccc2c1 Amb33140904 [2,0,0,0,0,0|2,0,0]=4 1659 B12R2.24 Brc1ccc2cnccc2c1 Amb7101488 [2,0,0,0,0,0|2,0,0]=4 1660 B12R2.24 Brc1ccc2ncccc2c1 Amb1033034 [2,0,0,0,0,0|2,0,0]=4 1661 B12R2.24 Brc1ccc2ncccc2c1 Amb19516224 [2,0,0,0,0,0|2,0,0]=4 1662 B12R2.24 Brc1cnc2ccccc2c1 Amb2722485 [2,0,0,0,0,0|2,0,0]=4 1663 B12R2.24 CC1=Cc2ccccc2CC1 Amb31292543 [2,0,0,0,0,0|0,0,2]=4 1664 B12R2.24 CC1=Cc2ccccc2CN1 Amb28322961 [2,0,0,0,0,0|1,0,1]=4 1665 B12R2.24 CC1=Cc2ccccc2NC1 Amb18559652 [2,0,0,0,0,0|1,0,1]=4 1666 B12R2.24 CC1C=Cc2ccccc2N1 Amb17593644 [2,0,0,0,0,0|1,0,1]=4 1667 B12R2.24 C[n+]1ccc2ccccc2c1 Amb1147460 [2,0,0,0,0,0|1,0,0]=3 1668 B12R2.24 C[n+]1ccc2ccccc2c1 Amb2609709 [2,0,0,0,0,0|1,0,0]=3 1669 B12R2.24 C[n+]1ccc2ncccc2c1 Amb2610099 [2,0,0,0,0,0|2,0,0]=4 1670 B12R2.24 C[n+]1ccc2ncccc2c1 Amb32454864 [2,0,0,0,0,0|2,0,0]=4 1671 B12R2.24 Cc1cc2ccccc2cn1 Amb8395994 [2,0,0,0,0,0|1,0,0]=3 1672 B12R2.24 Cc1cc2ccncc2cn1 Amb28250070 [2,0,0,0,0,0|2,0,0]=4 1673 B12R2.24 Cc1ccc2c(c1)C=CCN2 Amb18062199 [2,0,0,0,0,0|1,0,1]=4 1674 B12R2.24 Cc1ccc2c(c1)C=CCO2 Amb23441455 [2,0,0,0,0,0|1,0,1]=4 1675 B12R2.24 Cc1ccc2c(c1)NCC=C2 Amb18062194 [2,0,0,0,0,0|1,0,1]=4 1676 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [2,0,0,0,0,0|0,0,0]=2 1677 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [2,0,0,0,0,0|1,0,0]=3 1678 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [2,0,0,0,0,0|1,0,0]=3 1679 B12R2.24 Cc1ccc2cccnc2c1 Amb8397711 [2,0,0,0,0,0|1,0,0]=3 1680 B12R2.24 Cc1ccc2cccnc2n1 Amb2793429 [2,0,0,0,0,0|2,0,0]=4 1681 B12R2.24 Cc1ccc2ccncc2c1 Amb33544176 [2,0,0,0,0,0|1,0,0]=3 1682 B12R2.24 Cc1ccc2ccncc2n1 Amb25305156 [2,0,0,0,0,0|2,0,0]=4 1683 B12R2.24 Cc1ccc2cnccc2c1 Amb10071945 [2,0,0,0,0,0|1,0,0]=3 1684 B12R2.24 Cc1ccc2cnccc2n1 Amb23441223 [2,0,0,0,0,0|2,0,0]=4 1685 B12R2.24 Cc1ccc2ncccc2c1 Amb22235973 [2,0,0,0,0,0|1,0,0]=3 1686 B12R2.24 Cc1ccc2ncccc2c1 Amb6892169 [2,0,0,0,0,0|1,0,0]=3 1687 B12R2.24 Cc1ccc2ncccc2n1 Amb15692772 [2,0,0,0,0,0|2,0,0]=4 1688 B12R2.24 Cc1ccc2nccnc2c1 Amb2689687 [2,0,0,0,0,0|2,0,0]=4 1689 B12R2.24 Cc1cnc2ccccc2c1 Amb2447051 [2,0,0,0,0,0|1,0,0]=3 1690 B12R2.24 Cc1cnc2ccccc2n1 Amb4026338 [2,0,0,0,0,0|2,0,0]=4 1691 B12R2.24 Cc1cnc2cccnc2c1 Amb26979817 [2,0,0,0,0,0|2,0,0]=4 1692 B12R2.24 Cc1cnc2ncccc2c1 Amb26074359 [2,0,0,0,0,0|2,0,0]=4 1693 B12R2.24 Clc1cc2ccccc2cn1 Amb10071462 [2,0,0,0,0,0|2,0,0]=4 1694 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [2,0,0,0,0,0|1,0,0]=3 1695 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [2,0,0,0,0,0|2,0,0]=4 1696 B12R2.24 Clc1ccc2cccnc2c1 Amb10069239 [2,0,0,0,0,0|2,0,0]=4 1697 B12R2.24 Clc1ccc2ccncc2c1 Amb32663641 [2,0,0,0,0,0|2,0,0]=4 1698 B12R2.24 Clc1ccc2ccncc2c1 Amb4007488 [2,0,0,0,0,0|2,0,0]=4 1699 B12R2.24 Clc1ccc2cnccc2c1 Amb10603859 [2,0,0,0,0,0|2,0,0]=4 1700 B12R2.24 Clc1ccc2ncccc2c1 Amb749944 [2,0,0,0,0,0|2,0,0]=4 1701 B12R2.24 Clc1cnc2ccccc2c1 Amb19515997 [2,0,0,0,0,0|2,0,0]=4 1702 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [2,0,0,0,0,0|1,0,0]=3 1703 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [2,0,0,0,0,0|2,0,0]=4 1704 B12R2.24 Fc1ccc2cccnc2c1 Amb2622129 [2,0,0,0,0,0|2,0,0]=4 1705 B12R2.24 Fc1ccc2ccncc2c1 Amb19100617 [2,0,0,0,0,0|2,0,0]=4 1706 B12R2.24 Fc1ccc2cnccc2c1 Amb19958275 [2,0,0,0,0,0|2,0,0]=4 1707 B12R2.24 Fc1ccc2ncccc2c1 Amb22831215 [2,0,0,0,0,0|2,0,0]=4 1708 B12R2.24 Fc1ccc2ncccc2c1 Amb6892892 [2,0,0,0,0,0|2,0,0]=4 1709 B12R2.24 Fc1cnc2ccccc2c1 Amb22234447 [2,0,0,0,0,0|2,0,0]=4 1710 B12R2.24 Ic1cc2ccccc2cn1 Amb22170100 [2,0,0,0,0,0|2,0,0]=4 1711 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [2,0,0,0,0,0|1,0,0]=3 1712 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [2,0,0,0,0,0|2,0,0]=4 1713 B12R2.24 Ic1ccc2cccnc2c1 Amb21858708 [2,0,0,0,0,0|2,0,0]=4 1714 B12R2.24 Ic1ccc2ccncc2c1 Amb22170101 [2,0,0,0,0,0|2,0,0]=4 1715 B12R2.24 Ic1ccc2cnccc2c1 Amb10070847 [2,0,0,0,0,0|2,0,0]=4 1716 B12R2.24 Ic1ccc2ncccc2c1 Amb10066910 [2,0,0,0,0,0|2,0,0]=4 1717 B12R2.24 Ic1cnc2ccccc2c1 Amb19373724 [2,0,0,0,0,0|2,0,0]=4 1718 B12R2.24 Nc1cc2ccccc2cn1 Amb2722858 [2,0,0,0,0,0|2,0,0]=4 1719 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [2,0,0,0,0,0|1,0,0]=3 1720 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [2,0,0,0,0,0|1,0,0]=3 1721 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [2,0,0,0,0,0|2,0,0]=4 1722 B12R2.24 Nc1ccc2cccnc2c1 Amb24183307 [2,0,0,0,0,0|2,0,0]=4 1723 B12R2.24 Nc1ccc2cccnc2c1 Amb31217512 [2,0,0,0,0,0|2,0,0]=4 1724 B12R2.24 Nc1ccc2cccnc2c1 Amb5717605 [2,0,0,0,0,0|2,0,0]=4 1725 B12R2.24 Nc1ccc2ccncc2c1 Amb33456346 [2,0,0,0,0,0|2,0,0]=4 1726 B12R2.24 Nc1ccc2ccncc2c1 Amb8011457 [2,0,0,0,0,0|2,0,0]=4 1727 B12R2.24 Nc1ccc2cnccc2c1 Amb33527576 [2,0,0,0,0,0|2,0,0]=4 1728 B12R2.24 Nc1ccc2cnccc2c1 Amb8010910 [2,0,0,0,0,0|2,0,0]=4 1729 B12R2.24 Nc1ccc2ncccc2c1 Amb2721017 [2,0,0,0,0,0|2,0,0]=4 1730 B12R2.24 Nc1ccc2ncccc2c1 Amb33536629 [2,0,0,0,0,0|2,0,0]=4 1731 B12R2.24 Nc1cnc2ccccc2c1 Amb534917 [2,0,0,0,0,0|2,0,0]=4 1732 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [2,0,0,0,0,0|1,0,1]=4 1733 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [2,0,0,0,0,0|1,0,1]=4 1734 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [2,0,0,0,0,0|1,0,1]=4 1735 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [2,0,0,0,0,0|1,0,1]=4 1736 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [2,0,0,0,0,0|1,0,1]=4 1737 B12R2.24 O=c1ccn2ccccc2c1 Amb2609671 [2,0,0,0,0,0|1,0,1]=4 1738 B12R2.24 O=n1ccc2ccccc2c1 Amb20247039 [2,0,0,0,0,0|1,0,1]=4 1739 B12R2.24 OC1=CC=C2C=CC=CN2C1 Amb17835334 [2,0,0,0,0,0|1,0,1]=4 1740 B12R2.24 OC1C=Cc2ccccc2S1 Amb27394776 [2,0,0,0,0,0|1,0,1]=4 1741 B12R2.24 Oc1cc2ccccc2cn1 Amb10068513 [2,0,0,0,0,0|1,0,0]=3 1742 B12R2.24 Oc1cc2cnccc2cn1 Amb25051663 [2,0,0,0,0,0|2,0,0]=4 1743 B12R2.24 Oc1cc[n+]2ccccc2c1 Amb24309279 [2,0,0,0,0,0|1,0,0]=3 1744 B12R2.24 Oc1ccc2c(c1)C=CCC2 Amb28075248 [2,0,0,0,0,0|0,0,2]=4 1745 B12R2.24 Oc1ccc2c(c1)C=CCN2 Amb25998025 [2,0,0,0,0,0|1,0,1]=4 1746 B12R2.24 Oc1ccc2c(c1)OCC=C2 Amb27804492 [2,0,0,0,0,0|1,0,1]=4 1747 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [2,0,0,0,0,0|0,0,0]=2 1748 B12R2.24 Oc1ccc2cccnc2c1 Amb33204453 [2,0,0,0,0,0|1,0,0]=3 1749 B12R2.24 Oc1ccc2cccnc2c1 Amb535010 [2,0,0,0,0,0|1,0,0]=3 1750 B12R2.24 Oc1ccc2cccnc2n1 Amb9806398 [2,0,0,0,0,0|2,0,0]=4 1751 B12R2.24 Oc1ccc2ccncc2c1 Amb1152014 [2,0,0,0,0,0|1,0,0]=3 1752 B12R2.24 Oc1ccc2ccncc2c1 Amb19373209 [2,0,0,0,0,0|1,0,0]=3 1753 B12R2.24 Oc1ccc2ccnnc2c1 Amb25319976 [2,0,0,0,0,0|2,0,0]=4 1754 B12R2.24 Oc1ccc2cnccc2c1 Amb10067627 [2,0,0,0,0,0|1,0,0]=3 1755 B12R2.24 Oc1ccc2cnccc2c1 Amb30325887 [2,0,0,0,0,0|1,0,0]=3 1756 B12R2.24 Oc1ccc2cncnc2c1 Amb24066333 [2,0,0,0,0,0|2,0,0]=4 1757 B12R2.24 Oc1ccc2cnncc2c1 Amb28284891 [2,0,0,0,0,0|2,0,0]=4 1758 B12R2.24 Oc1ccc2ncccc2c1 Amb2609971 [2,0,0,0,0,0|1,0,0]=3 1759 B12R2.24 Oc1ccc2nccnc2c1 Amb2548376 [2,0,0,0,0,0|2,0,0]=4 1760 B12R2.24 Oc1ccc2ncncc2c1 Amb8484685 [2,0,0,0,0,0|2,0,0]=4 1761 B12R2.24 Oc1ccc2nnccc2c1 Amb26871668 [2,0,0,0,0,0|2,0,0]=4 1762 B12R2.24 Oc1cnc2ccccc2c1 Amb2610757 [2,0,0,0,0,0|1,0,0]=3 1763 B12R2.24 Oc1cnc2ccccc2n1 Amb2603786 [2,0,0,0,0,0|2,0,0]=4 1764 B12R2.24 Oc1cnc2cccnc2c1 Amb13890072 [2,0,0,0,0,0|2,0,0]=4 1765 B12R2.24 Oc1cnc2ccncc2c1 Amb27265400 [2,0,0,0,0,0|2,0,0]=4 1766 B12R2.24 Oc1cnc2ncccc2c1 Amb26616876 [2,0,0,0,0,0|2,0,0]=4 1767 B12R2.24 Oc1cnc2ncccc2c1 Amb32653317 [2,0,0,0,0,0|2,0,0]=4 1768 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [2,0,0,0,0,0|1,1,0]=4 1769 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [2,0,0,0,0,0|0,1,0]=3 1770 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [2,0,0,0,0,0|1,1,0]=4 1771 B12R2.24 Sc1ccc2cccnc2c1 Amb25885524 [2,0,0,0,0,0|1,1,0]=4 1772 B12R2.24 Sc1ccc2ncccc2c1 Amb25076144 [2,0,0,0,0,0|1,1,0]=4 1773 B12R2.24 Sc1cnc2ccccc2c1 Amb23440777 [2,0,0,0,0,0|1,1,0]=4 1774 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [2,0,0,0,0,0|1,0,0]=3 1775 B12R2.24 [O-][n+]1ccc2ccccc2c1 Amb2609972 [2,0,0,0,0,0|1,0,1]=4 1776 B14R1.29 C=C(NC(=O)OCC)c1ccccc1 Amb27230566 [0,1,1,0,0,0|2,0,0]=4 1777 B14R1.29 CCNC(=O)\C=C(\C)c1ccccc1 Amb27792973 [0,1,1,0,0,0|2,0,0]=4 1778 B14R1.29 CCNC(=O)\C=C(\Cl)c1ccccc1 Amb27875186 [0,1,1,0,0,0|2,0,0]=4 1779 B14R1.29 CCNC(=O)\C=C(\S)c1ccccc1 Amb27162822 [0,1,1,0,0,0|2,0,0]=4 1780 B14R1.29 CCOC(=O)CC(=O)c1ccccc1 Amb1212681 [0,1,1,0,0,0|1,0,1]=4 1781 B14R1.29 CCOC(=O)NC(=N)c1ccccc1 Amb4057355 [0,1,1,0,0,0|2,0,0]=4 1782 B14R1.29 CCOC(=O)NC(=O)c1ccccc1 Amb2682787 [0,1,1,0,0,0|2,0,0]=4 1783 B14R1.29 CCOC(=O)\C=C(/C)c1ccccc1 Amb8391067 [0,1,1,0,0,0|1,0,0]=3 1784 B14R1.29 CCOC(=O)\C=C(/N)c1ccccn1 Amb34912764 [0,1,1,0,0,0|2,0,0]=4 1785 B14R1.29 CCOC(=O)\C=C(\C)c1ccccc1 Amb10566527 [0,1,1,0,0,0|1,0,0]=3 1786 B14R1.29 CCOC(=O)\C=C(\C)c1ccccn1 Amb33493051 [0,1,1,0,0,0|2,0,0]=4 1787 B14R1.29 CCOC(=O)\C=C(\C)c1cccnc1 Amb33493054 [0,1,1,0,0,0|2,0,0]=4 1788 B14R1.29 CCOC(=O)\C=C(\C)c1ccncc1 Amb33493053 [0,1,1,0,0,0|2,0,0]=4 1789 B14R1.29 CCOC(=S)NC(=O)c1ccccc1 Amb1641309 [0,1,1,0,0,0|2,0,0]=4 1790 B14R1.32 CCNC(=O)\C=C\c1cccc(Br)c1 Amb9786534 [0,1,1,0,0,0|2,0,0]=4 1791 B14R1.32 CCNC(=O)\C=C\c1cccc(C)c1 Amb28364222 [0,1,1,0,0,0|2,0,0]=4 1792 B14R1.32 CCNC(=O)\C=C\c1cccc(N)c1 Amb17139254 [0,1,1,0,0,0|2,0,0]=4 1793 B14R1.32 CCOC(=O)\C=C\c1cc(Cl)ccn1 Amb33469204 [0,1,1,0,0,0|2,0,0]=4 1794 B14R1.32 CCOC(=O)\C=C\c1cccc(Br)c1 Amb23504994 [0,1,1,0,0,0|1,0,0]=3 1795 B14R1.32 CCOC(=O)\C=C\c1cccc(Br)n1 Amb33469169 [0,1,1,0,0,0|2,0,0]=4 1796 B14R1.32 CCOC(=O)\C=C\c1cccc(C)c1 Amb10566723 [0,1,1,0,0,0|1,0,0]=3 1797 B14R1.32 CCOC(=O)\C=C\c1cccc(Cl)c1 Amb23504715 [0,1,1,0,0,0|1,0,0]=3 1798 B14R1.32 CCOC(=O)\C=C\c1cccc(F)c1 Amb2699676 [0,1,1,0,0,0|1,0,0]=3 1799 B14R1.32 CCOC(=O)\C=C\c1cccc(N)c1 Amb24061861 [0,1,1,0,0,0|1,0,0]=3 1800 B14R1.32 CCOC(=O)\C=C\c1cccc(O)c1 Amb18651075 [0,1,1,0,0,0|1,0,0]=3 1801 B14R1.32 CCOC(=O)\C=C\c1ccnc(Cl)c1 Amb6565042 [0,1,1,0,0,0|2,0,0]=4 1802 B14R1.32 CCOC(=O)\C=C\c1cncc(Br)c1 Amb33469185 [0,1,1,0,0,0|2,0,0]=4 1803 B14R1.60 C=C(CCN)\C(C)=C\c1ccccc1 Amb33381243 [0,1,1,0,0,0|2,0,0]=4 1804 B14R1.60 C=C(SCC)C(=O)Nc1ccccc1 Amb28120049 [0,1,1,0,0,0|1,1,0]=4 1805 B14R1.60 CCOC(=N)C(=S)Nc1ccccc1 Amb28185834 [0,1,1,0,0,0|2,0,0]=4 1806 B14R1.60 CCOC(=O)C(=O)Cc1ccccc1 Amb28989403 [0,1,1,0,0,0|1,0,1]=4 1807 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 Amb1196006 [0,1,1,0,0,0|2,0,0]=4 1808 B14R1.60 CCOC(=O)\C(C)=C\c1ccccn1 Amb32664894 [0,1,1,0,0,0|2,0,0]=4 1809 B14R1.60 CCOC(=O)\C(C)=C\c1cccnc1 Amb32664895 [0,1,1,0,0,0|2,0,0]=4 1810 B14R1.60 CCOC(=O)\C(Cl)=C\c1ccccc1 Amb32425173 [0,1,1,0,0,0|1,0,0]=3 1811 B14R1.60 CCOC(=O)\C([O-])=C\c1ccncc1 Amb19506687 [0,1,1,0,0,0|2,0,0]=4 1812 B14R1.156 C=CCOC(=O)\C=C\c1ccccc1 Amb6358001 [0,1,1,0,0,0|1,0,1]=4 1813 B14R1.156 O=C(\C=C\c1ccccc1)NCCO Amb5799194 [0,1,1,0,0,0|2,0,0]=4 1814 B14R1.502 C=C(\C=C\c1ccc(F)cc1)CCN Amb33201730 [0,1,1,0,0,0|2,0,0]=4 1815 B14R1.502 CCNC(=O)\C=C\c1ccc(Br)cc1 Amb6881338 [0,1,1,0,0,0|2,0,0]=4 1816 B14R1.502 CCNC(=O)\C=C\c1ccc(Cl)cc1 Amb17775297 [0,1,1,0,0,0|2,0,0]=4 1817 B14R1.502 CCNC(=O)\C=C\c1ccc(F)cc1 Amb17859931 [0,1,1,0,0,0|2,0,0]=4 1818 B14R1.502 CCNC(=O)\C=C\c1ccc(N)cc1 Amb27588212 [0,1,1,0,0,0|2,0,0]=4 1819 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cc1 Amb33716486 [0,1,1,0,0,0|1,0,0]=3 1820 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cc1 Amb33870372 [0,1,1,0,0,0|1,0,0]=3 1821 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cn1 Amb28653453 [0,1,1,0,0,0|2,0,0]=4 1822 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)nc1 Amb28989668 [0,1,1,0,0,0|2,0,0]=4 1823 B14R1.502 CCOC(=O)\C=C\c1ccc(C)cc1 Amb30526854 [0,1,1,0,0,0|1,0,0]=3 1824 B14R1.502 CCOC(=O)\C=C\c1ccc(C)cn1 Amb30594534 [0,1,1,0,0,0|2,0,0]=4 1825 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cc1 Amb24078556 [0,1,1,0,0,0|1,0,0]=3 1826 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cc1 Amb33715893 [0,1,1,0,0,0|1,0,0]=3 1827 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cn1 Amb33469201 [0,1,1,0,0,0|2,0,0]=4 1828 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)nc1 Amb24097721 [0,1,1,0,0,0|2,0,0]=4 1829 B14R1.502 CCOC(=O)\C=C\c1ccc(F)cc1 Amb24089413 [0,1,1,0,0,0|1,0,0]=3 1830 B14R1.502 CCOC(=O)\C=C\c1ccc(F)nc1 Amb33469198 [0,1,1,0,0,0|2,0,0]=4 1831 B14R1.502 CCOC(=O)\C=C\c1ccc(N)cc1 Amb1197562 [0,1,1,0,0,0|1,0,0]=3 1832 B14R1.502 CCOC(=O)\C=C\c1ccc(N)nc1 Amb2697295 [0,1,1,0,0,0|2,0,0]=4 1833 B14R1.502 CCOC(=O)\C=C\c1ccc(O)cc1 Amb2445150 [0,1,1,0,0,0|1,0,0]=3 1834 B14R1.502 CCOC(=O)\C=N\c1ccc(Br)cc1 Amb20241622 [0,1,1,0,0,0|2,0,0]=4 1835 B14R1.502 CCOC(=O)\N=C\c1ccc(Cl)cc1 Amb29599218 [0,1,1,0,0,0|2,0,0]=4 1836 B14R1.502 CCOC(=O)\N=C\c1ccc(F)cc1 Amb33513280 [0,1,1,0,0,0|2,0,0]=4 1837 B14R1.598 CCOC(=O)\C=C\c1ccccc1Br Amb33997762 [0,1,1,0,0,0|1,0,0]=3 1838 B14R1.598 CCOC(=O)\C=C\c1ccccc1C Amb33358074 [0,1,1,0,0,0|1,0,0]=3 1839 B14R1.598 CCOC(=O)\C=C\c1ccccc1Cl Amb34103701 [0,1,1,0,0,0|1,0,0]=3 1840 B14R1.598 CCOC(=O)\C=C\c1ccccc1F Amb2699675 [0,1,1,0,0,0|1,0,0]=3 1841 B14R1.598 CCOC(=O)\C=C\c1ccccc1N Amb17777074 [0,1,1,0,0,0|1,0,0]=3 1842 B14R1.598 CCOC(=O)\C=C\c1ccccc1O Amb18651061 [0,1,1,0,0,0|1,0,0]=3 1843 B14R1.598 CCOC(=O)\C=C\c1cccnc1Br Amb33972638 [0,1,1,0,0,0|2,0,0]=4 1844 B14R1.598 CCOC(=O)\C=C\c1cccnc1Cl Amb24090584 [0,1,1,0,0,0|2,0,0]=4 1845 B14R1.598 CCOC(=O)\C=C\c1cccnc1F Amb33972618 [0,1,1,0,0,0|2,0,0]=4 1846 B14R1.598 CCOC(=O)\C=C\c1ccncc1F Amb33469196 [0,1,1,0,0,0|2,0,0]=4 1847 B14R1.598 CCOC(=O)\C=C\c1cnccc1C Amb32423788 [0,1,1,0,0,0|2,0,0]=4 1848 B14R1.598 CCOC(=O)\C=C\c1cnccc1N Amb10844701 [0,1,1,0,0,0|2,0,0]=4 1849 B14R1.598 CCOC(=O)\C=C\c1ncccc1F Amb33972617 [0,1,1,0,0,0|2,0,0]=4 1850 B14R1.818 C=C(\C=C\c1ccccc1)NC(C)=O Amb27210869 [0,1,1,0,0,0|1,0,1]=4 1851 B14R1.818 CC(=C\C(C)O)\C=C\c1ccccc1 Amb27472779 [0,1,1,0,0,0|1,0,1]=4 1852 B14R1.818 CC(C)NC(=O)\C=C\c1ccccc1 Amb3096736 [0,1,1,0,0,0|2,0,0]=4 1853 B14R1.24 C=CC(=O)Nc1ccc(OCC)nc1 Amb27465090 [0,1,1,0,0,0|2,0,0]=4 1854 B14R1.24 CCOc1ccc(\C=C(/C)C=O)cc1 Amb17336227 [0,1,1,0,0,0|1,0,0]=3 1855 B14R1.25 C=CCC(O)c1ccc(OCC)cc1 Amb30589776 [0,1,1,0,0,0|0,0,2]=4 1856 B14R1.25 CCCc1ccc(\C(Cl)=C\C=O)cc1 Amb17240128 [0,1,1,0,0,0|2,0,0]=4 1857 B14R1.25 CCOc1ccc(C(=O)CC=O)cc1 Amb7766239 [0,1,1,0,0,0|1,0,1]=4 1858 B14R1.25 CCOc1ccc(\C(C)=C\C#N)cc1 Amb27956681 [0,1,1,0,0,0|1,0,1]=4 1859 B14R1.25 CCOc1ccc(\C(Cl)=C\C=O)cc1 Amb17240742 [0,1,1,0,0,0|1,0,0]=3 1860 B14R1.68 C=C\C=C\c1ccc(NC(C)=O)cc1 Amb24694203 [0,1,1,0,0,0|1,0,1]=4 1861 B14R1.68 CC(C)Cc1ccc(\C=C\C=O)cc1 Amb33079934 [0,1,1,0,0,0|2,0,0]=4 1862 B14R1.68 CC(C)Oc1ccc(\C=C\C#N)cc1 Amb17477359 [0,1,1,0,0,0|1,0,1]=4 1863 B14R1.68 CC(C)Oc1ccc(\C=C\C=O)cc1 Amb33359703 [0,1,1,0,0,0|1,0,0]=3 1864 B14R1.68 CC(C)Oc1ccc(\C=C\CN)cc1 Amb18564970 [0,1,1,0,0,0|1,0,1]=4 1865 B14R1.68 CC(C)Oc1ccc(\C=C\CO)cc1 Amb33450164 [0,1,1,0,0,0|1,0,1]=4 1866 B14R1.68 O=C\C=C\c1ccc(OC(F)F)cc1 Amb33338049 [0,1,1,0,0,0|2,0,0]=4 1867 B14R1.70 C=CCOc1ccc(OCCC)cc1 Amb35746590 [0,1,1,0,0,0|1,0,1]=4 1868 B14R1.142 C=C(Br)CCc1ccc(OCC)cc1 Amb6299194 [0,1,1,0,0,0|0,0,2]=4 1869 B14R1.142 C=C(C)CCc1ccc(OCC)cc1 Amb6299195 [0,1,1,0,0,0|0,0,2]=4 1870 B14R1.142 C=C(Cl)CCc1ccc(OCC)cc1 Amb6299193 [0,1,1,0,0,0|0,0,2]=4 1871 B14R1.142 CCOc1ccc(NC=C(C)C)cc1 Amb27866461 [0,1,1,0,0,0|1,0,1]=4 1872 B14R1.142 CCOc1ccc(\C=C/C(N)=S)cc1 Amb18108365 [0,1,1,0,0,0|1,0,0]=3 1873 B14R1.142 CCOc1ccc(\C=C\B(O)O)cc1 Amb20669442 [0,1,1,0,0,0|2,0,0]=4 1874 B14R1.142 CCOc1ccc(\C=C\C(=O)Cl)cc1 Amb16230253 [0,1,1,0,0,0|1,0,0]=3 1875 B14R1.142 CCOc1ccc(\C=C\C(=O)O)cc1 Amb33869746 [0,1,1,0,0,0|1,0,0]=3 1876 B14R1.142 CCOc1ccc(\C=C\C(C)=O)cc1 Amb33079080 [0,1,1,0,0,0|0,0,1]=3 1877 B14R1.142 CCOc1ccc(\C=C\C(C)N)cc1 Amb33225582 [0,1,1,0,0,0|0,0,2]=4 1878 B14R1.142 CCOc1ccc(\C=C\[N+](=O)[O-])cc1 Amb2762732 [0,1,1,0,0,0|2,0,0]=4 1879 B14R1.142 CCSc1ccc(\C=C\C(=O)O)cc1 Amb18895946 [0,1,1,0,0,0|1,1,0]=4 1880 B14R1.465 C=CCNCc1ccc(OCC)cc1 Amb1923352 [0,1,1,0,0,0|0,0,2]=4 1881 B14R1.465 C=CCNCc1ccc(OCC)cc1 Amb6864777 [0,1,1,0,0,0|0,0,2]=4 1882 B14R1.465 CCOc1ccc(\C=C\CNC)cc1 Amb23555651 [0,1,1,0,0,0|0,0,2]=4 1883 B14R1.465 CCOc1ccc(\C=C\NC=O)cc1 Amb27773779 [0,1,1,0,0,0|1,0,0]=3 1884 B14R1.795 CCOc1ccc(\C=C\CN)cc1C Amb18564967 [0,1,1,0,0,0|1,0,1]=4 1885 B14R1.795 CCOc1ccc(\C=C\CN)cc1Cl Amb18569409 [0,1,1,0,0,0|1,0,1]=4 1886 B14R1.795 CCOc1ccc(\C=C\CN)cc1F Amb18565693 [0,1,1,0,0,0|1,0,1]=4 1887 B14R1.1356 CCOc1ccc(\C=C\C=O)c(C)c1 Amb33142235 [0,1,1,0,0,0|1,0,0]=3 1888 B14R1.1356 CCOc1ccc(\C=C\CN)c(C)c1 Amb33142233 [0,1,1,0,0,0|1,0,1]=4 1889 B14R1.1356 CCOc1ccc(\C=C\CO)c(C)c1 Amb33142234 [0,1,1,0,0,0|1,0,1]=4 1890 B14R1.549 C=C\C(=N/C(C)C)Nc1ccccc1 Amb28388669 [0,1,1,0,0,0|2,0,0]=4 1891 B14R1.487 C=CC(=O)c1ccc(OCC)cc1C Amb33143103 [0,1,1,0,0,0|0,0,1]=3 1892 B14R1.487 C=CC(O)c1ccc(OCC)cc1C Amb33142833 [0,1,1,0,0,0|0,0,2]=4 1893 B14R1.3348 CCOC(=O)C(=O)c1ccccc1Br Amb22498291 [0,1,1,0,0,0|2,0,0]=4 1894 B14R1.3348 CCOC(=O)C(=O)c1ccccc1C Amb18548466 [0,1,1,0,0,0|1,0,1]=4 1895 B14R1.3348 CCOC(=O)C(=O)c1ccccc1Cl Amb21961893 [0,1,1,0,0,0|2,0,0]=4 1896 B14R1.3348 CCOC(=O)C(=O)c1ccccc1F Amb6299678 [0,1,1,0,0,0|2,0,0]=4 1897 B14R1.3348 CCOC(=O)C(=O)c1ccccc1N Amb23412044 [0,1,1,0,0,0|2,0,0]=4 1898 B14R1.882 CCO\C=C\C#Cc1ccccc1N Amb27975490 [0,1,1,0,0,0|1,0,1]=4 1899 B14R1.1035 CCN\C=C\C(=O)c1ccccc1O Amb25087167 [0,1,1,0,0,0|2,0,0]=4 1900 B14R1.1035 CCO\C=C\C(=O)c1ccccc1Br Amb33355257 [0,1,1,0,0,0|1,0,0]=3 1901 B14R1.1035 CCO\C=C\C(=O)c1ccccc1C Amb33355231 [0,1,1,0,0,0|0,0,1]=3 1902 B14R1.1035 CCO\C=C\C(=O)c1ccccc1Cl Amb33355250 [0,1,1,0,0,0|1,0,0]=3 1903 B14R1.1035 CCO\C=C\C(=O)c1ccccc1F Amb33355237 [0,1,1,0,0,0|1,0,0]=3 1904 B14R1.468 CCOc1cccc(\C=C\C(=O)Cl)c1 Amb17143503 [0,1,1,0,0,0|1,0,0]=3 1905 B14R1.468 CCOc1cccc(\C=C\C(=O)O)c1 Amb17659319 [0,1,1,0,0,0|1,0,0]=3 1906 B14R1.468 CCOc1cccc(\C=C\C(C)=O)c1 Amb33474599 [0,1,1,0,0,0|0,0,1]=3 1907 B14R1.468 CCOc1cccc(\C=C\C(C)N)c1 Amb33475205 [0,1,1,0,0,0|0,0,2]=4 1908 B14R1.468 CCOc1cccc(\C=C\C(N)=O)c1 Amb17143091 [0,1,1,0,0,0|1,0,0]=3 1909 B14R1.468 CCOc1cccc(\C=C\[N+](=O)[O-])c1 Amb19050938 [0,1,1,0,0,0|2,0,0]=4 1910 B14R1.470 C=CC(=O)Nc1cccc(OCC)c1 Amb19050118 [0,1,1,0,0,0|1,0,0]=3 1911 B14R1.470 C=CC(=O)Nc1cccc(SCC)c1 Amb35690276 [0,1,1,0,0,0|1,1,0]=4 1912 B14R1.470 CCOc1cccc(\C=C(/C)C=O)c1 Amb17336225 [0,1,1,0,0,0|1,0,0]=3 1913 B14R1.471 C=CCC(O)c1cccc(OCC)c1 Amb19041624 [0,1,1,0,0,0|0,0,2]=4 1914 B14R1.778 CC(C)Oc1cccc(\C=C\C=O)n1 Amb33274610 [0,1,1,0,0,0|2,0,0]=4 1915 B14R1.778 O=C\C=C\c1cccc(OC(F)F)c1 Amb33405261 [0,1,1,0,0,0|2,0,0]=4 1916 B14R1.782 CCOc1cccc(\C=C\C=O)c1O Amb33171927 [0,1,1,0,0,0|1,0,0]=3 1917 B14R1.782 CCOc1cccc(\C=C\CN)c1O Amb33377510 [0,1,1,0,0,0|1,0,1]=4 1918 B14R1.782 CCOc1cccc(\C=C\CO)c1O Amb33377512 [0,1,1,0,0,0|1,0,1]=4 1919 B14R1.898 C=CCNCc1cccc(OCC)c1 Amb6864787 [0,1,1,0,0,0|0,0,2]=4 1920 B14R1.898 C=CCNCc1cccc(OCC)c1 Amb8450642 [0,1,1,0,0,0|0,0,2]=4 1921 B14R2.92 BrCc1ccc2ccccc2c1Br Amb3862741 [1,1,0,0,0,0|1,0,0]=3 1922 B14R2.92 BrCc1ccc2ccccc2c1I Amb28312898 [1,1,0,0,0,0|1,0,0]=3 1923 B14R2.92 BrCc1ccc2cccnc2c1Br Amb28196609 [1,1,0,0,0,0|2,0,0]=4 1924 B14R2.92 C#Cc1ccc2ccccc2c1Br Amb27641232 [1,1,0,0,0,0|0,0,2]=4 1925 B14R2.92 C=C1c2ccccc2C=CC1CO Amb27761641 [1,1,0,0,0,0|1,0,1]=4 1926 B14R2.92 C=Cc1ccc2ccccc2c1Br Amb27400948 [1,1,0,0,0,0|0,0,2]=4 1927 B14R2.92 C=Cc1ccc2ccccc2c1N Amb27796207 [1,1,0,0,0,0|0,0,2]=4 1928 B14R2.92 CCC1=CNc2ccccc2C1=O Amb27180179 [1,1,0,0,0,0|1,0,0]=3 1929 B14R2.92 CCC1C=Cc2ccccc2C1O Amb27484743 [1,1,0,0,0,0|0,0,2]=4 1930 B14R2.92 CCN1C=Cc2ccccc2C1=S Amb19770045 [1,1,0,0,0,0|1,0,0]=3 1931 B14R2.92 CCN1N=Cc2ccccc2C1=O Amb27949688 [1,1,0,0,0,0|2,0,0]=4 1932 B14R2.92 CC[C@@H]1C=Cc2ccccc2[C@H]1O Amb27980557 [1,1,0,0,0,0|0,0,2]=4 1933 B14R2.92 CC[C@H]1C=Cc2ccccc2[C@@H]1O Amb28318715 [1,1,0,0,0,0|0,0,2]=4 1934 B14R2.92 CCc1ccc2cccnc2c1N Amb22899681 [1,1,0,0,0,0|1,0,0]=3 1935 B14R2.92 CCc1ccc2cccnc2c1O Amb27227018 [1,1,0,0,0,0|1,0,0]=3 1936 B14R2.92 CCc1ccc2cnccc2c1N Amb25828778 [1,1,0,0,0,0|1,0,0]=3 1937 B14R2.92 CCc1ccc2ncccc2c1N Amb24739731 [1,1,0,0,0,0|1,0,0]=3 1938 B14R2.92 CCc1cnc2ccccc2[n+]1[O-] Amb25249608 [1,1,0,0,0,0|2,0,0]=4 1939 B14R2.92 CCc1cnc2ccccc2c1Cl Amb27623726 [1,1,0,0,0,0|1,0,0]=3 1940 B14R2.92 CCc1cnc2ccccc2c1N Amb27803824 [1,1,0,0,0,0|1,0,0]=3 1941 B14R2.92 CCc1ncc2ccccc2c1C Amb27959209 [1,1,0,0,0,0|1,0,0]=3 1942 B14R2.92 CCc1nnc2ccccc2c1O Amb18137024 [1,1,0,0,0,0|2,0,0]=4 1943 B14R2.92 CNc1ccc2ccccc2c1N Amb17594325 [1,1,0,0,0,0|1,0,0]=3 1944 B14R2.92 CNc1ccc2cccnc2c1N Amb17608146 [1,1,0,0,0,0|2,0,0]=4 1945 B14R2.92 CNc1ccc2ccncc2c1N Amb27618235 [1,1,0,0,0,0|2,0,0]=4 1946 B14R2.92 CNc1ccc2ncccc2c1N Amb31156388 [1,1,0,0,0,0|2,0,0]=4 1947 B14R2.92 CNc1ccc2ncccc2c1N Amb9676267 [1,1,0,0,0,0|2,0,0]=4 1948 B14R2.92 COC1=CNc2ccccc2C1=O Amb25679917 [1,1,0,0,0,0|1,0,0]=3 1949 B14R2.92 CO[C@@H]1C=Cc2ccccc2[C@@H]1O Amb27197147 [1,1,0,0,0,0|0,0,2]=4 1950 B14R2.92 COc1ccc2c(c1N)CC=CC2 Amb27224630 [1,1,0,0,0,0|0,0,2]=4 1951 B14R2.92 COc1ccc2ccccc2c1Br Amb2618563 [1,1,0,0,0,0|0,0,0]=2 1952 B14R2.92 COc1ccc2ccccc2c1C Amb17743960 [1,1,0,0,0,0|0,0,0]=2 1953 B14R2.92 COc1ccc2ccccc2c1F Amb28185351 [1,1,0,0,0,0|0,0,0]=2 1954 B14R2.92 COc1ccc2ccccc2c1I Amb2477152 [1,1,0,0,0,0|0,0,0]=2 1955 B14R2.92 COc1ccc2ccccc2c1N Amb17200200 [1,1,0,0,0,0|0,0,0]=2 1956 B14R2.92 COc1ccc2ccccc2c1S Amb32732685 [1,1,0,0,0,0|0,0,0]=2 1957 B14R2.92 COc1ccc2cccnc2c1Br Amb16226757 [1,1,0,0,0,0|1,0,0]=3 1958 B14R2.92 COc1ccc2cccnc2c1C Amb32651814 [1,1,0,0,0,0|1,0,0]=3 1959 B14R2.92 COc1ccc2cccnc2c1Cl Amb23437321 [1,1,0,0,0,0|1,0,0]=3 1960 B14R2.92 COc1ccc2cccnc2c1F Amb23403105 [1,1,0,0,0,0|1,0,0]=3 1961 B14R2.92 COc1ccc2cccnc2c1I Amb23400932 [1,1,0,0,0,0|1,0,0]=3 1962 B14R2.92 COc1ccc2cccnc2c1N Amb20621536 [1,1,0,0,0,0|1,0,0]=3 1963 B14R2.92 COc1ccc2cccnc2c1O Amb26880905 [1,1,0,0,0,0|1,0,0]=3 1964 B14R2.92 COc1ccc2ccncc2c1Br Amb19100699 [1,1,0,0,0,0|1,0,0]=3 1965 B14R2.92 COc1ccc2ccncc2c1I Amb2613187 [1,1,0,0,0,0|1,0,0]=3 1966 B14R2.92 COc1ccc2ccncc2c1N Amb8010681 [1,1,0,0,0,0|1,0,0]=3 1967 B14R2.92 COc1ccc2cnccc2c1Br Amb19100700 [1,1,0,0,0,0|1,0,0]=3 1968 B14R2.92 COc1ccc2cnccc2c1N Amb24062940 [1,1,0,0,0,0|1,0,0]=3 1969 B14R2.92 COc1ccc2cnccc2c1O Amb27954682 [1,1,0,0,0,0|1,0,0]=3 1970 B14R2.92 COc1ccc2ncccc2c1Br Amb18354242 [1,1,0,0,0,0|1,0,0]=3 1971 B14R2.92 COc1ccc2ncccc2c1C Amb35789585 [1,1,0,0,0,0|1,0,0]=3 1972 B14R2.92 COc1ccc2ncccc2c1Cl Amb23437324 [1,1,0,0,0,0|1,0,0]=3 1973 B14R2.92 COc1ccc2ncccc2c1I Amb23403115 [1,1,0,0,0,0|1,0,0]=3 1974 B14R2.92 COc1ccc2ncccc2c1N Amb9676517 [1,1,0,0,0,0|1,0,0]=3 1975 B14R2.92 COc1ccc2ncccc2c1O Amb18127369 [1,1,0,0,0,0|1,0,0]=3 1976 B14R2.92 COc1ccc2nccnc2c1Br Amb28290675 [1,1,0,0,0,0|2,0,0]=4 1977 B14R2.92 COc1ccc2nccnc2c1Cl Amb27800255 [1,1,0,0,0,0|2,0,0]=4 1978 B14R2.92 COc1ccc2ncncc2c1N Amb18647894 [1,1,0,0,0,0|2,0,0]=4 1979 B14R2.92 COc1cnc2ccccc2[n+]1[O-] Amb27231680 [1,1,0,0,0,0|2,0,0]=4 1980 B14R2.92 COc1cnc2ccccc2c1Br Amb27405335 [1,1,0,0,0,0|1,0,0]=3 1981 B14R2.92 COc1cnc2ccccc2c1N Amb18127237 [1,1,0,0,0,0|1,0,0]=3 1982 B14R2.92 COc1cnc2cccnc2c1I Amb21959427 [1,1,0,0,0,0|2,0,0]=4 1983 B14R2.92 CSC1=COc2ccccc2C1=O Amb28242942 [1,1,0,0,0,0|1,1,0]=4 1984 B14R2.92 CSc1ccc2ccccc2c1N Amb27407738 [1,1,0,0,0,0|0,1,0]=3 1985 B14R2.92 CSc1ccc2cccnc2c1N Amb18129874 [1,1,0,0,0,0|1,1,0]=4 1986 B14R2.92 CSc1cnc2ccccc2c1Br Amb28455428 [1,1,0,0,0,0|1,1,0]=4 1987 B14R2.92 CSc1cnc2ccccc2c1Cl Amb24271296 [1,1,0,0,0,0|1,1,0]=4 1988 B14R2.92 Cc1c(C#N)ccc2ccccc12 Amb17594178 [1,1,0,0,0,0|1,0,1]=4 1989 B14R2.92 Cc1c(C=O)ccc2ccccc12 Amb17594259 [1,1,0,0,0,0|1,0,1]=4 1990 B14R2.92 Cc1c(CBr)ccc2ccccc12 Amb27180973 [1,1,0,0,0,0|1,0,0]=3 1991 B14R2.92 Cc1c(CCl)ccc2ccccc12 Amb25927087 [1,1,0,0,0,0|1,0,0]=3 1992 B14R2.92 Cc1c(CN)ccc2ccccc12 Amb25815347 [1,1,0,0,0,0|1,0,0]=3 1993 B14R2.92 ClCc1ccc2ccccc2c1Br Amb26637972 [1,1,0,0,0,0|1,0,0]=3 1994 B14R2.92 ClCc1ccc2ccccc2c1Cl Amb25696540 [1,1,0,0,0,0|1,0,0]=3 1995 B14R2.92 ClCc1cnc2ccccc2c1Cl Amb28071137 [1,1,0,0,0,0|2,0,0]=4 1996 B14R2.92 Clc1c(CBr)ccc2ccccc12 Amb26332055 [1,1,0,0,0,0|1,0,0]=3 1997 B14R2.92 N#Cc1ccc2ccccc2c1Br Amb25301470 [1,1,0,0,0,0|1,0,1]=4 1998 B14R2.92 N#Cc1ccc2ccccc2c1Cl Amb18649706 [1,1,0,0,0,0|1,0,1]=4 1999 B14R2.92 N#Cc1ccc2ccccc2c1F Amb27464133 [1,1,0,0,0,0|1,0,1]=4 2000 B14R2.92 N#Cc1ccc2ccccc2c1I Amb25055750 [1,1,0,0,0,0|1,0,1]=4 2001 B14R2.92 N#Cc1ccc2ccccc2c1N Amb8439142 [1,1,0,0,0,0|1,0,1]=4 2002 B14R2.92 N#Cc1ccc2ccccc2c1O Amb17594234 [1,1,0,0,0,0|1,0,1]=4 2003 B14R2.92 N#[N+]c1ccc2ccccc2c1Br Amb27228992 [1,1,0,0,0,0|2,0,0]=4 2004 B14R2.92 NCC1=COc2ccccc2C1=O Amb18127388 [1,1,0,0,0,0|2,0,0]=4 2005 B14R2.92 NCc1ccc2ccccc2c1F Amb28243524 [1,1,0,0,0,0|1,0,0]=3 2006 B14R2.92 NCc1ccc2ccccc2c1F Amb33620975 [1,1,0,0,0,0|1,0,0]=3 2007 B14R2.92 NCc1ccc2ccccc2c1I Amb25804717 [1,1,0,0,0,0|1,0,0]=3 2008 B14R2.92 NCc1ccc2ccccc2c1N Amb18252189 [1,1,0,0,0,0|1,0,0]=3 2009 B14R2.92 NCc1ccc2ccccc2c1O Amb28242155 [1,1,0,0,0,0|1,0,0]=3 2010 B14R2.92 NCc1ccc2cccnc2c1O Amb28555930 [1,1,0,0,0,0|2,0,0]=4 2011 B14R2.92 NCc1ccc2cccnc2c1O Amb9776170 [1,1,0,0,0,0|2,0,0]=4 2012 B14R2.92 NCc1ccc2cnccc2c1O Amb28411214 [1,1,0,0,0,0|2,0,0]=4 2013 B14R2.92 NCc1ccc2ncccc2c1N Amb18252197 [1,1,0,0,0,0|2,0,0]=4 2014 B14R2.92 NCc1cnc2ccccc2c1N Amb18946631 [1,1,0,0,0,0|2,0,0]=4 2015 B14R2.92 NNc1ccc2ccccc2c1O Amb27760649 [1,1,0,0,0,0|2,0,0]=4 2016 B14R2.92 Nc1c(C=O)ccc2ccccc12 Amb27389594 [1,1,0,0,0,0|1,0,1]=4 2017 B14R2.92 Nc1c(CBr)ccc2ccccc12 Amb24488745 [1,1,0,0,0,0|1,0,0]=3 2018 B14R2.92 Nc1c(CO)ccc2ccccc12 Amb24649808 [1,1,0,0,0,0|1,0,0]=3 2019 B14R2.92 Nc1c(CO)ccc2cccnc12 Amb27831293 [1,1,0,0,0,0|2,0,0]=4 2020 B14R2.92 Nc1c(CO)ccc2cnccc12 Amb23448499 [1,1,0,0,0,0|2,0,0]=4 2021 B14R2.92 O=C1C(CO)=COc2ccccc21 Amb18048535 [1,1,0,0,0,0|2,0,0]=4 2022 B14R2.92 O=C1\C(=N\O)C=Cc2ccccc21 Amb22489656 [1,1,0,0,0,0|2,0,0]=4 2023 B14R2.92 O=Cc1ccc2ccccc2c1Br Amb3939652 [1,1,0,0,0,0|1,0,1]=4 2024 B14R2.92 O=Cc1ccc2ccccc2c1Cl Amb8388177 [1,1,0,0,0,0|1,0,1]=4 2025 B14R2.92 O=Cc1ccc2ccccc2c1F Amb8388176 [1,1,0,0,0,0|1,0,1]=4 2026 B14R2.92 O=Cc1ccc2ccccc2c1I Amb27647571 [1,1,0,0,0,0|1,0,1]=4 2027 B14R2.92 O=Cc1ccc2ccccc2c1O Amb4007826 [1,1,0,0,0,0|1,0,1]=4 2028 B14R2.92 O=Nc1ccc2ccccc2c1O Amb6357361 [1,1,0,0,0,0|2,0,0]=4 2029 B14R2.92 OCc1ccc2ccccc2c1Br Amb27633219 [1,1,0,0,0,0|1,0,0]=3 2030 B14R2.92 OCc1ccc2ccccc2c1F Amb24624550 [1,1,0,0,0,0|1,0,0]=3 2031 B14R2.92 OCc1ccc2ccccc2c1I Amb27608305 [1,1,0,0,0,0|1,0,0]=3 2032 B14R2.92 OCc1ccc2ccccc2c1O Amb18127195 [1,1,0,0,0,0|1,0,0]=3 2033 B14R2.92 OCc1ccc2ncccc2c1Cl Amb10976191 [1,1,0,0,0,0|2,0,0]=4 2034 B14R2.92 OCc1ccc2ncccc2c1F Amb28071704 [1,1,0,0,0,0|2,0,0]=4 2035 B14R2.92 OCc1ncc2ccccc2c1F Amb27472579 [1,1,0,0,0,0|2,0,0]=4 2036 B14R2.92 ONc1ccc2ccccc2c1O Amb27816554 [1,1,0,0,0,0|2,0,0]=4 2037 B14R2.92 Oc1c(CBr)ccc2ccccc12 Amb27876665 [1,1,0,0,0,0|1,0,0]=3 2038 B14R2.92 Oc1c(CCl)ccc2ccccc12 Amb25900678 [1,1,0,0,0,0|1,0,0]=3 2039 B14R2.92 [N-]=[N+]=C1C=Cc2ccccc2C1=O Amb25758125 [1,1,0,0,0,0|2,0,0]=4 2040 B14R2.134 BrCc1cc2cc(Br)ccc2cn1 Amb23412081 [1,1,0,0,0,0|2,0,0]=4 2041 B14R2.134 BrCc1cc2cc(Br)ccc2cn1 Amb28140769 [1,1,0,0,0,0|2,0,0]=4 2042 B14R2.134 BrCc1ccc2ccc(Br)cc2c1 Amb28068536 [1,1,0,0,0,0|1,0,0]=3 2043 B14R2.134 BrCc1ccc2ccc(I)cc2c1 Amb25670304 [1,1,0,0,0,0|1,0,0]=3 2044 B14R2.134 BrCc1cnc2ccc(Br)cc2c1 Amb26331182 [1,1,0,0,0,0|2,0,0]=4 2045 B14R2.134 CCc1cc2cc(C)ccc2cn1 Amb27847114 [1,1,0,0,0,0|1,0,0]=3 2046 B14R2.134 CCc1ccc2c(c1)C=C(C)CN2 Amb18559665 [1,1,0,0,0,0|1,0,1]=4 2047 B14R2.134 CCc1ccc2c(c1)OC(=O)C=C2 Amb28135747 [1,1,0,0,0,0|1,0,0]=3 2048 B14R2.134 CCc1ccc2ccc(F)nc2n1 Amb32679675 [1,1,0,0,0,0|2,0,0]=4 2049 B14R2.134 CCc1ccc2ccc(N)nc2c1 Amb18126933 [1,1,0,0,0,0|1,0,0]=3 2050 B14R2.134 CCc1ccc2ccc(O)cc2c1 Amb26937947 [1,1,0,0,0,0|0,0,0]=2 2051 B14R2.134 CCc1ccc2ncc(C)cc2c1 Amb17334865 [1,1,0,0,0,0|1,0,0]=3 2052 B14R2.134 CCc1ccc2ncc(N)cc2c1 Amb17157132 [1,1,0,0,0,0|1,0,0]=3 2053 B14R2.134 CCc1ccc2ncc(O)cc2c1 Amb25035410 [1,1,0,0,0,0|1,0,0]=3 2054 B14R2.134 CCc1cnc2ccc(C)cc2c1 Amb17334868 [1,1,0,0,0,0|1,0,0]=3 2055 B14R2.134 CCc1cnc2ccc(O)cc2c1 Amb28243145 [1,1,0,0,0,0|1,0,0]=3 2056 B14R2.134 CNc1cc2cc(Br)ccc2cn1 Amb24665971 [1,1,0,0,0,0|2,0,0]=4 2057 B14R2.134 CNc1ccc2c(c1)NC(=O)C=C2 Amb28410493 [1,1,0,0,0,0|2,0,0]=4 2058 B14R2.134 CNc1ccc2ccc(F)cc2n1 Amb28318054 [1,1,0,0,0,0|2,0,0]=4 2059 B14R2.134 CNc1ccc2ncc(Cl)cc2c1 Amb22751174 [1,1,0,0,0,0|2,0,0]=4 2060 B14R2.134 CNc1ccc2ncc(I)cc2c1 Amb22751170 [1,1,0,0,0,0|2,0,0]=4 2061 B14R2.134 COC1=CC2=CC(=O)NC=C2C=C1 Amb21964171 [1,1,0,0,0,0|1,0,0]=3 2062 B14R2.134 COc1cc2cc(Br)ccc2cn1 Amb22498297 [1,1,0,0,0,0|1,0,0]=3 2063 B14R2.134 COc1ccc2c(c1)C=C(C)CN2 Amb18559663 [1,1,0,0,0,0|1,0,1]=4 2064 B14R2.134 COc1ccc2c(c1)CC(=O)N=C2 Amb22015296 [1,1,0,0,0,0|1,0,1]=4 2065 B14R2.134 COc1ccc2c(c1)CC(N)C=C2 Amb17470523 [1,1,0,0,0,0|0,0,2]=4 2066 B14R2.134 COc1ccc2c(c1)NC(=O)C=N2 Amb21856989 [1,1,0,0,0,0|2,0,0]=4 2067 B14R2.134 COc1ccc2c(c1)NC(C)C=C2 Amb18559673 [1,1,0,0,0,0|1,0,1]=4 2068 B14R2.134 COc1ccc2c(c1)OC(=O)C=C2 Amb18511473 [1,1,0,0,0,0|1,0,0]=3 2069 B14R2.134 COc1ccc2c(c1)OC(=S)C=C2 Amb28385461 [1,1,0,0,0,0|1,0,0]=3 2070 B14R2.134 COc1ccc2c(c1)OC(O)C=C2 Amb27766566 [1,1,0,0,0,0|1,0,1]=4 2071 B14R2.134 COc1ccc2c(n1)NC(=O)C=C2 Amb22753693 [1,1,0,0,0,0|2,0,0]=4 2072 B14R2.134 COc1ccc2cc[n+]([O-])cc2c1 Amb2613189 [1,1,0,0,0,0|1,0,0]=3 2073 B14R2.134 COc1ccc2ccc(Br)cc2c1 Amb27252105 [1,1,0,0,0,0|0,0,0]=2 2074 B14R2.134 COc1ccc2ccc(Br)cc2n1 Amb22234521 [1,1,0,0,0,0|1,0,0]=3 2075 B14R2.134 COc1ccc2ccc(Br)nc2c1 Amb25789005 [1,1,0,0,0,0|1,0,0]=3 2076 B14R2.134 COc1ccc2ccc(C)cc2c1 Amb25340236 [1,1,0,0,0,0|0,0,0]=2 2077 B14R2.134 COc1ccc2ccc(C)nc2c1 Amb1994820 [1,1,0,0,0,0|1,0,0]=3 2078 B14R2.134 COc1ccc2ccc(Cl)cc2c1 Amb25974096 [1,1,0,0,0,0|0,0,0]=2 2079 B14R2.134 COc1ccc2ccc(Cl)nc2c1 Amb21864672 [1,1,0,0,0,0|1,0,0]=3 2080 B14R2.134 COc1ccc2ccc(F)cc2c1 Amb24725253 [1,1,0,0,0,0|0,0,0]=2 2081 B14R2.134 COc1ccc2ccc(I)cc2c1 Amb27667893 [1,1,0,0,0,0|0,0,0]=2 2082 B14R2.134 COc1ccc2ccc(N)cc2c1 Amb25187874 [1,1,0,0,0,0|0,0,0]=2 2083 B14R2.134 COc1ccc2ccc(N)cc2n1 Amb23401128 [1,1,0,0,0,0|1,0,0]=3 2084 B14R2.134 COc1ccc2ccc(N)nc2c1 Amb18127232 [1,1,0,0,0,0|1,0,0]=3 2085 B14R2.134 COc1ccc2ccc(N)nc2n1 Amb25900489 [1,1,0,0,0,0|2,0,0]=4 2086 B14R2.134 COc1ccc2ccc(O)cc2c1 Amb3939561 [1,1,0,0,0,0|0,0,0]=2 2087 B14R2.134 COc1ccc2ccc(O)cc2n1 Amb26317850 [1,1,0,0,0,0|1,0,0]=3 2088 B14R2.134 COc1ccc2ccc(S)nc2c1 Amb28429749 [1,1,0,0,0,0|1,0,0]=3 2089 B14R2.134 COc1ccc2cnc(C)cc2c1 Amb17778822 [1,1,0,0,0,0|1,0,0]=3 2090 B14R2.134 COc1ccc2cnc(C)nc2c1 Amb23401003 [1,1,0,0,0,0|2,0,0]=4 2091 B14R2.134 COc1ccc2cnc(Cl)cc2c1 Amb22735858 [1,1,0,0,0,0|1,0,0]=3 2092 B14R2.134 COc1ccc2cnc(Cl)nc2c1 Amb22292327 [1,1,0,0,0,0|2,0,0]=4 2093 B14R2.134 COc1ccc2cnc(F)cc2c1 Amb26414113 [1,1,0,0,0,0|1,0,0]=3 2094 B14R2.134 COc1ccc2cnc(N)nc2c1 Amb23402208 [1,1,0,0,0,0|2,0,0]=4 2095 B14R2.134 COc1ccc2ncc(Br)cc2c1 Amb1994330 [1,1,0,0,0,0|1,0,0]=3 2096 B14R2.134 COc1ccc2ncc(Br)nc2c1 Amb26500425 [1,1,0,0,0,0|2,0,0]=4 2097 B14R2.134 COc1ccc2ncc(C)cc2n1 Amb28120690 [1,1,0,0,0,0|2,0,0]=4 2098 B14R2.134 COc1ccc2ncc(Cl)nc2c1 Amb19959203 [1,1,0,0,0,0|2,0,0]=4 2099 B14R2.134 COc1ccc2ncc(F)cc2c1 Amb21926929 [1,1,0,0,0,0|1,0,0]=3 2100 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb10669512 [1,1,0,0,0,0|1,0,0]=3 2101 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb1994860 [1,1,0,0,0,0|1,0,0]=3 2102 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb20239407 [1,1,0,0,0,0|1,0,0]=3 2103 B14R2.134 COc1ccc2ncc(N)nc2c1 Amb21858805 [1,1,0,0,0,0|2,0,0]=4 2104 B14R2.134 COc1ccc2ncc(O)cc2c1 Amb8506041 [1,1,0,0,0,0|1,0,0]=3 2105 B14R2.134 COc1cnc2c(c1)NC(=O)C=C2 Amb22234510 [1,1,0,0,0,0|2,0,0]=4 2106 B14R2.134 COc1cnc2ccc(Br)cc2c1 Amb22494759 [1,1,0,0,0,0|1,0,0]=3 2107 B14R2.134 COc1cnc2ccc(Br)cc2n1 Amb27609348 [1,1,0,0,0,0|2,0,0]=4 2108 B14R2.134 COc1cnc2ccc(Cl)cc2c1 Amb22495280 [1,1,0,0,0,0|1,0,0]=3 2109 B14R2.134 COc1cnc2ccc(F)cc2c1 Amb22495281 [1,1,0,0,0,0|1,0,0]=3 2110 B14R2.134 COc1cnc2ccc(I)cc2c1 Amb22495279 [1,1,0,0,0,0|1,0,0]=3 2111 B14R2.134 COc1cnc2ccc(N)cc2c1 Amb26880806 [1,1,0,0,0,0|1,0,0]=3 2112 B14R2.134 COc1cnc2ccc(O)cc2c1 Amb28066536 [1,1,0,0,0,0|1,0,0]=3 2113 B14R2.134 COc1cnc2ncc(N)cc2c1 Amb27211178 [1,1,0,0,0,0|2,0,0]=4 2114 B14R2.134 COc1ncc2ccc(Cl)cc2n1 Amb28242391 [1,1,0,0,0,0|2,0,0]=4 2115 B14R2.134 CSc1ccc2ccc(C)cc2n1 Amb28255821 [1,1,0,0,0,0|1,1,0]=4 2116 B14R2.134 CSc1ccc2ccc(N)nc2c1 Amb18129872 [1,1,0,0,0,0|1,1,0]=4 2117 B14R2.134 Cc1ccc2ccc(C#N)cc2c1 Amb24580661 [1,1,0,0,0,0|1,0,1]=4 2118 B14R2.134 Cc1ccc2ccc(C=O)cc2c1 Amb2609106 [1,1,0,0,0,0|1,0,1]=4 2119 B14R2.134 Cc1ccc2ccc(CBr)cc2c1 Amb26572902 [1,1,0,0,0,0|1,0,0]=3 2120 B14R2.134 Cc1ccc2ccc(CN)cc2c1 Amb24407187 [1,1,0,0,0,0|1,0,0]=3 2121 B14R2.134 Cc1ccc2ccc(CN)cc2n1 Amb19103152 [1,1,0,0,0,0|2,0,0]=4 2122 B14R2.134 Cc1ccc2ccc(CO)cc2c1 Amb25374010 [1,1,0,0,0,0|1,0,0]=3 2123 B14R2.134 Cc1ccc2ncc(CCl)cc2c1 Amb23580341 [1,1,0,0,0,0|2,0,0]=4 2124 B14R2.134 Cc1ccc2ncc(CCl)cc2c1 Amb32663596 [1,1,0,0,0,0|2,0,0]=4 2125 B14R2.134 Cc1ccc2ncc(CN)cc2c1 Amb18252186 [1,1,0,0,0,0|2,0,0]=4 2126 B14R2.134 Cc1ccc2ncc(CO)cc2c1 Amb20669292 [1,1,0,0,0,0|2,0,0]=4 2127 B14R2.134 ClCc1cc2cc(Br)ccc2cn1 Amb23412080 [1,1,0,0,0,0|2,0,0]=4 2128 B14R2.134 ClCc1cc2cc(Br)ccc2cn1 Amb26055305 [1,1,0,0,0,0|2,0,0]=4 2129 B14R2.134 ClCc1ccc2ccc(Br)cc2c1 Amb25856973 [1,1,0,0,0,0|1,0,0]=3 2130 B14R2.134 ClCc1ccc2ccc(Br)cc2n1 Amb27223969 [1,1,0,0,0,0|2,0,0]=4 2131 B14R2.134 ClCc1ccc2ccc(Cl)cc2c1 Amb24697560 [1,1,0,0,0,0|1,0,0]=3 2132 B14R2.134 ClCc1ccc2ccc(Cl)cc2n1 Amb27873392 [1,1,0,0,0,0|2,0,0]=4 2133 B14R2.134 ClCc1cnc2ccc(Br)cc2c1 Amb27976405 [1,1,0,0,0,0|2,0,0]=4 2134 B14R2.134 Clc1ccc2ccc(CBr)cc2c1 Amb27608386 [1,1,0,0,0,0|1,0,0]=3 2135 B14R2.134 Clc1ccc2ccc(CBr)cc2n1 Amb27186407 [1,1,0,0,0,0|2,0,0]=4 2136 B14R2.134 Clc1ccc2ccc(CBr)nc2c1 Amb22002144 [1,1,0,0,0,0|2,0,0]=4 2137 B14R2.134 Fc1ccc2ccc(CBr)nc2c1 Amb27492941 [1,1,0,0,0,0|2,0,0]=4 2138 B14R2.134 Fc1ccc2ccc(CCl)cc2c1 Amb25188057 [1,1,0,0,0,0|1,0,0]=3 2139 B14R2.134 Fc1ccc2ccc(CCl)nc2c1 Amb27955196 [1,1,0,0,0,0|2,0,0]=4 2140 B14R2.134 Fc1ccc2ncc(CCl)cc2c1 Amb23580344 [1,1,0,0,0,0|2,0,0]=4 2141 B14R2.134 N#Cc1ccc2ccc(Br)cc2c1 Amb27797116 [1,1,0,0,0,0|1,0,1]=4 2142 B14R2.134 N#Cc1ccc2ccc(I)cc2c1 Amb25154970 [1,1,0,0,0,0|1,0,1]=4 2143 B14R2.134 N#Cc1ccc2ccc(N)cc2c1 Amb24463491 [1,1,0,0,0,0|1,0,1]=4 2144 B14R2.134 N#Cc1ccc2ccc(O)cc2c1 Amb8389630 [1,1,0,0,0,0|1,0,1]=4 2145 B14R2.134 NCc1cc2cc(F)ccc2cn1 Amb27794924 [1,1,0,0,0,0|2,0,0]=4 2146 B14R2.134 NCc1ccc2c(c1)NC(=O)C=C2 Amb27226307 [1,1,0,0,0,0|2,0,0]=4 2147 B14R2.134 NCc1ccc2c(c1)OC(=O)C=C2 Amb27403027 [1,1,0,0,0,0|2,0,0]=4 2148 B14R2.134 NCc1ccc2ccc(Br)cc2c1 Amb26855807 [1,1,0,0,0,0|1,0,0]=3 2149 B14R2.134 NCc1ccc2ccc(Cl)cc2c1 Amb26946474 [1,1,0,0,0,0|1,0,0]=3 2150 B14R2.134 NCc1ccc2ccc(Cl)cc2c1 Amb32668466 [1,1,0,0,0,0|1,0,0]=3 2151 B14R2.134 NCc1ccc2ccc(Cl)cc2n1 Amb17578604 [1,1,0,0,0,0|2,0,0]=4 2152 B14R2.134 NCc1ccc2ccc(F)cc2c1 Amb26426360 [1,1,0,0,0,0|1,0,0]=3 2153 B14R2.134 NCc1ccc2ccc(F)cc2n1 Amb17578281 [1,1,0,0,0,0|2,0,0]=4 2154 B14R2.134 NCc1ccc2ccc(I)cc2c1 Amb27859070 [1,1,0,0,0,0|1,0,0]=3 2155 B14R2.134 NCc1ccc2ccc(N)cc2c1 Amb28239656 [1,1,0,0,0,0|1,0,0]=3 2156 B14R2.134 NCc1ccc2ncc(Br)cc2c1 Amb22757102 [1,1,0,0,0,0|2,0,0]=4 2157 B14R2.134 NCc1cnc2ccc(Br)cc2c1 Amb17581744 [1,1,0,0,0,0|2,0,0]=4 2158 B14R2.134 NCc1cnc2ccc(Cl)cc2c1 Amb17578608 [1,1,0,0,0,0|2,0,0]=4 2159 B14R2.134 NCc1cnc2ccc(F)cc2c1 Amb17578280 [1,1,0,0,0,0|2,0,0]=4 2160 B14R2.134 NCc1cnc2ccc(O)cc2c1 Amb20669294 [1,1,0,0,0,0|2,0,0]=4 2161 B14R2.134 NNc1ccc2ccc(N)cc2c1 Amb27626017 [1,1,0,0,0,0|2,0,0]=4 2162 B14R2.134 NOc1ccc2c(c1)OC(=O)C=C2 Amb27186422 [1,1,0,0,0,0|2,0,0]=4 2163 B14R2.134 Nc1ccc2ccc(C=O)cc2c1 Amb28243613 [1,1,0,0,0,0|1,0,1]=4 2164 B14R2.134 Nc1ccc2ccc(CBr)cc2c1 Amb28185862 [1,1,0,0,0,0|1,0,0]=3 2165 B14R2.134 Nc1ccc2ccc(CCl)cc2c1 Amb24648773 [1,1,0,0,0,0|1,0,0]=3 2166 B14R2.134 Nc1ccc2ccc(CO)cc2c1 Amb27983571 [1,1,0,0,0,0|1,0,0]=3 2167 B14R2.134 Nc1ccc2ccc(CO)cc2n1 Amb27621056 [1,1,0,0,0,0|2,0,0]=4 2168 B14R2.134 O=C1C=Cc2ccc(CO)cc2O1 Amb27442471 [1,1,0,0,0,0|2,0,0]=4 2169 B14R2.134 O=Cc1ccc2ccc(Br)cc2c1 Amb8388174 [1,1,0,0,0,0|1,0,1]=4 2170 B14R2.134 O=Cc1ccc2ccc(Cl)cc2c1 Amb25359920 [1,1,0,0,0,0|1,0,1]=4 2171 B14R2.134 O=Cc1ccc2ccc(F)cc2c1 Amb28243612 [1,1,0,0,0,0|1,0,1]=4 2172 B14R2.134 O=Cc1ccc2ccc(I)cc2c1 Amb25877681 [1,1,0,0,0,0|1,0,1]=4 2173 B14R2.134 O=Cc1ccc2ccc(O)cc2c1 Amb18126872 [1,1,0,0,0,0|1,0,1]=4 2174 B14R2.134 OCc1cc2cc(O)ccc2cn1 Amb25954968 [1,1,0,0,0,0|2,0,0]=4 2175 B14R2.134 OCc1ccc2ccc(Br)cc2c1 Amb24427627 [1,1,0,0,0,0|1,0,0]=3 2176 B14R2.134 OCc1ccc2ccc(Br)cc2n1 Amb17581804 [1,1,0,0,0,0|2,0,0]=4 2177 B14R2.134 OCc1ccc2ccc(Cl)cc2c1 Amb27249801 [1,1,0,0,0,0|1,0,0]=3 2178 B14R2.134 OCc1ccc2ccc(Cl)cc2n1 Amb17578622 [1,1,0,0,0,0|2,0,0]=4 2179 B14R2.134 OCc1ccc2ccc(F)cc2c1 Amb27985394 [1,1,0,0,0,0|1,0,0]=3 2180 B14R2.134 OCc1ccc2ccc(F)cc2n1 Amb17578292 [1,1,0,0,0,0|2,0,0]=4 2181 B14R2.134 OCc1ccc2ccc(I)cc2c1 Amb27180842 [1,1,0,0,0,0|1,0,0]=3 2182 B14R2.134 OCc1ccc2ccc(O)cc2c1 Amb25074092 [1,1,0,0,0,0|1,0,0]=3 2183 B14R2.134 OCc1ccc2cnc(Cl)cc2c1 Amb28125685 [1,1,0,0,0,0|2,0,0]=4 2184 B14R2.134 OCc1ccc2ncc(Br)cc2c1 Amb26386579 [1,1,0,0,0,0|2,0,0]=4 2185 B14R2.134 OCc1ccc2ncc(Cl)cc2c1 Amb27784156 [1,1,0,0,0,0|2,0,0]=4 2186 B14R2.134 OCc1cnc2ccc(Br)cc2c1 Amb20670680 [1,1,0,0,0,0|2,0,0]=4 2187 B14R2.134 OCc1cnc2ccc(Cl)cc2c1 Amb23401870 [1,1,0,0,0,0|2,0,0]=4 2188 B14R2.134 OCc1cnc2ccc(F)cc2c1 Amb27952189 [1,1,0,0,0,0|2,0,0]=4 2189 B14R2.134 OCc1cnc2ccc(O)cc2c1 Amb23580335 [1,1,0,0,0,0|2,0,0]=4 2190 B14R2.134 Oc1ccc2ccc(CCl)cc2c1 Amb28144546 [1,1,0,0,0,0|1,0,0]=3 2191 B14R2.142 BrCc1ccc2cccc(Br)c2c1 Amb26657015 [1,1,0,0,0,0|1,0,0]=3 2192 B14R2.142 BrCc1ccc2cccc(I)c2c1 Amb26867943 [1,1,0,0,0,0|1,0,0]=3 2193 B14R2.142 BrCc1cnc2cccc(Br)c2c1 Amb28066147 [1,1,0,0,0,0|2,0,0]=4 2194 B14R2.142 CCc1ccc2c(c1)C(=O)C=CN2 Amb18178047 [1,1,0,0,0,0|1,0,0]=3 2195 B14R2.142 CCc1ccc2c(c1)C(=O)C=CO2 Amb26349294 [1,1,0,0,0,0|1,0,0]=3 2196 B14R2.142 CCc1ccc2c(c1)C(=O)N=CN2 Amb22494830 [1,1,0,0,0,0|2,0,0]=4 2197 B14R2.142 CCc1ccc2c(c1)C(=O)NC=C2 Amb18349276 [1,1,0,0,0,0|1,0,0]=3 2198 B14R2.142 CCc1ccc2cccc(Br)c2n1 Amb28429730 [1,1,0,0,0,0|1,0,0]=3 2199 B14R2.142 CCc1ccc2cccc(C)c2n1 Amb27975680 [1,1,0,0,0,0|1,0,0]=3 2200 B14R2.142 CCc1ccc2cccc(N)c2n1 Amb28455340 [1,1,0,0,0,0|1,0,0]=3 2201 B14R2.142 CCc1ccc2cccc(O)c2c1 Amb18559371 [1,1,0,0,0,0|0,0,0]=2 2202 B14R2.142 CCc1ccc2ccnc(Br)c2c1 Amb18346432 [1,1,0,0,0,0|1,0,0]=3 2203 B14R2.142 CCc1ccc2ccnc(Cl)c2c1 Amb18346732 [1,1,0,0,0,0|1,0,0]=3 2204 B14R2.142 CCc1ccc2nccc(Br)c2c1 Amb9134335 [1,1,0,0,0,0|1,0,0]=3 2205 B14R2.142 CCc1ccc2nccc(C)c2c1 Amb18352929 [1,1,0,0,0,0|1,0,0]=3 2206 B14R2.142 CCc1ccc2nccc(Cl)c2c1 Amb1994633 [1,1,0,0,0,0|1,0,0]=3 2207 B14R2.142 CCc1ccc2nccc(N)c2c1 Amb1994597 [1,1,0,0,0,0|1,0,0]=3 2208 B14R2.142 CCc1ccc2nccc(O)c2c1 Amb1269028 [1,1,0,0,0,0|1,0,0]=3 2209 B14R2.142 CCc1ccc2ncnc(Cl)c2c1 Amb2797901 [1,1,0,0,0,0|2,0,0]=4 2210 B14R2.142 CCc1ccc2ncnc(F)c2c1 Amb35656775 [1,1,0,0,0,0|2,0,0]=4 2211 B14R2.142 CCc1ccc2ncnc(N)c2c1 Amb28243618 [1,1,0,0,0,0|2,0,0]=4 2212 B14R2.142 CNc1cc2c(F)cccc2cn1 Amb32697391 [1,1,0,0,0,0|2,0,0]=4 2213 B14R2.142 CNc1ccc2cccc(C)c2n1 Amb28193372 [1,1,0,0,0,0|2,0,0]=4 2214 B14R2.142 CNc1ccc2cccc(O)c2c1 Amb17594347 [1,1,0,0,0,0|1,0,0]=3 2215 B14R2.142 CNc1ccc2cccc(O)c2n1 Amb8506024 [1,1,0,0,0,0|2,0,0]=4 2216 B14R2.142 CNc1ccc2ccnc(O)c2c1 Amb27172774 [1,1,0,0,0,0|2,0,0]=4 2217 B14R2.142 COc1cc2c(Br)cccc2cn1 Amb22735853 [1,1,0,0,0,0|1,0,0]=3 2218 B14R2.142 COc1cc2c(Cl)ccnc2cn1 Amb24364690 [1,1,0,0,0,0|2,0,0]=4 2219 B14R2.142 COc1cc2c(Cl)nccc2cn1 Amb28139696 [1,1,0,0,0,0|2,0,0]=4 2220 B14R2.142 COc1cc2c(N)cccc2cn1 Amb22500899 [1,1,0,0,0,0|1,0,0]=3 2221 B14R2.142 COc1cc2c(cn1)NC=CC2=O Amb24401497 [1,1,0,0,0,0|2,0,0]=4 2222 B14R2.142 COc1ccc2c(c1)C(=O)C=CN2 Amb18178164 [1,1,0,0,0,0|1,0,0]=3 2223 B14R2.142 COc1ccc2c(c1)C(=O)C=CN2 Amb33719339 [1,1,0,0,0,0|1,0,0]=3 2224 B14R2.142 COc1ccc2c(c1)C(=O)C=CO2 Amb19666847 [1,1,0,0,0,0|1,0,0]=3 2225 B14R2.142 COc1ccc2c(c1)C(=O)C=NN2 Amb23454437 [1,1,0,0,0,0|2,0,0]=4 2226 B14R2.142 COc1ccc2c(c1)C(=O)NC=N2 Amb20243343 [1,1,0,0,0,0|2,0,0]=4 2227 B14R2.142 COc1ccc2c(c1)C(=O)NN=C2 Amb26654640 [1,1,0,0,0,0|2,0,0]=4 2228 B14R2.142 COc1ccc2c(c1)C(=O)OC=C2 Amb27169698 [1,1,0,0,0,0|1,0,0]=3 2229 B14R2.142 COc1ccc2c(c1)C(=S)C=CN2 Amb22010850 [1,1,0,0,0,0|1,0,0]=3 2230 B14R2.142 COc1ccc2c(c1)[C@H](O)CC=C2 Amb27790378 [1,1,0,0,0,0|0,0,2]=4 2231 B14R2.142 COc1ccc2c(n1)C(=O)C=CN2 Amb22500169 [1,1,0,0,0,0|2,0,0]=4 2232 B14R2.142 COc1ccc2cccc(Br)c2c1 Amb25670283 [1,1,0,0,0,0|0,0,0]=2 2233 B14R2.142 COc1ccc2cccc(Br)c2n1 Amb22494690 [1,1,0,0,0,0|1,0,0]=3 2234 B14R2.142 COc1ccc2cccc(C)c2n1 Amb20171195 [1,1,0,0,0,0|1,0,0]=3 2235 B14R2.142 COc1ccc2cccc(Cl)c2c1 Amb26014314 [1,1,0,0,0,0|0,0,0]=2 2236 B14R2.142 COc1ccc2cccc(Cl)c2n1 Amb26521076 [1,1,0,0,0,0|1,0,0]=3 2237 B14R2.142 COc1ccc2cccc(N)c2c1 Amb18647727 [1,1,0,0,0,0|0,0,0]=2 2238 B14R2.142 COc1ccc2cccc(N)c2n1 Amb22713475 [1,1,0,0,0,0|1,0,0]=3 2239 B14R2.142 COc1ccc2cccc(O)c2c1 Amb3429497 [1,1,0,0,0,0|0,0,0]=2 2240 B14R2.142 COc1ccc2cccc(O)c2n1 Amb1779249 [1,1,0,0,0,0|1,0,0]=3 2241 B14R2.142 COc1ccc2ccnc(Br)c2c1 Amb18062826 [1,1,0,0,0,0|1,0,0]=3 2242 B14R2.142 COc1ccc2ccnc(Cl)c2c1 Amb18560354 [1,1,0,0,0,0|1,0,0]=3 2243 B14R2.142 COc1ccc2ccnc(F)c2c1 Amb35642416 [1,1,0,0,0,0|1,0,0]=3 2244 B14R2.142 COc1ccc2ccnc(I)c2c1 Amb8439711 [1,1,0,0,0,0|1,0,0]=3 2245 B14R2.142 COc1ccc2ccnc(N)c2c1 Amb18560418 [1,1,0,0,0,0|1,0,0]=3 2246 B14R2.142 COc1ccc2ccnc(O)c2c1 Amb18560323 [1,1,0,0,0,0|1,0,0]=3 2247 B14R2.142 COc1ccc2ccnc(S)c2c1 Amb27592542 [1,1,0,0,0,0|1,0,0]=3 2248 B14R2.142 COc1ccc2cnnc(Cl)c2c1 Amb22754607 [1,1,0,0,0,0|2,0,0]=4 2249 B14R2.142 COc1ccc2nccc(Br)c2c1 Amb1994865 [1,1,0,0,0,0|1,0,0]=3 2250 B14R2.142 COc1ccc2nccc(Br)c2n1 Amb21926825 [1,1,0,0,0,0|2,0,0]=4 2251 B14R2.142 COc1ccc2nccc(C)c2c1 Amb2689153 [1,1,0,0,0,0|1,0,0]=3 2252 B14R2.142 COc1ccc2nccc(C)c2c1 Amb6383241 [1,1,0,0,0,0|1,0,0]=3 2253 B14R2.142 COc1ccc2nccc(Cl)c2c1 Amb33531717 [1,1,0,0,0,0|1,0,0]=3 2254 B14R2.142 COc1ccc2nccc(Cl)c2n1 Amb19957914 [1,1,0,0,0,0|2,0,0]=4 2255 B14R2.142 COc1ccc2nccc(I)c2c1 Amb24073902 [1,1,0,0,0,0|1,0,0]=3 2256 B14R2.142 COc1ccc2nccc(N)c2c1 Amb1994316 [1,1,0,0,0,0|1,0,0]=3 2257 B14R2.142 COc1ccc2nccc(N)c2n1 Amb22899619 [1,1,0,0,0,0|2,0,0]=4 2258 B14R2.142 COc1ccc2nccc(O)c2c1 Amb1994274 [1,1,0,0,0,0|1,0,0]=3 2259 B14R2.142 COc1ccc2ncnc(Cl)c2c1 Amb8629828 [1,1,0,0,0,0|2,0,0]=4 2260 B14R2.142 COc1ccc2ncnc(F)c2c1 Amb35653900 [1,1,0,0,0,0|2,0,0]=4 2261 B14R2.142 COc1ccc2ncnc(O)c2c1 Amb19515853 [1,1,0,0,0,0|2,0,0]=4 2262 B14R2.142 COc1ccc2nncc(Br)c2c1 Amb25155032 [1,1,0,0,0,0|2,0,0]=4 2263 B14R2.142 COc1ccc2nncc(Cl)c2c1 Amb24400531 [1,1,0,0,0,0|2,0,0]=4 2264 B14R2.142 COc1cnc2cccc(Br)c2c1 Amb22048262 [1,1,0,0,0,0|1,0,0]=3 2265 B14R2.142 COc1cnc2cccc(Cl)c2n1 Amb27869968 [1,1,0,0,0,0|2,0,0]=4 2266 B14R2.142 COc1cnc2cccc(O)c2c1 Amb25700788 [1,1,0,0,0,0|1,0,0]=3 2267 B14R2.142 COc1cnc2ccnc(Cl)c2c1 Amb27668888 [1,1,0,0,0,0|2,0,0]=4 2268 B14R2.142 COc1cnc2ccnc(O)c2c1 Amb25224778 [1,1,0,0,0,0|2,0,0]=4 2269 B14R2.142 COc1cnc2nccc(Br)c2c1 Amb27177166 [1,1,0,0,0,0|2,0,0]=4 2270 B14R2.142 CSc1ccc2nccc(Cl)c2c1 Amb28313662 [1,1,0,0,0,0|1,1,0]=4 2271 B14R2.142 CSc1ccc2nccc(O)c2c1 Amb27814637 [1,1,0,0,0,0|1,1,0]=4 2272 B14R2.142 Cc1cccc2ccc(C#N)cc12 Amb18646776 [1,1,0,0,0,0|1,0,1]=4 2273 B14R2.142 Cc1cccc2ccc(C=O)cc12 Amb18126683 [1,1,0,0,0,0|1,0,1]=4 2274 B14R2.142 Cc1cccc2ccc(CBr)cc12 Amb27646658 [1,1,0,0,0,0|1,0,0]=3 2275 B14R2.142 Cc1cccc2ccc(CCl)cc12 Amb24408892 [1,1,0,0,0,0|1,0,0]=3 2276 B14R2.142 Cc1cccc2ccc(CN)nc12 Amb17578250 [1,1,0,0,0,0|2,0,0]=4 2277 B14R2.142 Cc1cccc2ccc(CO)cc12 Amb27948539 [1,1,0,0,0,0|1,0,0]=3 2278 B14R2.142 Cc1cccc2ccc(CO)nc12 Amb25187747 [1,1,0,0,0,0|2,0,0]=4 2279 B14R2.142 ClCc1ccc2cccc(Cl)c2c1 Amb27669831 [1,1,0,0,0,0|1,0,0]=3 2280 B14R2.142 Clc1cccc2ccc(CBr)cc12 Amb26361966 [1,1,0,0,0,0|1,0,0]=3 2281 B14R2.142 Clc1cccc2ccc(CBr)nc12 Amb28436564 [1,1,0,0,0,0|2,0,0]=4 2282 B14R2.142 Clc1ccnc2ccc(CBr)cc12 Amb27608471 [1,1,0,0,0,0|2,0,0]=4 2283 B14R2.142 Fc1cccc2ccc(CBr)cc12 Amb24627886 [1,1,0,0,0,0|1,0,0]=3 2284 B14R2.142 Fc1cccc2ccc(CCl)cc12 Amb25794171 [1,1,0,0,0,0|1,0,0]=3 2285 B14R2.142 N#Cc1ccc2cccc(Br)c2c1 Amb26620839 [1,1,0,0,0,0|1,0,1]=4 2286 B14R2.142 N#Cc1ccc2cccc(Cl)c2c1 Amb18649708 [1,1,0,0,0,0|1,0,1]=4 2287 B14R2.142 N#Cc1ccc2cccc(F)c2c1 Amb28066692 [1,1,0,0,0,0|1,0,1]=4 2288 B14R2.142 N#Cc1ccc2cccc(N)c2c1 Amb26881008 [1,1,0,0,0,0|1,0,1]=4 2289 B14R2.142 N#Cc1ccc2cccc(O)c2c1 Amb27645358 [1,1,0,0,0,0|1,0,1]=4 2290 B14R2.142 NCc1ccc2c(c1)C(=O)NC=C2 Amb22735991 [1,1,0,0,0,0|2,0,0]=4 2291 B14R2.142 NCc1ccc2cccc(Br)c2n1 Amb17581743 [1,1,0,0,0,0|2,0,0]=4 2292 B14R2.142 NCc1ccc2cccc(Cl)c2c1 Amb24753193 [1,1,0,0,0,0|1,0,0]=3 2293 B14R2.142 NCc1ccc2cccc(Cl)c2n1 Amb17578603 [1,1,0,0,0,0|2,0,0]=4 2294 B14R2.142 NCc1ccc2cccc(F)c2c1 Amb27471861 [1,1,0,0,0,0|1,0,0]=3 2295 B14R2.142 NCc1ccc2cccc(F)c2n1 Amb17578277 [1,1,0,0,0,0|2,0,0]=4 2296 B14R2.142 NCc1ccc2cccc(I)c2c1 Amb25311989 [1,1,0,0,0,0|1,0,0]=3 2297 B14R2.142 NCc1ccc2cccc(O)c2c1 Amb26548811 [1,1,0,0,0,0|1,0,0]=3 2298 B14R2.142 NCc1ccc2cccc(O)c2n1 Amb25104729 [1,1,0,0,0,0|2,0,0]=4 2299 B14R2.142 NCc1ccc2ccnc(N)c2c1 Amb27665908 [1,1,0,0,0,0|2,0,0]=4 2300 B14R2.142 Nc1cccc2ccc(CBr)cc12 Amb25832231 [1,1,0,0,0,0|1,0,0]=3 2301 B14R2.142 Nc1cccc2ccc(CCl)cc12 Amb25114733 [1,1,0,0,0,0|1,0,0]=3 2302 B14R2.142 Nc1cccc2ccc(CO)cc12 Amb25837407 [1,1,0,0,0,0|1,0,0]=3 2303 B14R2.142 Nc1cccc2ccc(CO)nc12 Amb25126307 [1,1,0,0,0,0|2,0,0]=4 2304 B14R2.142 Nc1nccc2ccc(CO)cc12 Amb22739925 [1,1,0,0,0,0|2,0,0]=4 2305 B14R2.142 O=Cc1ccc2cccc(Br)c2c1 Amb8388175 [1,1,0,0,0,0|1,0,1]=4 2306 B14R2.142 O=Cc1ccc2cccc(F)c2c1 Amb18647801 [1,1,0,0,0,0|1,0,1]=4 2307 B14R2.142 O=Cc1ccc2cccc(I)c2c1 Amb27772001 [1,1,0,0,0,0|1,0,1]=4 2308 B14R2.142 O=Cc1ccc2cccc(O)c2c1 Amb26880907 [1,1,0,0,0,0|1,0,1]=4 2309 B14R2.142 OCc1ccc2cccc(Br)c2c1 Amb27181100 [1,1,0,0,0,0|1,0,0]=3 2310 B14R2.142 OCc1ccc2cccc(Br)c2n1 Amb17581803 [1,1,0,0,0,0|2,0,0]=4 2311 B14R2.142 OCc1ccc2cccc(Cl)c2c1 Amb27862555 [1,1,0,0,0,0|1,0,0]=3 2312 B14R2.142 OCc1ccc2cccc(Cl)c2n1 Amb17578621 [1,1,0,0,0,0|2,0,0]=4 2313 B14R2.142 OCc1ccc2cccc(F)c2c1 Amb27261469 [1,1,0,0,0,0|1,0,0]=3 2314 B14R2.142 OCc1ccc2cccc(O)c2c1 Amb28239681 [1,1,0,0,0,0|1,0,0]=3 2315 B14R2.142 OCc1ccc2cccc(O)c2n1 Amb23590093 [1,1,0,0,0,0|2,0,0]=4 2316 B14R2.142 Oc1cccc2ccc(CCl)cc12 Amb26564264 [1,1,0,0,0,0|1,0,0]=3 2317 B14R2.781 BrC(Br)c1ccc2ccccc2n1 Amb2609692 [1,1,0,0,0,0|2,0,0]=4 2318 B14R2.781 C=C(C)c1cc2ccccc2cn1 Amb28193339 [1,1,0,0,0,0|1,0,1]=4 2319 B14R2.781 C=C(C)c1ccc2ccccc2c1 Amb6360067 [1,1,0,0,0,0|0,0,1]=3 2320 B14R2.781 C=C(C)c1ccc2ccccc2n1 Amb26451445 [1,1,0,0,0,0|1,0,1]=4 2321 B14R2.781 C=C(C)c1ccc2ncccc2c1 Amb27462453 [1,1,0,0,0,0|1,0,1]=4 2322 B14R2.781 C=C(C)c1cnc2ccccc2c1 Amb27642702 [1,1,0,0,0,0|1,0,1]=4 2323 B14R2.781 CC(=O)c1cc2ccccc2cn1 Amb21858387 [1,1,0,0,0,0|1,0,1]=4 2324 B14R2.781 CC(=O)c1ccc2ccccc2c1 Amb752737 [1,1,0,0,0,0|0,0,1]=3 2325 B14R2.781 CC(=O)c1ccc2ccccc2n1 Amb5494070 [1,1,0,0,0,0|1,0,1]=4 2326 B14R2.781 CC(=O)c1ccc2cccnc2c1 Amb18352594 [1,1,0,0,0,0|1,0,1]=4 2327 B14R2.781 CC(=O)c1ccc2ccncc2c1 Amb18353408 [1,1,0,0,0,0|1,0,1]=4 2328 B14R2.781 CC(=O)c1ccc2cnccc2c1 Amb19103647 [1,1,0,0,0,0|1,0,1]=4 2329 B14R2.781 CC(=O)c1ccc2ncccc2c1 Amb18353467 [1,1,0,0,0,0|1,0,1]=4 2330 B14R2.781 CC(=O)c1cnc2ccccc2c1 Amb18793962 [1,1,0,0,0,0|1,0,1]=4 2331 B14R2.781 CC(Br)c1ccc2ccccc2c1 Amb8835394 [1,1,0,0,0,0|0,0,0]=2 2332 B14R2.781 CC(Br)c1ccc2nccnc2c1 Amb27812141 [1,1,0,0,0,0|2,0,0]=4 2333 B14R2.781 CC(C)C1=Cc2ccccc2CC1 Amb27441309 [1,1,0,0,0,0|0,0,2]=4 2334 B14R2.781 CC(C)c1ccc2c(c1)C=CCN2 Amb18062205 [1,1,0,0,0,0|1,0,1]=4 2335 B14R2.781 CC(C)c1ccc2c(c1)C=CCO2 Amb27267043 [1,1,0,0,0,0|1,0,1]=4 2336 B14R2.781 CC(C)c1ccc2ccccc2c1 Amb2720809 [1,1,0,0,0,0|0,0,0]=2 2337 B14R2.781 CC(C)c1ccc2ccccc2n1 Amb24715817 [1,1,0,0,0,0|1,0,0]=3 2338 B14R2.781 CC(C)c1ccc2ccncc2c1 Amb19100676 [1,1,0,0,0,0|1,0,0]=3 2339 B14R2.781 CC(C)c1ccc2cnccc2c1 Amb24091749 [1,1,0,0,0,0|1,0,0]=3 2340 B14R2.781 CC(C)c1ccc2ncccc2c1 Amb6893055 [1,1,0,0,0,0|1,0,0]=3 2341 B14R2.781 CC(C)c1cnc2ccccc2c1 Amb17334869 [1,1,0,0,0,0|1,0,0]=3 2342 B14R2.781 CC(Cl)c1cc2ccccc2cn1 Amb27858110 [1,1,0,0,0,0|1,0,0]=3 2343 B14R2.781 CC(N)c1ccc2ccccc2c1 Amb1211899 [1,1,0,0,0,0|0,0,0]=2 2344 B14R2.781 CC(N)c1ccc2ccccc2c1 Amb6239355 [1,1,0,0,0,0|0,0,0]=2 2345 B14R2.781 CC(N)c1ccc2ccccc2n1 Amb24548779 [1,1,0,0,0,0|1,0,0]=3 2346 B14R2.781 CC(N)c1ccc2cccnc2c1 Amb18352716 [1,1,0,0,0,0|1,0,0]=3 2347 B14R2.781 CC(N)c1ccc2cnccc2c1 Amb18352433 [1,1,0,0,0,0|1,0,0]=3 2348 B14R2.781 CC(N)c1ccc2cnccc2n1 Amb27597044 [1,1,0,0,0,0|2,0,0]=4 2349 B14R2.781 CC(N)c1ccc2ncccc2c1 Amb19104603 [1,1,0,0,0,0|1,0,0]=3 2350 B14R2.781 CC(N)c1ccc2ncccc2n1 Amb27863677 [1,1,0,0,0,0|2,0,0]=4 2351 B14R2.781 CC(N)c1ccc2nccnc2c1 Amb13890526 [1,1,0,0,0,0|2,0,0]=4 2352 B14R2.781 CC(N)c1cnc2ccccc2c1 Amb18944280 [1,1,0,0,0,0|1,0,0]=3 2353 B14R2.781 CC(N)c1cnc2ccccc2n1 Amb27227842 [1,1,0,0,0,0|2,0,0]=4 2354 B14R2.781 CC(O)C1=COc2ccccc2O1 Amb27661173 [1,1,0,0,0,0|2,0,0]=4 2355 B14R2.781 CC(O)C1=Cc2ccccc2CC1 Amb28321250 [1,1,0,0,0,0|0,0,2]=4 2356 B14R2.781 CC(O)C1=Cc2ccccc2OC1 Amb27242657 [1,1,0,0,0,0|1,0,1]=4 2357 B14R2.781 CC(O)c1ccc2ccccc2c1 Amb9748274 [1,1,0,0,0,0|0,0,0]=2 2358 B14R2.781 CC(O)c1ccc2ccccc2n1 Amb25215245 [1,1,0,0,0,0|1,0,0]=3 2359 B14R2.781 CC(O)c1ccc2cccnc2n1 Amb35647264 [1,1,0,0,0,0|2,0,0]=4 2360 B14R2.781 CC(O)c1ccc2ccncc2c1 Amb18352498 [1,1,0,0,0,0|1,0,0]=3 2361 B14R2.781 CC(O)c1ccc2cnccc2c1 Amb19104578 [1,1,0,0,0,0|1,0,0]=3 2362 B14R2.781 CC(O)c1ccc2ncccc2c1 Amb17622029 [1,1,0,0,0,0|1,0,0]=3 2363 B14R2.781 CC(O)c1cnc2ccccc2c1 Amb33535848 [1,1,0,0,0,0|1,0,0]=3 2364 B14R2.781 CC(S)c1ccc2ccccc2c1 Amb7784705 [1,1,0,0,0,0|0,0,0]=2 2365 B14R2.781 CN(C)c1ccc2ccccc2c1 Amb22228802 [1,1,0,0,0,0|1,0,0]=3 2366 B14R2.781 CN(C)c1ccc2ccccc2n1 Amb4010061 [1,1,0,0,0,0|2,0,0]=4 2367 B14R2.781 CN(C)c1ccc2ccncc2c1 Amb19100677 [1,1,0,0,0,0|2,0,0]=4 2368 B14R2.781 CN(C)c1ccc2cnccc2c1 Amb19109237 [1,1,0,0,0,0|2,0,0]=4 2369 B14R2.781 CN(C)c1ccc2ncccc2c1 Amb534256 [1,1,0,0,0,0|2,0,0]=4 2370 B14R2.781 CN(C)c1ccc2ncccc2c1 Amb612958 [1,1,0,0,0,0|2,0,0]=4 2371 B14R2.781 CN(C)c1cnc2ccccc2c1 Amb18269699 [1,1,0,0,0,0|2,0,0]=4 2372 B14R2.781 CS(=O)c1ccc2ccccc2c1 Amb10553605 [1,1,0,0,0,0|0,1,0]=3 2373 B14R2.781 C[C@@H](Cl)c1ccc2ccccc2c1 Amb27858415 [1,1,0,0,0,0|0,0,0]=2 2374 B14R2.781 C[C@@H](N)c1ccc2ccccc2c1 Amb13951472 [1,1,0,0,0,0|0,0,0]=2 2375 B14R2.781 C[C@@H](N)c1ccc2ccccc2c1 Amb3941411 [1,1,0,0,0,0|0,0,0]=2 2376 B14R2.781 C[C@@H](N)c1ccc2ccccc2n1 Amb27187332 [1,1,0,0,0,0|1,0,0]=3 2377 B14R2.781 C[C@@H](N)c1ccc2cccnc2c1 Amb25117082 [1,1,0,0,0,0|1,0,0]=3 2378 B14R2.781 C[C@@H](N)c1ccc2cccnc2n1 Amb27249481 [1,1,0,0,0,0|2,0,0]=4 2379 B14R2.781 C[C@@H](N)c1ccc2ccncc2c1 Amb27225875 [1,1,0,0,0,0|1,0,0]=3 2380 B14R2.781 C[C@@H](N)c1ccc2cnccc2c1 Amb25669386 [1,1,0,0,0,0|1,0,0]=3 2381 B14R2.781 C[C@@H](N)c1ccc2ncccc2c1 Amb25743624 [1,1,0,0,0,0|1,0,0]=3 2382 B14R2.781 C[C@@H](N)c1ccc2nccnc2c1 Amb27799567 [1,1,0,0,0,0|2,0,0]=4 2383 B14R2.781 C[C@@H](N)c1cnc2ccccc2c1 Amb25250663 [1,1,0,0,0,0|1,0,0]=3 2384 B14R2.781 C[C@@H](N)c1cnc2ccccc2n1 Amb33377794 [1,1,0,0,0,0|2,0,0]=4 2385 B14R2.781 C[C@@H](O)C1=Cc2ccccc2CC1 Amb28079043 [1,1,0,0,0,0|0,0,2]=4 2386 B14R2.781 C[C@@H](O)c1ccc2ccccc2c1 Amb10844722 [1,1,0,0,0,0|0,0,0]=2 2387 B14R2.781 C[C@@H](O)c1ccc2ccccc2n1 Amb25839820 [1,1,0,0,0,0|1,0,0]=3 2388 B14R2.781 C[C@@H](O)c1ccc2cccnc2c1 Amb32879517 [1,1,0,0,0,0|1,0,0]=3 2389 B14R2.781 C[C@@H](O)c1ccc2ncccc2c1 Amb26865756 [1,1,0,0,0,0|1,0,0]=3 2390 B14R2.781 C[C@@H](O)c1ccc2nccnc2c1 Amb28322824 [1,1,0,0,0,0|2,0,0]=4 2391 B14R2.781 C[C@@H](O)c1cnc2ccccc2c1 Amb25872625 [1,1,0,0,0,0|1,0,0]=3 2392 B14R2.781 C[C@@H](O)c1cnc2ccccc2n1 Amb33378852 [1,1,0,0,0,0|2,0,0]=4 2393 B14R2.781 C[C@H](N)c1cc2ccccc2cn1 Amb24058224 [1,1,0,0,0,0|1,0,0]=3 2394 B14R2.781 C[C@H](N)c1ccc2ccccc2c1 Amb2611666 [1,1,0,0,0,0|0,0,0]=2 2395 B14R2.781 C[C@H](N)c1ccc2ccccc2n1 Amb24711720 [1,1,0,0,0,0|1,0,0]=3 2396 B14R2.781 C[C@H](N)c1ccc2cccnc2c1 Amb25948512 [1,1,0,0,0,0|1,0,0]=3 2397 B14R2.781 C[C@H](N)c1ccc2cnccc2c1 Amb24058131 [1,1,0,0,0,0|1,0,0]=3 2398 B14R2.781 C[C@H](N)c1ccc2ncccc2c1 Amb27947620 [1,1,0,0,0,0|1,0,0]=3 2399 B14R2.781 C[C@H](N)c1cnc2ccccc2c1 Amb25791638 [1,1,0,0,0,0|1,0,0]=3 2400 B14R2.781 C[C@H](N)c1cnc2ccccc2n1 Amb33377793 [1,1,0,0,0,0|2,0,0]=4 2401 B14R2.781 C[C@H](O)C1=Cc2ccccc2CC1 Amb27763822 [1,1,0,0,0,0|0,0,2]=4 2402 B14R2.781 C[C@H](O)c1cc2ccccc2cn1 Amb27411298 [1,1,0,0,0,0|1,0,0]=3 2403 B14R2.781 C[C@H](O)c1ccc2ccccc2c1 Amb4605849 [1,1,0,0,0,0|0,0,0]=2 2404 B14R2.781 C[C@H](O)c1ccc2ccccc2n1 Amb26943845 [1,1,0,0,0,0|1,0,0]=3 2405 B14R2.781 C[C@H](O)c1ccc2cccnc2c1 Amb32879621 [1,1,0,0,0,0|1,0,0]=3 2406 B14R2.781 C[C@H](O)c1ccc2ncccc2c1 Amb25348503 [1,1,0,0,0,0|1,0,0]=3 2407 B14R2.781 C[C@H](O)c1ccc2nccnc2c1 Amb28243575 [1,1,0,0,0,0|2,0,0]=4 2408 B14R2.781 C[C@H](O)c1cnc2ccccc2c1 Amb25872666 [1,1,0,0,0,0|1,0,0]=3 2409 B14R2.781 C[C@H](O)c1cnc2ccccc2n1 Amb33358202 [1,1,0,0,0,0|2,0,0]=4 2410 B14R2.781 FC(F)c1ccc2ccccc2c1 Amb20669942 [1,1,0,0,0,0|1,0,0]=3 2411 B14R2.781 FC(F)c1ccc2ccccc2n1 Amb20669752 [1,1,0,0,0,0|2,0,0]=4 2412 B14R2.781 FC(F)c1ccc2cccnc2c1 Amb26543059 [1,1,0,0,0,0|2,0,0]=4 2413 B14R2.781 FC(F)c1ccc2ccncc2c1 Amb20621048 [1,1,0,0,0,0|2,0,0]=4 2414 B14R2.781 FC(F)c1ccc2ncccc2c1 Amb27445957 [1,1,0,0,0,0|2,0,0]=4 2415 B14R2.781 FC(F)c1cnc2ccccc2c1 Amb20669753 [1,1,0,0,0,0|2,0,0]=4 2416 B14R2.781 N=C(N)c1ccc2ccccc2c1 Amb33528675 [1,1,0,0,0,0|1,0,1]=4 2417 B14R2.781 N=C(N)c1ccc2ccccc2c1 Amb8630189 [1,1,0,0,0,0|1,0,1]=4 2418 B14R2.781 NC(=O)c1ccc2ccccc2c1 Amb2701601 [1,1,0,0,0,0|1,0,1]=4 2419 B14R2.781 NC(=S)c1ccc2ccccc2c1 Amb1117722 [1,1,0,0,0,0|1,0,1]=4 2420 B14R2.781 O=C(Br)c1ccc2ccccc2c1 Amb27629780 [1,1,0,0,0,0|1,0,1]=4 2421 B14R2.781 O=C(Cl)c1ccc2ccccc2c1 Amb3939132 [1,1,0,0,0,0|1,0,1]=4 2422 B14R2.781 O=C(F)c1ccc2ccccc2c1 Amb25723360 [1,1,0,0,0,0|1,0,1]=4 2423 B14R2.781 O=C(O)c1ccc2ccccc2c1 Amb17678851 [1,1,0,0,0,0|1,0,1]=4 2424 B14R2.781 O=C([O-])c1ccc2ccccc2c1 Amb22045657 [1,1,0,0,0,0|1,0,1]=4 2425 B14R2.781 O=S(Cl)c1ccc2ccccc2c1 Amb27974351 [1,1,0,0,0,0|1,1,0]=4 2426 B14R2.781 O=S(O)c1ccc2ccccc2c1 Amb4013237 [1,1,0,0,0,0|1,1,0]=4 2427 B14R2.781 O=S([O-])c1ccc2ccccc2c1 Amb19944455 [1,1,0,0,0,0|1,1,0]=4 2428 B14R2.781 O=[N+]([O-])c1ccc2ccccc2c1 Amb9787778 [1,1,0,0,0,0|2,0,0]=4 2429 B14R2.781 OB(O)c1ccc2ccccc2c1 Amb2383493 [1,1,0,0,0,0|2,0,0]=4 2430 B14R2.1019 BrCc1cc(Br)c2ccccc2n1 Amb20623440 [1,1,0,0,0,0|2,0,0]=4 2431 B14R2.1019 BrCc1cc(Br)c2ncccc2c1 Amb27798413 [1,1,0,0,0,0|2,0,0]=4 2432 B14R2.1019 BrCc1cc(I)c2ccccc2c1 Amb24743480 [1,1,0,0,0,0|1,0,0]=3 2433 B14R2.1019 CCC1=CC(=O)c2ccccc2O1 Amb18048528 [1,1,0,0,0,0|1,0,0]=3 2434 B14R2.1019 CCC1=CC(=S)c2ccccc2N1 Amb28041388 [1,1,0,0,0,0|1,0,0]=3 2435 B14R2.1019 CCC1=Cc2ccccc2C(=O)N1 Amb28250132 [1,1,0,0,0,0|1,0,0]=3 2436 B14R2.1019 CCC1=Cc2ccccc2C(=O)O1 Amb20247492 [1,1,0,0,0,0|1,0,0]=3 2437 B14R2.1019 CCC1=Cc2ncccc2C(=O)N1 Amb28422627 [1,1,0,0,0,0|2,0,0]=4 2438 B14R2.1019 CCC1=NC(=O)c2ccccc2N1 Amb19958422 [1,1,0,0,0,0|2,0,0]=4 2439 B14R2.1019 CCC1=Nc2ccccc2C(=O)N1 Amb19516119 [1,1,0,0,0,0|2,0,0]=4 2440 B14R2.1019 CCC1=Nc2ccccc2C(=O)O1 Amb19944584 [1,1,0,0,0,0|2,0,0]=4 2441 B14R2.1019 CCc1cc(Br)c2ccccc2n1 Amb28051574 [1,1,0,0,0,0|1,0,0]=3 2442 B14R2.1019 CCc1cc(C)c2ccccc2n1 Amb27175355 [1,1,0,0,0,0|1,0,0]=3 2443 B14R2.1019 CCc1cc(Cl)c2ccccc2n1 Amb9533775 [1,1,0,0,0,0|1,0,0]=3 2444 B14R2.1019 CCc1cc(N)c2ccccc2c1 Amb18126820 [1,1,0,0,0,0|0,0,0]=2 2445 B14R2.1019 CCc1cc(N)c2ccccc2n1 Amb18946867 [1,1,0,0,0,0|1,0,0]=3 2446 B14R2.1019 CCc1cc(O)c2ccccc2n1 Amb22410671 [1,1,0,0,0,0|1,0,0]=3 2447 B14R2.1019 CCc1cc(S)c2ncccc2c1 Amb27261841 [1,1,0,0,0,0|1,0,0]=3 2448 B14R2.1019 CCc1nc(Br)c2ccccc2n1 Amb20618740 [1,1,0,0,0,0|2,0,0]=4 2449 B14R2.1019 CCc1nc(C)c2ccccc2n1 Amb27252102 [1,1,0,0,0,0|2,0,0]=4 2450 B14R2.1019 CCc1nc(Cl)c2ccccc2n1 Amb20412844 [1,1,0,0,0,0|2,0,0]=4 2451 B14R2.1019 CCc1nc(F)c2ccccc2n1 Amb35643323 [1,1,0,0,0,0|2,0,0]=4 2452 B14R2.1019 CCc1nc(N)c2ccccc2n1 Amb7748679 [1,1,0,0,0,0|2,0,0]=4 2453 B14R2.1019 CCc1nc(O)c2ccccc2n1 Amb18127248 [1,1,0,0,0,0|2,0,0]=4 2454 B14R2.1019 CNC1=Cc2ccccc2C(=O)N1 Amb18278369 [1,1,0,0,0,0|2,0,0]=4 2455 B14R2.1019 CNC1=Cc2ccccc2C(=O)O1 Amb27635259 [1,1,0,0,0,0|2,0,0]=4 2456 B14R2.1019 CNc1cc2ccccc2c(C)n1 Amb27858342 [1,1,0,0,0,0|2,0,0]=4 2457 B14R2.1019 COC1=Nc2ccccc2C(=O)N1 Amb21964345 [1,1,0,0,0,0|2,0,0]=4 2458 B14R2.1019 COc1c[n+]([O-])c2ccccc2n1 Amb24371120 [1,1,0,0,0,0|2,0,0]=4 2459 B14R2.1019 COc1cc(Br)c2ccccc2c1 Amb27754022 [1,1,0,0,0,0|0,0,0]=2 2460 B14R2.1019 COc1cc(Br)c2ccccc2n1 Amb24490818 [1,1,0,0,0,0|1,0,0]=3 2461 B14R2.1019 COc1cc(Br)c2cccnc2c1 Amb24076016 [1,1,0,0,0,0|1,0,0]=3 2462 B14R2.1019 COc1cc(Br)c2ccncc2c1 Amb25895582 [1,1,0,0,0,0|1,0,0]=3 2463 B14R2.1019 COc1cc(Br)c2cnccc2c1 Amb26051135 [1,1,0,0,0,0|1,0,0]=3 2464 B14R2.1019 COc1cc(Br)c2ncccc2c1 Amb21963302 [1,1,0,0,0,0|1,0,0]=3 2465 B14R2.1019 COc1cc(Br)c2ncncc2c1 Amb28196638 [1,1,0,0,0,0|2,0,0]=4 2466 B14R2.1019 COc1cc(C)c2ccccc2c1 Amb24652139 [1,1,0,0,0,0|0,0,0]=2 2467 B14R2.1019 COc1cc(C)c2ncccc2c1 Amb23437328 [1,1,0,0,0,0|1,0,0]=3 2468 B14R2.1019 COc1cc(Cl)c2ccccc2c1 Amb24417708 [1,1,0,0,0,0|0,0,0]=2 2469 B14R2.1019 COc1cc(Cl)c2cccnc2n1 Amb27242891 [1,1,0,0,0,0|2,0,0]=4 2470 B14R2.1019 COc1cc(Cl)c2ncccc2c1 Amb20670601 [1,1,0,0,0,0|1,0,0]=3 2471 B14R2.1019 COc1cc(F)c2ccccc2c1 Amb25060592 [1,1,0,0,0,0|0,0,0]=2 2472 B14R2.1019 COc1cc(F)c2ccccc2n1 Amb27179384 [1,1,0,0,0,0|1,0,0]=3 2473 B14R2.1019 COc1cc(F)c2ccncc2c1 Amb32670332 [1,1,0,0,0,0|1,0,0]=3 2474 B14R2.1019 COc1cc(F)c2ncccc2c1 Amb22495147 [1,1,0,0,0,0|1,0,0]=3 2475 B14R2.1019 COc1cc(I)c2ccccc2n1 Amb27633252 [1,1,0,0,0,0|1,0,0]=3 2476 B14R2.1019 COc1cc(I)c2ncccc2c1 Amb23437327 [1,1,0,0,0,0|1,0,0]=3 2477 B14R2.1019 COc1cc(N)c2ccccc2c1 Amb27233835 [1,1,0,0,0,0|0,0,0]=2 2478 B14R2.1019 COc1cc(N)c2ccccc2n1 Amb26636650 [1,1,0,0,0,0|1,0,0]=3 2479 B14R2.1019 COc1cc(N)c2ccccc2n1 Amb28600366 [1,1,0,0,0,0|1,0,0]=3 2480 B14R2.1019 COc1cc(N)c2ccncc2c1 Amb27459903 [1,1,0,0,0,0|1,0,0]=3 2481 B14R2.1019 COc1cc(N)c2ncccc2c1 Amb1094006 [1,1,0,0,0,0|1,0,0]=3 2482 B14R2.1019 COc1cc(N)c2nnccc2c1 Amb28119799 [1,1,0,0,0,0|2,0,0]=4 2483 B14R2.1019 COc1cc(O)c2ccccc2c1 Amb18127199 [1,1,0,0,0,0|0,0,0]=2 2484 B14R2.1019 COc1cc(O)c2cccnc2c1 Amb28243706 [1,1,0,0,0,0|1,0,0]=3 2485 B14R2.1019 COc1cc(O)c2ncccc2c1 Amb13883518 [1,1,0,0,0,0|1,0,0]=3 2486 B14R2.1019 COc1cc([NH3+])c2ncccc2c1 Amb4005869 [1,1,0,0,0,0|1,0,0]=3 2487 B14R2.1019 COc1cc2ccccc2[n+]([O-])n1 Amb27624419 [1,1,0,0,0,0|2,0,0]=4 2488 B14R2.1019 COc1cc2ccccc2c(N)n1 Amb24649975 [1,1,0,0,0,0|1,0,0]=3 2489 B14R2.1019 COc1nc(Cl)c2ccccc2n1 Amb27653988 [1,1,0,0,0,0|2,0,0]=4 2490 B14R2.1019 COc1nc(O)c2ccccc2n1 Amb8439076 [1,1,0,0,0,0|2,0,0]=4 2491 B14R2.1019 CSC1=CC(=O)c2ccccc2N1 Amb27224827 [1,1,0,0,0,0|1,1,0]=4 2492 B14R2.1019 CSC1=CC(=O)c2ccccc2S1 Amb19667918 [1,1,0,0,0,0|1,1,0]=4 2493 B14R2.1019 CSc1cc(C)c2ccccc2n1 Amb28066074 [1,1,0,0,0,0|1,1,0]=4 2494 B14R2.1019 CSc1cc(N)c2ccccc2n1 Amb27407722 [1,1,0,0,0,0|1,1,0]=4 2495 B14R2.1019 CSc1cc(N)c2cccnc2c1 Amb27393850 [1,1,0,0,0,0|1,1,0]=4 2496 B14R2.1019 CSc1cc(S)c2ncccc2c1 Amb27261858 [1,1,0,0,0,0|1,1,0]=4 2497 B14R2.1019 Cc1cc(C#N)cc2ccccc12 Amb27862486 [1,1,0,0,0,0|1,0,1]=4 2498 B14R2.1019 Cc1cc(C=O)cc2ccccc12 Amb18126680 [1,1,0,0,0,0|1,0,1]=4 2499 B14R2.1019 Cc1cc(CBr)cc2ccccc12 Amb25155140 [1,1,0,0,0,0|1,0,0]=3 2500 B14R2.1019 Cc1cc(CBr)nc2ccccc12 Amb22498115 [1,1,0,0,0,0|2,0,0]=4 2501 B14R2.1019 Cc1cc(CCl)cc2ccccc12 Amb28056750 [1,1,0,0,0,0|1,0,0]=3 2502 B14R2.1019 Cc1cc(CCl)nc2ccccc12 Amb22498114 [1,1,0,0,0,0|2,0,0]=4 2503 B14R2.1019 Cc1cc(CN)nc2ccccc12 Amb18252188 [1,1,0,0,0,0|2,0,0]=4 2504 B14R2.1019 Cc1cc(CO)cc2ccccc12 Amb28385519 [1,1,0,0,0,0|1,0,0]=3 2505 B14R2.1019 Cc1cc(CO)cc2cccnc12 Amb18352834 [1,1,0,0,0,0|2,0,0]=4 2506 B14R2.1019 Cc1cc(CO)nc2ccccc12 Amb19104980 [1,1,0,0,0,0|2,0,0]=4 2507 B14R2.1019 Cc1nc(CN)cc2ccccc12 Amb22495049 [1,1,0,0,0,0|2,0,0]=4 2508 B14R2.1019 Cc1nc(CO)cc2ccccc12 Amb22495047 [1,1,0,0,0,0|2,0,0]=4 2509 B14R2.1019 ClCc1cc(Br)c2ccccc2c1 Amb25312115 [1,1,0,0,0,0|1,0,0]=3 2510 B14R2.1019 ClCc1cc(Cl)c2ccccc2c1 Amb26458606 [1,1,0,0,0,0|1,0,0]=3 2511 B14R2.1019 ClCc1cc(I)c2ccccc2c1 Amb25797751 [1,1,0,0,0,0|1,0,0]=3 2512 B14R2.1019 ClCc1cc2ccccc2c(Cl)n1 Amb27242071 [1,1,0,0,0,0|2,0,0]=4 2513 B14R2.1019 Clc1cc(CBr)nc2ccccc12 Amb27637976 [1,1,0,0,0,0|2,0,0]=4 2514 B14R2.1019 Clc1nc(CBr)cc2ccccc12 Amb33431635 [1,1,0,0,0,0|2,0,0]=4 2515 B14R2.1019 Fc1cc(CBr)cc2ccccc12 Amb25800193 [1,1,0,0,0,0|1,0,0]=3 2516 B14R2.1019 Fc1cc(CBr)cc2cccnc12 Amb27474211 [1,1,0,0,0,0|2,0,0]=4 2517 B14R2.1019 Fc1cc(CCl)cc2ccccc12 Amb25829478 [1,1,0,0,0,0|1,0,0]=3 2518 B14R2.1019 N#Cc1cc(Br)c2ccccc2c1 Amb26304234 [1,1,0,0,0,0|1,0,1]=4 2519 B14R2.1019 N#Cc1cc(Cl)c2ccccc2c1 Amb28243492 [1,1,0,0,0,0|1,0,1]=4 2520 B14R2.1019 N#Cc1cc(F)c2ccccc2c1 Amb26565437 [1,1,0,0,0,0|1,0,1]=4 2521 B14R2.1019 N#Cc1cc(I)c2ccccc2c1 Amb26995845 [1,1,0,0,0,0|1,0,1]=4 2522 B14R2.1019 N#Cc1cc(N)c2ccccc2c1 Amb27803720 [1,1,0,0,0,0|1,0,1]=4 2523 B14R2.1019 N#Cc1cc(O)c2ccccc2c1 Amb25065212 [1,1,0,0,0,0|1,0,1]=4 2524 B14R2.1019 NCC1=CC(=O)c2ccccc2N1 Amb18252218 [1,1,0,0,0,0|2,0,0]=4 2525 B14R2.1019 NCC1=CC(=O)c2ccccc2O1 Amb26497100 [1,1,0,0,0,0|2,0,0]=4 2526 B14R2.1019 NCc1cc(Br)c2ccccc2c1 Amb25778126 [1,1,0,0,0,0|1,0,0]=3 2527 B14R2.1019 NCc1cc(Br)c2ccccc2c1 Amb32683544 [1,1,0,0,0,0|1,0,0]=3 2528 B14R2.1019 NCc1cc(Cl)c2ccccc2c1 Amb28043216 [1,1,0,0,0,0|1,0,0]=3 2529 B14R2.1019 NCc1cc(Cl)c2ccccc2n1 Amb28384688 [1,1,0,0,0,0|2,0,0]=4 2530 B14R2.1019 NCc1cc(F)c2ccccc2c1 Amb25973464 [1,1,0,0,0,0|1,0,0]=3 2531 B14R2.1019 NCc1cc(F)c2ncccc2c1 Amb19103213 [1,1,0,0,0,0|2,0,0]=4 2532 B14R2.1019 NCc1cc(N)c2ccccc2c1 Amb24423138 [1,1,0,0,0,0|1,0,0]=3 2533 B14R2.1019 NCc1cc(N)c2ccccc2n1 Amb27954734 [1,1,0,0,0,0|2,0,0]=4 2534 B14R2.1019 NCc1cc(O)c2ccccc2c1 Amb25923927 [1,1,0,0,0,0|1,0,0]=3 2535 B14R2.1019 NCc1cc(O)c2ccccc2n1 Amb32660495 [1,1,0,0,0,0|2,0,0]=4 2536 B14R2.1019 NCc1cc2ccccc2c(Cl)n1 Amb26952129 [1,1,0,0,0,0|2,0,0]=4 2537 B14R2.1019 Nc1cc(CBr)cc2ccccc12 Amb24666470 [1,1,0,0,0,0|1,0,0]=3 2538 B14R2.1019 Nc1cc(CBr)nc2ccccc12 Amb28314526 [1,1,0,0,0,0|2,0,0]=4 2539 B14R2.1019 Nc1cc(CCl)cc2ccccc12 Amb24665739 [1,1,0,0,0,0|1,0,0]=3 2540 B14R2.1019 O=C1C=C(CCl)Nc2ccccc21 Amb19516708 [1,1,0,0,0,0|2,0,0]=4 2541 B14R2.1019 O=C1C=C(CI)Oc2ccccc21 Amb28421770 [1,1,0,0,0,0|2,0,0]=4 2542 B14R2.1019 O=C1C=C(CO)Nc2ccccc21 Amb22372303 [1,1,0,0,0,0|2,0,0]=4 2543 B14R2.1019 O=C1C=C(CO)Oc2ccccc21 Amb24309153 [1,1,0,0,0,0|2,0,0]=4 2544 B14R2.1019 O=C1NC(CCl)=Cc2ccccc21 Amb19373152 [1,1,0,0,0,0|2,0,0]=4 2545 B14R2.1019 O=C1OC(CO)=Cc2ccccc21 Amb27830564 [1,1,0,0,0,0|2,0,0]=4 2546 B14R2.1019 O=Cc1cc(Br)c2ccccc2c1 Amb27827913 [1,1,0,0,0,0|1,0,1]=4 2547 B14R2.1019 O=Cc1cc(Cl)c2ccccc2c1 Amb25279349 [1,1,0,0,0,0|1,0,1]=4 2548 B14R2.1019 O=Cc1cc(F)c2ccccc2c1 Amb28127643 [1,1,0,0,0,0|1,0,1]=4 2549 B14R2.1019 O=Cc1cc(I)c2ccccc2c1 Amb25865357 [1,1,0,0,0,0|1,0,1]=4 2550 B14R2.1019 O=Cc1cc(O)c2ccccc2c1 Amb27267901 [1,1,0,0,0,0|1,0,1]=4 2551 B14R2.1019 OCc1cc(Br)c2ccccc2c1 Amb25055284 [1,1,0,0,0,0|1,0,0]=3 2552 B14R2.1019 OCc1cc(Cl)c2ccccc2c1 Amb26967026 [1,1,0,0,0,0|1,0,0]=3 2553 B14R2.1019 OCc1cc(Cl)c2ccccc2n1 Amb27598536 [1,1,0,0,0,0|2,0,0]=4 2554 B14R2.1019 OCc1cc(F)c2ccccc2c1 Amb25868867 [1,1,0,0,0,0|1,0,0]=3 2555 B14R2.1019 OCc1cc(F)c2ncccc2c1 Amb19103911 [1,1,0,0,0,0|2,0,0]=4 2556 B14R2.1019 OCc1cc(I)c2ccccc2c1 Amb26989533 [1,1,0,0,0,0|1,0,0]=3 2557 B14R2.1019 OCc1cc(O)c2ccccc2c1 Amb23570400 [1,1,0,0,0,0|1,0,0]=3 2558 B14R2.1019 Oc1cc(CBr)cc2ccccc12 Amb26988702 [1,1,0,0,0,0|1,0,0]=3 2559 B14R2.1019 Oc1cc(CCl)cc2ccccc12 Amb27658821 [1,1,0,0,0,0|1,0,0]=3 2560 B14R2.1128 BrCc1cc2ccccc2cc1I Amb26078041 [1,1,0,0,0,0|1,0,0]=3 2561 B14R2.1128 C#Cc1cc2ccccc2cc1N Amb27393581 [1,1,0,0,0,0|0,0,2]=4 2562 B14R2.1128 C=Cc1cc2ccccc2cc1O Amb28383138 [1,1,0,0,0,0|0,0,2]=4 2563 B14R2.1128 CCC1=C(N)Nc2ccccc2O1 Amb27633874 [1,1,0,0,0,0|2,0,0]=4 2564 B14R2.1128 CCC1=Cc2ccccc2NC1=O Amb22723317 [1,1,0,0,0,0|1,0,0]=3 2565 B14R2.1128 CCC1=Nc2ccccc2NC1=O Amb19891159 [1,1,0,0,0,0|2,0,0]=4 2566 B14R2.1128 CCc1cc2ccccc2cc1Br Amb32650448 [1,1,0,0,0,0|0,0,0]=2 2567 B14R2.1128 CCc1cc2ccccc2cc1Cl Amb32650447 [1,1,0,0,0,0|0,0,0]=2 2568 B14R2.1128 CCc1cc2ccccc2cc1O Amb25059607 [1,1,0,0,0,0|0,0,0]=2 2569 B14R2.1128 CCc1cc2ccccc2nc1Br Amb17158083 [1,1,0,0,0,0|1,0,0]=3 2570 B14R2.1128 CCc1cc2ccccc2nc1C Amb27391662 [1,1,0,0,0,0|1,0,0]=3 2571 B14R2.1128 CCc1cc2ccccc2nc1Cl Amb9134222 [1,1,0,0,0,0|1,0,0]=3 2572 B14R2.1128 CCc1cc2ccccc2nc1N Amb9134103 [1,1,0,0,0,0|1,0,0]=3 2573 B14R2.1128 CCc1nc2ccccc2cc1Br Amb32695576 [1,1,0,0,0,0|1,0,0]=3 2574 B14R2.1128 CCc1nc2ccccc2cc1N Amb26336609 [1,1,0,0,0,0|1,0,0]=3 2575 B14R2.1128 CCc1nc2ccccc2cc1O Amb24749839 [1,1,0,0,0,0|1,0,0]=3 2576 B14R2.1128 CCc1nc2ccccc2nc1Cl Amb4477212 [1,1,0,0,0,0|2,0,0]=4 2577 B14R2.1128 CCc1nc2ccccc2nc1N Amb18127093 [1,1,0,0,0,0|2,0,0]=4 2578 B14R2.1128 CNc1nc2ccccc2cc1C Amb27205570 [1,1,0,0,0,0|2,0,0]=4 2579 B14R2.1128 CNc1nc2ccccc2cc1N Amb27415570 [1,1,0,0,0,0|2,0,0]=4 2580 B14R2.1128 COC1=Cc2ccccc2OC1=O Amb23512578 [1,1,0,0,0,0|1,0,0]=3 2581 B14R2.1128 COC1=Cc2ccncc2NC1=O Amb28364749 [1,1,0,0,0,0|2,0,0]=4 2582 B14R2.1128 COC1=Cc2ncccc2NC1=O Amb27168932 [1,1,0,0,0,0|2,0,0]=4 2583 B14R2.1128 CO[C@@H]1C=C2C=CC=CC2=C[C@@H]1O Amb28067831 [1,1,0,0,0,0|0,0,2]=4 2584 B14R2.1128 COc1cc2c(cc1C)CCC=C2 Amb28205254 [1,1,0,0,0,0|0,0,2]=4 2585 B14R2.1128 COc1cc2c(cc1O)OC=CC2 Amb27586989 [1,1,0,0,0,0|1,0,1]=4 2586 B14R2.1128 COc1cc2ccccc2cc1Br Amb22445934 [1,1,0,0,0,0|0,0,0]=2 2587 B14R2.1128 COc1cc2ccccc2cc1C Amb24415328 [1,1,0,0,0,0|0,0,0]=2 2588 B14R2.1128 COc1cc2ccccc2cc1Cl Amb24735700 [1,1,0,0,0,0|0,0,0]=2 2589 B14R2.1128 COc1cc2ccccc2cc1I Amb26595184 [1,1,0,0,0,0|0,0,0]=2 2590 B14R2.1128 COc1cc2ccccc2cc1N Amb18127045 [1,1,0,0,0,0|0,0,0]=2 2591 B14R2.1128 COc1cc2ccccc2cc1O Amb6358072 [1,1,0,0,0,0|0,0,0]=2 2592 B14R2.1128 COc1cc2ccccc2nc1Br Amb25739600 [1,1,0,0,0,0|1,0,0]=3 2593 B14R2.1128 COc1cc2ccccc2nc1Cl Amb24534649 [1,1,0,0,0,0|1,0,0]=3 2594 B14R2.1128 COc1cc2ccccc2nc1O Amb2612889 [1,1,0,0,0,0|1,0,0]=3 2595 B14R2.1128 COc1cc2cccnc2cc1Br Amb23437339 [1,1,0,0,0,0|1,0,0]=3 2596 B14R2.1128 COc1cc2cccnc2cc1C Amb22886999 [1,1,0,0,0,0|1,0,0]=3 2597 B14R2.1128 COc1cc2cccnc2cc1Cl Amb23401102 [1,1,0,0,0,0|1,0,0]=3 2598 B14R2.1128 COc1cc2cccnc2cc1F Amb19957347 [1,1,0,0,0,0|1,0,0]=3 2599 B14R2.1128 COc1cc2cccnc2cc1I Amb23400929 [1,1,0,0,0,0|1,0,0]=3 2600 B14R2.1128 COc1cc2cccnc2cc1N Amb24565737 [1,1,0,0,0,0|1,0,0]=3 2601 B14R2.1128 COc1cc2ccncc2cc1Br Amb25999152 [1,1,0,0,0,0|1,0,0]=3 2602 B14R2.1128 COc1cc2ccncc2cc1O Amb33528714 [1,1,0,0,0,0|1,0,0]=3 2603 B14R2.1128 COc1cc2cnccc2cc1Br Amb25771927 [1,1,0,0,0,0|1,0,0]=3 2604 B14R2.1128 COc1cc2cnccc2cc1F Amb25697053 [1,1,0,0,0,0|1,0,0]=3 2605 B14R2.1128 COc1cc2cnccc2cc1I Amb24566749 [1,1,0,0,0,0|1,0,0]=3 2606 B14R2.1128 COc1cc2cnccc2cc1N Amb18197674 [1,1,0,0,0,0|1,0,0]=3 2607 B14R2.1128 COc1cc2cnccc2nc1C Amb28051261 [1,1,0,0,0,0|2,0,0]=4 2608 B14R2.1128 COc1cc2cncnc2cc1N Amb27415805 [1,1,0,0,0,0|2,0,0]=4 2609 B14R2.1128 COc1cc2ncccc2cc1Br Amb30594112 [1,1,0,0,0,0|1,0,0]=3 2610 B14R2.1128 COc1cc2ncccc2cc1C Amb25869889 [1,1,0,0,0,0|1,0,0]=3 2611 B14R2.1128 COc1cc2ncccc2cc1F Amb27593053 [1,1,0,0,0,0|1,0,0]=3 2612 B14R2.1128 COc1cc2ncccc2cc1N Amb24427333 [1,1,0,0,0,0|1,0,0]=3 2613 B14R2.1128 COc1cc2nccnc2cc1Cl Amb28290890 [1,1,0,0,0,0|2,0,0]=4 2614 B14R2.1128 COc1cc2nccnc2cc1F Amb28122912 [1,1,0,0,0,0|2,0,0]=4 2615 B14R2.1128 COc1nc2ccccc2cc1Br Amb10608360 [1,1,0,0,0,0|1,0,0]=3 2616 B14R2.1128 COc1nc2ccccc2cc1Cl Amb24533657 [1,1,0,0,0,0|1,0,0]=3 2617 B14R2.1128 COc1nc2ccccc2cc1N Amb27179996 [1,1,0,0,0,0|1,0,0]=3 2618 B14R2.1128 COc1nc2ccccc2cc1O Amb27476171 [1,1,0,0,0,0|1,0,0]=3 2619 B14R2.1128 COc1nc2ccccc2cc1S Amb32729752 [1,1,0,0,0,0|1,0,0]=3 2620 B14R2.1128 COc1nc2ccccc2nc1Cl Amb8386355 [1,1,0,0,0,0|2,0,0]=4 2621 B14R2.1128 COc1nc2ccccc2nc1F Amb35593850 [1,1,0,0,0,0|2,0,0]=4 2622 B14R2.1128 COc1nc2ccccc2nc1I Amb28051615 [1,1,0,0,0,0|2,0,0]=4 2623 B14R2.1128 COc1nc2ccccc2nc1N Amb18127415 [1,1,0,0,0,0|2,0,0]=4 2624 B14R2.1128 COc1nc2cccnc2cc1Br Amb34931281 [1,1,0,0,0,0|2,0,0]=4 2625 B14R2.1128 COc1nc2ncccc2cc1N Amb32424340 [1,1,0,0,0,0|2,0,0]=4 2626 B14R2.1128 CSC1=Cc2ccccc2OC1=O Amb27623644 [1,1,0,0,0,0|1,1,0]=4 2627 B14R2.1128 CSc1cc2ccccc2nc1O Amb24564502 [1,1,0,0,0,0|1,1,0]=4 2628 B14R2.1128 CSc1nc2ccccc2cc1Br Amb27209717 [1,1,0,0,0,0|1,1,0]=4 2629 B14R2.1128 Cc1cc2ccccc2cc1C#N Amb27265786 [1,1,0,0,0,0|1,0,1]=4 2630 B14R2.1128 Cc1cc2ccccc2cc1CBr Amb17778929 [1,1,0,0,0,0|1,0,0]=3 2631 B14R2.1128 Cc1cc2ccccc2cc1CCl Amb17778928 [1,1,0,0,0,0|1,0,0]=3 2632 B14R2.1128 Cc1cc2ccccc2cc1CN Amb24665750 [1,1,0,0,0,0|1,0,0]=3 2633 B14R2.1128 Cc1cc2ccccc2cc1CO Amb25943382 [1,1,0,0,0,0|1,0,0]=3 2634 B14R2.1128 Cc1cc2ccccc2nc1CBr Amb22498481 [1,1,0,0,0,0|2,0,0]=4 2635 B14R2.1128 Cc1cc2ccccc2nc1CCl Amb22498479 [1,1,0,0,0,0|2,0,0]=4 2636 B14R2.1128 Cc1cc2ccccc2nc1CN Amb17578253 [1,1,0,0,0,0|2,0,0]=4 2637 B14R2.1128 Cc1cc2ccccc2nc1CO Amb22498485 [1,1,0,0,0,0|2,0,0]=4 2638 B14R2.1128 Cc1nc2ccccc2cc1CI Amb28062546 [1,1,0,0,0,0|2,0,0]=4 2639 B14R2.1128 Cc1nc2ccccc2cc1CN Amb17578252 [1,1,0,0,0,0|2,0,0]=4 2640 B14R2.1128 Cc1nc2ccccc2cc1CO Amb27804004 [1,1,0,0,0,0|2,0,0]=4 2641 B14R2.1128 ClCc1cc2ccccc2cc1Br Amb25365052 [1,1,0,0,0,0|1,0,0]=3 2642 B14R2.1128 ClCc1cc2ccccc2nc1Cl Amb1154286 [1,1,0,0,0,0|2,0,0]=4 2643 B14R2.1128 Clc1cc2ccccc2cc1CBr Amb25958393 [1,1,0,0,0,0|1,0,0]=3 2644 B14R2.1128 Clc1cc2ncccc2cc1CBr Amb26078158 [1,1,0,0,0,0|2,0,0]=4 2645 B14R2.1128 Clc1nc2ccccc2cc1CBr Amb24105731 [1,1,0,0,0,0|2,0,0]=4 2646 B14R2.1128 FCc1cc2ccccc2nc1Cl Amb25141192 [1,1,0,0,0,0|2,0,0]=4 2647 B14R2.1128 Fc1cc2ccccc2cc1CBr Amb26078253 [1,1,0,0,0,0|1,0,0]=3 2648 B14R2.1128 Fc1cc2ccccc2cc1CCl Amb26319359 [1,1,0,0,0,0|1,0,0]=3 2649 B14R2.1128 Fc1cc2ccccc2nc1CCl Amb27612866 [1,1,0,0,0,0|2,0,0]=4 2650 B14R2.1128 N#Cc1cc2ccccc2cc1Br Amb25771839 [1,1,0,0,0,0|1,0,1]=4 2651 B14R2.1128 N#Cc1cc2ccccc2cc1Cl Amb27968319 [1,1,0,0,0,0|1,0,1]=4 2652 B14R2.1128 N#Cc1cc2ccccc2cc1F Amb26636420 [1,1,0,0,0,0|1,0,1]=4 2653 B14R2.1128 N#Cc1cc2ccccc2cc1I Amb27870832 [1,1,0,0,0,0|1,0,1]=4 2654 B14R2.1128 N#Cc1cc2ccccc2cc1N Amb2613372 [1,1,0,0,0,0|1,0,1]=4 2655 B14R2.1128 N#Cc1cc2ccccc2cc1O Amb27591627 [1,1,0,0,0,0|1,0,1]=4 2656 B14R2.1128 NCC1=Cc2ccccc2NC1=O Amb17991271 [1,1,0,0,0,0|2,0,0]=4 2657 B14R2.1128 NCC1=Cc2ccccc2NC1=O Amb18908960 [1,1,0,0,0,0|2,0,0]=4 2658 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb18908987 [1,1,0,0,0,0|2,0,0]=4 2659 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb32686597 [1,1,0,0,0,0|2,0,0]=4 2660 B14R2.1128 NCc1cc2ccccc2cc1Br Amb25980274 [1,1,0,0,0,0|1,0,0]=3 2661 B14R2.1128 NCc1cc2ccccc2cc1Cl Amb25299156 [1,1,0,0,0,0|1,0,0]=3 2662 B14R2.1128 NCc1cc2ccccc2cc1I Amb24448245 [1,1,0,0,0,0|1,0,0]=3 2663 B14R2.1128 NCc1cc2ccccc2cc1N Amb18944641 [1,1,0,0,0,0|1,0,0]=3 2664 B14R2.1128 NCc1cc2ccccc2cc1O Amb26044834 [1,1,0,0,0,0|1,0,0]=3 2665 B14R2.1128 NCc1cc2ccccc2nc1Br Amb22497904 [1,1,0,0,0,0|2,0,0]=4 2666 B14R2.1128 NCc1cc2ccccc2nc1Cl Amb22396141 [1,1,0,0,0,0|2,0,0]=4 2667 B14R2.1128 NCc1cc2ccccc2nc1I Amb25802785 [1,1,0,0,0,0|2,0,0]=4 2668 B14R2.1128 NCc1cc2cccnc2cc1Br Amb20668430 [1,1,0,0,0,0|2,0,0]=4 2669 B14R2.1128 NCc1cc2cccnc2cc1Br Amb27164263 [1,1,0,0,0,0|2,0,0]=4 2670 B14R2.1128 NCc1cc2cccnc2cc1Cl Amb28063296 [1,1,0,0,0,0|2,0,0]=4 2671 B14R2.1128 NCc1nc2ccccc2cc1Br Amb27608922 [1,1,0,0,0,0|2,0,0]=4 2672 B14R2.1128 NCc1nc2ccccc2cc1N Amb23399949 [1,1,0,0,0,0|2,0,0]=4 2673 B14R2.1128 NNc1cc2ccccc2cc1O Amb27830653 [1,1,0,0,0,0|2,0,0]=4 2674 B14R2.1128 Nc1cc2ccccc2cc1C=O Amb25782655 [1,1,0,0,0,0|1,0,1]=4 2675 B14R2.1128 Nc1cc2ccccc2cc1CBr Amb27180804 [1,1,0,0,0,0|1,0,0]=3 2676 B14R2.1128 Nc1cc2ccccc2cc1CCl Amb27862433 [1,1,0,0,0,0|1,0,0]=3 2677 B14R2.1128 Nc1cc2ccccc2cc1CO Amb19959319 [1,1,0,0,0,0|1,0,0]=3 2678 B14R2.1128 Nc1cc2ccccc2nc1CO Amb18127225 [1,1,0,0,0,0|2,0,0]=4 2679 B14R2.1128 Nc1nc2ccccc2cc1CO Amb18946793 [1,1,0,0,0,0|2,0,0]=4 2680 B14R2.1128 O=C1Nc2ccccc2C=C1CCl Amb18015274 [1,1,0,0,0,0|2,0,0]=4 2681 B14R2.1128 O=C1Nc2ccccc2C=C1CO Amb18528795 [1,1,0,0,0,0|2,0,0]=4 2682 B14R2.1128 O=C1Oc2ccccc2C=C1CBr Amb27239513 [1,1,0,0,0,0|2,0,0]=4 2683 B14R2.1128 O=C1Oc2ccccc2C=C1CCl Amb21937093 [1,1,0,0,0,0|2,0,0]=4 2684 B14R2.1128 O=Cc1cc2ccccc2cc1Cl Amb18650675 [1,1,0,0,0,0|1,0,1]=4 2685 B14R2.1128 O=Cc1cc2ccccc2cc1F Amb18647802 [1,1,0,0,0,0|1,0,1]=4 2686 B14R2.1128 O=Cc1cc2ccccc2cc1I Amb27223051 [1,1,0,0,0,0|1,0,1]=4 2687 B14R2.1128 O=Cc1cc2ccccc2cc1O Amb5494028 [1,1,0,0,0,0|1,0,1]=4 2688 B14R2.1128 OCc1cc2ccccc2cc1Br Amb27814189 [1,1,0,0,0,0|1,0,0]=3 2689 B14R2.1128 OCc1cc2ccccc2cc1Cl Amb26512048 [1,1,0,0,0,0|1,0,0]=3 2690 B14R2.1128 OCc1cc2ccccc2cc1F Amb25927086 [1,1,0,0,0,0|1,0,0]=3 2691 B14R2.1128 OCc1cc2ccccc2cc1I Amb27949521 [1,1,0,0,0,0|1,0,0]=3 2692 B14R2.1128 OCc1cc2ccccc2cc1O Amb18127196 [1,1,0,0,0,0|1,0,0]=3 2693 B14R2.1128 OCc1cc2ccccc2nc1Cl Amb696676 [1,1,0,0,0,0|2,0,0]=4 2694 B14R2.1128 OCc1cc2ccccc2nc1I Amb24309344 [1,1,0,0,0,0|2,0,0]=4 2695 B14R2.1128 OCc1nc2ccccc2cc1Br Amb27218089 [1,1,0,0,0,0|2,0,0]=4 2696 B14R2.1128 OCc1nc2ccccc2cc1I Amb25262837 [1,1,0,0,0,0|2,0,0]=4 2697 B14R2.1128 Oc1cc2ccccc2cc1CBr Amb26316705 [1,1,0,0,0,0|1,0,0]=3 2698 B14R2.1128 Oc1cc2ccccc2cc1CCl Amb26053532 [1,1,0,0,0,0|1,0,0]=3 2699 B14R2.1128 Oc1nc2ccccc2cc1CS Amb32788331 [1,1,0,0,0,0|2,0,0]=4 2700 B14R2.1128 SCc1cc2ccccc2nc1Cl Amb33057606 [1,1,0,0,0,0|2,0,0]=4 2701 B14R2.1801 BrCc1ccc2c(Br)cccc2c1 Amb24382675 [1,1,0,0,0,0|1,0,0]=3 2702 B14R2.1801 BrCc1ccc2c(Br)cccc2n1 Amb28187255 [1,1,0,0,0,0|2,0,0]=4 2703 B14R2.1801 BrCc1ccc2c(I)cccc2c1 Amb28140648 [1,1,0,0,0,0|1,0,0]=3 2704 B14R2.1801 BrCc1cnc2c(Br)cccc2c1 Amb27813374 [1,1,0,0,0,0|2,0,0]=4 2705 B14R2.1801 CCc1ccc2c(Br)nccc2c1 Amb18560388 [1,1,0,0,0,0|1,0,0]=3 2706 B14R2.1801 CCc1ccc2c(Cl)nccc2c1 Amb17216941 [1,1,0,0,0,0|1,0,0]=3 2707 B14R2.1801 CCc1ccc2c(N)cccc2n1 Amb25712154 [1,1,0,0,0,0|1,0,0]=3 2708 B14R2.1801 CCc1ccc2c(N)nccc2c1 Amb17216961 [1,1,0,0,0,0|1,0,0]=3 2709 B14R2.1801 CCc1ccc2c(O)nccc2c1 Amb18560321 [1,1,0,0,0,0|1,0,0]=3 2710 B14R2.1801 CCc1ccc2c(c1)OC=CC2=O Amb28052822 [1,1,0,0,0,0|1,0,0]=3 2711 B14R2.1801 CCc1cnc2c(C)cccc2c1 Amb17334866 [1,1,0,0,0,0|1,0,0]=3 2712 B14R2.1801 CCc1cnc2c(F)cccc2c1 Amb28242548 [1,1,0,0,0,0|1,0,0]=3 2713 B14R2.1801 CCc1cnc2c(O)cccc2c1 Amb18127051 [1,1,0,0,0,0|1,0,0]=3 2714 B14R2.1801 CCc1ncc2c(N)cccc2n1 Amb27667187 [1,1,0,0,0,0|2,0,0]=4 2715 B14R2.1801 CNc1ccc2c(Cl)nccc2c1 Amb27798489 [1,1,0,0,0,0|2,0,0]=4 2716 B14R2.1801 COc1cc2cccc(N)c2cn1 Amb25898312 [1,1,0,0,0,0|1,0,0]=3 2717 B14R2.1801 COc1cc2nccc(Cl)c2cn1 Amb22235300 [1,1,0,0,0,0|2,0,0]=4 2718 B14R2.1801 COc1cc2nccc(O)c2cn1 Amb24517156 [1,1,0,0,0,0|2,0,0]=4 2719 B14R2.1801 COc1ccc2c(Br)cccc2n1 Amb18157722 [1,1,0,0,0,0|1,0,0]=3 2720 B14R2.1801 COc1ccc2c(Br)ccnc2c1 Amb9134337 [1,1,0,0,0,0|1,0,0]=3 2721 B14R2.1801 COc1ccc2c(Br)nccc2c1 Amb18062821 [1,1,0,0,0,0|1,0,0]=3 2722 B14R2.1801 COc1ccc2c(C)cccc2c1 Amb23448322 [1,1,0,0,0,0|0,0,0]=2 2723 B14R2.1801 COc1ccc2c(C)ccnc2c1 Amb20240028 [1,1,0,0,0,0|1,0,0]=3 2724 B14R2.1801 COc1ccc2c(C)ccnc2c1 Amb8496543 [1,1,0,0,0,0|1,0,0]=3 2725 B14R2.1801 COc1ccc2c(C)nccc2c1 Amb24580619 [1,1,0,0,0,0|1,0,0]=3 2726 B14R2.1801 COc1ccc2c(C)nccc2n1 Amb27953781 [1,1,0,0,0,0|2,0,0]=4 2727 B14R2.1801 COc1ccc2c(Cl)cccc2c1 Amb24330978 [1,1,0,0,0,0|0,0,0]=2 2728 B14R2.1801 COc1ccc2c(Cl)ccnc2c1 Amb1994639 [1,1,0,0,0,0|1,0,0]=3 2729 B14R2.1801 COc1ccc2c(Cl)nccc2c1 Amb10603410 [1,1,0,0,0,0|1,0,0]=3 2730 B14R2.1801 COc1ccc2c(Cl)ncnc2c1 Amb5786704 [1,1,0,0,0,0|2,0,0]=4 2731 B14R2.1801 COc1ccc2c(Cl)nncc2c1 Amb22755724 [1,1,0,0,0,0|2,0,0]=4 2732 B14R2.1801 COc1ccc2c(F)cccc2c1 Amb24330977 [1,1,0,0,0,0|0,0,0]=2 2733 B14R2.1801 COc1ccc2c(F)nccc2c1 Amb28202693 [1,1,0,0,0,0|1,0,0]=3 2734 B14R2.1801 COc1ccc2c(F)ncnc2c1 Amb35649034 [1,1,0,0,0,0|2,0,0]=4 2735 B14R2.1801 COc1ccc2c(N)cccc2n1 Amb18127236 [1,1,0,0,0,0|1,0,0]=3 2736 B14R2.1801 COc1ccc2c(N)ccnc2c1 Amb1994611 [1,1,0,0,0,0|1,0,0]=3 2737 B14R2.1801 COc1ccc2c(N)nccc2c1 Amb17216965 [1,1,0,0,0,0|1,0,0]=3 2738 B14R2.1801 COc1ccc2c(N)nccc2n1 Amb27217962 [1,1,0,0,0,0|2,0,0]=4 2739 B14R2.1801 COc1ccc2c(N)ncnc2c1 Amb19929582 [1,1,0,0,0,0|2,0,0]=4 2740 B14R2.1801 COc1ccc2c(O)cccc2c1 Amb10603866 [1,1,0,0,0,0|0,0,0]=2 2741 B14R2.1801 COc1ccc2c(O)cccc2n1 Amb25735678 [1,1,0,0,0,0|1,0,0]=3 2742 B14R2.1801 COc1ccc2c(O)ccnc2c1 Amb1994268 [1,1,0,0,0,0|1,0,0]=3 2743 B14R2.1801 COc1ccc2c(O)nccc2c1 Amb18560322 [1,1,0,0,0,0|1,0,0]=3 2744 B14R2.1801 COc1ccc2c(c1)C=CNC2=O Amb18034940 [1,1,0,0,0,0|1,0,0]=3 2745 B14R2.1801 COc1ccc2c(c1)C=NNC2=O Amb26530336 [1,1,0,0,0,0|2,0,0]=4 2746 B14R2.1801 COc1ccc2c(c1)CC=CC2=O Amb21952654 [1,1,0,0,0,0|0,0,1]=3 2747 B14R2.1801 COc1ccc2c(c1)N=CNC2=O Amb17991173 [1,1,0,0,0,0|2,0,0]=4 2748 B14R2.1801 COc1ccc2c(c1)NC=CC2=O Amb22234843 [1,1,0,0,0,0|1,0,0]=3 2749 B14R2.1801 COc1ccc2c(c1)NC=CC2=S Amb24109680 [1,1,0,0,0,0|1,0,0]=3 2750 B14R2.1801 COc1ccc2c(c1)NC=NC2=O Amb20171406 [1,1,0,0,0,0|2,0,0]=4 2751 B14R2.1801 COc1ccc2c(c1)NN=CC2=O Amb23454436 [1,1,0,0,0,0|2,0,0]=4 2752 B14R2.1801 COc1ccc2c(c1)OC=CC2=O Amb19894750 [1,1,0,0,0,0|1,0,0]=3 2753 B14R2.1801 COc1ccc2c(ccc[n+]2C)c1 Amb8503643 [1,1,0,0,0,0|1,0,0]=3 2754 B14R2.1801 COc1cnc2c(Br)cccc2c1 Amb27623928 [1,1,0,0,0,0|1,0,0]=3 2755 B14R2.1801 COc1cnc2c(Cl)cccc2n1 Amb27200750 [1,1,0,0,0,0|2,0,0]=4 2756 B14R2.1801 COc1cnc2c(Cl)ccnc2c1 Amb20670994 [1,1,0,0,0,0|2,0,0]=4 2757 B14R2.1801 COc1cnc2c(Cl)nccc2c1 Amb28044101 [1,1,0,0,0,0|2,0,0]=4 2758 B14R2.1801 COc1cnc2c(N)cccc2c1 Amb24183789 [1,1,0,0,0,0|1,0,0]=3 2759 B14R2.1801 COc1cnc2c(N)cccc2n1 Amb25044226 [1,1,0,0,0,0|2,0,0]=4 2760 B14R2.1801 COc1cnc2c(N)nccc2c1 Amb26555423 [1,1,0,0,0,0|2,0,0]=4 2761 B14R2.1801 COc1cnc2c(O)cccc2c1 Amb25852325 [1,1,0,0,0,0|1,0,0]=3 2762 B14R2.1801 COc1cnc2c(c1)C=CNC2=O Amb25254905 [1,1,0,0,0,0|2,0,0]=4 2763 B14R2.1801 COc1cnc2c(c1)NC=CC2=O Amb23455160 [1,1,0,0,0,0|2,0,0]=4 2764 B14R2.1801 COc1ncc2c(Br)cccc2n1 Amb18157411 [1,1,0,0,0,0|2,0,0]=4 2765 B14R2.1801 CSc1ccc2c(Cl)ccnc2c1 Amb28187145 [1,1,0,0,0,0|1,1,0]=4 2766 B14R2.1801 CSc1cnc2c(N)cccc2c1 Amb27794585 [1,1,0,0,0,0|1,1,0]=4 2767 B14R2.1801 Cc1cccc2cc(C#N)ccc12 Amb28243705 [1,1,0,0,0,0|1,0,1]=4 2768 B14R2.1801 Cc1cccc2cc(CBr)ccc12 Amb26498671 [1,1,0,0,0,0|1,0,0]=3 2769 B14R2.1801 Cc1cccc2cc(CN)ccc12 Amb25108578 [1,1,0,0,0,0|1,0,0]=3 2770 B14R2.1801 Cc1cccc2cc(CN)cnc12 Amb17578251 [1,1,0,0,0,0|2,0,0]=4 2771 B14R2.1801 Cc1cccc2cc(CO)ccc12 Amb26507940 [1,1,0,0,0,0|1,0,0]=3 2772 B14R2.1801 Cc1cccc2cc(CO)cnc12 Amb20669301 [1,1,0,0,0,0|2,0,0]=4 2773 B14R2.1801 Cc1cccc2nc(CBr)ccc12 Amb27618040 [1,1,0,0,0,0|2,0,0]=4 2774 B14R2.1801 Cc1cccc2nc(CO)ccc12 Amb25724345 [1,1,0,0,0,0|2,0,0]=4 2775 B14R2.1801 Cc1nccc2cc(CN)ccc12 Amb26537759 [1,1,0,0,0,0|2,0,0]=4 2776 B14R2.1801 ClCc1ccc2c(Br)cccc2c1 Amb24713434 [1,1,0,0,0,0|1,0,0]=3 2777 B14R2.1801 ClCc1ccc2c(Br)cccc2n1 Amb26423335 [1,1,0,0,0,0|2,0,0]=4 2778 B14R2.1801 ClCc1ccc2c(Cl)cccc2c1 Amb28323102 [1,1,0,0,0,0|1,0,0]=3 2779 B14R2.1801 Clc1cccc2cc(CBr)ccc12 Amb25364192 [1,1,0,0,0,0|1,0,0]=3 2780 B14R2.1801 Clc1ccnc2cc(CBr)ccc12 Amb27613148 [1,1,0,0,0,0|2,0,0]=4 2781 B14R2.1801 Fc1cccc2cc(CBr)ccc12 Amb27263604 [1,1,0,0,0,0|1,0,0]=3 2782 B14R2.1801 Fc1cccc2cc(CCl)ccc12 Amb27966780 [1,1,0,0,0,0|1,0,0]=3 2783 B14R2.1801 Fc1cccc2nc(CBr)ccc12 Amb25155435 [1,1,0,0,0,0|2,0,0]=4 2784 B14R2.1801 N#Cc1ccc2c(Br)cccc2c1 Amb27778537 [1,1,0,0,0,0|1,0,1]=4 2785 B14R2.1801 N#Cc1ccc2c(Cl)cccc2c1 Amb18649707 [1,1,0,0,0,0|1,0,1]=4 2786 B14R2.1801 N#Cc1ccc2c(F)cccc2c1 Amb28243611 [1,1,0,0,0,0|1,0,1]=4 2787 B14R2.1801 N#Cc1ccc2c(N)cccc2c1 Amb27607185 [1,1,0,0,0,0|1,0,1]=4 2788 B14R2.1801 N#Cc1ccc2c(O)cccc2c1 Amb26843203 [1,1,0,0,0,0|1,0,1]=4 2789 B14R2.1801 NCc1ccc2c(Br)cccc2c1 Amb17777802 [1,1,0,0,0,0|1,0,0]=3 2790 B14R2.1801 NCc1ccc2c(Br)cccc2c1 Amb17777803 [1,1,0,0,0,0|1,0,0]=3 2791 B14R2.1801 NCc1ccc2c(Br)cccc2c1 Amb17777804 [1,1,0,0,0,0|1,0,0]=3 2792 B14R2.1801 NCc1ccc2c(Br)cccc2n1 Amb25911291 [1,1,0,0,0,0|2,0,0]=4 2793 B14R2.1801 NCc1ccc2c(Cl)cccc2c1 Amb25700301 [1,1,0,0,0,0|1,0,0]=3 2794 B14R2.1801 NCc1ccc2c(F)cccc2c1 Amb27618165 [1,1,0,0,0,0|1,0,0]=3 2795 B14R2.1801 NCc1ccc2c(I)cccc2c1 Amb26017148 [1,1,0,0,0,0|1,0,0]=3 2796 B14R2.1801 NCc1ccc2c(N)cccc2c1 Amb27483021 [1,1,0,0,0,0|1,0,0]=3 2797 B14R2.1801 NCc1ccc2c(N)nccc2c1 Amb25059203 [1,1,0,0,0,0|2,0,0]=4 2798 B14R2.1801 NCc1ccc2c(N)nccc2c1 Amb33714691 [1,1,0,0,0,0|2,0,0]=4 2799 B14R2.1801 NCc1ccc2c(O)cccc2c1 Amb24379524 [1,1,0,0,0,0|1,0,0]=3 2800 B14R2.1801 NCc1ccc2c(c1)C=CNC2=O Amb22735990 [1,1,0,0,0,0|2,0,0]=4 2801 B14R2.1801 NCc1ccc2c(c1)NC=CC2=O Amb26304158 [1,1,0,0,0,0|2,0,0]=4 2802 B14R2.1801 NCc1cnc2c(Br)cccc2c1 Amb17581745 [1,1,0,0,0,0|2,0,0]=4 2803 B14R2.1801 NCc1cnc2c(Cl)cccc2c1 Amb17578606 [1,1,0,0,0,0|2,0,0]=4 2804 B14R2.1801 NCc1cnc2c(F)cccc2c1 Amb17578279 [1,1,0,0,0,0|2,0,0]=4 2805 B14R2.1801 NCc1cnc2c(O)cccc2c1 Amb27808747 [1,1,0,0,0,0|2,0,0]=4 2806 B14R2.1801 NCc1cnc2c(S)cccc2c1 Amb27405334 [1,1,0,0,0,0|2,0,0]=4 2807 B14R2.1801 Nc1cccc2cc(C=O)ccc12 Amb24532068 [1,1,0,0,0,0|1,0,1]=4 2808 B14R2.1801 Nc1cccc2cc(CBr)ccc12 Amb27177257 [1,1,0,0,0,0|1,0,0]=3 2809 B14R2.1801 Nc1cccc2cc(CCl)ccc12 Amb24496882 [1,1,0,0,0,0|1,0,0]=3 2810 B14R2.1801 Nc1cccc2cc(CO)ccc12 Amb24585608 [1,1,0,0,0,0|1,0,0]=3 2811 B14R2.1801 Nc1nccc2cc(CO)ccc12 Amb22735859 [1,1,0,0,0,0|2,0,0]=4 2812 B14R2.1801 O=C1C=COc2cc(CBr)ccc21 Amb27865706 [1,1,0,0,0,0|2,0,0]=4 2813 B14R2.1801 O=Cc1ccc2c(Br)cccc2c1 Amb8388173 [1,1,0,0,0,0|1,0,1]=4 2814 B14R2.1801 O=Cc1ccc2c(Cl)cccc2c1 Amb27834339 [1,1,0,0,0,0|1,0,1]=4 2815 B14R2.1801 O=Cc1ccc2c(F)cccc2c1 Amb25373918 [1,1,0,0,0,0|1,0,1]=4 2816 B14R2.1801 O=Cc1ccc2c(I)cccc2c1 Amb27608404 [1,1,0,0,0,0|1,0,1]=4 2817 B14R2.1801 O=Cc1ccc2c(O)cccc2c1 Amb26494469 [1,1,0,0,0,0|1,0,1]=4 2818 B14R2.1801 OCc1ccc2c(Br)cccc2c1 Amb22462915 [1,1,0,0,0,0|1,0,0]=3 2819 B14R2.1801 OCc1ccc2c(Cl)cccc2c1 Amb24346715 [1,1,0,0,0,0|1,0,0]=3 2820 B14R2.1801 OCc1ccc2c(Cl)cccc2n1 Amb26980812 [1,1,0,0,0,0|2,0,0]=4 2821 B14R2.1801 OCc1ccc2c(Cl)ccnc2c1 Amb28319993 [1,1,0,0,0,0|2,0,0]=4 2822 B14R2.1801 OCc1ccc2c(Cl)nccc2c1 Amb26014210 [1,1,0,0,0,0|2,0,0]=4 2823 B14R2.1801 OCc1ccc2c(F)cccc2c1 Amb25697123 [1,1,0,0,0,0|1,0,0]=3 2824 B14R2.1801 OCc1ccc2c(F)cccc2n1 Amb25143960 [1,1,0,0,0,0|2,0,0]=4 2825 B14R2.1801 OCc1ccc2c(O)cccc2c1 Amb22492716 [1,1,0,0,0,0|1,0,0]=3 2826 B14R2.1801 OCc1ccc2c(c1)NC=CC2=S Amb28144990 [1,1,0,0,0,0|2,0,0]=4 2827 B14R2.1801 OCc1cnc2c(Cl)cccc2c1 Amb25116072 [1,1,0,0,0,0|2,0,0]=4 2828 B14R2.1801 OCc1cnc2c(F)cccc2c1 Amb28460766 [1,1,0,0,0,0|2,0,0]=4 2829 B14R2.1801 Oc1cccc2cc(CBr)ccc12 Amb27642501 [1,1,0,0,0,0|1,0,0]=3 2830 B14R2.1801 Oc1cccc2cc(CCl)ccc12 Amb24730544 [1,1,0,0,0,0|1,0,0]=3 2831 B14R2.2332 BrCc1ccc2cc(Br)ccc2c1 Amb20247816 [1,1,0,0,0,0|1,0,0]=3 2832 B14R2.2332 BrCc1ccc2cc(I)ccc2c1 Amb27224131 [1,1,0,0,0,0|1,0,0]=3 2833 B14R2.2332 C#Cc1ccc2cc(O)ccc2c1 Amb24706763 [1,1,0,0,0,0|0,0,2]=4 2834 B14R2.2332 C=Cc1ccc2cc(O)ccc2c1 Amb22495804 [1,1,0,0,0,0|0,0,2]=4 2835 B14R2.2332 CCc1ccc2c(c1)C=CC(=O)N2 Amb18546031 [1,1,0,0,0,0|1,0,0]=3 2836 B14R2.2332 CCc1ccc2c(c1)C=CC(C)N2 Amb18559677 [1,1,0,0,0,0|1,0,1]=4 2837 B14R2.2332 CCc1ccc2c(c1)C=CC(N)C2 Amb17470498 [1,1,0,0,0,0|0,0,2]=4 2838 B14R2.2332 CCc1ccc2cc(C)ccc2c1 Amb26519635 [1,1,0,0,0,0|0,0,0]=2 2839 B14R2.2332 CCc1ccc2cc(F)ccc2n1 Amb27179995 [1,1,0,0,0,0|1,0,0]=3 2840 B14R2.2332 CCc1ccc2cc(N)ccc2n1 Amb24531670 [1,1,0,0,0,0|1,0,0]=3 2841 B14R2.2332 CCc1ccc2cc(N)cnc2c1 Amb27484867 [1,1,0,0,0,0|1,0,0]=3 2842 B14R2.2332 CCc1ccc2cc(O)ccc2c1 Amb8387657 [1,1,0,0,0,0|0,0,0]=2 2843 B14R2.2332 CCc1ccc2cc(O)ncc2c1 Amb28139990 [1,1,0,0,0,0|1,0,0]=3 2844 B14R2.2332 CCc1ccc2nc(Br)ccc2c1 Amb28349921 [1,1,0,0,0,0|1,0,0]=3 2845 B14R2.2332 CCc1ccc2nc(C)ccc2c1 Amb1994250 [1,1,0,0,0,0|1,0,0]=3 2846 B14R2.2332 CCc1ccc2nc(S)ccc2c1 Amb28317468 [1,1,0,0,0,0|1,0,0]=3 2847 B14R2.2332 CCc1cnc2cc(C)ccc2c1 Amb17334867 [1,1,0,0,0,0|1,0,0]=3 2848 B14R2.2332 CCc1cnc2cc(O)ccc2c1 Amb27974465 [1,1,0,0,0,0|1,0,0]=3 2849 B14R2.2332 CNc1ccc2c(c1)C=CC(=O)N2 Amb25800987 [1,1,0,0,0,0|2,0,0]=4 2850 B14R2.2332 CNc1ccc2cc(Br)ccc2c1 Amb27851207 [1,1,0,0,0,0|1,0,0]=3 2851 B14R2.2332 CNc1ccc2cc(Br)ccc2n1 Amb26980680 [1,1,0,0,0,0|2,0,0]=4 2852 B14R2.2332 CNc1ccc2cc(C)ccc2n1 Amb28193373 [1,1,0,0,0,0|2,0,0]=4 2853 B14R2.2332 CNc1ccc2cc(N)ccc2n1 Amb9310169 [1,1,0,0,0,0|2,0,0]=4 2854 B14R2.2332 COC1=CC2=CNC(=O)C=C2C=C1 Amb26603414 [1,1,0,0,0,0|1,0,0]=3 2855 B14R2.2332 COc1cc2ccc(Br)cc2cn1 Amb22735852 [1,1,0,0,0,0|1,0,0]=3 2856 B14R2.2332 COc1cc2ccc(N)cc2cn1 Amb22500898 [1,1,0,0,0,0|1,0,0]=3 2857 B14R2.2332 COc1ccc2c(c1)C=CC(=O)N2 Amb18546025 [1,1,0,0,0,0|1,0,0]=3 2858 B14R2.2332 COc1ccc2c(c1)C=CC(=O)O2 Amb19892427 [1,1,0,0,0,0|1,0,0]=3 2859 B14R2.2332 COc1ccc2c(c1)C=CC(C)N2 Amb18062225 [1,1,0,0,0,0|1,0,1]=4 2860 B14R2.2332 COc1ccc2c(c1)C=CC(N)C2 Amb17470521 [1,1,0,0,0,0|0,0,2]=4 2861 B14R2.2332 COc1ccc2c(c1)CNC(C)=C2 Amb27831495 [1,1,0,0,0,0|1,0,1]=4 2862 B14R2.2332 COc1ccc2c(c1)NCC(C)=C2 Amb18559659 [1,1,0,0,0,0|1,0,1]=4 2863 B14R2.2332 COc1ccc2c(n1)C=CC(=O)N2 Amb28255716 [1,1,0,0,0,0|2,0,0]=4 2864 B14R2.2332 COc1ccc2c[n+]([O-])ccc2c1 Amb22500172 [1,1,0,0,0,0|1,0,0]=3 2865 B14R2.2332 COc1ccc2cc(Br)ccc2c1 Amb6365011 [1,1,0,0,0,0|0,0,0]=2 2866 B14R2.2332 COc1ccc2cc(Br)ccc2n1 Amb10608831 [1,1,0,0,0,0|1,0,0]=3 2867 B14R2.2332 COc1ccc2cc(Br)cnc2c1 Amb20241799 [1,1,0,0,0,0|1,0,0]=3 2868 B14R2.2332 COc1ccc2cc(Br)cnc2n1 Amb27461909 [1,1,0,0,0,0|2,0,0]=4 2869 B14R2.2332 COc1ccc2cc(Br)ncc2n1 Amb25696481 [1,1,0,0,0,0|2,0,0]=4 2870 B14R2.2332 COc1ccc2cc(C)ccc2c1 Amb22749231 [1,1,0,0,0,0|0,0,0]=2 2871 B14R2.2332 COc1ccc2cc(C)ccc2n1 Amb28341767 [1,1,0,0,0,0|1,0,0]=3 2872 B14R2.2332 COc1ccc2cc(C)cnc2c1 Amb27865816 [1,1,0,0,0,0|1,0,0]=3 2873 B14R2.2332 COc1ccc2cc(C)ncc2c1 Amb21857935 [1,1,0,0,0,0|1,0,0]=3 2874 B14R2.2332 COc1ccc2cc(Cl)cnc2c1 Amb20242057 [1,1,0,0,0,0|1,0,0]=3 2875 B14R2.2332 COc1ccc2cc(Cl)ncc2c1 Amb24099959 [1,1,0,0,0,0|1,0,0]=3 2876 B14R2.2332 COc1ccc2cc(F)ccc2n1 Amb19959135 [1,1,0,0,0,0|1,0,0]=3 2877 B14R2.2332 COc1ccc2cc(I)ccc2c1 Amb22749216 [1,1,0,0,0,0|0,0,0]=2 2878 B14R2.2332 COc1ccc2cc(I)cnc2c1 Amb22497629 [1,1,0,0,0,0|1,0,0]=3 2879 B14R2.2332 COc1ccc2cc(N)ccc2c1 Amb18279523 [1,1,0,0,0,0|0,0,0]=2 2880 B14R2.2332 COc1ccc2cc(N)ccc2c1 Amb32652033 [1,1,0,0,0,0|0,0,0]=2 2881 B14R2.2332 COc1ccc2cc(N)ccc2n1 Amb9310368 [1,1,0,0,0,0|1,0,0]=3 2882 B14R2.2332 COc1ccc2cc(N)cnc2c1 Amb15741138 [1,1,0,0,0,0|1,0,0]=3 2883 B14R2.2332 COc1ccc2cc(N)cnc2c1 Amb9830331 [1,1,0,0,0,0|1,0,0]=3 2884 B14R2.2332 COc1ccc2cc(O)ccc2c1 Amb17689147 [1,1,0,0,0,0|0,0,0]=2 2885 B14R2.2332 COc1ccc2cc(O)cnc2c1 Amb26501443 [1,1,0,0,0,0|1,0,0]=3 2886 B14R2.2332 COc1ccc2cc(S)ccc2c1 Amb19040993 [1,1,0,0,0,0|0,0,0]=2 2887 B14R2.2332 COc1ccc2nc(Br)ccc2c1 Amb22263104 [1,1,0,0,0,0|1,0,0]=3 2888 B14R2.2332 COc1ccc2nc(Br)cnc2c1 Amb28252202 [1,1,0,0,0,0|2,0,0]=4 2889 B14R2.2332 COc1ccc2nc(C)ccc2c1 Amb1774422 [1,1,0,0,0,0|1,0,0]=3 2890 B14R2.2332 COc1ccc2nc(C)ccc2n1 Amb25961137 [1,1,0,0,0,0|2,0,0]=4 2891 B14R2.2332 COc1ccc2nc(C)ncc2c1 Amb23400994 [1,1,0,0,0,0|2,0,0]=4 2892 B14R2.2332 COc1ccc2nc(Cl)ccc2c1 Amb1773592 [1,1,0,0,0,0|1,0,0]=3 2893 B14R2.2332 COc1ccc2nc(Cl)ccc2n1 Amb27751724 [1,1,0,0,0,0|2,0,0]=4 2894 B14R2.2332 COc1ccc2nc(Cl)cnc2c1 Amb10603579 [1,1,0,0,0,0|2,0,0]=4 2895 B14R2.2332 COc1ccc2nc(Cl)ncc2c1 Amb22002322 [1,1,0,0,0,0|2,0,0]=4 2896 B14R2.2332 COc1ccc2nc(N)ccc2c1 Amb8386592 [1,1,0,0,0,0|1,0,0]=3 2897 B14R2.2332 COc1ccc2nc(N)cnc2c1 Amb25299182 [1,1,0,0,0,0|2,0,0]=4 2898 B14R2.2332 COc1ccc2nc(N)ncc2c1 Amb22727766 [1,1,0,0,0,0|2,0,0]=4 2899 B14R2.2332 COc1ccc2nc(S)ccc2c1 Amb25127710 [1,1,0,0,0,0|1,0,0]=3 2900 B14R2.2332 COc1cnc2c(c1)C=CC(=O)N2 Amb28366213 [1,1,0,0,0,0|2,0,0]=4 2901 B14R2.2332 COc1cnc2cc(Br)ccc2c1 Amb22236117 [1,1,0,0,0,0|1,0,0]=3 2902 B14R2.2332 COc1cnc2cc(Br)cnc2c1 Amb25324908 [1,1,0,0,0,0|2,0,0]=4 2903 B14R2.2332 COc1cnc2cc(Cl)ccc2n1 Amb28051712 [1,1,0,0,0,0|2,0,0]=4 2904 B14R2.2332 CSc1ccc2cc(Br)ccc2n1 Amb27438712 [1,1,0,0,0,0|1,1,0]=4 2905 B14R2.2332 CSc1ccc2cc(C)ccc2n1 Amb10809159 [1,1,0,0,0,0|1,1,0]=4 2906 B14R2.2332 CSc1ccc2cc(O)ccc2c1 Amb28202173 [1,1,0,0,0,0|0,1,0]=3 2907 B14R2.2332 Cc1ccc2cc(C#N)ccc2c1 Amb25074500 [1,1,0,0,0,0|1,0,1]=4 2908 B14R2.2332 Cc1ccc2cc(C=O)ccc2c1 Amb18647394 [1,1,0,0,0,0|1,0,1]=4 2909 B14R2.2332 Cc1ccc2cc(CBr)ccc2c1 Amb26858360 [1,1,0,0,0,0|1,0,0]=3 2910 B14R2.2332 Cc1ccc2cc(CBr)ccc2n1 Amb2723431 [1,1,0,0,0,0|2,0,0]=4 2911 B14R2.2332 Cc1ccc2cc(CCl)ccc2n1 Amb27495272 [1,1,0,0,0,0|2,0,0]=4 2912 B14R2.2332 Cc1ccc2cc(CN)ccc2c1 Amb24417810 [1,1,0,0,0,0|1,0,0]=3 2913 B14R2.2332 Cc1ccc2cc(CN)ccc2n1 Amb19103150 [1,1,0,0,0,0|2,0,0]=4 2914 B14R2.2332 Cc1ccc2cc(CO)ccc2c1 Amb2609097 [1,1,0,0,0,0|1,0,0]=3 2915 B14R2.2332 Cc1ccc2cc(CO)ccc2n1 Amb2723432 [1,1,0,0,0,0|2,0,0]=4 2916 B14R2.2332 Cc1ccc2cc(CS)ccc2n1 Amb24396712 [1,1,0,0,0,0|2,0,0]=4 2917 B14R2.2332 Cc1ccc2nc(CN)ccc2c1 Amb7968782 [1,1,0,0,0,0|2,0,0]=4 2918 B14R2.2332 Cc1ccc2nc(CO)ccc2c1 Amb25087751 [1,1,0,0,0,0|2,0,0]=4 2919 B14R2.2332 ClCc1cc2ccc(Cl)cc2cn1 Amb23401584 [1,1,0,0,0,0|2,0,0]=4 2920 B14R2.2332 ClCc1ccc2cc(Br)ccc2c1 Amb20247817 [1,1,0,0,0,0|1,0,0]=3 2921 B14R2.2332 ClCc1ccc2cc(Br)ccc2n1 Amb27624534 [1,1,0,0,0,0|2,0,0]=4 2922 B14R2.2332 ClCc1ccc2cc(Cl)ccc2c1 Amb27667811 [1,1,0,0,0,0|1,0,0]=3 2923 B14R2.2332 ClCc1ccc2cc(I)ccc2c1 Amb25364115 [1,1,0,0,0,0|1,0,0]=3 2924 B14R2.2332 ClCc1ccc2nc(Cl)ccc2c1 Amb23412029 [1,1,0,0,0,0|2,0,0]=4 2925 B14R2.2332 ClCc1cnc2cc(Br)ccc2c1 Amb27200337 [1,1,0,0,0,0|2,0,0]=4 2926 B14R2.2332 Clc1ccc2cc(CBr)ccc2n1 Amb23399862 [1,1,0,0,0,0|2,0,0]=4 2927 B14R2.2332 Clc1ccc2cc(CBr)cnc2c1 Amb27749704 [1,1,0,0,0,0|2,0,0]=4 2928 B14R2.2332 Clc1ccc2cc(CBr)ncc2c1 Amb23401585 [1,1,0,0,0,0|2,0,0]=4 2929 B14R2.2332 Clc1ccc2nc(CBr)ccc2c1 Amb27769061 [1,1,0,0,0,0|2,0,0]=4 2930 B14R2.2332 Fc1ccc2cc(CBr)ccc2c1 Amb27967811 [1,1,0,0,0,0|1,0,0]=3 2931 B14R2.2332 Fc1ccc2cc(CCl)ccc2c1 Amb25808017 [1,1,0,0,0,0|1,0,0]=3 2932 B14R2.2332 Fc1ccc2nc(CBr)ccc2c1 Amb27807998 [1,1,0,0,0,0|2,0,0]=4 2933 B14R2.2332 Fc1ccc2nc(CCl)ccc2c1 Amb25783280 [1,1,0,0,0,0|2,0,0]=4 2934 B14R2.2332 N#Cc1ccc2cc(Br)ccc2c1 Amb25824592 [1,1,0,0,0,0|1,0,1]=4 2935 B14R2.2332 N#Cc1ccc2cc(F)ccc2c1 Amb10840775 [1,1,0,0,0,0|1,0,1]=4 2936 B14R2.2332 N#Cc1ccc2cc(I)ccc2c1 Amb27463069 [1,1,0,0,0,0|1,0,1]=4 2937 B14R2.2332 N#Cc1ccc2cc(N)ccc2c1 Amb26319285 [1,1,0,0,0,0|1,0,1]=4 2938 B14R2.2332 N#Cc1ccc2cc(O)ccc2c1 Amb9786902 [1,1,0,0,0,0|1,0,1]=4 2939 B14R2.2332 N#[N+]c1ccc2cc(Br)ccc2c1 Amb27236610 [1,1,0,0,0,0|2,0,0]=4 2940 B14R2.2332 NCc1ccc2c(c1)C=CC(=O)O2 Amb27179086 [1,1,0,0,0,0|2,0,0]=4 2941 B14R2.2332 NCc1ccc2cc(Br)ccc2c1 Amb27624520 [1,1,0,0,0,0|1,0,0]=3 2942 B14R2.2332 NCc1ccc2cc(Br)ccc2n1 Amb17581742 [1,1,0,0,0,0|2,0,0]=4 2943 B14R2.2332 NCc1ccc2cc(Cl)ccc2n1 Amb17578605 [1,1,0,0,0,0|2,0,0]=4 2944 B14R2.2332 NCc1ccc2cc(F)ccc2c1 Amb26873958 [1,1,0,0,0,0|1,0,0]=3 2945 B14R2.2332 NCc1ccc2cc(F)ccc2n1 Amb17578278 [1,1,0,0,0,0|2,0,0]=4 2946 B14R2.2332 NCc1ccc2cc(I)ccc2c1 Amb25758903 [1,1,0,0,0,0|1,0,0]=3 2947 B14R2.2332 NCc1ccc2cc(I)ccc2n1 Amb17589034 [1,1,0,0,0,0|2,0,0]=4 2948 B14R2.2332 NCc1ccc2cc(O)ccc2c1 Amb19929962 [1,1,0,0,0,0|1,0,0]=3 2949 B14R2.2332 NCc1cnc2cc(Cl)ccc2c1 Amb17578607 [1,1,0,0,0,0|2,0,0]=4 2950 B14R2.2332 NOc1ccc2cc(Br)ccc2c1 Amb27188210 [1,1,0,0,0,0|1,0,0]=3 2951 B14R2.2332 Nc1ccc2cc(C=O)ccc2c1 Amb26317884 [1,1,0,0,0,0|1,0,1]=4 2952 B14R2.2332 Nc1ccc2cc(CBr)ccc2c1 Amb27177287 [1,1,0,0,0,0|1,0,0]=3 2953 B14R2.2332 Nc1ccc2cc(CCl)ccc2c1 Amb25839869 [1,1,0,0,0,0|1,0,0]=3 2954 B14R2.2332 Nc1ccc2cc(CO)ccc2c1 Amb25805513 [1,1,0,0,0,0|1,0,0]=3 2955 B14R2.2332 Nc1ccc2cc(CO)cnc2c1 Amb25132459 [1,1,0,0,0,0|2,0,0]=4 2956 B14R2.2332 Nc1ccc2nc(CCl)ccc2c1 Amb27260299 [1,1,0,0,0,0|2,0,0]=4 2957 B14R2.2332 O=C1C=Cc2cc(CBr)ccc2N1 Amb27186271 [1,1,0,0,0,0|2,0,0]=4 2958 B14R2.2332 O=C1C=Cc2cc(CBr)ccc2O1 Amb27808727 [1,1,0,0,0,0|2,0,0]=4 2959 B14R2.2332 O=C1C=Cc2cc(CO)ccc2O1 Amb24453573 [1,1,0,0,0,0|2,0,0]=4 2960 B14R2.2332 O=C1C=Cc2cc(OBr)ccc2O1 Amb27613246 [1,1,0,0,0,0|2,0,0]=4 2961 B14R2.2332 O=Cc1ccc2cc(Br)ccc2c1 Amb20247818 [1,1,0,0,0,0|1,0,1]=4 2962 B14R2.2332 O=Cc1ccc2cc(F)ccc2c1 Amb25367222 [1,1,0,0,0,0|1,0,1]=4 2963 B14R2.2332 O=Cc1ccc2cc(O)ccc2c1 Amb6384122 [1,1,0,0,0,0|1,0,1]=4 2964 B14R2.2332 OCc1cc2ccc(Br)cc2cn1 Amb23401588 [1,1,0,0,0,0|2,0,0]=4 2965 B14R2.2332 OCc1ccc2cc(Br)ccc2c1 Amb20620533 [1,1,0,0,0,0|1,0,0]=3 2966 B14R2.2332 OCc1ccc2cc(Br)ccc2n1 Amb17581802 [1,1,0,0,0,0|2,0,0]=4 2967 B14R2.2332 OCc1ccc2cc(Cl)ccc2c1 Amb25288600 [1,1,0,0,0,0|1,0,0]=3 2968 B14R2.2332 OCc1ccc2cc(Cl)ccc2n1 Amb17578623 [1,1,0,0,0,0|2,0,0]=4 2969 B14R2.2332 OCc1ccc2cc(Cl)ncc2c1 Amb26358383 [1,1,0,0,0,0|2,0,0]=4 2970 B14R2.2332 OCc1ccc2cc(F)ccc2c1 Amb28243209 [1,1,0,0,0,0|1,0,0]=3 2971 B14R2.2332 OCc1ccc2cc(F)ccc2n1 Amb17578291 [1,1,0,0,0,0|2,0,0]=4 2972 B14R2.2332 OCc1ccc2cc(I)ccc2c1 Amb24520867 [1,1,0,0,0,0|1,0,0]=3 2973 B14R2.2332 OCc1ccc2nc(O)ccc2c1 Amb24329369 [1,1,0,0,0,0|2,0,0]=4 2974 B14R2.2332 OCc1cnc2cc(Br)ccc2c1 Amb30594179 [1,1,0,0,0,0|2,0,0]=4 2975 B14R2.2332 OCc1cnc2cc(Cl)ccc2c1 Amb25372453 [1,1,0,0,0,0|2,0,0]=4 2976 B14R2.2332 OCc1cnc2cc(F)ccc2c1 Amb27588995 [1,1,0,0,0,0|2,0,0]=4 2977 B14R2.2332 Oc1ccc2cc(CBr)ccc2c1 Amb24724308 [1,1,0,0,0,0|1,0,0]=3 2978 B14R2.2332 Oc1ccc2cc(CCl)ccc2c1 Amb24536635 [1,1,0,0,0,0|1,0,0]=3 2979 B14R2.2973 CCC1(C)C=Cc2ccccc2O1 Amb32418107 [1,1,0,0,0,0|1,0,1]=4 2980 B14R2.2 CC(=O)Oc1coc2ccccc12 Amb6357855 [0,1,0,0,1,0|1,0,1]=4 2981 B14R2.2 CC(Br)Cc1csc2ccccc12 Amb27670238 [0,1,0,0,1,0|2,0,0]=4 2982 B14R2.2 CC(C)Nc1coc2ccccc12 Amb25158272 [0,1,0,0,1,0|2,0,0]=4 2983 B14R2.2 CC(C)Nc1csc2ccccc12 Amb27448120 [0,1,0,0,1,0|2,0,0]=4 2984 B14R2.2 CC(C)Oc1cnc2ccccn12 Amb27217591 [0,1,0,0,1,0|2,0,0]=4 2985 B14R2.2 CC(N)Cc1csc2ccccc12 Amb2237287 [0,1,0,0,1,0|2,0,0]=4 2986 B14R2.2 CC(N)Cn1ccc2ccccc21 Amb15701214 [0,1,0,0,1,0|2,0,0]=4 2987 B14R2.2 CC(O)CC1=CCc2ccccc21 Amb27970563 [0,1,0,0,1,0|1,0,1]=4 2988 B14R2.2 CC(O)Cc1coc2ccccc12 Amb28061306 [0,1,0,0,1,0|2,0,0]=4 2989 B14R2.2 CC(O)Cc1csc2ccccc12 Amb26944427 [0,1,0,0,1,0|2,0,0]=4 2990 B14R2.2 C[C@@H](N)Cc1csc2ccccc12 Amb33312707 [0,1,0,0,1,0|2,0,0]=4 2991 B14R2.2 C[C@@H](O)Cc1csc2ccccc12 Amb33312704 [0,1,0,0,1,0|2,0,0]=4 2992 B14R2.2 C[C@H](N)Cc1csc2ccccc12 Amb33312706 [0,1,0,0,1,0|2,0,0]=4 2993 B14R2.2 C[C@H](O)Cc1csc2ccccc12 Amb33312705 [0,1,0,0,1,0|2,0,0]=4 2994 B14R2.3 BrCCCc1csc2ccccc12 Amb26353125 [0,1,0,0,1,0|2,0,0]=4 2995 B14R2.3 BrCCCn1ccc2ccccc21 Amb10608812 [0,1,0,0,1,0|2,0,0]=4 2996 B14R2.3 CCCNc1csc2ccccc12 Amb27186106 [0,1,0,0,1,0|2,0,0]=4 2997 B14R2.3 CCCOn1cnc2ccccc21 Amb24725237 [0,1,0,0,1,0|2,0,0]=4 2998 B14R2.3 CCNCc1coc2ccccc12 Amb19649832 [0,1,0,0,1,0|2,0,0]=4 2999 B14R2.3 CCNCc1csc2ccccc12 Amb18994544 [0,1,0,0,1,0|2,0,0]=4 3000 B14R2.3 CCOCc1coc2ccccc12 Amb27193439 [0,1,0,0,1,0|1,0,0]=3 3001 B14R2.3 CCOCn1ccc2ccccc21 Amb27978166 [0,1,0,0,1,0|1,0,0]=3 3002 B14R2.3 CCOCn1cnc2ccccc21 Amb25065187 [0,1,0,0,1,0|2,0,0]=4 3003 B14R2.3 CCONc1nsc2ccccc12 Amb27458613 [0,1,0,0,1,0|2,0,0]=4 3004 B14R2.3 CNCCC1C=Cc2ccccc21 Amb27215471 [0,1,0,0,1,0|1,0,1]=4 3005 B14R2.3 CNCCc1csc2ccccc12 Amb18129924 [0,1,0,0,1,0|2,0,0]=4 3006 B14R2.3 CNCCn1ccc2ccccc21 Amb1792778 [0,1,0,0,1,0|2,0,0]=4 3007 B14R2.3 CNCCn1ccc2ccccc21 Amb6344835 [0,1,0,0,1,0|2,0,0]=4 3008 B14R2.3 COCCn1ccc2ccccc21 Amb28427993 [0,1,0,0,1,0|2,0,0]=4 3009 B14R2.3 COCOn1ccc2ccccc21 Amb28243604 [0,1,0,0,1,0|1,0,0]=3 3010 B14R2.3 CSCCn1ccc2ccccc21 Amb27414624 [0,1,0,0,1,0|2,0,0]=4 3011 B14R2.3 ClCCCC1C=Cc2ccccc21 Amb28320765 [0,1,0,0,1,0|1,0,1]=4 3012 B14R2.3 ClCCCc1coc2ccccc12 Amb35704102 [0,1,0,0,1,0|2,0,0]=4 3013 B14R2.3 ClCCCc1csc2ccccc12 Amb28193411 [0,1,0,0,1,0|2,0,0]=4 3014 B14R2.3 ClCCOc1csc2ccccc12 Amb27463408 [0,1,0,0,1,0|1,0,0]=3 3015 B14R2.3 NCCCc1csc2ccccc12 Amb18910203 [0,1,0,0,1,0|2,0,0]=4 3016 B14R2.3 NCCCn1ccc2ccccc21 Amb2370979 [0,1,0,0,1,0|2,0,0]=4 3017 B14R2.3 NCCCn1ccc2ccccc21 Amb30308 [0,1,0,0,1,0|2,0,0]=4 3018 B14R2.3 NCCCn1ccc2ccccc21 Amb8503274 [0,1,0,0,1,0|2,0,0]=4 3019 B14R2.3 NCCOc1cnc2ccccn12 Amb33146259 [0,1,0,0,1,0|2,0,0]=4 3020 B14R2.3 NCCOc1cnn2ccccc12 Amb33146814 [0,1,0,0,1,0|2,0,0]=4 3021 B14R2.3 NCCOc1csc2ccccc12 Amb33196991 [0,1,0,0,1,0|1,0,0]=3 3022 B14R2.3 NCCSc1coc2ccccc12 Amb18130031 [0,1,0,0,1,0|1,1,0]=4 3023 B14R2.3 OCCCc1coc2ccccc12 Amb25898468 [0,1,0,0,1,0|2,0,0]=4 3024 B14R2.3 OCCCc1csc2ccccc12 Amb25138282 [0,1,0,0,1,0|2,0,0]=4 3025 B14R2.3 OCCOc1nsc2ccccc12 Amb28429720 [0,1,0,0,1,0|2,0,0]=4 3026 B14R2.3 OCCSc1coc2ccccc12 Amb27399514 [0,1,0,0,1,0|1,1,0]=4 3027 B14R2.3 SCCCc1coc2ccccc12 Amb27196744 [0,1,0,0,1,0|2,0,0]=4 3028 B14R2.3 SCCCc1csc2ccccc12 Amb24405823 [0,1,0,0,1,0|2,0,0]=4 3029 B14R2.7 CCCn1ccc2c(Cl)cccc21 Amb27760231 [0,1,0,0,1,0|2,0,0]=4 3030 B14R2.7 CCCn1ccc2c(N)cccc21 Amb25998588 [0,1,0,0,1,0|2,0,0]=4 3031 B14R2.7 CCNn1ccc2c(N)cccc21 Amb27186294 [0,1,0,0,1,0|2,0,0]=4 3032 B14R2.7 CCNn1ccc2c(O)cccc21 Amb27623519 [0,1,0,0,1,0|2,0,0]=4 3033 B14R2.95 CCC(=O)c1coc2ccccc12 Amb25086526 [0,1,0,0,1,0|2,0,0]=4 3034 B14R2.95 CCC(=O)c1csc2ccccc12 Amb9212755 [0,1,0,0,1,0|2,0,0]=4 3035 B14R2.95 CCC(Br)c1csc2ccccc12 Amb27833133 [0,1,0,0,1,0|2,0,0]=4 3036 B14R2.95 CCC(Cl)c1coc2ccccc12 Amb35704190 [0,1,0,0,1,0|2,0,0]=4 3037 B14R2.95 CC[C@@H](O)c1coc2ccccc12 Amb27634735 [0,1,0,0,1,0|2,0,0]=4 3038 B14R2.95 CC[C@H](O)c1coc2ccccc12 Amb27590084 [0,1,0,0,1,0|2,0,0]=4 3039 B14R2.467 CCCc1coc2cc(O)ccc12 Amb28199838 [0,1,0,0,1,0|2,0,0]=4 3040 B14R2.467 CCCn1ccc2cc(N)ccc21 Amb13951334 [0,1,0,0,1,0|2,0,0]=4 3041 B14R2.467 CCCn1ccc2cc(N)ccc21 Amb8855660 [0,1,0,0,1,0|2,0,0]=4 3042 B14R2.467 CCOc1noc2cc(O)ccc12 Amb24379028 [0,1,0,0,1,0|2,0,0]=4 3043 B14R2.510 CCNc1cn(C)c2ccccc12 Amb27946726 [0,1,0,0,1,0|2,0,0]=4 3044 B14R2.510 CCNn1cc(C)c2ccccc21 Amb27848655 [0,1,0,0,1,0|2,0,0]=4 3045 B14R2.510 CCOC1=NC(=N)c2ccccc21 Amb27847155 [0,1,0,0,1,0|1,0,0]=3 3046 B14R2.510 CCOC1NC(=O)c2ccccc21 Amb2667779 [0,1,0,0,1,0|1,0,1]=4 3047 B14R2.510 CCOc1nn(C)c2ccccc12 Amb23560579 [0,1,0,0,1,0|2,0,0]=4 3048 B14R2.510 CCSc1cn(C)c2ccccc12 Amb27777517 [0,1,0,0,1,0|1,1,0]=4 3049 B14R2.510 CC\C=C1/OC(=O)c2ccccc21 Amb22730297 [0,1,0,0,1,0|2,0,0]=4 3050 B14R2.510 CO\N=C1/C=C(O)c2ccccc21 Amb345418 [0,1,0,0,1,0|2,0,0]=4 3051 B14R2.517 CCCc1c(C)cc2ccccn12 Amb27264631 [0,1,0,0,1,0|2,0,0]=4 3052 B14R2.517 CCOC1C(=O)Cc2ccccc21 Amb28202366 [0,1,0,0,1,0|0,0,2]=4 3053 B14R2.517 CCOc1c(Br)oc2ccccc12 Amb27633626 [0,1,0,0,1,0|1,0,0]=3 3054 B14R2.517 CCOc1c2ccccc2cn1C Amb28365886 [0,1,0,0,1,0|1,0,0]=3 3055 B14R2.517 CCSc1c(C)cc2ccccn12 Amb27240235 [0,1,0,0,1,0|1,1,0]=4 3056 B14R2.517 CC\C=C1\C(=O)Nc2ccccc21 Amb27970958 [0,1,0,0,1,0|2,0,0]=4 3057 B14R2.517 CC\N=C1\C(=O)Nc2ccccc21 Amb25995413 [0,1,0,0,1,0|2,0,0]=4 3058 B14R2.6368 CCCn1ccc2cccc(N)c21 Amb27597273 [0,1,0,0,1,0|2,0,0]=4 3059 B14R2.6368 CCOc1nsc2cccc(Cl)c12 Amb27201813 [0,1,0,0,1,0|2,0,0]=4 3060 B14R2.6419 CCCc1ccc2ccc(C)cn12 Amb27670060 [0,1,0,0,1,0|2,0,0]=4 3061 B14R2.6419 CCCn1ccc2ccc(N)cc21 Amb8941149 [0,1,0,0,1,0|2,0,0]=4 3062 B14R2.6419 CCOC1=NCc2ccc(Cl)cc21 Amb27634224 [0,1,0,0,1,0|1,0,1]=4 3063 B14R2.6419 CCOn1ccc2ccc(O)cc21 Amb27633303 [0,1,0,0,1,0|1,0,0]=3 3064 B14R2.44 CCOc1nc2ccccc2n1C Amb27867406 [0,1,0,0,1,0|2,0,0]=4 3065 B14R2.44 CC\C=C1\Oc2ccccc2C1=O Amb24491384 [0,1,0,0,1,0|2,0,0]=4 3066 B14R2.67 BrCCCc1cc2ccccc2s1 Amb24566656 [0,1,0,0,1,0|2,0,0]=4 3067 B14R2.67 BrCCOc1nc2ccccc2s1 Amb28323650 [0,1,0,0,1,0|2,0,0]=4 3068 B14R2.67 CCCCC1=Cc2ccccc2C1 Amb15692408 [0,1,0,0,1,0|1,0,1]=4 3069 B14R2.67 CCCCc1cc2ccccc2o1 Amb4019508 [0,1,0,0,1,0|2,0,0]=4 3070 B14R2.67 CCCSc1cc2ccccc2o1 Amb27968000 [0,1,0,0,1,0|1,1,0]=4 3071 B14R2.67 CCNCc1cc2ccccc2o1 Amb20623588 [0,1,0,0,1,0|2,0,0]=4 3072 B14R2.67 CCNCc1cc2ccccc2o1 Amb4061617 [0,1,0,0,1,0|2,0,0]=4 3073 B14R2.67 CCNCc1cc2ccccc2s1 Amb21959930 [0,1,0,0,1,0|2,0,0]=4 3074 B14R2.67 CCNCc1cc2ccccc2s1 Amb2592066 [0,1,0,0,1,0|2,0,0]=4 3075 B14R2.67 CCNSc1cc2ccccc2s1 Amb27631732 [0,1,0,0,1,0|1,1,0]=4 3076 B14R2.67 CCOCc1cc2ccccc2o1 Amb27965776 [0,1,0,0,1,0|1,0,0]=3 3077 B14R2.67 CCOCc1nc2ccccc2o1 Amb28145999 [0,1,0,0,1,0|2,0,0]=4 3078 B14R2.67 CCON=C1Cc2ccccc2C1 Amb27261224 [0,1,0,0,1,0|0,0,2]=4 3079 B14R2.67 CNCCc1cc2ccccc2s1 Amb19648794 [0,1,0,0,1,0|2,0,0]=4 3080 B14R2.67 COCCc1cc2ccccc2s1 Amb22371692 [0,1,0,0,1,0|2,0,0]=4 3081 B14R2.67 ClCCCc1cc2ccccc2o1 Amb27392260 [0,1,0,0,1,0|2,0,0]=4 3082 B14R2.67 ICCCc1cc2ccccc2s1 Amb27962458 [0,1,0,0,1,0|2,0,0]=4 3083 B14R2.67 NCCCc1cc2ccccc2o1 Amb18559434 [0,1,0,0,1,0|2,0,0]=4 3084 B14R2.67 NCCCc1cc2ccccc2s1 Amb27810749 [0,1,0,0,1,0|2,0,0]=4 3085 B14R2.67 NCCCc1cc2ccccn2c1 Amb18560934 [0,1,0,0,1,0|2,0,0]=4 3086 B14R2.67 NCCCn1cc2ccccc2c1 Amb17594417 [0,1,0,0,1,0|2,0,0]=4 3087 B14R2.67 NCCCn1cc2ccccc2c1 Amb22001980 [0,1,0,0,1,0|2,0,0]=4 3088 B14R2.67 NCCOc1cc2ccccc2s1 Amb33312160 [0,1,0,0,1,0|1,0,0]=3 3089 B14R2.67 NCCOc1cn2ccccc2n1 Amb33446723 [0,1,0,0,1,0|2,0,0]=4 3090 B14R2.67 NCCOc1nc2ccccc2s1 Amb18988874 [0,1,0,0,1,0|2,0,0]=4 3091 B14R2.67 NCCOc1nc2ccccc2s1 Amb19373747 [0,1,0,0,1,0|2,0,0]=4 3092 B14R2.67 OCCCc1cc2ccccc2o1 Amb28341346 [0,1,0,0,1,0|2,0,0]=4 3093 B14R2.67 OCCCc1cc2ccccc2s1 Amb24072161 [0,1,0,0,1,0|2,0,0]=4 3094 B14R2.67 OCCSc1cc2ccccc2o1 Amb27653068 [0,1,0,0,1,0|1,1,0]=4 3095 B14R2.67 OCCSc1cc2ccccc2s1 Amb27634199 [0,1,0,0,1,0|1,1,0]=4 3096 B14R2.67 SCCCc1cc2ccccc2o1 Amb27851595 [0,1,0,0,1,0|2,0,0]=4 3097 B14R2.67 SCCCc1cc2ccccc2s1 Amb26441208 [0,1,0,0,1,0|2,0,0]=4 3098 B14R2.106 CCCc1cc2ccc(Br)cn2c1 Amb32863606 [0,1,0,0,1,0|2,0,0]=4 3099 B14R2.106 CCCc1cc2ccc(F)cn2c1 Amb32863617 [0,1,0,0,1,0|2,0,0]=4 3100 B14R2.106 CCCc1cc2ccc(N)cn2c1 Amb32863625 [0,1,0,0,1,0|2,0,0]=4 3101 B14R2.106 CCOc1cn2cc(Br)ccc2n1 Amb28183994 [0,1,0,0,1,0|2,0,0]=4 3102 B14R2.106 CCOc1nc2cc(Br)ccc2o1 Amb24727583 [0,1,0,0,1,0|2,0,0]=4 3103 B14R2.106 CCOc1nc2cc(C)ccc2o1 Amb25202154 [0,1,0,0,1,0|2,0,0]=4 3104 B14R2.106 CCOc1nc2cc(Cl)ccc2o1 Amb27873771 [0,1,0,0,1,0|2,0,0]=4 3105 B14R2.106 CCOc1nc2cc(F)ccc2o1 Amb25938101 [0,1,0,0,1,0|2,0,0]=4 3106 B14R2.106 CCOc1nc2cc(I)ccc2o1 Amb26012679 [0,1,0,0,1,0|2,0,0]=4 3107 B14R2.106 CCOc1nc2cc(N)ccc2o1 Amb24544500 [0,1,0,0,1,0|2,0,0]=4 3108 B14R2.106 CCOc1nc2cc(N)ccc2s1 Amb26870372 [0,1,0,0,1,0|2,0,0]=4 3109 B14R2.106 CCOc1nc2cc(O)ccc2o1 Amb26032822 [0,1,0,0,1,0|2,0,0]=4 3110 B14R2.106 CCOc1nc2ccc(Br)cc2o1 Amb27192252 [0,1,0,0,1,0|2,0,0]=4 3111 B14R2.106 CCOc1nc2ccc(Br)cc2s1 Amb27613244 [0,1,0,0,1,0|2,0,0]=4 3112 B14R2.106 CCOc1nc2ccc(Cl)cc2o1 Amb27192256 [0,1,0,0,1,0|2,0,0]=4 3113 B14R2.106 CCOc1nc2ccc(I)cc2o1 Amb25202153 [0,1,0,0,1,0|2,0,0]=4 3114 B14R2.106 CCOc1nc2ccc(N)cc2o1 Amb25762376 [0,1,0,0,1,0|2,0,0]=4 3115 B14R2.106 CCOc1nc2ccc(N)cc2s1 Amb18130099 [0,1,0,0,1,0|2,0,0]=4 3116 B14R2.106 CCOc1nc2ccc(O)cc2o1 Amb26927487 [0,1,0,0,1,0|2,0,0]=4 3117 B14R2.106 CCOc1nc2ccc(O)cc2s1 Amb24596706 [0,1,0,0,1,0|2,0,0]=4 3118 B14R2.106 CCOc1nc2ccc(S)cc2o1 Amb28140789 [0,1,0,0,1,0|2,0,0]=4 3119 B14R2.111 CCCC1=Cc2cccc(Cl)c2C1 Amb20242794 [0,1,0,0,1,0|1,0,1]=4 3120 B14R2.111 CCOc1nc2c(Br)cccc2o1 Amb26442298 [0,1,0,0,1,0|2,0,0]=4 3121 B14R2.111 CCOc1nc2c(Br)cccc2s1 Amb27748658 [0,1,0,0,1,0|2,0,0]=4 3122 B14R2.111 CCOc1nc2c(C)cccc2o1 Amb25249267 [0,1,0,0,1,0|2,0,0]=4 3123 B14R2.111 CCOc1nc2c(F)cccc2o1 Amb25963775 [0,1,0,0,1,0|2,0,0]=4 3124 B14R2.111 CCOc1nc2c(I)cccc2o1 Amb26032823 [0,1,0,0,1,0|2,0,0]=4 3125 B14R2.111 CCOc1nc2c(N)cccc2o1 Amb25893951 [0,1,0,0,1,0|2,0,0]=4 3126 B14R2.111 CCOc1nc2c(S)cccc2o1 Amb24558770 [0,1,0,0,1,0|2,0,0]=4 3127 B14R2.111 CCOc1nc2cccc(Br)c2o1 Amb27192254 [0,1,0,0,1,0|2,0,0]=4 3128 B14R2.111 CCOc1nc2cccc(C)c2o1 Amb27614112 [0,1,0,0,1,0|2,0,0]=4 3129 B14R2.111 CCOc1nc2cccc(Cl)c2o1 Amb26595389 [0,1,0,0,1,0|2,0,0]=4 3130 B14R2.111 CCOc1nc2cccc(F)c2o1 Amb26574415 [0,1,0,0,1,0|2,0,0]=4 3131 B14R2.111 CCOc1nc2cccc(I)c2o1 Amb26567466 [0,1,0,0,1,0|2,0,0]=4 3132 B14R2.111 CCOc1nc2cccc(N)c2o1 Amb26416531 [0,1,0,0,1,0|2,0,0]=4 3133 B14R2.111 CCOc1nc2cccc(O)c2o1 Amb28245442 [0,1,0,0,1,0|2,0,0]=4 3134 B14R2.768 CC(=O)Oc1cc2ccccc2s1 Amb27959183 [0,1,0,0,1,0|1,0,1]=4 3135 B14R2.768 CC(Br)Cc1cc2ccccc2s1 Amb33336618 [0,1,0,0,1,0|2,0,0]=4 3136 B14R2.768 CC(C)Oc1nc2ccccc2o1 Amb27463472 [0,1,0,0,1,0|2,0,0]=4 3137 B14R2.768 CC(N)Cc1cc2ccccc2s1 Amb19649530 [0,1,0,0,1,0|2,0,0]=4 3138 B14R2.768 CC(N)Cc1cc2ccccn2c1 Amb5736009 [0,1,0,0,1,0|2,0,0]=4 3139 B14R2.768 CC(O)Cc1cc2ccccc2o1 Amb28318205 [0,1,0,0,1,0|2,0,0]=4 3140 B14R2.768 CC(O)Cc1cc2ccccc2s1 Amb33313235 [0,1,0,0,1,0|2,0,0]=4 3141 B14R2.768 C[C@@H](N)Cc1cc2ccccc2s1 Amb33449035 [0,1,0,0,1,0|2,0,0]=4 3142 B14R2.768 C[C@@H](O)Cc1cc2ccccc2s1 Amb33312829 [0,1,0,0,1,0|2,0,0]=4 3143 B14R2.768 C[C@H](N)Cc1cc2ccccc2s1 Amb33312831 [0,1,0,0,1,0|2,0,0]=4 3144 B14R2.768 C[C@H](O)Cc1cc2ccccc2s1 Amb33312830 [0,1,0,0,1,0|2,0,0]=4 3145 B14R2.972 CCC(C)c1cc2ccccc2o1 Amb8387757 [0,1,0,0,1,0|2,0,0]=4 3146 B14R2.972 CCC(N)c1cc2ccccc2o1 Amb18967664 [0,1,0,0,1,0|2,0,0]=4 3147 B14R2.972 CCC(O)c1cc2ccccc2s1 Amb27489232 [0,1,0,0,1,0|2,0,0]=4 3148 B14R2.972 CC[C@@H](N)c1cc2ccccc2s1 Amb27398669 [0,1,0,0,1,0|2,0,0]=4 3149 B14R2.475 CCCc1ccc2occ(C)c2c1 Amb27190875 [0,1,0,0,1,0|2,0,0]=4 3150 B14R2.475 CCOc1ccc2c(c1)C(=O)CC2 Amb10021525 [0,1,0,0,1,0|0,0,2]=4 3151 B14R2.475 CCOc1ccc2c(c1)C(=O)CO2 Amb9372562 [0,1,0,0,1,0|1,0,1]=4 3152 B14R2.475 CCOc1ccc2ccn(C)c2c1 Amb27623614 [0,1,0,0,1,0|1,0,0]=3 3153 B14R2.475 CCOc1ccc2ncn(C)c2c1 Amb21971801 [0,1,0,0,1,0|2,0,0]=4 3154 B14R2.475 CCOc1ccc2occ(C)c2c1 Amb27256767 [0,1,0,0,1,0|1,0,0]=3 3155 B14R2.475 CCOc1ccc2onc(N)c2c1 Amb23402959 [0,1,0,0,1,0|2,0,0]=4 3156 B14R2.583 CCOc1cc2nccn2cc1Br Amb33714921 [0,1,0,0,1,0|2,0,0]=4 3157 B14R2.587 CCOc1cc(Cl)c2ccsc2n1 Amb27209720 [0,1,0,0,1,0|2,0,0]=4 3158 B14R2.808 CCOc1ccc2scnc2c1N Amb9310806 [0,1,0,0,1,0|2,0,0]=4 3159 B14R2.966 CCC(Cl)c1ccc2sccc2c1 Amb35615586 [0,1,0,0,1,0|2,0,0]=4 3160 B14R2.966 CC[C@H](N)c1ccc2occc2c1 Amb27461356 [0,1,0,0,1,0|2,0,0]=4 3161 B14R2.991 BrCCCc1ccc2occc2c1 Amb25694389 [0,1,0,0,1,0|2,0,0]=4 3162 B14R2.991 BrCCCc1ccc2sccc2c1 Amb30031022 [0,1,0,0,1,0|2,0,0]=4 3163 B14R2.991 BrCCOc1ccc2ncsc2c1 Amb32414135 [0,1,0,0,1,0|2,0,0]=4 3164 B14R2.991 CCNCc1ccc2sccc2c1 Amb1995216 [0,1,0,0,1,0|2,0,0]=4 3165 B14R2.991 CNCCc1ccc2occc2c1 Amb18141342 [0,1,0,0,1,0|2,0,0]=4 3166 B14R2.991 CNCCc1ccc2sccc2c1 Amb18676593 [0,1,0,0,1,0|2,0,0]=4 3167 B14R2.991 ClCCCc1ccc2sccc2c1 Amb35627590 [0,1,0,0,1,0|2,0,0]=4 3168 B14R2.991 FCCNc1ccc2sccc2c1 Amb27609323 [0,1,0,0,1,0|2,0,0]=4 3169 B14R2.991 FCCOc1ccc2ccsc2c1 Amb27200772 [0,1,0,0,1,0|1,0,0]=3 3170 B14R2.991 N#CCOc1ccc2ccoc2c1 Amb28061332 [0,1,0,0,1,0|1,0,1]=4 3171 B14R2.991 NCCCc1ccc2occc2c1 Amb18676612 [0,1,0,0,1,0|2,0,0]=4 3172 B14R2.991 NCCCc1ccc2sccc2c1 Amb18142286 [0,1,0,0,1,0|2,0,0]=4 3173 B14R2.991 NCCOc1ccc2ncsc2c1 Amb17513156 [0,1,0,0,1,0|2,0,0]=4 3174 B14R2.991 NCCOc1ccc2occc2c1 Amb33344703 [0,1,0,0,1,0|1,0,0]=3 3175 B14R2.991 OCCCc1ccc2occc2c1 Amb25072828 [0,1,0,0,1,0|2,0,0]=4 3176 B14R2.991 OCCNc1ccc2ccoc2c1 Amb28189858 [0,1,0,0,1,0|2,0,0]=4 3177 B14R2.991 OCCOc1ccc2ncsc2c1 Amb17513169 [0,1,0,0,1,0|2,0,0]=4 3178 B14R2.991 SCCCc1ccc2occc2c1 Amb33343235 [0,1,0,0,1,0|2,0,0]=4 3179 B14R2.1008 CC(=O)Oc1ccc2ccoc2c1 Amb27796472 [0,1,0,0,1,0|1,0,1]=4 3180 B14R2.1008 CC(=O)Oc1ccc2occc2c1 Amb27441514 [0,1,0,0,1,0|1,0,1]=4 3181 B14R2.1008 CC(=O)Oc1ccc2sccc2c1 Amb28410654 [0,1,0,0,1,0|1,0,1]=4 3182 B14R2.1008 CC(Br)Cc1ccc2occc2c1 Amb33432522 [0,1,0,0,1,0|2,0,0]=4 3183 B14R2.1008 CC(C)Oc1ccc2nccn2c1 Amb25308201 [0,1,0,0,1,0|2,0,0]=4 3184 B14R2.1008 CC(N)Cc1ccc2ccoc2c1 Amb27799281 [0,1,0,0,1,0|2,0,0]=4 3185 B14R2.1008 CC(N)Cc1ccc2occc2c1 Amb18676616 [0,1,0,0,1,0|2,0,0]=4 3186 B14R2.1008 CC(N)Cc1ccc2occc2c1 Amb22410847 [0,1,0,0,1,0|2,0,0]=4 3187 B14R2.1008 CC(N)Cc1ccc2sccc2c1 Amb18675376 [0,1,0,0,1,0|2,0,0]=4 3188 B14R2.1008 CC(O)Cc1ccc2occc2c1 Amb33344813 [0,1,0,0,1,0|2,0,0]=4 3189 B14R2.1008 C[C@@H](O)Cc1ccc2occc2c1 Amb33344026 [0,1,0,0,1,0|2,0,0]=4 3190 B14R2.1008 C[C@H](N)Cc1ccc2occc2c1 Amb28313286 [0,1,0,0,1,0|2,0,0]=4 3191 B14R2.1008 C[C@H](O)Cc1ccc2occc2c1 Amb33344364 [0,1,0,0,1,0|2,0,0]=4 3192 B14R2.6400 CCOc1ccc2c(c1)CC(=O)N2 Amb8629502 [0,1,0,0,1,0|1,0,1]=4 3193 B14R2.6400 CCOc1ccc2c(c1)CC(=O)O2 Amb27877568 [0,1,0,0,1,0|1,0,1]=4 3194 B14R2.6400 CCOc1ccc2c(c1)NC(=O)S2 Amb27470108 [0,1,0,0,1,0|2,0,0]=4 3195 B14R2.6400 CCOc1ccc2c(c1)OC(=O)C2 Amb27621620 [0,1,0,0,1,0|1,0,1]=4 3196 B14R2.6400 CCOc1ccc2c(c1)OC(=O)N2 Amb25759077 [0,1,0,0,1,0|2,0,0]=4 3197 B14R2.6400 CCOc1ccc2c(c1)SC(=O)C2 Amb28286812 [0,1,0,0,1,0|1,0,1]=4 3198 B14R2.6400 CCOc1ccc2c(c1)SC(=S)N2 Amb18043612 [0,1,0,0,1,0|2,0,0]=4 3199 B14R2.6400 CCOc1ccc2cc(Br)sc2c1 Amb28323563 [0,1,0,0,1,0|1,0,0]=3 3200 B14R2.6400 CCOc1ccc2cc(C)cn2c1 Amb28051704 [0,1,0,0,1,0|1,0,0]=3 3201 B14R2.6400 CCOc1ccc2nc(Br)sc2c1 Amb4449848 [0,1,0,0,1,0|2,0,0]=4 3202 B14R2.6400 CCOc1ccc2nc(C)oc2c1 Amb23447057 [0,1,0,0,1,0|2,0,0]=4 3203 B14R2.6400 CCOc1ccc2nc(C)sc2c1 Amb4010804 [0,1,0,0,1,0|2,0,0]=4 3204 B14R2.6400 CCOc1ccc2nc(Cl)oc2c1 Amb26990139 [0,1,0,0,1,0|2,0,0]=4 3205 B14R2.6400 CCOc1ccc2nc(Cl)sc2c1 Amb3318922 [0,1,0,0,1,0|2,0,0]=4 3206 B14R2.6400 CCOc1ccc2nc(I)oc2c1 Amb25922167 [0,1,0,0,1,0|2,0,0]=4 3207 B14R2.6400 CCOc1ccc2nc(I)sc2c1 Amb27874675 [0,1,0,0,1,0|2,0,0]=4 3208 B14R2.6400 CCOc1ccc2nc(N)oc2c1 Amb27657849 [0,1,0,0,1,0|2,0,0]=4 3209 B14R2.6400 CCOc1ccc2nc(N)sc2c1 Amb6335211 [0,1,0,0,1,0|2,0,0]=4 3210 B14R2.6400 CCOc1ccc2nc(N)sc2c1 Amb8469875 [0,1,0,0,1,0|2,0,0]=4 3211 B14R2.6400 CCOc1ccc2nc(O)sc2c1 Amb6307807 [0,1,0,0,1,0|2,0,0]=4 3212 B14R2.6400 CCOc1ccc2nc(S)sc2c1 Amb2196495 [0,1,0,0,1,0|2,0,0]=4 3213 B14R2.6400 CCOc1ccc2oc(C)nc2c1 Amb26530603 [0,1,0,0,1,0|2,0,0]=4 3214 B14R2.6400 CCOc1ccc2oc(Cl)nc2c1 Amb26905827 [0,1,0,0,1,0|2,0,0]=4 3215 B14R2.6400 CCOc1ccc2oc(F)nc2c1 Amb27665733 [0,1,0,0,1,0|2,0,0]=4 3216 B14R2.6400 CCOc1ccc2oc(I)nc2c1 Amb27633980 [0,1,0,0,1,0|2,0,0]=4 3217 B14R2.6400 CCOc1ccc2oc(N)nc2c1 Amb23594670 [0,1,0,0,1,0|2,0,0]=4 3218 B14R2.6400 CCOc1ccc2oc(O)nc2c1 Amb26575566 [0,1,0,0,1,0|2,0,0]=4 3219 B14R2.6400 CCOc1ccc2sc(N)nc2c1 Amb2613729 [0,1,0,0,1,0|2,0,0]=4 3220 B14R2.6412 CCNc1ccc2c(ccn2C)c1 Amb18270552 [0,1,0,0,1,0|2,0,0]=4 3221 B14R2.6412 CCOc1ccc2c(C)noc2c1 Amb27185987 [0,1,0,0,1,0|2,0,0]=4 3222 B14R2.6412 CCOc1ccc2c(Cl)csc2c1 Amb27208999 [0,1,0,0,1,0|1,0,0]=3 3223 B14R2.6412 CCOc1ccc2c(N)noc2c1 Amb23402960 [0,1,0,0,1,0|2,0,0]=4 3224 B14R2.6412 CCOc1ccc2c(O)csc2c1 Amb4007654 [0,1,0,0,1,0|1,0,0]=3 3225 B14R2.6412 CCOc1ccc2c(O)noc2c1 Amb27451653 [0,1,0,0,1,0|2,0,0]=4 3226 B14R2.6412 CCOc1ccc2c(c1)OCC2=O Amb2504927 [0,1,0,0,1,0|1,0,1]=4 3227 B14R2.6412 CCOc1ccc2c(c1)SCC2=O Amb4314585 [0,1,0,0,1,0|1,0,1]=4 3228 B16R2.599 CCOC1=Nc2ccccc2C(=O)NC1 Amb24104400 [0,1,0,0,0,1|1,0,1]=4 3229 B16R2.1213 COC(=O)C1=Cc2ccccc2OC=C1 Amb2617233 [0,1,0,0,0,1|2,0,0]=4 3230 B16R2.2308 CCOc1ccc2ccccc2c(=O)c1 Amb24092055 [0,1,0,0,0,1|0,0,0]=2 3231 B16R2.20891 CCOc1cc2c(cc1C)C=CC=CC2 Amb24085965 [0,1,0,0,0,1|0,0,0]=2 3232 B16R2.20891 CCOc1cc2c(cc1C)C=CCC=C2 Amb24104412 [0,1,0,0,0,1|0,0,0]=2 3233 B16R2.20891 CCOc1cc2c(cc1C)CC=CC=C2 Amb24104410 [0,1,0,0,0,1|0,0,0]=2 3234 B16R2.477 C=C(Br)CCc1ccc2ccccc2c1 Amb6299568 [0,2,0,0,0,0|1,0,1]=4 3235 B16R2.477 C=C(C)CCc1ccc2ccccc2c1 Amb6299570 [0,2,0,0,0,0|1,0,0]=3 3236 B16R2.477 C=C(Cl)CCc1ccc2ccccc2c1 Amb6299566 [0,2,0,0,0,0|1,0,1]=4 3237 B16R2.477 CC(=O)CCc1ccc2ccccc2c1 Amb28041962 [0,2,0,0,0,0|1,0,0]=3 3238 B16R2.477 CC(=O)CCc1ccc2ccccc2n1 Amb25122255 [0,2,0,0,0,0|2,0,0]=4 3239 B16R2.477 CC(=O)CCc1ccc2cccnc2c1 Amb24732296 [0,2,0,0,0,0|2,0,0]=4 3240 B16R2.477 CC(=O)CCc1ccc2ncccc2c1 Amb24345319 [0,2,0,0,0,0|2,0,0]=4 3241 B16R2.477 CC(=O)CCc1cnc2ccccc2c1 Amb8454845 [0,2,0,0,0,0|2,0,0]=4 3242 B16R2.477 CC(=O)COc1ccc2ncccc2c1 Amb18354948 [0,2,0,0,0,0|1,0,0]=3 3243 B16R2.477 CC(=O)CSc1ccc2ccccc2c1 Amb4857692 [0,2,0,0,0,0|0,1,0]=3 3244 B16R2.477 CC(=O)CSc1ccc2ccccc2n1 Amb26042230 [0,2,0,0,0,0|1,1,0]=4 3245 B16R2.477 CC(=O)NNc1ccc2ccccc2c1 Amb22039473 [0,2,0,0,0,0|1,0,1]=4 3246 B16R2.477 CC(=O)OCc1ccc2ccccc2n1 Amb528116 [0,2,0,0,0,0|1,0,1]=4 3247 B16R2.477 CC(=O)\C=C\c1ccc2ccccc2c1 Amb27603881 [0,2,0,0,0,0|1,0,1]=4 3248 B16R2.477 CC(Br)\C=C\c1ccc2ccccc2c1 Amb27402324 [0,2,0,0,0,0|1,0,0]=3 3249 B16R2.477 CC(Br)\C=C\c1ccc2ncccc2c1 Amb27480429 [0,2,0,0,0,0|2,0,0]=4 3250 B16R2.477 CC(C)CNc1ccc2ncccc2c1 Amb19086735 [0,2,0,0,0,0|2,0,0]=4 3251 B16R2.477 CC(C)CNc1cnc2ccccc2c1 Amb9556785 [0,2,0,0,0,0|2,0,0]=4 3252 B16R2.477 CC(C)NCc1ccc2ccccc2c1 Amb6685361 [0,2,0,0,0,0|1,0,0]=3 3253 B16R2.477 CC(C)NCc1cnc2ccccc2c1 Amb7589147 [0,2,0,0,0,0|2,0,0]=4 3254 B16R2.477 CC(Cl)CCc1ccc2ccccc2c1 Amb27873054 [0,2,0,0,0,0|1,0,0]=3 3255 B16R2.477 CC(Cl)CNc1ccc2ccccc2n1 Amb27809548 [0,2,0,0,0,0|2,0,0]=4 3256 B16R2.477 CC(N)CCc1ccc2ccccc2c1 Amb33359116 [0,2,0,0,0,0|1,0,0]=3 3257 B16R2.477 CC(N)CCc1ccc2ccccc2n1 Amb32952925 [0,2,0,0,0,0|2,0,0]=4 3258 B16R2.477 CC(N)CCc1ccc2cccnc2c1 Amb33360711 [0,2,0,0,0,0|2,0,0]=4 3259 B16R2.477 CC(N)CCc1ccc2ncccc2c1 Amb33358922 [0,2,0,0,0,0|2,0,0]=4 3260 B16R2.477 CC(N)CCc1cnc2ccccc2c1 Amb19649866 [0,2,0,0,0,0|2,0,0]=4 3261 B16R2.477 CC(N)COc1ccc2ncccc2c1 Amb22642661 [0,2,0,0,0,0|1,0,0]=3 3262 B16R2.477 CC(N)COc1ccc2ncccc2c1 Amb32662159 [0,2,0,0,0,0|1,0,0]=3 3263 B16R2.477 CC(N)\C=C\c1ccc2ccccc2c1 Amb33171935 [0,2,0,0,0,0|1,0,0]=3 3264 B16R2.477 CC(N)\C=C\c1ccc2ccccc2n1 Amb33474364 [0,2,0,0,0,0|2,0,0]=4 3265 B16R2.477 CC(N)\C=C\c1ccc2cccnc2c1 Amb32878538 [0,2,0,0,0,0|2,0,0]=4 3266 B16R2.477 CC(N)\C=C\c1ccc2ncccc2c1 Amb33475325 [0,2,0,0,0,0|2,0,0]=4 3267 B16R2.477 CC(N)\C=C\c1cnc2ccccc2c1 Amb33319780 [0,2,0,0,0,0|2,0,0]=4 3268 B16R2.477 CC(O)CCc1ccc2ccccc2c1 Amb33429892 [0,2,0,0,0,0|1,0,0]=3 3269 B16R2.477 CC(O)CCc1ccc2ccccc2n1 Amb33450015 [0,2,0,0,0,0|2,0,0]=4 3270 B16R2.477 CC(O)CCc1ccc2cccnc2c1 Amb33474694 [0,2,0,0,0,0|2,0,0]=4 3271 B16R2.477 CC(O)CCc1ccc2ncccc2c1 Amb32954877 [0,2,0,0,0,0|2,0,0]=4 3272 B16R2.477 CC(O)CCc1cnc2ccccc2c1 Amb33172084 [0,2,0,0,0,0|2,0,0]=4 3273 B16R2.477 CC(O)CNc1cnc2ccccc2c1 Amb18933524 [0,2,0,0,0,0|2,0,0]=4 3274 B16R2.477 CC(O)COc1ccc2ccccc2c1 Amb22339930 [0,2,0,0,0,0|0,0,0]=2 3275 B16R2.477 CC(O)COc1ccc2nccnc2c1 Amb17513123 [0,2,0,0,0,0|2,0,0]=4 3276 B16R2.477 C[C@@H](N)CCc1ccc2ccccc2c1 Amb33474915 [0,2,0,0,0,0|1,0,0]=3 3277 B16R2.477 C[C@@H](N)CCc1ccc2ccccc2n1 Amb33201377 [0,2,0,0,0,0|2,0,0]=4 3278 B16R2.477 C[C@@H](N)CCc1ccc2cccnc2c1 Amb32878865 [0,2,0,0,0,0|2,0,0]=4 3279 B16R2.477 C[C@@H](N)CCc1ccc2ncccc2c1 Amb33148695 [0,2,0,0,0,0|2,0,0]=4 3280 B16R2.477 C[C@@H](N)CCc1cnc2ccccc2c1 Amb33323985 [0,2,0,0,0,0|2,0,0]=4 3281 B16R2.477 C[C@@H](N)COc1ccc2ccccc2c1 Amb18538578 [0,2,0,0,0,0|0,0,0]=2 3282 B16R2.477 C[C@@H](N)COc1ccc2ncccc2c1 Amb18538581 [0,2,0,0,0,0|1,0,0]=3 3283 B16R2.477 C[C@@H](O)CCc1ccc2ccccc2c1 Amb33362161 [0,2,0,0,0,0|1,0,0]=3 3284 B16R2.477 C[C@@H](O)CCc1ccc2ccccc2n1 Amb33201378 [0,2,0,0,0,0|2,0,0]=4 3285 B16R2.477 C[C@@H](O)CCc1ccc2cccnc2c1 Amb32878871 [0,2,0,0,0,0|2,0,0]=4 3286 B16R2.477 C[C@@H](O)CCc1ccc2ncccc2c1 Amb33148696 [0,2,0,0,0,0|2,0,0]=4 3287 B16R2.477 C[C@@H](O)CCc1cnc2ccccc2c1 Amb33323986 [0,2,0,0,0,0|2,0,0]=4 3288 B16R2.477 C[C@H](N)CCc1ccc2ccccc2c1 Amb33079342 [0,2,0,0,0,0|1,0,0]=3 3289 B16R2.477 C[C@H](N)CCc1ccc2ccccc2n1 Amb33201376 [0,2,0,0,0,0|2,0,0]=4 3290 B16R2.477 C[C@H](N)CCc1ccc2cccnc2c1 Amb32878860 [0,2,0,0,0,0|2,0,0]=4 3291 B16R2.477 C[C@H](N)CCc1ccc2ncccc2c1 Amb33148694 [0,2,0,0,0,0|2,0,0]=4 3292 B16R2.477 C[C@H](N)CCc1cnc2ccccc2c1 Amb33323984 [0,2,0,0,0,0|2,0,0]=4 3293 B16R2.477 C[C@H](O)CCc1ccc2ccccc2c1 Amb33362162 [0,2,0,0,0,0|1,0,0]=3 3294 B16R2.477 C[C@H](O)CCc1ccc2ccccc2n1 Amb33201379 [0,2,0,0,0,0|2,0,0]=4 3295 B16R2.477 C[C@H](O)CCc1ccc2cccnc2c1 Amb32879155 [0,2,0,0,0,0|2,0,0]=4 3296 B16R2.477 C[C@H](O)CCc1ccc2ncccc2c1 Amb33148697 [0,2,0,0,0,0|2,0,0]=4 3297 B16R2.477 C[C@H](O)CCc1cnc2ccccc2c1 Amb33323987 [0,2,0,0,0,0|2,0,0]=4 3298 B16R2.477 FC(F)COc1cnc2ccccc2n1 Amb33613097 [0,2,0,0,0,0|2,0,0]=4 3299 B16R2.477 N=C(N)COc1ccc2ncccc2c1 Amb18355091 [0,2,0,0,0,0|1,0,1]=4 3300 B16R2.477 NC(=O)COc1ccc2ccccc2c1 Amb3836175 [0,2,0,0,0,0|0,0,1]=3 3301 B16R2.477 NC(=O)COc1ccc2cccnc2c1 Amb18355052 [0,2,0,0,0,0|1,0,1]=4 3302 B16R2.477 NC(=O)COc1ccc2ccncc2c1 Amb18355025 [0,2,0,0,0,0|1,0,1]=4 3303 B16R2.477 NC(=O)COc1ccc2cnccc2c1 Amb18355031 [0,2,0,0,0,0|1,0,1]=4 3304 B16R2.477 NC(=S)COc1ccc2ccccc2c1 Amb2568494 [0,2,0,0,0,0|0,0,1]=3 3305 B16R2.477 O=C(Cl)COc1ccc2ccccc2c1 Amb10880006 [0,2,0,0,0,0|0,0,1]=3 3306 B16R2.477 O=C(O)CCc1ccc2ccccc2c1 Amb3934499 [0,2,0,0,0,0|1,0,1]=4 3307 B16R2.477 O=C(O)CNc1ccc2ccccc2c1 Amb4598585 [0,2,0,0,0,0|1,0,1]=4 3308 B16R2.477 O=C(O)COc1ccc2ccccc2c1 Amb1830480 [0,2,0,0,0,0|0,0,1]=3 3309 B16R2.477 O=C(O)COc1ccc2ccccc2n1 Amb25193627 [0,2,0,0,0,0|1,0,1]=4 3310 B16R2.477 O=C(O)COc1ccc2cccnc2c1 Amb18354949 [0,2,0,0,0,0|1,0,1]=4 3311 B16R2.477 O=C(O)COc1ccc2ccncc2c1 Amb19107693 [0,2,0,0,0,0|1,0,1]=4 3312 B16R2.477 O=C(O)COc1ccc2ncccc2c1 Amb4574096 [0,2,0,0,0,0|1,0,1]=4 3313 B16R2.477 O=C(O)COc1cnc2ccccc2c1 Amb27870338 [0,2,0,0,0,0|1,0,1]=4 3314 B16R2.477 O=C(O)CSc1ccc2ccccc2c1 Amb1212229 [0,2,0,0,0,0|0,1,1]=4 3315 B16R2.477 O=[N+]([O-])CCc1ccc2ccccc2c1 Amb33361940 [0,2,0,0,0,0|2,0,0]=4 3316 B16R2.767 C=C(CCN)c1ccc2ccccc2c1 Amb33380783 [0,2,0,0,0,0|1,0,0]=3 3317 B16R2.767 C=C(CCN)c1ccc2ccccc2n1 Amb33201061 [0,2,0,0,0,0|2,0,0]=4 3318 B16R2.767 C=C(CCN)c1ccc2cccnc2c1 Amb32878547 [0,2,0,0,0,0|2,0,0]=4 3319 B16R2.767 C=C(CCN)c1ccc2ncccc2c1 Amb33148353 [0,2,0,0,0,0|2,0,0]=4 3320 B16R2.767 C=C(CCN)c1cnc2ccccc2c1 Amb33323240 [0,2,0,0,0,0|2,0,0]=4 3321 B16R2.767 C=CCC(=O)c1ccc2ccccc2c1 Amb19064611 [0,2,0,0,0,0|1,0,1]=4 3322 B16R2.767 CC(CCN)c1ccc2ccccc2c1 Amb18293555 [0,2,0,0,0,0|1,0,0]=3 3323 B16R2.767 CC(CCN)c1ccc2ccccc2n1 Amb33201931 [0,2,0,0,0,0|2,0,0]=4 3324 B16R2.767 CC(CCN)c1ccc2cccnc2c1 Amb33474666 [0,2,0,0,0,0|2,0,0]=4 3325 B16R2.767 CC(CCN)c1ccc2ncccc2c1 Amb33362213 [0,2,0,0,0,0|2,0,0]=4 3326 B16R2.767 CC(CCN)c1cnc2ccccc2c1 Amb32953265 [0,2,0,0,0,0|2,0,0]=4 3327 B16R2.767 CC(CON)c1ccc2ccccc2c1 Amb33362007 [0,2,0,0,0,0|2,0,0]=4 3328 B16R2.767 CCCC(=O)c1ccc2ccccc2c1 Amb19067000 [0,2,0,0,0,0|1,0,0]=3 3329 B16R2.767 CCCC(Cl)c1ccc2ccccc2c1 Amb27656977 [0,2,0,0,0,0|1,0,0]=3 3330 B16R2.767 CCCC(Cl)c1ccc2ncccc2c1 Amb27442300 [0,2,0,0,0,0|2,0,0]=4 3331 B16R2.767 CCOC(=N)c1ccc2ccccc2c1 Amb19056471 [0,2,0,0,0,0|0,0,0]=2 3332 B16R2.767 CCOC(=N)c1cnc2ccccc2c1 Amb27975542 [0,2,0,0,0,0|1,0,0]=3 3333 B16R2.767 CCOC(=O)C1=CNc2ccccc2S1 Amb20283033 [0,2,0,0,0,0|2,0,0]=4 3334 B16R2.767 CCOC(=O)C1=Cc2ccccc2OC1 Amb13995995 [0,2,0,0,0,0|1,0,1]=4 3335 B16R2.767 CCOC(=O)c1cc2ccccc2cn1 Amb7990136 [0,2,0,0,0,0|1,0,0]=3 3336 B16R2.767 CCOC(=O)c1cc2ccccc2nn1 Amb22903248 [0,2,0,0,0,0|2,0,0]=4 3337 B16R2.767 CCOC(=O)c1ccc2ccccc2c1 Amb2687909 [0,2,0,0,0,0|0,0,0]=2 3338 B16R2.767 CCOC(=O)c1ccc2ccccc2n1 Amb1088900 [0,2,0,0,0,0|1,0,0]=3 3339 B16R2.767 CCOC(=O)c1ccc2cccnc2n1 Amb4557916 [0,2,0,0,0,0|2,0,0]=4 3340 B16R2.767 CCOC(=O)c1ccc2ccncc2c1 Amb21857738 [0,2,0,0,0,0|1,0,0]=3 3341 B16R2.767 CCOC(=O)c1ccc2ccncc2n1 Amb22498134 [0,2,0,0,0,0|2,0,0]=4 3342 B16R2.767 CCOC(=O)c1ccc2cnccc2c1 Amb17933379 [0,2,0,0,0,0|1,0,0]=3 3343 B16R2.767 CCOC(=O)c1ccc2ncccc2c1 Amb19039734 [0,2,0,0,0,0|1,0,0]=3 3344 B16R2.767 CCOC(=O)c1ccc2nccnc2c1 Amb10069950 [0,2,0,0,0,0|2,0,0]=4 3345 B16R2.767 CCOC(=O)c1cnc2ccccc2c1 Amb2617152 [0,2,0,0,0,0|1,0,0]=3 3346 B16R2.767 CCOC(=O)c1cnc2ccccc2n1 Amb2716288 [0,2,0,0,0,0|2,0,0]=4 3347 B16R2.767 CCOC(=O)c1cnc2cccnc2c1 Amb22757404 [0,2,0,0,0,0|2,0,0]=4 3348 B16R2.767 CCOC(=O)c1cnc2cnccc2c1 Amb20241506 [0,2,0,0,0,0|2,0,0]=4 3349 B16R2.767 CCOC(=O)c1cnc2ncccc2c1 Amb34192837 [0,2,0,0,0,0|2,0,0]=4 3350 B16R2.767 CCOC(=O)c1ncc2ccccc2n1 Amb9854892 [0,2,0,0,0,0|2,0,0]=4 3351 B16R2.767 CN(CCBr)c1ccc2ccccc2n1 Amb27883646 [0,2,0,0,0,0|2,0,0]=4 3352 B16R2.767 CN(CCCl)c1ccc2ccccc2n1 Amb28319739 [0,2,0,0,0,0|2,0,0]=4 3353 B16R2.767 CNCC(=O)c1ccc2ccccc2c1 Amb17314279 [0,2,0,0,0,0|1,0,0]=3 3354 B16R2.767 CNCC(=O)c1ccc2ccccc2n1 Amb33474781 [0,2,0,0,0,0|2,0,0]=4 3355 B16R2.767 CNCC(=O)c1ccc2cccnc2c1 Amb24673785 [0,2,0,0,0,0|2,0,0]=4 3356 B16R2.767 CNCC(=O)c1ccc2ncccc2c1 Amb26415161 [0,2,0,0,0,0|2,0,0]=4 3357 B16R2.767 CNCC(=O)c1cnc2ccccc2c1 Amb25865618 [0,2,0,0,0,0|2,0,0]=4 3358 B16R2.767 CNCC(O)c1ccc2ccccc2c1 Amb18970404 [0,2,0,0,0,0|1,0,0]=3 3359 B16R2.767 CNCC(O)c1ccc2ccccc2n1 Amb33429778 [0,2,0,0,0,0|2,0,0]=4 3360 B16R2.767 CNCC(O)c1ccc2cccnc2c1 Amb32953338 [0,2,0,0,0,0|2,0,0]=4 3361 B16R2.767 CNCC(O)c1ccc2ncccc2c1 Amb33359565 [0,2,0,0,0,0|2,0,0]=4 3362 B16R2.767 CNCC(O)c1cnc2ccccc2c1 Amb18562960 [0,2,0,0,0,0|2,0,0]=4 3363 B16R2.767 COCC(=O)c1ccc2ccccc2n1 Amb27590012 [0,2,0,0,0,0|2,0,0]=4 3364 B16R2.767 CONC(=O)c1ccc2ccccc2c1 Amb8231963 [0,2,0,0,0,0|2,0,0]=4 3365 B16R2.767 C\C=C\C(=O)c1ccc2ccccc2c1 Amb28192492 [0,2,0,0,0,0|1,0,1]=4 3366 B16R2.767 N#CCC(=O)c1ccc2ccccc2c1 Amb6266715 [0,2,0,0,0,0|1,0,1]=4 3367 B16R2.767 N#CCC(O)c1ccc2ccccc2c1 Amb18652616 [0,2,0,0,0,0|1,0,1]=4 3368 B16R2.767 NC(CCO)c1ccc2ccccc2c1 Amb1993958 [0,2,0,0,0,0|1,0,0]=3 3369 B16R2.767 NC(CCO)c1ccc2ccccc2n1 Amb33474793 [0,2,0,0,0,0|2,0,0]=4 3370 B16R2.767 NC(CCO)c1ccc2cccnc2c1 Amb33171983 [0,2,0,0,0,0|2,0,0]=4 3371 B16R2.767 NC(CCO)c1ccc2ncccc2c1 Amb33448489 [0,2,0,0,0,0|2,0,0]=4 3372 B16R2.767 NC(CCO)c1cnc2ccccc2c1 Amb33448652 [0,2,0,0,0,0|2,0,0]=4 3373 B16R2.767 NCCC(=O)c1ccc2ccccc2c1 Amb18105783 [0,2,0,0,0,0|1,0,0]=3 3374 B16R2.767 NCCC(=O)c1ccc2ccccc2n1 Amb33449784 [0,2,0,0,0,0|2,0,0]=4 3375 B16R2.767 NCCC(=O)c1ccc2cccnc2c1 Amb27216608 [0,2,0,0,0,0|2,0,0]=4 3376 B16R2.767 NCCC(=O)c1ccc2cnccc2c1 Amb27654907 [0,2,0,0,0,0|2,0,0]=4 3377 B16R2.767 NCCC(=O)c1ccc2ncccc2c1 Amb25679945 [0,2,0,0,0,0|2,0,0]=4 3378 B16R2.767 NCCC(=O)c1cnc2ccccc2c1 Amb24426688 [0,2,0,0,0,0|2,0,0]=4 3379 B16R2.767 NCCC(F)c1ccc2ccccc2c1 Amb33449273 [0,2,0,0,0,0|1,0,0]=3 3380 B16R2.767 NCCC(F)c1ccc2ccccc2n1 Amb33226364 [0,2,0,0,0,0|2,0,0]=4 3381 B16R2.767 NCCC(F)c1ccc2cccnc2c1 Amb33429826 [0,2,0,0,0,0|2,0,0]=4 3382 B16R2.767 NCCC(F)c1ccc2ncccc2c1 Amb33474816 [0,2,0,0,0,0|2,0,0]=4 3383 B16R2.767 NCCC(F)c1cnc2ccccc2c1 Amb33449942 [0,2,0,0,0,0|2,0,0]=4 3384 B16R2.767 NCCC(O)c1ccc2ccccc2c1 Amb18105785 [0,2,0,0,0,0|1,0,0]=3 3385 B16R2.767 NCCC(O)c1ccc2ccccc2n1 Amb33450048 [0,2,0,0,0,0|2,0,0]=4 3386 B16R2.767 NCCC(O)c1ccc2cccnc2c1 Amb33080344 [0,2,0,0,0,0|2,0,0]=4 3387 B16R2.767 NCCC(O)c1ccc2ncccc2c1 Amb33171670 [0,2,0,0,0,0|2,0,0]=4 3388 B16R2.767 NCCC(O)c1cnc2ccccc2c1 Amb33079498 [0,2,0,0,0,0|2,0,0]=4 3389 B16R2.767 NCC[C@@H](O)c1ccc2ccccc2c1 Amb33362167 [0,2,0,0,0,0|1,0,0]=3 3390 B16R2.767 NCC[C@@H](O)c1ccc2ccccc2n1 Amb33201635 [0,2,0,0,0,0|2,0,0]=4 3391 B16R2.767 NCC[C@@H](O)c1ccc2cccnc2c1 Amb32879184 [0,2,0,0,0,0|2,0,0]=4 3392 B16R2.767 NCC[C@@H](O)c1ccc2ncccc2c1 Amb33143137 [0,2,0,0,0,0|2,0,0]=4 3393 B16R2.767 NCC[C@@H](O)c1cnc2ccccc2c1 Amb33224202 [0,2,0,0,0,0|2,0,0]=4 3394 B16R2.767 NCC[C@H](O)c1ccc2ccccc2c1 Amb33172385 [0,2,0,0,0,0|1,0,0]=3 3395 B16R2.767 NCC[C@H](O)c1ccc2ccccc2n1 Amb33201634 [0,2,0,0,0,0|2,0,0]=4 3396 B16R2.767 NCC[C@H](O)c1ccc2cccnc2c1 Amb32879183 [0,2,0,0,0,0|2,0,0]=4 3397 B16R2.767 NCC[C@H](O)c1ccc2ncccc2c1 Amb33143112 [0,2,0,0,0,0|2,0,0]=4 3398 B16R2.767 NCC[C@H](O)c1cnc2ccccc2c1 Amb33324474 [0,2,0,0,0,0|2,0,0]=4 3399 B16R2.767 N[C@@H](CCO)c1ccc2ccccc2c1 Amb32792648 [0,2,0,0,0,0|1,0,0]=3 3400 B16R2.767 N[C@@H](CCO)c1ccc2ncccc2c1 Amb32792643 [0,2,0,0,0,0|2,0,0]=4 3401 B16R2.767 N[C@H](CCO)c1ccc2ccccc2c1 Amb32793261 [0,2,0,0,0,0|1,0,0]=3 3402 B16R2.767 N[C@H](CCO)c1ccc2ncccc2c1 Amb32793503 [0,2,0,0,0,0|2,0,0]=4 3403 B16R2.767 O=C(CCBr)c1ccc2ccccc2c1 Amb17437872 [0,2,0,0,0,0|1,0,0]=3 3404 B16R2.767 O=CCC(=O)c1ccc2ccccc2c1 Amb9204930 [0,2,0,0,0,0|1,0,1]=4 3405 B16R2.1054 CCCCc1cc(Cl)c2ccccc2n1 Amb22497152 [0,2,0,0,0,0|2,0,0]=4 3406 B16R2.1054 CCCOc1cc(N)c2ccccc2n1 Amb32669487 [0,2,0,0,0,0|1,0,0]=3 3407 B16R2.1054 CCOCc1nc(N)c2ccccc2n1 Amb33218210 [0,2,0,0,0,0|2,0,0]=4 3408 B16R2.1054 Cc1cc(CCCN)nc2ccccc12 Amb18353579 [0,2,0,0,0,0|2,0,0]=4 3409 B16R2.1054 Cc1cc(NCCN)nc2ccccc12 Amb21886249 [0,2,0,0,0,0|2,0,0]=4 3410 B16R2.1054 Cc1cc(NCCN)nc2ccccc12 Amb534684 [0,2,0,0,0,0|2,0,0]=4 3411 B16R2.1054 Cc1cc(SCCBr)nc2ccccc12 Amb27227707 [0,2,0,0,0,0|1,1,0]=4 3412 B16R2.1054 Cc1cc(SCCN)nc2ccccc12 Amb31180994 [0,2,0,0,0,0|1,1,0]=4 3413 B16R2.1054 Clc1nc(CCCBr)cc2ccccc12 Amb33481569 [0,2,0,0,0,0|2,0,0]=4 3414 B16R2.1054 NCCCc1cc(F)c2ncccc2c1 Amb18353589 [0,2,0,0,0,0|2,0,0]=4 3415 B16R2.1056 CCCOc1nc2ccccc2nc1Cl Amb22476350 [0,2,0,0,0,0|2,0,0]=4 3416 B16R2.1056 CCCOc1nc2ccccc2nc1F Amb35593854 [0,2,0,0,0,0|2,0,0]=4 3417 B16R2.1056 CCNCC1=Cc2ccccc2NC1=O Amb18563364 [0,2,0,0,0,0|2,0,0]=4 3418 B16R2.1056 CCOCc1cc2ccccc2nc1Cl Amb27225680 [0,2,0,0,0,0|1,0,0]=3 3419 B16R2.1056 CNCCC1=Cc2ccccc2NC1=O Amb31112395 [0,2,0,0,0,0|2,0,0]=4 3420 B16R2.1056 CNCCc1cc2ccccc2nc1Cl Amb33058663 [0,2,0,0,0,0|2,0,0]=4 3421 B16R2.1056 CNCCc1nc2ccccc2cc1C Amb17578898 [0,2,0,0,0,0|2,0,0]=4 3422 B16R2.1056 Cc1cc2ccccc2nc1SCCN Amb31180995 [0,2,0,0,0,0|1,1,0]=4 3423 B16R2.1056 Cc1nc2ccccc2cc1CCCN Amb17578894 [0,2,0,0,0,0|2,0,0]=4 3424 B16R2.1056 Clc1nc2ccccc2cc1CCCBr Amb5745263 [0,2,0,0,0,0|2,0,0]=4 3425 B16R2.1056 NCCCC1=Cc2ccccc2NC1=O Amb18015366 [0,2,0,0,0,0|2,0,0]=4 3426 B16R2.1056 NCCCc1cc2ccccc2nc1Cl Amb33406663 [0,2,0,0,0,0|2,0,0]=4 3427 B16R2.1056 NCCOc1cc2ccccc2nc1Cl Amb33057592 [0,2,0,0,0,0|1,0,0]=3 3428 B16R2.1056 OCCCc1cc2ccccc2nc1Cl Amb33220757 [0,2,0,0,0,0|2,0,0]=4 3429 B16R2.1056 OCCOc1nc2ccccc2nc1Cl Amb35593573 [0,2,0,0,0,0|2,0,0]=4 3430 B16R2.1056 OCCOc1nc2ccccc2nc1F Amb35593846 [0,2,0,0,0,0|2,0,0]=4 3431 B16R2.1056 SCCCc1cc2ccccc2nc1Cl Amb33057579 [0,2,0,0,0,0|2,0,0]=4 3432 B16R2.1285 CCCCc1ccc2ccc(O)cc2c1 Amb32751564 [0,2,0,0,0,0|1,0,0]=3 3433 B16R2.1285 CCCOc1ccc2ncc(N)cc2c1 Amb23580246 [0,2,0,0,0,0|1,0,0]=3 3434 B16R2.1285 Cc1ccc2ccc(CCCN)cc2n1 Amb19105107 [0,2,0,0,0,0|2,0,0]=4 3435 B16R2.1285 Cc1ccc2ccc(SCCN)nc2c1 Amb31180998 [0,2,0,0,0,0|1,1,0]=4 3436 B16R2.1285 N#CCOc1ccc2c(c1)OC(=O)C=C2 Amb19376312 [0,2,0,0,0,0|1,0,1]=4 3437 B16R2.1285 NCCCc1ccc2ccc(Br)cc2n1 Amb17585758 [0,2,0,0,0,0|2,0,0]=4 3438 B16R2.1285 NCCCc1ccc2ccc(Cl)cc2n1 Amb17580186 [0,2,0,0,0,0|2,0,0]=4 3439 B16R2.1285 NCCCc1ccc2ccc(F)cc2n1 Amb17579028 [0,2,0,0,0,0|2,0,0]=4 3440 B16R2.1285 NCCOc1ccc2c(c1)OC(=O)C=C2 Amb18912385 [0,2,0,0,0,0|1,0,0]=3 3441 B16R2.1285 NCCSc1ccc2ccc(Cl)cc2n1 Amb31108181 [0,2,0,0,0,0|1,1,0]=4 3442 B16R2.1285 NCCSc1ccc2ccc(F)cc2n1 Amb31181953 [0,2,0,0,0,0|1,1,0]=4 3443 B16R2.1293 BrCCOc1cnc2cccc(Br)c2c1 Amb32988385 [0,2,0,0,0,0|1,0,0]=3 3444 B16R2.1293 CCCCc1ccc2c(c1)C(=O)NC=C2 Amb18349281 [0,2,0,0,0,0|2,0,0]=4 3445 B16R2.1293 CCCCc1ccc2ccnc(Br)c2c1 Amb19099711 [0,2,0,0,0,0|2,0,0]=4 3446 B16R2.1293 CCCCc1ccc2ccnc(Cl)c2c1 Amb18346742 [0,2,0,0,0,0|2,0,0]=4 3447 B16R2.1293 CCCCc1ccc2nccc(Br)c2c1 Amb27425951 [0,2,0,0,0,0|2,0,0]=4 3448 B16R2.1293 CCCCc1ccc2nccc(C)c2c1 Amb19108169 [0,2,0,0,0,0|2,0,0]=4 3449 B16R2.1293 CCCOc1ccc2cccc(N)c2c1 Amb31094514 [0,2,0,0,0,0|0,0,0]=2 3450 B16R2.1293 CCCOc1ccc2cccc(O)c2c1 Amb35745079 [0,2,0,0,0,0|0,0,0]=2 3451 B16R2.1293 CNCCc1ccc2cccc(C)c2n1 Amb17578900 [0,2,0,0,0,0|2,0,0]=4 3452 B16R2.1293 CNCCc1ccc2cccc(Cl)c2n1 Amb17580182 [0,2,0,0,0,0|2,0,0]=4 3453 B16R2.1293 CNCCc1ccc2cccc(F)c2n1 Amb17579024 [0,2,0,0,0,0|2,0,0]=4 3454 B16R2.1293 Cc1cccc2ccc(SCCN)nc12 Amb31180997 [0,2,0,0,0,0|1,1,0]=4 3455 B16R2.1293 Cc1ccnc2ccc(CCCN)cc12 Amb19105117 [0,2,0,0,0,0|2,0,0]=4 3456 B16R2.1293 Cc1ccnc2ccc(OCCN)cc12 Amb19107895 [0,2,0,0,0,0|1,0,0]=3 3457 B16R2.1293 NCCCc1ccc2cccc(F)c2n1 Amb17579026 [0,2,0,0,0,0|2,0,0]=4 3458 B16R2.1293 NCCSc1ccc2cccc(Br)c2n1 Amb31133997 [0,2,0,0,0,0|1,1,0]=4 3459 B16R2.1293 NCCSc1ccc2cccc(Cl)c2n1 Amb31108182 [0,2,0,0,0,0|1,1,0]=4 3460 B16R2.1293 NCCSc1ccc2cccc(F)c2n1 Amb31181954 [0,2,0,0,0,0|1,1,0]=4 3461 B16R2.2441 BrCCCOc1ccc2ccccc2c1 Amb2231590 [0,2,0,0,0,0|0,0,0]=2 3462 B16R2.2441 BrCCCOc1ccc2ncccc2c1 Amb17272079 [0,2,0,0,0,0|1,0,0]=3 3463 B16R2.2441 BrCC\C=C\c1ccc2cccnc2c1 Amb27438975 [0,2,0,0,0,0|2,0,0]=4 3464 B16R2.2441 BrCC\C=C\c1cnc2ccccc2c1 Amb28184618 [0,2,0,0,0,0|2,0,0]=4 3465 B16R2.2441 CCCCOc1ccc2ccccc2c1 Amb3836169 [0,2,0,0,0,0|0,0,0]=2 3466 B16R2.2441 CCCCOc1ccc2ncccc2c1 Amb19108435 [0,2,0,0,0,0|1,0,0]=3 3467 B16R2.2441 CCCNCc1ccc2ccccc2c1 Amb6665841 [0,2,0,0,0,0|1,0,0]=3 3468 B16R2.2441 CNCCOc1ccc2ccccc2c1 Amb7761798 [0,2,0,0,0,0|0,0,0]=2 3469 B16R2.2441 CNCCOc1ccc2ncccc2c1 Amb22642611 [0,2,0,0,0,0|1,0,0]=3 3470 B16R2.2441 CNCCOc1ccc2ncccc2c1 Amb32662269 [0,2,0,0,0,0|1,0,0]=3 3471 B16R2.2441 COCCNc1ccc2ncccc2c1 Amb18933544 [0,2,0,0,0,0|2,0,0]=4 3472 B16R2.2441 ClCCC#Cc1ccc2ccccc2c1 Amb27404013 [0,2,0,0,0,0|1,0,0]=3 3473 B16R2.2441 ClCCC#Cc1ccc2ccccc2n1 Amb27976839 [0,2,0,0,0,0|2,0,0]=4 3474 B16R2.2441 ClCCCOc1ccc2ccccc2c1 Amb6662694 [0,2,0,0,0,0|0,0,0]=2 3475 B16R2.2441 ClCCCOc1ccc2ncccc2c1 Amb17245288 [0,2,0,0,0,0|1,0,0]=3 3476 B16R2.2441 ClCC\C=C\c1cnc2ccccc2c1 Amb27262040 [0,2,0,0,0,0|2,0,0]=4 3477 B16R2.2441 N#CCCCc1cc2ccccc2cn1 Amb2698602 [0,2,0,0,0,0|2,0,0]=4 3478 B16R2.2441 NCCCCc1ccc2ccccc2c1 Amb18049792 [0,2,0,0,0,0|1,0,0]=3 3479 B16R2.2441 NCCCCc1ccc2ccccc2n1 Amb33380484 [0,2,0,0,0,0|2,0,0]=4 3480 B16R2.2441 NCCCCc1ccc2cccnc2c1 Amb18353898 [0,2,0,0,0,0|2,0,0]=4 3481 B16R2.2441 NCCCCc1ccc2ccncc2c1 Amb19105808 [0,2,0,0,0,0|2,0,0]=4 3482 B16R2.2441 NCCCCc1ccc2cnccc2c1 Amb18353872 [0,2,0,0,0,0|2,0,0]=4 3483 B16R2.2441 NCCCCc1ccc2ncccc2c1 Amb18353926 [0,2,0,0,0,0|2,0,0]=4 3484 B16R2.2441 NCCCCc1cnc2ccccc2c1 Amb33474974 [0,2,0,0,0,0|2,0,0]=4 3485 B16R2.2441 NCCCOc1ccc2ccccc2c1 Amb1135799 [0,2,0,0,0,0|0,0,0]=2 3486 B16R2.2441 NCCCOc1ccc2ccccc2n1 Amb18308517 [0,2,0,0,0,0|1,0,0]=3 3487 B16R2.2441 NCCCOc1ccc2cccnc2c1 Amb18355161 [0,2,0,0,0,0|1,0,0]=3 3488 B16R2.2441 NCCCOc1ccc2ccncc2c1 Amb19107941 [0,2,0,0,0,0|1,0,0]=3 3489 B16R2.2441 NCCCOc1ccc2ncccc2c1 Amb18355162 [0,2,0,0,0,0|1,0,0]=3 3490 B16R2.2441 NCCCOc1ccc2ncccc2c1 Amb32662402 [0,2,0,0,0,0|1,0,0]=3 3491 B16R2.2441 NCCCOc1cnc2ccccc2c1 Amb33171990 [0,2,0,0,0,0|1,0,0]=3 3492 B16R2.2441 NCCCOc1cnc2ccccc2n1 Amb18309344 [0,2,0,0,0,0|2,0,0]=4 3493 B16R2.2441 NNCCOc1ccc2ccccc2c1 Amb17402559 [0,2,0,0,0,0|0,0,0]=2 3494 B16R2.2441 NNCCOc1ccc2ncccc2c1 Amb17402692 [0,2,0,0,0,0|1,0,0]=3 3495 B16R2.2441 NOCCOc1ccc2ccccc2c1 Amb17088333 [0,2,0,0,0,0|0,0,0]=2 3496 B16R2.2441 O=C=NCCc1ccc2ccccc2c1 Amb31094172 [0,2,0,0,0,0|1,0,1]=4 3497 B16R2.2441 O=CCCCc1ccc2ccccc2c1 Amb18549395 [0,2,0,0,0,0|1,0,0]=3 3498 B16R2.2441 O=CCCCc1ccc2cccnc2c1 Amb32878553 [0,2,0,0,0,0|2,0,0]=4 3499 B16R2.2441 O=CCCCc1ccc2ncccc2c1 Amb33080416 [0,2,0,0,0,0|2,0,0]=4 3500 B16R2.2441 O=CCCCc1cnc2ccccc2c1 Amb33172349 [0,2,0,0,0,0|2,0,0]=4 3501 B16R2.2441 O=CCCOc1ccc2ccccc2c1 Amb5731790 [0,2,0,0,0,0|0,0,0]=2 3502 B16R2.2441 O=CCCSc1ccc2ccccc2c1 Amb32682635 [0,2,0,0,0,0|0,1,0]=3 3503 B16R2.2441 O=CCCSc1ccc2ccccc2n1 Amb32682677 [0,2,0,0,0,0|1,1,0]=4 3504 B16R2.2441 OCCC#Cc1ccc2ccccc2n1 Amb33307066 [0,2,0,0,0,0|2,0,0]=4 3505 B16R2.2441 OCCCCc1ccc2ccccc2c1 Amb33716158 [0,2,0,0,0,0|1,0,0]=3 3506 B16R2.2441 OCCCNc1ccc2ncccc2c1 Amb18933502 [0,2,0,0,0,0|2,0,0]=4 3507 B16R2.2441 OCCCOc1ccc2ccccc2c1 Amb9370699 [0,2,0,0,0,0|0,0,0]=2 3508 B16R2.2441 OCCCOc1ccc2ncccc2c1 Amb17105039 [0,2,0,0,0,0|1,0,0]=3 3509 B16R2.2441 OCCCOc1ccc2nccnc2c1 Amb17513121 [0,2,0,0,0,0|2,0,0]=4 3510 B16R2.2441 OCCNCc1ccc2ccccc2c1 Amb7757056 [0,2,0,0,0,0|1,0,0]=3 3511 B16R2.2441 OCCNCc1cnc2ccccc2c1 Amb19649748 [0,2,0,0,0,0|2,0,0]=4 3512 B16R2.2441 ONCCOc1ccc2ccccc2c1 Amb17088459 [0,2,0,0,0,0|0,0,0]=2 3513 B16R2.2441 SCCCOc1ccc2ccccc2c1 Amb17243345 [0,2,0,0,0,0|0,0,0]=2 3514 B16R2.2441 SCCCOc1ccc2ncccc2c1 Amb17243779 [0,2,0,0,0,0|1,0,0]=3 3515 B16R2.2441 [N-]=[N+]=NCCc1ccc2ccccc2c1 Amb33358414 [0,2,0,0,0,0|2,0,0]=4 3516 B16R2.2942 BrCCOc1ccc2ccccc2c1Br Amb2610614 [0,2,0,0,0,0|0,0,0]=2 3517 B16R2.2942 C=CCOc1ccc2ccccc2c1Br Amb1774164 [0,2,0,0,0,0|0,0,1]=3 3518 B16R2.2942 CCCOc1ccc2ccccc2c1Br Amb24441351 [0,2,0,0,0,0|0,0,0]=2 3519 B16R2.2942 CCCOc1ccc2ccccc2c1N Amb18054415 [0,2,0,0,0,0|0,0,0]=2 3520 B16R2.2942 CCO\C=C1/CCc2ccccc2C1=O Amb33355263 [0,2,0,0,0,0|0,0,2]=4 3521 B16R2.2942 CCO\C=C1/COc2ccccc2C1=O Amb33355266 [0,2,0,0,0,0|1,0,1]=4 3522 B16R2.2942 Cc1c(C#CCCl)ccc2ccccc12 Amb28067222 [0,2,0,0,0,0|1,0,1]=4 3523 B16R2.2942 ClCCOc1ccc2ccccc2c1Br Amb28065398 [0,2,0,0,0,0|0,0,0]=2 3524 B16R2.2942 Fc1c(CCCBr)ccc2ccccc12 Amb27437257 [0,2,0,0,0,0|1,0,0]=3 3525 B16R2.2942 N#CCOc1ccc2ccccc2c1Br Amb6752445 [0,2,0,0,0,0|0,0,1]=3 3526 B16R2.2942 N#CCOc1ccc2cccnc2c1Br Amb32430104 [0,2,0,0,0,0|1,0,1]=4 3527 B16R2.2942 N#CCOc1ccc2ncccc2c1Br Amb32430102 [0,2,0,0,0,0|1,0,1]=4 3528 B16R2.2942 NCCCN1C=Cc2ccccc2C1=O Amb18035112 [0,2,0,0,0,0|2,0,0]=4 3529 B16R2.2942 NCCOc1ccc2ccncc2c1Br Amb18355009 [0,2,0,0,0,0|1,0,0]=3 3530 B16R2.2942 O=CCOc1ccc2ccccc2c1Br Amb27952660 [0,2,0,0,0,0|0,0,1]=3 3531 B16R2.2942 [NH3+]CCOc1ccc2ccccc2c1Cl Amb32411030 [0,2,0,0,0,0|0,0,0]=2 3532 B16R2.5347 C#CC(=O)Oc1ccc2ccccc2c1 Amb22487655 [0,2,0,0,0,0|0,0,2]=4 3533 B16R2.5347 CC(C=O)Cc1ccc2cccnc2c1 Amb27968504 [0,2,0,0,0,0|2,0,0]=4 3534 B16R2.5347 CC(C=O)Oc1ccc2ccccc2c1 Amb30020968 [0,2,0,0,0,0|0,0,0]=2 3535 B16R2.5347 CC(C=O)Oc1ccc2cccnc2c1 Amb30020972 [0,2,0,0,0,0|1,0,0]=3 3536 B16R2.5347 CC(C=O)Sc1ccc2ccccc2c1 Amb30020901 [0,2,0,0,0,0|0,1,0]=3 3537 B16R2.5347 CC(C=O)Sc1ccc2ccccc2n1 Amb30020902 [0,2,0,0,0,0|1,1,0]=4 3538 B16R2.5347 CC(CBr)Cc1ccc2ccccc2c1 Amb28456230 [0,2,0,0,0,0|1,0,0]=3 3539 B16R2.5347 CC(CBr)Cc1ccc2ncccc2c1 Amb27623821 [0,2,0,0,0,0|2,0,0]=4 3540 B16R2.5347 CC(CBr)Oc1ccc2ccccc2c1 Amb17271457 [0,2,0,0,0,0|0,0,0]=2 3541 B16R2.5347 CC(CBr)Oc1ccc2ncccc2c1 Amb17272078 [0,2,0,0,0,0|1,0,0]=3 3542 B16R2.5347 CC(CCl)Cc1ccc2cccnc2c1 Amb28256028 [0,2,0,0,0,0|2,0,0]=4 3543 B16R2.5347 CC(CCl)Oc1ccc2ccccc2c1 Amb17244663 [0,2,0,0,0,0|0,0,0]=2 3544 B16R2.5347 CC(CCl)Oc1ccc2ncccc2c1 Amb17245287 [0,2,0,0,0,0|1,0,0]=3 3545 B16R2.5347 CC(CN)Cc1ccc2ccccc2c1 Amb33748491 [0,2,0,0,0,0|1,0,0]=3 3546 B16R2.5347 CC(CN)Cc1ccc2ccccc2n1 Amb17578901 [0,2,0,0,0,0|2,0,0]=4 3547 B16R2.5347 CC(CN)Cc1ccc2cccnc2c1 Amb18353624 [0,2,0,0,0,0|2,0,0]=4 3548 B16R2.5347 CC(CN)Cc1ccc2ccncc2c1 Amb19105232 [0,2,0,0,0,0|2,0,0]=4 3549 B16R2.5347 CC(CN)Cc1ccc2cnccc2c1 Amb19105234 [0,2,0,0,0,0|2,0,0]=4 3550 B16R2.5347 CC(CN)Cc1ccc2ncccc2c1 Amb18353670 [0,2,0,0,0,0|2,0,0]=4 3551 B16R2.5347 CC(CN)Cc1cnc2ccccc2c1 Amb33737171 [0,2,0,0,0,0|2,0,0]=4 3552 B16R2.5347 CC(CN)Oc1ccc2ncccc2c1 Amb18355019 [0,2,0,0,0,0|1,0,0]=3 3553 B16R2.5347 CC(CN)Oc1ccc2ncccc2c1 Amb32662205 [0,2,0,0,0,0|1,0,0]=3 3554 B16R2.5347 CC(CO)Cc1ccc2ccccc2c1 Amb33748495 [0,2,0,0,0,0|1,0,0]=3 3555 B16R2.5347 CC(CO)Cc1ccc2ccccc2n1 Amb33748302 [0,2,0,0,0,0|2,0,0]=4 3556 B16R2.5347 CC(CO)Cc1ccc2cccnc2c1 Amb33749420 [0,2,0,0,0,0|2,0,0]=4 3557 B16R2.5347 CC(CO)Cc1cnc2ccccc2c1 Amb33737537 [0,2,0,0,0,0|2,0,0]=4 3558 B16R2.5347 CC(CO)Oc1ccc2ccccc2c1 Amb2642901 [0,2,0,0,0,0|0,0,0]=2 3559 B16R2.5347 CC(CO)Oc1ccc2ncccc2c1 Amb17237664 [0,2,0,0,0,0|1,0,0]=3 3560 B16R2.5347 CCC(=O)Cc1ccc2ccccc2n1 Amb9205990 [0,2,0,0,0,0|2,0,0]=4 3561 B16R2.5347 CCC(Br)Cc1ccc2ccccc2c1 Amb18548932 [0,2,0,0,0,0|1,0,0]=3 3562 B16R2.5347 CCC(C)Nc1ccc2ncccc2c1 Amb19086734 [0,2,0,0,0,0|2,0,0]=4 3563 B16R2.5347 CCC(Cl)Cc1ccc2ccccc2n1 Amb27834391 [0,2,0,0,0,0|2,0,0]=4 3564 B16R2.5347 COC(=O)Cc1ccc2ccccc2c1 Amb10177537 [0,2,0,0,0,0|1,0,1]=4 3565 B16R2.5347 C[C@@H](CN)Cc1ccc2ccccc2c1 Amb33743133 [0,2,0,0,0,0|1,0,0]=3 3566 B16R2.5347 C[C@@H](CN)Cc1ccc2ccccc2n1 Amb33731719 [0,2,0,0,0,0|2,0,0]=4 3567 B16R2.5347 C[C@@H](CN)Cc1ccc2cccnc2c1 Amb33727235 [0,2,0,0,0,0|2,0,0]=4 3568 B16R2.5347 C[C@@H](CN)Cc1cnc2ccccc2c1 Amb33743244 [0,2,0,0,0,0|2,0,0]=4 3569 B16R2.5347 C[C@@H](CO)Cc1ccc2ccccc2c1 Amb33746681 [0,2,0,0,0,0|1,0,0]=3 3570 B16R2.5347 C[C@@H](CO)Cc1ccc2ccccc2n1 Amb33740796 [0,2,0,0,0,0|2,0,0]=4 3571 B16R2.5347 C[C@@H](CO)Cc1ccc2cccnc2c1 Amb33739857 [0,2,0,0,0,0|2,0,0]=4 3572 B16R2.5347 C[C@@H](CO)Cc1cnc2ccccc2c1 Amb33739843 [0,2,0,0,0,0|2,0,0]=4 3573 B16R2.5347 C[C@H](CN)Cc1ccc2ccccc2c1 Amb33740279 [0,2,0,0,0,0|1,0,0]=3 3574 B16R2.5347 C[C@H](CN)Cc1ccc2ccccc2n1 Amb33737688 [0,2,0,0,0,0|2,0,0]=4 3575 B16R2.5347 C[C@H](CN)Cc1ccc2cccnc2c1 Amb33728694 [0,2,0,0,0,0|2,0,0]=4 3576 B16R2.5347 C[C@H](CN)Cc1cnc2ccccc2c1 Amb33737874 [0,2,0,0,0,0|2,0,0]=4 3577 B16R2.5347 C[C@H](CO)Cc1ccc2ccccc2c1 Amb33738168 [0,2,0,0,0,0|1,0,0]=3 3578 B16R2.5347 C[C@H](CO)Cc1ccc2ccccc2n1 Amb33749845 [0,2,0,0,0,0|2,0,0]=4 3579 B16R2.5347 C[C@H](CO)Cc1ccc2cccnc2c1 Amb33749549 [0,2,0,0,0,0|2,0,0]=4 3580 B16R2.5347 C[C@H](CO)Cc1cnc2ccccc2c1 Amb33744420 [0,2,0,0,0,0|2,0,0]=4 3581 B16R2.5347 C\C(=C\c1ccc2ccccc2c1)CBr Amb28123424 [0,2,0,0,0,0|1,0,1]=4 3582 B16R2.5347 C\C(C=O)=C\c1ccc2ccccc2c1 Amb27397877 [0,2,0,0,0,0|1,0,1]=4 3583 B16R2.5347 NC(CO)Cc1ccc2ccccc2c1 Amb24056375 [0,2,0,0,0,0|1,0,0]=3 3584 B16R2.5347 NC(CO)Cc1ccc2ccccc2n1 Amb33358975 [0,2,0,0,0,0|2,0,0]=4 3585 B16R2.5347 NC(CO)Cc1ccc2cccnc2c1 Amb32879656 [0,2,0,0,0,0|2,0,0]=4 3586 B16R2.5347 NC(CO)Cc1ccc2ncccc2c1 Amb33475230 [0,2,0,0,0,0|2,0,0]=4 3587 B16R2.5347 NC(CO)Cc1cnc2ccccc2c1 Amb33171436 [0,2,0,0,0,0|2,0,0]=4 3588 B16R2.5347 NCC(=O)Nc1ccc2ccccc2c1 Amb2099483 [0,2,0,0,0,0|1,0,1]=4 3589 B16R2.5347 NCC(=O)Nc1ccc2ccccc2c1 Amb6358196 [0,2,0,0,0,0|1,0,1]=4 3590 B16R2.5347 NCC(=O)Oc1ccc2ccccc2c1 Amb17337651 [0,2,0,0,0,0|0,0,1]=3 3591 B16R2.5347 NCC(=O)Oc1ccc2ncccc2c1 Amb17337737 [0,2,0,0,0,0|1,0,1]=4 3592 B16R2.5347 NCC(O)Cc1ccc2ccccc2c1 Amb33362157 [0,2,0,0,0,0|1,0,0]=3 3593 B16R2.5347 NCC(O)Cc1ccc2ccccc2n1 Amb33172229 [0,2,0,0,0,0|2,0,0]=4 3594 B16R2.5347 NCC(O)Cc1ccc2cccnc2c1 Amb32878573 [0,2,0,0,0,0|2,0,0]=4 3595 B16R2.5347 NCC(O)Cc1ccc2ncccc2c1 Amb33359900 [0,2,0,0,0,0|2,0,0]=4 3596 B16R2.5347 NCC(O)Cc1cnc2ccccc2c1 Amb33359287 [0,2,0,0,0,0|2,0,0]=4 3597 B16R2.5347 O=C(CBr)Cc1ccc2ccccc2c1 Amb27227080 [0,2,0,0,0,0|1,0,1]=4 3598 B16R2.5347 O=C(CCl)Cc1ccc2ccccc2c1 Amb20673439 [0,2,0,0,0,0|1,0,1]=4 3599 B16R2.5347 O=C(CCl)Nc1ccc2ccccc2c1 Amb1205262 [0,2,0,0,0,0|1,0,1]=4 3600 B16R2.5347 O=C(CO)Nc1ccc2ccccc2c1 Amb1109845 [0,2,0,0,0,0|1,0,1]=4 3601 B16R2.5347 O=C(CS)Nc1ccc2ccccc2c1 Amb1781866 [0,2,0,0,0,0|1,0,1]=4 3602 B16R2.30336 C#CCOc1ccc2cc(Br)ccc2c1 Amb27610839 [0,2,0,0,0,0|0,0,1]=3 3603 B16R2.30336 C=CCOc1ccc2cc(Br)ccc2c1 Amb25685629 [0,2,0,0,0,0|0,0,1]=3 3604 B16R2.30336 CCCCc1ccc2c(c1)C=CC(=O)N2 Amb18546023 [0,2,0,0,0,0|2,0,0]=4 3605 B16R2.30336 CCCCc1ccc2nc(Br)ccc2c1 Amb27450734 [0,2,0,0,0,0|2,0,0]=4 3606 B16R2.30336 CCCCc1ccc2nc(C)ccc2c1 Amb18355169 [0,2,0,0,0,0|2,0,0]=4 3607 B16R2.30336 CCCOc1ccc2cc(Br)ccc2c1 Amb22728882 [0,2,0,0,0,0|0,0,0]=2 3608 B16R2.30336 CCCOc1ccc2cc(O)ccc2c1 Amb32721024 [0,2,0,0,0,0|0,0,0]=2 3609 B16R2.30336 CCCOc1ccc2nc(Br)ccc2c1 Amb27970243 [0,2,0,0,0,0|1,0,0]=3 3610 B16R2.30336 CNCCc1ccc2cc(Br)ccc2n1 Amb17585754 [0,2,0,0,0,0|2,0,0]=4 3611 B16R2.30336 CNCCc1ccc2cc(Cl)ccc2n1 Amb17580184 [0,2,0,0,0,0|2,0,0]=4 3612 B16R2.30336 CNCCc1ccc2nc(C)ccc2c1 Amb33449098 [0,2,0,0,0,0|2,0,0]=4 3613 B16R2.30336 CNCCc1cnc2cc(C)ccc2c1 Amb31112261 [0,2,0,0,0,0|2,0,0]=4 3614 B16R2.30336 CNCCc1cnc2cc(Cl)ccc2c1 Amb31181649 [0,2,0,0,0,0|2,0,0]=4 3615 B16R2.30336 CNCCc1cnc2cc(F)ccc2c1 Amb31112663 [0,2,0,0,0,0|2,0,0]=4 3616 B16R2.30336 COCOc1ccc2cc(Br)ccc2c1 Amb26345369 [0,2,0,0,0,0|0,0,0]=2 3617 B16R2.30336 Cc1ccc2cc(CCCBr)ccc2n1 Amb28125013 [0,2,0,0,0,0|2,0,0]=4 3618 B16R2.30336 Cc1ccc2cc(CCCCl)ccc2n1 Amb27164372 [0,2,0,0,0,0|2,0,0]=4 3619 B16R2.30336 Cc1ccc2cc(CCCN)ccc2n1 Amb19105105 [0,2,0,0,0,0|2,0,0]=4 3620 B16R2.30336 Cc1ccc2cc(CCCO)ccc2n1 Amb33080017 [0,2,0,0,0,0|2,0,0]=4 3621 B16R2.30336 Cc1ccc2cc(CCCS)ccc2n1 Amb33200647 [0,2,0,0,0,0|2,0,0]=4 3622 B16R2.30336 Cc1ccc2cc(OCCN)ccc2n1 Amb18354853 [0,2,0,0,0,0|1,0,0]=3 3623 B16R2.30336 Cc1ccc2nc(SCCN)ccc2c1 Amb31180996 [0,2,0,0,0,0|1,1,0]=4 3624 B16R2.30336 ClCCOc1ccc2cc(Br)ccc2c1 Amb8828441 [0,2,0,0,0,0|0,0,0]=2 3625 B16R2.30336 FCCOc1ccc2cc(Br)ccc2c1 Amb27454469 [0,2,0,0,0,0|0,0,0]=2 3626 B16R2.30336 N#CCOc1ccc2nc(O)ccc2c1 Amb32430101 [0,2,0,0,0,0|1,0,1]=4 3627 B16R2.30336 NCCCc1ccc2cc(Br)ccc2n1 Amb17585756 [0,2,0,0,0,0|2,0,0]=4 3628 B16R2.30336 NCCOc1ccc2cc(Br)ccc2c1 Amb10610366 [0,2,0,0,0,0|0,0,0]=2 3629 B16R2.30336 NCCOc1ccc2cc(Br)ccc2c1 Amb6262521 [0,2,0,0,0,0|0,0,0]=2 3630 B16R2.30336 NCCSc1ccc2cc(Br)ccc2n1 Amb31133996 [0,2,0,0,0,0|1,1,0]=4 3631 B16R2.30336 NCCSc1ccc2cc(Cl)ccc2n1 Amb31108180 [0,2,0,0,0,0|1,1,0]=4 3632 B16R2.30336 NCCSc1ccc2cc(F)ccc2n1 Amb31181952 [0,2,0,0,0,0|1,1,0]=4 3633 B16R2.30336 OCCOc1ccc2cc(Br)ccc2c1 Amb9245004 [0,2,0,0,0,0|0,0,0]=2 3634 B16R2.163604 CCCCc1ccc2c(Br)nccc2c1 Amb18560411 [0,2,0,0,0,0|2,0,0]=4 3635 B16R2.163604 CCCCc1ccc2c(Cl)nccc2c1 Amb18560384 [0,2,0,0,0,0|2,0,0]=4 3636 B16R2.163604 CCCCc1ccc2c(N)nccc2c1 Amb18560444 [0,2,0,0,0,0|2,0,0]=4 3637 B16R2.163604 CCCCc1ccc2c(O)nccc2c1 Amb18560350 [0,2,0,0,0,0|2,0,0]=4 3638 B16R2.163604 CCCOc1ccc2c(Cl)nccc2c1 Amb17216946 [0,2,0,0,0,0|1,0,0]=3 3639 B16R2.163604 CCCOc1ccc2c(N)cccc2c1 Amb31094510 [0,2,0,0,0,0|0,0,0]=2 3640 B16R2.163604 CCCOc1ccc2c(N)nccc2c1 Amb17216967 [0,2,0,0,0,0|1,0,0]=3 3641 B16R2.163604 CCCOc1ccc2c(c1)C=CNC2=O Amb18034942 [0,2,0,0,0,0|1,0,0]=3 3642 B16R2.163604 Cc1ccnc2cc(CCCN)ccc12 Amb18353567 [0,2,0,0,0,0|2,0,0]=4 3643 B16R2.163604 NCCOc1ccc2c(N)ncnc2c1 Amb32620552 [0,2,0,0,0,0|2,0,0]=4 3644 B16R2.3814 CCOc1cc(CCl)c2ccccc2n1 Amb27656661 [0,2,0,0,0,0|1,0,0]=3 3645 B16R2.21680 CCCc1cc(Cl)c2cc(Br)ccc2n1 Amb1994334 [0,2,0,0,0,0|2,0,0]=4 3646 B16R2.21680 CCCc1cc(N)c2cc(N)ccc2n1 Amb31291345 [0,2,0,0,0,0|2,0,0]=4 3647 B16R2.21680 CCOC1=Nc2ccc(C)cc2C(=O)O1 Amb19668389 [0,2,0,0,0,0|2,0,0]=4 3648 B16R2.21680 CCOc1cc(C)c2cc(Br)ccc2n1 Amb20171125 [0,2,0,0,0,0|1,0,0]=3 3649 B16R2.21680 CCOc1cc(N)c2nc(C)ccc2c1 Amb18653985 [0,2,0,0,0,0|1,0,0]=3 3650 B16R2.21692 CCOC1=CC(=O)c2ccccc2N1C Amb24062729 [0,2,0,0,0,0|1,0,0]=3 3651 B16R2.21692 COCC1=CC(=O)c2ccccc2C1=O Amb17595364 [0,2,0,0,0,0|2,0,0]=4 3652 B16R2.21720 CCCc1cc(O)c2cccc(C)c2n1 Amb9134496 [0,2,0,0,0,0|2,0,0]=4 3653 B16R2.21738 CCOc1nc2ccccc2c(N)c1C Amb24099685 [0,2,0,0,0,0|1,0,0]=3 3654 B16R2.24933 CC(=O)Sc1cc(O)c2ccccc2c1 Amb33521770 [0,2,0,0,0,0|0,1,1]=4 3655 B16R2.24933 CC(Br)Cc1cc2ccccc2c(Cl)n1 Amb33431652 [0,2,0,0,0,0|2,0,0]=4 3656 B16R2.24933 CC(C)NC1=Cc2ccccc2C(=O)N1 Amb18950428 [0,2,0,0,0,0|2,0,0]=4 3657 B16R2.24933 CC(C)Oc1cc2ccccc2c(N)n1 Amb32658950 [0,2,0,0,0,0|1,0,0]=3 3658 B16R2.24933 CC(N)Cc1cc(F)c2ncccc2c1 Amb19105931 [0,2,0,0,0,0|2,0,0]=4 3659 B16R2.24933 Cc1cc(CC(C)N)nc2ccccc12 Amb18353846 [0,2,0,0,0,0|2,0,0]=4 3660 B16R2.24933 Nc1nc(OC(F)F)cc2ccccc12 Amb32658952 [0,2,0,0,0,0|2,0,0]=4 3661 B16R2.33887 COC(=O)c1cc(N)c2ccccc2c1 Amb32697273 [0,2,0,0,0,0|2,0,0]=4 3662 B16R2.33887 COC(=O)c1cc(O)c2ccccc2c1 Amb18653758 [0,2,0,0,0,0|2,0,0]=4 3663 B16R2.114016 CCOC1=Nc2cccc(F)c2C(=O)O1 Amb24079288 [0,2,0,0,0,0|2,0,0]=4 3664 B16R2.64 CCCc1cc2ccccc2nc1NN Amb5746700 [0,2,0,0,0,0|2,0,0]=4 3665 B16R2.64 CCCc1nc2ccccc2cc1NN Amb33134354 [0,2,0,0,0,0|2,0,0]=4 3666 B16R2.64 CCOc1cc2ccccc2nc1CC Amb24085962 [0,2,0,0,0,0|1,0,0]=3 3667 B16R2.64 CCOc1nc2ccccc2cc1C#N Amb5756088 [0,2,0,0,0,0|1,0,0]=3 3668 B16R2.64 CCOc1nc2ccccc2cc1C=O Amb2605696 [0,2,0,0,0,0|1,0,0]=3 3669 B16R2.64 CCOc1nc2ccccc2cc1OC Amb24104408 [0,2,0,0,0,0|1,0,0]=3 3670 B16R2.64 CCSc1nc2ccccc2cc1C=O Amb2432681 [0,2,0,0,0,0|1,1,0]=4 3671 B16R2.3989 CC(Br)Cc1cc2ccccc2nc1Cl Amb33436062 [0,2,0,0,0,0|2,0,0]=4 3672 B16R2.3989 CC(C)Oc1nc2ccccc2nc1Cl Amb30010675 [0,2,0,0,0,0|2,0,0]=4 3673 B16R2.3989 CC(C)Oc1nc2ccccc2nc1F Amb35593839 [0,2,0,0,0,0|2,0,0]=4 3674 B16R2.3989 CC(C)Oc1nc2ncccc2cc1N Amb32424342 [0,2,0,0,0,0|2,0,0]=4 3675 B16R2.3989 CC(O)Cc1cc2ccccc2nc1Cl Amb33058687 [0,2,0,0,0,0|2,0,0]=4 3676 B16R2.3989 C[C@@H](N)Cc1cc2ccccc2nc1Cl Amb33058973 [0,2,0,0,0,0|2,0,0]=4 3677 B16R2.3989 C[C@@H](O)Cc1cc2ccccc2nc1Cl Amb33485135 [0,2,0,0,0,0|2,0,0]=4 3678 B16R2.3989 C[C@H](N)Cc1cc2ccccc2nc1Cl Amb33058873 [0,2,0,0,0,0|2,0,0]=4 3679 B16R2.3989 C[C@H](O)Cc1cc2ccccc2nc1Cl Amb33057297 [0,2,0,0,0,0|2,0,0]=4 3680 B16R2.5844 CCCC1=C(O)c2ccccc2NC1=O Amb20027945 [0,2,0,0,0,0|2,0,0]=4 3681 B16R2.6501 CCCc1nc2ccc(C)cc2cc1O Amb33133962 [0,2,0,0,0,0|2,0,0]=4 3682 B16R2.6501 CCCc1nc2ccc(Cl)cc2cc1O Amb33133135 [0,2,0,0,0,0|2,0,0]=4 3683 B16R2.6501 CCCc1nc2ccc(F)cc2cc1O Amb33133891 [0,2,0,0,0,0|2,0,0]=4 3684 B16R2.6501 CCCc1nc2ccc(N)cc2cc1O Amb33133858 [0,2,0,0,0,0|2,0,0]=4 3685 B16R2.6501 CCOc1cc2ncc(C)nc2cc1F Amb24091634 [0,2,0,0,0,0|2,0,0]=4 3686 B16R2.6538 CCCc1cc2cc(Br)ccc2nc1Cl Amb8388527 [0,2,0,0,0,0|2,0,0]=4 3687 B16R2.6538 CCCc1nc2cc(Br)ccc2cc1O Amb33134008 [0,2,0,0,0,0|2,0,0]=4 3688 B16R2.6538 CCCc1nc2cc(Cl)ccc2cc1O Amb33134119 [0,2,0,0,0,0|2,0,0]=4 3689 B16R2.6538 CCCc1nc2cc(F)ccc2cc1O Amb33133997 [0,2,0,0,0,0|2,0,0]=4 3690 B16R2.6538 CCOc1cc2nc(C)cnc2cc1F Amb24092056 [0,2,0,0,0,0|2,0,0]=4 3691 B16R2.6674 CCCc1nc2cccc(Br)c2cc1O Amb33134020 [0,2,0,0,0,0|2,0,0]=4 3692 B16R2.6674 CCCc1nc2cccc(Cl)c2cc1O Amb33134144 [0,2,0,0,0,0|2,0,0]=4 3693 B16R2.19253 CCCc1nc2c(Br)cccc2cc1O Amb33133911 [0,2,0,0,0,0|2,0,0]=4 3694 B16R2.19253 CCCc1nc2c(C)cccc2cc1O Amb33133930 [0,2,0,0,0,0|2,0,0]=4 3695 B16R2.19253 CCCc1nc2c(Cl)cccc2cc1O Amb33134084 [0,2,0,0,0,0|2,0,0]=4 3696 B16R2.19253 CCCc1nc2c(F)cccc2cc1O Amb33134009 [0,2,0,0,0,0|2,0,0]=4 3697 B16R2.33941 CCC(=O)c1cc2ccccc2cc1N Amb28197048 [0,2,0,0,0,0|1,0,0]=3 3698 B16R2.33941 CCC(C)c1nc2ccccc2cc1O Amb33133846 [0,2,0,0,0,0|2,0,0]=4 3699 B16R2.33941 COC(=O)c1cc2ccccc2cc1I Amb32410954 [0,2,0,0,0,0|2,0,0]=4 3700 B16R2.33941 COC(=O)c1cc2ccccc2cc1N Amb7764617 [0,2,0,0,0,0|2,0,0]=4 3701 B16R2.33941 COC(=O)c1cc2ccccc2cc1O Amb6357820 [0,2,0,0,0,0|2,0,0]=4 3702 B16R2.33941 COC(=O)c1cc2ccccc2cc1S Amb27611051 [0,2,0,0,0,0|2,0,0]=4 3703 B16R2.1205 CCC(C)c1ccc2ncc(N)cc2c1 Amb32673378 [0,2,0,0,0,0|2,0,0]=4 3704 B16R2.1205 COC(=O)c1ccc2ccc(O)cc2c1 Amb22751762 [0,2,0,0,0,0|2,0,0]=4 3705 B16R2.11975 CC(=O)Oc1ccc2ccc(O)cc2c1 Amb28905948 [0,2,0,0,0,0|0,0,1]=3 3706 B16R2.11975 CC(=O)Oc1ccc2ncc(Br)cc2c1 Amb19895073 [0,2,0,0,0,0|1,0,1]=4 3707 B16R2.11975 CC(C)Cc1ccc2ccc(O)cc2c1 Amb32751471 [0,2,0,0,0,0|1,0,0]=3 3708 B16R2.11975 CC(C)Oc1ccc2ncc(N)cc2c1 Amb23580245 [0,2,0,0,0,0|1,0,0]=3 3709 B16R2.11975 Cc1ccc2ccc(CC(C)N)cc2n1 Amb18353828 [0,2,0,0,0,0|2,0,0]=4 3710 B16R2.11975 FC(F)Oc1ccc2ccc(Cl)nc2c1 Amb33743930 [0,2,0,0,0,0|2,0,0]=4 3711 B16R2.11975 Nc1cnc2ccc(OC(F)F)cc2c1 Amb32673365 [0,2,0,0,0,0|2,0,0]=4 3712 B16R2.11975 Oc1ccc2ccc(OC(F)F)cc2n1 Amb33734239 [0,2,0,0,0,0|2,0,0]=4 3713 B16R2.11975 Oc1ccc2ccc(OC(F)F)nc2c1 Amb22236391 [0,2,0,0,0,0|2,0,0]=4 3714 B16R2.11975 Oc1ccc2ncc(OC(F)F)cc2c1 Amb34029563 [0,2,0,0,0,0|2,0,0]=4 3715 B16R2.28226 CCOc1ccc2c(c1)C=C(C=O)CO2 Amb1110479 [0,2,0,0,0,0|1,0,1]=4 3716 B16R2.28226 CCOc1ccc2ncc(CN)cc2c1 Amb23580336 [0,2,0,0,0,0|1,0,0]=3 3717 B16R2.28261 CCCc1ccc2ncc(I)c(Cl)c2c1 Amb28119328 [0,2,0,0,0,0|2,0,0]=4 3718 B16R2.28261 CCCc1ccc2ncc(N)c(Cl)c2c1 Amb27631175 [0,2,0,0,0,0|2,0,0]=4 3719 B16R2.28261 CCCc1ccc2ncc(N)c(N)c2c1 Amb32673440 [0,2,0,0,0,0|2,0,0]=4 3720 B16R2.28261 CCOc1ccc2ncc(Br)c(Br)c2c1 Amb10808188 [0,2,0,0,0,0|1,0,0]=3 3721 B16R2.28261 CCOc1ccc2ncc(Br)c(Cl)c2c1 Amb10241220 [0,2,0,0,0,0|1,0,0]=3 3722 B16R2.28261 CCOc1ccc2ncc(Br)c(O)c2c1 Amb10241118 [0,2,0,0,0,0|1,0,0]=3 3723 B16R2.28261 CCOc1ccc2ncc(Cl)c(Br)c2c1 Amb10808189 [0,2,0,0,0,0|1,0,0]=3 3724 B16R2.28261 CCOc1ccc2ncc(Cl)c(Cl)c2c1 Amb10241221 [0,2,0,0,0,0|1,0,0]=3 3725 B16R2.28261 CCOc1ccc2ncc(N)c(N)c2c1 Amb32673383 [0,2,0,0,0,0|1,0,0]=3 3726 B16R2.50969 CCOc1ccc2c(c1)C=C(N)C(=O)O2 Amb33129808 [0,2,0,0,0,0|1,0,0]=3 3727 B16R2.50969 CCOc1ccc2nc(Br)c(C)cc2c1 Amb17165334 [0,2,0,0,0,0|1,0,0]=3 3728 B16R2.50969 CCOc1ccc2nc(C)c(O)cc2c1 Amb33134068 [0,2,0,0,0,0|1,0,0]=3 3729 B16R2.50969 CCOc1ccc2nc(Cl)c(C)cc2c1 Amb1994525 [0,2,0,0,0,0|1,0,0]=3 3730 B16R2.50969 CCOc1ccc2nc(Cl)c(Cl)cc2c1 Amb32582433 [0,2,0,0,0,0|1,0,0]=3 3731 B16R2.50969 CCOc1ccc2nc(O)c(O)nc2c1 Amb3617841 [0,2,0,0,0,0|2,0,0]=4 3732 B16R2.50969 CCOc1ccc2nc(S)c(C)cc2c1 Amb2785694 [0,2,0,0,0,0|1,0,0]=3 3733 B16R2.150515 CC1=CC(=O)Oc2cc(OCCl)ccc21 Amb28202536 [0,2,0,0,0,0|2,0,0]=4 3734 B16R2.150515 CCNc1ccc2c(c1)OC(=O)C=C2C Amb20240696 [0,2,0,0,0,0|2,0,0]=4 3735 B16R2.150515 CCOc1ccc2c(Cl)cc(C)nc2c1 Amb24111531 [0,2,0,0,0,0|1,0,0]=3 3736 B16R2.150515 CCOc1ccc2c(Cl)nc(Cl)nc2c1 Amb32428561 [0,2,0,0,0,0|2,0,0]=4 3737 B16R2.150515 CCOc1ccc2c(N)cc(C)nc2c1 Amb18653982 [0,2,0,0,0,0|1,0,0]=3 3738 B16R2.150515 CCOc1ccc2c(N)nc(Cl)nc2c1 Amb32428562 [0,2,0,0,0,0|2,0,0]=4 3739 B16R2.150515 CCOc1ccc2c(O)cc(C)nc2c1 Amb24111530 [0,2,0,0,0,0|1,0,0]=3 3740 B16R2.150515 CCOc1ccc2c(O)nc(Cl)nc2c1 Amb32428560 [0,2,0,0,0,0|2,0,0]=4 3741 B16R2.150515 CCOc1ccc2c(c1)CC(=O)NC2=O Amb17212870 [0,2,0,0,0,0|1,0,1]=4 3742 B16R2.150515 CCOc1ccc2c(c1)NC(=O)C=C2O Amb32455780 [0,2,0,0,0,0|1,0,0]=3 3743 B16R2.150515 CCOc1ccc2c(c1)OC(=O)C=C2C Amb18482245 [0,2,0,0,0,0|1,0,0]=3 3744 B16R2.1212 CCC(C)c1ccc2nccc(Br)c2c1 Amb28249732 [0,2,0,0,0,0|2,0,0]=4 3745 B16R2.28301 CCOc1ccc2cccc(OC)c2n1 Amb22167525 [0,2,0,0,0,0|1,0,0]=3 3746 B16R2.28301 CCOc1ccc2nccc(CN)c2c1 Amb31112381 [0,2,0,0,0,0|1,0,0]=3 3747 B16R2.28301 CCOc1ccc2nccc(NN)c2c1 Amb1994656 [0,2,0,0,0,0|1,0,0]=3 3748 B16R2.51625 CCOc1ccc2c(Br)cnc(Br)c2c1 Amb32684064 [0,2,0,0,0,0|1,0,0]=3 3749 B16R2.51625 CCOc1ccc2c(Br)cnc(Cl)c2c1 Amb32683953 [0,2,0,0,0,0|1,0,0]=3 3750 B16R2.51625 CCOc1ccc2c(c1)C(=O)C=CN2C Amb24111659 [0,2,0,0,0,0|1,0,0]=3 3751 B16R2.51625 CCOc1ccc2c(c1)C(=O)NC=C2Br Amb32683872 [0,2,0,0,0,0|1,0,0]=3 3752 B16R2.51625 CCOc1ccc2c(c1)N(C)C=CC2=O Amb24111655 [0,2,0,0,0,0|1,0,0]=3 3753 B16R2.107862 CCCc1ccc2nc(Br)cc(C)c2c1 Amb35580828 [0,2,0,0,0,0|2,0,0]=4 3754 B16R2.107862 CCCc1ccc2nc(Cl)cc(C)c2c1 Amb35690019 [0,2,0,0,0,0|2,0,0]=4 3755 B16R2.107862 CCCc1ccc2nc(Cl)cc(Cl)c2c1 Amb35727538 [0,2,0,0,0,0|2,0,0]=4 3756 B16R2.107862 CCNc1ccc2nc(C)cc(N)c2c1 Amb24065808 [0,2,0,0,0,0|2,0,0]=4 3757 B16R2.107862 CCOc1ccc2c(c1)C(=O)C=C(C)N2 Amb20250820 [0,2,0,0,0,0|1,0,0]=3 3758 B16R2.107862 CCOc1ccc2c(c1)C(=O)NC(C)=C2 Amb32683879 [0,2,0,0,0,0|1,0,0]=3 3759 B16R2.107862 CCOc1ccc2c(c1)C(C)=CC(=S)N2 Amb18038019 [0,2,0,0,0,0|1,0,0]=3 3760 B16R2.107862 CCOc1ccc2cc(C)nc(Br)c2c1 Amb32683995 [0,2,0,0,0,0|1,0,0]=3 3761 B16R2.107862 CCOc1ccc2cc(C)nc(Cl)c2c1 Amb32683971 [0,2,0,0,0,0|1,0,0]=3 3762 B16R2.107862 CCOc1ccc2nc(Br)cc(C)c2c1 Amb19108226 [0,2,0,0,0,0|1,0,0]=3 3763 B16R2.107862 CCOc1ccc2nc(C)cc(Br)c2c1 Amb9134368 [0,2,0,0,0,0|1,0,0]=3 3764 B16R2.107862 CCOc1ccc2nc(C)cc(C)c2c1 Amb4010814 [0,2,0,0,0,0|1,0,0]=3 3765 B16R2.107862 CCOc1ccc2nc(C)cc(Cl)c2c1 Amb1994630 [0,2,0,0,0,0|1,0,0]=3 3766 B16R2.107862 CCOc1ccc2nc(C)cc(N)c2c1 Amb1994594 [0,2,0,0,0,0|1,0,0]=3 3767 B16R2.107862 CCOc1ccc2nc(C)cc(O)c2c1 Amb2556506 [0,2,0,0,0,0|1,0,0]=3 3768 B16R2.107862 CCOc1ccc2nc(C)cc(S)c2c1 Amb10577628 [0,2,0,0,0,0|1,0,0]=3 3769 B16R2.107862 CCOc1ccc2nc(Cl)cc(C)c2c1 Amb17318984 [0,2,0,0,0,0|1,0,0]=3 3770 B16R2.107862 CCOc1ccc2nc(Cl)cc(Cl)c2c1 Amb35713767 [0,2,0,0,0,0|1,0,0]=3 3771 B16R2.107862 CCOc1ccc2nc(Cl)nc(Cl)c2c1 Amb32428558 [0,2,0,0,0,0|2,0,0]=4 3772 B16R2.107862 CCOc1ccc2nc(Cl)nc(N)c2c1 Amb32428559 [0,2,0,0,0,0|2,0,0]=4 3773 B16R2.107862 CCOc1ccc2nc(Cl)nc(O)c2c1 Amb32428557 [0,2,0,0,0,0|2,0,0]=4 3774 B16R2.107862 CCOc1ccc2nc(N)cc(C)c2c1 Amb17595379 [0,2,0,0,0,0|1,0,0]=3 3775 B16R2.107862 CCOc1ccc2nc(O)cc(C)c2c1 Amb23441863 [0,2,0,0,0,0|1,0,0]=3 3776 B16R2.126902 CC(C)Nc1cc2c(F)cccc2cn1 Amb32697393 [0,2,0,0,0,0|2,0,0]=4 3777 B16R2.126902 CC(C)Oc1ccc2cccc(N)c2c1 Amb31094512 [0,2,0,0,0,0|0,0,0]=2 3778 B16R2.126902 CC(C)Oc1ccc2cccc(O)c2c1 Amb35745232 [0,2,0,0,0,0|0,0,0]=2 3779 B16R2.126902 CC(C)Oc1ccc2nccc(Cl)c2c1 Amb9393516 [0,2,0,0,0,0|1,0,0]=3 3780 B16R2.126902 CC(C)Oc1ccc2ncnc(Cl)c2c1 Amb13883465 [0,2,0,0,0,0|2,0,0]=4 3781 B16R2.126902 CC(C)Oc1ccc2ncnc(F)c2c1 Amb32945299 [0,2,0,0,0,0|2,0,0]=4 3782 B16R2.126902 CC(N)Cc1ccc2cccc(Br)c2n1 Amb17585760 [0,2,0,0,0,0|2,0,0]=4 3783 B16R2.126902 CC(N)Cc1ccc2cccc(Cl)c2n1 Amb17580188 [0,2,0,0,0,0|2,0,0]=4 3784 B16R2.126902 Cc1ccnc2ccc(CC(C)N)cc12 Amb18353831 [0,2,0,0,0,0|2,0,0]=4 3785 B16R2.442 CCC(CC)c1ccc2ccccc2c1 Amb33715179 [0,2,0,0,0,0|1,0,0]=3 3786 B16R2.442 CCN(CC)c1ccc2cnccc2c1 Amb19109239 [0,2,0,0,0,0|2,0,0]=4 3787 B16R2.442 CCN(CC)c1cnc2ccccc2c1 Amb18269663 [0,2,0,0,0,0|2,0,0]=4 3788 B16R2.442 CNC(C#N)c1ccc2ccccc2c1 Amb7766949 [0,2,0,0,0,0|2,0,0]=4 3789 B16R2.442 CNC(CO)c1ccc2ccccc2c1 Amb18971909 [0,2,0,0,0,0|2,0,0]=4 3790 B16R2.442 COC(CN)c1ccc2ccccc2c1 Amb17605862 [0,2,0,0,0,0|2,0,0]=4 3791 B16R2.442 NCC(CO)c1ccc2ccccc2c1 Amb33362174 [0,2,0,0,0,0|2,0,0]=4 3792 B16R2.1229 CCC(=O)c1ccc2ccccc2c1I Amb33347070 [0,2,0,0,0,0|1,0,0]=3 3793 B16R2.1229 COC(=O)c1ccc2ccccc2c1C Amb28905896 [0,2,0,0,0,0|2,0,0]=4 3794 B16R2.1229 COC(=O)c1ccc2ccccc2c1N Amb18281257 [0,2,0,0,0,0|2,0,0]=4 3795 B16R2.1229 COC(=O)c1ccc2ccccc2c1O Amb329194 [0,2,0,0,0,0|2,0,0]=4 3796 B16R2.1229 Cc1c(C(=O)CN)ccc2ccccc12 Amb28200680 [0,2,0,0,0,0|2,0,0]=4 3797 B16R2.1229 NC(CF)c1ccc2ccccc2c1O Amb33190133 [0,2,0,0,0,0|2,0,0]=4 3798 B16R2.1229 O=C(CBr)c1ccc2ccccc2c1O Amb19958424 [0,2,0,0,0,0|2,0,0]=4 3799 B16R2.3864 CC(C)(CBr)c1ccc2ccccc2c1 Amb33240790 [0,2,0,0,0,0|2,0,0]=4 3800 B16R2.3864 CC(C)(CN)c1ccc2ccccc2c1 Amb18864248 [0,2,0,0,0,0|2,0,0]=4 3801 B16R2.3864 CC(C)(CO)c1ccc2ccccc2c1 Amb29758507 [0,2,0,0,0,0|2,0,0]=4 3802 B16R2.3864 CC(N)(CO)c1ccc2ccccc2c1 Amb18951192 [0,2,0,0,0,0|2,0,0]=4 3803 B16R2.3864 CC(O)(CN)c1ccc2ccccc2c1 Amb18287326 [0,2,0,0,0,0|2,0,0]=4 3804 B16R2.3864 CNC(C)(C)c1ccc2ccccc2c1 Amb31176236 [0,2,0,0,0,0|2,0,0]=4 3805 B16R2.3864 CNS(=O)(=O)c1ccc2ccccc2c1 Amb1150538 [0,2,0,0,0,0|1,1,0]=4 3806 B16R2.3864 NCC(F)(F)c1ccc2ccccc2c1 Amb33338261 [0,2,0,0,0,0|2,0,0]=4 3807 B16R2.3864 O=S(=O)(CCl)c1ccc2ccccc2c1 Amb28048639 [0,2,0,0,0,0|1,1,0]=4 3808 B16R2.3864 OCC(F)(F)c1ccc2ccccc2c1 Amb33337214 [0,2,0,0,0,0|2,0,0]=4 3809 B16R2.6284 CC(=O)C(Br)c1ccc2ccccc2c1 Amb31193120 [0,2,0,0,0,0|1,0,1]=4 3810 B16R2.6284 CC(Br)C(=O)c1ccc2ccccc2c1 Amb18049146 [0,2,0,0,0,0|1,0,0]=3 3811 B16R2.6284 CC(Br)C(C)c1ccc2ncccc2c1 Amb27807826 [0,2,0,0,0,0|2,0,0]=4 3812 B16R2.6284 CC(Br)C(C)c1cnc2ccccc2c1 Amb27483858 [0,2,0,0,0,0|2,0,0]=4 3813 B16R2.6284 CC(C)C(=O)c1ccc2ccccc2n1 Amb27435479 [0,2,0,0,0,0|2,0,0]=4 3814 B16R2.6284 CC(C)C(=O)c1ccc2cccnc2c1 Amb27652021 [0,2,0,0,0,0|2,0,0]=4 3815 B16R2.6284 CC(C)C(=O)c1ccc2cnccc2c1 Amb28190378 [0,2,0,0,0,0|2,0,0]=4 3816 B16R2.6284 CC(C)C(=O)c1ccc2ncccc2c1 Amb27773374 [0,2,0,0,0,0|2,0,0]=4 3817 B16R2.6284 CC(C)C(=O)c1cnc2ccccc2c1 Amb19056468 [0,2,0,0,0,0|2,0,0]=4 3818 B16R2.6284 CC(Cl)C(=O)c1ccc2ccccc2c1 Amb18049310 [0,2,0,0,0,0|1,0,0]=3 3819 B16R2.6284 CC(N)C(=O)c1ccc2ccccc2c1 Amb18623693 [0,2,0,0,0,0|1,0,0]=3 3820 B16R2.6284 CC(N)C(=O)c1ccc2ccccc2n1 Amb33201932 [0,2,0,0,0,0|2,0,0]=4 3821 B16R2.6284 CC(N)C(=O)c1ccc2cccnc2c1 Amb25228408 [0,2,0,0,0,0|2,0,0]=4 3822 B16R2.6284 CC(N)C(=O)c1ccc2ncccc2c1 Amb26857702 [0,2,0,0,0,0|2,0,0]=4 3823 B16R2.6284 CC(N)C(=O)c1cnc2ccccc2c1 Amb25836998 [0,2,0,0,0,0|2,0,0]=4 3824 B16R2.6284 CC(O)C(=O)c1ccc2cnccc2c1 Amb27399028 [0,2,0,0,0,0|2,0,0]=4 3825 B16R2.6284 CC(O)C(=O)c1ccc2ncccc2c1 Amb27842664 [0,2,0,0,0,0|2,0,0]=4 3826 B16R2.6284 CC(O)C(=O)c1cnc2ccccc2c1 Amb27857604 [0,2,0,0,0,0|2,0,0]=4 3827 B16R2.6284 CC(O)C(C)c1ccc2ccccc2n1 Amb20623546 [0,2,0,0,0,0|2,0,0]=4 3828 B16R2.6284 C[C@@H](N)C(=O)c1ccc2ccccc2c1 Amb35588722 [0,2,0,0,0,0|1,0,0]=3 3829 B16R2.6284 C[C@@H](N)C(=O)c1ccc2cccnc2c1 Amb35588730 [0,2,0,0,0,0|2,0,0]=4 3830 B16R2.6284 C[C@@H](N)C(=O)c1ccc2cnccc2c1 Amb35588726 [0,2,0,0,0,0|2,0,0]=4 3831 B16R2.6284 C[C@@H](N)C(=O)c1ccc2ncccc2c1 Amb35588728 [0,2,0,0,0,0|2,0,0]=4 3832 B16R2.6284 C[C@@H](N)C(=O)c1cnc2ccccc2c1 Amb35588731 [0,2,0,0,0,0|2,0,0]=4 3833 B16R2.6284 C[C@H](N)C(=O)c1ccc2ccccc2c1 Amb35738084 [0,2,0,0,0,0|1,0,0]=3 3834 B16R2.6284 C[C@H](N)C(=O)c1ccc2cccnc2c1 Amb35738092 [0,2,0,0,0,0|2,0,0]=4 3835 B16R2.6284 C[C@H](N)C(=O)c1ccc2cnccc2c1 Amb35738088 [0,2,0,0,0,0|2,0,0]=4 3836 B16R2.6284 C[C@H](N)C(=O)c1ccc2ncccc2c1 Amb35738090 [0,2,0,0,0,0|2,0,0]=4 3837 B16R2.6284 C[C@H](N)C(=O)c1cnc2ccccc2c1 Amb35738093 [0,2,0,0,0,0|2,0,0]=4 3838 B16R2.6284 NC(c1ccc2ccccc2c1)C(F)F Amb33338543 [0,2,0,0,0,0|2,0,0]=4 3839 B16R2.6284 O=C(c1ccc2ccccc2c1)C(F)F Amb25925274 [0,2,0,0,0,0|2,0,0]=4 3840 B16R2.6284 OC(c1ccc2ccccc2c1)C(F)F Amb33436505 [0,2,0,0,0,0|2,0,0]=4 3841 B16R2.33799 CCC(=O)c1ccc2c(c1)C=CC(=O)N2 Amb18044327 [0,2,0,0,0,0|2,0,0]=4 3842 B16R2.33799 CCC(=O)c1ccc2nc(C)ccc2c1 Amb28401264 [0,2,0,0,0,0|2,0,0]=4 3843 B16R2.33799 CNC(=O)c1ccc2cc(Br)ccc2c1 Amb19958936 [0,2,0,0,0,0|2,0,0]=4 3844 B16R2.33799 COC(=O)c1ccc2cc(Br)ccc2c1 Amb1086780 [0,2,0,0,0,0|2,0,0]=4 3845 B16R2.33799 COC(=O)c1ccc2cc(F)ccc2c1 Amb22234023 [0,2,0,0,0,0|2,0,0]=4 3846 B16R2.33799 COC(=O)c1ccc2cc(N)ccc2c1 Amb24325175 [0,2,0,0,0,0|2,0,0]=4 3847 B16R2.33799 COC(=O)c1ccc2cc(O)ccc2c1 Amb18653772 [0,2,0,0,0,0|2,0,0]=4 3848 B16R2.33799 COC(=O)c1ccc2cc(S)ccc2c1 Amb33456138 [0,2,0,0,0,0|2,0,0]=4 3849 B16R2.33799 O=C(CBr)c1ccc2cc(Br)ccc2c1 Amb24358586 [0,2,0,0,0,0|2,0,0]=4 3850 B16R2.173132 CCC(C)c1ccc2c(Br)nccc2c1 Amb18062842 [0,2,0,0,0,0|2,0,0]=4 3851 B16R2.173132 CCC(C)c1ccc2c(Cl)nccc2c1 Amb18560386 [0,2,0,0,0,0|2,0,0]=4 3852 B16R2.173132 CCC(C)c1ccc2c(N)nccc2c1 Amb18560446 [0,2,0,0,0,0|2,0,0]=4 3853 B16R2.173132 CCC(C)c1ccc2c(O)nccc2c1 Amb18560352 [0,2,0,0,0,0|2,0,0]=4 3854 B16R2.173132 COC(=O)c1ccc2c(Br)cccc2c1 Amb5722120 [0,2,0,0,0,0|2,0,0]=4 3855 B16R2.173132 COC(=O)c1ccc2c(N)cccc2c1 Amb33309448 [0,2,0,0,0,0|2,0,0]=4 3856 B16R2.173132 COC(=O)c1ccc2c(O)cccc2c1 Amb26304473 [0,2,0,0,0,0|2,0,0]=4 3857 B16R2.11988 CC(=O)Nc1ccc2cc(Br)ccc2c1 Amb28398372 [0,2,0,0,0,0|1,0,1]=4 3858 B16R2.11988 CC(C)Oc1ccc2cc(Br)ccc2c1 Amb25333824 [0,2,0,0,0,0|0,0,0]=2 3859 B16R2.11988 CC(C)Oc1ccc2nc(Cl)ccc2c1 Amb24345177 [0,2,0,0,0,0|1,0,0]=3 3860 B16R2.11988 CC(C)Oc1ccc2nc(S)ccc2c1 Amb31181286 [0,2,0,0,0,0|1,0,0]=3 3861 B16R2.11988 CC(N)Cc1ccc2cc(Cl)ccc2n1 Amb17580190 [0,2,0,0,0,0|2,0,0]=4 3862 B16R2.11988 CC(N)Cc1ccc2cc(F)ccc2n1 Amb17579030 [0,2,0,0,0,0|2,0,0]=4 3863 B16R2.11988 Cc1ccc2cc(CC(C)Br)ccc2n1 Amb33334263 [0,2,0,0,0,0|2,0,0]=4 3864 B16R2.11988 Cc1ccc2cc(CC(C)N)ccc2n1 Amb18353827 [0,2,0,0,0,0|2,0,0]=4 3865 B16R2.11988 Cc1ccc2cc(CC(C)O)ccc2n1 Amb33201051 [0,2,0,0,0,0|2,0,0]=4 3866 B16R2.11988 Cc1ccc2cc(C[C@@H](C)N)ccc2n1 Amb33200741 [0,2,0,0,0,0|2,0,0]=4 3867 B16R2.11988 Cc1ccc2cc(C[C@@H](C)N)ccc2n1 Amb35751959 [0,2,0,0,0,0|2,0,0]=4 3868 B16R2.11988 Cc1ccc2cc(C[C@@H](C)O)ccc2n1 Amb33200740 [0,2,0,0,0,0|2,0,0]=4 3869 B16R2.11988 Cc1ccc2cc(C[C@H](C)N)ccc2n1 Amb33226209 [0,2,0,0,0,0|2,0,0]=4 3870 B16R2.11988 Cc1ccc2cc(C[C@H](C)O)ccc2n1 Amb33200650 [0,2,0,0,0,0|2,0,0]=4 3871 B16R2.11988 FC(F)Oc1ccc2cc(Br)ccc2c1 Amb25227781 [0,2,0,0,0,0|1,0,0]=3 3872 B16R2.11988 O=C(Cl)Oc1ccc2cc(Br)ccc2c1 Amb27394354 [0,2,0,0,0,0|1,0,1]=4 3873 B16R2.11988 Oc1ccc2nc(OC(F)F)ccc2c1 Amb22236389 [0,2,0,0,0,0|2,0,0]=4 3874 B16R2.22859 CC(C)Cc1ccc2c(Br)nccc2c1 Amb18560410 [0,2,0,0,0,0|2,0,0]=4 3875 B16R2.22859 CC(C)Cc1ccc2c(Cl)nccc2c1 Amb18560383 [0,2,0,0,0,0|2,0,0]=4 3876 B16R2.22859 CC(C)Cc1ccc2c(N)nccc2c1 Amb18560443 [0,2,0,0,0,0|2,0,0]=4 3877 B16R2.22859 CC(C)Cc1ccc2c(O)nccc2c1 Amb18560349 [0,2,0,0,0,0|2,0,0]=4 3878 B16R2.22859 CC(C)Oc1ccc2c(Br)nccc2c1 Amb18062823 [0,2,0,0,0,0|1,0,0]=3 3879 B16R2.22859 CC(C)Oc1ccc2c(Cl)nccc2c1 Amb17216948 [0,2,0,0,0,0|1,0,0]=3 3880 B16R2.22859 CC(C)Oc1ccc2c(N)cccc2c1 Amb31094509 [0,2,0,0,0,0|0,0,0]=2 3881 B16R2.22859 CC(C)Oc1ccc2c(N)nccc2c1 Amb17216969 [0,2,0,0,0,0|1,0,0]=3 3882 B16R2.22859 CC(C)Oc1ccc2c(O)nccc2c1 Amb18062801 [0,2,0,0,0,0|1,0,0]=3 3883 B16R2.22859 CC(C)Oc1ccc2c(c1)C=CNC2=O Amb18034944 [0,2,0,0,0,0|1,0,0]=3 3884 B16R2.22859 Cc1ccnc2cc(CC(C)N)ccc12 Amb18353839 [0,2,0,0,0,0|2,0,0]=4 3885 B16R2.22859 Oc1cccc2nc(OC(F)F)ccc12 Amb22236388 [0,2,0,0,0,0|2,0,0]=4 3886 B16R2.82802 CC(C)(Br)Cc1ccc2ccccc2c1 Amb18049611 [0,2,0,0,0,0|1,0,0]=3 3887 B16R2.82802 CC(C)(C)Nc1cnc2ccccc2c1 Amb18932579 [0,2,0,0,0,0|2,0,0]=4 3888 B16R2.82802 CC(C)(C)Oc1ccc2ncccc2c1 Amb19108437 [0,2,0,0,0,0|1,0,0]=3 3889 B16R2.82802 CC(C)(N)Cc1ccc2ccccc2c1 Amb10601985 [0,2,0,0,0,0|1,0,0]=3 3890 B16R2.82802 CC(C)(N)Cc1ccc2ccccc2c1 Amb19516161 [0,2,0,0,0,0|1,0,0]=3 3891 B16R2.82802 CC(C)(N)Cc1ccc2ccccc2n1 Amb33474754 [0,2,0,0,0,0|2,0,0]=4 3892 B16R2.82802 CC(C)(N)Cc1ccc2cccnc2c1 Amb19105603 [0,2,0,0,0,0|2,0,0]=4 3893 B16R2.82802 CC(C)(N)Cc1ccc2ccncc2c1 Amb18353756 [0,2,0,0,0,0|2,0,0]=4 3894 B16R2.82802 CC(C)(N)Cc1ccc2cnccc2c1 Amb18353758 [0,2,0,0,0,0|2,0,0]=4 3895 B16R2.82802 CC(C)(N)Cc1ccc2ncccc2c1 Amb18353661 [0,2,0,0,0,0|2,0,0]=4 3896 B16R2.82802 CC(C)(N)Cc1cnc2ccccc2c1 Amb33079705 [0,2,0,0,0,0|2,0,0]=4 3897 B16R2.82802 CC(C)(O)Cc1ccc2ccccc2c1 Amb30593635 [0,2,0,0,0,0|1,0,0]=3 3898 B16R2.82802 CC(C)(O)Cc1ccc2ccccc2n1 Amb32953476 [0,2,0,0,0,0|2,0,0]=4 3899 B16R2.82802 CC(C)(O)Cc1ccc2cccnc2c1 Amb32879200 [0,2,0,0,0,0|2,0,0]=4 3900 B16R2.82802 CC(C)(O)Cc1ccc2ncccc2c1 Amb33143360 [0,2,0,0,0,0|2,0,0]=4 3901 B16R2.82802 CC(C)(O)Cc1cnc2ccccc2c1 Amb33324710 [0,2,0,0,0,0|2,0,0]=4 3902 B16R2.82802 CS(=O)(=O)Nc1ccc2ccccc2c1 Amb3099082 [0,2,0,0,0,0|2,0,0]=4 3903 B16R2.82802 CS(=O)(=O)Oc1ccc2ccccc2c1 Amb8422892 [0,2,0,0,0,0|1,0,0]=3 3904 B16R2.82802 CS(=O)(=O)Oc1ccc2ncccc2c1 Amb23448884 [0,2,0,0,0,0|2,0,0]=4 3905 B16R2.82802 C[Si](C)(C)Oc1ccc2ccccc2n1 Amb24106767 [0,2,0,0,0,0|1,1,0]=4 3906 B16R2.82802 FC(F)(F)Oc1ccc2ccccc2c1 Amb22546571 [0,2,0,0,0,0|1,0,0]=3 3907 B16R2.82802 FC(F)(F)Oc1ccc2ncccc2c1 Amb19108438 [0,2,0,0,0,0|2,0,0]=4 3908 B16R2.82802 FC(F)(F)Oc1ccc2ncccc2c1 Amb22235970 [0,2,0,0,0,0|2,0,0]=4 3909 B16R2.82802 NS(=O)(=O)Oc1ccc2ccccc2c1 Amb33056288 [0,2,0,0,0,0|2,0,0]=4 3910 B16R2.82802 O=P([O-])(O)Oc1ccc2ccccc2c1 Amb22263076 [0,2,0,0,0,0|2,0,0]=4 3911 B16R2.82802 O=P([O-])(O)Oc1ccc2ccccc2c1 Amb33512749 [0,2,0,0,0,0|2,0,0]=4 3912 B16R2.83538 CC(=O)Nc1ccc2ccccc2c1Br Amb2610885 [0,2,0,0,0,0|1,0,1]=4 3913 B16R2.83538 CC(C)Nc1ccc2ccccc2c1Br Amb27435265 [0,2,0,0,0,0|1,0,0]=3 3914 B16R2.83538 CC(C)Oc1ccc2ccccc2c1Br Amb27753530 [0,2,0,0,0,0|0,0,0]=2 3915 B16R2.83538 CC(C)Oc1ccc2ccccc2c1N Amb18054387 [0,2,0,0,0,0|0,0,0]=2 3916 B16R2.83538 FC(F)Oc1ccc2ccccc2c1Br Amb26935558 [0,2,0,0,0,0|1,0,0]=3 3917 B16R2.83538 O=C(Cl)Oc1ccc2ccccc2c1Br Amb27963379 [0,2,0,0,0,0|1,0,1]=4 3918 B16R2.83538 Oc1c(OC(F)F)cnc2ccccc12 Amb34029561 [0,2,0,0,0,0|2,0,0]=4 3919 B16R2.28228 CCOc1ccc2cc(Br)ccc2c1Cl Amb33872964 [0,2,0,0,0,0|0,0,0]=2 3920 B16R2.28256 CCOc1ccc2ccccc2c1C#N Amb5774555 [0,2,0,0,0,0|0,0,0]=2 3921 B16R2.28256 CCOc1ccc2ccccc2c1C=O Amb1209048 [0,2,0,0,0,0|0,0,0]=2 3922 B16R2.28256 CCOc1ccc2ccccc2c1CBr Amb9366255 [0,2,0,0,0,0|0,0,0]=2 3923 B16R2.28256 CCOc1ccc2ccccc2c1CCl Amb9366117 [0,2,0,0,0,0|0,0,0]=2 3924 B16R2.28256 CCOc1ccc2ccccc2c1CN Amb5358432 [0,2,0,0,0,0|0,0,0]=2 3925 B16R2.28256 CCOc1ccc2ccccc2c1CO Amb1110156 [0,2,0,0,0,0|0,0,0]=2 3926 B16R2.28256 CCOc1cnc2ccccc2c1CC Amb24085975 [0,2,0,0,0,0|1,0,0]=3 3927 B16R2.28256 CCOc1cnc2ccccc2c1CN Amb32951209 [0,2,0,0,0,0|1,0,0]=3 3928 B16R2.28256 COCc1ccc2ccccc2c1C=O Amb21964955 [0,2,0,0,0,0|2,0,0]=4 3929 B16R2.51619 CCCN1C=Cc2c(O)cccc2C1=O Amb21936584 [0,2,0,0,0,0|2,0,0]=4 3930 B16R2.28230 CCCc1ccc2cc(OC)ccc2c1 Amb20622001 [0,2,0,0,0,0|1,0,0]=3 3931 B16R2.28230 CCOc1ccc2cc(OC)ccc2n1 Amb24086394 [0,2,0,0,0,0|1,0,0]=3 3932 B16R2.28230 CCOc1ccc2nc(C=O)ccc2c1 Amb3931355 [0,2,0,0,0,0|1,0,0]=3 3933 B16R2.28230 CNCc1ccc2cc(OC)ccc2c1 Amb1106070 [0,2,0,0,0,0|2,0,0]=4 3934 B16R2.28230 CNCc1ccc2cc(OC)ccc2c1 Amb33334648 [0,2,0,0,0,0|2,0,0]=4 3935 B16R2.28230 COc1ccc2cc(CCBr)ccc2c1 Amb28289759 [0,2,0,0,0,0|2,0,0]=4 3936 B16R2.28230 COc1ccc2cc(CCN)ccc2c1 Amb6249276 [0,2,0,0,0,0|2,0,0]=4 3937 B16R2.28230 COc1ccc2cc(CCO)ccc2c1 Amb30593445 [0,2,0,0,0,0|2,0,0]=4 3938 B16R2.28230 COc1ccc2cc(CCS)ccc2c1 Amb33195744 [0,2,0,0,0,0|2,0,0]=4 3939 B16R2.619 CCOc1ccc2c(NN)ccnc2c1 Amb24092052 [0,2,0,0,0,0|1,0,0]=3 3940 B16R2.619 CCOc1ccc2c(NN)nccc2c1 Amb17216988 [0,2,0,0,0,0|1,0,0]=3 3941 B14R2.21 C=C1OCCC(c2ccccc2)O1 Amb25897352 [0,0,1,1,0,0|1,0,1]=4 3942 B14R2.21 O=C1C=C(c2ccccc2)CCC1 Amb2613651 [0,0,1,1,0,0|2,0,0]=4 3943 B14R2.30 C=C1COC\C1=C\c2ccccc2 Amb27640106 [0,0,1,1,0,0|2,0,0]=4 3944 B14R2.30 O=C1CCC\C1=C/c2ccccc2 Amb1198712 [0,0,1,1,0,0|2,0,0]=4 3945 B14R2.30 O=C1NCC\C1=C/c2ccccc2 Amb22643155 [0,0,1,1,0,0|2,0,0]=4 3946 B14R2.30 O=C1OCC\C1=C/c2ccccc2 Amb593520 [0,0,1,1,0,0|1,0,0]=3 3947 B14R2.30 S=C1NCC\C1=C/c2ccccc2 Amb26445085 [0,0,1,1,0,0|2,0,0]=4 3948 B14R2.101 C(/Nc1ccccc1)=C2\CCCO2 Amb27453572 [0,0,1,1,0,0|1,0,1]=4 3949 B14R2.101 C(=C\C1CCCO1)/c2ccccc2 Amb4103388 [0,0,1,1,0,0|0,0,2]=4 3950 B14R2.101 C(=C\C1OCCO1)/c2ccccc2 Amb26483959 [0,0,1,1,0,0|1,0,1]=4 3951 B14R2.101 C(=C\c1ccccc1)/C2=NCCN2 Amb27474827 [0,0,1,1,0,0|2,0,0]=4 3952 B14R2.101 C(=C\c1ccccc1)/C2=NCCS2 Amb28139613 [0,0,1,1,0,0|1,1,0]=4 3953 B14R2.101 C(=C\c1ccco1)/c2ccccc2 Amb26498528 [0,0,1,1,0,0|0,0,2]=4 3954 B14R2.101 C1=C(CNc2ccccc2)OCC1 Amb27873530 [0,0,1,1,0,0|1,0,1]=4 3955 B14R2.203 CCN1C(=O)C=Cc2ccccc21 Amb22360524 [0,0,1,1,0,0|2,0,0]=4 3956 B14R2.203 CCN1C(=S)C=Cc2ccccc21 Amb20247294 [0,0,1,1,0,0|2,0,0]=4 3957 B14R2.203 CC[n+]1c(C)ccc2ccccc21 Amb1144527 [0,0,1,1,0,0|1,0,1]=4 3958 B14R2.203 CC[n+]1c(C)ccc2ccccc21 Amb2609772 [0,0,1,1,0,0|1,0,1]=4 3959 B14R2.203 CCc1c(N)ccc2ccccc12 Amb28322316 [0,0,1,1,0,0|2,0,0]=4 3960 B14R2.598 O=C1C=C(c2ccccc2)C(O)O1 Amb28422312 [0,0,1,1,0,0|2,0,0]=4 3961 B14R2.2899 O=C(\C=C\c1ccccc1)C2CC2 Amb1796193 [0,0,1,1,0,0|2,0,0]=4 3962 B14R2.244 O=C\C=C\c1ccc(C2CC2)cc1 Amb33474040 [0,0,1,1,0,0|2,0,0]=4 3963 B14R2.6 C1=CC(Oc2ccccc2)OCC1 Amb27868769 [0,0,1,1,0,0|1,0,1]=4 3964 B14R2.19 Cc1ccc(Sc2ccccc2)o1 Amb27480447 [0,0,1,1,0,0|1,0,1]=4 3965 B14R2.19 O=C1C=C\C(=C/c2ccccc2)O1 Amb28242947 [0,0,1,1,0,0|1,0,1]=4 3966 B14R2.39 CCCC1=C(c2ccccc2)C1=O Amb27261933 [0,0,1,1,0,0|2,0,0]=4 3967 B14R2.1129 C=Cc1cc2ccccc2n1CC Amb27445658 [0,0,1,1,0,0|1,0,0]=3 3968 B14R2.1129 CCn1c(C=O)cc2ccccc21 Amb18127066 [0,0,1,1,0,0|2,0,0]=4 3969 B14R2.1072 CCn1ccc2c(C=O)cccc21 Amb2182760 [0,0,1,1,0,0|2,0,0]=4 3970 B14R2.1145 CC1C\C1=C/c2ccccc2C=O Amb28253866 [0,0,1,1,0,0|2,0,0]=4 3971 B14R2.1914 O=Cc1ccccc1C=C2CCC2 Amb28046254 [0,0,1,1,0,0|2,0,0]=4 3972 B14R2.24101 O=C1CCCC=Cc2ccccc21 Amb27599478 [0,0,1,1,0,0|2,0,0]=4 3973 B14R2.6370 NCCc1ccc2cccccc12 Amb28137729 [0,0,1,1,0,0|2,0,0]=4 3974 B14R2.7150 BrCCc1cccc2ccccc12 Amb2721035 [0,0,1,1,0,0|2,0,0]=4 3975 B14R2.7150 CCCc1cccc2cccnc12 Amb27630042 [0,0,1,1,0,0|2,0,0]=4 3976 B14R2.7150 CCNc1cccc2ccccc12 Amb4313294 [0,0,1,1,0,0|1,0,0]=3 3977 B14R2.7150 CCOc1cccc2c1CC=CC2 Amb27769736 [0,0,1,1,0,0|0,0,2]=4 3978 B14R2.7150 CCOc1cccc2ccccc12 Amb3100947 [0,0,1,1,0,0|0,0,0]=2 3979 B14R2.7150 CCOc1cccc2cccnc12 Amb4035216 [0,0,1,1,0,0|1,0,0]=3 3980 B14R2.7150 CCOc1cccc2cnncc12 Amb27186340 [0,0,1,1,0,0|2,0,0]=4 3981 B14R2.7150 CCOc1ccnc2cccnc12 Amb27209942 [0,0,1,1,0,0|2,0,0]=4 3982 B14R2.7150 CCOc1nccc2ccccc12 Amb24415360 [0,0,1,1,0,0|1,0,0]=3 3983 B14R2.7150 CCOc1ncnc2ccccc12 Amb1420005 [0,0,1,1,0,0|2,0,0]=4 3984 B14R2.7150 CCSc1cccc2ccccc12 Amb28316549 [0,0,1,1,0,0|0,1,0]=3 3985 B14R2.7150 CCSc1ccnc2ccccc12 Amb25924424 [0,0,1,1,0,0|1,1,0]=4 3986 B14R2.7150 CNCc1cccc2ccccc12 Amb1115895 [0,0,1,1,0,0|2,0,0]=4 3987 B14R2.7150 CNCc1cccc2ccccc12 Amb33531254 [0,0,1,1,0,0|2,0,0]=4 3988 B14R2.7150 COCc1cccc2ccccc12 Amb28341769 [0,0,1,1,0,0|2,0,0]=4 3989 B14R2.7150 CSCc1cccc2ccccc12 Amb2613722 [0,0,1,1,0,0|2,0,0]=4 3990 B14R2.7150 ClCOc1cccc2ncccc12 Amb27617911 [0,0,1,1,0,0|2,0,0]=4 3991 B14R2.7150 ICCc1cccc2ccccc12 Amb27808573 [0,0,1,1,0,0|2,0,0]=4 3992 B14R2.7150 NCCc1cccc2ccccc12 Amb19373183 [0,0,1,1,0,0|2,0,0]=4 3993 B14R2.7150 NCCc1cccc2ccccc12 Amb6245392 [0,0,1,1,0,0|2,0,0]=4 3994 B14R2.7150 NCOc1cccc2cccnc12 Amb27662479 [0,0,1,1,0,0|2,0,0]=4 3995 B14R2.7150 OCCc1cccc2ccccc12 Amb2613650 [0,0,1,1,0,0|2,0,0]=4 3996 B14R2.7150 SCCc1cccc2ccccc12 Amb25757447 [0,0,1,1,0,0|2,0,0]=4 3997 B14R2.7413 CCNc1cc2cccccc2n1 Amb27863688 [0,0,1,1,0,0|2,0,0]=4 3998 B14R2.12801 C1=CC=C2C=CC=CC(=C1)COC2 Amb17778323 [0,0,1,1,0,0|2,0,0]=4 3999 B14R2.19194 NCC1c2ccccc1cccc2 Amb27180200 [0,0,1,1,0,0|2,0,0]=4 4000 B14R2.82 C=Cc1cc2c(cc1C=O)OCO2 Amb27859024 [0,0,1,1,0,0|2,0,0]=4 4001 B14R2.24 Cc1ccccc1C2=CCOCC2 Amb33077271 [0,0,1,1,0,0|0,0,2]=4 4002 B14R2.892 O=C\C=C\c1cccc2c1CCC2 Amb33146230 [0,0,1,1,0,0|2,0,0]=4 4003 B14R2.990 O=C\C=C\c1cccc(C2CC2)c1 Amb33079151 [0,0,1,1,0,0|2,0,0]=4 4004 B14R3.52 c1ccc2c3c(cnc2c1)CC3 Amb27254179 [1,0,0,1,0,0|1,0,0]=3 4005 B14R3.2534 c1ccc2nc3c(nc2c1)CC3 Amb24564781 [1,0,0,1,0,0|2,0,0]=4 4006 B14R3.2534 c1cnc2cc3c(cc2n1)CC3 Amb25152623 [1,0,0,1,0,0|2,0,0]=4 4007 B14R3.49 C1=C2C(=Nc3ccccc32)CC1 Amb27423983 [0,0,0,1,1,0|2,0,0]=4 4008 B14R3.49 c1ccc2c3n(nc2c1)CCO3 Amb27803783 [0,0,0,1,1,0|2,0,0]=4 4009 B14R3.51 c1ccc2c(c1)ccn2C3CC3 Amb20248281 [0,0,0,1,1,0|2,0,0]=4 4010 B14R3.164 C1=CC2CCCc3cccc1c32 Amb26880106 [0,0,0,1,1,0|1,0,1]=4 4011 B14R3.164 c1cc2c3c(c1)ccn3CCC2 Amb15693411 [0,0,0,1,1,0|2,0,0]=4 4012 B14R3.14987 C1=C(C2CC2)Cc3ccccc31 Amb28205139 [0,0,0,1,1,0|1,0,1]=4 4013 B14R3.14987 c1ccn2cc(C3CC3)cc2c1 Amb27959048 [0,0,0,1,1,0|2,0,0]=4 4014 B14R3.3015 c1cc2cc(C3CC3)ccc2o1 Amb27267170 [0,0,0,1,1,0|2,0,0]=4 4015 B14R3.3022 c1cc2cc3c(cc2o1)CCN3 Amb27764763 [0,0,0,1,1,0|2,0,0]=4 4016 B14R3.3022 c1cc2cc3c(cc2o1)OCO3 Amb27445319 [0,0,0,1,1,0|2,0,0]=4 4017 B14R3.3046 c1cc2c3c(ccc2o1)OCO3 Amb27481173 [0,0,0,1,1,0|2,0,0]=4 4018 B16R3.9 C1=C2OCCN=C2c3ccccc3N1 Amb27761740 [0,1,0,1,0,0|1,0,0]=3 4019 B16R3.9 C1=Cc2c(ccc3ccccc23)CC1 Amb24513593 [0,1,0,1,0,0|1,0,1]=4 4020 B16R3.9 C1=Cc2c(ccc3ccccc23)OC1 Amb23441463 [0,1,0,1,0,0|0,0,1]=3 4021 B16R3.9 C1=Cc2c(ccc3ccccc23)ON1 Amb28410351 [0,1,0,1,0,0|0,0,2]=4 4022 B16R3.9 C1=Cc2ccc3ccccc3c2OC1 Amb23441464 [0,1,0,1,0,0|1,0,1]=4 4023 B16R3.9 C1=NCCc2c1ccc3ccccc23 Amb28067640 [0,1,0,1,0,0|1,0,0]=3 4024 B16R3.9 c1ccc2c3c(ccc2c1)CCNC3 Amb27849578 [0,1,0,1,0,0|1,0,0]=3 4025 B16R3.9 c1ccc2c3c(ccc2c1)CCNC3 Amb33330561 [0,1,0,1,0,0|1,0,0]=3 4026 B16R3.9 c1ccc2c3c(ccc2c1)CNCC3 Amb19068292 [0,1,0,1,0,0|1,0,0]=3 4027 B16R3.9 c1ccc2c3c(ccc2c1)CNCC3 Amb32693429 [0,1,0,1,0,0|1,0,0]=3 4028 B16R3.9 c1ccc2c3c(cnc2c1)CCCC3 Amb1871531 [0,1,0,1,0,0|2,0,0]=4 4029 B16R3.9 c1ccc2c3c(cnc2c1)CCNC3 Amb24359012 [0,1,0,1,0,0|2,0,0]=4 4030 B16R3.9 c1ccc2c3c(cnc2c1)CNCC3 Amb26865855 [0,1,0,1,0,0|2,0,0]=4 4031 B16R3.9 c1ccc2c3c(cnc2c1)NCCO3 Amb25295412 [0,1,0,1,0,0|2,0,0]=4 4032 B16R3.9 c1cnc2c3c(ccc2c1)CCCN3 Amb28245352 [0,1,0,1,0,0|2,0,0]=4 4033 B16R3.9 c1cnc2c3c(ccc2c1)NCCC3 Amb5718816 [0,1,0,1,0,0|2,0,0]=4 4034 B16R3.1720 C1=CCc2cc3ccccc3cc2C1 Amb27634784 [0,1,0,1,0,0|1,0,1]=4 4035 B16R3.1720 C1=Cc2cc3c(cc2NC1)OCCO3 Amb18062210 [0,1,0,1,0,0|1,0,1]=4 4036 B16R3.1720 C1=Cc2cc3ccccc3nc2OC1 Amb27749402 [0,1,0,1,0,0|1,0,1]=4 4037 B16R3.1720 C1=NCCc2cc3ccccc3cc21 Amb27852381 [0,1,0,1,0,0|1,0,0]=3 4038 B16R3.1720 c1cc2cc3c(cc2cn1)OCCO3 Amb18349258 [0,1,0,1,0,0|1,0,0]=3 4039 B16R3.1720 c1ccc2cc3c(cc2c1)CCCN3 Amb25771744 [0,1,0,1,0,0|1,0,0]=3 4040 B16R3.1720 c1ccc2nc3c(cc2c1)CCCN3 Amb27203829 [0,1,0,1,0,0|2,0,0]=4 4041 B16R3.1720 c1ccc2nc3c(cc2c1)CCNC3 Amb26554975 [0,1,0,1,0,0|2,0,0]=4 4042 B16R3.1720 c1ccc2nc3c(cc2c1)CNCC3 Amb18863092 [0,1,0,1,0,0|2,0,0]=4 4043 B16R3.1720 c1ccc2nc3c(cc2c1)NCCN3 Amb25055313 [0,1,0,1,0,0|2,0,0]=4 4044 B16R3.1720 c1ncc2cc3c(cc2n1)OCCO3 Amb23400325 [0,1,0,1,0,0|2,0,0]=4 4045 B16R3.5186 BrC1CC1c2ccc3ccccc3c2 Amb27493617 [0,1,0,1,0,0|1,0,0]=3 4046 B16R3.5186 Br[C@@H]1C[C@H]1c2ccc3ccccc3c2 Amb28347583 [0,1,0,1,0,0|1,0,0]=3 4047 B16R3.5186 NC1CC1c2ccc3ccccc3c2 Amb19373436 [0,1,0,1,0,0|1,0,0]=3 4048 B16R3.5186 NC1CC1c2ccc3ccccc3c2 Amb9677185 [0,1,0,1,0,0|1,0,0]=3 4049 B16R3.5186 NC1CC1c2ccc3ccccc3n2 Amb27419440 [0,1,0,1,0,0|2,0,0]=4 4050 B16R3.5186 NC1CC1c2ccc3cccnc3c2 Amb32953247 [0,1,0,1,0,0|2,0,0]=4 4051 B16R3.5186 NC1CC1c2ccc3ncccc3c2 Amb26521983 [0,1,0,1,0,0|2,0,0]=4 4052 B16R3.5186 NC1CC1c2cnc3ccccc3c2 Amb33474740 [0,1,0,1,0,0|2,0,0]=4 4053 B16R3.5186 N[C@@H]1C[C@@H]1c2ccc3ccccc3c2 Amb34915318 [0,1,0,1,0,0|1,0,0]=3 4054 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3ccccc3c2 Amb26531031 [0,1,0,1,0,0|1,0,0]=3 4055 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3ccccc3c2 Amb33032244 [0,1,0,1,0,0|1,0,0]=3 4056 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3ccccc3n2 Amb33201639 [0,1,0,1,0,0|2,0,0]=4 4057 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3cccnc3c2 Amb32879505 [0,1,0,1,0,0|2,0,0]=4 4058 B16R3.5186 N[C@@H]1C[C@H]1c2ccc3ncccc3c2 Amb33143669 [0,1,0,1,0,0|2,0,0]=4 4059 B16R3.5186 N[C@@H]1C[C@H]1c2cnc3ccccc3c2 Amb33325123 [0,1,0,1,0,0|2,0,0]=4 4060 B16R3.17392 CP1CCc2ccc3ccccc3c21 Amb28455386 [0,1,0,1,0,0|1,0,0]=3 4061 B16R3.17392 N[C@@H]1CCc2ccc3ccccc3c21 Amb27799166 [0,1,0,1,0,0|1,0,0]=3 4062 B16R3.17392 O=C1CCc2ccc3ccccc3c21 Amb8388293 [0,1,0,1,0,0|1,0,1]=4 4063 B16R3.17392 O=C1CNc2ccc3ccccc3c21 Amb25247233 [0,1,0,1,0,0|1,0,1]=4 4064 B16R3.17392 O=C1COc2ccc3ccccc3c21 Amb2418861 [0,1,0,1,0,0|0,0,1]=3 4065 B16R3.17392 O=C1CSc2ccc3ccccc3c21 Amb24667654 [0,1,0,1,0,0|0,1,1]=4 4066 B16R3.17392 O=C1OCc2ccc3ccccc3c21 Amb4012245 [0,1,0,1,0,0|1,0,1]=4 4067 B16R3.17392 OC1C=Nc2ccc3ccccc3c21 Amb28319908 [0,1,0,1,0,0|1,0,1]=4 4068 B16R3.17428 NC1COc2cc3ccccc3cc21 Amb27640287 [0,1,0,1,0,0|0,0,0]=2 4069 B16R3.17428 NC1COc2cc3ncccc3cc21 Amb27881702 [0,1,0,1,0,0|1,0,0]=3 4070 B16R3.17428 N[C@@H]1CCc2cc3ccccc3cc21 Amb27749405 [0,1,0,1,0,0|1,0,0]=3 4071 B16R3.17428 N[C@@H]1CCc2cc3ncccc3cc21 Amb27749403 [0,1,0,1,0,0|2,0,0]=4 4072 B16R3.17428 N[C@H]1COc2cc3ccccc3cc21 Amb28313751 [0,1,0,1,0,0|0,0,0]=2 4073 B16R3.17428 O=C1CCc2cc3ncccc3cc21 Amb27759931 [0,1,0,1,0,0|2,0,0]=4 4074 B16R3.17428 O=C1COc2cc3ccccc3cc21 Amb25665046 [0,1,0,1,0,0|0,0,1]=3 4075 B16R3.17428 O=C1CSc2cc3ccccc3cc21 Amb17595312 [0,1,0,1,0,0|0,1,1]=4 4076 B16R3.17428 O=C1OCc2cc3ccccc3cc21 Amb4010632 [0,1,0,1,0,0|1,0,1]=4 4077 B16R3.17428 OC1C=Cc2cc3ccccc3cc21 Amb27949423 [0,1,0,1,0,0|1,0,1]=4 4078 B16R3.17428 OC1CCc2cc3ccccc3cc21 Amb24510993 [0,1,0,1,0,0|1,0,0]=3 4079 B16R3.17428 OC1OCc2cc3ccccc3cc21 Amb27594825 [0,1,0,1,0,0|1,0,0]=3 4080 B16R3.63903 c1cc2cc(NC3CC3)ccc2cn1 Amb18355995 [0,1,0,1,0,0|2,0,0]=4 4081 B16R3.63903 c1cc2ccc(NC3CC3)cc2cn1 Amb19109188 [0,1,0,1,0,0|2,0,0]=4 4082 B16R3.63903 c1ccc2cc(CC3CO3)ccc2c1 Amb33550622 [0,1,0,1,0,0|1,0,0]=3 4083 B16R3.63903 c1ccc2nc(CC3CO3)ccc2c1 Amb33201367 [0,1,0,1,0,0|2,0,0]=4 4084 B16R3.63903 c1ccc2ncc(CC3CO3)cc2c1 Amb27211730 [0,1,0,1,0,0|2,0,0]=4 4085 B16R3.63903 c1ccc2ncc(OC3CC3)cc2c1 Amb27600343 [0,1,0,1,0,0|1,0,0]=3 4086 B16R3.63903 c1cnc2cc(CC3CO3)ccc2c1 Amb27747892 [0,1,0,1,0,0|2,0,0]=4 4087 B16R3.63903 c1cnc2ccc(CC3CO3)cc2c1 Amb26343503 [0,1,0,1,0,0|2,0,0]=4 4088 B16R3.63903 c1cnc2ccc(NC3CC3)cc2c1 Amb18270532 [0,1,0,1,0,0|2,0,0]=4 4089 B16R3.275899 c1ccc2cc(C3CCN3)ccc2c1 Amb24657274 [0,1,0,1,0,0|1,0,0]=3 4090 B16R3.275899 c1ccc2cc(C3CNC3)ccc2c1 Amb26512034 [0,1,0,1,0,0|1,0,0]=3 4091 B16R3.275899 c1ccc2cc(C3COC3)ccc2c1 Amb28136975 [0,1,0,1,0,0|1,0,0]=3 4092 B16R3.275899 c1ccc2nc(C3CCN3)ccc2c1 Amb25324365 [0,1,0,1,0,0|2,0,0]=4 4093 B16R3.275899 c1ccc2nc(C3CNC3)ccc2c1 Amb22236356 [0,1,0,1,0,0|2,0,0]=4 4094 B16R3.275899 c1ccc2nc(C3CNC3)ccc2c1 Amb26979896 [0,1,0,1,0,0|2,0,0]=4 4095 B16R3.275899 c1ccc2ncc(C3CCN3)cc2c1 Amb26977092 [0,1,0,1,0,0|2,0,0]=4 4096 B16R3.275899 c1ccc2ncc(C3CNC3)cc2c1 Amb25808639 [0,1,0,1,0,0|2,0,0]=4 4097 B16R3.275899 c1ccc2ncc([C@H]3CCN3)cc2c1 Amb27468653 [0,1,0,1,0,0|2,0,0]=4 4098 B16R3.275899 c1cnc2cc(C3CCN3)ccc2c1 Amb25137104 [0,1,0,1,0,0|2,0,0]=4 4099 B16R3.275899 c1cnc2cc(C3CNC3)ccc2c1 Amb24693635 [0,1,0,1,0,0|2,0,0]=4 4100 B16R3.275899 c1cnc2cc([C@@H]3CCN3)ccc2c1 Amb27593429 [0,1,0,1,0,0|2,0,0]=4 4101 B16R3.275899 c1cnc2ccc(C3CCN3)cc2c1 Amb27957041 [0,1,0,1,0,0|2,0,0]=4 4102 B16R3.275899 c1cnc2ccc(C3CNC3)cc2c1 Amb25760136 [0,1,0,1,0,0|2,0,0]=4 4103 B16R3.2754 Brc1c2c(cc3ccccc13)CCN2 Amb26655720 [0,1,0,1,0,0|1,0,0]=3 4104 B16R3.2754 Brc1c2ccccc2cc3ccoc13 Amb27868082 [0,1,0,1,0,0|0,0,2]=4 4105 B16R3.2754 Cc1c2c(nc3ccccc13)CCC2 Amb27442562 [0,1,0,1,0,0|2,0,0]=4 4106 B16R3.2754 Cc1c2c(nc3ccccc13)CCN2 Amb27222514 [0,1,0,1,0,0|2,0,0]=4 4107 B16R3.2754 Cc1c2c(nc3ccccc13)NCC2 Amb27971832 [0,1,0,1,0,0|2,0,0]=4 4108 B16R3.2754 Cc1c2c(nc3ccccc13)OCC2 Amb28067018 [0,1,0,1,0,0|1,0,0]=3 4109 B16R3.2754 Clc1c2c(nc3ccccc13)CCC2 Amb2446314 [0,1,0,1,0,0|2,0,0]=4 4110 B16R3.2754 Clc1c2c(nc3ccccc13)OCC2 Amb27631697 [0,1,0,1,0,0|1,0,0]=3 4111 B16R3.2754 Clc1c2c(nc3ccccc13)SCC2 Amb27966300 [0,1,0,1,0,0|1,1,0]=4 4112 B16R3.2754 Nc1c2c(nc3ccccc13)CCC2 Amb1007670 [0,1,0,1,0,0|2,0,0]=4 4113 B16R3.2754 Nc1c2c(nc3ccccc13)CCO2 Amb24392296 [0,1,0,1,0,0|1,0,0]=3 4114 B16R3.2754 Nc1c2c(nc3ccccc13)OCC2 Amb18129619 [0,1,0,1,0,0|1,0,0]=3 4115 B16R3.2754 O=C1C2=C(CCC2)Nc3ccccc31 Amb19045715 [0,1,0,1,0,0|2,0,0]=4 4116 B16R3.2754 O=C1c2ccccc2N=C3OCCN13 Amb19665416 [0,1,0,1,0,0|2,0,0]=4 4117 B16R3.2754 O=c1c2c(oc3ccccc13)CCC2 Amb2675752 [0,1,0,1,0,0|2,0,0]=4 4118 B16R3.2754 Oc1c2c(nc3ccccc13)CCC2 Amb2587893 [0,1,0,1,0,0|2,0,0]=4 4119 B16R3.13490 Brc1cc2c(c3ccccc13)NCC2 Amb25076061 [0,1,0,1,0,0|2,0,0]=4 4120 B16R3.13490 Brc1cc2onnc2c3ccccc13 Amb32405853 [0,1,0,1,0,0|2,0,0]=4 4121 B16R3.13490 Nc1cc2c(c3ccccc13)CCC2 Amb18648786 [0,1,0,1,0,0|1,0,0]=3 4122 B16R3.31922 Clc1cc(C2CC2)nc3ccccc13 Amb27226386 [0,1,0,1,0,0|2,0,0]=4 4123 B16R3.31922 Fc1cc(C2CC2)cc3ccncc13 Amb32643966 [0,1,0,1,0,0|2,0,0]=4 4124 B16R3.31922 Nc1cc(C2CC2)nc3ccccc13 Amb17234090 [0,1,0,1,0,0|2,0,0]=4 4125 B16R3.31922 O=C1C=C(C2CC2)Nc3ccccc31 Amb25743562 [0,1,0,1,0,0|2,0,0]=4 4126 B16R3.31922 O=C1NC(C2CC2)=Cc3ccccc31 Amb28324459 [0,1,0,1,0,0|2,0,0]=4 4127 B16R3.2273 Cc1nc2cc3ccccc3cc2o1 Amb4052433 [0,1,0,1,0,0|0,0,1]=3 4128 B16R3.2273 Cc1nc2cc3ccccc3cc2s1 Amb8383636 [0,1,0,1,0,0|0,1,1]=4 4129 B16R3.2273 Clc1nc2cc3ccccc3cc2o1 Amb28410778 [0,1,0,1,0,0|1,0,1]=4 4130 B16R3.2273 O=C1Nc2cc3ccccc3cc2O1 Amb18010202 [0,1,0,1,0,0|1,0,1]=4 4131 B16R3.3492 Clc1nc2ccccc2cc1C3CC3 Amb24704250 [0,1,0,1,0,0|2,0,0]=4 4132 B16R3.3492 Oc1cc2ccccc2nc1C3CC3 Amb32455746 [0,1,0,1,0,0|2,0,0]=4 4133 B16R3.3492 [O-][n+]1cc2ccccc2cc1C3CC3 Amb27804262 [0,1,0,1,0,0|2,0,0]=4 4134 B16R3.3510 O=C1Nc2ccccc2C3=C1CCC3 Amb19654319 [0,1,0,1,0,0|2,0,0]=4 4135 B16R3.3510 S=C1Nc2ccccc2C3=C1CCC3 Amb21995507 [0,1,0,1,0,0|2,0,0]=4 4136 B16R3.10767 Brc1ccc2ccc(C3CC3)nc2c1 Amb32684862 [0,1,0,1,0,0|2,0,0]=4 4137 B16R3.10767 Nc1cnc2ccc(C3CC3)cc2c1 Amb32673407 [0,1,0,1,0,0|2,0,0]=4 4138 B16R3.10767 Oc1ccc2ccc(C3CC3)cc2c1 Amb32751566 [0,1,0,1,0,0|1,0,0]=3 4139 B16R3.10767 Oc1cnc2ccc(C3CC3)cc2c1 Amb35707461 [0,1,0,1,0,0|2,0,0]=4 4140 B16R3.10840 Brc1ccc2cc3c(nc2c1)NCC3 Amb17351971 [0,1,0,1,0,0|2,0,0]=4 4141 B16R3.10840 Brc1ccc2cc3c(nc2c1)OCC3 Amb9134325 [0,1,0,1,0,0|1,0,0]=3 4142 B16R3.10840 Brc1ccc2nc3c(cc2c1)CCC3 Amb8388525 [0,1,0,1,0,0|2,0,0]=4 4143 B16R3.10840 Brc1ccc2nc3c(cc2c1)CCO3 Amb9134324 [0,1,0,1,0,0|1,0,0]=3 4144 B16R3.10840 Brc1cnc2cc3c(cc2c1)OCO3 Amb28124800 [0,1,0,1,0,0|2,0,0]=4 4145 B16R3.10840 C[n+]1ccc2cc3c(cc2c1)OCO3 Amb17779105 [0,1,0,1,0,0|2,0,0]=4 4146 B16R3.10840 Cc1ccc2cc3c(nc2c1)NCC3 Amb5723648 [0,1,0,1,0,0|2,0,0]=4 4147 B16R3.10840 Cc1ccc2cc3c(nc2c1)OCC3 Amb782451 [0,1,0,1,0,0|1,0,0]=3 4148 B16R3.10840 Cc1ccc2nc3c(cc2c1)CCN3 Amb5723647 [0,1,0,1,0,0|2,0,0]=4 4149 B16R3.10840 Clc1cc2cc3c(cc2cn1)OCO3 Amb27238665 [0,1,0,1,0,0|2,0,0]=4 4150 B16R3.10840 Fc1ccc2cc3c(nc2c1)NCC3 Amb17592981 [0,1,0,1,0,0|2,0,0]=4 4151 B16R3.10840 Fc1ccc2nc3c(cc2c1)CCN3 Amb5723651 [0,1,0,1,0,0|2,0,0]=4 4152 B16R3.10840 Nc1ccc2cc3c(cc2n1)OCO3 Amb28364969 [0,1,0,1,0,0|2,0,0]=4 4153 B16R3.10840 Nc1ccc2cc3c(nc2c1)OCC3 Amb26058380 [0,1,0,1,0,0|1,0,0]=3 4154 B16R3.10840 Nc1ccc2nc3c(cc2c1)CCO3 Amb17139128 [0,1,0,1,0,0|1,0,0]=3 4155 B16R3.10840 Nc1ccc2nc3c(cc2c1)CCS3 Amb28073020 [0,1,0,1,0,0|1,1,0]=4 4156 B16R3.10840 O=C1C=Cc2cc3c(cc2N1)OCO3 Amb27643500 [0,1,0,1,0,0|2,0,0]=4 4157 B16R3.10840 O=C1C=Cc2cc3c(cc2O1)OCO3 Amb20247400 [0,1,0,1,0,0|2,0,0]=4 4158 B16R3.10840 Oc1ccc2cc3c(nc2c1)OCC3 Amb25962017 [0,1,0,1,0,0|1,0,0]=3 4159 B16R3.10840 Oc1ccc2nc3c(cc2c1)CCO3 Amb25051270 [0,1,0,1,0,0|1,0,0]=3 4160 B16R3.10840 Sc1ccc2cc3c(cc2n1)OCO3 Amb26058415 [0,1,0,1,0,0|2,0,0]=4 4161 B16R3.11020 Brc1ccc2ccc3c(c2n1)CCO3 Amb35606417 [0,1,0,1,0,0|1,0,0]=3 4162 B16R3.11020 Cc1ccc2ccc3c(c2c1)CC=C3 Amb24753249 [0,1,0,1,0,0|1,0,1]=4 4163 B16R3.11020 Clc1ccc2ccc3c(c2n1)CCO3 Amb35606416 [0,1,0,1,0,0|1,0,0]=3 4164 B16R3.11020 Nc1ccc2ccc3c(c2n1)CCO3 Amb35606283 [0,1,0,1,0,0|1,0,0]=3 4165 B16R3.11020 O=C1C=Cc2ccc3c(c2N1)CCO3 Amb35592716 [0,1,0,1,0,0|1,0,0]=3 4166 B16R3.11020 O=C1C=Cc2ccc3c(c2N1)OCO3 Amb24329370 [0,1,0,1,0,0|2,0,0]=4 4167 B16R3.11020 O=C1C=Cc2ccc3c(c2O1)OCO3 Amb22264539 [0,1,0,1,0,0|2,0,0]=4 4168 B16R3.27813 Brc1nccc2cc3c(cc12)CCC3 Amb18560413 [0,1,0,1,0,0|2,0,0]=4 4169 B16R3.27813 Brc1nccc2cc3c(cc12)OCO3 Amb18346681 [0,1,0,1,0,0|2,0,0]=4 4170 B16R3.27813 Cc1cccc2cc3c(nc12)NCC3 Amb5723649 [0,1,0,1,0,0|2,0,0]=4 4171 B16R3.27813 Clc1ccnc2cc3c(cc12)OCO3 Amb8388205 [0,1,0,1,0,0|2,0,0]=4 4172 B16R3.27813 Clc1nccc2cc3c(cc12)CCC3 Amb18062816 [0,1,0,1,0,0|2,0,0]=4 4173 B16R3.27813 Clc1nccc2cc3c(cc12)OCO3 Amb18346735 [0,1,0,1,0,0|2,0,0]=4 4174 B16R3.27813 Clc1ncnc2cc3c(cc12)OCC3 Amb27249757 [0,1,0,1,0,0|2,0,0]=4 4175 B16R3.27813 Fc1cccc2cc3c(nc12)NCC3 Amb5723650 [0,1,0,1,0,0|2,0,0]=4 4176 B16R3.27813 Fc1nccc2cc3c(cc12)OCO3 Amb35642419 [0,1,0,1,0,0|2,0,0]=4 4177 B16R3.27813 Nc1cccc2cc3c(cc12)OCO3 Amb8440260 [0,1,0,1,0,0|1,0,0]=3 4178 B16R3.27813 Nc1nccc2cc3c(cc12)CCC3 Amb18062851 [0,1,0,1,0,0|2,0,0]=4 4179 B16R3.27813 O=C1C=CNc2cc3c(cc21)OCO3 Amb19047334 [0,1,0,1,0,0|2,0,0]=4 4180 B16R3.27813 O=C1NC=Cc2cc3c(cc21)OCO3 Amb19100722 [0,1,0,1,0,0|2,0,0]=4 4181 B16R3.27813 Oc1cccc2cc3c(cc12)OCO3 Amb27612568 [0,1,0,1,0,0|1,0,0]=3 4182 B16R3.27813 Oc1cccc2cc3c(nc12)CCC3 Amb27612632 [0,1,0,1,0,0|2,0,0]=4 4183 B16R3.27813 Oc1cccc2cc3c(nc12)OCC3 Amb26451190 [0,1,0,1,0,0|1,0,0]=3 4184 B16R3.27813 Oc1nccc2cc3c(cc12)CCC3 Amb18062811 [0,1,0,1,0,0|2,0,0]=4 4185 B16R3.186177 Brc1cccc2ccc(C3CC3)nc12 Amb32684864 [0,1,0,1,0,0|2,0,0]=4 4186 B16R3.186177 Brc1ccnc2ccc(C3CC3)cc12 Amb29865256 [0,1,0,1,0,0|2,0,0]=4 4187 B16R3.186177 Clc1ccnc2ccc(C3CC3)cc12 Amb29865255 [0,1,0,1,0,0|2,0,0]=4 4188 B16R3.186177 Nc1ccnc2ccc(C3CC3)cc12 Amb35721525 [0,1,0,1,0,0|2,0,0]=4 4189 B16R3.186177 O=C1C=CNc2ccc(C3CC3)cc21 Amb35718181 [0,1,0,1,0,0|2,0,0]=4 4190 B16R3.186177 O=C1NC=Cc2ccc(C3CC3)cc21 Amb27599693 [0,1,0,1,0,0|2,0,0]=4 4191 B16R3.2620 ClC1CCc2c1ccc3ccccc23 Amb28070559 [0,1,0,1,0,0|1,0,0]=3 4192 B16R3.2620 N[C@@H]1CCc2c1ccc3ncccc23 Amb28250799 [0,1,0,1,0,0|2,0,0]=4 4193 B16R3.2620 O=C1CCc2c1ccc3ccccc23 Amb18179270 [0,1,0,1,0,0|1,0,0]=3 4194 B16R3.2620 O=C1CCc2c1ccc3cccnc23 Amb27632264 [0,1,0,1,0,0|2,0,0]=4 4195 B16R3.2620 O=C1COc2c1ccc3ccccc23 Amb2418866 [0,1,0,1,0,0|2,0,0]=4 4196 B16R3.2620 OC1CCc2c1ccc3ccccc23 Amb18318790 [0,1,0,1,0,0|1,0,0]=3 4197 B16R3.2620 OC1COc2c1ccc3ccccc23 Amb27641670 [0,1,0,1,0,0|2,0,0]=4 4198 B16R3.2620 OC1OCc2c1ccc3ccccc23 Amb27197586 [0,1,0,1,0,0|2,0,0]=4 4199 B16R3.11647 CC1(c2ccc3ccccc3c2)CC1 Amb25247543 [0,1,0,1,0,0|1,0,0]=3 4200 B16R3.11647 CC1(c2ccc3ccccc3c2)CO1 Amb19068718 [0,1,0,1,0,0|2,0,0]=4 4201 B16R3.11647 NC1(c2cc3ccccc3cn2)CC1 Amb28423392 [0,1,0,1,0,0|2,0,0]=4 4202 B16R3.11647 NC1(c2ccc3ccccc3c2)CC1 Amb19068293 [0,1,0,1,0,0|1,0,0]=3 4203 B16R3.11647 NC1(c2ccc3ccccc3n2)CC1 Amb28041835 [0,1,0,1,0,0|2,0,0]=4 4204 B16R3.11647 NC1(c2ccc3cccnc3c2)CC1 Amb27957133 [0,1,0,1,0,0|2,0,0]=4 4205 B16R3.11647 NC1(c2ccc3ncccc3c2)CC1 Amb26079242 [0,1,0,1,0,0|2,0,0]=4 4206 B16R3.11647 NC1(c2cnc3ccccc3c2)CC1 Amb27473368 [0,1,0,1,0,0|2,0,0]=4 4207 B16R3.11647 OC1(c2cc3ccccc3cn2)CC1 Amb27965569 [0,1,0,1,0,0|2,0,0]=4 4208 B16R3.11647 OC1(c2ccc3ccccc3c2)CC1 Amb19068717 [0,1,0,1,0,0|1,0,0]=3 4209 B16R3.11647 OC1(c2ccc3ccccc3n2)CC1 Amb19069278 [0,1,0,1,0,0|2,0,0]=4 4210 B16R3.11647 OC1(c2ccc3cccnc3c2)CC1 Amb32879520 [0,1,0,1,0,0|2,0,0]=4 4211 B16R3.11647 OC1(c2ccc3ncccc3c2)CC1 Amb19057911 [0,1,0,1,0,0|2,0,0]=4 4212 B16R3.11647 OC1(c2cnc3ccccc3c2)CC1 Amb28119574 [0,1,0,1,0,0|2,0,0]=4 4213 B16R3.15796 O=C1c2ccc3ccccc3c2C1Cl Amb27827834 [0,1,0,1,0,0|2,0,0]=4 4214 B16R3.335 CC1=Cc2c(ccc3ccccc23)C1 Amb21964649 [0,1,0,1,0,0|1,0,1]=4 4215 B16R3.335 CC1Cc2c(ccc3ccccc23)N1 Amb27165999 [0,1,0,1,0,0|1,0,0]=3 4216 B16R3.335 Cc1nc2c(ccc3ccccc32)s1 Amb1151328 [0,1,0,1,0,0|0,1,1]=4 4217 B16R3.335 Cc1nc2ccc3ccccc3c2o1 Amb8516705 [0,1,0,1,0,0|1,0,1]=4 4218 B16R3.335 Cc1nc2ccc3ccccc3c2s1 Amb6336330 [0,1,0,1,0,0|1,0,1]=4 4219 B16R3.335 Nc1nc2c(ccc3ccccc32)o1 Amb23594666 [0,1,0,1,0,0|1,0,1]=4 4220 B16R3.335 O=C1Cc2c(ccc3ccccc23)N1 Amb25277166 [0,1,0,1,0,0|1,0,1]=4 4221 B16R3.335 O=C1Cc2c(ccc3ccccc23)O1 Amb2608678 [0,1,0,1,0,0|0,0,1]=3 4222 B16R3.335 Oc1nc2c(ccc3ccccc32)o1 Amb8479568 [0,1,0,1,0,0|1,0,1]=4 4223 B16R3.2527 O=S1(=O)Oc2cc3ccccc3cc21 Amb2616411 [0,1,0,1,0,0|2,0,0]=4 4224 B16R3.20604 Brc1c(C2CC2)ccc3cccnc13 Amb28130075 [0,1,0,1,0,0|2,0,0]=4 4225 B16R3.20604 Fc1c(C2CC2)ncc3ccccc13 Amb25747725 [0,1,0,1,0,0|2,0,0]=4 4226 B16R3.2120 Oc1cnc2c3c(ccc2c1)OCC3 Amb35606285 [0,1,0,1,0,0|1,0,0]=3 4227 B16R3.96480 Brc1ccc2cc(C3CC3)ccc2n1 Amb29865315 [0,1,0,1,0,0|2,0,0]=4 4228 B16R3.96480 Brc1ccc2nc(C3CC3)ccc2c1 Amb32684863 [0,1,0,1,0,0|2,0,0]=4 4229 B16R3.96480 Nc1ccc2cc(C3CC3)ccc2n1 Amb29865482 [0,1,0,1,0,0|2,0,0]=4 4230 B16R3.96480 O=C1C=Cc2cc(C3CC3)ccc2N1 Amb35718343 [0,1,0,1,0,0|2,0,0]=4 4231 B16R3.3350 Brc1ccnc2c3c(ccc12)OCC3 Amb35606369 [0,1,0,1,0,0|1,0,0]=3 4232 B16R3.3350 Clc1ccnc2c3c(ccc12)OCC3 Amb35606368 [0,1,0,1,0,0|1,0,0]=3 4233 B16R3.3350 Clc1ncnc2c3c(ccc12)OCC3 Amb35744114 [0,1,0,1,0,0|2,0,0]=4 4234 B16R3.3350 Nc1ccnc2c3c(ccc12)OCC3 Amb35606234 [0,1,0,1,0,0|1,0,0]=3 4235 B16R3.3350 O=C1C=CNc2c1ccc3c2CCO3 Amb30029144 [0,1,0,1,0,0|1,0,0]=3 4236 B16R3.3350 O=C1NC=Cc2c1ccc3c2CCO3 Amb27958007 [0,1,0,1,0,0|1,0,0]=3 4237 B16R3.3350 O=C1NC=Nc2c1ccc3c2CCO3 Amb35606058 [0,1,0,1,0,0|2,0,0]=4 4238 B16R3.28181 Brc1cccc2nc(C3CC3)ccc12 Amb32684865 [0,1,0,1,0,0|2,0,0]=4 4239 B16R3.28181 O=C1NC=Cc2cc(C3CC3)ccc21 Amb27631552 [0,1,0,1,0,0|2,0,0]=4 4240 B12R1.51 CCOC(=O)\C=C\c1ccco1 Amb1033025 [0,0,1,0,1,0|2,0,0]=4 4241 B12R1.51 CCOC(=O)\C=C\c1cccs1 Amb21858181 [0,0,1,0,1,0|2,0,0]=4 4242 B12R1.51 CCOC(=O)\C=C\c1ccsc1 Amb33990712 [0,0,1,0,1,0|2,0,0]=4 4243 B12R1.3 C=C\C(=C/CCl)c1ccccc1 Amb27865659 [0,0,1,0,1,0|2,0,0]=4 4244 B12R1.3 CCO\C(=C/Cl)c1ccccc1 Amb28365649 [0,0,1,0,1,0|1,0,0]=3 4245 B12R1.3 CCO\C(=C\Cl)c1ccccc1 Amb28052050 [0,0,1,0,1,0|1,0,0]=3 4246 B12R1.3 CC\C=C(\C=O)c1ccccc1 Amb10807890 [0,0,1,0,1,0|2,0,0]=4 4247 B12R1.308 C=C(OCC)c1ccccc1N Amb33136058 [0,0,1,0,1,0|1,0,0]=3 4248 B12R1.308 C=C(OCC)c1ccccc1O Amb33136251 [0,0,1,0,1,0|1,0,0]=3 4249 B12R1.308 C=C(OCC)c1cccnc1N Amb33136323 [0,0,1,0,1,0|2,0,0]=4 4250 B12R1.308 C=C(OCC)c1ccncc1N Amb33135833 [0,0,1,0,1,0|2,0,0]=4 4251 B12R1.308 C=C(OCC)c1cnccc1C Amb19958591 [0,0,1,0,1,0|1,0,1]=4 4252 B12R1.308 C=C(OCC)c1cnccc1N Amb33136013 [0,0,1,0,1,0|2,0,0]=4 4253 B12R1.308 C=C(OCC)c1ncccc1N Amb33135937 [0,0,1,0,1,0|2,0,0]=4 4254 B12R1.308 C=C(OCC)c1ncccc1O Amb33136066 [0,0,1,0,1,0|2,0,0]=4 4255 B12R1.308 CCOC(=N)c1ccccc1C Amb18792487 [0,0,1,0,1,0|1,0,1]=4 4256 B12R1.308 CCOC(=N)c1ccccc1F Amb20673133 [0,0,1,0,1,0|2,0,0]=4 4257 B12R1.308 CCOC(=N)c1ccccc1F Amb25867109 [0,0,1,0,1,0|2,0,0]=4 4258 B12R1.308 CCOC(=N)c1ccccc1I Amb27845578 [0,0,1,0,1,0|2,0,0]=4 4259 B12R1.308 CCOC(=N)c1ccccc1O Amb25891346 [0,0,1,0,1,0|2,0,0]=4 4260 B12R1.308 CCOC(=O)c1ccccc1Br Amb2687785 [0,0,1,0,1,0|2,0,0]=4 4261 B12R1.308 CCOC(=O)c1ccccc1C Amb3940128 [0,0,1,0,1,0|1,0,1]=4 4262 B12R1.308 CCOC(=O)c1ccccc1Cl Amb3939008 [0,0,1,0,1,0|2,0,0]=4 4263 B12R1.308 CCOC(=O)c1ccccc1F Amb6357502 [0,0,1,0,1,0|2,0,0]=4 4264 B12R1.308 CCOC(=O)c1ccccc1I Amb8384588 [0,0,1,0,1,0|2,0,0]=4 4265 B12R1.308 CCOC(=O)c1ccccc1N Amb1229845 [0,0,1,0,1,0|2,0,0]=4 4266 B12R1.308 CCOC(=O)c1ccccc1O Amb3940304 [0,0,1,0,1,0|2,0,0]=4 4267 B12R1.308 CCOC(=S)c1ccccc1O Amb22230695 [0,0,1,0,1,0|2,0,0]=4 4268 B12R2.1 BrCc1coc2ccccc12 Amb23401826 [1,0,0,0,1,0|2,0,0]=4 4269 B12R2.1 BrCc1csc2ccccc12 Amb10609548 [1,0,0,0,1,0|2,0,0]=4 4270 B12R2.1 CCC1=CCc2ccccc21 Amb27227340 [1,0,0,0,1,0|0,0,1]=3 4271 B12R2.1 CC[n+]1csc2ccccc21 Amb2610544 [1,0,0,0,1,0|2,0,0]=4 4272 B12R2.1 CCc1ccn2ccccc12 Amb27977884 [1,0,0,0,1,0|1,0,0]=3 4273 B12R2.1 CCc1coc2ccccc12 Amb27792683 [1,0,0,0,1,0|1,0,0]=3 4274 B12R2.1 CCc1ncc2ccccn12 Amb2852264 [1,0,0,0,1,0|2,0,0]=4 4275 B12R2.1 CCn1ccc2ccccc21 Amb3708000 [1,0,0,0,1,0|1,0,0]=3 4276 B12R2.1 CCn1ccc2cccnc21 Amb26889057 [1,0,0,0,1,0|2,0,0]=4 4277 B12R2.1 CCn1ccc2ncccc21 Amb26568356 [1,0,0,0,1,0|2,0,0]=4 4278 B12R2.1 CCn1cnc2ccccc21 Amb1104116 [1,0,0,0,1,0|2,0,0]=4 4279 B12R2.1 CNc1coc2ccccc12 Amb26039834 [1,0,0,0,1,0|2,0,0]=4 4280 B12R2.1 CNc1csc2ccccc12 Amb23403655 [1,0,0,0,1,0|2,0,0]=4 4281 B12R2.1 COC1=CCc2ccccc21 Amb17778910 [1,0,0,0,1,0|0,0,1]=3 4282 B12R2.1 COc1ccn2ccccc12 Amb28282776 [1,0,0,0,1,0|1,0,0]=3 4283 B12R2.1 COc1csc2ccccc12 Amb28320302 [1,0,0,0,1,0|1,0,0]=3 4284 B12R2.1 COc1noc2ccccc12 Amb23571257 [1,0,0,0,1,0|2,0,0]=4 4285 B12R2.1 C\C=C1\C=Cc2ccccc21 Amb25322411 [1,0,0,0,1,0|0,0,1]=3 4286 B12R2.1 ClCc1coc2ccccc12 Amb5716310 [1,0,0,0,1,0|2,0,0]=4 4287 B12R2.1 ClCc1csc2ccccc12 Amb7808742 [1,0,0,0,1,0|2,0,0]=4 4288 B12R2.1 FCc1coc2ccccc12 Amb27186252 [1,0,0,0,1,0|2,0,0]=4 4289 B12R2.1 FCn1ccc2ccccc21 Amb27848541 [1,0,0,0,1,0|2,0,0]=4 4290 B12R2.1 NCC1=CCc2ccccc21 Amb18560208 [1,0,0,0,1,0|1,0,1]=4 4291 B12R2.1 NCC1C=Cc2ccccc21 Amb17470375 [1,0,0,0,1,0|1,0,1]=4 4292 B12R2.1 NCc1coc2ccccc12 Amb19373967 [1,0,0,0,1,0|2,0,0]=4 4293 B12R2.1 NCc1coc2ccccc12 Amb19649824 [1,0,0,0,1,0|2,0,0]=4 4294 B12R2.1 NCc1csc2ccccc12 Amb2723184 [1,0,0,0,1,0|2,0,0]=4 4295 B12R2.1 NCc1csc2ccccc12 Amb3941423 [1,0,0,0,1,0|2,0,0]=4 4296 B12R2.1 OCc1coc2ccccc12 Amb10572402 [1,0,0,0,1,0|2,0,0]=4 4297 B12R2.1 OCc1csc2ccccc12 Amb2723182 [1,0,0,0,1,0|2,0,0]=4 4298 B12R2.1 OCc1occ2ccccc12 Amb28345290 [1,0,0,0,1,0|2,0,0]=4 4299 B12R2.1 SCc1coc2ccccc12 Amb24405838 [1,0,0,0,1,0|2,0,0]=4 4300 B12R2.1 SCc1csc2ccccc12 Amb3429654 [1,0,0,0,1,0|2,0,0]=4 4301 B12R2.32 BrCc1cc2ccccc2o1 Amb9175042 [1,0,0,0,1,0|2,0,0]=4 4302 B12R2.32 BrCc1cc2ccccc2s1 Amb25289923 [1,0,0,0,1,0|2,0,0]=4 4303 B12R2.32 CCC1=Cc2ccccc2C1 Amb6357923 [1,0,0,0,1,0|0,0,1]=3 4304 B12R2.32 CC[n+]1cc2ccccc2o1 Amb4010969 [1,0,0,0,1,0|2,0,0]=4 4305 B12R2.32 CCc1cc2ccccc2o1 Amb6608886 [1,0,0,0,1,0|1,0,0]=3 4306 B12R2.32 CCc1cc2ccccn2c1 Amb27621615 [1,0,0,0,1,0|1,0,0]=3 4307 B12R2.32 CCc1cc2ccccn2n1 Amb26463804 [1,0,0,0,1,0|2,0,0]=4 4308 B12R2.32 CCc1nc2ccccc2o1 Amb5494065 [1,0,0,0,1,0|2,0,0]=4 4309 B12R2.32 CCc1nc2ccccc2s1 Amb10573484 [1,0,0,0,1,0|2,0,0]=4 4310 B12R2.32 CNc1cc2ccccc2s1 Amb27428924 [1,0,0,0,1,0|2,0,0]=4 4311 B12R2.32 COc1cc2ccccc2o1 Amb27962930 [1,0,0,0,1,0|1,0,0]=3 4312 B12R2.32 CSc1cc2ccccn2c1 Amb27186368 [1,0,0,0,1,0|1,1,0]=4 4313 B12R2.32 ClCc1cc2ccccc2o1 Amb9004317 [1,0,0,0,1,0|2,0,0]=4 4314 B12R2.32 ClCc1cc2ccccc2s1 Amb16187137 [1,0,0,0,1,0|2,0,0]=4 4315 B12R2.32 NCc1cc2ccccc2o1 Amb6271209 [1,0,0,0,1,0|2,0,0]=4 4316 B12R2.32 NCc1cc2ccccc2o1 Amb9176345 [1,0,0,0,1,0|2,0,0]=4 4317 B12R2.32 NCc1cc2ccccc2s1 Amb1801549 [1,0,0,0,1,0|2,0,0]=4 4318 B12R2.32 NCc1cc2ccccc2s1 Amb6344855 [1,0,0,0,1,0|2,0,0]=4 4319 B12R2.32 NCc1cc2ccccn2c1 Amb17506091 [1,0,0,0,1,0|2,0,0]=4 4320 B12R2.32 OC=C1C=C2C=CC=CC2=C1 Amb27947827 [1,0,0,0,1,0|1,0,1]=4 4321 B12R2.32 OCc1cc2ccccc2o1 Amb1156663 [1,0,0,0,1,0|2,0,0]=4 4322 B12R2.32 OCc1cc2ccccc2s1 Amb2688765 [1,0,0,0,1,0|2,0,0]=4 4323 B12R2.32 SCc1cc2ccccc2o1 Amb32788142 [1,0,0,0,1,0|2,0,0]=4 4324 B12R2.32 SCc1cc2ccccc2s1 Amb26004107 [1,0,0,0,1,0|2,0,0]=4 4325 B12R2.44 BrCc1ccc2ccoc2c1 Amb23401749 [1,0,0,0,1,0|2,0,0]=4 4326 B12R2.44 BrCc1ccc2occc2c1 Amb23401833 [1,0,0,0,1,0|2,0,0]=4 4327 B12R2.44 CCc1ccc2cncn2c1 Amb28042500 [1,0,0,0,1,0|2,0,0]=4 4328 B12R2.44 CCc1ccc2ncoc2c1 Amb27224299 [1,0,0,0,1,0|2,0,0]=4 4329 B12R2.44 CCc1ccc2ocnc2c1 Amb17304940 [1,0,0,0,1,0|2,0,0]=4 4330 B12R2.44 CCc1ccc2sccc2c1 Amb24727277 [1,0,0,0,1,0|1,0,0]=3 4331 B12R2.44 CCc1ccn2ccnc2c1 Amb27263657 [1,0,0,0,1,0|2,0,0]=4 4332 B12R2.44 CCc1ccn2nccc2c1 Amb25797476 [1,0,0,0,1,0|2,0,0]=4 4333 B12R2.44 CCc1cnc2sccc2c1 Amb27225131 [1,0,0,0,1,0|2,0,0]=4 4334 B12R2.44 COc1ccc2c(c1)C=CC2 Amb2383764 [1,0,0,0,1,0|0,0,1]=3 4335 B12R2.44 COc1ccc2c(c1)CC=C2 Amb21857137 [1,0,0,0,1,0|0,0,1]=3 4336 B12R2.44 COc1ccc2ccoc2c1 Amb21962786 [1,0,0,0,1,0|1,0,0]=3 4337 B12R2.44 COc1ccc2ccsc2c1 Amb22001743 [1,0,0,0,1,0|1,0,0]=3 4338 B12R2.44 COc1ccc2ccsc2n1 Amb25335420 [1,0,0,0,1,0|2,0,0]=4 4339 B12R2.44 COc1ccc2cnsc2c1 Amb25891725 [1,0,0,0,1,0|2,0,0]=4 4340 B12R2.44 COc1ccc2nccn2c1 Amb20075795 [1,0,0,0,1,0|2,0,0]=4 4341 B12R2.44 COc1ccc2ncoc2c1 Amb28069420 [1,0,0,0,1,0|2,0,0]=4 4342 B12R2.44 COc1ccc2ncsc2c1 Amb2613726 [1,0,0,0,1,0|2,0,0]=4 4343 B12R2.44 COc1ccc2nocc2c1 Amb10571853 [1,0,0,0,1,0|2,0,0]=4 4344 B12R2.44 COc1ccc2occc2c1 Amb2689090 [1,0,0,0,1,0|1,0,0]=3 4345 B12R2.44 COc1ccc2ocnc2c1 Amb17569997 [1,0,0,0,1,0|2,0,0]=4 4346 B12R2.44 COc1ccc2oncc2c1 Amb22002138 [1,0,0,0,1,0|2,0,0]=4 4347 B12R2.44 COc1ccc2sccc2c1 Amb8439416 [1,0,0,0,1,0|1,0,0]=3 4348 B12R2.44 COc1ccc2scnc2c1 Amb20669166 [1,0,0,0,1,0|2,0,0]=4 4349 B12R2.44 COc1ccc2sncc2c1 Amb26079654 [1,0,0,0,1,0|2,0,0]=4 4350 B12R2.44 COc1ccn2ccnc2c1 Amb22055533 [1,0,0,0,1,0|2,0,0]=4 4351 B12R2.44 COc1ccn2nccc2c1 Amb27860261 [1,0,0,0,1,0|2,0,0]=4 4352 B12R2.44 COc1cnc2sccc2c1 Amb27493459 [1,0,0,0,1,0|2,0,0]=4 4353 B12R2.44 CSc1ccc2occc2c1 Amb24070819 [1,0,0,0,1,0|1,1,0]=4 4354 B12R2.44 ClCc1ccc2ccoc2c1 Amb23401823 [1,0,0,0,1,0|2,0,0]=4 4355 B12R2.44 ClCc1ccc2occc2c1 Amb23401834 [1,0,0,0,1,0|2,0,0]=4 4356 B12R2.44 ClCc1ccc2sccc2c1 Amb23401640 [1,0,0,0,1,0|2,0,0]=4 4357 B12R2.44 NCc1ccc2ccoc2c1 Amb13951983 [1,0,0,0,1,0|2,0,0]=4 4358 B12R2.44 NCc1ccc2ccoc2c1 Amb35789094 [1,0,0,0,1,0|2,0,0]=4 4359 B12R2.44 NCc1ccc2occc2c1 Amb22755776 [1,0,0,0,1,0|2,0,0]=4 4360 B12R2.44 NCc1ccc2occc2c1 Amb2723113 [1,0,0,0,1,0|2,0,0]=4 4361 B12R2.44 NCc1ccc2sccc2c1 Amb1995214 [1,0,0,0,1,0|2,0,0]=4 4362 B12R2.44 NCc1ccc2sccc2c1 Amb8503338 [1,0,0,0,1,0|2,0,0]=4 4363 B12R2.44 OCc1ccc2ccoc2c1 Amb23399611 [1,0,0,0,1,0|2,0,0]=4 4364 B12R2.44 OCc1ccc2ccsc2c1 Amb22736729 [1,0,0,0,1,0|2,0,0]=4 4365 B12R2.44 OCc1ccc2occc2c1 Amb2723112 [1,0,0,0,1,0|2,0,0]=4 4366 B12R2.44 OCc1ccc2sccc2c1 Amb1995227 [1,0,0,0,1,0|2,0,0]=4 4367 B12R2.44 SCc1ccc2occc2c1 Amb33343237 [1,0,0,0,1,0|2,0,0]=4 4368 B12R2.931 NCCC1=Cc2ccccc21 Amb27866978 [0,0,0,0,2,0|2,0,0]=4 4369 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [0,0,0,0,2,0|2,0,0]=4 4370 B14R1.520 CCCC(=O)N\C=C/c1ccccc1 Amb27816219 [0,0,1,0,0,1|2,0,0]=4 4371 B14R1.520 CCCC(=O)\C=C\Nc1ccccc1 Amb28040792 [0,0,1,0,0,1|2,0,0]=4 4372 B14R1.520 CCOC(=O)C\C=C\c1ccccc1 Amb34916573 [0,0,1,0,0,1|1,0,0]=3 4373 B14R1.520 CCOC(=O)C\N=C\c1ccccc1 Amb8394336 [0,0,1,0,0,1|1,0,1]=4 4374 B14R1.520 CCOC(=O)N\C=N\c1ccccc1 Amb27957763 [0,0,1,0,0,1|2,0,0]=4 4375 B14R1.520 CCOC(=O)\C=C/Cc1ccccc1 Amb6295788 [0,0,1,0,0,1|1,0,0]=3 4376 B14R1.520 CCOC(=O)\C=C\Cc1ccccc1 Amb10873144 [0,0,1,0,0,1|1,0,0]=3