0 B12R1.252 BrC(=C)CNCc1ccccc1 Amb1774594 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.252 C=C(Cl)CNCc1ccccc1 Amb19004833 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.252 C=C(F)CNCc1ccccc1 Amb25060778 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.252 CC(=C)CCNc1cccc[n]1 Amb25273311 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.252 CC(=C)CNCc1ccccc1 Amb10608684 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.252 CC(=C)CNCc1ccccc1 Amb17622487 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.252 CC(=N)NCCc1cc[n]cc1 Amb25148471 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.252 CC(=N)NCCc1ccc[n]c1 Amb25148470 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.252 CC(=N)NCCc1cccc[n]1 Amb25051604 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.252 CC(=N)NCCc1ccccc1 Amb25148437 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.252 CC(=O)C#CSc1ccccc1 Amb25767013 [0,0,0,0,0,0|2,0,1]=3 13 B12R1.252 CC(=O)CCCc1cccc[n]1 Amb22284162 [0,0,0,0,0,0|2,0,0]=2 14 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [0,0,0,0,0,0|2,0,0]=2 15 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [0,0,0,0,0,0|2,0,0]=2 16 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [0,0,0,0,0,0|1,0,2]=3 17 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [0,0,0,0,0,0|2,0,1]=3 18 B12R1.252 CC(=O)NCCc1c[n]cc[n]1 Amb25277212 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.252 CC(=O)NCCc1cccc[n]1 Amb22751848 [0,0,0,0,0,0|2,0,0]=2 20 B12R1.252 CC(=O)NCCc1ccncc1 Amb1066478 [0,0,0,0,0,0|2,0,0]=2 21 B12R1.252 CC(=O)NOCc1[n]ccc[n]1 Amb24749174 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.252 CC(=O)NOCc1ccc[n]c1 Amb24420633 [0,0,0,0,0,0|3,0,0]=3 23 B12R1.252 CC(=O)NOCc1cccc[n]1 Amb25077790 [0,0,0,0,0,0|3,0,0]=3 24 B12R1.252 CC(=O)NOCc1ccccc1 Amb10571914 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.252 CC(=O)N\C=C\c1ccc[n]c1 Amb24497056 [0,0,0,0,0,0|2,0,2]=4 26 B12R1.252 CC(=O)OCCC1CC=CCC1 Amb24105649 [0,0,0,0,0,0|0,0,4]=4 27 B12R1.252 CC(=O)OCOc1cccc[n]1 Amb24100497 [0,0,0,0,0,0|2,0,0]=2 28 B12R1.252 CC(=O)O[Hg]Cc1ccccc1 Amb22347638 [0,0,0,0,0,0|1,0,0]=1 29 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [0,0,0,0,0,0|0,0,2]=2 30 B12R1.252 CC(=O)SCCc1ccccn1 Amb17619708 [0,0,0,0,0,0|1,1,0]=2 31 B12R1.252 CC(=O)\C=C/Nc1cccc[n]1 Amb24513633 [0,0,0,0,0,0|3,0,1]=4 32 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb10565265 [0,0,0,0,0,0|2,0,1]=3 33 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb25735703 [0,0,0,0,0,0|2,0,1]=3 34 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb25179518 [0,0,0,0,0,0|1,0,1]=2 35 B12R1.252 CC(=O)\C=C\N=C1C=CNC=C1 Amb25351670 [0,0,0,0,0,0|3,0,1]=4 36 B12R1.252 CC(=O)\C=C\Nc1cccc[n]1 Amb22490408 [0,0,0,0,0,0|3,0,1]=4 37 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [0,0,0,0,0,0|2,0,1]=3 38 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb25179665 [0,0,0,0,0,0|2,0,1]=3 39 B12R1.252 CC(=O)\C=N/Nc1ccccc1 Amb11012875 [0,0,0,0,0,0|3,0,0]=3 40 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [0,0,0,0,0,0|3,0,0]=3 41 B12R1.252 CC(=S)\C=C\Nc1ccccc1 Amb25732011 [0,0,0,0,0,0|2,1,1]=4 42 B12R1.252 CC(Br)CCSc1ccccc1 Amb20623511 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,0,0,0,0,0|2,0,0]=2 44 B12R1.252 CC(C)=CCOc1c[n]ccc1 Amb25314117 [0,0,0,0,0,0|4,0,0]=4 45 B12R1.252 CC(C)=CCOc1cc[n]cc1 Amb24459254 [0,0,0,0,0,0|4,0,0]=4 46 B12R1.252 CC(C)=CCOc1cccc[n]1 Amb25822848 [0,0,0,0,0,0|4,0,0]=4 47 B12R1.252 CC(C)=C\C=C\c1ccccc1 Amb22347651 [0,0,0,0,0,0|2,0,2]=4 48 B12R1.252 CC(C)=NNCc1ccccc1 Amb24421246 [0,0,0,0,0,0|3,0,0]=3 49 B12R1.252 CC(C)CCCc1ccccc1 Amb24063684 [0,0,0,0,0,0|2,0,1]=3 50 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [0,0,0,0,0,0|3,0,1]=4 51 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [0,0,0,0,0,0|3,0,1]=4 52 B12R1.252 CC(C)NCCc1cc[n]cc1 Amb24117837 [0,0,0,0,0,0|3,0,1]=4 53 B12R1.252 CC(C)NOCc1ccccc1 Amb24407142 [0,0,0,0,0,0|3,0,1]=4 54 B12R1.252 CC(C)ONCc1ccccc1 Amb24408832 [0,0,0,0,0,0|2,0,1]=3 55 B12R1.252 CC(CCCc1ccccc1)Cl Amb17477428 [0,0,0,0,0,0|2,0,1]=3 56 B12R1.252 CC(CCCc1ccccc1)O Amb17138575 [0,0,0,0,0,0|1,0,2]=3 57 B12R1.252 CC(CCCc1ccccn1)C Amb10573555 [0,0,0,0,0,0|3,0,1]=4 58 B12R1.252 CC(CCCc1cccnc1)N Amb17232504 [0,0,0,0,0,0|3,0,1]=4 59 B12R1.252 CC(CCSc1ccccc1)N Amb13881552 [0,0,0,0,0,0|3,0,1]=4 60 B12R1.252 CC(COCc1ccccc1)N Amb1124568 [0,0,0,0,0,0|3,0,1]=4 61 B12R1.252 CC(Cl)COCc1ccccc1 Amb25059141 [0,0,0,0,0,0|3,0,1]=4 62 B12R1.252 CC(Cl)\C=C\Cc1ccccc1 Amb25724973 [0,0,0,0,0,0|2,0,2]=4 63 B12R1.252 CC(F)CCCc1ccccc1 Amb22229780 [0,0,0,0,0,0|2,0,1]=3 64 B12R1.252 CC(F)CNCc1ccccc1 Amb25795376 [0,0,0,0,0,0|3,0,1]=4 65 B12R1.252 CC(I)CCCc1ccccc1 Amb22274883 [0,0,0,0,0,0|2,0,1]=3 66 B12R1.252 CC(N)=N\C=C\c1ccccc1 Amb25273902 [0,0,0,0,0,0|2,0,2]=4 67 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,0,0,0,0,0|3,0,1]=4 68 B12R1.252 CC(N)CNCc1ccccc1 Amb18305296 [0,0,0,0,0,0|3,0,1]=4 69 B12R1.252 CC(NCCc1ccccc1)C Amb2111109 [0,0,0,0,0,0|2,0,1]=3 70 B12R1.252 CC(NCCc1cccnc1)C Amb17400162 [0,0,0,0,0,0|3,0,1]=4 71 B12R1.252 CC(O)CCCc1c[n]ccc1 Amb22292250 [0,0,0,0,0,0|2,0,2]=4 72 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [0,0,0,0,0,0|2,0,2]=4 73 B12R1.252 CC(OCCc1ccccn1)C Amb10573511 [0,0,0,0,0,0|2,0,1]=3 74 B12R1.252 CC(S)CNCc1ccccc1 Amb18648551 [0,0,0,0,0,0|2,1,1]=4 75 B12R1.252 CN(C)CCOc1ccccc1 Amb22499767 [0,0,0,0,0,0|4,0,0]=4 76 B12R1.252 CN(C)\C=N\Cc1ccccc1 Amb25686859 [0,0,0,0,0,0|4,0,0]=4 77 B12R1.252 CN(CCCc1ccccc1)C Amb1085936 [0,0,0,0,0,0|3,0,0]=3 78 B12R1.252 CN(N)CCNc1ccccc1 Amb18646399 [0,0,0,0,0,0|4,0,0]=4 79 B12R1.252 CN(N)CCOc1ccccc1 Amb18563757 [0,0,0,0,0,0|4,0,0]=4 80 B12R1.252 CS(=O)CCNc1cccc[n]1 Amb24691238 [0,0,0,0,0,0|4,0,0]=4 81 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [0,0,0,0,0,0|3,0,0]=3 82 B12R1.252 CS(=O)NOCc1ccccc1 Amb24620390 [0,0,0,0,0,0|3,0,0]=3 83 B12R1.252 C[C@@H](COCc1ccccc1)N Amb17061656 [0,0,0,0,0,0|3,0,1]=4 84 B12R1.252 C[C@@H](N)CCCc1c[n]ccc1 Amb22388607 [0,0,0,0,0,0|3,0,1]=4 85 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [0,0,0,0,0,0|3,0,1]=4 86 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [0,0,0,0,0,0|2,0,2]=4 87 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [0,0,0,0,0,0|2,0,2]=4 88 B12R1.252 C[C@H](Cl)\C=N\Cc1ccccc1 Amb25279567 [0,0,0,0,0,0|3,0,1]=4 89 B12R1.252 C[C@H](N)CNCc1ccccc1 Amb25047295 [0,0,0,0,0,0|3,0,1]=4 90 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [0,0,0,0,0,0|2,0,2]=4 91 B12R1.252 C[SiH](C)CCCc1ccccc1 Amb22366558 [0,0,0,0,0,0|2,1,0]=3 92 B12R1.252 C\C(\N)=C\C=Nc1ccccc1 Amb25200020 [0,0,0,0,0,0|3,0,1]=4 93 B12R1.252 C\C(\N)=N\N=Cc1ccccc1 Amb25362013 [0,0,0,0,0,0|3,0,1]=4 94 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [0,0,0,0,0,0|3,0,0]=3 95 B12R1.252 ClC(Cl)=CCNc1ccccc1 Amb25160645 [0,0,0,0,0,0|4,0,0]=4 96 B12R1.252 Cl[SiH](Cl)CCCc1ccccc1 Amb22232507 [0,0,0,0,0,0|3,1,0]=4 97 B12R1.252 NC(=N)CCCc1cc[n]cc1 Amb24083112 [0,0,0,0,0,0|4,0,0]=4 98 B12R1.252 NC(=N)CCCc1ccc[n]c1 Amb24062322 [0,0,0,0,0,0|4,0,0]=4 99 B12R1.252 NC(=N)CCCc1cccc[n]1 Amb21618753 [0,0,0,0,0,0|4,0,0]=4 100 B12R1.252 NC(=N)CNCc1ccccc1 Amb25031584 [0,0,0,0,0,0|4,0,0]=4 101 B12R1.252 NC(=N)NCCc1cc[n]cc1 Amb18798340 [0,0,0,0,0,0|4,0,0]=4 102 B12R1.252 NC(=N)NCCc1ccc[n]c1 Amb18798339 [0,0,0,0,0,0|4,0,0]=4 103 B12R1.252 NC(=N)NCCc1cccc[n]1 Amb18798342 [0,0,0,0,0,0|4,0,0]=4 104 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736089 [0,0,0,0,0,0|3,0,0]=3 105 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736599 [0,0,0,0,0,0|3,0,0]=3 106 B12R1.252 NC(=N)NNCc1ccccc1 Amb10553070 [0,0,0,0,0,0|4,0,0]=4 107 B12R1.252 NC(=N)NNCc1ccccc1 Amb18563641 [0,0,0,0,0,0|4,0,0]=4 108 B12R1.252 NC(=N)NOCc1ccccc1 Amb24651150 [0,0,0,0,0,0|4,0,0]=4 109 B12R1.252 NC(=N)SCC[n+]1ccccc1 Amb2228345 [0,0,0,0,0,0|3,1,0]=4 110 B12R1.252 NC(=N)SCCc1ccccc1 Amb20675983 [0,0,0,0,0,0|2,1,0]=3 111 B12R1.252 NC(=O)CCNc1ccc[n]c1 Amb25241565 [0,0,0,0,0,0|4,0,0]=4 112 B12R1.252 NC(=O)CNCc1cccnc1 Amb10609111 [0,0,0,0,0,0|4,0,0]=4 113 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [0,0,0,0,0,0|4,0,0]=4 114 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [0,0,0,0,0,0|4,0,0]=4 115 B12R1.252 NC(=O)C\C=C\c1ccccc1 Amb24470049 [0,0,0,0,0,0|2,0,2]=4 116 B12R1.252 NC(=O)C\N=C\c1ccccc1 Amb24485689 [0,0,0,0,0,0|3,0,1]=4 117 B12R1.252 NC(=O)NCCc1ccc[n]c1 Amb19515015 [0,0,0,0,0,0|3,0,0]=3 118 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [0,0,0,0,0,0|2,0,0]=2 119 B12R1.252 NC(=O)NCCc1ccncc1 Amb10553043 [0,0,0,0,0,0|3,0,0]=3 120 B12R1.252 NC(=O)NN=Cc1ccccc1 Amb2389840 [0,0,0,0,0,0|3,0,1]=4 121 B12R1.252 NC(=O)NNCc1ccccc1 Amb24063820 [0,0,0,0,0,0|3,0,0]=3 122 B12R1.252 NC(=O)NOCc1cccc[n]1 Amb24343576 [0,0,0,0,0,0|4,0,0]=4 123 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [0,0,0,0,0,0|3,0,0]=3 124 B12R1.252 NC(=O)N\C=C\c1ccccc1 Amb25362141 [0,0,0,0,0,0|2,0,2]=4 125 B12R1.252 NC(=O)N\N=N\c1ccccc1 Amb24417714 [0,0,0,0,0,0|4,0,0]=4 126 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [0,0,0,0,0,0|2,0,1]=3 127 B12R1.252 NC(=O)\C=N\Nc1ccccc1 Amb25241203 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.252 NC(=S)CCNc1ccccc1 Amb17233757 [0,0,0,0,0,0|3,1,0]=4 129 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,0,0,0,0,0|3,1,0]=4 130 B12R1.252 NC(=S)CNCc1ccccc1 Amb17233758 [0,0,0,0,0,0|3,1,0]=4 131 B12R1.252 NC(=S)NCCc1cc[n]cc1 Amb18796483 [0,0,0,0,0,0|3,1,0]=4 132 B12R1.252 NC(=S)NCCc1ccc[n]c1 Amb18181422 [0,0,0,0,0,0|3,1,0]=4 133 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [0,0,0,0,0,0|2,1,0]=3 134 B12R1.252 NC(=S)NCSc1ccccc1 Amb25725067 [0,0,0,0,0,0|3,1,0]=4 135 B12R1.252 NC(=S)NNCc1ccccc1 Amb2439185 [0,0,0,0,0,0|3,1,0]=4 136 B12R1.252 NC(=[NH2+])SCCc1cc[nH+]cc1 Amb10556447 [0,0,0,0,0,0|3,1,0]=4 137 B12R1.252 N[13C](=O)N\N=C\c1ccccc1 Amb17608784 [0,0,0,0,0,0|3,0,1]=4 138 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [0,0,0,0,0,0|3,0,0]=3 139 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [0,0,0,0,0,0|2,0,2]=4 140 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [0,0,0,0,0,0|2,0,0]=2 141 B12R1.252 OB(O)CCCc1ccccc1 Amb21928056 [0,0,0,0,0,0|3,0,1]=4 142 B12R1.252 OC(=O)C#CCc1c[n]ccc1 Amb24684542 [0,0,0,0,0,0|3,0,1]=4 143 B12R1.252 OC(=O)C#CCc1cc[n]cc1 Amb25299055 [0,0,0,0,0,0|3,0,1]=4 144 B12R1.252 OC(=O)C#CCc1cccc[n]1 Amb25700659 [0,0,0,0,0,0|3,0,1]=4 145 B12R1.252 OC(=O)C#COc1ccccc1 Amb24634223 [0,0,0,0,0,0|3,0,1]=4 146 B12R1.252 OC(=O)C=C=Cc1ccccc1 Amb25102534 [0,0,0,0,0,0|2,0,2]=4 147 B12R1.252 OC(=O)CC#Cc1ccccc1 Amb18296382 [0,0,0,0,0,0|2,0,2]=4 148 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [0,0,0,0,0,0|2,0,0]=2 149 B12R1.252 OC(=O)CCCc1[n]ccc[n]1 Amb18862661 [0,0,0,0,0,0|4,0,0]=4 150 B12R1.252 OC(=O)CCCc1c[n]c[n]c1 Amb18827885 [0,0,0,0,0,0|4,0,0]=4 151 B12R1.252 OC(=O)CCCc1cc[n]cc1 Amb19929548 [0,0,0,0,0,0|3,0,0]=3 152 B12R1.252 OC(=O)CCCc1cccc[n]1 Amb19356883 [0,0,0,0,0,0|3,0,0]=3 153 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [0,0,0,0,0,0|2,0,0]=2 154 B12R1.252 OC(=O)CCCc1ccccn1 Amb1099328 [0,0,0,0,0,0|3,0,0]=3 155 B12R1.252 OC(=O)CCCc1cccnc1 Amb17232526 [0,0,0,0,0,0|3,0,0]=3 156 B12R1.252 OC(=O)CCCc1ccncc1 Amb1099336 [0,0,0,0,0,0|3,0,0]=3 157 B12R1.252 OC(=O)CCNc1ccc[n]c1 Amb18269696 [0,0,0,0,0,0|4,0,0]=4 158 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [0,0,0,0,0,0|3,0,0]=3 159 B12R1.252 OC(=O)CCNc1ccccn1 Amb10609119 [0,0,0,0,0,0|4,0,0]=4 160 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [0,0,0,0,0,0|3,0,0]=3 161 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [0,0,0,0,0,0|3,0,0]=3 162 B12R1.252 OC(=O)CCSc1ccccn1 Amb1133894 [0,0,0,0,0,0|4,0,0]=4 163 B12R1.252 OC(=O)CNCc1ccccn1 Amb1111426 [0,0,0,0,0,0|4,0,0]=4 164 B12R1.252 OC(=O)CNCc1ccccn1 Amb13951702 [0,0,0,0,0,0|4,0,0]=4 165 B12R1.252 OC(=O)CNCc1cccnc1 Amb1111197 [0,0,0,0,0,0|4,0,0]=4 166 B12R1.252 OC(=O)CNCc1ccncc1 Amb1110916 [0,0,0,0,0,0|4,0,0]=4 167 B12R1.252 OC(=O)CNNc1ccccc1 Amb25258415 [0,0,0,0,0,0|4,0,0]=4 168 B12R1.252 OC(=O)COCc1ccncc1 Amb13883046 [0,0,0,0,0,0|4,0,0]=4 169 B12R1.252 OC(=O)CSCc1ccccn1 Amb1126746 [0,0,0,0,0,0|4,0,0]=4 170 B12R1.252 OC(=O)CSCc1cccnc1 Amb1129471 [0,0,0,0,0,0|4,0,0]=4 171 B12R1.252 OC(=O)CSCc1ccncc1 Amb1134758 [0,0,0,0,0,0|4,0,0]=4 172 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [0,0,0,0,0,0|3,0,0]=3 173 B12R1.252 OC(=O)C\N=C\c1ccccc1 Amb24627161 [0,0,0,0,0,0|3,0,1]=4 174 B12R1.252 OC(=O)\C=C\Cc1ccc[n]c1 Amb25849857 [0,0,0,0,0,0|3,0,1]=4 175 B12R1.252 OC(=O)\C=C\Cc1cccc[n]1 Amb25696841 [0,0,0,0,0,0|3,0,1]=4 176 B12R1.252 OC(=O)\C=C\Nc1ccccc1 Amb25315667 [0,0,0,0,0,0|3,0,1]=4 177 B12R1.252 OC(=O)\C=C\Oc1ccccc1 Amb18645970 [0,0,0,0,0,0|3,0,1]=4 178 B12R1.252 OC(=O)\C=C\Sc1ccccc1 Amb1661597 [0,0,0,0,0,0|3,0,1]=4 179 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [0,0,0,0,0,0|3,0,0]=3 180 B12R1.252 OC(=O)\C=N/Nc1ccccc1 Amb24068313 [0,0,0,0,0,0|4,0,0]=4 181 B12R1.252 OC(=O)\C=N\Nc1ccccc1 Amb17594064 [0,0,0,0,0,0|4,0,0]=4 182 B12R1.252 [O-]C(=O)/C=C/Sc1ccccc1 Amb17913132 [0,0,0,0,0,0|3,0,1]=4 183 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [0,0,0,0,0,0|2,0,0]=2 184 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [0,0,0,0,0,0|3,0,0]=3 185 B12R1.252 [S-]C(=S)NCC[n+]1ccccc1 Amb24470157 [0,0,0,0,0,0|3,1,0]=4 186 B11R1.28 Br[Zn]CCCc1ccccc1 Amb22000503 [1,0,0,0,0,0|3,0,0]=4 187 B11R1.28 Br\C=C/CNc1ccccc1 Amb25063133 [1,0,0,0,0,0|3,0,0]=4 188 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [1,0,0,0,0,0|1,0,2]=4 189 B11R1.28 C/C=C/C=C/c1ccccc1 Amb17939507 [1,0,0,0,0,0|1,0,2]=4 190 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [1,0,0,0,0,0|1,0,0]=2 191 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [1,0,0,0,0,0|1,0,1]=3 192 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [1,0,0,0,0,0|2,0,1]=4 193 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [1,0,0,0,0,0|2,0,1]=4 194 B11R1.28 CC#CCNc1ccccc1 Amb21953777 [1,0,0,0,0,0|2,0,1]=4 195 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [1,0,0,0,0,0|2,0,1]=4 196 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [1,0,0,0,0,0|2,0,0]=3 197 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [1,0,0,0,0,0|1,0,0]=2 198 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [1,0,0,0,0,0|2,0,1]=4 199 B11R1.28 CCCCCc1cccnc1 Amb17672949 [1,0,0,0,0,0|2,0,1]=4 200 B11R1.28 CCCCCc1ccncc1 Amb17672950 [1,0,0,0,0,0|2,0,1]=4 201 B11R1.28 CCCNCc1ccccc1 Amb1105937 [1,0,0,0,0,0|2,0,1]=4 202 B11R1.28 CCNCC[n+]1ccccc1 Amb25383240 [1,0,0,0,0,0|2,0,1]=4 203 B11R1.28 CCNCCc1c[n]ccc1 Amb18303850 [1,0,0,0,0,0|2,0,1]=4 204 B11R1.28 CCNCCc1ccccc1 Amb2119468 [1,0,0,0,0,0|1,0,1]=3 205 B11R1.28 CCOCC[n+]1ccccc1 Amb24762647 [1,0,0,0,0,0|1,0,1]=3 206 B11R1.28 CCOCNc1ccccc1 Amb25856976 [1,0,0,0,0,0|1,0,1]=3 207 B11R1.28 CCOCOc1c[n]ccc1 Amb25383033 [1,0,0,0,0,0|2,0,1]=4 208 B11R1.28 CCOCSc1cc[n]cc1 Amb24762594 [1,0,0,0,0,0|2,0,1]=4 209 B11R1.28 CCOCSc1cccc[n]1 Amb24762592 [1,0,0,0,0,0|2,0,1]=4 210 B11R1.28 CCOCSc1ccccc1 Amb24762591 [1,0,0,0,0,0|1,0,1]=3 211 B11R1.28 CCONCc1ccccc1 Amb25151184 [1,0,0,0,0,0|1,0,1]=3 212 B11R1.28 CCO\N=C\c1ccccc1 Amb25712631 [1,0,0,0,0,0|1,0,2]=4 213 B11R1.28 CCSCSc1ccccc1 Amb25380606 [1,0,0,0,0,0|1,1,1]=4 214 B11R1.28 CNCCCc1c[n]ccc1 Amb23442716 [1,0,0,0,0,0|3,0,0]=4 215 B11R1.28 CNCCCc1cc[n]cc1 Amb19025185 [1,0,0,0,0,0|3,0,0]=4 216 B11R1.28 CNCCCc1cccc[n]1 Amb18312462 [1,0,0,0,0,0|3,0,0]=4 217 B11R1.28 CNCCCc1ccccc1 Amb21954280 [1,0,0,0,0,0|2,0,0]=3 218 B11R1.28 CNCCOc1ccccc1 Amb1105525 [1,0,0,0,0,0|3,0,0]=4 219 B11R1.28 CNCCSc1ccccc1 Amb10608735 [1,0,0,0,0,0|3,0,0]=4 220 B11R1.28 CNCCSc1ccccc1 Amb17622507 [1,0,0,0,0,0|3,0,0]=4 221 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [1,0,0,0,0,0|3,0,0]=4 222 B11R1.28 COCCCc1cccc[n]1 Amb25383067 [1,0,0,0,0,0|3,0,0]=4 223 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,0,0,0,0,0|3,0,0]=4 224 B11R1.28 CONCCc1cccc[n]1 Amb24763045 [1,0,0,0,0,0|3,0,0]=4 225 B11R1.28 CONCCc1ccccc1 Amb22897018 [1,0,0,0,0,0|2,0,0]=3 226 B11R1.28 CONCOc1ccccc1 Amb24096695 [1,0,0,0,0,0|3,0,0]=4 227 B11R1.28 CSCCCc1cc[n]cc1 Amb25382938 [1,0,0,0,0,0|3,0,0]=4 228 B11R1.28 CSCCCc1ccccc1 Amb25383748 [1,0,0,0,0,0|2,0,0]=3 229 B11R1.28 CSCCNc1ccccc1 Amb17307504 [1,0,0,0,0,0|3,0,0]=4 230 B11R1.28 CSCSCc1ccccc1 Amb25380610 [1,0,0,0,0,0|3,0,0]=4 231 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [1,0,0,0,0,0|2,0,0]=3 232 B11R1.28 C\C=C\CNc1c[n]ccc1 Amb25228933 [1,0,0,0,0,0|3,0,0]=4 233 B11R1.28 C\C=C\COc1c[n]ccc1 Amb25151771 [1,0,0,0,0,0|3,0,0]=4 234 B11R1.28 C\C=C\COc1cccc[n]1 Amb24101955 [1,0,0,0,0,0|3,0,0]=4 235 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [1,0,0,0,0,0|2,0,0]=3 236 B11R1.28 Cl[Mg]CCCc1ccccc1 Amb19928784 [1,0,0,0,0,0|3,0,0]=4 237 B11R1.28 Cl\C=C/CNc1ccccc1 Amb25241241 [1,0,0,0,0,0|3,0,0]=4 238 B11R1.28 Cl\C=C\CNc1ccccc1 Amb25148081 [1,0,0,0,0,0|3,0,0]=4 239 B11R1.28 ICCCCc1ccccc1 Amb25380384 [1,0,0,0,0,0|2,0,1]=4 240 B11R1.28 NCCCCc1ccccc1 Amb1227740 [1,0,0,0,0,0|2,0,1]=4 241 B11R1.28 NCCCCc1ccccc1 Amb19929939 [1,0,0,0,0,0|2,0,1]=4 242 B11R1.28 NCNCCc1ccccc1 Amb25385258 [1,0,0,0,0,0|2,0,1]=4 243 B11R1.28 NNCCCc1ccccc1 Amb19373221 [1,0,0,0,0,0|3,0,0]=4 244 B11R1.28 NOCCCc1ccccc1 Amb22231356 [1,0,0,0,0,0|3,0,0]=4 245 B11R1.28 O=C=NCCc1cc[n]cc1 Amb24477613 [1,0,0,0,0,0|2,0,1]=4 246 B11R1.28 O=C=NCCc1cccc[n]1 Amb24390560 [1,0,0,0,0,0|2,0,1]=4 247 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [1,0,0,0,0,0|1,0,1]=3 248 B11R1.28 O=C=NCCc1cccnc1 Amb17232038 [1,0,0,0,0,0|2,0,1]=4 249 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [1,0,0,0,0,0|2,0,1]=4 250 B11R1.28 O=CC#CCc1ccccc1 Amb25189233 [1,0,0,0,0,0|1,0,1]=3 251 B11R1.28 O=CC=C=Cc1ccccc1 Amb24435266 [1,0,0,0,0,0|1,0,2]=4 252 B11R1.28 O=CC=NNc1ccccc1 Amb24060829 [1,0,0,0,0,0|3,0,0]=4 253 B11R1.28 O=CCCCc1[n]ccc[n]1 Amb24061342 [1,0,0,0,0,0|3,0,0]=4 254 B11R1.28 O=CCCCc1c[n]c[n]c1 Amb24063015 [1,0,0,0,0,0|3,0,0]=4 255 B11R1.28 O=CCCCc1c[n]ccc1 Amb24099514 [1,0,0,0,0,0|2,0,0]=3 256 B11R1.28 O=CCCCc1cc[n]c[n]1 Amb24099617 [1,0,0,0,0,0|3,0,0]=4 257 B11R1.28 O=CCCCc1cc[n]cc1 Amb24099515 [1,0,0,0,0,0|2,0,0]=3 258 B11R1.28 O=CCCCc1cccc[n]1 Amb22897023 [1,0,0,0,0,0|2,0,0]=3 259 B11R1.28 O=CCCOc1cccc[n]1 Amb24762999 [1,0,0,0,0,0|3,0,0]=4 260 B11R1.28 O=CCCSc1cccc[n]1 Amb18177861 [1,0,0,0,0,0|3,0,0]=4 261 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [1,0,0,0,0,0|2,0,0]=3 262 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [1,0,0,0,0,0|2,0,0]=3 263 B11R1.28 O=CCONc1ccccc1 Amb24434643 [1,0,0,0,0,0|3,0,0]=4 264 B11R1.28 O=CCSCc1cc[n]cc1 Amb25383559 [1,0,0,0,0,0|3,0,0]=4 265 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [1,0,0,0,0,0|2,0,0]=3 266 B11R1.28 O=CC\C=C\c1ccccc1 Amb18644267 [1,0,0,0,0,0|1,0,2]=4 267 B11R1.28 O=CNCCc1c[n]cc[n]1 Amb24546681 [1,0,0,0,0,0|3,0,0]=4 268 B11R1.28 O=CNCCc1c[n]ccc1 Amb24592209 [1,0,0,0,0,0|2,0,0]=3 269 B11R1.28 O=CNCCc1cc[n]cc1 Amb24371433 [1,0,0,0,0,0|2,0,0]=3 270 B11R1.28 O=CNCCc1ccccc1 Amb10559023 [1,0,0,0,0,0|1,0,0]=2 271 B11R1.28 O=CNCSc1ccccc1 Amb24382608 [1,0,0,0,0,0|2,0,0]=3 272 B11R1.28 O=CN\C=C\c1ccccc1 Amb25327993 [1,0,0,0,0,0|1,0,2]=4 273 B11R1.28 O=C\C=C/Sc1ccccc1 Amb25827121 [1,0,0,0,0,0|2,0,1]=4 274 B11R1.28 O=C\C=C\Cc1ccccc1 Amb18124787 [1,0,0,0,0,0|1,0,1]=3 275 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [1,0,0,0,0,0|2,0,1]=4 276 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [1,0,0,0,0,0|2,0,1]=4 277 B11R1.28 O=C\C=C\Sc1ccccc1 Amb10563475 [1,0,0,0,0,0|2,0,1]=4 278 B11R1.28 O=C\C=N/Nc1ccccc1 Amb24638012 [1,0,0,0,0,0|3,0,0]=4 279 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [1,0,0,0,0,0|3,0,0]=4 280 B11R1.28 SCCCCc1ccccc1 Amb17400224 [1,0,0,0,0,0|1,1,1]=4 281 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [1,0,0,0,0,0|3,0,0]=4 282 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [1,0,0,0,0,0|2,0,1]=4 283 B13R1.45 CC(=C)C#CC(O)c1ccccc1 Amb25123690 [0,1,0,0,0,0|2,0,1]=4 284 B13R1.45 CC(=CCC(C)=O)c1ccccc1 Amb24090254 [0,1,0,0,0,0|1,0,2]=4 285 B13R1.45 CC(=O)C#CC(=O)c1ccccc1 Amb25134098 [0,1,0,0,0,0|1,0,2]=4 286 B13R1.45 CC(=O)C=CC(C)c1ccccc1 Amb24090253 [0,1,0,0,0,0|1,0,1]=3 287 B13R1.45 CC(=O)CCC(c1ccccn1)Cl Amb17402226 [0,1,0,0,0,0|2,0,0]=3 288 B13R1.45 CC(=O)CCC(c1cccnc1)Cl Amb17402227 [0,1,0,0,0,0|2,0,0]=3 289 B13R1.45 CC(=O)COC(=O)c1ccccc1 Amb22497327 [0,1,0,0,0,0|2,0,1]=4 290 B13R1.45 CC(=O)NCC(=O)c1c[n]ccc1 Amb25115599 [0,1,0,0,0,0|2,0,1]=4 291 B13R1.45 CC(=O)NCC(=O)c1cccc[n]1 Amb25796865 [0,1,0,0,0,0|2,0,1]=4 292 B13R1.45 CC(=O)NCC(C)c1cc[n]cc1 Amb25167442 [0,1,0,0,0,0|2,0,0]=3 293 B13R1.45 CC(=O)NCC(O)c1ccc[n]c1 Amb25091917 [0,1,0,0,0,0|2,0,0]=3 294 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 Amb25311245 [0,1,0,0,0,0|1,0,0]=2 295 B13R1.45 CC(=O)NC[C@@H](O)c1ccccc1 Amb24435357 [0,1,0,0,0,0|1,0,0]=2 296 B13R1.45 CC(=O)NC[C@H](N)c1ccccc1 Amb25752007 [0,1,0,0,0,0|1,0,0]=2 297 B13R1.45 CC(=O)NNC(C)c1ccccc1 Amb24573888 [0,1,0,0,0,0|2,0,0]=3 298 B13R1.45 CC(=O)NOC(=O)c1ccccc1 Amb24726089 [0,1,0,0,0,0|2,0,1]=4 299 B13R1.45 CC(=O)O/C=C(\C)c1ccccc1 Amb17778975 [0,1,0,0,0,0|0,0,2]=3 300 B13R1.45 CC(=O)OCC(=C)c1ccccc1 Amb17778927 [0,1,0,0,0,0|0,0,1]=2 301 B13R1.45 CC(=O)ONC(=O)c1cc[n]cc1 Amb25160710 [0,1,0,0,0,0|2,0,1]=4 302 B13R1.45 CC(=O)ONC(=O)c1cccc[n]1 Amb24745497 [0,1,0,0,0,0|2,0,1]=4 303 B13R1.45 CC(=O)ONC(=O)c1ccccc1 Amb24106396 [0,1,0,0,0,0|1,0,1]=3 304 B13R1.45 CC(=O)OOC(=O)c1ccccc1 Amb17672876 [0,1,0,0,0,0|1,0,1]=3 305 B13R1.45 CC(=O)\C=C\C(=O)c1ccccc1 Amb25094370 [0,1,0,0,0,0|1,0,2]=4 306 B13R1.45 CC(=O)\C=C\C(C)c1ccccc1 Amb25292084 [0,1,0,0,0,0|1,0,1]=3 307 B13R1.45 CC(=O)\C=C\C(O)c1ccccc1 Amb25318863 [0,1,0,0,0,0|1,0,1]=3 308 B13R1.45 CC(=O)\C=C\[C@H](C)c1ccccc1 Amb25059669 [0,1,0,0,0,0|1,0,1]=3 309 B13R1.45 CC(=O)\C=N\N(C)c1ccccc1 Amb24625825 [0,1,0,0,0,0|3,0,0]=4 310 B13R1.45 CC(=S)SCC(=O)c1ccccc1 Amb24309338 [0,1,0,0,0,0|0,2,1]=4 311 B13R1.45 CC(C)=CCC(O)c1cc[n]cc1 Amb24495899 [0,1,0,0,0,0|3,0,0]=4 312 B13R1.45 CC(C)=CCN(C)c1ccccc1 Amb22546825 [0,1,0,0,0,0|3,0,0]=4 313 B13R1.45 CC(C)=CC[C@@H](N)c1ccccc1 Amb25188074 [0,1,0,0,0,0|2,0,0]=3 314 B13R1.45 CC(C)=NCC(O)c1ccccc1 Amb25670758 [0,1,0,0,0,0|2,0,0]=3 315 B13R1.45 CC(C)NCC(O)c1ccccc1 Amb22496618 [0,1,0,0,0,0|2,0,1]=4 316 B13R1.45 CC(CNC(N)=N)c1ccccc1 Amb25286782 [0,1,0,0,0,0|3,0,0]=4 317 B13R1.45 CC(CNC(N)=O)c1ccccc1 Amb25156032 [0,1,0,0,0,0|2,0,0]=3 318 B13R1.45 CC(CSC(N)=N)c1ccccc1 Amb20676022 [0,1,0,0,0,0|2,1,0]=4 319 B13R1.45 CC(NNC(N)=O)c1ccccc1 Amb24070020 [0,1,0,0,0,0|3,0,0]=4 320 B13R1.45 CC(SCC(O)=O)c1ccccc1 Amb22275729 [0,1,0,0,0,0|3,0,0]=4 321 B13R1.45 CC(\N=C\C(N)=O)c1ccccc1 Amb24635800 [0,1,0,0,0,0|3,0,0]=4 322 B13R1.45 CC(\N=C\C(O)=O)c1ccccc1 Amb24545007 [0,1,0,0,0,0|3,0,0]=4 323 B13R1.45 CC(c1ccccc1)CNC(C)C Amb2119052 [0,1,0,0,0,0|2,0,1]=4 324 B13R1.45 CC(c1ccccc1)NCC(=O)N Amb1114995 [0,1,0,0,0,0|3,0,0]=4 325 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb22754498 [0,1,0,0,0,0|3,0,0]=4 326 B13R1.45 CN(C)CC[C@@H](O)c1ccccc1 Amb24181885 [0,1,0,0,0,0|3,0,0]=4 327 B13R1.45 CN(CCC(O)=O)c1ccccc1 Amb19373406 [0,1,0,0,0,0|3,0,0]=4 328 B13R1.45 CN(c1ccccc1)CCC(=O)Cl Amb17143181 [0,1,0,0,0,0|3,0,0]=4 329 B13R1.45 CN(c1ccccc1)CCC(=O)N Amb17142975 [0,1,0,0,0,0|3,0,0]=4 330 B13R1.45 C[C@@H](NCC(N)=O)c1ccccc1 Amb24271280 [0,1,0,0,0,0|3,0,0]=4 331 B13R1.45 C[C@@H](NCC(O)=O)c1ccccc1 Amb17935709 [0,1,0,0,0,0|3,0,0]=4 332 B13R1.45 C[C@H](C#CC(O)=O)c1ccccc1 Amb24390872 [0,1,0,0,0,0|2,0,1]=4 333 B13R1.45 C[C@H](NCC(O)=O)c1ccccc1 Amb17935708 [0,1,0,0,0,0|3,0,0]=4 334 B13R1.45 C\C(=C\CC(C)=O)\c1ccccc1 Amb24392921 [0,1,0,0,0,0|1,0,2]=4 335 B13R1.45 C\C(=C\OC(C)=O)\c1ccccc1 Amb25290986 [0,1,0,0,0,0|0,0,2]=3 336 B13R1.45 C\C(=N/NC(=O)C)\c1ccccc1 Amb1834900 [0,1,0,0,0,0|2,0,1]=4 337 B13R1.45 C\C(=N\OC(=O)C)\c1ccccc1 Amb1014467 [0,1,0,0,0,0|1,0,1]=3 338 B13R1.45 C\C(\Cl)=C\CC(O)c1ccccc1 Amb24752308 [0,1,0,0,0,0|2,0,0]=3 339 B13R1.45 ClC(c1ccccc1)CCC(=O)C Amb17402167 [0,1,0,0,0,0|1,0,0]=2 340 B13R1.45 ClC(c1ccncc1)CCC(=O)C Amb17402228 [0,1,0,0,0,0|2,0,0]=3 341 B13R1.45 NC(=N)NCC(O)c1ccccc1 Amb18804880 [0,1,0,0,0,0|3,0,0]=4 342 B13R1.45 NC(=O)CCC(c1ccccn1)O Amb17335401 [0,1,0,0,0,0|3,0,0]=4 343 B13R1.45 NC(=O)CCC(c1cccnc1)O Amb17335403 [0,1,0,0,0,0|3,0,0]=4 344 B13R1.45 NC(=O)NCC(=O)c1ccccc1 Amb24725690 [0,1,0,0,0,0|2,0,1]=4 345 B13R1.45 NC(=O)ONC(=O)c1ccccc1 Amb24635646 [0,1,0,0,0,0|2,0,1]=4 346 B13R1.45 NC(CCC(O)=O)c1ccccc1 Amb19514853 [0,1,0,0,0,0|2,0,0]=3 347 B13R1.45 NC(c1ccccc1)CCN(C)C Amb13949100 [0,1,0,0,0,0|3,0,0]=4 348 B13R1.45 NN(CCC(O)=O)c1ccccc1 Amb19861024 [0,1,0,0,0,0|3,0,0]=4 349 B13R1.45 N[C@@H](CCC(O)=O)c1ccccc1 Amb22745911 [0,1,0,0,0,0|2,0,0]=3 350 B13R1.45 N[C@@H](CCC(O)=O)c1ccccc1 Amb23399581 [0,1,0,0,0,0|2,0,0]=3 351 B13R1.45 N[C@@H](c1ccccc1)COC(C)C Amb17061653 [0,1,0,0,0,0|1,0,1]=3 352 B13R1.45 N\C(=N/OC(=O)C)\c1ccncc1 Amb16757873 [0,1,0,0,0,0|2,0,1]=4 353 B13R1.45 N\C(=N\OC(=O)C)\c1ccccc1 Amb2228036 [0,1,0,0,0,0|1,0,1]=3 354 B13R1.45 O=C(c1ccccc1)CCC(=O)N Amb17233256 [0,1,0,0,0,0|2,0,1]=4 355 B13R1.45 O=C(c1ccccc1)CCC(=O)O Amb1224638 [0,1,0,0,0,0|2,0,1]=4 356 B13R1.45 O=C(c1ccccc1)CNC(=O)C Amb17335159 [0,1,0,0,0,0|1,0,1]=3 357 B13R1.45 OC(=O)C#CC(O)c1ccccc1 Amb24355315 [0,1,0,0,0,0|2,0,1]=4 358 B13R1.45 OC(=O)CCC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054406 [0,1,0,0,0,0|2,0,1]=4 359 B13R1.45 OC(=O)CCC(O)c1c[n]ccc1 Amb18805211 [0,1,0,0,0,0|3,0,0]=4 360 B13R1.45 OC(=O)CCC(O)c1cc[n]cc1 Amb18193342 [0,1,0,0,0,0|3,0,0]=4 361 B13R1.45 OC(=O)CCC(O)c1cccc[n]1 Amb18824244 [0,1,0,0,0,0|3,0,0]=4 362 B13R1.45 OC(=O)\C=C\C(O)c1ccccc1 Amb18128124 [0,1,0,0,0,0|2,0,1]=4 363 B13R1.45 OC(CC=C(F)F)c1ccccc1 Amb25120143 [0,1,0,0,0,0|3,0,0]=4 364 B13R1.45 OC(c1ccccc1)CCC(=O)N Amb17335290 [0,1,0,0,0,0|2,0,0]=3 365 B13R1.45 OC(c1ccccc1)COC(=O)N Amb17594650 [0,1,0,0,0,0|1,0,0]=2 366 B13R1.45 OC(c1ccncc1)CCC(=O)N Amb17335405 [0,1,0,0,0,0|3,0,0]=4 367 B13R1.45 [O-]C(=O)CCC(c1cccnc1)O Amb17619701 [0,1,0,0,0,0|3,0,0]=4 368 B13R1.45 [O-]C(=O)CC[13CH](O)[13c]1[13cH][n][13cH][13cH][13cH]1 Amb22056115 [0,1,0,0,0,0|3,0,0]=4 369 B13R1.149 BrC(=C)CCCc1cccc(c1)C Amb13890668 [0,1,0,0,0,0|2,0,1]=4 370 B13R1.149 BrC(=C)CCCc1cccc(c1)Cl Amb13890656 [0,1,0,0,0,0|2,0,1]=4 371 B13R1.149 BrC(=C)CCCc1cccc(c1)F Amb13890680 [0,1,0,0,0,0|2,0,1]=4 372 B13R1.149 CC(=C)CCCc1cccc(c1)C Amb13890669 [0,1,0,0,0,0|2,0,0]=3 373 B13R1.149 CC(=C)CCCc1cccc(c1)Cl Amb13890657 [0,1,0,0,0,0|2,0,0]=3 374 B13R1.149 CC(=C)CCCc1cccc(c1)F Amb13890681 [0,1,0,0,0,0|2,0,0]=3 375 B13R1.149 CC(=C)CCNc1cccc(Br)c1 Amb25047963 [0,1,0,0,0,0|3,0,0]=4 376 B13R1.149 CC(=C)CCNc1cccc(Cl)c1 Amb24533539 [0,1,0,0,0,0|3,0,0]=4 377 B13R1.149 CC(=C)CCNc1cccc(F)c1 Amb24705980 [0,1,0,0,0,0|3,0,0]=4 378 B13R1.149 CC(=C)CNCc1cccc(Br)c1 Amb24768741 [0,1,0,0,0,0|3,0,0]=4 379 B13R1.149 CC(=N)NCCc1cccc(Br)c1 Amb24339580 [0,1,0,0,0,0|2,0,0]=3 380 B13R1.149 CC(=O)CCCc1cccc(c1)Br Amb17255477 [0,1,0,0,0,0|1,0,0]=2 381 B13R1.149 CC(=O)CCCc1cccc(c1)C Amb17233199 [0,1,0,0,0,0|1,0,0]=2 382 B13R1.149 CC(=O)CCCc1cccc(c1)Cl Amb17236502 [0,1,0,0,0,0|1,0,0]=2 383 B13R1.149 CC(=O)CCOc1cccc(c1)Cl Amb17139724 [0,1,0,0,0,0|2,0,0]=3 384 B13R1.149 CC(=O)C\C=C\c1cccc(Cl)c1 Amb25842151 [0,1,0,0,0,0|1,0,2]=4 385 B13R1.149 CC(=O)C\C=C\c1cccc(F)c1 Amb24731445 [0,1,0,0,0,0|1,0,2]=4 386 B13R1.149 CC(=O)N/N=C/c1cccc(O)c1 Amb17798514 [0,1,0,0,0,0|2,0,1]=4 387 B13R1.149 CC(=O)NCCc1c[n]cc(O)c1 Amb25687749 [0,1,0,0,0,0|2,0,0]=3 388 B13R1.149 CC(=O)NCCc1cccc(Cl)c1 Amb17791605 [0,1,0,0,0,0|1,0,0]=2 389 B13R1.149 CC(=O)NCCc1cccc(F)c1 Amb24476175 [0,1,0,0,0,0|1,0,0]=2 390 B13R1.149 CC(=O)NNCc1cc(N)ccc1 Amb25258036 [0,1,0,0,0,0|2,0,0]=3 391 B13R1.149 CC(=O)NOCc1c[n]cc(F)c1 Amb24458286 [0,1,0,0,0,0|3,0,0]=4 392 B13R1.149 CC(=O)NOCc1cccc(Cl)c1 Amb25687680 [0,1,0,0,0,0|2,0,0]=3 393 B13R1.149 CC(=O)NOCc1cccc(F)c1 Amb25106612 [0,1,0,0,0,0|2,0,0]=3 394 B13R1.149 CC(=O)N\C=C\c1cccc(Cl)c1 Amb24533979 [0,1,0,0,0,0|1,0,2]=4 395 B13R1.149 CC(=O)O\N=C\c1cccc(O)c1 Amb24587363 [0,1,0,0,0,0|1,0,1]=3 396 B13R1.149 CC(C)=CCCc1cc(C)ccc1 Amb22227609 [0,1,0,0,0,0|2,0,0]=3 397 B13R1.149 CC(C)=CCNc1cc(C)ccc1 Amb24467497 [0,1,0,0,0,0|3,0,0]=4 398 B13R1.149 CC(C)=CCNc1cccc(Br)c1 Amb25296500 [0,1,0,0,0,0|3,0,0]=4 399 B13R1.149 CC(C)=CCNc1cccc(F)c1 Amb25206783 [0,1,0,0,0,0|3,0,0]=4 400 B13R1.149 CC(C)=CCNc1cccc(I)c1 Amb25820057 [0,1,0,0,0,0|3,0,0]=4 401 B13R1.149 CC(C)=CCNc1cccc(N)c1 Amb24636586 [0,1,0,0,0,0|3,0,0]=4 402 B13R1.149 CC(C)=CCNc1cccc(O)c1 Amb24393718 [0,1,0,0,0,0|3,0,0]=4 403 B13R1.149 CC(C)=CCOc1cccc(F)c1 Amb24609325 [0,1,0,0,0,0|3,0,0]=4 404 B13R1.149 CC(C)=CCOc1cccc(N)c1 Amb18971500 [0,1,0,0,0,0|3,0,0]=4 405 B13R1.149 CC(C)=CCSc1cccc(O)c1 Amb25105170 [0,1,0,0,0,0|3,0,0]=4 406 B13R1.149 CC(C)=NNCc1cc(C)ccc1 Amb25272242 [0,1,0,0,0,0|3,0,0]=4 407 B13R1.149 CC(C)=NNCc1cccc(Cl)c1 Amb24505781 [0,1,0,0,0,0|3,0,0]=4 408 B13R1.149 CC(C)=NNCc1cccc(F)c1 Amb24749154 [0,1,0,0,0,0|3,0,0]=4 409 B13R1.149 CC(C)=NOCc1cccc(Cl)c1 Amb25052013 [0,1,0,0,0,0|3,0,0]=4 410 B13R1.149 CC(C)=NOCc1cccc(F)c1 Amb25136705 [0,1,0,0,0,0|3,0,0]=4 411 B13R1.149 CC(C)NCCc1cccc(N)c1 Amb18050452 [0,1,0,0,0,0|2,0,1]=4 412 B13R1.149 CC(CCCc1cccc(c1)Br)N Amb17255966 [0,1,0,0,0,0|2,0,1]=4 413 B13R1.149 CC(CCCc1cccc(c1)C)N Amb17233314 [0,1,0,0,0,0|2,0,1]=4 414 B13R1.149 CC(CCCc1cccc(c1)Cl)N Amb17236682 [0,1,0,0,0,0|2,0,1]=4 415 B13R1.149 CC(NCCc1cccc(c1)Br)C Amb17410545 [0,1,0,0,0,0|2,0,1]=4 416 B13R1.149 CC(NCCc1cccc(c1)C)C Amb17193877 [0,1,0,0,0,0|2,0,1]=4 417 B13R1.149 CC(NCCc1cccc(c1)Cl)C Amb17193878 [0,1,0,0,0,0|2,0,1]=4 418 B13R1.149 CN(CCCc1cccc(c1)N)C Amb17050706 [0,1,0,0,0,0|3,0,0]=4 419 B13R1.149 CS(=O)CCNc1cccc(I)c1 Amb24586043 [0,1,0,0,0,0|3,0,0]=4 420 B13R1.149 CS(=O)CCNc1cccc(N)c1 Amb25073066 [0,1,0,0,0,0|3,0,0]=4 421 B13R1.149 Cc1cc(CCNC(N)=N)ccc1 Amb18804666 [0,1,0,0,0,0|3,0,0]=4 422 B13R1.149 Cc1cc(CCNC(N)=O)ccc1 Amb18804769 [0,1,0,0,0,0|2,0,0]=3 423 B13R1.149 Cc1cc(CCNC(N)=S)ccc1 Amb19063183 [0,1,0,0,0,0|2,1,0]=4 424 B13R1.149 Cc1cc(CNCC(O)=O)ccc1 Amb19341149 [0,1,0,0,0,0|3,0,0]=4 425 B13R1.149 Cc1cc(CONC(N)=O)ccc1 Amb25766599 [0,1,0,0,0,0|3,0,0]=4 426 B13R1.149 Cc1cc[n]c(CONC(C)=O)c1 Amb25226612 [0,1,0,0,0,0|3,0,0]=4 427 B13R1.149 Cc1cccc(c1)NCCC(C)=C Amb25673699 [0,1,0,0,0,0|3,0,0]=4 428 B13R1.149 Cc1cccc(c1)NC\C=C(\C)/Cl Amb24488922 [0,1,0,0,0,0|3,0,0]=4 429 B13R1.149 Cc1cccc(c1)N\C=C\C(C)=O Amb24466974 [0,1,0,0,0,0|2,0,1]=4 430 B13R1.149 Cc1cccc(c1)N\N=C/C(C)=O Amb25830060 [0,1,0,0,0,0|3,0,0]=4 431 B13R1.149 Cc1cccc(c1)\C=C\CC(C)=O Amb24760567 [0,1,0,0,0,0|1,0,2]=4 432 B13R1.149 ClC(=C)CCCc1cccc(c1)C Amb13890667 [0,1,0,0,0,0|2,0,1]=4 433 B13R1.149 ClC(=C)CCCc1cccc(c1)Cl Amb13890655 [0,1,0,0,0,0|2,0,1]=4 434 B13R1.149 ClC(=C)CCCc1cccc(c1)F Amb13890679 [0,1,0,0,0,0|2,0,1]=4 435 B13R1.149 ClC(=O)CCSc1cccc(c1)C Amb17143636 [0,1,0,0,0,0|3,0,0]=4 436 B13R1.149 NC(=N)NCCc1cccc(Br)c1 Amb18071310 [0,1,0,0,0,0|3,0,0]=4 437 B13R1.149 NC(=N)NCCc1cccc(Cl)c1 Amb18066464 [0,1,0,0,0,0|3,0,0]=4 438 B13R1.149 NC(=N)NCCc1cccc(F)c1 Amb18805223 [0,1,0,0,0,0|3,0,0]=4 439 B13R1.149 NC(=N)NCCc1cccc(O)c1 Amb25118735 [0,1,0,0,0,0|3,0,0]=4 440 B13R1.149 NC(=O)CCSc1cccc(c1)C Amb17143163 [0,1,0,0,0,0|3,0,0]=4 441 B13R1.149 NC(=O)CCSc1cccc(c1)Cl Amb17143659 [0,1,0,0,0,0|3,0,0]=4 442 B13R1.149 NC(=O)CSCc1cccc(c1)Br Amb1234290 [0,1,0,0,0,0|3,0,0]=4 443 B13R1.149 NC(=O)NCCc1cccc(Br)c1 Amb24339582 [0,1,0,0,0,0|2,0,0]=3 444 B13R1.149 NC(=O)NCCc1cccc(Cl)c1 Amb25079869 [0,1,0,0,0,0|2,0,0]=3 445 B13R1.149 NC(=O)NCCc1cccc(O)c1 Amb24430516 [0,1,0,0,0,0|2,0,0]=3 446 B13R1.149 NC(=O)NOCc1cccc(F)c1 Amb25845085 [0,1,0,0,0,0|3,0,0]=4 447 B13R1.149 NC(=O)NOCc1cccc(c1)Cl Amb2438037 [0,1,0,0,0,0|3,0,0]=4 448 B13R1.149 NC(=S)NCCc1cccc(Br)c1 Amb24374217 [0,1,0,0,0,0|2,1,0]=4 449 B13R1.149 NC(=S)NCCc1cccc(Cl)c1 Amb22227594 [0,1,0,0,0,0|2,1,0]=4 450 B13R1.149 Nc1cc(COCC(O)=O)ccc1 Amb23569203 [0,1,0,0,0,0|3,0,0]=4 451 B13R1.149 Nc1cc(ccc1)SCCC(O)=O Amb19662090 [0,1,0,0,0,0|3,0,0]=4 452 B13R1.149 Nc1cccc(CCNC(N)=O)c1 Amb25765043 [0,1,0,0,0,0|2,0,0]=3 453 B13R1.149 Nc1cccc(COCC(N)=O)c1 Amb23569204 [0,1,0,0,0,0|3,0,0]=4 454 B13R1.149 OC(=O)C#CCc1cc(F)ccc1 Amb25039653 [0,1,0,0,0,0|2,0,1]=4 455 B13R1.149 OC(=O)CCCc1cccc(c1)N Amb10603728 [0,1,0,0,0,0|2,0,0]=3 456 B13R1.149 OC(=O)CCCc1cccc(c1)N Amb17335328 [0,1,0,0,0,0|2,0,0]=3 457 B13R1.149 OC(=O)CCCc1cccc(c1)S Amb17616853 [0,1,0,0,0,0|2,0,0]=3 458 B13R1.149 OC(=O)CCNc1cccc(c1)C Amb2209157 [0,1,0,0,0,0|3,0,0]=4 459 B13R1.149 OC(=O)CCNc1cccc(c1)Cl Amb2209166 [0,1,0,0,0,0|3,0,0]=4 460 B13R1.149 OC(=O)CCNc1cccc(c1)F Amb2209162 [0,1,0,0,0,0|3,0,0]=4 461 B13R1.149 OC(=O)CCOc1cccc(c1)Br Amb15755 [0,1,0,0,0,0|3,0,0]=4 462 B13R1.149 OC(=O)CCOc1cccc(c1)C Amb1102786 [0,1,0,0,0,0|3,0,0]=4 463 B13R1.149 OC(=O)CCOc1cccc(c1)Cl Amb1116710 [0,1,0,0,0,0|3,0,0]=4 464 B13R1.149 OC(=O)CCOc1cccc(c1)F Amb1114548 [0,1,0,0,0,0|3,0,0]=4 465 B13R1.149 OC(=O)CNCc1cccc(c1)Br Amb1111229 [0,1,0,0,0,0|3,0,0]=4 466 B13R1.149 OC(=O)CNCc1cccc(c1)C Amb1110883 [0,1,0,0,0,0|3,0,0]=4 467 B13R1.149 OC(=O)CNCc1cccc(c1)Cl Amb17598410 [0,1,0,0,0,0|3,0,0]=4 468 B13R1.149 OC(=O)CNCc1cccc(c1)F Amb10609867 [0,1,0,0,0,0|3,0,0]=4 469 B13R1.149 OC(=O)CNCc1cccc(c1)F Amb2372412 [0,1,0,0,0,0|3,0,0]=4 470 B13R1.149 OC(=O)COCc1cccc(c1)Br Amb17472946 [0,1,0,0,0,0|3,0,0]=4 471 B13R1.149 OC(=O)COCc1cccc(c1)C Amb17470624 [0,1,0,0,0,0|3,0,0]=4 472 B13R1.149 OC(=O)COCc1cccc(c1)Cl Amb17470999 [0,1,0,0,0,0|3,0,0]=4 473 B13R1.149 OC(=O)CSCc1cccc(c1)Cl Amb1546534 [0,1,0,0,0,0|3,0,0]=4 474 B13R1.149 OC(=O)CSCc1cccc(c1)F Amb1137816 [0,1,0,0,0,0|3,0,0]=4 475 B13R1.149 Oc1cccc(CCCC(O)=O)c1 Amb22490497 [0,1,0,0,0,0|2,0,0]=3 476 B13R1.149 Oc1cccc(c1)OCCC(O)=O Amb18192782 [0,1,0,0,0,0|3,0,0]=4 477 B13R1.158 BrC(=C)CCCc1ccccc1C Amb13890664 [0,1,0,0,0,0|2,0,1]=4 478 B13R1.158 CC(=C)CCCc1ccccc1C Amb13890665 [0,1,0,0,0,0|2,0,0]=3 479 B13R1.158 CC(=C)CCNc1ccccc1Br Amb25161292 [0,1,0,0,0,0|3,0,0]=4 480 B13R1.158 CC(=C)CCNc1ccccc1F Amb24430251 [0,1,0,0,0,0|3,0,0]=4 481 B13R1.158 CC(=C)CCNc1ccccc1I Amb24402659 [0,1,0,0,0,0|3,0,0]=4 482 B13R1.158 CC(=C)CNCc1ccccc1Br Amb24768742 [0,1,0,0,0,0|3,0,0]=4 483 B13R1.158 CC(=N)NCCc1ccccc1F Amb25316705 [0,1,0,0,0,0|2,0,0]=3 484 B13R1.158 CC(=O)CCCc1ccccc1C Amb17233198 [0,1,0,0,0,0|1,0,0]=2 485 B13R1.158 CC(=O)CCCc1ccccc1Cl Amb17236501 [0,1,0,0,0,0|1,0,0]=2 486 B13R1.158 CC(=O)CCCc1ccccc1F Amb17233676 [0,1,0,0,0,0|1,0,0]=2 487 B13R1.158 CC(=O)CCOc1ccccc1Cl Amb17139723 [0,1,0,0,0,0|2,0,0]=3 488 B13R1.158 CC(=O)C\C=C\c1ccccc1Br Amb25155472 [0,1,0,0,0,0|1,0,2]=4 489 B13R1.158 CC(=O)C\C=C\c1ccccc1Cl Amb25322439 [0,1,0,0,0,0|1,0,2]=4 490 B13R1.158 CC(=O)C\C=C\c1ccccc1F Amb25693688 [0,1,0,0,0,0|1,0,2]=4 491 B13R1.158 CC(=O)C\C=C\c1ccccc1O Amb25058690 [0,1,0,0,0,0|1,0,2]=4 492 B13R1.158 CC(=O)C\C=N\c1ccccc1O Amb25373167 [0,1,0,0,0,0|2,0,1]=4 493 B13R1.158 CC(=O)N/N=C/c1ccccc1C Amb17798513 [0,1,0,0,0,0|2,0,1]=4 494 B13R1.158 CC(=O)N/N=C/c1ccccc1I Amb17788101 [0,1,0,0,0,0|2,0,1]=4 495 B13R1.158 CC(=O)NCCc1[n]cccc1F Amb25668865 [0,1,0,0,0,0|2,0,0]=3 496 B13R1.158 CC(=O)NCCc1ccccc1Br Amb13133608 [0,1,0,0,0,0|1,0,0]=2 497 B13R1.158 CC(=O)NCCc1ccccc1C Amb15740396 [0,1,0,0,0,0|1,0,0]=2 498 B13R1.158 CC(=O)NCCc1ccccc1Cl Amb25324158 [0,1,0,0,0,0|1,0,0]=2 499 B13R1.158 CC(=O)NCCc1ccccc1O Amb16982301 [0,1,0,0,0,0|1,0,0]=2 500 B13R1.158 CC(=O)NOCc1cc[n]cc1Cl Amb25333152 [0,1,0,0,0,0|3,0,0]=4 501 B13R1.158 CC(=O)NOCc1ccccc1F Amb24386771 [0,1,0,0,0,0|2,0,0]=3 502 B13R1.158 CC(=O)N\C=C\c1ccccc1Cl Amb25328901 [0,1,0,0,0,0|1,0,2]=4 503 B13R1.158 CC(=O)N\C=C\c1ccccc1O Amb24558269 [0,1,0,0,0,0|1,0,2]=4 504 B13R1.158 CC(=O)N\N=C\c1ccccc1F Amb1014386 [0,1,0,0,0,0|2,0,1]=4 505 B13R1.158 CC(=O)N\N=C\c1ccccc1N Amb24628994 [0,1,0,0,0,0|2,0,1]=4 506 B13R1.158 CC(=O)O\C=C\c1ccccc1N Amb24558185 [0,1,0,0,0,0|0,0,2]=3 507 B13R1.158 CC(=O)O\C=C\c1ccccc1O Amb18128101 [0,1,0,0,0,0|0,0,2]=3 508 B13R1.158 CC(=O)O\N=C\c1ccccc1O Amb24492564 [0,1,0,0,0,0|1,0,1]=3 509 B13R1.158 CC(=O)\C=N\Nc1ccccc1O Amb24534161 [0,1,0,0,0,0|3,0,0]=4 510 B13R1.158 CC(C)=CCNc1ccccc1Cl Amb25779189 [0,1,0,0,0,0|3,0,0]=4 511 B13R1.158 CC(C)=CCOc1ccccc1F Amb25107945 [0,1,0,0,0,0|3,0,0]=4 512 B13R1.158 CC(C)=CCOc1ccccc1I Amb24624570 [0,1,0,0,0,0|3,0,0]=4 513 B13R1.158 CC(C)=CCOc1ccccc1N Amb18971537 [0,1,0,0,0,0|3,0,0]=4 514 B13R1.158 CC(C)=CCSc1ccccc1O Amb18317879 [0,1,0,0,0,0|3,0,0]=4 515 B13R1.158 CC(C)=NNCc1ccccc1Cl Amb24475594 [0,1,0,0,0,0|3,0,0]=4 516 B13R1.158 CC(C)=NOCc1ccccc1C Amb25730726 [0,1,0,0,0,0|3,0,0]=4 517 B13R1.158 CC(C)=NOCc1ccccc1F Amb24473782 [0,1,0,0,0,0|3,0,0]=4 518 B13R1.158 CC(CCCc1ccccc1C)N Amb17233313 [0,1,0,0,0,0|2,0,1]=4 519 B13R1.158 CC(CCCc1ccccc1Cl)N Amb17236681 [0,1,0,0,0,0|2,0,1]=4 520 B13R1.158 CC(CCCc1ccccc1F)N Amb17233820 [0,1,0,0,0,0|2,0,1]=4 521 B13R1.158 CN(CCCc1ccccc1N)C Amb17050681 [0,1,0,0,0,0|3,0,0]=4 522 B13R1.158 CS(=O)CCNc1ccccc1Br Amb24538957 [0,1,0,0,0,0|3,0,0]=4 523 B13R1.158 CS(=O)CCNc1ccccc1N Amb25774644 [0,1,0,0,0,0|3,0,0]=4 524 B13R1.158 C\C(\Cl)=C\CSc1ccccc1O Amb24580687 [0,1,0,0,0,0|3,0,0]=4 525 B13R1.158 Cc1c[n]ccc1CCNC(N)=O Amb25370137 [0,1,0,0,0,0|3,0,0]=4 526 B13R1.158 Cc1ccccc1CC#CC(O)=O Amb25736858 [0,1,0,0,0,0|2,0,1]=4 527 B13R1.158 Cc1ccccc1CCNC(N)=N Amb18065724 [0,1,0,0,0,0|3,0,0]=4 528 B13R1.158 Cc1ccccc1CCNC(N)=O Amb25100964 [0,1,0,0,0,0|2,0,0]=3 529 B13R1.158 Cc1ccccc1CONC(C)=O Amb25792311 [0,1,0,0,0,0|2,0,0]=3 530 B13R1.158 Cc1ccccc1C\C=C\C(N)=O Amb24634197 [0,1,0,0,0,0|2,0,1]=4 531 B13R1.158 Cc1ccccc1NCCC(C)=O Amb24664215 [0,1,0,0,0,0|2,0,0]=3 532 B13R1.158 Cc1ccccc1\C=C/CC(C)=O Amb24492730 [0,1,0,0,0,0|1,0,2]=4 533 B13R1.158 ClC(=C)CCCc1ccccc1C Amb13890663 [0,1,0,0,0,0|2,0,1]=4 534 B13R1.158 ClC(=O)CCOc1ccccc1Cl Amb17143748 [0,1,0,0,0,0|3,0,0]=4 535 B13R1.158 ClC(=O)CCSc1ccccc1Cl Amb17144559 [0,1,0,0,0,0|3,0,0]=4 536 B13R1.158 NC(=N)CCCc1ccccc1Cl Amb10844870 [0,1,0,0,0,0|3,0,0]=4 537 B13R1.158 NC(=N)NCCc1ccccc1Br Amb18071317 [0,1,0,0,0,0|3,0,0]=4 538 B13R1.158 NC(=N)NCCc1ccccc1Cl Amb18066463 [0,1,0,0,0,0|3,0,0]=4 539 B13R1.158 NC(=N)NCCc1ccccc1F Amb18185009 [0,1,0,0,0,0|3,0,0]=4 540 B13R1.158 NC(=O)CCCc1ccccc1Cl Amb22552422 [0,1,0,0,0,0|2,0,0]=3 541 B13R1.158 NC(=O)CCNc1ccccc1N Amb2226251 [0,1,0,0,0,0|3,0,0]=4 542 B13R1.158 NC(=O)CNCc1ccccc1O Amb1112462 [0,1,0,0,0,0|3,0,0]=4 543 B13R1.158 NC(=O)NCCc1ccccc1Cl Amb24627934 [0,1,0,0,0,0|2,0,0]=3 544 B13R1.158 NC(=O)NOCc1ccccc1F Amb2435065 [0,1,0,0,0,0|3,0,0]=4 545 B13R1.158 NC(=O)O\N=C\c1ccccc1O Amb25724987 [0,1,0,0,0,0|2,0,1]=4 546 B13R1.158 NC(=S)NCCc1ccccc1Cl Amb24529590 [0,1,0,0,0,0|2,1,0]=4 547 B13R1.158 Nc1ccccc1NCCC(N)=O Amb19514743 [0,1,0,0,0,0|3,0,0]=4 548 B13R1.158 Nc1ccccc1NCCC(O)=O Amb18128679 [0,1,0,0,0,0|3,0,0]=4 549 B13R1.158 Nc1ccccc1OCCC(O)=O Amb22728037 [0,1,0,0,0,0|3,0,0]=4 550 B13R1.158 O=C(Cl)CCCc1ccccc1Br Amb22295767 [0,1,0,0,0,0|2,0,0]=3 551 B13R1.158 OC(=O)C#CCc1ccccc1Cl Amb25225009 [0,1,0,0,0,0|2,0,1]=4 552 B13R1.158 OC(=O)CCCN1C=CC=CC1=O Amb18028573 [0,1,0,0,0,0|3,0,0]=4 553 B13R1.158 OC(=O)CCCc1ccccc1S Amb17616852 [0,1,0,0,0,0|2,0,0]=3 554 B13R1.158 OC(=O)CCNc1ccccc1Cl Amb2209165 [0,1,0,0,0,0|3,0,0]=4 555 B13R1.158 OC(=O)CCNc1ccccc1F Amb2209161 [0,1,0,0,0,0|3,0,0]=4 556 B13R1.158 OC(=O)CCOc1ccccc1Br Amb1117859 [0,1,0,0,0,0|3,0,0]=4 557 B13R1.158 OC(=O)CCOc1ccccc1C Amb1102807 [0,1,0,0,0,0|3,0,0]=4 558 B13R1.158 OC(=O)CCOc1ccccc1Cl Amb1112357 [0,1,0,0,0,0|3,0,0]=4 559 B13R1.158 OC(=O)CCOc1ccccc1F Amb1102819 [0,1,0,0,0,0|3,0,0]=4 560 B13R1.158 OC(=O)CCSc1ccccc1Br Amb1113939 [0,1,0,0,0,0|3,0,0]=4 561 B13R1.158 OC(=O)CCSc1ccccc1Cl Amb1102789 [0,1,0,0,0,0|3,0,0]=4 562 B13R1.158 OC(=O)CCSc1ccccc1N Amb17305640 [0,1,0,0,0,0|3,0,0]=4 563 B13R1.158 OC(=O)CNCc1ccccc1Br Amb1111282 [0,1,0,0,0,0|3,0,0]=4 564 B13R1.158 OC(=O)CNCc1ccccc1C Amb10609879 [0,1,0,0,0,0|3,0,0]=4 565 B13R1.158 OC(=O)CNCc1ccccc1C Amb2372498 [0,1,0,0,0,0|3,0,0]=4 566 B13R1.158 OC(=O)CNCc1ccccc1I Amb21861671 [0,1,0,0,0,0|3,0,0]=4 567 B13R1.158 OC(=O)COCc1ccccc1C Amb17470623 [0,1,0,0,0,0|3,0,0]=4 568 B13R1.158 OC(=O)COCc1ccccc1F Amb17470662 [0,1,0,0,0,0|3,0,0]=4 569 B13R1.158 OC(=O)CSCc1ccccc1Br Amb2372136 [0,1,0,0,0,0|3,0,0]=4 570 B13R1.158 OC(=O)CSCc1ccccc1C Amb1125979 [0,1,0,0,0,0|3,0,0]=4 571 B13R1.158 OC(=O)CSCc1ccccc1Cl Amb1551137 [0,1,0,0,0,0|3,0,0]=4 572 B13R1.158 OC(=O)CSCc1ccccc1I Amb24089653 [0,1,0,0,0,0|3,0,0]=4 573 B13R1.158 OC(=O)OCCc1ccccc1Cl Amb24079959 [0,1,0,0,0,0|1,0,0]=2 574 B13R1.158 Oc1ccccc1C\C=C\C(O)=O Amb24366638 [0,1,0,0,0,0|2,0,1]=4 575 B13R1.158 Oc1ccccc1NCCC(O)=O Amb24650948 [0,1,0,0,0,0|3,0,0]=4 576 B13R1.348 CC(=C)OC(=O)Nc1ccccc1 Amb25121132 [0,1,0,0,0,0|2,0,1]=4 577 B13R1.348 CC(=O)/C=C(\C)Cc1ccccc1 Amb17778969 [0,1,0,0,0,0|1,0,1]=3 578 B13R1.348 CC(=O)C/C(C)=C/c1ccccc1 Amb17778970 [0,1,0,0,0,0|1,0,2]=4 579 B13R1.348 CC(=O)CC(=O)Cc1cccc[n]1 Amb24076575 [0,1,0,0,0,0|2,0,1]=4 580 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,1,0,0,0,0|2,0,1]=4 581 B13R1.348 CC(=O)CC(=S)Nc1ccccc1 Amb25190045 [0,1,0,0,0,0|2,0,1]=4 582 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,1,0,0,0,0|2,0,0]=3 583 B13R1.348 CC(=O)NC(=N)Nc1ccccc1 Amb25046689 [0,1,0,0,0,0|2,0,1]=4 584 B13R1.348 CC(=O)NC(=O)Cc1ccccc1 Amb24073557 [0,1,0,0,0,0|1,0,1]=3 585 B13R1.348 CC(=O)NC(=S)Cc1ccccc1 Amb25689518 [0,1,0,0,0,0|1,0,1]=3 586 B13R1.348 CC(=O)NC(=S)Oc1ccccc1 Amb25758641 [0,1,0,0,0,0|2,0,1]=4 587 B13R1.348 CC(=O)NC(C)Cc1c[n]ccc1 Amb25095297 [0,1,0,0,0,0|2,0,0]=3 588 B13R1.348 CC(=O)NC(C)Cc1cc[n]cc1 Amb24705489 [0,1,0,0,0,0|2,0,0]=3 589 B13R1.348 CC(=O)NC(N)Cc1ccccc1 Amb25322191 [0,1,0,0,0,0|1,0,0]=2 590 B13R1.348 CC(=O)N[C@H](C)Cc1ccccc1 Amb24496665 [0,1,0,0,0,0|1,0,0]=2 591 B13R1.348 CC(=O)OC(C)Cc1ccccc1 Amb24323251 [0,1,0,0,0,0|0,0,0]=1 592 B13R1.348 CC(=O)SC(=O)Nc1ccccc1 Amb24396677 [0,1,0,0,0,0|1,1,1]=4 593 B13R1.348 CC(=O)\C=C(\N)/Cc1ccccc1 Amb24739677 [0,1,0,0,0,0|1,0,1]=3 594 B13R1.348 CC(=O)\C=C(\S)/Nc1ccccc1 Amb25840398 [0,1,0,0,0,0|2,0,1]=4 595 B13R1.348 CC(=S)NC(=O)Cc1ccccc1 Amb25835179 [0,1,0,0,0,0|1,1,1]=4 596 B13R1.348 CC(C)=CC(O)Cc1c[n]ccc1 Amb24389759 [0,1,0,0,0,0|3,0,0]=4 597 B13R1.348 CC(C)=CC(O)Cc1cc[n]cc1 Amb24355443 [0,1,0,0,0,0|3,0,0]=4 598 B13R1.348 CC(C)CC(Br)Cc1ccccc1 Amb18049557 [0,1,0,0,0,0|2,0,1]=4 599 B13R1.348 CC(C)CC(O)Cc1ccccc1 Amb18796054 [0,1,0,0,0,0|2,0,1]=4 600 B13R1.348 CC(Cc1cc[n]cc1)NC(N)=O Amb24380353 [0,1,0,0,0,0|3,0,0]=4 601 B13R1.348 CC(Cc1ccccc1)CC(=O)O Amb17233403 [0,1,0,0,0,0|2,0,0]=3 602 B13R1.348 CC(Cc1ccccc1)NC(N)=N Amb18178447 [0,1,0,0,0,0|3,0,0]=4 603 B13R1.348 CC(Cc1ccccn1)CC(=O)O Amb17335285 [0,1,0,0,0,0|3,0,0]=4 604 B13R1.348 CC(Cc1cccnc1)CC(=O)O Amb17335287 [0,1,0,0,0,0|3,0,0]=4 605 B13R1.348 CC(Cc1ccncc1)CC(=O)O Amb17335288 [0,1,0,0,0,0|3,0,0]=4 606 B13R1.348 CC(Nc1ccccc1)CC(=O)N Amb17233441 [0,1,0,0,0,0|3,0,0]=4 607 B13R1.348 CC(Oc1ccccc1)CC(=O)N Amb17233539 [0,1,0,0,0,0|3,0,0]=4 608 B13R1.348 CN(Cc1ccccc1)CC(=O)Cl Amb17143178 [0,1,0,0,0,0|3,0,0]=4 609 B13R1.348 CN(Cc1ccccc1)CC(=O)N Amb17142972 [0,1,0,0,0,0|3,0,0]=4 610 B13R1.348 CN(Cc1ccccc1)CC(=O)O Amb10610460 [0,1,0,0,0,0|3,0,0]=4 611 B13R1.348 C[C@@H](CC(N)=O)Nc1ccccc1 Amb24727147 [0,1,0,0,0,0|3,0,0]=4 612 B13R1.348 C[C@H](CC(N)=O)Nc1ccccc1 Amb25707756 [0,1,0,0,0,0|3,0,0]=4 613 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [0,1,0,0,0,0|2,0,0]=3 614 B13R1.348 C\C(=C/C(=O)O)\Cc1ccccc1 Amb17233183 [0,1,0,0,0,0|2,0,1]=4 615 B13R1.348 C\C(=C/C(C)=O)\Nc1ccccc1 Amb20672001 [0,1,0,0,0,0|2,0,1]=4 616 B13R1.348 C\C(=C\C(=O)C)\Nc1ccccc1 Amb2386561 [0,1,0,0,0,0|2,0,1]=4 617 B13R1.348 C\C(\N)=C\C(=O)Cc1ccccc1 Amb25767909 [0,1,0,0,0,0|2,0,1]=4 618 B13R1.348 C\C(\O)=C\C(=O)Cc1ccccc1 Amb24492639 [0,1,0,0,0,0|1,0,2]=4 619 B13R1.348 Cl\C(=C/C(=O)C)\Sc1ccccc1 Amb17595760 [0,1,0,0,0,0|2,0,1]=4 620 B13R1.348 NC(=O)OC(=O)Nc1ccccc1 Amb25350415 [0,1,0,0,0,0|2,0,1]=4 621 B13R1.348 NC(Cc1ccccc1)CC(O)=O Amb20623358 [0,1,0,0,0,0|2,0,0]=3 622 B13R1.348 NC(Cc1ccccn1)CC(=O)O Amb17470627 [0,1,0,0,0,0|3,0,0]=4 623 B13R1.348 NC(Cc1cccnc1)CC(=O)O Amb17470630 [0,1,0,0,0,0|3,0,0]=4 624 B13R1.348 NC(Cc1ccncc1)CC(=O)O Amb17470634 [0,1,0,0,0,0|3,0,0]=4 625 B13R1.348 N[C@@H](Cc1cc[n]cc1)CC(O)=O Amb22746344 [0,1,0,0,0,0|3,0,0]=4 626 B13R1.348 N[C@@H](Cc1ccc[n]c1)CC(O)=O Amb22746342 [0,1,0,0,0,0|3,0,0]=4 627 B13R1.348 N\C(\Cc1ccccc1)=C\C(N)=O Amb24602390 [0,1,0,0,0,0|2,0,1]=4 628 B13R1.348 O=C(Cc1ccccc1)CC(=O)C Amb15692856 [0,1,0,0,0,0|1,0,1]=3 629 B13R1.348 O=C(Nc1ccccc1)CC(=O)C Amb1210069 [0,1,0,0,0,0|2,0,1]=4 630 B13R1.348 OC(=O)CC(=O)Cc1ccccc1 Amb18128104 [0,1,0,0,0,0|2,0,1]=4 631 B13R1.348 OC(=O)CC(Br)Cc1ccccc1 Amb18111137 [0,1,0,0,0,0|2,0,0]=3 632 B13R1.348 OC(=O)CC(Cl)Cc1ccccc1 Amb18111136 [0,1,0,0,0,0|2,0,0]=3 633 B13R1.348 OC(Cc1ccccc1)CC(=O)O Amb17233662 [0,1,0,0,0,0|2,0,0]=3 634 B13R1.348 S=C(Nc1ccccc1)NC(=O)C Amb2456399 [0,1,0,0,0,0|2,0,1]=4 635 B13R1.348 [2H]C(Cc1ccccc1)C=C(C)C Amb22546630 [0,1,0,0,0,0|2,0,0]=3 636 B13R1.351 C=C(CSc1ccccc1)C(O)=O Amb18130089 [0,1,0,0,0,0|3,0,0]=4 637 B13R1.351 C=C(OCc1ccccc1)C(O)=O Amb24626599 [0,1,0,0,0,0|3,0,0]=4 638 B13R1.351 CC(=C)C(=C)CNc1ccccc1 Amb24664158 [0,1,0,0,0,0|3,0,0]=4 639 B13R1.351 CC(=C)C(=S)NCc1ccccc1 Amb24366057 [0,1,0,0,0,0|3,0,0]=4 640 B13R1.351 CC(=C)C(C)CNc1ccccc1 Amb25192041 [0,1,0,0,0,0|3,0,0]=4 641 B13R1.351 CC(=C)C(C)NCc1ccccc1 Amb25101597 [0,1,0,0,0,0|3,0,0]=4 642 B13R1.351 CC(=C=Nc1ccccc1)C(C)=O Amb24721727 [0,1,0,0,0,0|2,0,1]=4 643 B13R1.351 CC(=O)C(/C)=C\Nc1ccccc1 Amb17778142 [0,1,0,0,0,0|2,0,1]=4 644 B13R1.351 CC(=O)C(=O)CNc1ccccc1 Amb25123358 [0,1,0,0,0,0|2,0,0]=3 645 B13R1.351 CC(=O)C(=O)NCc1ccccn1 Amb17400654 [0,1,0,0,0,0|3,0,0]=4 646 B13R1.351 CC(=O)C(=O)NCc1cccnc1 Amb17400655 [0,1,0,0,0,0|3,0,0]=4 647 B13R1.351 CC(=O)C(=O)NNc1ccccc1 Amb25128271 [0,1,0,0,0,0|3,0,0]=4 648 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,1,0,0,0,0|2,0,0]=3 649 B13R1.351 CC(=O)C(=O)\C=C\c1ccccc1 Amb24697906 [0,1,0,0,0,0|1,0,2]=4 650 B13R1.351 CC(=O)C(C)C#Cc1ccccc1 Amb24492361 [0,1,0,0,0,0|1,0,2]=4 651 B13R1.351 CC(=O)C(C)CNc1ccccc1 Amb25325974 [0,1,0,0,0,0|2,0,0]=3 652 B13R1.351 CC(=O)C(C)NCc1ccccc1 Amb18127991 [0,1,0,0,0,0|2,0,0]=3 653 B13R1.351 CC(=O)C(C)ONc1ccccc1 Amb24495021 [0,1,0,0,0,0|3,0,0]=4 654 B13R1.351 CC(=O)C(C)\C=C/c1ccccc1 Amb25735093 [0,1,0,0,0,0|1,0,2]=4 655 B13R1.351 CC(=O)C(C)\C=C\c1ccccc1 Amb24655091 [0,1,0,0,0,0|1,0,2]=4 656 B13R1.351 CC(=O)C(Cl)ONc1ccccc1 Amb25858083 [0,1,0,0,0,0|3,0,0]=4 657 B13R1.351 CC(=O)N(C)OCc1ccccc1 Amb25829924 [0,1,0,0,0,0|2,0,0]=3 658 B13R1.351 CC(=O)[C@@H](C)\C=C\c1ccccc1 Amb24752492 [0,1,0,0,0,0|1,0,2]=4 659 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 Amb24492590 [0,1,0,0,0,0|2,0,0]=3 660 B13R1.351 CC(=O)[C@H](C)ONc1ccccc1 Amb24492768 [0,1,0,0,0,0|3,0,0]=4 661 B13R1.351 CC(=O)[C@H](C)\C=C\c1ccccc1 Amb24602920 [0,1,0,0,0,0|1,0,2]=4 662 B13R1.351 CC(=O)\C(\O)=C\Nc1ccccc1 Amb24488935 [0,1,0,0,0,0|2,0,1]=4 663 B13R1.351 CC(C(=O)C)OCc1ccccc1 Amb16231123 [0,1,0,0,0,0|2,0,0]=3 664 B13R1.351 CC(C(=O)N)COc1ccccc1 Amb17233540 [0,1,0,0,0,0|3,0,0]=4 665 B13R1.351 CC(C(=O)O)CCc1ccncc1 Amb17335289 [0,1,0,0,0,0|3,0,0]=4 666 B13R1.351 CC(C(=O)O)NCc1ccccc1 Amb10199880 [0,1,0,0,0,0|3,0,0]=4 667 B13R1.351 CC(C(=O)O)NCc1ccccc1 Amb1111423 [0,1,0,0,0,0|3,0,0]=4 668 B13R1.351 CC(C(=O)O)SCc1ccccc1 Amb1137630 [0,1,0,0,0,0|3,0,0]=4 669 B13R1.351 CC(C)=C(C)CNc1ccccc1 Amb25191847 [0,1,0,0,0,0|3,0,0]=4 670 B13R1.351 CC(C)C(O)CCc1ccccc1 Amb18034016 [0,1,0,0,0,0|2,0,1]=4 671 B13R1.351 CC(OCc1ccccc1)C(=O)Cl Amb24354312 [0,1,0,0,0,0|3,0,0]=4 672 B13R1.351 CN(C(=O)N)CCc1ccncc1 Amb17233545 [0,1,0,0,0,0|3,0,0]=4 673 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)Cl Amb24533460 [0,1,0,0,0,0|3,0,0]=4 674 B13R1.351 C[C@@H](OCc1ccccc1)C(N)=O Amb25192194 [0,1,0,0,0,0|3,0,0]=4 675 B13R1.351 C[C@H](C(=O)O)NCc1ccccc1 Amb16185448 [0,1,0,0,0,0|3,0,0]=4 676 B13R1.351 C[C@H](OCc1ccccc1)C(O)=O Amb25072743 [0,1,0,0,0,0|3,0,0]=4 677 B13R1.351 C\C(=C/Cc1ccccc1)\C(C)=O Amb24529690 [0,1,0,0,0,0|1,0,1]=3 678 B13R1.351 C\C(=C/Cc1ccccc1)\C(O)=O Amb24462262 [0,1,0,0,0,0|2,0,1]=4 679 B13R1.351 C\C(=N/Cc1ccccc1)\C(C)=O Amb25130600 [0,1,0,0,0,0|2,0,0]=3 680 B13R1.351 ClC(=NNc1ccccc1)C(=O)C Amb16236176 [0,1,0,0,0,0|3,0,0]=4 681 B13R1.351 Cl\C(=N\Nc1ccccc1)\C(=O)C Amb1980993 [0,1,0,0,0,0|3,0,0]=4 682 B13R1.351 N=C(NCc1ccccc1)C(O)=O Amb18128144 [0,1,0,0,0,0|3,0,0]=4 683 B13R1.351 NC(=O)C(=O)CCc1ccccc1 Amb24273105 [0,1,0,0,0,0|2,0,0]=3 684 B13R1.351 NC(=O)C(=O)NCc1ccccc1 Amb25858184 [0,1,0,0,0,0|3,0,0]=4 685 B13R1.351 NC(=O)C(N)CCc1ccccc1 Amb19035976 [0,1,0,0,0,0|2,0,0]=3 686 B13R1.351 NC(=O)C(O)CNc1ccccc1 Amb24696346 [0,1,0,0,0,0|3,0,0]=4 687 B13R1.351 NC(=O)C(O)COc1ccccc1 Amb22497384 [0,1,0,0,0,0|3,0,0]=4 688 B13R1.351 NC(C(=O)O)CCc1ccncc1 Amb17470633 [0,1,0,0,0,0|3,0,0]=4 689 B13R1.351 NC(CCc1cccc[n]1)C(O)=O Amb24117831 [0,1,0,0,0,0|3,0,0]=4 690 B13R1.351 NC(CNc1ccccc1)C(O)=O Amb25360987 [0,1,0,0,0,0|3,0,0]=4 691 B13R1.351 NC(CSc1ccccc1)C(O)=O Amb18325246 [0,1,0,0,0,0|3,0,0]=4 692 B13R1.351 N[C@H](CCc1ccccc1)C(O)=O Amb17872441 [0,1,0,0,0,0|2,0,0]=3 693 B13R1.351 N[C@H](CNc1ccccc1)C(O)=O Amb24652450 [0,1,0,0,0,0|3,0,0]=4 694 B13R1.351 O=C(C(=C)C)OCc1ccccc1 Amb10807491 [0,1,0,0,0,0|3,0,0]=4 695 B13R1.351 O=C(C(=O)C)C#Cc1ccccc1 Amb10562238 [0,1,0,0,0,0|1,0,2]=4 696 B13R1.351 O=C(C(=O)C)NCc1ccccc1 Amb17400597 [0,1,0,0,0,0|2,0,0]=3 697 B13R1.351 O=C(C(=O)C)NCc1ccncc1 Amb17400656 [0,1,0,0,0,0|3,0,0]=4 698 B13R1.351 O=C(OCc1ccccc1)C(=O)Cl Amb24687217 [0,1,0,0,0,0|3,0,0]=4 699 B13R1.351 OC(=O)C(=O)OCc1ccccc1 Amb18128558 [0,1,0,0,0,0|3,0,0]=4 700 B13R1.351 OC(=O)C(Br)CCc1ccccc1 Amb18662872 [0,1,0,0,0,0|2,0,0]=3 701 B13R1.351 OC(=O)C(CCc1ccccn1)C Amb17335286 [0,1,0,0,0,0|3,0,0]=4 702 B13R1.351 OC(=O)C(CCc1ccccn1)N Amb1101108 [0,1,0,0,0,0|3,0,0]=4 703 B13R1.351 OC(=O)C(CCc1cccnc1)C Amb17233532 [0,1,0,0,0,0|3,0,0]=4 704 B13R1.351 OC(=O)C(F)OCc1ccccc1 Amb25369072 [0,1,0,0,0,0|3,0,0]=4 705 B13R1.351 OC(=O)\C(\F)=C\Cc1ccccc1 Amb25265375 [0,1,0,0,0,0|2,0,1]=4 706 B13R1.351 O[C@H](C(=O)O)CCc1ccccc1 Amb10603260 [0,1,0,0,0,0|2,0,0]=3 707 B13R1.513 BrC(=C)CCCc1ccc(cc1)C Amb13890672 [0,1,0,0,0,0|2,0,1]=4 708 B13R1.513 BrC(=C)CCCc1ccc(cc1)Cl Amb13890660 [0,1,0,0,0,0|2,0,1]=4 709 B13R1.513 BrC(=C)CCCc1ccc(cc1)F Amb13890684 [0,1,0,0,0,0|2,0,1]=4 710 B13R1.513 CC(=C)CCCc1ccc(cc1)C Amb13890673 [0,1,0,0,0,0|2,0,0]=3 711 B13R1.513 CC(=C)CCCc1ccc(cc1)Cl Amb13890661 [0,1,0,0,0,0|2,0,0]=3 712 B13R1.513 CC(=C)CCCc1ccc(cc1)F Amb13890685 [0,1,0,0,0,0|2,0,0]=3 713 B13R1.513 CC(=C)CCNc1ccc(Br)cc1 Amb25803095 [0,1,0,0,0,0|3,0,0]=4 714 B13R1.513 CC(=C)CCNc1ccc(F)cc1 Amb24533540 [0,1,0,0,0,0|3,0,0]=4 715 B13R1.513 CC(=C)CCNc1ccc(I)cc1 Amb24386324 [0,1,0,0,0,0|3,0,0]=4 716 B13R1.513 CC(=C)CNCc1ccc(Br)cc1 Amb24768740 [0,1,0,0,0,0|3,0,0]=4 717 B13R1.513 CC(=C)CNCc1ccc(cc1)C Amb17308891 [0,1,0,0,0,0|3,0,0]=4 718 B13R1.513 CC(=C)CNCc1ccc(cc1)Cl Amb17309084 [0,1,0,0,0,0|3,0,0]=4 719 B13R1.513 CC(=C)CNCc1ccc(cc1)F Amb17308876 [0,1,0,0,0,0|3,0,0]=4 720 B13R1.513 CC(=C)CSCc1ccc(cc1)N Amb17498611 [0,1,0,0,0,0|3,0,0]=4 721 B13R1.513 CC(=N)NCCc1ccc(Cl)cc1 Amb25807067 [0,1,0,0,0,0|2,0,0]=3 722 B13R1.513 CC(=O)CCCc1ccc(cc1)Br Amb17255478 [0,1,0,0,0,0|1,0,0]=2 723 B13R1.513 CC(=O)CCCc1ccc(cc1)C Amb17233200 [0,1,0,0,0,0|1,0,0]=2 724 B13R1.513 CC(=O)CCCc1ccc(cc1)Cl Amb17236503 [0,1,0,0,0,0|1,0,0]=2 725 B13R1.513 CC(=O)CCCc1ccc(cc1)F Amb17233677 [0,1,0,0,0,0|1,0,0]=2 726 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl Amb17139725 [0,1,0,0,0,0|2,0,0]=3 727 B13R1.513 CC(=O)CSCc1ccc(Cl)cc1 Amb24064340 [0,1,0,0,0,0|2,0,0]=3 728 B13R1.513 CC(=O)C\C=C\c1ccc(Br)cc1 Amb24553090 [0,1,0,0,0,0|1,0,2]=4 729 B13R1.513 CC(=O)C\C=C\c1ccc(Cl)cc1 Amb22490195 [0,1,0,0,0,0|1,0,2]=4 730 B13R1.513 CC(=O)C\C=C\c1ccc(F)cc1 Amb25326496 [0,1,0,0,0,0|1,0,2]=4 731 B13R1.513 CC(=O)C\C=C\c1ccc(O)cc1 Amb24747691 [0,1,0,0,0,0|1,0,2]=4 732 B13R1.513 CC(=O)N/N=C/c1ccc(Br)cc1 Amb17798515 [0,1,0,0,0,0|2,0,1]=4 733 B13R1.513 CC(=O)N/N=C/c1ccc(F)cc1 Amb17862878 [0,1,0,0,0,0|2,0,1]=4 734 B13R1.513 CC(=O)NCCC=1C=CC(=O)NC1 Amb25272227 [0,1,0,0,0,0|2,0,0]=3 735 B13R1.513 CC(=O)NCCc1ccc(Br)c[n]1 Amb24436674 [0,1,0,0,0,0|2,0,0]=3 736 B13R1.513 CC(=O)NCCc1ccc(Br)cc1 Amb24451176 [0,1,0,0,0,0|1,0,0]=2 737 B13R1.513 CC(=O)NCCc1ccc(Cl)[n]c1 Amb24683764 [0,1,0,0,0,0|2,0,0]=3 738 B13R1.513 CC(=O)NCCc1ccc(Cl)cc1 Amb22227659 [0,1,0,0,0,0|1,0,0]=2 739 B13R1.513 CC(=O)NCCc1ccc(cc1)N Amb17138877 [0,1,0,0,0,0|1,0,0]=2 740 B13R1.513 CC(=O)NCOc1ccc(N)cc1 Amb24072944 [0,1,0,0,0,0|2,0,0]=3 741 B13R1.513 CC(=O)NOCc1ccc(Br)cc1 Amb24584005 [0,1,0,0,0,0|2,0,0]=3 742 B13R1.513 CC(=O)NOCc1ccc(Cl)c[n]1 Amb24619033 [0,1,0,0,0,0|3,0,0]=4 743 B13R1.513 CC(=O)NOCc1ccc(Cl)cc1 Amb25099136 [0,1,0,0,0,0|2,0,0]=3 744 B13R1.513 CC(=O)NOCc1ccc(F)c[n]1 Amb24352947 [0,1,0,0,0,0|3,0,0]=4 745 B13R1.513 CC(=O)NOCc1ccc(F)cc1 Amb24704201 [0,1,0,0,0,0|2,0,0]=3 746 B13R1.513 CC(=O)N\N=C\c1ccc(cc1)C Amb16224980 [0,1,0,0,0,0|2,0,1]=4 747 B13R1.513 CC(=O)N\N=C\c1ccc(cc1)Cl Amb16224983 [0,1,0,0,0,0|2,0,1]=4 748 B13R1.513 CC(=O)OCCc1ccc(cc1)O Amb17607347 [0,1,0,0,0,0|0,0,0]=1 749 B13R1.513 CC(=O)O\N=C\c1ccc(O)cc1 Amb25302268 [0,1,0,0,0,0|1,0,1]=3 750 B13R1.513 CC(=O)\C=C/Sc1ccc(O)cc1 Amb25712939 [0,1,0,0,0,0|2,0,1]=4 751 B13R1.513 CC(=O)\C=C\Nc1ccc(Cl)cc1 Amb25322184 [0,1,0,0,0,0|2,0,1]=4 752 B13R1.513 CC(=O)\C=C\Nc1ccc(O)cc1 Amb25830086 [0,1,0,0,0,0|2,0,1]=4 753 B13R1.513 CC(C)=CCNc1ccc(Br)cc1 Amb25820574 [0,1,0,0,0,0|3,0,0]=4 754 B13R1.513 CC(C)=CCNc1ccc(C)cc1 Amb24489128 [0,1,0,0,0,0|3,0,0]=4 755 B13R1.513 CC(C)=CCNc1ccc(F)cc1 Amb25136555 [0,1,0,0,0,0|3,0,0]=4 756 B13R1.513 CC(C)=CCNc1ccc(I)cc1 Amb25201449 [0,1,0,0,0,0|3,0,0]=4 757 B13R1.513 CC(C)=CCNc1ccc(N)cc1 Amb25191463 [0,1,0,0,0,0|3,0,0]=4 758 B13R1.513 CC(C)=CCOc1ccc(I)cc1 Amb24571558 [0,1,0,0,0,0|3,0,0]=4 759 B13R1.513 CC(C)=CCOc1ccc(N)cc1 Amb18971518 [0,1,0,0,0,0|3,0,0]=4 760 B13R1.513 CC(C)=CCSc1ccc(Cl)cc1 Amb20620745 [0,1,0,0,0,0|3,0,0]=4 761 B13R1.513 CC(C)=CCSc1ccc(F)cc1 Amb25846827 [0,1,0,0,0,0|3,0,0]=4 762 B13R1.513 CC(C)=CCSc1ccc(O)cc1 Amb18321262 [0,1,0,0,0,0|3,0,0]=4 763 B13R1.513 CC(C)=NNCc1ccc(Cl)cc1 Amb24343032 [0,1,0,0,0,0|3,0,0]=4 764 B13R1.513 CC(C)=NOCc1ccc(Br)cc1 Amb25092447 [0,1,0,0,0,0|3,0,0]=4 765 B13R1.513 CC(C)=NOCc1ccc(Cl)cc1 Amb25846847 [0,1,0,0,0,0|3,0,0]=4 766 B13R1.513 CC(CCCc1ccc(cc1)Br)N Amb17255967 [0,1,0,0,0,0|2,0,1]=4 767 B13R1.513 CC(CCCc1ccc(cc1)C)N Amb17233315 [0,1,0,0,0,0|2,0,1]=4 768 B13R1.513 CC(CCCc1ccc(cc1)Cl)N Amb17236683 [0,1,0,0,0,0|2,0,1]=4 769 B13R1.513 CC(CCCc1ccc(cc1)F)N Amb17233821 [0,1,0,0,0,0|2,0,1]=4 770 B13R1.513 CN(C)CCCc1ccc(O)cc1 Amb20671018 [0,1,0,0,0,0|3,0,0]=4 771 B13R1.513 CS(=O)CCNc1ccc(Br)cc1 Amb25229260 [0,1,0,0,0,0|3,0,0]=4 772 B13R1.513 CS(=O)CCNc1ccc(Cl)cc1 Amb25265284 [0,1,0,0,0,0|3,0,0]=4 773 B13R1.513 Cc1c[n]c(CCNC(C)=O)[n]c1 Amb25711880 [0,1,0,0,0,0|3,0,0]=4 774 B13R1.513 Cc1ccc(C=C=CC(C)=O)cc1 Amb24402076 [0,1,0,0,0,0|1,0,2]=4 775 B13R1.513 Cc1ccc(CC#CC(O)=O)cc1 Amb24438863 [0,1,0,0,0,0|2,0,1]=4 776 B13R1.513 Cc1ccc(CCCC(N)=S)cc1 Amb18626184 [0,1,0,0,0,0|2,1,0]=4 777 B13R1.513 Cc1ccc(CCNC(N)=N)cc1 Amb18065725 [0,1,0,0,0,0|3,0,0]=4 778 B13R1.513 Cc1ccc(CCNC(N)=S)cc1 Amb24488851 [0,1,0,0,0,0|2,1,0]=4 779 B13R1.513 Cc1ccc(CCNC(S)=S)cc1 Amb25815936 [0,1,0,0,0,0|2,1,0]=4 780 B13R1.513 Cc1ccc(CCOC(C)=O)cc1 Amb24100708 [0,1,0,0,0,0|0,0,0]=1 781 B13R1.513 Cc1ccc(C\C=C\C(C)=O)cc1 Amb25179399 [0,1,0,0,0,0|1,0,1]=3 782 B13R1.513 Cc1ccc(C\C=C\C(N)=O)cc1 Amb25362048 [0,1,0,0,0,0|2,0,1]=4 783 B13R1.513 Cc1ccc(\C=C/CC(C)=O)cc1 Amb24492797 [0,1,0,0,0,0|1,0,2]=4 784 B13R1.513 Cc1ccc(\C=C\CC(C)=O)cc1 Amb24447420 [0,1,0,0,0,0|1,0,2]=4 785 B13R1.513 Cc1ccc(\C=C\NC(C)=O)cc1 Amb24512796 [0,1,0,0,0,0|1,0,2]=4 786 B13R1.513 Cc1ccc(cc1)NCCC(C)=O Amb25155561 [0,1,0,0,0,0|2,0,0]=3 787 B13R1.513 Cc1ccc(cc1)N\N=C\C(C)=O Amb25807548 [0,1,0,0,0,0|3,0,0]=4 788 B13R1.513 Cc1ccc(cc1)[Te]CCC(O)=O Amb22367959 [0,1,0,0,0,0|3,0,0]=4 789 B13R1.513 ClC(=C)CCCc1ccc(cc1)C Amb13890671 [0,1,0,0,0,0|2,0,1]=4 790 B13R1.513 ClC(=C)CCCc1ccc(cc1)Cl Amb13890659 [0,1,0,0,0,0|2,0,1]=4 791 B13R1.513 ClC(=C)CCCc1ccc(cc1)F Amb13890683 [0,1,0,0,0,0|2,0,1]=4 792 B13R1.513 ClC(=O)CCOc1ccc(cc1)C Amb17143210 [0,1,0,0,0,0|3,0,0]=4 793 B13R1.513 ClC(=O)CCOc1ccc(cc1)Cl Amb17143749 [0,1,0,0,0,0|3,0,0]=4 794 B13R1.513 ClC(=O)CCSc1ccc(cc1)Cl Amb17144561 [0,1,0,0,0,0|3,0,0]=4 795 B13R1.513 NC(=N)NCCc1ccc(Br)cc1 Amb18071311 [0,1,0,0,0,0|3,0,0]=4 796 B13R1.513 NC(=N)NCCc1ccc(O)cc1 Amb18184507 [0,1,0,0,0,0|3,0,0]=4 797 B13R1.513 NC(=O)CCCc1ccc(cc1)C Amb17233276 [0,1,0,0,0,0|2,0,0]=3 798 B13R1.513 NC(=O)CCCc1ccc(cc1)Cl Amb17236667 [0,1,0,0,0,0|2,0,0]=3 799 B13R1.513 NC(=O)CCCc1ccc(cc1)F Amb17233787 [0,1,0,0,0,0|2,0,0]=3 800 B13R1.513 NC(=O)CCNc1ccc(cc1)F Amb1670561 [0,1,0,0,0,0|3,0,0]=4 801 B13R1.513 NC(=O)CCSc1ccc(cc1)Br Amb15962728 [0,1,0,0,0,0|3,0,0]=4 802 B13R1.513 NC(=O)CCSc1ccc(cc1)Cl Amb1539927 [0,1,0,0,0,0|3,0,0]=4 803 B13R1.513 NC(=O)CNCc1ccc(cc1)Br Amb1120953 [0,1,0,0,0,0|3,0,0]=4 804 B13R1.513 NC(=O)CNCc1ccc(cc1)C Amb1112534 [0,1,0,0,0,0|3,0,0]=4 805 B13R1.513 NC(=O)CNCc1ccc(cc1)Cl Amb1112155 [0,1,0,0,0,0|3,0,0]=4 806 B13R1.513 NC(=O)CNCc1ccc(cc1)F Amb1118480 [0,1,0,0,0,0|3,0,0]=4 807 B13R1.513 NC(=O)CSCc1ccc(cc1)Cl Amb1179222 [0,1,0,0,0,0|3,0,0]=4 808 B13R1.513 NC(=O)CSCc1ccc(cc1)N Amb17497163 [0,1,0,0,0,0|3,0,0]=4 809 B13R1.513 NC(=O)NCCc1ccc(O)cc1 Amb18181065 [0,1,0,0,0,0|2,0,0]=3 810 B13R1.513 NC(=O)NCCc1ccc(cc1)Cl Amb12806713 [0,1,0,0,0,0|2,0,0]=3 811 B13R1.513 NC(=O)NOCc1ccc(cc1)C Amb2427418 [0,1,0,0,0,0|3,0,0]=4 812 B13R1.513 NC(=O)NOCc1ccc(cc1)Cl Amb2430435 [0,1,0,0,0,0|3,0,0]=4 813 B13R1.513 NC(=O)NOCc1ccc(cc1)F Amb2435064 [0,1,0,0,0,0|3,0,0]=4 814 B13R1.513 NC(=O)\C=C\Cc1ccc(Cl)cc1 Amb25858090 [0,1,0,0,0,0|2,0,1]=4 815 B13R1.513 NC(=S)CCCc1ccc(Cl)cc1 Amb18107322 [0,1,0,0,0,0|2,1,0]=4 816 B13R1.513 NC(=S)NCCc1ccc(Br)cc1 Amb22464483 [0,1,0,0,0,0|2,1,0]=4 817 B13R1.513 NC(=S)NCCc1ccc(O)cc1 Amb24468719 [0,1,0,0,0,0|2,1,0]=4 818 B13R1.513 Nc1ccc(CCNC(N)=O)cc1 Amb18973442 [0,1,0,0,0,0|2,0,0]=3 819 B13R1.513 Nc1ccc(cc1)NCCC(N)=O Amb19373175 [0,1,0,0,0,0|3,0,0]=4 820 B13R1.513 Nc1ccc(cc1)NCCC(O)=O Amb25060675 [0,1,0,0,0,0|3,0,0]=4 821 B13R1.513 Nc1ccc(cc1)OCCC(O)=O Amb19348346 [0,1,0,0,0,0|3,0,0]=4 822 B13R1.513 Nc1ccc(cc1)SCCC(O)=O Amb19014210 [0,1,0,0,0,0|3,0,0]=4 823 B13R1.513 O=C(Cl)CCSc1ccc(F)cc1 Amb22642142 [0,1,0,0,0,0|3,0,0]=4 824 B13R1.513 OC(=O)CCCN1C=CC(=O)C=C1 Amb18029469 [0,1,0,0,0,0|3,0,0]=4 825 B13R1.513 OC(=O)CCCc1ccc(cc1)C Amb2568475 [0,1,0,0,0,0|2,0,0]=3 826 B13R1.513 OC(=O)CCCc1ccc(cc1)O Amb10602364 [0,1,0,0,0,0|2,0,0]=3 827 B13R1.513 OC(=O)CCCc1ccc(cc1)S Amb17616854 [0,1,0,0,0,0|2,0,0]=3 828 B13R1.513 OC(=O)CCNc1ccc(cc1)Br Amb2209168 [0,1,0,0,0,0|3,0,0]=4 829 B13R1.513 OC(=O)CCNc1ccc(cc1)C Amb2209164 [0,1,0,0,0,0|3,0,0]=4 830 B13R1.513 OC(=O)CCNc1ccc(cc1)Cl Amb2209167 [0,1,0,0,0,0|3,0,0]=4 831 B13R1.513 OC(=O)CCNc1ccc(cc1)F Amb2209163 [0,1,0,0,0,0|3,0,0]=4 832 B13R1.513 OC(=O)CCOc1ccc(cc1)Br Amb1118334 [0,1,0,0,0,0|3,0,0]=4 833 B13R1.513 OC(=O)CCOc1ccc(cc1)Cl Amb1115231 [0,1,0,0,0,0|3,0,0]=4 834 B13R1.513 OC(=O)CCOc1ccc(cc1)F Amb1119259 [0,1,0,0,0,0|3,0,0]=4 835 B13R1.513 OC(=O)CCSc1ccc(cc1)Br Amb1118833 [0,1,0,0,0,0|3,0,0]=4 836 B13R1.513 OC(=O)CCSc1ccc(cc1)C Amb1102788 [0,1,0,0,0,0|3,0,0]=4 837 B13R1.513 OC(=O)CCSc1ccc(cc1)Cl Amb1102804 [0,1,0,0,0,0|3,0,0]=4 838 B13R1.513 OC(=O)CCSc1ccc(cc1)F Amb1215312 [0,1,0,0,0,0|3,0,0]=4 839 B13R1.513 OC(=O)CC[Te]c1ccc(Br)cc1 Amb22359444 [0,1,0,0,0,0|3,0,0]=4 840 B13R1.513 OC(=O)CNCc1ccc(cc1)Cl Amb1111327 [0,1,0,0,0,0|3,0,0]=4 841 B13R1.513 OC(=O)CNCc1ccc(cc1)Cl Amb15740982 [0,1,0,0,0,0|3,0,0]=4 842 B13R1.513 OC(=O)CNCc1ccc(cc1)F Amb10610178 [0,1,0,0,0,0|3,0,0]=4 843 B13R1.513 OC(=O)CNCc1ccc(cc1)F Amb2372201 [0,1,0,0,0,0|3,0,0]=4 844 B13R1.513 OC(=O)COCc1ccc(cc1)C Amb17470625 [0,1,0,0,0,0|3,0,0]=4 845 B13R1.513 OC(=O)COCc1ccc(cc1)Cl Amb17471000 [0,1,0,0,0,0|3,0,0]=4 846 B13R1.513 OC(=O)COCc1ccc(cc1)F Amb17470663 [0,1,0,0,0,0|3,0,0]=4 847 B13R1.513 OC(=O)CSCc1ccc(cc1)C Amb1211907 [0,1,0,0,0,0|3,0,0]=4 848 B13R1.513 OC(=O)CSCc1ccc(cc1)F Amb1210139 [0,1,0,0,0,0|3,0,0]=4 849 B13R1.513 OC(=O)CSCc1ccc(cc1)N Amb17497517 [0,1,0,0,0,0|3,0,0]=4 850 B13R1.513 OC(=O)\C=C\Cc1ccc(F)cc1 Amb25697178 [0,1,0,0,0,0|2,0,1]=4 851 B13R1.513 Oc1ccc(CCCC(=O)Cl)cc1 Amb20621445 [0,1,0,0,0,0|2,0,0]=3 852 B13R1.718 BrCC(=O)NCCc1ccccc1 Amb2089064 [0,1,0,0,0,0|1,0,0]=2 853 B13R1.718 BrCC(=O)NCCc1ccccn1 Amb17323242 [0,1,0,0,0,0|2,0,0]=3 854 B13R1.718 C#CC(=O)COCc1ccccc1 Amb25697113 [0,1,0,0,0,0|2,0,1]=4 855 B13R1.718 C#CC(=O)NCCc1cc[n]cc1 Amb25051109 [0,1,0,0,0,0|2,0,1]=4 856 B13R1.718 C#CC(=O)NCCc1ccc[n]c1 Amb25795245 [0,1,0,0,0,0|2,0,1]=4 857 B13R1.718 C#CC(=O)NCCc1cccc[n]1 Amb24397559 [0,1,0,0,0,0|2,0,1]=4 858 B13R1.718 C#CC(=O)NCCc1ccccc1 Amb25349378 [0,1,0,0,0,0|1,0,1]=3 859 B13R1.718 C#CC(=O)NOCc1ccccc1 Amb25755722 [0,1,0,0,0,0|2,0,1]=4 860 B13R1.718 C=C(CN)COCc1ccccc1 Amb24560965 [0,1,0,0,0,0|3,0,0]=4 861 B13R1.718 C=C(CO)CNCc1ccccc1 Amb24375679 [0,1,0,0,0,0|3,0,0]=4 862 B13R1.718 C=C(CS)COCc1ccccc1 Amb24389998 [0,1,0,0,0,0|3,0,0]=4 863 B13R1.718 C=CC(=O)NOCc1ccccc1 Amb24684331 [0,1,0,0,0,0|2,0,1]=4 864 B13R1.718 C=CC(=O)OCCc1ccccc1 Amb17934131 [0,1,0,0,0,0|0,0,1]=2 865 B13R1.718 CC(C=C)ONCc1ccccc1 Amb24539150 [0,1,0,0,0,0|2,0,1]=4 866 B13R1.718 CC(C=O)\C=N\Cc1ccccc1 Amb25767846 [0,1,0,0,0,0|2,0,1]=4 867 B13R1.718 CC(CNCc1ccccc1)=C=C Amb25363323 [0,1,0,0,0,0|3,0,0]=4 868 B13R1.718 CC(COCc1ccccc1)C=O Amb18128219 [0,1,0,0,0,0|2,0,1]=4 869 B13R1.718 CCC(=O)C=C=Cc1ccccc1 Amb25713065 [0,1,0,0,0,0|1,0,2]=4 870 B13R1.718 CCC(=O)CCCc1ccccc1 Amb17138784 [0,1,0,0,0,0|1,0,0]=2 871 B13R1.718 CCC(=O)COCc1ccccc1 Amb18186198 [0,1,0,0,0,0|2,0,0]=3 872 B13R1.718 CCC(=O)NCCc1cc[n]cc1 Amb24073074 [0,1,0,0,0,0|2,0,0]=3 873 B13R1.718 CCC(=O)NOCc1ccccc1 Amb15742563 [0,1,0,0,0,0|2,0,0]=3 874 B13R1.718 CCC(=O)N\C=C\c1ccccc1 Amb10561812 [0,1,0,0,0,0|1,0,2]=4 875 B13R1.718 CCC(NCCc1ccccc1)C Amb2119578 [0,1,0,0,0,0|2,0,1]=4 876 B13R1.718 CC\C(\N)=N\OCc1ccccc1 Amb24626643 [0,1,0,0,0,0|3,0,0]=4 877 B13R1.718 CNC(=N)COCc1ccccc1 Amb24607701 [0,1,0,0,0,0|3,0,0]=4 878 B13R1.718 CNC(=N)NCCc1cc[n]cc1 Amb18184397 [0,1,0,0,0,0|3,0,0]=4 879 B13R1.718 CNC(=N)NCCc1ccc[n]c1 Amb18804783 [0,1,0,0,0,0|3,0,0]=4 880 B13R1.718 CNC(=N)NCCc1cccc[n]1 Amb18804782 [0,1,0,0,0,0|3,0,0]=4 881 B13R1.718 CNC(=N)NCCc1ccccc1 Amb18804663 [0,1,0,0,0,0|2,0,0]=3 882 B13R1.718 CNC(=N)NNCc1ccccc1 Amb25729841 [0,1,0,0,0,0|3,0,0]=4 883 B13R1.718 CNC(=O)CCNc1cc[n]cc1 Amb18186363 [0,1,0,0,0,0|3,0,0]=4 884 B13R1.718 CNC(=O)CCNc1cccc[n]1 Amb18186362 [0,1,0,0,0,0|3,0,0]=4 885 B13R1.718 CNC(=O)CCNc1ccccc1 Amb18180793 [0,1,0,0,0,0|2,0,0]=3 886 B13R1.718 CNC(=O)C\C=C\c1ccccc1 Amb25857434 [0,1,0,0,0,0|1,0,2]=4 887 B13R1.718 CNC(=O)NCCc1cc[n]cc1 Amb22584239 [0,1,0,0,0,0|2,0,0]=3 888 B13R1.718 CNC(=O)NCCc1ccc[n]c1 Amb22584252 [0,1,0,0,0,0|2,0,0]=3 889 B13R1.718 CNC(=O)NCCc1cccc[n]1 Amb22584238 [0,1,0,0,0,0|2,0,0]=3 890 B13R1.718 CNC(=O)NCCc1ccccc1 Amb2132768 [0,1,0,0,0,0|1,0,0]=2 891 B13R1.718 CNC(=O)\C=C/Sc1ccccc1 Amb24669067 [0,1,0,0,0,0|2,0,1]=4 892 B13R1.718 CNC(=O)\C=N\Nc1ccccc1 Amb24444432 [0,1,0,0,0,0|3,0,0]=4 893 B13R1.718 CNC(=S)NNCc1ccccc1 Amb25826591 [0,1,0,0,0,0|2,1,0]=4 894 B13R1.718 CNC(=S)NOCc1ccccc1 Amb25805223 [0,1,0,0,0,0|2,1,0]=4 895 B13R1.718 COC(=N)CNCc1ccccc1 Amb25074070 [0,1,0,0,0,0|3,0,0]=4 896 B13R1.718 COC(=N)COCc1ccccc1 Amb24607698 [0,1,0,0,0,0|3,0,0]=4 897 B13R1.718 COC(=O)C#CCc1c[n]ccc1 Amb24406047 [0,1,0,0,0,0|2,0,1]=4 898 B13R1.718 COC(=O)C#CCc1ccccc1 Amb24623934 [0,1,0,0,0,0|1,0,1]=3 899 B13R1.718 COC(=O)CC#Cc1ccccc1 Amb25763626 [0,1,0,0,0,0|1,0,2]=4 900 B13R1.718 COC(=O)CCCc1cc[n]cc1 Amb19888651 [0,1,0,0,0,0|2,0,0]=3 901 B13R1.718 COC(=O)CCCc1ccc[n]c1 Amb24066737 [0,1,0,0,0,0|2,0,0]=3 902 B13R1.718 COC(=O)CCNc1ccc[n]c1 Amb18933308 [0,1,0,0,0,0|3,0,0]=4 903 B13R1.718 COC(=O)CCNc1ccccc1 Amb1930724 [0,1,0,0,0,0|2,0,0]=3 904 B13R1.718 COC(=O)CCNc1ccccn1 Amb1243208 [0,1,0,0,0,0|3,0,0]=4 905 B13R1.718 COC(=O)CC[NH2+]c1ccccc1 Amb10553942 [0,1,0,0,0,0|2,0,0]=3 906 B13R1.718 COC(=O)CNCc1ccccc1 Amb21929289 [0,1,0,0,0,0|2,0,0]=3 907 B13R1.718 COC(=O)C\C=C\c1ccccc1 Amb10563169 [0,1,0,0,0,0|1,0,2]=4 908 B13R1.718 COC(=O)C\N=C\c1ccccc1 Amb22232615 [0,1,0,0,0,0|2,0,1]=4 909 B13R1.718 COC(=O)NCCc1ccncc1 Amb1089154 [0,1,0,0,0,0|2,0,0]=3 910 B13R1.718 COC(=O)NOCc1ccccc1 Amb25359225 [0,1,0,0,0,0|2,0,0]=3 911 B13R1.718 COC(=O)N\C=C\c1ccccc1 Amb20001007 [0,1,0,0,0,0|1,0,2]=4 912 B13R1.718 COC(=O)N\N=C\c1ccccc1 Amb2411289 [0,1,0,0,0,0|2,0,1]=4 913 B13R1.718 COC(=O)\C=C\Nc1ccccc1 Amb2386662 [0,1,0,0,0,0|2,0,1]=4 914 B13R1.718 COC(=O)\C=N/Nc1ccccc1 Amb24460271 [0,1,0,0,0,0|3,0,0]=4 915 B13R1.718 C[C@H](COCc1ccccc1)C=O Amb25780652 [0,1,0,0,0,0|2,0,1]=4 916 B13R1.718 C\C(=C/NCc1ccccc1)\C#N Amb25689534 [0,1,0,0,0,0|3,0,0]=4 917 B13R1.718 C\C(=C\NCc1ccccc1)\C#N Amb25176186 [0,1,0,0,0,0|3,0,0]=4 918 B13R1.718 C\C(\C=O)=C/C=C/c1ccccc1 Amb18126919 [0,1,0,0,0,0|1,0,2]=4 919 B13R1.718 C\C(\C=O)=N/NCc1ccccc1 Amb18127759 [0,1,0,0,0,0|2,0,0]=3 920 B13R1.718 C\C(\C=O)=N/OCc1ccccc1 Amb25192680 [0,1,0,0,0,0|2,0,0]=3 921 B13R1.718 C\C(\C=O)=N\NCc1ccccc1 Amb24574067 [0,1,0,0,0,0|2,0,0]=3 922 B13R1.718 C\C(\CC)=N/OCc1ccccc1 Amb24414826 [0,1,0,0,0,0|3,0,0]=4 923 B13R1.718 C\C(\CCl)=N\OCc1ccccc1 Amb25684800 [0,1,0,0,0,0|3,0,0]=4 924 B13R1.718 C\C(\CNCc1ccccc1)=C/C Amb18127531 [0,1,0,0,0,0|3,0,0]=4 925 B13R1.718 C\C(\CNCc1ccccc1)=C\C Amb24414647 [0,1,0,0,0,0|3,0,0]=4 926 B13R1.718 ClCC(=O)NCCc1ccncc1 Amb17333280 [0,1,0,0,0,0|2,0,0]=3 927 B13R1.718 N#CC(=O)NCCc1ccccc1 Amb25725944 [0,1,0,0,0,0|1,0,1]=3 928 B13R1.718 N#CC(NCCc1ccccc1)C Amb17044875 [0,1,0,0,0,0|2,0,1]=4 929 B13R1.718 NC(NCCc1ccccc1)=NO Amb18809201 [0,1,0,0,0,0|2,0,1]=4 930 B13R1.718 NCC(=O)NCCc1ccccc1 Amb13951619 [0,1,0,0,0,0|1,0,0]=2 931 B13R1.718 NCC(=O)N\N=C\c1ccccc1 Amb25360871 [0,1,0,0,0,0|2,0,1]=4 932 B13R1.718 NNC(=O)CCNc1ccccc1 Amb10607892 [0,1,0,0,0,0|3,0,0]=4 933 B13R1.718 NNC(=O)CNCc1ccccc1 Amb21967920 [0,1,0,0,0,0|3,0,0]=4 934 B13R1.718 NNC(=O)NCCc1cc[n]cc1 Amb18181088 [0,1,0,0,0,0|3,0,0]=4 935 B13R1.718 NNC(=O)NCCc1ccc[n]c1 Amb18181087 [0,1,0,0,0,0|3,0,0]=4 936 B13R1.718 NNC(=O)NNCc1ccccc1 Amb24501441 [0,1,0,0,0,0|3,0,0]=4 937 B13R1.718 NNC(=O)NOCc1ccccc1 Amb25251822 [0,1,0,0,0,0|3,0,0]=4 938 B13R1.718 N\C(\CCCc1ccccc1)=N\O Amb22551827 [0,1,0,0,0,0|2,0,1]=4 939 B13R1.718 N\C(\NCCc1ccccc1)=N\N Amb24573776 [0,1,0,0,0,0|3,0,0]=4 940 B13R1.718 O=C(CCl)CCCc1ccccc1 Amb22395307 [0,1,0,0,0,0|1,0,0]=2 941 B13R1.718 O=C(CCl)CCSc1ccccc1 Amb22395335 [0,1,0,0,0,0|2,0,0]=3 942 B13R1.718 O=C(CCl)COCc1ccccc1 Amb24738350 [0,1,0,0,0,0|2,0,0]=3 943 B13R1.718 O=C(CCl)CSCc1ccccc1 Amb22395293 [0,1,0,0,0,0|2,0,0]=3 944 B13R1.718 O=C(CCl)NCCc1ccc[n]c1 Amb19056184 [0,1,0,0,0,0|2,0,0]=3 945 B13R1.718 O=C(CCl)\C=C\Nc1ccccc1 Amb25295464 [0,1,0,0,0,0|2,0,1]=4 946 B13R1.718 O=C\C(\F)=C\NCc1ccccc1 Amb25046801 [0,1,0,0,0,0|3,0,0]=4 947 B13R1.718 OCC(=O)COCc1ccccc1 Amb24555141 [0,1,0,0,0,0|2,0,0]=3 948 B13R1.718 OCC(=O)NCCc1ccccc1 Amb1111400 [0,1,0,0,0,0|1,0,0]=2 949 B13R1.718 ONC(=O)COCc1ccccc1 Amb25072046 [0,1,0,0,0,0|3,0,0]=4 950 B13R1.718 ONC(=O)NCCc1ccccc1 Amb25112138 [0,1,0,0,0,0|2,0,0]=3 951 B13R1.3523 CC(C)(C)ONCc1ccccc1 Amb24566030 [0,1,0,0,0,0|2,0,1]=4 952 B13R1.3523 CC(C)(C)[NH2+]CCc1ccccc1 Amb22477658 [0,1,0,0,0,0|2,0,1]=4 953 B13R1.3523 CC(CCCc1ccccc1)(N)C Amb17400637 [0,1,0,0,0,0|2,0,1]=4 954 B13R1.3523 CC(CCCc1ccccc1)(O)C Amb17400670 [0,1,0,0,0,0|1,0,2]=4 955 B13R1.3523 CC(NCCc1ccccc1)(C)C Amb1139342 [0,1,0,0,0,0|2,0,1]=4 956 B13R1.3523 CC(NCCc1ccccc1)(C)C Amb2119111 [0,1,0,0,0,0|2,0,1]=4 957 B13R1.3523 CP(C)(=O)CNCc1ccccc1 Amb25804602 [0,1,0,0,0,0|3,0,0]=4 958 B13R1.3523 CS(=O)(=O)CCNc1ccccc1 Amb19004864 [0,1,0,0,0,0|3,0,0]=4 959 B13R1.3523 CS(=O)(=O)NCCc1cccnc1 Amb11292758 [0,1,0,0,0,0|3,0,0]=4 960 B13R1.3523 CS(=O)(=O)OCCc1c[n]ccc1 Amb24496386 [0,1,0,0,0,0|2,0,0]=3 961 B13R1.3523 CS(=O)(=O)OCCc1ccccc1 Amb22493888 [0,1,0,0,0,0|1,0,0]=2 962 B13R1.3523 C[Si](C)(Cl)CCCc1ccccc1 Amb19893686 [0,1,0,0,0,0|2,1,0]=4 963 B13R1.3523 ClS(=O)(=O)NCCc1ccccc1 Amb17193930 [0,1,0,0,0,0|3,0,0]=4 964 B13R1.3523 NS(=O)(=O)CCCc1ccccc1 Amb18322199 [0,1,0,0,0,0|3,0,0]=4 965 B13R1.3523 OP(O)(=O)CCCc1ccccc1 Amb22471211 [0,1,0,0,0,0|3,0,0]=4 966 B13R1.3523 OS(=O)(=O)NCCc1ccccc1 Amb22051654 [0,1,0,0,0,0|3,0,0]=4 967 B13R2.10 BrC1=NOC(C1)c2ccccc2 Amb10067856 [0,0,0,1,0,0|3,0,0]=4 968 B13R2.10 C=C1COC(C1)c2ccccc2 Amb25692265 [0,0,0,1,0,0|3,0,0]=4 969 B13R2.10 CC1=NC(CO1)c2ccccc2 Amb24754160 [0,0,0,1,0,0|1,0,0]=2 970 B13R2.10 CC1CC(CN1)c2ccccc2 Amb18563524 [0,0,0,1,0,0|2,0,1]=4 971 B13R2.10 CC1NC(CS1)c2ccccc2 Amb25375933 [0,0,0,1,0,0|1,1,1]=4 972 B13R2.10 CC1N[C@H](CO1)c2ccccc2 Amb25150915 [0,0,0,1,0,0|1,0,1]=3 973 B13R2.10 CC=1CC(NN1)c2ccccc2 Amb24069512 [0,0,0,1,0,0|3,0,0]=4 974 B13R2.10 CC=1CNC(C1)c2ccccc2 Amb24727039 [0,0,0,1,0,0|3,0,0]=4 975 B13R2.10 CC=1COC(C1)c2ccccc2 Amb25174191 [0,0,0,1,0,0|3,0,0]=4 976 B13R2.10 CC=1CP(CC1)c2ccccc2 Amb22734694 [0,0,0,1,0,0|3,0,0]=4 977 B13R2.10 CC=1NC(CN1)c2c[n]ccc2 Amb24085204 [0,0,0,1,0,0|3,0,0]=4 978 B13R2.10 CN1CCC(O1)c2ccccc2 Amb22304711 [0,0,0,1,0,0|2,0,1]=4 979 B13R2.10 C[C@@H]1CC[C@H](N1)c2ccccc2 Amb24627148 [0,0,0,1,0,0|2,0,1]=4 980 B13R2.10 C[C@H]1CC[C@H](N1)c2ccccc2 Amb24519292 [0,0,0,1,0,0|2,0,1]=4 981 B13R2.10 C[C@H]1NC[C@H](S1)c2ccccc2 Amb25327843 [0,0,0,1,0,0|1,1,1]=4 982 B13R2.10 Cc1occ(n1)c2ccccc2 Amb17400054 [0,0,0,1,0,0|1,0,2]=4 983 B13R2.10 Cc1onc(c1)c2ccccc2 Amb10553849 [0,0,0,1,0,0|2,0,1]=4 984 B13R2.10 ClC=1CC(ON1)c2ccccc2 Amb24450060 [0,0,0,1,0,0|3,0,0]=4 985 B13R2.10 N=C1CC(CN1)c2ccccc2 Amb25363924 [0,0,0,1,0,0|2,0,0]=3 986 B13R2.10 N=C1N[C@H](CO1)c2ccccc2 Amb25326051 [0,0,0,1,0,0|2,0,0]=3 987 B13R2.10 NC1=NC(CO1)c2ccccc2 Amb17619912 [0,0,0,1,0,0|2,0,0]=3 988 B13R2.10 NC1=NCC(O1)c2ccccc2 Amb17608294 [0,0,0,1,0,0|2,0,1]=4 989 B13R2.10 NC1=NCC(S1)c2ccccc2 Amb25060735 [0,0,0,1,0,0|2,1,0]=4 990 B13R2.10 NC1=NOC(C1)c2ccccc2 Amb17594037 [0,0,0,1,0,0|3,0,0]=4 991 B13R2.10 NC1CCC(C1)c2ccccc2 Amb17400101 [0,0,0,1,0,0|2,0,1]=4 992 B13R2.10 NC=1CCC(N1)c2ccccc2 Amb24391515 [0,0,0,1,0,0|3,0,0]=4 993 B13R2.10 O=C1C=C(CO1)c2ccccc2 Amb24633865 [0,0,0,1,0,0|0,0,2]=3 994 B13R2.10 O=C1C=CC(N1)c2ccccc2 Amb25311888 [0,0,0,1,0,0|2,0,1]=4 995 B13R2.10 O=C1C=CC(O1)c2ccccc2 Amb24090251 [0,0,0,1,0,0|2,0,1]=4 996 B13R2.10 O=C1C=[N+]([N-]O1)c2ccccc2 Amb21934019 [0,0,0,1,0,0|2,0,1]=4 997 B13R2.10 O=C1CC(=CN1)c2ccccc2 Amb24066196 [0,0,0,1,0,0|1,0,2]=4 998 B13R2.10 O=C1CC(=CO1)c2ccccc2 Amb25697090 [0,0,0,1,0,0|0,0,2]=3 999 B13R2.10 O=C1CC(=NO1)c2c[n]ccc2 Amb22496083 [0,0,0,1,0,0|2,0,1]=4 1000 B13R2.10 O=C1CC(CC1)c2c[n]c[n]c2 Amb25233832 [0,0,0,1,0,0|3,0,0]=4 1001 B13R2.10 O=C1CC(CC1)c2c[n]cc[n]2 Amb24413348 [0,0,0,1,0,0|3,0,0]=4 1002 B13R2.10 O=C1CC(CN1)c2[n]ccc[n]2 Amb24468209 [0,0,0,1,0,0|3,0,0]=4 1003 B13R2.10 O=C1CC(CN1)c2cc[n][n]c2 Amb25758810 [0,0,0,1,0,0|3,0,0]=4 1004 B13R2.10 O=C1CC(CN1)c2cc[n]c[n]2 Amb24341993 [0,0,0,1,0,0|3,0,0]=4 1005 B13R2.10 O=C1CCC(=C1)c2ccccc2 Amb10669546 [0,0,0,1,0,0|1,0,2]=4 1006 B13R2.10 O=C1CCC(C1)c2ccccc2 Amb17138497 [0,0,0,1,0,0|1,0,0]=2 1007 B13R2.10 O=C1CCC(C1)c2ccccn2 Amb17138526 [0,0,0,1,0,0|2,0,0]=3 1008 B13R2.10 O=C1CCC(C1)c2cccnc2 Amb17138527 [0,0,0,1,0,0|2,0,0]=3 1009 B13R2.10 O=C1CCC(C1)c2ccncc2 Amb17138528 [0,0,0,1,0,0|2,0,0]=3 1010 B13R2.10 O=C1CCC(N1)c2cccc[n]2 Amb25237487 [0,0,0,1,0,0|3,0,0]=4 1011 B13R2.10 O=C1CCC(N1)c2ccccc2 Amb17470413 [0,0,0,1,0,0|2,0,0]=3 1012 B13R2.10 O=C1CCC(N1)c2cccnc2 Amb17618670 [0,0,0,1,0,0|3,0,0]=4 1013 B13R2.10 O=C1CCC(O1)c2cccnc2 Amb17619714 [0,0,0,1,0,0|3,0,0]=4 1014 B13R2.10 O=C1CC[C@@H](N1)c2ccc[n]c2 Amb25233097 [0,0,0,1,0,0|3,0,0]=4 1015 B13R2.10 O=C1CN(C=N1)c2ccccc2 Amb24064867 [0,0,0,1,0,0|2,0,1]=4 1016 B13R2.10 O=C1CN(CC1)c2cc[n]cc2 Amb23449311 [0,0,0,1,0,0|3,0,0]=4 1017 B13R2.10 O=C1CN(CN1)c2ccccc2 Amb24079614 [0,0,0,1,0,0|2,0,0]=3 1018 B13R2.10 O=C1CN(NO1)c2ccccc2 Amb25736264 [0,0,0,1,0,0|2,0,0]=3 1019 B13R2.10 O=C1CNC(C1)c2ccccc2 Amb23437185 [0,0,0,1,0,0|2,0,0]=3 1020 B13R2.10 O=C1CNC(N1)c2ccccc2 Amb24342220 [0,0,0,1,0,0|3,0,0]=4 1021 B13R2.10 O=C1COC(C1)c2ccccc2 Amb25830079 [0,0,0,1,0,0|2,0,0]=3 1022 B13R2.10 O=C1COC(N1)c2ccccc2 Amb25766459 [0,0,0,1,0,0|3,0,0]=4 1023 B13R2.10 O=C1CO[C@@H](N1)c2ccccc2 Amb24366993 [0,0,0,1,0,0|3,0,0]=4 1024 B13R2.10 O=C1CSC(C1)c2ccccc2 Amb25702041 [0,0,0,1,0,0|2,0,0]=3 1025 B13R2.10 O=C1CSC(N1)c2ccccc2 Amb2221753 [0,0,0,1,0,0|3,0,0]=4 1026 B13R2.10 O=C1CSC(O1)c2ccccc2 Amb25793869 [0,0,0,1,0,0|3,0,0]=4 1027 B13R2.10 O=C1C[C@@H](CC1)c2ccccc2 Amb24323281 [0,0,0,1,0,0|1,0,0]=2 1028 B13R2.10 O=C1C[C@@H](CN1)c2ccccc2 Amb23401452 [0,0,0,1,0,0|1,0,0]=2 1029 B13R2.10 O=C1C[C@H](CC1)c2ccccc2 Amb24484347 [0,0,0,1,0,0|1,0,0]=2 1030 B13R2.10 O=C1C[C@H](CN1)c2ccccc2 Amb25277165 [0,0,0,1,0,0|1,0,0]=2 1031 B13R2.10 O=C1NC(=NO1)c2ccccc2 Amb18788105 [0,0,0,1,0,0|2,0,1]=4 1032 B13R2.10 O=C1NC(CO1)c2c[n]c[n]c2 Amb24609227 [0,0,0,1,0,0|3,0,0]=4 1033 B13R2.10 O=C1NC(CS1)c2ccccc2 Amb23439132 [0,0,0,1,0,0|1,1,0]=3 1034 B13R2.10 O=C1NCC(C1)c2ccccc2 Amb1772919 [0,0,0,1,0,0|1,0,0]=2 1035 B13R2.10 O=C1NCC(C1)c2ccccn2 Amb13952281 [0,0,0,1,0,0|2,0,0]=3 1036 B13R2.10 O=C1NCC(C1)c2cccnc2 Amb13783612 [0,0,0,1,0,0|2,0,0]=3 1037 B13R2.10 O=C1NCC(C1)c2ccncc2 Amb17400108 [0,0,0,1,0,0|2,0,0]=3 1038 B13R2.10 O=C1NCC(N1)c2c[n]ccc2 Amb24346599 [0,0,0,1,0,0|3,0,0]=4 1039 B13R2.10 O=C1NCC(N1)c2cccc[n]2 Amb25331915 [0,0,0,1,0,0|3,0,0]=4 1040 B13R2.10 O=C1NCC(N1)c2ccccc2 Amb22056050 [0,0,0,1,0,0|2,0,0]=3 1041 B13R2.10 O=C1NCC(O1)c2cc[n]cc2 Amb18639408 [0,0,0,1,0,0|3,0,0]=4 1042 B13R2.10 O=C1NCC(O1)c2cccc[n]2 Amb18639394 [0,0,0,1,0,0|3,0,0]=4 1043 B13R2.10 O=C1NCC(O1)c2ccccc2 Amb16232576 [0,0,0,1,0,0|2,0,0]=3 1044 B13R2.10 O=C1NCC(O1)c2cccnc2 Amb17232462 [0,0,0,1,0,0|3,0,0]=4 1045 B13R2.10 O=C1NC[C@@H](N1)c2cccc[n]2 Amb24730704 [0,0,0,1,0,0|3,0,0]=4 1046 B13R2.10 O=C1NC[C@@H](N1)c2ccccc2 Amb24568910 [0,0,0,1,0,0|2,0,0]=3 1047 B13R2.10 O=C1NC[C@@H](O1)c2ccccc2 Amb22338660 [0,0,0,1,0,0|2,0,0]=3 1048 B13R2.10 O=C1NC[C@H](N1)c2c[n]ccc2 Amb25251578 [0,0,0,1,0,0|3,0,0]=4 1049 B13R2.10 O=C1NC[C@H](N1)c2cccc[n]2 Amb24492823 [0,0,0,1,0,0|3,0,0]=4 1050 B13R2.10 O=C1NC[C@H](N1)c2ccccc2 Amb25054081 [0,0,0,1,0,0|2,0,0]=3 1051 B13R2.10 O=C1NC[C@H](O1)c2ccccc2 Amb24574681 [0,0,0,1,0,0|2,0,0]=3 1052 B13R2.10 O=C1NC[C@H](S1)c2ccccc2 Amb25246623 [0,0,0,1,0,0|2,0,0]=3 1053 B13R2.10 O=C1N[C@@H](CO1)c2cc[n]cc2 Amb24731875 [0,0,0,1,0,0|2,0,0]=3 1054 B13R2.10 O=C1N[C@@H](CS1)c2ccccc2 Amb24653499 [0,0,0,1,0,0|1,1,0]=3 1055 B13R2.10 O=C1N[C@H](CO1)c2ccc[n]c2 Amb25159332 [0,0,0,1,0,0|2,0,0]=3 1056 B13R2.10 O=C1ON=C(C1)c2ccncc2 Amb2405318 [0,0,0,1,0,0|2,0,1]=4 1057 B13R2.10 O=C1SSC(C1)c2ccccc2 Amb16757360 [0,0,0,1,0,0|1,1,0]=3 1058 B13R2.10 O=C1[CH-][N+](=NO1)c2ccccc2 Amb20659866 [0,0,0,1,0,0|2,0,1]=4 1059 B13R2.10 O=c1cc([nH]o1)-c2ccccc2 Amb24062192 [0,0,0,1,0,0|1,0,2]=4 1060 B13R2.10 OC1CC(CO1)c2ccccc2 Amb22752509 [0,0,0,1,0,0|0,0,2]=3 1061 B13R2.10 OC1CCC(C1)c2ccccc2 Amb17400115 [0,0,0,1,0,0|1,0,2]=4 1062 B13R2.10 OC1C[C@H](CO1)c2ccccc2 Amb25712077 [0,0,0,1,0,0|0,0,2]=3 1063 B13R2.10 OC=1CC(CN1)c2ccccc2 Amb19866679 [0,0,0,1,0,0|1,0,1]=3 1064 B13R2.10 S=C1NC(CS1)c2ccccc2 Amb24101079 [0,0,0,1,0,0|1,2,0]=4 1065 B13R2.10 S=C1NCC(S1)c2ccccc2 Amb10810186 [0,0,0,1,0,0|2,1,0]=4 1066 B13R2.10 S=C1NC[C@@H](O1)c2ccccc2 Amb24728461 [0,0,0,1,0,0|2,0,1]=4 1067 B13R2.10 S=C1NC[C@H](S1)c2ccccc2 Amb25150880 [0,0,0,1,0,0|2,1,0]=4 1068 B13R2.17 ClC1CC1CCc2ccccc2 Amb25737816 [0,0,0,1,0,0|2,0,1]=4 1069 B13R2.17 Cl[C@@H]1C[C@@H]1CCc2ccccc2 Amb24617348 [0,0,0,1,0,0|2,0,1]=4 1070 B13R2.17 Cl[C@@H]1C[C@H]1CCc2ccccc2 Amb24745759 [0,0,0,1,0,0|2,0,1]=4 1071 B13R2.17 NC1CC1CCc2ccccc2 Amb25106873 [0,0,0,1,0,0|2,0,1]=4 1072 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb23401475 [0,0,0,1,0,0|2,0,1]=4 1073 B13R2.31 O=C1CC(=C1)Nc2ccccc2 Amb24434908 [0,0,0,1,0,0|2,0,1]=4 1074 B13R2.31 O=C1CC(C1)Oc2ccccc2 Amb23439309 [0,0,0,1,0,0|2,0,0]=3 1075 B13R2.31 O=C1CC(Cc2ccccc2)C1 Amb23401474 [0,0,0,1,0,0|1,0,0]=2 1076 B13R2.31 O=C1CC(N1)Sc2cccc[n]2 Amb24401666 [0,0,0,1,0,0|3,0,0]=4 1077 B13R2.31 O=C1CN(C1)Cc2ccccc2 Amb10602421 [0,0,0,1,0,0|2,0,0]=3 1078 B13R2.31 O=C1C[C@@H](N1)Sc2ccccc2 Amb25119229 [0,0,0,1,0,0|2,0,0]=3 1079 B13R2.31 O=C1C[C@H](Cc2cccc[n]2)N1 Amb24497165 [0,0,0,1,0,0|2,0,0]=3 1080 B13R2.31 O=C1C[C@H](Cc2ccccc2)N1 Amb24757761 [0,0,0,1,0,0|1,0,0]=2 1081 B13R2.31 OC1CC(Cc2ccccc2)C1 Amb23401472 [0,0,0,1,0,0|1,0,2]=4 1082 B13R2.72 CC(=C)C1CNc2ccccc21 Amb25777880 [0,0,0,1,0,0|3,0,0]=4 1083 B13R2.72 CC(=O)C1C=Cc2ccccc21 Amb25735092 [0,0,0,1,0,0|1,0,2]=4 1084 B13R2.72 CC(=O)C1CCc2ccccc21 Amb24400099 [0,0,0,1,0,0|1,0,0]=2 1085 B13R2.72 CC(=O)C1CNc2ccccc21 Amb24393046 [0,0,0,1,0,0|2,0,0]=3 1086 B13R2.72 CC(=O)C1COc2ccccc21 Amb23586289 [0,0,0,1,0,0|2,0,0]=3 1087 B13R2.72 CC(=O)C1CSc2ccccc21 Amb24435646 [0,0,0,1,0,0|2,0,0]=3 1088 B13R2.72 CC(=O)N1CCc2c[n]ccc12 Amb25847503 [0,0,0,1,0,0|2,0,0]=3 1089 B13R2.72 CC(=O)N1CCc2cc[n]cc12 Amb23412123 [0,0,0,1,0,0|2,0,0]=3 1090 B13R2.72 CC(=O)[C@@H]1CCc2ccccc21 Amb25834379 [0,0,0,1,0,0|1,0,0]=2 1091 B13R2.72 CC(=O)[C@H]1CCc2ccccc21 Amb25756942 [0,0,0,1,0,0|1,0,0]=2 1092 B13R2.72 CC(=O)[n]1[n]cc2ccccc12 Amb22235128 [0,0,0,1,0,0|2,0,1]=4 1093 B13R2.72 CC(=O)c1[n]oc2ccccc21 Amb25723786 [0,0,0,1,0,0|3,0,0]=4 1094 B13R2.72 CC(=O)c1coc2ccccc12 Amb19887568 [0,0,0,1,0,0|2,0,1]=4 1095 B13R2.72 CC(=O)c1occ2ccccc21 Amb18199846 [0,0,0,1,0,0|2,0,1]=4 1096 B13R2.72 CC(C)N1CCc2ccccc12 Amb17689296 [0,0,0,1,0,0|2,0,1]=4 1097 B13R2.72 C[C@@H](N)C1CCc2ccccc21 Amb25259826 [0,0,0,1,0,0|2,0,1]=4 1098 B13R2.72 C[C@@H](O)C1CCc2ccccc21 Amb25077224 [0,0,0,1,0,0|1,0,2]=4 1099 B13R2.72 C[C@H](O)C1CCc2ccccc21 Amb25378827 [0,0,0,1,0,0|1,0,2]=4 1100 B13R2.72 NC(=N)C1CCc2ccccc21 Amb24484327 [0,0,0,1,0,0|3,0,0]=4 1101 B13R2.72 NC(=O)C1CCc2[n]cccc21 Amb24071419 [0,0,0,1,0,0|3,0,0]=4 1102 B13R2.72 NC(=O)C1CCc2ccc[n]c21 Amb24071778 [0,0,0,1,0,0|3,0,0]=4 1103 B13R2.72 NC(=O)C1CNc2ccccc21 Amb19320765 [0,0,0,1,0,0|3,0,0]=4 1104 B13R2.72 NC(=O)C1NCc2ccccc21 Amb25053931 [0,0,0,1,0,0|3,0,0]=4 1105 B13R2.72 NC(=O)N1CCc2c1cccc2 Amb1124478 [0,0,0,1,0,0|2,0,0]=3 1106 B13R2.72 NC(=O)N1CCc2cc[n]cc12 Amb25777686 [0,0,0,1,0,0|3,0,0]=4 1107 B13R2.72 NC(=S)N1CCc2c1cccc2 Amb1126630 [0,0,0,1,0,0|2,1,0]=4 1108 B13R2.72 O=C(Cl)C1=CCc2ccccc12 Amb24089074 [0,0,0,1,0,0|2,0,1]=4 1109 B13R2.72 O=C(Cl)C1CCc2ccccc21 Amb24397018 [0,0,0,1,0,0|2,0,0]=3 1110 B13R2.72 O=C(Cl)C1COc2ccccc21 Amb24436426 [0,0,0,1,0,0|3,0,0]=4 1111 B13R2.72 O=C(Cl)N1CCc2ccccc12 Amb20670451 [0,0,0,1,0,0|2,0,0]=3 1112 B13R2.72 OC(=O)C1CCc2c[n]ccc21 Amb25376359 [0,0,0,1,0,0|3,0,0]=4 1113 B13R2.72 OC(=O)C1CCc2ccc[n]c21 Amb22372226 [0,0,0,1,0,0|3,0,0]=4 1114 B13R2.72 OC(=O)C1CCc2ccccc21 Amb18538487 [0,0,0,1,0,0|2,0,0]=3 1115 B13R2.72 OC(=O)C1CNc2ccccc21 Amb22497686 [0,0,0,1,0,0|3,0,0]=4 1116 B13R2.72 OC(=O)C1COc2ccccc21 Amb19372915 [0,0,0,1,0,0|3,0,0]=4 1117 B13R2.72 OC(=O)C1CSc2ccccc21 Amb19335022 [0,0,0,1,0,0|3,0,0]=4 1118 B13R2.72 OC(=O)C1NCc2ccccc21 Amb22491461 [0,0,0,1,0,0|3,0,0]=4 1119 B13R2.72 OC(=O)C1OCc2ccccc21 Amb18829056 [0,0,0,1,0,0|3,0,0]=4 1120 B13R2.72 OC(=O)N1CSc2ccccc12 Amb24061895 [0,0,0,1,0,0|3,0,0]=4 1121 B13R2.72 OC(=O)[C@@H]1CCc2ccccc21 Amb24729539 [0,0,0,1,0,0|2,0,0]=3 1122 B13R2.72 OC(=O)[C@@H]1CNc2ccccc21 Amb25701751 [0,0,0,1,0,0|3,0,0]=4 1123 B13R2.72 OC(=O)[C@@H]1COc2ccccc21 Amb24539298 [0,0,0,1,0,0|3,0,0]=4 1124 B13R2.72 OC(=O)[C@@H]1NCc2ccccc21 Amb22748827 [0,0,0,1,0,0|3,0,0]=4 1125 B13R2.72 OC(=O)[C@H]1CCc2ccccc21 Amb24470066 [0,0,0,1,0,0|2,0,0]=3 1126 B13R2.72 OC(=O)[C@H]1CSc2ccccc21 Amb24701742 [0,0,0,1,0,0|3,0,0]=4 1127 B13R2.72 OC(=O)[C@H]1NCc2ccccc21 Amb25200954 [0,0,0,1,0,0|3,0,0]=4 1128 B13R2.72 [O-][N+](=O)N1CCc2ccccc12 Amb25781653 [0,0,0,1,0,0|3,0,0]=4 1129 B13R2.163 BrC=1CCCc2ccccc2C1 Amb25244811 [0,0,0,1,0,0|2,0,1]=4 1130 B13R2.163 CN1CCCc2c(C1)cccc2 Amb10572356 [0,0,0,1,0,0|3,0,0]=4 1131 B13R2.163 C[C@@H]1Cc2ccccc2CCN1 Amb24456422 [0,0,0,1,0,0|2,0,1]=4 1132 B13R2.163 NC1Cc2ccccc2CCC1 Amb24355951 [0,0,0,1,0,0|2,0,1]=4 1133 B13R2.163 NC1Cc2ccccc2CCN1 Amb22263645 [0,0,0,1,0,0|2,0,1]=4 1134 B13R2.163 NC=1Cc2ccccc2CCN1 Amb22263623 [0,0,0,1,0,0|2,0,0]=3 1135 B13R2.163 N[C@H]1Cc2ccccc2CCC1 Amb25151132 [0,0,0,1,0,0|2,0,1]=4 1136 B13R2.163 O=C1C=CCc2ccccc2N1 Amb24399245 [0,0,0,1,0,0|2,0,1]=4 1137 B13R2.163 O=C1CCCc2c(N1)cccc2 Amb1077569 [0,0,0,1,0,0|2,0,0]=3 1138 B13R2.163 O=C1CCCc2ccc[n]c2N1 Amb21962431 [0,0,0,1,0,0|3,0,0]=4 1139 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [0,0,0,1,0,0|2,0,0]=3 1140 B13R2.163 O=C1CCNc2c(N1)cccc2 Amb1666975 [0,0,0,1,0,0|3,0,0]=4 1141 B13R2.163 O=C1CCNc2ccccc2N1 Amb21857722 [0,0,0,1,0,0|3,0,0]=4 1142 B13R2.163 O=C1CCOc2c(N1)cccc2 Amb10608982 [0,0,0,1,0,0|3,0,0]=4 1143 B13R2.163 O=C1CCSc2c(N1)cccc2 Amb1154582 [0,0,0,1,0,0|3,0,0]=4 1144 B13R2.163 O=C1CNCc2c(N1)cccc2 Amb17606145 [0,0,0,1,0,0|3,0,0]=4 1145 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [0,0,0,1,0,0|3,0,0]=4 1146 B13R2.163 O=C1Cc2cc[n]cc2CCC1 Amb25730512 [0,0,0,1,0,0|2,0,0]=3 1147 B13R2.163 O=C1Cc2ccc[n]c2CCC1 Amb25097103 [0,0,0,1,0,0|2,0,0]=3 1148 B13R2.163 O=C1Cc2ccccc2NCC1 Amb18829955 [0,0,0,1,0,0|2,0,0]=3 1149 B13R2.163 O=C1Cc2ccccc2OCC1 Amb24352115 [0,0,0,1,0,0|2,0,0]=3 1150 B13R2.163 O=C1NCCc2c(C1)cccc2 Amb16203437 [0,0,0,1,0,0|1,0,0]=2 1151 B13R2.163 O=C1Nc2ccccc2CCO1 Amb24495939 [0,0,0,1,0,0|1,0,0]=2 1152 B13R2.163 O=C1Oc2ccccc2N=CO1 Amb24376626 [0,0,0,1,0,0|2,0,1]=4 1153 B13R2.163 S=C1Cc2ccccc2CCN1 Amb25826588 [0,0,0,1,0,0|1,1,0]=3 1154 B13R2.219 O=S1(=O)CCC1c2ccccc2 Amb24496772 [0,0,0,1,0,0|3,0,0]=4 1155 B13R2.423 CC(=O)C1OC1c2ccccc2 Amb17594030 [0,0,0,1,0,0|2,0,0]=3 1156 B13R2.423 CC(=O)[C@@H]1CC1c2ccccc2 Amb25759554 [0,0,0,1,0,0|1,0,0]=2 1157 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,0,0,1,0,0|1,0,0]=2 1158 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2cc[n]cc2 Amb25375191 [0,0,0,1,0,0|3,0,0]=4 1159 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [0,0,0,1,0,0|2,0,0]=3 1160 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,0,0,1,0,0|1,0,0]=2 1161 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2cc[n]cc2 Amb25174919 [0,0,0,1,0,0|3,0,0]=4 1162 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccc[n]c2 Amb24649931 [0,0,0,1,0,0|3,0,0]=4 1163 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [0,0,0,1,0,0|2,0,0]=3 1164 B13R2.423 CC(C)C1CC1c2ccccc2 Amb24070198 [0,0,0,1,0,0|2,0,1]=4 1165 B13R2.423 CC(C)[C@@H]1C[C@H]1c2ccccc2 Amb25253110 [0,0,0,1,0,0|2,0,1]=4 1166 B13R2.423 CC(C)[C@H]1C[C@H]1c2ccccc2 Amb24068901 [0,0,0,1,0,0|2,0,1]=4 1167 B13R2.423 CC(C1CC1c2ccccc2)N Amb10610180 [0,0,0,1,0,0|2,0,1]=4 1168 B13R2.423 CC(C1CC1c2ccccc2)O Amb17605479 [0,0,0,1,0,0|1,0,2]=4 1169 B13R2.423 CC(O)[C@@H]1C[C@@H]1c2ccccc2 Amb25306520 [0,0,0,1,0,0|1,0,2]=4 1170 B13R2.423 C[C@H](O)[C@@H]1C[C@@H]1c2ccccc2 Amb24520371 [0,0,0,1,0,0|1,0,2]=4 1171 B13R2.423 C[C@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb24583667 [0,0,0,1,0,0|1,0,2]=4 1172 B13R2.423 NC(=N)C1CC1c2ccccc2 Amb25242569 [0,0,0,1,0,0|3,0,0]=4 1173 B13R2.423 NC(=O)C1CC1c2ccc[n]c2 Amb25701875 [0,0,0,1,0,0|3,0,0]=4 1174 B13R2.423 NC(=O)C1CC1c2ccccc2 Amb24709280 [0,0,0,1,0,0|2,0,0]=3 1175 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2cc[n]cc2 Amb24678885 [0,0,0,1,0,0|3,0,0]=4 1176 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccc[n]c2 Amb24709317 [0,0,0,1,0,0|3,0,0]=4 1177 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25294667 [0,0,0,1,0,0|3,0,0]=4 1178 B13R2.423 NC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24519129 [0,0,0,1,0,0|3,0,0]=4 1179 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2cc[n]cc2 Amb24724910 [0,0,0,1,0,0|3,0,0]=4 1180 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb25227794 [0,0,0,1,0,0|2,0,0]=3 1181 B13R2.423 NC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24512021 [0,0,0,1,0,0|2,0,0]=3 1182 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,0,0,1,0,0|2,0,0]=3 1183 B13R2.423 O=C(Cl)C1C[C@H]1c2ccccc2 Amb25835857 [0,0,0,1,0,0|2,0,0]=3 1184 B13R2.423 O=C(Cl)C1OC1c2ccccc2 Amb25275213 [0,0,0,1,0,0|3,0,0]=4 1185 B13R2.423 O=C(Cl)[C@@H]1O[C@H]1c2ccccc2 Amb25205379 [0,0,0,1,0,0|3,0,0]=4 1186 B13R2.423 O=C(Cl)[C@H]1C[C@H]1c2ccccc2 Amb24654857 [0,0,0,1,0,0|2,0,0]=3 1187 B13R2.423 O=C(Cl)[C@H]1O[C@H]1c2ccccc2 Amb24621250 [0,0,0,1,0,0|3,0,0]=4 1188 B13R2.423 OC(=O)C1CC1c2cc[n]cc2 Amb19514911 [0,0,0,1,0,0|3,0,0]=4 1189 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2cccc[n]2 Amb25209805 [0,0,0,1,0,0|3,0,0]=4 1190 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,0,0,1,0,0|2,0,0]=3 1191 B13R2.423 OC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25299768 [0,0,0,1,0,0|3,0,0]=4 1192 B13R2.423 OC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb25216955 [0,0,0,1,0,0|3,0,0]=4 1193 B13R2.423 OC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24080018 [0,0,0,1,0,0|3,0,0]=4 1194 B13R2.423 OC(=O)[C@@H]1S[C@H]1c2ccccc2 Amb25286929 [0,0,0,1,0,0|3,0,0]=4 1195 B13R2.423 OC(=O)[C@H]1CC1c2cc[n]cc2 Amb24685293 [0,0,0,1,0,0|3,0,0]=4 1196 B13R2.423 OC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,0,0,1,0,0|2,0,0]=3 1197 B13R2.423 OC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,0,0,1,0,0|2,0,0]=3 1198 B13R2.423 OC(=O)[C@H]1O[C@H]1c2ccccc2 Amb24519473 [0,0,0,1,0,0|3,0,0]=4 1199 B13R2.423 OS(=O)C1CC1c2ccccc2 Amb24747050 [0,0,0,1,0,0|3,0,0]=4 1200 B13R2.2382 C(Cc1ccccc1)NC2CC2 Amb1130653 [0,0,0,1,0,0|2,0,1]=4 1201 B13R2.2382 C(Cc1ccccc1)NC2CC2 Amb2119838 [0,0,0,1,0,0|2,0,1]=4 1202 B13R2.3122 CC1(C)CCCc2ccccc12 Amb25328610 [0,0,0,1,0,0|2,0,1]=4 1203 B13R2.3122 CC1(C)NCCc2ccccc12 Amb18645550 [0,0,0,1,0,0|2,0,1]=4 1204 B13R2.3122 CC1(C)OCNc2ccccc12 Amb25690942 [0,0,0,1,0,0|2,0,1]=4 1205 B13R2.3122 CC1(N)CCCc2c1cccc2 Amb13952456 [0,0,0,1,0,0|2,0,1]=4 1206 B13R2.5881 CC(=O)CC1Cc2ccccc21 Amb25129209 [0,0,0,1,0,0|1,0,0]=2 1207 B13R2.5881 CC(=O)NC1Cc2ccccc12 Amb17778879 [0,0,0,1,0,0|1,0,0]=2 1208 B13R2.5881 CC(=O)OC1Cc2ccccc12 Amb17778687 [0,0,0,1,0,0|0,0,0]=1 1209 B13R2.5881 CC(=O)\C=C\1/Cc2ccccc21 Amb21948332 [0,0,0,1,0,0|1,0,1]=3 1210 B13R2.5881 CC(C)NC1Cc2ccccc21 Amb24749344 [0,0,0,1,0,0|2,0,1]=4 1211 B13R2.5881 CC(Cl)CC1Cc2ccccc21 Amb24570076 [0,0,0,1,0,0|2,0,1]=4 1212 B13R2.5881 CC(N)CC1Cc2ccccc21 Amb24738028 [0,0,0,1,0,0|2,0,1]=4 1213 B13R2.5881 CN(C)CC1Cc2ccccc21 Amb22446492 [0,0,0,1,0,0|3,0,0]=4 1214 B13R2.5881 NC(=N)CC1Cc2ccccc21 Amb25150145 [0,0,0,1,0,0|3,0,0]=4 1215 B13R2.5881 OC(=O)CC1Cc2ccccc21 Amb25279494 [0,0,0,1,0,0|2,0,0]=3 1216 B11R1.91 C=C(Br)CSc1ccccc1 Amb24458275 [0,0,0,0,1,0|2,0,1]=4 1217 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,0,0,0,1,0|2,0,1]=4 1218 B11R1.91 CC(=C)CNc1cc[n]cc1 Amb24740371 [0,0,0,0,1,0|3,0,0]=4 1219 B11R1.91 CC(=C)CNc1cccc[n]1 Amb24486042 [0,0,0,0,1,0|3,0,0]=4 1220 B11R1.91 CC(=C)COc1cc[n]cc1 Amb24690034 [0,0,0,0,1,0|3,0,0]=4 1221 B11R1.91 CC(=C)COc1cccc[n]1 Amb25084698 [0,0,0,0,1,0|3,0,0]=4 1222 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [0,0,0,0,1,0|2,0,0]=3 1223 B11R1.91 CC(=C)CSc1cc[n]cc1 Amb25260223 [0,0,0,0,1,0|3,0,0]=4 1224 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [0,0,0,0,1,0|1,0,0]=2 1225 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [0,0,0,0,1,0|1,0,2]=4 1226 B11R1.91 CC(=N)NCc1cccc[n]1 Amb25798703 [0,0,0,0,1,0|3,0,0]=4 1227 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,0,0,0,1,0|2,0,0]=3 1228 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,0,0,0,1,0|1,1,0]=3 1229 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [0,0,0,0,1,0|2,0,0]=3 1230 B11R1.91 CC(=O)C=Cc1ccc[nH+]c1 Amb24099599 [0,0,0,0,1,0|1,0,2]=4 1231 B11R1.91 CC(=O)CCN1CC=CC=C1 Amb24676819 [0,0,0,0,1,0|1,0,1]=3 1232 B11R1.91 CC(=O)CCc1[n]ccc[n]1 Amb24726140 [0,0,0,0,1,0|2,0,0]=3 1233 B11R1.91 CC(=O)CCc1c[n]cc[n]1 Amb25307907 [0,0,0,0,1,0|2,0,0]=3 1234 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,0,0,0,1,0|1,0,0]=2 1235 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,0,0,0,1,0|1,0,0]=2 1236 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,0,0,0,1,0|1,0,0]=2 1237 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,0,0,0,1,0|1,0,0]=2 1238 B11R1.91 CC(=O)CSc1cc[n]c[n]1 Amb24477647 [0,0,0,0,1,0|3,0,0]=4 1239 B11R1.91 CC(=O)CSc1cc[n]cc1 Amb25344740 [0,0,0,0,1,0|2,0,0]=3 1240 B11R1.91 CC(=O)CSc1ccc[n][n]1 Amb24371884 [0,0,0,0,1,0|3,0,0]=4 1241 B11R1.91 CC(=O)NCc1[n]ccc[n]1 Amb24704246 [0,0,0,0,1,0|3,0,0]=4 1242 B11R1.91 CC(=O)NCc1c[n]c[n]c1 Amb22727960 [0,0,0,0,1,0|3,0,0]=4 1243 B11R1.91 CC(=O)NCc1c[n]cc[n]1 Amb25311243 [0,0,0,0,1,0|3,0,0]=4 1244 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,0,0,0,1,0|1,0,0]=2 1245 B11R1.91 CC(=O)NNc1c[n]ccc1 Amb25272223 [0,0,0,0,1,0|3,0,0]=4 1246 B11R1.91 CC(=O)NNc1cc[n]cc1 Amb24416297 [0,0,0,0,1,0|3,0,0]=4 1247 B11R1.91 CC(=O)NOc1ccccc1 Amb24104585 [0,0,0,0,1,0|2,0,0]=3 1248 B11R1.91 CC(=O)OCC1C=CCC=C1 Amb22365037 [0,0,0,0,1,0|0,0,2]=3 1249 B11R1.91 CC(=O)OCc1[n]ccc[n]1 Amb22756932 [0,0,0,0,1,0|2,0,0]=3 1250 B11R1.91 CC(=O)SCc1ccc[n]c1 Amb22274513 [0,0,0,0,1,0|1,1,0]=3 1251 B11R1.91 CC(=O)SCc1cccc[n]1 Amb22274512 [0,0,0,0,1,0|1,1,0]=3 1252 B11R1.91 CC(=O)SSc1ccccc1 Amb24370825 [0,0,0,0,1,0|1,1,0]=3 1253 B11R1.91 CC(=O)\C=C/c1cccc[n]1 Amb24532942 [0,0,0,0,1,0|1,0,2]=4 1254 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [0,0,0,0,1,0|0,0,2]=3 1255 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,0,0,0,1,0|0,0,2]=3 1256 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [0,0,0,0,1,0|1,0,2]=4 1257 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb17477757 [0,0,0,0,1,0|1,0,2]=4 1258 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb17477756 [0,0,0,0,1,0|1,0,2]=4 1259 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [0,0,0,0,1,0|1,0,1]=3 1260 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [0,0,0,0,1,0|2,0,0]=3 1261 B11R1.91 CC(=S)NCc1cccc[n]1 Amb24372089 [0,0,0,0,1,0|2,1,0]=4 1262 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,0,0,0,1,0|1,1,0]=3 1263 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [0,0,0,0,1,0|0,1,0]=2 1264 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [0,0,0,0,1,0|2,0,1]=4 1265 B11R1.91 CC(C)=CNc1ccccc1 Amb24715634 [0,0,0,0,1,0|2,0,1]=4 1266 B11R1.91 CC(C)=NNc1ccccc1 Amb20240635 [0,0,0,0,1,0|3,0,0]=4 1267 B11R1.91 CC(C)OCc1cc[n]cc1 Amb24649842 [0,0,0,0,1,0|2,0,1]=4 1268 B11R1.91 CC(C)OCc1cccc[n]1 Amb24485831 [0,0,0,0,1,0|2,0,1]=4 1269 B11R1.91 CC(CCc1ccccn1)N Amb17507327 [0,0,0,0,1,0|2,0,1]=4 1270 B11R1.91 CC(CCc1ccccn1)O Amb17507263 [0,0,0,0,1,0|1,0,2]=4 1271 B11R1.91 CC(CCc1cccnc1)N Amb17507328 [0,0,0,0,1,0|2,0,1]=4 1272 B11R1.91 CC(CCc1cccnc1)O Amb17507264 [0,0,0,0,1,0|1,0,2]=4 1273 B11R1.91 CC(CCc1ccncc1)N Amb17507329 [0,0,0,0,1,0|2,0,1]=4 1274 B11R1.91 CC(CCc1ccncc1)O Amb17507265 [0,0,0,0,1,0|1,0,2]=4 1275 B11R1.91 CC(COc1ccccc1)N Amb10609380 [0,0,0,0,1,0|2,0,1]=4 1276 B11R1.91 CC(COc1ccccc1)N Amb1126967 [0,0,0,0,1,0|2,0,1]=4 1277 B11R1.91 CC(Cl)CCc1c[n]ccc1 Amb24486010 [0,0,0,0,1,0|2,0,1]=4 1278 B11R1.91 CC(Cl)CCc1cc[n]cc1 Amb24369393 [0,0,0,0,1,0|2,0,1]=4 1279 B11R1.91 CC(Cl)COc1ccccc1 Amb20248050 [0,0,0,0,1,0|2,0,1]=4 1280 B11R1.91 CC(Cl)CSc1ccccc1 Amb25361088 [0,0,0,0,1,0|2,0,1]=4 1281 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [0,0,0,0,1,0|2,0,1]=4 1282 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [0,0,0,0,1,0|2,0,1]=4 1283 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [0,0,0,0,1,0|2,0,1]=4 1284 B11R1.91 CC(N)OCc1cccc[n]1 Amb24432123 [0,0,0,0,1,0|2,0,1]=4 1285 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [0,0,0,0,1,0|2,0,1]=4 1286 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,0,0,0,1,0|1,0,2]=4 1287 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [0,0,0,0,1,0|0,0,2]=3 1288 B11R1.91 CC(S)CNc1ccccc1 Amb25701720 [0,0,0,0,1,0|1,1,1]=4 1289 B11R1.91 CN(C)CCc1cc[n]cc1 Amb24073816 [0,0,0,0,1,0|3,0,0]=4 1290 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [0,0,0,0,1,0|2,0,0]=3 1291 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [0,0,0,0,1,0|2,0,0]=3 1292 B11R1.91 CN(N)CCc1cccc[n]1 Amb25725193 [0,0,0,0,1,0|3,0,0]=4 1293 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,0,0,0,1,0|2,0,0]=3 1294 B11R1.91 CN(O)CCc1cc[n]cc1 Amb25684228 [0,0,0,0,1,0|2,0,1]=4 1295 B11R1.91 C[C@@H](COc1ccccc1)N Amb17232092 [0,0,0,0,1,0|2,0,1]=4 1296 B11R1.91 C[C@@H](N)CCc1cc[n]cc1 Amb24551017 [0,0,0,0,1,0|2,0,1]=4 1297 B11R1.91 C[C@@H](N)CCc1cccc[n]1 Amb25076768 [0,0,0,0,1,0|2,0,1]=4 1298 B11R1.91 C[C@@H](N)CNc1ccccc1 Amb24392348 [0,0,0,0,1,0|2,0,1]=4 1299 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [0,0,0,0,1,0|2,0,1]=4 1300 B11R1.91 C[C@@H](N)CSc1ccccc1 Amb24692771 [0,0,0,0,1,0|2,0,1]=4 1301 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,0,0,0,1,0|0,0,2]=3 1302 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [0,0,0,0,1,0|1,0,2]=4 1303 B11R1.91 C[C@H](N)CCc1cc[n]cc1 Amb24715801 [0,0,0,0,1,0|2,0,1]=4 1304 B11R1.91 C[C@H](N)CNc1ccccc1 Amb24423922 [0,0,0,0,1,0|2,0,1]=4 1305 B11R1.91 C[C@H](N)CSc1ccccc1 Amb24486596 [0,0,0,0,1,0|2,0,1]=4 1306 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,0,0,0,1,0|0,0,2]=3 1307 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [0,0,0,0,1,0|1,0,2]=4 1308 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [0,0,0,0,1,0|1,0,2]=4 1309 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [0,0,0,0,1,0|1,0,2]=4 1310 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [0,0,0,0,1,0|1,1,0]=3 1311 B11R1.91 C\C(=C\C[n+]1ccccc1)\Cl Amb2228412 [0,0,0,0,1,0|2,0,1]=4 1312 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [0,0,0,0,1,0|2,0,1]=4 1313 B11R1.91 C\C(\N)=N/Cc1c[n]ccc1 Amb24098048 [0,0,0,0,1,0|3,0,0]=4 1314 B11R1.91 C\C(\N)=N\Nc1ccccc1 Amb24417520 [0,0,0,0,1,0|3,0,0]=4 1315 B11R1.91 C\C(\N)=N\Oc1ccccc1 Amb25042875 [0,0,0,0,1,0|3,0,0]=4 1316 B11R1.91 ClP(Cl)OCc1ccccc1 Amb22054434 [0,0,0,0,1,0|3,0,0]=4 1317 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [0,0,0,0,1,0|2,1,0]=4 1318 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,0,0,0,1,0|2,1,0]=4 1319 B11R1.91 NC(=N)CCc1cccc[n]1 Amb22304703 [0,0,0,0,1,0|3,0,0]=4 1320 B11R1.91 NC(=N)CNc1ccccc1 Amb24426634 [0,0,0,0,1,0|3,0,0]=4 1321 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [0,0,0,0,1,0|3,0,0]=4 1322 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [0,0,0,0,1,0|3,0,0]=4 1323 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [0,0,0,0,1,0|2,1,0]=4 1324 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [0,0,0,0,1,0|3,0,0]=4 1325 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [0,0,0,0,1,0|3,0,0]=4 1326 B11R1.91 NC(=O)CCc1[n]ccc[n]1 Amb24355296 [0,0,0,0,1,0|3,0,0]=4 1327 B11R1.91 NC(=O)CCc1c[n]c[n]c1 Amb23571326 [0,0,0,0,1,0|3,0,0]=4 1328 B11R1.91 NC(=O)CCc1c[n]cc[n]1 Amb25321905 [0,0,0,0,1,0|3,0,0]=4 1329 B11R1.91 NC(=O)CCc1ccc[n][n]1 Amb25061349 [0,0,0,0,1,0|3,0,0]=4 1330 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,0,0,0,1,0|2,0,0]=3 1331 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,0,0,0,1,0|2,0,0]=3 1332 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [0,0,0,0,1,0|3,0,0]=4 1333 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,0,0,0,1,0|2,0,0]=3 1334 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [0,0,0,0,1,0|3,0,0]=4 1335 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [0,0,0,0,1,0|3,0,0]=4 1336 B11R1.91 NC(=O)NOc1ccccc1 Amb24726052 [0,0,0,0,1,0|3,0,0]=4 1337 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,0,0,0,1,0|1,1,0]=3 1338 B11R1.91 NC(=S)CCc1cccnc1 Amb17232623 [0,0,0,0,1,0|2,1,0]=4 1339 B11R1.91 NC(=S)CCc1ccncc1 Amb17400216 [0,0,0,0,1,0|2,1,0]=4 1340 B11R1.91 NC(=S)CNc1ccccc1 Amb17232624 [0,0,0,0,1,0|2,1,0]=4 1341 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,0,0,0,1,0|2,1,0]=4 1342 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,0,0,0,1,0|2,1,0]=4 1343 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [0,0,0,0,1,0|1,2,0]=4 1344 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,0,0,0,1,0|3,0,0]=4 1345 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [0,0,0,0,1,0|2,1,0]=4 1346 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,0,0,0,1,0|3,0,0]=4 1347 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [0,0,0,0,1,0|2,0,0]=3 1348 B11R1.91 O=C(Cl)CSc1cc[n]cc1 Amb22396542 [0,0,0,0,1,0|3,0,0]=4 1349 B11R1.91 O=C(Cl)CSc1cccc[n]1 Amb19650937 [0,0,0,0,1,0|3,0,0]=4 1350 B11R1.91 O=C(Cl)CSc1cccc[n]1 Amb21959947 [0,0,0,0,1,0|3,0,0]=4 1351 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [0,0,0,0,1,0|2,0,0]=3 1352 B11R1.91 O=C(Cl)OCc1cc[n]cc1 Amb24559531 [0,0,0,0,1,0|2,0,0]=3 1353 B11R1.91 O=C(Cl)OCc1ccc[n]c1 Amb25852784 [0,0,0,0,1,0|2,0,0]=3 1354 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [0,0,0,0,1,0|1,0,0]=2 1355 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [0,0,0,0,1,0|2,0,0]=3 1356 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [0,0,0,0,1,0|2,0,1]=4 1357 B11R1.91 OC(=O)CCc1c[n]c[n]c1 Amb18201449 [0,0,0,0,1,0|3,0,0]=4 1358 B11R1.91 OC(=O)CCc1cc[n][n]c1 Amb22499259 [0,0,0,0,1,0|3,0,0]=4 1359 B11R1.91 OC(=O)CCc1ccc[n][n]1 Amb23592184 [0,0,0,0,1,0|3,0,0]=4 1360 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [0,0,0,0,1,0|1,0,0]=2 1361 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [0,0,0,0,1,0|2,0,0]=3 1362 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [0,0,0,0,1,0|2,0,0]=3 1363 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [0,0,0,0,1,0|2,0,0]=3 1364 B11R1.91 OC(=O)CNc1cc[n]cc1 Amb21955325 [0,0,0,0,1,0|3,0,0]=4 1365 B11R1.91 OC(=O)CNc1ccc[n]c1 Amb22035240 [0,0,0,0,1,0|3,0,0]=4 1366 B11R1.91 OC(=O)CNc1cccc[nH+]1 Amb10564534 [0,0,0,0,1,0|3,0,0]=4 1367 B11R1.91 OC(=O)CNc1cccc[n]1 Amb22495404 [0,0,0,0,1,0|3,0,0]=4 1368 B11R1.91 OC(=O)CNc1cccnc1 Amb17593781 [0,0,0,0,1,0|3,0,0]=4 1369 B11R1.91 OC(=O)COc1c[n]ccc1 Amb22738612 [0,0,0,0,1,0|3,0,0]=4 1370 B11R1.91 OC(=O)COc1cc[n]cc1 Amb18125520 [0,0,0,0,1,0|3,0,0]=4 1371 B11R1.91 OC(=O)COc1ccc[nH+]c1 Amb22370885 [0,0,0,0,1,0|3,0,0]=4 1372 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [0,0,0,0,1,0|2,0,0]=3 1373 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [0,0,0,0,1,0|2,0,0]=3 1374 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [0,0,0,0,1,0|2,0,0]=3 1375 B11R1.91 OC(=O)CSc1cc[n]cc1 Amb24053001 [0,0,0,0,1,0|3,0,0]=4 1376 B11R1.91 OC(=O)CSc1ccc[n]c1 Amb24692785 [0,0,0,0,1,0|3,0,0]=4 1377 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [0,0,0,0,1,0|2,0,0]=3 1378 B11R1.91 OC(=O)CSc1ccccn1 Amb1130490 [0,0,0,0,1,0|3,0,0]=4 1379 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [0,0,0,0,1,0|2,0,0]=3 1380 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [0,0,0,0,1,0|1,0,0]=2 1381 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [0,0,0,0,1,0|1,0,2]=4 1382 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [0,0,0,0,1,0|2,0,1]=4 1383 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [0,0,0,0,1,0|1,0,2]=4 1384 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [0,0,0,0,1,0|3,0,0]=4 1385 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [0,0,0,0,1,0|3,0,0]=4 1386 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [0,0,0,0,1,0|1,0,0]=2 1387 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [0,0,0,0,1,0|1,1,0]=3 1388 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [0,0,0,0,1,0|1,1,0]=3 1389 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [0,0,0,0,1,0|1,1,0]=3 1390 B11R1.91 [O-]C(=O)C#Cc1ccccc1 Amb22753901 [0,0,0,0,1,0|1,0,2]=4 1391 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [0,0,0,0,1,0|1,0,0]=2 1392 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [0,0,0,0,1,0|2,0,0]=3 1393 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [0,0,0,0,1,0|2,0,0]=3 1394 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [0,0,0,0,1,0|2,0,0]=3 1395 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb1814995 [0,0,0,0,1,0|1,0,2]=4 1396 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb22360910 [0,0,0,0,1,0|1,0,2]=4 1397 B11R1.91 [O-]P(=O)OCc1ccccc1 Amb22461723 [0,0,0,0,1,0|2,0,0]=3 1398 B11R1.91 [O-]S(=O)NCc1ccccc1 Amb22641608 [0,0,0,0,1,0|3,0,0]=4 1399 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [0,0,0,0,1,0|2,0,0]=3 1400 B11R1.91 [O-][N+](=O)CCc1ccccn1 Amb17399924 [0,0,0,0,1,0|3,0,0]=4 1401 B11R1.91 [O-][N+](=O)CCc1cccnc1 Amb17399925 [0,0,0,0,1,0|3,0,0]=4 1402 B11R1.91 [O-][N+](=O)CCc1ccncc1 Amb17399926 [0,0,0,0,1,0|3,0,0]=4 1403 B11R1.91 [O-][N+](=O)CSc1ccccc1 Amb25689622 [0,0,0,0,1,0|3,0,0]=4 1404 B11R1.91 [O-][N+](=O)O[Hg]c1ccccc1 Amb22732287 [0,0,0,0,1,0|3,0,0]=4 1405 B11R1.172 CC(=N)NCCc1ccc[s]1 Amb25760789 [0,0,0,0,1,0|3,0,0]=4 1406 B11R1.172 CC(=N)NCCc1ccco1 Amb25807660 [0,0,0,0,1,0|3,0,0]=4 1407 B11R1.172 CC(=O)CCCc1c[n]c[s]1 Amb25379875 [0,0,0,0,1,0|3,0,0]=4 1408 B11R1.172 CC(=O)CCCc1ccco1 Amb17232099 [0,0,0,0,1,0|2,0,0]=3 1409 B11R1.172 CC(=O)CCCc1cccs1 Amb17232678 [0,0,0,0,1,0|2,0,0]=3 1410 B11R1.172 CC(=O)COCc1ccc[s]1 Amb18185636 [0,0,0,0,1,0|3,0,0]=4 1411 B11R1.172 CC(=O)COCc1ccco1 Amb18182896 [0,0,0,0,1,0|3,0,0]=4 1412 B11R1.172 CC(=O)NCC[n]1c[n]cc1 Amb24073044 [0,0,0,0,1,0|3,0,0]=4 1413 B11R1.172 CC(=O)NCC[n]1ccc[n]1 Amb23466811 [0,0,0,0,1,0|3,0,0]=4 1414 B11R1.172 CC(=O)NCCc1[n]cc[s]1 Amb24619343 [0,0,0,0,1,0|3,0,0]=4 1415 B11R1.172 CC(=O)NCCc1c[nH][n]c1 Amb25711896 [0,0,0,0,1,0|3,0,0]=4 1416 B11R1.172 CC(=O)NCCc1c[nH]cn1 Amb10567497 [0,0,0,0,1,0|3,0,0]=4 1417 B11R1.172 CC(=O)NCCc1cco[n]1 Amb25099237 [0,0,0,0,1,0|3,0,0]=4 1418 B11R1.172 CC(=O)NCCc1ccoc1 Amb22643451 [0,0,0,0,1,0|2,0,0]=3 1419 B11R1.172 CC(=O)NCCc1cscc1 Amb13821361 [0,0,0,0,1,0|2,0,0]=3 1420 B11R1.172 CC(=O)NCCn1cccc1 Amb2409180 [0,0,0,0,1,0|2,0,0]=3 1421 B11R1.172 CC(=O)OCC[n]1c[n]c[n]1 Amb24756185 [0,0,0,0,1,0|3,0,0]=4 1422 B11R1.172 CC(=O)OCC[n]1c[n]cc1 Amb24756184 [0,0,0,0,1,0|2,0,0]=3 1423 B11R1.172 CC(=O)OCC[n]1ccc[n]1 Amb24756183 [0,0,0,0,1,0|2,0,0]=3 1424 B11R1.172 CC(=O)OCC[n]1cccc1 Amb25383043 [0,0,0,0,1,0|1,0,0]=2 1425 B11R1.172 CC(=O)OCCc1[n]cc[s]1 Amb24756182 [0,0,0,0,1,0|2,0,0]=3 1426 B11R1.172 CC(=O)OCCc1c[nH][n][n]1 Amb24756178 [0,0,0,0,1,0|3,0,0]=4 1427 B11R1.172 CC(=O)OCCc1c[nH][n]c1 Amb24756181 [0,0,0,0,1,0|2,0,0]=3 1428 B11R1.172 CC(=O)OCCc1c[n]c[nH]1 Amb25385267 [0,0,0,0,1,0|2,0,0]=3 1429 B11R1.172 CC(=O)OCCc1cc[s]c1 Amb24756180 [0,0,0,0,1,0|1,0,0]=2 1430 B11R1.172 CC(=O)OCCc1ccc[s]1 Amb24756179 [0,0,0,0,1,0|1,0,0]=2 1431 B11R1.172 CC(=O)O\N=C\c1ccc[nH]1 Amb25377470 [0,0,0,0,1,0|2,0,1]=4 1432 B11R1.172 CC(=O)SCCc1c[nH]c[n]1 Amb25385268 [0,0,0,0,1,0|2,1,0]=4 1433 B11R1.172 CC(C)=CCCc1cocc1 Amb22584613 [0,0,0,0,1,0|3,0,0]=4 1434 B11R1.172 CC(C)OCC[n]1cccc1 Amb25380120 [0,0,0,0,1,0|2,0,1]=4 1435 B11R1.172 NC(=O)CCCn1cccc1 Amb13865744 [0,0,0,0,1,0|3,0,0]=4 1436 B11R1.172 NC(=O)NCC[n]1cccc1 Amb25729758 [0,0,0,0,1,0|3,0,0]=4 1437 B11R1.172 NC(=O)NCCc1cc[s]c1 Amb18183590 [0,0,0,0,1,0|3,0,0]=4 1438 B11R1.172 NC(=O)NCCc1ccco1 Amb18182898 [0,0,0,0,1,0|3,0,0]=4 1439 B11R1.172 NC(=O)NCCc1cccs1 Amb1089616 [0,0,0,0,1,0|3,0,0]=4 1440 B11R1.172 NC(=O)OCCc1[nH]cc[n]1 Amb24764779 [0,0,0,0,1,0|3,0,0]=4 1441 B11R1.172 OC(=O)CCCc1cc[nH]c1 Amb18065398 [0,0,0,0,1,0|3,0,0]=4 1442 B11R1.172 OC(=O)CCCc1cc[s]c1 Amb22000608 [0,0,0,0,1,0|3,0,0]=4 1443 B11R1.172 OC(=O)CCCc1ccco1 Amb18125675 [0,0,0,0,1,0|3,0,0]=4 1444 B11R1.172 OC(=O)CCCc1cccs1 Amb1152340 [0,0,0,0,1,0|3,0,0]=4 1445 B11R1.172 OC(=O)CCCc1ccoc1 Amb25385034 [0,0,0,0,1,0|3,0,0]=4 1446 B11R1.172 OC(=O)CCCn1cccc1 Amb1130872 [0,0,0,0,1,0|3,0,0]=4 1447 B11R1.172 OC(=O)OCCc1cc[nH]c1 Amb24070008 [0,0,0,0,1,0|2,0,0]=3 1448 B13R1.337 CC(=C)CONCc1ccccc1 Amb25229368 [0,0,0,0,0,1|2,0,0]=3 1449 B13R1.337 CC(=C)\C=C\CCc1ccccc1 Amb22546754 [0,0,0,0,0,1|2,0,0]=3 1450 B13R1.337 CC(=N)NC\C=C\c1ccccc1 Amb24366027 [0,0,0,0,0,1|2,0,1]=4 1451 B13R1.337 CC(=O)/C=C\NCc1ccccc1 Amb17778144 [0,0,0,0,0,1|1,0,1]=3 1452 B13R1.337 CC(=O)C#CC#Cc1ccccc1 Amb17594204 [0,0,0,0,0,1|1,0,2]=4 1453 B13R1.337 CC(=O)C#CCCc1ccccc1 Amb25759513 [0,0,0,0,0,1|1,0,0]=2 1454 B13R1.337 CC(=O)C#CCOc1ccccc1 Amb24491408 [0,0,0,0,0,1|1,0,1]=3 1455 B13R1.337 CC(=O)C#C\C=C\c1ccccc1 Amb10567237 [0,0,0,0,0,1|1,0,2]=4 1456 B13R1.337 CC(=O)C=CC=Cc1ccccc1 Amb24066241 [0,0,0,0,0,1|1,0,2]=4 1457 B13R1.337 CC(=O)CC#CCc1ccccc1 Amb24416732 [0,0,0,0,0,1|1,0,1]=3 1458 B13R1.337 CC(=O)CCC#Cc1ccccc1 Amb18802903 [0,0,0,0,0,1|1,0,1]=3 1459 B13R1.337 CC(=O)CCNCc1ccccc1 Amb23399608 [0,0,0,0,0,1|1,0,0]=2 1460 B13R1.337 CC(=O)CCOCc1ccccc1 Amb16233219 [0,0,0,0,0,1|1,0,0]=2 1461 B13R1.337 CC(=O)NCC#Cc1ccccc1 Amb25119168 [0,0,0,0,0,1|1,0,1]=3 1462 B13R1.337 CC(=O)NCCNc1c[n]c[n]c1 Amb18932964 [0,0,0,0,0,1|3,0,0]=4 1463 B13R1.337 CC(=O)NCCNc1cc[n]c[n]1 Amb18305879 [0,0,0,0,0,1|3,0,0]=4 1464 B13R1.337 CC(=O)NCCNc1ccc[n][n]1 Amb19023334 [0,0,0,0,0,1|3,0,0]=4 1465 B13R1.337 CC(=O)NCCNc1ccc[n]c1 Amb18270224 [0,0,0,0,0,1|2,0,0]=3 1466 B13R1.337 CC(=O)NCCNc1ccccc1 Amb18933018 [0,0,0,0,0,1|1,0,0]=2 1467 B13R1.337 CC(=O)NCCOc1ccccc1 Amb22524794 [0,0,0,0,0,1|1,0,0]=2 1468 B13R1.337 CC(=O)NCCOc1cccnc1 Amb16229587 [0,0,0,0,0,1|2,0,0]=3 1469 B13R1.337 CC(=O)NCCSc1cc[n]cc1 Amb24073078 [0,0,0,0,0,1|2,0,0]=3 1470 B13R1.337 CC(=O)NCCSc1ccccc1 Amb15740326 [0,0,0,0,0,1|1,0,0]=2 1471 B13R1.337 CC(=O)NCNCc1ccccc1 Amb24728285 [0,0,0,0,0,1|1,0,0]=2 1472 B13R1.337 CC(=O)NC\C=C\c1ccccc1 Amb24452225 [0,0,0,0,0,1|1,0,1]=3 1473 B13R1.337 CC(=O)OCCCc1ccc[n]c1 Amb24094205 [0,0,0,0,0,1|1,0,0]=2 1474 B13R1.337 CC(=O)OCCOc1ccccc1 Amb10560141 [0,0,0,0,0,1|0,0,0]=1 1475 B13R1.337 CC(=O)SCNCc1ccccc1 Amb25858716 [0,0,0,0,0,1|0,1,0]=2 1476 B13R1.337 CC(=O)\C=C/C=C/c1ccccc1 Amb25318843 [0,0,0,0,0,1|1,0,2]=4 1477 B13R1.337 CC(=O)\C=C\C#Cc1ccccc1 Amb17594260 [0,0,0,0,0,1|1,0,2]=4 1478 B13R1.337 CC(=O)\C=C\C=C/c1ccccc1 Amb24645444 [0,0,0,0,0,1|1,0,2]=4 1479 B13R1.337 CC(=O)\C=C\NCc1ccccc1 Amb25303594 [0,0,0,0,0,1|1,0,1]=3 1480 B13R1.337 CC(=O)\C=C\OCc1ccccc1 Amb25370872 [0,0,0,0,0,1|1,0,1]=3 1481 B13R1.337 CC(=O)\C=N\NCc1ccccc1 Amb25767927 [0,0,0,0,0,1|2,0,0]=3 1482 B13R1.337 CC(=O)\C=N\OCc1ccccc1 Amb25735259 [0,0,0,0,0,1|2,0,0]=3 1483 B13R1.337 CC(Br)CCOCc1ccccc1 Amb24490816 [0,0,0,0,0,1|2,0,1]=4 1484 B13R1.337 CC(C)=CCCNc1cc[n]cc1 Amb24354983 [0,0,0,0,0,1|3,0,0]=4 1485 B13R1.337 CC(C)=CCOCc1ccccc1 Amb25045065 [0,0,0,0,0,1|2,0,0]=3 1486 B13R1.337 CC(C)CCOCc1ccccc1 Amb22230283 [0,0,0,0,0,1|2,0,1]=4 1487 B13R1.337 CC(C)CONCc1ccccc1 Amb25717813 [0,0,0,0,0,1|2,0,1]=4 1488 B13R1.337 CC(C)NCCNc1ccccc1 Amb18180884 [0,0,0,0,0,1|2,0,1]=4 1489 B13R1.337 CC(CCNCc1ccccc1)C Amb2172437 [0,0,0,0,0,1|2,0,1]=4 1490 B13R1.337 CC(CNCCc1ccccc1)C Amb2119559 [0,0,0,0,0,1|2,0,1]=4 1491 B13R1.337 CC(CNCCc1ccccc1)O Amb2119395 [0,0,0,0,0,1|1,0,2]=4 1492 B13R1.337 CC(Cl)CCNCc1ccccc1 Amb24475425 [0,0,0,0,0,1|2,0,1]=4 1493 B13R1.337 CC(N)CCNCc1ccccc1 Amb18796072 [0,0,0,0,0,1|2,0,1]=4 1494 B13R1.337 CC(N)CCOCc1ccccc1 Amb18180974 [0,0,0,0,0,1|2,0,1]=4 1495 B13R1.337 CC(NCCCc1ccccc1)C Amb2097980 [0,0,0,0,0,1|2,0,1]=4 1496 B13R1.337 CC(NCCOc1ccccc1)C Amb13949173 [0,0,0,0,0,1|2,0,1]=4 1497 B13R1.337 CC(NCCSc1ccccc1)C Amb10608751 [0,0,0,0,0,1|2,0,1]=4 1498 B13R1.337 CC(O)CCNCc1ccccc1 Amb18128508 [0,0,0,0,0,1|1,0,2]=4 1499 B13R1.337 CC(O)CCOCc1ccccc1 Amb18809337 [0,0,0,0,0,1|1,0,2]=4 1500 B13R1.337 CC(SCCNc1ccccc1)C Amb17307514 [0,0,0,0,0,1|1,1,1]=4 1501 B13R1.337 CN(C)CCSCc1ccccc1 Amb21983729 [0,0,0,0,0,1|3,0,0]=4 1502 B13R1.337 CN(CCCNc1ccccc1)C Amb17233496 [0,0,0,0,0,1|3,0,0]=4 1503 B13R1.337 CN(N)CCOCc1ccccc1 Amb24522583 [0,0,0,0,0,1|3,0,0]=4 1504 B13R1.337 C[C@@H](O)CCNCc1ccccc1 Amb24652621 [0,0,0,0,0,1|1,0,2]=4 1505 B13R1.337 C[C@@H](O)CCOCc1ccccc1 Amb25788100 [0,0,0,0,0,1|1,0,2]=4 1506 B13R1.337 C[C@H](N)CCOCc1ccccc1 Amb25258106 [0,0,0,0,0,1|2,0,1]=4 1507 B13R1.337 C[C@H](O)CCNCc1ccccc1 Amb25833370 [0,0,0,0,0,1|1,0,2]=4 1508 B13R1.337 C\C(=C/CNCc1ccccc1)\Cl Amb1811425 [0,0,0,0,0,1|2,0,0]=3 1509 B13R1.337 C\C(\N)=N\CCNc1cc[n]cc1 Amb25086386 [0,0,0,0,0,1|3,0,0]=4 1510 B13R1.337 C\C(\N)=N\CCNc1cccc[n]1 Amb25144299 [0,0,0,0,0,1|3,0,0]=4 1511 B13R1.337 ClC(=O)CCCSc1ccccc1 Amb17143638 [0,0,0,0,0,1|2,0,0]=3 1512 B13R1.337 NC(=N)NCCNc1ccccc1 Amb25728941 [0,0,0,0,0,1|3,0,0]=4 1513 B13R1.337 NC(=N)SCCCc1ccccc1 Amb20676023 [0,0,0,0,0,1|2,1,0]=4 1514 B13R1.337 NC(=N)SCCOc1ccccc1 Amb20676015 [0,0,0,0,0,1|2,1,0]=4 1515 B13R1.337 NC(=N)SCOCc1ccccc1 Amb20093135 [0,0,0,0,0,1|2,1,0]=4 1516 B13R1.337 NC(=O)CCNCc1ccccc1 Amb1223227 [0,0,0,0,0,1|2,0,0]=3 1517 B13R1.337 NC(=O)CCOCc1ccccc1 Amb18796124 [0,0,0,0,0,1|2,0,0]=3 1518 B13R1.337 NC(=O)N/N=C/Cc1ccccc1 Amb17673737 [0,0,0,0,0,1|2,0,1]=4 1519 B13R1.337 NC(=O)NCCCc1ccccc1 Amb19514748 [0,0,0,0,0,1|2,0,0]=3 1520 B13R1.337 NC(=O)NCCNc1cc[n]cc1 Amb25768872 [0,0,0,0,0,1|3,0,0]=4 1521 B13R1.337 NC(=O)NC\C=C\c1ccccc1 Amb24407866 [0,0,0,0,0,1|2,0,1]=4 1522 B13R1.337 NC(=O)\C=N\OCc1ccccc1 Amb25729859 [0,0,0,0,0,1|3,0,0]=4 1523 B13R1.337 NC(=S)NCCOc1ccccc1 Amb17236450 [0,0,0,0,0,1|2,1,0]=4 1524 B13R1.337 OC(=O)C#CCCc1ccccc1 Amb25674935 [0,0,0,0,0,1|2,0,0]=3 1525 B13R1.337 OC(=O)CCCC[n+]1ccccc1 Amb17098179 [0,0,0,0,0,1|3,0,0]=4 1526 B13R1.337 OC(=O)CCCCc1ccc[n]c1 Amb18128434 [0,0,0,0,0,1|3,0,0]=4 1527 B13R1.337 OC(=O)CCCNc1ccccc1 Amb10189157 [0,0,0,0,0,1|2,0,0]=3 1528 B13R1.337 OC(=O)CCCOc1ccc[n]c1 Amb18809466 [0,0,0,0,0,1|3,0,0]=4 1529 B13R1.337 OC(=O)CCCOc1ccccc1 Amb1233059 [0,0,0,0,0,1|2,0,0]=3 1530 B13R1.337 OC(=O)CCCSc1cc[n]cc1 Amb24102888 [0,0,0,0,0,1|3,0,0]=4 1531 B13R1.337 OC(=O)CCCSc1ccccc1 Amb1105630 [0,0,0,0,0,1|2,0,0]=3 1532 B13R1.337 OC(=O)CCNCc1ccc[n]c1 Amb19373040 [0,0,0,0,0,1|3,0,0]=4 1533 B13R1.337 OC(=O)CCNCc1ccccc1 Amb1207218 [0,0,0,0,0,1|2,0,0]=3 1534 B13R1.337 OC(=O)CCNCc1ccccn1 Amb10187384 [0,0,0,0,0,1|3,0,0]=4 1535 B13R1.337 OC(=O)CCNCc1ccccn1 Amb1111102 [0,0,0,0,0,1|3,0,0]=4 1536 B13R1.337 OC(=O)CCNCc1cccnc1 Amb1110655 [0,0,0,0,0,1|3,0,0]=4 1537 B13R1.337 OC(=O)CCNCc1ccncc1 Amb10187385 [0,0,0,0,0,1|3,0,0]=4 1538 B13R1.337 OC(=O)CCNCc1ccncc1 Amb1109839 [0,0,0,0,0,1|3,0,0]=4 1539 B13R1.337 OC(=O)CCSCc1ccccc1 Amb1132307 [0,0,0,0,0,1|2,0,0]=3 1540 B13R1.337 OC(=O)CC\C=C\c1ccccc1 Amb17233184 [0,0,0,0,0,1|2,0,1]=4 1541 B13R1.337 OC(=O)CNCCc1ccccc1 Amb19373721 [0,0,0,0,0,1|2,0,0]=3 1542 B13R1.337 OC(=O)CNOCc1ccccc1 Amb18128832 [0,0,0,0,0,1|3,0,0]=4 1543 B13R1.337 OC(=O)CSCCc1ccccc1 Amb1244212 [0,0,0,0,0,1|1,1,0]=3 1544 B13R1.337 OC(=O)CSCCc1ccccn1 Amb1798760 [0,0,0,0,0,1|2,1,0]=4 1545 B13R1.337 OC(=O)\C=C\CCc1ccccc1 Amb17477496 [0,0,0,0,0,1|2,0,0]=3 1546 B13R1.337 OC(=O)\C=C\COc1ccccc1 Amb17233391 [0,0,0,0,0,1|2,0,1]=4 1547 B13R1.337 OC(=O)\C=C\SCc1ccccc1 Amb22448082 [0,0,0,0,0,1|2,0,1]=4 1548 B13R1.337 OC(=O)\C=N\OCc1ccccc1 Amb10976080 [0,0,0,0,0,1|3,0,0]=4 1549 B13R1.337 OP(=O)CCCCc1ccccc1 Amb24063702 [0,0,0,0,0,1|3,0,0]=4 1550 B13R1.337 OS(=O)OCNCc1ccccc1 Amb17595338 [0,0,0,0,0,1|2,0,0]=3 1551 B13R1.337 SC(=S)NCCNc1ccccc1 Amb25703643 [0,0,0,0,0,1|2,1,0]=4 1552 B13R1.337 [S-]C(=S)SCCOc1ccccc1 Amb22264560 [0,0,0,0,0,1|1,2,0]=4 1553 B10R0.71 CCCCC\C=C/C=CC=C Amb22336558 [1,0,1,0,0,0|1,0,1]=4 1554 B10R0.71 CCCCC\C=C\C=C/C=C Amb22546765 [1,0,1,0,0,0|1,0,1]=4 1555 B10R0.71 CCCCC\C=C\C=C\C=C Amb22730166 [1,0,1,0,0,0|1,0,1]=4 1556 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [2,0,0,0,0,0|2,0,0]=4 1557 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [2,0,0,0,0,0|2,0,0]=4 1558 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [2,0,0,0,0,0|1,0,1]=4 1559 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [2,0,0,0,0,0|1,0,1]=4 1560 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [2,0,0,0,0,0|1,0,1]=4 1561 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [2,0,0,0,0,0|1,0,1]=4 1562 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [2,0,0,0,0,0|1,0,1]=4 1563 B10R1.17 C=CNCc1ccccc1 Amb24505107 [2,0,0,0,0,0|1,0,1]=4 1564 B10R1.17 C=COCc1ccccc1 Amb17940722 [2,0,0,0,0,0|0,0,1]=3 1565 B10R1.17 C=NOCc1ccccc1 Amb24704253 [2,0,0,0,0,0|1,0,1]=4 1566 B10R1.17 CCCCc1ccccn1 Amb10574134 [2,0,0,0,0,0|1,0,1]=4 1567 B10R1.17 CCCCc1ccncc1 Amb10555008 [2,0,0,0,0,0|1,0,1]=4 1568 B10R1.17 CCCNc1ccccc1 Amb22284540 [2,0,0,0,0,0|1,0,1]=4 1569 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [2,0,0,0,0,0|2,0,0]=4 1570 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [2,0,0,0,0,0|2,0,0]=4 1571 B10R1.17 CNCCc1ccccc1 Amb1132990 [2,0,0,0,0,0|1,0,0]=3 1572 B10R1.17 CNCCc1ccccc1 Amb2119452 [2,0,0,0,0,0|1,0,0]=3 1573 B10R1.17 CNCCc1ccccn1 Amb1651624 [2,0,0,0,0,0|2,0,0]=4 1574 B10R1.17 CNCCc1cccnc1 Amb10068754 [2,0,0,0,0,0|2,0,0]=4 1575 B10R1.17 CNCCc1cccnc1 Amb10576212 [2,0,0,0,0,0|2,0,0]=4 1576 B10R1.17 CNCCc1cccnc1 Amb10576410 [2,0,0,0,0,0|2,0,0]=4 1577 B10R1.17 CNCCc1ccncc1 Amb10071184 [2,0,0,0,0,0|2,0,0]=4 1578 B10R1.17 CNNCc1ccccc1 Amb10553073 [2,0,0,0,0,0|2,0,0]=4 1579 B10R1.17 CNOCc1ccccc1 Amb22059601 [2,0,0,0,0,0|1,0,0]=3 1580 B10R1.17 COCCN1CC=CC=C1 Amb24064033 [2,0,0,0,0,0|1,0,1]=4 1581 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [2,0,0,0,0,0|1,0,0]=3 1582 B10R1.17 COCCc1cccc[n]1 Amb24089662 [2,0,0,0,0,0|1,0,0]=3 1583 B10R1.17 COCNc1ccccc1 Amb10565397 [2,0,0,0,0,0|1,0,0]=3 1584 B10R1.17 COCOc1cccnc1 Amb10561791 [2,0,0,0,0,0|2,0,0]=4 1585 B10R1.17 COCSc1cc[n]cc1 Amb25185189 [2,0,0,0,0,0|2,0,0]=4 1586 B10R1.17 COCSc1cccc[n]1 Amb24482838 [2,0,0,0,0,0|2,0,0]=4 1587 B10R1.17 CON=Cc1ccccc1 Amb22896936 [2,0,0,0,0,0|1,0,1]=4 1588 B10R1.17 CONCc1c[n]ccc1 Amb24062508 [2,0,0,0,0,0|2,0,0]=4 1589 B10R1.17 CONCc1cc[n]cc1 Amb25046027 [2,0,0,0,0,0|2,0,0]=4 1590 B10R1.17 CONCc1cccc[n]1 Amb25723329 [2,0,0,0,0,0|2,0,0]=4 1591 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [2,0,0,0,0,0|0,0,2]=4 1592 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [2,0,0,0,0,0|1,0,1]=4 1593 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [2,0,0,0,0,0|1,1,0]=4 1594 B10R1.17 CSCCc1ccncc1 Amb1864660 [2,0,0,0,0,0|1,1,0]=4 1595 B10R1.17 CSCOc1ccccc1 Amb22231357 [2,0,0,0,0,0|1,1,0]=4 1596 B10R1.17 CSCSc1ccccc1 Amb25162526 [2,0,0,0,0,0|1,1,0]=4 1597 B10R1.17 CSSCc1ccccc1 Amb22230274 [2,0,0,0,0,0|1,1,0]=4 1598 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [2,0,0,0,0,0|1,0,1]=4 1599 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [2,0,0,0,0,0|1,0,1]=4 1600 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [2,0,0,0,0,0|1,0,1]=4 1601 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [2,0,0,0,0,0|2,0,0]=4 1602 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [2,0,0,0,0,0|1,0,1]=4 1603 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [2,0,0,0,0,0|2,0,0]=4 1604 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [2,0,0,0,0,0|1,0,1]=4 1605 B10R1.17 FCCCc1ccccc1 Amb25737014 [2,0,0,0,0,0|1,0,1]=4 1606 B10R1.17 ICCCc1ccccc1 Amb10605506 [2,0,0,0,0,0|1,0,1]=4 1607 B10R1.17 N=COCc1ccccc1 Amb22269902 [2,0,0,0,0,0|1,0,0]=3 1608 B10R1.17 N=COCc1ccccc1 Amb24652885 [2,0,0,0,0,0|1,0,0]=3 1609 B10R1.17 NCCCc1ccccc1 Amb22490482 [2,0,0,0,0,0|1,0,1]=4 1610 B10R1.17 NNCCc1ccccc1 Amb10608987 [2,0,0,0,0,0|2,0,0]=4 1611 B10R1.17 NNCCc1ccccc1 Amb1117029 [2,0,0,0,0,0|2,0,0]=4 1612 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [2,0,0,0,0,0|2,0,0]=4 1613 B10R1.17 NOCCc1ccccn1 Amb17231907 [2,0,0,0,0,0|2,0,0]=4 1614 B10R1.17 NOCCc1ccncc1 Amb17231908 [2,0,0,0,0,0|2,0,0]=4 1615 B10R1.17 O=CCCc1[n]ccc[n]1 Amb24056162 [2,0,0,0,0,0|2,0,0]=4 1616 B10R1.17 O=CCCc1c[n]c[n]c1 Amb24657168 [2,0,0,0,0,0|2,0,0]=4 1617 B10R1.17 O=CCCc1ccccn1 Amb17081674 [2,0,0,0,0,0|1,0,0]=3 1618 B10R1.17 O=CCCc1cccnc1 Amb17081675 [2,0,0,0,0,0|1,0,0]=3 1619 B10R1.17 O=CCNc1cccc[n]1 Amb24100487 [2,0,0,0,0,0|2,0,0]=4 1620 B10R1.17 O=CCNc1ccccc1 Amb24566865 [2,0,0,0,0,0|1,0,0]=3 1621 B10R1.17 O=CCOc1c[n]ccc1 Amb24068437 [2,0,0,0,0,0|2,0,0]=4 1622 B10R1.17 O=CCOc1cc[n]cc1 Amb24068570 [2,0,0,0,0,0|2,0,0]=4 1623 B10R1.17 O=CCSc1cc[n]cc1 Amb24475471 [2,0,0,0,0,0|2,0,0]=4 1624 B10R1.17 O=CCSc1cccc[n]1 Amb18799459 [2,0,0,0,0,0|2,0,0]=4 1625 B10R1.17 O=CCSc1ccccc1 Amb17082903 [2,0,0,0,0,0|1,0,0]=3 1626 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [2,0,0,0,0,0|2,0,0]=4 1627 B10R1.17 O=CNCc1ccccc1 Amb1916036 [2,0,0,0,0,0|1,0,0]=3 1628 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [2,0,0,0,0,0|0,0,2]=4 1629 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [2,0,0,0,0,0|1,0,1]=4 1630 B10R1.17 OCOCc1ccccc1 Amb25727798 [2,0,0,0,0,0|0,0,2]=4 1631 B10R1.17 ONCCc1ccccc1 Amb24117032 [2,0,0,0,0,0|1,0,1]=4 1632 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [2,0,0,0,0,0|1,0,1]=4 1633 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [2,0,0,0,0,0|0,1,1]=4 1634 B12R1.1 C=CCCCc1ccc(cc1)C Amb13890670 [1,1,0,0,0,0|1,0,1]=4 1635 B12R1.1 C=CCCCc1ccc(cc1)Cl Amb13890658 [1,1,0,0,0,0|1,0,1]=4 1636 B12R1.1 C=CCCCc1ccc(cc1)F Amb13890682 [1,1,0,0,0,0|1,0,1]=4 1637 B12R1.1 CCCCCc1ccc(cc1)Br Amb2413171 [1,1,0,0,0,0|1,0,1]=4 1638 B12R1.1 CCNCCc1ccc(cc1)O Amb15694900 [1,1,0,0,0,0|1,0,1]=4 1639 B12R1.1 CCOCCc1ccc(Br)cc1 Amb23443758 [1,1,0,0,0,0|0,0,1]=3 1640 B12R1.1 CNCCCc1ccc(cc1)Br Amb17104523 [1,1,0,0,0,0|2,0,0]=4 1641 B12R1.1 CNCCCc1ccc(cc1)C Amb17104501 [1,1,0,0,0,0|2,0,0]=4 1642 B12R1.1 CNCCCc1ccc(cc1)Cl Amb17104509 [1,1,0,0,0,0|2,0,0]=4 1643 B12R1.1 CNCCCc1ccc(cc1)F Amb17104503 [1,1,0,0,0,0|2,0,0]=4 1644 B12R1.1 C\C=C\CNc1ccc(Br)cc1 Amb24344587 [1,1,0,0,0,0|2,0,0]=4 1645 B12R1.1 C\C=C\CNc1ccc(F)cc1 Amb25321448 [1,1,0,0,0,0|2,0,0]=4 1646 B12R1.1 C\C=C\CNc1ccc(I)cc1 Amb25772468 [1,1,0,0,0,0|2,0,0]=4 1647 B12R1.1 C\C=C\CNc1ccc(N)cc1 Amb24578052 [1,1,0,0,0,0|2,0,0]=4 1648 B12R1.1 C\C=C\COc1ccc(Cl)cc1 Amb24484186 [1,1,0,0,0,0|2,0,0]=4 1649 B12R1.1 C\C=C\COc1ccc(F)cc1 Amb25667089 [1,1,0,0,0,0|2,0,0]=4 1650 B12R1.1 C\C=C\COc1ccc(I)cc1 Amb25755848 [1,1,0,0,0,0|2,0,0]=4 1651 B12R1.1 C\C=C\COc1ccc(N)cc1 Amb18971519 [1,1,0,0,0,0|2,0,0]=4 1652 B12R1.1 C\C=C\CSc1ccc(Br)cc1 Amb25105700 [1,1,0,0,0,0|2,0,0]=4 1653 B12R1.1 C\C=C\CSc1ccc(O)cc1 Amb18796325 [1,1,0,0,0,0|2,0,0]=4 1654 B12R1.1 C\C=N\OCc1ccc(Cl)cc1 Amb24745737 [1,1,0,0,0,0|2,0,0]=4 1655 B12R1.1 Cc1ccc(cc1)SC\C=C\C Amb25802731 [1,1,0,0,0,0|2,0,0]=4 1656 B12R1.1 O=C=NCCc1ccc(cc1)Br Amb17089357 [1,1,0,0,0,0|1,0,1]=4 1657 B12R1.1 O=C=NCCc1ccc(cc1)C Amb17089349 [1,1,0,0,0,0|1,0,1]=4 1658 B12R1.1 O=C=NCCc1ccc(cc1)F Amb17089356 [1,1,0,0,0,0|1,0,1]=4 1659 B12R1.1 O=CCCCc1ccc(cc1)Br Amb17089176 [1,1,0,0,0,0|1,0,0]=3 1660 B12R1.1 O=CCCCc1ccc(cc1)C Amb17089167 [1,1,0,0,0,0|1,0,0]=3 1661 B12R1.1 O=CCCCc1ccc(cc1)Cl Amb17089175 [1,1,0,0,0,0|1,0,0]=3 1662 B12R1.1 O=CCCCc1ccc(cc1)F Amb17089174 [1,1,0,0,0,0|1,0,0]=3 1663 B12R1.1 O=CCCSc1ccc(cc1)Br Amb17082947 [1,1,0,0,0,0|2,0,0]=4 1664 B12R1.1 O=CCCSc1ccc(cc1)C Amb17082944 [1,1,0,0,0,0|2,0,0]=4 1665 B12R1.1 O=CCCSc1ccc(cc1)Cl Amb17082946 [1,1,0,0,0,0|2,0,0]=4 1666 B12R1.1 O=CCCSc1ccc(cc1)F Amb17082945 [1,1,0,0,0,0|2,0,0]=4 1667 B12R1.1 O=CNCCc1ccc(I)cc1 Amb25736857 [1,1,0,0,0,0|1,0,0]=3 1668 B12R1.1 O=CNCSc1ccc(Cl)cc1 Amb24495505 [1,1,0,0,0,0|2,0,0]=4 1669 B12R1.1 O=C\C=C\Cc1ccc(F)cc1 Amb24620104 [1,1,0,0,0,0|1,0,1]=4 1670 B12R1.1 Oc1ccc(CCN=C=O)cc1 Amb25376148 [1,1,0,0,0,0|1,0,1]=4 1671 B12R1.1 S=CNCCc1ccc(Cl)cc1 Amb24558852 [1,1,0,0,0,0|1,1,0]=4 1672 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [1,1,0,0,0,0|1,0,1]=4 1673 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [1,1,0,0,0,0|1,0,1]=4 1674 B12R1.8 C=CCONCc1ccccc1 Amb24725564 [1,1,0,0,0,0|1,0,1]=4 1675 B12R1.8 C=C\C=C\CCc1ccccc1 Amb20248567 [1,1,0,0,0,0|1,0,1]=4 1676 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [1,1,0,0,0,0|1,0,1]=4 1677 B12R1.8 CC#CCSCc1ccccc1 Amb25788750 [1,1,0,0,0,0|1,0,1]=4 1678 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [1,1,0,0,0,0|1,0,1]=4 1679 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [1,1,0,0,0,0|1,0,1]=4 1680 B12R1.8 CCCONCc1ccccc1 Amb25031180 [1,1,0,0,0,0|1,0,1]=4 1681 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [1,1,0,0,0,0|1,0,1]=4 1682 B12R1.8 CCNCCNc1ccccc1 Amb18792597 [1,1,0,0,0,0|1,0,1]=4 1683 B12R1.8 CCNCCOc1ccccc1 Amb2099717 [1,1,0,0,0,0|1,0,1]=4 1684 B12R1.8 CCNCCSc1ccccc1 Amb10608724 [1,1,0,0,0,0|1,0,1]=4 1685 B12R1.8 CCOCC#Cc1ccccc1 Amb24663302 [1,1,0,0,0,0|0,0,2]=4 1686 B12R1.8 CCOCCCc1ccccc1 Amb24063530 [1,1,0,0,0,0|0,0,1]=3 1687 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [1,1,0,0,0,0|0,1,1]=4 1688 B12R1.8 CC\C=C\NCc1ccccc1 Amb24519259 [1,1,0,0,0,0|2,0,0]=4 1689 B12R1.8 CC\C=N\OCc1ccccc1 Amb24395281 [1,1,0,0,0,0|2,0,0]=4 1690 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [1,1,0,0,0,0|1,0,1]=4 1691 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [1,1,0,0,0,0|2,0,0]=4 1692 B12R1.8 CNCCCSc1ccccc1 Amb10608730 [1,1,0,0,0,0|2,0,0]=4 1693 B12R1.8 CNCCCSc1ccccc1 Amb22588097 [1,1,0,0,0,0|2,0,0]=4 1694 B12R1.8 CNCCOCc1ccccc1 Amb20668782 [1,1,0,0,0,0|2,0,0]=4 1695 B12R1.8 CNCCSCc1ccccc1 Amb18809641 [1,1,0,0,0,0|2,0,0]=4 1696 B12R1.8 COCCCNc1ccccc1 Amb17232551 [1,1,0,0,0,0|2,0,0]=4 1697 B12R1.8 COCCCOc1ccccc1 Amb23450364 [1,1,0,0,0,0|2,0,0]=4 1698 B12R1.8 CSCCNCc1ccccc1 Amb18187025 [1,1,0,0,0,0|2,0,0]=4 1699 B12R1.8 CS\C=C/CNc1ccccc1 Amb25312228 [1,1,0,0,0,0|2,0,0]=4 1700 B12R1.8 CS\C=C\CNc1ccccc1 Amb25167583 [1,1,0,0,0,0|2,0,0]=4 1701 B12R1.8 C\C=C\CNCc1ccccc1 Amb18645560 [1,1,0,0,0,0|1,0,0]=3 1702 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [1,1,0,0,0,0|1,0,1]=4 1703 B12R1.8 Cl\C=C/COCc1ccccc1 Amb24711309 [1,1,0,0,0,0|2,0,0]=4 1704 B12R1.8 N#C\C=C\CCc1ccccc1 Amb17477529 [1,1,0,0,0,0|1,0,1]=4 1705 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [1,1,0,0,0,0|1,0,1]=4 1706 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [1,1,0,0,0,0|1,0,1]=4 1707 B12R1.8 NCCNCCc1ccccc1 Amb22283881 [1,1,0,0,0,0|1,0,1]=4 1708 B12R1.8 NCCOCCc1ccccc1 Amb19374389 [1,1,0,0,0,0|0,0,1]=3 1709 B12R1.8 NC\C=C\CNc1ccccc1 Amb25046454 [1,1,0,0,0,0|2,0,0]=4 1710 B12R1.8 O=C=NCCOc1ccccc1 Amb13783673 [1,1,0,0,0,0|1,0,1]=4 1711 B12R1.8 O=CC#CCCc1ccccc1 Amb24356095 [1,1,0,0,0,0|1,0,0]=3 1712 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [1,1,0,0,0,0|1,0,0]=3 1713 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [1,1,0,0,0,0|1,0,0]=3 1714 B12R1.8 O=CCOCCc1ccccc1 Amb18800786 [1,1,0,0,0,0|0,0,0]=2 1715 B12R1.8 O=CNCNCc1ccccc1 Amb24532665 [1,1,0,0,0,0|1,0,0]=3 1716 B12R1.8 O=CNCOCc1ccccc1 Amb24552397 [1,1,0,0,0,0|1,0,0]=3 1717 B12R1.8 O=CNC\C=C\c1ccccc1 Amb25249766 [1,1,0,0,0,0|1,0,1]=4 1718 B12R1.8 O=COCCCc1ccccc1 Amb22229401 [1,1,0,0,0,0|0,0,0]=2 1719 B12R1.8 O=C\C=C\NCc1ccccc1 Amb18645517 [1,1,0,0,0,0|1,0,1]=4 1720 B12R1.8 O=C\C=C\OCc1ccccc1 Amb18645661 [1,1,0,0,0,0|1,0,1]=4 1721 B12R1.8 O=C\C=N\OCc1ccccc1 Amb24540826 [1,1,0,0,0,0|2,0,0]=4 1722 B12R1.8 OCCNCCc1ccccc1 Amb2119205 [1,1,0,0,0,0|1,0,1]=4 1723 B12R1.8 OCOCOCc1ccccc1 Amb25803238 [1,1,0,0,0,0|0,0,2]=4 1724 B12R1.8 O\C=C\NCCc1ccccc1 Amb24721604 [1,1,0,0,0,0|1,0,1]=4 1725 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [1,1,0,0,0,0|1,0,1]=4 1726 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [1,1,0,0,0,0|2,0,0]=4 1727 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [1,1,0,0,0,0|1,0,1]=4 1728 B12R1.27 CNC(CCc1ccccc1)C Amb1138722 [1,1,0,0,0,0|2,0,0]=4 1729 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [1,1,0,0,0,0|2,0,0]=4 1730 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [1,1,0,0,0,0|1,0,1]=4 1731 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [1,1,0,0,0,0|1,0,1]=4 1732 B12R1.27 C\C(\CNc1ccccc1)=C\C Amb24636864 [1,1,0,0,0,0|2,0,0]=4 1733 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [1,1,0,0,0,0|2,0,0]=4 1734 B12R1.27 O=CC(CSc1ccccc1)C Amb17594629 [1,1,0,0,0,0|2,0,0]=4 1735 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [1,1,0,0,0,0|2,0,0]=4 1736 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [1,1,0,0,0,0|1,0,1]=4 1737 B12R1.28 C=CCCCc1cccc(c1)C Amb13890666 [1,1,0,0,0,0|1,0,1]=4 1738 B12R1.28 C=CCCCc1cccc(c1)Cl Amb13890654 [1,1,0,0,0,0|1,0,1]=4 1739 B12R1.28 C=CCCCc1cccc(c1)F Amb13890678 [1,1,0,0,0,0|1,0,1]=4 1740 B12R1.28 CCCCCc1cccc(F)c1 Amb22235097 [1,1,0,0,0,0|1,0,1]=4 1741 B12R1.28 CCNCCc1cccc(N)c1 Amb18550383 [1,1,0,0,0,0|1,0,1]=4 1742 B12R1.28 CCNCCc1cccc(c1)Br Amb17407066 [1,1,0,0,0,0|1,0,1]=4 1743 B12R1.28 CCNCCc1cccc(c1)C Amb17193871 [1,1,0,0,0,0|1,0,1]=4 1744 B12R1.28 CCOCOc1cc(N)ccc1 Amb24085370 [1,1,0,0,0,0|1,0,1]=4 1745 B12R1.28 CNCCCc1cccc(c1)Br Amb17104522 [1,1,0,0,0,0|2,0,0]=4 1746 B12R1.28 CNCCCc1cccc(c1)C Amb17104500 [1,1,0,0,0,0|2,0,0]=4 1747 B12R1.28 CNCCCc1cccc(c1)Cl Amb17104508 [1,1,0,0,0,0|2,0,0]=4 1748 B12R1.28 CNCCCc1cccc(c1)F Amb17605539 [1,1,0,0,0,0|2,0,0]=4 1749 B12R1.28 C\C=C\CNc1cccc(I)c1 Amb25232855 [1,1,0,0,0,0|2,0,0]=4 1750 B12R1.28 C\C=C\COc1cccc(N)c1 Amb18971501 [1,1,0,0,0,0|2,0,0]=4 1751 B12R1.28 Cc1cc(CCNC=O)ccc1 Amb25758483 [1,1,0,0,0,0|1,0,0]=3 1752 B12R1.28 O=C=NCCc1cccc(F)c1 Amb24392961 [1,1,0,0,0,0|1,0,1]=4 1753 B12R1.28 O=C=NCCc1cccc(c1)Br Amb17247243 [1,1,0,0,0,0|1,0,1]=4 1754 B12R1.28 O=C=NCCc1cccc(c1)C Amb17232366 [1,1,0,0,0,0|1,0,1]=4 1755 B12R1.28 O=CCCCc1cccc(Br)c1 Amb18048776 [1,1,0,0,0,0|1,0,0]=3 1756 B12R1.28 O=CCCSc1cccc(c1)C Amb17082972 [1,1,0,0,0,0|2,0,0]=4 1757 B12R1.28 O=CCCSc1cccc(c1)Cl Amb17082982 [1,1,0,0,0,0|2,0,0]=4 1758 B12R1.28 O=CNCCc1cccc(Br)c1 Amb24694394 [1,1,0,0,0,0|1,0,0]=3 1759 B12R1.28 O=CNCCc1cccc(F)c1 Amb25853482 [1,1,0,0,0,0|1,0,0]=3 1760 B12R1.28 Oc1cc(CCN=C=O)ccc1 Amb24636993 [1,1,0,0,0,0|1,0,1]=4 1761 B12R1.28 Oc1cc(CCNC=O)ccc1 Amb24399967 [1,1,0,0,0,0|1,0,0]=3 1762 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [1,1,0,0,0,0|1,0,1]=4 1763 B12R1.30 CC#CCC(N)c1ccccc1 Amb18988278 [1,1,0,0,0,0|1,0,1]=4 1764 B12R1.30 CC#CCC(O)c1ccccc1 Amb18797803 [1,1,0,0,0,0|1,0,1]=4 1765 B12R1.30 CC#CC[C@H](N)c1ccccc1 Amb25055199 [1,1,0,0,0,0|1,0,1]=4 1766 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [1,1,0,0,0,0|1,0,1]=4 1767 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb24554527 [1,1,0,0,0,0|1,0,1]=4 1768 B12R1.30 CC=C=CC(N)c1ccccc1 Amb25679572 [1,1,0,0,0,0|1,0,1]=4 1769 B12R1.30 CC=C=C[C@H](N)c1ccccc1 Amb25771886 [1,1,0,0,0,0|1,0,1]=4 1770 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [1,1,0,0,0,0|1,0,0]=3 1771 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [1,1,0,0,0,0|1,0,1]=4 1772 B12R1.30 CCNCC(O)c1ccccc1 Amb22491734 [1,1,0,0,0,0|1,0,1]=4 1773 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [1,1,0,0,0,0|1,0,1]=4 1774 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [1,1,0,0,0,0|0,0,1]=3 1775 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb20240620 [1,1,0,0,0,0|2,0,0]=4 1776 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb22747753 [1,1,0,0,0,0|2,0,0]=4 1777 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [1,1,0,0,0,0|2,0,0]=4 1778 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [1,1,0,0,0,0|2,0,0]=4 1779 B12R1.30 C\C=C/CC(=O)c1ccccc1 Amb24594702 [1,1,0,0,0,0|1,0,1]=4 1780 B12R1.30 C\C=C/NC(C)c1ccccc1 Amb25158747 [1,1,0,0,0,0|2,0,0]=4 1781 B12R1.30 C\C=C\CC(O)c1c[n]ccc1 Amb25832725 [1,1,0,0,0,0|2,0,0]=4 1782 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [1,1,0,0,0,0|2,0,0]=4 1783 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [1,1,0,0,0,0|1,0,0]=3 1784 B12R1.30 O=C(CNC=O)c1ccccc1 Amb20075907 [1,1,0,0,0,0|1,0,1]=4 1785 B12R1.30 O=C=NCC(Cl)c1ccccc1 Amb24692969 [1,1,0,0,0,0|1,0,1]=4 1786 B12R1.30 OC(CNC=O)c1ccccc1 Amb18792635 [1,1,0,0,0,0|1,0,0]=3 1787 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [1,1,0,0,0,0|2,0,0]=4 1788 B12R1.30 OC(\C=C\C=O)c1ccccc1 Amb18645664 [1,1,0,0,0,0|1,0,1]=4 1789 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [1,1,0,0,0,0|2,0,0]=4 1790 B12R1.32 C=CCC(N)Cc1ccccc1 Amb19015820 [1,1,0,0,0,0|1,0,1]=4 1791 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [1,1,0,0,0,0|0,0,2]=4 1792 B12R1.32 CC#CC(N)Cc1ccccc1 Amb24417700 [1,1,0,0,0,0|1,0,1]=4 1793 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [1,1,0,0,0,0|1,0,1]=4 1794 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [1,1,0,0,0,0|1,1,0]=4 1795 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [1,1,0,0,0,0|1,0,1]=4 1796 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [1,1,0,0,0,0|1,0,1]=4 1797 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [1,1,0,0,0,0|1,0,1]=4 1798 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [1,1,0,0,0,0|1,0,1]=4 1799 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [1,1,0,0,0,0|1,0,1]=4 1800 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [1,1,0,0,0,0|0,0,2]=4 1801 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [1,1,0,0,0,0|2,0,0]=4 1802 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [1,1,0,0,0,0|2,0,0]=4 1803 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [1,1,0,0,0,0|2,0,0]=4 1804 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [1,1,0,0,0,0|2,0,0]=4 1805 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [1,1,0,0,0,0|1,0,0]=3 1806 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [1,1,0,0,0,0|1,0,1]=4 1807 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [1,1,0,0,0,0|1,0,0]=3 1808 B12R1.32 C\C=C\C(O)Cc1cccc[n]1 Amb25221506 [1,1,0,0,0,0|2,0,0]=4 1809 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [1,1,0,0,0,0|1,0,0]=3 1810 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [1,1,0,0,0,0|1,0,0]=3 1811 B12R1.267 C=CCCCc1ccccc1C Amb13890662 [1,1,0,0,0,0|1,0,1]=4 1812 B12R1.267 CNCCCc1ccccc1Br Amb17605546 [1,1,0,0,0,0|2,0,0]=4 1813 B12R1.267 CNCCCc1ccccc1C Amb17104499 [1,1,0,0,0,0|2,0,0]=4 1814 B12R1.267 CNCCCc1ccccc1Cl Amb17104507 [1,1,0,0,0,0|2,0,0]=4 1815 B12R1.267 CNCCCc1ccccc1F Amb17104502 [1,1,0,0,0,0|2,0,0]=4 1816 B12R1.267 C\C=C/CNc1ccccc1F Amb24072922 [1,1,0,0,0,0|2,0,0]=4 1817 B12R1.267 C\C=C\CCc1ccccc1N Amb25233153 [1,1,0,0,0,0|1,0,0]=3 1818 B12R1.267 C\C=C\CCc1ccccc1O Amb24676835 [1,1,0,0,0,0|1,0,0]=3 1819 B12R1.267 C\C=C\CNc1ccccc1Br Amb25073121 [1,1,0,0,0,0|2,0,0]=4 1820 B12R1.267 C\C=C\CNc1ccccc1F Amb24365712 [1,1,0,0,0,0|2,0,0]=4 1821 B12R1.267 C\C=C\CNc1ccccc1I Amb24739328 [1,1,0,0,0,0|2,0,0]=4 1822 B12R1.267 C\C=C\CNc1ccccc1N Amb24588670 [1,1,0,0,0,0|2,0,0]=4 1823 B12R1.267 C\C=C\COc1ccccc1F Amb24388004 [1,1,0,0,0,0|2,0,0]=4 1824 B12R1.267 C\C=C\COc1ccccc1I Amb25841807 [1,1,0,0,0,0|2,0,0]=4 1825 B12R1.267 C\C=C\COc1ccccc1N Amb18290042 [1,1,0,0,0,0|2,0,0]=4 1826 B12R1.267 C\C=C\CSc1ccccc1Cl Amb25345653 [1,1,0,0,0,0|2,0,0]=4 1827 B12R1.267 C\C=C\CSc1ccccc1F Amb25188271 [1,1,0,0,0,0|2,0,0]=4 1828 B12R1.267 C\C=C\CSc1ccccc1O Amb24422451 [1,1,0,0,0,0|2,0,0]=4 1829 B12R1.267 Cc1ccccc1CCC=CC Amb22347883 [1,1,0,0,0,0|1,0,0]=3 1830 B12R1.267 Cc1ccccc1CCNC=O Amb24637730 [1,1,0,0,0,0|1,0,0]=3 1831 B12R1.267 Cc1ccccc1C\C=C\C=O Amb24497170 [1,1,0,0,0,0|1,0,1]=4 1832 B12R1.267 O=C=NCCc1ccccc1C Amb17232365 [1,1,0,0,0,0|1,0,1]=4 1833 B12R1.267 O=C=NCCc1ccccc1Cl Amb17233866 [1,1,0,0,0,0|1,0,1]=4 1834 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [1,1,0,0,0,0|2,0,0]=4 1835 B12R1.267 O=CNCCc1ccccc1Cl Amb25101673 [1,1,0,0,0,0|1,0,0]=3 1836 B12R1.267 O=CNCCc1ccccc1F Amb24399686 [1,1,0,0,0,0|1,0,0]=3 1837 B12R1.267 Oc1ccccc1CCN=C=O Amb25267891 [1,1,0,0,0,0|1,0,1]=4 1838 B12R1.267 Oc1ccccc1C\C=C\C=O Amb25075559 [1,1,0,0,0,0|1,0,1]=4 1839 B12R1.21 CC(=C)CNc1ccc(cc1)Br Amb17306797 [0,1,0,0,1,0|2,0,0]=4 1840 B12R1.21 CC(=C)CNc1ccc(cc1)C Amb17306884 [0,1,0,0,1,0|2,0,0]=4 1841 B12R1.21 CC(=C)CNc1ccc(cc1)Cl Amb17307251 [0,1,0,0,1,0|2,0,0]=4 1842 B12R1.21 CC(=C)CNc1ccc(cc1)F Amb17306195 [0,1,0,0,1,0|2,0,0]=4 1843 B12R1.21 CC(=C)CNc1ccc(cc1)I Amb17306249 [0,1,0,0,1,0|2,0,0]=4 1844 B12R1.21 CC(=C)COc1ccc(Cl)cc1 Amb24367387 [0,1,0,0,1,0|2,0,0]=4 1845 B12R1.21 CC(=C)COc1ccc(cc1)F Amb2444928 [0,1,0,0,1,0|2,0,0]=4 1846 B12R1.21 CC(=C)COc1ccc(cc1)N Amb2081541 [0,1,0,0,1,0|2,0,0]=4 1847 B12R1.21 CC(=C)CSc1ccc(Br)cc1 Amb25051868 [0,1,0,0,1,0|2,0,0]=4 1848 B12R1.21 CC(=C)CSc1ccc(O)cc1 Amb18796319 [0,1,0,0,1,0|2,0,0]=4 1849 B12R1.21 CC(=N)NCc1ccc(Cl)cc1 Amb24483598 [0,1,0,0,1,0|2,0,0]=4 1850 B12R1.21 CC(=O)C#Cc1ccc(Cl)cc1 Amb24645414 [0,1,0,0,1,0|0,0,2]=4 1851 B12R1.21 CC(=O)C#Cc1ccc(F)cc1 Amb24484221 [0,1,0,0,1,0|0,0,2]=4 1852 B12R1.21 CC(=O)CCC=1C=CC(=O)NC1 Amb24346528 [0,1,0,0,1,0|1,0,0]=3 1853 B12R1.21 CC(=O)CCN1C=CC(=O)C=C1 Amb24483600 [0,1,0,0,1,0|1,0,0]=3 1854 B12R1.21 CC(=O)CCc1ccc(Br)c[n]1 Amb25729593 [0,1,0,0,1,0|1,0,0]=3 1855 B12R1.21 CC(=O)CCc1ccc(Cl)[n]c1 Amb25725533 [0,1,0,0,1,0|1,0,0]=3 1856 B12R1.21 CC(=O)CNc1ccc(Cl)cc1 Amb24729554 [0,1,0,0,1,0|1,0,0]=3 1857 B12R1.21 CC(=O)COc1ccc(Br)[n]c1 Amb25346012 [0,1,0,0,1,0|2,0,0]=4 1858 B12R1.21 CC(=O)COc1ccc(Cl)[n]c1 Amb24431620 [0,1,0,0,1,0|2,0,0]=4 1859 B12R1.21 CC(=O)COc1ccc(I)[n]c1 Amb25306196 [0,1,0,0,1,0|2,0,0]=4 1860 B12R1.21 CC(=O)COc1ccc(O)cc1 Amb18646453 [0,1,0,0,1,0|1,0,0]=3 1861 B12R1.21 CC(=O)COc1ccc(cc1)Br Amb17601394 [0,1,0,0,1,0|1,0,0]=3 1862 B12R1.21 CC(=O)COc1ccc(cc1)Cl Amb1094739 [0,1,0,0,1,0|1,0,0]=3 1863 B12R1.21 CC(=O)COc1ccc(cc1)N Amb17110083 [0,1,0,0,1,0|1,0,0]=3 1864 B12R1.21 CC(=O)CSc1ccc(Br)c[n]1 Amb25318490 [0,1,0,0,1,0|2,0,0]=4 1865 B12R1.21 CC(=O)CSc1ccc(Cl)c[n]1 Amb25337175 [0,1,0,0,1,0|2,0,0]=4 1866 B12R1.21 CC(=O)CSc1ccc(nc1)N Amb17305706 [0,1,0,0,1,0|2,0,0]=4 1867 B12R1.21 CC(=O)NCC=1C=CC(=O)NC1 Amb25232374 [0,1,0,0,1,0|2,0,0]=4 1868 B12R1.21 CC(=O)NCc1ccc(Br)cc1 Amb20622638 [0,1,0,0,1,0|1,0,0]=3 1869 B12R1.21 CC(=O)NCc1ccc(cc1)O Amb10549495 [0,1,0,0,1,0|1,0,0]=3 1870 B12R1.21 CC(=O)NCc1ccc(cn1)N Amb13890645 [0,1,0,0,1,0|2,0,0]=4 1871 B12R1.21 CC(=O)NCc1ccc(nc1)Cl Amb10608428 [0,1,0,0,1,0|2,0,0]=4 1872 B12R1.21 CC(=O)NNc1ccc(N)cc1 Amb18646317 [0,1,0,0,1,0|2,0,0]=4 1873 B12R1.21 CC(=O)NNc1ccc(cc1)Br Amb1040272 [0,1,0,0,1,0|2,0,0]=4 1874 B12R1.21 CC(=O)NNc1ccc(cc1)C Amb1040273 [0,1,0,0,1,0|2,0,0]=4 1875 B12R1.21 CC(=O)NOc1ccc(N)cc1 Amb25742910 [0,1,0,0,1,0|2,0,0]=4 1876 B12R1.21 CC(=O)OCC=1C=NC(=O)CC1 Amb24425470 [0,1,0,0,1,0|1,0,1]=4 1877 B12R1.21 CC(=O)OCc1c[n]c(Cl)c[n]1 Amb25296915 [0,1,0,0,1,0|2,0,0]=4 1878 B12R1.21 CC(=O)OCc1c[n]c(N)c[n]1 Amb25808752 [0,1,0,0,1,0|2,0,0]=4 1879 B12R1.21 CC(=O)OCc1ccc(Cl)[n][n]1 Amb24596102 [0,1,0,0,1,0|2,0,0]=4 1880 B12R1.21 CC(=O)OCc1ccc(Cl)c[n]1 Amb25220252 [0,1,0,0,1,0|1,0,0]=3 1881 B12R1.21 CC(=O)OCc1ccc(I)cc1 Amb25687671 [0,1,0,0,1,0|0,0,0]=2 1882 B12R1.21 CC(=O)OCc1ccc(N)[n]c1 Amb24689359 [0,1,0,0,1,0|1,0,0]=3 1883 B12R1.21 CC(=O)OCc1ccc(N)c[n]1 Amb20248322 [0,1,0,0,1,0|1,0,0]=3 1884 B12R1.21 CC(=O)OCc1ccc(O)c[n]1 Amb18646673 [0,1,0,0,1,0|1,0,0]=3 1885 B12R1.21 CC(=O)OCc1ccc(O)cc1 Amb18646455 [0,1,0,0,1,0|0,0,0]=2 1886 B12R1.21 CC(=O)OCc1ccc(cc1)Cl Amb2421366 [0,1,0,0,1,0|0,0,0]=2 1887 B12R1.21 CC(=O)ONc1ccc(Cl)c[n]1 Amb20247510 [0,1,0,0,1,0|2,0,0]=4 1888 B12R1.21 CC(=O)ONc1ccc(O)cc1 Amb24497023 [0,1,0,0,1,0|1,0,0]=3 1889 B12R1.21 CC(=O)OOc1ccc(N)cc1 Amb22233285 [0,1,0,0,1,0|1,0,0]=3 1890 B12R1.21 CC(=O)O[Hg]c1ccc(N)cc1 Amb22351859 [0,1,0,0,1,0|1,0,0]=3 1891 B12R1.21 CC(=O)SCc1ccc(Br)cc1 Amb22338619 [0,1,0,0,1,0|0,1,0]=3 1892 B12R1.21 CC(=O)SCc1ccc(Cl)[n]c1 Amb25223594 [0,1,0,0,1,0|1,1,0]=4 1893 B12R1.21 CC(=O)SCc1ccc(N)[n]c1 Amb24388564 [0,1,0,0,1,0|1,1,0]=4 1894 B12R1.21 CC(=O)SSc1ccc(O)cc1 Amb25373390 [0,1,0,0,1,0|1,1,0]=4 1895 B12R1.21 CC(=O)\C=C\c1ccc(I)cc1 Amb25736694 [0,1,0,0,1,0|0,0,2]=4 1896 B12R1.21 CC(=O)\C=C\c1ccc(N)cc1 Amb23247750 [0,1,0,0,1,0|0,0,2]=4 1897 B12R1.21 CC(=O)\N=C/c1ccc(Cl)cc1 Amb24073008 [0,1,0,0,1,0|1,0,1]=4 1898 B12R1.21 CC(=O)\N=C\c1ccc(Cl)cc1 Amb24404018 [0,1,0,0,1,0|1,0,1]=4 1899 B12R1.21 CC(=O)\N=C\c1ccc(O)cc1 Amb25059643 [0,1,0,0,1,0|1,0,1]=4 1900 B12R1.21 CC(=S)NCc1ccc(Cl)cc1 Amb25858106 [0,1,0,0,1,0|1,1,0]=4 1901 B12R1.21 CC(=S)NCc1ccc(F)cc1 Amb25139700 [0,1,0,0,1,0|1,1,0]=4 1902 B12R1.21 CC(Br)CCc1ccc(Br)cc1 Amb25803938 [0,1,0,0,1,0|1,0,1]=4 1903 B12R1.21 CC(Br)CCc1ccc(O)cc1 Amb24532811 [0,1,0,0,1,0|1,0,1]=4 1904 B12R1.21 CC(C)CCc1ccc(S)cc1 Amb19888153 [0,1,0,0,1,0|1,0,1]=4 1905 B12R1.21 CC(C)OCc1ccc(Br)cc1 Amb19301962 [0,1,0,0,1,0|1,0,1]=4 1906 B12R1.21 CC(C)OCc1ccc(Cl)cc1 Amb24514322 [0,1,0,0,1,0|1,0,1]=4 1907 B12R1.21 CC(C)OCc1ccc(I)cc1 Amb25695675 [0,1,0,0,1,0|1,0,1]=4 1908 B12R1.21 CC(CCc1ccc(cc1)Br)C Amb2226924 [0,1,0,0,1,0|1,0,1]=4 1909 B12R1.21 CC(CCc1ccc(cc1)Cl)O Amb17507284 [0,1,0,0,1,0|0,0,2]=4 1910 B12R1.21 CC(CCc1ccc(cc1)F)O Amb17507285 [0,1,0,0,1,0|0,0,2]=4 1911 B12R1.21 CC(CCc1ccc(cc1)O)O Amb1110722 [0,1,0,0,1,0|0,0,2]=4 1912 B12R1.21 CC(Cl)CCc1ccc(Br)cc1 Amb25796648 [0,1,0,0,1,0|1,0,1]=4 1913 B12R1.21 CC(Cl)CCc1ccc(Cl)cc1 Amb24488696 [0,1,0,0,1,0|1,0,1]=4 1914 B12R1.21 CC(Cl)CCc1ccc(F)cc1 Amb19076402 [0,1,0,0,1,0|1,0,1]=4 1915 B12R1.21 CC(Cl)CCc1ccc(O)cc1 Amb25715798 [0,1,0,0,1,0|1,0,1]=4 1916 B12R1.21 CC(F)CCc1ccc(N)cc1 Amb24511306 [0,1,0,0,1,0|1,0,1]=4 1917 B12R1.21 CC(N)CCc1ccc(Br)cc1 Amb17991263 [0,1,0,0,1,0|1,0,1]=4 1918 B12R1.21 CC(N)CCc1ccc(Cl)cc1 Amb22461482 [0,1,0,0,1,0|1,0,1]=4 1919 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [0,1,0,0,1,0|0,0,2]=4 1920 B12R1.21 CN(C)CCc1ccc(Br)cc1 Amb21858668 [0,1,0,0,1,0|2,0,0]=4 1921 B12R1.21 CN(C)CCc1ccc(N)cc1 Amb22756010 [0,1,0,0,1,0|2,0,0]=4 1922 B12R1.21 CN(N)CCc1ccc(Br)cc1 Amb18070402 [0,1,0,0,1,0|2,0,0]=4 1923 B12R1.21 CN(N)CCc1ccc(Cl)cc1 Amb18564318 [0,1,0,0,1,0|2,0,0]=4 1924 B12R1.21 CN(N)CCc1ccc(F)cc1 Amb18563851 [0,1,0,0,1,0|2,0,0]=4 1925 B12R1.21 CS(=O)CCc1ccc(N)cc1 Amb18974603 [0,1,0,0,1,0|1,0,0]=3 1926 B12R1.21 CS(=O)CCc1ccc(cc1)C Amb16185126 [0,1,0,0,1,0|1,0,0]=3 1927 B12R1.21 CS(=O)COc1ccc(Br)cc1 Amb25692440 [0,1,0,0,1,0|2,0,0]=4 1928 B12R1.21 CS(=O)NCc1ccc(Br)cc1 Amb25177255 [0,1,0,0,1,0|2,0,0]=4 1929 B12R1.21 CS(=O)NCc1ccc(N)cc1 Amb24582929 [0,1,0,0,1,0|2,0,0]=4 1930 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [0,1,0,0,1,0|0,0,2]=4 1931 B12R1.21 C[C@H](N)CCc1ccc(Cl)cc1 Amb24702508 [0,1,0,0,1,0|1,0,1]=4 1932 B12R1.21 C[C@H](N)CCc1ccc(F)cc1 Amb24624091 [0,1,0,0,1,0|1,0,1]=4 1933 B12R1.21 Cc1c[n]c(COC(C)=O)c[n]1 Amb25065213 [0,1,0,0,1,0|2,0,0]=4 1934 B12R1.21 Cc1ccc(CCC(C)=O)c[n]1 Amb25197877 [0,1,0,0,1,0|1,0,0]=3 1935 B12R1.21 Cc1ccc(CCC(C)Cl)cc1 Amb19074261 [0,1,0,0,1,0|1,0,1]=4 1936 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [0,1,0,0,1,0|0,0,2]=4 1937 B12R1.21 Cc1ccc(CCC(N)=N)cc1 Amb18065466 [0,1,0,0,1,0|2,0,0]=4 1938 B12R1.21 Cc1ccc(CCC(O)=O)[n]c1 Amb22886574 [0,1,0,0,1,0|2,0,0]=4 1939 B12R1.21 Cc1ccc(CCC(O)=O)c[n]1 Amb18828437 [0,1,0,0,1,0|2,0,0]=4 1940 B12R1.21 Cc1ccc(CCN(C)N)cc1 Amb18563653 [0,1,0,0,1,0|2,0,0]=4 1941 B12R1.21 Cc1ccc(CNC(C)=N)cc1 Amb24443445 [0,1,0,0,1,0|2,0,0]=4 1942 B12R1.21 Cc1ccc(CNC(C)=O)[n]c1 Amb25799544 [0,1,0,0,1,0|2,0,0]=4 1943 B12R1.21 Cc1ccc(CNC(C)=S)cc1 Amb25725010 [0,1,0,0,1,0|1,1,0]=4 1944 B12R1.21 Cc1ccc(COC(C)=O)[n]c1 Amb24086564 [0,1,0,0,1,0|1,0,0]=3 1945 B12R1.21 Cc1ccc(COC(C)=O)c[n]1 Amb22750507 [0,1,0,0,1,0|1,0,0]=3 1946 B12R1.21 Cc1ccc([n]c1)SCC(C)=O Amb24351751 [0,1,0,0,1,0|2,0,0]=4 1947 B12R1.21 Cc1ccc(\C=C/C(C)=O)cc1 Amb24422503 [0,1,0,0,1,0|0,0,2]=4 1948 B12R1.21 Cc1ccc(cc1)CC[N+](=O)[O-] Amb17400178 [0,1,0,0,1,0|2,0,0]=4 1949 B12R1.21 Cc1ccc(cc1)NCC(C)=O Amb25068510 [0,1,0,0,1,0|1,0,0]=3 1950 B12R1.21 Cc1ccc(cc1)NOC(C)=O Amb24073550 [0,1,0,0,1,0|1,0,0]=3 1951 B12R1.21 Cc1ccc(cc1)SCC(C)=S Amb24607333 [0,1,0,0,1,0|1,1,0]=4 1952 B12R1.21 Cc1ccc(cc1)\N=C\C(C)=O Amb25334923 [0,1,0,0,1,0|1,0,1]=4 1953 B12R1.21 ClC(=O)CCc1ccc(cc1)C Amb17142993 [0,1,0,0,1,0|1,0,0]=3 1954 B12R1.21 ClC(=O)CCc1ccc(cc1)Cl Amb17143273 [0,1,0,0,1,0|1,0,0]=3 1955 B12R1.21 ClC(=O)COc1ccc(cc1)Br Amb16186415 [0,1,0,0,1,0|2,0,0]=4 1956 B12R1.21 ClC(=O)COc1ccc(cc1)C Amb10880011 [0,1,0,0,1,0|2,0,0]=4 1957 B12R1.21 ClC(=O)CSc1ccc(cc1)Cl Amb17143821 [0,1,0,0,1,0|2,0,0]=4 1958 B12R1.21 NC(=N)CCc1ccc(Br)cc1 Amb18571448 [0,1,0,0,1,0|2,0,0]=4 1959 B12R1.21 NC(=N)CCc1ccc(Cl)cc1 Amb18564231 [0,1,0,0,1,0|2,0,0]=4 1960 B12R1.21 NC(=N)CCc1ccc(F)cc1 Amb18563719 [0,1,0,0,1,0|2,0,0]=4 1961 B12R1.21 NC(=N)CCc1ccc(cc1)O Amb13883011 [0,1,0,0,1,0|2,0,0]=4 1962 B12R1.21 NC(=O)CCN1C=CC(=O)C=C1 Amb18788434 [0,1,0,0,1,0|2,0,0]=4 1963 B12R1.21 NC(=O)CCc1cc[n+](cc1)C Amb10553742 [0,1,0,0,1,0|2,0,0]=4 1964 B12R1.21 NC(=O)CCc1cc[n+](cc1)[O-] Amb10553010 [0,1,0,0,1,0|2,0,0]=4 1965 B12R1.21 NC(=O)CCc1ccc(cc1)Br Amb17407065 [0,1,0,0,1,0|1,0,0]=3 1966 B12R1.21 NC(=O)CCc1ccc(cc1)Cl Amb17142998 [0,1,0,0,1,0|1,0,0]=3 1967 B12R1.21 NC(=O)COc1ccc(cc1)F Amb2456996 [0,1,0,0,1,0|2,0,0]=4 1968 B12R1.21 NC(=O)COc1ccc(cc1)I Amb173371 [0,1,0,0,1,0|2,0,0]=4 1969 B12R1.21 NC(=O)CSc1ccc(O)cc1 Amb19057102 [0,1,0,0,1,0|2,0,0]=4 1970 B12R1.21 NC(=O)CSc1ccc(cc1)Br Amb1218433 [0,1,0,0,1,0|2,0,0]=4 1971 B12R1.21 NC(=O)CSc1ccc(cc1)Cl Amb1530887 [0,1,0,0,1,0|2,0,0]=4 1972 B12R1.21 NC(=O)CSc1ccc(cc1)F Amb1646201 [0,1,0,0,1,0|2,0,0]=4 1973 B12R1.21 NC(=O)NCc1ccc(cc1)Br Amb1139295 [0,1,0,0,1,0|2,0,0]=4 1974 B12R1.21 NC(=O)NCc1ccc(cc1)C Amb1134976 [0,1,0,0,1,0|2,0,0]=4 1975 B12R1.21 NC(=O)NCc1ccc(cc1)Cl Amb2435054 [0,1,0,0,1,0|2,0,0]=4 1976 B12R1.21 NC(=O)NCc1ccc(cc1)F Amb1128118 [0,1,0,0,1,0|2,0,0]=4 1977 B12R1.21 NC(=O)OCc1ccc(Cl)cc1 Amb25737813 [0,1,0,0,1,0|1,0,0]=3 1978 B12R1.21 NC(=S)CCc1ccc(cc1)Cl Amb17237061 [0,1,0,0,1,0|1,1,0]=4 1979 B12R1.21 Nc1ccc(CCC(O)=O)[n]c1 Amb24663664 [0,1,0,0,1,0|2,0,0]=4 1980 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb19958679 [0,1,0,0,1,0|2,0,0]=4 1981 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb22546430 [0,1,0,0,1,0|2,0,0]=4 1982 B12R1.21 Nc1ccc(CC[N+]([O-])=O)cc1 Amb24406773 [0,1,0,0,1,0|2,0,0]=4 1983 B12R1.21 Nc1ccc(cc1)NCC(O)=O Amb18296058 [0,1,0,0,1,0|2,0,0]=4 1984 B12R1.21 Nc1ccc(cc1)OCC(O)=O Amb22751390 [0,1,0,0,1,0|2,0,0]=4 1985 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [0,1,0,0,1,0|1,0,0]=3 1986 B12R1.21 O=C(Cl)CNc1ccc(Cl)cc1 Amb24537780 [0,1,0,0,1,0|2,0,0]=4 1987 B12R1.21 O=C(Cl)OCc1ccc(Br)cc1 Amb22059767 [0,1,0,0,1,0|1,0,0]=3 1988 B12R1.21 O=C(Cl)OCc1ccc(F)cc1 Amb24471576 [0,1,0,0,1,0|1,0,0]=3 1989 B12R1.21 OC(=O)CCN1C=CC(=O)C=C1 Amb18534262 [0,1,0,0,1,0|2,0,0]=4 1990 B12R1.21 OC(=O)CCN1C=CC(=S)C=C1 Amb25751169 [0,1,0,0,1,0|2,0,0]=4 1991 B12R1.21 OC(=O)CC[n+]1ccc(cc1)C Amb17098177 [0,1,0,0,1,0|2,0,0]=4 1992 B12R1.21 OC(=O)CCc1ccc(Br)[n]c1 Amb22292277 [0,1,0,0,1,0|2,0,0]=4 1993 B12R1.21 OC(=O)CCc1ccc(Cl)[n]c1 Amb18649204 [0,1,0,0,1,0|2,0,0]=4 1994 B12R1.21 OC(=O)CCc1ccc(F)[n]c1 Amb22886575 [0,1,0,0,1,0|2,0,0]=4 1995 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [0,1,0,0,1,0|1,0,0]=3 1996 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [0,1,0,0,1,0|1,0,0]=3 1997 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [0,1,0,0,1,0|1,0,0]=3 1998 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [0,1,0,0,1,0|1,0,0]=3 1999 B12R1.21 OC(=O)CNc1ccc(cc1)Br Amb1981434 [0,1,0,0,1,0|2,0,0]=4 2000 B12R1.21 OC(=O)CNc1ccc(cc1)C Amb1106469 [0,1,0,0,1,0|2,0,0]=4 2001 B12R1.21 OC(=O)CNc1ccc(cc1)Cl Amb1486152 [0,1,0,0,1,0|2,0,0]=4 2002 B12R1.21 OC(=O)CNc1ccc(cc1)O Amb1950558 [0,1,0,0,1,0|2,0,0]=4 2003 B12R1.21 OC(=O)COc1ccc(cc1)Cl Amb1830178 [0,1,0,0,1,0|2,0,0]=4 2004 B12R1.21 OC(=O)COc1ccc(cc1)F Amb1210357 [0,1,0,0,1,0|2,0,0]=4 2005 B12R1.21 OC(=O)COc1ccc(cc1)I Amb1152251 [0,1,0,0,1,0|2,0,0]=4 2006 B12R1.21 OC(=O)COc1ccc(cc1)N Amb1034889 [0,1,0,0,1,0|2,0,0]=4 2007 B12R1.21 OC(=O)CSc1ccc(S)cc1 Amb24341890 [0,1,0,0,1,0|2,0,0]=4 2008 B12R1.21 OC(=O)CSc1ccc(cc1)Br Amb1208368 [0,1,0,0,1,0|2,0,0]=4 2009 B12R1.21 OC(=O)CSc1ccc(cc1)C Amb1197696 [0,1,0,0,1,0|2,0,0]=4 2010 B12R1.21 OC(=O)CSc1ccc(cc1)F Amb1209262 [0,1,0,0,1,0|2,0,0]=4 2011 B12R1.21 Oc1ccc(cc1)OCC(=O)Cl Amb24467045 [0,1,0,0,1,0|2,0,0]=4 2012 B12R1.21 Oc1ccc(cc1)SCC(O)=O Amb18291566 [0,1,0,0,1,0|2,0,0]=4 2013 B12R1.21 [O-][N+](=O)CCc1ccc(F)cc1 Amb18542361 [0,1,0,0,1,0|2,0,0]=4 2014 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,1,0,0,1,0|0,0,0]=2 2015 B12R1.43 BrC(C(=O)C)Cc1ccncc1 Amb17507815 [0,1,0,0,1,0|1,0,0]=3 2016 B12R1.43 BrC(C(=O)O)C[n+]1ccccc1 Amb1030017 [0,1,0,0,1,0|2,0,0]=4 2017 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,1,0,0,1,0|1,0,0]=3 2018 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,1,0,0,1,0|1,0,0]=3 2019 B12R1.43 Br\C(=C/c1ccccc1)\C(=O)C Amb17596166 [0,1,0,0,1,0|0,0,2]=4 2020 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,1,0,0,1,0|1,0,1]=4 2021 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,1,0,0,1,0|1,0,0]=3 2022 B12R1.43 CC(=C)C(N)Cc1cc[n]cc1 Amb25779646 [0,1,0,0,1,0|2,0,0]=4 2023 B12R1.43 CC(=C)C(N)Cc1cccc[n]1 Amb24438082 [0,1,0,0,1,0|2,0,0]=4 2024 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,1,0,0,1,0|1,0,0]=3 2025 B12R1.43 CC(=O)C(=C)Oc1ccccc1 Amb25714243 [0,1,0,0,1,0|1,0,1]=4 2026 B12R1.43 CC(=O)C(=O)Cc1c[n]ccc1 Amb24556780 [0,1,0,0,1,0|1,0,1]=4 2027 B12R1.43 CC(=O)C(=O)Cc1cc[n]cc1 Amb24555440 [0,1,0,0,1,0|1,0,1]=4 2028 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,1,0,0,1,0|0,0,1]=3 2029 B12R1.43 CC(=O)C(C)Cc1cc[n]cc1 Amb25303664 [0,1,0,0,1,0|1,0,0]=3 2030 B12R1.43 CC(=O)C(C)Oc1cccc[n]1 Amb25120521 [0,1,0,0,1,0|2,0,0]=4 2031 B12R1.43 CC(=O)C(C)Sc1cc[n]cc1 Amb25792214 [0,1,0,0,1,0|2,0,0]=4 2032 B12R1.43 CC(=O)C(Cc1ccccn1)Br Amb17507813 [0,1,0,0,1,0|1,0,0]=3 2033 B12R1.43 CC(=O)C(Cc1ccccn1)Cl Amb17507767 [0,1,0,0,1,0|1,0,0]=3 2034 B12R1.43 CC(=O)C(Cc1cccnc1)Br Amb17507814 [0,1,0,0,1,0|1,0,0]=3 2035 B12R1.43 CC(=O)C(Cc1cccnc1)Cl Amb17507768 [0,1,0,0,1,0|1,0,0]=3 2036 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,1,0,0,1,0|0,0,0]=2 2037 B12R1.43 CC(=O)C(Oc1cccnc1)C Amb2407640 [0,1,0,0,1,0|2,0,0]=4 2038 B12R1.43 CC(=O)N(C)Cc1cc[n]cc1 Amb25152576 [0,1,0,0,1,0|2,0,0]=4 2039 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,1,0,0,1,0|2,0,0]=4 2040 B12R1.43 CC(=O)N(O)Cc1ccccc1 Amb25297453 [0,1,0,0,1,0|1,0,0]=3 2041 B12R1.43 CC(=O)[C@@H](C)Cc1cc[n]cc1 Amb25358977 [0,1,0,0,1,0|1,0,0]=3 2042 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,1,0,0,1,0|0,0,0]=2 2043 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [0,1,0,0,1,0|1,0,0]=3 2044 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,1,0,0,1,0|0,0,0]=2 2045 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,1,0,0,1,0|0,0,0]=2 2046 B12R1.43 CC(=O)[C@H](C)Cc1cc[n]cc1 Amb24380859 [0,1,0,0,1,0|1,0,0]=3 2047 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,1,0,0,1,0|0,0,0]=2 2048 B12R1.43 CC(=O)\C(\O)=C\c1ccccc1 Amb24456527 [0,1,0,0,1,0|0,0,2]=4 2049 B12R1.43 CC(=S)N(C)Cc1ccccc1 Amb24073637 [0,1,0,0,1,0|1,1,0]=4 2050 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,1,0,0,1,0|0,0,0]=2 2051 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [0,1,0,0,1,0|1,0,0]=3 2052 B12R1.43 CC(C(=O)Cl)Sc1ccccc1 Amb17143250 [0,1,0,0,1,0|2,0,0]=4 2053 B12R1.43 CC(C(=O)N)Sc1ccccc1 Amb10665761 [0,1,0,0,1,0|2,0,0]=4 2054 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,1,0,0,1,0|2,0,0]=4 2055 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,1,0,0,1,0|2,0,0]=4 2056 B12R1.43 CC(C(N)C)Cc1ccccc1 Amb17232438 [0,1,0,0,1,0|1,0,1]=4 2057 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,1,0,0,1,0|0,0,2]=4 2058 B12R1.43 CC(C)C(Br)Cc1ccccc1 Amb25690703 [0,1,0,0,1,0|1,0,1]=4 2059 B12R1.43 CC(C)C(Cl)Cc1ccccc1 Amb19045146 [0,1,0,0,1,0|1,0,1]=4 2060 B12R1.43 CC(Cc1ccccc1)C(C)Br Amb24751375 [0,1,0,0,1,0|1,0,1]=4 2061 B12R1.43 CC(Cc1ccccc1)C(C)Cl Amb19074260 [0,1,0,0,1,0|1,0,1]=4 2062 B12R1.43 CC(Cc1ccccc1)[N+]([O-])=O Amb17689219 [0,1,0,0,1,0|2,0,0]=4 2063 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb1086747 [0,1,0,0,1,0|2,0,0]=4 2064 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb2099764 [0,1,0,0,1,0|2,0,0]=4 2065 B12R1.43 CC(N)C(F)Cc1ccccc1 Amb25850180 [0,1,0,0,1,0|1,0,1]=4 2066 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [0,1,0,0,1,0|1,0,1]=4 2067 B12R1.43 CC(N)[C@H](O)Cc1ccccc1 Amb24389484 [0,1,0,0,1,0|1,0,1]=4 2068 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,1,0,0,1,0|0,0,2]=4 2069 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,1,0,0,1,0|0,0,2]=4 2070 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,1,0,0,1,0|0,0,2]=4 2071 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,1,0,0,1,0|0,0,2]=4 2072 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,1,0,0,1,0|0,0,2]=4 2073 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,1,0,0,1,0|0,0,2]=4 2074 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,1,0,0,1,0|2,0,0]=4 2075 B12R1.43 CN(C(=O)Cl)Cc1ccccc1 Amb17563090 [0,1,0,0,1,0|2,0,0]=4 2076 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,1,0,0,1,0|1,0,0]=3 2077 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,1,0,0,1,0|0,0,2]=4 2078 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [0,1,0,0,1,0|1,0,0]=3 2079 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [0,1,0,0,1,0|2,0,0]=4 2080 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,1,0,0,1,0|0,0,2]=4 2081 B12R1.43 C[C@@H](Cc1ccccc1)[C@H](C)Cl Amb25275062 [0,1,0,0,1,0|1,0,1]=4 2082 B12R1.43 C[C@@H](N)[C@@H](N)Cc1ccccc1 Amb24407278 [0,1,0,0,1,0|1,0,1]=4 2083 B12R1.43 C[C@@H](N)[C@@H](O)Cc1ccccc1 Amb25202137 [0,1,0,0,1,0|1,0,1]=4 2084 B12R1.43 C[C@@H](N)[C@H](O)Cc1ccccc1 Amb25258010 [0,1,0,0,1,0|1,0,1]=4 2085 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,1,0,0,1,0|2,0,0]=4 2086 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,1,0,0,1,0|0,0,2]=4 2087 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,1,0,0,1,0|0,0,2]=4 2088 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,1,0,0,1,0|0,0,2]=4 2089 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,1,0,0,1,0|2,0,0]=4 2090 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,1,0,0,1,0|1,0,0]=3 2091 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,1,0,0,1,0|0,0,2]=4 2092 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,1,0,0,1,0|0,0,2]=4 2093 B12R1.43 C[C@H](N)[C@@H](N)Cc1ccccc1 Amb25152488 [0,1,0,0,1,0|1,0,1]=4 2094 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,1,0,0,1,0|2,0,0]=4 2095 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,1,0,0,1,0|0,0,2]=4 2096 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,1,0,0,1,0|0,0,2]=4 2097 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,1,0,0,1,0|0,0,2]=4 2098 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,1,0,0,1,0|2,0,0]=4 2099 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,1,0,0,1,0|2,0,0]=4 2100 B12R1.43 C\C(=C/c1ccccc1)\C(=O)C Amb17594004 [0,1,0,0,1,0|0,0,2]=4 2101 B12R1.43 C\C(=N/c1ccccc1)\C(C)=O Amb24537849 [0,1,0,0,1,0|1,0,1]=4 2102 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,1,0,0,1,0|0,0,0]=2 2103 B12R1.43 ClC(C(=O)C)Cc1ccncc1 Amb17507769 [0,1,0,0,1,0|1,0,0]=3 2104 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [0,1,0,0,1,0|1,0,0]=3 2105 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [0,1,0,0,1,0|1,0,0]=3 2106 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,1,0,0,1,0|1,0,0]=3 2107 B12R1.43 NC(=O)C(Br)Cc1ccc[n]c1 Amb25741625 [0,1,0,0,1,0|2,0,0]=4 2108 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,1,0,0,1,0|1,0,0]=3 2109 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [0,1,0,0,1,0|1,0,0]=3 2110 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,1,0,0,1,0|1,0,0]=3 2111 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,1,0,0,1,0|2,0,0]=4 2112 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,1,0,0,1,0|1,0,0]=3 2113 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [0,1,0,0,1,0|1,0,0]=3 2114 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,1,0,0,1,0|1,0,0]=3 2115 B12R1.43 NC(=S)C(N)Cc1ccccc1 Amb25765717 [0,1,0,0,1,0|1,1,0]=4 2116 B12R1.43 NC(=S)[C@H](O)Cc1ccccc1 Amb24419006 [0,1,0,0,1,0|1,1,0]=4 2117 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,1,0,0,1,0|0,0,0]=2 2118 B12R1.43 NC(C(C)C)Cc1ccccc1 Amb17138565 [0,1,0,0,1,0|1,0,1]=4 2119 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,1,0,0,1,0|1,0,0]=3 2120 B12R1.43 NC(Cc1cc[n]cc1)C(O)=O Amb22728340 [0,1,0,0,1,0|2,0,0]=4 2121 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22301544 [0,1,0,0,1,0|2,0,0]=4 2122 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22497387 [0,1,0,0,1,0|2,0,0]=4 2123 B12R1.43 NC(Cc1cccc[n]1)C(O)=O Amb22234042 [0,1,0,0,1,0|2,0,0]=4 2124 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [0,1,0,0,1,0|1,0,0]=3 2125 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [0,1,0,0,1,0|1,0,0]=3 2126 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,1,0,0,1,0|1,0,0]=3 2127 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,1,0,0,1,0|1,0,0]=3 2128 B12R1.43 NC(Nc1ccccc1)C(=O)Cl Amb24558423 [0,1,0,0,1,0|2,0,0]=4 2129 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,1,0,0,1,0|2,0,0]=4 2130 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,1,0,0,1,0|1,0,0]=3 2131 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,1,0,0,1,0|1,0,0]=3 2132 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,1,0,0,1,0|1,0,0]=3 2133 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,1,0,0,1,0|1,0,0]=3 2134 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [0,1,0,0,1,0|1,0,0]=3 2135 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,1,0,0,1,0|1,0,0]=3 2136 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb20241997 [0,1,0,0,1,0|2,0,0]=4 2137 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb22745959 [0,1,0,0,1,0|2,0,0]=4 2138 B12R1.43 N[C@@H](Cc1ccc[n]c1)C(O)=O Amb22008701 [0,1,0,0,1,0|2,0,0]=4 2139 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,1,0,0,1,0|1,0,0]=3 2140 B12R1.43 N[C@H](Cc1cc[n]cc1)C(O)=O Amb19944301 [0,1,0,0,1,0|2,0,0]=4 2141 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb19930749 [0,1,0,0,1,0|2,0,0]=4 2142 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb22008700 [0,1,0,0,1,0|2,0,0]=4 2143 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [0,1,0,0,1,0|1,0,0]=3 2144 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,1,0,0,1,0|2,0,0]=4 2145 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [0,1,0,0,1,0|1,0,1]=4 2146 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,1,0,0,1,0|1,0,0]=3 2147 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,1,0,0,1,0|2,0,0]=4 2148 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,1,0,0,1,0|1,0,0]=3 2149 B12R1.43 OC(=O)C(Cc1ccccn1)O Amb17138619 [0,1,0,0,1,0|2,0,0]=4 2150 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,1,0,0,1,0|2,0,0]=4 2151 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,1,0,0,1,0|2,0,0]=4 2152 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,1,0,0,1,0|2,0,0]=4 2153 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,1,0,0,1,0|2,0,0]=4 2154 B12R1.43 OC(=O)C(S)Cc1cc[n]cc1 Amb18289016 [0,1,0,0,1,0|2,0,0]=4 2155 B12R1.43 OC(=O)C(S)Cc1ccc[n]c1 Amb18968269 [0,1,0,0,1,0|2,0,0]=4 2156 B12R1.43 OC(=O)C(S)Cc1cccc[n]1 Amb18289034 [0,1,0,0,1,0|2,0,0]=4 2157 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,1,0,0,1,0|1,0,0]=3 2158 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,1,0,0,1,0|1,0,0]=3 2159 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,1,0,0,1,0|1,0,0]=3 2160 B12R1.43 OC(=O)[C@H](Cc1cccnc1)N Amb16231985 [0,1,0,0,1,0|2,0,0]=4 2161 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,1,0,0,1,0|1,0,0]=3 2162 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,1,0,0,1,0|1,0,0]=3 2163 B12R1.43 OC(=O)[C@H](O)Cc1c[n]ccc1 Amb24726274 [0,1,0,0,1,0|2,0,0]=4 2164 B12R1.43 OC(=O)[C@H](O)Cc1cc[n]cc1 Amb25260488 [0,1,0,0,1,0|2,0,0]=4 2165 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,1,0,0,1,0|1,0,1]=4 2166 B12R1.43 OC(C(=O)O)Cc1ccncc1 Amb17138620 [0,1,0,0,1,0|2,0,0]=4 2167 B12R1.43 OC(C(C)C)Cc1ccccc1 Amb17138584 [0,1,0,0,1,0|1,0,1]=4 2168 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,1,0,0,1,0|1,0,0]=3 2169 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [0,1,0,0,1,0|1,0,1]=4 2170 B12R1.107 BrC(c1ccccc1)CN(C)C Amb10563751 [0,1,0,0,1,0|2,0,0]=4 2171 B12R1.107 C=C(CC(N)=O)c1ccccc1 Amb25798918 [0,1,0,0,1,0|1,0,1]=4 2172 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [0,1,0,0,1,0|1,0,1]=4 2173 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [0,1,0,0,1,0|1,0,1]=4 2174 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [0,1,0,0,1,0|1,0,1]=4 2175 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [0,1,0,0,1,0|1,0,1]=4 2176 B12R1.107 CC(=C)CC(=O)c1ccccc1 Amb18563490 [0,1,0,0,1,0|1,0,1]=4 2177 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [0,1,0,0,1,0|1,0,0]=3 2178 B12R1.107 CC(=C)CC(O)c1cc[n]cc1 Amb24439149 [0,1,0,0,1,0|2,0,0]=4 2179 B12R1.107 CC(=C)CC(O)c1ccc[n]c1 Amb25083900 [0,1,0,0,1,0|2,0,0]=4 2180 B12R1.107 CC(=C)CC(O)c1cccc[n]1 Amb25675378 [0,1,0,0,1,0|2,0,0]=4 2181 B12R1.107 CC(=C)C[C@@H](N)c1ccc[n]c1 Amb24612157 [0,1,0,0,1,0|2,0,0]=4 2182 B12R1.107 CC(=C)C[C@H](N)c1cccc[n]1 Amb24629000 [0,1,0,0,1,0|2,0,0]=4 2183 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [0,1,0,0,1,0|1,0,0]=3 2184 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [0,1,0,0,1,0|1,0,0]=3 2185 B12R1.107 CC(=O)CC(C)c1c[n]ccc1 Amb24691286 [0,1,0,0,1,0|1,0,0]=3 2186 B12R1.107 CC(=O)CC(C)c1cc[n]c[n]1 Amb24580545 [0,1,0,0,1,0|2,0,0]=4 2187 B12R1.107 CC(=O)CC(C)c1cccc[n]1 Amb24370168 [0,1,0,0,1,0|1,0,0]=3 2188 B12R1.107 CC(=O)CC(c1ccccn1)O Amb1016907 [0,1,0,0,1,0|1,0,0]=3 2189 B12R1.107 CC(=O)C[C@@H](O)c1cccc[n]1 Amb25319984 [0,1,0,0,1,0|1,0,0]=3 2190 B12R1.107 CC(=O)C[C@H](C)c1c[n]ccc1 Amb25714386 [0,1,0,0,1,0|1,0,0]=3 2191 B12R1.107 CC(=O)NC(=O)c1ccccc1 Amb24073560 [0,1,0,0,1,0|1,0,1]=4 2192 B12R1.107 CC(=O)NC(=S)c1ccccc1 Amb24073591 [0,1,0,0,1,0|1,0,1]=4 2193 B12R1.107 CC(=O)NC(C)c1cc[n]cc1 Amb25150955 [0,1,0,0,1,0|2,0,0]=4 2194 B12R1.107 CC(=O)NC(C)c1cccc[n]1 Amb25150956 [0,1,0,0,1,0|2,0,0]=4 2195 B12R1.107 CC(=O)N[C@@H](C)c1cccc[n]1 Amb25134946 [0,1,0,0,1,0|2,0,0]=4 2196 B12R1.107 CC(=O)N[C@H](C)c1cccc[n]1 Amb24659356 [0,1,0,0,1,0|2,0,0]=4 2197 B12R1.107 CC(=O)OC(=C)c1ccccc1 Amb22730633 [0,1,0,0,1,0|0,0,1]=3 2198 B12R1.107 CC(=O)OC(=O)c1ccccc1 Amb17678790 [0,1,0,0,1,0|0,0,1]=3 2199 B12R1.107 CC(=O)OC(C)c1c[n]ccc1 Amb25723772 [0,1,0,0,1,0|1,0,0]=3 2200 B12R1.107 CC(=O)O[C@@H](C)c1c[n]cc[n]1 Amb24676447 [0,1,0,0,1,0|2,0,0]=4 2201 B12R1.107 CC(=O)O[C@@H](C)c1ccccc1 Amb25144207 [0,1,0,0,1,0|0,0,0]=2 2202 B12R1.107 CC(=O)O[C@H](C)c1c[n]cc[n]1 Amb24473985 [0,1,0,0,1,0|2,0,0]=4 2203 B12R1.107 CC(=O)O[C@H](C)c1ccccc1 Amb25160190 [0,1,0,0,1,0|0,0,0]=2 2204 B12R1.107 CC(=O)\C=C(/S)\c1ccccc1 Amb25730212 [0,1,0,0,1,0|0,0,2]=4 2205 B12R1.107 CC(=O)\C=C(\N)/c1ccccc1 Amb25309296 [0,1,0,0,1,0|0,0,2]=4 2206 B12R1.107 CC(=O)\N=C(\N)/c1ccccc1 Amb25150972 [0,1,0,0,1,0|1,0,1]=4 2207 B12R1.107 CC(=S)N[C@@H](C)c1ccccc1 Amb24532689 [0,1,0,0,1,0|1,1,0]=4 2208 B12R1.107 CC(C)=CC(N)c1ccccc1 Amb24355884 [0,1,0,0,1,0|1,0,1]=4 2209 B12R1.107 CC(C)C[C@@H](Cl)c1ccccc1 Amb25667428 [0,1,0,0,1,0|1,0,1]=4 2210 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,1,0,0,1,0|1,0,1]=4 2211 B12R1.107 CC(C)C[C@@H](O)c1ccccc1 Amb25816173 [0,1,0,0,1,0|1,0,1]=4 2212 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,1,0,0,1,0|1,0,1]=4 2213 B12R1.107 CC(C)C[C@H](O)c1ccccc1 Amb24344678 [0,1,0,0,1,0|1,0,1]=4 2214 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [0,1,0,0,1,0|1,0,1]=4 2215 B12R1.107 CC(CC(N)=O)c1cc[n]cc1 Amb25724402 [0,1,0,0,1,0|2,0,0]=4 2216 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,1,0,0,1,0|1,1,0]=4 2217 B12R1.107 CC(CN(C)C)c1ccccc1 Amb22491726 [0,1,0,0,1,0|2,0,0]=4 2218 B12R1.107 CC(CN(C)C)c1ccccc1 Amb25848155 [0,1,0,0,1,0|2,0,0]=4 2219 B12R1.107 CC(CN(C)N)c1ccccc1 Amb24379493 [0,1,0,0,1,0|2,0,0]=4 2220 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [0,1,0,0,1,0|1,0,0]=3 2221 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,1,0,0,1,0|2,0,0]=4 2222 B12R1.107 CC(CS([O-])=O)c1ccccc1 Amb24385785 [0,1,0,0,1,0|2,0,0]=4 2223 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,1,0,0,1,0|1,0,1]=4 2224 B12R1.107 CC(N)C[C@@H](O)c1ccccc1 Amb25719473 [0,1,0,0,1,0|1,0,1]=4 2225 B12R1.107 CC(NC(=O)Cl)c1ccccc1 Amb25780625 [0,1,0,0,1,0|2,0,0]=4 2226 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,1,0,0,1,0|0,0,2]=4 2227 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,1,0,0,1,0|0,0,2]=4 2228 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,1,0,0,1,0|0,0,2]=4 2229 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,1,0,0,1,0|0,0,2]=4 2230 B12R1.107 CC(OC(C)=O)c1ccccn1 Amb17912737 [0,1,0,0,1,0|1,0,0]=3 2231 B12R1.107 CC(OC(C)=O)c1ccncc1 Amb17689315 [0,1,0,0,1,0|1,0,0]=3 2232 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,1,0,0,1,0|1,0,0]=3 2233 B12R1.107 CC(c1ccccc1)NC(=O)N Amb1135151 [0,1,0,0,1,0|2,0,0]=4 2234 B12R1.107 CN(C)CC(Br)c1ccccc1 Amb25055256 [0,1,0,0,1,0|2,0,0]=4 2235 B12R1.107 CN(C)CC(F)c1ccccc1 Amb24623425 [0,1,0,0,1,0|2,0,0]=4 2236 B12R1.107 CN(C)CC(N)c1ccccc1 Amb22042488 [0,1,0,0,1,0|2,0,0]=4 2237 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb22745082 [0,1,0,0,1,0|2,0,0]=4 2238 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 Amb22226504 [0,1,0,0,1,0|2,0,0]=4 2239 B12R1.107 CN(C)C[C@H](O)c1ccccc1 Amb24707113 [0,1,0,0,1,0|2,0,0]=4 2240 B12R1.107 CN(c1ccccc1)CC(=C)C Amb10571185 [0,1,0,0,1,0|2,0,0]=4 2241 B12R1.107 CN(c1ccccc1)CC(=O)Cl Amb17142999 [0,1,0,0,1,0|2,0,0]=4 2242 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [0,1,0,0,1,0|2,0,0]=4 2243 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [0,1,0,0,1,0|2,0,0]=4 2244 B12R1.107 CS(=O)CC(=O)c1ccccc1 Amb24741512 [0,1,0,0,1,0|1,0,1]=4 2245 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [0,1,0,0,1,0|1,0,0]=3 2246 B12R1.107 CS(=O)CC(O)c1cc[n]cc1 Amb25753341 [0,1,0,0,1,0|2,0,0]=4 2247 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [0,1,0,0,1,0|1,0,0]=3 2248 B12R1.107 CS(=O)C[C@@H](O)c1cc[n]cc1 Amb25333612 [0,1,0,0,1,0|2,0,0]=4 2249 B12R1.107 C[C@@H](N)C[C@@H]([O-])c1ccccc1 Amb25825094 [0,1,0,0,1,0|1,0,1]=4 2250 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [0,1,0,0,1,0|2,0,0]=4 2251 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,1,0,0,1,0|0,0,2]=4 2252 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,1,0,0,1,0|0,0,2]=4 2253 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,1,0,0,1,0|1,0,0]=3 2254 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,1,0,0,1,0|0,0,2]=4 2255 B12R1.107 C[C@H](Cl)C[C@@H](Cl)c1ccccc1 Amb25119306 [0,1,0,0,1,0|1,0,1]=4 2256 B12R1.107 C[C@H](N)C[C@@H](O)c1ccccc1 Amb25362221 [0,1,0,0,1,0|1,0,1]=4 2257 B12R1.107 C[C@H](N)C[C@H]([O-])c1ccccc1 Amb25180739 [0,1,0,0,1,0|1,0,1]=4 2258 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [0,1,0,0,1,0|2,0,0]=4 2259 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,1,0,0,1,0|0,0,2]=4 2260 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,1,0,0,1,0|0,0,2]=4 2261 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,1,0,0,1,0|0,0,2]=4 2262 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,1,0,0,1,0|0,0,2]=4 2263 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,1,0,0,1,0|0,0,2]=4 2264 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,1,0,0,1,0|1,0,0]=3 2265 B12R1.107 C\C(=C\C(C)=O)\c1ccccc1 Amb24367599 [0,1,0,0,1,0|0,0,2]=4 2266 B12R1.107 C\C(\Cl)=C\C(Cl)c1ccccc1 Amb25277290 [0,1,0,0,1,0|1,0,1]=4 2267 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [0,1,0,0,1,0|1,0,1]=4 2268 B12R1.107 ClC(c1ccccc1)CN(C)C Amb10563749 [0,1,0,0,1,0|2,0,0]=4 2269 B12R1.107 ClC(c1ccccc1)CN(C)C Amb17546791 [0,1,0,0,1,0|2,0,0]=4 2270 B12R1.107 NC(=O)CN(N)c1ccccc1 Amb25150990 [0,1,0,0,1,0|2,0,0]=4 2271 B12R1.107 NC(=O)C[C@@H](N)c1c[n]ccc1 Amb18792646 [0,1,0,0,1,0|2,0,0]=4 2272 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,1,0,0,1,0|1,0,0]=3 2273 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [0,1,0,0,1,0|1,0,0]=3 2274 B12R1.107 NC(=O)C[C@H](N)c1c[n]ccc1 Amb25137393 [0,1,0,0,1,0|2,0,0]=4 2275 B12R1.107 NC(=O)C[C@H](N)c1cccc[n]1 Amb25049883 [0,1,0,0,1,0|2,0,0]=4 2276 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [0,1,0,0,1,0|1,0,0]=3 2277 B12R1.107 NC(=O)C[P](=S)c1ccccc1 Amb24375519 [0,1,0,0,1,0|2,0,0]=4 2278 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,1,0,0,1,0|1,1,0]=4 2279 B12R1.107 NC(CC(O)=O)c1cccc[n]1 Amb22898991 [0,1,0,0,1,0|2,0,0]=4 2280 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [0,1,0,0,1,0|1,0,0]=3 2281 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [0,1,0,0,1,0|1,0,0]=3 2282 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,1,0,0,1,0|1,0,0]=3 2283 B12R1.107 NC(c1ccccc1)CC(C)C Amb1107536 [0,1,0,0,1,0|1,0,1]=4 2284 B12R1.107 NC(c1ccccc1)CN(C)C Amb1218288 [0,1,0,0,1,0|2,0,0]=4 2285 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [0,1,0,0,1,0|2,0,0]=4 2286 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb19929593 [0,1,0,0,1,0|2,0,0]=4 2287 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb20240885 [0,1,0,0,1,0|2,0,0]=4 2288 B12R1.107 N[C@@H](CC(O)=O)c1ccc[n]c1 Amb19929600 [0,1,0,0,1,0|2,0,0]=4 2289 B12R1.107 N[C@@H](CC(O)=O)c1cccc[n]1 Amb20241102 [0,1,0,0,1,0|2,0,0]=4 2290 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb19929602 [0,1,0,0,1,0|2,0,0]=4 2291 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb20241136 [0,1,0,0,1,0|2,0,0]=4 2292 B12R1.107 N[C@H](CC(O)=O)c1ccc[n]c1 Amb19929601 [0,1,0,0,1,0|2,0,0]=4 2293 B12R1.107 N[C@H](CC(O)=O)c1cccc[n]1 Amb20241101 [0,1,0,0,1,0|2,0,0]=4 2294 B12R1.107 O=C(CC(=O)[Na])c1ccccc1 Amb24364157 [0,1,0,0,1,0|1,0,1]=4 2295 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [0,1,0,0,1,0|1,0,1]=4 2296 B12R1.107 OC(=O)CC(Cl)c1cc[n]cc1 Amb18119876 [0,1,0,0,1,0|2,0,0]=4 2297 B12R1.107 OC(=O)CC(Cl)c1ccc[n]c1 Amb18119752 [0,1,0,0,1,0|2,0,0]=4 2298 B12R1.107 OC(=O)CC(Cl)c1cccc[n]1 Amb18120042 [0,1,0,0,1,0|2,0,0]=4 2299 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,1,0,0,1,0|1,0,0]=3 2300 B12R1.107 OC(=O)CC(F)c1ccc[n]c1 Amb25823686 [0,1,0,0,1,0|2,0,0]=4 2301 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,1,0,0,1,0|1,0,0]=3 2302 B12R1.107 OC(=O)CC(O)c1cc[n]cc1 Amb18563783 [0,1,0,0,1,0|2,0,0]=4 2303 B12R1.107 OC(=O)CC(O)c1cccc[n]1 Amb18563782 [0,1,0,0,1,0|2,0,0]=4 2304 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,1,0,0,1,0|1,0,0]=3 2305 B12R1.107 OC(=O)CC(c1ccccn1)Br Amb17596297 [0,1,0,0,1,0|2,0,0]=4 2306 B12R1.107 OC(=O)CC(c1cccnc1)N Amb1993735 [0,1,0,0,1,0|2,0,0]=4 2307 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [0,1,0,0,1,0|2,0,0]=4 2308 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [0,1,0,0,1,0|1,1,0]=4 2309 B12R1.107 OC(c1ccccc1)CC(C)C Amb1110402 [0,1,0,0,1,0|1,0,1]=4 2310 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,1,0,0,1,0|0,0,2]=4 2311 B12R1.107 OC(c1ccccc1)CN(C)C Amb10563753 [0,1,0,0,1,0|2,0,0]=4 2312 B12R1.107 OC(c1ccccc1)CN(C)C Amb17104281 [0,1,0,0,1,0|2,0,0]=4 2313 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [0,1,0,0,1,0|2,0,0]=4 2314 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb22491482 [0,1,0,0,1,0|1,0,1]=4 2315 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb23401058 [0,1,0,0,1,0|1,0,1]=4 2316 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb1395651 [0,1,0,0,1,0|0,0,2]=4 2317 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb2563772 [0,1,0,0,1,0|0,0,2]=4 2318 B12R1.125 CC(=C)CCc1ccc[n]c1N Amb25148822 [0,1,0,0,1,0|2,0,0]=4 2319 B12R1.125 CC(=C)CNc1ccccc1Br Amb17306219 [0,1,0,0,1,0|2,0,0]=4 2320 B12R1.125 CC(=C)CNc1ccccc1C Amb17306597 [0,1,0,0,1,0|2,0,0]=4 2321 B12R1.125 CC(=C)CNc1ccccc1Cl Amb18809688 [0,1,0,0,1,0|2,0,0]=4 2322 B12R1.125 CC(=C)CNc1ccccc1F Amb18800922 [0,1,0,0,1,0|2,0,0]=4 2323 B12R1.125 CC(=C)CNc1ccccc1N Amb24727221 [0,1,0,0,1,0|2,0,0]=4 2324 B12R1.125 CC(=C)COc1ccccc1Cl Amb25831212 [0,1,0,0,1,0|2,0,0]=4 2325 B12R1.125 CC(=C)COc1ccccc1F Amb25069154 [0,1,0,0,1,0|2,0,0]=4 2326 B12R1.125 CC(=C)COc1ccccc1I Amb24730906 [0,1,0,0,1,0|2,0,0]=4 2327 B12R1.125 CC(=C)COc1ccccc1N Amb2081551 [0,1,0,0,1,0|2,0,0]=4 2328 B12R1.125 CC(=C)CSc1ccccc1Br Amb25077720 [0,1,0,0,1,0|2,0,0]=4 2329 B12R1.125 CC(=C)CSc1ccccc1O Amb18791174 [0,1,0,0,1,0|2,0,0]=4 2330 B12R1.125 CC(=N)NCc1ccccc1Br Amb24476278 [0,1,0,0,1,0|2,0,0]=4 2331 B12R1.125 CC(=N)NCc1ccccc1F Amb25148439 [0,1,0,0,1,0|2,0,0]=4 2332 B12R1.125 CC(=O)C#Cc1ccccc1F Amb25767750 [0,1,0,0,1,0|0,0,2]=4 2333 B12R1.125 CC(=O)C=Cc1ccccc1O Amb24065680 [0,1,0,0,1,0|0,0,2]=4 2334 B12R1.125 CC(=O)CCC1=CC=CNC1=O Amb24404877 [0,1,0,0,1,0|1,0,0]=3 2335 B12R1.125 CC(=O)CCN1C=NC=CC1=O Amb25148492 [0,1,0,0,1,0|2,0,0]=4 2336 B12R1.125 CC(=O)CCc1[n]cccc1Br Amb25703295 [0,1,0,0,1,0|1,0,0]=3 2337 B12R1.125 CC(=O)CCc1[n]cccc1O Amb24537666 [0,1,0,0,1,0|1,0,0]=3 2338 B12R1.125 CC(=O)CCc1c[n]ccc1Cl Amb25044219 [0,1,0,0,1,0|1,0,0]=3 2339 B12R1.125 CC(=O)CCc1cc[n]cc1Cl Amb24678607 [0,1,0,0,1,0|1,0,0]=3 2340 B12R1.125 CC(=O)CCc1ccc[n]c1Cl Amb25731066 [0,1,0,0,1,0|1,0,0]=3 2341 B12R1.125 CC(=O)CCc1ccc[n]c1N Amb25687160 [0,1,0,0,1,0|1,0,0]=3 2342 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [0,1,0,0,1,0|0,0,0]=2 2343 B12R1.125 CC(=O)CNc1ccccc1Cl Amb24552973 [0,1,0,0,1,0|1,0,0]=3 2344 B12R1.125 CC(=O)COc1cccc[n+]1[O-] Amb25357221 [0,1,0,0,1,0|2,0,0]=4 2345 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [0,1,0,0,1,0|1,0,0]=3 2346 B12R1.125 CC(=O)COc1ccccc1Cl Amb19075143 [0,1,0,0,1,0|1,0,0]=3 2347 B12R1.125 CC(=O)COc1ccccc1I Amb25692816 [0,1,0,0,1,0|1,0,0]=3 2348 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [0,1,0,0,1,0|1,0,0]=3 2349 B12R1.125 CC(=O)COc1ccccc1O Amb18646466 [0,1,0,0,1,0|1,0,0]=3 2350 B12R1.125 CC(=O)CSc1[n]cccc1Br Amb25034656 [0,1,0,0,1,0|2,0,0]=4 2351 B12R1.125 CC(=O)CSc1[n]cccc1Cl Amb25152614 [0,1,0,0,1,0|2,0,0]=4 2352 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [0,1,0,0,1,0|1,0,0]=3 2353 B12R1.125 CC(=O)NCc1[n]cccc1F Amb25333132 [0,1,0,0,1,0|2,0,0]=4 2354 B12R1.125 CC(=O)NCc1[n]cccc1O Amb25688352 [0,1,0,0,1,0|2,0,0]=4 2355 B12R1.125 CC(=O)NCc1ccc[n]c1F Amb24458330 [0,1,0,0,1,0|2,0,0]=4 2356 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [0,1,0,0,1,0|1,0,0]=3 2357 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [0,1,0,0,1,0|1,0,0]=3 2358 B12R1.125 CC(=O)NCc1ccccc1N Amb18284299 [0,1,0,0,1,0|1,0,0]=3 2359 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [0,1,0,0,1,0|1,0,0]=3 2360 B12R1.125 CC(=O)NCc1cnccc1C Amb17778543 [0,1,0,0,1,0|2,0,0]=4 2361 B12R1.125 CC(=O)NNc1ccccc1N Amb18646313 [0,1,0,0,1,0|2,0,0]=4 2362 B12R1.125 CC(=O)OCN1C=NC=CC1=O Amb24351758 [0,1,0,0,1,0|2,0,0]=4 2363 B12R1.125 CC(=O)OCc1c[n]c[n]c1N Amb25829653 [0,1,0,0,1,0|2,0,0]=4 2364 B12R1.125 CC(=O)OCc1cc[n]cc1Br Amb25159749 [0,1,0,0,1,0|1,0,0]=3 2365 B12R1.125 CC(=O)OCc1cccc[n+]1C Amb10553787 [0,1,0,0,1,0|1,0,0]=3 2366 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [0,1,0,0,1,0|0,0,0]=2 2367 B12R1.125 CC(=O)OCc1ccccc1F Amb25788639 [0,1,0,0,1,0|0,0,0]=2 2368 B12R1.125 CC(=O)OCc1ccccc1O Amb18646465 [0,1,0,0,1,0|0,0,0]=2 2369 B12R1.125 CC(=O)SCc1ccc[n]c1N Amb24518695 [0,1,0,0,1,0|1,1,0]=4 2370 B12R1.125 CC(=O)SCc1ccccc1F Amb22231630 [0,1,0,0,1,0|0,1,0]=3 2371 B12R1.125 CC(=O)\C=C\c1ccccc1Br Amb18068027 [0,1,0,0,1,0|0,0,2]=4 2372 B12R1.125 CC(=O)\C=C\c1ccccc1C Amb17477498 [0,1,0,0,1,0|0,0,2]=4 2373 B12R1.125 CC(=O)\C=C\c1ccccc1F Amb18563599 [0,1,0,0,1,0|0,0,2]=4 2374 B12R1.125 CC(=O)\C=C\c1ccccc1O Amb1266216 [0,1,0,0,1,0|0,0,2]=4 2375 B12R1.125 CC(=O)\N=C\c1ccccc1Cl Amb24072988 [0,1,0,0,1,0|1,0,1]=4 2376 B12R1.125 CC(Br)CCc1ccccc1Br Amb24488694 [0,1,0,0,1,0|1,0,1]=4 2377 B12R1.125 CC(C)=CCc1ccccc1N Amb18645540 [0,1,0,0,1,0|1,0,1]=4 2378 B12R1.125 CC(C)=CCc1ccccc1O Amb24357144 [0,1,0,0,1,0|1,0,1]=4 2379 B12R1.125 CC(C)OCc1ccccc1Br Amb22900130 [0,1,0,0,1,0|1,0,1]=4 2380 B12R1.125 CC(CCc1ccccc1N)C Amb13951566 [0,1,0,0,1,0|1,0,1]=4 2381 B12R1.125 CC(CCc1ccccc1O)N Amb17507315 [0,1,0,0,1,0|1,0,1]=4 2382 B12R1.125 CC(CCc1ccccc1O)O Amb17507249 [0,1,0,0,1,0|0,0,2]=4 2383 B12R1.125 CC(Cl)CCc1ccccc1Br Amb24488697 [0,1,0,0,1,0|1,0,1]=4 2384 B12R1.125 CC(Cl)CCc1ccccc1F Amb19076400 [0,1,0,0,1,0|1,0,1]=4 2385 B12R1.125 CC(F)CCc1ccccc1N Amb25212968 [0,1,0,0,1,0|1,0,1]=4 2386 B12R1.125 CC(N)CCc1ccccc1N Amb18646140 [0,1,0,0,1,0|1,0,1]=4 2387 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [0,1,0,0,1,0|0,0,2]=4 2388 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [0,1,0,0,1,0|0,0,2]=4 2389 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [0,1,0,0,1,0|0,0,2]=4 2390 B12R1.125 CC(O)CCc1ccccc1N Amb24485690 [0,1,0,0,1,0|0,0,2]=4 2391 B12R1.125 CC(OCc1ccccc1O)C Amb10560039 [0,1,0,0,1,0|1,0,1]=4 2392 B12R1.125 CN(C)CCc1ccccc1Br Amb25795341 [0,1,0,0,1,0|2,0,0]=4 2393 B12R1.125 CN(C)CCc1ccccc1O Amb25066330 [0,1,0,0,1,0|2,0,0]=4 2394 B12R1.125 CN(N)CCc1ccccc1Cl Amb18564316 [0,1,0,0,1,0|2,0,0]=4 2395 B12R1.125 CN(N)CCc1ccccc1F Amb18563850 [0,1,0,0,1,0|2,0,0]=4 2396 B12R1.125 CS(=O)CCN1C=CC=CC1=O Amb24592911 [0,1,0,0,1,0|2,0,0]=4 2397 B12R1.125 CS(=O)CCc1ccccc1N Amb18299124 [0,1,0,0,1,0|1,0,0]=3 2398 B12R1.125 CS(=O)NCc1ccccc1N Amb24600929 [0,1,0,0,1,0|2,0,0]=4 2399 B12R1.125 CS(=O)NCc1ccccc1O Amb24589168 [0,1,0,0,1,0|2,0,0]=4 2400 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb24117939 [0,1,0,0,1,0|1,0,1]=4 2401 B12R1.125 C[C@H](N)CCc1ccccc1Cl Amb24470862 [0,1,0,0,1,0|1,0,1]=4 2402 B12R1.125 C[C@H](N)CCc1ccccc1O Amb25149919 [0,1,0,0,1,0|1,0,1]=4 2403 B12R1.125 C\C(\Cl)=C\Cc1ccccc1O Amb24614705 [0,1,0,0,1,0|1,0,1]=4 2404 B12R1.125 C\C(\N)=N\Cc1ccccc1O Amb24734749 [0,1,0,0,1,0|2,0,0]=4 2405 B12R1.125 Cc1[n]cccc1CCC(C)=O Amb25859556 [0,1,0,0,1,0|1,0,0]=3 2406 B12R1.125 Cc1[n]cccc1CCC(O)=O Amb18853387 [0,1,0,0,1,0|2,0,0]=4 2407 B12R1.125 Cc1[n]cccc1COC(C)=O Amb22750508 [0,1,0,0,1,0|1,0,0]=3 2408 B12R1.125 Cc1cc[n]cc1CCC(O)=O Amb18828438 [0,1,0,0,1,0|2,0,0]=4 2409 B12R1.125 Cc1ccc[n]c1CNC(C)=O Amb22584206 [0,1,0,0,1,0|2,0,0]=4 2410 B12R1.125 Cc1ccc[n]c1COC(C)=O Amb24063548 [0,1,0,0,1,0|1,0,0]=3 2411 B12R1.125 Cc1ccc[n]c1SCC(C)=O Amb25136842 [0,1,0,0,1,0|2,0,0]=4 2412 B12R1.125 Cc1cccc[n+]1CCC(O)=O Amb24410939 [0,1,0,0,1,0|2,0,0]=4 2413 B12R1.125 Cc1ccccc1C#CC(C)=O Amb23438225 [0,1,0,0,1,0|0,0,2]=4 2414 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [0,1,0,0,1,0|1,0,0]=3 2415 B12R1.125 Cc1ccccc1CCC(C)Cl Amb19074258 [0,1,0,0,1,0|1,0,1]=4 2416 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [0,1,0,0,1,0|0,0,2]=4 2417 B12R1.125 Cc1ccccc1CCC(N)=N Amb18065464 [0,1,0,0,1,0|2,0,0]=4 2418 B12R1.125 Cc1ccccc1CCN(C)N Amb18563651 [0,1,0,0,1,0|2,0,0]=4 2419 B12R1.125 Cc1ccccc1CNC(C)=N Amb25780309 [0,1,0,0,1,0|2,0,0]=4 2420 B12R1.125 Cc1ccccc1CNC(C)=O Amb24721874 [0,1,0,0,1,0|1,0,0]=3 2421 B12R1.125 Cc1ccccc1CNC(N)=O Amb18800799 [0,1,0,0,1,0|2,0,0]=4 2422 B12R1.125 Cc1ccccc1COC(N)=O Amb25152446 [0,1,0,0,1,0|1,0,0]=3 2423 B12R1.125 Cc1ccccc1CSC(C)=O Amb22231631 [0,1,0,0,1,0|0,1,0]=3 2424 B12R1.125 Cc1ccccc1NCC(C)=O Amb25062983 [0,1,0,0,1,0|1,0,0]=3 2425 B12R1.125 Cc1ccccc1SCC(C)=O Amb18796318 [0,1,0,0,1,0|1,0,0]=3 2426 B12R1.125 ClC(=O)CCc1ccccc1F Amb10838958 [0,1,0,0,1,0|1,0,0]=3 2427 B12R1.125 ClC(=O)COc1ccccc1Br Amb16230053 [0,1,0,0,1,0|2,0,0]=4 2428 B12R1.125 ClC(=O)COc1ccccc1C Amb10880009 [0,1,0,0,1,0|2,0,0]=4 2429 B12R1.125 ClC(=O)COc1ccccc1Cl Amb16230049 [0,1,0,0,1,0|2,0,0]=4 2430 B12R1.125 ClC(=O)COc1ccccc1F Amb10880012 [0,1,0,0,1,0|2,0,0]=4 2431 B12R1.125 ClC(=O)CSc1ccccc1C Amb17143248 [0,1,0,0,1,0|2,0,0]=4 2432 B12R1.125 ClC(=O)CSc1ccccc1Cl Amb17143819 [0,1,0,0,1,0|2,0,0]=4 2433 B12R1.125 NC(=N)CCc1ccccc1Br Amb18070244 [0,1,0,0,1,0|2,0,0]=4 2434 B12R1.125 NC(=N)CCc1ccccc1Cl Amb10844871 [0,1,0,0,1,0|2,0,0]=4 2435 B12R1.125 NC(=N)CCc1ccccc1F Amb18563718 [0,1,0,0,1,0|2,0,0]=4 2436 B12R1.125 NC(=O)CCc1[n]cccc1O Amb25760722 [0,1,0,0,1,0|2,0,0]=4 2437 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [0,1,0,0,1,0|1,0,0]=3 2438 B12R1.125 NC(=O)CCc1ccccc1C Amb17400134 [0,1,0,0,1,0|1,0,0]=3 2439 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [0,1,0,0,1,0|1,0,0]=3 2440 B12R1.125 NC(=O)CNc1ccccc1I Amb142128 [0,1,0,0,1,0|2,0,0]=4 2441 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,1,0,0,1,0|2,0,0]=4 2442 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [0,1,0,0,1,0|2,0,0]=4 2443 B12R1.125 NC(=O)CSc1ccccc1Br Amb10189178 [0,1,0,0,1,0|2,0,0]=4 2444 B12R1.125 NC(=O)CSc1ccccc1N Amb1215630 [0,1,0,0,1,0|2,0,0]=4 2445 B12R1.125 NC(=O)CSc1ccccc1O Amb19045199 [0,1,0,0,1,0|2,0,0]=4 2446 B12R1.125 NC(=O)NCc1ccccc1Cl Amb2435051 [0,1,0,0,1,0|2,0,0]=4 2447 B12R1.125 NC(=O)NCc1ccccc1F Amb1141051 [0,1,0,0,1,0|2,0,0]=4 2448 B12R1.125 NC(=S)CCc1ccccc1F Amb17234010 [0,1,0,0,1,0|1,1,0]=4 2449 B12R1.125 Nc1[n]cccc1CCC(O)=O Amb25124989 [0,1,0,0,1,0|2,0,0]=4 2450 B12R1.125 Nc1cc[n]cc1CCC(O)=O Amb24375593 [0,1,0,0,1,0|2,0,0]=4 2451 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [0,1,0,0,1,0|1,0,0]=3 2452 B12R1.125 Nc1ccccc1CNC(N)=O Amb18957838 [0,1,0,0,1,0|2,0,0]=4 2453 B12R1.125 Nc1ccccc1NCC(O)=O Amb18296519 [0,1,0,0,1,0|2,0,0]=4 2454 B12R1.125 Nc1ccccc1OCC([O-])=O Amb21972214 [0,1,0,0,1,0|2,0,0]=4 2455 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [0,1,0,0,1,0|1,0,0]=3 2456 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [0,1,0,0,1,0|1,0,0]=3 2457 B12R1.125 O=C(Cl)OCc1ccccc1Br Amb20620406 [0,1,0,0,1,0|1,0,0]=3 2458 B12R1.125 O=C(Cl)OCc1ccccc1Cl Amb21618686 [0,1,0,0,1,0|1,0,0]=3 2459 B12R1.125 O=C(Cl)OCc1ccccc1F Amb25039104 [0,1,0,0,1,0|1,0,0]=3 2460 B12R1.125 OC(=O)CCC1=CC=CNC1=O Amb18262602 [0,1,0,0,1,0|2,0,0]=4 2461 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb18534261 [0,1,0,0,1,0|2,0,0]=4 2462 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb21955606 [0,1,0,0,1,0|2,0,0]=4 2463 B12R1.125 OC(=O)CCc1[n]cccc1F Amb25311377 [0,1,0,0,1,0|2,0,0]=4 2464 B12R1.125 OC(=O)CCc1c[n]ccc1Br Amb25253329 [0,1,0,0,1,0|2,0,0]=4 2465 B12R1.125 OC(=O)CCc1c[n]ccc1Cl Amb25270751 [0,1,0,0,1,0|2,0,0]=4 2466 B12R1.125 OC(=O)CCc1cc[n]cc1Cl Amb23596515 [0,1,0,0,1,0|2,0,0]=4 2467 B12R1.125 OC(=O)CCc1ccc[n]c1Br Amb24525068 [0,1,0,0,1,0|2,0,0]=4 2468 B12R1.125 OC(=O)CCc1ccc[n]c1Cl Amb24484270 [0,1,0,0,1,0|2,0,0]=4 2469 B12R1.125 OC(=O)CCc1ccc[n]c1F Amb25295347 [0,1,0,0,1,0|2,0,0]=4 2470 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [0,1,0,0,1,0|1,0,0]=3 2471 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [0,1,0,0,1,0|1,0,0]=3 2472 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [0,1,0,0,1,0|1,0,0]=3 2473 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [0,1,0,0,1,0|1,0,0]=3 2474 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [0,1,0,0,1,0|1,0,0]=3 2475 B12R1.125 OC(=O)CCn1ccccc1=O Amb1124605 [0,1,0,0,1,0|2,0,0]=4 2476 B12R1.125 OC(=O)CNc1ccccc1C Amb1258286 [0,1,0,0,1,0|2,0,0]=4 2477 B12R1.125 OC(=O)CNc1ccccc1S Amb25124141 [0,1,0,0,1,0|2,0,0]=4 2478 B12R1.125 OC(=O)COc1ccccc1C Amb1215022 [0,1,0,0,1,0|2,0,0]=4 2479 B12R1.125 OC(=O)COc1ccccc1O Amb1030005 [0,1,0,0,1,0|2,0,0]=4 2480 B12R1.125 OC(=O)CSc1ccccc1Br Amb1113386 [0,1,0,0,1,0|2,0,0]=4 2481 B12R1.125 OC(=O)CSc1ccccc1C Amb1205492 [0,1,0,0,1,0|2,0,0]=4 2482 B12R1.125 OC(=O)CSc1ccccc1Cl Amb1105912 [0,1,0,0,1,0|2,0,0]=4 2483 B12R1.125 OC(=O)CSc1ccccc1F Amb1105913 [0,1,0,0,1,0|2,0,0]=4 2484 B12R1.125 Oc1ccccc1CCC(=O)Cl Amb25808033 [0,1,0,0,1,0|1,0,0]=3 2485 B12R1.125 Oc1ccccc1SCC(O)=O Amb18294823 [0,1,0,0,1,0|2,0,0]=4 2486 B12R1.125 [O-]C(=O)COc1ccccc1O Amb10789357 [0,1,0,0,1,0|2,0,0]=4 2487 B12R1.125 [O-][N+](=O)CCc1ccccc1C Amb17400176 [0,1,0,0,1,0|2,0,0]=4 2488 B12R1.125 [O-][N+](=O)CCc1ccccc1Cl Amb17401072 [0,1,0,0,1,0|2,0,0]=4 2489 B12R1.125 [O-][N+](=O)CCc1ccccc1F Amb17400297 [0,1,0,0,1,0|2,0,0]=4 2490 B12R1.226 CC(=C)CNc1cccc(N)c1 Amb24390135 [0,1,0,0,1,0|2,0,0]=4 2491 B12R1.226 CC(=C)CNc1cccc(c1)Br Amb17306224 [0,1,0,0,1,0|2,0,0]=4 2492 B12R1.226 CC(=C)CNc1cccc(c1)C Amb17306564 [0,1,0,0,1,0|2,0,0]=4 2493 B12R1.226 CC(=C)CNc1cccc(c1)Cl Amb17307143 [0,1,0,0,1,0|2,0,0]=4 2494 B12R1.226 CC(=C)CNc1cccc(c1)F Amb17306245 [0,1,0,0,1,0|2,0,0]=4 2495 B12R1.226 CC(=C)COc1cccc(Cl)c1 Amb24409848 [0,1,0,0,1,0|2,0,0]=4 2496 B12R1.226 CC(=C)COc1cccc(I)c1 Amb24582646 [0,1,0,0,1,0|2,0,0]=4 2497 B12R1.226 CC(=C)COc1cccc(c1)N Amb2081546 [0,1,0,0,1,0|2,0,0]=4 2498 B12R1.226 CC(=C)CSc1cccc(Cl)c1 Amb24355077 [0,1,0,0,1,0|2,0,0]=4 2499 B12R1.226 CC(=N)NCc1cccc(Cl)c1 Amb24632269 [0,1,0,0,1,0|2,0,0]=4 2500 B12R1.226 CC(=N)NCc1cccc(F)c1 Amb25799323 [0,1,0,0,1,0|2,0,0]=4 2501 B12R1.226 CC(=O)C=Cc1cccc(O)c1 Amb24094413 [0,1,0,0,1,0|0,0,2]=4 2502 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl Amb10808067 [0,1,0,0,1,0|0,0,2]=4 2503 B12R1.226 CC(=O)CCc1c[n]cc(F)c1 Amb25034788 [0,1,0,0,1,0|1,0,0]=3 2504 B12R1.226 CC(=O)CCc1cc[n]c(N)[n]1 Amb25174408 [0,1,0,0,1,0|2,0,0]=4 2505 B12R1.226 CC(=O)CCc1cccc(O)[n]1 Amb24605336 [0,1,0,0,1,0|1,0,0]=3 2506 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [0,1,0,0,1,0|0,0,0]=2 2507 B12R1.226 CC(=O)CNc1cccc(Cl)c1 Amb24626052 [0,1,0,0,1,0|1,0,0]=3 2508 B12R1.226 CC(=O)COC1=CC(=O)NC=C1 Amb25734509 [0,1,0,0,1,0|2,0,0]=4 2509 B12R1.226 CC(=O)COc1c[n]cc(Br)c1 Amb24386347 [0,1,0,0,1,0|2,0,0]=4 2510 B12R1.226 CC(=O)COc1c[n]cc(Cl)c1 Amb25152535 [0,1,0,0,1,0|2,0,0]=4 2511 B12R1.226 CC(=O)COc1cccc(Cl)c1 Amb19075144 [0,1,0,0,1,0|1,0,0]=3 2512 B12R1.226 CC(=O)COc1cccc(O)c1 Amb25053053 [0,1,0,0,1,0|1,0,0]=3 2513 B12R1.226 CC(=O)COc1cccc(c1)Br Amb17226706 [0,1,0,0,1,0|1,0,0]=3 2514 B12R1.226 CC(=O)COc1cccc(c1)N Amb17110084 [0,1,0,0,1,0|1,0,0]=3 2515 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [0,1,0,0,1,0|1,0,0]=3 2516 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [0,1,0,0,1,0|1,0,0]=3 2517 B12R1.226 CC(=O)NCC1=CC(=O)NC=C1 Amb25227214 [0,1,0,0,1,0|2,0,0]=4 2518 B12R1.226 CC(=O)NCC1=CC=CC(=O)N1 Amb25256952 [0,1,0,0,1,0|2,0,0]=4 2519 B12R1.226 CC(=O)NCc1c[n]cc(Br)c1 Amb22276859 [0,1,0,0,1,0|2,0,0]=4 2520 B12R1.226 CC(=O)NCc1cc[n]c(Cl)c1 Amb24072881 [0,1,0,0,1,0|2,0,0]=4 2521 B12R1.226 CC(=O)NCc1cccc(Cl)[n]1 Amb25734187 [0,1,0,0,1,0|2,0,0]=4 2522 B12R1.226 CC(=O)NCc1cccc(I)c1 Amb25148829 [0,1,0,0,1,0|1,0,0]=3 2523 B12R1.226 CC(=O)NCc1cccc(N)c1 Amb18286659 [0,1,0,0,1,0|1,0,0]=3 2524 B12R1.226 CC(=O)NCc1cccc(O)c1 Amb18792630 [0,1,0,0,1,0|1,0,0]=3 2525 B12R1.226 CC(=O)NCc1cccc(c1)Br Amb2085743 [0,1,0,0,1,0|1,0,0]=3 2526 B12R1.226 CC(=O)NCc1cccc(c1)Cl Amb2023612 [0,1,0,0,1,0|1,0,0]=3 2527 B12R1.226 CC(=O)NCc1cccc(n1)N Amb13890642 [0,1,0,0,1,0|2,0,0]=4 2528 B12R1.226 CC(=O)NNc1cc(F)ccc1 Amb25036298 [0,1,0,0,1,0|2,0,0]=4 2529 B12R1.226 CC(=O)OCc1c[n](=O)ccc1 Amb20247038 [0,1,0,0,1,0|1,0,0]=3 2530 B12R1.226 CC(=O)OCc1cc(Br)ccn1 Amb10603159 [0,1,0,0,1,0|1,0,0]=3 2531 B12R1.226 CC(=O)OCc1cc(I)cc[n]1 Amb24063673 [0,1,0,0,1,0|1,0,0]=3 2532 B12R1.226 CC(=O)OCc1cccc(Br)c1 Amb25099120 [0,1,0,0,1,0|0,0,0]=2 2533 B12R1.226 CC(=O)OCc1cccc(Cl)[n]1 Amb25710369 [0,1,0,0,1,0|1,0,0]=3 2534 B12R1.226 CC(=O)OCc1cccc(Cl)c1 Amb25306228 [0,1,0,0,1,0|0,0,0]=2 2535 B12R1.226 CC(=O)OCc1cccc(F)c1 Amb25145061 [0,1,0,0,1,0|0,0,0]=2 2536 B12R1.226 CC(=O)OCc1cccc(N)c1 Amb22229178 [0,1,0,0,1,0|0,0,0]=2 2537 B12R1.226 CC(=O)OCc1cccc(c1)C Amb10601899 [0,1,0,0,1,0|0,0,0]=2 2538 B12R1.226 CC(=O)OCc1cccc(n1)C Amb10573711 [0,1,0,0,1,0|1,0,0]=3 2539 B12R1.226 CC(=O)SCc1cc[n]c(N)c1 Amb25793643 [0,1,0,0,1,0|1,1,0]=4 2540 B12R1.226 CC(=O)SCc1cccc(Cl)c1 Amb22231632 [0,1,0,0,1,0|0,1,0]=3 2541 B12R1.226 CC(=O)SCc1cccc(F)c1 Amb22231633 [0,1,0,0,1,0|0,1,0]=3 2542 B12R1.226 CC(=O)\C=C\c1cccc(F)c1 Amb18563600 [0,1,0,0,1,0|0,0,2]=4 2543 B12R1.226 CC(=O)\C=C\c1cccc(N)c1 Amb23247751 [0,1,0,0,1,0|0,0,2]=4 2544 B12R1.226 CC(=O)\C=C\c1cccc(c1)Br Amb10601440 [0,1,0,0,1,0|0,0,2]=4 2545 B12R1.226 CC(=O)\C=C\c1cccc(c1)C Amb17477497 [0,1,0,0,1,0|0,0,2]=4 2546 B12R1.226 CC(=O)\C=C\c1cccc(c1)O Amb17615740 [0,1,0,0,1,0|0,0,2]=4 2547 B12R1.226 CC(Br)CCc1cc(Br)ccc1 Amb24488695 [0,1,0,0,1,0|1,0,1]=4 2548 B12R1.226 CC(Br)CCc1cccc(F)c1 Amb24366969 [0,1,0,0,1,0|1,0,1]=4 2549 B12R1.226 CC(Br)CCc1cccc(O)c1 Amb25765194 [0,1,0,0,1,0|1,0,1]=4 2550 B12R1.226 CC(C)=CCc1cccc(O)c1 Amb24341888 [0,1,0,0,1,0|1,0,1]=4 2551 B12R1.226 CC(C)OCc1cccc(Br)c1 Amb22058979 [0,1,0,0,1,0|1,0,1]=4 2552 B12R1.226 CC(C)OCc1cccc(O)c1 Amb23443320 [0,1,0,0,1,0|1,0,1]=4 2553 B12R1.226 CC(CCc1cccc(c1)C)O Amb17507253 [0,1,0,0,1,0|0,0,2]=4 2554 B12R1.226 CC(Cl)CCc1cccc(F)c1 Amb19076401 [0,1,0,0,1,0|1,0,1]=4 2555 B12R1.226 CC(F)CCc1cccc(N)c1 Amb24610510 [0,1,0,0,1,0|1,0,1]=4 2556 B12R1.226 CC(N)CCc1cc(N)ccc1 Amb24424070 [0,1,0,0,1,0|1,0,1]=4 2557 B12R1.226 CC(N)CCc1cccc(I)c1 Amb25281897 [0,1,0,0,1,0|1,0,1]=4 2558 B12R1.226 CC(N)CCc1cccc(O)c1 Amb18828241 [0,1,0,0,1,0|1,0,1]=4 2559 B12R1.226 CC(O)CCc1cc(O)ccc1 Amb25251886 [0,1,0,0,1,0|0,0,2]=4 2560 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [0,1,0,0,1,0|0,0,2]=4 2561 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [0,1,0,0,1,0|0,0,2]=4 2562 B12R1.226 CN(C)CCc1cccc(O)c1 Amb17942808 [0,1,0,0,1,0|2,0,0]=4 2563 B12R1.226 CN(CCc1cccc(c1)N)C Amb17050647 [0,1,0,0,1,0|2,0,0]=4 2564 B12R1.226 CN(N)CCc1cccc(Br)c1 Amb18571910 [0,1,0,0,1,0|2,0,0]=4 2565 B12R1.226 CN(N)CCc1cccc(Cl)c1 Amb18564317 [0,1,0,0,1,0|2,0,0]=4 2566 B12R1.226 CS(=O)NCc1cccc(O)c1 Amb24582944 [0,1,0,0,1,0|2,0,0]=4 2567 B12R1.226 C[C@H](N)CCc1cccc(Br)c1 Amb24683805 [0,1,0,0,1,0|1,0,1]=4 2568 B12R1.226 Cc1c[n]cc(COC(C)=O)[n]1 Amb24485579 [0,1,0,0,1,0|2,0,0]=4 2569 B12R1.226 Cc1c[n]cc(COC(C)=O)c1 Amb24448150 [0,1,0,0,1,0|1,0,0]=3 2570 B12R1.226 Cc1cc(CCC(=O)Cl)ccc1 Amb18325287 [0,1,0,0,1,0|1,0,0]=3 2571 B12R1.226 Cc1cc(CCC(C)=O)[n]c[n]1 Amb24566550 [0,1,0,0,1,0|2,0,0]=4 2572 B12R1.226 Cc1cc(CCC(C)=O)cc[n]1 Amb24677051 [0,1,0,0,1,0|1,0,0]=3 2573 B12R1.226 Cc1cc(CCC(N)=N)ccc1 Amb18065465 [0,1,0,0,1,0|2,0,0]=4 2574 B12R1.226 Cc1cc(CCC(N)=O)[n]cc1 Amb25858570 [0,1,0,0,1,0|2,0,0]=4 2575 B12R1.226 Cc1cc(CCC(O)=O)[n]cc1 Amb18828439 [0,1,0,0,1,0|2,0,0]=4 2576 B12R1.226 Cc1cc(CCC(O)=O)c[n]c1 Amb22886573 [0,1,0,0,1,0|2,0,0]=4 2577 B12R1.226 Cc1cc(CCC(O)=O)cc[n]1 Amb22886572 [0,1,0,0,1,0|2,0,0]=4 2578 B12R1.226 Cc1cc(CNC(N)=O)ccc1 Amb18798292 [0,1,0,0,1,0|2,0,0]=4 2579 B12R1.226 Cc1cc(COC(C)=O)cc[n]1 Amb24487151 [0,1,0,0,1,0|1,0,0]=3 2580 B12R1.226 Cc1cc[n]c(COC(C)=O)[n]1 Amb24183819 [0,1,0,0,1,0|2,0,0]=4 2581 B12R1.226 Cc1cc[n]c(COC(C)=O)c1 Amb22490556 [0,1,0,0,1,0|1,0,0]=3 2582 B12R1.226 Cc1cccc(CCC(C)Br)c1 Amb25723537 [0,1,0,0,1,0|1,0,1]=4 2583 B12R1.226 Cc1cccc(CCC(C)Cl)c1 Amb18321700 [0,1,0,0,1,0|1,0,1]=4 2584 B12R1.226 Cc1cccc(CCN(C)N)c1 Amb18563652 [0,1,0,0,1,0|2,0,0]=4 2585 B12R1.226 Cc1cccc(CC[C@H](C)N)c1 Amb24682488 [0,1,0,0,1,0|1,0,1]=4 2586 B12R1.226 Cc1cccc(CSC(C)=O)[n]1 Amb25128176 [0,1,0,0,1,0|1,1,0]=4 2587 B12R1.226 Cc1cccc(c1)NCC(C)=O Amb25831083 [0,1,0,0,1,0|1,0,0]=3 2588 B12R1.226 Cc1cccc(c1)SCC(C)=O Amb18791171 [0,1,0,0,1,0|1,0,0]=3 2589 B12R1.226 ClC(=O)COc1cccc(c1)Br Amb16230149 [0,1,0,0,1,0|2,0,0]=4 2590 B12R1.226 ClC(=O)COc1cccc(c1)C Amb10880010 [0,1,0,0,1,0|2,0,0]=4 2591 B12R1.226 ClC(=O)CSc1cccc(c1)C Amb17143249 [0,1,0,0,1,0|2,0,0]=4 2592 B12R1.226 ClC(=O)CSc1cccc(c1)Cl Amb17143820 [0,1,0,0,1,0|2,0,0]=4 2593 B12R1.226 NC(=N)CCc1cccc(Br)c1 Amb18571443 [0,1,0,0,1,0|2,0,0]=4 2594 B12R1.226 NC(=N)CCc1cccc(Cl)c1 Amb18564230 [0,1,0,0,1,0|2,0,0]=4 2595 B12R1.226 NC(=N)CCc1cccc(F)c1 Amb18563720 [0,1,0,0,1,0|2,0,0]=4 2596 B12R1.226 NC(=O)CCc1c[n]cc(F)c1 Amb25821158 [0,1,0,0,1,0|2,0,0]=4 2597 B12R1.226 NC(=O)CCc1c[n]cc(O)c1 Amb25833308 [0,1,0,0,1,0|2,0,0]=4 2598 B12R1.226 NC(=O)CCc1cc(Br)cc[n]1 Amb24671371 [0,1,0,0,1,0|2,0,0]=4 2599 B12R1.226 NC(=O)CCc1cc(Cl)cc[n]1 Amb25046525 [0,1,0,0,1,0|2,0,0]=4 2600 B12R1.226 NC(=O)CCc1cccc(c1)C Amb17400135 [0,1,0,0,1,0|1,0,0]=3 2601 B12R1.226 NC(=O)CCc1cccc(c1)Cl Amb17400995 [0,1,0,0,1,0|1,0,0]=3 2602 B12R1.226 NC(=O)CNc1cccc(c1)Br Amb143565 [0,1,0,0,1,0|2,0,0]=4 2603 B12R1.226 NC(=O)COc1cccc(c1)Br Amb192032 [0,1,0,0,1,0|2,0,0]=4 2604 B12R1.226 NC(=O)COc1cccc(c1)I Amb181273 [0,1,0,0,1,0|2,0,0]=4 2605 B12R1.226 NC(=O)COc1cccc(c1)N Amb1112358 [0,1,0,0,1,0|2,0,0]=4 2606 B12R1.226 NC(=O)CSc1cccc(Br)c1 Amb25726747 [0,1,0,0,1,0|2,0,0]=4 2607 B12R1.226 NC(=O)CSc1cccc(F)c1 Amb25784013 [0,1,0,0,1,0|2,0,0]=4 2608 B12R1.226 NC(=O)CSc1cccc(O)c1 Amb25102367 [0,1,0,0,1,0|2,0,0]=4 2609 B12R1.226 NC(=O)CSc1cccc(c1)C Amb17142988 [0,1,0,0,1,0|2,0,0]=4 2610 B12R1.226 NC(=O)CSc1cccc(c1)Cl Amb17143258 [0,1,0,0,1,0|2,0,0]=4 2611 B12R1.226 NC(=O)NCc1cccc(O)c1 Amb18792735 [0,1,0,0,1,0|2,0,0]=4 2612 B12R1.226 NC(=O)NCc1cccc(c1)Cl Amb2440664 [0,1,0,0,1,0|2,0,0]=4 2613 B12R1.226 Nc1cc(CCC(O)=O)c[n]c1 Amb25760281 [0,1,0,0,1,0|2,0,0]=4 2614 B12R1.226 Nc1cc(CCC(O)=O)cc[n]1 Amb24105413 [0,1,0,0,1,0|2,0,0]=4 2615 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22408735 [0,1,0,0,1,0|1,0,0]=3 2616 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22757721 [0,1,0,0,1,0|1,0,0]=3 2617 B12R1.226 Nc1cc(ccc1)NCC(O)=O Amb18987711 [0,1,0,0,1,0|2,0,0]=4 2618 B12R1.226 Nc1cc(ccc1)SCC(O)=O Amb25700944 [0,1,0,0,1,0|2,0,0]=4 2619 B12R1.226 Nc1cccc(CNC(N)=O)c1 Amb18962222 [0,1,0,0,1,0|2,0,0]=4 2620 B12R1.226 O=C(Cl)CCc1cc(Cl)ccc1 Amb24403345 [0,1,0,0,1,0|1,0,0]=3 2621 B12R1.226 O=C(Cl)CCc1cccc(Br)c1 Amb25150110 [0,1,0,0,1,0|1,0,0]=3 2622 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [0,1,0,0,1,0|1,0,0]=3 2623 B12R1.226 O=C(Cl)OCc1cccc(Br)c1 Amb24649567 [0,1,0,0,1,0|1,0,0]=3 2624 B12R1.226 OC(=O)CCC1=CC(=O)C=CN1 Amb25230528 [0,1,0,0,1,0|2,0,0]=4 2625 B12R1.226 OC(=O)CCc1c[n]cc(Cl)c1 Amb25689846 [0,1,0,0,1,0|2,0,0]=4 2626 B12R1.226 OC(=O)CCc1c[n]cc(F)c1 Amb23450303 [0,1,0,0,1,0|2,0,0]=4 2627 B12R1.226 OC(=O)CCc1cc(F)cc[n]1 Amb22886576 [0,1,0,0,1,0|2,0,0]=4 2628 B12R1.226 OC(=O)CCc1cc[n]c(Br)c1 Amb24418909 [0,1,0,0,1,0|2,0,0]=4 2629 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [0,1,0,0,1,0|1,0,0]=3 2630 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [0,1,0,0,1,0|1,0,0]=3 2631 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [0,1,0,0,1,0|1,0,0]=3 2632 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [0,1,0,0,1,0|1,0,0]=3 2633 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [0,1,0,0,1,0|1,0,0]=3 2634 B12R1.226 OC(=O)CNc1cccc(F)c1 Amb19341704 [0,1,0,0,1,0|2,0,0]=4 2635 B12R1.226 OC(=O)CNc1cccc(c1)Cl Amb10609174 [0,1,0,0,1,0|2,0,0]=4 2636 B12R1.226 OC(=O)COc1cccc(c1)Cl Amb1211231 [0,1,0,0,1,0|2,0,0]=4 2637 B12R1.226 OC(=O)COc1cccc(c1)F Amb1102803 [0,1,0,0,1,0|2,0,0]=4 2638 B12R1.226 OC(=O)CSc1cccc(F)c1 Amb19887452 [0,1,0,0,1,0|2,0,0]=4 2639 B12R1.226 OC(=O)CSc1cccc(c1)Br Amb2372547 [0,1,0,0,1,0|2,0,0]=4 2640 B12R1.226 Oc1c[n]cc(CCC(O)=O)c1 Amb24435210 [0,1,0,0,1,0|2,0,0]=4 2641 B12R1.226 Oc1cc(CCC(=O)Cl)ccc1 Amb25356247 [0,1,0,0,1,0|1,0,0]=3 2642 B12R1.226 [O-][N+](=O)CCc1cccc(O)c1 Amb25141958 [0,1,0,0,1,0|2,0,0]=4 2643 B12R1.226 [O-][N+](=O)CCc1cccc(c1)C Amb17400177 [0,1,0,0,1,0|2,0,0]=4 2644 B12R1.226 [O-][N+](=O)CCc1cccc(c1)Cl Amb17401073 [0,1,0,0,1,0|2,0,0]=4 2645 B12R1.891 CC(C)(C)CCc1ccccc1 Amb24470690 [0,1,0,0,1,0|1,0,1]=4 2646 B12R1.891 CC(C)(N)CCc1ccccc1 Amb19373033 [0,1,0,0,1,0|1,0,1]=4 2647 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [0,1,0,0,1,0|0,0,2]=4 2648 B12R1.891 CC(CCc1ccccc1)(N)C Amb17334588 [0,1,0,0,1,0|1,0,1]=4 2649 B12R1.891 CS(=O)(=O)CCc1ccccc1 Amb24454272 [0,1,0,0,1,0|1,0,0]=3 2650 B12R1.891 CS(=O)(=O)NCc1ccccc1 Amb2435156 [0,1,0,0,1,0|2,0,0]=4 2651 B12R1.891 CS(=O)(=O)OCc1c[n]ccc1 Amb24472514 [0,1,0,0,1,0|2,0,0]=4 2652 B12R1.891 CS(=O)(=O)OCc1cc[n]cc1 Amb24524731 [0,1,0,0,1,0|2,0,0]=4 2653 B12R1.891 CS(=O)(=O)OCc1cccc[n]1 Amb25322928 [0,1,0,0,1,0|2,0,0]=4 2654 B12R1.891 CS(=O)(=O)SCc1ccccc1 Amb10071891 [0,1,0,0,1,0|1,1,0]=4 2655 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22433133 [0,1,0,0,1,0|2,0,0]=4 2656 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22433887 [0,1,0,0,1,0|2,0,0]=4 2657 B12R1.891 C[N+](C)(C)CCc1ccccc1 Amb22483565 [0,1,0,0,1,0|2,0,0]=4 2658 B12R1.891 C[Si](C)(Cl)CCc1ccccc1 Amb19893995 [0,1,0,0,1,0|1,1,0]=4 2659 B12R1.891 ClS(=O)(=O)CCc1ccccc1 Amb1130049 [0,1,0,0,1,0|2,0,0]=4 2660 B12R1.891 O=S(=O)(Br)CCc1ccccc1 Amb23555507 [0,1,0,0,1,0|2,0,0]=4 2661 B12R1.891 O=S(=O)(F)CCc1ccccc1 Amb19375026 [0,1,0,0,1,0|2,0,0]=4 2662 B12R1.891 OS(=O)(=O)CCc1ccccc1 Amb19866568 [0,1,0,0,1,0|2,0,0]=4 2663 B12R1.891 [O-]S(=O)(=O)CCc1ccccc1 Amb22457030 [0,1,0,0,1,0|2,0,0]=4 2664 B12R1.891 [O-]S(=O)(=O)OCc1ccccc1 Amb24694356 [0,1,0,0,1,0|2,0,0]=4 2665 B12R1.54 CC(=O)CCC(c1ccco1)Cl Amb17401089 [0,1,0,0,1,0|2,0,0]=4 2666 B12R1.54 CC(=O)CCC(c1cccs1)Cl Amb17402623 [0,1,0,0,1,0|2,0,0]=4 2667 B12R1.54 CC(=O)NCC(C)c1c[s]cc1 Amb25154457 [0,1,0,0,1,0|2,0,0]=4 2668 B12R1.54 CC(=O)NCC(C)c1ccc[s]1 Amb24412731 [0,1,0,0,1,0|2,0,0]=4 2669 B12R1.54 CC(=O)NCC(O)c1ccco1 Amb24356097 [0,1,0,0,1,0|2,0,0]=4 2670 B12R1.54 CC(=O)NCC(c1cccs1)O Amb17335755 [0,1,0,0,1,0|2,0,0]=4 2671 B12R1.54 CC(=O)NC[C@@H](O)c1ccco1 Amb24346861 [0,1,0,0,1,0|2,0,0]=4 2672 B12R1.105 CC(=O)NCCc1ccc(Br)o1 Amb25204953 [0,1,0,0,1,0|2,0,0]=4 2673 B12R1.105 CC(=O)NCCc1ccc(Cl)[s]1 Amb25110362 [0,1,0,0,1,0|2,0,0]=4 2674 B12R1.105 CC(=O)NCCc1ccc(I)[s]1 Amb20642134 [0,1,0,0,1,0|2,0,0]=4 2675 B12R1.105 CC(=O)OCCn1cc(cn1)Br Amb13884502 [0,1,0,0,1,0|2,0,0]=4 2676 B12R1.130 Cc1[s]c[n]c1CCOC(C)=O Amb24065048 [0,1,0,0,1,0|2,0,0]=4 2677 B12R1.130 Cc1c[nH]cc1CCNC(C)=O Amb25859334 [0,1,0,0,1,0|2,0,0]=4 2678 B12R1.130 Cc1ccc[n]1CCNC(C)=O Amb25363602 [0,1,0,0,1,0|2,0,0]=4 2679 B12R1.260 CC(=O)NC(C)Cc1c[s]cc1 Amb25141334 [0,1,0,0,1,0|2,0,0]=4 2680 B12R1.260 CC(=O)NC(C)Cc1cocc1 Amb22710655 [0,1,0,0,1,0|2,0,0]=4 2681 B12R1.260 CC(=O)OC(C)Nc1ccco1 Amb25350526 [0,1,0,0,1,0|2,0,0]=4 2682 B12R1.260 CC(Cc1ccco1)NC(=O)C Amb13798432 [0,1,0,0,1,0|2,0,0]=4 2683 B12R1.260 CC(Cc1cccs1)NC(=O)C Amb10940490 [0,1,0,0,1,0|2,0,0]=4 2684 B12R1.477 BrCC(=O)NCCc1cccs1 Amb17333422 [0,1,0,0,1,0|2,0,0]=4 2685 B12R1.477 BrCC(=O)NCCn1cccc1 Amb17330852 [0,1,0,0,1,0|2,0,0]=4 2686 B12R1.477 CCC(=O)NCCc1cscc1 Amb13821362 [0,1,0,0,1,0|2,0,0]=4 2687 B12R1.477 CNC(=O)NCC[n]1cccc1 Amb25060446 [0,1,0,0,1,0|2,0,0]=4 2688 B12R1.477 CNC(=O)NCCc1ccc[s]1 Amb24351945 [0,1,0,0,1,0|2,0,0]=4 2689 B12R1.477 COC(=O)CCC[n]1cccc1 Amb22971177 [0,1,0,0,1,0|2,0,0]=4 2690 B12R1.477 COC(=O)CCCc1cc[s]c1 Amb22494756 [0,1,0,0,1,0|2,0,0]=4 2691 B12R1.477 COC(=O)NCCc1cscc1 Amb13821363 [0,1,0,0,1,0|2,0,0]=4 2692 B12R1.477 ClCC(=O)NCCc1ccco1 Amb17329057 [0,1,0,0,1,0|2,0,0]=4 2693 B12R1.477 ClCC(=O)NCCc1cccs1 Amb1106069 [0,1,0,0,1,0|2,0,0]=4 2694 B12R1.477 NCC(=O)NCCc1cc[nH]c1 Amb18893568 [0,1,0,0,1,0|2,0,0]=4 2695 B12R1.477 O=C(CCl)NCCc1cc[s]c1 Amb19514455 [0,1,0,0,1,0|2,0,0]=4 2696 B12R1.477 OCC(=O)NCCc1cccs1 Amb1110223 [0,1,0,0,1,0|2,0,0]=4 2697 B12R1.890 CS(=O)(=O)OCCc1ccco1 Amb22886971 [0,1,0,0,1,0|2,0,0]=4 2698 B14R1.148 CC(=O)NCCNc1c[n]cc(N)c1 Amb25166672 [0,1,0,0,0,1|2,0,0]=4 2699 B14R1.148 CC(=O)NCCNc1cc(N)cc[n]1 Amb19062591 [0,1,0,0,0,1|2,0,0]=4 2700 B14R1.148 CC(=O)NCCNc1cc[n]c(Cl)c1 Amb24345602 [0,1,0,0,0,1|2,0,0]=4 2701 B14R1.148 CC(=O)NCCNc1cc[n]c(N)c1 Amb24668323 [0,1,0,0,0,1|2,0,0]=4 2702 B14R1.148 CC(=O)NCCNc1cccc(Cl)[n]1 Amb25164325 [0,1,0,0,0,1|2,0,0]=4 2703 B14R1.148 CC(=O)NCCNc1cccc(Cl)c1 Amb18270431 [0,1,0,0,0,1|1,0,0]=3 2704 B14R1.148 CC(=O)NCCNc1cccc(F)[n]1 Amb18305755 [0,1,0,0,0,1|2,0,0]=4 2705 B14R1.148 CC(=O)NCCNc1cccc(F)c1 Amb18933375 [0,1,0,0,0,1|1,0,0]=3 2706 B14R1.148 CC(=O)NCCOc1cc(Br)cc[n]1 Amb22276873 [0,1,0,0,0,1|2,0,0]=4 2707 B14R1.148 CC(=O)NCCOc1cccc(c1)Br Amb16229678 [0,1,0,0,0,1|1,0,0]=3 2708 B14R1.148 CC(=O)OCCOc1cccc(O)c1 Amb24089823 [0,1,0,0,0,1|0,0,0]=2 2709 B14R1.148 Cc1cc(cc[n]1)NCCNC(C)=O Amb25800658 [0,1,0,0,0,1|2,0,0]=4 2710 B14R1.148 Cc1cc[n]c(c1)NCCNC(C)=O Amb19061759 [0,1,0,0,0,1|2,0,0]=4 2711 B14R1.148 Cc1cccc(NCCNC(C)=O)[n]1 Amb19005121 [0,1,0,0,0,1|2,0,0]=4 2712 B14R1.148 Cc1cccc(c1)NCCNC(C)=O Amb24423981 [0,1,0,0,0,1|1,0,0]=3 2713 B14R1.148 Cc1cccc(c1)OCCNC(C)=O Amb19706104 [0,1,0,0,0,1|1,0,0]=3 2714 B14R1.148 ClC(=O)CCCSc1cccc(c1)C Amb17144251 [0,1,0,0,0,1|2,0,0]=4 2715 B14R1.148 ClC(=O)CCCSc1cccc(c1)Cl Amb17145378 [0,1,0,0,0,1|2,0,0]=4 2716 B14R1.148 NC(=O)CCCSc1cccc(c1)C Amb17143479 [0,1,0,0,0,1|2,0,0]=4 2717 B14R1.148 NC(=O)CCSCc1cccc(c1)Br Amb11244974 [0,1,0,0,0,1|2,0,0]=4 2718 B14R1.148 NC(=O)NCCOc1cccc(c1)Br Amb17266782 [0,1,0,0,0,1|2,0,0]=4 2719 B14R1.148 NC(=O)NCCOc1cccc(c1)C Amb17235935 [0,1,0,0,0,1|2,0,0]=4 2720 B14R1.148 NC(=O)NCCOc1cccc(c1)Cl Amb17241797 [0,1,0,0,0,1|2,0,0]=4 2721 B14R1.148 NC(=O)NCCOc1cccc(c1)F Amb17236723 [0,1,0,0,0,1|2,0,0]=4 2722 B14R1.148 Nc1cc(ccc1)OCCCC(O)=O Amb18111932 [0,1,0,0,0,1|2,0,0]=4 2723 B14R1.148 OC(=O)CCCCc1cccc(Br)c1 Amb18049692 [0,1,0,0,0,1|2,0,0]=4 2724 B14R1.148 OC(=O)CCCOc1cccc(c1)Br Amb15371 [0,1,0,0,0,1|2,0,0]=4 2725 B14R1.148 OC(=O)CCCOc1cccc(c1)C Amb1206876 [0,1,0,0,0,1|2,0,0]=4 2726 B14R1.148 OC(=O)CCCOc1cccc(c1)F Amb1950653 [0,1,0,0,0,1|2,0,0]=4 2727 B14R1.148 OC(=O)CCNCc1cccc(c1)C Amb1111411 [0,1,0,0,0,1|2,0,0]=4 2728 B14R1.148 OC(=O)CCNCc1cccc(c1)Cl Amb10187387 [0,1,0,0,0,1|2,0,0]=4 2729 B14R1.148 OC(=O)CCNCc1cccc(c1)Cl Amb1110208 [0,1,0,0,0,1|2,0,0]=4 2730 B14R1.148 OC(=O)CCNCc1cccc(c1)F Amb2372350 [0,1,0,0,0,1|2,0,0]=4 2731 B14R1.148 Oc1cccc(CCCCC(O)=O)c1 Amb20668368 [0,1,0,0,0,1|2,0,0]=4 2732 B14R1.159 CC(=O)NCCNc1[n]cccc1Br Amb24271457 [0,1,0,0,0,1|2,0,0]=4 2733 B14R1.159 CC(=O)NCCNc1[n]cccc1F Amb19029646 [0,1,0,0,0,1|2,0,0]=4 2734 B14R1.159 CC(=O)NCCNc1cc[n]cc1Cl Amb23706212 [0,1,0,0,0,1|2,0,0]=4 2735 B14R1.159 CC(=O)NCCNc1ccccc1Br Amb25717140 [0,1,0,0,0,1|1,0,0]=3 2736 B14R1.159 CC(=O)NCCNc1ccccc1Cl Amb18270051 [0,1,0,0,0,1|1,0,0]=3 2737 B14R1.159 CC(=O)NCCNc1ccccc1F Amb18933376 [0,1,0,0,0,1|1,0,0]=3 2738 B14R1.159 CC(=O)NCCNc1ccccc1I Amb24371473 [0,1,0,0,0,1|1,0,0]=3 2739 B14R1.159 CC(=O)NCCOc1ccccc1N Amb17131704 [0,1,0,0,0,1|1,0,0]=3 2740 B14R1.159 CC(=O)OCC#Cc1ccccc1O Amb25142632 [0,1,0,0,0,1|0,0,1]=3 2741 B14R1.159 Cc1c[n]ccc1NCCNC(C)=O Amb24335938 [0,1,0,0,0,1|2,0,0]=4 2742 B14R1.159 Cc1ccc[n]c1NCCNC(C)=O Amb19079451 [0,1,0,0,0,1|2,0,0]=4 2743 B14R1.159 Cc1ccccc1CCC#CC(O)=O Amb25043249 [0,1,0,0,0,1|2,0,0]=4 2744 B14R1.159 Cc1ccccc1CSCCC(N)=O Amb20749738 [0,1,0,0,0,1|2,0,0]=4 2745 B14R1.159 Cc1ccccc1OCCNC(C)=O Amb23166893 [0,1,0,0,0,1|1,0,0]=3 2746 B14R1.159 NC(=O)CCCSc1ccccc1Cl Amb17144304 [0,1,0,0,0,1|2,0,0]=4 2747 B14R1.159 NC(=O)NCCNc1ccccc1Cl Amb25817794 [0,1,0,0,0,1|2,0,0]=4 2748 B14R1.159 NC(=O)NCCOc1ccccc1Br Amb17266780 [0,1,0,0,0,1|2,0,0]=4 2749 B14R1.159 NC(=O)NCCOc1ccccc1C Amb17235933 [0,1,0,0,0,1|2,0,0]=4 2750 B14R1.159 NC(=O)NCCOc1ccccc1Cl Amb17241795 [0,1,0,0,0,1|2,0,0]=4 2751 B14R1.159 NC(=O)NCCOc1ccccc1F Amb17236721 [0,1,0,0,0,1|2,0,0]=4 2752 B14R1.159 Nc1ccccc1NCCNC(N)=O Amb24689609 [0,1,0,0,0,1|2,0,0]=4 2753 B14R1.159 OC(=O)CCCCc1ccccc1Cl Amb22481113 [0,1,0,0,0,1|2,0,0]=4 2754 B14R1.159 OC(=O)CCCOc1ccccc1F Amb1950642 [0,1,0,0,0,1|2,0,0]=4 2755 B14R1.159 OC(=O)CCNCc1ccccc1C Amb2372159 [0,1,0,0,0,1|2,0,0]=4 2756 B14R1.159 OC(=O)CCNCc1ccccc1Cl Amb10187386 [0,1,0,0,0,1|2,0,0]=4 2757 B14R1.159 OC(=O)CCNCc1ccccc1Cl Amb1110577 [0,1,0,0,0,1|2,0,0]=4 2758 B14R1.159 OC(=O)CCNCc1ccccc1F Amb17758538 [0,1,0,0,0,1|2,0,0]=4 2759 B14R1.420 CC(=O)NCNC(=O)c1ccccc1 Amb24336454 [0,1,0,0,0,1|1,0,1]=4 2760 B14R1.420 CC(=O)\C=C\NC(C)c1ccccc1 Amb25324895 [0,1,0,0,0,1|1,0,1]=4 2761 B14R1.420 CC(CCCC(O)=O)c1ccccc1 Amb17844447 [0,1,0,0,0,1|2,0,0]=4 2762 B14R1.420 CC(NCCC(N)=O)c1ccccc1 Amb24273095 [0,1,0,0,0,1|2,0,0]=4 2763 B14R1.420 CC(c1ccccc1)NCCC(=O)O Amb2372473 [0,1,0,0,0,1|2,0,0]=4 2764 B14R1.420 CN(c1ccccc1)CCCC(=O)Cl Amb17143525 [0,1,0,0,0,1|2,0,0]=4 2765 B14R1.420 CN(c1ccccc1)CCCC(=O)N Amb17143114 [0,1,0,0,0,1|2,0,0]=4 2766 B14R1.420 C\C(=C\CNC(C)=O)\c1ccccc1 Amb25315136 [0,1,0,0,0,1|1,0,1]=4 2767 B14R1.420 C\C(\Cl)=C/CNC(C)c1ccccc1 Amb21953975 [0,1,0,0,0,1|2,0,0]=4 2768 B14R1.420 NC(COC=C(F)F)c1ccccc1 Amb19374593 [0,1,0,0,0,1|2,0,0]=4 2769 B14R1.420 N[C@@H](CCCC(O)=O)c1ccccc1 Amb23440369 [0,1,0,0,0,1|2,0,0]=4 2770 B14R1.420 O=C(c1ccccc1)NCCC(=O)C Amb10562812 [0,1,0,0,0,1|1,0,1]=4 2771 B14R1.420 OC(COC=C(F)F)c1ccccc1 Amb19374599 [0,1,0,0,0,1|2,0,0]=4 2772 B14R1.423 CC(=O)COC(=O)Cc1ccccc1 Amb24084925 [0,1,0,0,0,1|0,0,1]=3 2773 B14R1.423 CC(=O)O\N=C(/N)\Cc1ccccc1 Amb23247777 [0,1,0,0,0,1|0,0,1]=3 2774 B14R1.423 CC(CNC(N)=O)Nc1ccccc1 Amb24448575 [0,1,0,0,0,1|2,0,0]=4 2775 B14R1.423 CN(Cc1ccccc1)CCC(=O)C Amb17401563 [0,1,0,0,0,1|1,0,0]=3 2776 B14R1.423 CN(Cc1ccccc1)CCC(=O)Cl Amb17143522 [0,1,0,0,0,1|2,0,0]=4 2777 B14R1.423 CN(Cc1ccccc1)CCC(=O)O Amb15740934 [0,1,0,0,0,1|2,0,0]=4 2778 B14R1.423 C\C(\CNC(C)=O)=C/c1ccccc1 Amb24627853 [0,1,0,0,0,1|1,0,1]=4 2779 B14R1.423 NC(Cc1ccccc1)C#CC(O)=O Amb25124720 [0,1,0,0,0,1|2,0,0]=4 2780 B14R1.423 N[C@@H](Cc1ccccc1)C#CC(O)=O Amb25858142 [0,1,0,0,0,1|2,0,0]=4 2781 B14R1.423 N[C@@H](Cc1ccccc1)CCC(O)=O Amb22754385 [0,1,0,0,0,1|2,0,0]=4 2782 B14R1.423 O=C(Cc1ccccc1)CC=C(C)C Amb17594894 [0,1,0,0,0,1|2,0,0]=4 2783 B14R1.423 O=C(Nc1ccccc1)COC(=O)C Amb1210678 [0,1,0,0,0,1|0,0,1]=3 2784 B14R1.677 CC(=C)CNCCc1ccc(cc1)F Amb17317886 [0,1,0,0,0,1|2,0,0]=4 2785 B14R1.677 CC(=O)CC\C=C\c1ccc(Br)cc1 Amb18228461 [0,1,0,0,0,1|1,0,1]=4 2786 B14R1.677 CC(=O)CC\C=C\c1ccc(Cl)cc1 Amb18865910 [0,1,0,0,0,1|1,0,1]=4 2787 B14R1.677 CC(=O)CC\C=C\c1ccc(F)cc1 Amb18863723 [0,1,0,0,0,1|1,0,1]=4 2788 B14R1.677 CC(=O)NCC#Cc1ccc(Cl)cc1 Amb25082744 [0,1,0,0,0,1|1,0,1]=4 2789 B14R1.677 CC(=O)NCCCc1ccc(cc1)N Amb17139367 [0,1,0,0,0,1|1,0,0]=3 2790 B14R1.677 CC(=O)NCCNc1ccc(Br)cc1 Amb24389106 [0,1,0,0,0,1|1,0,0]=3 2791 B14R1.677 CC(=O)NCCNc1ccc(Cl)cc1 Amb18270425 [0,1,0,0,0,1|1,0,0]=3 2792 B14R1.677 CC(=O)NCCNc1ccc(F)c[n]1 Amb18306377 [0,1,0,0,0,1|2,0,0]=4 2793 B14R1.677 CC(=O)NCCNc1ccc(F)cc1 Amb18270423 [0,1,0,0,0,1|1,0,0]=3 2794 B14R1.677 CC(=O)NCCNc1ccc(O)cc1 Amb24677616 [0,1,0,0,0,1|1,0,0]=3 2795 B14R1.677 CC(=O)NCCOc1ccc(cc1)Br Amb1094624 [0,1,0,0,0,1|1,0,0]=3 2796 B14R1.677 CC(=O)NCCOc1ccc(cc1)C Amb1014121 [0,1,0,0,0,1|1,0,0]=3 2797 B14R1.677 CC(=O)NCCOc1ccc(cc1)Cl Amb1014120 [0,1,0,0,0,1|1,0,0]=3 2798 B14R1.677 CC(=O)NCCOc1ccc(cc1)N Amb16229560 [0,1,0,0,0,1|1,0,0]=3 2799 B14R1.677 CC(=O)NCCSc1ccc(O)cc1 Amb19514711 [0,1,0,0,0,1|1,0,0]=3 2800 B14R1.677 CC(=O)OCCCc1ccc(Br)cc1 Amb24046248 [0,1,0,0,0,1|0,0,0]=2 2801 B14R1.677 CC(=O)OCCOc1ccc(Br)cc1 Amb22493613 [0,1,0,0,0,1|0,0,0]=2 2802 B14R1.677 CC(C)=CCCNc1ccc(N)cc1 Amb25245609 [0,1,0,0,0,1|2,0,0]=4 2803 B14R1.677 Cc1ccc(\C=C\CCC(C)=O)cc1 Amb18224841 [0,1,0,0,0,1|1,0,1]=4 2804 B14R1.677 Cc1ccc(cc1)NCCNC(C)=O Amb25818747 [0,1,0,0,0,1|1,0,0]=3 2805 B14R1.677 Cc1ccc(cc1)OCCOC(C)=O Amb22735029 [0,1,0,0,0,1|0,0,0]=2 2806 B14R1.677 ClC(=O)CCCOc1ccc(cc1)C Amb17143550 [0,1,0,0,0,1|2,0,0]=4 2807 B14R1.677 ClC(=O)CCCOc1ccc(cc1)Cl Amb17144450 [0,1,0,0,0,1|2,0,0]=4 2808 B14R1.677 ClC(=O)CCCOc1ccc(cc1)F Amb17143677 [0,1,0,0,0,1|2,0,0]=4 2809 B14R1.677 ClC(=O)CCCSc1ccc(cc1)Cl Amb17145379 [0,1,0,0,0,1|2,0,0]=4 2810 B14R1.677 NC(=O)CCCOc1ccc(cc1)Br Amb225459 [0,1,0,0,0,1|2,0,0]=4 2811 B14R1.677 NC(=O)CCCOc1ccc(cc1)C Amb2556432 [0,1,0,0,0,1|2,0,0]=4 2812 B14R1.677 NC(=O)CCSCc1ccc(cc1)Br Amb11244956 [0,1,0,0,0,1|2,0,0]=4 2813 B14R1.677 NC(=O)NCCOc1ccc(cc1)Br Amb17266784 [0,1,0,0,0,1|2,0,0]=4 2814 B14R1.677 NC(=O)NCCOc1ccc(cc1)Cl Amb17241799 [0,1,0,0,0,1|2,0,0]=4 2815 B14R1.677 NC(=O)NCCOc1ccc(cc1)F Amb17236725 [0,1,0,0,0,1|2,0,0]=4 2816 B14R1.677 NC(=O)OCCOc1ccc(cc1)C Amb2229039 [0,1,0,0,0,1|1,0,0]=3 2817 B14R1.677 Nc1ccc(cc1)NCCCC(O)=O Amb19374547 [0,1,0,0,0,1|2,0,0]=4 2818 B14R1.677 OC(=O)CCCOc1ccc(cc1)Br Amb15374 [0,1,0,0,0,1|2,0,0]=4 2819 B14R1.677 OC(=O)CCCOc1ccc(cc1)C Amb1204762 [0,1,0,0,0,1|2,0,0]=4 2820 B14R1.677 OC(=O)CCCOc1ccc(cc1)Cl Amb1950628 [0,1,0,0,0,1|2,0,0]=4 2821 B14R1.677 OC(=O)CCCSc1ccc(cc1)Cl Amb1102903 [0,1,0,0,0,1|2,0,0]=4 2822 B14R1.677 OC(=O)CCNCc1ccc(cc1)Cl Amb10187381 [0,1,0,0,0,1|2,0,0]=4 2823 B14R1.677 OC(=O)CCNCc1ccc(cc1)Cl Amb1110486 [0,1,0,0,0,1|2,0,0]=4 2824 B14R1.677 OC(=O)CCNCc1ccc(cc1)F Amb10187378 [0,1,0,0,0,1|2,0,0]=4 2825 B14R1.677 OC(=O)CCNCc1ccc(cc1)F Amb1109654 [0,1,0,0,0,1|2,0,0]=4 2826 B14R1.677 OC(=O)CCSCc1ccc(cc1)N Amb17498383 [0,1,0,0,0,1|2,0,0]=4 2827 B14R1.677 OC(=O)COCCc1ccc(cc1)Br Amb17065893 [0,1,0,0,0,1|1,0,0]=3 2828 B14R1.677 OC(=O)COCCc1ccc(cc1)C Amb17065886 [0,1,0,0,0,1|1,0,0]=3 2829 B14R1.677 OC(=O)COCCc1ccc(cc1)Cl Amb17065894 [0,1,0,0,0,1|1,0,0]=3 2830 B14R1.677 OC(=O)CSCCc1ccc(cc1)C Amb17065871 [0,1,0,0,0,1|1,1,0]=4 2831 B14R1.677 OC(=O)CSCCc1ccc(cc1)F Amb17065879 [0,1,0,0,0,1|1,1,0]=4 2832 B14R1.716 BrCC(=O)NCCCc1ccccc1 Amb17323643 [0,1,0,0,0,1|1,0,0]=3 2833 B14R1.716 BrCC(=O)NCCOc1ccccc1 Amb17333035 [0,1,0,0,0,1|1,0,0]=3 2834 B14R1.716 C#CC(=O)NCCNc1ccccc1 Amb24723511 [0,1,0,0,0,1|1,0,1]=4 2835 B14R1.716 C=C(CCOCc1ccccc1)C=O Amb24419955 [0,1,0,0,0,1|1,0,1]=4 2836 B14R1.716 C=C(CCl)CCOCc1ccccc1 Amb24653568 [0,1,0,0,0,1|2,0,0]=4 2837 B14R1.716 C=C(CO)C#CCCc1ccccc1 Amb24748529 [0,1,0,0,0,1|2,0,0]=4 2838 B14R1.716 C=CC(=O)OCCCc1ccccc1 Amb17934135 [0,1,0,0,0,1|0,0,1]=3 2839 B14R1.716 C=CC(=O)OCCSc1ccccc1 Amb17934210 [0,1,0,0,0,1|0,0,1]=3 2840 B14R1.716 C=CC(=O)OC\C=C\c1ccccc1 Amb17933977 [0,1,0,0,0,1|0,0,2]=4 2841 B14R1.716 CC(C=O)OCOCc1ccccc1 Amb25104863 [0,1,0,0,0,1|0,0,1]=3 2842 B14R1.716 CC(CCOCc1ccccc1)C=O Amb24740978 [0,1,0,0,0,1|1,0,1]=4 2843 B14R1.716 CC(CO)OCOCc1ccccc1 Amb24340676 [0,1,0,0,0,1|0,0,2]=4 2844 B14R1.716 CCC(=O)CCC#Cc1ccccc1 Amb19070057 [0,1,0,0,0,1|1,0,1]=4 2845 B14R1.716 CCC(=O)CCCCc1ccccc1 Amb17234942 [0,1,0,0,0,1|1,0,0]=3 2846 B14R1.716 CCC(=O)CCCCc1cccnc1 Amb17235102 [0,1,0,0,0,1|2,0,0]=4 2847 B14R1.716 CCC(=O)CCNCc1ccccc1 Amb25040589 [0,1,0,0,0,1|1,0,0]=3 2848 B14R1.716 CCC(=O)NCC#Cc1ccccc1 Amb10562814 [0,1,0,0,0,1|1,0,1]=4 2849 B14R1.716 CCC(=O)NCCSc1ccccc1 Amb19558300 [0,1,0,0,0,1|1,0,0]=3 2850 B14R1.716 CCC(=O)OCC#Cc1ccccc1 Amb25251500 [0,1,0,0,0,1|0,0,1]=3 2851 B14R1.716 CCC(=O)\C=C\NCc1ccccc1 Amb24627880 [0,1,0,0,0,1|1,0,1]=4 2852 B14R1.716 CCC(C)COCCc1ccccc1 Amb24100310 [0,1,0,0,0,1|1,0,1]=4 2853 B14R1.716 CNC(=O)CCC#Cc1ccccc1 Amb25185908 [0,1,0,0,0,1|1,0,1]=4 2854 B14R1.716 CNC(=O)CCNCc1c[n]ccc1 Amb19984984 [0,1,0,0,0,1|2,0,0]=4 2855 B14R1.716 CNC(=O)CCNCc1ccc[n]c1 Amb19079385 [0,1,0,0,0,1|2,0,0]=4 2856 B14R1.716 CNC(=O)CCNCc1ccccc1 Amb18330312 [0,1,0,0,0,1|1,0,0]=3 2857 B14R1.716 CNC(=O)CNOCc1ccccc1 Amb25114481 [0,1,0,0,0,1|2,0,0]=4 2858 B14R1.716 CNC(=O)CSCCc1cc[n]cc1 Amb24303597 [0,1,0,0,0,1|1,1,0]=4 2859 B14R1.716 CNC(=O)CSCCc1cccc[n]1 Amb24303603 [0,1,0,0,0,1|1,1,0]=4 2860 B14R1.716 CNC(=O)N\N=C\Cc1ccccc1 Amb25183663 [0,1,0,0,0,1|1,0,1]=4 2861 B14R1.716 CNC(=O)OCCOc1ccccc1 Amb24081214 [0,1,0,0,0,1|0,0,0]=2 2862 B14R1.716 CNC(=O)\C=N\OCc1ccccc1 Amb24506570 [0,1,0,0,0,1|2,0,0]=4 2863 B14R1.716 COC(=O)CCCCc1cccc[n]1 Amb24113266 [0,1,0,0,0,1|2,0,0]=4 2864 B14R1.716 COC(=O)CCCNc1cc[n]cc1 Amb18933138 [0,1,0,0,0,1|2,0,0]=4 2865 B14R1.716 COC(=O)CCCNc1cccc[n]1 Amb18933129 [0,1,0,0,0,1|2,0,0]=4 2866 B14R1.716 COC(=O)CCCOc1ccccc1 Amb2170599 [0,1,0,0,0,1|1,0,0]=3 2867 B14R1.716 COC(=O)NCC#Cc1ccccc1 Amb24374036 [0,1,0,0,0,1|1,0,1]=4 2868 B14R1.716 COC(=O)NCCOc1ccccc1 Amb1014011 [0,1,0,0,0,1|1,0,0]=3 2869 B14R1.716 COC(=O)OCC=Cc1ccccc1 Amb22230406 [0,1,0,0,0,1|0,0,1]=3 2870 B14R1.716 C[C@@H](C=O)OCC#Cc1ccccc1 Amb24620123 [0,1,0,0,0,1|0,0,2]=4 2871 B14R1.716 C[C@@H](C=O)OCOCc1ccccc1 Amb24347014 [0,1,0,0,0,1|0,0,1]=3 2872 B14R1.716 C[C@@H](CCOCc1ccccc1)C=O Amb24682868 [0,1,0,0,0,1|1,0,1]=4 2873 B14R1.716 C[C@H](C=O)OCOCc1ccccc1 Amb25858257 [0,1,0,0,0,1|0,0,1]=3 2874 B14R1.716 C\C(=C/COCc1ccccc1)\C=O Amb18650557 [0,1,0,0,0,1|1,0,0]=3 2875 B14R1.716 C\C(=C\COCc1ccccc1)\C=O Amb24540844 [0,1,0,0,0,1|1,0,0]=3 2876 B14R1.716 C\C(\CCNCc1ccccc1)=C\C Amb24440553 [0,1,0,0,0,1|2,0,0]=4 2877 B14R1.716 C\C(\CCNCc1ccccc1)=N\O Amb24696355 [0,1,0,0,0,1|1,0,1]=4 2878 B14R1.716 C\C(\CCl)=C/COCc1ccccc1 Amb24403278 [0,1,0,0,0,1|2,0,0]=4 2879 B14R1.716 C\C(\CCl)=C\COCc1ccccc1 Amb25287177 [0,1,0,0,0,1|2,0,0]=4 2880 B14R1.716 C\N=C(\N)/NCCNc1ccccc1 Amb25318489 [0,1,0,0,0,1|2,0,0]=4 2881 B14R1.716 ClCC(=O)NCCCc1ccccc1 Amb1103589 [0,1,0,0,0,1|1,0,0]=3 2882 B14R1.716 ClCC(=O)NCCSc1ccccc1 Amb1657260 [0,1,0,0,0,1|1,0,0]=3 2883 B14R1.716 NCC(=O)CCOCc1ccccc1 Amb25698053 [0,1,0,0,0,1|1,0,0]=3 2884 B14R1.716 NCC(=O)NCCOc1ccccc1 Amb17235931 [0,1,0,0,0,1|1,0,0]=3 2885 B14R1.716 NCC(=O)NCCSc1ccccc1 Amb24770028 [0,1,0,0,0,1|1,0,0]=3 2886 B14R1.716 NNC(=O)CCCCc1ccccc1 Amb22484620 [0,1,0,0,0,1|2,0,0]=4 2887 B14R1.716 NNC(=O)CCCNc1ccccc1 Amb1007482 [0,1,0,0,0,1|2,0,0]=4 2888 B14R1.716 NNC(=O)CCNCc1ccccc1 Amb17604772 [0,1,0,0,0,1|2,0,0]=4 2889 B14R1.716 O=C(CBr)CCOCc1ccccc1 Amb25342908 [0,1,0,0,0,1|1,0,0]=3 2890 B14R1.716 O=C(CBr)OCCCc1ccccc1 Amb24094180 [0,1,0,0,0,1|0,0,0]=2 2891 B14R1.716 O=C(CCl)NCC#Cc1ccccc1 Amb19514326 [0,1,0,0,0,1|1,0,1]=4 2892 B14R1.716 O=C(CCl)NCOCc1ccccc1 Amb25181342 [0,1,0,0,0,1|1,0,0]=3 2893 B14R1.716 O=C(CCl)OCC=Cc1ccccc1 Amb22358971 [0,1,0,0,0,1|0,0,1]=3 2894 B14R1.818 CC(=CC(C)=O)NCc1ccccc1 Amb24079060 [0,1,0,0,0,1|1,0,1]=4 2895 B14R1.818 CC(=O)CC(=S)NCc1ccccc1 Amb24451576 [0,1,0,0,0,1|1,0,1]=4 2896 B14R1.818 CC(=O)CC(O)OCc1ccccc1 Amb25802890 [0,1,0,0,0,1|1,0,0]=3 2897 B14R1.818 CC(=O)C[C@@H](N)C#Cc1ccccc1 Amb25664270 [0,1,0,0,0,1|1,0,1]=4 2898 B14R1.818 CC(=O)C[C@H](O)C#Cc1ccccc1 Amb25688770 [0,1,0,0,0,1|1,0,1]=4 2899 B14R1.818 CC(=O)NC(=C)CCc1ccccc1 Amb24741052 [0,1,0,0,0,1|1,0,0]=3 2900 B14R1.818 CC(=O)NC(=N)NCc1ccccc1 Amb25351673 [0,1,0,0,0,1|1,0,1]=4 2901 B14R1.818 CC(=O)NC(=O)CNc1ccccc1 Amb25814083 [0,1,0,0,0,1|1,0,1]=4 2902 B14R1.818 CC(=O)NC(=O)OCc1ccccc1 Amb24506532 [0,1,0,0,0,1|1,0,1]=4 2903 B14R1.818 CC(=O)NC(=O)SCc1ccccc1 Amb24639120 [0,1,0,0,0,1|1,0,1]=4 2904 B14R1.818 CC(=O)NC(C)CNc1ccccc1 Amb25750704 [0,1,0,0,0,1|1,0,0]=3 2905 B14R1.818 CC(=O)OC(C)C#Cc1ccccc1 Amb25676953 [0,1,0,0,0,1|0,0,1]=3 2906 B14R1.818 CC(=O)[CH-]C(=O)NCc1ccccc1 Amb22445976 [0,1,0,0,0,1|1,0,1]=4 2907 B14R1.818 CC(C)=CC(C)NCc1ccccc1 Amb25833857 [0,1,0,0,0,1|2,0,0]=4 2908 B14R1.818 CC(C)=CC(O)CNc1ccccc1 Amb24374615 [0,1,0,0,0,1|2,0,0]=4 2909 B14R1.818 CC(CC(=O)N)NCc1ccccc1 Amb17235456 [0,1,0,0,0,1|2,0,0]=4 2910 B14R1.818 CC(CC(N)=O)OCc1ccccc1 Amb25249681 [0,1,0,0,0,1|2,0,0]=4 2911 B14R1.818 CC(CCc1ccccc1)NC(N)=O Amb19078987 [0,1,0,0,0,1|2,0,0]=4 2912 B14R1.818 CC(CS(C)=O)NCc1ccccc1 Amb25166531 [0,1,0,0,0,1|2,0,0]=4 2913 B14R1.818 CC(OCc1ccccc1)C=C(C)C Amb17844386 [0,1,0,0,0,1|2,0,0]=4 2914 B14R1.818 C[C@@H](CC(N)=O)NCc1ccccc1 Amb24566940 [0,1,0,0,0,1|2,0,0]=4 2915 B14R1.818 C[C@@H](CC(N)=O)OCc1ccccc1 Amb24498301 [0,1,0,0,0,1|2,0,0]=4 2916 B14R1.818 C[C@@H](CC(O)=O)NCc1ccccc1 Amb25124067 [0,1,0,0,0,1|2,0,0]=4 2917 B14R1.818 C[C@@H](CC(O)=O)OCc1ccccc1 Amb24335959 [0,1,0,0,0,1|2,0,0]=4 2918 B14R1.818 C\C(\CCc1ccccc1)=C\C(O)=O Amb22095783 [0,1,0,0,0,1|2,0,0]=4 2919 B14R1.818 NC(=O)NC(=O)CCc1ccccc1 Amb24335936 [0,1,0,0,0,1|2,0,0]=4 2920 B14R1.818 NC(CC(=O)O)CCc1ccccc1 Amb1993736 [0,1,0,0,0,1|2,0,0]=4 2921 B14R1.818 N[C@@H](CCc1ccccc1)CC(O)=O Amb19887670 [0,1,0,0,0,1|2,0,0]=4 2922 B14R1.818 N[C@@H](CCc1ccccc1)CC(O)=O Amb22746249 [0,1,0,0,0,1|2,0,0]=4 2923 B14R1.818 N[C@H](CCc1ccccc1)CC(O)=O Amb19888418 [0,1,0,0,0,1|2,0,0]=4 2924 B14R1.818 O=C(CC(=O)C)NCc1ccccc1 Amb1034892 [0,1,0,0,0,1|1,0,1]=4 2925 B14R1.818 O=C(CC(=O)O)CCc1ccccc1 Amb17235338 [0,1,0,0,0,1|2,0,0]=4 2926 B14R1.818 OC(CC(=O)O)CCc1ccccc1 Amb17235897 [0,1,0,0,0,1|2,0,0]=4 2927 B14R1.818 S=C(NC(=O)C)NCc1ccccc1 Amb2054418 [0,1,0,0,0,1|1,0,1]=4 2928 B14R1.3331 CP(C)(=O)CCNCc1ccccc1 Amb25207796 [0,1,0,0,0,1|2,0,0]=4 2929 B14R1.3331 CS(=O)(=O)CCCCc1ccccc1 Amb24287787 [0,1,0,0,0,1|2,0,0]=4 2930 B14R1.3331 CS(=O)(=O)CCNCc1ccccc1 Amb25839478 [0,1,0,0,0,1|2,0,0]=4 2931 B14R1.3331 CS(=O)(=O)CCSCc1ccccc1 Amb20909327 [0,1,0,0,0,1|2,0,0]=4 2932 B14R1.3331 OP(O)(=O)OCNCc1ccccc1 Amb25685987 [0,1,0,0,0,1|2,0,0]=4 2933 B14R1.6449 CC(=C)C(=O)OCCc1ccccc1 Amb17934134 [0,1,0,0,0,1|1,0,0]=3 2934 B14R1.6449 CC(=C)C(N)COCc1ccccc1 Amb24726739 [0,1,0,0,0,1|2,0,0]=4 2935 B14R1.6449 CC(=C)[C@@H](O)COCc1ccccc1 Amb24403871 [0,1,0,0,0,1|2,0,0]=4 2936 B14R1.6449 CC(=O)C(=O)CNCc1ccccc1 Amb25103178 [0,1,0,0,0,1|1,0,0]=3 2937 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 Amb17401500 [0,1,0,0,0,1|1,0,0]=3 2938 B14R1.6449 CC(=O)C(C)CC#Cc1ccccc1 Amb19070058 [0,1,0,0,0,1|1,0,1]=4 2939 B14R1.6449 CC(=O)[C@@H](C)COCc1ccccc1 Amb24544010 [0,1,0,0,0,1|1,0,0]=3 2940 B14R1.6449 CC(=O)\C(\O)=C\NCc1ccccc1 Amb24758955 [0,1,0,0,0,1|1,0,1]=4 2941 B14R1.6449 CC(C(=O)O)CCOc1ccccc1 Amb17235913 [0,1,0,0,0,1|2,0,0]=4 2942 B14R1.6449 CC(C)=C(C)CNCc1ccccc1 Amb25111160 [0,1,0,0,0,1|2,0,0]=4 2943 B14R1.6449 CC(CNCc1ccccc1)C(O)=O Amb20623866 [0,1,0,0,0,1|2,0,0]=4 2944 B14R1.6449 CN(C(=O)N)CCNc1ccccc1 Amb16229498 [0,1,0,0,0,1|2,0,0]=4 2945 B14R1.6449 C[C@@H](C(=O)O)COCc1ccccc1 Amb10844261 [0,1,0,0,0,1|2,0,0]=4 2946 B14R1.6449 C[C@H](C(=O)O)COCc1ccccc1 Amb10844264 [0,1,0,0,0,1|2,0,0]=4 2947 B14R1.6449 C\C(=C\NCc1ccccc1)\C(C)=O Amb25672607 [0,1,0,0,0,1|1,0,1]=4 2948 B14R1.6449 NC(=O)C(Cl)COCc1ccccc1 Amb25103271 [0,1,0,0,0,1|2,0,0]=4 2949 B14R1.6449 NC(=O)C(N)COCc1ccccc1 Amb25809213 [0,1,0,0,0,1|2,0,0]=4 2950 B14R1.6449 NC(CCCc1ccccc1)C(O)=O Amb19342362 [0,1,0,0,0,1|2,0,0]=4 2951 B14R1.6449 N[C@@H](CCCc1ccccc1)C(O)=O Amb20241024 [0,1,0,0,0,1|2,0,0]=4 2952 B14R1.6449 N[C@H](COCc1ccccc1)C(O)=O Amb19944297 [0,1,0,0,0,1|2,0,0]=4 2953 B14R1.6449 OC(=O)C(Br)COCc1ccccc1 Amb18668071 [0,1,0,0,0,1|2,0,0]=4 2954 B14R1.6449 OC(=O)C(Cl)COCc1ccccc1 Amb25734789 [0,1,0,0,0,1|2,0,0]=4 2955 B14R1.6449 OC(=O)[C@@H](Cl)COCc1ccccc1 Amb25752794 [0,1,0,0,0,1|2,0,0]=4 2956 B14R1.6449 OC(=O)[C@@H](O)CNCc1ccccc1 Amb24650939 [0,1,0,0,0,1|2,0,0]=4 2957 B14R1.6449 OC(=O)[C@@H](O)COCc1ccccc1 Amb25088415 [0,1,0,0,0,1|2,0,0]=4 2958 B14R1.6449 OC(=O)[C@@H](S)CNCc1ccccc1 Amb25381284 [0,1,0,0,0,1|2,0,0]=4 2959 B14R1.6449 OC(=O)[C@H](Cl)COCc1ccccc1 Amb25309625 [0,1,0,0,0,1|2,0,0]=4 2960 B14R1.6449 OC(=O)[C@H](O)COCc1ccccc1 Amb24428781 [0,1,0,0,0,1|2,0,0]=4 2961 B14R1.149 CC(=O)CCC(c1cccc(c1)Br)Cl Amb17421439 [0,2,0,0,0,0|1,0,0]=3 2962 B14R1.149 CC(=O)CCC(c1cccc(c1)C)Cl Amb17404055 [0,2,0,0,0,0|1,0,0]=3 2963 B14R1.149 CC(=O)CCC(c1cccc(c1)Cl)Cl Amb17407559 [0,2,0,0,0,0|1,0,0]=3 2964 B14R1.149 CC(=O)NCC(=O)c1cc(Br)ccc1 Amb24379968 [0,2,0,0,0,0|1,0,1]=4 2965 B14R1.149 CC(=O)NCC(=O)c1cc(C)ccc1 Amb24506417 [0,2,0,0,0,0|1,0,1]=4 2966 B14R1.149 CC(=O)NCC(=O)c1cc(O)ccc1 Amb18651415 [0,2,0,0,0,0|1,0,1]=4 2967 B14R1.149 CC(=O)NCC(O)c1cc(O)ccc1 Amb25683434 [0,2,0,0,0,0|1,0,0]=3 2968 B14R1.149 CC(=O)O\N=C(\N)/c1cccc(Cl)c1 Amb25703636 [0,2,0,0,0,0|1,0,1]=4 2969 B14R1.149 CC(C)=CCC(O)c1cccc(F)c1 Amb25193133 [0,2,0,0,0,0|2,0,0]=4 2970 B14R1.149 NC(=O)CCC(c1cccc(c1)Br)O Amb17356399 [0,2,0,0,0,0|2,0,0]=4 2971 B14R1.149 NC(=O)CCC(c1cccc(c1)C)O Amb17336590 [0,2,0,0,0,0|2,0,0]=4 2972 B14R1.149 NC(=O)CCC(c1cccc(c1)Cl)O Amb17340098 [0,2,0,0,0,0|2,0,0]=4 2973 B14R1.149 NC(=O)CCC(c1cccc(c1)O)O Amb17336927 [0,2,0,0,0,0|2,0,0]=4 2974 B14R1.149 NC(CCC(O)=O)c1cccc(F)c1 Amb24117525 [0,2,0,0,0,0|2,0,0]=4 2975 B14R1.149 OC(=O)CCC(c1cccc(c1)Br)O Amb17198779 [0,2,0,0,0,0|2,0,0]=4 2976 B14R1.149 OC(=O)CCC(c1cccc(c1)C)O Amb17198751 [0,2,0,0,0,0|2,0,0]=4 2977 B14R1.149 OC(=O)CCC(c1cccc(c1)Cl)O Amb17198766 [0,2,0,0,0,0|2,0,0]=4 2978 B14R1.160 CC(=O)CCC(c1ccccc1C)Cl Amb17404054 [0,2,0,0,0,0|1,0,0]=3 2979 B14R1.160 CC(=O)CCC(c1ccccc1Cl)Cl Amb17407558 [0,2,0,0,0,0|1,0,0]=3 2980 B14R1.160 CC(=O)CCC(c1ccccc1F)Cl Amb17404371 [0,2,0,0,0,0|1,0,0]=3 2981 B14R1.160 CC(=O)NCC(=O)c1ccccc1O Amb24402937 [0,2,0,0,0,0|1,0,1]=4 2982 B14R1.160 CC(=O)ONC(=O)c1ccccc1O Amb17607640 [0,2,0,0,0,0|1,0,1]=4 2983 B14R1.160 CC(=O)O\N=C(\C)/c1ccccc1O Amb24564905 [0,2,0,0,0,0|1,0,1]=4 2984 B14R1.160 CC(=O)O\N=C(\N)/c1ccccc1C Amb25257429 [0,2,0,0,0,0|1,0,1]=4 2985 B14R1.160 CC(=O)O\N=C(\c1ccccc1O)/C Amb17615035 [0,2,0,0,0,0|1,0,1]=4 2986 B14R1.160 CC(C)=CCC(O)c1ccccc1F Amb25837924 [0,2,0,0,0,0|2,0,0]=4 2987 B14R1.160 Cc1ccccc1N(C)CNC(C)=O Amb25036000 [0,2,0,0,0,0|2,0,0]=4 2988 B14R1.160 NC(=O)CCC(c1ccccc1C)O Amb17336588 [0,2,0,0,0,0|2,0,0]=4 2989 B14R1.160 NC(=O)CCC(c1ccccc1Cl)O Amb17340096 [0,2,0,0,0,0|2,0,0]=4 2990 B14R1.160 NC(=O)CCC(c1ccccc1F)O Amb17337158 [0,2,0,0,0,0|2,0,0]=4 2991 B14R1.160 NC(=O)OCC(c1ccccc1Cl)O Amb17610616 [0,2,0,0,0,0|1,0,0]=3 2992 B14R1.160 NC(=O)OC[C@@H](O)c1ccccc1Cl Amb19131130 [0,2,0,0,0,0|1,0,0]=3 2993 B14R1.160 OC(=O)CCC(c1ccccc1Br)C Amb17597110 [0,2,0,0,0,0|2,0,0]=4 2994 B14R1.160 OC(=O)CCC(c1ccccc1C)O Amb17198750 [0,2,0,0,0,0|2,0,0]=4 2995 B14R1.160 OC(=O)CCC(c1ccccc1Cl)O Amb17198765 [0,2,0,0,0,0|2,0,0]=4 2996 B14R1.160 OC(=O)CCC(c1ccccc1F)O Amb17198756 [0,2,0,0,0,0|2,0,0]=4 2997 B14R1.163 BrCC(=O)NCC(c1ccccc1)O Amb17332028 [0,2,0,0,0,0|1,0,0]=3 2998 B14R1.163 C#CC(=O)NCC(N)c1ccccc1 Amb24442445 [0,2,0,0,0,0|1,0,1]=4 2999 B14R1.163 CCC(=O)NCC(=O)c1ccccc1 Amb17336295 [0,2,0,0,0,0|1,0,1]=4 3000 B14R1.163 CNC(=N)NCC(O)c1ccccc1 Amb19061797 [0,2,0,0,0,0|2,0,0]=4 3001 B14R1.163 CNC(=O)CCC(=O)c1ccccc1 Amb17336307 [0,2,0,0,0,0|1,0,1]=4 3002 B14R1.163 CNC(=O)CCC(c1ccccc1)O Amb17336618 [0,2,0,0,0,0|1,0,0]=3 3003 B14R1.163 CNC(=O)CSC(C)c1ccccc1 Amb21620817 [0,2,0,0,0,0|2,0,0]=4 3004 B14R1.163 CNC(=O)NCC(=O)c1ccccc1 Amb24639111 [0,2,0,0,0,0|1,0,1]=4 3005 B14R1.163 CNC(=O)NCC(C)c1ccccc1 Amb25143591 [0,2,0,0,0,0|1,0,0]=3 3006 B14R1.163 CNC(=O)NCC(N)c1ccccc1 Amb25048042 [0,2,0,0,0,0|1,0,0]=3 3007 B14R1.163 CNC(=O)NCC(O)c1ccccc1 Amb24181770 [0,2,0,0,0,0|1,0,0]=3 3008 B14R1.163 CNC(=S)NCC(C)c1ccccc1 Amb24380520 [0,2,0,0,0,0|1,1,0]=4 3009 B14R1.163 COC(=O)C#CC(C)c1ccccc1 Amb24461465 [0,2,0,0,0,0|1,0,1]=4 3010 B14R1.163 COC(=O)C#CC(O)c1ccccc1 Amb25796421 [0,2,0,0,0,0|1,0,1]=4 3011 B14R1.163 COC(=O)C#C[C@H](O)c1ccccc1 Amb25079187 [0,2,0,0,0,0|1,0,1]=4 3012 B14R1.163 COC(=O)CCC(N)c1ccccc1 Amb19373309 [0,2,0,0,0,0|1,0,0]=3 3013 B14R1.163 COC(=O)CCC(c1ccccc1)N Amb10610596 [0,2,0,0,0,0|1,0,0]=3 3014 B14R1.163 C\C(=C\CC(O)c1ccccc1)\C#N Amb24734824 [0,2,0,0,0,0|2,0,0]=4 3015 B14R1.163 C\C(=C\C[C@@H](O)c1ccccc1)\C#N Amb25823039 [0,2,0,0,0,0|2,0,0]=4 3016 B14R1.163 C\C(=C\C[C@H](O)c1ccccc1)\C#N Amb24661103 [0,2,0,0,0,0|2,0,0]=4 3017 B14R1.163 ClCC(=O)NCC(=O)c1ccccc1 Amb2099654 [0,2,0,0,0,0|1,0,1]=4 3018 B14R1.163 ClCC(=O)NCC(c1ccccc1)C Amb1657748 [0,2,0,0,0,0|1,0,0]=3 3019 B14R1.163 ClCC(=O)NCC(c1ccccc1)O Amb17326215 [0,2,0,0,0,0|1,0,0]=3 3020 B14R1.163 NNC(=O)CCC(c1ccccc1)O Amb1808301 [0,2,0,0,0,0|2,0,0]=4 3021 B14R1.163 N\C(=N\OC(=O)CCl)\c1ccccc1 Amb24121345 [0,2,0,0,0,0|1,0,1]=4 3022 B14R1.163 O=C(CBr)NCC(=O)c1ccccc1 Amb23536418 [0,2,0,0,0,0|1,0,1]=4 3023 B14R1.163 OCC(=O)NCC(c1ccccc1)C Amb1110526 [0,2,0,0,0,0|1,0,0]=3 3024 B14R1.415 CC(=O)C(=O)N[C@@H](C)c1ccccc1 Amb24452606 [0,2,0,0,0,0|2,0,0]=4 3025 B14R1.415 CC(=O)C(=O)N[C@H](C)c1ccccc1 Amb25371972 [0,2,0,0,0,0|2,0,0]=4 3026 B14R1.415 CC(C[C@@H](N)C(O)=O)c1ccccc1 Amb17933184 [0,2,0,0,0,0|2,0,0]=4 3027 B14R1.415 CC(c1ccccc1)NC(=O)C(=O)C Amb17401498 [0,2,0,0,0,0|2,0,0]=4 3028 B14R1.417 CC(=O)NC(C)C(C)c1ccccc1 Amb25086516 [0,2,0,0,0,0|1,0,0]=3 3029 B14R1.417 CC(=O)NC(Cl)C(=O)c1ccccc1 Amb24096304 [0,2,0,0,0,0|1,0,1]=4 3030 B14R1.417 CC(=O)N[C@@H](C)[C@@H](C)c1ccccc1 Amb25725960 [0,2,0,0,0,0|1,0,0]=3 3031 B14R1.417 CC(=O)N[C@@H](C)[C@@H](O)c1ccccc1 Amb24418068 [0,2,0,0,0,0|1,0,0]=3 3032 B14R1.417 CC(=O)N[C@@H](C)[C@H](S)c1ccccc1 Amb25165741 [0,2,0,0,0,0|1,0,0]=3 3033 B14R1.417 CC(=O)N[C@H](C)C(=O)c1ccccc1 Amb25695468 [0,2,0,0,0,0|1,0,1]=4 3034 B14R1.417 CC(C)=CC(N)C(C)c1ccccc1 Amb25840651 [0,2,0,0,0,0|2,0,0]=4 3035 B14R1.417 CC(C)=NC(C)C(O)c1ccccc1 Amb24648156 [0,2,0,0,0,0|2,0,0]=4 3036 B14R1.417 CC(C)=N[C@@H](C)[C@H](O)c1ccccc1 Amb24718349 [0,2,0,0,0,0|2,0,0]=4 3037 B14R1.417 CC(C)=N[C@H](C)[C@@H](O)c1ccccc1 Amb25057756 [0,2,0,0,0,0|2,0,0]=4 3038 B14R1.417 CC(NC(N)=O)C(Cl)c1ccccc1 Amb24668959 [0,2,0,0,0,0|2,0,0]=4 3039 B14R1.417 CC(NC(N)=O)C(O)c1ccccc1 Amb25772992 [0,2,0,0,0,0|2,0,0]=4 3040 B14R1.417 C[C@@H](NC(N)=O)[C@@H](O)c1ccccc1 Amb24433430 [0,2,0,0,0,0|2,0,0]=4 3041 B14R1.417 C[C@@H](NC(N)=O)[C@H](Cl)c1ccccc1 Amb25785564 [0,2,0,0,0,0|2,0,0]=4 3042 B14R1.417 C[C@@H](NC(N)=O)[C@H](O)c1ccccc1 Amb25055138 [0,2,0,0,0,0|2,0,0]=4 3043 B14R1.417 NC(CC(O)=O)C(O)c1ccccc1 Amb18108613 [0,2,0,0,0,0|2,0,0]=4 3044 B14R1.417 OC(C(=O)c1ccccc1)NC(=O)C Amb2458920 [0,2,0,0,0,0|1,0,1]=4 3045 B14R1.417 OC(c1ccccc1)C(NC(=O)C)C Amb17595062 [0,2,0,0,0,0|1,0,0]=3 3046 B14R1.540 N#CC(c1ccccc1)CCC(=O)C Amb17594857 [0,2,0,0,0,0|1,0,0]=3 3047 B14R1.678 CC(=O)CCC(c1ccc(cc1)C)Cl Amb17404056 [0,2,0,0,0,0|1,0,0]=3 3048 B14R1.678 CC(=O)NCC(=C)c1ccc(Cl)cc1 Amb25315144 [0,2,0,0,0,0|1,0,1]=4 3049 B14R1.678 CC(=O)NCC(=O)c1ccc(O)cc1 Amb24461771 [0,2,0,0,0,0|1,0,1]=4 3050 B14R1.678 CC(=O)NCC(=O)c1ccc(cc1)C Amb17336296 [0,2,0,0,0,0|1,0,1]=4 3051 B14R1.678 CC(=O)NCC(C)c1ccc(N)cc1 Amb18651285 [0,2,0,0,0,0|1,0,0]=3 3052 B14R1.678 CC(=O)NCC(c1ccc(cc1)C)O Amb17336586 [0,2,0,0,0,0|1,0,0]=3 3053 B14R1.678 CC(=O)NC[C@@H](O)c1ccc(Cl)cc1 Amb24521436 [0,2,0,0,0,0|1,0,0]=3 3054 B14R1.678 CC(=O)OCC(=O)c1ccc(O)cc1 Amb20248329 [0,2,0,0,0,0|0,0,1]=3 3055 B14R1.678 CC(=O)ONC(=N)c1ccc(O)cc1 Amb25773419 [0,2,0,0,0,0|1,0,1]=4 3056 B14R1.678 CC(C)=CCC(O)c1ccc(F)cc1 Amb25813934 [0,2,0,0,0,0|2,0,0]=4 3057 B14R1.678 CC(CCC(O)=O)c1ccc(C)cc1 Amb17778099 [0,2,0,0,0,0|2,0,0]=4 3058 B14R1.678 CC(CCC([O-])=O)c1ccc(C)cc1 Amb17778100 [0,2,0,0,0,0|2,0,0]=4 3059 B14R1.678 Cc1ccc(cc1)C(C)CCC([O-])=O Amb21947924 [0,2,0,0,0,0|2,0,0]=4 3060 B14R1.678 Cc1ccc(cc1)C(C)CNC(N)=O Amb24738573 [0,2,0,0,0,0|2,0,0]=4 3061 B14R1.678 Cc1ccc(cc1)C(N)CCC(O)=O Amb23440419 [0,2,0,0,0,0|2,0,0]=4 3062 B14R1.678 Cc1ccc(cc1)N(C)CNC(C)=O Amb25075652 [0,2,0,0,0,0|2,0,0]=4 3063 B14R1.678 Cc1ccc(cc1)\C(\N)=N\OC(C)=O Amb24423882 [0,2,0,0,0,0|1,0,1]=4 3064 B14R1.678 ClC(c1ccc(cc1)Br)CCC(=O)C Amb17421440 [0,2,0,0,0,0|1,0,0]=3 3065 B14R1.678 ClC(c1ccc(cc1)Cl)CCC(=O)C Amb17407560 [0,2,0,0,0,0|1,0,0]=3 3066 B14R1.678 ClC(c1ccc(cc1)F)CCC(=O)C Amb17404372 [0,2,0,0,0,0|1,0,0]=3 3067 B14R1.678 N\C(=N/OC(=O)C)\c1ccc(cc1)Br Amb1842997 [0,2,0,0,0,0|1,0,1]=4 3068 B14R1.678 O=C(c1ccc(cc1)Br)CNC(=O)C Amb10809366 [0,2,0,0,0,0|1,0,1]=4 3069 B14R1.678 O=C(c1ccc(cc1)Cl)CCC(=O)C Amb2422237 [0,2,0,0,0,0|1,0,1]=4 3070 B14R1.678 O=C(c1ccc(cc1)F)CNC(=O)C Amb17336918 [0,2,0,0,0,0|1,0,1]=4 3071 B14R1.678 OC(c1ccc(cc1)Br)CCC(=O)N Amb17356401 [0,2,0,0,0,0|2,0,0]=4 3072 B14R1.678 OC(c1ccc(cc1)Br)CNC(=O)C Amb17356398 [0,2,0,0,0,0|1,0,0]=3 3073 B14R1.678 OC(c1ccc(cc1)C)CCC(=O)N Amb17336592 [0,2,0,0,0,0|2,0,0]=4 3074 B14R1.678 OC(c1ccc(cc1)Cl)CCC(=O)N Amb17340100 [0,2,0,0,0,0|2,0,0]=4 3075 B14R1.678 OC(c1ccc(cc1)F)CCC(=O)N Amb17337160 [0,2,0,0,0,0|2,0,0]=4 3076 B14R1.678 OC(c1ccc(cc1)F)CNC(=O)C Amb17337157 [0,2,0,0,0,0|1,0,0]=3 3077 B14R1.678 OC(c1ccc(cc1)O)CCC(=O)N Amb17336925 [0,2,0,0,0,0|2,0,0]=4 3078 B14R1.813 CC(=O)CCS(=O)(=O)c1ccccc1 Amb2409569 [0,2,0,0,0,0|2,0,0]=4 3079 B14R1.813 CC(=O)NCC(C)(O)c1ccccc1 Amb21941959 [0,2,0,0,0,0|1,0,0]=3 3080 B14R1.813 CC(=O)OCC(C)(C)c1ccccc1 Amb22264614 [0,2,0,0,0,0|0,0,0]=2 3081 B14R1.813 CC(=O)OCC(F)(F)c1ccccc1 Amb22325299 [0,2,0,0,0,0|0,0,0]=2 3082 B14R1.813 OC(=O)CCC(c1ccccc1)(O)C Amb17336815 [0,2,0,0,0,0|2,0,0]=4 3083 B14R1.3098 CC(COS(C)(=O)=O)c1ccccc1 Amb25730022 [0,2,0,0,0,0|1,0,0]=3 3084 B14R1.3098 CC(c1ccccc1)CNS(=O)(=O)C Amb11251264 [0,2,0,0,0,0|2,0,0]=4 3085 B14R1.3098 CS(=O)(=O)CCC(O)c1ccccc1 Amb21984424 [0,2,0,0,0,0|2,0,0]=4 3086 B14R1.3098 CS(=O)(=O)NCC(N)c1ccccc1 Amb24769776 [0,2,0,0,0,0|2,0,0]=4 3087 B14R1.3098 CS(=O)(=O)OCC(=O)c1ccccc1 Amb25694305 [0,2,0,0,0,0|1,0,1]=4 3088 B14R1.3098 CS(=O)(=O)OCC(N)c1ccccc1 Amb24694535 [0,2,0,0,0,0|1,0,0]=3 3089 B14R1.3098 CS(C)(=O)=NC[C@@H](N)c1ccccc1 Amb24618328 [0,2,0,0,0,0|2,0,0]=4 3090 B14R1.76 CC(=O)NCCc1cccc(C#C)[n]1 Amb24073083 [0,2,0,0,0,0|2,0,0]=4 3091 B14R1.76 CC(=O)NCCc1cccc(C#N)[n]1 Amb24073082 [0,2,0,0,0,0|2,0,0]=4 3092 B14R1.76 CC(=O)NCCc1cccc(c1)C#C Amb24073064 [0,2,0,0,0,0|1,0,0]=3 3093 B14R1.76 COc1cccc(c1)CCCC(=C)C Amb13890689 [0,2,0,0,0,0|2,0,0]=4 3094 B14R1.147 CS(=O)(=O)OCCc1cccc(Br)c1 Amb25795379 [0,2,0,0,0,0|1,0,0]=3 3095 B14R1.147 CS(=O)(=O)OCCc1cccc(F)c1 Amb25242785 [0,2,0,0,0,0|1,0,0]=3 3096 B14R1.147 CS(=O)(=O)OCCc1cccc(I)c1 Amb25033423 [0,2,0,0,0,0|1,0,0]=3 3097 B14R1.147 Fc1cccc(c1)CCNS(=O)(=O)C Amb11251539 [0,2,0,0,0,0|2,0,0]=4 3098 B14R1.154 CC(=O)CCOc1cccc(c1Cl)Cl Amb17157525 [0,2,0,0,0,0|2,0,0]=4 3099 B14R1.154 CC(=O)NCCc1cccc(F)c1O Amb25378953 [0,2,0,0,0,0|1,0,0]=3 3100 B14R1.154 CC(=O)OCCc1cccc(F)c1F Amb24092745 [0,2,0,0,0,0|0,0,0]=2 3101 B14R1.154 Cc1cccc(CCNC(N)=O)c1C Amb24602443 [0,2,0,0,0,0|2,0,0]=4 3102 B14R1.687 CC(=O)CCOc1ccc(c(c1)C)Cl Amb17140721 [0,2,0,0,0,0|2,0,0]=4 3103 B14R1.687 CC(=O)CCOc1ccc(c(c1)Cl)Cl Amb17157527 [0,2,0,0,0,0|2,0,0]=4 3104 B14R1.687 CC(=O)NCCc1cc(N)c(N)cc1 Amb18651570 [0,2,0,0,0,0|1,0,0]=3 3105 B14R1.687 CC(=O)NCCc1ccc(O)c(S)c1 Amb25046734 [0,2,0,0,0,0|1,0,0]=3 3106 B14R1.687 CC(=O)OCCc1cc(O)c(O)cc1 Amb22055516 [0,2,0,0,0,0|0,0,0]=2 3107 B14R1.687 CC(=S)NCCc1cc(O)c(O)cc1 Amb24526533 [0,2,0,0,0,0|1,1,0]=4 3108 B14R1.687 Cc1cc(CCNC(N)=O)ccc1C Amb24390757 [0,2,0,0,0,0|2,0,0]=4 3109 B14R1.687 Cc1ccc(CCCC(O)=O)cc1Br Amb18586156 [0,2,0,0,0,0|2,0,0]=4 3110 B14R1.687 NC(=O)CCCc1ccc(c(c1)C)C Amb17235128 [0,2,0,0,0,0|2,0,0]=4 3111 B14R1.687 NC(=O)CCCc1ccc(c(c1)C)F Amb17236174 [0,2,0,0,0,0|2,0,0]=4 3112 B14R1.687 OC(=O)CCCc1ccc(c(c1)N)N Amb17202022 [0,2,0,0,0,0|2,0,0]=4 3113 B14R1.687 Oc1cc(CCCC(O)=O)ccc1O Amb22043438 [0,2,0,0,0,0|2,0,0]=4 3114 B14R1.687 Oc1cc(CCCC(O)=O)ccc1O Amb24120391 [0,2,0,0,0,0|2,0,0]=4 3115 B14R1.1025 C#CC(=O)NCCc1cccc(Br)c1 Amb25322459 [0,2,0,0,0,0|1,0,1]=4 3116 B14R1.1025 CCC(=O)NCCc1cccc(c1)F Amb13968706 [0,2,0,0,0,0|1,0,0]=3 3117 B14R1.1025 CNC(=N)NCCc1cc(Br)ccc1 Amb24339585 [0,2,0,0,0,0|2,0,0]=4 3118 B14R1.1025 CNC(=N)NCCc1cc(F)ccc1 Amb19063434 [0,2,0,0,0,0|2,0,0]=4 3119 B14R1.1025 CNC(=O)CCCc1cccc(c1)N Amb17336480 [0,2,0,0,0,0|1,0,0]=3 3120 B14R1.1025 CNC(=O)CCNc1cc(Cl)ccc1 Amb24335723 [0,2,0,0,0,0|2,0,0]=4 3121 B14R1.1025 CNC(=O)CCNc1cc(F)ccc1 Amb19064591 [0,2,0,0,0,0|2,0,0]=4 3122 B14R1.1025 CNC(=O)CCNc1cc(I)ccc1 Amb25663742 [0,2,0,0,0,0|2,0,0]=4 3123 B14R1.1025 CNC(=O)CCNc1cc(N)ccc1 Amb19079410 [0,2,0,0,0,0|2,0,0]=4 3124 B14R1.1025 CNC(=O)CCOc1cccc(c1)Br Amb17266148 [0,2,0,0,0,0|2,0,0]=4 3125 B14R1.1025 CNC(=O)CCOc1cccc(c1)N Amb17235929 [0,2,0,0,0,0|2,0,0]=4 3126 B14R1.1025 CNC(=O)COCc1cccc(N)c1 Amb23569205 [0,2,0,0,0,0|2,0,0]=4 3127 B14R1.1025 CNC(=O)CSCc1cccc(c1)Cl Amb10667899 [0,2,0,0,0,0|2,0,0]=4 3128 B14R1.1025 CNC(=O)NCCc1cc(Br)ccc1 Amb25375227 [0,2,0,0,0,0|1,0,0]=3 3129 B14R1.1025 CNC(=O)NCCc1cc(F)ccc1 Amb25257022 [0,2,0,0,0,0|1,0,0]=3 3130 B14R1.1025 CNC(=O)NCCc1cc(N)ccc1 Amb25205557 [0,2,0,0,0,0|1,0,0]=3 3131 B14R1.1025 CNC(=S)NCCc1cc(Br)ccc1 Amb24339588 [0,2,0,0,0,0|1,1,0]=4 3132 B14R1.1025 CNC(=S)NCCc1cc(F)ccc1 Amb25748399 [0,2,0,0,0,0|1,1,0]=4 3133 B14R1.1025 COC(=O)C=CCc1cccc(Cl)c1 Amb22229468 [0,2,0,0,0,0|1,0,1]=4 3134 B14R1.1025 COC(=O)CCSc1cccc(N)c1 Amb22058830 [0,2,0,0,0,0|2,0,0]=4 3135 B14R1.1025 COC(=O)CNCc1cccc(c1)F Amb10609869 [0,2,0,0,0,0|2,0,0]=4 3136 B14R1.1025 COC(=O)COCc1cccc(N)c1 Amb23443790 [0,2,0,0,0,0|2,0,0]=4 3137 B14R1.1025 COC(=O)NCCc1cccc(O)c1 Amb22395729 [0,2,0,0,0,0|1,0,0]=3 3138 B14R1.1025 Cc1cc(CCNC(=N)NC)ccc1 Amb19073518 [0,2,0,0,0,0|2,0,0]=4 3139 B14R1.1025 Cc1cc(CCNC(=O)NC)ccc1 Amb24447971 [0,2,0,0,0,0|1,0,0]=3 3140 B14R1.1025 Cc1cc(CCNC(=O)NN)ccc1 Amb19061784 [0,2,0,0,0,0|2,0,0]=4 3141 B14R1.1025 Cc1cc(CCNC(=S)NC)ccc1 Amb24457215 [0,2,0,0,0,0|1,1,0]=4 3142 B14R1.1025 Cc1cc(CSCC(=O)NC)ccc1 Amb21128708 [0,2,0,0,0,0|2,0,0]=4 3143 B14R1.1025 Cc1cc(ccc1)NCCC(=O)NC Amb19074017 [0,2,0,0,0,0|2,0,0]=4 3144 B14R1.1025 ClCC(=O)NCCc1cccc(c1)Br Amb17421888 [0,2,0,0,0,0|1,0,0]=3 3145 B14R1.1025 ClCC(=O)NCCc1cccc(c1)C Amb17322980 [0,2,0,0,0,0|1,0,0]=3 3146 B14R1.1025 ClCC(=O)NCCc1cccc(c1)Cl Amb1676616 [0,2,0,0,0,0|1,0,0]=3 3147 B14R1.1025 NCC(=O)NCCc1cccc(c1)Br Amb17414918 [0,2,0,0,0,0|1,0,0]=3 3148 B14R1.1025 NCC(=O)NCCc1cccc(c1)C Amb17401667 [0,2,0,0,0,0|1,0,0]=3 3149 B14R1.1025 NNC(=O)NCCc1cc(Br)ccc1 Amb25054212 [0,2,0,0,0,0|2,0,0]=4 3150 B14R1.1025 OCC(=O)NCCc1cccc(c1)Br Amb17415247 [0,2,0,0,0,0|1,0,0]=3 3151 B14R1.1025 OCC(=O)NCCc1cccc(c1)C Amb17401772 [0,2,0,0,0,0|1,0,0]=3 3152 B14R1.4250 CC(=C)CCCc1cc(F)cc(c1)Cl Amb13890677 [0,2,0,0,0,0|2,0,0]=4 3153 B14R1.4250 CC(=O)CCOc1cc(Cl)cc(c1)Cl Amb17157526 [0,2,0,0,0,0|2,0,0]=4 3154 B14R1.4250 CC(=O)NCCc1cc(C)cc(C)c1 Amb25703683 [0,2,0,0,0,0|1,0,0]=3 3155 B14R1.4250 Cc1cc(CCCC(O)=O)cc(C)c1 Amb18565108 [0,2,0,0,0,0|2,0,0]=4 3156 B14R1.4250 NC(=O)NCCc1cc(F)cc(F)c1 Amb19086127 [0,2,0,0,0,0|2,0,0]=4 3157 B14R1.5956 CC(CCc1cccc(F)c1)C(O)=O Amb19337858 [0,2,0,0,0,0|2,0,0]=4 3158 B14R1.5956 OC(=O)C(CCc1cccc(c1)Br)C Amb17265517 [0,2,0,0,0,0|2,0,0]=4 3159 B14R1.5956 OC(=O)C(CCc1cccc(c1)Br)N Amb17473592 [0,2,0,0,0,0|2,0,0]=4 3160 B14R1.5956 OC(=O)C(CCc1cccc(c1)C)C Amb17235379 [0,2,0,0,0,0|2,0,0]=4 3161 B14R1.5956 OC(=O)C(CCc1cccc(c1)C)N Amb17470843 [0,2,0,0,0,0|2,0,0]=4 3162 B14R1.5956 OC(=O)C(CCc1cccc(c1)Cl)C Amb17241242 [0,2,0,0,0,0|2,0,0]=4 3163 B14R1.5956 OC(=O)C(CCc1cccc(c1)Cl)N Amb17471481 [0,2,0,0,0,0|2,0,0]=4 3164 B14R1.5956 OC(=O)C(CCc1cccc(c1)F)N Amb17470960 [0,2,0,0,0,0|2,0,0]=4 3165 B14R1.5956 OC(=O)C(CCc1cccc(c1)O)C Amb17336810 [0,2,0,0,0,0|2,0,0]=4 3166 B14R1.5978 CC(=O)NC(C)Cc1cccc(Cl)c1 Amb24510947 [0,2,0,0,0,0|1,0,0]=3 3167 B14R1.5978 CC(=O)NC(C)Cc1cccc(O)c1 Amb24506362 [0,2,0,0,0,0|1,0,0]=3 3168 B14R1.5978 CC(=O)N[C@@H](C)Cc1cccc(O)c1 Amb25166006 [0,2,0,0,0,0|1,0,0]=3 3169 B14R1.5978 CC(=O)N[C@@H](C)Cc1cccc(S)c1 Amb24404829 [0,2,0,0,0,0|1,0,0]=3 3170 B14R1.5978 CC(C)=CC(N)Cc1cc(C)ccc1 Amb24498432 [0,2,0,0,0,0|2,0,0]=4 3171 B14R1.5978 CC(C)=CC(N)Cc1cccc(Cl)c1 Amb25677902 [0,2,0,0,0,0|2,0,0]=4 3172 B14R1.5978 CC(C)=CC(O)Cc1cccc(Br)c1 Amb24431080 [0,2,0,0,0,0|2,0,0]=4 3173 B14R1.5978 CC(C)=CC(O)Cc1cccc(Cl)c1 Amb25167177 [0,2,0,0,0,0|2,0,0]=4 3174 B14R1.5978 CC(Cc1cccc(Cl)c1)NC(N)=O Amb24753672 [0,2,0,0,0,0|2,0,0]=4 3175 B14R1.5978 CC(Cc1cccc(F)c1)CC(O)=O Amb19149363 [0,2,0,0,0,0|2,0,0]=4 3176 B14R1.5978 CC(Cc1cccc(F)c1)NC(N)=O Amb25375940 [0,2,0,0,0,0|2,0,0]=4 3177 B14R1.5978 CC(Cc1cccc(c1)Br)CC(=O)O Amb17265519 [0,2,0,0,0,0|2,0,0]=4 3178 B14R1.5978 CC(Cc1cccc(c1)Br)NC(=O)C Amb12283588 [0,2,0,0,0,0|1,0,0]=3 3179 B14R1.5978 CC(Cc1cccc(c1)Cl)CC(=O)O Amb17241247 [0,2,0,0,0,0|2,0,0]=4 3180 B14R1.5978 CC(Cc1cccc(c1)O)CC(=O)O Amb17336809 [0,2,0,0,0,0|2,0,0]=4 3181 B14R1.5978 C\C(\Cc1cccc(F)c1)=C\C(C)=O Amb24638510 [0,2,0,0,0,0|1,0,1]=4 3182 B14R1.5978 Cc1cccc(CC(C)NC(C)=O)c1 Amb24393394 [0,2,0,0,0,0|1,0,0]=3 3183 B14R1.5978 Cc1cccc(C[C@H](C)NC(C)=O)c1 Amb25102710 [0,2,0,0,0,0|1,0,0]=3 3184 B14R1.5978 NC(Cc1cc(O)ccc1)CC(O)=O Amb18814152 [0,2,0,0,0,0|2,0,0]=4 3185 B14R1.5978 NC(Cc1cccc(c1)Br)CC(=O)O Amb17473593 [0,2,0,0,0,0|2,0,0]=4 3186 B14R1.5978 NC(Cc1cccc(c1)C)CC(=O)O Amb17470844 [0,2,0,0,0,0|2,0,0]=4 3187 B14R1.5978 NC(Cc1cccc(c1)Cl)CC(=O)O Amb17471482 [0,2,0,0,0,0|2,0,0]=4 3188 B14R1.5978 NC(Cc1cccc(c1)F)CC(=O)O Amb17470961 [0,2,0,0,0,0|2,0,0]=4 3189 B14R1.5978 N[C@@H](Cc1cccc(Br)c1)CC(O)=O Amb22757443 [0,2,0,0,0,0|2,0,0]=4 3190 B14R1.5978 N[C@@H](Cc1cccc(Cl)c1)CC(O)=O Amb22747011 [0,2,0,0,0,0|2,0,0]=4 3191 B14R1.5978 N[C@@H](Cc1cccc(c1)Cl)CC(=O)O Amb16231757 [0,2,0,0,0,0|2,0,0]=4 3192 B14R1.5978 N[C@@H](Cc1cccc(c1)F)CC(=O)O Amb16231652 [0,2,0,0,0,0|2,0,0]=4 3193 B14R1.5978 N[C@H](Cc1cccc(c1)C)CC(=O)O Amb16231754 [0,2,0,0,0,0|2,0,0]=4 3194 B14R1.5978 O=C(Cc1cccc(c1)Br)CC(=O)C Amb17264233 [0,2,0,0,0,0|1,0,1]=4 3195 B14R1.5978 O=C(Cc1cccc(c1)C)CC(=O)C Amb17234896 [0,2,0,0,0,0|1,0,1]=4 3196 B14R1.5978 O=C(Cc1cccc(c1)Cl)CC(=O)C Amb17240732 [0,2,0,0,0,0|1,0,1]=4 3197 B14R1.5978 OC(Cc1cccc(c1)Br)CC(=O)O Amb17266776 [0,2,0,0,0,0|2,0,0]=4 3198 B14R1.5978 OC(Cc1cccc(c1)C)CC(=O)O Amb17235899 [0,2,0,0,0,0|2,0,0]=4 3199 B14R1.5978 OC(Cc1cccc(c1)Cl)CC(=O)O Amb17241782 [0,2,0,0,0,0|2,0,0]=4 3200 B14R1.6072 CC(=O)CCOc1cc(C)ccc1Cl Amb17140722 [0,2,0,0,0,0|2,0,0]=4 3201 B14R1.6072 CC(=O)CCOc1cc(Cl)ccc1Cl Amb17157523 [0,2,0,0,0,0|2,0,0]=4 3202 B14R1.6072 Cc1ccc(cc1CCCC(=O)N)C Amb17235131 [0,2,0,0,0,0|2,0,0]=4 3203 B14R1.6072 OC(=O)CCCC1=CC(=O)C=CC1=O Amb17595083 [0,2,0,0,0,0|2,0,0]=4 3204 B14R1.6072 OC(=O)CCCc1cc(Cl)ccc1F Amb18244564 [0,2,0,0,0,0|2,0,0]=4 3205 B14R1.6072 OC(=O)CCCc1cc(O)ccc1O Amb10976192 [0,2,0,0,0,0|2,0,0]=4 3206 B14R1.6072 Oc1ccc(Cl)cc1CCCC(O)=O Amb18110188 [0,2,0,0,0,0|2,0,0]=4 3207 B14R1.6072 Oc1ccc(F)cc1CCCC(O)=O Amb18057883 [0,2,0,0,0,0|2,0,0]=4 3208 B14R1.96 CC(=O)CCNc1ccccc1C#C Amb24635669 [0,2,0,0,0,0|2,0,0]=4 3209 B14R1.161 CC(C)=C(C)CCc1ccccc1O Amb25050251 [0,2,0,0,0,0|2,0,0]=4 3210 B14R1.161 Cc1ccccc1NCC(C)C(C)=O Amb25299393 [0,2,0,0,0,0|2,0,0]=4 3211 B14R1.161 OC(=O)C(CCc1ccccc1Br)N Amb17473600 [0,2,0,0,0,0|2,0,0]=4 3212 B14R1.161 OC(=O)C(CCc1ccccc1C)C Amb17235378 [0,2,0,0,0,0|2,0,0]=4 3213 B14R1.161 OC(=O)C(CCc1ccccc1C)N Amb17470839 [0,2,0,0,0,0|2,0,0]=4 3214 B14R1.161 OC(=O)C(CCc1ccccc1Cl)C Amb17241241 [0,2,0,0,0,0|2,0,0]=4 3215 B14R1.161 OC(=O)C(CCc1ccccc1Cl)N Amb17471477 [0,2,0,0,0,0|2,0,0]=4 3216 B14R1.161 OC(=O)C(CCc1ccccc1F)C Amb17236370 [0,2,0,0,0,0|2,0,0]=4 3217 B14R1.161 OC(=O)C(CCc1ccccc1F)N Amb17470953 [0,2,0,0,0,0|2,0,0]=4 3218 B14R1.242 CS(=O)(=O)OCCc1ccccc1Br Amb24092749 [0,2,0,0,0,0|1,0,0]=3 3219 B14R1.242 Cc1ccccc1CCOS(C)(=O)=O Amb22266352 [0,2,0,0,0,0|1,0,0]=3 3220 B14R1.242 Fc1ccccc1CCNS(=O)(=O)C Amb11251283 [0,2,0,0,0,0|2,0,0]=4 3221 B14R1.337 CC(=O)NC(C)Cc1ccccc1Cl Amb24570130 [0,2,0,0,0,0|1,0,0]=3 3222 B14R1.337 CC(C)=CC(O)Cc1ccccc1C Amb25186484 [0,2,0,0,0,0|2,0,0]=4 3223 B14R1.337 CC(C)=CC(O)Cc1ccccc1Cl Amb25048832 [0,2,0,0,0,0|2,0,0]=4 3224 B14R1.337 CC(Cc1ccccc1C)CC(=O)O Amb17235384 [0,2,0,0,0,0|2,0,0]=4 3225 B14R1.337 CC(Cc1ccccc1Cl)CC(=O)O Amb17241244 [0,2,0,0,0,0|2,0,0]=4 3226 B14R1.337 CC(Cc1ccccc1F)CC(=O)O Amb17236372 [0,2,0,0,0,0|2,0,0]=4 3227 B14R1.337 Cc1ccccc1CC(C)NC(C)=O Amb25833113 [0,2,0,0,0,0|1,0,0]=3 3228 B14R1.337 Cc1ccccc1C[C@@H](N)CC(O)=O Amb22747177 [0,2,0,0,0,0|2,0,0]=4 3229 B14R1.337 Cc1ccccc1C[C@H](C)NC(C)=O Amb25091141 [0,2,0,0,0,0|1,0,0]=3 3230 B14R1.337 NC(Cc1ccccc1Br)CC(=O)O Amb17473601 [0,2,0,0,0,0|2,0,0]=4 3231 B14R1.337 NC(Cc1ccccc1C)CC(=O)O Amb17470840 [0,2,0,0,0,0|2,0,0]=4 3232 B14R1.337 NC(Cc1ccccc1Cl)CC(=O)O Amb17471478 [0,2,0,0,0,0|2,0,0]=4 3233 B14R1.337 NC(Cc1ccccc1F)CC(=O)O Amb17470954 [0,2,0,0,0,0|2,0,0]=4 3234 B14R1.337 N[C@@H](Cc1ccccc1Br)CC(O)=O Amb22746341 [0,2,0,0,0,0|2,0,0]=4 3235 B14R1.337 N[C@@H](Cc1ccccc1Cl)CC(O)=O Amb22746257 [0,2,0,0,0,0|2,0,0]=4 3236 B14R1.337 N[C@@H](Cc1ccccc1F)CC(=O)O Amb16231750 [0,2,0,0,0,0|2,0,0]=4 3237 B14R1.337 N[C@@H](Cc1ccccc1F)CC(O)=O Amb22747012 [0,2,0,0,0,0|2,0,0]=4 3238 B14R1.337 N[C@H](Cc1ccccc1C)CC(=O)O Amb16231753 [0,2,0,0,0,0|2,0,0]=4 3239 B14R1.337 N[C@H](Cc1ccccc1F)CC(O)=O Amb19929569 [0,2,0,0,0,0|2,0,0]=4 3240 B14R1.337 O=C(Cc1ccccc1C)CC(=O)C Amb17234893 [0,2,0,0,0,0|1,0,1]=4 3241 B14R1.337 O=C(Cc1ccccc1Cl)CC(=O)C Amb17240729 [0,2,0,0,0,0|1,0,1]=4 3242 B14R1.337 O=C(Cc1ccccc1F)CC(=O)C Amb17235880 [0,2,0,0,0,0|1,0,1]=4 3243 B14R1.337 OC(Cc1ccccc1C)CC(=O)O Amb17235898 [0,2,0,0,0,0|2,0,0]=4 3244 B14R1.337 OC(Cc1ccccc1Cl)CC(=O)O Amb17241781 [0,2,0,0,0,0|2,0,0]=4 3245 B14R1.337 OC(Cc1ccccc1F)CC(=O)O Amb17236718 [0,2,0,0,0,0|2,0,0]=4 3246 B14R1.837 BrCC(=O)NCCc1ccccc1C Amb17331119 [0,2,0,0,0,0|1,0,0]=3 3247 B14R1.837 CCC(=O)NCCc1ccccc1Br Amb13133639 [0,2,0,0,0,0|1,0,0]=3 3248 B14R1.837 CCC(=O)NCCc1ccccc1C Amb10672003 [0,2,0,0,0,0|1,0,0]=3 3249 B14R1.837 CNC(=N)NCCc1ccccc1F Amb19063433 [0,2,0,0,0,0|2,0,0]=4 3250 B14R1.837 CNC(=O)CCNc1ccccc1Br Amb24454929 [0,2,0,0,0,0|2,0,0]=4 3251 B14R1.837 CNC(=O)CCNc1ccccc1F Amb19064593 [0,2,0,0,0,0|2,0,0]=4 3252 B14R1.837 CNC(=O)CCNc1ccccc1I Amb25663743 [0,2,0,0,0,0|2,0,0]=4 3253 B14R1.837 CNC(=O)CCNc1ccccc1N Amb19079422 [0,2,0,0,0,0|2,0,0]=4 3254 B14R1.837 CNC(=O)CCOc1ccccc1Br Amb17266147 [0,2,0,0,0,0|2,0,0]=4 3255 B14R1.837 CNC(=O)CCOc1ccccc1N Amb17235928 [0,2,0,0,0,0|2,0,0]=4 3256 B14R1.837 CNC(=O)CCSc1ccccc1Br Amb19345121 [0,2,0,0,0,0|2,0,0]=4 3257 B14R1.837 CNC(=O)CCSc1ccccc1F Amb19422943 [0,2,0,0,0,0|2,0,0]=4 3258 B14R1.837 CNC(=O)CSCc1ccccc1Cl Amb21799001 [0,2,0,0,0,0|2,0,0]=4 3259 B14R1.837 CNC(=O)NCCc1ccccc1Br Amb13047212 [0,2,0,0,0,0|1,0,0]=3 3260 B14R1.837 CNC(=O)O\N=C\c1ccccc1Br Amb24664342 [0,2,0,0,0,0|1,0,1]=4 3261 B14R1.837 COC(=O)C#CCc1ccccc1F Amb25338856 [0,2,0,0,0,0|1,0,1]=4 3262 B14R1.837 COC(=O)CCCN1C=CC=CC1=O Amb19080573 [0,2,0,0,0,0|2,0,0]=4 3263 B14R1.837 COC(=O)CCOc1ccccc1N Amb19148869 [0,2,0,0,0,0|2,0,0]=4 3264 B14R1.837 COC(=O)CCSc1ccccc1N Amb22461590 [0,2,0,0,0,0|2,0,0]=4 3265 B14R1.837 COC(=O)CNCc1ccccc1C Amb10610000 [0,2,0,0,0,0|2,0,0]=4 3266 B14R1.837 COC(=O)CNCc1ccccc1Cl Amb10609298 [0,2,0,0,0,0|2,0,0]=4 3267 B14R1.837 COC(=O)NCCc1ccccc1Br Amb22831370 [0,2,0,0,0,0|1,0,0]=3 3268 B14R1.837 COC(=O)NCCc1ccccc1N Amb17777450 [0,2,0,0,0,0|1,0,0]=3 3269 B14R1.837 Cc1ccccc1CCNC(=O)NC Amb25272370 [0,2,0,0,0,0|1,0,0]=3 3270 B14R1.837 Cc1ccccc1CCNC(=S)NC Amb25221284 [0,2,0,0,0,0|1,1,0]=4 3271 B14R1.837 Cc1ccccc1NCCC(=O)NC Amb19078979 [0,2,0,0,0,0|2,0,0]=4 3272 B14R1.837 ClCC(=O)NCCc1ccccc1C Amb1677630 [0,2,0,0,0,0|1,0,0]=3 3273 B14R1.837 ClCC(=O)NCCc1ccccc1Cl Amb17407824 [0,2,0,0,0,0|1,0,0]=3 3274 B14R1.837 NCC(=O)NCCc1ccccc1C Amb17401666 [0,2,0,0,0,0|1,0,0]=3 3275 B14R1.837 NCC(=O)NCCc1ccccc1Cl Amb17404214 [0,2,0,0,0,0|1,0,0]=3 3276 B14R1.837 NNC(=O)NCCc1ccccc1Cl Amb24336508 [0,2,0,0,0,0|2,0,0]=4 3277 B14R1.837 OCC(=O)NCCc1ccccc1C Amb17401770 [0,2,0,0,0,0|1,0,0]=3 3278 B14R1.837 OCC(=O)NCCc1ccccc1Cl Amb17404293 [0,2,0,0,0,0|1,0,0]=3 3279 B14R1.837 OCC(=O)NCCc1ccccc1F Amb17402182 [0,2,0,0,0,0|1,0,0]=3 3280 B14R1.4464 CC(=N)NCCc1ccc(Cl)cc1Cl Amb25037807 [0,2,0,0,0,0|2,0,0]=4 3281 B14R1.4464 CC(=O)CCOc1ccc(cc1C)Cl Amb17140720 [0,2,0,0,0,0|2,0,0]=4 3282 B14R1.4464 CC(=O)CCOc1ccc(cc1Cl)Cl Amb17157524 [0,2,0,0,0,0|2,0,0]=4 3283 B14R1.4464 CC(=O)CCOc1ccc(cc1Cl)F Amb17140994 [0,2,0,0,0,0|2,0,0]=4 3284 B14R1.4464 CC(=O)NCCc1ccc(Cl)cc1Cl Amb24510948 [0,2,0,0,0,0|1,0,0]=3 3285 B14R1.4464 CC(=O)NCCc1ccc(O)cc1O Amb25701609 [0,2,0,0,0,0|1,0,0]=3 3286 B14R1.4464 Cc1cc(Br)ccc1CCCC(O)=O Amb18586097 [0,2,0,0,0,0|2,0,0]=4 3287 B14R1.4464 Cc1cc(F)ccc1CCNC(C)=O Amb25855224 [0,2,0,0,0,0|1,0,0]=3 3288 B14R1.4464 Cc1ccc(CCCC(O)=O)c(Br)c1 Amb18073396 [0,2,0,0,0,0|2,0,0]=4 3289 B14R1.4464 Cc1ccc(CCNC(N)=O)c(C)c1 Amb25164390 [0,2,0,0,0,0|2,0,0]=4 3290 B14R1.4464 NC(=O)CCCc1ccc(cc1C)C Amb17235138 [0,2,0,0,0,0|2,0,0]=4 3291 B14R1.4464 O=C(Cl)CCCc1ccc(F)cc1F Amb22229451 [0,2,0,0,0,0|2,0,0]=4 3292 B14R1.4464 Oc1ccc(CCCC(O)=O)c(Cl)c1 Amb18556146 [0,2,0,0,0,0|2,0,0]=4 3293 B14R1.4920 CC(=O)CCCc1c(F)cccc1Cl Amb17241803 [0,2,0,0,0,0|1,0,0]=3 3294 B14R1.4920 CC(=O)CCOc1c(C)cccc1C Amb17139356 [0,2,0,0,0,0|2,0,0]=4 3295 B14R1.4920 CC(=O)CCOc1c(Cl)cccc1Cl Amb17157522 [0,2,0,0,0,0|2,0,0]=4 3296 B14R1.4920 Cc1cccc(C)c1CCNC(N)=O Amb24710078 [0,2,0,0,0,0|2,0,0]=4 3297 B14R1.425 CC(=O)C(=C)C(C)Nc1ccccc1 Amb25737943 [0,2,0,0,0,0|2,0,0]=4 3298 B14R1.425 CC(=O)C(C)N(C)Cc1ccccc1 Amb19078620 [0,2,0,0,0,0|2,0,0]=4 3299 B14R1.425 CC(=O)N(C)C(C)Cc1c[n]ccc1 Amb22055795 [0,2,0,0,0,0|2,0,0]=4 3300 B14R1.425 CC(=O)N(O)C(=O)Cc1ccccc1 Amb22754381 [0,2,0,0,0,0|1,0,1]=4 3301 B14R1.425 CC(Cc1ccccc1)N(N)C(N)=O Amb22446446 [0,2,0,0,0,0|2,0,0]=4 3302 B14R1.425 CN(C(=O)C(=O)C)Cc1ccccc1 Amb17401499 [0,2,0,0,0,0|2,0,0]=4 3303 B14R1.425 NC(Cc1ccccc1)C(O)C(O)=O Amb18652122 [0,2,0,0,0,0|2,0,0]=4 3304 B14R1.425 N[C@@H](Cc1ccccc1)[C@@H](O)C(O)=O Amb22744925 [0,2,0,0,0,0|2,0,0]=4 3305 B14R1.425 N[C@@H](Cc1ccccc1)[C@@H](O)C(O)=O Amb22750622 [0,2,0,0,0,0|2,0,0]=4 3306 B14R1.425 N[C@@H](Cc1ccccc1)[C@H](O)C(O)=O Amb22746338 [0,2,0,0,0,0|2,0,0]=4 3307 B14R1.425 N[C@@H](Cc1ccccc1)[C@H](O)C(O)=O Amb22747652 [0,2,0,0,0,0|2,0,0]=4 3308 B14R1.549 CC(=O)CC(C#N)Nc1ccccc1 Amb25096428 [0,2,0,0,0,0|2,0,0]=4 3309 B14R1.549 CC(=O)CN(Cc1ccccc1)CC Amb19078590 [0,2,0,0,0,0|2,0,0]=4 3310 B14R1.549 CC(=O)NC(Cc1ccccc1)C#N Amb24539287 [0,2,0,0,0,0|1,0,0]=3 3311 B14R1.549 CC(=O)NC(Cc1ccccc1)C=C Amb24096354 [0,2,0,0,0,0|1,0,0]=3 3312 B14R1.549 ClC[C@H](Cc1ccccc1)NC(=O)C Amb17103592 [0,2,0,0,0,0|1,0,0]=3 3313 B14R1.549 N#CC(Cc1ccccc1)CC(=O)O Amb17336081 [0,2,0,0,0,0|2,0,0]=4 3314 B14R1.549 OC[C@H](Cc1ccccc1)NC(=O)C Amb17102648 [0,2,0,0,0,0|1,0,0]=3 3315 B14R1.698 CC(=O)NC(=O)Cc1ccc(Cl)cc1 Amb25119239 [0,2,0,0,0,0|1,0,1]=4 3316 B14R1.698 CC(=O)NC(C)Cc1ccc(F)cc1 Amb24721876 [0,2,0,0,0,0|1,0,0]=3 3317 B14R1.698 CC(=O)NC(C)Cc1ccc(O)cc1 Amb25123953 [0,2,0,0,0,0|1,0,0]=3 3318 B14R1.698 CC(=O)N[C@@H](C)Cc1ccc(O)cc1 Amb24345555 [0,2,0,0,0,0|1,0,0]=3 3319 B14R1.698 CC(C)=CC(N)Cc1ccc(C)cc1 Amb24599904 [0,2,0,0,0,0|2,0,0]=4 3320 B14R1.698 CC(C)=CC(O)Cc1ccc(Br)cc1 Amb25167084 [0,2,0,0,0,0|2,0,0]=4 3321 B14R1.698 CC(C)=CC(O)Cc1ccc(F)cc1 Amb25167085 [0,2,0,0,0,0|2,0,0]=4 3322 B14R1.698 CC(Cc1ccc(Cl)cc1)NC(N)=O Amb22461493 [0,2,0,0,0,0|2,0,0]=4 3323 B14R1.698 CC(Cc1ccc(Cl)cc1)OC(O)=O Amb24063646 [0,2,0,0,0,0|1,0,0]=3 3324 B14R1.698 CC(Cc1ccc(F)cc1)NC(N)=O Amb19053109 [0,2,0,0,0,0|2,0,0]=4 3325 B14R1.698 CC(Cc1ccc(cc1)Br)CC(=O)O Amb17265523 [0,2,0,0,0,0|2,0,0]=4 3326 B14R1.698 CC(Cc1ccc(cc1)Br)NC(=O)C Amb10652716 [0,2,0,0,0,0|1,0,0]=3 3327 B14R1.698 CC(Cc1ccc(cc1)F)CC(=O)O Amb17236375 [0,2,0,0,0,0|2,0,0]=4 3328 B14R1.698 CC(Cc1ccc(cc1)O)CC(=O)O Amb17336807 [0,2,0,0,0,0|2,0,0]=4 3329 B14R1.698 C\C(\Cc1ccc(Br)cc1)=C\C(C)=O Amb24409214 [0,2,0,0,0,0|1,0,1]=4 3330 B14R1.698 Cc1ccc(CC(Br)CC(O)=O)cc1 Amb18108429 [0,2,0,0,0,0|2,0,0]=4 3331 B14R1.698 Cc1ccc(CC(Cl)CC(O)=O)cc1 Amb18627988 [0,2,0,0,0,0|2,0,0]=4 3332 B14R1.698 NC(Cc1ccc(O)cc1)CC(O)=O Amb18814153 [0,2,0,0,0,0|2,0,0]=4 3333 B14R1.698 NC(Cc1ccc(cc1)Br)CC(=O)O Amb17473597 [0,2,0,0,0,0|2,0,0]=4 3334 B14R1.698 NC(Cc1ccc(cc1)Cl)CC(=O)O Amb17471486 [0,2,0,0,0,0|2,0,0]=4 3335 B14R1.698 N[C@@H](CC(O)=O)Cc1ccc(F)cc1 Amb17678831 [0,2,0,0,0,0|2,0,0]=4 3336 B14R1.698 N[C@@H](Cc1ccc(Cl)cc1)CC(O)=O Amb22745372 [0,2,0,0,0,0|2,0,0]=4 3337 B14R1.698 N[C@@H](Cc1ccc(I)cc1)CC(O)=O Amb22746264 [0,2,0,0,0,0|2,0,0]=4 3338 B14R1.698 N[C@@H](Cc1ccc(O)cc1)CC(O)=O Amb22369425 [0,2,0,0,0,0|2,0,0]=4 3339 B14R1.698 N[C@@H](Cc1ccc(cc1)Br)CC(=O)O Amb16231755 [0,2,0,0,0,0|2,0,0]=4 3340 B14R1.698 N[C@@H](Cc1ccc(cc1)Cl)CC(=O)O Amb10603271 [0,2,0,0,0,0|2,0,0]=4 3341 B14R1.698 N[C@@H](Cc1ccc(cc1)F)CC(=O)O Amb16231675 [0,2,0,0,0,0|2,0,0]=4 3342 B14R1.698 N[C@H](Cc1ccc(cc1)C)CC(=O)O Amb16231749 [0,2,0,0,0,0|2,0,0]=4 3343 B14R1.698 O=C(Cc1ccc(cc1)Br)CC(=O)C Amb17264236 [0,2,0,0,0,0|1,0,1]=4 3344 B14R1.698 O=C(Cc1ccc(cc1)C)CC(=O)C Amb17234899 [0,2,0,0,0,0|1,0,1]=4 3345 B14R1.698 O=C(Cc1ccc(cc1)Cl)CC(=O)C Amb17240735 [0,2,0,0,0,0|1,0,1]=4 3346 B14R1.698 O=C(Cc1ccc(cc1)F)CC(=O)C Amb17235883 [0,2,0,0,0,0|1,0,1]=4 3347 B14R1.698 OC(=O)CC(Br)Cc1ccc(Cl)cc1 Amb18628161 [0,2,0,0,0,0|2,0,0]=4 3348 B14R1.698 OC(=O)CC(Br)Cc1ccc(F)cc1 Amb18629098 [0,2,0,0,0,0|2,0,0]=4 3349 B14R1.698 OC(=O)CC(Cl)Cc1ccc(Br)cc1 Amb18111139 [0,2,0,0,0,0|2,0,0]=4 3350 B14R1.698 OC(=O)CC(Cl)Cc1ccc(Cl)cc1 Amb18111140 [0,2,0,0,0,0|2,0,0]=4 3351 B14R1.698 OC(=O)CC(Cl)Cc1ccc(F)cc1 Amb18628471 [0,2,0,0,0,0|2,0,0]=4 3352 B14R1.698 OC(Cc1ccc(cc1)Br)CC(=O)O Amb17266777 [0,2,0,0,0,0|2,0,0]=4 3353 B14R1.698 OC(Cc1ccc(cc1)C)CC(=O)O Amb17235900 [0,2,0,0,0,0|2,0,0]=4 3354 B14R1.698 OC(Cc1ccc(cc1)Cl)CC(=O)O Amb17241783 [0,2,0,0,0,0|2,0,0]=4 3355 B14R1.698 OC(Cc1ccc(cc1)F)CC(=O)O Amb17236719 [0,2,0,0,0,0|2,0,0]=4 3356 B14R1.743 BrCC(=O)NC(Cc1ccccc1)C Amb17333679 [0,2,0,0,0,0|1,0,0]=3 3357 B14R1.743 BrCC(=O)NC(Cc1ccccn1)C Amb17329729 [0,2,0,0,0,0|2,0,0]=4 3358 B14R1.743 BrCC(=O)NC(Cc1cccnc1)C Amb17327664 [0,2,0,0,0,0|2,0,0]=4 3359 B14R1.743 BrCC(=O)NC(Cc1ccncc1)C Amb17325591 [0,2,0,0,0,0|2,0,0]=4 3360 B14R1.743 CC(Cc1ccccc1)NC(=O)CN Amb19036468 [0,2,0,0,0,0|1,0,0]=3 3361 B14R1.743 CC(Cc1ccccc1)NC(=O)NN Amb19042175 [0,2,0,0,0,0|2,0,0]=4 3362 B14R1.743 CCC(=O)CN(C)Cc1ccccc1 Amb19078626 [0,2,0,0,0,0|2,0,0]=4 3363 B14R1.743 CCC(=O)NC(=O)Cc1ccccc1 Amb10563533 [0,2,0,0,0,0|1,0,1]=4 3364 B14R1.743 CNC(=N)NC(C)Cc1ccccc1 Amb19041369 [0,2,0,0,0,0|2,0,0]=4 3365 B14R1.743 CNC(=O)CC(C)Nc1ccccc1 Amb25283916 [0,2,0,0,0,0|2,0,0]=4 3366 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 Amb19967610 [0,2,0,0,0,0|2,0,0]=4 3367 B14R1.743 CNC(=O)NC(C)Cc1ccccc1 Amb25277231 [0,2,0,0,0,0|1,0,0]=3 3368 B14R1.743 CNC(=S)NC(C)Cc1ccccc1 Amb25678616 [0,2,0,0,0,0|1,1,0]=4 3369 B14R1.743 COC(=O)CC(Br)Cc1ccccc1 Amb18111203 [0,2,0,0,0,0|1,0,0]=3 3370 B14R1.743 COC(=O)CC(Cl)Cc1ccccc1 Amb18111202 [0,2,0,0,0,0|1,0,0]=3 3371 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb18110742 [0,2,0,0,0,0|1,0,0]=3 3372 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb21964184 [0,2,0,0,0,0|1,0,0]=3 3373 B14R1.743 ClCC(=O)NC(=O)Cc1ccccc1 Amb1107213 [0,2,0,0,0,0|1,0,1]=4 3374 B14R1.1485 CC(=O)CC(Nc1ccccc1)(C)C Amb10608598 [0,2,0,0,0,0|2,0,0]=4 3375 B14R1.1485 CC(=O)CC(Oc1ccccc1)(C)C Amb17235419 [0,2,0,0,0,0|2,0,0]=4 3376 B14R1.1485 CC(=O)NC(C)(C)Cc1c[n]ccc1 Amb24453293 [0,2,0,0,0,0|2,0,0]=4 3377 B14R1.1485 CC(=O)NC(C)(C)Cc1ccccc1 Amb19517626 [0,2,0,0,0,0|1,0,0]=3 3378 B14R1.1485 CC(C)(Cc1ccccc1)NC(N)=O Amb25858099 [0,2,0,0,0,0|2,0,0]=4 3379 B14R1.1485 CC(C)(Cc1ccccc1)OC(N)=O Amb24084628 [0,2,0,0,0,0|1,0,0]=3 3380 B14R1.1485 OC(=O)CC(Cc1ccccc1)(C)C Amb17336451 [0,2,0,0,0,0|2,0,0]=4 3381 B14R1.679 CC(C(=O)C)SCc1ccc(cc1)N Amb17498400 [0,2,0,0,0,0|2,0,0]=4 3382 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)Br Amb17265518 [0,2,0,0,0,0|2,0,0]=4 3383 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)C Amb17235380 [0,2,0,0,0,0|2,0,0]=4 3384 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)Cl Amb17241243 [0,2,0,0,0,0|2,0,0]=4 3385 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)F Amb17236371 [0,2,0,0,0,0|2,0,0]=4 3386 B14R1.679 Cc1ccc(cc1)CNC(=O)C(=O)C Amb17401497 [0,2,0,0,0,0|2,0,0]=4 3387 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)Br Amb17473596 [0,2,0,0,0,0|2,0,0]=4 3388 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)C Amb17470847 [0,2,0,0,0,0|2,0,0]=4 3389 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)Cl Amb17471485 [0,2,0,0,0,0|2,0,0]=4 3390 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)F Amb17470957 [0,2,0,0,0,0|2,0,0]=4 3391 B14R1.679 NC(CCc1ccc(O)cc1)C(O)=O Amb24087709 [0,2,0,0,0,0|2,0,0]=4 3392 B14R1.679 N[C@H](CCc1ccc(O)cc1)C(O)=O Amb24099406 [0,2,0,0,0,0|2,0,0]=4 3393 B14R1.679 Nc1ccc(CCC(O)C(O)=O)cc1 Amb22473017 [0,2,0,0,0,0|2,0,0]=4 3394 B14R1.679 OC(=O)C(CCc1ccc(cc1)O)C Amb17336808 [0,2,0,0,0,0|2,0,0]=4 3395 B14R1.679 Oc1ccc(CCC(O)C(O)=O)cc1 Amb19928328 [0,2,0,0,0,0|2,0,0]=4 3396 B14R1.756 BrCC(=O)N(CCc1ccncc1)C Amb17331649 [0,2,0,0,0,0|2,0,0]=4 3397 B14R1.756 CCC(=O)C(C)OCc1ccccc1 Amb25708039 [0,2,0,0,0,0|2,0,0]=4 3398 B14R1.756 CCC(=O)N(CCc1ccccc1)C Amb14001759 [0,2,0,0,0,0|1,0,0]=3 3399 B14R1.756 CN(OCc1ccccc1)C(=O)CCl Amb24714671 [0,2,0,0,0,0|2,0,0]=4 3400 B14R1.756 CNC(=O)C(=O)CCc1c[n]ccc1 Amb22734372 [0,2,0,0,0,0|2,0,0]=4 3401 B14R1.756 CNC(=O)C(=O)NCc1ccccc1 Amb2422863 [0,2,0,0,0,0|2,0,0]=4 3402 B14R1.756 CNC(=O)N(Cl)OCc1ccccc1 Amb24658346 [0,2,0,0,0,0|2,0,0]=4 3403 B14R1.756 CNC(=O)[C@@H](C)NCc1ccccc1 Amb25819693 [0,2,0,0,0,0|2,0,0]=4 3404 B14R1.756 CNC(=O)[C@H](C)NCc1ccccc1 Amb25819451 [0,2,0,0,0,0|2,0,0]=4 3405 B14R1.756 COC(=O)C(=O)CCc1ccccc1 Amb10069228 [0,2,0,0,0,0|1,0,0]=3 3406 B14R1.756 COC(=O)C(=O)NCc1ccccc1 Amb24444903 [0,2,0,0,0,0|2,0,0]=4 3407 B14R1.756 COC(=O)C(Br)CCc1ccccc1 Amb22500039 [0,2,0,0,0,0|1,0,0]=3 3408 B14R1.756 COC(=O)C(C)CCc1ccccc1 Amb17844109 [0,2,0,0,0,0|1,0,0]=3 3409 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb20625132 [0,2,0,0,0,0|2,0,0]=4 3410 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb22741033 [0,2,0,0,0,0|2,0,0]=4 3411 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb23439021 [0,2,0,0,0,0|1,0,0]=3 3412 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb22746683 [0,2,0,0,0,0|2,0,0]=4 3413 B14R1.756 COC(=O)[C@@H](N)CCc1ccccc1 Amb23439002 [0,2,0,0,0,0|1,0,0]=3 3414 B14R1.756 COC(=O)[C@H](C)OCc1ccccc1 Amb25833053 [0,2,0,0,0,0|2,0,0]=4 3415 B14R1.756 COC(=O)[C@H](NCc1ccccc1)C Amb16183003 [0,2,0,0,0,0|2,0,0]=4 3416 B14R1.756 COC(=O)[C@H](OCc1ccccc1)C Amb17617220 [0,2,0,0,0,0|2,0,0]=4 3417 B14R1.756 ClCC(=O)N(CCc1ccccc1)C Amb17241042 [0,2,0,0,0,0|1,0,0]=3 3418 B14R1.756 NCC(=O)N(CCc1ccccc1)C Amb17235470 [0,2,0,0,0,0|1,0,0]=3 3419 B14R1.756 O=C(CBr)C(=O)NCc1ccccc1 Amb24468687 [0,2,0,0,0,0|2,0,0]=4 3420 B14R1.756 O=C(CCl)C(=O)NCc1ccccc1 Amb25828359 [0,2,0,0,0,0|2,0,0]=4 3421 B14R1.756 OCC(=O)N(CCc1ccccc1)C Amb17401768 [0,2,0,0,0,0|1,0,0]=3 3422 B14R1.756 OCC(=O)N(CCc1ccncc1)C Amb17336832 [0,2,0,0,0,0|2,0,0]=4 3423 B14R1.4194 CC(=O)N(CCc1ccccc1)C=C Amb24072057 [0,2,0,0,0,0|1,0,0]=3 3424 B14R1.4194 CC(=O)N(CO)OCc1ccccc1 Amb25813758 [0,2,0,0,0,0|2,0,0]=4 3425 B14R1.4194 CC(=O)\C(=C/C)\NCc1ccccc1 Amb24498103 [0,2,0,0,0,0|2,0,0]=4 3426 B14R1.4194 CNC(CCc1ccccc1)C(O)=O Amb19042064 [0,2,0,0,0,0|2,0,0]=4 3427 B14R1.6395 CC(=O)C(C)(C)NCc1ccccc1 Amb25377113 [0,2,0,0,0,0|2,0,0]=4 3428 B14R1.6395 C[C@@](N)(CCc1ccccc1)C(O)=O Amb22229869 [0,2,0,0,0,0|2,0,0]=4 3429 B14R1.6395 OC(=O)C(CCc1ccccc1)(C)C Amb17235442 [0,2,0,0,0,0|2,0,0]=4 3430 B14R1.6395 OC(=O)C(CCc1ccccc1)(N)C Amb10609240 [0,2,0,0,0,0|2,0,0]=4 3431 B14R1.4 CC(=O)CCNc1ccc(cc1)C#N Amb24521197 [0,2,0,0,0,0|2,0,0]=4 3432 B14R1.4 CC(=O)NCCc1ccc(cc1)C#C Amb25676453 [0,2,0,0,0,0|1,0,0]=3 3433 B14R1.4 CC(=O)NCCc1ccc(cc1)C#N Amb24073070 [0,2,0,0,0,0|1,0,0]=3 3434 B14R1.4 COc1ccc(cc1)CCCC(=C)C Amb13890693 [0,2,0,0,0,0|2,0,0]=4 3435 B14R1.4 COc1ccc(cc1)CCCC(=O)O Amb1822392 [0,2,0,0,0,0|2,0,0]=4 3436 B14R1.4 CSc1ccc(CCCC(O)=O)cc1 Amb18055309 [0,2,0,0,0,0|2,0,0]=4 3437 B14R1.13 BrCC(=O)NCCc1ccc(cc1)F Amb17325725 [0,2,0,0,0,0|1,0,0]=3 3438 B14R1.13 BrCC(=O)NCCc1ccc(cc1)O Amb17325592 [0,2,0,0,0,0|1,0,0]=3 3439 B14R1.13 C#CC(=O)NCCc1ccc(O)cc1 Amb19060335 [0,2,0,0,0,0|1,0,1]=4 3440 B14R1.13 CCC(=O)NCCc1ccc(cc1)F Amb1868957 [0,2,0,0,0,0|1,0,0]=3 3441 B14R1.13 CCC(=O)NCCc1ccc(cc1)N Amb17139366 [0,2,0,0,0,0|1,0,0]=3 3442 B14R1.13 CN=C(NCCc1ccc(cc1)Cl)N Amb11206703 [0,2,0,0,0,0|2,0,0]=4 3443 B14R1.13 CNC(=N)NCCc1ccc(F)cc1 Amb19063432 [0,2,0,0,0,0|2,0,0]=4 3444 B14R1.13 CNC(=N)NCCc1ccc(O)cc1 Amb19061800 [0,2,0,0,0,0|2,0,0]=4 3445 B14R1.13 CNC(=O)CCCc1ccc(cc1)N Amb17336479 [0,2,0,0,0,0|1,0,0]=3 3446 B14R1.13 CNC(=O)CCNc1ccc(Br)cc1 Amb24565640 [0,2,0,0,0,0|2,0,0]=4 3447 B14R1.13 CNC(=O)CCNc1ccc(Cl)cc1 Amb24730153 [0,2,0,0,0,0|2,0,0]=4 3448 B14R1.13 CNC(=O)CCNc1ccc(F)cc1 Amb19064592 [0,2,0,0,0,0|2,0,0]=4 3449 B14R1.13 CNC(=O)CCNc1ccc(I)cc1 Amb25361876 [0,2,0,0,0,0|2,0,0]=4 3450 B14R1.13 CNC(=O)CCNc1ccc(N)cc1 Amb19035022 [0,2,0,0,0,0|2,0,0]=4 3451 B14R1.13 CNC(=O)CCOc1ccc(N)cc1 Amb18538554 [0,2,0,0,0,0|2,0,0]=4 3452 B14R1.13 CNC(=O)CCOc1ccc(cc1)Br Amb17266149 [0,2,0,0,0,0|2,0,0]=4 3453 B14R1.13 CNC(=O)CCOc1ccc(cc1)F Amb13891872 [0,2,0,0,0,0|2,0,0]=4 3454 B14R1.13 CNC(=O)CCSc1ccc(F)cc1 Amb19338532 [0,2,0,0,0,0|2,0,0]=4 3455 B14R1.13 CNC(=O)CCSc1ccc(cc1)C Amb1827981 [0,2,0,0,0,0|2,0,0]=4 3456 B14R1.13 CNC(=O)CSCc1ccc(cc1)F Amb2114239 [0,2,0,0,0,0|2,0,0]=4 3457 B14R1.13 CNC(=O)CSCc1ccc(cc1)N Amb17498722 [0,2,0,0,0,0|2,0,0]=4 3458 B14R1.13 CNC(=O)NCCc1ccc(Br)cc1 Amb24693714 [0,2,0,0,0,0|1,0,0]=3 3459 B14R1.13 CNC(=O)NCCc1ccc(cc1)Cl Amb2132770 [0,2,0,0,0,0|1,0,0]=3 3460 B14R1.13 CNC(=O)NCCc1ccc(cc1)F Amb2132754 [0,2,0,0,0,0|1,0,0]=3 3461 B14R1.13 CNC(=O)NCCc1ccc(cc1)O Amb2132787 [0,2,0,0,0,0|1,0,0]=3 3462 B14R1.13 CNC(=O)O\N=C\c1ccc(Cl)cc1 Amb24342907 [0,2,0,0,0,0|1,0,1]=4 3463 B14R1.13 COC(=O)C#CCc1ccc(F)cc1 Amb25067541 [0,2,0,0,0,0|1,0,1]=4 3464 B14R1.13 COC(=O)CCCc1ccc(Br)cc1 Amb18629275 [0,2,0,0,0,0|1,0,0]=3 3465 B14R1.13 COC(=O)CCCc1ccc(Cl)cc1 Amb18629276 [0,2,0,0,0,0|1,0,0]=3 3466 B14R1.13 COC(=O)CCCc1ccc(F)cc1 Amb18110191 [0,2,0,0,0,0|1,0,0]=3 3467 B14R1.13 COC(=O)CCCc1ccc(N)cc1 Amb22728278 [0,2,0,0,0,0|1,0,0]=3 3468 B14R1.13 COC(=O)CCNc1ccc(cc1)Br Amb1981435 [0,2,0,0,0,0|2,0,0]=4 3469 B14R1.13 COC(=O)CCOc1ccc(cc1)N Amb13951735 [0,2,0,0,0,0|2,0,0]=4 3470 B14R1.13 COC(=O)CNCc1ccc(cc1)Cl Amb10609077 [0,2,0,0,0,0|2,0,0]=4 3471 B14R1.13 COC(=O)NCCc1ccc(Br)cc1 Amb23589074 [0,2,0,0,0,0|1,0,0]=3 3472 B14R1.13 Cc1ccc(CCCC(=O)OC)cc1 Amb18110189 [0,2,0,0,0,0|1,0,0]=3 3473 B14R1.13 Cc1ccc(cc1)NCCC(=O)NC Amb19078978 [0,2,0,0,0,0|2,0,0]=4 3474 B14R1.13 ClCC(=O)NCCc1ccc(cc1)Br Amb17421889 [0,2,0,0,0,0|1,0,0]=3 3475 B14R1.13 ClCC(=O)NCCc1ccc(cc1)C Amb10075558 [0,2,0,0,0,0|1,0,0]=3 3476 B14R1.13 ClCC(=O)NCCc1ccc(cc1)F Amb1635500 [0,2,0,0,0,0|1,0,0]=3 3477 B14R1.13 NCC(=O)NCCc1ccc(Cl)cc1 Amb24770025 [0,2,0,0,0,0|1,0,0]=3 3478 B14R1.13 NCC(=O)NCCc1ccc(cc1)Br Amb17414922 [0,2,0,0,0,0|1,0,0]=3 3479 B14R1.13 NCC(=O)NCCc1ccc(cc1)C Amb17401668 [0,2,0,0,0,0|1,0,0]=3 3480 B14R1.13 NNC(=O)CCCc1ccc(cc1)O Amb1822852 [0,2,0,0,0,0|2,0,0]=4 3481 B14R1.13 NNC(=O)NCCc1ccc(Br)cc1 Amb25738164 [0,2,0,0,0,0|2,0,0]=4 3482 B14R1.13 NNC(=O)NCCc1ccc(Cl)cc1 Amb25302908 [0,2,0,0,0,0|2,0,0]=4 3483 B14R1.13 NNC(=O)NCCc1ccc(O)cc1 Amb19042965 [0,2,0,0,0,0|2,0,0]=4 3484 B14R1.13 OCC(=O)NCCc1ccc(cc1)Br Amb17415250 [0,2,0,0,0,0|1,0,0]=3 3485 B14R1.13 OCC(=O)NCCc1ccc(cc1)C Amb17401775 [0,2,0,0,0,0|1,0,0]=3 3486 B14R1.13 OCC(=O)NCCc1ccc(cc1)Cl Amb1110300 [0,2,0,0,0,0|1,0,0]=3 3487 B14R1.13 OCC(=O)NCCc1ccc(cc1)F Amb1109713 [0,2,0,0,0,0|1,0,0]=3 3488 B14R1.131 CS(=O)(=O)OCCc1ccc(Br)[n]c1 Amb25212067 [0,2,0,0,0,0|2,0,0]=4 3489 B14R1.131 CS(=O)(=O)OCCc1ccc(Br)cc1 Amb25747948 [0,2,0,0,0,0|1,0,0]=3 3490 B14R1.131 CS(=O)(=O)OCCc1ccc(Cl)[n]c1 Amb25293526 [0,2,0,0,0,0|2,0,0]=4 3491 B14R1.131 Cc1ccc(CCNS(C)(=O)=O)cc1 Amb22450887 [0,2,0,0,0,0|2,0,0]=4 3492 B14R1.131 NS(=O)(=O)OCCc1ccc(Br)cc1 Amb24087621 [0,2,0,0,0,0|2,0,0]=4 3493 B14R1.131 Nc1ccc(cc1)CCNS(=O)(=O)C Amb17140854 [0,2,0,0,0,0|2,0,0]=4 3494 B14R1.131 Oc1ccc(cc1)CCNS(=O)(=O)C Amb13883053 [0,2,0,0,0,0|2,0,0]=4 3495 B14R1.292 O=S(=O)(CCl)CCCc1ccccc1 Amb22364591 [0,2,0,0,0,0|2,0,0]=4 3496 B14R1.520 BrCCC(=O)NCCc1ccccn1 Amb17329338 [0,2,0,0,0,0|2,0,0]=4 3497 B14R1.520 CC#CC(=O)NOCc1ccccc1 Amb24382783 [0,2,0,0,0,0|2,0,0]=4 3498 B14R1.520 CCCC(=O)CCCc1ccccc1 Amb17234943 [0,2,0,0,0,0|1,0,0]=3 3499 B14R1.520 CCCC(=O)CCCc1cccnc1 Amb17235104 [0,2,0,0,0,0|2,0,0]=4 3500 B14R1.520 CCCC(=O)COCc1ccccc1 Amb19078959 [0,2,0,0,0,0|2,0,0]=4 3501 B14R1.520 CCCC(=O)NOCc1ccccc1 Amb15742562 [0,2,0,0,0,0|2,0,0]=4 3502 B14R1.520 CCNC(=O)COCc1ccccc1 Amb24386300 [0,2,0,0,0,0|2,0,0]=4 3503 B14R1.520 CCNC(=O)NOCc1ccccc1 Amb22460726 [0,2,0,0,0,0|2,0,0]=4 3504 B14R1.520 CCOC(=O)CCNc1ccccc1 Amb21961618 [0,2,0,0,0,0|2,0,0]=4 3505 B14R1.520 CCOC(=O)CNCc1ccccc1 Amb20247257 [0,2,0,0,0,0|2,0,0]=4 3506 B14R1.520 CCOC(=O)NNCc1ccccc1 Amb25183830 [0,2,0,0,0,0|2,0,0]=4 3507 B14R1.520 CCOC(=O)ONNc1ccccc1 Amb22438848 [0,2,0,0,0,0|2,0,0]=4 3508 B14R1.520 CCOC(=O)\C=C\Cc1ccccc1 Amb10873144 [0,2,0,0,0,0|1,0,1]=4 3509 B14R1.520 CNCC(=O)NCCc1ccccc1 Amb15740954 [0,2,0,0,0,0|1,0,0]=3 3510 B14R1.520 CNCC(=O)NOCc1ccccc1 Amb25335308 [0,2,0,0,0,0|2,0,0]=4 3511 B14R1.520 COCC(=O)NCCc1ccccn1 Amb10668889 [0,2,0,0,0,0|2,0,0]=4 3512 B14R1.520 COCC(=O)NCCc1cccnc1 Amb15746996 [0,2,0,0,0,0|2,0,0]=4 3513 B14R1.520 COCC(=O)NOCc1ccccc1 Amb10682506 [0,2,0,0,0,0|2,0,0]=4 3514 B14R1.520 CSCC(=O)NCCc1ccccc1 Amb19419141 [0,2,0,0,0,0|1,0,0]=3 3515 B14R1.520 CSCC(=O)NCCc1ccccn1 Amb13958069 [0,2,0,0,0,0|2,0,0]=4 3516 B14R1.520 CSCC(=O)NOCc1ccccc1 Amb21388015 [0,2,0,0,0,0|2,0,0]=4 3517 B14R1.520 C\C(\COCc1ccccc1)=C/C=O Amb24422510 [0,2,0,0,0,0|2,0,0]=4 3518 B14R1.520 ClCCC(=O)NCCc1ccccc1 Amb1132002 [0,2,0,0,0,0|1,0,0]=3 3519 B14R1.520 ClCCC(=O)NCCc1ccncc1 Amb17329185 [0,2,0,0,0,0|2,0,0]=4 3520 B14R1.520 N#CCC(=O)OCCc1ccccc1 Amb17210534 [0,2,0,0,0,0|0,0,0]=2 3521 B14R1.520 NCCC(=O)CNCc1ccccc1 Amb25200064 [0,2,0,0,0,0|2,0,0]=4 3522 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb1131212 [0,2,0,0,0,0|1,0,0]=3 3523 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb15741009 [0,2,0,0,0,0|1,0,0]=3 3524 B14R1.520 O=C(CCBr)NOCc1ccccc1 Amb24412294 [0,2,0,0,0,0|2,0,0]=4 3525 B14R1.546 CN\C(\NCCc1ccccc1)=N\C Amb24710194 [0,2,0,0,0,0|2,0,0]=4 3526 B14R1.546 CN\C(\NCCc1ccccc1)=N\N Amb25121072 [0,2,0,0,0,0|2,0,0]=4 3527 B12R1.438 CC(=O)Oc1cccc(C=C)[n]1 Amb24471307 [0,0,1,1,0,0|1,0,1]=4 3528 B12R1.65 CC(=O)OC1CC(=O)C=C1C=O Amb25262694 [0,0,1,1,0,0|2,0,0]=4 3529 B12R1.65 CC(=O)O[C@@H]1CC(=O)C=C1C=O Amb24743204 [0,0,1,1,0,0|2,0,0]=4 3530 B12R1.75 CC(=O)Oc1ccccc1C=C Amb18798087 [0,0,1,1,0,0|0,0,2]=4 3531 B12R1.1335 CC(=O)C=1C=CC=CC=CCC1 Amb25376175 [0,0,1,1,0,0|1,0,1]=4 3532 B12R1.1343 CC(=O)\C=C\C1C=CC=CC=C1 Amb25179614 [0,0,1,1,0,0|1,0,1]=4 3533 B12R2.1 CCC1CCc2ccccc21 Amb20248519 [1,0,0,1,0,0|1,0,1]=4 3534 B12R2.1 CCN1CCc2ccccc12 Amb17689295 [1,0,0,1,0,0|1,0,1]=4 3535 B12R2.1 CNC1CCc2c1cccc2 Amb1117068 [1,0,0,1,0,0|2,0,0]=4 3536 B12R2.1 CNC1CCc2ccccc21 Amb22757336 [1,0,0,1,0,0|2,0,0]=4 3537 B12R2.1 CN[C@@H]1CCc2ccccc21 Amb25808104 [1,0,0,1,0,0|2,0,0]=4 3538 B12R2.1 CSC1CCc2ccccc21 Amb24684843 [1,0,0,1,0,0|2,0,0]=4 3539 B12R2.1 C\C=C\1/CNc2ccccc21 Amb25858232 [1,0,0,1,0,0|2,0,0]=4 3540 B12R2.1 Cl\C=C/1\CCc2ccccc21 Amb24519209 [1,0,0,1,0,0|2,0,0]=4 3541 B12R2.1 O=CC1=CCc2ccccc12 Amb18644151 [1,0,0,1,0,0|1,0,1]=4 3542 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [1,0,0,1,0,0|1,0,0]=3 3543 B12R2.1 O=CC1CNc2ccccc21 Amb23590098 [1,0,0,1,0,0|2,0,0]=4 3544 B12R2.1 O=CC1COc2ccccc21 Amb23586276 [1,0,0,1,0,0|2,0,0]=4 3545 B12R2.1 O=NN1CCc2ccccc12 Amb17689298 [1,0,0,1,0,0|2,0,0]=4 3546 B12R2.2 C1C=CCP1c2ccccc2 Amb25736369 [1,0,0,1,0,0|2,0,0]=4 3547 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [1,0,0,1,0,0|1,0,1]=4 3548 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [1,0,0,1,0,0|1,0,1]=4 3549 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [1,0,0,1,0,0|1,0,1]=4 3550 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [1,0,0,1,0,0|1,0,1]=4 3551 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [1,0,0,1,0,0|1,0,1]=4 3552 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [1,0,0,1,0,0|1,0,1]=4 3553 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [1,0,0,1,0,0|1,0,1]=4 3554 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [1,0,0,1,0,0|1,0,0]=3 3555 B12R2.2 C1OCCC1c2c[n]ccc2 Amb24320767 [1,0,0,1,0,0|1,0,1]=4 3556 B12R2.2 C1OCCC1c2cc[n]cc2 Amb24320766 [1,0,0,1,0,0|1,0,1]=4 3557 B12R2.2 C1OCCC1c2cccc[n]2 Amb24320768 [1,0,0,1,0,0|1,0,1]=4 3558 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [1,0,0,1,0,0|0,0,1]=3 3559 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [1,0,0,1,0,0|0,0,2]=4 3560 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [1,0,0,1,0,0|1,0,1]=4 3561 B12R2.23 C[C@@H]1NC[C@H]1c2ccccc2 Amb24618159 [1,0,0,1,0,0|1,0,1]=4 3562 B12R2.23 O=C1CCC1c2ccc[n]c2 Amb24472315 [1,0,0,1,0,0|2,0,0]=4 3563 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [1,0,0,1,0,0|1,0,0]=3 3564 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [1,0,0,1,0,0|2,0,0]=4 3565 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [1,0,0,1,0,0|2,0,0]=4 3566 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [1,0,0,1,0,0|2,0,0]=4 3567 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [1,0,0,1,0,0|2,0,0]=4 3568 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [1,0,0,1,0,0|2,0,0]=4 3569 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [1,0,0,1,0,0|2,0,0]=4 3570 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [1,0,0,1,0,0|1,0,0]=3 3571 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [1,0,0,1,0,0|1,0,0]=3 3572 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [1,0,0,1,0,0|2,0,0]=4 3573 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [1,0,0,1,0,0|1,0,0]=3 3574 B12R2.27 O=C[C@@H]1C[C@H]1c2cc[n]cc2 Amb25288457 [1,0,0,1,0,0|2,0,0]=4 3575 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [1,0,0,1,0,0|1,0,0]=3 3576 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [1,0,0,1,0,0|1,0,0]=3 3577 B12R2.41 C1C=CCNc2ccccc21 Amb24375360 [1,0,0,1,0,0|2,0,0]=4 3578 B12R2.41 C1C=CCOc2ccccc21 Amb22585745 [1,0,0,1,0,0|2,0,0]=4 3579 B12R2.41 C1C=Cc2c(CC1)cccc2 Amb2383779 [1,0,0,1,0,0|1,0,1]=4 3580 B12R2.41 C1CCCCc2ccccc21 Amb25336299 [1,0,0,1,0,0|1,0,1]=4 3581 B12R2.41 C1COCCc2[n]cccc21 Amb24359900 [1,0,0,1,0,0|1,0,1]=4 3582 B12R2.41 C1Cc2ccccc2CCO1 Amb22233129 [1,0,0,1,0,0|0,0,1]=3 3583 B12R2.41 C1NCc2c(CC1)cccc2 Amb10608887 [1,0,0,1,0,0|2,0,0]=4 3584 B12R2.41 C1NCc2c(CC1)cccc2 Amb17470382 [1,0,0,1,0,0|2,0,0]=4 3585 B12R2.41 N1CCc2c(CC1)cccc2 Amb1811889 [1,0,0,1,0,0|1,0,1]=4 3586 B12R2.931 CNCC1Cc2ccccc21 Amb24670284 [1,0,0,1,0,0|2,0,0]=4 3587 B12R2.931 O=C=NC1Cc2ccccc21 Amb25149119 [1,0,0,1,0,0|1,0,1]=4 3588 B12R2.931 O=CCC1Cc2ccccc21 Amb25808254 [1,0,0,1,0,0|1,0,0]=3 3589 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [1,0,0,1,0,0|1,0,1]=4 3590 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [1,0,0,1,0,0|1,0,1]=4 3591 B12R2.1081 C=C1NCCc2ccccc21 Amb24685452 [1,0,0,1,0,0|1,0,1]=4 3592 B12R2.1081 CC1=CCCc2c1cccc2 Amb2439915 [1,0,0,1,0,0|1,0,0]=3 3593 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [1,0,0,1,0,0|2,0,0]=4 3594 B12R2.1081 CC1=COCc2ccccc21 Amb24436497 [1,0,0,1,0,0|2,0,0]=4 3595 B12R2.1081 CC1=NCCc2[n]cccc21 Amb22751775 [1,0,0,1,0,0|2,0,0]=4 3596 B12R2.1081 CC1=NCCc2ccccc12 Amb17940779 [1,0,0,1,0,0|1,0,0]=3 3597 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [1,0,0,1,0,0|1,0,1]=4 3598 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [1,0,0,1,0,0|1,0,1]=4 3599 B12R2.1081 CC1OCCc2ccccc21 Amb25773190 [1,0,0,1,0,0|0,0,1]=3 3600 B12R2.1081 CC1OCOc2ccccc21 Amb24070527 [1,0,0,1,0,0|1,0,1]=4 3601 B12R2.1081 CN1CCCc2c1cccc2 Amb15692645 [1,0,0,1,0,0|2,0,0]=4 3602 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [1,0,0,1,0,0|1,0,1]=4 3603 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22756655 [1,0,0,1,0,0|1,0,1]=4 3604 B12R2.1081 FC1OCCc2ccccc21 Amb25073157 [1,0,0,1,0,0|1,0,1]=4 3605 B12R2.1081 IC1OCCc2ccccc21 Amb25309346 [1,0,0,1,0,0|1,0,1]=4 3606 B12R2.1081 NC1=NCCc2ccccc21 Amb18644285 [1,0,0,1,0,0|2,0,0]=4 3607 B12R2.1081 O=C1C=CCc2c1cccc2 Amb2388336 [1,0,0,1,0,0|1,0,1]=4 3608 B12R2.1081 O=C1C=NCc2ccccc21 Amb25717685 [1,0,0,1,0,0|2,0,0]=4 3609 B12R2.1081 O=C1CCC[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22056230 [1,0,0,1,0,0|1,0,0]=3 3610 B12R2.1081 O=C1CCC[n+]2c1cccc2 Amb16191924 [1,0,0,1,0,0|2,0,0]=4 3611 B12R2.1081 O=C1CCCc2[n]cccc21 Amb19515604 [1,0,0,1,0,0|2,0,0]=4 3612 B12R2.1081 O=C1CCCc2c1ccnc2 Amb10603887 [1,0,0,1,0,0|2,0,0]=4 3613 B12R2.1081 O=C1CCCc2c[n]ccc21 Amb20621086 [1,0,0,1,0,0|2,0,0]=4 3614 B12R2.1081 O=C1CCCc2cc[n]cc21 Amb19888360 [1,0,0,1,0,0|2,0,0]=4 3615 B12R2.1081 O=C1CCCc2cc[n]cc21 Amb22727966 [1,0,0,1,0,0|2,0,0]=4 3616 B12R2.1081 O=C1CCNc2c1cccc2 Amb10067080 [1,0,0,1,0,0|2,0,0]=4 3617 B12R2.1081 O=C1CCOc2c1cccc2 Amb1153759 [1,0,0,1,0,0|2,0,0]=4 3618 B12R2.1081 O=C1CCSc2c1cccc2 Amb1151631 [1,0,0,1,0,0|2,0,0]=4 3619 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [1,0,0,1,0,0|2,0,0]=4 3620 B12R2.1081 O=C1COCc2c1cccc2 Amb10067824 [1,0,0,1,0,0|2,0,0]=4 3621 B12R2.1081 O=C1NCC[n+]2ccccc21 Amb23437947 [1,0,0,1,0,0|2,0,0]=4 3622 B12R2.1081 O=C1NCCc2[n]cccc21 Amb22002362 [1,0,0,1,0,0|2,0,0]=4 3623 B12R2.1081 O=C1NCCc2c1cccc2 Amb2502473 [1,0,0,1,0,0|1,0,0]=3 3624 B12R2.1081 O=C1NCCc2c[n]ccc21 Amb23455308 [1,0,0,1,0,0|2,0,0]=4 3625 B12R2.1081 O=C1NCCc2cc[n]cc21 Amb18202262 [1,0,0,1,0,0|2,0,0]=4 3626 B12R2.1081 O=C1NCCc2ccc[n]c21 Amb22234340 [1,0,0,1,0,0|2,0,0]=4 3627 B12R2.1081 O=C1NCOc2ccccc21 Amb24104580 [1,0,0,1,0,0|2,0,0]=4 3628 B12R2.1081 O=C1OC=Cc2ccccc21 Amb25189261 [1,0,0,1,0,0|0,0,2]=4 3629 B12R2.1081 O=C1OCCc2[n]cccc21 Amb25200934 [1,0,0,1,0,0|1,0,0]=3 3630 B12R2.1081 O=C1OCCc2c1cccc2 Amb16232507 [1,0,0,1,0,0|0,0,0]=2 3631 B12R2.1081 O=C1OCCc2cc[n]cc21 Amb22372215 [1,0,0,1,0,0|1,0,0]=3 3632 B12R2.1081 O=C1OCOc2ccccc21 Amb24066081 [1,0,0,1,0,0|1,0,0]=3 3633 B12R2.1081 O=C1OS[PbH2]c2ccccc21 Amb22347227 [1,0,0,1,0,0|2,0,0]=4 3634 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [1,0,0,1,0,0|0,1,0]=3 3635 B12R2.1081 OB1OCCc2c1cccc2 Amb10070693 [1,0,0,1,0,0|1,0,1]=4 3636 B12R2.2057 C1C=C1CNc2ccccc2 Amb25824311 [1,0,0,1,0,0|2,0,0]=4 3637 B12R2.2057 C1OC1CCc2ccccc2 Amb24105379 [1,0,0,1,0,0|2,0,0]=4 3638 B12R2.2058 B1CC(C1)Cc2ccccc2 Amb25243383 [1,0,0,1,0,0|2,0,0]=4 3639 B12R2.2058 C(C1CCN1)c2ccccc2 Amb20623701 [1,0,0,1,0,0|1,0,1]=4 3640 B12R2.2058 C1NCC1Cc2ccccc2 Amb19373673 [1,0,0,1,0,0|2,0,0]=4 3641 B12R2.2058 N1CC(C1)Cc2ccccc2 Amb1123190 [1,0,0,1,0,0|2,0,0]=4 3642 B12R2.22 Br[C@@H]1C[C@H](C1)c2ccccc2 Amb25119213 [0,0,0,1,1,0|1,0,1]=4 3643 B12R2.22 C=C1CC(C1)c2cc[n]cc2 Amb24102821 [0,0,0,1,1,0|2,0,0]=4 3644 B12R2.22 NC1CC(C1)c2ccccc2 Amb19514746 [0,0,0,1,1,0|1,0,1]=4 3645 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccccc2 Amb23439754 [0,0,0,1,1,0|1,0,1]=4 3646 B12R2.22 N[C@@H]1C[C@H](C1)c2ccccc2 Amb23439755 [0,0,0,1,1,0|1,0,1]=4 3647 B12R2.22 O=C1CC(C1)c2c[n]cc[n]2 Amb24606497 [0,0,0,1,1,0|2,0,0]=4 3648 B12R2.22 O=C1CC(C1)c2cc[n]cc2 Amb24407200 [0,0,0,1,1,0|1,0,0]=3 3649 B12R2.22 O=C1CC(C1)c2ccc[n]c2 Amb25151161 [0,0,0,1,1,0|1,0,0]=3 3650 B12R2.22 O=C1CC(N1)c2ccc[n]c2 Amb25322297 [0,0,0,1,1,0|2,0,0]=4 3651 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [0,0,0,1,1,0|1,0,0]=3 3652 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [0,0,0,1,1,0|1,0,0]=3 3653 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [0,0,0,1,1,0|0,0,2]=4 3654 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [0,0,0,1,1,0|0,0,2]=4 3655 B12R2.22 SC1CC(C1)c2ccccc2 Amb24690234 [0,0,0,1,1,0|0,1,1]=4 3656 B12R2.24 BrC1CCc2c(C1)cccc2 Amb13952699 [0,0,0,1,1,0|1,0,1]=4 3657 B12R2.24 BrC=1CCc2ccccc2C1 Amb25726468 [0,0,0,1,1,0|1,0,1]=4 3658 B12R2.24 C=C1Cc2ccccc2CC1 Amb25151359 [0,0,0,1,1,0|1,0,0]=3 3659 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [0,0,0,1,1,0|2,0,0]=4 3660 B12R2.24 CC1=Nc2c(CC1)cccc2 Amb10553816 [0,0,0,1,1,0|1,0,0]=3 3661 B12R2.24 CC1=Nc2c(SC1)cccc2 Amb10976510 [0,0,0,1,1,0|2,0,0]=4 3662 B12R2.24 CC1CCc2c(N1)cccc2 Amb2525824 [0,0,0,1,1,0|1,0,1]=4 3663 B12R2.24 CC1CCc2ccccc2N1 Amb22499773 [0,0,0,1,1,0|1,0,1]=4 3664 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,0,0,1,1,0|0,0,2]=4 3665 B12R2.24 CC1CCc2ccccc2S1 Amb25706129 [0,0,0,1,1,0|0,1,1]=4 3666 B12R2.24 CC=1CNc2ccccc2C1 Amb18559652 [0,0,0,1,1,0|2,0,0]=4 3667 B12R2.24 CC=1COc2ccccc2C1 Amb24484437 [0,0,0,1,1,0|2,0,0]=4 3668 B12R2.24 CC=1CSc2ccccc2C1 Amb24485796 [0,0,0,1,1,0|2,0,0]=4 3669 B12R2.24 CN1CCc2c(C1)cccc2 Amb2581727 [0,0,0,1,1,0|2,0,0]=4 3670 B12R2.24 CN1Cc2ccccc2CC1 Amb22001820 [0,0,0,1,1,0|2,0,0]=4 3671 B12R2.24 C[C@@H]1CCc2ccccc2N1 Amb22751676 [0,0,0,1,1,0|1,0,1]=4 3672 B12R2.24 C[C@H]1CCc2ccccc2N1 Amb25138125 [0,0,0,1,1,0|1,0,1]=4 3673 B12R2.24 C[N+]1=Cc2c(CC1)cccc2 Amb10553962 [0,0,0,1,1,0|2,0,0]=4 3674 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [0,0,0,1,1,0|1,0,1]=4 3675 B12R2.24 ClC1Cc2ccccc2CO1 Amb25152704 [0,0,0,1,1,0|1,0,1]=4 3676 B12R2.24 IC1Cc2ccccc2CO1 Amb25811321 [0,0,0,1,1,0|1,0,1]=4 3677 B12R2.24 NC1=Nc2c(CC1)cccc2 Amb2373583 [0,0,0,1,1,0|2,0,0]=4 3678 B12R2.24 NC1CCc2c(C1)cccc2 Amb13952050 [0,0,0,1,1,0|1,0,1]=4 3679 B12R2.24 NC1CCc2c(C1)cccc2 Amb2383251 [0,0,0,1,1,0|1,0,1]=4 3680 B12R2.24 NC1Cc2ccccc2CO1 Amb24365192 [0,0,0,1,1,0|1,0,1]=4 3681 B12R2.24 NN1CCc2c(C1)cccc2 Amb17232046 [0,0,0,1,1,0|2,0,0]=4 3682 B12R2.24 NN1Cc2ccccc2CC1 Amb22495461 [0,0,0,1,1,0|2,0,0]=4 3683 B12R2.24 N[C@H]1Cc2ccccc2CC1 Amb25113422 [0,0,0,1,1,0|1,0,1]=4 3684 B12R2.24 O=C1C=C2C=CC=CC2=CO1 Amb25242585 [0,0,0,1,1,0|0,0,2]=4 3685 B12R2.24 O=C1CCN2C=CC=CC2=N1 Amb17749056 [0,0,0,1,1,0|2,0,0]=4 3686 B12R2.24 O=C1CCc2[n]cccc2N1 Amb25095800 [0,0,0,1,1,0|2,0,0]=4 3687 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [0,0,0,1,1,0|0,0,0]=2 3688 B12R2.24 O=C1CCc2c[n]ccc2N1 Amb22899719 [0,0,0,1,1,0|2,0,0]=4 3689 B12R2.24 O=C1CCc2ccc[n]c2N1 Amb21960778 [0,0,0,1,1,0|2,0,0]=4 3690 B12R2.24 O=C1CN2C=CC=CC2=NC1 Amb25301630 [0,0,0,1,1,0|2,0,0]=4 3691 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,0,0,1,1,0|2,0,0]=4 3692 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [0,0,0,1,1,0|1,0,0]=3 3693 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [0,0,0,1,1,0|2,0,0]=4 3694 B12R2.24 O=C1CSc2c(N1)cccc2 Amb1007458 [0,0,0,1,1,0|2,0,0]=4 3695 B12R2.24 O=C1C[n+]2ccccc2CN1 Amb24342049 [0,0,0,1,1,0|2,0,0]=4 3696 B12R2.24 O=C1Cc2[n]c[n]cc2CC1 Amb24554237 [0,0,0,1,1,0|2,0,0]=4 3697 B12R2.24 O=C1Cc2[n]cccc2CC1 Amb22292032 [0,0,0,1,1,0|1,0,0]=3 3698 B12R2.24 O=C1Cc2c[n]c[n]c2CC1 Amb22494044 [0,0,0,1,1,0|2,0,0]=4 3699 B12R2.24 O=C1Cc2c[n]ccc2CC1 Amb24093783 [0,0,0,1,1,0|1,0,0]=3 3700 B12R2.24 O=C1Cc2cc[n]cc2CN1 Amb25760054 [0,0,0,1,1,0|2,0,0]=4 3701 B12R2.24 O=C1Cc2ccc[n]c2CN1 Amb24513882 [0,0,0,1,1,0|2,0,0]=4 3702 B12R2.24 O=C1Cc2ccc[n]c2CO1 Amb22494099 [0,0,0,1,1,0|1,0,0]=3 3703 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [0,0,0,1,1,0|0,0,0]=2 3704 B12R2.24 O=C1Cc2ccccc2N=C1 Amb24078566 [0,0,0,1,1,0|1,0,1]=4 3705 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [0,0,0,1,1,0|1,0,0]=3 3706 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [0,0,0,1,1,0|2,0,0]=4 3707 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [0,0,0,1,1,0|1,0,0]=3 3708 B12R2.24 O=C1NCc2c(N1)cccc2 Amb10603974 [0,0,0,1,1,0|2,0,0]=4 3709 B12R2.24 O=C1NCc2ccccc2S1 Amb24713217 [0,0,0,1,1,0|2,0,0]=4 3710 B12R2.24 O=C1Nc2[n]cccc2CO1 Amb24634652 [0,0,0,1,1,0|2,0,0]=4 3711 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [0,0,0,1,1,0|1,0,0]=3 3712 B12R2.24 O=C1Nc2ccccc2CS1 Amb24509578 [0,0,0,1,1,0|1,1,0]=4 3713 B12R2.24 O=C1OCc2ccccc2O1 Amb24536007 [0,0,0,1,1,0|1,0,0]=3 3714 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [0,0,0,1,1,0|0,0,2]=4 3715 B12R2.24 ON1Cc2ccccc2CC1 Amb24533074 [0,0,0,1,1,0|1,0,1]=4 3716 B12R2.24 O[C@@H]1Cc2ccccc2CC1 Amb25149682 [0,0,0,1,1,0|0,0,2]=4 3717 B12R2.24 O[C@H]1Cc2ccccc2CC1 Amb25043599 [0,0,0,1,1,0|0,0,2]=4 3718 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,0,0,1,1,0|1,1,0]=4 3719 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [0,0,0,1,1,0|1,0,1]=4 3720 B12R2.24 S=C1Cc2ccccc2CN1 Amb24538124 [0,0,0,1,1,0|1,1,0]=4 3721 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [0,0,0,1,1,0|0,1,1]=4 3722 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [0,0,0,1,1,0|1,0,1]=4 3723 B12R2.92 CC1(C)OC1c2ccccc2 Amb21964286 [0,0,0,1,1,0|1,0,1]=4 3724 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [0,0,0,1,1,0|0,0,2]=4 3725 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [0,0,0,1,1,0|1,0,1]=4 3726 B12R2.92 C[C@]1(N)C[C@@H]1c2ccccc2 Amb24613115 [0,0,0,1,1,0|1,0,1]=4 3727 B12R2.2403 CC1(C)CCc2ccccc12 Amb24657207 [0,0,0,1,1,0|1,0,1]=4 3728 B12R2.2403 CC1(C)OCc2ccccc12 Amb23558274 [0,0,0,1,1,0|1,0,1]=4 3729 B12R2.2403 C[Si]1(C)OCc2ccccc12 Amb22167083 [0,0,0,1,1,0|1,1,0]=4 3730 B12R2.2403 OP1(=O)OCc2ccccc12 Amb25149207 [0,0,0,1,1,0|2,0,0]=4 3731 B12R2.3190 CC(=O)N1Cc2ccccc12 Amb25148191 [0,0,0,1,1,0|1,0,0]=3 3732 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [0,0,0,1,1,0|0,0,2]=4 3733 B12R2.3190 C[C@@H](N)C1Cc2ccccc21 Amb25047176 [0,0,0,1,1,0|1,0,1]=4 3734 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [0,0,0,1,1,0|0,0,2]=4 3735 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [0,0,0,1,1,0|0,0,2]=4 3736 B12R2.3190 NC(=N)C1Cc2ccccc21 Amb25152697 [0,0,0,1,1,0|2,0,0]=4 3737 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [0,0,0,1,1,0|1,0,0]=3 3738 B12R2.3190 NC(=S)C1Cc2ccccc21 Amb25152696 [0,0,0,1,1,0|1,1,0]=4 3739 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [0,0,0,1,1,0|1,0,0]=3 3740 B12R2.6 O=C1CC(CC1)c2cc[nH]c2 Amb25727884 [0,0,0,1,1,0|2,0,0]=4 3741 B12R2.6 O=C1CC(CC1)c2ccc[nH]2 Amb25145918 [0,0,0,1,1,0|2,0,0]=4 3742 B12R2.6 O=C1CC(CN1)c2ccc[nH]2 Amb25693174 [0,0,0,1,1,0|2,0,0]=4 3743 B12R2.6 O=C1CC(CN1)c2ccoc2 Amb22304822 [0,0,0,1,1,0|2,0,0]=4 3744 B12R2.6 O=C1CCC(C1)c2ccco2 Amb17138428 [0,0,0,1,1,0|2,0,0]=4 3745 B12R2.6 O=C1CCC(C1)c2cccs2 Amb17138616 [0,0,0,1,1,0|2,0,0]=4 3746 B12R2.6 O=C1NC(CO1)c2cc[s]c2 Amb24454391 [0,0,0,1,1,0|2,0,0]=4 3747 B12R2.6 O=C1NC(CO1)c2ccc[nH]2 Amb25150573 [0,0,0,1,1,0|2,0,0]=4 3748 B12R2.6 O=C1NC(CO1)c2ccoc2 Amb24705751 [0,0,0,1,1,0|2,0,0]=4 3749 B12R2.6 O=C1NCC(C1)c2ccco2 Amb17399916 [0,0,0,1,1,0|2,0,0]=4 3750 B12R2.6 O=C1NCC(C1)c2cccs2 Amb13783611 [0,0,0,1,1,0|2,0,0]=4 3751 B12R2.6 O=C1N[C@@H](CO1)c2ccc[nH]2 Amb24658612 [0,0,0,1,1,0|2,0,0]=4 3752 B12R2.6 O=C1N[C@@H](CO1)c2ccco2 Amb25365113 [0,0,0,1,1,0|2,0,0]=4 3753 B12R2.6 O=C1N[C@@H](CO1)c2ccoc2 Amb24562211 [0,0,0,1,1,0|2,0,0]=4 3754 B12R2.6 O=C1N[C@H](CO1)c2ccc[nH]2 Amb25714688 [0,0,0,1,1,0|2,0,0]=4 3755 B12R2.6 O=C1N[C@H](CO1)c2ccco2 Amb25738019 [0,0,0,1,1,0|2,0,0]=4 3756 B12R2.114 O=C1Cc2cc[nH]c2CCN1 Amb24486525 [0,0,0,1,1,0|2,0,0]=4 3757 B12R2.114 O=C1Cc2cc[s]c2CCC1 Amb24553612 [0,0,0,1,1,0|2,0,0]=4 3758 B12R2.114 O=C1Cc2cc[s]c2CCN1 Amb24392110 [0,0,0,1,1,0|2,0,0]=4 3759 B12R2.136 O=C1CC(Cc2ccco2)N1 Amb25727849 [0,0,0,1,1,0|2,0,0]=4 3760 B12R2.136 O=C1C[C@H](Cc2ccc[s]2)N1 Amb24484792 [0,0,0,1,1,0|2,0,0]=4 3761 B12R2.136 O=C1C[C@H](Cc2ccco2)N1 Amb24560953 [0,0,0,1,1,0|2,0,0]=4 3762 B12R2.1354 CC(=O)C1CC1c2ccoc2 Amb24415934 [0,0,0,1,1,0|2,0,0]=4 3763 B12R2.1354 CC(=O)[C@@H]1C[C@H]1c2ccco2 Amb24741210 [0,0,0,1,1,0|2,0,0]=4 3764 B12R2.1354 CC(=O)[C@H]1C[C@@H]1c2ccc[s]2 Amb25286323 [0,0,0,1,1,0|2,0,0]=4 3765 B14R2.2 CC(=C)CC1NCc2ccccc21 Amb24689726 [0,0,0,1,0,1|2,0,0]=4 3766 B14R2.2 CC(=O)CC1CNc2ccccc21 Amb25155675 [0,0,0,1,0,1|1,0,0]=3 3767 B14R2.2 CC(=O)C[C@H]1CCc2ccccc21 Amb24495028 [0,0,0,1,0,1|1,0,0]=3 3768 B14R2.2 CC(=O)NC1=CCc2ccccc12 Amb22270448 [0,0,0,1,0,1|1,0,1]=4 3769 B14R2.2 CC(=O)NC1COc2ccccc21 Amb25369926 [0,0,0,1,0,1|1,0,0]=3 3770 B14R2.2 CC(=O)NN1CCc2ccccc12 Amb21951336 [0,0,0,1,0,1|1,0,0]=3 3771 B14R2.2 CC(=O)N[C@H]1CCc2ccc[n]c21 Amb24343851 [0,0,0,1,0,1|2,0,0]=4 3772 B14R2.2 CC(=O)OC1CCc2ccc[n]c21 Amb22497182 [0,0,0,1,0,1|1,0,0]=3 3773 B14R2.2 CC(=O)OC1CCc2ccccc21 Amb24323359 [0,0,0,1,0,1|0,0,0]=2 3774 B14R2.2 CC(=O)OC1COc2cc[n]cc21 Amb24400622 [0,0,0,1,0,1|1,0,0]=3 3775 B14R2.2 CC(=O)OC1COc2ccccc21 Amb24393757 [0,0,0,1,0,1|0,0,0]=2 3776 B14R2.2 CC(=O)O[n]1ccc2ccccc12 Amb25760121 [0,0,0,1,0,1|0,0,2]=4 3777 B14R2.2 CC(=O)Oc1[n][nH]c2ccccc21 Amb25850315 [0,0,0,1,0,1|1,0,1]=4 3778 B14R2.2 CC(=O)Oc1c[nH]c2c1cccc2 Amb1229160 [0,0,0,1,0,1|0,0,2]=4 3779 B14R2.2 CC(=O)Oc1c[s]c2ccccc21 Amb24066373 [0,0,0,1,0,1|0,0,2]=4 3780 B14R2.2 CC(=O)\C=C\1/CCc2ccccc12 Amb25116540 [0,0,0,1,0,1|1,0,0]=3 3781 B14R2.2 CC(=O)\C=C\1/OCc2ccccc12 Amb19651458 [0,0,0,1,0,1|1,0,1]=4 3782 B14R2.2 NC(=O)CC1CCc2c1cccc2 Amb17233113 [0,0,0,1,0,1|2,0,0]=4 3783 B14R2.2 NC(=O)CC1CNc2ccccc21 Amb22371342 [0,0,0,1,0,1|2,0,0]=4 3784 B14R2.2 NC(=O)CC1SCc2ccccc21 Amb24489016 [0,0,0,1,0,1|2,0,0]=4 3785 B14R2.2 NC(=O)NC1COc2ccccc21 Amb24455414 [0,0,0,1,0,1|2,0,0]=4 3786 B14R2.2 NC(=O)NN1CCc2ccccc12 Amb24638316 [0,0,0,1,0,1|2,0,0]=4 3787 B14R2.2 OC(=O)CC1CNc2ccccc21 Amb19429209 [0,0,0,1,0,1|2,0,0]=4 3788 B14R2.2 OC(=O)CC1NCc2ccccc21 Amb18196180 [0,0,0,1,0,1|2,0,0]=4 3789 B14R2.2 OC(=O)CC1OCc2ccccc21 Amb18195570 [0,0,0,1,0,1|2,0,0]=4 3790 B14R2.2 OC(=O)C[C@H]1CCc2ccccc21 Amb25337786 [0,0,0,1,0,1|2,0,0]=4 3791 B14R2.2 OC(=O)\C=C/1\CCc2ccccc12 Amb25102937 [0,0,0,1,0,1|2,0,0]=4 3792 B14R2.2 OC(=O)\C=C\1/CCc2ccccc12 Amb18035939 [0,0,0,1,0,1|2,0,0]=4 3793 B14R2.19 C=C1CN(Cc2ccccc2)CC1 Amb19334016 [0,0,0,1,0,1|2,0,0]=4 3794 B14R2.19 CC1COC(Cc2ccccc2)O1 Amb24081159 [0,0,0,1,0,1|0,0,2]=4 3795 B14R2.19 CC1COC(N1)Cc2ccccc2 Amb17506177 [0,0,0,1,0,1|1,0,1]=4 3796 B14R2.19 CC=1CCC(C1)Nc2ccccc2 Amb25096401 [0,0,0,1,0,1|2,0,0]=4 3797 B14R2.19 Cc1[n]c(Cc2ccccc2)[n]o1 Amb25760165 [0,0,0,1,0,1|1,0,1]=4 3798 B14R2.19 NC1=NC(Cc2ccccc2)CO1 Amb23449444 [0,0,0,1,0,1|2,0,0]=4 3799 B14R2.19 O=C1C=C(CO1)Nc2ccccc2 Amb22481357 [0,0,0,1,0,1|0,0,2]=4 3800 B14R2.19 O=C1C=C(CO1)Sc2ccccc2 Amb21928058 [0,0,0,1,0,1|0,0,2]=4 3801 B14R2.19 O=C1CC(CC1)Sc2cccc[n]2 Amb25731692 [0,0,0,1,0,1|2,0,0]=4 3802 B14R2.19 O=C1CC(CC1)Sc2ccccc2 Amb25815229 [0,0,0,1,0,1|1,0,0]=3 3803 B14R2.19 O=C1CC(Cc2cc[n]cc2)CN1 Amb24349657 [0,0,0,1,0,1|2,0,0]=4 3804 B14R2.19 O=C1CC(Cc2ccc[n]c2)CC1 Amb25684374 [0,0,0,1,0,1|2,0,0]=4 3805 B14R2.19 O=C1CC(Cc2ccccc2)=CC1 Amb24422432 [0,0,0,1,0,1|1,0,1]=4 3806 B14R2.19 O=C1CC(Cc2ccccc2)CC1 Amb24455173 [0,0,0,1,0,1|1,0,0]=3 3807 B14R2.19 O=C1CC(Nc2ccccc2)=NO1 Amb25192239 [0,0,0,1,0,1|1,0,1]=4 3808 B14R2.19 O=C1CCC(Cc2ccccc2)O1 Amb20669272 [0,0,0,1,0,1|2,0,0]=4 3809 B14R2.19 O=C1CCN(C1)Cc2ccccc2 Amb1680105 [0,0,0,1,0,1|1,0,0]=3 3810 B14R2.19 O=C1CCN(N1)Cc2ccccc2 Amb2423894 [0,0,0,1,0,1|2,0,0]=4 3811 B14R2.19 O=C1CC[C@@H](Cc2ccccc2)N1 Amb25068439 [0,0,0,1,0,1|2,0,0]=4 3812 B14R2.19 O=C1CC[C@H](Cc2ccccc2)N1 Amb25365168 [0,0,0,1,0,1|2,0,0]=4 3813 B14R2.19 O=C1CN(Cc2ccccc2)CC1 Amb18048933 [0,0,0,1,0,1|1,0,0]=3 3814 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CC1 Amb24723978 [0,0,0,1,0,1|1,0,0]=3 3815 B14R2.19 O=C1C\C(\CO1)=C\c2ccccc2 Amb24712490 [0,0,0,1,0,1|0,0,1]=3 3816 B14R2.19 O=C1NC(Cc2cccc[n]2)CO1 Amb25288331 [0,0,0,1,0,1|2,0,0]=4 3817 B14R2.19 O=C1NC(Cc2ccccc2)=NO1 Amb18184032 [0,0,0,1,0,1|1,0,1]=4 3818 B14R2.19 O=C1NCC(C1)Cc2ccccc2 Amb10608007 [0,0,0,1,0,1|1,0,0]=3 3819 B14R2.19 O=C1NCC(Cc2ccccc2)N1 Amb18061673 [0,0,0,1,0,1|2,0,0]=4 3820 B14R2.19 O=C1NCC(Cc2ccccc2)O1 Amb18061675 [0,0,0,1,0,1|2,0,0]=4 3821 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CS1 Amb19887642 [0,0,0,1,0,1|1,1,0]=4 3822 B14R2.19 O=C1N[C@H](Cc2ccccc2)CS1 Amb19888420 [0,0,0,1,0,1|1,1,0]=4 3823 B14R2.19 O=C1OC(Cc2ccccc2)CS1 Amb25726403 [0,0,0,1,0,1|1,1,0]=4 3824 B14R2.19 O=C1OCC(O1)Sc2cc[n]cc2 Amb24410445 [0,0,0,1,0,1|2,0,0]=4 3825 B14R2.19 O=C1OCC(O1)Sc2cccc[n]2 Amb25749218 [0,0,0,1,0,1|2,0,0]=4 3826 B14R2.19 O=C1OCC(O1)Sc2ccccc2 Amb25749160 [0,0,0,1,0,1|1,0,0]=3 3827 B14R2.19 O=C1ON=C(C1)Cc2ccccc2 Amb1099037 [0,0,0,1,0,1|0,0,1]=3 3828 B14R2.19 OC1CC(Cc2ccccc2)CO1 Amb22752560 [0,0,0,1,0,1|0,0,2]=4 3829 B14R2.19 OC1CC(Cc2ccccc2)OC1 Amb24495738 [0,0,0,1,0,1|0,0,2]=4 3830 B14R2.21 CC1COCC(N1)c2ccccc2 Amb18065682 [0,0,0,1,0,1|1,0,1]=4 3831 B14R2.21 CC=1CC(NCC1)c2ccccc2 Amb25046867 [0,0,0,1,0,1|2,0,0]=4 3832 B14R2.21 CC=1CC(OCC1)c2ccccc2 Amb24066155 [0,0,0,1,0,1|2,0,0]=4 3833 B14R2.21 NC=1COCC(N1)c2ccccc2 Amb25245328 [0,0,0,1,0,1|2,0,0]=4 3834 B14R2.21 O=C1C=CCC(N1)c2ccccc2 Amb25309660 [0,0,0,1,0,1|2,0,0]=4 3835 B14R2.21 O=C1C=CC[C@@H](N1)c2ccccc2 Amb25201635 [0,0,0,1,0,1|2,0,0]=4 3836 B14R2.21 O=C1C=CC[C@@H](O1)c2ccccc2 Amb25157497 [0,0,0,1,0,1|2,0,0]=4 3837 B14R2.21 O=C1CC(C=CO1)c2ccccc2 Amb24685281 [0,0,0,1,0,1|0,0,1]=3 3838 B14R2.21 O=C1CC(CC=C1)c2ccccc2 Amb23443331 [0,0,0,1,0,1|1,0,0]=3 3839 B14R2.21 O=C1CC(CCC1)c2cc[n]cc2 Amb25044331 [0,0,0,1,0,1|2,0,0]=4 3840 B14R2.21 O=C1CC(CCC1)c2ccc[n]c2 Amb24553703 [0,0,0,1,0,1|2,0,0]=4 3841 B14R2.21 O=C1CC(CCC1)c2cccc[n]2 Amb21961938 [0,0,0,1,0,1|2,0,0]=4 3842 B14R2.21 O=C1CC(CCC1)c2ccccc2 Amb18065540 [0,0,0,1,0,1|1,0,0]=3 3843 B14R2.21 O=C1CC(CCN1)c2ccccc2 Amb20171612 [0,0,0,1,0,1|1,0,0]=3 3844 B14R2.21 O=C1CC(CCO1)c2ccccc2 Amb22499444 [0,0,0,1,0,1|0,0,0]=2 3845 B14R2.21 O=C1CC(NCC1)c2cc[n]cc2 Amb18196727 [0,0,0,1,0,1|2,0,0]=4 3846 B14R2.21 O=C1CC(NCC1)c2cccc[n]2 Amb18196728 [0,0,0,1,0,1|2,0,0]=4 3847 B14R2.21 O=C1CC(NCC1)c2ccccc2 Amb22274020 [0,0,0,1,0,1|1,0,0]=3 3848 B14R2.21 O=C1CC(OCC1)c2cc[n]cc2 Amb23586180 [0,0,0,1,0,1|2,0,0]=4 3849 B14R2.21 O=C1CC(OCC1)c2ccc[n]c2 Amb23586184 [0,0,0,1,0,1|2,0,0]=4 3850 B14R2.21 O=C1CC(OCC1)c2ccccc2 Amb19957821 [0,0,0,1,0,1|1,0,0]=3 3851 B14R2.21 O=C1CCCC(O1)c2ccccc2 Amb24118032 [0,0,0,1,0,1|2,0,0]=4 3852 B14R2.21 O=C1CCC[C@@H](N1)c2ccccc2 Amb24759096 [0,0,0,1,0,1|2,0,0]=4 3853 B14R2.21 O=C1CCC[C@@H](O1)c2ccccc2 Amb25097059 [0,0,0,1,0,1|2,0,0]=4 3854 B14R2.21 O=C1CCC[C@H](N1)c2ccccc2 Amb25131134 [0,0,0,1,0,1|2,0,0]=4 3855 B14R2.21 O=C1CCC[C@H](O1)c2ccccc2 Amb25100832 [0,0,0,1,0,1|2,0,0]=4 3856 B14R2.21 O=C1CCNC(C1)c2ccccc2 Amb17233086 [0,0,0,1,0,1|1,0,0]=3 3857 B14R2.21 O=C1CCNC(C1)c2cccnc2 Amb17233193 [0,0,0,1,0,1|2,0,0]=4 3858 B14R2.21 O=C1CCOC(N1)c2ccccc2 Amb24757545 [0,0,0,1,0,1|2,0,0]=4 3859 B14R2.21 O=C1CN(CC=C1)c2ccccc2 Amb24492699 [0,0,0,1,0,1|1,0,1]=4 3860 B14R2.21 O=C1CN(CCC1)c2cccc[n]2 Amb25669384 [0,0,0,1,0,1|2,0,0]=4 3861 B14R2.21 O=C1CN(CCC1)c2ccccc2 Amb19958729 [0,0,0,1,0,1|1,0,0]=3 3862 B14R2.21 O=C1CN(CCN1)c2cc[n]cc2 Amb24094480 [0,0,0,1,0,1|2,0,0]=4 3863 B14R2.21 O=C1CNCC(O1)c2ccccc2 Amb23536463 [0,0,0,1,0,1|2,0,0]=4 3864 B14R2.21 O=C1COCC(N1)c2cc[n]cc2 Amb25782968 [0,0,0,1,0,1|2,0,0]=4 3865 B14R2.21 O=C1COCC(N1)c2ccc[n]c2 Amb25125963 [0,0,0,1,0,1|2,0,0]=4 3866 B14R2.21 O=C1COCC(N1)c2cccc[n]2 Amb24494857 [0,0,0,1,0,1|2,0,0]=4 3867 B14R2.21 O=C1COCC(N1)c2ccccc2 Amb21864800 [0,0,0,1,0,1|1,0,0]=3 3868 B14R2.21 O=C1COC[C@@H](N1)c2ccc[n]c2 Amb25704205 [0,0,0,1,0,1|2,0,0]=4 3869 B14R2.21 O=C1COC[C@@H](N1)c2ccccc2 Amb24181880 [0,0,0,1,0,1|1,0,0]=3 3870 B14R2.21 O=C1COC[C@H](N1)c2cc[n]cc2 Amb25140157 [0,0,0,1,0,1|2,0,0]=4 3871 B14R2.21 O=C1COC[C@H](N1)c2ccc[n]c2 Amb25687602 [0,0,0,1,0,1|2,0,0]=4 3872 B14R2.21 O=C1COC[C@H](N1)c2ccccc2 Amb24654701 [0,0,0,1,0,1|1,0,0]=3 3873 B14R2.21 O=C1CP(CCN1)c2ccccc2 Amb25105493 [0,0,0,1,0,1|1,0,0]=3 3874 B14R2.21 O=C1C[C@@H](CC=C1)c2ccccc2 Amb24492589 [0,0,0,1,0,1|1,0,0]=3 3875 B14R2.21 O=C1C[C@@H](CCC1)c2ccccc2 Amb22745610 [0,0,0,1,0,1|1,0,0]=3 3876 B14R2.21 O=C1C[C@@H](CCO1)c2ccccc2 Amb25113432 [0,0,0,1,0,1|0,0,0]=2 3877 B14R2.21 O=C1C[C@@H](NC=C1)c2ccccc2 Amb25732040 [0,0,0,1,0,1|1,0,1]=4 3878 B14R2.21 O=C1C[C@@H](OC=C1)c2ccccc2 Amb25785647 [0,0,0,1,0,1|1,0,1]=4 3879 B14R2.21 O=C1C[C@@H](OCC1)c2ccccc2 Amb22748229 [0,0,0,1,0,1|1,0,0]=3 3880 B14R2.21 O=C1C[C@H](CC=C1)c2ccccc2 Amb25373085 [0,0,0,1,0,1|1,0,0]=3 3881 B14R2.21 O=C1C[C@H](CCN1)c2ccccc2 Amb25191711 [0,0,0,1,0,1|1,0,0]=3 3882 B14R2.21 O=C1C[C@H](NC=C1)c2ccccc2 Amb25858746 [0,0,0,1,0,1|1,0,1]=4 3883 B14R2.21 O=C1C[C@H](OCC1)c2ccccc2 Amb24408429 [0,0,0,1,0,1|1,0,0]=3 3884 B14R2.21 O=C1NC(CCN1)c2ccccc2 Amb25733512 [0,0,0,1,0,1|2,0,0]=4 3885 B14R2.21 O=C1NC(CCO1)c2cc[n]cc2 Amb25795538 [0,0,0,1,0,1|2,0,0]=4 3886 B14R2.21 O=C1NCCC(O1)c2ccccc2 Amb25081073 [0,0,0,1,0,1|2,0,0]=4 3887 B14R2.21 O=C1NN(CCN1)c2ccccc2 Amb25190360 [0,0,0,1,0,1|2,0,0]=4 3888 B14R2.21 O=C1N[C@@H](CCN1)c2ccccc2 Amb25288289 [0,0,0,1,0,1|2,0,0]=4 3889 B14R2.21 O=C1N[C@@H](CCO1)c2ccccc2 Amb25153780 [0,0,0,1,0,1|1,0,0]=3 3890 B14R2.21 O=C1N[C@H](CCN1)c2ccccc2 Amb24441525 [0,0,0,1,0,1|2,0,0]=4 3891 B14R2.21 O=C1N[C@H](CCO1)c2cc[n]cc2 Amb25156414 [0,0,0,1,0,1|2,0,0]=4 3892 B14R2.21 O=C1N[C@H](CCO1)c2ccc[n]c2 Amb25156419 [0,0,0,1,0,1|2,0,0]=4 3893 B14R2.21 O=C1N[C@H](CCO1)c2cccc[n]2 Amb25153779 [0,0,0,1,0,1|2,0,0]=4 3894 B14R2.21 O=C1N[C@H](CCO1)c2ccccc2 Amb24427391 [0,0,0,1,0,1|1,0,0]=3 3895 B14R2.21 O=S1CC(NCC1)c2ccccc2 Amb19374300 [0,0,0,1,0,1|2,0,0]=4 3896 B14R2.21 OC1CC(CCO1)c2ccccc2 Amb25739647 [0,0,0,1,0,1|0,0,2]=4 3897 B14R2.21 O[C@@H]1C[C@@H](CCO1)c2ccccc2 Amb25271997 [0,0,0,1,0,1|0,0,2]=4 3898 B14R2.391 O=C1CCCOc2ccccc2N1 Amb25669175 [0,0,0,1,0,1|2,0,0]=4 3899 B14R2.391 O=C1CCSCc2ccccc2N1 Amb24444838 [0,0,0,1,0,1|2,0,0]=4 3900 B14R2.391 O=S1Cc2ccccc2NCCC1 Amb24451209 [0,0,0,1,0,1|2,0,0]=4 3901 B14R2.436 O=C1CC(C#Cc2ccccc2)N1 Amb25803644 [0,0,0,1,0,1|1,0,1]=4 3902 B14R2.436 O=C1CC(C1)OCc2ccccc2 Amb10844904 [0,0,0,1,0,1|1,0,0]=3 3903 B14R2.436 O=C1CC(N1)SCc2ccc[n]c2 Amb25121168 [0,0,0,1,0,1|2,0,0]=4 3904 B14R2.436 O=C1CC(N1)SCc2ccccc2 Amb25770538 [0,0,0,1,0,1|1,0,0]=3 3905 B14R2.436 O=C1CC(\C=C\c2ccccc2)N1 Amb24666627 [0,0,0,1,0,1|1,0,1]=4 3906 B14R2.764 CC(=O)C/1C\C1=C\c2ccccc2 Amb25034284 [0,0,0,1,0,1|1,0,1]=4 3907 B14R2.764 CC(=O)C1CC1Oc2ccccc2 Amb24408342 [0,0,0,1,0,1|1,0,0]=3 3908 B14R2.764 CC(=O)C1OC1Cc2ccccc2 Amb24706975 [0,0,0,1,0,1|0,0,0]=2 3909 B14R2.764 CC(=O)[C@@H]1C[C@H]1Oc2ccccc2 Amb24655035 [0,0,0,1,0,1|1,0,0]=3 3910 B14R2.764 CC(=O)[C@@H]1O[C@H]1Cc2ccccc2 Amb24512629 [0,0,0,1,0,1|0,0,0]=2 3911 B14R2.764 NC(=O)C1CC1Cc2ccccc2 Amb25802442 [0,0,0,1,0,1|2,0,0]=4 3912 B14R2.764 NC(=O)C1CC1Oc2ccccc2 Amb25702314 [0,0,0,1,0,1|2,0,0]=4 3913 B14R2.764 NC(=O)[C@@H]1C[C@H]1Oc2ccccc2 Amb24649972 [0,0,0,1,0,1|2,0,0]=4 3914 B14R2.764 OC(=O)C1CC1Cc2ccccc2 Amb18990227 [0,0,0,1,0,1|2,0,0]=4 3915 B14R2.764 OC(=O)[C@@H]1C[C@H]1Cc2ccccc2 Amb25179092 [0,0,0,1,0,1|2,0,0]=4 3916 B14R2.764 OC(=O)[C@@H]1C[C@H]1Oc2ccccc2 Amb25173187 [0,0,0,1,0,1|2,0,0]=4 3917 B14R2.764 [O-]C(=O)C1CN1Cc2ccccc2 Amb22261487 [0,0,0,1,0,1|2,0,0]=4 3918 B14R2.780 CC(=O)C1CCC1c2ccccc2 Amb24548830 [0,0,0,1,0,1|1,0,0]=3 3919 B14R2.780 CC(=O)N1CCC1c2ccccc2 Amb24352925 [0,0,0,1,0,1|1,0,0]=3 3920 B14R2.780 CC(=O)[C@@H]1CC[C@@H]1c2ccccc2 Amb24724006 [0,0,0,1,0,1|1,0,0]=3 3921 B14R2.780 OC(=O)C1CCN1c2ccccc2 Amb24444949 [0,0,0,1,0,1|2,0,0]=4 3922 B14R2.780 OC(=O)C1CSC1c2ccccc2 Amb24624933 [0,0,0,1,0,1|2,0,0]=4 3923 B14R2.780 OC(=O)[C@@H]1CC[C@@H]1c2ccccc2 Amb24550645 [0,0,0,1,0,1|2,0,0]=4 3924 B14R2.780 OC(=O)[C@@H]1CC[C@H]1c2ccccc2 Amb24622779 [0,0,0,1,0,1|2,0,0]=4 3925 B14R2.780 OC(=O)[C@@H]1NC[C@H]1c2ccccc2 Amb24552426 [0,0,0,1,0,1|2,0,0]=4 3926 B14R2.780 OC(=O)[C@H]1NC[C@@H]1c2ccccc2 Amb24550614 [0,0,0,1,0,1|2,0,0]=4 3927 B14R2.790 CC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb24273291 [0,0,0,1,0,1|1,0,0]=3 3928 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccc[n]c2 Amb24459310 [0,0,0,1,0,1|2,0,0]=4 3929 B14R2.790 NC(=O)C[C@@H]1O[C@@H]1c2ccccc2 Amb24562883 [0,0,0,1,0,1|2,0,0]=4 3930 B14R2.790 NC(=O)NC1CC1c2ccccc2 Amb18180588 [0,0,0,1,0,1|2,0,0]=4 3931 B14R2.790 NC(=O)N[C@@H]1C[C@@H]1c2ccccc2 Amb24519168 [0,0,0,1,0,1|2,0,0]=4 3932 B14R2.790 NC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb24602073 [0,0,0,1,0,1|2,0,0]=4 3933 B14R2.790 OC(=O)CC1CC1c2ccccc2 Amb17233181 [0,0,0,1,0,1|2,0,0]=4 3934 B14R2.790 OC(=O)CC1OC1c2ccccc2 Amb25794476 [0,0,0,1,0,1|2,0,0]=4 3935 B14R2.790 OC(=O)C[C@@H]1C[C@H]1c2ccccc2 Amb24467878 [0,0,0,1,0,1|2,0,0]=4 3936 B14R2.790 OC(=O)C[C@H]1C[C@@H]1c2ccccc2 Amb25209939 [0,0,0,1,0,1|2,0,0]=4 3937 B14R2.31137 CC(=C)CNC1Cc2ccccc21 Amb24387460 [0,0,0,1,0,1|2,0,0]=4 3938 B14R2.31137 CC(=O)CCC1Cc2ccccc21 Amb25720706 [0,0,0,1,0,1|1,0,0]=3 3939 B14R2.31137 OC(=O)CCC1Cc2ccccc21 Amb25684770 [0,0,0,1,0,1|2,0,0]=4 3940 B14R2.31359 CC(=N)N1CCCc2ccccc12 Amb25141464 [0,0,0,1,0,1|2,0,0]=4 3941 B14R2.31359 CC(=O)C1=CCOc2ccccc21 Amb24449014 [0,0,0,1,0,1|1,0,1]=4 3942 B14R2.31359 CC(=O)C1C=CCc2ccccc21 Amb25706975 [0,0,0,1,0,1|1,0,1]=4 3943 B14R2.31359 CC(=O)C1CCCc2ccc[n]c21 Amb25046405 [0,0,0,1,0,1|2,0,0]=4 3944 B14R2.31359 CC(=O)C1CCCc2ccccc21 Amb18183860 [0,0,0,1,0,1|1,0,0]=3 3945 B14R2.31359 CC(=O)C1CCNc2ccccc21 Amb25839747 [0,0,0,1,0,1|1,0,0]=3 3946 B14R2.31359 CC(=O)C1COCc2ccccc21 Amb25121584 [0,0,0,1,0,1|1,0,0]=3 3947 B14R2.31359 CC(=O)C1NCCc2ccccc21 Amb25843581 [0,0,0,1,0,1|1,0,0]=3 3948 B14R2.31359 CC(=O)C1OCCc2c1cccc2 Amb17594476 [0,0,0,1,0,1|0,0,0]=2 3949 B14R2.31359 CC(=O)N1CCCc2[n]cccc12 Amb25100904 [0,0,0,1,0,1|2,0,0]=4 3950 B14R2.31359 CC(=O)N1CCNc2ccc[n]c12 Amb18196089 [0,0,0,1,0,1|2,0,0]=4 3951 B14R2.31359 CC(=O)N1CCOc2[n]cccc12 Amb25847441 [0,0,0,1,0,1|2,0,0]=4 3952 B14R2.31359 CC(=O)N1CCOc2c1cccc2 Amb17593003 [0,0,0,1,0,1|1,0,0]=3 3953 B14R2.31359 CC(=O)N1CCOc2ccc[n]c12 Amb25815273 [0,0,0,1,0,1|2,0,0]=4 3954 B14R2.31359 CC(N)C1OCCc2ccccc21 Amb18127999 [0,0,0,1,0,1|1,0,1]=4 3955 B14R2.31359 CC(O)C1OCCc2ccccc21 Amb24617377 [0,0,0,1,0,1|0,0,2]=4 3956 B14R2.31359 CS(=O)N1CCNc2ccccc12 Amb24665568 [0,0,0,1,0,1|2,0,0]=4 3957 B14R2.31359 ClC(=O)N1CCCc2c1cccc2 Amb17563101 [0,0,0,1,0,1|2,0,0]=4 3958 B14R2.31359 NC(=N)C1OCCc2ccccc21 Amb23504141 [0,0,0,1,0,1|2,0,0]=4 3959 B14R2.31359 NC(=O)C1CCNc2ccccc21 Amb22059639 [0,0,0,1,0,1|2,0,0]=4 3960 B14R2.31359 NC(=O)C1CNCc2ccccc21 Amb25849864 [0,0,0,1,0,1|2,0,0]=4 3961 B14R2.31359 NC(=O)C1NCCc2ccccc21 Amb18946033 [0,0,0,1,0,1|2,0,0]=4 3962 B14R2.31359 NC(=O)C1OCCc2ccccc21 Amb18180638 [0,0,0,1,0,1|1,0,0]=3 3963 B14R2.31359 NC(=O)N1CCCc2c1cccc2 Amb1126930 [0,0,0,1,0,1|2,0,0]=4 3964 B14R2.31359 O=C(Cl)C1=CCCc2ccccc21 Amb25793463 [0,0,0,1,0,1|2,0,0]=4 3965 B14R2.31359 O=C(Cl)C1CCCc2ccccc21 Amb18324831 [0,0,0,1,0,1|2,0,0]=4 3966 B14R2.31359 O=C(Cl)C1COCc2ccccc21 Amb25335278 [0,0,0,1,0,1|2,0,0]=4 3967 B14R2.31359 O=C(Cl)C1OCCc2ccccc21 Amb24571154 [0,0,0,1,0,1|1,0,0]=3 3968 B14R2.31359 O=C(Cl)C1SCCc2ccccc21 Amb24531746 [0,0,0,1,0,1|1,1,0]=4 3969 B14R2.31359 OC(=O)C1=CCCc2c1cccc2 Amb17232997 [0,0,0,1,0,1|2,0,0]=4 3970 B14R2.31359 OC(=O)C1CCNc2c1cccc2 Amb10603353 [0,0,0,1,0,1|2,0,0]=4 3971 B14R2.31359 OC(=O)C1CCNc2ccccc21 Amb21857054 [0,0,0,1,0,1|2,0,0]=4 3972 B14R2.31359 OC(=O)C1CCOc2c1cccc2 Amb13952834 [0,0,0,1,0,1|2,0,0]=4 3973 B14R2.31359 OC(=O)C1CCSc2ccccc21 Amb18651956 [0,0,0,1,0,1|2,0,0]=4 3974 B14R2.31359 OC(=O)C1CNCc2c1cccc2 Amb2372591 [0,0,0,1,0,1|2,0,0]=4 3975 B14R2.31359 OC(=O)C1CNCc2ccccc21 Amb22751637 [0,0,0,1,0,1|2,0,0]=4 3976 B14R2.31359 OC(=O)C1NCCc2c1cccc2 Amb1034897 [0,0,0,1,0,1|2,0,0]=4 3977 B14R2.31359 OC(=O)C1NCCc2ccccc21 Amb22492442 [0,0,0,1,0,1|2,0,0]=4 3978 B14R2.31359 OC(=O)C1OCCc2c1cccc2 Amb2372592 [0,0,0,1,0,1|1,0,0]=3 3979 B14R2.31359 OC(=O)C1SCCc2ccccc21 Amb19148991 [0,0,0,1,0,1|1,1,0]=4 3980 B14R2.31359 OC(=O)[C@@H]1CCNc2ccccc21 Amb24489311 [0,0,0,1,0,1|2,0,0]=4 3981 B14R2.31359 OC(=O)[C@@H]1OCCc2ccccc21 Amb24442964 [0,0,0,1,0,1|1,0,0]=3 3982 B14R2.31359 OC(=O)[C@H]1CCCc2ccccc12 Amb17672002 [0,0,0,1,0,1|2,0,0]=4 3983 B14R2.4359 O=C1CC(CN1)C=2C=CC=CNC2 Amb25086856 [0,0,0,1,0,1|1,0,0]=3 3984 B14R2.68 C=C1CNC(CC1)c2ccccc2 Amb25799677 [0,1,0,1,0,0|2,0,0]=4 3985 B14R2.68 CC1CNC(CO1)c2ccccc2 Amb18065683 [0,1,0,1,0,0|1,0,1]=4 3986 B14R2.68 NC1=NCC(CS1)c2ccccc2 Amb25060756 [0,1,0,1,0,0|1,1,0]=4 3987 B14R2.68 NC=1COC(CN1)c2ccccc2 Amb24407090 [0,1,0,1,0,0|2,0,0]=4 3988 B14R2.68 NC=1NCC(CN1)c2ccccc2 Amb18127515 [0,1,0,1,0,0|2,0,0]=4 3989 B14R2.68 O=C1CCC(CC1)c2cc[n]cc2 Amb18065559 [0,1,0,1,0,0|2,0,0]=4 3990 B14R2.68 O=C1CCC(CC1)c2ccc[n]c2 Amb18065558 [0,1,0,1,0,0|2,0,0]=4 3991 B14R2.68 O=C1CCC(CC1)c2cccc[n]2 Amb18065557 [0,1,0,1,0,0|2,0,0]=4 3992 B14R2.68 O=C1CCC(CC1)c2ccccc2 Amb1208394 [0,1,0,1,0,0|1,0,0]=3 3993 B14R2.68 O=C1CCC(CN1)c2cccc[n]2 Amb25110093 [0,1,0,1,0,0|2,0,0]=4 3994 B14R2.68 O=C1CCC(CN1)c2ccccc2 Amb17400501 [0,1,0,1,0,0|1,0,0]=3 3995 B14R2.68 O=C1CCC(N=N1)c2ccccc2 Amb10576464 [0,1,0,1,0,0|2,0,0]=4 3996 B14R2.68 O=C1CCN(CC1)c2ccccc2 Amb10070984 [0,1,0,1,0,0|2,0,0]=4 3997 B14R2.68 O=C1CCN(OC1)c2ccccc2 Amb25190301 [0,1,0,1,0,0|2,0,0]=4 3998 B14R2.68 O=C1CNC(CN1)c2cc[n]cc2 Amb23452783 [0,1,0,1,0,0|2,0,0]=4 3999 B14R2.68 O=C1CNC(CN1)c2ccc[n]c2 Amb23452782 [0,1,0,1,0,0|2,0,0]=4 4000 B14R2.68 O=C1CNC(CN1)c2ccccc2 Amb23452781 [0,1,0,1,0,0|1,0,0]=3 4001 B14R2.68 O=C1CNC(CO1)c2ccccc2 Amb18127910 [0,1,0,1,0,0|0,0,0]=2 4002 B14R2.68 O=C1CN[C@@H](CO1)c2ccccc2 Amb22748846 [0,1,0,1,0,0|0,0,0]=2 4003 B14R2.68 O=C1CN[C@H](CO1)c2ccccc2 Amb24052958 [0,1,0,1,0,0|0,0,0]=2 4004 B14R2.68 O=C1COC(CN1)c2ccccc2 Amb18224547 [0,1,0,1,0,0|1,0,0]=3 4005 B14R2.68 O=C1CSC(SC1)c2ccccc2 Amb22461597 [0,1,0,1,0,0|2,0,0]=4 4006 B14R2.68 O=C1NCC(CN1)c2ccc[n]c2 Amb25776935 [0,1,0,1,0,0|2,0,0]=4 4007 B14R2.68 O=C1NCC(CN1)c2ccccc2 Amb25295398 [0,1,0,1,0,0|1,0,0]=3 4008 B14R2.68 O=C1NN=C(CO1)c2ccccc2 Amb24715861 [0,1,0,1,0,0|1,0,1]=4 4009 B14R2.68 S=C1NCC(CN1)c2ccccc2 Amb24090250 [0,1,0,1,0,0|1,1,0]=4 4010 B14R2.287 CN1CCC(=O)Cc2ccccc12 Amb18197184 [0,1,0,1,0,0|2,0,0]=4 4011 B14R2.287 NC1CCC(=O)Nc2ccccc21 Amb18196737 [0,1,0,1,0,0|2,0,0]=4 4012 B14R2.287 O=C1Cc2ccccc2C(=O)CC1 Amb24492585 [0,1,0,1,0,0|1,0,1]=4 4013 B14R2.403 CC1(C)NC(CO1)c2ccccc2 Amb25192104 [0,1,0,1,0,0|1,0,1]=4 4014 B14R2.403 CC1(C)N[C@H](CO1)c2ccccc2 Amb25685392 [0,1,0,1,0,0|1,0,1]=4 4015 B14R2.403 O=S1(=O)CCC(C1)c2ccccc2 Amb2500798 [0,1,0,1,0,0|2,0,0]=4 4016 B14R2.422 O=C1CC(C1)C(=O)c2ccccc2 Amb25130597 [0,1,0,1,0,0|1,0,1]=4 4017 B14R2.422 O=C1CC(N1)S(=O)c2ccccc2 Amb25324966 [0,1,0,1,0,0|2,0,0]=4 4018 B14R2.422 O[C@@H]([C@H]1CC(=O)N1)c2ccccc2 Amb25350566 [0,1,0,1,0,0|1,0,0]=3 4019 B14R2.453 CC(=O)O[C@@H]1[C@H](O)c2ccccc21 Amb25284410 [0,1,0,1,0,0|0,0,0]=2 4020 B14R2.779 CC(=O)N1CC(C1)c2ccccc2 Amb22494950 [0,1,0,1,0,0|1,0,0]=3 4021 B14R2.779 NC(=O)C1CC(C1)c2ccccc2 Amb24396903 [0,1,0,1,0,0|2,0,0]=4 4022 B14R2.779 OC(=O)C1CC(C1)c2ccccc2 Amb13951336 [0,1,0,1,0,0|2,0,0]=4 4023 B14R2.779 OC(=O)[C@@H]1C[C@H](C1)c2ccccc2 Amb24607374 [0,1,0,1,0,0|2,0,0]=4 4024 B14R2.792 OC(CC=C1CC1)c2ccccc2 Amb24495706 [0,1,0,1,0,0|2,0,0]=4 4025 B14R2.2950 CC1(CC(=O)CO1)c2ccccc2 Amb25236963 [0,1,0,1,0,0|2,0,0]=4 4026 B14R2.2950 CC1(CCC(=O)C1)c2ccc[n]c2 Amb25688171 [0,1,0,1,0,0|2,0,0]=4 4027 B14R2.2950 CC1(CNC(=O)C1)c2ccc[n]c2 Amb25154891 [0,1,0,1,0,0|2,0,0]=4 4028 B14R2.2950 CC1(COC(=O)N1)c2cc[n]cc2 Amb24563301 [0,1,0,1,0,0|2,0,0]=4 4029 B14R2.2950 CC1(COC(=O)N1)c2ccc[n]c2 Amb24692519 [0,1,0,1,0,0|2,0,0]=4 4030 B14R2.2950 CC1(COC(=O)N1)c2ccccc2 Amb23454646 [0,1,0,1,0,0|1,0,0]=3 4031 B14R2.2950 CC1CC(C)(CO1)c2ccccc2 Amb25324271 [0,1,0,1,0,0|1,0,1]=4 4032 B14R2.2950 C[C@@]1(COC(=O)N1)c2ccccc2 Amb24344040 [0,1,0,1,0,0|1,0,0]=3 4033 B14R2.2950 C[C@]1(CC(=O)C=C1)c2ccccc2 Amb24380820 [0,1,0,1,0,0|1,0,1]=4 4034 B14R2.2950 C[C@]1(CCC(=O)C1)c2ccccc2 Amb24689537 [0,1,0,1,0,0|1,0,0]=3 4035 B14R2.2950 C[C@]1(COC(N)=N1)c2ccccc2 Amb24561011 [0,1,0,1,0,0|2,0,0]=4 4036 B14R2.2950 O=C1NCC(O1)(C)c2ccccc2 Amb17194507 [0,1,0,1,0,0|2,0,0]=4 4037 B14R2.2950 OC1(CCC(=O)N1)c2ccccc2 Amb19986980 [0,1,0,1,0,0|2,0,0]=4 4038 B14R2.2950 OC1(CSC(=O)N1)c2ccccc2 Amb24669068 [0,1,0,1,0,0|1,1,0]=4 4039 B14R2.9520 C[C@@]1(C[C@H]1C(N)=O)c2ccccc2 Amb24512054 [0,1,0,1,0,0|2,0,0]=4 4040 B14R2.9520 C[C@@]1(C[C@H]1C(O)=O)c2ccccc2 Amb25176089 [0,1,0,1,0,0|2,0,0]=4 4041 B14R2.9520 C[C@]1(C[C@H]1C(N)=O)c2ccccc2 Amb24602361 [0,1,0,1,0,0|2,0,0]=4 4042 B14R2.9520 C[C@]1(C[C@H]1C(O)=O)c2ccccc2 Amb25366533 [0,1,0,1,0,0|2,0,0]=4 4043 B14R2.9520 OC(=O)[C@@H]1C[C@@]1(F)c2ccccc2 Amb25213297 [0,1,0,1,0,0|2,0,0]=4 4044 B14R2.9520 OC(=O)[C@@H]1C[C@]1(F)c2ccccc2 Amb24538835 [0,1,0,1,0,0|2,0,0]=4 4045 B14R2.15693 CC1(C)OC1C(O)c2ccccc2 Amb24648165 [0,1,0,1,0,0|1,0,1]=4 4046 B14R2.25733 CC(=N)N1CC(C)c2ccccc12 Amb24681446 [0,1,0,1,0,0|2,0,0]=4 4047 B14R2.25733 CC(=O)N1OC(O)c2ccccc12 Amb25058516 [0,1,0,1,0,0|2,0,0]=4 4048 B14R2.25733 CC1CN(C(=O)Cl)c2ccccc21 Amb25231029 [0,1,0,1,0,0|2,0,0]=4 4049 B14R2.25733 CC1CN(C(N)=O)c2ccccc21 Amb25344539 [0,1,0,1,0,0|2,0,0]=4 4050 B14R2.25733 NC(=O)[C@@H]1C[C@H](N)c2ccccc21 Amb25327852 [0,1,0,1,0,0|2,0,0]=4 4051 B14R2.25733 N[C@@H]1C[C@@H](c2ccccc21)C(O)=O Amb17933182 [0,1,0,1,0,0|2,0,0]=4 4052 B14R2.25733 N[C@@H]1C[C@@H](c2ccccc21)C(O)=O Amb22747813 [0,1,0,1,0,0|2,0,0]=4 4053 B14R2.25733 N[C@H]1C[C@@H](c2ccccc21)C(O)=O Amb24580024 [0,1,0,1,0,0|2,0,0]=4 4054 B14R2.25733 OC(=O)C1CC(O)c2ccccc21 Amb18039839 [0,1,0,1,0,0|2,0,0]=4 4055 B14R2.25733 OC(=O)C1CC(c2c1cccc2)C Amb17233191 [0,1,0,1,0,0|2,0,0]=4 4056 B14R2.25733 OC(=O)C1CC(c2c1cccc2)N Amb17470562 [0,1,0,1,0,0|2,0,0]=4 4057 B14R2.22 Cc1cc(c[n]c1)C2CCC(=O)C2 Amb25374744 [0,1,0,1,0,0|2,0,0]=4 4058 B14R2.22 Cc1cc(ccc1)C2CNC(=O)N2 Amb25191596 [0,1,0,1,0,0|2,0,0]=4 4059 B14R2.22 Cc1cc(ccc1)C2COC(N)=N2 Amb25280634 [0,1,0,1,0,0|2,0,0]=4 4060 B14R2.22 Cc1cc(ccc1)C=2CC(=O)ON2 Amb24425459 [0,1,0,1,0,0|1,0,1]=4 4061 B14R2.22 Cc1cc(ccc1)[C@@H]2CCC(=O)N2 Amb24740618 [0,1,0,1,0,0|2,0,0]=4 4062 B14R2.22 Cc1cc(ccc1)[C@@H]2CNC(=O)N2 Amb25153942 [0,1,0,1,0,0|2,0,0]=4 4063 B14R2.22 Cc1cc(ccc1)[C@H]2CCC(=O)N2 Amb24360806 [0,1,0,1,0,0|2,0,0]=4 4064 B14R2.22 Cc1cc(ccc1)[C@H]2COC(=O)N2 Amb24472273 [0,1,0,1,0,0|1,0,0]=3 4065 B14R2.22 Cc1cccc([n]1)C2CNC(=O)C2 Amb24534467 [0,1,0,1,0,0|2,0,0]=4 4066 B14R2.22 Cc1cccc([n]1)[C@@H]2COC(=O)N2 Amb25091044 [0,1,0,1,0,0|2,0,0]=4 4067 B14R2.22 NC1=NC(CO1)c2cccc(Br)c2 Amb24618055 [0,1,0,1,0,0|2,0,0]=4 4068 B14R2.22 NC1=NC(CO1)c2cccc(Cl)c2 Amb25670116 [0,1,0,1,0,0|2,0,0]=4 4069 B14R2.22 NC1=NC(CO1)c2cccc(I)c2 Amb25294970 [0,1,0,1,0,0|2,0,0]=4 4070 B14R2.22 NC1=NC(CO1)c2cccc(O)c2 Amb25354397 [0,1,0,1,0,0|2,0,0]=4 4071 B14R2.22 NC1=N[C@H](CO1)c2cccc(Cl)c2 Amb24658428 [0,1,0,1,0,0|2,0,0]=4 4072 B14R2.22 NC1=N[C@H](CO1)c2cccc(F)c2 Amb25180742 [0,1,0,1,0,0|2,0,0]=4 4073 B14R2.22 Nc1cc(c[n]c1)C2CCC(=O)C2 Amb24453905 [0,1,0,1,0,0|2,0,0]=4 4074 B14R2.22 Nc1cc(c[n]c1)C2CNC(=O)C2 Amb24490823 [0,1,0,1,0,0|2,0,0]=4 4075 B14R2.22 Nc1cc(cc[n]1)C2CCC(=O)C2 Amb25342442 [0,1,0,1,0,0|2,0,0]=4 4076 B14R2.22 Nc1cc(cc[n]1)C2CNC(=O)C2 Amb24413852 [0,1,0,1,0,0|2,0,0]=4 4077 B14R2.22 Nc1cc(ccc1)C2CNC(=O)C2 Amb19894999 [0,1,0,1,0,0|1,0,0]=3 4078 B14R2.22 Nc1cc(ccc1)C2CNC(=O)C2 Amb20668391 [0,1,0,1,0,0|1,0,0]=3 4079 B14R2.22 Nc1cc(ccc1)C2CNC(=O)O2 Amb18120405 [0,1,0,1,0,0|2,0,0]=4 4080 B14R2.22 Nc1cc(ccc1)[C@H]2CCC(=O)N2 Amb24730083 [0,1,0,1,0,0|2,0,0]=4 4081 B14R2.22 Nc1cccc([n]1)C2CC(=O)CC2 Amb25341239 [0,1,0,1,0,0|2,0,0]=4 4082 B14R2.22 Nc1cccc([n]1)C2CNC(=O)C2 Amb25121266 [0,1,0,1,0,0|2,0,0]=4 4083 B14R2.22 O=C1CC(=NO1)c2cccc(Cl)c2 Amb22469072 [0,1,0,1,0,0|1,0,1]=4 4084 B14R2.22 O=C1CC(=NO1)c2cccc(F)c2 Amb25222437 [0,1,0,1,0,0|1,0,1]=4 4085 B14R2.22 O=C1CC(CC1)c2c[n]cc(Br)c2 Amb25140036 [0,1,0,1,0,0|2,0,0]=4 4086 B14R2.22 O=C1CC(CC1)c2cc(Cl)cc[n]2 Amb25251227 [0,1,0,1,0,0|2,0,0]=4 4087 B14R2.22 O=C1CC(CC1)c2cc[n]c(Cl)c2 Amb25850014 [0,1,0,1,0,0|2,0,0]=4 4088 B14R2.22 O=C1CC(CC1)c2cccc(Cl)[n]2 Amb25859096 [0,1,0,1,0,0|2,0,0]=4 4089 B14R2.22 O=C1CC(CC1)c2cccc(F)[n]2 Amb24491959 [0,1,0,1,0,0|2,0,0]=4 4090 B14R2.22 O=C1CC(CC1)c2cccc(F)c2 Amb18065747 [0,1,0,1,0,0|1,0,0]=3 4091 B14R2.22 O=C1CC(CN1)c2c[n]cc(Br)c2 Amb23586017 [0,1,0,1,0,0|2,0,0]=4 4092 B14R2.22 O=C1CC(CN1)c2c[n]cc(Cl)c2 Amb25839324 [0,1,0,1,0,0|2,0,0]=4 4093 B14R2.22 O=C1CC(CN1)c2cc(Br)cc[n]2 Amb25669198 [0,1,0,1,0,0|2,0,0]=4 4094 B14R2.22 O=C1CC(CN1)c2cc(Cl)cc[n]2 Amb25192513 [0,1,0,1,0,0|2,0,0]=4 4095 B14R2.22 O=C1CC(CN1)c2cc[n]c(F)c2 Amb24494369 [0,1,0,1,0,0|2,0,0]=4 4096 B14R2.22 O=C1CC(CN1)c2cccc(Br)[n]2 Amb25341086 [0,1,0,1,0,0|2,0,0]=4 4097 B14R2.22 O=C1CC(CN1)c2cccc(Cl)[n]2 Amb25073438 [0,1,0,1,0,0|2,0,0]=4 4098 B14R2.22 O=C1CC(NN1)c2cccc(Cl)c2 Amb24372050 [0,1,0,1,0,0|2,0,0]=4 4099 B14R2.22 O=C1CC(NN1)c2cccc(F)c2 Amb24533566 [0,1,0,1,0,0|2,0,0]=4 4100 B14R2.22 O=C1CCC(C1)c2cccc(c2)Br Amb17158700 [0,1,0,1,0,0|1,0,0]=3 4101 B14R2.22 O=C1CCC(C1)c2cccc(c2)C Amb17138724 [0,1,0,1,0,0|1,0,0]=3 4102 B14R2.22 O=C1CCC(C1)c2cccc(c2)Cl Amb17139524 [0,1,0,1,0,0|1,0,0]=3 4103 B14R2.22 O=C1CCC(N1)c2cccc(Br)c2 Amb23399886 [0,1,0,1,0,0|2,0,0]=4 4104 B14R2.22 O=C1CCC(O1)c2cccc(Cl)c2 Amb25076781 [0,1,0,1,0,0|2,0,0]=4 4105 B14R2.22 O=C1CC[C@@H](N1)c2cccc(Br)c2 Amb24627938 [0,1,0,1,0,0|2,0,0]=4 4106 B14R2.22 O=C1CC[C@@H](O1)c2cccc(Br)c2 Amb24392298 [0,1,0,1,0,0|2,0,0]=4 4107 B14R2.22 O=C1CC[C@@H](O1)c2cccc(Cl)c2 Amb25829476 [0,1,0,1,0,0|2,0,0]=4 4108 B14R2.22 O=C1CC[C@@H](O1)c2cccc(F)c2 Amb25187896 [0,1,0,1,0,0|2,0,0]=4 4109 B14R2.22 O=C1CC[C@H](N1)c2cccc(Br)c2 Amb25076485 [0,1,0,1,0,0|2,0,0]=4 4110 B14R2.22 O=C1CC[C@H](O1)c2cccc(Br)c2 Amb25201651 [0,1,0,1,0,0|2,0,0]=4 4111 B14R2.22 O=C1CC[C@H](O1)c2cccc(F)c2 Amb25117495 [0,1,0,1,0,0|2,0,0]=4 4112 B14R2.22 O=C1C[C@@H](CN1)c2cccc(Br)c2 Amb24494891 [0,1,0,1,0,0|1,0,0]=3 4113 B14R2.22 O=C1C[C@@H](CN1)c2cccc(Cl)c2 Amb24492046 [0,1,0,1,0,0|1,0,0]=3 4114 B14R2.22 O=C1C[C@@H](CN1)c2cccc(F)c2 Amb24494663 [0,1,0,1,0,0|1,0,0]=3 4115 B14R2.22 O=C1C[C@H](CN1)c2cccc(Cl)c2 Amb24682410 [0,1,0,1,0,0|1,0,0]=3 4116 B14R2.22 O=C1C[C@H](CN1)c2cccc(F)c2 Amb25330728 [0,1,0,1,0,0|1,0,0]=3 4117 B14R2.22 O=C1NC(CO1)c2c[n]cc(Br)c2 Amb25730923 [0,1,0,1,0,0|2,0,0]=4 4118 B14R2.22 O=C1NC(CO1)c2cccc(F)c2 Amb25316630 [0,1,0,1,0,0|1,0,0]=3 4119 B14R2.22 O=C1NC(CO1)c2cccc(I)c2 Amb25100583 [0,1,0,1,0,0|1,0,0]=3 4120 B14R2.22 O=C1NCC(C1)c2cccc(c2)Br Amb17410186 [0,1,0,1,0,0|1,0,0]=3 4121 B14R2.22 O=C1NCC(C1)c2cccc(c2)C Amb17400497 [0,1,0,1,0,0|1,0,0]=3 4122 B14R2.22 O=C1NCC(O1)c2cccc(F)c2 Amb25725655 [0,1,0,1,0,0|2,0,0]=4 4123 B14R2.22 O=C1NCC(O1)c2cccc(c2)Br Amb17255946 [0,1,0,1,0,0|2,0,0]=4 4124 B14R2.22 O=C1NCC(O1)c2cccc(c2)C Amb17233254 [0,1,0,1,0,0|2,0,0]=4 4125 B14R2.22 O=C1NCC(O1)c2cccc(c2)Cl Amb17236664 [0,1,0,1,0,0|2,0,0]=4 4126 B14R2.22 O=C1NC[C@@H](N1)c2cc(Br)ccc2 Amb25156465 [0,1,0,1,0,0|2,0,0]=4 4127 B14R2.22 O=C1NC[C@@H](N1)c2cc(F)ccc2 Amb25156409 [0,1,0,1,0,0|2,0,0]=4 4128 B14R2.22 O=C1NC[C@H](N1)c2cc(Cl)ccc2 Amb24447723 [0,1,0,1,0,0|2,0,0]=4 4129 B14R2.22 O=C1NC[C@H](N1)c2cc(F)ccc2 Amb24385190 [0,1,0,1,0,0|2,0,0]=4 4130 B14R2.22 O=C1N[C@@H](CO1)c2c[n]cc(Br)c2 Amb24409026 [0,1,0,1,0,0|2,0,0]=4 4131 B14R2.22 O=C1N[C@@H](CO1)c2cccc(Br)[n]2 Amb25714748 [0,1,0,1,0,0|2,0,0]=4 4132 B14R2.22 O=C1N[C@@H](CO1)c2cccc(Br)c2 Amb24513687 [0,1,0,1,0,0|1,0,0]=3 4133 B14R2.22 O=C1N[C@@H](CO1)c2cccc(F)c2 Amb25153939 [0,1,0,1,0,0|1,0,0]=3 4134 B14R2.22 O=C1N[C@H](CO1)c2cc[n]c(Br)c2 Amb25133638 [0,1,0,1,0,0|2,0,0]=4 4135 B14R2.22 O=C1N[C@H](CO1)c2cccc(Br)[n]2 Amb25775222 [0,1,0,1,0,0|2,0,0]=4 4136 B14R2.22 O=C1N[C@H](CO1)c2cccc(Br)c2 Amb24730803 [0,1,0,1,0,0|1,0,0]=3 4137 B14R2.22 Oc1cc(c[n]c1)C2CNC(=O)C2 Amb24647948 [0,1,0,1,0,0|2,0,0]=4 4138 B14R2.22 Oc1cc(cc[n]1)C2CCC(=O)C2 Amb25244095 [0,1,0,1,0,0|2,0,0]=4 4139 B14R2.22 Oc1cc(ccc1)C2CCC(=O)N2 Amb22295872 [0,1,0,1,0,0|2,0,0]=4 4140 B14R2.22 Oc1cc(ccc1)C2CCC(=O)O2 Amb25724360 [0,1,0,1,0,0|2,0,0]=4 4141 B14R2.22 Oc1cc(ccc1)C2COC(=O)N2 Amb25283568 [0,1,0,1,0,0|1,0,0]=3 4142 B14R2.22 Oc1cc(ccc1)[C@H]2CCC(=O)O2 Amb25667716 [0,1,0,1,0,0|2,0,0]=4 4143 B14R2.22 Oc1cc(ccc1)[C@H]2COC(=O)N2 Amb24462997 [0,1,0,1,0,0|1,0,0]=3 4144 B14R2.22 Oc1cccc([n]1)C2CNC(=O)C2 Amb25687478 [0,1,0,1,0,0|2,0,0]=4 4145 B14R2.300 CC(=O)C1=CCc2cc(F)ccc12 Amb25178707 [0,1,0,1,0,0|1,0,1]=4 4146 B14R2.300 CC(=O)N1CCc2cc(Cl)ccc12 Amb17673959 [0,1,0,1,0,0|1,0,0]=3 4147 B14R2.300 CC(=O)N1CCc2cc(F)ccc12 Amb17689300 [0,1,0,1,0,0|1,0,0]=3 4148 B14R2.300 CC(=O)N1CCc2cc(N)c[n]c12 Amb18196087 [0,1,0,1,0,0|2,0,0]=4 4149 B14R2.300 CC(=O)N1CCc2cc(S)ccc12 Amb24611077 [0,1,0,1,0,0|1,0,0]=3 4150 B14R2.300 Cc1cc2CCN(C(=O)Cl)c2cc1 Amb25208926 [0,1,0,1,0,0|2,0,0]=4 4151 B14R2.300 Cc1cc2CC[C@@H](C(O)=O)c2cc1 Amb25259172 [0,1,0,1,0,0|2,0,0]=4 4152 B14R2.300 Cc1ccc2c(CCN2C(C)=O)c1 Amb25768958 [0,1,0,1,0,0|1,0,0]=3 4153 B14R2.300 NC(=O)C1CCc2cc(Cl)ccc21 Amb22475924 [0,1,0,1,0,0|2,0,0]=4 4154 B14R2.300 NC(=O)N1CCc2cc(Br)ccc12 Amb25749268 [0,1,0,1,0,0|2,0,0]=4 4155 B14R2.300 Nc1cc2CCC(C(O)=O)c2cc1 Amb22234469 [0,1,0,1,0,0|2,0,0]=4 4156 B14R2.300 OC(=O)C1CCc2c1ccc(c2)C Amb17400539 [0,1,0,1,0,0|2,0,0]=4 4157 B14R2.300 OC(=O)C1CCc2c1ccc(c2)Cl Amb17402160 [0,1,0,1,0,0|2,0,0]=4 4158 B14R2.300 OC(=O)C1CCc2c1ccc(c2)F Amb17400751 [0,1,0,1,0,0|2,0,0]=4 4159 B14R2.300 OC(=O)C1CCc2cc(Br)ccc21 Amb18135276 [0,1,0,1,0,0|2,0,0]=4 4160 B14R2.300 OC(=O)[C@@H]1CCc2cc(Br)ccc21 Amb24417873 [0,1,0,1,0,0|2,0,0]=4 4161 B14R2.300 OC(=O)[C@@H]1CCc2cc(Cl)ccc21 Amb24655818 [0,1,0,1,0,0|2,0,0]=4 4162 B14R2.300 OC(=O)[C@@H]1CCc2cc(F)ccc21 Amb24714725 [0,1,0,1,0,0|2,0,0]=4 4163 B14R2.300 OC(=O)[C@H]1CCc2cc(F)ccc21 Amb24428706 [0,1,0,1,0,0|2,0,0]=4 4164 B14R2.300 Oc1ccc2C(CCc2c1)C(O)=O Amb25725018 [0,1,0,1,0,0|2,0,0]=4 4165 B14R2.300 Oc1ccc2c(c1)CCN2C(=O)C Amb17594505 [0,1,0,1,0,0|1,0,0]=3 4166 B14R2.390 O=C1CCCc2cccc(Br)c2N1 Amb22497451 [0,1,0,1,0,0|2,0,0]=4 4167 B14R2.390 O=C1CCCc2cccc(Cl)c2N1 Amb22500654 [0,1,0,1,0,0|2,0,0]=4 4168 B14R2.390 O=C1CCCc2cccc(F)c2N1 Amb21864694 [0,1,0,1,0,0|2,0,0]=4 4169 B14R2.4476 CC(=O)C1CC1c2cc(Br)c[n]c2 Amb24351846 [0,1,0,1,0,0|2,0,0]=4 4170 B14R2.4476 Cc1cc(ccc1)C2CC2C(N)=O Amb24490097 [0,1,0,1,0,0|2,0,0]=4 4171 B14R2.4476 Cc1cc(ccc1)[C@H]2C[C@@H]2C(N)=O Amb24648756 [0,1,0,1,0,0|2,0,0]=4 4172 B14R2.4476 Cc1cc(ccc1)[C@H]2C[C@@H]2C(O)=O Amb24567212 [0,1,0,1,0,0|2,0,0]=4 4173 B14R2.4476 Cc1cccc(c1)[C@@H]2C[C@H]2C(C)=O Amb25262717 [0,1,0,1,0,0|1,0,0]=3 4174 B14R2.4476 NC(=O)C1CC1c2cc(Cl)ccc2 Amb25738001 [0,1,0,1,0,0|2,0,0]=4 4175 B14R2.4476 NC(=O)C1CC1c2cc(F)ccc2 Amb24677885 [0,1,0,1,0,0|2,0,0]=4 4176 B14R2.4476 NC(=O)C1CC1c2cccc(c2)Br Amb13322380 [0,1,0,1,0,0|2,0,0]=4 4177 B14R2.4476 Nc1cc(ccc1)C2CC2C(O)=O Amb25238282 [0,1,0,1,0,0|2,0,0]=4 4178 B14R2.4476 OC(=O)C1CC1c2cccc(c2)O Amb17568185 [0,1,0,1,0,0|2,0,0]=4 4179 B14R2.4476 OC(=O)[C@@H]1CC1c2cc(Br)ccc2 Amb24058242 [0,1,0,1,0,0|2,0,0]=4 4180 B14R2.4476 OC(=O)[C@@H]1C[C@H]1c2cc(F)ccc2 Amb25322492 [0,1,0,1,0,0|2,0,0]=4 4181 B14R2.4476 OC(=O)[C@H]1C[C@@H]1c2cc(Cl)ccc2 Amb25322133 [0,1,0,1,0,0|2,0,0]=4 4182 B14R2.4476 Oc1cccc(c1)[C@H]2C[C@@H]2C(O)=O Amb24738654 [0,1,0,1,0,0|2,0,0]=4 4183 B14R2.7974 Cc1cc2CCCC(=O)Nc2cc1 Amb24414416 [0,1,0,1,0,0|2,0,0]=4 4184 B14R2.7974 Nc1cc2CCNC(=O)Nc2cc1 Amb25771834 [0,1,0,1,0,0|2,0,0]=4 4185 B14R2.7974 O=C1CCCc2cc(F)ccc2N1 Amb22371496 [0,1,0,1,0,0|2,0,0]=4 4186 B14R2.7974 O=C1CCCc2cc(I)ccc2N1 Amb25105403 [0,1,0,1,0,0|2,0,0]=4 4187 B14R2.7974 O=C1Cc2ccc(F)cc2CCN1 Amb25376153 [0,1,0,1,0,0|1,0,0]=3 4188 B14R2.7974 Oc1cc2CCNC(=O)Cc2cc1 Amb25678540 [0,1,0,1,0,0|1,0,0]=3 4189 B14R2.8053 CC(=O)N1CCc2cccc(Br)c12 Amb18156862 [0,1,0,1,0,0|1,0,0]=3 4190 B14R2.8053 CC(=O)N1CCc2cccc(O)c12 Amb18127887 [0,1,0,1,0,0|1,0,0]=3 4191 B14R2.8053 Cc1cccc2CCN(c12)C(C)=O Amb24069294 [0,1,0,1,0,0|1,0,0]=3 4192 B14R2.8053 NC(=O)C1CCc2cccc(O)c21 Amb25734899 [0,1,0,1,0,0|2,0,0]=4 4193 B14R2.8053 NC(=O)N1CCc2cccc(Cl)c12 Amb25763465 [0,1,0,1,0,0|2,0,0]=4 4194 B14R2.8053 NC(=O)N1CCc2cccc(F)c12 Amb25749269 [0,1,0,1,0,0|2,0,0]=4 4195 B14R2.8053 Nc1cccc2CCN(c12)C(N)=O Amb24667473 [0,1,0,1,0,0|2,0,0]=4 4196 B14R2.8053 OC(=O)C1CCc2c1c(C)ccc2 Amb17400540 [0,1,0,1,0,0|2,0,0]=4 4197 B14R2.8053 OC(=O)C1CCc2c1c(Cl)ccc2 Amb17402161 [0,1,0,1,0,0|2,0,0]=4 4198 B14R2.8053 OC(=O)C1CCc2c1c(F)ccc2 Amb17400752 [0,1,0,1,0,0|2,0,0]=4 4199 B14R2.8053 OC(=O)C1CCc2cccc(Br)c21 Amb25762897 [0,1,0,1,0,0|2,0,0]=4 4200 B14R2.8053 Oc1cccc2CCC(c12)C(O)=O Amb24341262 [0,1,0,1,0,0|2,0,0]=4 4201 B14R2.9057 Cc1cc(ccc1)OC2CC(=O)C2 Amb24489587 [0,1,0,1,0,0|2,0,0]=4 4202 B14R2.9057 Nc1cc(ccc1)OC2CC(=O)N2 Amb24470201 [0,1,0,1,0,0|2,0,0]=4 4203 B14R2.9057 O=C1CC(C1)Oc2cccc(Cl)c2 Amb24533924 [0,1,0,1,0,0|2,0,0]=4 4204 B14R2.9057 O=C1CC(C1)Oc2cccc(F)c2 Amb24407870 [0,1,0,1,0,0|2,0,0]=4 4205 B14R2.9061 Oc1cc(CCC=C2CC2)ccc1 Amb24614801 [0,1,0,1,0,0|2,0,0]=4 4206 B14R2.256 Cc1[n]cccc1C2CC(=O)CC2 Amb25091094 [0,1,0,1,0,0|2,0,0]=4 4207 B14R2.256 Cc1[n]cccc1C2CNC(=O)C2 Amb23586022 [0,1,0,1,0,0|2,0,0]=4 4208 B14R2.256 Cc1c[n]ccc1C2CC(=O)CC2 Amb24378212 [0,1,0,1,0,0|2,0,0]=4 4209 B14R2.256 Cc1c[n]ccc1C2CNC(=O)C2 Amb25317971 [0,1,0,1,0,0|2,0,0]=4 4210 B14R2.256 Cc1cc[n]cc1C2CC(=O)CC2 Amb25293574 [0,1,0,1,0,0|2,0,0]=4 4211 B14R2.256 Cc1cc[n]cc1C2CNC(=O)C2 Amb24444025 [0,1,0,1,0,0|2,0,0]=4 4212 B14R2.256 Cc1cc[n]cc1C2COC(=O)N2 Amb25096130 [0,1,0,1,0,0|2,0,0]=4 4213 B14R2.256 Cc1ccc[n]c1C2CNC(=O)C2 Amb24490687 [0,1,0,1,0,0|2,0,0]=4 4214 B14R2.256 Cc1ccccc1C2CCC(=O)N2 Amb24753232 [0,1,0,1,0,0|2,0,0]=4 4215 B14R2.256 Cc1ccccc1C=2CC(=O)ON2 Amb25131716 [0,1,0,1,0,0|1,0,1]=4 4216 B14R2.256 Cc1ccccc1[C@@H]2CC(=O)CC2 Amb25116484 [0,1,0,1,0,0|1,0,0]=3 4217 B14R2.256 Cc1ccccc1[C@@H]2CNC(=O)N2 Amb24471629 [0,1,0,1,0,0|2,0,0]=4 4218 B14R2.256 Cc1ccccc1[C@@H]2COC(=O)N2 Amb25153778 [0,1,0,1,0,0|1,0,0]=3 4219 B14R2.256 Cc1ccccc1[C@H]2CC(=O)CC2 Amb24492532 [0,1,0,1,0,0|1,0,0]=3 4220 B14R2.256 Cc1ccccc1[C@H]2CCC(=O)O2 Amb25299215 [0,1,0,1,0,0|2,0,0]=4 4221 B14R2.256 Cc1ccccc1[C@H]2COC(=O)N2 Amb25341207 [0,1,0,1,0,0|1,0,0]=3 4222 B14R2.256 NC1=NC(CO1)c2ccccc2Br Amb25752148 [0,1,0,1,0,0|2,0,0]=4 4223 B14R2.256 NC1=N[C@H](CO1)c2ccccc2Cl Amb25797405 [0,1,0,1,0,0|2,0,0]=4 4224 B14R2.256 Nc1[n]cccc1C2CNC(=O)C2 Amb25786370 [0,1,0,1,0,0|2,0,0]=4 4225 B14R2.256 Nc1cc[n]cc1C2CNC(=O)C2 Amb24445276 [0,1,0,1,0,0|2,0,0]=4 4226 B14R2.256 Nc1ccc[n]c1C2CC(=O)CC2 Amb24494871 [0,1,0,1,0,0|2,0,0]=4 4227 B14R2.256 Nc1ccc[n]c1C2CNC(=O)C2 Amb24447543 [0,1,0,1,0,0|2,0,0]=4 4228 B14R2.256 Nc1ccccc1C2CCC(=O)N2 Amb25839783 [0,1,0,1,0,0|2,0,0]=4 4229 B14R2.256 Nc1ccccc1C2COC(=O)N2 Amb24679539 [0,1,0,1,0,0|1,0,0]=3 4230 B14R2.256 O=C1CC(=NO1)c2ccccc2Cl Amb25817486 [0,1,0,1,0,0|1,0,1]=4 4231 B14R2.256 O=C1CC(CC1)c2[n]cccc2Br Amb25255997 [0,1,0,1,0,0|2,0,0]=4 4232 B14R2.256 O=C1CC(CC1)c2cc[n]cc2Br Amb24491960 [0,1,0,1,0,0|2,0,0]=4 4233 B14R2.256 O=C1CC(CC1)c2cc[n]cc2Cl Amb24658646 [0,1,0,1,0,0|2,0,0]=4 4234 B14R2.256 O=C1CC(CC1)c2cc[n]cc2F Amb25325884 [0,1,0,1,0,0|2,0,0]=4 4235 B14R2.256 O=C1CC(CC1)c2ccc[n]c2Cl Amb24368710 [0,1,0,1,0,0|2,0,0]=4 4236 B14R2.256 O=C1CC(CC1)c2ccccc2Br Amb18071277 [0,1,0,1,0,0|1,0,0]=3 4237 B14R2.256 O=C1CC(CC1)c2ccccc2I Amb25225737 [0,1,0,1,0,0|1,0,0]=3 4238 B14R2.256 O=C1CC(CN1)c2[n]cccc2Cl Amb25140074 [0,1,0,1,0,0|2,0,0]=4 4239 B14R2.256 O=C1CC(CN1)c2c[n]ccc2Br Amb25353575 [0,1,0,1,0,0|2,0,0]=4 4240 B14R2.256 O=C1CC(CN1)c2cc[n]cc2F Amb24341285 [0,1,0,1,0,0|2,0,0]=4 4241 B14R2.256 O=C1CC(CN1)c2ccc[n]c2Br Amb25286752 [0,1,0,1,0,0|2,0,0]=4 4242 B14R2.256 O=C1CC(CN1)c2ccc[n]c2Cl Amb25711193 [0,1,0,1,0,0|2,0,0]=4 4243 B14R2.256 O=C1CC(NN1)c2ccccc2Cl Amb23591489 [0,1,0,1,0,0|2,0,0]=4 4244 B14R2.256 O=C1CCC(C1)c2ccccc2C Amb17138723 [0,1,0,1,0,0|1,0,0]=3 4245 B14R2.256 O=C1CCC(C1)c2ccccc2Cl Amb17139523 [0,1,0,1,0,0|1,0,0]=3 4246 B14R2.256 O=C1CCC(C1)c2ccccc2F Amb17138846 [0,1,0,1,0,0|1,0,0]=3 4247 B14R2.256 O=C1CCC(N1)c2ccccc2Br Amb23399885 [0,1,0,1,0,0|2,0,0]=4 4248 B14R2.256 O=C1CCC(O1)c2ccccc2Cl Amb25114151 [0,1,0,1,0,0|2,0,0]=4 4249 B14R2.256 O=C1CC[C@@H](N1)c2ccccc2F Amb25133136 [0,1,0,1,0,0|2,0,0]=4 4250 B14R2.256 O=C1CC[C@@H](N1)c2ccccc2I Amb24375696 [0,1,0,1,0,0|2,0,0]=4 4251 B14R2.256 O=C1CC[C@@H](N1)c2ccccc2S Amb25190015 [0,1,0,1,0,0|2,0,0]=4 4252 B14R2.256 O=C1CC[C@@H](O1)c2ccccc2Cl Amb25831173 [0,1,0,1,0,0|2,0,0]=4 4253 B14R2.256 O=C1CC[C@H](N1)c2ccccc2Br Amb25730658 [0,1,0,1,0,0|2,0,0]=4 4254 B14R2.256 O=C1CC[C@H](O1)c2ccccc2I Amb24400408 [0,1,0,1,0,0|2,0,0]=4 4255 B14R2.256 O=C1C[C@@H](CN1)c2ccccc2F Amb25682493 [0,1,0,1,0,0|1,0,0]=3 4256 B14R2.256 O=C1NC(CO1)c2ccc[n]c2Br Amb25296146 [0,1,0,1,0,0|2,0,0]=4 4257 B14R2.256 O=C1NC(CO1)c2ccc[n]c2Cl Amb24430902 [0,1,0,1,0,0|2,0,0]=4 4258 B14R2.256 O=C1NC(CO1)c2ccccc2Br Amb25061795 [0,1,0,1,0,0|1,0,0]=3 4259 B14R2.256 O=C1NC(CO1)c2ccccc2Cl Amb24714277 [0,1,0,1,0,0|1,0,0]=3 4260 B14R2.256 O=C1NC(CO1)c2ccccc2F Amb24642133 [0,1,0,1,0,0|1,0,0]=3 4261 B14R2.256 O=C1NCC(C1)c2ccccc2C Amb13952157 [0,1,0,1,0,0|1,0,0]=3 4262 B14R2.256 O=C1NCC(N1)c2ccccc2Br Amb25697820 [0,1,0,1,0,0|2,0,0]=4 4263 B14R2.256 O=C1NCC(N1)c2ccccc2Cl Amb25700117 [0,1,0,1,0,0|2,0,0]=4 4264 B14R2.256 O=C1NCC(N1)c2ccccc2F Amb24402152 [0,1,0,1,0,0|2,0,0]=4 4265 B14R2.256 O=C1NCC(N1)c2ccccc2I Amb24721517 [0,1,0,1,0,0|2,0,0]=4 4266 B14R2.256 O=C1NCC(O1)c2ccccc2C Amb17233253 [0,1,0,1,0,0|2,0,0]=4 4267 B14R2.256 O=C1NCC(O1)c2ccccc2Cl Amb17236663 [0,1,0,1,0,0|2,0,0]=4 4268 B14R2.256 O=C1NCC(O1)c2ccccc2F Amb17233779 [0,1,0,1,0,0|2,0,0]=4 4269 B14R2.256 O=C1NC[C@@H](N1)c2ccccc2Cl Amb24698141 [0,1,0,1,0,0|2,0,0]=4 4270 B14R2.256 O=C1NC[C@@H](N1)c2ccccc2F Amb25260788 [0,1,0,1,0,0|2,0,0]=4 4271 B14R2.256 O=C1NC[C@H](N1)c2ccccc2Br Amb25783144 [0,1,0,1,0,0|2,0,0]=4 4272 B14R2.256 O=C1NC[C@H](N1)c2ccccc2Cl Amb24701384 [0,1,0,1,0,0|2,0,0]=4 4273 B14R2.256 O=C1N[C@@H](CO1)c2cc[n]cc2Cl Amb25062741 [0,1,0,1,0,0|2,0,0]=4 4274 B14R2.256 O=C1N[C@@H](CO1)c2ccccc2Br Amb24447521 [0,1,0,1,0,0|1,0,0]=3 4275 B14R2.256 O=C1N[C@@H](CO1)c2ccccc2Cl Amb25328280 [0,1,0,1,0,0|1,0,0]=3 4276 B14R2.256 O=C1N[C@H](CO1)c2ccc[n]c2Br Amb24548110 [0,1,0,1,0,0|2,0,0]=4 4277 B14R2.256 O=C1N[C@H](CO1)c2ccc[n]c2Cl Amb24384155 [0,1,0,1,0,0|2,0,0]=4 4278 B14R2.256 O=C1N[C@H](CO1)c2ccc[n]c2F Amb25715986 [0,1,0,1,0,0|2,0,0]=4 4279 B14R2.256 O=C1N[C@H](CO1)c2ccccc2Br Amb25050168 [0,1,0,1,0,0|1,0,0]=3 4280 B14R2.256 O=C1N[C@H](CO1)c2ccccc2F Amb25085105 [0,1,0,1,0,0|1,0,0]=3 4281 B14R2.256 Oc1[n]cccc1C2CNC(=O)C2 Amb25063105 [0,1,0,1,0,0|2,0,0]=4 4282 B14R2.256 Oc1ccc[n]c1C2CNC(=O)C2 Amb25140971 [0,1,0,1,0,0|2,0,0]=4 4283 B14R2.256 Oc1ccccc1C2CC(=O)CC2 Amb25710427 [0,1,0,1,0,0|1,0,0]=3 4284 B14R2.256 Oc1ccccc1C2CCC(=O)N2 Amb18127874 [0,1,0,1,0,0|2,0,0]=4 4285 B14R2.256 Oc1ccccc1C2CCC(=O)O2 Amb24534534 [0,1,0,1,0,0|2,0,0]=4 4286 B14R2.280 O=C1CCCc2ccccc2C=C1 Amb24408507 [0,1,0,1,0,0|1,0,1]=4 4287 B14R2.280 O=C1CCNc2ccccc2CN1 Amb23403550 [0,1,0,1,0,0|2,0,0]=4 4288 B14R2.280 O=C1COc2ccccc2CC=C1 Amb24424860 [0,1,0,1,0,0|1,0,1]=4 4289 B14R2.280 O=C1COc2ccccc2CCN1 Amb24398696 [0,1,0,1,0,0|1,0,0]=3 4290 B14R2.663 Cc1ccccc1OC2CC(=O)C2 Amb25731179 [0,1,0,1,0,0|2,0,0]=4 4291 B14R2.663 Cc1ccccc1O[C@@H]2CC(=O)N2 Amb25816139 [0,1,0,1,0,0|2,0,0]=4 4292 B14R2.663 O=C1CC(C1)Oc2ccccc2Cl Amb24489585 [0,1,0,1,0,0|2,0,0]=4 4293 B14R2.663 O=C1CC(C1)Oc2ccccc2F Amb24607894 [0,1,0,1,0,0|2,0,0]=4 4294 B14R2.663 O=C1CC(C1)Oc2ccccc2I Amb24489588 [0,1,0,1,0,0|2,0,0]=4 4295 B14R2.768 CC(=O)C=C1Cc2ccccc2C1 Amb24490905 [0,1,0,1,0,0|1,0,1]=4 4296 B14R2.768 CC(=O)CC1Oc2ccccc2O1 Amb24736389 [0,1,0,1,0,0|2,0,0]=4 4297 B14R2.768 CC(=O)CN1Cc2ccccc2C1 Amb18185903 [0,1,0,1,0,0|2,0,0]=4 4298 B14R2.768 CC(=O)NC1Cc2c(C1)cccc2 Amb2031411 [0,1,0,1,0,0|1,0,0]=3 4299 B14R2.768 CC(=O)N[C@@H]1Cc2ccc[n]c2C1 Amb24473031 [0,1,0,1,0,0|2,0,0]=4 4300 B14R2.768 CC(=O)OC1Cc2ccccc2C1 Amb22234649 [0,1,0,1,0,0|0,0,0]=2 4301 B14R2.768 CC(=O)Oc1cc2ccccc2o1 Amb24586556 [0,1,0,1,0,0|0,0,2]=4 4302 B14R2.768 CC(=O)SC1Cc2ccccc2C1 Amb24590122 [0,1,0,1,0,0|0,1,0]=3 4303 B14R2.768 CC(C)=CC1Cc2ccccc2N1 Amb24488854 [0,1,0,1,0,0|2,0,0]=4 4304 B14R2.768 NC(=O)OC1Cc2ccccc2C1 Amb25775009 [0,1,0,1,0,0|1,0,0]=3 4305 B14R2.768 O=C(Cl)CC1Cc2ccccc2C1 Amb25694239 [0,1,0,1,0,0|2,0,0]=4 4306 B14R2.768 OC(=O)CC1Cc2c(O1)cccc2 Amb17606149 [0,1,0,1,0,0|2,0,0]=4 4307 B14R2.768 OC(=O)CC1Cc2ccccc2S1 Amb18189899 [0,1,0,1,0,0|2,0,0]=4 4308 B14R2.781 CC(=C)C1CCc2ccccc2N1 Amb25041020 [0,1,0,1,0,0|2,0,0]=4 4309 B14R2.781 CC(=N)N1Cc2ccccc2CC1 Amb24619733 [0,1,0,1,0,0|2,0,0]=4 4310 B14R2.781 CC(=O)C1CNc2ccccc2O1 Amb25155762 [0,1,0,1,0,0|2,0,0]=4 4311 B14R2.781 CC(=O)C1COc2c(S1)cccc2 Amb17570722 [0,1,0,1,0,0|2,0,0]=4 4312 B14R2.781 CC(=O)C1Cc2ccccc2NC1 Amb25376919 [0,1,0,1,0,0|2,0,0]=4 4313 B14R2.781 CC(=O)C1Cc2ccccc2OC1 Amb24670907 [0,1,0,1,0,0|2,0,0]=4 4314 B14R2.781 CC(=O)C=1Cc2ccccc2CC1 Amb25334979 [0,1,0,1,0,0|1,0,1]=4 4315 B14R2.781 CC(=O)N1Cc2ccc[n]c2CC1 Amb24449085 [0,1,0,1,0,0|2,0,0]=4 4316 B14R2.781 CC(=O)N1Cc2ccccc2CO1 Amb25256548 [0,1,0,1,0,0|2,0,0]=4 4317 B14R2.781 CC(=O)[C@@H]1COc2ccccc2O1 Amb25853616 [0,1,0,1,0,0|2,0,0]=4 4318 B14R2.781 ClC(=O)N1CCc2c(C1)cccc2 Amb17563082 [0,1,0,1,0,0|2,0,0]=4 4319 B14R2.781 NC(=O)C1CCc2ccccc2O1 Amb24097305 [0,1,0,1,0,0|2,0,0]=4 4320 B14R2.781 NC(=O)N1CCc2c(C1)cccc2 Amb1136139 [0,1,0,1,0,0|2,0,0]=4 4321 B14R2.781 NC(=O)[C@@H]1CCc2ccccc2O1 Amb24182081 [0,1,0,1,0,0|2,0,0]=4 4322 B14R2.781 O=C(Cl)[C@@H]1CCc2ccccc2O1 Amb24496956 [0,1,0,1,0,0|2,0,0]=4 4323 B14R2.781 OC(=O)C1CCc2c(N1)cccc2 Amb10604189 [0,1,0,1,0,0|2,0,0]=4 4324 B14R2.781 OC(=O)C1CCc2ccccc2N1 Amb18560475 [0,1,0,1,0,0|2,0,0]=4 4325 B14R2.781 OC(=O)C=1CCc2ccccc2C1 Amb18127224 [0,1,0,1,0,0|2,0,0]=4 4326 B14R2.781 OC(=O)[C@@H]1CCc2ccccc2N1 Amb19887699 [0,1,0,1,0,0|2,0,0]=4 4327 B14R2.781 OC(=O)[C@@H]1CCc2ccccc2N1 Amb22754395 [0,1,0,1,0,0|2,0,0]=4 4328 B14R2.781 OC(=O)[C@H]1CCc2ccccc2N1 Amb19888454 [0,1,0,1,0,0|2,0,0]=4 4329 B14R2.781 OC(=O)[C@H]1CCc2ccccc2O1 Amb25807936 [0,1,0,1,0,0|2,0,0]=4 4330 B14R2.781 [O-]C(=O)C1CCc2c(O1)cccc2 Amb10553838 [0,1,0,1,0,0|2,0,0]=4 4331 B14R2.4622 Oc1ccccc1CCC=C2CC2 Amb25718431 [0,1,0,1,0,0|2,0,0]=4 4332 B14R2.5443 CC(=O)[C@H]1C[C@@H]1c2ccccc2F Amb24617571 [0,1,0,1,0,0|1,0,0]=3 4333 B14R2.5443 Cc1c[n]ccc1C2CC2C(C)=O Amb24735937 [0,1,0,1,0,0|2,0,0]=4 4334 B14R2.5443 Cc1cc[n]cc1C2CC2C(C)=O Amb24444026 [0,1,0,1,0,0|2,0,0]=4 4335 B14R2.5443 Cc1ccccc1[C@H]2C[C@@H]2C(C)=O Amb24761426 [0,1,0,1,0,0|1,0,0]=3 4336 B14R2.5443 Cc1ccccc1[C@H]2C[C@@H]2C(O)=O Amb25367196 [0,1,0,1,0,0|2,0,0]=4 4337 B14R2.5443 NC(=O)C1CC1c2ccccc2Br Amb25854838 [0,1,0,1,0,0|2,0,0]=4 4338 B14R2.5443 NC(=O)[C@@H]1C[C@H]1c2ccccc2Cl Amb24519397 [0,1,0,1,0,0|2,0,0]=4 4339 B14R2.5443 OC(=O)C1CC1c2ccccc2Cl Amb17073010 [0,1,0,1,0,0|2,0,0]=4 4340 B14R2.5443 OC(=O)C1CC1c2ccccc2F Amb17073011 [0,1,0,1,0,0|2,0,0]=4 4341 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccccc2C Amb16233255 [0,1,0,1,0,0|2,0,0]=4 4342 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccccc2Cl Amb24571313 [0,1,0,1,0,0|2,0,0]=4 4343 B14R2.5443 Oc1ccccc1C2CC2C(O)=O Amb24455728 [0,1,0,1,0,0|2,0,0]=4 4344 B14R2.8032 CC(=O)N1CCc2c(Br)cccc12 Amb22498222 [0,1,0,1,0,0|1,0,0]=3 4345 B14R2.8032 CC(=O)N1CCc2c(F)cccc12 Amb19895460 [0,1,0,1,0,0|1,0,0]=3 4346 B14R2.8032 CC(=O)N1CCc2c(N)cccc12 Amb18669653 [0,1,0,1,0,0|1,0,0]=3 4347 B14R2.8032 CC(=O)N1CCc2c(O)cccc12 Amb20621411 [0,1,0,1,0,0|1,0,0]=3 4348 B14R2.8032 CC(=O)N1CCc2c1nccc2N Amb13885314 [0,1,0,1,0,0|2,0,0]=4 4349 B14R2.8032 CS(=O)N1CCc2c(N)cccc12 Amb24615196 [0,1,0,1,0,0|2,0,0]=4 4350 B14R2.8032 Cc1cccc2[C@@H](CCc21)C(O)=O Amb25062919 [0,1,0,1,0,0|2,0,0]=4 4351 B14R2.8032 Cc1cccc2c1CCN2C(N)=O Amb25092541 [0,1,0,1,0,0|2,0,0]=4 4352 B14R2.8032 Nc1cccc2C(CCc21)C(O)=O Amb21858877 [0,1,0,1,0,0|2,0,0]=4 4353 B14R2.8032 OC(=O)C1CCc2c(Br)cccc21 Amb18135285 [0,1,0,1,0,0|2,0,0]=4 4354 B14R2.8032 OC(=O)C1CCc2c1cccc2C Amb17233187 [0,1,0,1,0,0|2,0,0]=4 4355 B14R2.8032 OC(=O)C1CCc2c1cccc2Cl Amb17236499 [0,1,0,1,0,0|2,0,0]=4 4356 B14R2.8032 OC(=O)C1CCc2c1cccc2F Amb17233657 [0,1,0,1,0,0|2,0,0]=4 4357 B14R2.8032 OC(=O)[C@H]1CCc2c(Cl)cccc21 Amb25744604 [0,1,0,1,0,0|2,0,0]=4 4358 B14R2.8032 OC(=O)[C@H]1CCc2c(F)cccc21 Amb25117968 [0,1,0,1,0,0|2,0,0]=4 4359 B14R2.8032 Oc1cccc2C(CCc12)C(O)=O Amb25771634 [0,1,0,1,0,0|2,0,0]=4 4360 B14R2.28454 Cc1cccc2CC(=O)CCNc21 Amb18197185 [0,1,0,1,0,0|2,0,0]=4 4361 B14R2.28454 O=C1CCCc2c(Br)cccc2N1 Amb22235020 [0,1,0,1,0,0|2,0,0]=4 4362 B14R2.28454 O=C1CCCc2c(F)cccc2N1 Amb22497467 [0,1,0,1,0,0|2,0,0]=4 4363 B14R2.28454 O=C1Cc2cccc(F)c2CCN1 Amb24695544 [0,1,0,1,0,0|1,0,0]=3 4364 B14R2.598 CC1=CC(=O)CC1c2ccccc2 Amb17594322 [0,1,0,1,0,0|1,0,1]=4 4365 B14R2.598 CC1CC(=O)NC1c2ccccc2 Amb24715638 [0,1,0,1,0,0|2,0,0]=4 4366 B14R2.598 CC1N=C(N)CC1c2ccccc2 Amb25700422 [0,1,0,1,0,0|2,0,0]=4 4367 B14R2.598 CC1NC(=O)OC1c2ccccc2 Amb10845025 [0,1,0,1,0,0|2,0,0]=4 4368 B14R2.598 CC1OC(=O)NC1c2ccccc2 Amb25759483 [0,1,0,1,0,0|1,0,0]=3 4369 B14R2.598 CC1OC(=O)OC1c2ccccc2 Amb25263220 [0,1,0,1,0,0|1,0,0]=3 4370 B14R2.598 CC1OC(=S)NC1c2ccccc2 Amb25077303 [0,1,0,1,0,0|1,1,0]=4 4371 B14R2.598 CC1OC(N)=NC1c2ccccc2 Amb24710185 [0,1,0,1,0,0|2,0,0]=4 4372 B14R2.598 CC1O[C@H](C(O)O1)c2ccccc2 Amb24495604 [0,1,0,1,0,0|0,0,2]=4 4373 B14R2.598 CC=1NC(C(C)N1)c2ccccc2 Amb25808989 [0,1,0,1,0,0|2,0,0]=4 4374 B14R2.598 CC=1N[C@H]([C@H](C)N1)c2ccccc2 Amb25208406 [0,1,0,1,0,0|2,0,0]=4 4375 B14R2.598 CN1CC(=O)CC1c2ccccc2 Amb23437184 [0,1,0,1,0,0|2,0,0]=4 4376 B14R2.598 C[C@@H]1CC(=O)C[C@@H]1c2ccccc2 Amb25373264 [0,1,0,1,0,0|1,0,0]=3 4377 B14R2.598 C[C@@H]1CC(=O)C[C@H]1c2ccccc2 Amb24584459 [0,1,0,1,0,0|1,0,0]=3 4378 B14R2.598 C[C@@H]1CC(=O)N[C@H]1c2ccccc2 Amb24585758 [0,1,0,1,0,0|2,0,0]=4 4379 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2ccccc2 Amb10068685 [0,1,0,1,0,0|2,0,0]=4 4380 B14R2.598 C[C@@H]1NC(=O)O[C@H]1c2ccccc2 Amb17617584 [0,1,0,1,0,0|2,0,0]=4 4381 B14R2.598 C[C@@H]1OC(=O)N[C@@H]1c2ccccc2 Amb25226668 [0,1,0,1,0,0|1,0,0]=3 4382 B14R2.598 C[C@@H]1OC(=O)N[C@H]1c2ccccc2 Amb25220629 [0,1,0,1,0,0|1,0,0]=3 4383 B14R2.598 C[C@H]1CC(=O)C[C@H]1c2ccccc2 Amb24583010 [0,1,0,1,0,0|1,0,0]=3 4384 B14R2.598 C[C@H]1CC(=O)N[C@@H]1c2ccccc2 Amb25231239 [0,1,0,1,0,0|2,0,0]=4 4385 B14R2.598 C[C@H]1NC(=O)OC1c2ccccc2 Amb24534608 [0,1,0,1,0,0|2,0,0]=4 4386 B14R2.598 C[C@H]1NC(=O)S[C@@H]1c2ccccc2 Amb24599009 [0,1,0,1,0,0|2,0,0]=4 4387 B14R2.598 C[C@H]1NC(=O)S[C@H]1c2ccccc2 Amb24610222 [0,1,0,1,0,0|2,0,0]=4 4388 B14R2.598 NC1CC(=O)NC1c2ccccc2 Amb18065621 [0,1,0,1,0,0|2,0,0]=4 4389 B14R2.598 O=C1C[C@@H](Cl)[C@@H](O1)c2ccccc2 Amb25210899 [0,1,0,1,0,0|2,0,0]=4 4390 B14R2.598 O=C1OC(=O)C(C1)c2ccccn2 Amb17400588 [0,1,0,1,0,0|1,0,1]=4 4391 B14R2.598 O=C1OC(=O)C(C1)c2cccnc2 Amb17233240 [0,1,0,1,0,0|1,0,1]=4 4392 B14R2.598 O=C1OC(=O)CC1c2ccncc2 Amb17400589 [0,1,0,1,0,0|1,0,1]=4 4393 B14R2.598 O=C1OC(=O)CN1c2ccccc2 Amb25084575 [0,1,0,1,0,0|1,0,1]=4 4394 B14R2.598 O=C1OC(=O)C[C@@H]1c2ccccc2 Amb23401547 [0,1,0,1,0,0|0,0,1]=3 4395 B14R2.598 O=C1OC(=O)NC1c2ccccc2 Amb25772896 [0,1,0,1,0,0|1,0,1]=4 4396 B14R2.598 O=C1OC(=O)N[C@H]1c2ccccc2 Amb25039558 [0,1,0,1,0,0|1,0,1]=4 4397 B14R2.598 O=C1O[C@H](c2ccccc2)C(=O)O1 Amb25073739 [0,1,0,1,0,0|1,0,1]=4 4398 B14R2.598 OC1CC(=O)CC1c2ccccc2 Amb24545651 [0,1,0,1,0,0|1,0,0]=3 4399 B14R2.598 OC1CC(=O)OC1c2ccccc2 Amb25831819 [0,1,0,1,0,0|2,0,0]=4 4400 B14R2.598 OC1OC(=O)CC1c2ccccc2 Amb25058513 [0,1,0,1,0,0|0,0,0]=2 4401 B14R2.598 OC1OC(=O)C[C@H]1c2ccccc2 Amb24748335 [0,1,0,1,0,0|0,0,0]=2 4402 B14R2.598 OC1OC(=O)OC1c2ccccc2 Amb25788943 [0,1,0,1,0,0|1,0,0]=3 4403 B14R2.598 O[C@@H]1CC(=O)N[C@H]1c2ccccc2 Amb24558586 [0,1,0,1,0,0|2,0,0]=4 4404 B14R2.598 O[C@@H]1CC(=O)O[C@@H]1c2ccccc2 Amb24671435 [0,1,0,1,0,0|2,0,0]=4 4405 B14R2.642 CC(=O)N1C(O)Cc2[n]cccc12 Amb25097831 [0,1,0,1,0,0|2,0,0]=4 4406 B14R2.642 CC(C)=C1C(O)Cc2ccccc21 Amb24748321 [0,1,0,1,0,0|2,0,0]=4 4407 B14R2.642 CC1Cc2ccccc2C1C(O)=O Amb18127734 [0,1,0,1,0,0|2,0,0]=4 4408 B14R2.642 CC=1Cc2ccccc2C1C(C)=O Amb24492413 [0,1,0,1,0,0|1,0,1]=4 4409 B14R2.642 C[C@H]1Cc2ccccc2[C@H]1C(O)=O Amb24558175 [0,1,0,1,0,0|2,0,0]=4 4410 B14R2.642 NC(=O)C1C(N)Cc2ccccc21 Amb25743913 [0,1,0,1,0,0|2,0,0]=4 4411 B14R2.642 OC(=O)C1C(O)Cc2ccccc21 Amb24366682 [0,1,0,1,0,0|2,0,0]=4 4412 B14R2.642 OC(=O)[C@@H]1[C@@H](O)Cc2ccccc21 Amb25321980 [0,1,0,1,0,0|2,0,0]=4 4413 B14R2.738 CC1Cc2ccccc2NC(=O)C1 Amb24490332 [0,1,0,1,0,0|2,0,0]=4 4414 B14R2.738 C[C@@H]1Cc2ccccc2NC(=O)C1 Amb24490233 [0,1,0,1,0,0|2,0,0]=4 4415 B14R2.738 N[C@@H]1Cc2ccccc2NC(=O)C1 Amb24659280 [0,1,0,1,0,0|2,0,0]=4 4416 B14R2.738 N[C@H]1Cc2ccccc2NC(=O)C1 Amb25848478 [0,1,0,1,0,0|2,0,0]=4 4417 B14R2.4586 CC1C(C1C(O)=O)c2ccccc2 Amb24440802 [0,1,0,1,0,0|2,0,0]=4 4418 B14R2.4586 C[C@@H]1[C@@H]([C@@H]1C(O)=O)c2ccccc2 Amb25209963 [0,1,0,1,0,0|2,0,0]=4 4419 B14R2.4586 C[C@@H]1[C@H]([C@@H]1C(O)=O)c2ccccc2 Amb25274087 [0,1,0,1,0,0|2,0,0]=4 4420 B14R2.4586 C[C@H]1[C@H]([C@H]1C(O)=O)c2ccccc2 Amb24591205 [0,1,0,1,0,0|2,0,0]=4 4421 B14R2.4586 OC(=O)C1C(C1Br)c2ccccc2 Amb25292716 [0,1,0,1,0,0|2,0,0]=4 4422 B14R2.31 O=C1CCC1CCc2ccccc2 Amb24492658 [0,1,0,1,0,0|1,0,0]=3 4423 B14R2.31 O=C1CCC1OCc2ccccc2 Amb22896544 [0,1,0,1,0,0|2,0,0]=4 4424 B14R2.31 O=C1CC[C@@H]1OCc2ccccc2 Amb24494962 [0,1,0,1,0,0|2,0,0]=4 4425 B14R2.31 O=C1CC[C@H]1CCc2ccccc2 Amb24364139 [0,1,0,1,0,0|1,0,0]=3 4426 B14R2.31 O=C1COC1CCc2ccccc2 Amb24492472 [0,1,0,1,0,0|1,0,0]=3 4427 B14R2.260 C=C1CC(NC1=O)c2ccccc2 Amb24529607 [0,1,0,1,0,0|2,0,0]=4 4428 B14R2.260 C=C1CC(OC1=O)c2ccccc2 Amb24534660 [0,1,0,1,0,0|2,0,0]=4 4429 B14R2.260 C=C1C[C@@H](NC1=O)c2ccccc2 Amb25857087 [0,1,0,1,0,0|2,0,0]=4 4430 B14R2.260 CC1CC(NC1=O)c2ccccc2 Amb25250684 [0,1,0,1,0,0|2,0,0]=4 4431 B14R2.260 CN1C[C@@H](NC1=O)c2ccccc2 Amb25191937 [0,1,0,1,0,0|2,0,0]=4 4432 B14R2.260 CN1C[C@H](NC1=O)c2ccccc2 Amb24418415 [0,1,0,1,0,0|2,0,0]=4 4433 B14R2.260 C[C@@H]1C[C@@H](CC1=O)c2ccccc2 Amb24631132 [0,1,0,1,0,0|1,0,0]=3 4434 B14R2.260 NC1CC(NC1=O)c2ccccc2 Amb23590809 [0,1,0,1,0,0|2,0,0]=4 4435 B14R2.260 NC1CC(OC1=O)c2ccccc2 Amb17470561 [0,1,0,1,0,0|2,0,0]=4 4436 B14R2.260 O=C1CC(CC1=O)c2ccccc2 Amb24590974 [0,1,0,1,0,0|1,0,0]=3 4437 B14R2.260 O=C1OC(CC1=O)c2ccccc2 Amb25718939 [0,1,0,1,0,0|2,0,0]=4 4438 B14R2.260 O=C1OC(CC1Cl)c2ccccc2 Amb24710095 [0,1,0,1,0,0|2,0,0]=4 4439 B14R2.260 O=C1O[C@@H](CC1=O)c2ccccc2 Amb25833624 [0,1,0,1,0,0|2,0,0]=4 4440 B14R2.260 OC1=CC(CC1=O)c2ccccc2 Amb24662315 [0,1,0,1,0,0|1,0,1]=4 4441 B14R2.260 OC1CC(NC1=O)c2ccccc2 Amb25325087 [0,1,0,1,0,0|2,0,0]=4 4442 B14R2.260 OC1CC(OC1=O)c2ccccc2 Amb24414844 [0,1,0,1,0,0|2,0,0]=4 4443 B14R2.260 O[C@@H]1CC(OC1=O)c2ccccc2 Amb25846190 [0,1,0,1,0,0|2,0,0]=4 4444 B14R2.260 O[C@@H]1C[C@H](OC1=O)c2ccccc2 Amb25176996 [0,1,0,1,0,0|2,0,0]=4 4445 B14R2.260 O[C@H]1C[C@@H](OC1=O)c2ccccc2 Amb24520002 [0,1,0,1,0,0|2,0,0]=4 4446 B14R2.427 C=C1C(Cc2ccccc2)CC1=O Amb25263562 [0,1,0,1,0,0|1,0,0]=3 4447 B14R2.427 CC1C(Cc2ccccc2)NC1=O Amb24647838 [0,1,0,1,0,0|1,0,0]=3 4448 B14R2.427 C[C@@H]1[C@H](NC1=O)Sc2ccccc2 Amb24512994 [0,1,0,1,0,0|2,0,0]=4 4449 B14R2.427 C[C@H]1[C@H](NC1=O)Sc2ccccc2 Amb25317654 [0,1,0,1,0,0|2,0,0]=4 4450 B14R2.427 NC1C(Cc2ccccc2)NC1=O Amb18196732 [0,1,0,1,0,0|1,0,0]=3 4451 B14R2.427 N[C@H]1[C@H](NC1=O)Oc2ccccc2 Amb24621902 [0,1,0,1,0,0|2,0,0]=4 4452 B14R2.427 O=C1CN(Cc2ccccc2)C1=O Amb25770465 [0,1,0,1,0,0|2,0,0]=4 4453 B14R2.427 OC1C(Cc2ccccc2)C=C1Cl Amb25787348 [0,1,0,1,0,0|2,0,0]=4 4454 B14R2.427 OC1C(Cc2ccccc2)NC1=O Amb24453779 [0,1,0,1,0,0|1,0,0]=3 4455 B14R2.741 CC1CCc2ccccc2NC1=O Amb24434952 [0,1,0,1,0,0|2,0,0]=4 4456 B14R2.741 CC1NCc2ccccc2CC1=O Amb25223185 [0,1,0,1,0,0|2,0,0]=4 4457 B14R2.741 C[C@@H]1CCc2ccccc2NC1=O Amb25743449 [0,1,0,1,0,0|2,0,0]=4 4458 B14R2.741 O=C1Nc2ccccc2CCC1Cl Amb21964387 [0,1,0,1,0,0|2,0,0]=4 4459 B14R2.741 OC1CCc2ccccc2NC1=O Amb25226835 [0,1,0,1,0,0|2,0,0]=4 4460 B14R2.741 O[C@H]1CCc2ccccc2NC1=O Amb24642515 [0,1,0,1,0,0|2,0,0]=4 4461 B14R2.786 CC(=O)C1(C)CC1c2ccccc2 Amb25231294 [0,1,0,1,0,0|1,0,0]=3 4462 B14R2.786 CC(=O)[C@]1(C)C[C@@H]1c2ccccc2 Amb24617250 [0,1,0,1,0,0|1,0,0]=3 4463 B14R2.786 CC1(C[C@@H]1c2ccccc2)C(O)=O Amb25684837 [0,1,0,1,0,0|2,0,0]=4 4464 B14R2.786 C[C@@]1(C[C@@H]1c2ccccc2)C(O)=O Amb24552946 [0,1,0,1,0,0|2,0,0]=4 4465 B14R2.786 C[C@@]1(C[C@H]1c2ccccc2)C(O)=O Amb25179070 [0,1,0,1,0,0|2,0,0]=4 4466 B14R2.786 C[C@]1(C[C@H]1c2ccccc2)C(N)=O Amb24512281 [0,1,0,1,0,0|2,0,0]=4 4467 B14R2.786 C[C@]1(C[C@H]1c2ccccc2)C(O)=O Amb25022674 [0,1,0,1,0,0|2,0,0]=4 4468 B14R2.786 NC1(CC1c2ccccc2)C(O)=O Amb19374730 [0,1,0,1,0,0|2,0,0]=4 4469 B14R2.786 NC1(CC1c2ccccc2)C(O)=O Amb22546302 [0,1,0,1,0,0|2,0,0]=4 4470 B14R2.786 N[C@@]1(C[C@@H]1c2ccccc2)C(O)=O Amb25359928 [0,1,0,1,0,0|2,0,0]=4 4471 B14R2.786 N[C@@]1(C[C@H]1c2ccccc2)C(O)=O Amb24519858 [0,1,0,1,0,0|2,0,0]=4 4472 B14R2.786 N[C@]1(C[C@H]1c2ccccc2)C(O)=O Amb24519225 [0,1,0,1,0,0|2,0,0]=4 4473 B14R2.786 OC(=O)C1(C)CC1c2ccccc2 Amb17335110 [0,1,0,1,0,0|2,0,0]=4 4474 B14R2.786 OC(=O)[C@@]1(F)C[C@@H]1c2ccccc2 Amb24538836 [0,1,0,1,0,0|2,0,0]=4 4475 B14R2.9535 CC(=O)C1(Cl)CCc2ccccc12 Amb24359039 [0,1,0,1,0,0|1,0,0]=3 4476 B14R2.9535 CC(=O)C1(O)CCc2ccccc12 Amb25282827 [0,1,0,1,0,0|1,0,0]=3 4477 B14R2.9535 NC(=O)C1(N)CCc2ccccc12 Amb18278302 [0,1,0,1,0,0|2,0,0]=4 4478 B14R2.9535 NC(=O)C1(O)CCc2ccccc12 Amb18186063 [0,1,0,1,0,0|2,0,0]=4 4479 B14R2.9535 OC(=O)C1(C)CCc2c1cccc2 Amb10843978 [0,1,0,1,0,0|2,0,0]=4 4480 B14R2.9535 OC(=O)C1(N)CCc2c1cccc2 Amb10601665 [0,1,0,1,0,0|2,0,0]=4 4481 B14R2.9535 OC(=O)C1(N)CCc2c1cccc2 Amb10610396 [0,1,0,1,0,0|2,0,0]=4 4482 B14R2.9535 OC(=O)C1(O)CCc2ccccc12 Amb18944703 [0,1,0,1,0,0|2,0,0]=4 4483 B14R2.45467 CC(=C)C(N)C1Cc2ccccc21 Amb25679342 [0,1,0,1,0,0|2,0,0]=4 4484 B14R2.20 Cc1ccc([n]c1)C2COC(=O)N2 Amb25686273 [0,1,0,1,0,0|2,0,0]=4 4485 B14R2.20 Cc1ccc([n]c1)[C@H]2COC(=O)N2 Amb24733821 [0,1,0,1,0,0|2,0,0]=4 4486 B14R2.20 Cc1ccc(c[n]1)C2CCC(=O)C2 Amb24386451 [0,1,0,1,0,0|2,0,0]=4 4487 B14R2.20 Cc1ccc(c[n]1)C2COC(=O)N2 Amb25353496 [0,1,0,1,0,0|2,0,0]=4 4488 B14R2.20 Cc1ccc(c[n]1)[C@H]2COC(=O)N2 Amb24344220 [0,1,0,1,0,0|2,0,0]=4 4489 B14R2.20 Cc1ccc(cc1)C2CNC(=O)N2 Amb24463831 [0,1,0,1,0,0|2,0,0]=4 4490 B14R2.20 Cc1ccc(cc1)C2COC(=O)N2 Amb25082390 [0,1,0,1,0,0|1,0,0]=3 4491 B14R2.20 Cc1ccc(cc1)C2COC(N)=N2 Amb25843058 [0,1,0,1,0,0|2,0,0]=4 4492 B14R2.20 Cc1ccc(cc1)C=2CC(=O)ON2 Amb24548209 [0,1,0,1,0,0|1,0,1]=4 4493 B14R2.20 Cc1ccc(cc1)[C@@H]2CC(=O)CC2 Amb25712929 [0,1,0,1,0,0|1,0,0]=3 4494 B14R2.20 Cc1ccc(cc1)[C@@H]2CCC(=O)N2 Amb25302890 [0,1,0,1,0,0|2,0,0]=4 4495 B14R2.20 Cc1ccc(cc1)[C@@H]2CCC(=O)O2 Amb24607301 [0,1,0,1,0,0|2,0,0]=4 4496 B14R2.20 Cc1ccc(cc1)[C@@H]2CNC(=O)N2 Amb25352370 [0,1,0,1,0,0|2,0,0]=4 4497 B14R2.20 Cc1ccc(cc1)[C@H]2CCC(=O)N2 Amb24360807 [0,1,0,1,0,0|2,0,0]=4 4498 B14R2.20 Cc1ccc(cc1)[C@H]2CNC(=O)C2 Amb24591261 [0,1,0,1,0,0|1,0,0]=3 4499 B14R2.20 Cc1ccc(cc1)[C@H]2CNC(=O)N2 Amb24462995 [0,1,0,1,0,0|2,0,0]=4 4500 B14R2.20 NC1=NC(CO1)c2ccc(Br)cc2 Amb24367563 [0,1,0,1,0,0|2,0,0]=4 4501 B14R2.20 NC1=NC(CO1)c2ccc(Cl)cc2 Amb25180772 [0,1,0,1,0,0|2,0,0]=4 4502 B14R2.20 NC1=NC(CO1)c2ccc(I)cc2 Amb25231900 [0,1,0,1,0,0|2,0,0]=4 4503 B14R2.20 NC1=N[C@H](CO1)c2ccc(F)cc2 Amb25752666 [0,1,0,1,0,0|2,0,0]=4 4504 B14R2.20 NC=1CC(CN1)c2ccc(N)cc2 Amb25101574 [0,1,0,1,0,0|2,0,0]=4 4505 B14R2.20 Nc1ccc([n]c1)C2CC(=O)CC2 Amb24491326 [0,1,0,1,0,0|2,0,0]=4 4506 B14R2.20 Nc1ccc(cc1)C2CC(=O)CC2 Amb24730827 [0,1,0,1,0,0|1,0,0]=3 4507 B14R2.20 Nc1ccc(cc1)C2CCC(=O)N2 Amb23399888 [0,1,0,1,0,0|2,0,0]=4 4508 B14R2.20 Nc1ccc(cc1)C2CNC(=O)O2 Amb18639383 [0,1,0,1,0,0|2,0,0]=4 4509 B14R2.20 Nc1ccc(cc1)[C@H]2CCC(=O)N2 Amb25692493 [0,1,0,1,0,0|2,0,0]=4 4510 B14R2.20 O=C1C=C(CO1)c2ccc(F)cc2 Amb25135231 [0,1,0,1,0,0|0,0,2]=4 4511 B14R2.20 O=C1CC(=NO1)c2ccc(F)cc2 Amb24376264 [0,1,0,1,0,0|1,0,1]=4 4512 B14R2.20 O=C1CC(CC1)C2=CNC(=O)C=C2 Amb24462886 [0,1,0,1,0,0|2,0,0]=4 4513 B14R2.20 O=C1CC(CC1)c2ccc(Br)[n]c2 Amb24384311 [0,1,0,1,0,0|2,0,0]=4 4514 B14R2.20 O=C1CC(CC1)c2ccc(Br)c[n]2 Amb24455581 [0,1,0,1,0,0|2,0,0]=4 4515 B14R2.20 O=C1CC(CC1)c2ccc(Cl)[n]c2 Amb25342256 [0,1,0,1,0,0|2,0,0]=4 4516 B14R2.20 O=C1CC(CC1)c2ccc(Cl)c[n]2 Amb25198715 [0,1,0,1,0,0|2,0,0]=4 4517 B14R2.20 O=C1CC(CC1)c2ccc(F)[n]c2 Amb24690764 [0,1,0,1,0,0|2,0,0]=4 4518 B14R2.20 O=C1CC(CN1)c2ccc(Cl)c[n]2 Amb25049436 [0,1,0,1,0,0|2,0,0]=4 4519 B14R2.20 O=C1CC(CN1)c2ccc(F)[n]c2 Amb24494361 [0,1,0,1,0,0|2,0,0]=4 4520 B14R2.20 O=C1CC(CN1)c2ccc(F)c[n]2 Amb24427455 [0,1,0,1,0,0|2,0,0]=4 4521 B14R2.20 O=C1CC(CN1)c2ccc(S)[n]c2 Amb24642910 [0,1,0,1,0,0|2,0,0]=4 4522 B14R2.20 O=C1CC(CN1)c2ccc(S)cc2 Amb24438360 [0,1,0,1,0,0|1,0,0]=3 4523 B14R2.20 O=C1CC(CO1)c2ccc(Cl)cc2 Amb24097675 [0,1,0,1,0,0|0,0,0]=2 4524 B14R2.20 O=C1CC(NN1)c2ccc(Br)cc2 Amb25107661 [0,1,0,1,0,0|2,0,0]=4 4525 B14R2.20 O=C1CC(NN1)c2ccc(F)cc2 Amb25257161 [0,1,0,1,0,0|2,0,0]=4 4526 B14R2.20 O=C1CCC(C1)c2ccc(cc2)Br Amb17158701 [0,1,0,1,0,0|1,0,0]=3 4527 B14R2.20 O=C1CCC(C1)c2ccc(cc2)C Amb17138725 [0,1,0,1,0,0|1,0,0]=3 4528 B14R2.20 O=C1CCC(C1)c2ccc(cc2)Cl Amb17139525 [0,1,0,1,0,0|1,0,0]=3 4529 B14R2.20 O=C1CCC(C1)c2ccc(cc2)F Amb17138847 [0,1,0,1,0,0|1,0,0]=3 4530 B14R2.20 O=C1CCC(N1)c2ccc(I)cc2 Amb25709111 [0,1,0,1,0,0|2,0,0]=4 4531 B14R2.20 O=C1CCC(N1)c2ccc(cc2)Br Amb17472798 [0,1,0,1,0,0|2,0,0]=4 4532 B14R2.20 O=C1CCC(N1)c2ccc(cc2)C Amb17470517 [0,1,0,1,0,0|2,0,0]=4 4533 B14R2.20 O=C1CCC(N1)c2ccc(cc2)Cl Amb17470923 [0,1,0,1,0,0|2,0,0]=4 4534 B14R2.20 O=C1CCC(N1)c2ccc(cc2)F Amb17470590 [0,1,0,1,0,0|2,0,0]=4 4535 B14R2.20 O=C1CCC(O1)c2ccc(cc2)Br Amb1041779 [0,1,0,1,0,0|2,0,0]=4 4536 B14R2.20 O=C1CC[C@@H](N1)c2ccc(Cl)cc2 Amb25728010 [0,1,0,1,0,0|2,0,0]=4 4537 B14R2.20 O=C1CC[C@@H](N1)c2ccc(S)cc2 Amb24730084 [0,1,0,1,0,0|2,0,0]=4 4538 B14R2.20 O=C1CC[C@@H](O1)c2ccc(Br)cc2 Amb24343932 [0,1,0,1,0,0|2,0,0]=4 4539 B14R2.20 O=C1CC[C@@H](O1)c2ccc(F)cc2 Amb25736757 [0,1,0,1,0,0|2,0,0]=4 4540 B14R2.20 O=C1CC[C@H](N1)c2ccc(S)cc2 Amb24374061 [0,1,0,1,0,0|2,0,0]=4 4541 B14R2.20 O=C1CC[C@H](O1)c2ccc(Cl)cc2 Amb25349456 [0,1,0,1,0,0|2,0,0]=4 4542 B14R2.20 O=C1C[C@@H](CC1)c2ccc(Br)cc2 Amb25848474 [0,1,0,1,0,0|1,0,0]=3 4543 B14R2.20 O=C1C[C@@H](CC1)c2ccc(F)[n]c2 Amb25706952 [0,1,0,1,0,0|2,0,0]=4 4544 B14R2.20 O=C1C[C@@H](CC1)c2ccc(F)cc2 Amb24495011 [0,1,0,1,0,0|1,0,0]=3 4545 B14R2.20 O=C1C[C@@H](CN1)c2ccc(Br)cc2 Amb25693140 [0,1,0,1,0,0|1,0,0]=3 4546 B14R2.20 O=C1C[C@@H](CN1)c2ccc(Cl)cc2 Amb25827568 [0,1,0,1,0,0|1,0,0]=3 4547 B14R2.20 O=C1C[C@@H](CN1)c2ccc(F)cc2 Amb23401453 [0,1,0,1,0,0|1,0,0]=3 4548 B14R2.20 O=C1NC(CO1)c2ccc(Br)cc2 Amb24419169 [0,1,0,1,0,0|1,0,0]=3 4549 B14R2.20 O=C1NCC(C1)c2ccc(cc2)Br Amb13783610 [0,1,0,1,0,0|1,0,0]=3 4550 B14R2.20 O=C1NCC(C1)c2ccc(cc2)C Amb17400498 [0,1,0,1,0,0|1,0,0]=3 4551 B14R2.20 O=C1NCC(O1)c2ccc(cc2)Br Amb17255947 [0,1,0,1,0,0|2,0,0]=4 4552 B14R2.20 O=C1NCC(O1)c2ccc(cc2)C Amb17233255 [0,1,0,1,0,0|2,0,0]=4 4553 B14R2.20 O=C1NCC(O1)c2ccc(cc2)Cl Amb17236665 [0,1,0,1,0,0|2,0,0]=4 4554 B14R2.20 O=C1NCC(O1)c2ccc(cc2)F Amb17233780 [0,1,0,1,0,0|2,0,0]=4 4555 B14R2.20 O=C1NC[C@@H](N1)c2ccc(F)cc2 Amb24702480 [0,1,0,1,0,0|2,0,0]=4 4556 B14R2.20 O=C1NC[C@H](N1)c2ccc(Br)cc2 Amb24534588 [0,1,0,1,0,0|2,0,0]=4 4557 B14R2.20 O=C1NC[C@H](O1)c2ccc(Cl)cc2 Amb25233123 [0,1,0,1,0,0|2,0,0]=4 4558 B14R2.20 O=C1N[C@@H](CO1)c2ccc(Br)[n]c2 Amb25156473 [0,1,0,1,0,0|2,0,0]=4 4559 B14R2.20 O=C1N[C@@H](CO1)c2ccc(Cl)[n]c2 Amb24731832 [0,1,0,1,0,0|2,0,0]=4 4560 B14R2.20 O=C1N[C@@H](CO1)c2ccc(I)cc2 Amb25311681 [0,1,0,1,0,0|1,0,0]=3 4561 B14R2.20 O=C1N[C@H](CO1)c2ccc(Br)c[n]2 Amb25842467 [0,1,0,1,0,0|2,0,0]=4 4562 B14R2.20 O=C1N[C@H](CO1)c2ccc(Br)cc2 Amb25715338 [0,1,0,1,0,0|1,0,0]=3 4563 B14R2.20 O=C1N[C@H](CO1)c2ccc(Cl)cc2 Amb25816140 [0,1,0,1,0,0|1,0,0]=3 4564 B14R2.20 O=C1N[C@H](CO1)c2ccc(F)c[n]2 Amb25777028 [0,1,0,1,0,0|2,0,0]=4 4565 B14R2.20 O=C1ON=C(C1)c2ccc(cc2)Cl Amb1011011 [0,1,0,1,0,0|1,0,1]=4 4566 B14R2.20 OC1CC(CO1)c2ccc(Cl)cc2 Amb24718436 [0,1,0,1,0,0|0,0,2]=4 4567 B14R2.20 Oc1ccc([n]c1)C2CC(=O)CC2 Amb24736473 [0,1,0,1,0,0|2,0,0]=4 4568 B14R2.20 Oc1ccc(cc1)C2CC(=O)CC2 Amb25129032 [0,1,0,1,0,0|1,0,0]=3 4569 B14R2.20 Oc1ccc(cc1)C2CCC(=O)N2 Amb23412159 [0,1,0,1,0,0|2,0,0]=4 4570 B14R2.20 Oc1ccc(cc1)C2CNC(=O)C2 Amb18127880 [0,1,0,1,0,0|1,0,0]=3 4571 B14R2.20 Oc1ccc(cc1)C2COC(=O)N2 Amb24709902 [0,1,0,1,0,0|1,0,0]=3 4572 B14R2.20 Oc1ccc(cc1)C2COC(O)C2 Amb24364069 [0,1,0,1,0,0|0,0,2]=4 4573 B14R2.20 Oc1ccc(cc1)C=2COC(=O)C2 Amb24492399 [0,1,0,1,0,0|0,0,2]=4 4574 B14R2.20 Oc1ccc(cc1)[C@@H]2CCC(=O)N2 Amb25274859 [0,1,0,1,0,0|2,0,0]=4 4575 B14R2.20 Oc1ccc(cc1)[C@@H]2CNC(=O)N2 Amb25153835 [0,1,0,1,0,0|2,0,0]=4 4576 B14R2.20 Oc1ccc(cc1)[C@@H]2COC(=O)N2 Amb24490125 [0,1,0,1,0,0|1,0,0]=3 4577 B14R2.20 Oc1ccc(cc1)[C@H]2CNC(=O)N2 Amb25153744 [0,1,0,1,0,0|2,0,0]=4 4578 B14R2.380 Nc1cc2CC(=O)CCCc2cc1 Amb24545919 [0,1,0,1,0,0|1,0,0]=3 4579 B14R2.380 O=C1CCCc2c(N1)cc(Cl)cc2 Amb17470925 [0,1,0,1,0,0|2,0,0]=4 4580 B14R2.380 O=C1CCCc2c(N1)cc(F)cc2 Amb17470592 [0,1,0,1,0,0|2,0,0]=4 4581 B14R2.380 O=C1Cc2cc(Br)ccc2CCC1 Amb22235035 [0,1,0,1,0,0|1,0,0]=3 4582 B14R2.380 O=C1Cc2cc(Br)ccc2CCN1 Amb25216332 [0,1,0,1,0,0|1,0,0]=3 4583 B14R2.380 O=C1Cc2cc(Cl)ccc2NCC1 Amb18189131 [0,1,0,1,0,0|2,0,0]=4 4584 B14R2.380 Oc1ccc2CCCC(=O)Nc2c1 Amb24529359 [0,1,0,1,0,0|2,0,0]=4 4585 B14R2.947 Cc1ccc(cc1)SC2CC(=O)N2 Amb24490282 [0,1,0,1,0,0|2,0,0]=4 4586 B14R2.947 Nc1ccc(cc1)OC2CC(=O)N2 Amb25175823 [0,1,0,1,0,0|2,0,0]=4 4587 B14R2.947 Nc1ccc(cc1)SC2CC(=O)N2 Amb25320853 [0,1,0,1,0,0|2,0,0]=4 4588 B14R2.947 O=C1CC(C1)Oc2ccc(Br)cc2 Amb24489584 [0,1,0,1,0,0|2,0,0]=4 4589 B14R2.947 O=C1CC(C1)Oc2ccc(I)cc2 Amb25262054 [0,1,0,1,0,0|2,0,0]=4 4590 B14R2.947 O=C1CC(N1)Oc2ccc(Br)cc2 Amb25109394 [0,1,0,1,0,0|2,0,0]=4 4591 B14R2.4402 CC(=O)C1CC1c2ccc(I)cc2 Amb24444973 [0,1,0,1,0,0|1,0,0]=3 4592 B14R2.4402 CC(=O)C1CC1c2ccc(cc2)Cl Amb2406920 [0,1,0,1,0,0|1,0,0]=3 4593 B14R2.4402 CC(=O)C1CC1c2ccc(cc2)F Amb2415814 [0,1,0,1,0,0|1,0,0]=3 4594 B14R2.4402 CC(=O)C1OC1c2ccc(O)cc2 Amb24370156 [0,1,0,1,0,0|2,0,0]=4 4595 B14R2.4402 CC(C)=C1CC1c2ccc(O)cc2 Amb24102753 [0,1,0,1,0,0|2,0,0]=4 4596 B14R2.4402 Cc1ccc([n]c1)C2CC2C(C)=O Amb25693501 [0,1,0,1,0,0|2,0,0]=4 4597 B14R2.4402 Cc1ccc(c[n]1)C2CC2C(C)=O Amb25763189 [0,1,0,1,0,0|2,0,0]=4 4598 B14R2.4402 Cc1ccc(cc1)C2CC2C(=O)Cl Amb25670775 [0,1,0,1,0,0|2,0,0]=4 4599 B14R2.4402 Cc1ccc(cc1)C2CC2C(N)=O Amb25690823 [0,1,0,1,0,0|2,0,0]=4 4600 B14R2.4402 Cc1ccc(cc1)C2OC2C(C)=O Amb24619633 [0,1,0,1,0,0|2,0,0]=4 4601 B14R2.4402 Cc1ccc(cc1)[C@@H]2C[C@@H]2C(O)=O Amb24512171 [0,1,0,1,0,0|2,0,0]=4 4602 B14R2.4402 Cc1ccc(cc1)[C@H]2C[C@H]2C(N)=O Amb24519396 [0,1,0,1,0,0|2,0,0]=4 4603 B14R2.4402 Cc1ccc(cc1)[C@H]2O[C@@H]2C(C)=O Amb24582585 [0,1,0,1,0,0|2,0,0]=4 4604 B14R2.4402 NC(=O)C1CC1c2ccc(Cl)cc2 Amb25108306 [0,1,0,1,0,0|2,0,0]=4 4605 B14R2.4402 NC(=O)C1CC1c2ccc(F)cc2 Amb21811908 [0,1,0,1,0,0|2,0,0]=4 4606 B14R2.4402 NC(=O)[C@@H]1C[C@@H]1c2ccc(Cl)cc2 Amb25311929 [0,1,0,1,0,0|2,0,0]=4 4607 B14R2.4402 NC(=O)[C@@H]1C[C@@H]1c2ccc(F)cc2 Amb24743435 [0,1,0,1,0,0|2,0,0]=4 4608 B14R2.4402 NC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24650188 [0,1,0,1,0,0|2,0,0]=4 4609 B14R2.4402 Nc1ccc(cc1)[C@@H]2C[C@H]2C(O)=O Amb25799160 [0,1,0,1,0,0|2,0,0]=4 4610 B14R2.4402 Nc1ccc(cc1)[C@H]2C[C@@H]2C(O)=O Amb25176098 [0,1,0,1,0,0|2,0,0]=4 4611 B14R2.4402 O=C(Cl)C1CC1c2ccc(F)cc2 Amb24738452 [0,1,0,1,0,0|2,0,0]=4 4612 B14R2.4402 OC(=O)C1CC1c2ccc(I)cc2 Amb25343384 [0,1,0,1,0,0|2,0,0]=4 4613 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)Cl Amb1935060 [0,1,0,1,0,0|2,0,0]=4 4614 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)F Amb17073012 [0,1,0,1,0,0|2,0,0]=4 4615 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)O Amb17568130 [0,1,0,1,0,0|2,0,0]=4 4616 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb25175756 [0,1,0,1,0,0|2,0,0]=4 4617 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24742590 [0,1,0,1,0,0|2,0,0]=4 4618 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24557857 [0,1,0,1,0,0|2,0,0]=4 4619 B14R2.4402 OC(=O)[C@H]1C[C@@H]1c2ccc(F)cc2 Amb24600834 [0,1,0,1,0,0|2,0,0]=4 4620 B14R2.4402 OC(=O)[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb24739770 [0,1,0,1,0,0|2,0,0]=4 4621 B14R2.4402 Oc1ccc(cc1)[C@H]2C[C@H]2C(O)=O Amb25236047 [0,1,0,1,0,0|2,0,0]=4 4622 B14R2.5816 CC(=O)N1CCc2c1cc(=O)[nH]c2 Amb2369113 [0,1,0,1,0,0|2,0,0]=4 4623 B14R2.5816 CC(=O)N1CCc2ccc(Br)cc12 Amb22498223 [0,1,0,1,0,0|1,0,0]=3 4624 B14R2.5816 CC(=O)N1CCc2ccc(Cl)cc12 Amb17673958 [0,1,0,1,0,0|1,0,0]=3 4625 B14R2.5816 CC(=O)N1CCc2ccc(F)cc12 Amb17689299 [0,1,0,1,0,0|1,0,0]=3 4626 B14R2.5816 CC(=O)N1CCc2ccc(O)cc12 Amb24080168 [0,1,0,1,0,0|1,0,0]=3 4627 B14R2.5816 Cc1ccc2CC[C@@H](C(O)=O)c2c1 Amb25160558 [0,1,0,1,0,0|2,0,0]=4 4628 B14R2.5816 NC(=O)C1CCc2ccc(Cl)cc21 Amb22499729 [0,1,0,1,0,0|2,0,0]=4 4629 B14R2.5816 NC(=O)N1CCc2ccc(Cl)cc12 Amb25206122 [0,1,0,1,0,0|2,0,0]=4 4630 B14R2.5816 Nc1ccc2CCC(C(O)=O)c2c1 Amb24398586 [0,1,0,1,0,0|2,0,0]=4 4631 B14R2.5816 O=C(Cl)N1CCc2ccc(F)cc12 Amb25191306 [0,1,0,1,0,0|2,0,0]=4 4632 B14R2.5816 OC(=O)C1CCc2c1cc(C)cc2 Amb17233186 [0,1,0,1,0,0|2,0,0]=4 4633 B14R2.5816 OC(=O)C1CCc2c1cc(Cl)cc2 Amb17236498 [0,1,0,1,0,0|2,0,0]=4 4634 B14R2.5816 OC(=O)C1CCc2c1cc(F)cc2 Amb17233656 [0,1,0,1,0,0|2,0,0]=4 4635 B14R2.5816 OC(=O)C1CCc2ccc(Br)cc21 Amb18660722 [0,1,0,1,0,0|2,0,0]=4 4636 B14R2.5816 OC(=O)[C@@H]1CCc2ccc(Cl)cc21 Amb25817521 [0,1,0,1,0,0|2,0,0]=4 4637 B14R2.5816 OC(=O)[C@@H]1CCc2ccc(F)cc21 Amb25160557 [0,1,0,1,0,0|2,0,0]=4 4638 B14R2.5816 OC(=O)[C@H]1CCc2ccc(Br)cc21 Amb24382701 [0,1,0,1,0,0|2,0,0]=4 4639 B14R2.5816 OC(=O)[C@H]1CCc2ccc(Cl)cc21 Amb25679657 [0,1,0,1,0,0|2,0,0]=4 4640 B14R2.5816 OC(=O)[C@H]1CCc2ccc(F)cc21 Amb25301988 [0,1,0,1,0,0|2,0,0]=4 4641 B14R2.5816 Oc1ccc2CCC(c2c1)C(O)=O Amb22234428 [0,1,0,1,0,0|2,0,0]=4 4642 B14R2.23278 O=C1CC2C=C(CCN1)C=CC2=O Amb25799643 [0,1,0,1,0,0|1,0,1]=4 4643 B14R2.28978 O=C1CC2(CCC1)C=CC(=O)C=C2 Amb25286691 [0,1,0,1,0,0|1,0,1]=4 4644 B14R2.28978 O=C1CC2(CCO1)C=CC(=O)C=C2 Amb25370877 [0,1,0,1,0,0|0,0,1]=3 4645 B14R2.8 CCC1N[C@H](CO1)c2ccccc2 Amb25108096 [0,1,0,1,0,0|1,0,1]=4 4646 B14R2.8 CNC=1CC(CN1)c2ccccc2 Amb24375653 [0,1,0,1,0,0|2,0,0]=4 4647 B14R2.8 ClCC1=N[C@H](CO1)c2ccccc2 Amb25331175 [0,1,0,1,0,0|1,0,0]=3 4648 B14R2.8 NCC1OCC(O1)c2ccccc2 Amb17470594 [0,1,0,1,0,0|0,0,2]=4 4649 B14R2.8 O=CC1=CCC(S1)c2ccccc2 Amb24570871 [0,1,0,1,0,0|2,0,0]=4 4650 B14R2.8 O=CC1=CC[C@H](S1)c2ccccc2 Amb24614767 [0,1,0,1,0,0|2,0,0]=4 4651 B14R2.8 O=CC1CC(CC1)c2ccccc2 Amb24364116 [0,1,0,1,0,0|1,0,1]=4 4652 B14R2.8 O=CC=1C[C@@H](ON1)c2ccccc2 Amb25712953 [0,1,0,1,0,0|2,0,0]=4 4653 B14R2.8 O=CN1CC(CC1)c2ccccc2 Amb24685502 [0,1,0,1,0,0|2,0,0]=4 4654 B14R2.8 O=C[C@@H]1OC[C@H](O1)c2ccccc2 Amb24512918 [0,1,0,1,0,0|1,0,1]=4 4655 B14R2.8 OCC1CC(CO1)c2ccccc2 Amb25226649 [0,1,0,1,0,0|0,0,2]=4 4656 B14R2.8 OC[C@@H]1C[C@@H](CO1)c2ccccc2 Amb24615402 [0,1,0,1,0,0|0,0,2]=4 4657 B14R2.95 BrCC(=O)N1CCc2c1cccc2 Amb2089065 [0,1,0,1,0,0|1,0,0]=3 4658 B14R2.95 C=CC(=O)C1CCc2ccccc21 Amb25133333 [0,1,0,1,0,0|1,0,1]=4 4659 B14R2.95 CCC(=O)C1CCc2ccc[n]c21 Amb25741822 [0,1,0,1,0,0|2,0,0]=4 4660 B14R2.95 CCC(=O)C1CCc2ccccc21 Amb24593074 [0,1,0,1,0,0|1,0,0]=3 4661 B14R2.95 CCC(=O)C1CNc2ccccc21 Amb25228919 [0,1,0,1,0,0|2,0,0]=4 4662 B14R2.95 CCC(=O)N1CCc2c1cccc2 Amb1672516 [0,1,0,1,0,0|1,0,0]=3 4663 B14R2.95 CCS(=O)N1CCc2ccccc12 Amb25348331 [0,1,0,1,0,0|2,0,0]=4 4664 B14R2.95 CNC(=N)N1CCc2ccccc12 Amb18183947 [0,1,0,1,0,0|2,0,0]=4 4665 B14R2.95 CNC(=O)C1CCc2ccccc21 Amb24658312 [0,1,0,1,0,0|1,0,0]=3 4666 B14R2.95 CNC(=O)C1CSc2ccccc21 Amb25832994 [0,1,0,1,0,0|2,0,0]=4 4667 B14R2.95 CNC(=O)N1CCc2ccccc12 Amb24490123 [0,1,0,1,0,0|1,0,0]=3 4668 B14R2.95 COC(=N)C1CCc2ccccc21 Amb25345442 [0,1,0,1,0,0|2,0,0]=4 4669 B14R2.95 COC(=O)C1CCc2[n]cccc21 Amb25262859 [0,1,0,1,0,0|2,0,0]=4 4670 B14R2.95 COC(=O)C1CCc2c1cccc2 Amb10563171 [0,1,0,1,0,0|1,0,0]=3 4671 B14R2.95 COC(=O)C1CNc2ccccc21 Amb19320764 [0,1,0,1,0,0|2,0,0]=4 4672 B14R2.95 COC(=O)C1CNc2ccccc21 Amb22234034 [0,1,0,1,0,0|2,0,0]=4 4673 B14R2.95 COC(=O)C1COc2ccccc21 Amb22059417 [0,1,0,1,0,0|2,0,0]=4 4674 B14R2.95 COC(=O)C1CSc2ccccc21 Amb24489808 [0,1,0,1,0,0|2,0,0]=4 4675 B14R2.95 COC(=O)C1NCc2c1cccc2 Amb10066941 [0,1,0,1,0,0|2,0,0]=4 4676 B14R2.95 COC(=O)C1NCc2ccccc21 Amb22490554 [0,1,0,1,0,0|2,0,0]=4 4677 B14R2.95 COC(=O)N1CCc2cc[n]cc12 Amb25318238 [0,1,0,1,0,0|2,0,0]=4 4678 B14R2.95 COC(=O)[C@H]1NCc2ccccc21 Amb25780034 [0,1,0,1,0,0|2,0,0]=4 4679 B14R2.95 N#CC(=O)N1CCc2ccccc12 Amb25309711 [0,1,0,1,0,0|1,0,1]=4 4680 B14R2.95 NCC(=O)N1CCc2c1cccc2 Amb13952606 [0,1,0,1,0,0|1,0,0]=3 4681 B14R2.95 NNC(=O)C1CCc2ccccc21 Amb25689061 [0,1,0,1,0,0|2,0,0]=4 4682 B14R2.95 O=C(C=O)N1CCc2ccccc12 Amb25723267 [0,1,0,1,0,0|1,0,1]=4 4683 B14R2.95 O=C(CBr)C1COc2ccccc21 Amb24452410 [0,1,0,1,0,0|2,0,0]=4 4684 B14R2.95 O=C(CBr)C1CSc2ccccc21 Amb25670351 [0,1,0,1,0,0|2,0,0]=4 4685 B14R2.95 O=C(CBr)C1NCc2ccccc21 Amb25300659 [0,1,0,1,0,0|2,0,0]=4 4686 B14R2.95 O=C(CCl)C1CSc2ccccc21 Amb25678752 [0,1,0,1,0,0|2,0,0]=4 4687 B14R2.95 O=C(CCl)N1CCc2c[n]ccc12 Amb25833372 [0,1,0,1,0,0|2,0,0]=4 4688 B14R2.95 O=C(CCl)N1COc2ccccc12 Amb24496938 [0,1,0,1,0,0|2,0,0]=4 4689 B14R2.95 O=C(CS)N1CCc2ccccc12 Amb20413873 [0,1,0,1,0,0|1,0,0]=3 4690 B14R2.95 OCC(=O)C1=CCc2ccccc12 Amb25706926 [0,1,0,1,0,0|1,0,1]=4 4691 B14R2.95 ONC(=O)C1CCc2ccccc21 Amb25663645 [0,1,0,1,0,0|2,0,0]=4 4692 B14R2.143 CNC=1CCCc2ccccc2C1 Amb24461692 [0,1,0,1,0,0|2,0,0]=4 4693 B14R2.143 CSC=1CCCc2ccccc2N1 Amb24704313 [0,1,0,1,0,0|2,0,0]=4 4694 B14R2.143 O=CC=1CCCc2ccccc2C1 Amb25770552 [0,1,0,1,0,0|1,0,1]=4 4695 B14R2.143 O=CC=1Cc2ccccc2CCC1 Amb25833599 [0,1,0,1,0,0|1,0,0]=3 4696 B14R2.279 C=C1C(=O)CCCc2ccccc21 Amb25273029 [0,1,0,1,0,0|1,0,1]=4 4697 B14R2.279 CC1C(=O)CCCc2ccccc21 Amb24491400 [0,1,0,1,0,0|1,0,0]=3 4698 B14R2.279 CC1C(=O)NCCc2ccccc21 Amb25124711 [0,1,0,1,0,0|1,0,0]=3 4699 B14R2.279 CC1CCCc2ccccc2C1=O Amb18183849 [0,1,0,1,0,0|1,0,1]=4 4700 B14R2.279 CN1C(=O)CCNc2ccccc12 Amb18224515 [0,1,0,1,0,0|2,0,0]=4 4701 B14R2.279 CN1C(=O)OCCc2ccccc12 Amb24526707 [0,1,0,1,0,0|0,0,0]=2 4702 B14R2.279 CN1CCCc2ccccc2C1=O Amb25156131 [0,1,0,1,0,0|2,0,0]=4 4703 B14R2.279 C[C@H]1CCCc2ccccc2C1=O Amb25844348 [0,1,0,1,0,0|1,0,1]=4 4704 B14R2.279 NC1C(=O)NCCc2ccccc21 Amb22491660 [0,1,0,1,0,0|1,0,0]=3 4705 B14R2.279 NN1c2ccccc2CCCC1=O Amb17772370 [0,1,0,1,0,0|2,0,0]=4 4706 B14R2.279 O=C1CCCc2ccccc2N1Cl Amb24555131 [0,1,0,1,0,0|2,0,0]=4 4707 B14R2.279 O=C1CCOc2c(N1C)cccc2 Amb17570222 [0,1,0,1,0,0|2,0,0]=4 4708 B14R2.279 O=C1NCCc2c(C1N)cccc2 Amb10067379 [0,1,0,1,0,0|1,0,0]=3 4709 B14R2.279 OC1C(=O)SCCc2ccccc21 Amb25306580 [0,1,0,1,0,0|0,1,0]=3 4710 B14R2.958 C=CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb24633398 [0,1,0,1,0,0|1,0,1]=4 4711 B14R2.958 CCC(=O)C1CC1c2ccccc2 Amb24534293 [0,1,0,1,0,0|1,0,0]=3 4712 B14R2.958 CCC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25322800 [0,1,0,1,0,0|1,0,0]=3 4713 B14R2.958 CCC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24612438 [0,1,0,1,0,0|2,0,0]=4 4714 B14R2.958 CNC(=O)C1CC1c2cc[n]cc2 Amb25132180 [0,1,0,1,0,0|2,0,0]=4 4715 B14R2.958 CNC(=O)[C@@H]1C[C@@H]1c2cc[n]cc2 Amb24617709 [0,1,0,1,0,0|2,0,0]=4 4716 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccc[n]c2 Amb25355670 [0,1,0,1,0,0|2,0,0]=4 4717 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25226125 [0,1,0,1,0,0|1,0,0]=3 4718 B14R2.958 CNC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25317578 [0,1,0,1,0,0|2,0,0]=4 4719 B14R2.958 CNC(=O)[C@H]1C[C@@H]1c2cc[n]cc2 Amb24610051 [0,1,0,1,0,0|2,0,0]=4 4720 B14R2.958 CNC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb24605065 [0,1,0,1,0,0|1,0,0]=3 4721 B14R2.958 CNC(=S)C1CC1c2ccccc2 Amb24428152 [0,1,0,1,0,0|1,1,0]=4 4722 B14R2.958 CNC(=S)[C@H]1C[C@@H]1c2ccccc2 Amb25324077 [0,1,0,1,0,0|1,1,0]=4 4723 B14R2.958 COC(=O)C1CC1c2cc[n]cc2 Amb25355787 [0,1,0,1,0,0|2,0,0]=4 4724 B14R2.958 COC(=O)C1CC1c2ccc[n]c2 Amb25852071 [0,1,0,1,0,0|2,0,0]=4 4725 B14R2.958 COC(=O)N1CC1c2ccccc2 Amb1039317 [0,1,0,1,0,0|1,0,0]=3 4726 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2cccc[n]2 Amb24617301 [0,1,0,1,0,0|2,0,0]=4 4727 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb24526297 [0,1,0,1,0,0|1,0,0]=3 4728 B14R2.958 C\C(=N\N)\[C@@H]1C[C@H]1c2ccccc2 Amb25031668 [0,1,0,1,0,0|2,0,0]=4 4729 B14R2.958 NNC(=O)C1CC1c2ccccc2 Amb1799991 [0,1,0,1,0,0|2,0,0]=4 4730 B14R2.958 NNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb17939352 [0,1,0,1,0,0|2,0,0]=4 4731 B14R2.958 NNC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24501421 [0,1,0,1,0,0|2,0,0]=4 4732 B14R2.958 O=C(CBr)C1CC1c2ccccc2 Amb25220775 [0,1,0,1,0,0|1,0,0]=3 4733 B14R2.958 ONC(=O)C1CC1c2ccccc2 Amb25332697 [0,1,0,1,0,0|2,0,0]=4 4734 B14R2.2956 CC1(C=O)OC1Cc2ccccc2 Amb25371918 [0,1,0,1,0,0|0,0,1]=3 4735 B14R2.2956 CC1(CO)OC1Cc2ccccc2 Amb25734381 [0,1,0,1,0,0|0,0,2]=4 4736 B14R2.2956 C[C@]1(CO)O[C@@H]1Cc2ccccc2 Amb24519588 [0,1,0,1,0,0|0,0,2]=4 4737 B14R2.2969 CC1(CO)OCC1c2ccccc2 Amb24414910 [0,1,0,1,0,0|0,0,2]=4 4738 B14R2.2969 C[C@@]1(CO)OC[C@@H]1c2ccccc2 Amb25306643 [0,1,0,1,0,0|0,0,2]=4 4739 B14R2.3019 C1NCC1=CCCc2ccccc2 Amb24713039 [0,1,0,1,0,0|2,0,0]=4 4740 B14R2.3459 CC1(C=O)OCCc2ccccc12 Amb18127701 [0,1,0,1,0,0|0,0,1]=3 4741 B14R2.3459 C[C@@]1(CCCc2ccccc12)C=O Amb25103690 [0,1,0,1,0,0|1,0,1]=4 4742 B14R2.3459 C[C@]1(CCCc2ccccc12)C=O Amb25322805 [0,1,0,1,0,0|1,0,1]=4 4743 B14R2.4514 C=C1C(COC1=O)c2ccccc2 Amb24417074 [0,1,0,1,0,0|0,0,1]=3 4744 B14R2.4514 CC1C(=O)ON=C1c2ccccc2 Amb25675398 [0,1,0,1,0,0|1,0,1]=4 4745 B14R2.4514 CC1C(C=CC1=O)c2ccccc2 Amb25859267 [0,1,0,1,0,0|1,0,1]=4 4746 B14R2.4514 CC1C(CCC1=O)c2ccccc2 Amb24051457 [0,1,0,1,0,0|1,0,0]=3 4747 B14R2.4514 CC1C(CNC1=O)c2c[n]ccc2 Amb24764179 [0,1,0,1,0,0|2,0,0]=4 4748 B14R2.4514 CC1C(CNC1=O)c2cccc[n]2 Amb24560750 [0,1,0,1,0,0|2,0,0]=4 4749 B14R2.4514 CC1C(CNC1=O)c2ccccc2 Amb24312552 [0,1,0,1,0,0|1,0,0]=3 4750 B14R2.4514 CC1C(OCC1=O)c2ccccc2 Amb25370856 [0,1,0,1,0,0|2,0,0]=4 4751 B14R2.4514 CC=1C(=O)CCC1c2ccccc2 Amb24408335 [0,1,0,1,0,0|1,0,1]=4 4752 B14R2.4514 CN1C(CCC1=O)c2cccc[n]2 Amb22054764 [0,1,0,1,0,0|2,0,0]=4 4753 B14R2.4514 CN1C(CCC1=O)c2cccc[n]2 Amb24064826 [0,1,0,1,0,0|2,0,0]=4 4754 B14R2.4514 CN1C(CNC1=O)c2cc[n]cc2 Amb24672456 [0,1,0,1,0,0|2,0,0]=4 4755 B14R2.4514 CN1C(CNC1=O)c2ccc[n]c2 Amb25689003 [0,1,0,1,0,0|2,0,0]=4 4756 B14R2.4514 CN1C(CNC1=O)c2cccc[n]2 Amb24718293 [0,1,0,1,0,0|2,0,0]=4 4757 B14R2.4514 CN1C(CNC1=O)c2ccccc2 Amb25218843 [0,1,0,1,0,0|1,0,0]=3 4758 B14R2.4514 CN1C(CNC1=S)c2ccccc2 Amb24064843 [0,1,0,1,0,0|1,1,0]=4 4759 B14R2.4514 CN1C(COC1=O)c2ccccc2 Amb25191541 [0,1,0,1,0,0|0,0,0]=2 4760 B14R2.4514 CN1[C@@H](NCC1=O)c2ccccc2 Amb25232599 [0,1,0,1,0,0|2,0,0]=4 4761 B14R2.4514 CN1[C@H](COC1=O)c2ccccc2 Amb24362005 [0,1,0,1,0,0|0,0,0]=2 4762 B14R2.4514 C[C@H]1[C@@H](CCC1=O)c2ccccc2 Amb25327910 [0,1,0,1,0,0|1,0,0]=3 4763 B14R2.4514 C[C@H]1[C@@H](OCC1=O)c2ccccc2 Amb24512682 [0,1,0,1,0,0|2,0,0]=4 4764 B14R2.4514 N[C@@H]1[C@H](ONC1=O)c2ccccc2 Amb24744776 [0,1,0,1,0,0|2,0,0]=4 4765 B14R2.4514 O=C1C(=O)OCN1c2ccccc2 Amb24378061 [0,1,0,1,0,0|1,0,1]=4 4766 B14R2.4514 O=C1CCC(C1Cl)c2ccccc2 Amb25300341 [0,1,0,1,0,0|1,0,0]=3 4767 B14R2.4514 O=C1CCC(N1C)c2ccccn2 Amb10069450 [0,1,0,1,0,0|2,0,0]=4 4768 B14R2.4514 O=C1CCC(N1C)c2cccnc2 Amb10845303 [0,1,0,1,0,0|2,0,0]=4 4769 B14R2.4514 O=C1CC[C@@H](N1C)c2cccnc2 Amb10071651 [0,1,0,1,0,0|2,0,0]=4 4770 B14R2.4514 O=C1ONN(C1Br)c2ccccc2 Amb25804192 [0,1,0,1,0,0|2,0,0]=4 4771 B14R2.4514 O=c1o[nH]c(c1C)c2ccccc2 Amb10553850 [0,1,0,1,0,0|1,0,1]=4 4772 B14R2.4514 OC1C(C=CC1=O)c2ccccc2 Amb25262773 [0,1,0,1,0,0|1,0,1]=4 4773 B14R2.4514 OC1C(CNC1=O)c2ccccc2 Amb24490122 [0,1,0,1,0,0|1,0,0]=3 4774 B14R2.4514 OC1C(NNC1=O)c2ccccc2 Amb24475814 [0,1,0,1,0,0|2,0,0]=4 4775 B14R2.35816 C=CC(=O)CC1Cc2ccccc21 Amb24685567 [0,1,0,1,0,0|1,0,1]=4 4776 B14R2.35816 CCC(=O)NC1Cc2ccccc21 Amb24404446 [0,1,0,1,0,0|1,0,0]=3 4777 B14R2.35816 CNC(=S)NC1Cc2ccccc21 Amb24529944 [0,1,0,1,0,0|1,1,0]=4 4778 B14R2.35816 COC(=O)NC1Cc2ccccc21 Amb25725896 [0,1,0,1,0,0|1,0,0]=3 4779 B14R2.35816 OCC(=O)NC1Cc2ccccc21 Amb25749238 [0,1,0,1,0,0|1,0,0]=3 4780 B14R3.358 O=C1C=CC2C1c3ccccc32 Amb24614778 [0,0,0,2,0,0|1,0,1]=4 4781 B14R3.358 O=C1CCC2C1c3ccccc32 Amb25319986 [0,0,0,2,0,0|1,0,0]=3 4782 B14R3.608 CC1=CC2CC1c3ccccc32 Amb22356900 [0,0,0,2,0,0|2,0,0]=4 4783 B14R3.608 O=C1CC2CC1c3cc[n]cc32 Amb24537936 [0,0,0,2,0,0|2,0,0]=4 4784 B14R3.608 O=C1CC2CC1c3ccccc32 Amb22356924 [0,0,0,2,0,0|1,0,0]=3 4785 B14R3.608 O=C1CC2OC1c3ccccc32 Amb24388623 [0,0,0,2,0,0|2,0,0]=4 4786 B14R3.608 O=C1C[C@@H]2C[C@H]1c3cc[n]cc32 Amb24629734 [0,0,0,2,0,0|2,0,0]=4 4787 B14R3.8004 O=C1Cc2c3N1CCc3ccc2 Amb17334458 [0,0,0,2,0,0|1,0,0]=3 4788 B14R3.8004 O=C1Nc2cccc3CCC1c32 Amb18559244 [0,0,0,2,0,0|2,0,0]=4 4789 B10R1.21 O=CCCC[n]1cccc1 Amb24060824 [1,0,0,0,1,0|2,0,0]=4 4790 B10R1.21 O=CCCCc1c[nH]cc1 Amb18223326 [1,0,0,0,1,0|2,0,0]=4 4791 B10R1.21 O=CCCCc1c[s]cc1 Amb24415638 [1,0,0,0,1,0|2,0,0]=4 4792 B10R1.21 O=CCCCc1cccs1 Amb17089166 [1,0,0,0,1,0|2,0,0]=4 4793 B10R1.21 O=CCCCc1cocc1 Amb25684248 [1,0,0,0,1,0|2,0,0]=4 4794 B10R1.21 O=CNCCc1c[s]cc1 Amb25107058 [1,0,0,0,1,0|2,0,0]=4 4795 B10R1.21 O=CNCCc1ccc[nH]1 Amb25127273 [1,0,0,0,1,0|2,0,0]=4 4796 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [0,0,0,0,2,0|2,0,0]=4 4797 B10R1.18 CC(=C)Oc1cccc[n]1 Amb24101320 [0,0,0,0,2,0|2,0,0]=4 4798 B10R1.18 CC(=N)Cc1cccc[n]1 Amb25315666 [0,0,0,0,2,0|2,0,0]=4 4799 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [0,0,0,0,2,0|2,0,0]=4 4800 B10R1.18 CC(=O)CN1C=COC=C1 Amb25100926 [0,0,0,0,2,0|2,0,0]=4 4801 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [0,0,0,0,2,0|1,0,0]=3 4802 B10R1.18 CC(=O)Cc1[n]ccc[n]1 Amb21864927 [0,0,0,0,2,0|2,0,0]=4 4803 B10R1.18 CC(=O)Cc1c[n]c[n]c1 Amb25328576 [0,0,0,0,2,0|2,0,0]=4 4804 B10R1.18 CC(=O)Cc1cc[n][n]c1 Amb22008576 [0,0,0,0,2,0|2,0,0]=4 4805 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [0,0,0,0,2,0|1,0,0]=3 4806 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [0,0,0,0,2,0|1,0,0]=3 4807 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [0,0,0,0,2,0|1,0,0]=3 4808 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [0,0,0,0,2,0|1,0,0]=3 4809 B10R1.18 CC(=O)Cc1cnccn1 Amb1995176 [0,0,0,0,2,0|2,0,0]=4 4810 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [0,0,0,0,2,0|1,0,0]=3 4811 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552800 [0,0,0,0,2,0|2,0,0]=4 4812 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552804 [0,0,0,0,2,0|2,0,0]=4 4813 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb22451374 [0,0,0,0,2,0|2,0,0]=4 4814 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb24086636 [0,0,0,0,2,0|2,0,0]=4 4815 B10R1.18 CC(=O)Oc1cc[n]c[n]1 Amb25357546 [0,0,0,0,2,0|2,0,0]=4 4816 B10R1.18 CC(=O)Oc1cc[n]cc1 Amb22522585 [0,0,0,0,2,0|1,0,0]=3 4817 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [0,0,0,0,2,0|0,0,0]=2 4818 B10R1.18 CC(=O)Oc1ccccn1 Amb17619694 [0,0,0,0,2,0|1,0,0]=3 4819 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [0,0,0,0,2,0|0,1,0]=3 4820 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [0,0,0,0,2,0|1,0,0]=3 4821 B10R1.18 CC(=O)\C=C\1/C=CC=CS1 Amb24610243 [0,0,0,0,2,0|1,0,1]=4 4822 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [0,0,0,0,2,0|1,0,1]=4 4823 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [0,0,0,0,2,0|1,0,1]=4 4824 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [0,0,0,0,2,0|1,0,1]=4 4825 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [0,0,0,0,2,0|1,0,1]=4 4826 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [0,0,0,0,2,0|2,0,0]=4 4827 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [0,0,0,0,2,0|1,0,1]=4 4828 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [0,0,0,0,2,0|1,0,1]=4 4829 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [0,0,0,0,2,0|1,0,1]=4 4830 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [0,0,0,0,2,0|0,1,1]=4 4831 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [0,0,0,0,2,0|2,0,0]=4 4832 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [0,0,0,0,2,0|1,0,0]=3 4833 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [0,0,0,0,2,0|1,0,0]=3 4834 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [0,0,0,0,2,0|0,0,2]=4 4835 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [0,0,0,0,2,0|1,0,1]=4 4836 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [0,0,0,0,2,0|1,0,1]=4 4837 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [0,0,0,0,2,0|0,0,2]=4 4838 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [0,0,0,0,2,0|1,0,1]=4 4839 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [0,0,0,0,2,0|1,1,0]=4 4840 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [0,0,0,0,2,0|1,1,0]=4 4841 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [0,0,0,0,2,0|0,0,2]=4 4842 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [0,0,0,0,2,0|2,0,0]=4 4843 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [0,0,0,0,2,0|2,0,0]=4 4844 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [0,0,0,0,2,0|1,0,0]=3 4845 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [0,0,0,0,2,0|2,0,0]=4 4846 B10R1.18 NC(=O)Oc1cccc[n]1 Amb25772133 [0,0,0,0,2,0|2,0,0]=4 4847 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [0,0,0,0,2,0|1,1,0]=4 4848 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [0,0,0,0,2,0|1,0,0]=3 4849 B10R1.18 O=C(Cl)Cc1cc[n]cc1 Amb24446208 [0,0,0,0,2,0|2,0,0]=4 4850 B10R1.18 O=C(Cl)Cc1ccc[n]c1 Amb24605722 [0,0,0,0,2,0|2,0,0]=4 4851 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [0,0,0,0,2,0|2,0,0]=4 4852 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [0,0,0,0,2,0|2,0,0]=4 4853 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [0,0,0,0,2,0|1,0,0]=3 4854 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [0,0,0,0,2,0|2,0,0]=4 4855 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [0,0,0,0,2,0|2,0,0]=4 4856 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [0,0,0,0,2,0|2,0,0]=4 4857 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [0,0,0,0,2,0|2,0,0]=4 4858 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [0,0,0,0,2,0|2,0,0]=4 4859 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [0,0,0,0,2,0|2,0,0]=4 4860 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [0,0,0,0,2,0|1,0,0]=3 4861 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [0,0,0,0,2,0|1,0,1]=4 4862 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [0,0,0,0,2,0|2,0,0]=4 4863 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [0,0,0,0,2,0|2,0,0]=4 4864 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [0,0,0,0,2,0|1,0,0]=3 4865 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [0,0,0,0,2,0|1,0,0]=3 4866 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [0,0,0,0,2,0|1,0,0]=3 4867 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [0,0,0,0,2,0|1,0,0]=3 4868 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552724 [0,0,0,0,2,0|2,0,0]=4 4869 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552757 [0,0,0,0,2,0|2,0,0]=4 4870 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10573238 [0,0,0,0,2,0|2,0,0]=4 4871 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb22345878 [0,0,0,0,2,0|2,0,0]=4 4872 B10R1.18 [O-]C(=O)Cc1ccc[n]c1 Amb21618883 [0,0,0,0,2,0|2,0,0]=4 4873 B10R1.18 [O-]C(=O)Cc1cccc[n]1 Amb22000882 [0,0,0,0,2,0|2,0,0]=4 4874 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [0,0,0,0,2,0|1,0,0]=3 4875 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [0,0,0,0,2,0|1,0,0]=3 4876 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [0,0,0,0,2,0|2,0,0]=4 4877 B10R1.66 CC(=O)CC[n]1cccc1 Amb25138234 [0,0,0,0,2,0|1,0,0]=3 4878 B10R1.66 CC(=O)CCc1[n]cco1 Amb18832106 [0,0,0,0,2,0|2,0,0]=4 4879 B10R1.66 CC(=O)CCc1c[n]co1 Amb18832107 [0,0,0,0,2,0|2,0,0]=4 4880 B10R1.66 CC(=O)CCc1c[s]c[n]1 Amb25133415 [0,0,0,0,2,0|2,0,0]=4 4881 B10R1.66 CC(=O)CCc1cc[nH]c1 Amb18223260 [0,0,0,0,2,0|1,0,0]=3 4882 B10R1.66 CC(=O)CCc1cc[n][s]1 Amb24699528 [0,0,0,0,2,0|2,0,0]=4 4883 B10R1.66 CC(=O)CCc1ccc[nH]1 Amb24505108 [0,0,0,0,2,0|1,0,0]=3 4884 B10R1.66 CC(=O)CCc1ccco1 Amb1107538 [0,0,0,0,2,0|1,0,0]=3 4885 B10R1.66 CC(=O)CCc1cco[n]1 Amb18832105 [0,0,0,0,2,0|2,0,0]=4 4886 B10R1.66 CC(=O)CCc1nccs1 Amb17334384 [0,0,0,0,2,0|2,0,0]=4 4887 B10R1.66 CC(=O)NCc1ccco1 Amb1209246 [0,0,0,0,2,0|2,0,0]=4 4888 B10R1.66 CC(=O)NCc1cccs1 Amb1218150 [0,0,0,0,2,0|2,0,0]=4 4889 B10R1.66 CC(=O)NCc1cscc1 Amb10945323 [0,0,0,0,2,0|2,0,0]=4 4890 B10R1.66 CC(=O)OCc1c[nH]c[n]1 Amb20248319 [0,0,0,0,2,0|2,0,0]=4 4891 B10R1.66 CC(=O)OCc1c[n]c[s]1 Amb25279956 [0,0,0,0,2,0|2,0,0]=4 4892 B10R1.66 CC(=O)OCc1cc[n]o1 Amb25840725 [0,0,0,0,2,0|2,0,0]=4 4893 B10R1.66 CC(=O)OCc1cc[s]c1 Amb25369522 [0,0,0,0,2,0|1,0,0]=3 4894 B10R1.66 CC(=O)OCc1ccc[nH]1 Amb24478971 [0,0,0,0,2,0|1,0,0]=3 4895 B10R1.66 CC(=O)OCc1ccc[s]1 Amb25077698 [0,0,0,0,2,0|1,0,0]=3 4896 B10R1.66 CC(=O)OCc1cco[n]1 Amb24482875 [0,0,0,0,2,0|2,0,0]=4 4897 B10R1.66 CC(=S)OCc1ccco1 Amb10807433 [0,0,0,0,2,0|1,1,0]=4 4898 B10R1.66 NC(=O)CCc1ccoc1 Amb24722346 [0,0,0,0,2,0|2,0,0]=4 4899 B10R1.66 O=C(Cl)CCc1ccc[s]1 Amb23440823 [0,0,0,0,2,0|2,0,0]=4 4900 B10R1.66 OC(=O)CCC=1CC=CC1 Amb25264551 [0,0,0,0,2,0|1,0,1]=4 4901 B10R1.66 OC(=O)CCc1cc[nH]c1 Amb18562783 [0,0,0,0,2,0|2,0,0]=4 4902 B10R1.66 OC(=O)CCc1ccc[nH]1 Amb10602142 [0,0,0,0,2,0|2,0,0]=4 4903 B10R1.66 OC(=O)CCc1ccco1 Amb1153073 [0,0,0,0,2,0|2,0,0]=4 4904 B10R1.66 OC(=O)CCc1cccs1 Amb1154297 [0,0,0,0,2,0|2,0,0]=4 4905 B10R1.66 OC(=O)CCc1ccoc1 Amb18643489 [0,0,0,0,2,0|2,0,0]=4 4906 B10R1.66 OC(=O)CCc1cscc1 Amb1153814 [0,0,0,0,2,0|2,0,0]=4 4907 B10R1.66 OC(=O)CCn1cccc1 Amb1130611 [0,0,0,0,2,0|2,0,0]=4 4908 B14R1.422 CC(=C)CCNOCc1ccccc1 Amb24575123 [0,0,0,0,0,2|2,0,0]=4 4909 B14R1.422 CC(=O)C#CCOCc1ccccc1 Amb25818767 [0,0,0,0,0,2|1,0,0]=3 4910 B14R1.422 CC(=O)CCCOCc1ccccc1 Amb19078943 [0,0,0,0,0,2|1,0,0]=3 4911 B14R1.422 CC(=O)NCCC#Cc1ccccc1 Amb24072453 [0,0,0,0,0,2|1,0,0]=3 4912 B14R1.422 CC(=O)NCCCSc1ccccc1 Amb21792154 [0,0,0,0,0,2|1,0,0]=3 4913 B14R1.422 CC(=O)NCCOCc1ccccc1 Amb23166894 [0,0,0,0,0,2|1,0,0]=3 4914 B14R1.422 CC(=O)NCC\N=C\c1ccccc1 Amb24073400 [0,0,0,0,0,2|1,0,0]=3 4915 B14R1.422 CC(=O)NC\C=C/Cc1ccccc1 Amb24072932 [0,0,0,0,0,2|1,0,0]=3 4916 B14R1.422 CC(=O)NNC\C=C/c1ccccc1 Amb24072928 [0,0,0,0,0,2|1,0,1]=4 4917 B14R1.422 CC(=O)OCCCOc1ccccc1 Amb24046251 [0,0,0,0,0,2|0,0,0]=2 4918 B14R1.422 CC(=O)OCCNCc1ccccc1 Amb18929298 [0,0,0,0,0,2|0,0,0]=2 4919 B14R1.422 CC(C)=C=CCNCc1ccccc1 Amb25664127 [0,0,0,0,0,2|2,0,0]=4 4920 B14R1.422 CC(C)=C\C=C\CCc1ccccc1 Amb22546753 [0,0,0,0,0,2|2,0,0]=4 4921 B14R1.422 CC(C)CCOCCc1ccccc1 Amb22732326 [0,0,0,0,0,2|1,0,1]=4 4922 B14R1.422 CC(C)OCCNCc1ccccc1 Amb19079556 [0,0,0,0,0,2|1,0,1]=4 4923 B14R1.422 CS(=O)CCNOCc1ccccc1 Amb25248431 [0,0,0,0,0,2|2,0,0]=4 4924 B14R1.422 ClC(=O)OCCOCc1ccccc1 Amb10844670 [0,0,0,0,0,2|1,0,0]=3 4925 B14R1.422 NC(=O)CCCNCc1ccccc1 Amb19050609 [0,0,0,0,0,2|2,0,0]=4 4926 B14R1.422 NC(=O)CCCOCc1ccccc1 Amb25073445 [0,0,0,0,0,2|2,0,0]=4 4927 B14R1.422 NC(=O)CCNCCc1ccccc1 Amb22587630 [0,0,0,0,0,2|2,0,0]=4 4928 B14R1.422 NC(=O)NCCNCc1ccccc1 Amb18651583 [0,0,0,0,0,2|2,0,0]=4 4929 B14R1.422 NC(=O)NCCOCc1ccccc1 Amb25059842 [0,0,0,0,0,2|2,0,0]=4 4930 B14R1.422 NC(=O)N\N=C\CCc1ccccc1 Amb1630644 [0,0,0,0,0,2|2,0,0]=4 4931 B14R1.422 NC(=O)\C=C\CNCc1ccccc1 Amb25242587 [0,0,0,0,0,2|2,0,0]=4 4932 B14R1.422 O=C(Br)CCCCOc1ccccc1 Amb24062988 [0,0,0,0,0,2|2,0,0]=4 4933 B14R1.422 O=C(Cl)CCCOCc1ccccc1 Amb25841722 [0,0,0,0,0,2|2,0,0]=4 4934 B14R1.422 OC(=O)C#CCCCc1ccccc1 Amb25729581 [0,0,0,0,0,2|2,0,0]=4 4935 B14R1.422 OC(=O)CCCC#Cc1ccccc1 Amb25138666 [0,0,0,0,0,2|2,0,0]=4 4936 B14R1.422 OC(=O)CCCNCc1ccccc1 Amb1111090 [0,0,0,0,0,2|2,0,0]=4 4937 B14R1.422 OC(=O)CCCNCc1ccccc1 Amb24097641 [0,0,0,0,0,2|2,0,0]=4 4938 B14R1.422 OC(=O)CCC\C=C\c1ccccc1 Amb17619337 [0,0,0,0,0,2|2,0,0]=4 4939 B14R1.422 OC(=O)CCNCCc1ccccc1 Amb1111405 [0,0,0,0,0,2|2,0,0]=4 4940 B14R1.422 OC(=O)CCNCCc1ccccc1 Amb13952728 [0,0,0,0,0,2|2,0,0]=4 4941 B14R1.422 OC(=O)CCNNCc1ccccc1 Amb24601133 [0,0,0,0,0,2|2,0,0]=4 4942 B14R1.422 OC(=O)COC\C=C\c1ccccc1 Amb19041553 [0,0,0,0,0,2|1,0,1]=4 4943 B14R1.422 OC(=O)CSCCCc1ccccc1 Amb1110511 [0,0,0,0,0,2|1,1,0]=4 4944 B14R1.422 OC(=O)CSCCOc1ccccc1 Amb2417110 [0,0,0,0,0,2|1,1,0]=4 4945 B14R1.422 OC(=O)CSCOCc1ccccc1 Amb24472490 [0,0,0,0,0,2|1,1,0]=4 4946 B14R1.422 OC(=O)\C=C\CNCc1ccccc1 Amb25085378 [0,0,0,0,0,2|2,0,0]=4 4947 B14R1.422 OC(=O)\C=C\SCCc1ccccc1 Amb22448083 [0,0,0,0,0,2|1,1,0]=4