0 B10R1.18 BrC(Br)=Cc1c[n]ccc1 Amb24349522 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.18 BrC(Br)[Hg]c1ccccc1 Amb22345487 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.18 C=C(Cl)C[n+]1ccccc1 Amb24717958 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.18 C=C(F)Sc1ccccc1 Amb24630548 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.18 C=C(O)C=C1C=COC=C1 Amb24407180 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.18 CC(=C)Oc1cccc[n]1 Amb24101320 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.18 CC(=N)Cc1cccc[n]1 Amb25315666 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.18 CC(=N)Nc1ccc[n]c1 Amb25848009 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.18 CC(=O)CN1C=COC=C1 Amb25100926 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.18 CC(=O)Cc1[n]ccc[n]1 Amb21864927 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.18 CC(=O)Cc1c[n]c[n][n]1 Amb25174404 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.18 CC(=O)Cc1c[n]c[n]c1 Amb25328576 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.18 CC(=O)Cc1cc[n][n]c1 Amb22008576 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.18 CC(=O)Cc1cnccn1 Amb1995176 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552800 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552804 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.18 CC(=O)Nc1c[n]c[n]c1 Amb21962991 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.18 CC(=O)Nc1cc[n]c[n]1 Amb24072458 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb22451374 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb24086636 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.18 CC(=O)Oc1cc[n]c[n]1 Amb25357546 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.18 CC(=O)Oc1cc[n]cc1 Amb22522585 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.18 CC(=O)Oc1ccccn1 Amb17619694 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.18 CC(=O)Sc1[n]ccc[n]1 Amb25365230 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.18 CC(=O)\C=C\1/C=CC=CS1 Amb24610243 [0,0,0,0,0,0|2,0,1]=3 38 B10R1.18 CC(Br)Cc1cc[n]cc1 Amb25208255 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.18 CC(C)=Cc1c[n]ccc1 Amb24417745 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.18 CC(C)=Nc1c[n]ccc1 Amb25337657 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.18 CC(C)Cc1c[n]ccc1 Amb22043313 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.18 CC(C)Cc1cc[n]cc1 Amb22353758 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.18 CC(Cc1ccccn1)C Amb15691003 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.18 CC(Cc1ccccn1)Cl Amb17477796 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.18 CC(Cc1ccccn1)N Amb1995149 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.18 CC(Cc1ccccn1)O Amb1995148 [0,0,0,0,0,0|2,0,1]=3 48 B10R1.18 CC(Cc1cccnc1)Cl Amb17477798 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.18 CC(Cc1cccnc1)O Amb17477790 [0,0,0,0,0,0|2,0,1]=3 50 B10R1.18 CC(Cc1ccncc1)Cl Amb17477797 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.18 CC(Cc1ccncc1)O Amb17477789 [0,0,0,0,0,0|2,0,1]=3 52 B10R1.18 CC(Cc1cnccn1)O Amb1995175 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [0,0,0,0,0,0|2,0,1]=3 54 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.18 CC(Cl)Sc1ccccc1 Amb17673697 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [0,0,0,0,0,0|2,0,1]=3 57 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [0,0,0,0,0,0|3,0,0]=3 58 B10R1.18 CC(N)Cc1c[n]ccc1 Amb21972219 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.18 CC(N)Cc1cc[n]cc1 Amb21972220 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [0,0,0,0,0,0|2,0,1]=3 61 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [0,0,0,0,0,0|2,0,1]=3 62 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.18 CC(O)Nc1cccc[n]1 Amb24478972 [0,0,0,0,0,0|3,0,1]=4 64 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [0,0,0,0,0,0|2,0,1]=3 65 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [0,0,0,0,0,0|1,1,1]=3 66 B10R1.18 CN(C)Cc1cc[n]cc1 Amb20247602 [0,0,0,0,0,0|4,0,0]=4 67 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.18 CN(C)Nc1ccccc1 Amb25810299 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [0,0,0,0,0,0|2,0,0]=2 70 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [0,0,0,0,0,0|2,0,0]=2 71 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [0,0,0,0,0,0|1,0,1]=2 72 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [0,0,0,0,0,0|2,0,1]=3 73 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [0,0,0,0,0,0|2,0,1]=3 74 B10R1.18 C[C@@H](O)Cc1c[n]ccc1 Amb22896922 [0,0,0,0,0,0|2,0,1]=3 75 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [0,0,0,0,0,0|1,0,1]=2 76 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [0,0,0,0,0,0|2,0,1]=3 77 B10R1.18 C[C@H](N)Cc1cccc[n]1 Amb24451425 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [0,0,0,0,0,0|2,1,0]=3 79 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [0,0,0,0,0,0|2,1,0]=3 80 B10R1.18 C\C(\N)=C\c1cccc[n]1 Amb24518492 [0,0,0,0,0,0|3,0,1]=4 81 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [0,0,0,0,0,0|1,0,1]=2 82 B10R1.18 C\C(\O)=C\c1cccc[n]1 Amb24100261 [0,0,0,0,0,0|2,0,1]=3 83 B10R1.18 ClB(Cl)Cc1ccccc1 Amb25832795 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.18 ClB(Cl)Nc1ccccc1 Amb24658709 [0,0,0,0,0,0|4,0,0]=4 85 B10R1.18 ClC(Cl)=Nc1ccccc1 Amb22336308 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [0,0,0,0,0,0|2,0,1]=3 87 B10R1.18 ClC(Cl)Sc1ccccc1 Amb24389589 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.18 ClC(Cl)[SiH2]c1ccccc1 Amb22167700 [0,0,0,0,0,0|2,1,1]=4 89 B10R1.18 ClP(Cl)Cc1ccccc1 Amb25838123 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.18 FC(F)=Cc1cc[n]cc1 Amb24102681 [0,0,0,0,0,0|3,0,1]=4 91 B10R1.18 FC(F)=Cc1cccc[n]1 Amb24070038 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [0,0,0,0,0,0|2,0,1]=3 93 B10R1.18 FC(Sc1ccccc1)F Amb17232315 [0,0,0,0,0,0|3,0,1]=4 94 B10R1.18 F\C(\Br)=C\c1ccccc1 Amb24053589 [0,0,0,0,0,0|2,0,1]=3 95 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [0,0,0,0,0,0|2,0,0]=2 96 B10R1.18 NC(=N)Cc1cc[n]cc1 Amb22499359 [0,0,0,0,0,0|3,0,0]=3 97 B10R1.18 NC(=N)Cc1ccc[n]c1 Amb19890175 [0,0,0,0,0,0|3,0,0]=3 98 B10R1.18 NC(=N)Nc1cc[n]cc1 Amb22752815 [0,0,0,0,0,0|4,0,0]=4 99 B10R1.18 NC(=N)Nc1cccc[n]1 Amb24098501 [0,0,0,0,0,0|4,0,0]=4 100 B10R1.18 NC(=N)Nc1cccc[n]1 Amb25751134 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.18 NC(=N)Nc1ccccc1 Amb20249360 [0,0,0,0,0,0|3,0,0]=3 102 B10R1.18 NC(=N)Nc1ccccc1 Amb22732584 [0,0,0,0,0,0|3,0,0]=3 103 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.18 NC(=O)C[n+]1ccccn1 Amb2228091 [0,0,0,0,0,0|3,0,0]=3 105 B10R1.18 NC(=O)Cc1[n]ccc[n]1 Amb22277045 [0,0,0,0,0,0|3,0,0]=3 106 B10R1.18 NC(=O)Cc1c[n]c[n]c1 Amb20092728 [0,0,0,0,0,0|3,0,0]=3 107 B10R1.18 NC(=O)Cc1cc[n]c[n]1 Amb23440836 [0,0,0,0,0,0|3,0,0]=3 108 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [0,0,0,0,0,0|2,0,0]=2 109 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [0,0,0,0,0,0|1,0,0]=1 110 B10R1.18 NC(=O)Nc1cc[n]cc1 Amb23581130 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.18 NC(=O)Nc1ccc[n][n]1 Amb24645000 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [0,0,0,0,0,0|2,0,0]=2 113 B10R1.18 NC(=O)Nc1cccnc1 Amb1137270 [0,0,0,0,0,0|3,0,0]=3 114 B10R1.18 NC(=O)Oc1cccc[n]1 Amb25772133 [0,0,0,0,0,0|3,0,0]=3 115 B10R1.18 NC(=S)C[n+]1ccccc1 Amb17119656 [0,0,0,0,0,0|2,1,0]=3 116 B10R1.18 NC(=S)Cc1[n]ccc[n]1 Amb18796709 [0,0,0,0,0,0|3,1,0]=4 117 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [0,0,0,0,0,0|1,1,0]=2 118 B10R1.18 NC(=S)Nc1ccccn1 Amb1162454 [0,0,0,0,0,0|3,1,0]=4 119 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [0,0,0,0,0,0|3,0,0]=3 120 B10R1.18 NC(N)=Nc1cccc[n]1 Amb24451896 [0,0,0,0,0,0|4,0,0]=4 121 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [0,0,0,0,0,0|1,0,1]=2 122 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [0,0,0,0,0,0|3,0,0]=3 123 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [0,0,0,0,0,0|1,0,1]=2 124 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [0,0,0,0,0,0|1,0,1]=2 125 B10R1.18 N\C(\O)=C\c1cccc[n]1 Amb24068863 [0,0,0,0,0,0|2,0,1]=3 126 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [0,0,0,0,0,0|2,0,0]=2 127 B10R1.18 O=C(Cl)Cc1cc[n]cc1 Amb24446208 [0,0,0,0,0,0|2,0,0]=2 128 B10R1.18 O=C(Cl)Cc1ccc[n]c1 Amb24605722 [0,0,0,0,0,0|2,0,0]=2 129 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [0,0,0,0,0,0|2,0,0]=2 130 B10R1.18 O=C(Cl)Oc1c[n]cc[n]1 Amb25121175 [0,0,0,0,0,0|4,0,0]=4 131 B10R1.18 O=C(Cl)Sc1cccc[n]1 Amb25273872 [0,0,0,0,0,0|3,0,0]=3 132 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [0,0,0,0,0,0|2,0,0]=2 133 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [0,0,0,0,0,0|1,0,1]=2 134 B10R1.18 OB(O)Cc1c[n]ccc1 Amb24699248 [0,0,0,0,0,0|2,0,1]=3 135 B10R1.18 OB(O)Cc1cc[n]cc1 Amb24105357 [0,0,0,0,0,0|2,0,1]=3 136 B10R1.18 OC(=O)CC1=COCCO1 Amb24596866 [0,0,0,0,0,0|2,0,2]=4 137 B10R1.18 OC(=O)CC1CC=CCC1 Amb18643595 [0,0,0,0,0,0|0,0,4]=4 138 B10R1.18 OC(=O)CC1CCCC=C1 Amb18124573 [0,0,0,0,0,0|0,0,4]=4 139 B10R1.18 OC(=O)CC1CCOC=C1 Amb22015171 [0,0,0,0,0,0|1,0,3]=4 140 B10R1.18 OC(=O)CC=1CC=CCC1 Amb24120619 [0,0,0,0,0,0|0,0,2]=2 141 B10R1.18 OC(=O)CC=1COCCC1 Amb24661667 [0,0,0,0,0,0|1,0,3]=4 142 B10R1.18 OC(=O)CN1CC=CCC1 Amb18118539 [0,0,0,0,0,0|1,0,3]=4 143 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [0,0,0,0,0,0|0,0,0]=0 144 B10R1.18 OC(=O)C[C@@H]1CCCC=C1 Amb24427722 [0,0,0,0,0,0|0,0,4]=4 145 B10R1.18 OC(=O)C[C@H]1CCCC=C1 Amb25789979 [0,0,0,0,0,0|0,0,4]=4 146 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [0,0,0,0,0,0|1,0,0]=1 147 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [0,0,0,0,0,0|1,0,0]=1 148 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [0,0,0,0,0,0|1,0,0]=1 149 B10R1.18 OC(=O)Cc1[n][n]c[n][n]1 Amb18643482 [0,0,0,0,0,0|4,0,0]=4 150 B10R1.18 OC(=O)Cc1[n][n]cc[n]1 Amb18832133 [0,0,0,0,0,0|3,0,0]=3 151 B10R1.18 OC(=O)Cc1[n]c[n]c[n]1 Amb18223164 [0,0,0,0,0,0|3,0,0]=3 152 B10R1.18 OC(=O)Cc1c[n][n]c[n]1 Amb18832132 [0,0,0,0,0,0|3,0,0]=3 153 B10R1.18 OC(=O)Cc1c[n]cc[n]1 Amb19929342 [0,0,0,0,0,0|2,0,0]=2 154 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [0,0,0,0,0,0|1,0,0]=1 155 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [0,0,0,0,0,0|1,0,0]=1 156 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [0,0,0,0,0,0|1,0,0]=1 157 B10R1.18 OC(=O)Cc1cnccn1 Amb10602133 [0,0,0,0,0,0|2,0,0]=2 158 B10R1.18 OC(=O)Nc1[n]ccc[n]1 Amb24085046 [0,0,0,0,0,0|3,0,0]=3 159 B10R1.18 OC(=O)Nc1cc[n]cc1 Amb24070647 [0,0,0,0,0,0|2,0,0]=2 160 B10R1.18 OC(=O)Nc1ccc[n]c1 Amb24102579 [0,0,0,0,0,0|2,0,0]=2 161 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [0,0,0,0,0,0|0,0,0]=0 162 B10R1.18 OC(=O)\C=C/1\CCC=CC1 Amb24551051 [0,0,0,0,0,0|0,0,4]=4 163 B10R1.18 OC(=O)\C=C/1\CCCC=C1 Amb24502168 [0,0,0,0,0,0|0,0,4]=4 164 B10R1.18 OC(=O)\C=C\1/CCC=CC1 Amb24670048 [0,0,0,0,0,0|0,0,4]=4 165 B10R1.18 OC(=S)Cc1cc[n]cc1 Amb24099577 [0,0,0,0,0,0|1,1,0]=2 166 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [0,0,0,0,0,0|0,1,0]=1 167 B10R1.18 OC(=S)Nc1ccccc1 Amb24669066 [0,0,0,0,0,0|1,1,0]=2 168 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [0,0,0,0,0,0|1,0,1]=2 169 B10R1.18 OC(O)C[n+]1ccccc1 Amb25149726 [0,0,0,0,0,0|1,0,2]=3 170 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [0,0,0,0,0,0|0,0,2]=2 171 B10R1.18 OP(=O)Cc1cccc[n]1 Amb25787147 [0,0,0,0,0,0|2,0,0]=2 172 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [0,0,0,0,0,0|1,0,0]=1 173 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [0,0,0,0,0,0|2,0,0]=2 174 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [0,0,0,0,0,0|0,0,0]=0 175 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [0,0,0,0,0,0|0,0,0]=0 176 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [0,0,0,0,0,0|0,0,0]=0 177 B10R1.18 S=C(Cl)Cc1cc[n]cc1 Amb24401128 [0,0,0,0,0,0|2,1,0]=3 178 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [0,0,0,0,0,0|0,1,0]=1 179 B10R1.18 SC(=S)Nc1cccc[n]1 Amb25302011 [0,0,0,0,0,0|2,2,0]=4 180 B10R1.18 SC(=S)Nc1ccncc1 Amb10554331 [0,0,0,0,0,0|2,2,0]=4 181 B10R1.18 [2H]C([2H])=Cc1ccccc1 Amb22363280 [0,0,0,0,0,0|2,0,1]=3 182 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552724 [0,0,0,0,0,0|1,0,1]=2 183 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552757 [0,0,0,0,0,0|1,0,1]=2 184 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10573238 [0,0,0,0,0,0|1,0,1]=2 185 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb22345878 [0,0,0,0,0,0|1,0,1]=2 186 B10R1.18 [O-]C(=O)Cc1cc[n][n]c1 Amb22496781 [0,0,0,0,0,0|2,0,1]=3 187 B10R1.18 [O-]C(=O)Cc1cc[n][n]c1 Amb22899129 [0,0,0,0,0,0|2,0,1]=3 188 B10R1.18 [O-]C(=O)Cc1cc[n]c[n]1 Amb22755792 [0,0,0,0,0,0|2,0,1]=3 189 B10R1.18 [O-]C(=O)Cc1cc[n]c[n]1 Amb22899178 [0,0,0,0,0,0|2,0,1]=3 190 B10R1.18 [O-]C(=O)Cc1ccc[n][n]1 Amb22499484 [0,0,0,0,0,0|2,0,1]=3 191 B10R1.18 [O-]C(=O)Cc1ccc[n][n]1 Amb23439149 [0,0,0,0,0,0|2,0,1]=3 192 B10R1.18 [O-]C(=O)Cc1ccc[n]c1 Amb21618883 [0,0,0,0,0,0|1,0,1]=2 193 B10R1.18 [O-]C(=O)Cc1cccc[n]1 Amb22000882 [0,0,0,0,0,0|1,0,1]=2 194 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [0,0,0,0,0,0|0,0,1]=1 195 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [0,0,0,0,0,0|0,0,1]=1 196 B10R1.18 [O-]C(=O)NC=1C=CCC=C1 Amb24642585 [0,0,0,0,0,0|1,0,3]=4 197 B10R1.18 [O-][N+](=O)Cc1c[n]ccc1 Amb23589279 [0,0,0,0,0,0|2,0,1]=3 198 B10R1.18 [O-][N+](=O)Cc1cc[n]c[n]1 Amb24103020 [0,0,0,0,0,0|3,0,1]=4 199 B10R1.18 [O-][N+](=O)Cc1cc[n]cc1 Amb23589332 [0,0,0,0,0,0|2,0,1]=3 200 B10R1.18 [O-][N+](=O)Cc1cccc[n]1 Amb22522599 [0,0,0,0,0,0|2,0,1]=3 201 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [0,0,0,0,0,0|1,0,1]=2 202 B10R1.18 [O-][N+](=O)Nc1ccccc1 Amb17939349 [0,0,0,0,0,0|2,0,1]=3 203 B10R1.18 [O-][N+](=O)Nc1ccccn1 Amb1039528 [0,0,0,0,0,0|3,0,1]=4 204 B10R1.18 [O-][N+](=O)[N-][n+]1ccccc1 Amb10552476 [0,0,0,0,0,0|3,0,1]=4 205 B10R1.18 [O-][N+](O)=Cc1cccc[n]1 Amb24100496 [0,0,0,0,0,0|2,0,2]=4 206 B10R1.18 [O-]\[N+](=C/c1ccccc1)\C Amb2420785 [0,0,0,0,0,0|2,0,2]=4 207 B9R1.8 BOCc1cccc[n]1 Amb24406683 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 209 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [1,0,0,0,0,0|2,0,1]=4 210 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [1,0,0,0,0,0|2,0,1]=4 211 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [1,0,0,0,0,0|2,0,1]=4 212 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,1]=4 213 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,1]=4 214 B9R1.8 BrCNc1ccccc1 Amb25758335 [1,0,0,0,0,0|2,0,1]=4 215 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [1,0,0,0,0,0|2,0,0]=3 216 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [1,0,0,0,0,0|2,0,0]=3 217 B9R1.8 Br\C=C/c1c[n]ccc1 Amb24085678 [1,0,0,0,0,0|2,0,1]=4 218 B9R1.8 Br\C=C/c1cc[n]cc1 Amb25074029 [1,0,0,0,0,0|2,0,1]=4 219 B9R1.8 Br\C=C/c1cccc[n]1 Amb25200984 [1,0,0,0,0,0|2,0,1]=4 220 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,1]=3 221 B9R1.8 Br\C=C\c1c[n]ccc1 Amb24085662 [1,0,0,0,0,0|2,0,1]=4 222 B9R1.8 Br\C=C\c1cccc[n]1 Amb24546348 [1,0,0,0,0,0|2,0,1]=4 223 B9R1.8 C#CC[n+]1ccccc1 Amb2227878 [1,0,0,0,0,0|2,0,1]=4 224 B9R1.8 C#CCc1cc[n]cc1 Amb24478677 [1,0,0,0,0,0|2,0,1]=4 225 B9R1.8 C#CCc1cccc[n]1 Amb25759001 [1,0,0,0,0,0|2,0,1]=4 226 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|2,0,1]=4 227 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|2,0,1]=4 228 B9R1.8 C=CC[n+]1ccccc1 Amb10554482 [1,0,0,0,0,0|2,0,0]=3 229 B9R1.8 C=CC[n+]1ccccc1 Amb10573243 [1,0,0,0,0,0|2,0,0]=3 230 B9R1.8 C=CCc1c[n]cc[n]1 Amb24365743 [1,0,0,0,0,0|3,0,0]=4 231 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [1,0,0,0,0,0|2,0,0]=3 232 B9R1.8 C=CCc1cc[n]c[n]1 Amb24091172 [1,0,0,0,0,0|3,0,0]=4 233 B9R1.8 C=CNc1ccccc1 Amb24476658 [1,0,0,0,0,0|2,0,0]=3 234 B9R1.8 C=COc1c[n]ccc1 Amb24085952 [1,0,0,0,0,0|3,0,0]=4 235 B9R1.8 C=COc1cc[n]cc1 Amb24091446 [1,0,0,0,0,0|3,0,0]=4 236 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|2,0,0]=3 237 B9R1.8 C=CSc1c[n]ccc1 Amb24102618 [1,0,0,0,0,0|3,0,0]=4 238 B9R1.8 C=CSc1cc[n]cc1 Amb24070689 [1,0,0,0,0,0|3,0,0]=4 239 B9R1.8 C=C\C=C\1/C=CC=CN1 Amb24691445 [1,0,0,0,0,0|2,0,1]=4 240 B9R1.8 C=NCc1c[n]ccc1 Amb24062506 [1,0,0,0,0,0|3,0,0]=4 241 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|2,0,1]=4 242 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|1,0,1]=3 243 B9R1.8 CCNc1ccccc1 Amb22731692 [1,0,0,0,0,0|2,0,1]=4 244 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|3,0,0]=4 245 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|3,0,0]=4 246 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|3,0,0]=4 247 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|3,0,0]=4 248 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|3,0,0]=4 249 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|3,0,0]=4 250 B9R1.8 CNCc1ccncc1 Amb10576211 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|3,0,0]=4 252 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|3,0,0]=4 253 B9R1.8 CNSc1ccccc1 Amb25811332 [1,0,0,0,0,0|3,0,0]=4 254 B9R1.8 COC[n+]1ccccc1 Amb25309455 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.8 COCc1c[n]ccc1 Amb24106446 [1,0,0,0,0,0|3,0,0]=4 256 B9R1.8 COCc1cc[n]cc1 Amb24075931 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.8 COPc1ccccc1 Amb22729661 [1,0,0,0,0,0|3,0,0]=4 258 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [1,0,0,0,0,0|3,0,0]=4 259 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|2,0,0]=3 260 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [1,0,0,0,0,0|2,0,1]=4 261 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [1,0,0,0,0,0|2,0,1]=4 262 B9R1.8 C\C=C\[n+]1ccccc1 Amb22485619 [1,0,0,0,0,0|2,0,1]=4 263 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [1,0,0,0,0,0|2,0,1]=4 264 B9R1.8 C\C=N\c1cccc[n]1 Amb24533295 [1,0,0,0,0,0|3,0,0]=4 265 B9R1.8 ClC#Cc1ccccc1 Amb17670521 [1,0,0,0,0,0|1,0,2]=4 266 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [1,0,0,0,0,0|2,0,0]=3 267 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [1,0,0,0,0,0|2,0,1]=4 268 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [1,0,0,0,0,0|2,0,1]=4 269 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [1,0,0,0,0,0|2,0,1]=4 270 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [1,0,0,0,0,0|2,0,1]=4 271 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,1]=4 272 B9R1.8 ClCNc1ccccc1 Amb25836772 [1,0,0,0,0,0|2,0,1]=4 273 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|2,0,1]=4 274 B9R1.8 ClCPc1ccccc1 Amb25294535 [1,0,0,0,0,0|2,0,1]=4 275 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [1,0,0,0,0,0|1,1,1]=4 276 B9R1.8 ClSSc1ccccc1 Amb25248198 [1,0,0,0,0,0|3,0,0]=4 277 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [1,0,0,0,0,0|2,0,0]=3 278 B9R1.8 Cl[Zn]Cc1cccc[n]1 Amb22000362 [1,0,0,0,0,0|3,0,0]=4 279 B9R1.8 Cl\C=C/c1c[n]ccc1 Amb24085684 [1,0,0,0,0,0|2,0,1]=4 280 B9R1.8 Cl\C=C/c1cc[n]cc1 Amb24103276 [1,0,0,0,0,0|2,0,1]=4 281 B9R1.8 Cl\C=C/c1cccc[n]1 Amb24106765 [1,0,0,0,0,0|2,0,1]=4 282 B9R1.8 Cl\C=C\c1cccc[n]1 Amb24106741 [1,0,0,0,0,0|2,0,1]=4 283 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,1]=3 284 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [1,0,0,0,0,0|2,0,0]=3 285 B9R1.8 FC#Cc1ccccc1 Amb25080554 [1,0,0,0,0,0|1,0,2]=4 286 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [1,0,0,0,0,0|2,0,1]=4 287 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [1,0,0,0,0,0|2,0,1]=4 288 B9R1.8 FCCc1cccc[n]1 Amb24070130 [1,0,0,0,0,0|2,0,1]=4 289 B9R1.8 FCOc1ccccc1 Amb24099991 [1,0,0,0,0,0|2,0,1]=4 290 B9R1.8 F\C=C/c1cccc[n]1 Amb24106770 [1,0,0,0,0,0|2,0,1]=4 291 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,1]=3 292 B9R1.8 ICCc1cccc[n]1 Amb24573930 [1,0,0,0,0,0|2,0,1]=4 293 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [1,0,0,0,0,0|2,0,0]=3 294 B9R1.8 I\C=C\c1c[n]ccc1 Amb24628558 [1,0,0,0,0,0|2,0,1]=4 295 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,1]=3 296 B9R1.8 N#CC[n+]1ccccc1 Amb10554489 [1,0,0,0,0,0|2,0,1]=4 297 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|2,0,1]=4 298 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [1,0,0,0,0,0|1,0,1]=3 299 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [1,0,0,0,0,0|1,0,1]=3 300 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [1,0,0,0,0,0|1,0,1]=3 301 B9R1.8 N=CNc1cccc[n]1 Amb24073535 [1,0,0,0,0,0|3,0,0]=4 302 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [1,0,0,0,0,0|2,0,1]=4 303 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [1,0,0,0,0,0|2,0,1]=4 304 B9R1.8 NCCc1cccc[n]1 Amb24065228 [1,0,0,0,0,0|2,0,1]=4 305 B9R1.8 NCCc1cccc[n]1 Amb24066975 [1,0,0,0,0,0|2,0,1]=4 306 B9R1.8 NCCc1ccccc1 Amb17772283 [1,0,0,0,0,0|1,0,1]=3 307 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|1,0,1]=3 308 B9R1.8 NCCc1ccccc1 Amb22360716 [1,0,0,0,0,0|1,0,1]=3 309 B9R1.8 NCCc1ccccc1 Amb24325112 [1,0,0,0,0,0|1,0,1]=3 310 B9R1.8 NCCc1ccccc1 Amb24325408 [1,0,0,0,0,0|1,0,1]=3 311 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|2,0,1]=4 312 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|2,0,1]=4 313 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|2,0,1]=4 314 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|2,0,1]=4 315 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|2,0,1]=4 316 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|2,0,1]=4 317 B9R1.8 NCSc1ccccc1 Amb25128061 [1,0,0,0,0,0|2,0,1]=4 318 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [1,0,0,0,0,0|1,0,1]=3 319 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [1,0,0,0,0,0|3,0,0]=4 320 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [1,0,0,0,0,0|3,0,0]=4 321 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [1,0,0,0,0,0|3,0,0]=4 322 B9R1.8 NNCc1cccc[n]1 Amb19893254 [1,0,0,0,0,0|3,0,0]=4 323 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|2,0,0]=3 324 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|2,0,0]=3 325 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|2,0,0]=3 326 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|3,0,0]=4 327 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|3,0,0]=4 328 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|3,0,0]=4 329 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [1,0,0,0,0,0|3,0,0]=4 330 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [1,0,0,0,0,0|3,0,0]=4 331 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [1,0,0,0,0,0|3,0,0]=4 332 B9R1.8 NOCc1cccc[n]1 Amb18642195 [1,0,0,0,0,0|3,0,0]=4 333 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,0]=3 334 B9R1.8 NOCc1ccccc1 Amb16204809 [1,0,0,0,0,0|2,0,0]=3 335 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,0]=3 336 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [1,0,0,0,0,0|1,0,1]=3 337 B9R1.8 N\C=C/c1cc[n]cc1 Amb24068867 [1,0,0,0,0,0|2,0,1]=4 338 B9R1.8 N\C=C\c1cc[n]cc1 Amb24749618 [1,0,0,0,0,0|2,0,1]=4 339 B9R1.8 N\C=C\c1cccc[n]1 Amb24518526 [1,0,0,0,0,0|2,0,1]=4 340 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|2,0,0]=3 341 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [1,0,0,0,0,0|2,0,1]=4 342 B9R1.8 O/N=N/c1ccccn1 Amb17940654 [1,0,0,0,0,0|3,0,0]=4 343 B9R1.8 O=C=Cc1cc[n]cc1 Amb24100723 [1,0,0,0,0,0|1,0,2]=4 344 B9R1.8 O=C=Cc1cccc[n]1 Amb24070207 [1,0,0,0,0,0|1,0,2]=4 345 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [1,0,0,0,0,0|0,0,2]=3 346 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [1,0,0,0,0,0|1,0,1]=3 347 B9R1.8 O=CCc1[n]ccc[n]1 Amb24061341 [1,0,0,0,0,0|2,0,0]=3 348 B9R1.8 O=CCc1c[n]c[n]c1 Amb24634482 [1,0,0,0,0,0|2,0,0]=3 349 B9R1.8 O=CCc1c[n]cc[n]1 Amb25124492 [1,0,0,0,0,0|2,0,0]=3 350 B9R1.8 O=CCc1cc[n]c[n]1 Amb24099612 [1,0,0,0,0,0|2,0,0]=3 351 B9R1.8 O=CCc1ccc[n][n]1 Amb24682971 [1,0,0,0,0,0|2,0,0]=3 352 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|1,0,0]=2 353 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|1,0,0]=2 354 B9R1.8 O=CNc1c[n]c[n]c1 Amb24095248 [1,0,0,0,0,0|3,0,0]=4 355 B9R1.8 O=CNc1c[n]cc[n]1 Amb24698276 [1,0,0,0,0,0|3,0,0]=4 356 B9R1.8 O=COc1c[n]ccc1 Amb25299157 [1,0,0,0,0,0|2,0,0]=3 357 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|1,0,0]=2 358 B9R1.8 O=C\C=C/1\C=CC=CN1 Amb24068319 [1,0,0,0,0,0|1,0,1]=3 359 B9R1.8 O=C\C=C/1\C=CNC=N1 Amb24068339 [1,0,0,0,0,0|2,0,1]=4 360 B9R1.8 O=C\C=C\1/C=CC=NN1 Amb24596682 [1,0,0,0,0,0|2,0,1]=4 361 B9R1.8 O=C\C=C\1/NC=CC=N1 Amb24100373 [1,0,0,0,0,0|2,0,1]=4 362 B9R1.8 O=S=Nc1cc[n]cc1 Amb25147155 [1,0,0,0,0,0|3,0,0]=4 363 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [1,0,0,0,0,0|1,0,1]=3 364 B9R1.8 OCCc1[n]ccc[n]1 Amb22896758 [1,0,0,0,0,0|2,0,1]=4 365 B9R1.8 OCCc1c[n][n]cc1 Amb23559765 [1,0,0,0,0,0|2,0,1]=4 366 B9R1.8 OCCc1c[n]c[n]c1 Amb20240921 [1,0,0,0,0,0|2,0,1]=4 367 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [1,0,0,0,0,0|1,0,1]=3 368 B9R1.8 OCCc1ccc[n][n]1 Amb25086060 [1,0,0,0,0,0|2,0,1]=4 369 B9R1.8 OCCc1ccncn1 Amb17593271 [1,0,0,0,0,0|2,0,1]=4 370 B9R1.8 OCNc1cccc[n]1 Amb25066721 [1,0,0,0,0,0|2,0,1]=4 371 B9R1.8 OCOc1ccccc1 Amb25847006 [1,0,0,0,0,0|1,0,1]=3 372 B9R1.8 ON=Cc1ccccn1 Amb10573542 [1,0,0,0,0,0|2,0,1]=4 373 B9R1.8 ON=Cc1ccncc1 Amb10075320 [1,0,0,0,0,0|2,0,1]=4 374 B9R1.8 ONCc1[n]ccc[n]1 Amb23586395 [1,0,0,0,0,0|3,0,0]=4 375 B9R1.8 ONCc1c[n][n]cc1 Amb23586390 [1,0,0,0,0,0|3,0,0]=4 376 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [1,0,0,0,0,0|2,0,0]=3 377 B9R1.8 ONCc1cc[n]c[n]1 Amb23586394 [1,0,0,0,0,0|3,0,0]=4 378 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [1,0,0,0,0,0|2,0,0]=3 379 B9R1.8 ONCc1ccc[n][n]1 Amb23586391 [1,0,0,0,0,0|3,0,0]=4 380 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|1,0,0]=2 381 B9R1.8 O\N=C/c1c[n]ccc1 Amb24611619 [1,0,0,0,0,0|2,0,1]=4 382 B9R1.8 O\N=C/c1ccccn1 Amb10069892 [1,0,0,0,0,0|2,0,1]=4 383 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|1,0,1]=3 384 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [1,0,0,0,0,0|2,0,1]=4 385 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [1,0,0,0,0,0|0,1,2]=4 386 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,1,1]=4 387 B9R1.8 S=CNc1cccc[n]1 Amb25785094 [1,0,0,0,0,0|2,1,0]=4 388 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,1,0]=3 389 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [1,0,0,0,0,0|1,1,1]=4 390 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|1,1,1]=4 391 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|1,1,1]=4 392 B9R1.8 [2H]C#Cc1ccccc1 Amb22351662 [1,0,0,0,0,0|1,0,2]=4 393 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [1,0,0,0,0,0|1,0,1]=3 394 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [1,0,0,0,0,0|1,0,1]=3 395 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|2,0,0]=3 396 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|3,0,0]=4 397 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|3,0,0]=4 398 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|3,0,0]=4 399 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [1,0,0,0,0,0|1,0,1]=3 400 B9R1.8 [Cu]C#Cc1ccccc1 Amb2480676 [1,0,0,0,0,0|1,0,2]=4 401 B9R1.8 [Li]C#Cc1ccccc1 Amb22336681 [1,0,0,0,0,0|1,0,2]=4 402 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|2,0,1]=4 403 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [1,0,0,0,0,0|2,0,1]=4 404 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|1,0,1]=3 405 B11R1.20 BrC(=Cc1ccc(cc1)Cl)Br Amb10575986 [0,1,0,0,0,0|2,0,1]=4 406 B11R1.20 C=C(Br)CN1C=CC(=O)C=C1 Amb25142299 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.20 CC(=C)CN1C=CC(=O)C=C1 Amb25076881 [0,1,0,0,0,0|3,0,0]=4 408 B11R1.20 CC(=Cc1ccc(cc1)O)C Amb1333686 [0,1,0,0,0,0|2,0,1]=4 409 B11R1.20 CC(=N)Nc1ccc(Cl)cc1 Amb24477671 [0,1,0,0,0,0|3,0,0]=4 410 B11R1.20 CC(=O)CN1C=CC(=O)C=C1 Amb18787428 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.20 CC(=O)C[n+]1ccc(cc1)C Amb10573522 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.20 CC(=O)Cc1ccc(Cl)c[n]1 Amb23437495 [0,1,0,0,0,0|2,0,0]=3 413 B11R1.20 CC(=O)Cc1ccc(F)[n]c1 Amb25733918 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.20 CC(=O)Cc1ccc(N)[n]c1 Amb18201937 [0,1,0,0,0,0|2,0,0]=3 415 B11R1.20 CC(=O)Cc1ccc(cn1)C Amb10607335 [0,1,0,0,0,0|2,0,0]=3 416 B11R1.20 CC(=O)Cc1ccc(nc1)Cl Amb10976126 [0,1,0,0,0,0|2,0,0]=3 417 B11R1.20 CC(=O)NC1C=CC(=O)C=C1 Amb25695875 [0,1,0,0,0,0|2,0,1]=4 418 B11R1.20 CC(=O)N[13c]1[13cH][13cH][13c]([13cH][13cH]1)Cl Amb17610795 [0,1,0,0,0,0|2,0,0]=3 419 B11R1.20 CC(=O)Nc1cc[n+](cc1)[O-] Amb10552789 [0,1,0,0,0,0|3,0,0]=4 420 B11R1.20 CC(=O)Nc1ccc(Cl)[n]c1 Amb24121741 [0,1,0,0,0,0|3,0,0]=4 421 B11R1.20 CC(=O)Nc1ccc(F)[n]c1 Amb24486081 [0,1,0,0,0,0|3,0,0]=4 422 B11R1.20 CC(=O)Nc1ccc(N)[n]c1 Amb18949287 [0,1,0,0,0,0|3,0,0]=4 423 B11R1.20 CC(=O)Nc1ccc(O)[n]c1 Amb22752688 [0,1,0,0,0,0|3,0,0]=4 424 B11R1.20 CC(=O)Nc1ccc(O)c[n]1 Amb22002364 [0,1,0,0,0,0|3,0,0]=4 425 B11R1.20 CC(=O)Nc1ccc([NH3+])cc1 Amb24113861 [0,1,0,0,0,0|2,0,0]=3 426 B11R1.20 CC(=O)Nc1ccc(cc1)N Amb1208563 [0,1,0,0,0,0|2,0,0]=3 427 B11R1.20 CC(=O)Nc1ccc(cc1)O Amb1209347 [0,1,0,0,0,0|2,0,0]=3 428 B11R1.20 CC(=O)Nc1ccc(cn1)Cl Amb1808922 [0,1,0,0,0,0|3,0,0]=4 429 B11R1.20 CC(=O)Nc1ccc(cn1)I Amb2054963 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.20 CC(=O)Nc1ccc(nc1)Br Amb10071320 [0,1,0,0,0,0|3,0,0]=4 431 B11R1.20 CC(=O)Nc1ccc(nc1)I Amb10608890 [0,1,0,0,0,0|3,0,0]=4 432 B11R1.20 CC(=O)Nc1ccc(nc1)S Amb10569732 [0,1,0,0,0,0|3,0,0]=4 433 B11R1.20 CC(=O)Oc1ccc(Br)[n]c1 Amb20617838 [0,1,0,0,0,0|3,0,0]=4 434 B11R1.20 CC(=O)Oc1ccc(Br)c[n]1 Amb25149038 [0,1,0,0,0,0|3,0,0]=4 435 B11R1.20 CC(=O)Oc1ccc(F)[n]c1 Amb25689698 [0,1,0,0,0,0|3,0,0]=4 436 B11R1.20 CC(=O)Oc1ccc(I)cc1 Amb25330825 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.20 CC(=O)Oc1ccc(N)cc1 Amb18125232 [0,1,0,0,0,0|2,0,0]=3 438 B11R1.20 CC(=O)Oc1ccc(cc1)O Amb10843589 [0,1,0,0,0,0|2,0,0]=3 439 B11R1.20 CC(=O)Oc1ccc(cc1)[*] Amb22045256 [0,1,0,0,0,0|2,0,0]=3 440 B11R1.20 CC(=O)Sc1ccc(C)cc1 Amb17741675 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.20 CC(=O)Sc1ccc(Cl)cc1 Amb24433357 [0,1,0,0,0,0|2,0,0]=3 442 B11R1.20 CC(=O)Sc1ccc(F)cc1 Amb25348487 [0,1,0,0,0,0|2,0,0]=3 443 B11R1.20 CC(=O)Sc1ccc(I)cc1 Amb22344406 [0,1,0,0,0,0|2,0,0]=3 444 B11R1.20 CC(=O)Sc1ccc(cc1)Br Amb1394995 [0,1,0,0,0,0|2,0,0]=3 445 B11R1.20 CC(=S)Nc1ccc(cc1)C Amb2553853 [0,1,0,0,0,0|2,1,0]=4 446 B11R1.20 CC(=S)Nc1ccc(cc1)F Amb2373818 [0,1,0,0,0,0|2,1,0]=4 447 B11R1.20 CC(=S)Oc1ccc(Br)cc1 Amb24637638 [0,1,0,0,0,0|2,1,0]=4 448 B11R1.20 CC(Br)Cc1ccc(Br)cc1 Amb18049388 [0,1,0,0,0,0|2,0,1]=4 449 B11R1.20 CC(Br)Cc1ccc(Cl)cc1 Amb25832281 [0,1,0,0,0,0|2,0,1]=4 450 B11R1.20 CC(C)=Cc1ccc(C)cc1 Amb24484512 [0,1,0,0,0,0|2,0,1]=4 451 B11R1.20 CC(C)=Cc1ccc(N)cc1 Amb18124842 [0,1,0,0,0,0|2,0,1]=4 452 B11R1.20 CC(C)=Nc1ccc(N)cc1 Amb24761154 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.20 CC(C)Cc1ccc(Cl)cc1 Amb22750460 [0,1,0,0,0,0|2,0,1]=4 454 B11R1.20 CC(C)Cc1ccc(I)cc1 Amb22750462 [0,1,0,0,0,0|2,0,1]=4 455 B11R1.20 CC(C)Cc1ccc(N)cc1 Amb20668373 [0,1,0,0,0,0|2,0,1]=4 456 B11R1.20 CC(C)Cc1ccc(O)cc1 Amb17779015 [0,1,0,0,0,0|2,0,1]=4 457 B11R1.20 CC(Cc1ccc(cc1)Br)Cl Amb17477731 [0,1,0,0,0,0|2,0,1]=4 458 B11R1.20 CC(Cc1ccc(cc1)Br)N Amb10205335 [0,1,0,0,0,0|2,0,1]=4 459 B11R1.20 CC(Cc1ccc(cc1)Br)O Amb17477716 [0,1,0,0,0,0|1,0,1]=3 460 B11R1.20 CC(Cc1ccc(cc1)C)Cl Amb17477591 [0,1,0,0,0,0|2,0,1]=4 461 B11R1.20 CC(Cc1ccc(cc1)C)O Amb17138431 [0,1,0,0,0,0|1,0,1]=3 462 B11R1.20 CC(Cc1ccc(cc1)Cl)Cl Amb17477736 [0,1,0,0,0,0|2,0,1]=4 463 B11R1.20 CC(Cc1ccc(cc1)Cl)O Amb17138670 [0,1,0,0,0,0|1,0,1]=3 464 B11R1.20 CC(Cc1ccc(cc1)F)Cl Amb17477738 [0,1,0,0,0,0|2,0,1]=4 465 B11R1.20 CC(Cc1ccc(cc1)F)N Amb10605742 [0,1,0,0,0,0|2,0,1]=4 466 B11R1.20 CC(Cc1ccc(cc1)F)O Amb17138452 [0,1,0,0,0,0|1,0,1]=3 467 B11R1.20 CC(Cc1ccc(cc1)N)C Amb1133124 [0,1,0,0,0,0|2,0,1]=4 468 B11R1.20 CC(Cl)Cc1ccc(I)cc1 Amb24573927 [0,1,0,0,0,0|2,0,1]=4 469 B11R1.20 CC(F)Cc1ccc(Br)cc1 Amb25247565 [0,1,0,0,0,0|2,0,1]=4 470 B11R1.20 CC(O)CN1C=CC(=O)C=C1 Amb18177255 [0,1,0,0,0,0|2,0,1]=4 471 B11R1.20 CC(O)Cc1ccc(Br)c[n]1 Amb25220757 [0,1,0,0,0,0|2,0,1]=4 472 B11R1.20 CC(O)Cc1ccc(I)cc1 Amb25277831 [0,1,0,0,0,0|1,0,1]=3 473 B11R1.20 CC(O)Cc1ccc(O)cc1 Amb25265892 [0,1,0,0,0,0|1,0,1]=3 474 B11R1.20 CC(O)Nc1ccc(Cl)cc1 Amb25687581 [0,1,0,0,0,0|2,0,1]=4 475 B11R1.20 CC(O)Oc1ccc(O)cc1 Amb24752465 [0,1,0,0,0,0|2,0,1]=4 476 B11R1.20 CC(O)Sc1ccc(F)cc1 Amb24079187 [0,1,0,0,0,0|2,0,1]=4 477 B11R1.20 CC(S)Cc1ccc(F)cc1 Amb24577187 [0,1,0,0,0,0|1,1,1]=4 478 B11R1.20 CN(C)Cc1ccc(C)cc1 Amb17663830 [0,1,0,0,0,0|3,0,0]=4 479 B11R1.20 CN(C)Cc1ccc(Cl)cc1 Amb22900098 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.20 CN(C)Cc1ccc(F)cc1 Amb25189644 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.20 CN(C)Cc1ccc(S)cc1 Amb19649791 [0,1,0,0,0,0|3,0,0]=4 482 B11R1.20 CN(Cc1ccc(cc1)Br)C Amb2447334 [0,1,0,0,0,0|3,0,0]=4 483 B11R1.20 CN(Cc1ccc(cc1)I)C Amb10070277 [0,1,0,0,0,0|3,0,0]=4 484 B11R1.20 CN(Cc1ccc(cc1)N)C Amb1136045 [0,1,0,0,0,0|3,0,0]=4 485 B11R1.20 CN(Cc1ccc(cc1)O)C Amb1803821 [0,1,0,0,0,0|3,0,0]=4 486 B11R1.20 CN(N)Cc1ccc(Br)cc1 Amb18569747 [0,1,0,0,0,0|3,0,0]=4 487 B11R1.20 CN(N)Cc1ccc(Cl)cc1 Amb18563956 [0,1,0,0,0,0|3,0,0]=4 488 B11R1.20 CN(N)Cc1ccc(F)cc1 Amb18065411 [0,1,0,0,0,0|3,0,0]=4 489 B11R1.20 CN(O)Cc1ccc(Br)c[n]1 Amb25318683 [0,1,0,0,0,0|3,0,0]=4 490 B11R1.20 CS(=O)Cc1ccc(Cl)[n]c1 Amb25227089 [0,1,0,0,0,0|3,0,0]=4 491 B11R1.20 CS(=O)Cc1ccc(N)cc1 Amb18952403 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.20 CS(=O)Nc1ccc(Br)cc1 Amb24601287 [0,1,0,0,0,0|3,0,0]=4 493 B11R1.20 CS(=O)Nc1ccc(I)cc1 Amb25177241 [0,1,0,0,0,0|3,0,0]=4 494 B11R1.20 CS(=O)Nc1ccc(N)cc1 Amb25359575 [0,1,0,0,0,0|3,0,0]=4 495 B11R1.20 C[C@@H](N)Cc1ccc(N)cc1 Amb24646766 [0,1,0,0,0,0|2,0,1]=4 496 B11R1.20 C[C@@H](O)CN1C=CC(=O)C=C1 Amb25151863 [0,1,0,0,0,0|2,0,1]=4 497 B11R1.20 C[C@@H](O)Cc1ccc(F)cc1 Amb24068203 [0,1,0,0,0,0|1,0,1]=3 498 B11R1.20 C[C@@H](O)Cc1ccc(N)cc1 Amb25064736 [0,1,0,0,0,0|1,0,1]=3 499 B11R1.20 C[C@H](N)Cc1ccc(N)cc1 Amb24485923 [0,1,0,0,0,0|2,0,1]=4 500 B11R1.20 C[C@H](N)Cc1ccc(O)cc1 Amb25172822 [0,1,0,0,0,0|2,0,1]=4 501 B11R1.20 C[C@H](O)Cc1ccc(Cl)cc1 Amb24421443 [0,1,0,0,0,0|1,0,1]=3 502 B11R1.20 C\C(\N)=C\c1ccc(Cl)cc1 Amb25028102 [0,1,0,0,0,0|2,0,1]=4 503 B11R1.20 C\C(\N)=N\c1ccc(Br)cc1 Amb24311042 [0,1,0,0,0,0|3,0,0]=4 504 B11R1.20 C\C(\O)=C\c1ccc(F)cc1 Amb24100279 [0,1,0,0,0,0|1,0,1]=3 505 B11R1.20 Cc1[n]cc(CC(N)=O)c[n]1 Amb20092734 [0,1,0,0,0,0|3,0,0]=4 506 B11R1.20 Cc1[n]cc(CC(O)=O)[n][n]1 Amb18201150 [0,1,0,0,0,0|3,0,0]=4 507 B11R1.20 Cc1[n]cc(CC(O)=O)c[n]1 Amb18201416 [0,1,0,0,0,0|2,0,0]=3 508 B11R1.20 Cc1c[n]c(CC(C)=O)c[n]1 Amb25234305 [0,1,0,0,0,0|3,0,0]=4 509 B11R1.20 Cc1c[n]c(CC(O)=O)[n][n]1 Amb18201171 [0,1,0,0,0,0|3,0,0]=4 510 B11R1.20 Cc1c[n]c(CC(O)=O)c[n]1 Amb18201438 [0,1,0,0,0,0|2,0,0]=3 511 B11R1.20 Cc1cc[n+](CC(=C)Cl)cc1 Amb25127581 [0,1,0,0,0,0|3,0,0]=4 512 B11R1.20 Cc1ccc(C=C(Br)Br)cc1 Amb18117913 [0,1,0,0,0,0|2,0,1]=4 513 B11R1.20 Cc1ccc(CC(C)=C)c[n]1 Amb24484467 [0,1,0,0,0,0|3,0,0]=4 514 B11R1.20 Cc1ccc(CC(C)C)cc1 Amb24064801 [0,1,0,0,0,0|2,0,1]=4 515 B11R1.20 Cc1ccc(CC(C)N)cc1 Amb22055742 [0,1,0,0,0,0|2,0,1]=4 516 B11R1.20 Cc1ccc(CC(Cl)Cl)cc1 Amb24710113 [0,1,0,0,0,0|2,0,1]=4 517 B11R1.20 Cc1ccc(CC(N)=O)c[n]1 Amb25027878 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.20 Cc1ccc(CC(O)=O)[n][n]1 Amb18201450 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.20 Cc1ccc(CC(O)=O)[n]c1 Amb18201731 [0,1,0,0,0,0|1,0,0]=2 520 B11R1.20 Cc1ccc(CC(O)=O)[n]c1 Amb22495844 [0,1,0,0,0,0|1,0,0]=2 521 B11R1.20 Cc1ccc(CC(O)=O)cc1 Amb22434999 [0,1,0,0,0,0|0,0,0]=1 522 B11R1.20 Cc1ccc(CC(O)=S)cc1 Amb22229853 [0,1,0,0,0,0|0,1,0]=2 523 B11R1.20 Cc1ccc(CN(C)N)cc1 Amb18065318 [0,1,0,0,0,0|3,0,0]=4 524 B11R1.20 Cc1ccc(C[C@@H](C)N)cc1 Amb25141953 [0,1,0,0,0,0|2,0,1]=4 525 B11R1.20 Cc1ccc(NC(N)=O)[n]c1 Amb24390796 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.20 Cc1ccc(NC(S)=N)cc1 Amb17938675 [0,1,0,0,0,0|2,1,0]=4 527 B11R1.20 Cc1ccc([n]c1)OC(C)=O Amb25337544 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.20 Cc1ccc(\C=C(/C)\N)cc1 Amb25111949 [0,1,0,0,0,0|2,0,1]=4 529 B11R1.20 Cc1ccc(c[n]1)NC(C)=O Amb20248220 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.20 Cc1ccc(c[n]1)OC(C)=O Amb24103883 [0,1,0,0,0,0|3,0,0]=4 531 B11R1.20 Cc1ccc(cc1)NC(=N)Cl Amb25725948 [0,1,0,0,0,0|3,0,0]=4 532 B11R1.20 Cc1ccc(cc1)NC(=N)[NH3+] Amb22480234 [0,1,0,0,0,0|3,0,0]=4 533 B11R1.20 Cc1ccc(cc1)NC(=O)Cl Amb24419875 [0,1,0,0,0,0|2,0,0]=3 534 B11R1.20 Cc1ccc(cc1)NC(=O)F Amb25277105 [0,1,0,0,0,0|2,0,0]=3 535 B11R1.20 Cc1ccc(cc1)NC(C)=C Amb24374732 [0,1,0,0,0,0|3,0,0]=4 536 B11R1.20 Cc1ccc(cc1)NC(C)=N Amb25761000 [0,1,0,0,0,0|3,0,0]=4 537 B11R1.20 Cc1ccc(cc1)NC(C)O Amb24571159 [0,1,0,0,0,0|2,0,1]=4 538 B11R1.20 Cc1ccc(cc1)NC(N)=N Amb20249361 [0,1,0,0,0,0|3,0,0]=4 539 B11R1.20 Cc1ccc(cc1)NC(N)=N Amb22757010 [0,1,0,0,0,0|3,0,0]=4 540 B11R1.20 Cc1ccc(cc1)NC([S-])=S Amb22757808 [0,1,0,0,0,0|1,2,0]=4 541 B11R1.20 Cc1ccc(cc1)OC(N)=N Amb24484851 [0,1,0,0,0,0|3,0,0]=4 542 B11R1.20 Cc1ccc(cc1)SC(C)O Amb25032605 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.20 Cc1ccc(cc1)SC(N)=N Amb24747710 [0,1,0,0,0,0|3,0,0]=4 544 B11R1.20 ClC(=O)Cc1ccc(cc1)Cl Amb1680103 [0,1,0,0,0,0|1,0,0]=2 545 B11R1.20 ClC(=O)Oc1ccc(cc1)Cl Amb10068923 [0,1,0,0,0,0|2,0,0]=3 546 B11R1.20 FC(F)=Cc1ccc(Br)cc1 Amb22493936 [0,1,0,0,0,0|2,0,1]=4 547 B11R1.20 F\C(\Br)=C\c1ccc(Br)cc1 Amb24053591 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.20 F\C(\Br)=C\c1ccc(Cl)cc1 Amb24053592 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.20 Fc1ccc(C=C(Br)Br)cc1 Amb18115317 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.20 N=C(O)Nc1ccc(Cl)cc1 Amb24063643 [0,1,0,0,0,0|2,0,0]=3 551 B11R1.20 N=C([NH3+])Nc1ccc(Cl)cc1 Amb22480232 [0,1,0,0,0,0|3,0,0]=4 552 B11R1.20 N=C([NH3+])Nc1ccc(F)cc1 Amb22467971 [0,1,0,0,0,0|3,0,0]=4 553 B11R1.20 NC(=N)Cc1ccc(Cl)[n]c1 Amb25169276 [0,1,0,0,0,0|3,0,0]=4 554 B11R1.20 NC(=N)Cc1ccc(F)[n]c1 Amb22898922 [0,1,0,0,0,0|3,0,0]=4 555 B11R1.20 NC(=N)Cc1ccc(cc1)F Amb2183302 [0,1,0,0,0,0|2,0,0]=3 556 B11R1.20 NC(=N)Nc1ccc(Cl)cc1 Amb22734127 [0,1,0,0,0,0|3,0,0]=4 557 B11R1.20 NC(=N)Nc1ccc(Cl)cc1 Amb24079151 [0,1,0,0,0,0|3,0,0]=4 558 B11R1.20 NC(=N)Nc1ccc(I)cc1 Amb22831667 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.20 NC(=N)Nc1ccc(I)cc1 Amb25353279 [0,1,0,0,0,0|3,0,0]=4 560 B11R1.20 NC(=N)Nc1ccc(cc1)Br Amb10879724 [0,1,0,0,0,0|3,0,0]=4 561 B11R1.20 NC(=N)Nc1ccc(cc1)C Amb16227208 [0,1,0,0,0,0|3,0,0]=4 562 B11R1.20 NC(=N)Sc1ccc(Br)cc1 Amb24618904 [0,1,0,0,0,0|3,0,0]=4 563 B11R1.20 NC(=N)Sc1ccc(Cl)cc1 Amb19878115 [0,1,0,0,0,0|3,0,0]=4 564 B11R1.20 NC(=N)[NH2+]c1ccc(Cl)cc1 Amb22269906 [0,1,0,0,0,0|3,0,0]=4 565 B11R1.20 NC(=N)[NH2+]c1ccc(F)cc1 Amb25746854 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.20 NC(=Nc1ccc(cc1)Cl)N Amb10070760 [0,1,0,0,0,0|3,0,0]=4 567 B11R1.20 NC(=O)CN1C=CC(=O)C=C1 Amb18177192 [0,1,0,0,0,0|2,0,0]=3 568 B11R1.20 NC(=O)Cc1[n]cc(Br)c[n]1 Amb22494640 [0,1,0,0,0,0|3,0,0]=4 569 B11R1.20 NC(=O)Cc1ccc(Br)c[n]1 Amb22497485 [0,1,0,0,0,0|2,0,0]=3 570 B11R1.20 NC(=O)Cc1ccc(Cl)[n][n]1 Amb24611626 [0,1,0,0,0,0|3,0,0]=4 571 B11R1.20 NC(=O)Cc1ccc(Cl)c[n]1 Amb23403387 [0,1,0,0,0,0|2,0,0]=3 572 B11R1.20 NC(=O)Cc1ccc(S)cc1 Amb25148336 [0,1,0,0,0,0|1,0,0]=2 573 B11R1.20 NC(=O)Cc1ccc(cc1)N Amb1121163 [0,1,0,0,0,0|1,0,0]=2 574 B11R1.20 NC(=O)NC=1C=CC(=O)NC1 Amb25705385 [0,1,0,0,0,0|3,0,0]=4 575 B11R1.20 NC(=O)Nc1ccc(Br)[n]c1 Amb25084128 [0,1,0,0,0,0|3,0,0]=4 576 B11R1.20 NC(=O)Nc1ccc(Br)c[n]1 Amb22491202 [0,1,0,0,0,0|3,0,0]=4 577 B11R1.20 NC(=O)Nc1ccc(Cl)[n]c1 Amb25852585 [0,1,0,0,0,0|3,0,0]=4 578 B11R1.20 NC(=O)Nc1ccc(Cl)c[n]1 Amb24756948 [0,1,0,0,0,0|3,0,0]=4 579 B11R1.20 NC(=O)Nc1ccc(F)[n]c1 Amb24718048 [0,1,0,0,0,0|3,0,0]=4 580 B11R1.20 NC(=O)Nc1ccc(cc1)Br Amb1215049 [0,1,0,0,0,0|2,0,0]=3 581 B11R1.20 NC(=O)Nc1ccc(cc1)C Amb1195893 [0,1,0,0,0,0|2,0,0]=3 582 B11R1.20 NC(=O)Nc1ccc(cc1)Cl Amb1195894 [0,1,0,0,0,0|2,0,0]=3 583 B11R1.20 NC(=O)Nc1ccc(cc1)F Amb1130731 [0,1,0,0,0,0|2,0,0]=3 584 B11R1.20 NC(=O)Nc1ccc(cc1)I Amb1144373 [0,1,0,0,0,0|2,0,0]=3 585 B11R1.20 NC(=O)Nc1ccc(cc1)N Amb1116957 [0,1,0,0,0,0|2,0,0]=3 586 B11R1.20 NC(=O)Nc1ccc(cn1)I Amb2428882 [0,1,0,0,0,0|3,0,0]=4 587 B11R1.20 NC(=O)Oc1ccc(Br)cc1 Amb25790618 [0,1,0,0,0,0|2,0,0]=3 588 B11R1.20 NC(=O)Oc1ccc(cc1)Cl Amb10575589 [0,1,0,0,0,0|2,0,0]=3 589 B11R1.20 NC(=S)CN1C=CC(=O)C=C1 Amb18534872 [0,1,0,0,0,0|2,1,0]=4 590 B11R1.20 NC(=S)C[n+]1ccc(cc1)C Amb17119670 [0,1,0,0,0,0|2,1,0]=4 591 B11R1.20 NC(=S)Cc1ccc(Br)c[n]1 Amb24397341 [0,1,0,0,0,0|2,1,0]=4 592 B11R1.20 NC(=S)Cc1ccc(cc1)Cl Amb1116565 [0,1,0,0,0,0|1,1,0]=3 593 B11R1.20 NC(=S)Cc1ccc(cc1)O Amb1112056 [0,1,0,0,0,0|1,1,0]=3 594 B11R1.20 NC(=S)Nc1ccc(cc1)C Amb1042391 [0,1,0,0,0,0|2,1,0]=4 595 B11R1.20 NC(=S)Nc1ccc(cc1)Cl Amb1105896 [0,1,0,0,0,0|2,1,0]=4 596 B11R1.20 NC(=S)Nc1ccc(cc1)F Amb1106146 [0,1,0,0,0,0|2,1,0]=4 597 B11R1.20 NC(=S)Nc1ccc(cc1)N Amb1816858 [0,1,0,0,0,0|2,1,0]=4 598 B11R1.20 NC(=S)Nc1ccc(cc1)O Amb1263735 [0,1,0,0,0,0|2,1,0]=4 599 B11R1.20 NC(=S)Oc1ccc(Cl)cc1 Amb24487983 [0,1,0,0,0,0|2,1,0]=4 600 B11R1.20 NC(N)=Nc1ccc(Cl)cc1 Amb22736536 [0,1,0,0,0,0|3,0,0]=4 601 B11R1.20 NC(O)Cc1ccc(O)cc1 Amb24102717 [0,1,0,0,0,0|1,0,1]=3 602 B11R1.20 Nc1c[n]c(CC(N)=O)[n]c1 Amb18952124 [0,1,0,0,0,0|3,0,0]=4 603 B11R1.20 Nc1c[n]c(CC(O)=O)[n]c1 Amb18201152 [0,1,0,0,0,0|2,0,0]=3 604 B11R1.20 Nc1cc[n+](CC([O-])=O)cc1 Amb25751156 [0,1,0,0,0,0|1,0,1]=3 605 B11R1.20 Nc1ccc(C=C(F)F)cc1 Amb23570652 [0,1,0,0,0,0|2,0,1]=4 606 B11R1.20 Nc1ccc(CC(N)=O)[n]c1 Amb22496373 [0,1,0,0,0,0|2,0,0]=3 607 B11R1.20 Nc1ccc(CC(N)=O)c[n]1 Amb24622802 [0,1,0,0,0,0|2,0,0]=3 608 B11R1.20 Nc1ccc(CC(N)=O)cc1 Amb22899489 [0,1,0,0,0,0|1,0,0]=2 609 B11R1.20 Nc1ccc(CC(O)=O)[n]c1 Amb20248323 [0,1,0,0,0,0|1,0,0]=2 610 B11R1.20 Nc1ccc(CC(O)=O)c[n]1 Amb24117183 [0,1,0,0,0,0|1,0,0]=2 611 B11R1.20 Nc1ccc(C[13C](O)=O)cc1 Amb22367320 [0,1,0,0,0,0|0,0,0]=1 612 B11R1.20 Nc1ccc(C[N+]([O-])=O)[n]c1 Amb20248324 [0,1,0,0,0,0|2,0,1]=4 613 B11R1.20 Nc1ccc(c[n]1)NC(N)=O Amb18948580 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.20 Nc1ccc(cc1)NC(S)=S Amb24694442 [0,1,0,0,0,0|1,2,0]=4 615 B11R1.20 Nc1ccc(cc1)SC(=O)F Amb25169490 [0,1,0,0,0,0|2,0,0]=3 616 B11R1.20 Nc1ccc(cc1)SC(N)=O Amb24433331 [0,1,0,0,0,0|2,0,0]=3 617 B11R1.20 O=C(Br)Cc1ccc(F)cc1 Amb25130669 [0,1,0,0,0,0|1,0,0]=2 618 B11R1.20 O=C(Cl)Cc1ccc(I)cc1 Amb24693364 [0,1,0,0,0,0|1,0,0]=2 619 B11R1.20 O=C(Cl)Oc1ccc(Br)cc1 Amb21618685 [0,1,0,0,0,0|2,0,0]=3 620 B11R1.20 O=C(Cl)Oc1ccc(I)cc1 Amb25775700 [0,1,0,0,0,0|2,0,0]=3 621 B11R1.20 O=C(F)Nc1ccc(Cl)cc1 Amb24484940 [0,1,0,0,0,0|2,0,0]=3 622 B11R1.20 O=C1C=CC(=NC(=O)C)C=C1 Amb10071635 [0,1,0,0,0,0|2,0,0]=3 623 B11R1.20 OB(O)Cc1ccc(Br)cc1 Amb24388589 [0,1,0,0,0,0|1,0,1]=3 624 B11R1.20 OB(O)Cc1ccc(Cl)cc1 Amb24068537 [0,1,0,0,0,0|1,0,1]=3 625 B11R1.20 OB(O)Cc1ccc(F)cc1 Amb24063664 [0,1,0,0,0,0|1,0,1]=3 626 B11R1.20 OC(=O)CC1=CNC(=O)C=N1 Amb25028216 [0,1,0,0,0,0|2,0,0]=3 627 B11R1.20 OC(=O)CC1CCC(=O)C=C1 Amb25046213 [0,1,0,0,0,0|0,0,3]=4 628 B11R1.20 OC(=O)CC=1C=CC(=O)NC1 Amb18024214 [0,1,0,0,0,0|1,0,0]=2 629 B11R1.20 OC(=O)CC=1C=CC(=O)NN1 Amb18211856 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.20 OC(=O)CC=1CCC(=O)CC1 Amb25139696 [0,1,0,0,0,0|0,0,3]=4 631 B11R1.20 OC(=O)CN1C=CC(=O)C=C1 Amb18029462 [0,1,0,0,0,0|1,0,0]=2 632 B11R1.20 OC(=O)C[C@H]1CCC(=O)C=C1 Amb24391524 [0,1,0,0,0,0|0,0,3]=4 633 B11R1.20 OC(=O)C[n+]1ccc(cc1)C Amb17098175 [0,1,0,0,0,0|1,0,0]=2 634 B11R1.20 OC(=O)Cc1[n]cc(Cl)c[n]1 Amb25694923 [0,1,0,0,0,0|2,0,0]=3 635 B11R1.20 OC(=O)Cc1[n]cc(F)c[n]1 Amb19958249 [0,1,0,0,0,0|2,0,0]=3 636 B11R1.20 OC(=O)Cc1[n]cc(I)c[n]1 Amb24405634 [0,1,0,0,0,0|2,0,0]=3 637 B11R1.20 OC(=O)Cc1c[n]c(Br)[n]c1 Amb24532992 [0,1,0,0,0,0|2,0,0]=3 638 B11R1.20 OC(=O)Cc1c[n]c(Br)c[n]1 Amb18168758 [0,1,0,0,0,0|2,0,0]=3 639 B11R1.20 OC(=O)Cc1cc[n+](cc1)[O-] Amb10552756 [0,1,0,0,0,0|1,0,0]=2 640 B11R1.20 OC(=O)Cc1ccc(Br)c[n]1 Amb20247880 [0,1,0,0,0,0|1,0,0]=2 641 B11R1.20 OC(=O)Cc1ccc(Cl)[n][n]1 Amb22499435 [0,1,0,0,0,0|2,0,0]=3 642 B11R1.20 OC(=O)Cc1ccc(Cl)c[n]1 Amb20247877 [0,1,0,0,0,0|1,0,0]=2 643 B11R1.20 OC(=O)Cc1ccc(F)[n]c1 Amb20247894 [0,1,0,0,0,0|1,0,0]=2 644 B11R1.20 OC(=O)Cc1ccc(F)c[n]1 Amb20247873 [0,1,0,0,0,0|1,0,0]=2 645 B11R1.20 OC(=O)Cc1ccc(cc1)Br Amb1140645 [0,1,0,0,0,0|0,0,0]=1 646 B11R1.20 OC(=O)Cc1ccc(cc1)O Amb1214964 [0,1,0,0,0,0|0,0,0]=1 647 B11R1.20 OC(=O)Cc1ccc(cc1)S Amb10808003 [0,1,0,0,0,0|0,0,0]=1 648 B11R1.20 OC(=O)Cc1ccc(cn1)Br Amb16231529 [0,1,0,0,0,0|1,0,0]=2 649 B11R1.20 OC(=O)Cc1ncc(cn1)Br Amb10603177 [0,1,0,0,0,0|2,0,0]=3 650 B11R1.20 OC(=O)Nc1ccc(Br)c[n]1 Amb23554912 [0,1,0,0,0,0|2,0,0]=3 651 B11R1.20 OC(=S)Cc1ccc(Br)cc1 Amb24079105 [0,1,0,0,0,0|0,1,0]=2 652 B11R1.20 OC(O)Cc1ccc(Cl)cc1 Amb24353162 [0,1,0,0,0,0|0,0,2]=3 653 B11R1.20 Oc1c[n]c(CC(O)=O)[n]c1 Amb18200873 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.20 Oc1ccc(C=C(Br)Br)cc1 Amb18635918 [0,1,0,0,0,0|2,0,1]=4 655 B11R1.20 Oc1ccc(C=C(Cl)Cl)cc1 Amb22480456 [0,1,0,0,0,0|2,0,1]=4 656 B11R1.20 Oc1ccc(CC(=O)Br)cc1 Amb25202724 [0,1,0,0,0,0|1,0,0]=2 657 B11R1.20 Oc1ccc(CC(=O)Cl)cc1 Amb25730089 [0,1,0,0,0,0|1,0,0]=2 658 B11R1.20 Oc1ccc(cc1)NC(O)=S Amb24076711 [0,1,0,0,0,0|1,1,0]=3 659 B11R1.20 Oc1ccc(cc1)NC(S)=S Amb25366269 [0,1,0,0,0,0|1,2,0]=4 660 B11R1.20 Oc1ccc(cc1)OB(O)O Amb24066087 [0,1,0,0,0,0|2,0,1]=4 661 B11R1.20 Oc1ccc(cc1)OP(O)=O Amb24513753 [0,1,0,0,0,0|2,0,0]=3 662 B11R1.20 SC(=S)Nc1ccc(Cl)cc1 Amb25236997 [0,1,0,0,0,0|1,2,0]=4 663 B11R1.20 [O-]C(=O)Cc1ccc(F)cc1 Amb24088363 [0,1,0,0,0,0|0,0,1]=2 664 B11R1.20 [O-][N+](=O)Cc1ccc(Br)cc1 Amb23589330 [0,1,0,0,0,0|1,0,1]=3 665 B11R1.20 [O-][N+](=O)Cc1ccc(Cl)cc1 Amb23589315 [0,1,0,0,0,0|1,0,1]=3 666 B11R1.20 [O-][N+](=O)Cc1ccc(F)cc1 Amb23589319 [0,1,0,0,0,0|1,0,1]=3 667 B11R1.20 [S-]C(=S)Nc1ccc(cc1)C Amb15741177 [0,1,0,0,0,0|1,2,0]=4 668 B11R1.36 BrC(Br)=C(Br)c1ccccc1 Amb20246913 [0,1,0,0,0,0|2,0,1]=4 669 B11R1.36 BrC(c1ccccc1)C(=O)C Amb16234147 [0,1,0,0,0,0|1,0,0]=2 670 B11R1.36 C(=C(c1ccccc1)[2H])([2H])[2H] Amb16185561 [0,1,0,0,0,0|2,0,1]=4 671 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [0,1,0,0,0,0|2,0,1]=4 672 B11R1.36 C=C(C(=O)Cl)c1ccccc1 Amb24687929 [0,1,0,0,0,0|1,0,1]=3 673 B11R1.36 C=C(C(O)=O)[n+]1ccccc1 Amb24433450 [0,1,0,0,0,0|1,0,1]=3 674 B11R1.36 C=C(C(O)=O)c1ccc[n]c1 Amb24578705 [0,1,0,0,0,0|1,0,1]=3 675 B11R1.36 C=C(C(O)=O)c1cccc[n]1 Amb24657250 [0,1,0,0,0,0|1,0,1]=3 676 B11R1.36 C=C(F)C(=O)c1ccccc1 Amb25347602 [0,1,0,0,0,0|2,0,1]=4 677 B11R1.36 CC(=C)C(Cl)c1ccccc1 Amb25320926 [0,1,0,0,0,0|2,0,0]=3 678 B11R1.36 CC(=C)C(N)c1cc[n]cc1 Amb25149238 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.36 CC(=C)C(N)c1ccc[n]c1 Amb25297470 [0,1,0,0,0,0|3,0,0]=4 680 B11R1.36 CC(=C)C(N)c1ccccc1 Amb18124853 [0,1,0,0,0,0|2,0,0]=3 681 B11R1.36 CC(=C)C(O)c1cc[n]cc1 Amb24447288 [0,1,0,0,0,0|3,0,0]=4 682 B11R1.36 CC(=C)C(O)c1ccc[n]c1 Amb25687146 [0,1,0,0,0,0|3,0,0]=4 683 B11R1.36 CC(=N)C(=O)c1ccccc1 Amb24612580 [0,1,0,0,0,0|2,0,1]=4 684 B11R1.36 CC(=N)N(C)c1ccccc1 Amb24432936 [0,1,0,0,0,0|3,0,0]=4 685 B11R1.36 CC(=O)C(=C)c1ccccc1 Amb24062191 [0,1,0,0,0,0|1,0,1]=3 686 B11R1.36 CC(=O)C(=O)c1c[n]ccc1 Amb25152863 [0,1,0,0,0,0|2,0,1]=4 687 B11R1.36 CC(=O)C(F)c1cc[n]cc1 Amb25739565 [0,1,0,0,0,0|2,0,0]=3 688 B11R1.36 CC(=O)C(N)c1cccc[n]1 Amb25082427 [0,1,0,0,0,0|2,0,0]=3 689 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [0,1,0,0,0,0|1,0,0]=2 690 B11R1.36 CC(=O)C(O)c1ccc[n]c1 Amb24486339 [0,1,0,0,0,0|2,0,0]=3 691 B11R1.36 CC(=O)C(O)c1cccc[n]1 Amb24392468 [0,1,0,0,0,0|2,0,0]=3 692 B11R1.36 CC(=O)C(c1ccccn1)C Amb17593714 [0,1,0,0,0,0|2,0,0]=3 693 B11R1.36 CC(=O)C(c1ccccn1)Cl Amb17477809 [0,1,0,0,0,0|2,0,0]=3 694 B11R1.36 CC(=O)C(c1cccnc1)Cl Amb17477811 [0,1,0,0,0,0|2,0,0]=3 695 B11R1.36 CC(=O)N(C)c1cc[n]cc1 Amb25049376 [0,1,0,0,0,0|3,0,0]=4 696 B11R1.36 CC(=O)N(C)c1cccc[n]1 Amb24096739 [0,1,0,0,0,0|3,0,0]=4 697 B11R1.36 CC(=O)N(Cl)c1ccccc1 Amb17672882 [0,1,0,0,0,0|2,0,0]=3 698 B11R1.36 CC(=O)[C@H](F)c1ccccc1 Amb24486354 [0,1,0,0,0,0|1,0,0]=2 699 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [0,1,0,0,0,0|1,0,0]=2 700 B11R1.36 CC(Br)C(Br)c1ccccc1 Amb25067299 [0,1,0,0,0,0|2,0,1]=4 701 B11R1.36 CC(Br)C(F)c1ccccc1 Amb24375780 [0,1,0,0,0,0|2,0,1]=4 702 B11R1.36 CC(Br)C(N)c1ccccc1 Amb24542749 [0,1,0,0,0,0|2,0,1]=4 703 B11R1.36 CC(Br)[C@@H](O)c1ccccc1 Amb25218214 [0,1,0,0,0,0|2,0,1]=4 704 B11R1.36 CC(Br)[C@H](O)c1ccccc1 Amb25835623 [0,1,0,0,0,0|2,0,1]=4 705 B11R1.36 CC(C(C)Br)c1ccccc1 Amb25191202 [0,1,0,0,0,0|2,0,1]=4 706 B11R1.36 CC(C(C)Cl)c1ccccc1 Amb25832184 [0,1,0,0,0,0|2,0,1]=4 707 B11R1.36 CC(C(C)N)c1ccccc1 Amb18125050 [0,1,0,0,0,0|2,0,1]=4 708 B11R1.36 CC(C(C)N)c1ccccc1 Amb22477704 [0,1,0,0,0,0|2,0,1]=4 709 B11R1.36 CC(C(Cl)Cl)c1ccccc1 Amb24390914 [0,1,0,0,0,0|2,0,1]=4 710 B11R1.36 CC(C(F)F)c1ccccc1 Amb20669786 [0,1,0,0,0,0|2,0,1]=4 711 B11R1.36 CC(C(N)=N)c1ccccc1 Amb22886648 [0,1,0,0,0,0|2,0,0]=3 712 B11R1.36 CC(C(N)=O)c1c[n]c[n]c1 Amb24704219 [0,1,0,0,0,0|3,0,0]=4 713 B11R1.36 CC(C(N)=O)c1c[n]cc[n]1 Amb25708509 [0,1,0,0,0,0|3,0,0]=4 714 B11R1.36 CC(C(N)=O)c1cccc[n]1 Amb25217360 [0,1,0,0,0,0|2,0,0]=3 715 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [0,1,0,0,0,0|1,0,0]=2 716 B11R1.36 CC(C(N)=S)c1cccc[n]1 Amb22397083 [0,1,0,0,0,0|2,1,0]=4 717 B11R1.36 CC(C(O)=O)[n+]1ccccc1 Amb25708377 [0,1,0,0,0,0|1,0,0]=2 718 B11R1.36 CC(C(O)=O)c1c[n]c[n]c1 Amb18962092 [0,1,0,0,0,0|2,0,0]=3 719 B11R1.36 CC(C(O)=O)c1c[n]cc[n]1 Amb24070205 [0,1,0,0,0,0|2,0,0]=3 720 B11R1.36 CC(C(O)=O)c1cc[n]c[n]1 Amb18201427 [0,1,0,0,0,0|2,0,0]=3 721 B11R1.36 CC(C(O)=O)c1cc[n]cc1 Amb18952037 [0,1,0,0,0,0|1,0,0]=2 722 B11R1.36 CC(C(O)=O)c1ccc[n]c1 Amb18952038 [0,1,0,0,0,0|1,0,0]=2 723 B11R1.36 CC(C(O)=O)c1cccc[n]1 Amb18951446 [0,1,0,0,0,0|1,0,0]=2 724 B11R1.36 CC(C(c1cccnc1)N)O Amb17232102 [0,1,0,0,0,0|2,0,1]=4 725 B11R1.36 CC(C)=C(N)c1ccccc1 Amb24453064 [0,1,0,0,0,0|2,0,1]=4 726 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [0,1,0,0,0,0|2,0,1]=4 727 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [0,1,0,0,0,0|2,0,1]=4 728 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [0,1,0,0,0,0|2,0,1]=4 729 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [0,1,0,0,0,0|2,0,1]=4 730 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.36 CC(C)[C@H](Cl)c1ccccc1 Amb25028094 [0,1,0,0,0,0|2,0,1]=4 732 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [0,1,0,0,0,0|2,0,1]=4 734 B11R1.36 CC(C)[C@H](O)c1ccccc1 Amb22226521 [0,1,0,0,0,0|2,0,1]=4 735 B11R1.36 CC(Cl)C(F)c1ccccc1 Amb25095827 [0,1,0,0,0,0|2,0,1]=4 736 B11R1.36 CC(N)C(Br)c1ccccc1 Amb24542874 [0,1,0,0,0,0|2,0,1]=4 737 B11R1.36 CC(N)C(F)c1ccccc1 Amb25189148 [0,1,0,0,0,0|2,0,1]=4 738 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [0,1,0,0,0,0|2,0,1]=4 739 B11R1.36 CC(O)C(=C)c1ccccc1 Amb25226435 [0,1,0,0,0,0|1,0,2]=4 740 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [0,1,0,0,0,0|1,0,2]=4 741 B11R1.36 CC(O)C(Cl)c1ccccc1 Amb25724947 [0,1,0,0,0,0|1,0,1]=3 742 B11R1.36 CC(O)C(F)c1ccccc1 Amb25148218 [0,1,0,0,0,0|1,0,1]=3 743 B11R1.36 CC(O)C(O)c1c[n]ccc1 Amb24643547 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.36 CC(O)C(S)c1ccccc1 Amb25145349 [0,1,0,0,0,0|1,0,1]=3 745 B11R1.36 CC(O)[C@@H](N)c1ccc[n]c1 Amb24659692 [0,1,0,0,0,0|2,0,1]=4 746 B11R1.36 CC(O)[C@@H](N)c1cccc[n]1 Amb24470743 [0,1,0,0,0,0|2,0,1]=4 747 B11R1.36 CC(O)[C@H](N)c1cc[n]cc1 Amb25126570 [0,1,0,0,0,0|2,0,1]=4 748 B11R1.36 CC(O)[C@H](N)c1cccc[n]1 Amb24486964 [0,1,0,0,0,0|2,0,1]=4 749 B11R1.36 CC(O)[C@H](N)c1ccccc1 Amb24659547 [0,1,0,0,0,0|1,0,1]=3 750 B11R1.36 CC(c1cc[n]cc1)[N+]([O-])=O Amb24620457 [0,1,0,0,0,0|2,0,1]=4 751 B11R1.36 CC(c1ccccc1)C(=O)C Amb17593697 [0,1,0,0,0,0|1,0,0]=2 752 B11R1.36 CC(c1ccccc1)C(=S)N Amb17465747 [0,1,0,0,0,0|1,1,0]=3 753 B11R1.36 CN(C(N)=N)c1ccccc1 Amb19148904 [0,1,0,0,0,0|3,0,0]=4 754 B11R1.36 CN(C(N)=O)c1ccc[n]c1 Amb25352855 [0,1,0,0,0,0|3,0,0]=4 755 B11R1.36 CN(C(S)=S)c1ccccc1 Amb24732198 [0,1,0,0,0,0|1,2,0]=4 756 B11R1.36 CN(C)C(Cl)c1ccccc1 Amb25690215 [0,1,0,0,0,0|3,0,0]=4 757 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [0,1,0,0,0,0|3,0,0]=4 758 B11R1.36 CN(C)C(O)c1ccccc1 Amb24421296 [0,1,0,0,0,0|3,0,0]=4 759 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [0,1,0,0,0,0|2,0,1]=4 760 B11R1.36 CN(c1ccccc1)C(=O)N Amb1137584 [0,1,0,0,0,0|2,0,0]=3 761 B11R1.36 CN(c1ccccc1)C(=S)N Amb1132381 [0,1,0,0,0,0|2,1,0]=4 762 B11R1.36 CS(=O)C(Cl)c1ccccc1 Amb25778206 [0,1,0,0,0,0|2,0,0]=3 763 B11R1.36 C[C@@H](B(O)O)c1ccccc1 Amb25687626 [0,1,0,0,0,0|1,0,1]=3 764 B11R1.36 C[C@@H](C(C)N)c1ccccc1 Amb25200252 [0,1,0,0,0,0|2,0,1]=4 765 B11R1.36 C[C@@H](C(N)=S)c1ccccc1 Amb25112155 [0,1,0,0,0,0|1,1,0]=3 766 B11R1.36 C[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb24635727 [0,1,0,0,0,0|2,0,1]=4 767 B11R1.36 C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb24602441 [0,1,0,0,0,0|2,0,1]=4 768 B11R1.36 C[C@@H](Cl)[C@H](O)c1ccccc1 Amb24433948 [0,1,0,0,0,0|2,0,1]=4 769 B11R1.36 C[C@@H](F)[C@@H](O)c1ccccc1 Amb25346193 [0,1,0,0,0,0|2,0,1]=4 770 B11R1.36 C[C@@H](N)[C@@H](S)c1ccccc1 Amb25129484 [0,1,0,0,0,0|2,0,1]=4 771 B11R1.36 C[C@@H](O)[C@@H](Br)c1ccccc1 Amb25075563 [0,1,0,0,0,0|1,0,1]=3 772 B11R1.36 C[C@@H](O)[C@@H](Cl)c1ccccc1 Amb25310965 [0,1,0,0,0,0|1,0,1]=3 773 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccc1 Amb24695036 [0,1,0,0,0,0|1,0,1]=3 774 B11R1.36 C[C@@H](O)[C@@H](O)c1ccccc1 Amb23604600 [0,1,0,0,0,0|1,0,1]=3 775 B11R1.36 C[C@@H](O)[C@H](Cl)c1ccccc1 Amb24433930 [0,1,0,0,0,0|1,0,1]=3 776 B11R1.36 C[C@@H](O)[C@H](N)c1cc[n]cc1 Amb24665797 [0,1,0,0,0,0|2,0,1]=4 777 B11R1.36 C[C@@H](O)[C@H](N)c1cccc[n]1 Amb25794058 [0,1,0,0,0,0|2,0,1]=4 778 B11R1.36 C[C@@H](O)[C@H](N)c1ccccc1 Amb25794225 [0,1,0,0,0,0|1,0,1]=3 779 B11R1.36 C[C@@H](O)[C@H](O)c1ccccc1 Amb25789551 [0,1,0,0,0,0|1,0,1]=3 780 B11R1.36 C[C@@H]([C@@H](C)N)c1ccccc1 Amb25789348 [0,1,0,0,0,0|2,0,1]=4 781 B11R1.36 C[C@@H](c1ccccc1)N(C)C Amb10807413 [0,1,0,0,0,0|3,0,0]=4 782 B11R1.36 C[C@@H](c1ccccc1)[C@@H](O)C Amb16210577 [0,1,0,0,0,0|1,0,1]=3 783 B11R1.36 C[C@H](Br)[C@@H](F)c1ccccc1 Amb25055861 [0,1,0,0,0,0|2,0,1]=4 784 B11R1.36 C[C@H](Br)[C@@H](O)c1ccccc1 Amb25844405 [0,1,0,0,0,0|2,0,1]=4 785 B11R1.36 C[C@H](Br)[C@H](F)c1ccccc1 Amb25313145 [0,1,0,0,0,0|2,0,1]=4 786 B11R1.36 C[C@H](C(C)N)c1ccccc1 Amb25339523 [0,1,0,0,0,0|2,0,1]=4 787 B11R1.36 C[C@H](C(C)O)c1ccccc1 Amb24372048 [0,1,0,0,0,0|1,0,1]=3 788 B11R1.36 C[C@H](Cl)[C@@H](N)c1ccccc1 Amb25211090 [0,1,0,0,0,0|2,0,1]=4 789 B11R1.36 C[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25322171 [0,1,0,0,0,0|2,0,1]=4 790 B11R1.36 C[C@H](Cl)[C@H](O)c1ccccc1 Amb24442982 [0,1,0,0,0,0|2,0,1]=4 791 B11R1.36 C[C@H](N)[C@@H](Cl)c1ccccc1 Amb24740855 [0,1,0,0,0,0|2,0,1]=4 792 B11R1.36 C[C@H](N)[C@@H](F)c1ccccc1 Amb25251481 [0,1,0,0,0,0|2,0,1]=4 793 B11R1.36 C[C@H](N)[C@@H](N)c1ccccc1 Amb25053950 [0,1,0,0,0,0|2,0,1]=4 794 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb22349976 [0,1,0,0,0,0|2,0,1]=4 795 B11R1.36 C[C@H](N)[C@@H](S)c1ccccc1 Amb25241973 [0,1,0,0,0,0|2,0,1]=4 796 B11R1.36 C[C@H](N)[C@H](F)c1ccccc1 Amb25073105 [0,1,0,0,0,0|2,0,1]=4 797 B11R1.36 C[C@H](O)C(=C)c1ccccc1 Amb25188700 [0,1,0,0,0,0|1,0,2]=4 798 B11R1.36 C[C@H](O)C(=O)c1ccccc1 Amb25151480 [0,1,0,0,0,0|1,0,2]=4 799 B11R1.36 C[C@H](O)C(O)c1ccccc1 Amb25806789 [0,1,0,0,0,0|1,0,1]=3 800 B11R1.36 C[C@H](O)[C@@H](Cl)c1ccccc1 Amb25288148 [0,1,0,0,0,0|1,0,1]=3 801 B11R1.36 C[C@H](O)[C@@H](N)c1cc[n]cc1 Amb24485782 [0,1,0,0,0,0|2,0,1]=4 802 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [0,1,0,0,0,0|1,0,1]=3 803 B11R1.36 C[C@H](O)[C@@H](O)c1ccccc1 Amb25149680 [0,1,0,0,0,0|1,0,1]=3 804 B11R1.36 C[C@H](O)[C@H](Cl)c1ccccc1 Amb25211675 [0,1,0,0,0,0|1,0,1]=3 805 B11R1.36 C[C@H](O)[C@H](N)c1ccc[n]c1 Amb24654822 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.36 C[C@H](O)[C@H](N)c1cccc[n]1 Amb25189265 [0,1,0,0,0,0|2,0,1]=4 807 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [0,1,0,0,0,0|1,0,1]=3 808 B11R1.36 C[C@H]([C@@H](C)Cl)c1ccccc1 Amb24652492 [0,1,0,0,0,0|2,0,1]=4 809 B11R1.36 C\C(\N)=C(/O)\c1ccccc1 Amb24097762 [0,1,0,0,0,0|2,0,1]=4 810 B11R1.36 C\C(\c1ccccc1)=C(\C)/Br Amb25211055 [0,1,0,0,0,0|2,0,1]=4 811 B11R1.36 ClC(Cl)C(Cl)c1ccccc1 Amb17835935 [0,1,0,0,0,0|2,0,1]=4 812 B11R1.36 ClC(c1ccccc1)C(=O)N Amb1678054 [0,1,0,0,0,0|1,0,0]=2 813 B11R1.36 ClC(c1ccccc1)C(C)C Amb17138646 [0,1,0,0,0,0|2,0,1]=4 814 B11R1.36 ClC(c1ccccc1)C(N)C Amb17594246 [0,1,0,0,0,0|2,0,1]=4 815 B11R1.36 ClC(c1ccncc1)C(=O)C Amb17477810 [0,1,0,0,0,0|2,0,0]=3 816 B11R1.36 FC(=C(F)F)c1ccccc1 Amb10839818 [0,1,0,0,0,0|2,0,1]=4 817 B11R1.36 FC(C(Cl)Cl)c1ccccc1 Amb25362359 [0,1,0,0,0,0|2,0,1]=4 818 B11R1.36 FC(Cl)C(Cl)c1ccccc1 Amb24470147 [0,1,0,0,0,0|2,0,1]=4 819 B11R1.36 FC(F)=C(Br)c1ccccc1 Amb22008100 [0,1,0,0,0,0|2,0,1]=4 820 B11R1.36 FC(F)C(Br)c1ccccc1 Amb24664987 [0,1,0,0,0,0|2,0,1]=4 821 B11R1.36 FC(F)C(Cl)c1ccccc1 Amb24400669 [0,1,0,0,0,0|2,0,1]=4 822 B11R1.36 F\C(=C(\Cl)/F)\c1ccccc1 Amb13952905 [0,1,0,0,0,0|2,0,1]=4 823 B11R1.36 F\C(\c1ccccc1)=C(\F)/Cl Amb25776764 [0,1,0,0,0,0|2,0,1]=4 824 B11R1.36 N=C(C(O)=O)c1ccccc1 Amb24581249 [0,1,0,0,0,0|0,0,1]=2 825 B11R1.36 N=C(Cl)C(O)c1ccccc1 Amb25149713 [0,1,0,0,0,0|2,0,0]=3 826 B11R1.36 N=C(c1ccccc1)C(=N)Cl Amb25236876 [0,1,0,0,0,0|2,0,1]=4 827 B11R1.36 N=C(c1ccccc1)N(O)O Amb24486661 [0,1,0,0,0,0|1,0,2]=4 828 B11R1.36 NC(=N)C(F)c1ccccc1 Amb25069563 [0,1,0,0,0,0|2,0,0]=3 829 B11R1.36 NC(=N)C(O)c1ccccc1 Amb19890170 [0,1,0,0,0,0|2,0,0]=3 830 B11R1.36 NC(=N)[C@@H](O)c1ccccc1 Amb22587581 [0,1,0,0,0,0|2,0,0]=3 831 B11R1.36 NC(=N)[C@H](O)c1ccccc1 Amb22587530 [0,1,0,0,0,0|2,0,0]=3 832 B11R1.36 NC(=O)C(=N)c1ccccc1 Amb24714517 [0,1,0,0,0,0|1,0,1]=3 833 B11R1.36 NC(=O)C(=O)c1c[n]ccc1 Amb18063199 [0,1,0,0,0,0|2,0,1]=4 834 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,1,0,0,0,0|1,0,1]=3 835 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [0,1,0,0,0,0|1,0,0]=2 836 B11R1.36 NC(=O)C(Cl)c1ccc[n]c1 Amb18185667 [0,1,0,0,0,0|2,0,0]=3 837 B11R1.36 NC(=O)C(N)c1ccccc1 Amb22469872 [0,1,0,0,0,0|1,0,0]=2 838 B11R1.36 NC(=O)C(O)c1c[n]c[n]c1 Amb24552586 [0,1,0,0,0,0|3,0,0]=4 839 B11R1.36 NC(=O)C(O)c1cc[n]cc1 Amb25783931 [0,1,0,0,0,0|2,0,0]=3 840 B11R1.36 NC(=O)C(O)c1ccc[n]c1 Amb18182774 [0,1,0,0,0,0|2,0,0]=3 841 B11R1.36 NC(=O)C(O)c1cccc[n]1 Amb24396108 [0,1,0,0,0,0|2,0,0]=3 842 B11R1.36 NC(=O)C(c1ccccn1)N Amb17334311 [0,1,0,0,0,0|2,0,0]=3 843 B11R1.36 NC(=O)C(c1cccnc1)N Amb17334312 [0,1,0,0,0,0|2,0,0]=3 844 B11R1.36 NC(=O)N(N)c1ccccc1 Amb18125271 [0,1,0,0,0,0|2,0,0]=3 845 B11R1.36 NC(=O)N(O)c1ccccc1 Amb25765611 [0,1,0,0,0,0|2,0,0]=3 846 B11R1.36 NC(=O)[C@@H](Br)c1ccccc1 Amb24611041 [0,1,0,0,0,0|1,0,0]=2 847 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [0,1,0,0,0,0|1,0,0]=2 848 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [0,1,0,0,0,0|1,0,0]=2 849 B11R1.36 NC(=O)[C@H](Cl)c1ccccc1 Amb25320858 [0,1,0,0,0,0|1,0,0]=2 850 B11R1.36 NC(=O)[C@H](F)c1ccccc1 Amb25027917 [0,1,0,0,0,0|1,0,0]=2 851 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [0,1,0,0,0,0|1,0,0]=2 852 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [0,1,0,0,0,0|1,0,0]=2 853 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [0,1,0,0,0,0|1,1,0]=3 854 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb21912493 [0,1,0,0,0,0|1,0,0]=2 855 B11R1.36 NC(C(Cl)Cl)c1ccccc1 Amb25299414 [0,1,0,0,0,0|2,0,1]=4 856 B11R1.36 NC(C(O)=O)c1[n]ccc[n]1 Amb24738404 [0,1,0,0,0,0|2,0,0]=3 857 B11R1.36 NC(C(O)=O)c1c[n]c[n][n]1 Amb24697045 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.36 NC(C(O)=O)c1c[n]c[n]c1 Amb24485788 [0,1,0,0,0,0|2,0,0]=3 859 B11R1.36 NC(C(O)=O)c1c[n]cc[n]1 Amb22899538 [0,1,0,0,0,0|2,0,0]=3 860 B11R1.36 NC(C(O)=O)c1ccc[n][n]1 Amb18201157 [0,1,0,0,0,0|2,0,0]=3 861 B11R1.36 NC(C(O)=O)c1cccc[n]1 Amb22496612 [0,1,0,0,0,0|1,0,0]=2 862 B11R1.36 NC(c1ccccc1)C(=O)Cl Amb16203807 [0,1,0,0,0,0|1,0,0]=2 863 B11R1.36 NC(c1ccccc1)C(=O)N Amb13951330 [0,1,0,0,0,0|1,0,0]=2 864 B11R1.36 NC(c1ccccc1)C(=O)O Amb1869285 [0,1,0,0,0,0|0,0,0]=1 865 B11R1.36 NC(c1ccccc1)C(C)C Amb1129834 [0,1,0,0,0,0|2,0,1]=4 866 B11R1.36 NC(c1ccccc1)P(O)=O Amb25191187 [0,1,0,0,0,0|1,0,0]=2 867 B11R1.36 NC(c1ccncc1)C(=O)N Amb17334313 [0,1,0,0,0,0|2,0,0]=3 868 B11R1.36 N[C@@H](C(=O)Cl)c1ccccc1 Amb22351781 [0,1,0,0,0,0|1,0,0]=2 869 B11R1.36 N[C@@H](C(O)=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351396 [0,1,0,0,0,0|0,0,0]=1 870 B11R1.36 N[C@@H](C(O)=O)c1c[n]c[n]c1 Amb24485751 [0,1,0,0,0,0|2,0,0]=3 871 B11R1.36 N[C@@H](C(O)=O)c1ccc[n]c1 Amb24074448 [0,1,0,0,0,0|1,0,0]=2 872 B11R1.36 N[C@@H](C(O)=O)c1ccccc1 Amb22745585 [0,1,0,0,0,0|0,0,0]=1 873 B11R1.36 N[C@@H](c1ccccc1)C(=O)N Amb10603128 [0,1,0,0,0,0|1,0,0]=2 874 B11R1.36 N[C@@H](c1ccccc1)C(C)C Amb10608147 [0,1,0,0,0,0|2,0,1]=4 875 B11R1.36 N[C@H](C(=O)Cl)c1ccccc1 Amb25152830 [0,1,0,0,0,0|1,0,0]=2 876 B11R1.36 N[C@H](C(F)F)c1ccccc1 Amb24485821 [0,1,0,0,0,0|2,0,1]=4 877 B11R1.36 N[C@H](C(O)=O)c1c[n]c[n]c1 Amb24484501 [0,1,0,0,0,0|2,0,0]=3 878 B11R1.36 N[C@H](c1ccccc1)P(O)O Amb25301291 [0,1,0,0,0,0|1,0,1]=3 879 B11R1.36 O=C(C(=S)Cl)c1ccccc1 Amb24096825 [0,1,0,0,0,0|1,1,1]=4 880 B11R1.36 O=C(Cl)[C@@H](Cl)c1ccccc1 Amb24657090 [0,1,0,0,0,0|1,0,0]=2 881 B11R1.36 O=C(c1ccccc1)C(=C)C Amb17593661 [0,1,0,0,0,0|2,0,1]=4 882 B11R1.36 O=C(c1ccccc1)C(=O)Br Amb24096833 [0,1,0,0,0,0|1,0,1]=3 883 B11R1.36 O=C(c1ccccc1)C(=O)C Amb2099500 [0,1,0,0,0,0|1,0,1]=3 884 B11R1.36 O=C(c1ccccc1)C(=O)Cl Amb17594226 [0,1,0,0,0,0|1,0,1]=3 885 B11R1.36 OB(C(=C)c1ccccc1)O Amb10071036 [0,1,0,0,0,0|1,0,2]=4 886 B11R1.36 OB(O)C(=O)c1ccccc1 Amb25260688 [0,1,0,0,0,0|1,0,2]=4 887 B11R1.36 OB(O)C(Cl)c1ccccc1 Amb24468112 [0,1,0,0,0,0|1,0,1]=3 888 B11R1.36 OC(=O)C(=O)c1[n]ccc[n]1 Amb25127552 [0,1,0,0,0,0|2,0,1]=4 889 B11R1.36 OC(=O)C(=O)c1c[n]cc[n]1 Amb24361851 [0,1,0,0,0,0|2,0,1]=4 890 B11R1.36 OC(=O)C(=O)c1c[n]ccc1 Amb22492371 [0,1,0,0,0,0|1,0,1]=3 891 B11R1.36 OC(=O)C(=O)c1cc[n]cc1 Amb18125209 [0,1,0,0,0,0|1,0,1]=3 892 B11R1.36 OC(=O)C(=O)c1cccc[n]1 Amb18831273 [0,1,0,0,0,0|1,0,1]=3 893 B11R1.36 OC(=O)C(=O)c1cccnc1 Amb15701278 [0,1,0,0,0,0|1,0,1]=3 894 B11R1.36 OC(=O)C(Br)c1ccc[n]c1 Amb19929998 [0,1,0,0,0,0|1,0,0]=2 895 B11R1.36 OC(=O)C(Br)c1cccc[n]1 Amb24081184 [0,1,0,0,0,0|1,0,0]=2 896 B11R1.36 OC(=O)C(Cl)c1cc[n]cc1 Amb24488132 [0,1,0,0,0,0|1,0,0]=2 897 B11R1.36 OC(=O)C(Cl)c1ccc[n]c1 Amb24089492 [0,1,0,0,0,0|1,0,0]=2 898 B11R1.36 OC(=O)C(F)c1c[n]cc[n]1 Amb25358269 [0,1,0,0,0,0|2,0,0]=3 899 B11R1.36 OC(=O)C(F)c1cc[n]cc1 Amb24466152 [0,1,0,0,0,0|1,0,0]=2 900 B11R1.36 OC(=O)C(F)c1cccc[n]1 Amb25149165 [0,1,0,0,0,0|1,0,0]=2 901 B11R1.36 OC(=O)C(O)c1c[n]cc[n]1 Amb18200877 [0,1,0,0,0,0|2,0,0]=3 902 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb18952024 [0,1,0,0,0,0|1,0,0]=2 903 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb19373382 [0,1,0,0,0,0|1,0,0]=2 904 B11R1.36 OC(=O)C(O)c1cc[n]cc1 Amb18201200 [0,1,0,0,0,0|1,0,0]=2 905 B11R1.36 OC(=O)C(O)c1cccc[n]1 Amb18201201 [0,1,0,0,0,0|1,0,0]=2 906 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22729762 [0,1,0,0,0,0|0,0,0]=1 907 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22732258 [0,1,0,0,0,0|0,0,0]=1 908 B11R1.36 OC(=O)C(c1ccccc1)N Amb2228457 [0,1,0,0,0,0|0,0,0]=1 909 B11R1.36 OC(=O)C(c1cccnc1)N Amb10632723 [0,1,0,0,0,0|1,0,0]=2 910 B11R1.36 OC(=O)[C@@H](Br)c1ccccc1 Amb25056175 [0,1,0,0,0,0|0,0,0]=1 911 B11R1.36 OC(=O)[C@@H](O)c1c[n]ccc1 Amb24595431 [0,1,0,0,0,0|1,0,0]=2 912 B11R1.36 OC(=O)[C@H](Cl)c1ccccc1 Amb24650918 [0,1,0,0,0,0|0,0,0]=1 913 B11R1.36 OC(=O)[C@H](O)c1c[n]ccc1 Amb25060746 [0,1,0,0,0,0|1,0,0]=2 914 B11R1.36 OC(Br)C(=O)c1ccccc1 Amb24104060 [0,1,0,0,0,0|1,0,2]=4 915 B11R1.36 OC(C(=O)Br)c1ccccc1 Amb24095709 [0,1,0,0,0,0|1,0,0]=2 916 B11R1.36 OC(C(=O)S)c1ccccc1 Amb25681441 [0,1,0,0,0,0|0,1,0]=2 917 B11R1.36 OC(C(F)Cl)c1ccccc1 Amb24509297 [0,1,0,0,0,0|2,0,1]=4 918 B11R1.36 OC(C(F)F)c1ccccc1 Amb19895457 [0,1,0,0,0,0|2,0,1]=4 919 B11R1.36 OC(Cl)C(=O)c1ccccc1 Amb24528115 [0,1,0,0,0,0|1,0,2]=4 920 B11R1.36 OC(c1c[n]ccc1)P(O)=O Amb24502009 [0,1,0,0,0,0|2,0,0]=3 921 B11R1.36 OC(c1ccccc1)=C(Cl)Cl Amb24101433 [0,1,0,0,0,0|2,0,1]=4 922 B11R1.36 OC(c1ccccc1)C(=C)C Amb10807411 [0,1,0,0,0,0|2,0,0]=3 923 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [0,1,0,0,0,0|1,0,0]=2 924 B11R1.36 OC(c1ccccc1)C(Br)C Amb17595842 [0,1,0,0,0,0|2,0,1]=4 925 B11R1.36 OC(c1ccccc1)P(O)=O Amb21618921 [0,1,0,0,0,0|1,0,0]=2 926 B11R1.36 O[C@@H](C(=O)Cl)c1ccccc1 Amb25683267 [0,1,0,0,0,0|1,0,0]=2 927 B11R1.36 O[C@@H](C(F)Cl)c1ccccc1 Amb25028097 [0,1,0,0,0,0|2,0,1]=4 928 B11R1.36 O[C@@H]([C@H](F)Cl)c1ccccc1 Amb24390849 [0,1,0,0,0,0|2,0,1]=4 929 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [0,1,0,0,0,0|1,0,0]=2 930 B11R1.36 O[C@@H](c1ccccc1)[C@@H](N)C Amb17619646 [0,1,0,0,0,0|2,0,1]=4 931 B11R1.36 O[C@H](C(F)Cl)c1ccccc1 Amb24487906 [0,1,0,0,0,0|2,0,1]=4 932 B11R1.36 O[C@H](C(F)F)c1ccccc1 Amb24623094 [0,1,0,0,0,0|2,0,1]=4 933 B11R1.36 O[C@H](c1ccccc1)[C@H](N)C Amb10071337 [0,1,0,0,0,0|2,0,1]=4 934 B11R1.36 SC(c1ccccc1)C(=O)C Amb17594139 [0,1,0,0,0,0|1,0,0]=2 935 B11R1.36 [NH3+]C(C(O)=O)c1ccccc1 Amb22641589 [0,1,0,0,0,0|0,0,0]=1 936 B11R1.36 [O-]C(=O)C(O)c1cccc[n]1 Amb23452663 [0,1,0,0,0,0|1,0,1]=3 937 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22729281 [0,1,0,0,0,0|0,0,1]=2 938 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22732065 [0,1,0,0,0,0|0,0,1]=2 939 B11R1.36 [O-]C(c1cccc[n]1)C(O)=O Amb22453597 [0,1,0,0,0,0|1,0,0]=2 940 B11R1.36 [O-]P(=O)C(c1cccnc1)O Amb1089262 [0,1,0,0,0,0|2,0,1]=4 941 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [0,1,0,0,0,0|2,0,1]=4 942 B11R1.40 BrCC(=O)Cc1ccccc1 Amb17569850 [0,1,0,0,0,0|1,0,0]=2 943 B11R1.40 BrCC(=O)Nc1ccccc1 Amb2222053 [0,1,0,0,0,0|2,0,0]=3 944 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [0,1,0,0,0,0|1,0,1]=3 945 B11R1.40 C#CC(=O)Cc1cc[n]cc1 Amb25758182 [0,1,0,0,0,0|2,0,0]=3 946 B11R1.40 C#CC(=O)Cc1ccc[n]c1 Amb25070158 [0,1,0,0,0,0|2,0,0]=3 947 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,1,0,0,0,0|1,0,0]=2 948 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,1,0,0,0,0|2,0,0]=3 949 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [0,1,0,0,0,0|2,0,1]=4 950 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [0,1,0,0,0,0|2,0,1]=4 951 B11R1.40 C#CC(O)Cc1c[n]ccc1 Amb24704924 [0,1,0,0,0,0|2,0,1]=4 952 B11R1.40 C#CC(O)Nc1ccccc1 Amb24561876 [0,1,0,0,0,0|2,0,1]=4 953 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [0,1,0,0,0,0|1,0,1]=3 954 B11R1.40 C=C(C=C)Nc1ccccc1 Amb25131122 [0,1,0,0,0,0|3,0,0]=4 955 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [0,1,0,0,0,0|2,0,0]=3 956 B11R1.40 C=C(C=O)Sc1ccccc1 Amb25347672 [0,1,0,0,0,0|2,0,0]=3 957 B11R1.40 C=C(Cc1ccccc1)CCl Amb25185403 [0,1,0,0,0,0|2,0,0]=3 958 B11R1.40 C=CC(=O)Cc1cccc[n]1 Amb24425169 [0,1,0,0,0,0|2,0,0]=3 959 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,1,0,0,0,0|1,0,0]=2 960 B11R1.40 C=CC(=O)Oc1ccccc1 Amb17934129 [0,1,0,0,0,0|2,0,0]=3 961 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [0,1,0,0,0,0|2,0,1]=4 962 B11R1.40 C=CC(O)Cc1c[n]ccc1 Amb25097959 [0,1,0,0,0,0|2,0,1]=4 963 B11R1.40 C=CC(O)Cc1cccc[n]1 Amb25241001 [0,1,0,0,0,0|2,0,1]=4 964 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|1,0,1]=3 965 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [0,1,0,0,0,0|2,0,1]=4 966 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [0,1,0,0,0,0|2,0,1]=4 967 B11R1.40 C=C[C@H](O)Cc1cccc[n]1 Amb25806691 [0,1,0,0,0,0|2,0,1]=4 968 B11R1.40 CC(=NC)Oc1ccccc1 Amb24066830 [0,1,0,0,0,0|3,0,0]=4 969 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,0,0,0,0|2,0,1]=4 970 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,0,0,0,0|2,0,1]=4 971 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,1,0,0,0,0|2,0,1]=4 972 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,1,0,0,0,0|2,0,1]=4 973 B11R1.40 CC(CO)Cc1cc[n]cc1 Amb25374015 [0,1,0,0,0,0|2,0,1]=4 974 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,1,0,0,0,0|2,0,1]=4 975 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [0,1,0,0,0,0|2,0,1]=4 976 B11R1.40 CC(Cc1ccccc1)=[N+]=[N-] Amb25173943 [0,1,0,0,0,0|2,0,0]=3 977 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [0,1,0,0,0,0|2,0,1]=4 978 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [0,1,0,0,0,0|2,0,1]=4 979 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [0,1,0,0,0,0|2,0,1]=4 980 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [0,1,0,0,0,0|2,0,1]=4 981 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [0,1,0,0,0,0|2,0,1]=4 982 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [0,1,0,0,0,0|2,0,0]=3 983 B11R1.40 CCC(=O)Cc1ccncc1 Amb17477729 [0,1,0,0,0,0|2,0,0]=3 984 B11R1.40 CCC(=O)Oc1ccc[n]c1 Amb24674574 [0,1,0,0,0,0|3,0,0]=4 985 B11R1.40 CCC(=O)Oc1cccc[n]1 Amb25264358 [0,1,0,0,0,0|3,0,0]=4 986 B11R1.40 CCC(=S)Nc1ccccc1 Amb24757738 [0,1,0,0,0,0|2,1,0]=4 987 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,1,0,0,0,0|2,0,1]=4 988 B11R1.40 CCC(Cc1ccccn1)O Amb17477703 [0,1,0,0,0,0|2,0,1]=4 989 B11R1.40 CCC(Cc1cccnc1)O Amb17477705 [0,1,0,0,0,0|2,0,1]=4 990 B11R1.40 CCC(Cc1ccncc1)O Amb17477704 [0,1,0,0,0,0|2,0,1]=4 991 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,1,0,0,0,0|2,0,1]=4 992 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [0,1,0,0,0,0|3,0,0]=4 993 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [0,1,0,0,0,0|3,0,0]=4 994 B11R1.40 CCP(=O)Oc1ccccc1 Amb21963209 [0,1,0,0,0,0|3,0,0]=4 995 B11R1.40 CCS(=O)Cc1cc[n]cc1 Amb24690059 [0,1,0,0,0,0|3,0,0]=4 996 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [0,1,0,0,0,0|2,0,0]=3 997 B11R1.40 CCS(=O)Nc1ccccc1 Amb24752666 [0,1,0,0,0,0|3,0,0]=4 998 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [0,1,0,0,0,0|2,0,1]=4 999 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [0,1,0,0,0,0|2,0,1]=4 1000 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [0,1,0,0,0,0|2,0,1]=4 1001 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,1,0,0,0,0|2,0,1]=4 1002 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,1,0,0,0,0|1,0,1]=3 1003 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [0,1,0,0,0,0|2,0,1]=4 1004 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,1,0,0,0,0|2,0,1]=4 1005 B11R1.40 CC\C(\I)=C/c1ccccc1 Amb22641702 [0,1,0,0,0,0|2,0,1]=4 1006 B11R1.40 CC\C(\N)=N\c1ccccc1 Amb24453266 [0,1,0,0,0,0|3,0,0]=4 1007 B11R1.40 CN(CCl)Cc1ccccc1 Amb25324443 [0,1,0,0,0,0|3,0,0]=4 1008 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [0,1,0,0,0,0|2,0,0]=3 1009 B11R1.40 CN(Cc1c[n]ccc1)C=O Amb24096746 [0,1,0,0,0,0|3,0,0]=4 1010 B11R1.40 CN(Cc1cccc[n]1)C=O Amb25189288 [0,1,0,0,0,0|3,0,0]=4 1011 B11R1.40 CN(Cc1cccc[n]1)N=O Amb24636522 [0,1,0,0,0,0|3,0,0]=4 1012 B11R1.40 CN(Cc1ccccc1)C#N Amb25072835 [0,1,0,0,0,0|3,0,0]=4 1013 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [0,1,0,0,0,0|2,1,0]=4 1014 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,1,0,0,0,0|2,0,0]=3 1015 B11R1.40 CNC(=N)Cc1cccc[n]1 Amb25261557 [0,1,0,0,0,0|3,0,0]=4 1016 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [0,1,0,0,0,0|2,0,0]=3 1017 B11R1.40 CNC(=O)Cc1c[n]c[n]c1 Amb25787810 [0,1,0,0,0,0|3,0,0]=4 1018 B11R1.40 CNC(=O)Cc1c[n]cc[n]1 Amb25284121 [0,1,0,0,0,0|3,0,0]=4 1019 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [0,1,0,0,0,0|2,0,0]=3 1020 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [0,1,0,0,0,0|2,0,0]=3 1021 B11R1.40 CNC(=O)Nc1ccccn1 Amb2132780 [0,1,0,0,0,0|3,0,0]=4 1022 B11R1.40 CNC(=O)Nc1cccnc1 Amb2132752 [0,1,0,0,0,0|3,0,0]=4 1023 B11R1.40 CNC(=O)Oc1ccc[n]c1 Amb24362237 [0,1,0,0,0,0|3,0,0]=4 1024 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [0,1,0,0,0,0|1,1,0]=3 1025 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [0,1,0,0,0,0|2,0,1]=4 1027 B11R1.40 CN\C(\Cl)=N\c1ccccc1 Amb24670343 [0,1,0,0,0,0|3,0,0]=4 1028 B11R1.40 COC(=N)Cc1cc[n]cc1 Amb18182737 [0,1,0,0,0,0|2,0,0]=3 1029 B11R1.40 COC(=N)Cc1ccc[n]c1 Amb18799364 [0,1,0,0,0,0|2,0,0]=3 1030 B11R1.40 COC(=N)Cc1cccc[n]1 Amb18179377 [0,1,0,0,0,0|2,0,0]=3 1031 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,1,0,0,0,0|1,0,0]=2 1032 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,1,0,0,0,0|1,0,0]=2 1033 B11R1.40 COC(=N)Nc1ccccc1 Amb24509579 [0,1,0,0,0,0|2,0,0]=3 1034 B11R1.40 COC(=O)Cc1c[n]c[n]c1 Amb25763089 [0,1,0,0,0,0|2,0,0]=3 1035 B11R1.40 COC(=O)Cc1cc[n][n]c1 Amb22405879 [0,1,0,0,0,0|2,0,0]=3 1036 B11R1.40 COC(=O)Cc1cc[n]c[n]1 Amb22500240 [0,1,0,0,0,0|2,0,0]=3 1037 B11R1.40 COC(=O)Cc1cc[n]cc1 Amb20240688 [0,1,0,0,0,0|1,0,0]=2 1038 B11R1.40 COC(=O)Cc1ccc[n]c1 Amb22497118 [0,1,0,0,0,0|1,0,0]=2 1039 B11R1.40 COC(=O)Cc1ccccn1 Amb1223230 [0,1,0,0,0,0|1,0,0]=2 1040 B11R1.40 COC(=O)Cc1ncccn1 Amb17912090 [0,1,0,0,0,0|2,0,0]=3 1041 B11R1.40 COC(=O)Nc1c[n]c[n]c1 Amb25122552 [0,1,0,0,0,0|3,0,0]=4 1042 B11R1.40 COC(=O)Nc1cc[n]c[n]1 Amb25701812 [0,1,0,0,0,0|3,0,0]=4 1043 B11R1.40 COC(=O)Nc1ccc[n][n]1 Amb24356600 [0,1,0,0,0,0|3,0,0]=4 1044 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,1,0,0,0,0|1,0,0]=2 1045 B11R1.40 COC(=O)Nc1ccccn1 Amb17860931 [0,1,0,0,0,0|2,0,0]=3 1046 B11R1.40 COC(=O)Nc1cccnc1 Amb2222993 [0,1,0,0,0,0|2,0,0]=3 1047 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,1,0,0,0,0|1,0,0]=2 1048 B11R1.40 COC(C)Cc1cc[n]cc1 Amb24485830 [0,1,0,0,0,0|2,0,1]=4 1049 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,1,0,0,0,0|1,0,1]=3 1050 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,1,0,0,0,0|0,0,2]=3 1051 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [0,1,0,0,0,0|1,1,0]=3 1052 B11R1.40 CO\C(=N/c1ccccc1)\[O-] Amb16224823 [0,1,0,0,0,0|1,0,1]=3 1053 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [0,1,0,0,0,0|1,1,0]=3 1054 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [0,1,0,0,0,0|0,1,0]=2 1055 B11R1.40 CSC(=O)Nc1ccc[n]c1 Amb24486137 [0,1,0,0,0,0|2,1,0]=4 1056 B11R1.40 CSC(=S)C[N]1=CC=CC=C1 Amb17835327 [0,1,0,0,0,0|1,2,0]=4 1057 B11R1.40 CSC(=S)C[n+]1ccccc1 Amb2228085 [0,1,0,0,0,0|1,2,0]=4 1058 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [0,1,0,0,0,0|2,0,1]=4 1059 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,0,0,0,0|2,0,1]=4 1060 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,1,0,0,0,0|2,0,1]=4 1061 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [0,1,0,0,0,0|2,0,1]=4 1062 B11R1.40 C[C@@H](Cc1cc[n]cc1)C=O Amb24608169 [0,1,0,0,0,0|2,0,1]=4 1063 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,1,0,0,0,0|1,0,1]=3 1064 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [0,1,0,0,0,0|1,0,1]=3 1065 B11R1.40 C\C(=C/Cl)\Sc1ccccc1 Amb24694004 [0,1,0,0,0,0|3,0,0]=4 1066 B11R1.40 C\C(=C/c1ccccc1)\C#N Amb18644009 [0,1,0,0,0,0|2,0,1]=4 1067 B11R1.40 C\C(=C/c1ccccc1)\NC Amb25825428 [0,1,0,0,0,0|2,0,1]=4 1068 B11R1.40 C\C(=C\c1cc[n]cc1)\C=O Amb24366948 [0,1,0,0,0,0|2,0,1]=4 1069 B11R1.40 C\C(=C\c1cccc[n]1)\C=O Amb25149235 [0,1,0,0,0,0|2,0,1]=4 1070 B11R1.40 C\C(=C\c1ccccc1)\C=O Amb22058732 [0,1,0,0,0,0|1,0,1]=3 1071 B11R1.40 C\C(=C\c1ccccc1)\N=O Amb25246172 [0,1,0,0,0,0|1,0,1]=3 1072 B11R1.40 C\C(=N\c1cccc[n]1)\OC Amb24095834 [0,1,0,0,0,0|3,0,0]=4 1073 B11R1.40 C\C(\CBr)=C/c1ccccc1 Amb24605004 [0,1,0,0,0,0|2,0,1]=4 1074 B11R1.40 C\C(\CC)=C\c1ccccc1 Amb22546773 [0,1,0,0,0,0|2,0,1]=4 1075 B11R1.40 C\C(\CN)=C/c1ccccc1 Amb25076849 [0,1,0,0,0,0|2,0,1]=4 1076 B11R1.40 C\C(\CN)=C\c1ccccc1 Amb24634730 [0,1,0,0,0,0|2,0,1]=4 1077 B11R1.40 C\C(\CO)=C/c1cccc[n]1 Amb25060585 [0,1,0,0,0,0|2,0,1]=4 1078 B11R1.40 C\C(\CO)=C\c1ccc[n]c1 Amb24730218 [0,1,0,0,0,0|2,0,1]=4 1079 B11R1.40 C\C(\CO)=C\c1cccc[n]1 Amb25149286 [0,1,0,0,0,0|2,0,1]=4 1080 B11R1.40 C\C(\Cc1cc[n]cc1)=N/O Amb24630186 [0,1,0,0,0,0|2,0,0]=3 1081 B11R1.40 C\C(\Cc1cc[n]cc1)=N\O Amb24417230 [0,1,0,0,0,0|2,0,0]=3 1082 B11R1.40 C\C(\Cc1cccc[n]1)=N\N Amb25760219 [0,1,0,0,0,0|3,0,0]=4 1083 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [0,1,0,0,0,0|2,0,0]=3 1084 B11R1.40 C\C(\Cc1ccccc1)=N\N Amb24501436 [0,1,0,0,0,0|2,0,0]=3 1085 B11R1.40 C\N=C(/N)\Cc1c[n]ccc1 Amb24062497 [0,1,0,0,0,0|3,0,0]=4 1086 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [0,1,0,0,0,0|2,0,0]=3 1087 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [0,1,0,0,0,0|2,0,1]=4 1088 B11R1.40 ClCC(=O)Cc1ccccc1 Amb2371529 [0,1,0,0,0,0|1,0,0]=2 1089 B11R1.40 ClCC(=O)Nc1ccccn1 Amb1129705 [0,1,0,0,0,0|3,0,0]=4 1090 B11R1.40 ClCC(=O)Nc1cccnc1 Amb1126278 [0,1,0,0,0,0|3,0,0]=4 1091 B11R1.40 ClCC(=O)Nc1ccncc1 Amb1124841 [0,1,0,0,0,0|3,0,0]=4 1092 B11R1.40 ClCC(=O)Oc1ccccc1 Amb1914503 [0,1,0,0,0,0|2,0,0]=3 1093 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [0,1,0,0,0,0|2,0,1]=4 1094 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [0,1,0,0,0,0|2,0,1]=4 1095 B11R1.40 ClC\C(\Br)=C\c1ccccc1 Amb25283246 [0,1,0,0,0,0|2,0,1]=4 1096 B11R1.40 Cl\C(\CCl)=C/c1ccccc1 Amb25362063 [0,1,0,0,0,0|2,0,1]=4 1097 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [0,1,0,0,0,0|2,0,1]=4 1098 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [0,1,0,0,0,0|2,0,1]=4 1099 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,1,0,0,0,0|2,0,1]=4 1100 B11R1.40 F\C(\CBr)=C\c1ccccc1 Amb24745736 [0,1,0,0,0,0|2,0,1]=4 1101 B11R1.40 N#CC(O)Cc1c[n]ccc1 Amb24062544 [0,1,0,0,0,0|2,0,1]=4 1102 B11R1.40 N#CC(O)Cc1cccc[n]1 Amb25722520 [0,1,0,0,0,0|2,0,1]=4 1103 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [0,1,0,0,0,0|1,0,1]=3 1104 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [0,1,0,0,0,0|1,0,1]=3 1105 B11R1.40 N#C\C(\Cl)=C/c1ccccc1 Amb25209358 [0,1,0,0,0,0|2,0,1]=4 1106 B11R1.40 N#C\C(\Cl)=C\c1ccccc1 Amb18126389 [0,1,0,0,0,0|2,0,1]=4 1107 B11R1.40 N#C\C(\F)=C/c1ccccc1 Amb25187404 [0,1,0,0,0,0|2,0,1]=4 1108 B11R1.40 N#C\C(\F)=C\c1ccccc1 Amb18644314 [0,1,0,0,0,0|2,0,1]=4 1109 B11R1.40 N=C(CS)Nc1ccccc1 Amb25194642 [0,1,0,0,0,0|2,1,0]=4 1110 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,1,0,0,0,0|1,0,0]=2 1111 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [0,1,0,0,0,0|2,0,1]=4 1112 B11R1.40 NC(Cc1[n]ccc[n]1)=NO Amb18796668 [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.40 NC(Cc1c[n]ccc1)=NN Amb18182746 [0,1,0,0,0,0|3,0,0]=4 1114 B11R1.40 NC(Cc1cc[n]cc1)=NN Amb18182747 [0,1,0,0,0,0|3,0,0]=4 1115 B11R1.40 NC(Cc1ccccc1)=S=O Amb25053951 [0,1,0,0,0,0|1,0,0]=2 1116 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [0,1,0,0,0,0|2,0,1]=4 1117 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [0,1,0,0,0,0|1,0,1]=3 1118 B11R1.40 NC(Nc1c[n]ccc1)=NO Amb18182780 [0,1,0,0,0,0|3,0,0]=4 1119 B11R1.40 NC(Nc1ccccc1)=NO Amb18799378 [0,1,0,0,0,0|2,0,0]=3 1120 B11R1.40 NCC(=N)Nc1ccccc1 Amb24746458 [0,1,0,0,0,0|3,0,0]=4 1121 B11R1.40 NCC(=O)Cc1c[n]ccc1 Amb18251321 [0,1,0,0,0,0|2,0,0]=3 1122 B11R1.40 NCC(=O)Cc1cc[n]cc1 Amb18201930 [0,1,0,0,0,0|2,0,0]=3 1123 B11R1.40 NCC(=O)Cc1cccc[n]1 Amb18908409 [0,1,0,0,0,0|2,0,0]=3 1124 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,1,0,0,0,0|1,0,0]=2 1125 B11R1.40 NCC(=O)Cc1ccccc1 Amb19516183 [0,1,0,0,0,0|1,0,0]=2 1126 B11R1.40 NCC(=O)Nc1ccc[n]c1 Amb21987914 [0,1,0,0,0,0|3,0,0]=4 1127 B11R1.40 NCC(=O)Nc1ccccc1 Amb10609338 [0,1,0,0,0,0|2,0,0]=3 1128 B11R1.40 NCC(=O)Nc1ccccn1 Amb15741010 [0,1,0,0,0,0|3,0,0]=4 1129 B11R1.40 NCC(=O)Nc1ccncc1 Amb15741011 [0,1,0,0,0,0|3,0,0]=4 1130 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,1,0,0,0,0|2,0,0]=3 1131 B11R1.40 NCC(=S)Nc1ccccc1 Amb25128037 [0,1,0,0,0,0|2,1,0]=4 1132 B11R1.40 NCC(Cc1cccnc1)O Amb17232103 [0,1,0,0,0,0|2,0,1]=4 1133 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [0,1,0,0,0,0|2,0,1]=4 1134 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [0,1,0,0,0,0|2,0,1]=4 1135 B11R1.40 NCC(O)Cc1cc[n]cc1 Amb18201350 [0,1,0,0,0,0|2,0,1]=4 1136 B11R1.40 NCC(O)Cc1cccc[n]1 Amb18201349 [0,1,0,0,0,0|2,0,1]=4 1137 B11R1.40 NCC(O)Cc1cccc[n]1 Amb22898917 [0,1,0,0,0,0|2,0,1]=4 1138 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [0,1,0,0,0,0|1,1,1]=4 1139 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [0,1,0,0,0,0|2,0,1]=4 1140 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,1,0,0,0,0|1,0,1]=3 1141 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [0,1,0,0,0,0|2,0,1]=4 1142 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,1,0,0,0,0|1,0,1]=3 1143 B11R1.40 NC\C(\Cl)=C\c1ccccc1 Amb25259250 [0,1,0,0,0,0|2,0,1]=4 1144 B11R1.40 NNC(=N)Nc1ccccc1 Amb22459345 [0,1,0,0,0,0|3,0,0]=4 1145 B11R1.40 NNC(=O)C[N]1=CC=CC=C1 Amb17836433 [0,1,0,0,0,0|2,0,0]=3 1146 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb10552843 [0,1,0,0,0,0|2,0,0]=3 1147 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb1154171 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb19748594 [0,1,0,0,0,0|2,0,0]=3 1149 B11R1.40 NNC(=O)Cc1c[n]c[n]c1 Amb20092729 [0,1,0,0,0,0|3,0,0]=4 1150 B11R1.40 NNC(=O)Cc1c[n]cc[n]1 Amb25306562 [0,1,0,0,0,0|3,0,0]=4 1151 B11R1.40 NNC(=O)Cc1cccc[n]1 Amb19373217 [0,1,0,0,0,0|2,0,0]=3 1152 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [0,1,0,0,0,0|1,0,0]=2 1153 B11R1.40 NNC(=O)Cc1ccncc1 Amb1133661 [0,1,0,0,0,0|2,0,0]=3 1154 B11R1.40 NNC(=O)Nc1c[n]ccc1 Amb24433263 [0,1,0,0,0,0|3,0,0]=4 1155 B11R1.40 NNC(=O)Nc1cc[n]cc1 Amb25148277 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,1,0,0,0,0|2,0,0]=3 1157 B11R1.40 NNC(=S)Cc1ccccc1 Amb24377114 [0,1,0,0,0,0|1,1,0]=3 1158 B11R1.40 NN\C(=N/c1ccccc1)\S Amb2502886 [0,1,0,0,0,0|2,1,0]=4 1159 B11R1.40 NOC(=O)Nc1ccccc1 Amb24484939 [0,1,0,0,0,0|1,0,0]=2 1160 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [0,1,0,0,0,0|2,0,1]=4 1161 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [0,1,0,0,0,0|2,0,1]=4 1162 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [0,1,0,0,0,0|2,0,1]=4 1163 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [0,1,0,0,0,0|1,0,1]=3 1164 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [0,1,0,0,0,0|1,1,1]=4 1165 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [0,1,0,0,0,0|2,0,1]=4 1166 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [0,1,0,0,0,0|2,0,1]=4 1167 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [0,1,0,0,0,0|2,0,1]=4 1168 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [0,1,0,0,0,0|1,1,1]=4 1169 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [0,1,0,0,0,0|1,0,1]=3 1170 B11R1.40 N\C(\C#N)=N\c1ccccc1 Amb24680966 [0,1,0,0,0,0|3,0,0]=4 1171 B11R1.40 N\C(\Cc1cc[n]c[n]1)=N\O Amb24514544 [0,1,0,0,0,0|3,0,0]=4 1172 B11R1.40 N\C(\Cc1ccc[n][n]1)=N\O Amb24695789 [0,1,0,0,0,0|3,0,0]=4 1173 B11R1.40 N\C(\Cc1cccc[n]1)=N\N Amb18177153 [0,1,0,0,0,0|3,0,0]=4 1174 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [0,1,0,0,0,0|1,0,0]=2 1175 B11R1.40 N\C(\Cc1ccccc1)=N/N Amb17933233 [0,1,0,0,0,0|2,0,0]=3 1176 B11R1.40 N\C(\Cc1ccccc1)=N\Cl Amb25689858 [0,1,0,0,0,0|2,0,0]=3 1177 B11R1.40 N\C(\Nc1ccccc1)=N\N Amb25046170 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.40 N\N=C(\Cl)/Cc1ccccc1 Amb25188651 [0,1,0,0,0,0|2,0,0]=3 1179 B11R1.40 O=C(C=O)Nc1cc[n]cc1 Amb24360354 [0,1,0,0,0,0|2,0,1]=4 1180 B11R1.40 O=C(C=O)Oc1c[n]ccc1 Amb24484745 [0,1,0,0,0,0|2,0,1]=4 1181 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [0,1,0,0,0,0|1,0,1]=3 1182 B11R1.40 O=C(CBr)C[n+]1ccccc1 Amb24641641 [0,1,0,0,0,0|2,0,0]=3 1183 B11R1.40 O=C(CBr)Sc1ccccc1 Amb24730786 [0,1,0,0,0,0|2,0,0]=3 1184 B11R1.40 O=C(CCl)Nc1cc[n]cc1 Amb20623041 [0,1,0,0,0,0|3,0,0]=4 1185 B11R1.40 O=C(CCl)Nc1ccc[n]c1 Amb19373564 [0,1,0,0,0,0|3,0,0]=4 1186 B11R1.40 O=C(CCl)Nc1cccc[n]1 Amb22054725 [0,1,0,0,0,0|3,0,0]=4 1187 B11R1.40 O=C(CCl)Sc1ccccc1 Amb24712200 [0,1,0,0,0,0|2,0,0]=3 1188 B11R1.40 O=C(CF)Nc1cccc[n]1 Amb24452192 [0,1,0,0,0,0|3,0,0]=4 1189 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,1,0,0,0,0|2,0,0]=3 1190 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,1,0,0,0,0|2,0,0]=3 1191 B11R1.40 O=C(CP)Nc1ccccc1 Amb25032359 [0,1,0,0,0,0|2,0,0]=3 1192 B11R1.40 O=C(CS)Nc1ccc[n]c1 Amb25147953 [0,1,0,0,0,0|2,1,0]=4 1193 B11R1.40 O=C(CS)Nc1cccc[n]1 Amb20622356 [0,1,0,0,0,0|2,1,0]=4 1194 B11R1.40 O=C(Cc1cc[n]cc1)CCl Amb22494556 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.40 O=C(Cc1ccccc1)CF Amb22234964 [0,1,0,0,0,0|1,0,0]=2 1196 B11R1.40 O=C(Cc1ccccc1)CS Amb25294429 [0,1,0,0,0,0|0,1,0]=2 1197 B11R1.40 O=C(Cc1ccccc1)O[Ag] Amb22359200 [0,1,0,0,0,0|0,0,0]=1 1198 B11R1.40 O=C(Nc1ccccc1)NCl Amb25756195 [0,1,0,0,0,0|2,0,0]=3 1199 B11R1.40 O=C(Nc1ccccc1)SCl Amb25095177 [0,1,0,0,0,0|1,1,0]=3 1200 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,0,0,0,0|0,0,1]=2 1201 B11R1.40 O=CC(Br)Cc1c[n]ccc1 Amb25365114 [0,1,0,0,0,0|2,0,1]=4 1202 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [0,1,0,0,0,0|1,0,1]=3 1203 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [0,1,0,0,0,0|1,0,1]=3 1204 B11R1.40 O=CC(F)Cc1cc[n]cc1 Amb25053677 [0,1,0,0,0,0|2,0,1]=4 1205 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [0,1,0,0,0,0|1,0,1]=3 1206 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [0,1,0,0,0,0|1,0,1]=3 1207 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [0,1,0,0,0,0|1,0,1]=3 1208 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [0,1,0,0,0,0|1,0,1]=3 1209 B11R1.40 O=C\C(=C\c1ccccn1)\C Amb1014105 [0,1,0,0,0,0|2,0,1]=4 1210 B11R1.40 O=C\C(=C\c1cccnc1)\C Amb17334266 [0,1,0,0,0,0|2,0,1]=4 1211 B11R1.40 O=C\C(=C\c1ccncc1)\C Amb17334268 [0,1,0,0,0,0|2,0,1]=4 1212 B11R1.40 O=C\C(\Br)=C/c1ccccc1 Amb25047719 [0,1,0,0,0,0|1,0,1]=3 1213 B11R1.40 O=C\C(\Cl)=C/c1ccc[n]c1 Amb24357125 [0,1,0,0,0,0|2,0,1]=4 1214 B11R1.40 O=C\C(\Cl)=C\c1cccc[n]1 Amb18126489 [0,1,0,0,0,0|2,0,1]=4 1215 B11R1.40 O=C\C(\F)=C/c1ccccc1 Amb25714375 [0,1,0,0,0,0|1,0,1]=3 1216 B11R1.40 O=C\C(\F)=C\c1cccc[n]1 Amb24689556 [0,1,0,0,0,0|2,0,1]=4 1217 B11R1.40 O=C\C(\F)=C\c1ccccc1 Amb18125101 [0,1,0,0,0,0|1,0,1]=3 1218 B11R1.40 O=NC(Cc1ccccn1)C Amb10549352 [0,1,0,0,0,0|2,0,1]=4 1219 B11R1.40 O=N\C(\Br)=C\c1ccccc1 Amb24666519 [0,1,0,0,0,0|1,0,1]=3 1220 B11R1.40 O=S(CCl)Cc1ccccc1 Amb24373167 [0,1,0,0,0,0|2,0,0]=3 1221 B11R1.40 OC(CBr)Oc1ccccc1 Amb24724811 [0,1,0,0,0,0|2,0,1]=4 1222 B11R1.40 OC(CBr)Sc1ccccc1 Amb24065441 [0,1,0,0,0,0|2,0,1]=4 1223 B11R1.40 OC(CCl)C[n+]1ccccc1 Amb22346544 [0,1,0,0,0,0|2,0,1]=4 1224 B11R1.40 OC(CCl)Cc1c[n]ccc1 Amb25189476 [0,1,0,0,0,0|2,0,1]=4 1225 B11R1.40 OC(CCl)Oc1ccccc1 Amb24635839 [0,1,0,0,0,0|2,0,1]=4 1226 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,1,0,0,0,0|1,0,1]=3 1227 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [0,1,0,0,0,0|0,1,1]=3 1228 B11R1.40 OC(Cc1c[n]ccc1)C=O Amb24533570 [0,1,0,0,0,0|1,0,1]=3 1229 B11R1.40 OC(Cc1cc[n]cc1)C=O Amb24751695 [0,1,0,0,0,0|1,0,1]=3 1230 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [0,1,0,0,0,0|0,0,1]=2 1231 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [0,1,0,0,0,0|0,0,0]=1 1232 B11R1.40 OCC(=O)Nc1c[n]cc[n]1 Amb24685085 [0,1,0,0,0,0|3,0,0]=4 1233 B11R1.40 OCC(=O)Nc1ccccc1 Amb1110212 [0,1,0,0,0,0|1,0,0]=2 1234 B11R1.40 OCC(=O)Oc1ccccc1 Amb25149728 [0,1,0,0,0,0|1,0,0]=2 1235 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [0,1,0,0,0,0|1,0,1]=3 1236 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [0,1,0,0,0,0|0,0,2]=3 1237 B11R1.40 OCC(Cc1ccccn1)N Amb17062682 [0,1,0,0,0,0|2,0,1]=4 1238 B11R1.40 OCC(Cc1cccnc1)N Amb17062683 [0,1,0,0,0,0|2,0,1]=4 1239 B11R1.40 OCC(Cc1ccncc1)N Amb17062684 [0,1,0,0,0,0|2,0,1]=4 1240 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,1,0,0,0,0|1,0,1]=3 1241 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [0,1,0,0,0,0|1,0,1]=3 1242 B11R1.40 OCC(O)Nc1ccccc1 Amb25369775 [0,1,0,0,0,0|1,0,2]=4 1243 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [0,1,0,0,0,0|2,0,1]=4 1244 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [0,1,0,0,0,0|0,0,2]=3 1245 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [0,1,0,0,0,0|1,0,1]=3 1246 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [0,1,0,0,0,0|0,0,2]=3 1247 B11R1.40 OC\C(\Br)=C\c1ccccc1 Amb25187542 [0,1,0,0,0,0|1,0,1]=3 1248 B11R1.40 OC\C(\F)=C\c1cccc[n]1 Amb24354427 [0,1,0,0,0,0|2,0,1]=4 1249 B11R1.40 ON=C(Cc1ccccn1)N Amb13994155 [0,1,0,0,0,0|2,0,0]=3 1250 B11R1.40 ONC(=O)Cc1ccc[n]c1 Amb25052392 [0,1,0,0,0,0|1,0,0]=2 1251 B11R1.40 ONC(=O)Oc1ccccc1 Amb22493600 [0,1,0,0,0,0|1,0,0]=2 1252 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,1,0,0,0,0|1,0,1]=3 1253 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [0,1,0,0,0,0|1,0,1]=3 1254 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,1,0,0,0,0|1,0,1]=3 1255 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [0,1,0,0,0,0|0,0,1]=2 1256 B11R1.40 O\C(=C/c1ccccc1)\C=O Amb18124881 [0,1,0,0,0,0|0,0,1]=2 1257 B11R1.40 O\C(=C\c1ccccc1)\C=O Amb24595210 [0,1,0,0,0,0|0,0,1]=2 1258 B11R1.40 O\C(\CCl)=C/c1cccc[n]1 Amb24378083 [0,1,0,0,0,0|2,0,1]=4 1259 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [0,1,0,0,0,0|0,0,1]=2 1260 B11R1.40 O\N=C(/Cc1ccccc1)\N Amb1106303 [0,1,0,0,0,0|1,0,0]=2 1261 B11R1.40 O\N=C(\Cc1ccccc1)/N Amb1159399 [0,1,0,0,0,0|1,0,0]=2 1262 B11R1.40 O\N=C(\Cl)/Cc1ccccc1 Amb25721012 [0,1,0,0,0,0|1,0,0]=2 1263 B11R1.40 SCC(=O)Nc1ccccc1 Amb1349645 [0,1,0,0,0,0|1,1,0]=3 1264 B11R1.86 BrC(Br)=Cc1ccccc1Br Amb24074060 [0,1,0,0,0,0|2,0,1]=4 1265 B11R1.86 C=C(Br)Cc1ccccc1O Amb25147877 [0,1,0,0,0,0|2,0,0]=3 1266 B11R1.86 C=C(Cl)CN1C=CC=CC1=O Amb24550976 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.86 C=C(Cl)C[n+]1ccccc1Br Amb24349845 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.86 C=C(Cl)C[n+]1ccccc1F Amb25669868 [0,1,0,0,0,0|3,0,0]=4 1269 B11R1.86 C=C(Cl)Cc1ccccc1O Amb18126586 [0,1,0,0,0,0|2,0,0]=3 1270 B11R1.86 C=C1C=CC=CC1CC(O)=O Amb24396318 [0,1,0,0,0,0|0,0,1]=2 1271 B11R1.86 CC(=C)CN1C=CC=CC1=O Amb24426989 [0,1,0,0,0,0|3,0,0]=4 1272 B11R1.86 CC(=C)Cc1ccc[n]c1F Amb25831076 [0,1,0,0,0,0|3,0,0]=4 1273 B11R1.86 CC(=C)Cc1ccccc1N Amb18124844 [0,1,0,0,0,0|2,0,0]=3 1274 B11R1.86 CC(=C)Cc1ccccc1O Amb18124924 [0,1,0,0,0,0|2,0,0]=3 1275 B11R1.86 CC(=C)Sc1ccccc1O Amb18646620 [0,1,0,0,0,0|3,0,0]=4 1276 B11R1.86 CC(=N)Nc1ccccc1F Amb25087719 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.86 CC(=N)Nc1ccccc1I Amb25064560 [0,1,0,0,0,0|3,0,0]=4 1278 B11R1.86 CC(=O)CC1=NC=CNC1=O Amb18201469 [0,1,0,0,0,0|3,0,0]=4 1279 B11R1.86 CC(=O)CC1C=CNC=C1Cl Amb25294889 [0,1,0,0,0,0|2,0,1]=4 1280 B11R1.86 CC(=O)CN1C=CC=CC1=O Amb18177167 [0,1,0,0,0,0|2,0,0]=3 1281 B11R1.86 CC(=O)CN1C=CC=CC1=S Amb20647758 [0,1,0,0,0,0|2,0,0]=3 1282 B11R1.86 CC(=O)CN1C=CC=NC1=N Amb24707140 [0,1,0,0,0,0|3,0,0]=4 1283 B11R1.86 CC(=O)CN1C=CC=NC1=O Amb18182773 [0,1,0,0,0,0|3,0,0]=4 1284 B11R1.86 CC(=O)CN1C=CC=NC1=[NH2+] Amb20661238 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.86 CC(=O)CN1N=CC=CC1=O Amb18179415 [0,1,0,0,0,0|3,0,0]=4 1286 B11R1.86 CC(=O)C[n+]1ccccc1Br Amb2522951 [0,1,0,0,0,0|2,0,0]=3 1287 B11R1.86 CC(=O)C[n+]1ccccc1C Amb2556861 [0,1,0,0,0,0|2,0,0]=3 1288 B11R1.86 CC(=O)C[n+]1ccccc1N Amb24470768 [0,1,0,0,0,0|2,0,0]=3 1289 B11R1.86 CC(=O)Cc1[n]cc[n]c1Cl Amb24662372 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.86 CC(=O)Cc1[n]cccc1Cl Amb25169236 [0,1,0,0,0,0|2,0,0]=3 1291 B11R1.86 CC(=O)Cc1[n]cccc1F Amb23402724 [0,1,0,0,0,0|2,0,0]=3 1292 B11R1.86 CC(=O)Cc1c[n]c[n]c1Cl Amb25268464 [0,1,0,0,0,0|3,0,0]=4 1293 B11R1.86 CC(=O)Cc1c[n]ccc1N Amb25824114 [0,1,0,0,0,0|2,0,0]=3 1294 B11R1.86 CC(=O)Cc1cc[n]cc1F Amb25152854 [0,1,0,0,0,0|2,0,0]=3 1295 B11R1.86 CC(=O)Cc1cc[n]cc1O Amb24579005 [0,1,0,0,0,0|2,0,0]=3 1296 B11R1.86 CC(=O)Cc1ccc[n]c1N Amb25789980 [0,1,0,0,0,0|2,0,0]=3 1297 B11R1.86 CC(=O)Cc1cccc[n+]1C Amb16224769 [0,1,0,0,0,0|2,0,0]=3 1298 B11R1.86 CC(=O)Cc1ccccc1I Amb24431271 [0,1,0,0,0,0|1,0,0]=2 1299 B11R1.86 CC(=O)Cc1ccccc1O Amb18041942 [0,1,0,0,0,0|1,0,0]=2 1300 B11R1.86 CC(=O)Cc1ccccc1S Amb25312284 [0,1,0,0,0,0|1,0,0]=2 1301 B11R1.86 CC(=O)Cc1ncccc1C Amb1995156 [0,1,0,0,0,0|2,0,0]=3 1302 B11R1.86 CC(=O)NC1=CC=CNC1=O Amb22747067 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.86 CC(=O)NC1=CC=CNC1=S Amb25322217 [0,1,0,0,0,0|3,0,0]=4 1304 B11R1.86 CC(=O)NC1=COC=CC1=O Amb25287593 [0,1,0,0,0,0|3,0,0]=4 1305 B11R1.86 CC(=O)Nc1[n]cccc1Cl Amb24083706 [0,1,0,0,0,0|3,0,0]=4 1306 B11R1.86 CC(=O)Nc1[n]cccc1F Amb23401859 [0,1,0,0,0,0|3,0,0]=4 1307 B11R1.86 CC(=O)Nc1[n]cccc1N Amb18125264 [0,1,0,0,0,0|3,0,0]=4 1308 B11R1.86 CC(=O)Nc1c[n]ccc1Cl Amb22495899 [0,1,0,0,0,0|3,0,0]=4 1309 B11R1.86 CC(=O)Nc1c[n]ccc1N Amb20247153 [0,1,0,0,0,0|3,0,0]=4 1310 B11R1.86 CC(=O)Nc1c[n]ccc1N Amb24083708 [0,1,0,0,0,0|3,0,0]=4 1311 B11R1.86 CC(=O)Nc1cc[n]cc1Cl Amb25187612 [0,1,0,0,0,0|3,0,0]=4 1312 B11R1.86 CC(=O)Nc1ccc[n]c1I Amb24613116 [0,1,0,0,0,0|3,0,0]=4 1313 B11R1.86 CC(=O)Nc1ccccc1F Amb2444091 [0,1,0,0,0,0|2,0,0]=3 1314 B11R1.86 CC(=O)Nc1ccccc1N Amb1121033 [0,1,0,0,0,0|2,0,0]=3 1315 B11R1.86 CC(=O)Nc1ccccc1O Amb1212257 [0,1,0,0,0,0|2,0,0]=3 1316 B11R1.86 CC(=O)Nc1ccccc1S Amb16186713 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.86 CC(=O)Nc1cccnc1O Amb13889927 [0,1,0,0,0,0|3,0,0]=4 1318 B11R1.86 CC(=O)Nc1cccoc1=O Amb24072052 [0,1,0,0,0,0|3,0,0]=4 1319 B11R1.86 CC(=O)Nc1ccncc1N Amb16230402 [0,1,0,0,0,0|3,0,0]=4 1320 B11R1.86 CC(=O)Nc1ccncc1O Amb13889918 [0,1,0,0,0,0|3,0,0]=4 1321 B11R1.86 CC(=O)Nc1cnccc1O Amb13889919 [0,1,0,0,0,0|3,0,0]=4 1322 B11R1.86 CC(=O)OC1=CC=CNC1=O Amb20660071 [0,1,0,0,0,0|3,0,0]=4 1323 B11R1.86 CC(=O)OC1=CC=CNC1=S Amb24677788 [0,1,0,0,0,0|3,0,0]=4 1324 B11R1.86 CC(=O)OC1=COC=CC1=O Amb25288533 [0,1,0,0,0,0|3,0,0]=4 1325 B11R1.86 CC(=O)ON1C=CC=CC1=O Amb24713195 [0,1,0,0,0,0|3,0,0]=4 1326 B11R1.86 CC(=O)Oc1[n]cccc1Br Amb25258912 [0,1,0,0,0,0|3,0,0]=4 1327 B11R1.86 CC(=O)Oc1c[n]ccc1Br Amb23412302 [0,1,0,0,0,0|3,0,0]=4 1328 B11R1.86 CC(=O)Oc1ccccc1Br Amb20242519 [0,1,0,0,0,0|2,0,0]=3 1329 B11R1.86 CC(=O)Oc1ccccc1F Amb10605688 [0,1,0,0,0,0|2,0,0]=3 1330 B11R1.86 CC(=O)Oc1ccccc1I Amb10975213 [0,1,0,0,0,0|2,0,0]=3 1331 B11R1.86 CC(=O)Oc1ccccc1N Amb18644456 [0,1,0,0,0,0|2,0,0]=3 1332 B11R1.86 CC(=O)Oc1ccccc1O Amb18125344 [0,1,0,0,0,0|2,0,0]=3 1333 B11R1.86 CC(=O)Oc1cccnc1I Amb2405507 [0,1,0,0,0,0|3,0,0]=4 1334 B11R1.86 CC(=O)\C=C\1/C=CC=CN1C Amb25282770 [0,1,0,0,0,0|2,0,1]=4 1335 B11R1.86 CC(=O)\N=C/1\C=CC=CC1N Amb24072876 [0,1,0,0,0,0|2,0,1]=4 1336 B11R1.86 CC(=S)Nc1ccccc1Br Amb22728786 [0,1,0,0,0,0|2,1,0]=4 1337 B11R1.86 CC(=S)Nc1ccccc1Cl Amb24640250 [0,1,0,0,0,0|2,1,0]=4 1338 B11R1.86 CC(=S)Nc1ccccc1F Amb25742786 [0,1,0,0,0,0|2,1,0]=4 1339 B11R1.86 CC(Br)Cc1ccccc1Cl Amb24477523 [0,1,0,0,0,0|2,0,1]=4 1340 B11R1.86 CC(Br)Cc1ccccc1F Amb24477522 [0,1,0,0,0,0|2,0,1]=4 1341 B11R1.86 CC(C)=Cc1ccccc1N Amb24509254 [0,1,0,0,0,0|2,0,1]=4 1342 B11R1.86 CC(C)=Cc1ccccc1O Amb18124916 [0,1,0,0,0,0|2,0,1]=4 1343 B11R1.86 CC(C)=Nc1ccccc1N Amb25326372 [0,1,0,0,0,0|3,0,0]=4 1344 B11R1.86 CC(C)=Nc1ccccc1O Amb25370803 [0,1,0,0,0,0|3,0,0]=4 1345 B11R1.86 CC(C)Cc1ccccc1Br Amb23400887 [0,1,0,0,0,0|2,0,1]=4 1346 B11R1.86 CC(C)Cc1ccccc1N Amb18644400 [0,1,0,0,0,0|2,0,1]=4 1347 B11R1.86 CC(C)Cc1ccccc1O Amb18125161 [0,1,0,0,0,0|2,0,1]=4 1348 B11R1.86 CC(Cc1ccccc1C)Cl Amb17477590 [0,1,0,0,0,0|2,0,1]=4 1349 B11R1.86 CC(Cc1ccccc1C)N Amb10609282 [0,1,0,0,0,0|2,0,1]=4 1350 B11R1.86 CC(Cc1ccccc1C)O Amb17138429 [0,1,0,0,0,0|1,0,1]=3 1351 B11R1.86 CC(Cc1ccccc1Cl)Cl Amb17477735 [0,1,0,0,0,0|2,0,1]=4 1352 B11R1.86 CC(Cc1ccccc1Cl)O Amb17138668 [0,1,0,0,0,0|1,0,1]=3 1353 B11R1.86 CC(Cc1ccccc1F)O Amb17138450 [0,1,0,0,0,0|1,0,1]=3 1354 B11R1.86 CC(Cc1ncccc1C)O Amb1995155 [0,1,0,0,0,0|2,0,1]=4 1355 B11R1.86 CC(Cl)Cc1ccccc1Br Amb25289973 [0,1,0,0,0,0|2,0,1]=4 1356 B11R1.86 CC(Cl)Cc1ccccc1F Amb18178039 [0,1,0,0,0,0|2,0,1]=4 1357 B11R1.86 CC(Cl)Cc1ccccc1N Amb25028099 [0,1,0,0,0,0|2,0,1]=4 1358 B11R1.86 CC(F)Cc1ccccc1O Amb24486439 [0,1,0,0,0,0|2,0,1]=4 1359 B11R1.86 CC(N)Cc1ccccc1Br Amb20626162 [0,1,0,0,0,0|2,0,1]=4 1360 B11R1.86 CC(N)Cc1ccccc1F Amb22055289 [0,1,0,0,0,0|2,0,1]=4 1361 B11R1.86 CC(N)Cc1ccccc1N Amb24070090 [0,1,0,0,0,0|2,0,1]=4 1362 B11R1.86 CC(O)CN1C=CC=CC1=N Amb19895632 [0,1,0,0,0,0|2,0,1]=4 1363 B11R1.86 CC(O)CN1C=CC=CC1=O Amb18179470 [0,1,0,0,0,0|2,0,1]=4 1364 B11R1.86 CC(O)Cc1ccc[n]c1N Amb24446997 [0,1,0,0,0,0|2,0,1]=4 1365 B11R1.86 CC(O)Cc1ccccc1N Amb24369609 [0,1,0,0,0,0|1,0,1]=3 1366 B11R1.86 CC(O)Cc1ccccc1O Amb18125386 [0,1,0,0,0,0|1,0,1]=3 1367 B11R1.86 CC(O)Cc1ccccc1S Amb25346291 [0,1,0,0,0,0|1,0,1]=3 1368 B11R1.86 CN(C)Cc1ccccc1C Amb17663824 [0,1,0,0,0,0|3,0,0]=4 1369 B11R1.86 CN(C)Cc1ccccc1Cl Amb17827038 [0,1,0,0,0,0|3,0,0]=4 1370 B11R1.86 CN(C)Cc1ccccc1F Amb17717255 [0,1,0,0,0,0|3,0,0]=4 1371 B11R1.86 CN(C)Cc1ccccc1N Amb22755856 [0,1,0,0,0,0|3,0,0]=4 1372 B11R1.86 CN(C)Cc1ccccc1O Amb21868780 [0,1,0,0,0,0|3,0,0]=4 1373 B11R1.86 CN(C)Cc1ccccc1O Amb22730884 [0,1,0,0,0,0|3,0,0]=4 1374 B11R1.86 CN(C)Cc1ccccc1S Amb19649790 [0,1,0,0,0,0|3,0,0]=4 1375 B11R1.86 CN(Cc1ccccc1I)C Amb10071381 [0,1,0,0,0,0|3,0,0]=4 1376 B11R1.86 CN(Cc1ccccc1N)C Amb13949144 [0,1,0,0,0,0|3,0,0]=4 1377 B11R1.86 CN(Cc1ccccc1O)C Amb2052288 [0,1,0,0,0,0|3,0,0]=4 1378 B11R1.86 CN(N)Cc1ccccc1Br Amb25692412 [0,1,0,0,0,0|3,0,0]=4 1379 B11R1.86 CN(N)Cc1ccccc1Cl Amb18563932 [0,1,0,0,0,0|3,0,0]=4 1380 B11R1.86 CN(N)Cc1ccccc1F Amb18065410 [0,1,0,0,0,0|3,0,0]=4 1381 B11R1.86 CN(N)Cc1ccccc1O Amb24614787 [0,1,0,0,0,0|3,0,0]=4 1382 B11R1.86 CN(O)Cc1ccccc1O Amb24676904 [0,1,0,0,0,0|2,0,0]=3 1383 B11R1.86 CN/1C=CC=C\C1=N/C(N)=O Amb24741233 [0,1,0,0,0,0|3,0,0]=4 1384 B11R1.86 CS(=O)Cc1ccc[n]c1N Amb25775357 [0,1,0,0,0,0|3,0,0]=4 1385 B11R1.86 CS(=O)Cc1ccccc1Cl Amb24485114 [0,1,0,0,0,0|2,0,0]=3 1386 B11R1.86 CS(=O)Cc1ccccc1N Amb18282229 [0,1,0,0,0,0|2,0,0]=3 1387 B11R1.86 CS(=O)Cc1ccccc1O Amb24486438 [0,1,0,0,0,0|2,0,0]=3 1388 B11R1.86 CS(=O)Nc1ccccc1Br Amb25177190 [0,1,0,0,0,0|3,0,0]=4 1389 B11R1.86 CS(=O)Nc1ccccc1I Amb24725109 [0,1,0,0,0,0|3,0,0]=4 1390 B11R1.86 CS(=O)Nc1ccccc1N Amb24578252 [0,1,0,0,0,0|3,0,0]=4 1391 B11R1.86 CS(=O)Nc1ccccc1O Amb25177210 [0,1,0,0,0,0|3,0,0]=4 1392 B11R1.86 C[C@@H](N)Cc1ccccc1N Amb25844561 [0,1,0,0,0,0|2,0,1]=4 1393 B11R1.86 C[C@@H](O)CN1C=CC=CC1=O Amb25079526 [0,1,0,0,0,0|2,0,1]=4 1394 B11R1.86 C[C@@H](O)Cc1ccccc1Cl Amb25842201 [0,1,0,0,0,0|1,0,1]=3 1395 B11R1.86 C[C@@H](O)Cc1ccccc1O Amb22896916 [0,1,0,0,0,0|1,0,1]=3 1396 B11R1.86 C[C@H](N)Cc1ccccc1Cl Amb25793461 [0,1,0,0,0,0|2,0,1]=4 1397 B11R1.86 C[C@H](N)Cc1ccccc1F Amb25726401 [0,1,0,0,0,0|2,0,1]=4 1398 B11R1.86 C[C@H](N)Cc1ccccc1N Amb24419036 [0,1,0,0,0,0|2,0,1]=4 1399 B11R1.86 C[C@H](O)CN1C=CC=CC1=O Amb25122337 [0,1,0,0,0,0|2,0,1]=4 1400 B11R1.86 C[C@H](O)Cc1ccccc1F Amb25792429 [0,1,0,0,0,0|1,0,1]=3 1401 B11R1.86 Cc1[n]cc[n]c1CC(C)=O Amb18201921 [0,1,0,0,0,0|3,0,0]=4 1402 B11R1.86 Cc1[n]cc[n]c1CC(O)=O Amb18201468 [0,1,0,0,0,0|2,0,0]=3 1403 B11R1.86 Cc1[n]cccc1CC(=O)Cl Amb25364584 [0,1,0,0,0,0|2,0,0]=3 1404 B11R1.86 Cc1[n]cccc1CC(O)=O Amb18215698 [0,1,0,0,0,0|1,0,0]=2 1405 B11R1.86 Cc1[n]cccc1NC(C)=O Amb22750736 [0,1,0,0,0,0|3,0,0]=4 1406 B11R1.86 Cc1[n]cccc1OC(=O)Cl Amb25303759 [0,1,0,0,0,0|3,0,0]=4 1407 B11R1.86 Cc1[n]cccc1OC(C)=O Amb24485974 [0,1,0,0,0,0|3,0,0]=4 1408 B11R1.86 Cc1[n]cccc1OC(N)=O Amb22295922 [0,1,0,0,0,0|3,0,0]=4 1409 B11R1.86 Cc1c[n]ccc1NC(C)=O Amb20248230 [0,1,0,0,0,0|3,0,0]=4 1410 B11R1.86 Cc1cc[n]cc1CC(C)=C Amb24356431 [0,1,0,0,0,0|3,0,0]=4 1411 B11R1.86 Cc1cc[n]cc1CC(O)=O Amb18201752 [0,1,0,0,0,0|1,0,0]=2 1412 B11R1.86 Cc1cc[n]cc1OC(C)=O Amb24102576 [0,1,0,0,0,0|3,0,0]=4 1413 B11R1.86 Cc1ccc[n]c1CC(N)=N Amb25728557 [0,1,0,0,0,0|3,0,0]=4 1414 B11R1.86 Cc1ccc[n]c1CC(N)=O Amb25114188 [0,1,0,0,0,0|2,0,0]=3 1415 B11R1.86 Cc1ccc[n]c1CC(O)=O Amb20247885 [0,1,0,0,0,0|1,0,0]=2 1416 B11R1.86 Cc1ccc[n]c1CC(O)=O Amb22587588 [0,1,0,0,0,0|1,0,0]=2 1417 B11R1.86 Cc1ccc[n]c1C[N+]([O-])=O Amb25196045 [0,1,0,0,0,0|2,0,1]=4 1418 B11R1.86 Cc1ccc[n]c1NC(N)=O Amb25708319 [0,1,0,0,0,0|3,0,0]=4 1419 B11R1.86 Cc1cccc[n+]1CC(=C)Cl Amb25762633 [0,1,0,0,0,0|3,0,0]=4 1420 B11R1.86 Cc1ccccc1C=C(Br)Br Amb18112946 [0,1,0,0,0,0|2,0,1]=4 1421 B11R1.86 Cc1ccccc1CB(O)O Amb25728634 [0,1,0,0,0,0|1,0,1]=3 1422 B11R1.86 Cc1ccccc1CC(Cl)Cl Amb25697186 [0,1,0,0,0,0|2,0,1]=4 1423 B11R1.86 Cc1ccccc1CC(N)=N Amb20622866 [0,1,0,0,0,0|2,0,0]=3 1424 B11R1.86 Cc1ccccc1CN(C)N Amb18064378 [0,1,0,0,0,0|3,0,0]=4 1425 B11R1.86 Cc1ccccc1C[C@@H](C)O Amb24432685 [0,1,0,0,0,0|1,0,1]=3 1426 B11R1.86 Cc1ccccc1NC(=N)Cl Amb25338234 [0,1,0,0,0,0|3,0,0]=4 1427 B11R1.86 Cc1ccccc1NC(=O)Cl Amb24668975 [0,1,0,0,0,0|2,0,0]=3 1428 B11R1.86 Cc1ccccc1NC(S)=S Amb24469343 [0,1,0,0,0,0|1,2,0]=4 1429 B11R1.86 Cc1ccccc1OC(=O)Cl Amb24055454 [0,1,0,0,0,0|2,0,0]=3 1430 B11R1.86 Cc1ccccc1OC(=S)Cl Amb24533218 [0,1,0,0,0,0|2,1,0]=4 1431 B11R1.86 Cc1ccccc1OC(C)O Amb25206423 [0,1,0,0,0,0|2,0,1]=4 1432 B11R1.86 Cc1ccccc1SC(C)=O Amb25189277 [0,1,0,0,0,0|2,0,0]=3 1433 B11R1.86 Cc1ccccc1SC(N)=N Amb25332627 [0,1,0,0,0,0|3,0,0]=4 1434 B11R1.86 ClC(=O)Oc1ccccc1Cl Amb10844668 [0,1,0,0,0,0|2,0,0]=3 1435 B11R1.86 Clc1ccccc1C=C(Br)Br Amb18115365 [0,1,0,0,0,0|2,0,1]=4 1436 B11R1.86 FC(F)Cc1ccccc1Br Amb19929261 [0,1,0,0,0,0|2,0,1]=4 1437 B11R1.86 FC(F)Cc1ccccc1I Amb22739040 [0,1,0,0,0,0|2,0,1]=4 1438 B11R1.86 Fc1ccccc1C=C(Br)Br Amb18115341 [0,1,0,0,0,0|2,0,1]=4 1439 B11R1.86 Fc1ccccc1CC(Cl)Cl Amb24487864 [0,1,0,0,0,0|2,0,1]=4 1440 B11R1.86 N=C1C=CC=CN1CC(O)=O Amb19888680 [0,1,0,0,0,0|1,0,0]=2 1441 B11R1.86 N=C1C=CN=CN1CC(O)=O Amb24365199 [0,1,0,0,0,0|2,0,0]=3 1442 B11R1.86 NC(=N)Cc1[n]cccc1Br Amb25823671 [0,1,0,0,0,0|3,0,0]=4 1443 B11R1.86 NC(=N)Cc1cc[n]cc1Cl Amb24718923 [0,1,0,0,0,0|3,0,0]=4 1444 B11R1.86 NC(=N)Cc1ccccc1Br Amb16231135 [0,1,0,0,0,0|2,0,0]=3 1445 B11R1.86 NC(=N)Cc1ccccc1Cl Amb20673127 [0,1,0,0,0,0|2,0,0]=3 1446 B11R1.86 NC(=N)Cc1ccccc1O Amb25045573 [0,1,0,0,0,0|2,0,0]=3 1447 B11R1.86 NC(=N)Nc1ccccc1Br Amb10879748 [0,1,0,0,0,0|3,0,0]=4 1448 B11R1.86 NC(=N)Nc1ccccc1C Amb17505553 [0,1,0,0,0,0|3,0,0]=4 1449 B11R1.86 NC(=N)Nc1ccccc1Cl Amb18183575 [0,1,0,0,0,0|3,0,0]=4 1450 B11R1.86 NC(=N)Nc1ccccc1Cl Amb22831185 [0,1,0,0,0,0|3,0,0]=4 1451 B11R1.86 NC(=N)Nc1ccccc1F Amb18796697 [0,1,0,0,0,0|3,0,0]=4 1452 B11R1.86 NC(=N)Nc1ccccc1I Amb24476561 [0,1,0,0,0,0|3,0,0]=4 1453 B11R1.86 NC(=N)Sc1ccccc1F Amb24462214 [0,1,0,0,0,0|3,0,0]=4 1454 B11R1.86 NC(=O)CN1C=CC=CC1=O Amb18182770 [0,1,0,0,0,0|2,0,0]=3 1455 B11R1.86 NC(=O)CN1C=CC=NC1=O Amb18791530 [0,1,0,0,0,0|3,0,0]=4 1456 B11R1.86 NC(=O)CN1N=CC=CC1=O Amb18791531 [0,1,0,0,0,0|3,0,0]=4 1457 B11R1.86 NC(=O)C[n+]1ccccc1C Amb10567653 [0,1,0,0,0,0|2,0,0]=3 1458 B11R1.86 NC(=O)C[n+]1ccccc1F Amb25051063 [0,1,0,0,0,0|2,0,0]=3 1459 B11R1.86 NC(=O)Cc1[n]cccc1O Amb18125364 [0,1,0,0,0,0|2,0,0]=3 1460 B11R1.86 NC(=O)Cc1ccccc1C Amb2107849 [0,1,0,0,0,0|1,0,0]=2 1461 B11R1.86 NC(=O)Cc1ccccc1I Amb24685113 [0,1,0,0,0,0|1,0,0]=2 1462 B11R1.86 NC(=O)Cc1ccccc1N Amb1116123 [0,1,0,0,0,0|1,0,0]=2 1463 B11R1.86 NC(=O)NC1=CC=CNC1=S Amb24679428 [0,1,0,0,0,0|3,0,0]=4 1464 B11R1.86 NC(=O)Nc1[n]cccc1Cl Amb25149376 [0,1,0,0,0,0|3,0,0]=4 1465 B11R1.86 NC(=O)Nc1cc[n]cc1Br Amb24631139 [0,1,0,0,0,0|3,0,0]=4 1466 B11R1.86 NC(=O)Nc1cc[n]cc1I Amb25271124 [0,1,0,0,0,0|3,0,0]=4 1467 B11R1.86 NC(=O)Nc1ccc[n]c1Cl Amb23584701 [0,1,0,0,0,0|3,0,0]=4 1468 B11R1.86 NC(=O)Nc1ccc[n]c1O Amb25363195 [0,1,0,0,0,0|3,0,0]=4 1469 B11R1.86 NC(=O)Nc1ccccc1Br Amb1140530 [0,1,0,0,0,0|2,0,0]=3 1470 B11R1.86 NC(=O)Nc1ccccc1Cl Amb1131193 [0,1,0,0,0,0|2,0,0]=3 1471 B11R1.86 NC(=O)Nc1ccccc1F Amb1211836 [0,1,0,0,0,0|2,0,0]=3 1472 B11R1.86 NC(=O)Nc1ccccc1N Amb1114330 [0,1,0,0,0,0|2,0,0]=3 1473 B11R1.86 NC(=O)Nc1ccccc1O Amb18125361 [0,1,0,0,0,0|2,0,0]=3 1474 B11R1.86 NC(=O)Oc1ccccc1C Amb10576081 [0,1,0,0,0,0|2,0,0]=3 1475 B11R1.86 NC(=O)Oc1ccccc1Cl Amb10575594 [0,1,0,0,0,0|2,0,0]=3 1476 B11R1.86 NC(=O)Oc1ccccc1F Amb16227453 [0,1,0,0,0,0|2,0,0]=3 1477 B11R1.86 NC(=O)Sc1ccccc1Cl Amb24739645 [0,1,0,0,0,0|2,0,0]=3 1478 B11R1.86 NC(=S)CN1C=CC=CC1=O Amb18012904 [0,1,0,0,0,0|2,1,0]=4 1479 B11R1.86 NC(=S)C[n+]1ccccc1C Amb17119685 [0,1,0,0,0,0|2,1,0]=4 1480 B11R1.86 NC(=S)Nc1ccccc1Br Amb2372750 [0,1,0,0,0,0|2,1,0]=4 1481 B11R1.86 NC(=S)Nc1ccccc1C Amb1350449 [0,1,0,0,0,0|2,1,0]=4 1482 B11R1.86 NC(=S)Nc1ccccc1F Amb1157575 [0,1,0,0,0,0|2,1,0]=4 1483 B11R1.86 NC(=S)Nc1ccccc1I Amb2256330 [0,1,0,0,0,0|2,1,0]=4 1484 B11R1.86 NC(=S)Nc1ccccc1O Amb2528108 [0,1,0,0,0,0|2,1,0]=4 1485 B11R1.86 NC(=S)Nc1ccccc1S Amb25689801 [0,1,0,0,0,0|2,1,0]=4 1486 B11R1.86 NC(O)Cc1ccccc1O Amb25051465 [0,1,0,0,0,0|1,0,1]=3 1487 B11R1.86 Nc1[n]c[n]cc1CC(N)=O Amb25277622 [0,1,0,0,0,0|3,0,0]=4 1488 B11R1.86 Nc1[n]c[n]cc1CC(O)=O Amb18201153 [0,1,0,0,0,0|2,0,0]=3 1489 B11R1.86 Nc1[n]cccc1CC(O)=O Amb21962140 [0,1,0,0,0,0|1,0,0]=2 1490 B11R1.86 Nc1[n]cccc1C[N+]([O-])=O Amb24061062 [0,1,0,0,0,0|2,0,1]=4 1491 B11R1.86 Nc1[n]cccc1NC(N)=O Amb24630844 [0,1,0,0,0,0|3,0,0]=4 1492 B11R1.86 Nc1c[n]ccc1CC(O)=O Amb20171419 [0,1,0,0,0,0|1,0,0]=2 1493 B11R1.86 Nc1c[n]ccc1NC(N)=O Amb18280957 [0,1,0,0,0,0|3,0,0]=4 1494 B11R1.86 Nc1cc[n]cc1CC(O)=O Amb20171456 [0,1,0,0,0,0|1,0,0]=2 1495 B11R1.86 Nc1cc[n]cc1CC(O)=O Amb22491670 [0,1,0,0,0,0|1,0,0]=2 1496 B11R1.86 Nc1cc[n]cc1NC(N)=O Amb25706782 [0,1,0,0,0,0|3,0,0]=4 1497 B11R1.86 Nc1ccc[n]c1CC(O)=O Amb18125358 [0,1,0,0,0,0|1,0,0]=2 1498 B11R1.86 Nc1ccc[n]c1NC(N)=O Amb24486748 [0,1,0,0,0,0|3,0,0]=4 1499 B11R1.86 Nc1ccc[n]c1OC(N)=O Amb25237535 [0,1,0,0,0,0|3,0,0]=4 1500 B11R1.86 Nc1cccc[n+]1CP([O-])=O Amb24589223 [0,1,0,0,0,0|2,0,1]=4 1501 B11R1.86 Nc1ccccc1NC(N)=N Amb24484491 [0,1,0,0,0,0|3,0,0]=4 1502 B11R1.86 Nc1ccccc1NC(N)=S Amb24565794 [0,1,0,0,0,0|2,1,0]=4 1503 B11R1.86 Nc1ccccc1OC(N)=O Amb24636357 [0,1,0,0,0,0|2,0,0]=3 1504 B11R1.86 O=C(Cl)OC1=CC=CNC1=S Amb24693203 [0,1,0,0,0,0|3,0,0]=4 1505 B11R1.86 O=C(Cl)Oc1ccc[n]c1Br Amb25058454 [0,1,0,0,0,0|3,0,0]=4 1506 B11R1.86 O=C(F)Nc1ccccc1Cl Amb25189380 [0,1,0,0,0,0|2,0,0]=3 1507 B11R1.86 O=S(Cl)Cc1ccccc1F Amb24654921 [0,1,0,0,0,0|2,0,0]=3 1508 B11R1.86 OB(O)Cc1[n]cccc1Br Amb25163199 [0,1,0,0,0,0|2,0,1]=4 1509 B11R1.86 OB(O)Cc1ccccc1Cl Amb24723210 [0,1,0,0,0,0|1,0,1]=3 1510 B11R1.86 OC(=O)CC1=CC=CNC1=O Amb18925114 [0,1,0,0,0,0|1,0,0]=2 1511 B11R1.86 OC(=O)CC1=CCCCC1=O Amb18125686 [0,1,0,0,0,0|0,0,3]=4 1512 B11R1.86 OC(=O)CC1=CN=CNC1=O Amb19516784 [0,1,0,0,0,0|2,0,0]=3 1513 B11R1.86 OC(=O)CC1=CNC=CC1=O Amb25684519 [0,1,0,0,0,0|1,0,0]=2 1514 B11R1.86 OC(=O)CC1=COCCC1=O Amb24106430 [0,1,0,0,0,0|1,0,2]=4 1515 B11R1.86 OC(=O)CN1C=CC=CC1=O Amb18536106 [0,1,0,0,0,0|1,0,0]=2 1516 B11R1.86 OC(=O)CN1C=CC=NC1=O Amb18284125 [0,1,0,0,0,0|2,0,0]=3 1517 B11R1.86 OC(=O)CN1C=CSCC1=O Amb17205153 [0,1,0,0,0,0|2,0,1]=4 1518 B11R1.86 OC(=O)CN1C=NC=CC1=O Amb25830306 [0,1,0,0,0,0|2,0,0]=3 1519 B11R1.86 OC(=O)CN1N=CC=CC1=O Amb18288263 [0,1,0,0,0,0|2,0,0]=3 1520 B11R1.86 OC(=O)Cc1[n]c[n]cc1Br Amb22496247 [0,1,0,0,0,0|2,0,0]=3 1521 B11R1.86 OC(=O)Cc1[n]c[n]cc1Cl Amb22496228 [0,1,0,0,0,0|2,0,0]=3 1522 B11R1.86 OC(=O)Cc1[n]cc[n]c1Cl Amb22498026 [0,1,0,0,0,0|2,0,0]=3 1523 B11R1.86 OC(=O)Cc1[n]cccc1Br Amb20247878 [0,1,0,0,0,0|1,0,0]=2 1524 B11R1.86 OC(=O)Cc1[n]cccc1Br Amb20247879 [0,1,0,0,0,0|1,0,0]=2 1525 B11R1.86 OC(=O)Cc1[n]cccc1Cl Amb19516058 [0,1,0,0,0,0|1,0,0]=2 1526 B11R1.86 OC(=O)Cc1[n]cccc1F Amb20247871 [0,1,0,0,0,0|1,0,0]=2 1527 B11R1.86 OC(=O)Cc1c[n]c[n]c1Cl Amb18198128 [0,1,0,0,0,0|2,0,0]=3 1528 B11R1.86 OC(=O)Cc1c[n]ccc1Br Amb24105356 [0,1,0,0,0,0|1,0,0]=2 1529 B11R1.86 OC(=O)Cc1c[n]ccc1Cl Amb18198378 [0,1,0,0,0,0|1,0,0]=2 1530 B11R1.86 OC(=O)Cc1c[n]ccc1F Amb20247893 [0,1,0,0,0,0|1,0,0]=2 1531 B11R1.86 OC(=O)Cc1cc[n]cc1Br Amb23586154 [0,1,0,0,0,0|1,0,0]=2 1532 B11R1.86 OC(=O)Cc1cc[n]cc1Cl Amb18198379 [0,1,0,0,0,0|1,0,0]=2 1533 B11R1.86 OC(=O)Cc1cc[n]cc1F Amb24379723 [0,1,0,0,0,0|1,0,0]=2 1534 B11R1.86 OC(=O)Cc1ccc[n]c1Br Amb25834640 [0,1,0,0,0,0|1,0,0]=2 1535 B11R1.86 OC(=O)Cc1ccc[n]c1F Amb20247892 [0,1,0,0,0,0|1,0,0]=2 1536 B11R1.86 OC(=O)Cc1ccccc1Br Amb1139894 [0,1,0,0,0,0|0,0,0]=1 1537 B11R1.86 OC(=O)Cc1ccccc1O Amb2388914 [0,1,0,0,0,0|0,0,0]=1 1538 B11R1.86 OC(=O)Cc1ccccc1S Amb17616851 [0,1,0,0,0,0|0,0,0]=1 1539 B11R1.86 OC(=O)Nc1ccccc1C Amb1261710 [0,1,0,0,0,0|1,0,0]=2 1540 B11R1.86 OC(=S)Cc1ccccc1Br Amb24065440 [0,1,0,0,0,0|0,1,0]=2 1541 B11R1.86 OC(=S)Cc1ccccc1F Amb24065632 [0,1,0,0,0,0|0,1,0]=2 1542 B11R1.86 Oc1[n]cc[n]c1CC(O)=O Amb18831046 [0,1,0,0,0,0|2,0,0]=3 1543 B11R1.86 Oc1c[n]ccc1CC(O)=O Amb25849124 [0,1,0,0,0,0|1,0,0]=2 1544 B11R1.86 Oc1ccc[n]c1CC(O)=O Amb18125512 [0,1,0,0,0,0|1,0,0]=2 1545 B11R1.86 Oc1ccc[n]c1CC(O)=O Amb20247882 [0,1,0,0,0,0|1,0,0]=2 1546 B11R1.86 Oc1ccccc1C=C(Cl)Cl Amb25373129 [0,1,0,0,0,0|2,0,1]=4 1547 B11R1.86 Oc1ccccc1OC(=O)Cl Amb25284326 [0,1,0,0,0,0|2,0,0]=3 1548 B11R1.86 SC(=S)Nc1ccccc1Cl Amb25188714 [0,1,0,0,0,0|1,2,0]=4 1549 B11R1.86 [O-]C(=O)Cc1[n]c[n]cc1Br Amb22756866 [0,1,0,0,0,0|2,0,1]=4 1550 B11R1.86 [O-]C(=O)Cc1[n]c[n]cc1Br Amb22756867 [0,1,0,0,0,0|2,0,1]=4 1551 B11R1.86 [O-]C(=O)Cc1[n]cccc1Cl Amb22899565 [0,1,0,0,0,0|1,0,1]=3 1552 B11R1.86 [O-][N+](=O)Cc1[n]cccc1Br Amb25095896 [0,1,0,0,0,0|2,0,1]=4 1553 B11R1.86 [O-][N+](=O)Cc1ccccc1Br Amb23589328 [0,1,0,0,0,0|1,0,1]=3 1554 B11R1.86 [O-][N+](=O)Cc1ccccc1Cl Amb23589312 [0,1,0,0,0,0|1,0,1]=3 1555 B11R1.86 [O-][N+](=O)Cc1ccccc1F Amb23589317 [0,1,0,0,0,0|1,0,1]=3 1556 B11R1.86 [O-][N+](=O)Cc1ccccc1O Amb24617748 [0,1,0,0,0,0|1,0,1]=3 1557 B11R1.86 [O-][N+](=O)Nc1ccccc1Cl Amb24093627 [0,1,0,0,0,0|2,0,1]=4 1558 B11R1.86 [O-][n+]1ccccc1CC(O)=O Amb25073338 [0,1,0,0,0,0|1,0,0]=2 1559 B11R1.157 BrC(=C)C[n+]1cccc(c1)O Amb11508181 [0,1,0,0,0,0|3,0,0]=4 1560 B11R1.157 C=C(Br)Cc1cccc(O)c1 Amb25149190 [0,1,0,0,0,0|2,0,0]=3 1561 B11R1.157 C=C(Cl)C[n+]1cc(O)ccc1 Amb24734747 [0,1,0,0,0,0|3,0,0]=4 1562 B11R1.157 CC(=C)Cc1cccc(O)c1 Amb24388029 [0,1,0,0,0,0|2,0,0]=3 1563 B11R1.157 CC(=N)Nc1cccc(Br)c1 Amb24533201 [0,1,0,0,0,0|3,0,0]=4 1564 B11R1.157 CC(=N)Nc1cccc(Cl)c1 Amb19884067 [0,1,0,0,0,0|3,0,0]=4 1565 B11R1.157 CC(=N)Nc1cccc(I)c1 Amb24373036 [0,1,0,0,0,0|3,0,0]=4 1566 B11R1.157 CC(=N)Nc1cccc(N)c1 Amb24072123 [0,1,0,0,0,0|3,0,0]=4 1567 B11R1.157 CC(=O)C[n+]1cccc(c1)Br Amb2522946 [0,1,0,0,0,0|2,0,0]=3 1568 B11R1.157 CC(=O)C[n+]1cccc(c1)C Amb1102045 [0,1,0,0,0,0|2,0,0]=3 1569 B11R1.157 CC(=O)Cc1c[n]cc(Br)c1 Amb24080127 [0,1,0,0,0,0|2,0,0]=3 1570 B11R1.157 CC(=O)Cc1c[n]cc(Cl)[n]1 Amb24519040 [0,1,0,0,0,0|3,0,0]=4 1571 B11R1.157 CC(=O)Cc1c[n]cc(N)c1 Amb24509274 [0,1,0,0,0,0|2,0,0]=3 1572 B11R1.157 CC(=O)Cc1cc(Cl)cc[n]1 Amb25808767 [0,1,0,0,0,0|2,0,0]=3 1573 B11R1.157 CC(=O)Cc1cc(O)[n]c[n]1 Amb25301633 [0,1,0,0,0,0|3,0,0]=4 1574 B11R1.157 CC(=O)Cc1cc[n]c(Cl)c1 Amb25301796 [0,1,0,0,0,0|2,0,0]=3 1575 B11R1.157 CC(=O)Cc1cc[n]c(N)c1 Amb25145695 [0,1,0,0,0,0|2,0,0]=3 1576 B11R1.157 CC(=O)Cc1cccc(Cl)[n]1 Amb25074053 [0,1,0,0,0,0|2,0,0]=3 1577 B11R1.157 CC(=O)Cc1cccc(c1)N Amb17477728 [0,1,0,0,0,0|1,0,0]=2 1578 B11R1.157 CC(=O)Cc1cccc(c1)O Amb16192704 [0,1,0,0,0,0|1,0,0]=2 1579 B11R1.157 CC(=O)Cc1cccc(n1)C Amb1995166 [0,1,0,0,0,0|2,0,0]=3 1580 B11R1.157 CC(=O)Cc1nccc(c1)C Amb1995157 [0,1,0,0,0,0|2,0,0]=3 1581 B11R1.157 CC(=O)NC1=CC(=O)NC=C1 Amb22752689 [0,1,0,0,0,0|3,0,0]=4 1582 B11R1.157 CC(=O)Nc1c[n]cc(Br)c1 Amb20242024 [0,1,0,0,0,0|3,0,0]=4 1583 B11R1.157 CC(=O)Nc1c[n]cc(F)c1 Amb25337418 [0,1,0,0,0,0|3,0,0]=4 1584 B11R1.157 CC(=O)Nc1c[n]cc(I)c1 Amb24574957 [0,1,0,0,0,0|3,0,0]=4 1585 B11R1.157 CC(=O)Nc1c[n]cc(N)c1 Amb25130782 [0,1,0,0,0,0|3,0,0]=4 1586 B11R1.157 CC(=O)Nc1c[n]cc(O)c1 Amb18125366 [0,1,0,0,0,0|3,0,0]=4 1587 B11R1.157 CC(=O)Nc1cc(Br)cc[n]1 Amb21857697 [0,1,0,0,0,0|3,0,0]=4 1588 B11R1.157 CC(=O)Nc1cc(Cl)ccn1 Amb15690612 [0,1,0,0,0,0|3,0,0]=4 1589 B11R1.157 CC(=O)Nc1cc(F)cc[n]1 Amb23400397 [0,1,0,0,0,0|3,0,0]=4 1590 B11R1.157 CC(=O)Nc1cc(I)cc[n]1 Amb21857698 [0,1,0,0,0,0|3,0,0]=4 1591 B11R1.157 CC(=O)Nc1cc(N)cc[n]1 Amb18644458 [0,1,0,0,0,0|3,0,0]=4 1592 B11R1.157 CC(=O)Nc1cc[n]c(N)c1 Amb20670782 [0,1,0,0,0,0|3,0,0]=4 1593 B11R1.157 CC(=O)Nc1ccc[n+](c1)C Amb2237835 [0,1,0,0,0,0|3,0,0]=4 1594 B11R1.157 CC(=O)Nc1ccc[n+](c1)[O-] Amb10576560 [0,1,0,0,0,0|3,0,0]=4 1595 B11R1.157 CC(=O)Nc1cccc(Cl)[n]1 Amb22736785 [0,1,0,0,0,0|3,0,0]=4 1596 B11R1.157 CC(=O)Nc1cccc(F)[n]1 Amb23401855 [0,1,0,0,0,0|3,0,0]=4 1597 B11R1.157 CC(=O)Nc1cccc(c1)Br Amb1019639 [0,1,0,0,0,0|2,0,0]=3 1598 B11R1.157 CC(=O)Nc1cccc(c1)C Amb1934773 [0,1,0,0,0,0|2,0,0]=3 1599 B11R1.157 CC(=O)Nc1cccc(c1)O Amb1208498 [0,1,0,0,0,0|2,0,0]=3 1600 B11R1.157 CC(=O)Nc1cccc(n1)C Amb1244208 [0,1,0,0,0,0|3,0,0]=4 1601 B11R1.157 CC(=O)Nc1cccn(=O)c1 Amb17749043 [0,1,0,0,0,0|3,0,0]=4 1602 B11R1.157 CC(=O)Nc1ccnc(c1)Cl Amb1257630 [0,1,0,0,0,0|3,0,0]=4 1603 B11R1.157 CC(=O)OC1=CC(=O)NC=C1 Amb25063093 [0,1,0,0,0,0|3,0,0]=4 1604 B11R1.157 CC(=O)Oc1c[n+](C)ccc1 Amb24728144 [0,1,0,0,0,0|3,0,0]=4 1605 B11R1.157 CC(=O)Oc1c[n]cc(Br)c1 Amb25847420 [0,1,0,0,0,0|3,0,0]=4 1606 B11R1.157 CC(=O)Oc1c[n]cc(Cl)c1 Amb25306173 [0,1,0,0,0,0|3,0,0]=4 1607 B11R1.157 CC(=O)Oc1cc[n]c(Br)c1 Amb20617577 [0,1,0,0,0,0|3,0,0]=4 1608 B11R1.157 CC(=O)Oc1cccc(Br)[n]1 Amb20617565 [0,1,0,0,0,0|3,0,0]=4 1609 B11R1.157 CC(=O)Oc1cccc(Br)c1 Amb21858014 [0,1,0,0,0,0|2,0,0]=3 1610 B11R1.157 CC(=O)Sc1cccc(F)c1 Amb24407201 [0,1,0,0,0,0|2,0,0]=3 1611 B11R1.157 CC(=S)Cc1cccc(Br)c1 Amb24701960 [0,1,0,0,0,0|1,1,0]=3 1612 B11R1.157 CC(=S)Cc1cccc(Cl)c1 Amb25088890 [0,1,0,0,0,0|1,1,0]=3 1613 B11R1.157 CC(=S)Nc1cccc(F)c1 Amb25352399 [0,1,0,0,0,0|2,1,0]=4 1614 B11R1.157 CC(Br)Cc1cc(Br)ccc1 Amb18548909 [0,1,0,0,0,0|2,0,1]=4 1615 B11R1.157 CC(C)=Cc1cccc(O)c1 Amb24334807 [0,1,0,0,0,0|2,0,1]=4 1616 B11R1.157 CC(C)=Nc1cccc(O)c1 Amb25087201 [0,1,0,0,0,0|3,0,0]=4 1617 B11R1.157 CC(C)Cc1cccc(Br)c1 Amb22750461 [0,1,0,0,0,0|2,0,1]=4 1618 B11R1.157 CC(C)Cc1cccc(F)c1 Amb25056766 [0,1,0,0,0,0|2,0,1]=4 1619 B11R1.157 CC(C)Cc1cccc(I)c1 Amb24487074 [0,1,0,0,0,0|2,0,1]=4 1620 B11R1.157 CC(C)Cc1cccc(O)c1 Amb18644438 [0,1,0,0,0,0|2,0,1]=4 1621 B11R1.157 CC(Cc1cccc(c1)Br)Cl Amb17477732 [0,1,0,0,0,0|2,0,1]=4 1622 B11R1.157 CC(Cc1cccc(c1)Br)N Amb10610450 [0,1,0,0,0,0|2,0,1]=4 1623 B11R1.157 CC(Cc1cccc(c1)Br)O Amb17477717 [0,1,0,0,0,0|1,0,1]=3 1624 B11R1.157 CC(Cc1cccc(c1)C)Cl Amb17477589 [0,1,0,0,0,0|2,0,1]=4 1625 B11R1.157 CC(Cc1cccc(c1)C)O Amb17138430 [0,1,0,0,0,0|1,0,1]=3 1626 B11R1.157 CC(Cc1cccc(c1)Cl)Cl Amb17477737 [0,1,0,0,0,0|2,0,1]=4 1627 B11R1.157 CC(Cc1cccc(c1)Cl)N Amb10205336 [0,1,0,0,0,0|2,0,1]=4 1628 B11R1.157 CC(Cc1cccc(c1)Cl)O Amb17138669 [0,1,0,0,0,0|1,0,1]=3 1629 B11R1.157 CC(Cc1cccc(c1)F)O Amb17138451 [0,1,0,0,0,0|1,0,1]=3 1630 B11R1.157 CC(Cc1cccc(c1)N)C Amb17138425 [0,1,0,0,0,0|2,0,1]=4 1631 B11R1.157 CC(Cc1cccc(n1)C)O Amb1995165 [0,1,0,0,0,0|2,0,1]=4 1632 B11R1.157 CC(Cc1nccc(c1)C)O Amb1995158 [0,1,0,0,0,0|2,0,1]=4 1633 B11R1.157 CC(Cl)Cc1cccc(F)c1 Amb18178038 [0,1,0,0,0,0|2,0,1]=4 1634 B11R1.157 CC(F)Cc1cccc(N)c1 Amb25377517 [0,1,0,0,0,0|2,0,1]=4 1635 B11R1.157 CC(F)Cc1cccc(O)c1 Amb25312419 [0,1,0,0,0,0|2,0,1]=4 1636 B11R1.157 CC(N)Cc1cccc(F)c1 Amb19515438 [0,1,0,0,0,0|2,0,1]=4 1637 B11R1.157 CC(N)Cc1cccc(O)c1 Amb22055403 [0,1,0,0,0,0|2,0,1]=4 1638 B11R1.157 CC(O)Cc1c[n]cc(F)c1 Amb24536145 [0,1,0,0,0,0|2,0,1]=4 1639 B11R1.157 CC(O)Cc1cccc(N)c1 Amb24666879 [0,1,0,0,0,0|1,0,1]=3 1640 B11R1.157 CC(O)Sc1cccc(Cl)c1 Amb24099968 [0,1,0,0,0,0|2,0,1]=4 1641 B11R1.157 CC(O)Sc1cccc(F)c1 Amb24094125 [0,1,0,0,0,0|2,0,1]=4 1642 B11R1.157 CN(C)Cc1cccc(C)c1 Amb17663821 [0,1,0,0,0,0|3,0,0]=4 1643 B11R1.157 CN(C)Cc1cccc(Cl)c1 Amb17663825 [0,1,0,0,0,0|3,0,0]=4 1644 B11R1.157 CN(C)Cc1cccc(F)c1 Amb17663829 [0,1,0,0,0,0|3,0,0]=4 1645 B11R1.157 CN(C)Cc1cccc(O)c1 Amb18125286 [0,1,0,0,0,0|3,0,0]=4 1646 B11R1.157 CN(C)Cc1cccc(O)c1 Amb22034547 [0,1,0,0,0,0|3,0,0]=4 1647 B11R1.157 CN(C)Cc1cccc(S)c1 Amb21959944 [0,1,0,0,0,0|3,0,0]=4 1648 B11R1.157 CN(Cc1cccc(c1)Br)C Amb2447333 [0,1,0,0,0,0|3,0,0]=4 1649 B11R1.157 CN(Cc1cccc(c1)I)C Amb10070276 [0,1,0,0,0,0|3,0,0]=4 1650 B11R1.157 CN(Cc1cccc(c1)S)C Amb16187185 [0,1,0,0,0,0|3,0,0]=4 1651 B11R1.157 CN(N)Cc1cccc(Br)c1 Amb18066854 [0,1,0,0,0,0|3,0,0]=4 1652 B11R1.157 CN(N)Cc1cccc(Cl)c1 Amb18563955 [0,1,0,0,0,0|3,0,0]=4 1653 B11R1.157 CS(=O)Cc1c[n]cc(Br)c1 Amb24696976 [0,1,0,0,0,0|3,0,0]=4 1654 B11R1.157 CS(=O)Cc1cc[n]c(N)c1 Amb25290938 [0,1,0,0,0,0|3,0,0]=4 1655 B11R1.157 CS(=O)Cc1cccc(Cl)c1 Amb25807309 [0,1,0,0,0,0|2,0,0]=3 1656 B11R1.157 CS(=O)Cc1cccc(N)c1 Amb18954301 [0,1,0,0,0,0|2,0,0]=3 1657 B11R1.157 CS(=O)Nc1cccc(Br)c1 Amb25177195 [0,1,0,0,0,0|3,0,0]=4 1658 B11R1.157 CS(=O)Nc1cccc(N)c1 Amb24565164 [0,1,0,0,0,0|3,0,0]=4 1659 B11R1.157 C[C@@H](N)Cc1cc(N)ccc1 Amb24485922 [0,1,0,0,0,0|2,0,1]=4 1660 B11R1.157 C[C@@H](N)Cc1cccc(Br)c1 Amb24670162 [0,1,0,0,0,0|2,0,1]=4 1661 B11R1.157 C[C@@H](O)Cc1cc(O)ccc1 Amb22896912 [0,1,0,0,0,0|1,0,1]=3 1662 B11R1.157 C[C@@H](O)Cc1cccc(Br)c1 Amb22896914 [0,1,0,0,0,0|1,0,1]=3 1663 B11R1.157 C[C@@H](O)Cc1cccc(F)c1 Amb25823607 [0,1,0,0,0,0|1,0,1]=3 1664 B11R1.157 C[C@H](N)Cc1cc(N)ccc1 Amb24378558 [0,1,0,0,0,0|2,0,1]=4 1665 B11R1.157 C[C@H](N)Cc1cccc(Br)c1 Amb25785909 [0,1,0,0,0,0|2,0,1]=4 1666 B11R1.157 C[C@H](N)Cc1cccc(Cl)c1 Amb24538303 [0,1,0,0,0,0|2,0,1]=4 1667 B11R1.157 C[C@H](N)Cc1cccc(F)c1 Amb25277304 [0,1,0,0,0,0|2,0,1]=4 1668 B11R1.157 C[C@H](N)Cc1cccc(S)c1 Amb24746814 [0,1,0,0,0,0|2,0,1]=4 1669 B11R1.157 C[C@H](O)Cc1cc(O)ccc1 Amb24486863 [0,1,0,0,0,0|1,0,1]=3 1670 B11R1.157 C[C@H](O)Cc1cccc(Br)c1 Amb25797570 [0,1,0,0,0,0|1,0,1]=3 1671 B11R1.157 C[n+]1cc(CC(O)=O)ccc1 Amb24443152 [0,1,0,0,0,0|1,0,0]=2 1672 B11R1.157 Cc1[n]c(CC(O)=O)[n]c[n]1 Amb24656517 [0,1,0,0,0,0|3,0,0]=4 1673 B11R1.157 Cc1[n]c(CC(O)=O)c[n][n]1 Amb18201166 [0,1,0,0,0,0|3,0,0]=4 1674 B11R1.157 Cc1[n]c(CC(O)=O)cc[n]1 Amb18201470 [0,1,0,0,0,0|2,0,0]=3 1675 B11R1.157 Cc1c[n+](CC(=C)Cl)ccc1 Amb25206112 [0,1,0,0,0,0|3,0,0]=4 1676 B11R1.157 Cc1c[n+](CC(N)=O)ccc1 Amb25274967 [0,1,0,0,0,0|2,0,0]=3 1677 B11R1.157 Cc1c[n+](CC(O)=O)ccc1 Amb25363198 [0,1,0,0,0,0|1,0,0]=2 1678 B11R1.157 Cc1c[n]cc(C[C@@H](C)O)c1 Amb22896888 [0,1,0,0,0,0|2,0,1]=4 1679 B11R1.157 Cc1cc(C=C(Br)Br)ccc1 Amb18635919 [0,1,0,0,0,0|2,0,1]=4 1680 B11R1.157 Cc1cc(CC(N)=O)[n]cc1 Amb25360857 [0,1,0,0,0,0|2,0,0]=3 1681 B11R1.157 Cc1cc(CC(N)=O)c[n]c1 Amb25099355 [0,1,0,0,0,0|2,0,0]=3 1682 B11R1.157 Cc1cc(CC(O)=O)[n]c[n]1 Amb18862487 [0,1,0,0,0,0|2,0,0]=3 1683 B11R1.157 Cc1cc(CC(O)=O)[n]cc1 Amb18201755 [0,1,0,0,0,0|1,0,0]=2 1684 B11R1.157 Cc1cc(CC(O)=O)[n]cc1 Amb22587582 [0,1,0,0,0,0|1,0,0]=2 1685 B11R1.157 Cc1cc(CC(O)=O)c[n]c1 Amb18201711 [0,1,0,0,0,0|1,0,0]=2 1686 B11R1.157 Cc1cc(CC(O)=O)cc[n]1 Amb18831266 [0,1,0,0,0,0|1,0,0]=2 1687 B11R1.157 Cc1cc(CC([O-])=O)[n]cc1 Amb23440537 [0,1,0,0,0,0|1,0,1]=3 1688 B11R1.157 Cc1cc(CS([O-])=O)ccc1 Amb25039109 [0,1,0,0,0,0|1,0,1]=3 1689 B11R1.157 Cc1cc(C[N+]([O-])=O)cc[n]1 Amb25223964 [0,1,0,0,0,0|2,0,1]=4 1690 B11R1.157 Cc1cc(C[N+]([O-])=O)ccc1 Amb25777011 [0,1,0,0,0,0|1,0,1]=3 1691 B11R1.157 Cc1cc(c[n]c1)NC(N)=O Amb25148139 [0,1,0,0,0,0|3,0,0]=4 1692 B11R1.157 Cc1cc(cc[n]1)NC(C)=O Amb20248228 [0,1,0,0,0,0|3,0,0]=4 1693 B11R1.157 Cc1cc(cc[n]1)NC(N)=O Amb24485015 [0,1,0,0,0,0|3,0,0]=4 1694 B11R1.157 Cc1cc(cc[n]1)OC(C)=O Amb25053397 [0,1,0,0,0,0|3,0,0]=4 1695 B11R1.157 Cc1cc(ccc1)NC(=N)Cl Amb24484913 [0,1,0,0,0,0|3,0,0]=4 1696 B11R1.157 Cc1cc(ccc1)NC(N)=N Amb20249359 [0,1,0,0,0,0|3,0,0]=4 1697 B11R1.157 Cc1cc(ccc1)NC(S)=S Amb24486091 [0,1,0,0,0,0|1,2,0]=4 1698 B11R1.157 Cc1cc(ccc1)OC(=O)Cl Amb22229382 [0,1,0,0,0,0|2,0,0]=3 1699 B11R1.157 Cc1cc(ccc1)OC(=S)Cl Amb24485765 [0,1,0,0,0,0|2,1,0]=4 1700 B11R1.157 Cc1cc(ccc1)OC(N)=N Amb24486535 [0,1,0,0,0,0|3,0,0]=4 1701 B11R1.157 Cc1cc(ccc1)SC(N)=N Amb24719022 [0,1,0,0,0,0|3,0,0]=4 1702 B11R1.157 Cc1cc(ccc1)SC(N)=O Amb25335340 [0,1,0,0,0,0|2,0,0]=3 1703 B11R1.157 Cc1cc[n]c(CC(O)=O)[n]1 Amb18224300 [0,1,0,0,0,0|2,0,0]=3 1704 B11R1.157 Cc1cccc(CC(C)C)c1 Amb24585328 [0,1,0,0,0,0|2,0,1]=4 1705 B11R1.157 Cc1cccc(CC(N)=N)[n]1 Amb24469933 [0,1,0,0,0,0|3,0,0]=4 1706 B11R1.157 Cc1cccc(CC(N)=O)[n]1 Amb22494002 [0,1,0,0,0,0|2,0,0]=3 1707 B11R1.157 Cc1cccc(CC([O-])=O)[n]1 Amb20076035 [0,1,0,0,0,0|1,0,1]=3 1708 B11R1.157 Cc1cccc(CN(C)N)c1 Amb18065019 [0,1,0,0,0,0|3,0,0]=4 1709 B11R1.157 Cc1cccc(C[C@H](C)N)c1 Amb24677552 [0,1,0,0,0,0|2,0,1]=4 1710 B11R1.157 Cc1cccc(C[N+]([O-])=O)[n]1 Amb25239503 [0,1,0,0,0,0|2,0,1]=4 1711 B11R1.157 Cc1cccc([n]1)OC(C)=O Amb24085033 [0,1,0,0,0,0|3,0,0]=4 1712 B11R1.157 Cc1cccc(c1)SC(C)O Amb24062165 [0,1,0,0,0,0|2,0,1]=4 1713 B11R1.157 Cc1cccc(n1)CC(=O)O Amb17617788 [0,1,0,0,0,0|1,0,0]=2 1714 B11R1.157 Clc1cc(C=C(Br)Br)ccc1 Amb24355244 [0,1,0,0,0,0|2,0,1]=4 1715 B11R1.157 FC(F)=Cc1cccc(Br)c1 Amb22229231 [0,1,0,0,0,0|2,0,1]=4 1716 B11R1.157 F\C(\Br)=C\c1cccc(Cl)c1 Amb24053593 [0,1,0,0,0,0|2,0,1]=4 1717 B11R1.157 Fc1cc(C=C(Br)Br)ccc1 Amb18114971 [0,1,0,0,0,0|2,0,1]=4 1718 B11R1.157 NC(=N)Cc1c[n]cc(F)c1 Amb25293455 [0,1,0,0,0,0|3,0,0]=4 1719 B11R1.157 NC(=N)Cc1cccc(Br)c1 Amb24271148 [0,1,0,0,0,0|2,0,0]=3 1720 B11R1.157 NC(=N)Cc1cccc(O)[n]1 Amb25223771 [0,1,0,0,0,0|3,0,0]=4 1721 B11R1.157 NC(=N)Cc1cccc(O)c1 Amb25133500 [0,1,0,0,0,0|2,0,0]=3 1722 B11R1.157 NC(=N)Cc1cccc(c1)Cl Amb2183303 [0,1,0,0,0,0|2,0,0]=3 1723 B11R1.157 NC(=N)Nc1cc(O)ccc1 Amb22496394 [0,1,0,0,0,0|3,0,0]=4 1724 B11R1.157 NC(=N)Nc1cccc(F)c1 Amb20249363 [0,1,0,0,0,0|3,0,0]=4 1725 B11R1.157 NC(=N)Nc1cccc(I)c1 Amb24476560 [0,1,0,0,0,0|3,0,0]=4 1726 B11R1.157 NC(=N)Nc1cccc(c1)Br Amb10879725 [0,1,0,0,0,0|3,0,0]=4 1727 B11R1.157 NC(=N)Sc1cccc(Br)c1 Amb25098054 [0,1,0,0,0,0|3,0,0]=4 1728 B11R1.157 NC(=N)Sc1cccc(F)c1 Amb25741115 [0,1,0,0,0,0|3,0,0]=4 1729 B11R1.157 NC(=O)CC1=CC=CC(=O)N1 Amb25174273 [0,1,0,0,0,0|2,0,0]=3 1730 B11R1.157 NC(=O)CC=1NC(=O)C=CN1 Amb18177241 [0,1,0,0,0,0|3,0,0]=4 1731 B11R1.157 NC(=O)Cc1c[n]cc(F)c1 Amb24707829 [0,1,0,0,0,0|2,0,0]=3 1732 B11R1.157 NC(=O)Cc1cc[n]c(Cl)[n]1 Amb23440859 [0,1,0,0,0,0|3,0,0]=4 1733 B11R1.157 NC(=O)Cc1cccc(I)c1 Amb25750996 [0,1,0,0,0,0|1,0,0]=2 1734 B11R1.157 NC(=O)Cc1cccc(c1)Br Amb2447571 [0,1,0,0,0,0|1,0,0]=2 1735 B11R1.157 NC(=O)Cc1cccc(c1)C Amb2107850 [0,1,0,0,0,0|1,0,0]=2 1736 B11R1.157 NC(=O)Cc1cccc(c1)Cl Amb17400312 [0,1,0,0,0,0|1,0,0]=2 1737 B11R1.157 NC(=O)Nc1cccc(F)[n]1 Amb24686112 [0,1,0,0,0,0|3,0,0]=4 1738 B11R1.157 NC(=O)Nc1cccc(c1)Br Amb1130078 [0,1,0,0,0,0|2,0,0]=3 1739 B11R1.157 NC(=O)Nc1cccc(c1)C Amb1139814 [0,1,0,0,0,0|2,0,0]=3 1740 B11R1.157 NC(=O)Nc1cccc(c1)Cl Amb1132008 [0,1,0,0,0,0|2,0,0]=3 1741 B11R1.157 NC(=O)Nc1cccc(c1)F Amb1133367 [0,1,0,0,0,0|2,0,0]=3 1742 B11R1.157 NC(=O)Nc1cccc(c1)N Amb1116839 [0,1,0,0,0,0|2,0,0]=3 1743 B11R1.157 NC(=O)Oc1cccc(c1)Cl Amb10575592 [0,1,0,0,0,0|2,0,0]=3 1744 B11R1.157 NC(=O)Sc1cccc(Cl)c1 Amb25257996 [0,1,0,0,0,0|2,0,0]=3 1745 B11R1.157 NC(=S)Cc1c[n]cc(F)c1 Amb24757491 [0,1,0,0,0,0|2,1,0]=4 1746 B11R1.157 NC(=S)Cc1cccc(O)c1 Amb25251673 [0,1,0,0,0,0|1,1,0]=3 1747 B11R1.157 NC(=S)Nc1cccc(c1)Br Amb1155461 [0,1,0,0,0,0|2,1,0]=4 1748 B11R1.157 NC(=S)Nc1cccc(c1)C Amb1263748 [0,1,0,0,0,0|2,1,0]=4 1749 B11R1.157 NC(=S)Nc1cccc(c1)Cl Amb1675432 [0,1,0,0,0,0|2,1,0]=4 1750 B11R1.157 NC(=S)Nc1cccc(c1)F Amb2372753 [0,1,0,0,0,0|2,1,0]=4 1751 B11R1.157 NC(=S)Nc1cccc(c1)O Amb1264534 [0,1,0,0,0,0|2,1,0]=4 1752 B11R1.157 NC(=S)Oc1cccc(Cl)c1 Amb24558036 [0,1,0,0,0,0|2,1,0]=4 1753 B11R1.157 NC(O)Cc1cc(O)ccc1 Amb25855628 [0,1,0,0,0,0|1,0,1]=3 1754 B11R1.157 Nc1[n]c(CC(N)=O)cc[n]1 Amb24728510 [0,1,0,0,0,0|3,0,0]=4 1755 B11R1.157 Nc1cc(C=C(Cl)Cl)ccc1 Amb24373154 [0,1,0,0,0,0|2,0,1]=4 1756 B11R1.157 Nc1cc(CC(O)=O)ccc1 Amb19373490 [0,1,0,0,0,0|0,0,0]=1 1757 B11R1.157 Nc1cc(CS([O-])=O)ccc1 Amb24468713 [0,1,0,0,0,0|1,0,1]=3 1758 B11R1.157 Nc1cc(ccc1)NC(S)=S Amb25351309 [0,1,0,0,0,0|1,2,0]=4 1759 B11R1.157 Nc1cc(ccc1)OC(=O)F Amb24417695 [0,1,0,0,0,0|2,0,0]=3 1760 B11R1.157 Nc1cc(ccc1)SC(=O)F Amb25169491 [0,1,0,0,0,0|2,0,0]=3 1761 B11R1.157 Nc1cc[n]c(CC(O)=O)[n]1 Amb18201162 [0,1,0,0,0,0|2,0,0]=3 1762 B11R1.157 Nc1cccc(CC(N)=O)[n]1 Amb25856998 [0,1,0,0,0,0|2,0,0]=3 1763 B11R1.157 Nc1cccc(CC(O)=O)[n]1 Amb22011865 [0,1,0,0,0,0|1,0,0]=2 1764 B11R1.157 Nc1cccc(c1)NC(N)=N Amb24484490 [0,1,0,0,0,0|3,0,0]=4 1765 B11R1.157 Nc1cccc(c1)NC(N)=O Amb22732415 [0,1,0,0,0,0|2,0,0]=3 1766 B11R1.157 Nc1cccc(c1)NC(N)=S Amb25337683 [0,1,0,0,0,0|2,1,0]=4 1767 B11R1.157 Nc1cccc(c1)OC(N)=O Amb24369239 [0,1,0,0,0,0|2,0,0]=3 1768 B11R1.157 O=C(Br)Cc1cc(Br)ccc1 Amb20620591 [0,1,0,0,0,0|1,0,0]=2 1769 B11R1.157 O=C(Cl)Cc1cc(Cl)ccc1 Amb18286412 [0,1,0,0,0,0|1,0,0]=2 1770 B11R1.157 O=C(Cl)Cc1cccc(Br)c1 Amb18284226 [0,1,0,0,0,0|1,0,0]=2 1771 B11R1.157 O=C(Cl)Cc1cccc(I)c1 Amb25322405 [0,1,0,0,0,0|1,0,0]=2 1772 B11R1.157 O=C(Cl)Nc1cc(Cl)ccc1 Amb24093909 [0,1,0,0,0,0|2,0,0]=3 1773 B11R1.157 O=C(Cl)Oc1c[n]cc(F)c1 Amb25112855 [0,1,0,0,0,0|3,0,0]=4 1774 B11R1.157 O=C(Cl)Oc1cc(Cl)c[n]c1 Amb25728336 [0,1,0,0,0,0|3,0,0]=4 1775 B11R1.157 O=C(Cl)Oc1cc(Cl)ccc1 Amb24455216 [0,1,0,0,0,0|2,0,0]=3 1776 B11R1.157 O=C(Cl)Oc1cccc(F)c1 Amb25049826 [0,1,0,0,0,0|2,0,0]=3 1777 B11R1.157 O=S(=O)Cc1cccc(Br)c1 Amb25278522 [0,1,0,0,0,0|1,0,1]=3 1778 B11R1.157 OB(O)Cc1cccc(F)c1 Amb22059300 [0,1,0,0,0,0|1,0,1]=3 1779 B11R1.157 OC(=O)CC1=CC(=O)NC=N1 Amb22009632 [0,1,0,0,0,0|2,0,0]=3 1780 B11R1.157 OC(=O)CC1=CC(=O)NN=C1 Amb25825208 [0,1,0,0,0,0|2,0,0]=3 1781 B11R1.157 OC(=O)CC1=CN=CC(=O)N1 Amb18200849 [0,1,0,0,0,0|2,0,0]=3 1782 B11R1.157 OC(=O)CC1=CSCC(=O)N1 Amb17112127 [0,1,0,0,0,0|2,0,1]=4 1783 B11R1.157 OC(=O)CC=1CCCC(=O)C1 Amb25322003 [0,1,0,0,0,0|0,0,3]=4 1784 B11R1.157 OC(=O)C[n+]1cc(Cl)ccc1 Amb25159250 [0,1,0,0,0,0|1,0,0]=2 1785 B11R1.157 OC(=O)C[n+]1cccc(c1)Cl Amb10573207 [0,1,0,0,0,0|1,0,0]=2 1786 B11R1.157 OC(=O)Cc1[n]c(Br)cc[n]1 Amb22751893 [0,1,0,0,0,0|2,0,0]=3 1787 B11R1.157 OC(=O)Cc1[n]c(Cl)cc[n]1 Amb24509273 [0,1,0,0,0,0|2,0,0]=3 1788 B11R1.157 OC(=O)Cc1[n]c(F)cc[n]1 Amb24509123 [0,1,0,0,0,0|2,0,0]=3 1789 B11R1.157 OC(=O)Cc1c[n]cc(F)c1 Amb18285911 [0,1,0,0,0,0|1,0,0]=2 1790 B11R1.157 OC(=O)Cc1cc(Br)[n]c[n]1 Amb24527832 [0,1,0,0,0,0|2,0,0]=3 1791 B11R1.157 OC(=O)Cc1cc(Cl)[n]c[n]1 Amb25152705 [0,1,0,0,0,0|2,0,0]=3 1792 B11R1.157 OC(=O)Cc1cc(Cl)cc[n]1 Amb20247876 [0,1,0,0,0,0|1,0,0]=2 1793 B11R1.157 OC(=O)Cc1cc(Cl)cc[n]1 Amb22899499 [0,1,0,0,0,0|1,0,0]=2 1794 B11R1.157 OC(=O)Cc1cc(F)[n]c[n]1 Amb25377314 [0,1,0,0,0,0|2,0,0]=3 1795 B11R1.157 OC(=O)Cc1cc(F)cc[n]1 Amb20247872 [0,1,0,0,0,0|1,0,0]=2 1796 B11R1.157 OC(=O)Cc1cc[n]c(Cl)[n]1 Amb24509076 [0,1,0,0,0,0|2,0,0]=3 1797 B11R1.157 OC(=O)Cc1cc[n]c(S)[n]1 Amb18198915 [0,1,0,0,0,0|2,0,0]=3 1798 B11R1.157 OC(=O)Cc1cccc(Br)[n]1 Amb22494936 [0,1,0,0,0,0|1,0,0]=2 1799 B11R1.157 OC(=O)Cc1cccc(F)[n]1 Amb20247874 [0,1,0,0,0,0|1,0,0]=2 1800 B11R1.157 OC(=O)Cc1cccc(c1)Br Amb1134647 [0,1,0,0,0,0|0,0,0]=1 1801 B11R1.157 OC(=O)Cc1cccc(n1)Br Amb13883482 [0,1,0,0,0,0|1,0,0]=2 1802 B11R1.157 OC(=O)Cc1cccc(n1)Cl Amb10976127 [0,1,0,0,0,0|1,0,0]=2 1803 B11R1.157 OC(=O)Cc1cncc(n1)Cl Amb10603186 [0,1,0,0,0,0|2,0,0]=3 1804 B11R1.157 OC(=O)Nc1cc(Br)cc[n]1 Amb23554914 [0,1,0,0,0,0|2,0,0]=3 1805 B11R1.157 OC(=S)Cc1cccc(Br)c1 Amb24099892 [0,1,0,0,0,0|0,1,0]=2 1806 B11R1.157 OC(=S)Cc1cccc(F)c1 Amb24094124 [0,1,0,0,0,0|0,1,0]=2 1807 B11R1.157 Oc1[n]c(CC(O)=O)cc[n]1 Amb18200881 [0,1,0,0,0,0|2,0,0]=3 1808 B11R1.157 Oc1cc(C=C(Br)Br)ccc1 Amb18116128 [0,1,0,0,0,0|2,0,1]=4 1809 B11R1.157 Oc1cc(CC(=O)Cl)ccc1 Amb18177959 [0,1,0,0,0,0|1,0,0]=2 1810 B11R1.157 Oc1cc(ccc1)NC(S)=S Amb24418030 [0,1,0,0,0,0|1,2,0]=4 1811 B11R1.157 Oc1cc[n]c(CC(O)=O)[n]1 Amb18862504 [0,1,0,0,0,0|2,0,0]=3 1812 B11R1.157 Oc1cc[n]c(CC(O)=O)c1 Amb25320721 [0,1,0,0,0,0|1,0,0]=2 1813 B11R1.157 Oc1cccc(CC(O)=O)[n]1 Amb20247884 [0,1,0,0,0,0|1,0,0]=2 1814 B11R1.157 Oc1cccc(c1)OB(O)O Amb24094132 [0,1,0,0,0,0|2,0,1]=4 1815 B11R1.157 S=C(Cl)Oc1cccc(Br)c1 Amb25710724 [0,1,0,0,0,0|2,1,0]=4 1816 B11R1.157 SC(=S)Nc1cccc(Cl)c1 Amb24469317 [0,1,0,0,0,0|1,2,0]=4 1817 B11R1.157 [O-]C(=O)Cc1cccc(Cl)[n]1 Amb22757538 [0,1,0,0,0,0|1,0,1]=3 1818 B11R1.157 [O-][N+](=O)Cc1cc[n]c(Cl)c1 Amb25276757 [0,1,0,0,0,0|2,0,1]=4 1819 B11R1.157 [O-][N+](=O)Cc1cccc(Br)c1 Amb23589329 [0,1,0,0,0,0|1,0,1]=3 1820 B11R1.157 [O-][N+](=O)Cc1cccc(Cl)[n]1 Amb25820611 [0,1,0,0,0,0|2,0,1]=4 1821 B11R1.157 [O-][N+](=O)Cc1cccc(Cl)c1 Amb23589314 [0,1,0,0,0,0|1,0,1]=3 1822 B11R1.157 [O-][N+](=O)Cc1cccc(F)c1 Amb23589318 [0,1,0,0,0,0|1,0,1]=3 1823 B11R1.157 [O-][n+]1cc(CC(O)=O)ccc1 Amb24518678 [0,1,0,0,0,0|1,0,0]=2 1824 B11R1.509 CC(C)(Br)Cc1ccccc1 Amb18049599 [0,1,0,0,0,0|2,0,1]=4 1825 B11R1.509 CC(C)(N)Cc1ccccc1 Amb18524601 [0,1,0,0,0,0|2,0,1]=4 1826 B11R1.509 CC(C)(O)Cc1c[n]ccc1 Amb24065739 [0,1,0,0,0,0|2,0,1]=4 1827 B11R1.509 CC(Cc1ccccc1)(Cl)C Amb17102035 [0,1,0,0,0,0|2,0,1]=4 1828 B11R1.509 CS(=O)(=O)Oc1ccccc1 Amb2227587 [0,1,0,0,0,0|2,0,1]=4 1829 B11R1.509 CS(=O)(=O)Sc1ccccc1 Amb17619349 [0,1,0,0,0,0|2,0,1]=4 1830 B11R1.509 C[C@@](N)(O)Cc1ccccc1 Amb25716775 [0,1,0,0,0,0|1,0,1]=3 1831 B11R1.509 C[C@](N)(O)Cc1ccccc1 Amb24445153 [0,1,0,0,0,0|1,0,1]=3 1832 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb17739711 [0,1,0,0,0,0|3,0,0]=4 1833 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb19930163 [0,1,0,0,0,0|3,0,0]=4 1834 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22002664 [0,1,0,0,0,0|3,0,0]=4 1835 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22052447 [0,1,0,0,0,0|3,0,0]=4 1836 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22054449 [0,1,0,0,0,0|3,0,0]=4 1837 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22336519 [0,1,0,0,0,0|3,0,0]=4 1838 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22351768 [0,1,0,0,0,0|3,0,0]=4 1839 B11R1.509 C[N+](C)(C)Cc1ccccc1 Amb22366021 [0,1,0,0,0,0|3,0,0]=4 1840 B11R1.509 C[N+](C)([O-])Cc1ccccc1 Amb24103349 [0,1,0,0,0,0|2,0,1]=4 1841 B11R1.509 C[N+](Cc1ccccc1)(C)C Amb10603979 [0,1,0,0,0,0|3,0,0]=4 1842 B11R1.509 C[N+](Cc1ccccc1)(C)C Amb1153962 [0,1,0,0,0,0|3,0,0]=4 1843 B11R1.509 C[N+](Cc1ccccc1)(N)C Amb1085967 [0,1,0,0,0,0|3,0,0]=4 1844 B11R1.509 C[Si](C)(C)Cc1ccccc1 Amb19893559 [0,1,0,0,0,0|2,1,0]=4 1845 B11R1.509 C[Si](C)(Cl)Cc1ccccc1 Amb19893553 [0,1,0,0,0,0|2,1,0]=4 1846 B11R1.509 C[Si](C)(F)Cc1ccccc1 Amb25293989 [0,1,0,0,0,0|2,1,0]=4 1847 B11R1.509 C[Si](Cl)(Cl)Cc1ccccc1 Amb19893557 [0,1,0,0,0,0|2,1,0]=4 1848 B11R1.509 ClC(Cl)(Cl)Cc1ccccc1 Amb23402550 [0,1,0,0,0,0|2,0,1]=4 1849 B11R1.509 ClS(=O)(=O)Cc1ccccn1 Amb10808366 [0,1,0,0,0,0|2,0,1]=4 1850 B11R1.509 ClS(=O)(=O)Cc1ccccn1 Amb1129028 [0,1,0,0,0,0|2,0,1]=4 1851 B11R1.509 ClS(=O)(=O)Cc1cccnc1 Amb10808436 [0,1,0,0,0,0|2,0,1]=4 1852 B11R1.509 ClS(=O)(=O)Cc1cccnc1 Amb1128586 [0,1,0,0,0,0|2,0,1]=4 1853 B11R1.509 ClS(=O)(=O)Cc1ccncc1 Amb10576461 [0,1,0,0,0,0|2,0,1]=4 1854 B11R1.509 ClS(=O)(=O)Cc1ccncc1 Amb1127917 [0,1,0,0,0,0|2,0,1]=4 1855 B11R1.509 Cl[Ge](Cl)(Cl)Cc1ccccc1 Amb19930241 [0,1,0,0,0,0|2,1,0]=4 1856 B11R1.509 Cl[Si](Cl)(Cl)Cc1ccccc1 Amb19893538 [0,1,0,0,0,0|2,1,0]=4 1857 B11R1.509 FC(F)(F)Cc1ccccc1 Amb19894564 [0,1,0,0,0,0|2,0,1]=4 1858 B11R1.509 FS(=O)(=O)Cc1ccccc1 Amb1157545 [0,1,0,0,0,0|1,0,1]=3 1859 B11R1.509 F[B-](Cc1ccccc1)(F)F Amb13890330 [0,1,0,0,0,0|3,0,0]=4 1860 B11R1.509 NP(O)(=O)Oc1ccccc1 Amb25200138 [0,1,0,0,0,0|2,0,0]=3 1861 B11R1.509 NS(=O)(=O)Cc1ccccc1 Amb1127409 [0,1,0,0,0,0|1,0,1]=3 1862 B11R1.509 O=P(Cl)(Cl)Cc1ccccc1 Amb25194718 [0,1,0,0,0,0|2,0,0]=3 1863 B11R1.509 O=S(=O)(Cl)Cc1c[n]ccc1 Amb22498687 [0,1,0,0,0,0|2,0,1]=4 1864 B11R1.509 O=S(=O)(Cl)Cc1cc[n]cc1 Amb22752087 [0,1,0,0,0,0|2,0,1]=4 1865 B11R1.509 O=S(=O)(Cl)Nc1ccccc1 Amb22549323 [0,1,0,0,0,0|2,0,1]=4 1866 B11R1.509 O=S(=O)(Cl)Oc1ccccc1 Amb22325313 [0,1,0,0,0,0|2,0,1]=4 1867 B11R1.509 OP(=O)(Oc1ccccc1)O Amb1148179 [0,1,0,0,0,0|2,0,0]=3 1868 B11R1.509 OP(O)(=O)Cc1c[n]ccc1 Amb22388736 [0,1,0,0,0,0|2,0,0]=3 1869 B11R1.509 OP(O)(=O)Cc1cc[n]cc1 Amb22388741 [0,1,0,0,0,0|2,0,0]=3 1870 B11R1.509 OP(O)(=O)Cc1cccc[n]1 Amb22388742 [0,1,0,0,0,0|2,0,0]=3 1871 B11R1.509 OP(O)(=S)Cc1ccccc1 Amb25174255 [0,1,0,0,0,0|1,0,1]=3 1872 B11R1.509 OS(=O)(=O)Cc1c[n]ccc1 Amb22298331 [0,1,0,0,0,0|2,0,0]=3 1873 B11R1.509 OS(=O)(=O)Cc1cc[n]cc1 Amb22298426 [0,1,0,0,0,0|2,0,0]=3 1874 B11R1.509 OS(=O)(=O)Nc1ccccc1 Amb22490957 [0,1,0,0,0,0|2,0,0]=3 1875 B11R1.509 [O-]P([O-])(=O)Oc1ccccc1 Amb22168049 [0,1,0,0,0,0|2,0,1]=4 1876 B11R1.509 [O-]S(=O)(=O)Cc1cccc[n]1 Amb19514827 [0,1,0,0,0,0|2,0,1]=4 1877 B11R1.509 [O-]S(=O)(=O)Cc1ccccc1 Amb22490986 [0,1,0,0,0,0|1,0,1]=3 1878 B11R1.509 [O-][N+](O)(O)[Hg]c1ccccc1 Amb21952658 [0,1,0,0,0,0|2,0,1]=4 1879 B11R1.928 C[C@]1(CC=CC=C1)CC(O)=O Amb24726333 [0,1,0,0,0,0|0,0,2]=3 1880 B9R0.2 C=CCC\C=C\CC(O)=O Amb18643551 [0,0,1,0,0,0|0,0,2]=3 1881 B9R0.2 C=CC\C=C\CCC(O)=O Amb18643540 [0,0,1,0,0,0|0,0,2]=3 1882 B9R0.2 C=C\C=C\CCCC(O)=O Amb25085778 [0,0,1,0,0,0|0,0,2]=3 1883 B9R0.2 CC(=O)CCC\C=C\C=C Amb25713959 [0,0,1,0,0,0|1,0,2]=4 1884 B9R0.2 CC(=O)CC\C=C\CC=C Amb25245400 [0,0,1,0,0,0|1,0,2]=4 1885 B9R0.2 CC(=O)N\C=C\C=CC=O Amb24629598 [0,0,1,0,0,0|3,0,0]=4 1886 B9R0.2 CC(=O)O\C=C\C=C\C=O Amb25311232 [0,0,1,0,0,0|3,0,0]=4 1887 B9R0.2 CC=CC=CC=CC(C)=O Amb25238403 [0,0,1,0,0,0|1,0,2]=4 1888 B9R0.2 CC=CC=CC=CC(O)=O Amb24561626 [0,0,1,0,0,0|0,0,2]=3 1889 B9R0.2 CC\C=C\C=C\CC(N)=O Amb24763164 [0,0,1,0,0,0|1,0,2]=4 1890 B9R0.2 CC\C=C\C=C\CC(O)=O Amb18643575 [0,0,1,0,0,0|0,0,2]=3 1891 B9R0.2 CO\C=C\C=C\CC(O)=O Amb25213919 [0,0,1,0,0,0|1,0,1]=3 1892 B9R0.2 C\C=C\C=CC#CC(O)=O Amb24562774 [0,0,1,0,0,0|0,0,3]=4 1893 B9R0.2 C\C=C\C=C\C#CC(=O)O Amb17593444 [0,0,1,0,0,0|0,0,3]=4 1894 B9R0.2 C\C=C\C=C\C=C/C(C)=O Amb25822807 [0,0,1,0,0,0|1,0,2]=4 1895 B9R0.2 C\C=C\C=C\C=C\C(C)=O Amb25185305 [0,0,1,0,0,0|1,0,2]=4 1896 B9R0.2 C\C=C\C=C\CCC(C)=O Amb24478389 [0,0,1,0,0,0|1,0,2]=4 1897 B9R0.2 C\C=C\C=C\CCC(O)=O Amb18643576 [0,0,1,0,0,0|0,0,2]=3 1898 B9R0.2 C\C=C\CC=CCC(O)=O Amb25076809 [0,0,1,0,0,0|0,0,2]=3 1899 B9R0.2 N#CC=C\C=C\CC(O)=O Amb24480438 [0,0,1,0,0,0|1,0,1]=3 1900 B9R0.2 OC(=O)C=CC=CC=CBr Amb25240084 [0,0,1,0,0,0|1,0,1]=3 1901 B9R0.2 OC(=O)C\C=C/CCC=O Amb24480684 [0,0,1,0,0,0|1,0,2]=4 1902 B9R0.2 OC(=O)C\C=C\CCC=O Amb18643818 [0,0,1,0,0,0|1,0,2]=4 1903 B9R0.2 OC(=O)\C=C\C=C\C=C\Br Amb25733431 [0,0,1,0,0,0|1,0,1]=3 1904 B9R0.4 C=CCNC(=O)CC(=O)O Amb17399877 [0,0,1,0,0,0|2,0,1]=4 1905 B9R0.4 C=CCNC(=S)CC(O)=O Amb24373150 [0,0,1,0,0,0|2,0,1]=4 1906 B9R0.4 C=CCOC(=O)CC(O)=O Amb18644068 [0,0,1,0,0,0|2,0,1]=4 1907 B9R0.4 CC(=O)CS(=O)\C=C/C=C Amb24737497 [0,0,1,0,0,0|3,0,0]=4 1908 B9R0.4 CC(=O)NC(=O)\C=C\C=C Amb24682157 [0,0,1,0,0,0|3,0,0]=4 1909 B9R0.4 CC(=O)OC(=C)\C=C\C=O Amb24584495 [0,0,1,0,0,0|3,0,0]=4 1910 B9R0.4 C\C(=C\C(O)=O)\C=CC=C Amb25316740 [0,0,1,0,0,0|0,0,2]=3 1911 B9R0.4 C\C(=C\C(O)=O)\C=CC=O Amb24562641 [0,0,1,0,0,0|1,0,2]=4 1912 B9R0.4 C\C(=C\C(O)=O)\C=C\C=C Amb24746708 [0,0,1,0,0,0|0,0,2]=3 1913 B9R0.4 OC(=O)\C=C(\O)/C=CC=O Amb25370890 [0,0,1,0,0,0|2,0,1]=4 1914 B9R0.14 C=CC(CC=O)CC(O)=O Amb18643819 [0,0,1,0,0,0|1,0,2]=4 1915 B9R0.14 C=CCC(CC(O)=O)C=C Amb18643594 [0,0,1,0,0,0|0,0,2]=3 1916 B9R0.14 C\C=C\C(C=O)=CC(O)=O Amb25175014 [0,0,1,0,0,0|1,0,2]=4 1917 B9R0.14 C\C=C\C(\C=O)=C\C(O)=O Amb25324073 [0,0,1,0,0,0|1,0,2]=4 1918 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|2,0,1]=4 1919 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|2,0,1]=4 1920 B11R2.4 C=C1CC1c2ccccc2 Amb22733871 [0,0,0,1,0,0|2,0,0]=3 1921 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [0,0,0,1,0,0|2,0,1]=4 1922 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [0,0,0,1,0,0|2,0,1]=4 1923 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [0,0,0,1,0,0|1,0,1]=3 1924 B11R2.4 CN1NC1c2ccccc2 Amb25766657 [0,0,0,1,0,0|3,0,0]=4 1925 B11R2.4 CN1OC1c2cccc[n]2 Amb24586710 [0,0,0,1,0,0|3,0,0]=4 1926 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [0,0,0,1,0,0|1,0,1]=3 1927 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [0,0,0,1,0,0|1,0,1]=3 1928 B11R2.4 ClC1OC1c2ccccc2 Amb24372881 [0,0,0,1,0,0|1,0,1]=3 1929 B11R2.4 FC1CC1c2ccccc2 Amb25267358 [0,0,0,1,0,0|2,0,1]=4 1930 B11R2.4 F[C@@H]1C[C@@H]1c2ccccc2 Amb24600206 [0,0,0,1,0,0|2,0,1]=4 1931 B11R2.4 F[C@@H]1C[C@H]1c2ccccc2 Amb24538986 [0,0,0,1,0,0|2,0,1]=4 1932 B11R2.4 NC1CC1c2ccccc2 Amb19514914 [0,0,0,1,0,0|2,0,1]=4 1933 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|2,0,1]=4 1934 B11R2.4 NC1OC1c2ccccc2 Amb25724793 [0,0,0,1,0,0|1,0,1]=3 1935 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|3,0,0]=4 1936 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|2,0,1]=4 1937 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|2,0,1]=4 1938 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|2,0,1]=4 1939 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|2,0,1]=4 1940 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|2,0,1]=4 1941 B11R2.4 O=C1C=C1c2ccccc2 Amb24722866 [0,0,0,1,0,0|1,0,1]=3 1942 B11R2.4 O=C1CC1c2ccccc2 Amb25689197 [0,0,0,1,0,0|1,0,0]=2 1943 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|1,0,1]=3 1944 B11R2.4 O[C@H]1C[C@@H]1c2ccccc2 Amb17689138 [0,0,0,1,0,0|1,0,1]=3 1945 B11R2.10 Br[b]1oc2ccccc2o1 Amb22731967 [0,0,0,1,0,0|3,0,0]=4 1946 B11R2.10 Brc1[n]c2[n]cccc2o1 Amb24481078 [0,0,0,1,0,0|3,0,0]=4 1947 B11R2.10 Brc1[n]c2ccc[n]c2o1 Amb25217845 [0,0,0,1,0,0|3,0,0]=4 1948 B11R2.10 Brc1[n]c2ccccc2o1 Amb19054929 [0,0,0,1,0,0|2,0,0]=3 1949 B11R2.10 Brc1cc2[n]cccc2o1 Amb25133797 [0,0,0,1,0,0|2,0,1]=4 1950 B11R2.10 Brc1cc2c[n]ccc2o1 Amb18187766 [0,0,0,1,0,0|2,0,1]=4 1951 B11R2.10 Brc1cc2cc[n]cc2o1 Amb25377338 [0,0,0,1,0,0|2,0,1]=4 1952 B11R2.10 Brc1cc2ccccc2[nH]1 Amb24089429 [0,0,0,1,0,0|2,0,1]=4 1953 B11R2.10 C=C1Cc2[n]cccc2N1 Amb25794133 [0,0,0,1,0,0|3,0,0]=4 1954 B11R2.10 C=C1Cc2ccc[n]c2N1 Amb25707927 [0,0,0,1,0,0|3,0,0]=4 1955 B11R2.10 C=C1Nc2ccccc2S1 Amb24084855 [0,0,0,1,0,0|2,1,0]=4 1956 B11R2.10 C=C1Oc2ccccc2O1 Amb24665414 [0,0,0,1,0,0|2,0,0]=3 1957 B11R2.10 CC1=Cc2c(C1)cccc2 Amb15692403 [0,0,0,1,0,0|2,0,0]=3 1958 B11R2.10 CC1Cc2c(O1)cccc2 Amb10783206 [0,0,0,1,0,0|1,0,1]=3 1959 B11R2.10 CC1Cc2ccccc2C1 Amb20248354 [0,0,0,1,0,0|2,0,1]=4 1960 B11R2.10 CC1Cc2ccccc2S1 Amb17672854 [0,0,0,1,0,0|1,1,1]=4 1961 B11R2.10 CC1Nc2ccccc2O1 Amb25367470 [0,0,0,1,0,0|2,0,1]=4 1962 B11R2.10 CC1Oc2ccccc2O1 Amb24065730 [0,0,0,1,0,0|2,0,1]=4 1963 B11R2.10 CN1Cc2c(C1)cccc2 Amb10554435 [0,0,0,1,0,0|3,0,0]=4 1964 B11R2.10 CP1Oc2ccccc2O1 Amb24761474 [0,0,0,1,0,0|3,0,0]=4 1965 B11R2.10 C[C@@H]1Cc2ccccc2N1 Amb23439109 [0,0,0,1,0,0|2,0,1]=4 1966 B11R2.10 C[C@H]1Cc2ccccc2N1 Amb25294551 [0,0,0,1,0,0|2,0,1]=4 1967 B11R2.10 Cc1[nH+]c2ccccc2[s]1 Amb24096232 [0,0,0,1,0,0|2,1,0]=4 1968 B11R2.10 Cc1[nH]c2ccccc2[p]1 Amb25759070 [0,0,0,1,0,0|3,0,0]=4 1969 B11R2.10 Cc1[n]c2c[n]ccc2o1 Amb21963764 [0,0,0,1,0,0|3,0,0]=4 1970 B11R2.10 Cc1[n]c2cc[n]cc2o1 Amb24098529 [0,0,0,1,0,0|3,0,0]=4 1971 B11R2.10 Cc1[n]c2ccc[n]c2o1 Amb18621258 [0,0,0,1,0,0|3,0,0]=4 1972 B11R2.10 Cc1[n]c2ccccc2[s]1 Amb24084608 [0,0,0,1,0,0|2,1,0]=4 1973 B11R2.10 Cc1cc2c(s1)cccc2 Amb2237023 [0,0,0,1,0,0|1,1,1]=4 1974 B11R2.10 Cc1cc2c[n]ccc2o1 Amb23590993 [0,0,0,1,0,0|2,0,1]=4 1975 B11R2.10 Cc1cc2cc[n]cc2o1 Amb24648841 [0,0,0,1,0,0|2,0,1]=4 1976 B11R2.10 Cc1cc2ccc[n]c2o1 Amb25299352 [0,0,0,1,0,0|2,0,1]=4 1977 B11R2.10 Cc1cc2ccccc2[nH]1 Amb22926528 [0,0,0,1,0,0|2,0,1]=4 1978 B11R2.10 Cc1cc2ccccc2[nH]1 Amb22926529 [0,0,0,1,0,0|2,0,1]=4 1979 B11R2.10 Cc1cc2ccccc2o1 Amb20621560 [0,0,0,1,0,0|1,0,1]=3 1980 B11R2.10 Cc1nc2c([nH]1)cccc2 Amb1286779 [0,0,0,1,0,0|3,0,0]=4 1981 B11R2.10 Cc1nc2c(o1)cccn2 Amb2433107 [0,0,0,1,0,0|3,0,0]=4 1982 B11R2.10 Cc1sc2c([nH+]1)cccc2 Amb2243865 [0,0,0,1,0,0|2,1,0]=4 1983 B11R2.10 ClC1=[S]c2ccccc2N1 Amb17935640 [0,0,0,1,0,0|2,1,0]=4 1984 B11R2.10 ClC=1Cc2ccccc2C1 Amb22752069 [0,0,0,1,0,0|2,0,0]=3 1985 B11R2.10 ClC=1Cc2ccccc2N1 Amb24061194 [0,0,0,1,0,0|2,0,0]=3 1986 B11R2.10 Cl[b]1oc2ccccc2o1 Amb22801025 [0,0,0,1,0,0|3,0,0]=4 1987 B11R2.10 Clc1[n]c2[n]cccc2o1 Amb21857472 [0,0,0,1,0,0|3,0,0]=4 1988 B11R2.10 Clc1[n]c2[n]cccc2o1 Amb23439056 [0,0,0,1,0,0|3,0,0]=4 1989 B11R2.10 Clc1[n]c2c[n]ccc2o1 Amb22495194 [0,0,0,1,0,0|3,0,0]=4 1990 B11R2.10 Clc1[n]c2c[n]ccc2o1 Amb22495195 [0,0,0,1,0,0|3,0,0]=4 1991 B11R2.10 Clc1[n]c2cc[n]cc2o1 Amb19514835 [0,0,0,1,0,0|3,0,0]=4 1992 B11R2.10 Clc1[n]c2ccc[n]c2o1 Amb19516209 [0,0,0,1,0,0|3,0,0]=4 1993 B11R2.10 Clc1[n]c2ccc[n]c2o1 Amb22495179 [0,0,0,1,0,0|3,0,0]=4 1994 B11R2.10 Clc1cc2[n]cccc2o1 Amb24538055 [0,0,0,1,0,0|2,0,1]=4 1995 B11R2.10 Clc1cc2ccccc2[nH]1 Amb17673956 [0,0,0,1,0,0|2,0,1]=4 1996 B11R2.10 Clc1cc2ccccc2[nH]1 Amb22757517 [0,0,0,1,0,0|2,0,1]=4 1997 B11R2.10 Clc1cc2ccccc2[s]1 Amb24086422 [0,0,0,1,0,0|1,1,1]=4 1998 B11R2.10 Clc1cc2ccccc2o1 Amb24104234 [0,0,0,1,0,0|1,0,1]=3 1999 B11R2.10 Clc1nc2c(o1)cccc2 Amb1106378 [0,0,0,1,0,0|2,0,0]=3 2000 B11R2.10 Fc1[nH]c2ccccc2[n]1 Amb20240666 [0,0,0,1,0,0|3,0,0]=4 2001 B11R2.10 Fc1[n]c2ccccc2o1 Amb24565875 [0,0,0,1,0,0|2,0,0]=3 2002 B11R2.10 Fc1cc2ccccc2[nH]1 Amb24738487 [0,0,0,1,0,0|2,0,1]=4 2003 B11R2.10 Fc1cc2ccccc2[s]1 Amb24086004 [0,0,0,1,0,0|1,1,1]=4 2004 B11R2.10 Fc1cc2ccccc2o1 Amb24648804 [0,0,0,1,0,0|1,0,1]=3 2005 B11R2.10 IC1Cc2ccccc2C1 Amb23401305 [0,0,0,1,0,0|2,0,1]=4 2006 B11R2.10 I[As]1Cc2ccccc2C1 Amb22346742 [0,0,0,1,0,0|3,0,0]=4 2007 B11R2.10 Ic1[nH]c2ccccc2[n]1 Amb22044672 [0,0,0,1,0,0|3,0,0]=4 2008 B11R2.10 Ic1[n]c2ccccc2[s]1 Amb19957529 [0,0,0,1,0,0|2,1,0]=4 2009 B11R2.10 Ic1[n]c2ccccc2o1 Amb25111418 [0,0,0,1,0,0|2,0,0]=3 2010 B11R2.10 Ic1cc2ccccc2[nH]1 Amb22001898 [0,0,0,1,0,0|2,0,1]=4 2011 B11R2.10 Ic1cc2ccccc2[s]1 Amb22896395 [0,0,0,1,0,0|1,1,1]=4 2012 B11R2.10 Ic1cc2ccccc2o1 Amb24482100 [0,0,0,1,0,0|1,0,1]=3 2013 B11R2.10 N=C1Nc2ccccc2S1 Amb19866564 [0,0,0,1,0,0|2,1,0]=4 2014 B11R2.10 NC1Cc2c(C1)cccc2 Amb2182881 [0,0,0,1,0,0|2,0,1]=4 2015 B11R2.10 NC1Nc2ccccc2O1 Amb25147449 [0,0,0,1,0,0|2,0,1]=4 2016 B11R2.10 NN1Cc2ccccc2C1 Amb22586451 [0,0,0,1,0,0|3,0,0]=4 2017 B11R2.10 Nc1[n]c2c[n]ccc2o1 Amb21963676 [0,0,0,1,0,0|3,0,0]=4 2018 B11R2.10 Nc1[n]c2cc[n]cc2o1 Amb22233918 [0,0,0,1,0,0|3,0,0]=4 2019 B11R2.10 Nc1[n]c2ccc[n]c2o1 Amb18136760 [0,0,0,1,0,0|3,0,0]=4 2020 B11R2.10 Nc1[n]c2ccc[n]c2o1 Amb21857471 [0,0,0,1,0,0|3,0,0]=4 2021 B11R2.10 Nc1[s]c2ccccc2[s+]1 Amb25743437 [0,0,0,1,0,0|2,1,0]=4 2022 B11R2.10 Nc1cc2c([nH]1)cccc2 Amb17593390 [0,0,0,1,0,0|2,0,1]=4 2023 B11R2.10 Nc1cc2c(s1)cccc2 Amb17593717 [0,0,0,1,0,0|1,1,1]=4 2024 B11R2.10 Nc1cc2c[n]ccc2o1 Amb18203158 [0,0,0,1,0,0|2,0,1]=4 2025 B11R2.10 Nc1cc2ccccc2[s]1 Amb22496276 [0,0,0,1,0,0|1,1,1]=4 2026 B11R2.10 Nc1cc2ccccc2o1 Amb22011828 [0,0,0,1,0,0|1,0,1]=3 2027 B11R2.10 Nc1nc2c([nH]1)cccc2 Amb1154882 [0,0,0,1,0,0|3,0,0]=4 2028 B11R2.10 Nc1nc2c(o1)cccc2 Amb1153977 [0,0,0,1,0,0|2,0,0]=3 2029 B11R2.10 O=C1C=C2C=CC=CC2=N1 Amb24620213 [0,0,0,1,0,0|1,0,1]=3 2030 B11R2.10 O=C1C=C2C=CC=CN2N1 Amb21858515 [0,0,0,1,0,0|2,0,1]=4 2031 B11R2.10 O=C1C=C2C=COC=C2O1 Amb19132425 [0,0,0,1,0,0|1,0,1]=3 2032 B11R2.10 O=C1C=C2NC=CC=C2N1 Amb23437349 [0,0,0,1,0,0|2,0,1]=4 2033 B11R2.10 O=C1C=C2NC=CC=C2O1 Amb24718430 [0,0,0,1,0,0|1,0,1]=3 2034 B11R2.10 O=C1CC2=CNC=CC2=N1 Amb25708880 [0,0,0,1,0,0|2,0,0]=3 2035 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17679305 [0,0,0,1,0,0|2,0,0]=3 2036 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17680921 [0,0,0,1,0,0|2,0,0]=3 2037 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17731514 [0,0,0,1,0,0|2,0,0]=3 2038 B11R2.10 O=C1Cc2[n]cccc2N1 Amb22494989 [0,0,0,1,0,0|2,0,0]=3 2039 B11R2.10 O=C1Cc2[n]cccc2O1 Amb24093371 [0,0,0,1,0,0|1,0,0]=2 2040 B11R2.10 O=C1Cc2c(C1)cccc2 Amb1227714 [0,0,0,1,0,0|1,0,0]=2 2041 B11R2.10 O=C1Cc2c(N1)cccc2 Amb1351379 [0,0,0,1,0,0|1,0,0]=2 2042 B11R2.10 O=C1Cc2c[n]c[n]c2N1 Amb22494135 [0,0,0,1,0,0|3,0,0]=4 2043 B11R2.10 O=C1Cc2c[n]ccc2N1 Amb22494990 [0,0,0,1,0,0|2,0,0]=3 2044 B11R2.10 O=C1Cc2cc[n]cc2N1 Amb19929479 [0,0,0,1,0,0|2,0,0]=3 2045 B11R2.10 O=C1Cc2cc[n]cc2N1 Amb21964304 [0,0,0,1,0,0|2,0,0]=3 2046 B11R2.10 O=C1Cc2ccc[n]c2C1 Amb24083418 [0,0,0,1,0,0|2,0,0]=3 2047 B11R2.10 O=C1Cc2ccc[n]c2N1 Amb22405864 [0,0,0,1,0,0|2,0,0]=3 2048 B11R2.10 O=C1Cc2ccccc2S1 Amb24066372 [0,0,0,1,0,0|0,1,0]=2 2049 B11R2.10 O=C1N=C2C=CC=CC2=N1 Amb20247445 [0,0,0,1,0,0|2,0,0]=3 2050 B11R2.10 O=C1Nc2[n+](C1)cccc2 Amb10552755 [0,0,0,1,0,0|2,0,0]=3 2051 B11R2.10 O=C1Nc2[n]cccc2O1 Amb17933371 [0,0,0,1,0,0|2,0,0]=3 2052 B11R2.10 O=C1Nc2[n]cccc2S1 Amb23403194 [0,0,0,1,0,0|2,1,0]=4 2053 B11R2.10 O=C1Nc2c[n]ccc2N1 Amb18043121 [0,0,0,1,0,0|3,0,0]=4 2054 B11R2.10 O=C1Nc2cc[n]cc2O1 Amb22233917 [0,0,0,1,0,0|2,0,0]=3 2055 B11R2.10 O=C1Nc2ccc[n]c2N1 Amb18043123 [0,0,0,1,0,0|3,0,0]=4 2056 B11R2.10 O=C1Nc2ccc[n]c2O1 Amb18560583 [0,0,0,1,0,0|2,0,0]=3 2057 B11R2.10 O=C1Nc2ccc[n]c2S1 Amb21857086 [0,0,0,1,0,0|2,1,0]=4 2058 B11R2.10 O=C1Nc2ccccc2N1 Amb18375774 [0,0,0,1,0,0|2,0,0]=3 2059 B11R2.10 O=C1Nc2ccccc2O1 Amb18043097 [0,0,0,1,0,0|1,0,0]=2 2060 B11R2.10 O=C1Nc2ccccc2S1 Amb17933260 [0,0,0,1,0,0|1,1,0]=3 2061 B11R2.10 O=C1O[n+]2ccccc2S1 Amb20662459 [0,0,0,1,0,0|2,0,0]=3 2062 B11R2.10 O=C1Oc2cccc[n+]2S1 Amb24472982 [0,0,0,1,0,0|2,0,0]=3 2063 B11R2.10 O=C1Oc2ccccc2O1 Amb19514273 [0,0,0,1,0,0|1,0,0]=2 2064 B11R2.10 O=C1Sc2ccccc2S1 Amb25108529 [0,0,0,1,0,0|1,1,0]=3 2065 B11R2.10 O=S1Cc2c(C1)cccc2 Amb10558516 [0,0,0,1,0,0|2,0,0]=3 2066 B11R2.10 O=[Ti]1Oc2ccccc2O1 Amb22733198 [0,0,0,1,0,0|2,0,0]=3 2067 B11R2.10 O=c1oc2c([nH]1)cccc2 Amb1149900 [0,0,0,1,0,0|1,0,0]=2 2068 B11R2.10 O=c1oc2c(s1)nccc2 Amb10552542 [0,0,0,1,0,0|2,0,0]=3 2069 B11R2.10 O=c1sc2c([nH]1)cccc2 Amb16205823 [0,0,0,1,0,0|1,1,0]=3 2070 B11R2.10 OB1Oc2c(O1)cccc2 Amb16228209 [0,0,0,1,0,0|2,0,1]=4 2071 B11R2.10 OB1Oc2c(O1)cccc2 Amb16228210 [0,0,0,1,0,0|2,0,1]=4 2072 B11R2.10 OC1Cc2ccccc2N1 Amb24090500 [0,0,0,1,0,0|1,0,1]=3 2073 B11R2.10 ON1Cc2ccccc2C1 Amb22493884 [0,0,0,1,0,0|2,0,0]=3 2074 B11R2.10 O[Sb]1Oc2ccccc2O1 Amb22453160 [0,0,0,1,0,0|2,0,1]=4 2075 B11R2.10 O[b]1oc2ccccc2o1 Amb24674117 [0,0,0,1,0,0|2,0,1]=4 2076 B11R2.10 O[n]1cc2ccccc2[n]1 Amb24085998 [0,0,0,1,0,0|2,0,1]=4 2077 B11R2.10 Oc1c[n]2ccccc2[n]1 Amb19515773 [0,0,0,1,0,0|2,0,1]=4 2078 B11R2.10 Oc1cc2[n]cccc2[nH]1 Amb23437350 [0,0,0,1,0,0|2,0,1]=4 2079 B11R2.10 Oc1cc2c([nH]1)cccc2 Amb10561372 [0,0,0,1,0,0|1,0,1]=3 2080 B11R2.10 Oc1cc2c[n]ccc2[s]1 Amb24694388 [0,0,0,1,0,0|1,1,1]=4 2081 B11R2.10 Oc1cc2cc[n]cc2[nH]1 Amb23437347 [0,0,0,1,0,0|2,0,1]=4 2082 B11R2.10 Oc1cc2ccc[n]c2[nH]1 Amb21963071 [0,0,0,1,0,0|2,0,1]=4 2083 B11R2.10 Oc1cc2ccccc2[s]1 Amb24518934 [0,0,0,1,0,0|0,1,1]=3 2084 B11R2.10 Oc1cc2ccccc2o1 Amb24065682 [0,0,0,1,0,0|0,0,2]=3 2085 B11R2.10 Oc1nc2c(o1)cccc2 Amb17593429 [0,0,0,1,0,0|1,0,1]=3 2086 B11R2.10 Oc1nc2c(s1)cccc2 Amb1814195 [0,0,0,1,0,0|1,1,0]=3 2087 B11R2.10 Oc1nc2ncccc2o1 Amb17949727 [0,0,0,1,0,0|2,0,1]=4 2088 B11R2.10 S=C1C=C2C=CC=CC2=N1 Amb25251819 [0,0,0,1,0,0|1,1,1]=4 2089 B11R2.10 S=C1Cc2c(N1)cccc2 Amb1153150 [0,0,0,1,0,0|1,1,0]=3 2090 B11R2.10 S=C1Cc2ccccc2O1 Amb24089820 [0,0,0,1,0,0|0,1,0]=2 2091 B11R2.10 S=C1Nc2[n]cccc2O1 Amb19895098 [0,0,0,1,0,0|2,1,0]=4 2092 B11R2.10 S=C1Nc2cc[n]cc2O1 Amb25247357 [0,0,0,1,0,0|2,1,0]=4 2093 B11R2.10 S=C1Nc2ccc[n]c2O1 Amb18135727 [0,0,0,1,0,0|2,1,0]=4 2094 B11R2.10 S=C1Nc2ccccc2N1 Amb19115313 [0,0,0,1,0,0|2,1,0]=4 2095 B11R2.10 S=C1Nc2ccccc2O1 Amb18799383 [0,0,0,1,0,0|1,1,0]=3 2096 B11R2.10 S=C1Nc2ccccc2S1 Amb18545517 [0,0,0,1,0,0|1,2,0]=4 2097 B11R2.10 S=C1Oc2ccccc2O1 Amb22363540 [0,0,0,1,0,0|1,1,0]=3 2098 B11R2.10 S=c1oc2c([nH]1)cccc2 Amb1157763 [0,0,0,1,0,0|1,1,0]=3 2099 B11R2.10 Sc1[n]c2c[n]ccc2o1 Amb19706003 [0,0,0,1,0,0|2,1,0]=4 2100 B11R2.10 Sc1[n]c2ccc[n]c2o1 Amb18662609 [0,0,0,1,0,0|2,1,0]=4 2101 B11R2.10 Sc1[n]c2ccccc2[se]1 Amb22729201 [0,0,0,1,0,0|1,2,0]=4 2102 B11R2.10 Sc1cc2ccccc2[s]1 Amb24105482 [0,0,0,1,0,0|0,2,1]=4 2103 B11R2.10 Sc1cc2ccccc2o1 Amb24061116 [0,0,0,1,0,0|0,1,1]=3 2104 B11R2.10 Sc1nc2c([nH]1)cccc2 Amb1262654 [0,0,0,1,0,0|2,1,0]=4 2105 B11R2.10 Sc1nc2c(o1)cccc2 Amb17570013 [0,0,0,1,0,0|1,1,0]=3 2106 B11R2.10 Sc1nc2c(o1)cccn2 Amb1091182 [0,0,0,1,0,0|2,1,0]=4 2107 B11R2.10 [NH3+]C1Cc2ccccc2C1 Amb24113669 [0,0,0,1,0,0|2,0,1]=4 2108 B11R2.10 [S-]c1[n]c2ccccc2[s]1 Amb20239441 [0,0,0,1,0,0|1,2,0]=4 2109 B11R2.10 [S-]c1[n]c2ccccc2[s]1 Amb22360205 [0,0,0,1,0,0|1,2,0]=4 2110 B11R2.10 [S-]c1nc2c(s1)cccc2 Amb15691686 [0,0,0,1,0,0|1,2,0]=4 2111 B11R2.10 [SH3]c1[n]c2ccccc2o1 Amb18046725 [0,0,0,1,0,0|1,1,0]=3 2112 B11R2.59 CC1(C)Cc2ccccc12 Amb17844031 [0,0,0,1,0,0|2,0,1]=4 2113 B11R2.59 CC1(O)Cc2ccccc12 Amb17844000 [0,0,0,1,0,0|1,0,1]=3 2114 B11R2.59 ClC1(Cl)Cc2ccccc12 Amb17778864 [0,0,0,1,0,0|2,0,1]=4 2115 B11R2.59 [2H]C1(O)Cc2ccccc12 Amb17778677 [0,0,0,1,0,0|1,0,1]=3 2116 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [0,0,0,1,0,0|2,0,1]=4 2117 B11R2.238 C1CC1=Cc2ccccc2 Amb19515480 [0,0,0,1,0,0|2,0,1]=4 2118 B11R2.238 C1N=C1Cc2ccccc2 Amb22498074 [0,0,0,1,0,0|2,0,0]=3 2119 B11R2.238 C1OC1Cc2cc[n]cc2 Amb24677560 [0,0,0,1,0,0|2,0,1]=4 2120 B11R2.238 C1OC1Cc2cccc[n]2 Amb24649901 [0,0,0,1,0,0|2,0,1]=4 2121 B11R2.238 N1CC1Cc2ccccc2 Amb10072810 [0,0,0,1,0,0|2,0,1]=4 2122 B11R2.238 N1C[C@@H]1Cc2ccccc2 Amb15690958 [0,0,0,1,0,0|2,0,1]=4 2123 B11R2.238 N1C[C@H]1Cc2ccccc2 Amb10603217 [0,0,0,1,0,0|2,0,1]=4 2124 B9R1.6 BrC(=C)c1ccccn1 Amb2447497 [0,0,0,0,1,0|3,0,0]=4 2125 B9R1.6 C=C(Br)c1cc[n]cc1 Amb24710590 [0,0,0,0,1,0|3,0,0]=4 2126 B9R1.6 C=C(Cl)c1cc[n]cc1 Amb24102656 [0,0,0,0,1,0|3,0,0]=4 2127 B9R1.6 C=C(Cl)c1ccc[n]c1 Amb24085113 [0,0,0,0,1,0|3,0,0]=4 2128 B9R1.6 C=C(Cl)c1cccc[n]1 Amb24069950 [0,0,0,0,1,0|3,0,0]=4 2129 B9R1.6 C=C(F)c1cc[n]cc1 Amb20248442 [0,0,0,0,1,0|3,0,0]=4 2130 B9R1.6 C=C(F)c1ccc[n]c1 Amb20248553 [0,0,0,0,1,0|3,0,0]=4 2131 B9R1.6 C=C(F)c1cccc[n]1 Amb20248373 [0,0,0,0,1,0|3,0,0]=4 2132 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [0,0,0,0,1,0|2,0,0]=3 2133 B9R1.6 C=C([Zn+])c1ccccc1 Amb22228006 [0,0,0,0,1,0|2,0,0]=3 2134 B9R1.6 CC(=C)c1cc[n]cc1 Amb25126374 [0,0,0,0,1,0|3,0,0]=4 2135 B9R1.6 CC(=C)c1cccc[n]1 Amb25077592 [0,0,0,0,1,0|3,0,0]=4 2136 B9R1.6 CC(=C)c1ccccc1 Amb22338342 [0,0,0,0,1,0|2,0,0]=3 2137 B9R1.6 CC(=C)c1ccccc1 Amb22338444 [0,0,0,0,1,0|2,0,0]=3 2138 B9R1.6 CC(=N)c1cc[n]cc1 Amb24478617 [0,0,0,0,1,0|3,0,0]=4 2139 B9R1.6 CC(=N)c1ccc[n]c1 Amb22170296 [0,0,0,0,1,0|3,0,0]=4 2140 B9R1.6 CC(=O)C1=CC=CCS1 Amb24582465 [0,0,0,0,1,0|2,0,1]=4 2141 B9R1.6 CC(=O)C1C=CNC=C1 Amb24707722 [0,0,0,0,1,0|2,0,1]=4 2142 B9R1.6 CC(=O)C=1CCC=CC1 Amb22232236 [0,0,0,0,1,0|1,0,2]=4 2143 B9R1.6 CC(=O)C=1CNC=CC1 Amb25700322 [0,0,0,0,1,0|2,0,1]=4 2144 B9R1.6 CC(=O)[n+]1ccccc1 Amb24692607 [0,0,0,0,1,0|2,0,0]=3 2145 B9R1.6 CC(=O)c1cc[n][n]c1 Amb19958070 [0,0,0,0,1,0|3,0,0]=4 2146 B9R1.6 CC(=O)c1cc[n]c[n]1 Amb19959228 [0,0,0,0,1,0|3,0,0]=4 2147 B9R1.6 CC(=O)c1ccc[nH+]c1 Amb10552777 [0,0,0,0,1,0|2,0,0]=3 2148 B9R1.6 CC(=O)c1ccc[n][n]1 Amb20242017 [0,0,0,0,1,0|3,0,0]=4 2149 B9R1.6 CC(=O)c1cccc[nH+]1 Amb10552776 [0,0,0,0,1,0|2,0,0]=3 2150 B9R1.6 CC(C)c1ccccc1 Amb24052959 [0,0,0,0,1,0|2,0,1]=4 2151 B9R1.6 CC(F)c1ccccc1 Amb24555504 [0,0,0,0,1,0|2,0,1]=4 2152 B9R1.6 CC(I)c1ccccc1 Amb24064714 [0,0,0,0,1,0|2,0,1]=4 2153 B9R1.6 CC(c1ccccc1)[NH3+] Amb10560245 [0,0,0,0,1,0|2,0,1]=4 2154 B9R1.6 CN(C)c1ccccc1 Amb22040069 [0,0,0,0,1,0|3,0,0]=4 2155 B9R1.6 CN(N)c1ccccc1 Amb22346095 [0,0,0,0,1,0|3,0,0]=4 2156 B9R1.6 CN(N)c1ccccc1 Amb22754142 [0,0,0,0,1,0|3,0,0]=4 2157 B9R1.6 CN(O)c1cc[n]cc1 Amb22522442 [0,0,0,0,1,0|3,0,0]=4 2158 B9R1.6 CN(c1ccccc1)N Amb1153615 [0,0,0,0,1,0|3,0,0]=4 2159 B9R1.6 CP(=O)c1ccccc1 Amb21858071 [0,0,0,0,1,0|2,0,0]=3 2160 B9R1.6 CP(C)c1ccccc1 Amb22369673 [0,0,0,0,1,0|3,0,0]=4 2161 B9R1.6 CP(C)c1ccccc1 Amb24325382 [0,0,0,0,1,0|3,0,0]=4 2162 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [0,0,0,0,1,0|3,0,0]=4 2163 B9R1.6 CS(=O)c1c[n]ccc1 Amb24102456 [0,0,0,0,1,0|3,0,0]=4 2164 B9R1.6 CS(=O)c1cc[n]cc1 Amb24103016 [0,0,0,0,1,0|3,0,0]=4 2165 B9R1.6 CS(=O)c1cccc[n]1 Amb24562247 [0,0,0,0,1,0|3,0,0]=4 2166 B9R1.6 C[13C](=O)c1ccccc1 Amb22337854 [0,0,0,0,1,0|1,0,0]=2 2167 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [0,0,0,0,1,0|2,0,1]=4 2168 B9R1.6 C[C@@H](Cl)c1ccccc1 Amb25772789 [0,0,0,0,1,0|2,0,1]=4 2169 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [0,0,0,0,1,0|2,0,1]=4 2170 B9R1.6 C[C@@H](O)c1cccc[n]1 Amb24087444 [0,0,0,0,1,0|2,0,1]=4 2171 B9R1.6 C[C@@H](c1ccccn1)O Amb13951167 [0,0,0,0,1,0|2,0,1]=4 2172 B9R1.6 C[C@H](Br)c1ccccc1 Amb24355307 [0,0,0,0,1,0|2,0,1]=4 2173 B9R1.6 C[C@H](Cl)c1ccccc1 Amb24391406 [0,0,0,0,1,0|2,0,1]=4 2174 B9R1.6 C[S@@](=O)c1ccccc1 Amb22747474 [0,0,0,0,1,0|2,0,0]=3 2175 B9R1.6 C[SiH](C)c1ccccc1 Amb19894005 [0,0,0,0,1,0|2,1,0]=4 2176 B9R1.6 C[Si](=O)c1ccccc1 Amb22053625 [0,0,0,0,1,0|1,1,0]=3 2177 B9R1.6 C[Te+](C)c1ccccc1 Amb22345602 [0,0,0,0,1,0|3,0,0]=4 2178 B9R1.6 ClC(=O)c1cnccn1 Amb2455965 [0,0,0,0,1,0|3,0,0]=4 2179 B9R1.6 ClS(=O)c1ccccc1 Amb13881360 [0,0,0,0,1,0|2,0,0]=3 2180 B9R1.6 Cl[As](Cl)c1ccccc1 Amb22734276 [0,0,0,0,1,0|3,0,0]=4 2181 B9R1.6 Cl[C+](Cl)c1ccccc1 Amb22369050 [0,0,0,0,1,0|2,0,1]=4 2182 B9R1.6 Cl[I](c1ccccc1)Cl Amb10071738 [0,0,0,0,1,0|3,0,0]=4 2183 B9R1.6 FB(F)c1ccccc1 Amb24654946 [0,0,0,0,1,0|3,0,0]=4 2184 B9R1.6 FC(=O)c1ccccc1 Amb10607152 [0,0,0,0,1,0|1,0,0]=2 2185 B9R1.6 FC(c1ccccc1)Cl Amb10838337 [0,0,0,0,1,0|2,0,1]=4 2186 B9R1.6 FC(c1ccccc1)F Amb10606272 [0,0,0,0,1,0|2,0,1]=4 2187 B9R1.6 N=C(/N)\c1cc[n]cc1 Amb20243353 [0,0,0,0,1,0|3,0,0]=4 2188 B9R1.6 N=C(Cl)c1cccc[n]1 Amb24061333 [0,0,0,0,1,0|3,0,0]=4 2189 B9R1.6 N=C(O)c1c[n]cc[n]1 Amb22166847 [0,0,0,0,1,0|3,0,0]=4 2190 B9R1.6 NC(=N)c1cc[nH+]cc1 Amb22734887 [0,0,0,0,1,0|3,0,0]=4 2191 B9R1.6 NC(=N)c1cc[n]cc1 Amb24180789 [0,0,0,0,1,0|3,0,0]=4 2192 B9R1.6 NC(=N)c1ccc[nH+]c1 Amb22166890 [0,0,0,0,1,0|3,0,0]=4 2193 B9R1.6 NC(=N)c1ccc[n]c1 Amb21955334 [0,0,0,0,1,0|3,0,0]=4 2194 B9R1.6 NC(=N)c1cccc[n]1 Amb22343442 [0,0,0,0,1,0|3,0,0]=4 2195 B9R1.6 NC(=N)c1ccccc1 Amb10068704 [0,0,0,0,1,0|2,0,0]=3 2196 B9R1.6 NC(=N)c1ccccc1 Amb2371546 [0,0,0,0,1,0|2,0,0]=3 2197 B9R1.6 NC(=O)C=1C=COCC1 Amb25662817 [0,0,0,0,1,0|2,0,1]=4 2198 B9R1.6 NC(=O)C=1CC=CNC1 Amb24574438 [0,0,0,0,1,0|2,0,1]=4 2199 B9R1.6 NC(=O)c1cc[n][n]c1 Amb22235791 [0,0,0,0,1,0|3,0,0]=4 2200 B9R1.6 NC(=O)c1cc[n]c[n]1 Amb24074283 [0,0,0,0,1,0|3,0,0]=4 2201 B9R1.6 NC(=O)c1cc[n]cc1 Amb24066211 [0,0,0,0,1,0|2,0,0]=3 2202 B9R1.6 NC(=O)c1ccc[n][n]1 Amb22499430 [0,0,0,0,1,0|3,0,0]=4 2203 B9R1.6 NC(=O)c1cccc[p]1 Amb25353307 [0,0,0,0,1,0|2,0,0]=3 2204 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [0,0,0,0,1,0|2,0,0]=3 2205 B9R1.6 NC(=O)c1cccnc1 Amb16231206 [0,0,0,0,1,0|2,0,0]=3 2206 B9R1.6 NC(=S)c1cccnc1 Amb1152408 [0,0,0,0,1,0|2,1,0]=4 2207 B9R1.6 NC(=S)c1ccncc1 Amb1397718 [0,0,0,0,1,0|2,1,0]=4 2208 B9R1.6 NC(=[NH2+])c1ccccn1 Amb16233715 [0,0,0,0,1,0|3,0,0]=4 2209 B9R1.6 NC(F)c1ccccc1 Amb25059400 [0,0,0,0,1,0|2,0,1]=4 2210 B9R1.6 NC(O)c1c[n]ccc1 Amb25251813 [0,0,0,0,1,0|2,0,1]=4 2211 B9R1.6 NC(O)c1cc[n]cc1 Amb25744601 [0,0,0,0,1,0|2,0,1]=4 2212 B9R1.6 N[13C](=O)c1ccccc1 Amb22351604 [0,0,0,0,1,0|1,0,0]=2 2213 B9R1.6 O=C(Br)c1cc[n]cc1 Amb24536581 [0,0,0,0,1,0|2,0,0]=3 2214 B9R1.6 O=C(Cl)c1[n]ccc[n]1 Amb24056588 [0,0,0,0,1,0|3,0,0]=4 2215 B9R1.6 O=C(Cl)c1c[n]cc[n]1 Amb21954009 [0,0,0,0,1,0|3,0,0]=4 2216 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [0,0,0,0,1,0|2,0,0]=3 2217 B9R1.6 O=C(Cl)c1cc[n]c[n]1 Amb19895573 [0,0,0,0,1,0|3,0,0]=4 2218 B9R1.6 O=C(Cl)c1ccc[n][n]1 Amb24062270 [0,0,0,0,1,0|3,0,0]=4 2219 B9R1.6 O=C(Cl)c1cccc[n]1 Amb22492448 [0,0,0,0,1,0|2,0,0]=3 2220 B9R1.6 O=C(F)c1ccc[n]c1 Amb25146722 [0,0,0,0,1,0|2,0,0]=3 2221 B9R1.6 O=N(=O)c1cc[n]cc1 Amb20621911 [0,0,0,0,1,0|2,0,1]=4 2222 B9R1.6 O=S(Cl)c1c[n]ccc1 Amb25347198 [0,0,0,0,1,0|3,0,0]=4 2223 B9R1.6 O=[13C](Cl)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054407 [0,0,0,0,1,0|1,0,0]=2 2224 B9R1.6 O=[13C](Cl)c1ccccc1 Amb22167795 [0,0,0,0,1,0|1,0,0]=2 2225 B9R1.6 OB(O)c1c[n]ccc1 Amb21954295 [0,0,0,0,1,0|2,0,1]=4 2226 B9R1.6 OB(O)c1ccccc1 Amb22587706 [0,0,0,0,1,0|1,0,1]=3 2227 B9R1.6 OB(c1ccccn1)O Amb2383498 [0,0,0,0,1,0|2,0,1]=4 2228 B9R1.6 OB(c1cccnc1)O Amb1353193 [0,0,0,0,1,0|2,0,1]=4 2229 B9R1.6 OB(c1ccncc1)O Amb13887063 [0,0,0,0,1,0|2,0,1]=4 2230 B9R1.6 OB(c1ccncc1)O Amb2383497 [0,0,0,0,1,0|2,0,1]=4 2231 B9R1.6 OC(=O)C1=CC=CCS1 Amb22831443 [0,0,0,0,1,0|1,0,1]=3 2232 B9R1.6 OC(=O)C1=COC=CO1 Amb25305603 [0,0,0,0,1,0|2,0,0]=3 2233 B9R1.6 OC(=O)C1C=CC=CN1 Amb24746571 [0,0,0,0,1,0|1,0,1]=3 2234 B9R1.6 OC(=O)C1C=CC=CO1 Amb18642363 [0,0,0,0,1,0|1,0,1]=3 2235 B9R1.6 OC(=O)C1C=CCC=C1 Amb17593268 [0,0,0,0,1,0|0,0,2]=3 2236 B9R1.6 OC(=O)C1C=CNC=C1 Amb24099560 [0,0,0,0,1,0|1,0,1]=3 2237 B9R1.6 OC(=O)C1CC=CC=N1 Amb25246673 [0,0,0,0,1,0|1,0,2]=4 2238 B9R1.6 OC(=O)C=1CC=CNC1 Amb25293556 [0,0,0,0,1,0|1,0,1]=3 2239 B9R1.6 OC(=O)C=1CNC=CC1 Amb25823057 [0,0,0,0,1,0|1,0,1]=3 2240 B9R1.6 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054405 [0,0,0,0,1,0|0,0,0]=1 2241 B9R1.6 OC(=O)[13c]1ccccc1 Amb22353371 [0,0,0,0,1,0|0,0,0]=1 2242 B9R1.6 OC(=O)c1[n]ccc[n]1 Amb19330380 [0,0,0,0,1,0|2,0,0]=3 2243 B9R1.6 OC(=O)c1c[n][n][n]c1 Amb22490823 [0,0,0,0,1,0|3,0,0]=4 2244 B9R1.6 OC(=O)c1c[n]c[n][n]1 Amb18832864 [0,0,0,0,1,0|3,0,0]=4 2245 B9R1.6 OC(=O)c1c[n]c[n]c1 Amb24099331 [0,0,0,0,1,0|2,0,0]=3 2246 B9R1.6 OC(=O)c1cc[13cH]cc1 Amb22367544 [0,0,0,0,1,0|0,0,0]=1 2247 B9R1.6 OC(=O)c1ccccc1 Amb16232256 [0,0,0,0,1,0|0,0,0]=1 2248 B9R1.6 OC(=O)c1ccccc1 Amb1935196 [0,0,0,0,1,0|0,0,0]=1 2249 B9R1.6 OC(=O)c1ccccc1 Amb22002523 [0,0,0,0,1,0|0,0,0]=1 2250 B9R1.6 OC(=O)c1ccccc1 Amb22279605 [0,0,0,0,1,0|0,0,0]=1 2251 B9R1.6 OC(=O)c1ccccc1 Amb22336602 [0,0,0,0,1,0|0,0,0]=1 2252 B9R1.6 OC(=O)c1ccccc1 Amb22338105 [0,0,0,0,1,0|0,0,0]=1 2253 B9R1.6 OC(=O)c1ccccc1 Amb22351742 [0,0,0,0,1,0|0,0,0]=1 2254 B9R1.6 OC(=O)c1ccccc1 Amb22472602 [0,0,0,0,1,0|0,0,0]=1 2255 B9R1.6 OC(=O)c1ccccc1 Amb22491636 [0,0,0,0,1,0|0,0,0]=1 2256 B9R1.6 OC(=O)c1ccccn1 Amb1227737 [0,0,0,0,1,0|1,0,0]=2 2257 B9R1.6 OC(=O)c1cccnc1 Amb1195995 [0,0,0,0,1,0|1,0,0]=2 2258 B9R1.6 OC(=O)c1ccncn1 Amb1102414 [0,0,0,0,1,0|2,0,0]=3 2259 B9R1.6 OC(=O)c1cnccn1 Amb2455963 [0,0,0,0,1,0|2,0,0]=3 2260 B9R1.6 OC(=O)c1cncnc1 Amb2455830 [0,0,0,0,1,0|2,0,0]=3 2261 B9R1.6 OC(=S)c1ccc[n]c1 Amb22731908 [0,0,0,0,1,0|1,1,0]=3 2262 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [0,0,0,0,1,0|0,1,0]=2 2263 B9R1.6 OC(Br)c1ccccc1 Amb24693764 [0,0,0,0,1,0|1,0,1]=3 2264 B9R1.6 OC(Cl)c1ccccc1 Amb24480238 [0,0,0,0,1,0|1,0,1]=3 2265 B9R1.6 OC(O)c1c[n]ccc1 Amb24102578 [0,0,0,0,1,0|1,0,2]=4 2266 B9R1.6 OC(O)c1cc[n]cc1 Amb24070648 [0,0,0,0,1,0|1,0,2]=4 2267 B9R1.6 OC(O)c1cccc[n]1 Amb24085037 [0,0,0,0,1,0|1,0,2]=4 2268 B9R1.6 OC(P)c1ccccc1 Amb24448419 [0,0,0,0,1,0|1,0,1]=3 2269 B9R1.6 ON(O)c1cc[n]cc1 Amb24572621 [0,0,0,0,1,0|2,0,1]=4 2270 B9R1.6 OP(=O)c1ccccc1 Amb10571098 [0,0,0,0,1,0|1,0,0]=2 2271 B9R1.6 OS(=O)c1[n]ccc[n]1 Amb24061346 [0,0,0,0,1,0|3,0,0]=4 2272 B9R1.6 OS(=O)c1c[n]ccc1 Amb24062548 [0,0,0,0,1,0|2,0,0]=3 2273 B9R1.6 OS(=O)c1cc[n]cc1 Amb24099594 [0,0,0,0,1,0|2,0,0]=3 2274 B9R1.6 OS(=O)c1ccccc1 Amb17939345 [0,0,0,0,1,0|1,0,0]=2 2275 B9R1.6 O[12C](=O)[12c]1[12cH][12cH][12cH][12cH][12cH]1 Amb22338193 [0,0,0,0,1,0|0,0,0]=1 2276 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367547 [0,0,0,0,1,0|0,0,0]=1 2277 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1 Amb17618353 [0,0,0,0,1,0|1,0,0]=2 2278 B9R1.6 O[13C](=O)c1ccccc1 Amb22338753 [0,0,0,0,1,0|0,0,0]=1 2279 B9R1.6 O[14C](=O)c1ccccc1 Amb22352700 [0,0,0,0,1,0|0,0,0]=1 2280 B9R1.6 O[C@H](Br)c1ccccc1 Amb25114797 [0,0,0,0,1,0|1,0,1]=3 2281 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [0,0,0,0,1,0|1,1,0]=3 2282 B9R1.6 SC(=S)c1ccccc1 Amb22051683 [0,0,0,0,1,0|0,2,0]=3 2283 B9R1.6 SC(S)c1ccccc1 Amb25716873 [0,0,0,0,1,0|0,2,1]=4 2284 B9R1.6 [13CH3]C(=O)c1ccccc1 Amb22353264 [0,0,0,0,1,0|1,0,0]=2 2285 B9R1.6 [13CH3][13CH](O)c1ccccc1 Amb22363197 [0,0,0,0,1,0|1,0,1]=3 2286 B9R1.6 [13CH3][13C](=O)c1ccccc1 Amb22366852 [0,0,0,0,1,0|1,0,0]=2 2287 B9R1.6 [15NH2]C(=O)c1ccc[n]c1 Amb22367445 [0,0,0,0,1,0|2,0,0]=3 2288 B9R1.6 [15NH2]C(=O)c1ccccc1 Amb22366901 [0,0,0,0,1,0|1,0,0]=2 2289 B9R1.6 [2H]C(=C)c1ccccc1 Amb22337758 [0,0,0,0,1,0|2,0,0]=3 2290 B9R1.6 [2H]C(=O)c1ccccc1 Amb22043987 [0,0,0,0,1,0|1,0,0]=2 2291 B9R1.6 [2H][13C](=O)c1ccccc1 Amb22369001 [0,0,0,0,1,0|1,0,0]=2 2292 B9R1.6 [CH2-]C(=O)c1c[n]cc[n]1 Amb25692527 [0,0,0,0,1,0|3,0,0]=4 2293 B9R1.6 [CH2-]C(=O)c1cc[n]c[n]1 Amb25373169 [0,0,0,0,1,0|3,0,0]=4 2294 B9R1.6 [CH2-]C(=O)c1ccc[n][n]1 Amb24631590 [0,0,0,0,1,0|3,0,0]=4 2295 B9R1.6 [CH2-]C(=O)c1ccc[n]c1 Amb25692916 [0,0,0,0,1,0|2,0,0]=3 2296 B9R1.6 [O-]C(=O)c1[n]ccc[n]1 Amb22643200 [0,0,0,0,1,0|2,0,1]=4 2297 B9R1.6 [O-]C(=O)c1c[n]cc[n]1 Amb21928015 [0,0,0,0,1,0|2,0,1]=4 2298 B9R1.6 [O-]C(=O)c1cc[n]c[n]1 Amb22057356 [0,0,0,0,1,0|2,0,1]=4 2299 B9R1.6 [O-]C(=O)c1cc[n]cc1 Amb22730239 [0,0,0,0,1,0|1,0,1]=3 2300 B9R1.6 [O-]C(=O)c1ccc[n]c1 Amb22043320 [0,0,0,0,1,0|1,0,1]=3 2301 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22058087 [0,0,0,0,1,0|1,0,1]=3 2302 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22411648 [0,0,0,0,1,0|1,0,1]=3 2303 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22734923 [0,0,0,0,1,0|1,0,1]=3 2304 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053472 [0,0,0,0,1,0|0,0,1]=2 2305 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053705 [0,0,0,0,1,0|0,0,1]=2 2306 B9R1.6 [O-]C(=O)c1ccccc1 Amb22167689 [0,0,0,0,1,0|0,0,1]=2 2307 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168438 [0,0,0,0,1,0|0,0,1]=2 2308 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168439 [0,0,0,0,1,0|0,0,1]=2 2309 B9R1.6 [O-]C(=O)c1ccccc1 Amb22351958 [0,0,0,0,1,0|0,0,1]=2 2310 B9R1.6 [O-]C(=O)c1ccccc1 Amb22353183 [0,0,0,0,1,0|0,0,1]=2 2311 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732264 [0,0,0,0,1,0|0,0,1]=2 2312 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732273 [0,0,0,0,1,0|0,0,1]=2 2313 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732500 [0,0,0,0,1,0|0,0,1]=2 2314 B9R1.6 [O-]C(=O)c1ccccc1 Amb22734002 [0,0,0,0,1,0|0,0,1]=2 2315 B9R1.6 [O-]P(=O)c1ccccc1 Amb21618955 [0,0,0,0,1,0|1,0,1]=3 2316 B9R1.6 [O-]S(=O)c1cccc[n]1 Amb22751253 [0,0,0,0,1,0|2,0,1]=4 2317 B9R1.6 [O-]S(=O)c1ccccc1 Amb10790483 [0,0,0,0,1,0|1,0,1]=3 2318 B9R1.6 [O-]S(=O)c1ccccc1 Amb22043426 [0,0,0,0,1,0|1,0,1]=3 2319 B9R1.6 [O-]S(=O)c1ccccc1 Amb22053867 [0,0,0,0,1,0|1,0,1]=3 2320 B9R1.6 [O-]S(=O)c1ccccc1 Amb22352998 [0,0,0,0,1,0|1,0,1]=3 2321 B9R1.6 [O-][15N+](=O)c1ccccc1 Amb22351461 [0,0,0,0,1,0|1,0,1]=3 2322 B9R1.6 [O-][N+](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351475 [0,0,0,0,1,0|1,0,1]=3 2323 B9R1.6 [O-][N+](=O)[n+]1ccccc1 Amb10552465 [0,0,0,0,1,0|2,0,1]=4 2324 B9R1.6 [O-][N+](=O)c1ccccc1 Amb24061309 [0,0,0,0,1,0|1,0,1]=3 2325 B9R1.6 [O-][P](=O)c1ccccc1 Amb22731674 [0,0,0,0,1,0|1,0,1]=3 2326 B9R1.6 [S-]C(=O)c1ccccc1 Amb10555187 [0,0,0,0,1,0|0,1,0]=2 2327 B9R1.13 C=C(Br)Cc1ccc[s]1 Amb25185096 [0,0,0,0,1,0|3,0,0]=4 2328 B9R1.13 C=C(Br)Cc1ccco1 Amb24411253 [0,0,0,0,1,0|3,0,0]=4 2329 B9R1.13 C=C(Cl)C[n]1cccc1 Amb25180980 [0,0,0,0,1,0|3,0,0]=4 2330 B9R1.13 C=C(Cl)Cc1ccc[s]1 Amb24674094 [0,0,0,0,1,0|3,0,0]=4 2331 B9R1.13 C=C(O)CC1C=CC=N1 Amb25162740 [0,0,0,0,1,0|2,0,1]=4 2332 B9R1.13 CC(=C)Cc1ccc[nH]1 Amb24477810 [0,0,0,0,1,0|3,0,0]=4 2333 B9R1.13 CC(=C)Cc1ccco1 Amb24673621 [0,0,0,0,1,0|3,0,0]=4 2334 B9R1.13 CC(=O)CC1=CC=C[SiH2]1 Amb25729101 [0,0,0,0,1,0|1,1,0]=3 2335 B9R1.13 CC(=O)C[n]1ccc[n]1 Amb21988437 [0,0,0,0,1,0|3,0,0]=4 2336 B9R1.13 CC(=O)Cc1c[nH]c[n]1 Amb25832036 [0,0,0,0,1,0|3,0,0]=4 2337 B9R1.13 CC(=O)Cc1cc[nH]c1 Amb18893399 [0,0,0,0,1,0|2,0,0]=3 2338 B9R1.13 CC(=O)Cc1cc[n]o1 Amb24425365 [0,0,0,0,1,0|3,0,0]=4 2339 B9R1.13 CC(=O)Cc1ccoc1 Amb25713513 [0,0,0,0,1,0|2,0,0]=3 2340 B9R1.13 CC(=O)Cn1cccn1 Amb1092543 [0,0,0,0,1,0|3,0,0]=4 2341 B9R1.13 CC(=O)Nc1cccs1 Amb2228309 [0,0,0,0,1,0|3,0,0]=4 2342 B9R1.13 CC(=O)Oc1cc[nH]c1 Amb24476976 [0,0,0,0,1,0|3,0,0]=4 2343 B9R1.13 CC(=O)Oc1ccc[s]1 Amb24566730 [0,0,0,0,1,0|3,0,0]=4 2344 B9R1.13 CC(=O)Oc1cocc1 Amb24583167 [0,0,0,0,1,0|3,0,0]=4 2345 B9R1.13 CC(=O)Sc1c[s]cc1 Amb24727644 [0,0,0,0,1,0|3,0,0]=4 2346 B9R1.13 CC(=O)Sc1ccc[s]1 Amb25235134 [0,0,0,0,1,0|3,0,0]=4 2347 B9R1.13 CC(=O)Sc1ccco1 Amb24511658 [0,0,0,0,1,0|3,0,0]=4 2348 B9R1.13 CC(Cc1ccc[nH]1)O Amb17593297 [0,0,0,0,1,0|2,0,1]=4 2349 B9R1.13 CC(O)CC=1C=CCC1 Amb24732104 [0,0,0,0,1,0|1,0,2]=4 2350 B9R1.13 CC(O)CC=1CC=CC1 Amb25832624 [0,0,0,0,1,0|1,0,2]=4 2351 B9R1.13 CC(O)C[n]1cccc1 Amb24589643 [0,0,0,0,1,0|2,0,1]=4 2352 B9R1.13 CC(O)Cc1c[s]cc1 Amb24725695 [0,0,0,0,1,0|2,0,1]=4 2353 B9R1.13 CC(O)Cc1ccco1 Amb22748663 [0,0,0,0,1,0|2,0,1]=4 2354 B9R1.13 CS(=O)Cc1ccc[s]1 Amb25746950 [0,0,0,0,1,0|3,0,0]=4 2355 B9R1.13 C[C@@H](O)C[n]1cccc1 Amb25793900 [0,0,0,0,1,0|2,0,1]=4 2356 B9R1.13 C[C@@H](O)Cc1c[s]cc1 Amb22896909 [0,0,0,0,1,0|2,0,1]=4 2357 B9R1.13 C[C@@H](O)Cc1ccc[s]1 Amb22896924 [0,0,0,0,1,0|2,0,1]=4 2358 B9R1.13 C[C@@H](O)Cc1ccco1 Amb24433279 [0,0,0,0,1,0|2,0,1]=4 2359 B9R1.13 C[C@H](O)Cc1c[s]cc1 Amb24395208 [0,0,0,0,1,0|2,0,1]=4 2360 B9R1.13 C[C@H](O)Cc1ccc[s]1 Amb25354706 [0,0,0,0,1,0|2,0,1]=4 2361 B9R1.13 NC(=N)C[n]1cccc1 Amb22292337 [0,0,0,0,1,0|3,0,0]=4 2362 B9R1.13 NC(=O)Cc1[n]cc[s]1 Amb23440630 [0,0,0,0,1,0|3,0,0]=4 2363 B9R1.13 NC(=O)Cc1c[nH]c[n]1 Amb24746799 [0,0,0,0,1,0|3,0,0]=4 2364 B9R1.13 NC(=O)Cc1c[n]c[s]1 Amb22372056 [0,0,0,0,1,0|3,0,0]=4 2365 B9R1.13 NC(=O)Cc1cc[nH]c1 Amb18243493 [0,0,0,0,1,0|2,0,0]=3 2366 B9R1.13 NC(=O)Cc1ccc[nH]1 Amb22886650 [0,0,0,0,1,0|2,0,0]=3 2367 B9R1.13 NC(=O)Cc1ccco1 Amb24534382 [0,0,0,0,1,0|2,0,0]=3 2368 B9R1.13 NC(=O)Cc1cco[n]1 Amb23440839 [0,0,0,0,1,0|3,0,0]=4 2369 B9R1.13 NC(=O)Cn1cccn1 Amb10609663 [0,0,0,0,1,0|3,0,0]=4 2370 B9R1.13 NC(=O)Cn1cncc1 Amb1056114 [0,0,0,0,1,0|3,0,0]=4 2371 B9R1.13 NC(=O)Nc1cc[s]c1 Amb25749521 [0,0,0,0,1,0|3,0,0]=4 2372 B9R1.13 NC(=O)Oc1ccc[nH]1 Amb24763643 [0,0,0,0,1,0|3,0,0]=4 2373 B9R1.13 NC(=O)Sc1ccc[s]1 Amb24406078 [0,0,0,0,1,0|3,0,0]=4 2374 B9R1.13 NC(=S)Cc1ccc[nH]1 Amb19148730 [0,0,0,0,1,0|2,1,0]=4 2375 B9R1.13 NC(=S)Cc1cccs1 Amb1092031 [0,0,0,0,1,0|2,1,0]=4 2376 B9R1.13 O=C(Cl)C[n]1ccc[n]1 Amb24340282 [0,0,0,0,1,0|3,0,0]=4 2377 B9R1.13 O=C(Cl)Cc1c[nH]c[n]1 Amb25146205 [0,0,0,0,1,0|3,0,0]=4 2378 B9R1.13 O=C(Cl)Cc1ccco1 Amb25124003 [0,0,0,0,1,0|2,0,0]=3 2379 B9R1.13 O=C(Cl)Oc1ccco1 Amb25258766 [0,0,0,0,1,0|3,0,0]=4 2380 B9R1.13 O=C(Cl)Sc1ccc[nH]1 Amb25690947 [0,0,0,0,1,0|3,0,0]=4 2381 B9R1.13 O=C(Cl)Sc1ccc[s]1 Amb24696820 [0,0,0,0,1,0|3,0,0]=4 2382 B9R1.13 O=C(Cn1cccn1)[OH2+] Amb10552495 [0,0,0,0,1,0|2,0,1]=4 2383 B9R1.13 O=C(F)Sc1ccc[s]1 Amb25178865 [0,0,0,0,1,0|3,0,0]=4 2384 B9R1.13 OB(Cc1ccco1)O Amb10576612 [0,0,0,0,1,0|2,0,1]=4 2385 B9R1.13 OC(=O)CC1=CCCO1 Amb24639240 [0,0,0,0,1,0|1,0,2]=4 2386 B9R1.13 OC(=O)CC1CC=CC1 Amb25673915 [0,0,0,0,1,0|0,0,3]=4 2387 B9R1.13 OC(=O)CC=1CCCC1 Amb18642404 [0,0,0,0,1,0|0,0,3]=4 2388 B9R1.13 OC(=O)CC=1CCOC1 Amb23538473 [0,0,0,0,1,0|1,0,2]=4 2389 B9R1.13 OC(=O)CN1CC=CC1 Amb24360179 [0,0,0,0,1,0|1,0,2]=4 2390 B9R1.13 OC(=O)C[C@H]1CCC=C1 Amb25378723 [0,0,0,0,1,0|0,0,3]=4 2391 B9R1.13 OC(=O)C[n]1c[n][n]c1 Amb20248057 [0,0,0,0,1,0|3,0,0]=4 2392 B9R1.13 OC(=O)Cc1[cH-]ccc1 Amb24122585 [0,0,0,0,1,0|0,0,1]=2 2393 B9R1.13 OC(=O)Cc1[nH][n]c[n]1 Amb18222494 [0,0,0,0,1,0|3,0,0]=4 2394 B9R1.13 OC(=O)Cc1[nH][n]c[n]1 Amb22498751 [0,0,0,0,1,0|3,0,0]=4 2395 B9R1.13 OC(=O)Cc1[nH]cc[n]1 Amb22750530 [0,0,0,0,1,0|2,0,0]=3 2396 B9R1.13 OC(=O)Cc1[n][n]co1 Amb22753920 [0,0,0,0,1,0|3,0,0]=4 2397 B9R1.13 OC(=O)Cc1[n]c[n][s]1 Amb18831517 [0,0,0,0,1,0|3,0,0]=4 2398 B9R1.13 OC(=O)Cc1[n]c[s][n]1 Amb18202411 [0,0,0,0,1,0|3,0,0]=4 2399 B9R1.13 OC(=O)Cc1c[nH]c[n]1 Amb20670251 [0,0,0,0,1,0|2,0,0]=3 2400 B9R1.13 OC(=O)Cc1c[n][n][nH]1 Amb18203289 [0,0,0,0,1,0|3,0,0]=4 2401 B9R1.13 OC(=O)Cc1c[n][s]c1 Amb18831589 [0,0,0,0,1,0|2,0,0]=3 2402 B9R1.13 OC(=O)Cc1c[n]o[n]1 Amb18832655 [0,0,0,0,1,0|3,0,0]=4 2403 B9R1.13 OC(=O)Cc1cc[nH]c1 Amb18062951 [0,0,0,0,1,0|1,0,0]=2 2404 B9R1.13 OC(=O)Cc1cc[n][nH]1 Amb19243677 [0,0,0,0,1,0|2,0,0]=3 2405 B9R1.13 OC(=O)Cc1cc[n][s]1 Amb18831590 [0,0,0,0,1,0|2,0,0]=3 2406 B9R1.13 OC(=O)Cc1cc[s][n]1 Amb18831591 [0,0,0,0,1,0|2,0,0]=3 2407 B9R1.13 OC(=O)Cc1cscc1 Amb1151879 [0,0,0,0,1,0|1,0,0]=2 2408 B9R1.13 OC(=O)Cc1cscn1 Amb17039671 [0,0,0,0,1,0|2,0,0]=3 2409 B9R1.13 OC(=O)Cn1cccc1 Amb1124868 [0,0,0,0,1,0|1,0,0]=2 2410 B9R1.13 OC(=O)Cn1cccn1 Amb1157167 [0,0,0,0,1,0|2,0,0]=3 2411 B9R1.13 OC(=O)Cn1ccnn1 Amb10669511 [0,0,0,0,1,0|3,0,0]=4 2412 B9R1.13 OC(=O)Cn1cncn1 Amb10552411 [0,0,0,0,1,0|3,0,0]=4 2413 B9R1.13 OC(=O)Cn1cncn1 Amb1152056 [0,0,0,0,1,0|3,0,0]=4 2414 B9R1.13 OC(=O)Cn1cnnc1 Amb10879957 [0,0,0,0,1,0|3,0,0]=4 2415 B9R1.13 OC(=O)Sc1ccco1 Amb24695916 [0,0,0,0,1,0|2,0,0]=3 2416 B9R1.13 O[13C](=O)[13CH2][15n]1c[15n]cc1 Amb17616038 [0,0,0,0,1,0|2,0,0]=3 2417 B9R1.13 [O-]C(=O)Cc1c[nH]cn1 Amb10843901 [0,0,0,0,1,0|2,0,1]=4 2418 B11R1.91 C=C(Br)CNc1cccc[n]1 Amb24488340 [0,0,0,0,0,1|3,0,0]=4 2419 B11R1.91 C=C(Br)CSc1ccccc1 Amb24458275 [0,0,0,0,0,1|2,0,0]=3 2420 B11R1.91 C=C(Cl)CNc1cc[n]cc1 Amb24442783 [0,0,0,0,0,1|3,0,0]=4 2421 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,0,0,0,0,1|2,0,0]=3 2422 B11R1.91 C=C(Cl)CSc1cccc[n]1 Amb25372588 [0,0,0,0,0,1|3,0,0]=4 2423 B11R1.91 CC(=C)CNc1cc[n]cc1 Amb24740371 [0,0,0,0,0,1|3,0,0]=4 2424 B11R1.91 CC(=C)CNc1cccc[n]1 Amb24486042 [0,0,0,0,0,1|3,0,0]=4 2425 B11R1.91 CC(=C)COc1cc[n]cc1 Amb24690034 [0,0,0,0,0,1|3,0,0]=4 2426 B11R1.91 CC(=C)COc1cccc[n]1 Amb25084698 [0,0,0,0,0,1|3,0,0]=4 2427 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [0,0,0,0,0,1|2,0,0]=3 2428 B11R1.91 CC(=C)CSc1cc[n]cc1 Amb25260223 [0,0,0,0,0,1|3,0,0]=4 2429 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [0,0,0,0,0,1|2,0,0]=3 2430 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [0,0,0,0,0,1|2,0,1]=4 2431 B11R1.91 CC(=N)NCc1cccc[n]1 Amb25798703 [0,0,0,0,0,1|3,0,0]=4 2432 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,0,0,0,0,1|2,0,0]=3 2433 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,0,0,0,0,1|2,0,0]=3 2434 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [0,0,0,0,0,1|2,0,0]=3 2435 B11R1.91 CC(=O)C=Cc1ccc[nH+]c1 Amb24099599 [0,0,0,0,0,1|2,0,1]=4 2436 B11R1.91 CC(=O)CCN1CC=CC=C1 Amb24676819 [0,0,0,0,0,1|2,0,1]=4 2437 B11R1.91 CC(=O)CCc1[n]ccc[n]1 Amb24726140 [0,0,0,0,0,1|3,0,0]=4 2438 B11R1.91 CC(=O)CCc1c[n]cc[n]1 Amb25307907 [0,0,0,0,0,1|3,0,0]=4 2439 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,0,0,0,0,1|2,0,0]=3 2440 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,0,0,0,0,1|2,0,0]=3 2441 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,0,0,0,0,1|2,0,0]=3 2442 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,0,0,0,0,1|1,0,0]=2 2443 B11R1.91 CC(=O)CSc1cc[n]c[n]1 Amb24477647 [0,0,0,0,0,1|3,0,0]=4 2444 B11R1.91 CC(=O)CSc1cc[n]cc1 Amb25344740 [0,0,0,0,0,1|2,0,0]=3 2445 B11R1.91 CC(=O)CSc1ccc[n][n]1 Amb24371884 [0,0,0,0,0,1|3,0,0]=4 2446 B11R1.91 CC(=O)NCc1[n]ccc[n]1 Amb24704246 [0,0,0,0,0,1|3,0,0]=4 2447 B11R1.91 CC(=O)NCc1c[n]c[n]c1 Amb22727960 [0,0,0,0,0,1|3,0,0]=4 2448 B11R1.91 CC(=O)NCc1c[n]cc[n]1 Amb25311243 [0,0,0,0,0,1|3,0,0]=4 2449 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,0,0,0,0,1|1,0,0]=2 2450 B11R1.91 CC(=O)NNc1c[n]ccc1 Amb25272223 [0,0,0,0,0,1|3,0,0]=4 2451 B11R1.91 CC(=O)NNc1cc[n]cc1 Amb24416297 [0,0,0,0,0,1|3,0,0]=4 2452 B11R1.91 CC(=O)NOc1ccccc1 Amb24104585 [0,0,0,0,0,1|2,0,0]=3 2453 B11R1.91 CC(=O)OCC1C=CCC=C1 Amb22365037 [0,0,0,0,0,1|1,0,2]=4 2454 B11R1.91 CC(=O)OCc1[n]ccc[n]1 Amb22756932 [0,0,0,0,0,1|3,0,0]=4 2455 B11R1.91 CC(=O)SCc1ccc[n]c1 Amb22274513 [0,0,0,0,0,1|2,0,0]=3 2456 B11R1.91 CC(=O)SCc1cccc[n]1 Amb22274512 [0,0,0,0,0,1|2,0,0]=3 2457 B11R1.91 CC(=O)SSc1ccccc1 Amb24370825 [0,0,0,0,0,1|2,0,0]=3 2458 B11R1.91 CC(=O)\C=C/c1cccc[n]1 Amb24532942 [0,0,0,0,0,1|2,0,1]=4 2459 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [0,0,0,0,0,1|1,0,1]=3 2460 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,0,0,0,0,1|1,0,1]=3 2461 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [0,0,0,0,0,1|2,0,1]=4 2462 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb17477757 [0,0,0,0,0,1|2,0,1]=4 2463 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb17477756 [0,0,0,0,0,1|2,0,1]=4 2464 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [0,0,0,0,0,1|1,0,1]=3 2465 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [0,0,0,0,0,1|2,0,0]=3 2466 B11R1.91 CC(=S)NCc1cccc[n]1 Amb24372089 [0,0,0,0,0,1|2,1,0]=4 2467 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,0,0,0,0,1|1,1,0]=3 2468 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [0,0,0,0,0,1|1,1,0]=3 2469 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [0,0,0,0,0,1|2,0,1]=4 2470 B11R1.91 CC(C)=CNc1ccccc1 Amb24715634 [0,0,0,0,0,1|2,0,1]=4 2471 B11R1.91 CC(C)=NNc1ccccc1 Amb20240635 [0,0,0,0,0,1|3,0,0]=4 2472 B11R1.91 CC(CCc1ccccn1)O Amb17507263 [0,0,0,0,0,1|2,0,1]=4 2473 B11R1.91 CC(CCc1cccnc1)O Amb17507264 [0,0,0,0,0,1|2,0,1]=4 2474 B11R1.91 CC(CCc1ccncc1)O Amb17507265 [0,0,0,0,0,1|2,0,1]=4 2475 B11R1.91 CC(COc1ccccc1)N Amb10609380 [0,0,0,0,0,1|2,0,1]=4 2476 B11R1.91 CC(COc1ccccc1)N Amb1126967 [0,0,0,0,0,1|2,0,1]=4 2477 B11R1.91 CC(Cl)COc1ccccc1 Amb20248050 [0,0,0,0,0,1|2,0,1]=4 2478 B11R1.91 CC(Cl)CSc1ccccc1 Amb25361088 [0,0,0,0,0,1|2,0,1]=4 2479 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [0,0,0,0,0,1|2,0,1]=4 2480 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [0,0,0,0,0,1|2,0,1]=4 2481 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [0,0,0,0,0,1|2,0,1]=4 2482 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [0,0,0,0,0,1|2,0,1]=4 2483 B11R1.91 CC(O)C#Cc1ccccc1 Amb24101080 [0,0,0,0,0,1|1,0,2]=4 2484 B11R1.91 CC(O)CNc1c[n]ccc1 Amb18933159 [0,0,0,0,0,1|2,0,1]=4 2485 B11R1.91 CC(O)COc1c[n]ccc1 Amb24538290 [0,0,0,0,0,1|2,0,1]=4 2486 B11R1.91 CC(O)CSc1cccc[n]1 Amb18180213 [0,0,0,0,0,1|2,0,1]=4 2487 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,0,0,0,0,1|1,0,1]=3 2488 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [0,0,0,0,0,1|1,0,1]=3 2489 B11R1.91 CC(S)CNc1ccccc1 Amb25701720 [0,0,0,0,0,1|1,1,1]=4 2490 B11R1.91 CC(\C=C\c1ccccc1)O Amb17593695 [0,0,0,0,0,1|1,0,2]=4 2491 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [0,0,0,0,0,1|3,0,0]=4 2492 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [0,0,0,0,0,1|3,0,0]=4 2493 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,0,0,0,0,1|3,0,0]=4 2494 B11R1.91 CN(O)CCc1cc[n]cc1 Amb25684228 [0,0,0,0,0,1|3,0,0]=4 2495 B11R1.91 CN(O)N=Nc1ccccc1 Amb24064881 [0,0,0,0,0,1|3,0,0]=4 2496 B11R1.91 C[C@@H](COc1ccccc1)N Amb17232092 [0,0,0,0,0,1|2,0,1]=4 2497 B11R1.91 C[C@@H](N)CNc1ccccc1 Amb24392348 [0,0,0,0,0,1|2,0,1]=4 2498 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [0,0,0,0,0,1|2,0,1]=4 2499 B11R1.91 C[C@@H](N)CSc1ccccc1 Amb24692771 [0,0,0,0,0,1|2,0,1]=4 2500 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,0,0,0,0,1|1,0,1]=3 2501 B11R1.91 C[C@@H](O)CNc1cc[n]cc1 Amb24422164 [0,0,0,0,0,1|2,0,1]=4 2502 B11R1.91 C[C@@H](O)CNc1cccc[n]1 Amb24633004 [0,0,0,0,0,1|2,0,1]=4 2503 B11R1.91 C[C@@H](O)CSc1c[n]ccc1 Amb25306432 [0,0,0,0,0,1|2,0,1]=4 2504 B11R1.91 C[C@@H](O)CSc1cc[n]cc1 Amb25374733 [0,0,0,0,0,1|2,0,1]=4 2505 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [0,0,0,0,0,1|1,0,1]=3 2506 B11R1.91 C[C@H](N)CNc1ccccc1 Amb24423922 [0,0,0,0,0,1|2,0,1]=4 2507 B11R1.91 C[C@H](N)CSc1ccccc1 Amb24486596 [0,0,0,0,0,1|2,0,1]=4 2508 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,0,0,0,0,1|1,0,1]=3 2509 B11R1.91 C[C@H](O)CNc1cc[n]cc1 Amb25838422 [0,0,0,0,0,1|2,0,1]=4 2510 B11R1.91 C[C@H](O)CNc1cccc[n]1 Amb25698310 [0,0,0,0,0,1|2,0,1]=4 2511 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [0,0,0,0,0,1|1,0,1]=3 2512 B11R1.91 C[C@H](O)COc1c[n]ccc1 Amb25148164 [0,0,0,0,0,1|2,0,1]=4 2513 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [0,0,0,0,0,1|1,0,1]=3 2514 B11R1.91 C[C@H](O)CSc1cc[n]cc1 Amb25073090 [0,0,0,0,0,1|2,0,1]=4 2515 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [0,0,0,0,0,1|1,0,1]=3 2516 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [0,0,0,0,0,1|2,1,0]=4 2517 B11R1.91 C\C(=C\C[n+]1ccccc1)\Cl Amb2228412 [0,0,0,0,0,1|3,0,0]=4 2518 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [0,0,0,0,0,1|2,0,1]=4 2519 B11R1.91 C\C(\N)=N/Cc1c[n]ccc1 Amb24098048 [0,0,0,0,0,1|3,0,0]=4 2520 B11R1.91 C\C(\N)=N\Nc1ccccc1 Amb24417520 [0,0,0,0,0,1|3,0,0]=4 2521 B11R1.91 C\C(\N)=N\Oc1ccccc1 Amb25042875 [0,0,0,0,0,1|3,0,0]=4 2522 B11R1.91 ClC(Cl)CNc1ccccc1 Amb24720107 [0,0,0,0,0,1|2,0,1]=4 2523 B11R1.91 ClC(Cl)COc1ccccc1 Amb24417608 [0,0,0,0,0,1|2,0,1]=4 2524 B11R1.91 ClP(Cl)OCc1ccccc1 Amb22054434 [0,0,0,0,0,1|3,0,0]=4 2525 B11R1.91 FC(F)CNc1ccccc1 Amb18791799 [0,0,0,0,0,1|2,0,1]=4 2526 B11R1.91 FC(F)CNc1ccccc1 Amb20623918 [0,0,0,0,0,1|2,0,1]=4 2527 B11R1.91 FC(F)COc1ccccc1 Amb22008298 [0,0,0,0,0,1|2,0,1]=4 2528 B11R1.91 FC(F)CSc1ccccc1 Amb25668847 [0,0,0,0,0,1|2,0,1]=4 2529 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [0,0,0,0,0,1|2,0,0]=3 2530 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,0,0,0,0,1|2,0,0]=3 2531 B11R1.91 NC(=N)C=Cc1ccccc1 Amb22464717 [0,0,0,0,0,1|2,0,1]=4 2532 B11R1.91 NC(=N)CCc1cccc[n]1 Amb22304703 [0,0,0,0,0,1|3,0,0]=4 2533 B11R1.91 NC(=N)CNc1ccccc1 Amb24426634 [0,0,0,0,0,1|2,0,0]=3 2534 B11R1.91 NC(=N)CSc1cc[n]cc1 Amb24675096 [0,0,0,0,0,1|3,0,0]=4 2535 B11R1.91 NC(=N)NCc1cc[n]cc1 Amb22586445 [0,0,0,0,0,1|3,0,0]=4 2536 B11R1.91 NC(=N)NCc1cc[n]cc1 Amb22586971 [0,0,0,0,0,1|3,0,0]=4 2537 B11R1.91 NC(=N)NCc1ccc[n]c1 Amb20631269 [0,0,0,0,0,1|3,0,0]=4 2538 B11R1.91 NC(=N)NCc1ccc[n]c1 Amb22586970 [0,0,0,0,0,1|3,0,0]=4 2539 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [0,0,0,0,0,1|2,0,0]=3 2540 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [0,0,0,0,0,1|2,0,0]=3 2541 B11R1.91 NC(=N)NCc1ccccn1 Amb13995592 [0,0,0,0,0,1|3,0,0]=4 2542 B11R1.91 NC(=N)NCc1cccnc1 Amb10607729 [0,0,0,0,0,1|3,0,0]=4 2543 B11R1.91 NC(=N)NCc1ccncc1 Amb10607730 [0,0,0,0,0,1|3,0,0]=4 2544 B11R1.91 NC(=N)SCc1cc[n]cc1 Amb23538018 [0,0,0,0,0,1|3,0,0]=4 2545 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [0,0,0,0,0,1|2,0,0]=3 2546 B11R1.91 NC(=N)SCc1cccnc1 Amb16229677 [0,0,0,0,0,1|3,0,0]=4 2547 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [0,0,0,0,0,1|2,0,0]=3 2548 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22755484 [0,0,0,0,0,1|2,0,1]=4 2549 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22756994 [0,0,0,0,0,1|2,0,1]=4 2550 B11R1.91 NC(=N)\N=C\c1ccccc1 Amb24435682 [0,0,0,0,0,1|2,0,1]=4 2551 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [0,0,0,0,0,1|2,0,0]=3 2552 B11R1.91 NC(=O)CCc1[n]ccc[n]1 Amb24355296 [0,0,0,0,0,1|3,0,0]=4 2553 B11R1.91 NC(=O)CCc1c[n]c[n]c1 Amb23571326 [0,0,0,0,0,1|3,0,0]=4 2554 B11R1.91 NC(=O)CCc1c[n]cc[n]1 Amb25321905 [0,0,0,0,0,1|3,0,0]=4 2555 B11R1.91 NC(=O)CCc1ccc[n][n]1 Amb25061349 [0,0,0,0,0,1|3,0,0]=4 2556 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,0,0,0,0,1|2,0,0]=3 2557 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,0,0,0,0,1|2,0,0]=3 2558 B11R1.91 NC(=O)CNc1cc[n]c[n]1 Amb18973884 [0,0,0,0,0,1|3,0,0]=4 2559 B11R1.91 NC(=O)CNc1ccc[n][n]1 Amb18298645 [0,0,0,0,0,1|3,0,0]=4 2560 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [0,0,0,0,0,1|2,0,0]=3 2561 B11R1.91 NC(=O)NCc1cc[n]c[n]1 Amb24467215 [0,0,0,0,0,1|3,0,0]=4 2562 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,0,0,0,0,1|1,0,0]=2 2563 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [0,0,0,0,0,1|2,0,0]=3 2564 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [0,0,0,0,0,1|2,0,0]=3 2565 B11R1.91 NC(=O)NOc1ccccc1 Amb24726052 [0,0,0,0,0,1|2,0,0]=3 2566 B11R1.91 NC(=O)NSc1cccc[n]1 Amb24610581 [0,0,0,0,0,1|3,0,0]=4 2567 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [0,0,0,0,0,1|2,0,1]=4 2568 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,0,0,0,0,1|1,1,0]=3 2569 B11R1.91 NC(=S)CCc1cccnc1 Amb17232623 [0,0,0,0,0,1|2,1,0]=4 2570 B11R1.91 NC(=S)CCc1ccncc1 Amb17400216 [0,0,0,0,0,1|2,1,0]=4 2571 B11R1.91 NC(=S)CNc1ccccc1 Amb17232624 [0,0,0,0,0,1|1,1,0]=3 2572 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,0,0,0,0,1|1,1,0]=3 2573 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,0,0,0,0,1|1,1,0]=3 2574 B11R1.91 NC(=S)NCc1cccnc1 Amb2445857 [0,0,0,0,0,1|2,1,0]=4 2575 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [0,0,0,0,0,1|1,1,0]=3 2576 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [0,0,0,0,0,1|1,1,1]=4 2577 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,0,0,0,0,1|2,0,0]=3 2578 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [0,0,0,0,0,1|2,0,0]=3 2579 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,0,0,0,0,1|2,0,0]=3 2580 B11R1.91 NC(N)=NNc1ccccc1 Amb24726173 [0,0,0,0,0,1|3,0,0]=4 2581 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [0,0,0,0,0,1|2,0,0]=3 2582 B11R1.91 O=C(Cl)CSc1cc[n]cc1 Amb22396542 [0,0,0,0,0,1|2,0,0]=3 2583 B11R1.91 O=C(Cl)CSc1cccc[n]1 Amb19650937 [0,0,0,0,0,1|2,0,0]=3 2584 B11R1.91 O=C(Cl)CSc1cccc[n]1 Amb21959947 [0,0,0,0,0,1|2,0,0]=3 2585 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [0,0,0,0,0,1|1,0,0]=2 2586 B11R1.91 O=C(Cl)OCc1cc[n]cc1 Amb24559531 [0,0,0,0,0,1|2,0,0]=3 2587 B11R1.91 O=C(Cl)OCc1ccc[n]c1 Amb25852784 [0,0,0,0,0,1|2,0,0]=3 2588 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [0,0,0,0,0,1|0,1,0]=2 2589 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [0,0,0,0,0,1|2,0,0]=3 2590 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [0,0,0,0,0,1|1,0,1]=3 2591 B11R1.91 OB(O)C#Cc1ccccc1 Amb25151882 [0,0,0,0,0,1|1,0,2]=4 2592 B11R1.91 OB(O)CCc1c[n]ccc1 Amb25259201 [0,0,0,0,0,1|2,0,1]=4 2593 B11R1.91 OB(O)CCc1cccc[n]1 Amb24392967 [0,0,0,0,0,1|2,0,1]=4 2594 B11R1.91 OB(O)CSc1cccc[n]1 Amb22388601 [0,0,0,0,0,1|2,0,1]=4 2595 B11R1.91 OB(O)O[Hg]c1ccccc1 Amb22345921 [0,0,0,0,0,1|2,0,1]=4 2596 B11R1.91 OB(O)\C=C/c1ccccc1 Amb24117859 [0,0,0,0,0,1|1,0,2]=4 2597 B11R1.91 OB(\C=C\c1ccccc1)O Amb2447227 [0,0,0,0,0,1|1,0,2]=4 2598 B11R1.91 OC(=O)C#Cc1c[n]cc[n]1 Amb25315912 [0,0,0,0,0,1|2,0,1]=4 2599 B11R1.91 OC(=O)C#Cc1c[n]ccc1 Amb20673066 [0,0,0,0,0,1|1,0,1]=3 2600 B11R1.91 OC(=O)C#Cc1cc[n][n]c1 Amb25228310 [0,0,0,0,0,1|2,0,1]=4 2601 B11R1.91 OC(=O)C#Cc1cc[n]cc1 Amb20673077 [0,0,0,0,0,1|1,0,1]=3 2602 B11R1.91 OC(=O)C#Cc1ccccn1 Amb16233314 [0,0,0,0,0,1|1,0,1]=3 2603 B11R1.91 OC(=O)C=Cc1c[n]cc[n]1 Amb24082749 [0,0,0,0,0,1|2,0,1]=4 2604 B11R1.91 OC(=O)CCc1[n][n]cc[n]1 Amb18201164 [0,0,0,0,0,1|3,0,0]=4 2605 B11R1.91 OC(=O)CCc1[n]c[n]c[n]1 Amb18862491 [0,0,0,0,0,1|3,0,0]=4 2606 B11R1.91 OC(=O)CCc1c[n][n]c[n]1 Amb18201165 [0,0,0,0,0,1|3,0,0]=4 2607 B11R1.91 OC(=O)CCc1c[n]c[n]c1 Amb18201449 [0,0,0,0,0,1|2,0,0]=3 2608 B11R1.91 OC(=O)CCc1cc[n][n]c1 Amb22499259 [0,0,0,0,0,1|2,0,0]=3 2609 B11R1.91 OC(=O)CCc1ccc[n][n]1 Amb23592184 [0,0,0,0,0,1|2,0,0]=3 2610 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [0,0,0,0,0,1|0,0,0]=1 2611 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [0,0,0,0,0,1|1,0,0]=2 2612 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [0,0,0,0,0,1|1,0,0]=2 2613 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [0,0,0,0,0,1|1,0,0]=2 2614 B11R1.91 OC(=O)CNC=1CC=CCC1 Amb21929324 [0,0,0,0,0,1|0,0,2]=3 2615 B11R1.91 OC(=O)CNc1c[n]c[n]c1 Amb18933571 [0,0,0,0,0,1|2,0,0]=3 2616 B11R1.91 OC(=O)CNc1cc[n]c[n]1 Amb18973871 [0,0,0,0,0,1|2,0,0]=3 2617 B11R1.91 OC(=O)CNc1cc[n]cc1 Amb21955325 [0,0,0,0,0,1|1,0,0]=2 2618 B11R1.91 OC(=O)CNc1ccc[n]c1 Amb22035240 [0,0,0,0,0,1|1,0,0]=2 2619 B11R1.91 OC(=O)CNc1cccc[nH+]1 Amb10564534 [0,0,0,0,0,1|1,0,0]=2 2620 B11R1.91 OC(=O)CNc1cccc[n]1 Amb22495404 [0,0,0,0,0,1|1,0,0]=2 2621 B11R1.91 OC(=O)CNc1cccnc1 Amb17593781 [0,0,0,0,0,1|1,0,0]=2 2622 B11R1.91 OC(=O)CNc1ncccn1 Amb2372087 [0,0,0,0,0,1|2,0,0]=3 2623 B11R1.91 OC(=O)COc1c[n]ccc1 Amb22738612 [0,0,0,0,0,1|1,0,0]=2 2624 B11R1.91 OC(=O)COc1cc[n]cc1 Amb18125520 [0,0,0,0,0,1|1,0,0]=2 2625 B11R1.91 OC(=O)COc1ccc[nH+]c1 Amb22370885 [0,0,0,0,0,1|1,0,0]=2 2626 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [0,0,0,0,0,1|0,0,0]=1 2627 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [0,0,0,0,0,1|0,0,0]=1 2628 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [0,0,0,0,0,1|0,0,0]=1 2629 B11R1.91 OC(=O)CSc1[n][n]cc[n]1 Amb24433355 [0,0,0,0,0,1|3,0,0]=4 2630 B11R1.91 OC(=O)CSc1cc[n][n]c1 Amb24670204 [0,0,0,0,0,1|2,0,0]=3 2631 B11R1.91 OC(=O)CSc1cc[n]cc1 Amb24053001 [0,0,0,0,0,1|1,0,0]=2 2632 B11R1.91 OC(=O)CSc1ccc[n]c1 Amb24692785 [0,0,0,0,0,1|1,0,0]=2 2633 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [0,0,0,0,0,1|0,0,0]=1 2634 B11R1.91 OC(=O)CSc1ccccn1 Amb1130490 [0,0,0,0,0,1|1,0,0]=2 2635 B11R1.91 OC(=O)CSc1ncccn1 Amb1625763 [0,0,0,0,0,1|2,0,0]=3 2636 B11R1.91 OC(=O)C\C=C/1\CCCC=C1 Amb25216929 [0,0,0,0,0,1|0,0,3]=4 2637 B11R1.91 OC(=O)C\C=C\1/CCCC=C1 Amb24398614 [0,0,0,0,0,1|0,0,3]=4 2638 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [0,0,0,0,0,1|0,0,0]=1 2639 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [0,0,0,0,0,1|0,0,0]=1 2640 B11R1.91 OC(=O)\C=C/c1[n]ccc[n]1 Amb25830337 [0,0,0,0,0,1|2,0,1]=4 2641 B11R1.91 OC(=O)\C=C/c1cc[n]cc1 Amb20622011 [0,0,0,0,0,1|1,0,1]=3 2642 B11R1.91 OC(=O)\C=C/c1ccc[n]c1 Amb25378742 [0,0,0,0,0,1|1,0,1]=3 2643 B11R1.91 OC(=O)\C=C/c1ccccn1 Amb10071558 [0,0,0,0,0,1|1,0,1]=3 2644 B11R1.91 OC(=O)\C=C\N1CC=CC=C1 Amb22015329 [0,0,0,0,0,1|1,0,2]=4 2645 B11R1.91 OC(=O)\C=C\c1cc[n][n]c1 Amb18125071 [0,0,0,0,0,1|2,0,1]=4 2646 B11R1.91 OC(=O)\C=C\c1cc[n]c[n]1 Amb25337419 [0,0,0,0,0,1|2,0,1]=4 2647 B11R1.91 OC(=O)\C=C\c1ccc[n][n]1 Amb18125070 [0,0,0,0,0,1|2,0,1]=4 2648 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [0,0,0,0,0,1|0,0,1]=2 2649 B11R1.91 OC(=O)\C=C\c1ccncc1 Amb1107607 [0,0,0,0,0,1|1,0,1]=3 2650 B11R1.91 OC(=O)\C=C\c1cnccn1 Amb10609139 [0,0,0,0,0,1|2,0,1]=4 2651 B11R1.91 OC(=O)\C=C\c1ncccn1 Amb17593721 [0,0,0,0,0,1|2,0,1]=4 2652 B11R1.91 OC(=O)\C=N/c1cc[n]cc1 Amb24068310 [0,0,0,0,0,1|1,0,1]=3 2653 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [0,0,0,0,0,1|0,0,1]=2 2654 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [0,0,0,0,0,1|0,0,2]=3 2655 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [0,0,0,0,0,1|2,0,0]=3 2656 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [0,0,0,0,0,1|1,0,0]=2 2657 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [0,0,0,0,0,1|0,0,0]=1 2658 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [0,0,0,0,0,1|0,2,0]=3 2659 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [0,0,0,0,0,1|0,2,0]=3 2660 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [0,0,0,0,0,1|0,2,0]=3 2661 B11R1.91 [O-]C(=O)C#Cc1ccccc1 Amb22753901 [0,0,0,0,0,1|0,0,2]=3 2662 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [0,0,0,0,0,1|0,0,1]=2 2663 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [0,0,0,0,0,1|0,0,1]=2 2664 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [0,0,0,0,0,1|0,0,1]=2 2665 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [0,0,0,0,0,1|0,0,1]=2 2666 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb1814995 [0,0,0,0,0,1|0,0,2]=3 2667 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb22360910 [0,0,0,0,0,1|0,0,2]=3 2668 B11R1.91 [O-]P(=O)OCc1ccccc1 Amb22461723 [0,0,0,0,0,1|1,0,1]=3 2669 B11R1.91 [O-]S(=O)NCc1ccccc1 Amb22641608 [0,0,0,0,0,1|1,0,1]=3 2670 B11R1.91 [O-][N+](=O)C#Cc1ccccc1 Amb24068842 [0,0,0,0,0,1|1,0,2]=4 2671 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [0,0,0,0,0,1|1,0,1]=3 2672 B11R1.91 [O-][N+](=O)CCc1ccccn1 Amb17399924 [0,0,0,0,0,1|2,0,1]=4 2673 B11R1.91 [O-][N+](=O)CCc1cccnc1 Amb17399925 [0,0,0,0,0,1|2,0,1]=4 2674 B11R1.91 [O-][N+](=O)CCc1ccncc1 Amb17399926 [0,0,0,0,0,1|2,0,1]=4 2675 B11R1.91 [O-][N+](=O)CSc1cccc[n]1 Amb25802409 [0,0,0,0,0,1|2,0,1]=4 2676 B11R1.91 [O-][N+](=O)CSc1ccccc1 Amb25689622 [0,0,0,0,0,1|1,0,1]=3 2677 B11R1.91 [O-][N+](=O)NNc1ccccc1 Amb21953657 [0,0,0,0,0,1|2,0,1]=4 2678 B11R1.91 [O-][N+](=O)O[Hg]c1ccccc1 Amb22732287 [0,0,0,0,0,1|2,0,1]=4 2679 B11R1.91 [S-]C(=S)NCc1ccc[n]c1 Amb25690403 [0,0,0,0,0,1|1,2,0]=4 2680 B11R1.91 [S-]C(=S)NNc1ccccc1 Amb10552747 [0,0,0,0,0,1|1,2,0]=4 2681 B11R1.91 [S-]C(=S)NNc1ccccc1 Amb22486868 [0,0,0,0,0,1|1,2,0]=4 2682 B11R1.742 CC(=O)C=C1C=CC=CC=C1 Amb24706699 [0,0,0,0,0,1|1,0,1]=3 2683 B11R1.742 CC(=O)CC=1C=CC=CCC1 Amb24378360 [0,0,0,0,0,1|1,0,0]=2 2684 B11R1.742 CC(=O)CC=1CC=CC=CC1 Amb25371758 [0,0,0,0,0,1|1,0,0]=2 2685 B11R1.742 CC(=O)NC1C=CC=CC=C1 Amb25703260 [0,0,0,0,0,1|2,0,1]=4 2686 B11R1.742 CC(O)CC1C=CC=CC=C1 Amb25120138 [0,0,0,0,0,1|1,0,2]=4 2687 B11R1.742 NC(=O)CC1C=CC=CC=C1 Amb24432478 [0,0,0,0,0,1|1,0,1]=3 2688 B11R1.742 NC(=O)NC=1C=CCC=CC1 Amb24693859 [0,0,0,0,0,1|2,0,0]=3 2689 B11R1.742 OC(=O)CC1C=CC=CC=C1 Amb24487914 [0,0,0,0,0,1|0,0,1]=2 2690 B11R1.742 OC(=O)CC1CCC=CC=C1 Amb25362183 [0,0,0,0,0,1|0,0,2]=3 2691 B11R1.742 OC(=O)C[C@@H]1CCC=CC=C1 Amb25102501 [0,0,0,0,0,1|0,0,2]=3 2692 B8R0.4 C=C=C\C=C\CCC=O Amb25725906 [1,0,1,0,0,0|0,0,2]=4 2693 B8R0.4 C=CC\C=C\C=C/C=O Amb18642058 [1,0,1,0,0,0|0,0,2]=4 2694 B8R0.4 C=CC\C=C\C=CC=O Amb25259279 [1,0,1,0,0,0|0,0,2]=4 2695 B8R0.4 C=CC\C=C\C=C\C=O Amb25772895 [1,0,1,0,0,0|0,0,2]=4 2696 B8R0.4 C=CC\C=C\CCC=O Amb18642218 [1,0,1,0,0,0|0,0,2]=4 2697 B8R0.4 C=C\C=C\CCCC=O Amb18642211 [1,0,1,0,0,0|0,0,2]=4 2698 B8R0.4 CC=CC=CC=CC=O Amb24632185 [1,0,1,0,0,0|0,0,2]=4 2699 B8R0.4 CCC\C=C\C=C\C=C Amb22641675 [1,0,1,0,0,0|1,0,1]=4 2700 B8R0.4 C\C=C/C=C/CCC=O Amb25770156 [1,0,1,0,0,0|0,0,2]=4 2701 B8R0.4 C\C=C\C=C\C=C\C=O Amb17593248 [1,0,1,0,0,0|0,0,2]=4 2702 B8R0.4 C\C=C\C=C\CCC=O Amb25363492 [1,0,1,0,0,0|0,0,2]=4 2703 B8R0.4 NC=CC=CC=CC=O Amb24477820 [1,0,1,0,0,0|1,0,1]=4 2704 B8R0.4 O=CC=CC=CC=CBr Amb25237493 [1,0,1,0,0,0|1,0,1]=4 2705 B8R0.4 O=CCCC=C\C=C\Cl Amb25173006 [1,0,1,0,0,0|1,0,1]=4 2706 B8R0.4 O=CCC\C=C/C=C/Cl Amb24480011 [1,0,1,0,0,0|1,0,1]=4 2707 B8R0.4 O=C\C=C/C=C\CC=O Amb24496324 [1,0,1,0,0,0|1,0,0]=3 2708 B8R0.4 O=C\C=C\C=C\C=C\Cl Amb25706814 [1,0,1,0,0,0|1,0,1]=4 2709 B8R0.4 [O-]\C=C\C=C\C=C\C=O Amb24639146 [1,0,1,0,0,0|1,0,1]=4 2710 B8R0.7 C=CCC\C=C\C(O)=O Amb25756053 [1,0,1,0,0,0|0,0,2]=4 2711 B8R0.7 C=CCO\C=C\C(O)=O Amb24471908 [1,0,1,0,0,0|1,0,1]=4 2712 B8R0.7 C=CC\C=C\CC(O)=O Amb18642408 [1,0,1,0,0,0|0,0,1]=3 2713 B8R0.7 C=C\C=C\C=C\C(O)=O Amb25785031 [1,0,1,0,0,0|0,0,0]=2 2714 B8R0.7 C=C\C=C\CCC(N)=O Amb24531499 [1,0,1,0,0,0|1,0,1]=4 2715 B8R0.7 CC(=O)CC\C=C/C=C Amb24736163 [1,0,1,0,0,0|1,0,1]=4 2716 B8R0.7 CC(=O)CC\C=C\C=C Amb24686743 [1,0,1,0,0,0|1,0,1]=4 2717 B8R0.7 CC(=O)C\C=C/CC=C Amb24584479 [1,0,1,0,0,0|1,0,1]=4 2718 B8R0.7 CC(=O)\C=C/C=C\C=O Amb25239361 [1,0,1,0,0,0|2,0,0]=4 2719 B8R0.7 CC(=O)\C=C\C=C/C=C Amb25723853 [1,0,1,0,0,0|1,0,0]=3 2720 B8R0.7 CC(=O)\C=C\C=CC=C Amb24634570 [1,0,1,0,0,0|1,0,0]=3 2721 B8R0.7 CC(=O)\C=C\C=C\C=C Amb25707424 [1,0,1,0,0,0|1,0,0]=3 2722 B8R0.7 CC(=O)\C=C\C=C\C=O Amb18642168 [1,0,1,0,0,0|2,0,0]=4 2723 B8R0.7 CC\C=C\C=CC(O)=O Amb24552622 [1,0,1,0,0,0|0,0,2]=4 2724 B8R0.7 CC\C=C\C=C\C(O)=O Amb18642407 [1,0,1,0,0,0|0,0,2]=4 2725 B8R0.7 CO\C=C\C=C/C(O)=O Amb25856553 [1,0,1,0,0,0|1,0,1]=4 2726 B8R0.7 C\C=C\C=C/CC(C)=O Amb25837209 [1,0,1,0,0,0|1,0,1]=4 2727 B8R0.7 C\C=C\C\C=C\C(O)=O Amb24688696 [1,0,1,0,0,0|0,0,2]=4 2728 B8R0.7 N#C\C=C/C=C\C(O)=O Amb18642088 [1,0,1,0,0,0|1,0,1]=4 2729 B8R0.7 NC\C=C\C=CC(O)=O Amb24682694 [1,0,1,0,0,0|1,0,1]=4 2730 B8R0.7 NC\C=C\C=C\C(O)=O Amb25146005 [1,0,1,0,0,0|1,0,1]=4 2731 B8R0.7 OC(=O)CC\C=C\C=C Amb10605294 [1,0,1,0,0,0|0,0,1]=3 2732 B8R0.7 OC(=O)CN\C=C\C=O Amb25223016 [1,0,1,0,0,0|2,0,0]=4 2733 B8R0.7 OC(=O)CS\C=C\C=O Amb25230965 [1,0,1,0,0,0|2,0,0]=4 2734 B8R0.7 OC(=O)C\C=C/CC=O Amb25050861 [1,0,1,0,0,0|1,0,1]=4 2735 B8R0.7 OC(=O)\C=C\C=CCBr Amb25746310 [1,0,1,0,0,0|1,0,1]=4 2736 B8R0.7 OC(=O)\C=C\C=C\C=O Amb18642364 [1,0,1,0,0,0|1,0,0]=3 2737 B8R0.7 OC\C=C\C=C\C(O)=O Amb18642572 [1,0,1,0,0,0|1,0,1]=4 2738 B8R0.1 CC(CC=O)=C\C=C\Br Amb24480026 [1,0,1,0,0,0|1,0,1]=4 2739 B8R0.1 CC(CC=O)\C=C/C=C Amb25074501 [1,0,1,0,0,0|0,0,2]=4 2740 B8R0.1 CC(CC=O)\C=C\C=C Amb24656025 [1,0,1,0,0,0|0,0,2]=4 2741 B8R0.1 C\C(=C/C=O)\C=C\C=C Amb24677104 [1,0,1,0,0,0|0,0,2]=4 2742 B8R0.1 C\C(\CC=O)=C\C=CBr Amb24595758 [1,0,1,0,0,0|1,0,1]=4 2743 B8R0.5 C=C(CC=C)CC(O)=O Amb25261334 [1,0,1,0,0,0|0,0,1]=3 2744 B8R0.16 C=CC(CC(O)=O)C=C Amb18642422 [1,0,1,0,0,0|0,0,1]=3 2745 B8R0.16 CC(=O)CC(C=C)C=C Amb25371536 [1,0,1,0,0,0|1,0,1]=4 2746 B8R0.22 CC=C(CC=O)\C=C\C Amb25179849 [1,0,1,0,0,0|0,0,2]=4 2747 B8R0.22 C\C=C(\CC=O)/C=C/C Amb25785625 [1,0,1,0,0,0|0,0,2]=4 2748 B8R0.22 C\C=C/C(CC=O)=C=C Amb25053038 [1,0,1,0,0,0|0,0,2]=4 2749 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [2,0,0,0,0,0|1,0,0]=3 2750 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [2,0,0,0,0,0|1,0,0]=3 2751 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [2,0,0,0,0,0|2,0,0]=4 2752 B8R1.2 BrCc1cccc[n]1 Amb22751621 [2,0,0,0,0,0|2,0,0]=4 2753 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [2,0,0,0,0,0|1,0,0]=3 2754 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [2,0,0,0,0,0|2,0,0]=4 2755 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [2,0,0,0,0,0|0,0,2]=4 2756 B8R1.2 C=C[n+]1ccccc1 Amb10552726 [2,0,0,0,0,0|1,0,1]=4 2757 B8R1.2 C=C[n+]1ccccc1 Amb10552768 [2,0,0,0,0,0|1,0,1]=4 2758 B8R1.2 C=C[n+]1ccccc1 Amb10552769 [2,0,0,0,0,0|1,0,1]=4 2759 B8R1.2 C=C[n+]1ccccc1 Amb10552775 [2,0,0,0,0,0|1,0,1]=4 2760 B8R1.2 C=Cc1ccccc1 Amb22337033 [2,0,0,0,0,0|0,0,1]=3 2761 B8R1.2 C=Cc1ccccc1 Amb22337871 [2,0,0,0,0,0|0,0,1]=3 2762 B8R1.2 C=Cc1ccccc1 Amb22337937 [2,0,0,0,0,0|0,0,1]=3 2763 B8R1.2 C=Cc1ccccc1 Amb22338204 [2,0,0,0,0,0|0,0,1]=3 2764 B8R1.2 C=Cc1ccccc1 Amb22338475 [2,0,0,0,0,0|0,0,1]=3 2765 B8R1.2 C=Cc1ccccc1 Amb22351316 [2,0,0,0,0,0|0,0,1]=3 2766 B8R1.2 C=Cc1ccccc1 Amb22731028 [2,0,0,0,0,0|0,0,1]=3 2767 B8R1.2 C=Cc1ccccc1 Amb22733123 [2,0,0,0,0,0|0,0,1]=3 2768 B8R1.2 C=Cc1cccnc1 Amb10071930 [2,0,0,0,0,0|1,0,1]=4 2769 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|1,0,0]=3 2770 B8R1.2 CC[n+]1ccccc1 Amb22739693 [2,0,0,0,0,0|1,0,1]=4 2771 B8R1.2 CCc1ccccc1 Amb22336270 [2,0,0,0,0,0|0,0,1]=3 2772 B8R1.2 CCc1ccccc1 Amb22366965 [2,0,0,0,0,0|0,0,1]=3 2773 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,1]=3 2774 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [2,0,0,0,0,0|1,0,1]=4 2775 B8R1.2 CO[13c]1ccccc1 Amb22362658 [2,0,0,0,0,0|1,0,1]=4 2776 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|1,0,1]=4 2777 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [2,0,0,0,0,0|0,0,1]=3 2778 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [2,0,0,0,0,0|0,1,1]=4 2779 B8R1.2 ClC=C1C=COC=C1 Amb24470181 [2,0,0,0,0,0|2,0,0]=4 2780 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [2,0,0,0,0,0|1,0,0]=3 2781 B8R1.2 ClCc1cccc[n]1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 2782 B8R1.2 ClCc1ccccc1 Amb22363332 [2,0,0,0,0,0|1,0,0]=3 2783 B8R1.2 ClCc1ccncc1 Amb1933717 [2,0,0,0,0,0|2,0,0]=4 2784 B8R1.2 ClSc1ccccc1 Amb10575597 [2,0,0,0,0,0|2,0,0]=4 2785 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [2,0,0,0,0,0|1,0,0]=3 2786 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 2787 B8R1.2 FCc1c[n]ccc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 2788 B8R1.2 FCc1cc[n]cc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 2789 B8R1.2 FCc1cccc[n]1 Amb24093657 [2,0,0,0,0,0|2,0,0]=4 2790 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 2791 B8R1.2 FSc1ccccc1 Amb25198589 [2,0,0,0,0,0|2,0,0]=4 2792 B8R1.2 ICc1cc[n]cc1 Amb22489735 [2,0,0,0,0,0|2,0,0]=4 2793 B8R1.2 ICc1cc[n]cc1 Amb22748952 [2,0,0,0,0,0|2,0,0]=4 2794 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 2795 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [2,0,0,0,0,0|2,0,0]=4 2796 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [2,0,0,0,0,0|2,0,0]=4 2797 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|2,0,0]=4 2798 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|1,0,1]=4 2799 B8R1.2 N#Cc1ccccc1 Amb22167299 [2,0,0,0,0,0|1,0,1]=4 2800 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|2,0,0]=4 2801 B8R1.2 N=Cc1c[n]ccc1 Amb24062509 [2,0,0,0,0,0|2,0,0]=4 2802 B8R1.2 N=Cc1cccc[n]1 Amb24081259 [2,0,0,0,0,0|2,0,0]=4 2803 B8R1.2 NC[n+]1ccccc1 Amb24716810 [2,0,0,0,0,0|2,0,0]=4 2804 B8R1.2 NCc1cc[n]cc1 Amb20620293 [2,0,0,0,0,0|2,0,0]=4 2805 B8R1.2 NCc1cc[n]cc1 Amb20622010 [2,0,0,0,0,0|2,0,0]=4 2806 B8R1.2 NCc1cccc[n]1 Amb20620292 [2,0,0,0,0,0|2,0,0]=4 2807 B8R1.2 NCc1cccc[n]1 Amb22274458 [2,0,0,0,0,0|2,0,0]=4 2808 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,0]=3 2809 B8R1.2 NCc1ccccc1 Amb22052549 [2,0,0,0,0,0|1,0,0]=3 2810 B8R1.2 NCc1ccccc1 Amb23459863 [2,0,0,0,0,0|1,0,0]=3 2811 B8R1.2 NCc1ccccc1 Amb24325406 [2,0,0,0,0,0|1,0,0]=3 2812 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|2,0,0]=4 2813 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|2,0,0]=4 2814 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|2,0,0]=4 2815 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|2,0,0]=4 2816 B8R1.2 NNc1ccccc1 Amb22166856 [2,0,0,0,0,0|2,0,0]=4 2817 B8R1.2 NNc1ccccc1 Amb22731573 [2,0,0,0,0,0|2,0,0]=4 2818 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|2,0,0]=4 2819 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|2,0,0]=4 2820 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|1,0,0]=3 2821 B8R1.2 O=CC1=CCNC=C1 Amb24598254 [2,0,0,0,0,0|1,0,1]=4 2822 B8R1.2 O=CC1C=CC=CO1 Amb25053141 [2,0,0,0,0,0|1,0,1]=4 2823 B8R1.2 O=CC1C=COC=C1 Amb18641607 [2,0,0,0,0,0|1,0,1]=4 2824 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [2,0,0,0,0,0|0,0,0]=2 2825 B8R1.2 O=Cc1cc[n]cc1 Amb20672039 [2,0,0,0,0,0|1,0,0]=3 2826 B8R1.2 O=Cc1cncnc1 Amb2235993 [2,0,0,0,0,0|2,0,0]=4 2827 B8R1.2 O=S=C1C=CC=CN1 Amb25679690 [2,0,0,0,0,0|2,0,0]=4 2828 B8R1.2 O=S=C1C=CNC=C1 Amb24606190 [2,0,0,0,0,0|2,0,0]=4 2829 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [2,0,0,0,0,0|0,0,0]=2 2830 B8R1.2 O=[I]c1ccccc1 Amb15692855 [2,0,0,0,0,0|1,0,0]=3 2831 B8R1.2 OCC1=CCNC=C1 Amb25662609 [2,0,0,0,0,0|1,0,1]=4 2832 B8R1.2 OCN1C=CNC=C1 Amb17938355 [2,0,0,0,0,0|2,0,0]=4 2833 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [2,0,0,0,0,0|0,0,0]=2 2834 B8R1.2 OCc1c[n][n]cc1 Amb21856410 [2,0,0,0,0,0|2,0,0]=4 2835 B8R1.2 OCc1c[n]ccc1 Amb20622013 [2,0,0,0,0,0|1,0,0]=3 2836 B8R1.2 OCc1c[n]ccc1 Amb22434305 [2,0,0,0,0,0|1,0,0]=3 2837 B8R1.2 OCc1cc[n]cc1 Amb24183964 [2,0,0,0,0,0|1,0,0]=3 2838 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|1,0,0]=3 2839 B8R1.2 OCc1ccncc1 Amb16231990 [2,0,0,0,0,0|1,0,0]=3 2840 B8R1.2 ONc1cccc[n]1 Amb25057797 [2,0,0,0,0,0|2,0,0]=4 2841 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,0]=3 2842 B8R1.2 ONc1ccccc1 Amb22445293 [2,0,0,0,0,0|1,0,0]=3 2843 B8R1.2 OSc1cccc[n]1 Amb24061294 [2,0,0,0,0,0|2,0,0]=4 2844 B8R1.2 OSc1ccccc1 Amb25200260 [2,0,0,0,0,0|1,0,0]=3 2845 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [2,0,0,0,0,0|0,0,0]=2 2846 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [2,0,0,0,0,0|0,0,0]=2 2847 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [2,0,0,0,0,0|1,0,0]=3 2848 B8R1.2 SCc1c[n]ccc1 Amb21984718 [2,0,0,0,0,0|1,1,0]=4 2849 B8R1.2 SCc1cc[n]cc1 Amb22008603 [2,0,0,0,0,0|1,1,0]=4 2850 B8R1.2 SCc1cccc[n]1 Amb20622005 [2,0,0,0,0,0|1,1,0]=4 2851 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [2,0,0,0,0,0|0,0,1]=3 2852 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [2,0,0,0,0,0|1,0,0]=3 2853 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [2,0,0,0,0,0|0,0,2]=4 2854 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [2,0,0,0,0,0|0,0,2]=4 2855 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [2,0,0,0,0,0|0,0,2]=4 2856 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|1,0,1]=4 2857 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [2,0,0,0,0,0|2,0,0]=4 2858 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 2859 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [2,0,0,0,0,0|1,0,0]=3 2860 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [2,0,0,0,0,0|2,0,0]=4 2861 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [2,0,0,0,0,0|2,0,0]=4 2862 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [2,0,0,0,0,0|0,0,1]=3 2863 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 2864 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [2,0,0,0,0,0|2,0,0]=4 2865 B10R0.3 CC(=O)C\C=C\C(C)=CC=O Amb24766816 [0,1,1,0,0,0|2,0,0]=4 2866 B10R0.3 CC(=O)C\C=C\C(\C)=C\C=O Amb24765090 [0,1,1,0,0,0|2,0,0]=4 2867 B10R0.3 C\C(\C=CCC(O)=O)=C\CC Amb25386395 [0,1,1,0,0,0|0,0,2]=4 2868 B10R0.4 C=C\C=C\C=C\C=C\C(O)=O Amb25386381 [0,1,1,0,0,0|0,0,1]=3 2869 B10R0.4 CC(=O)\C=C\C=C\C=C\C=O Amb25384480 [0,1,1,0,0,0|1,0,1]=4 2870 B10R0.6 C\C=C\C=CC(N)CC(O)=O Amb25384147 [0,1,1,0,0,0|0,0,2]=4 2871 B10R0.6 C\C=C\C=CC(O)CC(O)=O Amb25384176 [0,1,1,0,0,0|0,0,2]=4 2872 B10R0.6 C\C=C\C=C\C(O)CC(O)=O Amb22831940 [0,1,1,0,0,0|0,0,2]=4 2873 B10R0.75 C\C(=C/C=C/C=C/C)\C(O)=O Amb24373133 [0,1,1,0,0,0|0,0,2]=4 2874 B10R0.78 C\C(\C\C=C\C)=C\CC(O)=O Amb18125753 [0,1,1,0,0,0|0,0,2]=4 2875 B10R0.96 C\C(\CC(O)=O)=C\CC(C)=C Amb25386397 [0,1,1,0,0,0|0,0,2]=4 2876 B10R0.23 CC(=C)C(CC(O)=O)\C=C\C Amb25385171 [0,1,1,0,0,0|0,0,2]=4 2877 B10R1.1 BrC=Cc1ccc(cc1)Cl Amb17609952 [1,1,0,0,0,0|1,0,1]=4 2878 B10R1.1 BrCCc1ccc(I)cc1 Amb25266376 [1,1,0,0,0,0|1,0,1]=4 2879 B10R1.1 BrCCc1ccc(cc1)N Amb17595296 [1,1,0,0,0,0|1,0,1]=4 2880 B10R1.1 Br[Zn]Cc1ccc(I)cc1 Amb22000470 [1,1,0,0,0,0|2,0,0]=4 2881 B10R1.1 Br\C=C\c1ccc(cc1)Br Amb17609929 [1,1,0,0,0,0|1,0,1]=4 2882 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,1]=4 2883 B10R1.1 Brc1ccc(C[Mg]Br)cc1 Amb22000536 [1,1,0,0,0,0|2,0,0]=4 2884 B10R1.1 Brc1ccc(C[Zn]Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 2885 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|1,0,1]=4 2886 B10R1.1 C=CCC1C=CC(=O)C=C1 Amb25718380 [1,1,0,0,0,0|1,0,1]=4 2887 B10R1.1 C=CC[n+]1ccc(N)cc1 Amb24486611 [1,1,0,0,0,0|2,0,0]=4 2888 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|1,0,0]=3 2889 B10R1.1 C=COc1ccc(Br)cc1 Amb24366552 [1,1,0,0,0,0|2,0,0]=4 2890 B10R1.1 C=COc1ccc(I)cc1 Amb24753381 [1,1,0,0,0,0|2,0,0]=4 2891 B10R1.1 C=COc1ccc(O)cc1 Amb25134046 [1,1,0,0,0,0|2,0,0]=4 2892 B10R1.1 C=CSc1ccc(N)cc1 Amb18125327 [1,1,0,0,0,0|2,0,0]=4 2893 B10R1.1 CCCc1ccc(cc1)F Amb10845722 [1,1,0,0,0,0|1,0,1]=4 2894 B10R1.1 CN1C=CC(=CC=O)C=C1 Amb25075626 [1,1,0,0,0,0|1,0,1]=4 2895 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|2,0,0]=4 2896 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|2,0,0]=4 2897 B10R1.1 CNCc1ccc(I)cc1 Amb23569028 [1,1,0,0,0,0|2,0,0]=4 2898 B10R1.1 CNCc1ccc(cc1)Br Amb1209641 [1,1,0,0,0,0|2,0,0]=4 2899 B10R1.1 CNCc1ccc(cc1)C Amb1241142 [1,1,0,0,0,0|2,0,0]=4 2900 B10R1.1 CNCc1ccc(cc1)Cl Amb1648458 [1,1,0,0,0,0|2,0,0]=4 2901 B10R1.1 CNCc1ccc(cc1)F Amb1105922 [1,1,0,0,0,0|2,0,0]=4 2902 B10R1.1 CNCc1ccc(cc1)O Amb1116278 [1,1,0,0,0,0|2,0,0]=4 2903 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|2,0,0]=4 2904 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|2,0,0]=4 2905 B10R1.1 COCc1ccc(F)cc1 Amb24064703 [1,1,0,0,0,0|2,0,0]=4 2906 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|2,0,0]=4 2907 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|2,0,0]=4 2908 B10R1.1 COCc1ccc(cc1)N Amb1137167 [1,1,0,0,0,0|2,0,0]=4 2909 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|2,0,0]=4 2910 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|2,0,0]=4 2911 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|2,0,0]=4 2912 B10R1.1 CSCc1ccc(O)cc1 Amb18644673 [1,1,0,0,0,0|2,0,0]=4 2913 B10R1.1 CSCc1ccc(cc1)C Amb16185125 [1,1,0,0,0,0|2,0,0]=4 2914 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb25698766 [1,1,0,0,0,0|1,0,1]=4 2915 B10R1.1 C\C=C\c1ccc(O)cc1 Amb18124423 [1,1,0,0,0,0|1,0,1]=4 2916 B10R1.1 Cc1ccc(C=C=O)cc1 Amb24100707 [1,1,0,0,0,0|0,0,2]=4 2917 B10R1.1 Cc1ccc(CCC)cc1 Amb22227992 [1,1,0,0,0,0|1,0,1]=4 2918 B10R1.1 Cc1ccc(CCF)cc1 Amb24659769 [1,1,0,0,0,0|1,0,1]=4 2919 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,1]=4 2920 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|1,0,1]=4 2921 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|2,0,0]=4 2922 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|2,0,0]=4 2923 B10R1.1 Cc1ccc(CNO)[n]c1 Amb25145636 [1,1,0,0,0,0|2,0,0]=4 2924 B10R1.1 Cc1ccc(CNO)c[n]1 Amb25305252 [1,1,0,0,0,0|2,0,0]=4 2925 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|1,0,0]=3 2926 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|2,0,0]=4 2927 B10R1.1 Cc1ccc(C[Mg]Cl)cc1 Amb19928780 [1,1,0,0,0,0|2,0,0]=4 2928 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 2929 B10R1.1 Cc1ccc(NC=O)[n]c1 Amb24072528 [1,1,0,0,0,0|2,0,0]=4 2930 B10R1.1 Cc1ccc(OC=C)cc1 Amb17674188 [1,1,0,0,0,0|2,0,0]=4 2931 B10R1.1 Cc1ccc(\C=C\Cl)cc1 Amb24652500 [1,1,0,0,0,0|1,0,1]=4 2932 B10R1.1 Cc1ccc(cc1)C[N+]#[C-] Amb1981066 [1,1,0,0,0,0|2,0,0]=4 2933 B10R1.1 Cc1ccc(cc1)N=S=O Amb22411290 [1,1,0,0,0,0|2,0,0]=4 2934 B10R1.1 Cc1ccc(cc1)NC=S Amb24427648 [1,1,0,0,0,0|1,1,0]=4 2935 B10R1.1 Cc1ccc(cc1)NCO Amb24745213 [1,1,0,0,0,0|1,0,1]=4 2936 B10R1.1 Cc1ccc(cc1)OC=O Amb25248584 [1,1,0,0,0,0|1,0,0]=3 2937 B10R1.1 Cc1ccc(cc1)SC=C Amb24375563 [1,1,0,0,0,0|2,0,0]=4 2938 B10R1.1 Cl\C=C\c1ccc(cc1)Cl Amb10573154 [1,1,0,0,0,0|1,0,1]=4 2939 B10R1.1 Clc1ccc(CCI)cc1 Amb25363991 [1,1,0,0,0,0|1,0,1]=4 2940 B10R1.1 Clc1ccc(C[Zn]Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 2941 B10R1.1 Clc1ccc(\C=C\Br)cc1 Amb25145661 [1,1,0,0,0,0|1,0,1]=4 2942 B10R1.1 Clc1ccc(cc1)C[N+]#[C-] Amb2235910 [1,1,0,0,0,0|2,0,0]=4 2943 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,1]=4 2944 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 2945 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 2946 B10R1.1 Fc1ccc(\C=C\Br)cc1 Amb24553254 [1,1,0,0,0,0|1,0,1]=4 2947 B10R1.1 Fc1ccc(\C=C\Cl)cc1 Amb24482350 [1,1,0,0,0,0|1,0,1]=4 2948 B10R1.1 Fc1ccc(cc1)C[N+]#[C-] Amb1981065 [1,1,0,0,0,0|2,0,0]=4 2949 B10R1.1 Fc1ccc(cc1)NC=S Amb24703342 [1,1,0,0,0,0|1,1,0]=4 2950 B10R1.1 N#CCc1ccc(S)cc1 Amb24509708 [1,1,0,0,0,0|1,0,1]=4 2951 B10R1.1 N#CCc1ccc(cc1)Br Amb1130758 [1,1,0,0,0,0|1,0,1]=4 2952 B10R1.1 N#CCc1ccc(cc1)Cl Amb1883007 [1,1,0,0,0,0|1,0,1]=4 2953 B10R1.1 N#CCc1ccc(cc1)F Amb1154069 [1,1,0,0,0,0|1,0,1]=4 2954 B10R1.1 N#CCc1ccc(cc1)N Amb1215260 [1,1,0,0,0,0|1,0,1]=4 2955 B10R1.1 N#CCc1ccc(cc1)O Amb1154109 [1,1,0,0,0,0|1,0,1]=4 2956 B10R1.1 N=CNc1ccc(Cl)cc1 Amb25683127 [1,1,0,0,0,0|2,0,0]=4 2957 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|1,0,1]=4 2958 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|1,0,1]=4 2959 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|1,0,1]=4 2960 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|1,0,1]=4 2961 B10R1.1 NCCc1ccc(S)cc1 Amb25700837 [1,1,0,0,0,0|1,0,1]=4 2962 B10R1.1 NCCc1ccc(cc1)Br Amb10808111 [1,1,0,0,0,0|1,0,1]=4 2963 B10R1.1 NCCc1ccc(cc1)C Amb1129454 [1,1,0,0,0,0|1,0,1]=4 2964 B10R1.1 NCCc1ccc(cc1)Cl Amb1212558 [1,1,0,0,0,0|1,0,1]=4 2965 B10R1.1 NCCc1ccc(cc1)F Amb1215262 [1,1,0,0,0,0|1,0,1]=4 2966 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|2,0,0]=4 2967 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|2,0,0]=4 2968 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|2,0,0]=4 2969 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|2,0,0]=4 2970 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|2,0,0]=4 2971 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|2,0,0]=4 2972 B10R1.1 NNCc1ccc(I)cc1 Amb25794991 [1,1,0,0,0,0|2,0,0]=4 2973 B10R1.1 NNCc1ccc(cc1)Br Amb1114984 [1,1,0,0,0,0|2,0,0]=4 2974 B10R1.1 NNCc1ccc(cc1)C Amb1112560 [1,1,0,0,0,0|2,0,0]=4 2975 B10R1.1 NNCc1ccc(cc1)Cl Amb1121233 [1,1,0,0,0,0|2,0,0]=4 2976 B10R1.1 NNCc1ccc(cc1)F Amb10841872 [1,1,0,0,0,0|2,0,0]=4 2977 B10R1.1 NNCc1ccc(cc1)F Amb1112880 [1,1,0,0,0,0|2,0,0]=4 2978 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|2,0,0]=4 2979 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|2,0,0]=4 2980 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|2,0,0]=4 2981 B10R1.1 NOCc1ccc(cc1)C Amb1946246 [1,1,0,0,0,0|2,0,0]=4 2982 B10R1.1 NOCc1ccc(cc1)Cl Amb10607411 [1,1,0,0,0,0|2,0,0]=4 2983 B10R1.1 NOCc1ccc(cc1)F Amb17091427 [1,1,0,0,0,0|2,0,0]=4 2984 B10R1.1 N\C=C\c1ccc(Cl)cc1 Amb24418167 [1,1,0,0,0,0|1,0,1]=4 2985 B10R1.1 Nc1ccc(CC=O)c[n]1 Amb24549097 [1,1,0,0,0,0|1,0,0]=3 2986 B10R1.1 Nc1ccc(CC=O)cc1 Amb22831156 [1,1,0,0,0,0|0,0,0]=2 2987 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,1]=4 2988 B10R1.1 Nc1ccc(CCCl)cc1 Amb18125908 [1,1,0,0,0,0|1,0,1]=4 2989 B10R1.1 Nc1ccc(CCF)cc1 Amb24655949 [1,1,0,0,0,0|1,0,1]=4 2990 B10R1.1 Nc1ccc(CCO)[n]c1 Amb24593512 [1,1,0,0,0,0|1,0,1]=4 2991 B10R1.1 Nc1ccc(CCO)c[n]1 Amb23446333 [1,1,0,0,0,0|1,0,1]=4 2992 B10R1.1 Nc1ccc(CNO)cc1 Amb25835653 [1,1,0,0,0,0|1,0,0]=3 2993 B10R1.1 Nc1ccc(C[PH2]=O)cc1 Amb25118632 [1,1,0,0,0,0|1,0,0]=3 2994 B10R1.1 Nc1ccc(cc1)N=S=O Amb25321782 [1,1,0,0,0,0|2,0,0]=4 2995 B10R1.1 Nc1ccc(cc1)ON=O Amb25147338 [1,1,0,0,0,0|2,0,0]=4 2996 B10R1.1 Nc1ccc(cc1)SC=O Amb25299329 [1,1,0,0,0,0|1,0,0]=3 2997 B10R1.1 O=C=Nc1ccc(S)cc1 Amb24477298 [1,1,0,0,0,0|1,0,1]=4 2998 B10R1.1 O=C=Nc1ccc(cc1)F Amb2092739 [1,1,0,0,0,0|1,0,1]=4 2999 B10R1.1 O=CCN1C=CC(=O)C=C1 Amb25337339 [1,1,0,0,0,0|1,0,0]=3 3000 B10R1.1 O=CCc1[n]cc(Cl)c[n]1 Amb24712674 [1,1,0,0,0,0|2,0,0]=4 3001 B10R1.1 O=CCc1ccc(Br)[n]c1 Amb24068700 [1,1,0,0,0,0|1,0,0]=3 3002 B10R1.1 O=CCc1ccc(I)cc1 Amb24079622 [1,1,0,0,0,0|0,0,0]=2 3003 B10R1.1 O=CCc1ccc(cc1)Br Amb16230450 [1,1,0,0,0,0|0,0,0]=2 3004 B10R1.1 O=CCc1ccc(cc1)Cl Amb10603161 [1,1,0,0,0,0|0,0,0]=2 3005 B10R1.1 O=CCc1ccc(cc1)F Amb16230451 [1,1,0,0,0,0|0,0,0]=2 3006 B10R1.1 O=CNc1ccc(Br)[n]c1 Amb24411713 [1,1,0,0,0,0|2,0,0]=4 3007 B10R1.1 O=CNc1ccc(Cl)[n]c1 Amb24480511 [1,1,0,0,0,0|2,0,0]=4 3008 B10R1.1 O=CNc1ccc(F)cc1 Amb20407399 [1,1,0,0,0,0|1,0,0]=3 3009 B10R1.1 O=CNc1ccc(I)c[n]1 Amb25738355 [1,1,0,0,0,0|2,0,0]=4 3010 B10R1.1 O=CNc1ccc(cc1)N Amb17334152 [1,1,0,0,0,0|1,0,0]=3 3011 B10R1.1 O=CNc1ccc(cc1)O Amb2370690 [1,1,0,0,0,0|1,0,0]=3 3012 B10R1.1 O=COc1ccc(Cl)cc1 Amb24436068 [1,1,0,0,0,0|1,0,0]=3 3013 B10R1.1 O=S=Nc1ccc(Br)cc1 Amb22411348 [1,1,0,0,0,0|2,0,0]=4 3014 B10R1.1 O=S=Nc1ccc(Cl)cc1 Amb22411317 [1,1,0,0,0,0|2,0,0]=4 3015 B10R1.1 OCCN1C=CC(=O)C=C1 Amb18041230 [1,1,0,0,0,0|1,0,1]=4 3016 B10R1.1 OCCN1C=CC(=S)C=C1 Amb25739794 [1,1,0,0,0,0|1,0,1]=4 3017 B10R1.1 OCCc1ccc(Br)[n]c1 Amb23569407 [1,1,0,0,0,0|1,0,1]=4 3018 B10R1.1 OCCc1ccc(Br)c[n]1 Amb21858814 [1,1,0,0,0,0|1,0,1]=4 3019 B10R1.1 OCCc1ccc(Cl)[n]c1 Amb22752853 [1,1,0,0,0,0|1,0,1]=4 3020 B10R1.1 OCCc1ccc(F)[n]c1 Amb25063775 [1,1,0,0,0,0|1,0,1]=4 3021 B10R1.1 OCCc1ccc(F)c[n]1 Amb24426849 [1,1,0,0,0,0|1,0,1]=4 3022 B10R1.1 OCCc1ccc(I)[n]c1 Amb23446988 [1,1,0,0,0,0|1,0,1]=4 3023 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|0,0,1]=3 3024 B10R1.1 OCCc1ccc(S)[n]c1 Amb23446733 [1,1,0,0,0,0|1,0,1]=4 3025 B10R1.1 OCCc1ccc(S)cc1 Amb24379931 [1,1,0,0,0,0|0,0,1]=3 3026 B10R1.1 OCCc1ccc(nc1)C Amb10603991 [1,1,0,0,0,0|1,0,1]=4 3027 B10R1.1 OCNc1ccc(Cl)cc1 Amb24702524 [1,1,0,0,0,0|1,0,1]=4 3028 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|1,0,0]=3 3029 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|1,0,0]=3 3030 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|1,0,0]=3 3031 B10R1.1 ONCc1ccc(I)cc1 Amb24529167 [1,1,0,0,0,0|1,0,0]=3 3032 B10R1.1 O\N=C\c1ccc(cc1)Br Amb1152409 [1,1,0,0,0,0|1,0,1]=4 3033 B10R1.1 O\N=C\c1ccc(cc1)C Amb1152459 [1,1,0,0,0,0|1,0,1]=4 3034 B10R1.1 O\N=C\c1ccc(cc1)Cl Amb1152205 [1,1,0,0,0,0|1,0,1]=4 3035 B10R1.1 O\N=C\c1ccc(cc1)F Amb1152218 [1,1,0,0,0,0|1,0,1]=4 3036 B10R1.1 Oc1ccc(CCCl)cc1 Amb25709371 [1,1,0,0,0,0|1,0,1]=4 3037 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,1]=4 3038 B10R1.1 Oc1ccc(CCI)cc1 Amb24094233 [1,1,0,0,0,0|1,0,1]=4 3039 B10R1.1 Oc1ccc(CCO)c[n]1 Amb23446664 [1,1,0,0,0,0|1,0,1]=4 3040 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|0,1,1]=4 3041 B10R1.1 Oc1ccc(CNO)cc1 Amb23449449 [1,1,0,0,0,0|1,0,0]=3 3042 B10R1.1 Oc1ccc(\C=C/Br)cc1 Amb25830036 [1,1,0,0,0,0|1,0,1]=4 3043 B10R1.1 Oc1ccc(cc1)N=C=O Amb18642975 [1,1,0,0,0,0|1,0,1]=4 3044 B10R1.1 Oc1ccc(cc1)N=S=O Amb24478361 [1,1,0,0,0,0|2,0,0]=4 3045 B10R1.1 Oc1ccc(cc1)OC=O Amb18643207 [1,1,0,0,0,0|1,0,0]=3 3046 B10R1.1 Oc1ccc(cc1)ON=O Amb25729156 [1,1,0,0,0,0|2,0,0]=4 3047 B10R1.1 Oc1ccc(cc1)SCO Amb24631003 [1,1,0,0,0,0|1,0,1]=4 3048 B10R1.1 S=CNc1ccc(Br)cc1 Amb24453374 [1,1,0,0,0,0|1,1,0]=4 3049 B10R1.1 S=CNc1ccc(Cl)cc1 Amb25040558 [1,1,0,0,0,0|1,1,0]=4 3050 B10R1.1 SCCc1ccc(cc1)Br Amb17404679 [1,1,0,0,0,0|0,1,1]=4 3051 B10R1.1 SCCc1ccc(cc1)C Amb16183304 [1,1,0,0,0,0|0,1,1]=4 3052 B10R1.1 SCCc1ccc(cc1)Cl Amb17400376 [1,1,0,0,0,0|0,1,1]=4 3053 B10R1.1 SCCc1ccc(cc1)F Amb17400005 [1,1,0,0,0,0|0,1,1]=4 3054 B10R1.1 Sc1ccc(CCBr)cc1 Amb24428628 [1,1,0,0,0,0|1,0,1]=4 3055 B10R1.1 Sc1ccc(CCCl)cc1 Amb24482361 [1,1,0,0,0,0|1,0,1]=4 3056 B10R1.1 [NH3+]OCc1ccc(cc1)Cl Amb2427236 [1,1,0,0,0,0|2,0,0]=4 3057 B10R1.1 [NH3+]OCc1ccc(cc1)F Amb2420803 [1,1,0,0,0,0|2,0,0]=4 3058 B10R1.1 [O-][n+]1ccc(CCO)cc1 Amb25236037 [1,1,0,0,0,0|1,0,1]=4 3059 B10R1.4 Bc1ccccc1CCN Amb24629754 [1,1,0,0,0,0|1,0,1]=4 3060 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,1]=4 3061 B10R1.4 Br\C=C\c1ccccc1Br Amb17609930 [1,1,0,0,0,0|1,0,1]=4 3062 B10R1.4 Brc1ccccc1CCBr Amb19515770 [1,1,0,0,0,0|1,0,1]=4 3063 B10R1.4 Brc1ccccc1CCI Amb25255595 [1,1,0,0,0,0|1,0,1]=4 3064 B10R1.4 Brc1ccccc1C[Mg]Br Amb22000538 [1,1,0,0,0,0|2,0,0]=4 3065 B10R1.4 Brc1ccccc1C[Zn]Br Amb22000430 [1,1,0,0,0,0|2,0,0]=4 3066 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|1,0,1]=4 3067 B10R1.4 C=CCC1=CC=CNC1=O Amb24479088 [1,1,0,0,0,0|2,0,0]=4 3068 B10R1.4 C=CCC1=COC=CC1=O Amb22749954 [1,1,0,0,0,0|2,0,0]=4 3069 B10R1.4 C=CCN1C=CC=CC1=O Amb22364461 [1,1,0,0,0,0|2,0,0]=4 3070 B10R1.4 C=CCN1C=CC=CC1=O Amb22730630 [1,1,0,0,0,0|2,0,0]=4 3071 B10R1.4 C=CCN1C=CC=CC1=S Amb24365325 [1,1,0,0,0,0|2,0,0]=4 3072 B10R1.4 C=CC[n+]1ccccc1Br Amb25854845 [1,1,0,0,0,0|2,0,0]=4 3073 B10R1.4 C=CC[n+]1ccccc1N Amb1394989 [1,1,0,0,0,0|2,0,0]=4 3074 B10R1.4 C=CCc1[n]cccc1O Amb20248276 [1,1,0,0,0,0|2,0,0]=4 3075 B10R1.4 C=CCc1c[n]ccc1Br Amb25167378 [1,1,0,0,0,0|2,0,0]=4 3076 B10R1.4 C=CCc1cc[n]cc1F Amb24524528 [1,1,0,0,0,0|2,0,0]=4 3077 B10R1.4 C=CCc1cccc[n+]1[O-] Amb24433371 [1,1,0,0,0,0|2,0,0]=4 3078 B10R1.4 C=CCc1ccccc1N Amb18642928 [1,1,0,0,0,0|1,0,0]=3 3079 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|1,0,0]=3 3080 B10R1.4 C=COc1ccccc1Br Amb25095432 [1,1,0,0,0,0|2,0,0]=4 3081 B10R1.4 C=COc1ccccc1N Amb18124449 [1,1,0,0,0,0|2,0,0]=4 3082 B10R1.4 C=COc1ccccc1O Amb18643057 [1,1,0,0,0,0|2,0,0]=4 3083 B10R1.4 C=c1ccccc1=C=C=O Amb24068717 [1,1,0,0,0,0|0,0,2]=4 3084 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|1,0,1]=4 3085 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|2,0,0]=4 3086 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|2,0,0]=4 3087 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|2,0,0]=4 3088 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|2,0,0]=4 3089 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|2,0,0]=4 3090 B10R1.4 CNCc1ccccc1I Amb21861741 [1,1,0,0,0,0|2,0,0]=4 3091 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|2,0,0]=4 3092 B10R1.4 CNCc1ccccc1O Amb19930187 [1,1,0,0,0,0|2,0,0]=4 3093 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|2,0,0]=4 3094 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|2,0,0]=4 3095 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|2,0,0]=4 3096 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|2,0,0]=4 3097 B10R1.4 C[n]1ccccc1=NC=O Amb24072921 [1,1,0,0,0,0|2,0,0]=4 3098 B10R1.4 C\C=C/c1ccccc1O Amb24422361 [1,1,0,0,0,0|1,0,1]=4 3099 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|1,0,1]=4 3100 B10R1.4 C\C=C\c1ccccc1N Amb18642929 [1,1,0,0,0,0|1,0,1]=4 3101 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|2,0,0]=4 3102 B10R1.4 C\C=N\c1ccccc1O Amb25296771 [1,1,0,0,0,0|2,0,0]=4 3103 B10R1.4 Cc1[n]cccc1CCO Amb24061576 [1,1,0,0,0,0|1,0,1]=4 3104 B10R1.4 Cc1[n]cccc1NC=O Amb24072042 [1,1,0,0,0,0|2,0,0]=4 3105 B10R1.4 Cc1c[n]ccc1CC=O Amb25368595 [1,1,0,0,0,0|1,0,0]=3 3106 B10R1.4 Cc1c[n]ccc1NC=O Amb24072215 [1,1,0,0,0,0|2,0,0]=4 3107 B10R1.4 Cc1cc[n]cc1CNO Amb25135601 [1,1,0,0,0,0|2,0,0]=4 3108 B10R1.4 Cc1ccccc1C=NO Amb24084825 [1,1,0,0,0,0|1,0,1]=4 3109 B10R1.4 Cc1ccccc1CCC Amb22227985 [1,1,0,0,0,0|1,0,1]=4 3110 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|1,0,1]=4 3111 B10R1.4 Cc1ccccc1CNN Amb21954057 [1,1,0,0,0,0|2,0,0]=4 3112 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|1,0,0]=3 3113 B10R1.4 Cc1ccccc1CSC Amb24370548 [1,1,0,0,0,0|2,0,0]=4 3114 B10R1.4 Cc1ccccc1C[Mg]Cl Amb22000539 [1,1,0,0,0,0|2,0,0]=4 3115 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 3116 B10R1.4 Cc1ccccc1N=S=O Amb22411326 [1,1,0,0,0,0|2,0,0]=4 3117 B10R1.4 Cc1ccccc1OC=C Amb17674186 [1,1,0,0,0,0|2,0,0]=4 3118 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,1]=4 3119 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,1]=4 3120 B10R1.4 Cl\C=C\c1ccccc1Cl Amb10572874 [1,1,0,0,0,0|1,0,1]=4 3121 B10R1.4 Clc1ccccc1CCI Amb25048390 [1,1,0,0,0,0|1,0,1]=4 3122 B10R1.4 Clc1ccccc1C[Mg]Cl Amb19928783 [1,1,0,0,0,0|2,0,0]=4 3123 B10R1.4 Clc1ccccc1C[Zn]Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 3124 B10R1.4 Clc1ccccc1\C=C\Br Amb24449703 [1,1,0,0,0,0|1,0,1]=4 3125 B10R1.4 FCCc1ccccc1Br Amb24754179 [1,1,0,0,0,0|1,0,1]=4 3126 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,1]=4 3127 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 3128 B10R1.4 Fc1ccccc1\C=C\Br Amb25141256 [1,1,0,0,0,0|1,0,1]=4 3129 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|1,0,1]=4 3130 B10R1.4 N#CCc1ccccc1C Amb1651450 [1,1,0,0,0,0|1,0,1]=4 3131 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|1,0,1]=4 3132 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|1,0,1]=4 3133 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|1,0,1]=4 3134 B10R1.4 N=C1C=CC=CN1CCO Amb18548415 [1,1,0,0,0,0|1,0,1]=4 3135 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|1,0,1]=4 3136 B10R1.4 NCCc1ccccc1C Amb1212557 [1,1,0,0,0,0|1,0,1]=4 3137 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|1,0,1]=4 3138 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|1,0,1]=4 3139 B10R1.4 NCCc1ccccc1O Amb10609215 [1,1,0,0,0,0|1,0,1]=4 3140 B10R1.4 NCCc1ccccc1S Amb25831177 [1,1,0,0,0,0|1,0,1]=4 3141 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|2,0,0]=4 3142 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|2,0,0]=4 3143 B10R1.4 NNCc1ccccc1C Amb1118964 [1,1,0,0,0,0|2,0,0]=4 3144 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|2,0,0]=4 3145 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|2,0,0]=4 3146 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|2,0,0]=4 3147 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|2,0,0]=4 3148 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|2,0,0]=4 3149 B10R1.4 NOCc1ccccc1C Amb17091424 [1,1,0,0,0,0|2,0,0]=4 3150 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|2,0,0]=4 3151 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|2,0,0]=4 3152 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|2,0,0]=4 3153 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|2,0,0]=4 3154 B10R1.4 N\C=N\c1ccccc1O Amb18643068 [1,1,0,0,0,0|2,0,0]=4 3155 B10R1.4 Nc1[n]c[n]cc1CC=O Amb24596788 [1,1,0,0,0,0|2,0,0]=4 3156 B10R1.4 Nc1[n]cccc1CCO Amb21858404 [1,1,0,0,0,0|1,0,1]=4 3157 B10R1.4 Nc1c[n]ccc1CCO Amb25291562 [1,1,0,0,0,0|1,0,1]=4 3158 B10R1.4 Nc1cc[n]cc1CC=O Amb25703380 [1,1,0,0,0,0|1,0,0]=3 3159 B10R1.4 Nc1cc[n]cc1CCO Amb24062498 [1,1,0,0,0,0|1,0,1]=4 3160 B10R1.4 Nc1ccc[n]c1NC=O Amb24072116 [1,1,0,0,0,0|2,0,0]=4 3161 B10R1.4 Nc1ccccc1C=C=O Amb25331219 [1,1,0,0,0,0|0,0,2]=4 3162 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,1]=4 3163 B10R1.4 Nc1ccccc1CCBr Amb24573051 [1,1,0,0,0,0|1,0,1]=4 3164 B10R1.4 Nc1ccccc1CCF Amb24554505 [1,1,0,0,0,0|1,0,1]=4 3165 B10R1.4 Nc1ccccc1CCN Amb20670599 [1,1,0,0,0,0|1,0,1]=4 3166 B10R1.4 Nc1ccccc1CCP Amb25808564 [1,1,0,0,0,0|1,0,1]=4 3167 B10R1.4 Nc1ccccc1CCS Amb25114690 [1,1,0,0,0,0|0,1,1]=4 3168 B10R1.4 Nc1ccccc1CNN Amb25294794 [1,1,0,0,0,0|2,0,0]=4 3169 B10R1.4 Nc1ccccc1CNO Amb25345206 [1,1,0,0,0,0|1,0,0]=3 3170 B10R1.4 Nc1ccccc1N=C=O Amb24477326 [1,1,0,0,0,0|1,0,1]=4 3171 B10R1.4 Nc1ccccc1N=S=O Amb24482342 [1,1,0,0,0,0|2,0,0]=4 3172 B10R1.4 Nc1ccccc1NC=O Amb18643067 [1,1,0,0,0,0|1,0,0]=3 3173 B10R1.4 Nc1ccccc1NC=S Amb24390820 [1,1,0,0,0,0|1,1,0]=4 3174 B10R1.4 Nc1ccccc1\C=C\Br Amb25109193 [1,1,0,0,0,0|1,0,1]=4 3175 B10R1.4 O=CCN1C=CC=CC1=O Amb24059958 [1,1,0,0,0,0|1,0,0]=3 3176 B10R1.4 O=CCN1C=CC=CC1=S Amb24059961 [1,1,0,0,0,0|1,0,0]=3 3177 B10R1.4 O=CCN1C=CC=NC1=O Amb25123496 [1,1,0,0,0,0|2,0,0]=4 3178 B10R1.4 O=CCN1C=NC=CC1=O Amb25205968 [1,1,0,0,0,0|2,0,0]=4 3179 B10R1.4 O=CCc1cc[n]cc1Cl Amb25250526 [1,1,0,0,0,0|1,0,0]=3 3180 B10R1.4 O=CCc1cc[n]cc1F Amb24553979 [1,1,0,0,0,0|1,0,0]=3 3181 B10R1.4 O=CCc1ccc[n]c1Br Amb24746150 [1,1,0,0,0,0|1,0,0]=3 3182 B10R1.4 O=CCc1ccc[n]c1Cl Amb25768390 [1,1,0,0,0,0|1,0,0]=3 3183 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|0,0,0]=2 3184 B10R1.4 O=CCc1ccccc1C Amb10844840 [1,1,0,0,0,0|0,0,0]=2 3185 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|0,0,0]=2 3186 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|0,0,0]=2 3187 B10R1.4 O=CCc1ccccc1I Amb25377055 [1,1,0,0,0,0|0,0,0]=2 3188 B10R1.4 O=CNc1cc[n]cc1F Amb24679615 [1,1,0,0,0,0|2,0,0]=4 3189 B10R1.4 O=CNc1ccccc1F Amb24401130 [1,1,0,0,0,0|1,0,0]=3 3190 B10R1.4 O=COc1ccccc1O Amb17593488 [1,1,0,0,0,0|1,0,0]=3 3191 B10R1.4 O=S=Nc1ccccc1Cl Amb22411311 [1,1,0,0,0,0|2,0,0]=4 3192 B10R1.4 O=S=Nc1ccccc1F Amb22411336 [1,1,0,0,0,0|2,0,0]=4 3193 B10R1.4 O=c1[nH]cccc1NC=O Amb24072049 [1,1,0,0,0,0|2,0,0]=4 3194 B10R1.4 O=c1cc[nH]cc1NC=O Amb24072447 [1,1,0,0,0,0|2,0,0]=4 3195 B10R1.4 OCCN1C=CC=CC1=O Amb18041231 [1,1,0,0,0,0|1,0,1]=4 3196 B10R1.4 OCCN1C=CC=CC1=S Amb25065240 [1,1,0,0,0,0|1,0,1]=4 3197 B10R1.4 OCCc1[n]cccc1Br Amb22896751 [1,1,0,0,0,0|1,0,1]=4 3198 B10R1.4 OCCc1c[n]ccc1Cl Amb24364650 [1,1,0,0,0,0|1,0,1]=4 3199 B10R1.4 OCCc1cc[n]cc1Br Amb24482101 [1,1,0,0,0,0|1,0,1]=4 3200 B10R1.4 OCCc1cc[n]cc1F Amb25776747 [1,1,0,0,0,0|1,0,1]=4 3201 B10R1.4 OCCc1ccc[n]c1F Amb24513826 [1,1,0,0,0,0|1,0,1]=4 3202 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|0,0,1]=3 3203 B10R1.4 OCCc1ccccc1S Amb24672563 [1,1,0,0,0,0|0,0,1]=3 3204 B10R1.4 ONCc1ccc[n]c1Cl Amb21847006 [1,1,0,0,0,0|2,0,0]=4 3205 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|1,0,0]=3 3206 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|1,0,0]=3 3207 B10R1.4 O\N=C/c1ccccc1Br Amb25247795 [1,1,0,0,0,0|1,0,1]=4 3208 B10R1.4 O\N=C\c1ccccc1Br Amb1152031 [1,1,0,0,0,0|1,0,1]=4 3209 B10R1.4 O\N=C\c1ccccc1C Amb1647706 [1,1,0,0,0,0|1,0,1]=4 3210 B10R1.4 O\N=C\c1ccccc1Cl Amb1152026 [1,1,0,0,0,0|1,0,1]=4 3211 B10R1.4 O\N=C\c1ccccc1F Amb1152952 [1,1,0,0,0,0|1,0,1]=4 3212 B10R1.4 O\N=C\c1ccccc1I Amb1782090 [1,1,0,0,0,0|1,0,1]=4 3213 B10R1.4 O\N=C\c1ccccc1O Amb1159212 [1,1,0,0,0,0|1,0,1]=4 3214 B10R1.4 Oc1ccc[n]c1CCO Amb24062095 [1,1,0,0,0,0|1,0,1]=4 3215 B10R1.4 Oc1ccccc1CCBr Amb18130684 [1,1,0,0,0,0|1,0,1]=4 3216 B10R1.4 Oc1ccccc1CCCl Amb25790019 [1,1,0,0,0,0|1,0,1]=4 3217 B10R1.4 Oc1ccccc1CCF Amb25768394 [1,1,0,0,0,0|1,0,1]=4 3218 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,1]=4 3219 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|0,1,1]=4 3220 B10R1.4 Oc1ccccc1CNO Amb25128279 [1,1,0,0,0,0|1,0,0]=3 3221 B10R1.4 Oc1ccccc1N=C=O Amb25110147 [1,1,0,0,0,0|1,0,1]=4 3222 B10R1.4 Oc1ccccc1\C=C/Cl Amb25774622 [1,1,0,0,0,0|1,0,1]=4 3223 B10R1.4 S=CNc1ccccc1Br Amb25803506 [1,1,0,0,0,0|1,1,0]=4 3224 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|0,1,1]=4 3225 B10R1.4 SCCc1ccccc1C Amb17399938 [1,1,0,0,0,0|0,1,1]=4 3226 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|0,1,1]=4 3227 B10R1.4 SCCc1ccccc1F Amb17400004 [1,1,0,0,0,0|0,1,1]=4 3228 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|0,1,1]=4 3229 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|2,0,0]=4 3230 B10R1.4 [NH3+]OCc1ccccc1Cl Amb2437206 [1,1,0,0,0,0|2,0,0]=4 3231 B10R1.10 BrCCc1cc(I)ccc1 Amb25137377 [1,1,0,0,0,0|1,0,1]=4 3232 B10R1.10 Br[Zn]Cc1cccc(I)c1 Amb22000468 [1,1,0,0,0,0|2,0,0]=4 3233 B10R1.10 Brc1cc(\C=C/I)ccc1 Amb22231752 [1,1,0,0,0,0|1,0,1]=4 3234 B10R1.10 Brc1cccc(CCBr)c1 Amb18048758 [1,1,0,0,0,0|1,0,1]=4 3235 B10R1.10 Brc1cccc(C[Mg]Br)c1 Amb22000537 [1,1,0,0,0,0|2,0,0]=4 3236 B10R1.10 Brc1cccc(C[Zn]Br)c1 Amb22000431 [1,1,0,0,0,0|2,0,0]=4 3237 B10R1.10 Brc1cccc(c1)\C=C\Br Amb22831297 [1,1,0,0,0,0|1,0,1]=4 3238 B10R1.10 C=CC[n+]1cc(Br)ccc1 Amb25722840 [1,1,0,0,0,0|2,0,0]=4 3239 B10R1.10 C=CC[n+]1cc(O)ccc1 Amb25781445 [1,1,0,0,0,0|2,0,0]=4 3240 B10R1.10 C=CCc1c[n]cc(Cl)c1 Amb25137887 [1,1,0,0,0,0|2,0,0]=4 3241 B10R1.10 C=CCc1c[n]cc(F)c1 Amb25772526 [1,1,0,0,0,0|2,0,0]=4 3242 B10R1.10 C=CCc1cc[n]c(Cl)c1 Amb24101015 [1,1,0,0,0,0|2,0,0]=4 3243 B10R1.10 C=CCc1cccc(Br)[n]1 Amb25363953 [1,1,0,0,0,0|2,0,0]=4 3244 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|1,0,0]=3 3245 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|1,0,0]=3 3246 B10R1.10 C=COc1cccc(Br)c1 Amb25248086 [1,1,0,0,0,0|2,0,0]=4 3247 B10R1.10 C=COc1cccc(Cl)c1 Amb24092694 [1,1,0,0,0,0|2,0,0]=4 3248 B10R1.10 C=COc1cccc(I)c1 Amb25144604 [1,1,0,0,0,0|2,0,0]=4 3249 B10R1.10 C=COc1cccc(N)c1 Amb18124447 [1,1,0,0,0,0|2,0,0]=4 3250 B10R1.10 CCCc1cc(Br)ccc1 Amb25736130 [1,1,0,0,0,0|1,0,1]=4 3251 B10R1.10 CCCc1cc(F)ccc1 Amb22235098 [1,1,0,0,0,0|1,0,1]=4 3252 B10R1.10 CCCc1cc(N)ccc1 Amb18643014 [1,1,0,0,0,0|1,0,1]=4 3253 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|2,0,0]=4 3254 B10R1.10 CNCc1cccc(Cl)c1 Amb19958745 [1,1,0,0,0,0|2,0,0]=4 3255 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|2,0,0]=4 3256 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|2,0,0]=4 3257 B10R1.10 CNCc1cccc(c1)Br Amb1114712 [1,1,0,0,0,0|2,0,0]=4 3258 B10R1.10 CNCc1cccc(c1)C Amb1116082 [1,1,0,0,0,0|2,0,0]=4 3259 B10R1.10 CNCc1cccc(c1)Cl Amb1648830 [1,1,0,0,0,0|2,0,0]=4 3260 B10R1.10 CNCc1cccc(c1)F Amb1647905 [1,1,0,0,0,0|2,0,0]=4 3261 B10R1.10 CNCc1cccc(c1)O Amb1131158 [1,1,0,0,0,0|2,0,0]=4 3262 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|2,0,0]=4 3263 B10R1.10 COCc1cccc(Cl)c1 Amb24092696 [1,1,0,0,0,0|2,0,0]=4 3264 B10R1.10 COCc1cccc(F)c1 Amb20241023 [1,1,0,0,0,0|2,0,0]=4 3265 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|2,0,0]=4 3266 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|2,0,0]=4 3267 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|2,0,0]=4 3268 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|2,0,0]=4 3269 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|2,0,0]=4 3270 B10R1.10 C\C=C\c1cccc(O)c1 Amb18124427 [1,1,0,0,0,0|1,0,1]=4 3271 B10R1.10 Cc1cc(CCCl)ccc1 Amb18181942 [1,1,0,0,0,0|1,0,1]=4 3272 B10R1.10 Cc1cc(CCO)[n]cc1 Amb25679639 [1,1,0,0,0,0|1,0,1]=4 3273 B10R1.10 Cc1cc(CCO)cc[n]1 Amb24568116 [1,1,0,0,0,0|1,0,1]=4 3274 B10R1.10 Cc1cc(CNN)ccc1 Amb19890111 [1,1,0,0,0,0|2,0,0]=4 3275 B10R1.10 Cc1cc(CNO)ccc1 Amb25784359 [1,1,0,0,0,0|1,0,0]=3 3276 B10R1.10 Cc1cc(C[Zn]Cl)ccc1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 3277 B10R1.10 Cc1cc(\C=C/Br)ccc1 Amb24737652 [1,1,0,0,0,0|1,0,1]=4 3278 B10R1.10 Cc1cc(\C=N\O)ccc1 Amb18041948 [1,1,0,0,0,0|1,0,1]=4 3279 B10R1.10 Cc1cc(c[n]c1)NC=O Amb24643577 [1,1,0,0,0,0|2,0,0]=4 3280 B10R1.10 Cc1cc(ccc1)N=S=O Amb22411325 [1,1,0,0,0,0|2,0,0]=4 3281 B10R1.10 Cc1cc(ccc1)NC=N Amb24548031 [1,1,0,0,0,0|2,0,0]=4 3282 B10R1.10 Cc1cccc(CCC)c1 Amb22232362 [1,1,0,0,0,0|1,0,1]=4 3283 B10R1.10 Cc1cccc(CSC)c1 Amb24416576 [1,1,0,0,0,0|2,0,0]=4 3284 B10R1.10 Cc1cccc(OC=C)c1 Amb17674187 [1,1,0,0,0,0|2,0,0]=4 3285 B10R1.10 ClCCc1cc(Br)ccc1 Amb24502263 [1,1,0,0,0,0|1,0,1]=4 3286 B10R1.10 Clc1cc(\C=C\Br)ccc1 Amb25262044 [1,1,0,0,0,0|1,0,1]=4 3287 B10R1.10 Clc1cccc(CCCl)c1 Amb18185798 [1,1,0,0,0,0|1,0,1]=4 3288 B10R1.10 Clc1cccc(C[Mg]Cl)c1 Amb19928782 [1,1,0,0,0,0|2,0,0]=4 3289 B10R1.10 Clc1cccc(C[Zn]Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 3290 B10R1.10 Fc1cc(CCI)ccc1 Amb25766475 [1,1,0,0,0,0|1,0,1]=4 3291 B10R1.10 Fc1cc(\C=C\I)ccc1 Amb25049507 [1,1,0,0,0,0|1,0,1]=4 3292 B10R1.10 Fc1cc(ccc1)NC=S Amb24695430 [1,1,0,0,0,0|1,1,0]=4 3293 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 3294 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 3295 B10R1.10 N#CCc1cccc(c1)Br Amb1138679 [1,1,0,0,0,0|1,0,1]=4 3296 B10R1.10 N#CCc1cccc(c1)Cl Amb1651451 [1,1,0,0,0,0|1,0,1]=4 3297 B10R1.10 N#CCc1cccc(c1)N Amb1215231 [1,1,0,0,0,0|1,0,1]=4 3298 B10R1.10 NCCc1cc(Br)ccc1 Amb22900947 [1,1,0,0,0,0|1,0,1]=4 3299 B10R1.10 NCCc1cc(Cl)ccc1 Amb22490605 [1,1,0,0,0,0|1,0,1]=4 3300 B10R1.10 NCCc1cc(I)ccc1 Amb25096322 [1,1,0,0,0,0|1,0,1]=4 3301 B10R1.10 NCCc1cccc(c1)C Amb1126573 [1,1,0,0,0,0|1,0,1]=4 3302 B10R1.10 NCCc1cccc(c1)C Amb13952645 [1,1,0,0,0,0|1,0,1]=4 3303 B10R1.10 NCCc1cccc(c1)Cl Amb1212556 [1,1,0,0,0,0|1,0,1]=4 3304 B10R1.10 NCCc1cccc(c1)F Amb1216921 [1,1,0,0,0,0|1,0,1]=4 3305 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|2,0,0]=4 3306 B10R1.10 NNCc1cccc(Br)c1 Amb20667747 [1,1,0,0,0,0|2,0,0]=4 3307 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|2,0,0]=4 3308 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|2,0,0]=4 3309 B10R1.10 NNCc1cccc(I)c1 Amb25355316 [1,1,0,0,0,0|2,0,0]=4 3310 B10R1.10 NNCc1cccc(c1)Br Amb1119246 [1,1,0,0,0,0|2,0,0]=4 3311 B10R1.10 NNCc1cccc(c1)C Amb1116333 [1,1,0,0,0,0|2,0,0]=4 3312 B10R1.10 NNCc1cccc(c1)Cl Amb1111798 [1,1,0,0,0,0|2,0,0]=4 3313 B10R1.10 NNCc1cccc(c1)Cl Amb13949121 [1,1,0,0,0,0|2,0,0]=4 3314 B10R1.10 NNCc1cccc(c1)F Amb1121411 [1,1,0,0,0,0|2,0,0]=4 3315 B10R1.10 NOCc1cccc(Br)c1 Amb22231355 [1,1,0,0,0,0|2,0,0]=4 3316 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|2,0,0]=4 3317 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|2,0,0]=4 3318 B10R1.10 NOCc1cccc(c1)Br Amb17091429 [1,1,0,0,0,0|2,0,0]=4 3319 B10R1.10 NOCc1cccc(c1)C Amb17091425 [1,1,0,0,0,0|2,0,0]=4 3320 B10R1.10 NOCc1cccc(c1)Cl Amb17091428 [1,1,0,0,0,0|2,0,0]=4 3321 B10R1.10 NOCc1cccc(c1)F Amb17091426 [1,1,0,0,0,0|2,0,0]=4 3322 B10R1.10 Nc1cc(CC#N)ccc1 Amb21857787 [1,1,0,0,0,0|1,0,1]=4 3323 B10R1.10 Nc1cc(CC=O)cc[n]1 Amb25146413 [1,1,0,0,0,0|1,0,0]=3 3324 B10R1.10 Nc1cc(CC=O)ccc1 Amb25147333 [1,1,0,0,0,0|0,0,0]=2 3325 B10R1.10 Nc1cc(CCCl)ccc1 Amb24748802 [1,1,0,0,0,0|1,0,1]=4 3326 B10R1.10 Nc1cc(CCO)[n]cc1 Amb25027828 [1,1,0,0,0,0|1,0,1]=4 3327 B10R1.10 Nc1cc(CCO)cc[n]1 Amb25146377 [1,1,0,0,0,0|1,0,1]=4 3328 B10R1.10 Nc1cc(CCO)ccc1 Amb21857105 [1,1,0,0,0,0|0,0,1]=3 3329 B10R1.10 Nc1cc(CCS)ccc1 Amb22728749 [1,1,0,0,0,0|0,1,1]=4 3330 B10R1.10 Nc1cccc(CCN)c1 Amb22733355 [1,1,0,0,0,0|1,0,1]=4 3331 B10R1.10 Nc1cccc(CCO)[n]1 Amb24401500 [1,1,0,0,0,0|1,0,1]=4 3332 B10R1.10 O=C=Nc1cccc(c1)C Amb2093133 [1,1,0,0,0,0|1,0,1]=4 3333 B10R1.10 O=C=Nc1cccc(c1)F Amb2093115 [1,1,0,0,0,0|1,0,1]=4 3334 B10R1.10 O=CCc1cc(Br)cc[n]1 Amb24482134 [1,1,0,0,0,0|1,0,0]=3 3335 B10R1.10 O=CCc1cccc(Br)[n]1 Amb21858958 [1,1,0,0,0,0|1,0,0]=3 3336 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|0,0,0]=2 3337 B10R1.10 O=CCc1cccc(c1)Br Amb16230449 [1,1,0,0,0,0|0,0,0]=2 3338 B10R1.10 O=CCc1cccc(c1)C Amb16230453 [1,1,0,0,0,0|0,0,0]=2 3339 B10R1.10 O=CCc1cccc(c1)Cl Amb10844835 [1,1,0,0,0,0|0,0,0]=2 3340 B10R1.10 O=CCc1cccc(c1)O Amb17089543 [1,1,0,0,0,0|0,0,0]=2 3341 B10R1.10 O=CNc1c[n]cc(Br)c1 Amb24354748 [1,1,0,0,0,0|2,0,0]=4 3342 B10R1.10 O=CNc1c[n]cc(F)c1 Amb24475259 [1,1,0,0,0,0|2,0,0]=4 3343 B10R1.10 O=CNc1cc[n]c(Br)c1 Amb25125305 [1,1,0,0,0,0|2,0,0]=4 3344 B10R1.10 O=CNc1ccc[n+](c1)[O-] Amb10560230 [1,1,0,0,0,0|2,0,0]=4 3345 B10R1.10 O=CNc1cccc(Br)[n]1 Amb24371374 [1,1,0,0,0,0|2,0,0]=4 3346 B10R1.10 O=CNc1cccc(Br)c1 Amb22367295 [1,1,0,0,0,0|1,0,0]=3 3347 B10R1.10 O=CNc1cccc(Cl)[n]1 Amb25805864 [1,1,0,0,0,0|2,0,0]=4 3348 B10R1.10 O=CNc1cccc(F)[n]1 Amb24072627 [1,1,0,0,0,0|2,0,0]=4 3349 B10R1.10 O=CNc1cccc(F)c1 Amb25830595 [1,1,0,0,0,0|1,0,0]=3 3350 B10R1.10 O=CNc1cccc(I)c1 Amb25240204 [1,1,0,0,0,0|1,0,0]=3 3351 B10R1.10 O=S=Nc1cccc(Br)c1 Amb22411349 [1,1,0,0,0,0|2,0,0]=4 3352 B10R1.10 O=S=Nc1cccc(Cl)c1 Amb22411319 [1,1,0,0,0,0|2,0,0]=4 3353 B10R1.10 O=S=Nc1cccc(F)c1 Amb22411338 [1,1,0,0,0,0|2,0,0]=4 3354 B10R1.10 OCC[n+]1cc(S)ccc1 Amb25831912 [1,1,0,0,0,0|1,0,1]=4 3355 B10R1.10 OCC[n+]1cccc(c1)C Amb10553046 [1,1,0,0,0,0|1,0,1]=4 3356 B10R1.10 OCCc1cc(Br)[n]cc1 Amb25773220 [1,1,0,0,0,0|1,0,1]=4 3357 B10R1.10 OCCc1cc(Br)c[n]c1 Amb25114229 [1,1,0,0,0,0|1,0,1]=4 3358 B10R1.10 OCCc1cc(Br)cc[n]1 Amb24065849 [1,1,0,0,0,0|1,0,1]=4 3359 B10R1.10 OCCc1cc(Cl)[n]cc1 Amb22754705 [1,1,0,0,0,0|1,0,1]=4 3360 B10R1.10 OCCc1cc(F)cc[n]1 Amb25032462 [1,1,0,0,0,0|1,0,1]=4 3361 B10R1.10 OCCc1cc(I)ccc1 Amb24524319 [1,1,0,0,0,0|0,0,1]=3 3362 B10R1.10 OCCc1cccc(F)[n]1 Amb25076783 [1,1,0,0,0,0|1,0,1]=4 3363 B10R1.10 OCCc1cccc(n1)Br Amb13883481 [1,1,0,0,0,0|1,0,1]=4 3364 B10R1.10 OCNc1cccc(Cl)c1 Amb25804223 [1,1,0,0,0,0|1,0,1]=4 3365 B10R1.10 ONCc1cccc(Br)[n]1 Amb24647347 [1,1,0,0,0,0|2,0,0]=4 3366 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|1,0,0]=3 3367 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|1,0,0]=3 3368 B10R1.10 O\N=C\c1cccc(c1)Cl Amb1776533 [1,1,0,0,0,0|1,0,1]=4 3369 B10R1.10 O\N=C\c1cccc(c1)F Amb1152958 [1,1,0,0,0,0|1,0,1]=4 3370 B10R1.10 O\N=C\c1cccc(c1)I Amb1831123 [1,1,0,0,0,0|1,0,1]=4 3371 B10R1.10 Oc1c[n]cc(CCO)c1 Amb24757058 [1,1,0,0,0,0|1,0,1]=4 3372 B10R1.10 Oc1cc(CCBr)ccc1 Amb18130690 [1,1,0,0,0,0|1,0,1]=4 3373 B10R1.10 Oc1cc(\C=C\Br)ccc1 Amb24518614 [1,1,0,0,0,0|1,0,1]=4 3374 B10R1.10 Oc1cc(\C=C\Cl)ccc1 Amb24686373 [1,1,0,0,0,0|1,0,1]=4 3375 B10R1.10 Oc1cc(ccc1)N=C=O Amb18642976 [1,1,0,0,0,0|1,0,1]=4 3376 B10R1.10 Oc1cc(ccc1)OC=O Amb18643208 [1,1,0,0,0,0|1,0,0]=3 3377 B10R1.10 Oc1cc[n]c(CCO)c1 Amb24544455 [1,1,0,0,0,0|1,0,1]=4 3378 B10R1.10 Oc1cccc(CNO)c1 Amb24524626 [1,1,0,0,0,0|1,0,0]=3 3379 B10R1.10 Oc1cccc(c1)OCO Amb25712897 [1,1,0,0,0,0|1,0,1]=4 3380 B10R1.10 Oc1cccc(c1)\C=N/O Amb25162781 [1,1,0,0,0,0|1,0,1]=4 3381 B10R1.10 SCCc1cccc(c1)Br Amb17404678 [1,1,0,0,0,0|0,1,1]=4 3382 B10R1.10 SCCc1cccc(c1)C Amb17399939 [1,1,0,0,0,0|0,1,1]=4 3383 B10R1.10 SCCc1cccc(c1)Cl Amb17400375 [1,1,0,0,0,0|0,1,1]=4 3384 B10R1.10 SCCc1cccc(c1)F Amb17400006 [1,1,0,0,0,0|0,1,1]=4 3385 B10R1.10 Sc1cc(CCCl)ccc1 Amb24627571 [1,1,0,0,0,0|1,0,1]=4 3386 B10R1.10 [NH3+]OCc1cccc(c1)Br Amb2444298 [1,1,0,0,0,0|2,0,0]=4 3387 B10R1.10 [NH3+]OCc1cccc(c1)Cl Amb2405661 [1,1,0,0,0,0|2,0,0]=4 3388 B10R1.10 [NH3+]OCc1cccc(c1)F Amb2424153 [1,1,0,0,0,0|2,0,0]=4 3389 B10R1.10 [O-][n+]1cc(CC=O)ccc1 Amb24099139 [1,1,0,0,0,0|1,0,0]=3 3390 B10R1.10 [O-]c1c[n+](CCO)ccc1 Amb24464239 [1,1,0,0,0,0|1,0,1]=4 3391 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [1,1,0,0,0,0|1,0,1]=4 3392 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [1,1,0,0,0,0|1,0,1]=4 3393 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,1,0,0,0,0|1,0,1]=4 3394 B10R1.15 C#C[C@@H](Cl)c1ccccc1 Amb25114793 [1,1,0,0,0,0|1,0,1]=4 3395 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [1,1,0,0,0,0|1,0,1]=4 3396 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,1,0,0,0,0|1,0,1]=4 3397 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [1,1,0,0,0,0|1,0,1]=4 3398 B10R1.15 C=CC(=O)c1ccccc1 Amb18062256 [1,1,0,0,0,0|1,0,1]=4 3399 B10R1.15 C=CC(N)c1cc[n]cc1 Amb25789567 [1,1,0,0,0,0|2,0,0]=4 3400 B10R1.15 C=CC(N)c1cccc[n]1 Amb24561652 [1,1,0,0,0,0|2,0,0]=4 3401 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|1,0,0]=3 3402 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|1,0,0]=3 3403 B10R1.15 C=CC(O)c1cc[n]cc1 Amb24546417 [1,1,0,0,0,0|2,0,0]=4 3404 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|1,0,0]=3 3405 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [1,1,0,0,0,0|2,0,0]=4 3406 B10R1.15 C=C[C@@H](N)c1cccc[n]1 Amb25146457 [1,1,0,0,0,0|2,0,0]=4 3407 B10R1.15 C=C[C@@H](O)c1c[n]ccc1 Amb25335661 [1,1,0,0,0,0|2,0,0]=4 3408 B10R1.15 C=C[C@@H](O)c1cccc[n]1 Amb25109191 [1,1,0,0,0,0|2,0,0]=4 3409 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|1,0,0]=3 3410 B10R1.15 C=C[C@H](N)c1cccc[n]1 Amb25237215 [1,1,0,0,0,0|2,0,0]=4 3411 B10R1.15 C=C[C@H](O)c1cccc[n]1 Amb24105810 [1,1,0,0,0,0|2,0,0]=4 3412 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [1,1,0,0,0,0|1,0,0]=3 3413 B10R1.15 C=C[S@@](=O)c1ccccc1 Amb22747463 [1,1,0,0,0,0|2,0,0]=4 3414 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [1,1,0,0,0,0|1,0,1]=4 3415 B10R1.15 CC(C=O)c1c[n]ccc1 Amb24100578 [1,1,0,0,0,0|1,0,0]=3 3416 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,1,0,0,0,0|1,0,1]=4 3417 B10R1.15 CC(CO)c1cc[n]cc1 Amb24480432 [1,1,0,0,0,0|1,0,1]=4 3418 B10R1.15 CC(CO)c1cccc[n]1 Amb22896757 [1,1,0,0,0,0|1,0,1]=4 3419 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,1,0,0,0,0|2,0,0]=4 3420 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [1,1,0,0,0,0|2,0,0]=4 3421 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [1,1,0,0,0,0|2,0,0]=4 3422 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [1,1,0,0,0,0|1,0,1]=4 3423 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [1,1,0,0,0,0|1,0,1]=4 3424 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,1,0,0,0,0|1,0,1]=4 3425 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,1,0,0,0,0|1,0,1]=4 3426 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,1,0,0,0,0|1,0,1]=4 3427 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [1,1,0,0,0,0|1,0,1]=4 3428 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,1,0,0,0,0|1,0,1]=4 3429 B10R1.15 CN(C=O)c1cc[n]cc1 Amb24096778 [1,1,0,0,0,0|2,0,0]=4 3430 B10R1.15 CN([13CH]=O)c1ccccc1 Amb22351846 [1,1,0,0,0,0|1,0,0]=3 3431 B10R1.15 CNC(c1ccccc1)C Amb1215689 [1,1,0,0,0,0|2,0,0]=4 3432 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,1,0,0,0,0|2,0,0]=4 3433 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [1,1,0,0,0,0|2,0,0]=4 3434 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [1,1,0,0,0,0|2,0,0]=4 3435 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,1,0,0,0,0|2,0,0]=4 3436 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [1,1,0,0,0,0|2,0,0]=4 3437 B10R1.15 COC(O)c1ccccc1 Amb25225981 [1,1,0,0,0,0|2,0,0]=4 3438 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [1,1,0,0,0,0|2,0,0]=4 3439 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [1,1,0,0,0,0|2,0,0]=4 3440 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|0,0,0]=2 3441 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [1,1,0,0,0,0|1,0,1]=4 3442 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [1,1,0,0,0,0|1,0,1]=4 3443 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,1,0,0,0,0|2,0,0]=4 3444 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,1,0,0,0,0|1,0,0]=3 3445 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,1,0,0,0,0|1,0,0]=3 3446 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,1,0,0,0,0|2,0,0]=4 3447 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|0,0,0]=2 3448 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [1,1,0,0,0,0|1,0,1]=4 3449 B10R1.15 C[C@H](NO)c1cc[n]cc1 Amb24630448 [1,1,0,0,0,0|2,0,0]=4 3450 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [1,1,0,0,0,0|1,0,0]=3 3451 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [1,1,0,0,0,0|1,0,0]=3 3452 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [1,1,0,0,0,0|1,0,1]=4 3453 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [1,1,0,0,0,0|1,0,1]=4 3454 B10R1.15 C\C(=C\O)\c1cc[n]cc1 Amb24661195 [1,1,0,0,0,0|1,0,1]=4 3455 B10R1.15 C\C(=C\O)\c1cccc[n]1 Amb24100288 [1,1,0,0,0,0|1,0,1]=4 3456 B10R1.15 C\[N+](=C\Cl)\c1ccccc1 Amb24740754 [1,1,0,0,0,0|2,0,0]=4 3457 B10R1.15 ClC(C#C)c1ccccc1 Amb17670636 [1,1,0,0,0,0|1,0,1]=4 3458 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [1,1,0,0,0,0|1,0,0]=3 3459 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [1,1,0,0,0,0|1,0,1]=4 3460 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [1,1,0,0,0,0|1,0,1]=4 3461 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [1,1,0,0,0,0|1,0,1]=4 3462 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [1,1,0,0,0,0|1,0,1]=4 3463 B10R1.15 Cl\C(=C\Cl)\c1ccccc1 Amb25849275 [1,1,0,0,0,0|1,0,1]=4 3464 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,1,0,0,0,0|1,0,1]=4 3465 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [1,1,0,0,0,0|1,0,1]=4 3466 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [1,1,0,0,0,0|1,0,1]=4 3467 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,1,0,0,0,0|1,0,1]=4 3468 B10R1.15 F\C(=C/Cl)\c1ccccc1 Amb24589902 [1,1,0,0,0,0|1,0,1]=4 3469 B10R1.15 F\C(=C\F)\c1ccccc1 Amb25762778 [1,1,0,0,0,0|1,0,1]=4 3470 B10R1.15 N#CC(Cl)c1ccccc1 Amb18787437 [1,1,0,0,0,0|1,0,1]=4 3471 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,1,0,0,0,0|1,0,1]=4 3472 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,1,0,0,0,0|1,0,1]=4 3473 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [1,1,0,0,0,0|1,0,1]=4 3474 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,1,0,0,0,0|1,0,1]=4 3475 B10R1.15 NC(=S=O)c1ccccc1 Amb24406743 [1,1,0,0,0,0|1,0,1]=4 3476 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,1,0,0,0,0|1,0,1]=4 3477 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,1,0,0,0,0|1,0,1]=4 3478 B10R1.15 NC(CO)c1c[n]ccc1 Amb22756404 [1,1,0,0,0,0|1,0,1]=4 3479 B10R1.15 NC(CO)c1cc[n]cc1 Amb18561776 [1,1,0,0,0,0|1,0,1]=4 3480 B10R1.15 NC(CO)c1cccc[n]1 Amb18560041 [1,1,0,0,0,0|1,0,1]=4 3481 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,1,0,0,0,0|1,0,1]=4 3482 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,1,0,0,0,0|1,0,1]=4 3483 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,1,0,0,0,0|0,1,1]=4 3484 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [1,1,0,0,0,0|1,0,1]=4 3485 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,1,0,0,0,0|1,0,1]=4 3486 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,1,0,0,0,0|1,0,1]=4 3487 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [1,1,0,0,0,0|1,0,1]=4 3488 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [1,1,0,0,0,0|1,0,1]=4 3489 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [1,1,0,0,0,0|1,0,1]=4 3490 B10R1.15 NCC(c1ccccc1)C Amb1085937 [1,1,0,0,0,0|1,0,1]=4 3491 B10R1.15 NCC(c1ccccc1)O Amb2383121 [1,1,0,0,0,0|1,0,1]=4 3492 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [1,1,0,0,0,0|1,0,1]=4 3493 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,1,0,0,0,0|1,0,1]=4 3494 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,1,0,0,0,0|1,0,1]=4 3495 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [1,1,0,0,0,0|1,0,1]=4 3496 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [1,1,0,0,0,0|1,0,1]=4 3497 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,1,0,0,0,0|1,0,1]=4 3498 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [1,1,0,0,0,0|1,0,1]=4 3499 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [1,1,0,0,0,0|2,0,0]=4 3500 B10R1.15 NNC(c1ccccc1)C Amb10610271 [1,1,0,0,0,0|2,0,0]=4 3501 B10R1.15 NOC(c1ccccc1)C Amb17089185 [1,1,0,0,0,0|2,0,0]=4 3502 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [1,1,0,0,0,0|1,0,1]=4 3503 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [1,1,0,0,0,0|1,0,1]=4 3504 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,1,0,0,0,0|1,0,1]=4 3505 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,1,0,0,0,0|1,0,1]=4 3506 B10R1.15 N[C@@H](CO)c1c[n]ccc1 Amb25146409 [1,1,0,0,0,0|1,0,1]=4 3507 B10R1.15 N[C@@H](CO)c1cc[n]cc1 Amb25146410 [1,1,0,0,0,0|1,0,1]=4 3508 B10R1.15 N[C@@H](CO)c1cccc[n]1 Amb22756435 [1,1,0,0,0,0|1,0,1]=4 3509 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,1,0,0,0,0|0,1,1]=4 3510 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [1,1,0,0,0,0|1,0,1]=4 3511 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,1,0,0,0,0|1,0,1]=4 3512 B10R1.15 N[C@H](CO)c1c[n]ccc1 Amb24712243 [1,1,0,0,0,0|1,0,1]=4 3513 B10R1.15 N[C@H](CO)c1cc[n]cc1 Amb24714739 [1,1,0,0,0,0|1,0,1]=4 3514 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,1,0,0,0,0|0,1,1]=4 3515 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [1,1,0,0,0,0|1,0,1]=4 3516 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [1,1,0,0,0,0|0,0,1]=3 3517 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [1,1,0,0,0,0|0,0,1]=3 3518 B10R1.15 O/N=C(/O)c1ccccc1 Amb17843421 [1,1,0,0,0,0|1,0,1]=4 3519 B10R1.15 O=C(C=O)c1c[n]ccc1 Amb18642978 [1,1,0,0,0,0|1,0,1]=4 3520 B10R1.15 O=C(C=O)c1cccc[n]1 Amb25066902 [1,1,0,0,0,0|1,0,1]=4 3521 B10R1.15 O=C(N=O)c1ccccc1 Amb24096802 [1,1,0,0,0,0|1,0,1]=4 3522 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [1,1,0,0,0,0|0,0,1]=3 3523 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,1,0,0,0,0|0,0,0]=2 3524 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|0,0,0]=2 3525 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|0,0,0]=2 3526 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,1,0,0,0,0|0,0,0]=2 3527 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,1,0,0,0,0|0,0,0]=2 3528 B10R1.15 OC(C=O)c1c[n]cc[n]1 Amb24363870 [1,1,0,0,0,0|2,0,0]=4 3529 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,1,0,0,0,0|1,0,1]=4 3530 B10R1.15 OCC(F)c1cccc[n]1 Amb24518945 [1,1,0,0,0,0|1,0,1]=4 3531 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,1,0,0,0,0|0,0,1]=3 3532 B10R1.15 OCC(O)c1c[n]ccc1 Amb23538717 [1,1,0,0,0,0|1,0,1]=4 3533 B10R1.15 OCC(O)c1cc[n]cc1 Amb23538718 [1,1,0,0,0,0|1,0,1]=4 3534 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,1,0,0,0,0|0,0,1]=3 3535 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,1,0,0,0,0|0,0,1]=3 3536 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,1,0,0,0,0|0,0,1]=3 3537 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,1,0,0,0,0|0,0,1]=3 3538 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,1,0,0,0,0|0,0,1]=3 3539 B10R1.15 OC[C@H](O)c1c[n]ccc1 Amb24433399 [1,1,0,0,0,0|1,0,1]=4 3540 B10R1.15 OC[C@H](O)c1cc[n]cc1 Amb25831641 [1,1,0,0,0,0|1,0,1]=4 3541 B10R1.15 ON(C=O)c1ccccc1 Amb25027443 [1,1,0,0,0,0|1,0,0]=3 3542 B10R1.15 ON(N=O)c1ccccc1 Amb17666641 [1,1,0,0,0,0|2,0,0]=4 3543 B10R1.15 ON(N=O)c1ccccc1 Amb22001406 [1,1,0,0,0,0|2,0,0]=4 3544 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [1,1,0,0,0,0|1,0,1]=4 3545 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [1,1,0,0,0,0|1,0,1]=4 3546 B10R1.15 ONC(c1ccccc1)C Amb10605006 [1,1,0,0,0,0|1,0,0]=3 3547 B10R1.15 ONC(c1ccccn1)C Amb10605008 [1,1,0,0,0,0|2,0,0]=4 3548 B10R1.15 ONC(c1cccnc1)C Amb10605009 [1,1,0,0,0,0|2,0,0]=4 3549 B10R1.15 ONC(c1ccncc1)C Amb10605014 [1,1,0,0,0,0|2,0,0]=4 3550 B10R1.15 OOC(=O)c1ccccc1 Amb17672281 [1,1,0,0,0,0|1,0,1]=4 3551 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,1,0,0,0,0|1,0,1]=4 3552 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,1,0,0,0,0|1,0,1]=4 3553 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [1,1,0,0,0,0|1,0,1]=4 3554 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [1,1,0,0,0,0|1,0,1]=4 3555 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,1,0,0,0,0|1,0,1]=4 3556 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,1,0,0,0,0|1,0,1]=4 3557 B10R1.15 O\C(=C/Cl)\c1ccccc1 Amb24068872 [1,1,0,0,0,0|1,0,1]=4 3558 B10R1.15 O\C(=C/F)\c1ccccc1 Amb24068873 [1,1,0,0,0,0|1,0,1]=4 3559 B10R1.15 O\C(=C\F)\c1ccccc1 Amb25094625 [1,1,0,0,0,0|1,0,1]=4 3560 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [1,1,0,0,0,0|0,0,1]=3 3561 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [1,1,0,0,0,0|1,0,1]=4 3562 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [1,1,0,0,0,0|1,0,1]=4 3563 B10R1.15 O\N=C(\c1ccccc1)/Cl Amb10563288 [1,1,0,0,0,0|1,0,1]=4 3564 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [1,1,0,0,0,0|1,0,1]=4 3565 B10R1.15 SCC(c1ccccc1)O Amb10608997 [1,1,0,0,0,0|0,1,1]=4 3566 B10R1.15 [2H]\C(=C\[2H])\c1ccccc1 Amb22353430 [1,1,0,0,0,0|1,0,1]=4 3567 B10R1.17 BrC=C=Cc1ccccc1 Amb17673290 [1,1,0,0,0,0|1,0,1]=4 3568 B10R1.17 BrCCOc1ccccc1 Amb1152333 [1,1,0,0,0,0|1,0,1]=4 3569 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [1,1,0,0,0,0|1,0,1]=4 3570 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [1,1,0,0,0,0|1,0,1]=4 3571 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [1,1,0,0,0,0|1,0,1]=4 3572 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [1,1,0,0,0,0|1,0,0]=3 3573 B10R1.17 Br\C=N/Nc1ccccc1 Amb25783866 [1,1,0,0,0,0|2,0,0]=4 3574 B10R1.17 Br\C=N\Nc1ccccc1 Amb25274154 [1,1,0,0,0,0|2,0,0]=4 3575 B10R1.17 C#CCNc1ccccc1 Amb21953889 [1,1,0,0,0,0|1,0,1]=4 3576 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [1,1,0,0,0,0|1,0,1]=4 3577 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [1,1,0,0,0,0|1,0,1]=4 3578 B10R1.17 C=C=CCc1cccc[n]1 Amb24649907 [1,1,0,0,0,0|2,0,0]=4 3579 B10R1.17 C=C=COc1ccccc1 Amb17673264 [1,1,0,0,0,0|2,0,0]=4 3580 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [1,1,0,0,0,0|1,0,1]=4 3581 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [1,1,0,0,0,0|2,0,0]=4 3582 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [1,1,0,0,0,0|2,0,0]=4 3583 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [1,1,0,0,0,0|2,0,0]=4 3584 B10R1.17 C=CCNc1cc[n]cc1 Amb18986519 [1,1,0,0,0,0|2,0,0]=4 3585 B10R1.17 C=CCOc1cc[n]cc1 Amb25234559 [1,1,0,0,0,0|2,0,0]=4 3586 B10R1.17 C=CCSc1cc[n]cc1 Amb25725359 [1,1,0,0,0,0|2,0,0]=4 3587 B10R1.17 C=CC[Se]c1cccc[n]1 Amb24101157 [1,1,0,0,0,0|2,0,0]=4 3588 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [1,1,0,0,0,0|1,0,0]=3 3589 B10R1.17 C=CNCc1ccccc1 Amb24505107 [1,1,0,0,0,0|1,0,0]=3 3590 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,1,0,0,0,0|1,0,0]=3 3591 B10R1.17 C=NOCc1ccccc1 Amb24704253 [1,1,0,0,0,0|2,0,0]=4 3592 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [1,1,0,0,0,0|1,0,1]=4 3593 B10R1.17 CCCNc1ccccc1 Amb22284540 [1,1,0,0,0,0|1,0,1]=4 3594 B10R1.17 CNCCc1ccccc1 Amb1132990 [1,1,0,0,0,0|1,0,1]=4 3595 B10R1.17 CNCCc1ccccc1 Amb2119452 [1,1,0,0,0,0|1,0,1]=4 3596 B10R1.17 CNNCc1ccccc1 Amb10553073 [1,1,0,0,0,0|2,0,0]=4 3597 B10R1.17 CNOCc1ccccc1 Amb22059601 [1,1,0,0,0,0|2,0,0]=4 3598 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [1,1,0,0,0,0|2,0,0]=4 3599 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [1,1,0,0,0,0|1,0,1]=4 3600 B10R1.17 COCCc1cccc[n]1 Amb24089662 [1,1,0,0,0,0|1,0,1]=4 3601 B10R1.17 COCNc1ccccc1 Amb10565397 [1,1,0,0,0,0|1,0,1]=4 3602 B10R1.17 CON=Cc1ccccc1 Amb22896936 [1,1,0,0,0,0|1,0,1]=4 3603 B10R1.17 CONCc1c[n]ccc1 Amb24062508 [1,1,0,0,0,0|2,0,0]=4 3604 B10R1.17 CONCc1cc[n]cc1 Amb25046027 [1,1,0,0,0,0|2,0,0]=4 3605 B10R1.17 CONCc1cccc[n]1 Amb25723329 [1,1,0,0,0,0|2,0,0]=4 3606 B10R1.17 CO\C=C/c1c[n]ccc1 Amb24085685 [1,1,0,0,0,0|1,0,1]=4 3607 B10R1.17 CO\C=C/c1cc[n]cc1 Amb24103279 [1,1,0,0,0,0|1,0,1]=4 3608 B10R1.17 CO\C=C/c1cccc[n]1 Amb24106783 [1,1,0,0,0,0|1,0,1]=4 3609 B10R1.17 CO\C=C\c1c[n]ccc1 Amb24085666 [1,1,0,0,0,0|1,0,1]=4 3610 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,1,0,0,0,0|0,0,1]=3 3611 B10R1.17 CO\C=N\c1c[n]ccc1 Amb25217756 [1,1,0,0,0,0|2,0,0]=4 3612 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [1,1,0,0,0,0|1,0,1]=4 3613 B10R1.17 CSCOc1ccccc1 Amb22231357 [1,1,0,0,0,0|2,0,0]=4 3614 B10R1.17 CSCSc1ccccc1 Amb25162526 [1,1,0,0,0,0|2,0,0]=4 3615 B10R1.17 CSSCc1ccccc1 Amb22230274 [1,1,0,0,0,0|1,1,0]=4 3616 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [1,1,0,0,0,0|2,0,0]=4 3617 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [1,1,0,0,0,0|1,0,1]=4 3618 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,1,0,0,0,0|1,0,1]=4 3619 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [1,1,0,0,0,0|2,0,0]=4 3620 B10R1.17 ClC=C=Cc1ccccc1 Amb17670635 [1,1,0,0,0,0|1,0,1]=4 3621 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [1,1,0,0,0,0|1,0,0]=3 3622 B10R1.17 ClCCNc1ccccc1 Amb17334388 [1,1,0,0,0,0|1,0,1]=4 3623 B10R1.17 ClCCPc1ccccc1 Amb24390336 [1,1,0,0,0,0|1,0,1]=4 3624 B10R1.17 ClCSCc1ccccc1 Amb16231183 [1,1,0,0,0,0|1,0,1]=4 3625 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [1,1,0,0,0,0|1,0,1]=4 3626 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [1,1,0,0,0,0|1,0,1]=4 3627 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb24396864 [1,1,0,0,0,0|2,0,0]=4 3628 B10R1.17 Cl\C=C\Cc1cc[n]cc1 Amb24697784 [1,1,0,0,0,0|2,0,0]=4 3629 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [1,1,0,0,0,0|1,0,0]=3 3630 B10R1.17 FCCCc1ccccc1 Amb25737014 [1,1,0,0,0,0|1,0,1]=4 3631 B10R1.17 FCCOc1ccccc1 Amb25350055 [1,1,0,0,0,0|1,0,1]=4 3632 B10R1.17 ICCCc1ccccc1 Amb10605506 [1,1,0,0,0,0|1,0,1]=4 3633 B10R1.17 ICCOc1ccccc1 Amb10608588 [1,1,0,0,0,0|1,0,1]=4 3634 B10R1.17 N#CCNc1ccccc1 Amb1651088 [1,1,0,0,0,0|1,0,1]=4 3635 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [1,1,0,0,0,0|1,0,1]=4 3636 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [1,1,0,0,0,0|1,0,1]=4 3637 B10R1.17 N=COCc1ccccc1 Amb22269902 [1,1,0,0,0,0|1,0,0]=3 3638 B10R1.17 N=COCc1ccccc1 Amb24652885 [1,1,0,0,0,0|1,0,0]=3 3639 B10R1.17 NCCCc1ccccc1 Amb22490482 [1,1,0,0,0,0|1,0,1]=4 3640 B10R1.17 NCCNc1ccccc1 Amb23412206 [1,1,0,0,0,0|1,0,1]=4 3641 B10R1.17 NCCOc1ccccc1 Amb1214559 [1,1,0,0,0,0|1,0,1]=4 3642 B10R1.17 NCCOc1ccccc1 Amb2099529 [1,1,0,0,0,0|1,0,1]=4 3643 B10R1.17 NCCPc1ccccc1 Amb24482461 [1,1,0,0,0,0|1,0,1]=4 3644 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [1,1,0,0,0,0|1,0,1]=4 3645 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [1,1,0,0,0,0|1,0,1]=4 3646 B10R1.17 NNCCc1ccccc1 Amb10608987 [1,1,0,0,0,0|1,0,1]=4 3647 B10R1.17 NNCCc1ccccc1 Amb1117029 [1,1,0,0,0,0|1,0,1]=4 3648 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [1,1,0,0,0,0|1,0,1]=4 3649 B10R1.17 NOCCc1ccccn1 Amb17231907 [1,1,0,0,0,0|1,0,1]=4 3650 B10R1.17 NOCCc1ccncc1 Amb17231908 [1,1,0,0,0,0|1,0,1]=4 3651 B10R1.17 O=C=C\C=C/1\C=CC=CN1 Amb25689817 [1,1,0,0,0,0|1,0,1]=4 3652 B10R1.17 O=C=NCc1cccnc1 Amb17090261 [1,1,0,0,0,0|1,0,1]=4 3653 B10R1.17 O=C=NCc1ccncc1 Amb17090262 [1,1,0,0,0,0|1,0,1]=4 3654 B10R1.17 O=CCCc1[n]ccc[n]1 Amb24056162 [1,1,0,0,0,0|2,0,0]=4 3655 B10R1.17 O=CCCc1c[n]c[n]c1 Amb24657168 [1,1,0,0,0,0|2,0,0]=4 3656 B10R1.17 O=CCCc1ccccn1 Amb17081674 [1,1,0,0,0,0|1,0,0]=3 3657 B10R1.17 O=CCCc1cccnc1 Amb17081675 [1,1,0,0,0,0|1,0,0]=3 3658 B10R1.17 O=CCNc1cccc[n]1 Amb24100487 [1,1,0,0,0,0|1,0,0]=3 3659 B10R1.17 O=CCNc1ccccc1 Amb24566865 [1,1,0,0,0,0|0,0,0]=2 3660 B10R1.17 O=CCOc1c[n]c[n]c1 Amb24083667 [1,1,0,0,0,0|2,0,0]=4 3661 B10R1.17 O=CCOc1c[n]ccc1 Amb24068437 [1,1,0,0,0,0|1,0,0]=3 3662 B10R1.17 O=CCOc1cc[n]c[n]1 Amb24478315 [1,1,0,0,0,0|2,0,0]=4 3663 B10R1.17 O=CCOc1cc[n]cc1 Amb24068570 [1,1,0,0,0,0|1,0,0]=3 3664 B10R1.17 O=CCSc1[n]ccc[n]1 Amb18799502 [1,1,0,0,0,0|2,0,0]=4 3665 B10R1.17 O=CCSc1c[n]cc[n]1 Amb25261998 [1,1,0,0,0,0|2,0,0]=4 3666 B10R1.17 O=CCSc1cc[n]c[n]1 Amb25825832 [1,1,0,0,0,0|2,0,0]=4 3667 B10R1.17 O=CCSc1cc[n]cc1 Amb24475471 [1,1,0,0,0,0|1,0,0]=3 3668 B10R1.17 O=CCSc1cccc[n]1 Amb18799459 [1,1,0,0,0,0|1,0,0]=3 3669 B10R1.17 O=CCSc1ccccc1 Amb17082903 [1,1,0,0,0,0|0,0,0]=2 3670 B10R1.17 O=CNCc1c[n]cc[n]1 Amb24478911 [1,1,0,0,0,0|2,0,0]=4 3671 B10R1.17 O=CNCc1cc[n]c[n]1 Amb24072457 [1,1,0,0,0,0|2,0,0]=4 3672 B10R1.17 O=CNCc1ccc[n][n]1 Amb25696123 [1,1,0,0,0,0|2,0,0]=4 3673 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [1,1,0,0,0,0|1,0,0]=3 3674 B10R1.17 O=CNCc1ccccc1 Amb1916036 [1,1,0,0,0,0|0,0,0]=2 3675 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [1,1,0,0,0,0|0,0,1]=3 3676 B10R1.17 O=C\C=C\c1cc[n]cc1 Amb24325387 [1,1,0,0,0,0|1,0,1]=4 3677 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [1,1,0,0,0,0|1,0,1]=4 3678 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [1,1,0,0,0,0|1,0,1]=4 3679 B10R1.17 O=C\C=C\c1ccncc1 Amb17334137 [1,1,0,0,0,0|1,0,1]=4 3680 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [1,1,0,0,0,0|0,0,1]=3 3681 B10R1.17 O=NC#Cc1ccccc1 Amb24068843 [1,1,0,0,0,0|0,0,2]=4 3682 B10R1.17 OCCCc1cccc[n]1 Amb22749323 [1,1,0,0,0,0|1,0,1]=4 3683 B10R1.17 OCCNc1c[n]ccc1 Amb18266115 [1,1,0,0,0,0|1,0,1]=4 3684 B10R1.17 OCCNc1ccccc1 Amb24065196 [1,1,0,0,0,0|0,0,1]=3 3685 B10R1.17 OCCNc1ccccc1 Amb24065197 [1,1,0,0,0,0|0,0,1]=3 3686 B10R1.17 OCCNc1ccccn1 Amb10809152 [1,1,0,0,0,0|1,0,1]=4 3687 B10R1.17 OCCOc1c[n]ccc1 Amb19333986 [1,1,0,0,0,0|1,0,1]=4 3688 B10R1.17 OCCOc1cccc[n]1 Amb23598433 [1,1,0,0,0,0|1,0,1]=4 3689 B10R1.17 OCCOc1ccccc1 Amb2209344 [1,1,0,0,0,0|0,0,1]=3 3690 B10R1.17 OCCOc1ccncc1 Amb10552812 [1,1,0,0,0,0|1,0,1]=4 3691 B10R1.17 OCCSc1c[n]ccc1 Amb25343843 [1,1,0,0,0,0|1,0,1]=4 3692 B10R1.17 OCNCc1ccccc1 Amb24756521 [1,1,0,0,0,0|0,0,1]=3 3693 B10R1.17 OCOCc1ccccc1 Amb25727798 [1,1,0,0,0,0|0,0,1]=3 3694 B10R1.17 OC\C=C\c1cc[n]cc1 Amb22749186 [1,1,0,0,0,0|1,0,1]=4 3695 B10R1.17 OC\C=C\c1cccc[n]1 Amb22749315 [1,1,0,0,0,0|1,0,1]=4 3696 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [1,1,0,0,0,0|1,0,1]=4 3697 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [1,1,0,0,0,0|1,0,0]=3 3698 B10R1.17 OC\N=C\c1ccccc1 Amb25105990 [1,1,0,0,0,0|0,0,2]=4 3699 B10R1.17 ONCCc1ccccc1 Amb24117032 [1,1,0,0,0,0|0,0,1]=3 3700 B10R1.17 O\N=C\Cc1cc[n]c[n]1 Amb24559505 [1,1,0,0,0,0|2,0,0]=4 3701 B10R1.17 S=C=CNc1ccccc1 Amb25728146 [1,1,0,0,0,0|1,1,0]=4 3702 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [1,1,0,0,0,0|0,1,1]=4 3703 B10R1.17 SCCNc1ccccc1 Amb24065195 [1,1,0,0,0,0|0,1,1]=4 3704 B10R1.17 SCCSc1ccccc1 Amb13881734 [1,1,0,0,0,0|0,1,1]=4 3705 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [1,1,0,0,0,0|1,0,1]=4 3706 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [1,1,0,0,0,0|2,0,0]=4 3707 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [1,1,0,0,0,0|1,0,1]=4 3708 B10R1.13 Brc1ccc(cc1)P(=O)O Amb10571105 [0,1,0,0,1,0|1,0,0]=3 3709 B10R1.13 Brc1ccc(cc1)[N+](=O)[O-] Amb1929309 [0,1,0,0,1,0|1,0,1]=4 3710 B10R1.13 Brc1ccc(cn1)C(=O)N Amb10070703 [0,1,0,0,1,0|2,0,0]=4 3711 B10R1.13 Brc1ccc(nc1)C(=O)C Amb10601919 [0,1,0,0,1,0|2,0,0]=4 3712 B10R1.13 Brc1ccc(nc1)C(=O)Cl Amb10068998 [0,1,0,0,1,0|2,0,0]=4 3713 B10R1.13 Brc1ccc(nc1)C(=O)O Amb2447466 [0,1,0,0,1,0|1,0,0]=3 3714 B10R1.13 C=C(Br)c1ccc(Cl)cc1 Amb22336832 [0,1,0,0,1,0|2,0,0]=4 3715 B10R1.13 C=C(F)c1ccc(Br)cc1 Amb25169370 [0,1,0,0,1,0|2,0,0]=4 3716 B10R1.13 C=C(F)c1ccc(Cl)cc1 Amb22008097 [0,1,0,0,1,0|2,0,0]=4 3717 B10R1.13 C=C(F)c1ccc(F)cc1 Amb24053856 [0,1,0,0,1,0|2,0,0]=4 3718 B10R1.13 C=C1CC=C(C=C1)C(N)=O Amb25336291 [0,1,0,0,1,0|1,0,1]=4 3719 B10R1.13 CC(=C)c1ccc(cc1)N Amb17107085 [0,1,0,0,1,0|2,0,0]=4 3720 B10R1.13 CC(=C)c1ccc(cc1)O Amb13883631 [0,1,0,0,1,0|2,0,0]=4 3721 B10R1.13 CC(=N)c1ccc(cc1)O Amb10576568 [0,1,0,0,1,0|2,0,0]=4 3722 B10R1.13 CC(=O)C=1C=CC(=C)CC1 Amb24758694 [0,1,0,0,1,0|1,0,1]=4 3723 B10R1.13 CC(=O)C=1C=CC(=O)NC1 Amb22744839 [0,1,0,0,1,0|2,0,0]=4 3724 B10R1.13 CC(=O)N1C=CC(=O)C=C1 Amb25320190 [0,1,0,0,1,0|2,0,0]=4 3725 B10R1.13 CC(=O)N1C=CC(=S)C=C1 Amb24062617 [0,1,0,0,1,0|2,0,0]=4 3726 B10R1.13 CC(=O)[n+]1ccc(N)cc1 Amb24661347 [0,1,0,0,1,0|2,0,0]=4 3727 B10R1.13 CC(=O)c1c[n]c(O)cc1 Amb22490878 [0,1,0,0,1,0|2,0,0]=4 3728 B10R1.13 CC(=O)c1cc[n+](C)cc1 Amb22481987 [0,1,0,0,1,0|2,0,0]=4 3729 B10R1.13 CC(=O)c1cc[n+](cc1)[O-] Amb10552750 [0,1,0,0,1,0|2,0,0]=4 3730 B10R1.13 CC(=O)c1ccc(F)c[n]1 Amb21864749 [0,1,0,0,1,0|2,0,0]=4 3731 B10R1.13 CC(=O)c1ccc(I)[n]c1 Amb25217952 [0,1,0,0,1,0|2,0,0]=4 3732 B10R1.13 CC(=O)c1ccc(N)c[n]1 Amb20247966 [0,1,0,0,1,0|2,0,0]=4 3733 B10R1.13 CC(=O)c1ccc(N)cc1 Amb22734863 [0,1,0,0,1,0|1,0,0]=3 3734 B10R1.13 CC(=O)c1ccc(O)[n]c1 Amb19958095 [0,1,0,0,1,0|2,0,0]=4 3735 B10R1.13 CC(=O)c1ccc(S)[n]c1 Amb24505216 [0,1,0,0,1,0|2,0,0]=4 3736 B10R1.13 CC(=O)c1ccc(cc1)Br Amb1221363 [0,1,0,0,1,0|1,0,0]=3 3737 B10R1.13 CC(=O)c1ccc(cc1)I Amb1233200 [0,1,0,0,1,0|1,0,0]=3 3738 B10R1.13 CC(=O)c1ccc(cc1)O Amb1212250 [0,1,0,0,1,0|1,0,0]=3 3739 B10R1.13 CC(=O)c1ccc(cc1)S Amb17593795 [0,1,0,0,1,0|1,0,0]=3 3740 B10R1.13 CC(C)=C1C=CC(=O)C=C1 Amb24690878 [0,1,0,0,1,0|2,0,0]=4 3741 B10R1.13 CC(O)=C1C=CC(=O)C=C1 Amb24480664 [0,1,0,0,1,0|1,0,0]=3 3742 B10R1.13 CC(c1ccc(cc1)F)O Amb1211893 [0,1,0,0,1,0|1,0,1]=4 3743 B10R1.13 CC(c1ccc(cc1)I)O Amb1110523 [0,1,0,0,1,0|1,0,1]=4 3744 B10R1.13 CC(c1ccc(cc1)S)O Amb17593857 [0,1,0,0,1,0|1,0,1]=4 3745 B10R1.13 CC1C=CC(C=C1)C(O)=O Amb22364714 [0,1,0,0,1,0|0,0,2]=4 3746 B10R1.13 CN1CC=C(C=C1)C(O)=O Amb24622513 [0,1,0,0,1,0|1,0,1]=4 3747 B10R1.13 CS(=O)c1ccc(Cl)cc1 Amb19892199 [0,1,0,0,1,0|2,0,0]=4 3748 B10R1.13 CS(=O)c1ccc(F)cc1 Amb19892152 [0,1,0,0,1,0|2,0,0]=4 3749 B10R1.13 CS(=O)c1ccc(N)cc1 Amb18945202 [0,1,0,0,1,0|2,0,0]=4 3750 B10R1.13 CS(=O)c1ccc(O)cc1 Amb17873067 [0,1,0,0,1,0|2,0,0]=4 3751 B10R1.13 C[13C](=O)c1ccc(cc1)N Amb17607866 [0,1,0,0,1,0|1,0,0]=3 3752 B10R1.13 C[C@@H](O)c1ccc(Cl)cc1 Amb20241103 [0,1,0,0,1,0|1,0,1]=4 3753 B10R1.13 C[C@@H](O)c1ccc(N)cc1 Amb25228343 [0,1,0,0,1,0|1,0,1]=4 3754 B10R1.13 C[C@@H](O)c1ccc(O)cc1 Amb25273162 [0,1,0,0,1,0|1,0,1]=4 3755 B10R1.13 C[C@@H](c1ccc(cc1)F)O Amb16185872 [0,1,0,0,1,0|1,0,1]=4 3756 B10R1.13 C[C@H](O)c1ccc(Cl)cc1 Amb20241104 [0,1,0,0,1,0|1,0,1]=4 3757 B10R1.13 C[C@H](O)c1ccc(N)cc1 Amb24384238 [0,1,0,0,1,0|1,0,1]=4 3758 B10R1.13 C[C@H](O)c1ccc(O)cc1 Amb24644699 [0,1,0,0,1,0|1,0,1]=4 3759 B10R1.13 C[C@H](O)c1ccc(S)cc1 Amb25823717 [0,1,0,0,1,0|1,0,1]=4 3760 B10R1.13 Cc1[n]cc(c[n]1)C(O)=O Amb22492357 [0,1,0,0,1,0|2,0,0]=4 3761 B10R1.13 Cc1ccc([n]c1)C(C)=O Amb22587200 [0,1,0,0,1,0|2,0,0]=4 3762 B10R1.13 Cc1ccc([n]c1)C(N)=O Amb25288938 [0,1,0,0,1,0|2,0,0]=4 3763 B10R1.13 Cc1ccc([n]c1)C(O)=O Amb21962879 [0,1,0,0,1,0|1,0,0]=3 3764 B10R1.13 Cc1ccc([n]c1)C(O)=O Amb22276156 [0,1,0,0,1,0|1,0,0]=3 3765 B10R1.13 Cc1ccc(cc1)B(C)O Amb25120944 [0,1,0,0,1,0|2,0,0]=4 3766 B10R1.13 Cc1ccc(cc1)B(O)O Amb22044308 [0,1,0,0,1,0|1,0,1]=4 3767 B10R1.13 Cc1ccc(cc1)C(=C)F Amb25354650 [0,1,0,0,1,0|2,0,0]=4 3768 B10R1.13 Cc1ccc(cc1)C(=O)C Amb2447132 [0,1,0,0,1,0|1,0,0]=3 3769 B10R1.13 Cc1ccc(cc1)C(=S)C Amb10602373 [0,1,0,0,1,0|1,1,0]=4 3770 B10R1.13 Cc1ccc(cc1)C(N)=S Amb22047967 [0,1,0,0,1,0|1,1,0]=4 3771 B10R1.13 Cc1ccc(cc1)C(O)=S Amb22262973 [0,1,0,0,1,0|0,1,0]=3 3772 B10R1.13 Cc1ccc(cc1)C([O-])=O Amb21962678 [0,1,0,0,1,0|0,0,1]=3 3773 B10R1.13 Cc1ccc(cc1)P(=O)O Amb10571101 [0,1,0,0,1,0|1,0,0]=3 3774 B10R1.13 Cc1ccc(cc1)S(=O)O Amb10601729 [0,1,0,0,1,0|1,0,0]=3 3775 B10R1.13 Cc1ccc(cc1)S(=O)[O-] Amb10790480 [0,1,0,0,1,0|1,0,1]=4 3776 B10R1.13 Cc1ccc(cc1)S(=O)[O-] Amb16185755 [0,1,0,0,1,0|1,0,1]=4 3777 B10R1.13 Cc1ccc(cc1)S(Cl)=O Amb17939004 [0,1,0,0,1,0|2,0,0]=4 3778 B10R1.13 Cc1ccc(cc1)S(O)=O Amb22436806 [0,1,0,0,1,0|1,0,0]=3 3779 B10R1.13 Cc1ccc(cc1)S(O)=O Amb22730230 [0,1,0,0,1,0|1,0,0]=3 3780 B10R1.13 Cc1ccc(cc1)S([O-])=O Amb22360764 [0,1,0,0,1,0|1,0,1]=4 3781 B10R1.13 Cc1ccc(cc1)S([O-])=O Amb22411411 [0,1,0,0,1,0|1,0,1]=4 3782 B10R1.13 Cc1ccc(cc1)[C@@H](C)O Amb25859279 [0,1,0,0,1,0|1,0,1]=4 3783 B10R1.13 Cc1ccc(cc1)[C@H](C)O Amb20241494 [0,1,0,0,1,0|1,0,1]=4 3784 B10R1.13 Cc1ccc(cc1)[C@H](O)Cl Amb25065327 [0,1,0,0,1,0|1,0,1]=4 3785 B10R1.13 Cc1ccc(cc1)[S@](=O)N Amb16233804 [0,1,0,0,1,0|2,0,0]=4 3786 B10R1.13 Cc1ccc(cc1)[S@](C)=O Amb22226741 [0,1,0,0,1,0|2,0,0]=4 3787 B10R1.13 Cc1ccc(cc1)[S@](N)=O Amb19889838 [0,1,0,0,1,0|2,0,0]=4 3788 B10R1.13 Cc1ccc(cn1)C(=O)O Amb2371808 [0,1,0,0,1,0|1,0,0]=3 3789 B10R1.13 Cc1ccc(cn1)C(=O)[O-] Amb10070842 [0,1,0,0,1,0|1,0,1]=4 3790 B10R1.13 Cc1ccc(nc1)C(=O)C Amb10608263 [0,1,0,0,1,0|2,0,0]=4 3791 B10R1.13 Cc1ccc(nn1)C(O)=O Amb17798483 [0,1,0,0,1,0|2,0,0]=4 3792 B10R1.13 ClC(=C)c1ccc(cc1)F Amb17610890 [0,1,0,0,1,0|2,0,0]=4 3793 B10R1.13 Clc1ccc(cc1)S(=O)[O-] Amb10790466 [0,1,0,0,1,0|1,0,1]=4 3794 B10R1.13 Clc1ccc(cc1)[I](=O)=O Amb10553247 [0,1,0,0,1,0|1,0,1]=4 3795 B10R1.13 Clc1ccc(nc1)C(=O)C Amb16191910 [0,1,0,0,1,0|2,0,0]=4 3796 B10R1.13 Fc1ccc(cc1)C(I)=O Amb17942820 [0,1,0,0,1,0|1,0,0]=3 3797 B10R1.13 Fc1ccc(cc1)S(=O)Cl Amb13881361 [0,1,0,0,1,0|2,0,0]=4 3798 B10R1.13 Fc1ccc(cn1)C(=O)C Amb10603339 [0,1,0,0,1,0|2,0,0]=4 3799 B10R1.13 Fc1ccc(cn1)C(=O)Cl Amb2447511 [0,1,0,0,1,0|2,0,0]=4 3800 B10R1.13 Fc1ccc(cn1)C(=O)O Amb2447507 [0,1,0,0,1,0|1,0,0]=3 3801 B10R1.13 Ic1ccc(cc1)[N+](=O)[O-] Amb1151924 [0,1,0,0,1,0|1,0,1]=4 3802 B10R1.13 Ic1ccc(nc1)C(=O)O Amb10602946 [0,1,0,0,1,0|1,0,0]=3 3803 B10R1.13 N=C(/N)\c1ccc(N)cc1 Amb20665523 [0,1,0,0,1,0|2,0,0]=4 3804 B10R1.13 NC(=N)c1ccc(Cl)cc1 Amb22489466 [0,1,0,0,1,0|2,0,0]=4 3805 B10R1.13 NC(=N)c1ccc(I)cc1 Amb22463737 [0,1,0,0,1,0|2,0,0]=4 3806 B10R1.13 NC(=N)c1ccc(cc1)Cl Amb1145037 [0,1,0,0,1,0|2,0,0]=4 3807 B10R1.13 NC(=O)C=1C=CC(=O)NC1 Amb19419628 [0,1,0,0,1,0|2,0,0]=4 3808 B10R1.13 NC(=O)C=1C=CC(=O)OC1 Amb25147558 [0,1,0,0,1,0|2,0,0]=4 3809 B10R1.13 NC(=O)c1cc[n+](cc1)[O-] Amb10573737 [0,1,0,0,1,0|2,0,0]=4 3810 B10R1.13 NC(=O)c1ccc(Cl)c[n]1 Amb22500440 [0,1,0,0,1,0|2,0,0]=4 3811 B10R1.13 NC(=O)c1ccc(Cl)c[n]1 Amb22899146 [0,1,0,0,1,0|2,0,0]=4 3812 B10R1.13 NC(=O)c1ccc(F)c[n]1 Amb22001839 [0,1,0,0,1,0|2,0,0]=4 3813 B10R1.13 NC(=O)c1ccc(I)c[n]1 Amb24482132 [0,1,0,0,1,0|2,0,0]=4 3814 B10R1.13 NC(=O)c1ccc(S)[n]c1 Amb24081719 [0,1,0,0,1,0|2,0,0]=4 3815 B10R1.13 NC(=O)c1ccc(cc1)Br Amb1232839 [0,1,0,0,1,0|1,0,0]=3 3816 B10R1.13 NC(=O)c1ccc(cc1)F Amb1230540 [0,1,0,0,1,0|1,0,0]=3 3817 B10R1.13 NC(=O)c1ccc(cc1)I Amb2227687 [0,1,0,0,1,0|1,0,0]=3 3818 B10R1.13 NC(=O)c1ccc(cc1)O Amb1240570 [0,1,0,0,1,0|1,0,0]=3 3819 B10R1.13 NC(=O)c1ccc(cc1)O Amb13951374 [0,1,0,0,1,0|1,0,0]=3 3820 B10R1.13 NC(=S)c1ccc(I)cc1 Amb18617991 [0,1,0,0,1,0|1,1,0]=4 3821 B10R1.13 NC(=S)c1ccc(cc1)Br Amb1152460 [0,1,0,0,1,0|1,1,0]=4 3822 B10R1.13 NC(=S)c1ccc(cc1)F Amb1152550 [0,1,0,0,1,0|1,1,0]=4 3823 B10R1.13 NC(=S)c1ccc(cc1)O Amb1154194 [0,1,0,0,1,0|1,1,0]=4 3824 B10R1.13 NC(N)=C1C=CC(=N)C=C1 Amb24409784 [0,1,0,0,1,0|2,0,0]=4 3825 B10R1.13 NC(N)=C1C=CC(=O)C=C1 Amb25278698 [0,1,0,0,1,0|2,0,0]=4 3826 B10R1.13 Nc1ccc(c[n]1)C(=O)Cl Amb24071897 [0,1,0,0,1,0|2,0,0]=4 3827 B10R1.13 Nc1ccc(c[n]1)C(O)=O Amb24062482 [0,1,0,0,1,0|1,0,0]=3 3828 B10R1.13 Nc1ccc(cc1)B(O)O Amb20242086 [0,1,0,0,1,0|1,0,1]=4 3829 B10R1.13 Nc1ccc(cc1)C(=N)N Amb16224864 [0,1,0,0,1,0|2,0,0]=4 3830 B10R1.13 Nc1ccc(cc1)C(=O)F Amb24548959 [0,1,0,0,1,0|1,0,0]=3 3831 B10R1.13 Nc1ccc(cc1)C(O)=O Amb22349631 [0,1,0,0,1,0|0,0,0]=2 3832 B10R1.13 Nc1ccc(cc1)C(O)=O Amb22363131 [0,1,0,0,1,0|0,0,0]=2 3833 B10R1.13 Nc1ccc(cc1)C(O)=O Amb24066899 [0,1,0,0,1,0|0,0,0]=2 3834 B10R1.13 Nc1ccc(cc1)C(O)=O Amb24091246 [0,1,0,0,1,0|0,0,0]=2 3835 B10R1.13 Nc1ccc(cc1)P(O)=O Amb24482412 [0,1,0,0,1,0|1,0,0]=3 3836 B10R1.13 Nc1ccc(cc1)S(=O)=O Amb25065185 [0,1,0,0,1,0|1,0,1]=4 3837 B10R1.13 Nc1ccc(cc1)S(N)=O Amb24446357 [0,1,0,0,1,0|2,0,0]=4 3838 B10R1.13 Nc1ccc(cc1)[N+](=O)[O-] Amb1935140 [0,1,0,0,1,0|1,0,1]=4 3839 B10R1.13 Nc1ccc(cn1)C(=O)C Amb10608783 [0,1,0,0,1,0|2,0,0]=4 3840 B10R1.13 Nc1ccc(cn1)C(=O)O Amb1215277 [0,1,0,0,1,0|1,0,0]=3 3841 B10R1.13 Nc1cnc(cn1)C(=O)O Amb13883736 [0,1,0,0,1,0|2,0,0]=4 3842 B10R1.13 O=C(Br)c1ccc(Br)cc1 Amb24079095 [0,1,0,0,1,0|1,0,0]=3 3843 B10R1.13 O=C(Br)c1ccc(Cl)cc1 Amb25843658 [0,1,0,0,1,0|1,0,0]=3 3844 B10R1.13 O=C(Br)c1ccc(F)cc1 Amb24070269 [0,1,0,0,1,0|1,0,0]=3 3845 B10R1.13 O=C(Cl)c1ccc(Br)[n]c1 Amb20620534 [0,1,0,0,1,0|2,0,0]=4 3846 B10R1.13 O=C(Cl)c1ccc(Cl)[n]c1 Amb22728126 [0,1,0,0,1,0|2,0,0]=4 3847 B10R1.13 O=C(Cl)c1ccc(Cl)c[n]1 Amb22002486 [0,1,0,0,1,0|2,0,0]=4 3848 B10R1.13 O=C(Cl)c1ccc(F)c[n]1 Amb22388450 [0,1,0,0,1,0|2,0,0]=4 3849 B10R1.13 O=C(Cl)c1ccc(I)[n]c1 Amb25351712 [0,1,0,0,1,0|2,0,0]=4 3850 B10R1.13 O=C(Cl)c1ccc(S)cc1 Amb24070681 [0,1,0,0,1,0|1,0,0]=3 3851 B10R1.13 O=C(Cl)c1ccc([n]c1)[*] Amb22052730 [0,1,0,0,1,0|2,0,0]=4 3852 B10R1.13 O=C(Cl)c1ccc(cc1)[*] Amb22045243 [0,1,0,0,1,0|1,0,0]=3 3853 B10R1.13 O=C(F)c1ccc(Cl)[n]c1 Amb24091605 [0,1,0,0,1,0|2,0,0]=4 3854 B10R1.13 O=C1C=CC(=CN1)C(=O)Cl Amb24082934 [0,1,0,0,1,0|2,0,0]=4 3855 B10R1.13 O=C1C=CC(=CO1)C(=O)Cl Amb19895315 [0,1,0,0,1,0|2,0,0]=4 3856 B10R1.13 O=N(=O)c1ccc(Cl)cc1 Amb20621796 [0,1,0,0,1,0|1,0,1]=4 3857 B10R1.13 O=N(=O)c1ccc(F)cc1 Amb20621319 [0,1,0,0,1,0|1,0,1]=4 3858 B10R1.13 O=N(=O)c1ccc(I)cc1 Amb20621832 [0,1,0,0,1,0|1,0,1]=4 3859 B10R1.13 O=S(Cl)c1ccc(Br)cc1 Amb18071349 [0,1,0,0,1,0|2,0,0]=4 3860 B10R1.13 O=S(Cl)c1ccc(Cl)cc1 Amb18565622 [0,1,0,0,1,0|2,0,0]=4 3861 B10R1.13 O=[13C](Cl)c1ccc(Cl)cc1 Amb22367579 [0,1,0,0,1,0|1,0,0]=3 3862 B10R1.13 O=[13C](Cl)c1ccc(F)cc1 Amb22351347 [0,1,0,0,1,0|1,0,0]=3 3863 B10R1.13 O=[S-](=O)c1ccc(cc1)F Amb13881372 [0,1,0,0,1,0|1,0,1]=4 3864 B10R1.13 OB(O)c1ccc(Cl)cc1 Amb22587705 [0,1,0,0,1,0|1,0,1]=4 3865 B10R1.13 OB(c1ccc(cc1)Br)O Amb2447085 [0,1,0,0,1,0|1,0,1]=4 3866 B10R1.13 OB(c1ccc(cc1)C)O Amb2447083 [0,1,0,0,1,0|1,0,1]=4 3867 B10R1.13 OB(c1ccc(cc1)Cl)O Amb2383484 [0,1,0,0,1,0|1,0,1]=4 3868 B10R1.13 OB(c1ccc(cc1)F)O Amb2383483 [0,1,0,0,1,0|1,0,1]=4 3869 B10R1.13 OB(c1ccc(cc1)N)O Amb10068599 [0,1,0,0,1,0|1,0,1]=4 3870 B10R1.13 OB(c1ccc(cc1)N)O Amb2455636 [0,1,0,0,1,0|1,0,1]=4 3871 B10R1.13 OB(c1ccc(cc1)S)O Amb2447100 [0,1,0,0,1,0|1,0,1]=4 3872 B10R1.13 OC(=O)C1=CNC(=O)C=N1 Amb18278228 [0,1,0,0,1,0|2,0,0]=4 3873 B10R1.13 OC(=O)C1=CNC(=O)N=C1 Amb18643480 [0,1,0,0,1,0|2,0,0]=4 3874 B10R1.13 OC(=O)C=1C=CC(=O)NC1 Amb18028595 [0,1,0,0,1,0|1,0,0]=3 3875 B10R1.13 OC(=O)C=1C=CC(=O)NN1 Amb18013052 [0,1,0,0,1,0|2,0,0]=4 3876 B10R1.13 OC(=O)C=1C=CC(=O)NN1 Amb19894728 [0,1,0,0,1,0|2,0,0]=4 3877 B10R1.13 OC(=O)C=1C=CC(=O)OC1 Amb19723416 [0,1,0,0,1,0|1,0,0]=3 3878 B10R1.13 OC(=O)C=1C=CC(=O)OC1 Amb20661802 [0,1,0,0,1,0|1,0,0]=3 3879 B10R1.13 OC(=O)C=1C=CC(=S)NC1 Amb18947773 [0,1,0,0,1,0|1,0,0]=3 3880 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c](Br)[13cH][13cH]1 Amb22336507 [0,1,0,0,1,0|0,0,0]=2 3881 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c](Cl)[13cH][13cH]1 Amb22336969 [0,1,0,0,1,0|0,0,0]=2 3882 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c]([13cH][13cH]1)N Amb17607883 [0,1,0,0,1,0|0,0,0]=2 3883 B10R1.13 OC(=O)c1[n]cc(F)c[n]1 Amb21858020 [0,1,0,0,1,0|2,0,0]=4 3884 B10R1.13 OC(=O)c1c[n]c(Br)[n]c1 Amb25775393 [0,1,0,0,1,0|2,0,0]=4 3885 B10R1.13 OC(=O)c1c[n]c(Br)c[n]1 Amb18176908 [0,1,0,0,1,0|2,0,0]=4 3886 B10R1.13 OC(=O)c1c[n]c(F)[n]c1 Amb25126926 [0,1,0,0,1,0|2,0,0]=4 3887 B10R1.13 OC(=O)c1c[n]c(I)[n]c1 Amb25147776 [0,1,0,0,1,0|2,0,0]=4 3888 B10R1.13 OC(=O)c1c[n]c(I)c[n]1 Amb25771119 [0,1,0,0,1,0|2,0,0]=4 3889 B10R1.13 OC(=O)c1c[n]c(S)c[n]1 Amb24480656 [0,1,0,0,1,0|2,0,0]=4 3890 B10R1.13 OC(=O)c1ccc(Cl)[n][n]1 Amb19889556 [0,1,0,0,1,0|2,0,0]=4 3891 B10R1.13 OC(=O)c1ccc(Cl)cc1 Amb22432829 [0,1,0,0,1,0|0,0,0]=2 3892 B10R1.13 OC(=O)c1ccc(Cl)cc1 Amb22445441 [0,1,0,0,1,0|0,0,0]=2 3893 B10R1.13 OC(=O)c1ccc(O)cc1 Amb22338464 [0,1,0,0,1,0|0,0,0]=2 3894 B10R1.13 OC(=O)c1ccc(O)nn1 Amb17755179 [0,1,0,0,1,0|2,0,0]=4 3895 B10R1.13 OC(=O)c1ccc(O)nn1 Amb17935842 [0,1,0,0,1,0|2,0,0]=4 3896 B10R1.13 OC(=O)c1ccc(S)[n][n]1 Amb18945341 [0,1,0,0,1,0|2,0,0]=4 3897 B10R1.13 OC(=O)c1ccc(S)c[n]1 Amb18644721 [0,1,0,0,1,0|1,0,0]=3 3898 B10R1.13 OC(=O)c1ccc(cc1)Br Amb1935068 [0,1,0,0,1,0|0,0,0]=2 3899 B10R1.13 OC(=O)c1ccc(cc1)S Amb2371749 [0,1,0,0,1,0|0,0,0]=2 3900 B10R1.13 OC(=O)c1ccc(cc1)[Hg+] Amb17610950 [0,1,0,0,1,0|0,0,0]=2 3901 B10R1.13 OC(=O)c1cnc(nc1)Cl Amb10067813 [0,1,0,0,1,0|2,0,0]=4 3902 B10R1.13 OC(=O)c1ncc(cn1)C Amb10602959 [0,1,0,0,1,0|2,0,0]=4 3903 B10R1.13 OP(=O)c1ccc(Br)cc1 Amb21963574 [0,1,0,0,1,0|1,0,0]=3 3904 B10R1.13 OS(=O)c1ccc(Br)cc1 Amb18570792 [0,1,0,0,1,0|1,0,0]=3 3905 B10R1.13 OS(=O)c1ccc(Cl)cc1 Amb18564047 [0,1,0,0,1,0|1,0,0]=3 3906 B10R1.13 OS(=O)c1ccc(F)[n]c1 Amb24599331 [0,1,0,0,1,0|2,0,0]=4 3907 B10R1.13 OS(=O)c1ccc(F)cc1 Amb18065461 [0,1,0,0,1,0|1,0,0]=3 3908 B10R1.13 O[13C](=O)c1ccc(Cl)cc1 Amb22367343 [0,1,0,0,1,0|0,0,0]=2 3909 B10R1.13 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)C(O)=O Amb22367403 [0,1,0,0,1,0|0,0,0]=2 3910 B10R1.13 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)[13C](O)=O Amb22367323 [0,1,0,0,1,0|0,0,0]=2 3911 B10R1.13 Oc1c[n]c([n]c1)C(O)=O Amb18831952 [0,1,0,0,1,0|2,0,0]=4 3912 B10R1.13 Oc1ccc([p]c1)C(O)=O Amb25321003 [0,1,0,0,1,0|1,0,0]=3 3913 B10R1.13 Oc1ccc(cc1)B(O)O Amb2447026 [0,1,0,0,1,0|1,0,1]=4 3914 B10R1.13 Oc1ccc(cc1)C(=O)Br Amb24070379 [0,1,0,0,1,0|1,0,0]=3 3915 B10R1.13 Oc1ccc(cc1)C(=O)F Amb25736983 [0,1,0,0,1,0|1,0,0]=3 3916 B10R1.13 Oc1ccc(cc1)C(=O)O Amb2569657 [0,1,0,0,1,0|0,0,0]=2 3917 B10R1.13 Oc1ccc(cc1)C(O)=S Amb24476276 [0,1,0,0,1,0|0,1,0]=3 3918 B10R1.13 Oc1ccc(cc1)C(O)O Amb24478338 [0,1,0,0,1,0|0,0,2]=4 3919 B10R1.13 Oc1ccc(cc1)N(=O)=O Amb20621866 [0,1,0,0,1,0|1,0,1]=4 3920 B10R1.13 Oc1ccc(cc1)S(=O)=O Amb25321036 [0,1,0,0,1,0|1,0,1]=4 3921 B10R1.13 Oc1ccc(cc1)[13C](O)=O Amb22353368 [0,1,0,0,1,0|0,0,0]=2 3922 B10R1.13 Oc1ccc(cc1)[15N+](=O)[O-] Amb17618438 [0,1,0,0,1,0|1,0,1]=4 3923 B10R1.13 Oc1ccc(cc1)[N+]([O-])=O Amb17679040 [0,1,0,0,1,0|1,0,1]=4 3924 B10R1.13 Oc1ccc(cn1)C(=O)N Amb2371669 [0,1,0,0,1,0|2,0,0]=4 3925 B10R1.13 Oc1ccc(cn1)C(=O)O Amb1085852 [0,1,0,0,1,0|1,0,0]=3 3926 B10R1.13 Oc1ccc(nc1)C(=O)C Amb16231971 [0,1,0,0,1,0|2,0,0]=4 3927 B10R1.13 Oc1ccc(nc1)C(=O)O Amb2235994 [0,1,0,0,1,0|1,0,0]=3 3928 B10R1.13 Oc1ncc(cn1)C(=O)O Amb10067812 [0,1,0,0,1,0|2,0,0]=4 3929 B10R1.13 [15NH2]c1ccc(cc1)[15N+]([O-])=O Amb22338600 [0,1,0,0,1,0|1,0,1]=4 3930 B10R1.13 [2H]C(=O)c1ccc(O)cc1 Amb22367155 [0,1,0,0,1,0|1,0,0]=3 3931 B10R1.13 [2H]c1ccc(cc1)C(O)=O Amb22345875 [0,1,0,0,1,0|0,0,0]=2 3932 B10R1.13 [O-]C(=O)c1cc[n+](cc1)N Amb10560830 [0,1,0,0,1,0|1,0,1]=4 3933 B10R1.13 [O-]C(=O)c1ccc(Br)c[n]1 Amb21927969 [0,1,0,0,1,0|1,0,1]=4 3934 B10R1.13 [O-]C(=O)c1ccc(I)cc1 Amb22347262 [0,1,0,0,1,0|0,0,1]=3 3935 B10R1.13 [O-]S(=O)c1ccc(Br)cc1 Amb17871926 [0,1,0,0,1,0|1,0,1]=4 3936 B10R1.13 [O-]S(=O)c1ccc(Cl)cc1 Amb22167650 [0,1,0,0,1,0|1,0,1]=4 3937 B10R1.13 [O-]S(=O)c1ccc(F)cc1 Amb22899783 [0,1,0,0,1,0|1,0,1]=4 3938 B10R1.13 [O-]S(=O)c1ccc(I)cc1 Amb24589703 [0,1,0,0,1,0|1,0,1]=4 3939 B10R1.13 [O-][N+](=O)[13c]1[13cH][13cH][13c](Br)[13cH][13cH]1 Amb22338850 [0,1,0,0,1,0|1,0,1]=4 3940 B10R1.13 [O-][N+](=O)c1c[13cH][13c](O)[13cH]c1 Amb22055938 [0,1,0,0,1,0|1,0,1]=4 3941 B10R1.13 [O-]c1ccc(cc1)[N+]([O-])=O Amb24308951 [0,1,0,0,1,0|1,0,1]=4 3942 B10R1.28 CP(C)(=O)c1ccccc1 Amb19925666 [0,1,0,0,1,0|2,0,0]=4 3943 B10R1.28 CP(O)(=O)c1ccccc1 Amb22052646 [0,1,0,0,1,0|1,0,0]=3 3944 B10R1.28 CS(=N)(=O)c1ccccc1 Amb17768294 [0,1,0,0,1,0|2,0,0]=4 3945 B10R1.28 CS(=O)(=O)c1ccccc1 Amb2419479 [0,1,0,0,1,0|1,0,1]=4 3946 B10R1.28 CS(N)(=O)c1ccccc1 Amb17774672 [0,1,0,0,1,0|2,0,0]=4 3947 B10R1.28 C[S@@](=O)(=N)c1ccccc1 Amb17617583 [0,1,0,0,1,0|2,0,0]=4 3948 B10R1.28 NS(=O)(=O)c1ccccc1 Amb1134014 [0,1,0,0,1,0|1,0,1]=4 3949 B10R1.28 O=S(=O)(Cl)c1ccccc1 Amb22169434 [0,1,0,0,1,0|1,0,1]=4 3950 B10R1.28 O=S(=O)([S-])c1ccccc1 Amb22730319 [0,1,0,0,1,0|1,0,1]=4 3951 B10R1.28 OP(O)(=O)c1c[n]ccc1 Amb24407299 [0,1,0,0,1,0|2,0,0]=4 3952 B10R1.28 OP(O)(=O)c1cc[n]cc1 Amb25295220 [0,1,0,0,1,0|2,0,0]=4 3953 B10R1.28 OS(=O)(=O)c1ccccc1 Amb16233878 [0,1,0,0,1,0|1,0,0]=3 3954 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22347475 [0,1,0,0,1,0|1,0,0]=3 3955 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22350405 [0,1,0,0,1,0|1,0,0]=3 3956 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22406404 [0,1,0,0,1,0|1,0,0]=3 3957 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22490259 [0,1,0,0,1,0|1,0,0]=3 3958 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22491846 [0,1,0,0,1,0|1,0,0]=3 3959 B10R1.28 OS(=O)(=O)c1cccnc1 Amb2553269 [0,1,0,0,1,0|2,0,0]=4 3960 B10R1.28 OS(=O)(=O)c1ccncc1 Amb10071269 [0,1,0,0,1,0|2,0,0]=4 3961 B10R1.28 O[B-](O)(O)c1ccccc1 Amb24323454 [0,1,0,0,1,0|1,0,1]=4 3962 B10R1.28 [13CH3]S(=O)(=O)c1ccccc1 Amb22055823 [0,1,0,0,1,0|1,0,1]=4 3963 B10R1.28 [2H]C([2H])(O)c1ccccc1 Amb22336509 [0,1,0,0,1,0|1,0,1]=4 3964 B10R1.28 [2H][13C]([2H])(O)c1ccccc1 Amb22353418 [0,1,0,0,1,0|1,0,1]=4 3965 B10R1.28 [O-]P([O-])(=O)c1ccccc1 Amb22366491 [0,1,0,0,1,0|1,0,1]=4 3966 B10R1.28 [O-]P([O-])(=O)c1ccccc1 Amb22730862 [0,1,0,0,1,0|1,0,1]=4 3967 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb1953809 [0,1,0,0,1,0|1,0,1]=4 3968 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb19957999 [0,1,0,0,1,0|1,0,1]=4 3969 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb22231402 [0,1,0,0,1,0|1,0,1]=4 3970 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb22366488 [0,1,0,0,1,0|1,0,1]=4 3971 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb22734771 [0,1,0,0,1,0|1,0,1]=4 3972 B10R1.28 [O-]S(=O)(=S)c1ccccc1 Amb22168151 [0,1,0,0,1,0|1,0,1]=4 3973 B10R1.28 [S-]S(=O)(=O)c1ccccc1 Amb17190275 [0,1,0,0,1,0|1,0,1]=4 3974 B10R1.61 CC(=C)c1ccccc1Br Amb25797043 [0,1,0,0,1,0|2,0,0]=4 3975 B10R1.61 CC(=C)c1ccccc1Cl Amb24720539 [0,1,0,0,1,0|2,0,0]=4 3976 B10R1.61 CC(=C)c1ccccc1O Amb18124426 [0,1,0,0,1,0|2,0,0]=4 3977 B10R1.61 CC(=N)c1ccccc1O Amb24505228 [0,1,0,0,1,0|2,0,0]=4 3978 B10R1.61 CC(=O)C1=CC=CNC1=O Amb18263217 [0,1,0,0,1,0|2,0,0]=4 3979 B10R1.61 CC(=O)C1=CNC=CC1=O Amb22522167 [0,1,0,0,1,0|2,0,0]=4 3980 B10R1.61 CC(=O)C1C=CC=CC1=C Amb24408031 [0,1,0,0,1,0|1,0,1]=4 3981 B10R1.61 CC(=O)c1[n]cccc1Br Amb19959407 [0,1,0,0,1,0|2,0,0]=4 3982 B10R1.61 CC(=O)c1[n]cccc1Cl Amb22233858 [0,1,0,0,1,0|2,0,0]=4 3983 B10R1.61 CC(=O)c1[n]cccc1I Amb23402738 [0,1,0,0,1,0|2,0,0]=4 3984 B10R1.61 CC(=O)c1c[n]ccc1F Amb22233738 [0,1,0,0,1,0|2,0,0]=4 3985 B10R1.61 CC(=O)c1c[n]ccc1N Amb23401918 [0,1,0,0,1,0|2,0,0]=4 3986 B10R1.61 CC(=O)c1cc[n]cc1Br Amb21858252 [0,1,0,0,1,0|2,0,0]=4 3987 B10R1.61 CC(=O)c1cc[n]cc1Cl Amb22494032 [0,1,0,0,1,0|2,0,0]=4 3988 B10R1.61 CC(=O)c1cc[n]cc1I Amb24638217 [0,1,0,0,1,0|2,0,0]=4 3989 B10R1.61 CC(=O)c1cc[n]cc1O Amb18643112 [0,1,0,0,1,0|2,0,0]=4 3990 B10R1.61 CC(=O)c1ccc[n]c1O Amb18832396 [0,1,0,0,1,0|2,0,0]=4 3991 B10R1.61 CC(=O)c1cccc[n+]1C Amb10573498 [0,1,0,0,1,0|2,0,0]=4 3992 B10R1.61 CC(=O)c1ccccc1Br Amb1232838 [0,1,0,0,1,0|1,0,0]=3 3993 B10R1.61 CC(=O)c1ccccc1S Amb22396354 [0,1,0,0,1,0|1,0,0]=3 3994 B10R1.61 CC(=O)c1cccnc1Br Amb10602206 [0,1,0,0,1,0|2,0,0]=4 3995 B10R1.61 CC(=O)c1cccnc1F Amb2447597 [0,1,0,0,1,0|2,0,0]=4 3996 B10R1.61 CC(=O)c1ccncc1F Amb10603317 [0,1,0,0,1,0|2,0,0]=4 3997 B10R1.61 CC(=O)c1ncccc1C Amb10067752 [0,1,0,0,1,0|2,0,0]=4 3998 B10R1.61 CC(=O)c1ncccc1O Amb16233269 [0,1,0,0,1,0|2,0,0]=4 3999 B10R1.61 CC(=S)c1ccccc1F Amb25114147 [0,1,0,0,1,0|1,1,0]=4 4000 B10R1.61 CC(=S)c1ccccc1O Amb25116058 [0,1,0,0,1,0|1,1,0]=4 4001 B10R1.61 CC(O)c1ccccc1I Amb24644378 [0,1,0,0,1,0|1,0,1]=4 4002 B10R1.61 CC(c1ccccc1N)O Amb10609794 [0,1,0,0,1,0|1,0,1]=4 4003 B10R1.61 CC1OC=CC=C1C(O)=O Amb24065741 [0,1,0,0,1,0|1,0,1]=4 4004 B10R1.61 CC=1OC=CSC1C(O)=O Amb24480390 [0,1,0,0,1,0|2,0,0]=4 4005 B10R1.61 CS(=O)c1ccccc1Br Amb19891620 [0,1,0,0,1,0|2,0,0]=4 4006 B10R1.61 CS(=O)c1ccccc1F Amb10839323 [0,1,0,0,1,0|2,0,0]=4 4007 B10R1.61 CS(=O)c1ccccc1I Amb19930098 [0,1,0,0,1,0|2,0,0]=4 4008 B10R1.61 CS(=O)c1ccccc1N Amb18945203 [0,1,0,0,1,0|2,0,0]=4 4009 B10R1.61 CS(=O)c1ccccc1O Amb2420338 [0,1,0,0,1,0|2,0,0]=4 4010 B10R1.61 C[C@@H](c1ccccc1F)O Amb10838300 [0,1,0,0,1,0|1,0,1]=4 4011 B10R1.61 C[C@H](O)c1ccccc1O Amb24476869 [0,1,0,0,1,0|1,0,1]=4 4012 B10R1.61 C[C@H](c1ccccc1F)O Amb10838298 [0,1,0,0,1,0|1,0,1]=4 4013 B10R1.61 C[n+]1ccccc1C(O)=O Amb22450577 [0,1,0,0,1,0|1,0,0]=3 4014 B10R1.61 C[n+]1ccccc1C([O-])=O Amb21855915 [0,1,0,0,1,0|1,0,1]=4 4015 B10R1.61 C\C(\N)=C/1\C=CC=CC1=O Amb25147320 [0,1,0,0,1,0|2,0,0]=4 4016 B10R1.61 C\C(\N)=C\1/C=CC=CC1=O Amb24583511 [0,1,0,0,1,0|2,0,0]=4 4017 B10R1.61 C\C(\O)=C/1\C=CC=CC1=C Amb25269599 [0,1,0,0,1,0|1,0,0]=3 4018 B10R1.61 C\C(\O)=C/1\C=CN=CC1=O Amb25797219 [0,1,0,0,1,0|2,0,0]=4 4019 B10R1.61 Cc1[n][n]ccc1C(O)=O Amb18832267 [0,1,0,0,1,0|2,0,0]=4 4020 B10R1.61 Cc1[n]cccc1C(C)=O Amb18832502 [0,1,0,0,1,0|2,0,0]=4 4021 B10R1.61 Cc1[n]cccc1C(O)=O Amb19514954 [0,1,0,0,1,0|1,0,0]=3 4022 B10R1.61 Cc1c[n][n]cc1C(O)=O Amb18832259 [0,1,0,0,1,0|2,0,0]=4 4023 B10R1.61 Cc1c[n]c[n]c1C(O)=O Amb22497343 [0,1,0,0,1,0|2,0,0]=4 4024 B10R1.61 Cc1c[n]ccc1C(C)=O Amb25757892 [0,1,0,0,1,0|2,0,0]=4 4025 B10R1.61 Cc1c[n]ccc1C(O)=O Amb22490345 [0,1,0,0,1,0|1,0,0]=3 4026 B10R1.61 Cc1cc[n][n]c1C(O)=O Amb22276547 [0,1,0,0,1,0|2,0,0]=4 4027 B10R1.61 Cc1cc[n]cc1C(C)=O Amb21964244 [0,1,0,0,1,0|2,0,0]=4 4028 B10R1.61 Cc1ccc[n]c1C(=O)Cl Amb18947043 [0,1,0,0,1,0|2,0,0]=4 4029 B10R1.61 Cc1ccc[n]c1C(O)=O Amb21964439 [0,1,0,0,1,0|1,0,0]=3 4030 B10R1.61 Cc1ccccc1C(=C)I Amb25289651 [0,1,0,0,1,0|2,0,0]=4 4031 B10R1.61 Cc1ccccc1C(Br)=O Amb17844075 [0,1,0,0,1,0|1,0,0]=3 4032 B10R1.61 Cc1ccccc1C(C)=C Amb22043466 [0,1,0,0,1,0|2,0,0]=4 4033 B10R1.61 Cc1ccccc1C(O)=S Amb20242952 [0,1,0,0,1,0|0,1,0]=3 4034 B10R1.61 Cc1ccccc1S(=O)Cl Amb25179881 [0,1,0,0,1,0|2,0,0]=4 4035 B10R1.61 Cc1ccccc1S(C)=O Amb25092647 [0,1,0,0,1,0|2,0,0]=4 4036 B10R1.61 Cc1ccccc1S(O)=O Amb24093011 [0,1,0,0,1,0|1,0,0]=3 4037 B10R1.61 Cc1ccccc1S([O-])=O Amb19944452 [0,1,0,0,1,0|1,0,1]=4 4038 B10R1.61 ClC(=O)c1cccnc1C Amb16230804 [0,1,0,0,1,0|2,0,0]=4 4039 B10R1.61 ClC(=O)c1cccnc1F Amb16230805 [0,1,0,0,1,0|2,0,0]=4 4040 B10R1.61 ClC(=O)c1cnccc1C Amb16230802 [0,1,0,0,1,0|2,0,0]=4 4041 B10R1.61 ClC(=O)c1cnccc1Cl Amb16230803 [0,1,0,0,1,0|2,0,0]=4 4042 B10R1.61 N=S(=O)c1ccccc1F Amb25760993 [0,1,0,0,1,0|2,0,0]=4 4043 B10R1.61 NC(=N)c1ccccc1Br Amb19432125 [0,1,0,0,1,0|2,0,0]=4 4044 B10R1.61 NC(=N)c1ccccc1C Amb10607001 [0,1,0,0,1,0|2,0,0]=4 4045 B10R1.61 NC(=O)C1=CC=COC1=O Amb25824623 [0,1,0,0,1,0|2,0,0]=4 4046 B10R1.61 NC(=O)c1[n]cccc1Br Amb23555628 [0,1,0,0,1,0|2,0,0]=4 4047 B10R1.61 NC(=O)c1[n]cccc1Cl Amb23399605 [0,1,0,0,1,0|2,0,0]=4 4048 B10R1.61 NC(=O)c1[n]cccc1F Amb23412448 [0,1,0,0,1,0|2,0,0]=4 4049 B10R1.61 NC(=O)c1[n]cccc1S Amb25114764 [0,1,0,0,1,0|2,0,0]=4 4050 B10R1.61 NC(=O)c1cc[n]cc1Br Amb19957712 [0,1,0,0,1,0|2,0,0]=4 4051 B10R1.61 NC(=O)c1cc[n]cc1Cl Amb22490741 [0,1,0,0,1,0|2,0,0]=4 4052 B10R1.61 NC(=O)c1cc[n]cc1F Amb20241733 [0,1,0,0,1,0|2,0,0]=4 4053 B10R1.61 NC(=O)c1cc[n]cc1I Amb25204440 [0,1,0,0,1,0|2,0,0]=4 4054 B10R1.61 NC(=O)c1cc[n]cc1O Amb23401565 [0,1,0,0,1,0|2,0,0]=4 4055 B10R1.61 NC(=O)c1cc[n]cc1S Amb25263979 [0,1,0,0,1,0|2,0,0]=4 4056 B10R1.61 NC(=O)c1ccc[n]c1O Amb18643213 [0,1,0,0,1,0|2,0,0]=4 4057 B10R1.61 NC(=O)c1cccc[n+]1C Amb2228078 [0,1,0,0,1,0|2,0,0]=4 4058 B10R1.61 NC(=O)c1ccccc1F Amb1221270 [0,1,0,0,1,0|1,0,0]=3 4059 B10R1.61 NC(=O)c1ccccc1I Amb2384520 [0,1,0,0,1,0|1,0,0]=3 4060 B10R1.61 NC(=O)c1ccccc1N Amb1212111 [0,1,0,0,1,0|1,0,0]=3 4061 B10R1.61 NC(=O)c1ccccc1O Amb1935248 [0,1,0,0,1,0|1,0,0]=3 4062 B10R1.61 NC(=O)c1cccnc1C Amb16231197 [0,1,0,0,1,0|2,0,0]=4 4063 B10R1.61 NC(=O)c1cccnc1Cl Amb1239475 [0,1,0,0,1,0|2,0,0]=4 4064 B10R1.61 NC(=O)c1cccnc1F Amb16231205 [0,1,0,0,1,0|2,0,0]=4 4065 B10R1.61 NC(=O)c1cccnc1N Amb13951562 [0,1,0,0,1,0|2,0,0]=4 4066 B10R1.61 NC(=O)c1cccnc1S Amb1131765 [0,1,0,0,1,0|2,0,0]=4 4067 B10R1.61 NC(=O)c1ccncc1C Amb10602336 [0,1,0,0,1,0|2,0,0]=4 4068 B10R1.61 NC(=O)c1ccncc1N Amb10069339 [0,1,0,0,1,0|2,0,0]=4 4069 B10R1.61 NC(=O)c1cnccc1Cl Amb16231200 [0,1,0,0,1,0|2,0,0]=4 4070 B10R1.61 NC(=S)c1ccccc1F Amb1264600 [0,1,0,0,1,0|1,1,0]=4 4071 B10R1.61 NC(=S)c1ccccc1I Amb19889459 [0,1,0,0,1,0|1,1,0]=4 4072 B10R1.61 NC(=S)c1ccccc1N Amb1217775 [0,1,0,0,1,0|1,1,0]=4 4073 B10R1.61 NC(=S)c1ccccc1S Amb25041798 [0,1,0,0,1,0|1,1,0]=4 4074 B10R1.61 Nc1[n][n]ccc1C(O)=O Amb19929599 [0,1,0,0,1,0|2,0,0]=4 4075 B10R1.61 Nc1[n]c[n]cc1C(O)=O Amb24063121 [0,1,0,0,1,0|2,0,0]=4 4076 B10R1.61 Nc1[n]cccc1C(=O)Cl Amb24106227 [0,1,0,0,1,0|2,0,0]=4 4077 B10R1.61 Nc1c[n][n]cc1C(O)=O Amb22011695 [0,1,0,0,1,0|2,0,0]=4 4078 B10R1.61 Nc1c[n]ccc1C(N)=O Amb19374970 [0,1,0,0,1,0|2,0,0]=4 4079 B10R1.61 Nc1c[n]ccc1C(O)=O Amb23400907 [0,1,0,0,1,0|1,0,0]=3 4080 B10R1.61 Nc1cc[n][n]c1C(O)=O Amb22899494 [0,1,0,0,1,0|2,0,0]=4 4081 B10R1.61 Nc1cc[n]cc1C(N)=O Amb21927713 [0,1,0,0,1,0|2,0,0]=4 4082 B10R1.61 Nc1cc[n]cc1C(O)=O Amb24065823 [0,1,0,0,1,0|1,0,0]=3 4083 B10R1.61 Nc1ccc[n]c1C(O)=O Amb22276123 [0,1,0,0,1,0|1,0,0]=3 4084 B10R1.61 Nc1ccccc1C(=O)Cl Amb20620197 [0,1,0,0,1,0|1,0,0]=3 4085 B10R1.61 Nc1ccccc1C(=O)S Amb24563424 [0,1,0,0,1,0|0,1,0]=3 4086 B10R1.61 Nc1ccccc1C(N)=N Amb24559098 [0,1,0,0,1,0|2,0,0]=4 4087 B10R1.61 Nc1ccccc1N(=O)=O Amb20621758 [0,1,0,0,1,0|1,0,1]=4 4088 B10R1.61 Nc1ccccc1S(O)=O Amb25351788 [0,1,0,0,1,0|1,0,0]=3 4089 B10R1.61 Nc1ccccc1[N+]([O-])=O Amb22277145 [0,1,0,0,1,0|1,0,1]=4 4090 B10R1.61 O=C(Cl)c1[n]cccc1Br Amb24382658 [0,1,0,0,1,0|2,0,0]=4 4091 B10R1.61 O=C(Cl)c1cc[n]cc1Br Amb24668867 [0,1,0,0,1,0|2,0,0]=4 4092 B10R1.61 O=C(Cl)c1cc[n]cc1Cl Amb24117133 [0,1,0,0,1,0|2,0,0]=4 4093 B10R1.61 O=C(Cl)c1cc[n]cc1F Amb22735608 [0,1,0,0,1,0|2,0,0]=4 4094 B10R1.61 O=C(Cl)c1ccc[n]c1S Amb19930039 [0,1,0,0,1,0|2,0,0]=4 4095 B10R1.61 O=C(Cl)c1ccccc1S Amb25770152 [0,1,0,0,1,0|1,0,0]=3 4096 B10R1.61 O=C(F)c1ccc[n]c1F Amb24084242 [0,1,0,0,1,0|2,0,0]=4 4097 B10R1.61 O=C1C=CC=CC1=C(F)F Amb24478251 [0,1,0,0,1,0|2,0,0]=4 4098 B10R1.61 O=C1C=CSC=C1C(=O)Cl Amb24079578 [0,1,0,0,1,0|2,0,0]=4 4099 B10R1.61 O=C1OC=CC=C1C(=O)Cl Amb24428929 [0,1,0,0,1,0|2,0,0]=4 4100 B10R1.61 O=N(=O)c1ccccc1Cl Amb20621781 [0,1,0,0,1,0|1,0,1]=4 4101 B10R1.61 O=N(=O)c1ccccc1F Amb20621321 [0,1,0,0,1,0|1,0,1]=4 4102 B10R1.61 O=N(=O)c1ccccc1I Amb20621837 [0,1,0,0,1,0|1,0,1]=4 4103 B10R1.61 O=S(Cl)c1ccccc1Cl Amb25286319 [0,1,0,0,1,0|2,0,0]=4 4104 B10R1.61 O=S(Cl)c1ccccc1F Amb25371664 [0,1,0,0,1,0|2,0,0]=4 4105 B10R1.61 OB(O)c1ccccc1S Amb19958291 [0,1,0,0,1,0|1,0,1]=4 4106 B10R1.61 OB(c1ccccc1C)O Amb2447081 [0,1,0,0,1,0|1,0,1]=4 4107 B10R1.61 OB(c1ccccc1Cl)O Amb2383486 [0,1,0,0,1,0|1,0,1]=4 4108 B10R1.61 OB(c1ccccc1F)O Amb2447092 [0,1,0,0,1,0|1,0,1]=4 4109 B10R1.61 OB(c1ccccc1I)O Amb16234273 [0,1,0,0,1,0|1,0,1]=4 4110 B10R1.61 OB(c1ccccc1N)O Amb2455634 [0,1,0,0,1,0|1,0,1]=4 4111 B10R1.61 OB(c1ccccc1N)O Amb2455781 [0,1,0,0,1,0|1,0,1]=4 4112 B10R1.61 OB(c1ccccc1O)O Amb2447024 [0,1,0,0,1,0|1,0,1]=4 4113 B10R1.61 OC(=O)C1=CC=CNC1=O Amb18832138 [0,1,0,0,1,0|1,0,0]=3 4114 B10R1.61 OC(=O)C1=CC=CNC1=S Amb18799572 [0,1,0,0,1,0|1,0,0]=3 4115 B10R1.61 OC(=O)C1=CC=COC1=O Amb19894956 [0,1,0,0,1,0|1,0,0]=3 4116 B10R1.61 OC(=O)C1=CC=NNC1=O Amb18643481 [0,1,0,0,1,0|2,0,0]=4 4117 B10R1.61 OC(=O)C1=CN=CCC1=O Amb24062424 [0,1,0,0,1,0|1,0,1]=4 4118 B10R1.61 OC(=O)C1=CN=CNC1=O Amb18279550 [0,1,0,0,1,0|2,0,0]=4 4119 B10R1.61 OC(=O)C1=CNC=CC1=O Amb22489507 [0,1,0,0,1,0|1,0,0]=3 4120 B10R1.61 OC(=O)C1=CNC=NC1=O Amb20630296 [0,1,0,0,1,0|2,0,0]=4 4121 B10R1.61 OC(=O)C1=CNN=CC1=O Amb18202917 [0,1,0,0,1,0|2,0,0]=4 4122 B10R1.61 OC(=O)C1=COC=CC1=O Amb25774589 [0,1,0,0,1,0|1,0,0]=3 4123 B10R1.61 OC(=O)C1=NC=CNC1=O Amb21936458 [0,1,0,0,1,0|2,0,0]=4 4124 B10R1.61 OC(=O)C1=[N](O)C=CC=C1 Amb17842698 [0,1,0,0,1,0|1,0,0]=3 4125 B10R1.61 OC(=O)N1C=CC=CC1=O Amb24060019 [0,1,0,0,1,0|1,0,0]=3 4126 B10R1.61 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13c]1O Amb17620019 [0,1,0,0,1,0|0,0,0]=2 4127 B10R1.61 OC(=O)c1[n][n]ccc1Br Amb25858921 [0,1,0,0,1,0|2,0,0]=4 4128 B10R1.61 OC(=O)c1[n][n]ccc1I Amb24741652 [0,1,0,0,1,0|2,0,0]=4 4129 B10R1.61 OC(=O)c1[n]c[n]cc1S Amb25693308 [0,1,0,0,1,0|2,0,0]=4 4130 B10R1.61 OC(=O)c1[n]cc[n]c1F Amb24419673 [0,1,0,0,1,0|2,0,0]=4 4131 B10R1.61 OC(=O)c1[n]cc[n]c1I Amb19957728 [0,1,0,0,1,0|2,0,0]=4 4132 B10R1.61 OC(=O)c1[n]cc[n]c1S Amb18279791 [0,1,0,0,1,0|2,0,0]=4 4133 B10R1.61 OC(=O)c1[n]cccc1F Amb22497209 [0,1,0,0,1,0|1,0,0]=3 4134 B10R1.61 OC(=O)c1[n]cccc1S Amb18644720 [0,1,0,0,1,0|1,0,0]=3 4135 B10R1.61 OC(=O)c1c[n]c[n]c1Br Amb25187297 [0,1,0,0,1,0|2,0,0]=4 4136 B10R1.61 OC(=O)c1c[n]c[n]c1Cl Amb22494597 [0,1,0,0,1,0|2,0,0]=4 4137 B10R1.61 OC(=O)c1c[n]cc[n]1=O Amb22388358 [0,1,0,0,1,0|2,0,0]=4 4138 B10R1.61 OC(=O)c1c[n]ccc1Br Amb21927781 [0,1,0,0,1,0|1,0,0]=3 4139 B10R1.61 OC(=O)c1cc[n][n]c1Cl Amb20240930 [0,1,0,0,1,0|2,0,0]=4 4140 B10R1.61 OC(=O)c1cc[n][n]c1S Amb25032119 [0,1,0,0,1,0|2,0,0]=4 4141 B10R1.61 OC(=O)c1cc[n]cc1S Amb18644719 [0,1,0,0,1,0|1,0,0]=3 4142 B10R1.61 OC(=O)c1ccc[n]c1I Amb22755748 [0,1,0,0,1,0|1,0,0]=3 4143 B10R1.61 OC(=O)c1ccccc1Cl Amb1935156 [0,1,0,0,1,0|0,0,0]=2 4144 B10R1.61 OC(=O)c1ccccc1Cl Amb22469215 [0,1,0,0,1,0|0,0,0]=2 4145 B10R1.61 OC(=O)c1ccccc1N Amb1933714 [0,1,0,0,1,0|0,0,0]=2 4146 B10R1.61 OC(=O)c1ccccc1O Amb11012607 [0,1,0,0,1,0|0,0,0]=2 4147 B10R1.61 OC(=O)c1ccccc1O Amb1912504 [0,1,0,0,1,0|0,0,0]=2 4148 B10R1.61 OC(=O)c1ccccc1O Amb22730296 [0,1,0,0,1,0|0,0,0]=2 4149 B10R1.61 OC(=O)c1cccnc1Br Amb2447561 [0,1,0,0,1,0|1,0,0]=3 4150 B10R1.61 OC(=O)c1cccnc1Cl Amb10602094 [0,1,0,0,1,0|1,0,0]=3 4151 B10R1.61 OC(=O)c1cccnc1F Amb2447268 [0,1,0,0,1,0|1,0,0]=3 4152 B10R1.61 OC(=O)c1cccnc1O Amb1950661 [0,1,0,0,1,0|1,0,0]=3 4153 B10R1.61 OC(=O)c1cccnc1S Amb1210101 [0,1,0,0,1,0|1,0,0]=3 4154 B10R1.61 OC(=O)c1ccncc1Br Amb1094019 [0,1,0,0,1,0|1,0,0]=3 4155 B10R1.61 OC(=O)c1ccncc1C Amb1950722 [0,1,0,0,1,0|1,0,0]=3 4156 B10R1.61 OC(=O)c1ccncc1Cl Amb2447292 [0,1,0,0,1,0|1,0,0]=3 4157 B10R1.61 OC(=O)c1ccncc1F Amb10840476 [0,1,0,0,1,0|1,0,0]=3 4158 B10R1.61 OC(=O)c1ccncc1F Amb2447421 [0,1,0,0,1,0|1,0,0]=3 4159 B10R1.61 OC(=O)c1ccncc1N Amb1058763 [0,1,0,0,1,0|1,0,0]=3 4160 B10R1.61 OC(=O)c1cnccc1C Amb1102435 [0,1,0,0,1,0|1,0,0]=3 4161 B10R1.61 OC(=O)c1cnccc1F Amb17942817 [0,1,0,0,1,0|1,0,0]=3 4162 B10R1.61 OC(=O)c1cnccc1N Amb10982498 [0,1,0,0,1,0|1,0,0]=3 4163 B10R1.61 OC(=O)c1cnccc1N Amb2404894 [0,1,0,0,1,0|1,0,0]=3 4164 B10R1.61 OC(=O)c1cnccc1O Amb1420333 [0,1,0,0,1,0|1,0,0]=3 4165 B10R1.61 OC(=O)c1cnccc1[2H] Amb17618350 [0,1,0,0,1,0|1,0,0]=3 4166 B10R1.61 OC(=O)c1cncnc1N Amb1093993 [0,1,0,0,1,0|2,0,0]=4 4167 B10R1.61 OC(=O)c1cncnc1O Amb16735285 [0,1,0,0,1,0|2,0,0]=4 4168 B10R1.61 OC(=O)c1ncccc1Br Amb2447560 [0,1,0,0,1,0|1,0,0]=3 4169 B10R1.61 OC(=O)c1ncccc1F Amb2447510 [0,1,0,0,1,0|1,0,0]=3 4170 B10R1.61 OC(=O)c1ncccc1I Amb10602322 [0,1,0,0,1,0|1,0,0]=3 4171 B10R1.61 OC(=O)c1nccnc1N Amb1148690 [0,1,0,0,1,0|2,0,0]=4 4172 B10R1.61 OS(=O)c1[n]cccc1F Amb24570698 [0,1,0,0,1,0|2,0,0]=4 4173 B10R1.61 OS(=O)c1ccccc1Br Amb24707545 [0,1,0,0,1,0|1,0,0]=3 4174 B10R1.61 OS(=O)c1ccccc1Cl Amb25174713 [0,1,0,0,1,0|1,0,0]=3 4175 B10R1.61 Oc1[n]cccc1C(=O)Cl Amb24371117 [0,1,0,0,1,0|2,0,0]=4 4176 B10R1.61 Oc1c[n]ccc1C(=O)Cl Amb24584161 [0,1,0,0,1,0|2,0,0]=4 4177 B10R1.61 Oc1ccccc1C(=O)Br Amb24084360 [0,1,0,0,1,0|1,0,0]=3 4178 B10R1.61 Oc1ccccc1C(O)=O Amb22395961 [0,1,0,0,1,0|0,0,0]=2 4179 B10R1.61 Oc1ccccc1C(O)=O Amb22552528 [0,1,0,0,1,0|0,0,0]=2 4180 B10R1.61 Oc1ccccc1C(O)=O Amb22731482 [0,1,0,0,1,0|0,0,0]=2 4181 B10R1.61 Oc1ccccc1C(O)=O Amb22731708 [0,1,0,0,1,0|0,0,0]=2 4182 B10R1.61 Oc1ccccc1C(O)=S Amb22734424 [0,1,0,0,1,0|0,1,0]=3 4183 B10R1.61 Oc1ccccc1S(O)=O Amb25044336 [0,1,0,0,1,0|1,0,0]=3 4184 B10R1.61 Oc1ccccc1[13C](O)=O Amb22367300 [0,1,0,0,1,0|0,0,0]=2 4185 B10R1.61 Oc1ccccc1[14C](O)=O Amb22349940 [0,1,0,0,1,0|0,0,0]=2 4186 B10R1.61 [13CH3]c1ccccc1[13C](O)=O Amb22056255 [0,1,0,0,1,0|0,0,0]=2 4187 B10R1.61 [O-]C(=O)c1cc[n]cc1F Amb22735737 [0,1,0,0,1,0|1,0,1]=4 4188 B10R1.61 [O-]C(=O)c1ccccc1Br Amb2227647 [0,1,0,0,1,0|0,0,1]=3 4189 B10R1.61 [O-]C(=O)c1ccccc1Cl Amb10071066 [0,1,0,0,1,0|0,0,1]=3 4190 B10R1.61 [O-]C(=O)c1ccccc1O Amb10807392 [0,1,0,0,1,0|0,0,1]=3 4191 B10R1.61 [O-]C(=O)c1ccccc1O Amb20246478 [0,1,0,0,1,0|0,0,1]=3 4192 B10R1.61 [O-]C(=O)c1ccccc1O Amb20246479 [0,1,0,0,1,0|0,0,1]=3 4193 B10R1.61 [O-]C(=O)c1ccccc1O Amb20246572 [0,1,0,0,1,0|0,0,1]=3 4194 B10R1.61 [O-]C(=O)c1ccccc1O Amb22051701 [0,1,0,0,1,0|0,0,1]=3 4195 B10R1.61 [O-]C(=O)c1ccccc1O Amb22166780 [0,1,0,0,1,0|0,0,1]=3 4196 B10R1.61 [O-]C(=O)c1ccccc1O Amb22338523 [0,1,0,0,1,0|0,0,1]=3 4197 B10R1.61 [O-]C(=O)c1ccccc1O Amb22351945 [0,1,0,0,1,0|0,0,1]=3 4198 B10R1.61 [O-]C(=O)c1ccccc1O Amb22474113 [0,1,0,0,1,0|0,0,1]=3 4199 B10R1.61 [O-]C(=O)c1ccccc1O Amb22728988 [0,1,0,0,1,0|0,0,1]=3 4200 B10R1.61 [O-]C(=O)c1ccccc1O Amb22730611 [0,1,0,0,1,0|0,0,1]=3 4201 B10R1.61 [O-]C(=O)c1ccccc1O Amb22732058 [0,1,0,0,1,0|0,0,1]=3 4202 B10R1.61 [O-]C(=O)c1ccccc1O Amb22732059 [0,1,0,0,1,0|0,0,1]=3 4203 B10R1.61 [O-]C(=O)c1ccccc1O Amb22734697 [0,1,0,0,1,0|0,0,1]=3 4204 B10R1.61 [O-]C(=O)c1ccccc1S Amb21928585 [0,1,0,0,1,0|0,0,1]=3 4205 B10R1.61 [O-]C(=O)c1ccccc1S Amb22729716 [0,1,0,0,1,0|0,0,1]=3 4206 B10R1.61 [O-]C(=O)c1ccccc1[S-] Amb20239365 [0,1,0,0,1,0|0,0,1]=3 4207 B10R1.61 [O-]C(=O)c1ncccc1Br Amb17610074 [0,1,0,0,1,0|1,0,1]=4 4208 B10R1.61 [O-]S(=O)c1ccccc1Br Amb19944407 [0,1,0,0,1,0|1,0,1]=4 4209 B10R1.61 [O-]S(=O)c1ccccc1Cl Amb19944419 [0,1,0,0,1,0|1,0,1]=4 4210 B10R1.61 [O-]S(=O)c1ccccc1F Amb19944444 [0,1,0,0,1,0|1,0,1]=4 4211 B10R1.61 [O-][N+](=O)c1ccccc1I Amb1151956 [0,1,0,0,1,0|1,0,1]=4 4212 B10R1.61 [O-][N+](=O)c1ccccc1S Amb2519390 [0,1,0,0,1,0|1,0,1]=4 4213 B10R1.61 [O-]c1ccccc1C([O-])=O Amb22045661 [0,1,0,0,1,0|0,0,1]=3 4214 B10R1.61 [O-]c1ccccc1[N+]([O-])=O Amb24309051 [0,1,0,0,1,0|1,0,1]=4 4215 B10R1.113 Brc1cccc(c1)B(O)O Amb2447244 [0,1,0,0,1,0|1,0,1]=4 4216 B10R1.113 Brc1cccc(c1)C(=N)N Amb10602273 [0,1,0,0,1,0|2,0,0]=4 4217 B10R1.113 Brc1cccc(c1)C(=S)N Amb1152669 [0,1,0,0,1,0|1,1,0]=4 4218 B10R1.113 Brc1cccc(c1)C(O)C Amb1109861 [0,1,0,0,1,0|1,0,1]=4 4219 B10R1.113 Brc1cccc(n1)C(=O)N Amb10068098 [0,1,0,0,1,0|2,0,0]=4 4220 B10R1.113 Brc1nccc(c1)C(=O)C Amb10069912 [0,1,0,0,1,0|2,0,0]=4 4221 B10R1.113 Brc1nccc(c1)C(=O)O Amb1353186 [0,1,0,0,1,0|1,0,0]=3 4222 B10R1.113 C=C(Br)c1cccc(N)c1 Amb25109648 [0,1,0,0,1,0|2,0,0]=4 4223 B10R1.113 C=C(Br)c1cccc(O)c1 Amb25130635 [0,1,0,0,1,0|2,0,0]=4 4224 B10R1.113 CC(=C)c1cccc(Br)c1 Amb24448711 [0,1,0,0,1,0|2,0,0]=4 4225 B10R1.113 CC(=C)c1cccc(Cl)c1 Amb24088166 [0,1,0,0,1,0|2,0,0]=4 4226 B10R1.113 CC(=C)c1cccc(F)c1 Amb25133875 [0,1,0,0,1,0|2,0,0]=4 4227 B10R1.113 CC(=C)c1cccc(O)c1 Amb18124424 [0,1,0,0,1,0|2,0,0]=4 4228 B10R1.113 CC(=O)C1=CC=CC(=O)N1 Amb22372289 [0,1,0,0,1,0|2,0,0]=4 4229 B10R1.113 CC(=O)C1=CC=CC(=S)N1 Amb24518912 [0,1,0,0,1,0|2,0,0]=4 4230 B10R1.113 CC(=O)c1c[n]cc(F)c1 Amb19374623 [0,1,0,0,1,0|2,0,0]=4 4231 B10R1.113 CC(=O)c1c[n]cc(F)c1 Amb22275941 [0,1,0,0,1,0|2,0,0]=4 4232 B10R1.113 CC(=O)c1c[n]cc(O)c1 Amb23399982 [0,1,0,0,1,0|2,0,0]=4 4233 B10R1.113 CC(=O)c1cc(Br)cc[n]1 Amb21858737 [0,1,0,0,1,0|2,0,0]=4 4234 B10R1.113 CC(=O)c1cc(Cl)ccn1 Amb10603326 [0,1,0,0,1,0|2,0,0]=4 4235 B10R1.113 CC(=O)c1cc(F)cc[n]1 Amb25689744 [0,1,0,0,1,0|2,0,0]=4 4236 B10R1.113 CC(=O)c1cc(N)cc[n]1 Amb23401922 [0,1,0,0,1,0|2,0,0]=4 4237 B10R1.113 CC(=O)c1cc(O)cc[n]1 Amb23399916 [0,1,0,0,1,0|2,0,0]=4 4238 B10R1.113 CC(=O)c1cc[n]c(Br)c1 Amb21964445 [0,1,0,0,1,0|2,0,0]=4 4239 B10R1.113 CC(=O)c1cc[n]c(N)c1 Amb18643066 [0,1,0,0,1,0|2,0,0]=4 4240 B10R1.113 CC(=O)c1cccc(F)[n]1 Amb21857925 [0,1,0,0,1,0|2,0,0]=4 4241 B10R1.113 CC(=O)c1cccc(N)[n]1 Amb23401921 [0,1,0,0,1,0|2,0,0]=4 4242 B10R1.113 CC(=O)c1cccc(S)c1 Amb19374493 [0,1,0,0,1,0|1,0,0]=3 4243 B10R1.113 CN1C=C(CC=C1)C(O)=O Amb24460814 [0,1,0,0,1,0|1,0,1]=4 4244 B10R1.113 CN1CC(=CC=C1)C(O)=O Amb24680947 [0,1,0,0,1,0|1,0,1]=4 4245 B10R1.113 CS(=O)c1cccc(Br)c1 Amb19891299 [0,1,0,0,1,0|2,0,0]=4 4246 B10R1.113 CS(=O)c1cccc(Cl)c1 Amb19892202 [0,1,0,0,1,0|2,0,0]=4 4247 B10R1.113 CS(=O)c1cccc(F)c1 Amb19892020 [0,1,0,0,1,0|2,0,0]=4 4248 B10R1.113 C[C@@H](O)c1cccc(I)c1 Amb25187293 [0,1,0,0,1,0|1,0,1]=4 4249 B10R1.113 C[N]1=CC(=CC=C1)C(N)=O Amb17836440 [0,1,0,0,1,0|2,0,0]=4 4250 B10R1.113 C[n+]1cc(ccc1)C(O)=O Amb22363937 [0,1,0,0,1,0|1,0,0]=3 4251 B10R1.113 C[n+]1cc(ccc1)C([O-])=O Amb18511714 [0,1,0,0,1,0|1,0,1]=4 4252 B10R1.113 C[n+]1cc(ncc1)C(=O)O Amb10573192 [0,1,0,0,1,0|2,0,0]=4 4253 B10R1.113 C[n+]1cccc(c1)C(=O)C Amb10573212 [0,1,0,0,1,0|2,0,0]=4 4254 B10R1.113 C[n+]1cccc(c1)C(=O)C Amb10573246 [0,1,0,0,1,0|2,0,0]=4 4255 B10R1.113 C[n+]1cccc(c1)C(=O)N Amb17617626 [0,1,0,0,1,0|2,0,0]=4 4256 B10R1.113 C[n+]1cccc(c1)C(N)=O Amb17778548 [0,1,0,0,1,0|2,0,0]=4 4257 B10R1.113 Cc1c[n]cc(c1)C(C)=O Amb21964245 [0,1,0,0,1,0|2,0,0]=4 4258 B10R1.113 Cc1cc([n][n]c1)C(O)=O Amb18832254 [0,1,0,0,1,0|2,0,0]=4 4259 B10R1.113 Cc1cc([n]c[n]1)C(O)=O Amb18948013 [0,1,0,0,1,0|2,0,0]=4 4260 B10R1.113 Cc1cc([n]cc1)C(=O)Cl Amb25697305 [0,1,0,0,1,0|2,0,0]=4 4261 B10R1.113 Cc1cc([n]cc1)C(O)=O Amb22490414 [0,1,0,0,1,0|1,0,0]=3 4262 B10R1.113 Cc1cc(c[n][n]1)C(O)=O Amb24505306 [0,1,0,0,1,0|2,0,0]=4 4263 B10R1.113 Cc1cc(cc[n]1)C(=O)Cl Amb25138191 [0,1,0,0,1,0|2,0,0]=4 4264 B10R1.113 Cc1cc(cc[n]1)C(C)=O Amb19957654 [0,1,0,0,1,0|2,0,0]=4 4265 B10R1.113 Cc1cc(cc[n]1)C(N)=O Amb22496777 [0,1,0,0,1,0|2,0,0]=4 4266 B10R1.113 Cc1cc(ccc1)C(N)=S Amb22047942 [0,1,0,0,1,0|1,1,0]=4 4267 B10R1.113 Cc1cc(ccc1)C(O)=S Amb24535989 [0,1,0,0,1,0|0,1,0]=3 4268 B10R1.113 Cc1cc(ccc1)C(O)O Amb24581716 [0,1,0,0,1,0|0,0,2]=4 4269 B10R1.113 Cc1cc(ccc1)S(=O)Cl Amb18065521 [0,1,0,0,1,0|2,0,0]=4 4270 B10R1.113 Cc1cc(ccc1)S(O)=O Amb18563469 [0,1,0,0,1,0|1,0,0]=3 4271 B10R1.113 Cc1cc(ccc1)S([O-])=O Amb19944453 [0,1,0,0,1,0|1,0,1]=4 4272 B10R1.113 Cc1cc(cnc1)C(=O)O Amb10068354 [0,1,0,0,1,0|1,0,0]=3 4273 B10R1.113 Cc1cc(ncc1)C(=O)N Amb16231199 [0,1,0,0,1,0|2,0,0]=4 4274 B10R1.113 Cc1cccc([n]1)C(O)=O Amb24081761 [0,1,0,0,1,0|1,0,0]=3 4275 B10R1.113 Cc1cccc(c1)B(O)O Amb22044323 [0,1,0,0,1,0|1,0,1]=4 4276 B10R1.113 Cc1cccc(c1)B(O)O Amb22044335 [0,1,0,0,1,0|1,0,1]=4 4277 B10R1.113 Cc1cccc(c1)B(O)O Amb22044591 [0,1,0,0,1,0|1,0,1]=4 4278 B10R1.113 Cc1cccc(c1)B(O)O Amb2447082 [0,1,0,0,1,0|1,0,1]=4 4279 B10R1.113 Cc1cccc(c1)C(=C)C Amb10844683 [0,1,0,0,1,0|2,0,0]=4 4280 B10R1.113 Cc1cccc(c1)S(C)=O Amb19892225 [0,1,0,0,1,0|2,0,0]=4 4281 B10R1.113 Cc1cccc(c1)[C@@H](C)O Amb24476868 [0,1,0,0,1,0|1,0,1]=4 4282 B10R1.113 Cc1cccc(c1)[C@H](C)O Amb25335556 [0,1,0,0,1,0|1,0,1]=4 4283 B10R1.113 Cc1cccc(n1)C(=O)C Amb10069245 [0,1,0,0,1,0|2,0,0]=4 4284 B10R1.113 Cc1cccc(n1)C(=O)Cl Amb10610376 [0,1,0,0,1,0|2,0,0]=4 4285 B10R1.113 Cc1nccc(n1)C(=O)O Amb10602122 [0,1,0,0,1,0|2,0,0]=4 4286 B10R1.113 Clc1cccc(c1)B(O)O Amb2383485 [0,1,0,0,1,0|1,0,1]=4 4287 B10R1.113 Clc1cccc(c1)C(=O)N Amb1218066 [0,1,0,0,1,0|1,0,0]=3 4288 B10R1.113 Clc1cccc(c1)C(=O)O Amb2223069 [0,1,0,0,1,0|0,0,0]=2 4289 B10R1.113 Clc1cccc(c1)C(=O)[O-] Amb10069116 [0,1,0,0,1,0|0,0,1]=3 4290 B10R1.113 Clc1cccc(c1)C(=S)N Amb1649396 [0,1,0,0,1,0|1,1,0]=4 4291 B10R1.113 Clc1cccc(n1)C(=O)C Amb10603338 [0,1,0,0,1,0|2,0,0]=4 4292 B10R1.113 Clc1cccc(n1)C(=O)O Amb1197598 [0,1,0,0,1,0|1,0,0]=3 4293 B10R1.113 Clc1ccnc(c1)C(=O)Cl Amb17611082 [0,1,0,0,1,0|2,0,0]=4 4294 B10R1.113 Clc1nccc(c1)C(=O)O Amb1221736 [0,1,0,0,1,0|1,0,0]=3 4295 B10R1.113 Fc1cccc(c1)B(O)O Amb2383489 [0,1,0,0,1,0|1,0,1]=4 4296 B10R1.113 Fc1cccc(c1)C(=S)N Amb1152618 [0,1,0,0,1,0|1,1,0]=4 4297 B10R1.113 Fc1cccc(n1)C(=O)N Amb10607167 [0,1,0,0,1,0|2,0,0]=4 4298 B10R1.113 Fc1nccc(c1)C(=O)C Amb10066942 [0,1,0,0,1,0|2,0,0]=4 4299 B10R1.113 Fc1nccc(c1)C(=O)Cl Amb17621620 [0,1,0,0,1,0|2,0,0]=4 4300 B10R1.113 Fc1nccc(c1)C(=O)N Amb13951683 [0,1,0,0,1,0|2,0,0]=4 4301 B10R1.113 Fc1nccc(c1)C(=O)O Amb2447269 [0,1,0,0,1,0|1,0,0]=3 4302 B10R1.113 Ic1nccc(c1)C(=O)N Amb10608176 [0,1,0,0,1,0|2,0,0]=4 4303 B10R1.113 N=C(O)c1cc(F)cc[n]1 Amb22411479 [0,1,0,0,1,0|2,0,0]=4 4304 B10R1.113 NC(=O)C1=CC(=O)NC=C1 Amb22489898 [0,1,0,0,1,0|2,0,0]=4 4305 B10R1.113 NC(=O)C1=CC=CC(=O)O1 Amb24622493 [0,1,0,0,1,0|2,0,0]=4 4306 B10R1.113 NC(=O)c1c[n]cc(Cl)c1 Amb19895235 [0,1,0,0,1,0|2,0,0]=4 4307 B10R1.113 NC(=O)c1c[n]cc(F)c1 Amb21856857 [0,1,0,0,1,0|2,0,0]=4 4308 B10R1.113 NC(=O)c1c[n]cc(I)c1 Amb24329332 [0,1,0,0,1,0|2,0,0]=4 4309 B10R1.113 NC(=O)c1cc(Br)ccn1 Amb2549772 [0,1,0,0,1,0|2,0,0]=4 4310 B10R1.113 NC(=O)c1cc(Br)cnc1 Amb2570605 [0,1,0,0,1,0|2,0,0]=4 4311 B10R1.113 NC(=O)c1cc(F)ccn1 Amb10067843 [0,1,0,0,1,0|2,0,0]=4 4312 B10R1.113 NC(=O)c1cc(O)cc[n]1 Amb23412183 [0,1,0,0,1,0|2,0,0]=4 4313 B10R1.113 NC(=O)c1cc(O)cnc1 Amb10608604 [0,1,0,0,1,0|2,0,0]=4 4314 B10R1.113 NC(=O)c1cc[n]c(Cl)c1 Amb22577682 [0,1,0,0,1,0|2,0,0]=4 4315 B10R1.113 NC(=O)c1cccc(O)[n]1 Amb24182048 [0,1,0,0,1,0|2,0,0]=4 4316 B10R1.113 NC(=O)c1cccc(S)[n]1 Amb25758927 [0,1,0,0,1,0|2,0,0]=4 4317 B10R1.113 NC(=O)c1cccc(S)c1 Amb24059371 [0,1,0,0,1,0|1,0,0]=3 4318 B10R1.113 Nc1c[n]cc([n]1)C(O)=O Amb18643357 [0,1,0,0,1,0|2,0,0]=4 4319 B10R1.113 Nc1cc([n]cc1)C(O)=O Amb19958023 [0,1,0,0,1,0|1,0,0]=3 4320 B10R1.113 Nc1cc(c[n][n]1)C(O)=O Amb23557092 [0,1,0,0,1,0|2,0,0]=4 4321 B10R1.113 Nc1cc(cc[n]1)C(=O)Cl Amb25729999 [0,1,0,0,1,0|2,0,0]=4 4322 B10R1.113 Nc1cc(cc[n]1)C(=O)F Amb25067357 [0,1,0,0,1,0|2,0,0]=4 4323 B10R1.113 Nc1cc(ccc1)C(=O)Cl Amb24085841 [0,1,0,0,1,0|1,0,0]=3 4324 B10R1.113 Nc1cc(ccc1)C(=O)F Amb25698257 [0,1,0,0,1,0|1,0,0]=3 4325 B10R1.113 Nc1cc(ccc1)C([O-])=O Amb22730283 [0,1,0,0,1,0|0,0,1]=3 4326 B10R1.113 Nc1cc(ncn1)C(O)=O Amb17935623 [0,1,0,0,1,0|2,0,0]=4 4327 B10R1.113 Nc1cc[n]c([n]1)C(O)=O Amb18202983 [0,1,0,0,1,0|2,0,0]=4 4328 B10R1.113 Nc1cccc([n]1)C(=O)Cl Amb24650006 [0,1,0,0,1,0|2,0,0]=4 4329 B10R1.113 Nc1cccc([n]1)C(N)=O Amb18279842 [0,1,0,0,1,0|2,0,0]=4 4330 B10R1.113 Nc1cccc(c1)B(O)O Amb17672010 [0,1,0,0,1,0|1,0,1]=4 4331 B10R1.113 Nc1cccc(c1)B(O)O Amb2447084 [0,1,0,0,1,0|1,0,1]=4 4332 B10R1.113 Nc1cccc(c1)B(O)O Amb2455755 [0,1,0,0,1,0|1,0,1]=4 4333 B10R1.113 Nc1cccc(c1)C(=C)C Amb17107084 [0,1,0,0,1,0|2,0,0]=4 4334 B10R1.113 Nc1cccc(c1)C(=O)N Amb1106189 [0,1,0,0,1,0|1,0,0]=3 4335 B10R1.113 Nc1cccc(c1)C(=O)O Amb1935166 [0,1,0,0,1,0|0,0,0]=2 4336 B10R1.113 Nc1cccc(c1)C(O)C Amb2092782 [0,1,0,0,1,0|1,0,1]=4 4337 B10R1.113 Nc1cccc(n1)C(=O)O Amb1235493 [0,1,0,0,1,0|1,0,0]=3 4338 B10R1.113 Nc1cncc(c1)C(=O)N Amb10602828 [0,1,0,0,1,0|2,0,0]=4 4339 B10R1.113 O=C(Cl)c1c[n]cc(F)c1 Amb25691932 [0,1,0,0,1,0|2,0,0]=4 4340 B10R1.113 O=C(Cl)c1cc(Br)cc[n]1 Amb24520483 [0,1,0,0,1,0|2,0,0]=4 4341 B10R1.113 O=C(Cl)c1cc(Cl)c[n]c1 Amb24071250 [0,1,0,0,1,0|2,0,0]=4 4342 B10R1.113 O=C(Cl)c1cccc(Br)[n]1 Amb24077446 [0,1,0,0,1,0|2,0,0]=4 4343 B10R1.113 O=C(Cl)c1cccc(S)c1 Amb21961741 [0,1,0,0,1,0|1,0,0]=3 4344 B10R1.113 O=C(F)c1cc(F)[n]cc1 Amb24416828 [0,1,0,0,1,0|2,0,0]=4 4345 B10R1.113 O=C1C=C(C=CN1)C(=O)Cl Amb24448901 [0,1,0,0,1,0|2,0,0]=4 4346 B10R1.113 O=C1C=CC=C(O1)C(=O)Cl Amb25114148 [0,1,0,0,1,0|2,0,0]=4 4347 B10R1.113 O=C1C=COC(=C1)C(=O)Cl Amb25067758 [0,1,0,0,1,0|2,0,0]=4 4348 B10R1.113 O=N(=O)c1cccc(Cl)c1 Amb20621790 [0,1,0,0,1,0|1,0,1]=4 4349 B10R1.113 O=N(=O)c1cccc(F)c1 Amb20621320 [0,1,0,0,1,0|1,0,1]=4 4350 B10R1.113 O=S(Cl)c1cc(Cl)ccc1 Amb18565623 [0,1,0,0,1,0|2,0,0]=4 4351 B10R1.113 OC(=O)C1=CC(=O)C=CN1 Amb18832139 [0,1,0,0,1,0|1,0,0]=3 4352 B10R1.113 OC(=O)C1=CC(=O)C=CO1 Amb18643476 [0,1,0,0,1,0|1,0,0]=3 4353 B10R1.113 OC(=O)C1=CC(=O)N=CN1 Amb17933819 [0,1,0,0,1,0|2,0,0]=4 4354 B10R1.113 OC(=O)C1=CC(=O)NC=C1 Amb18124536 [0,1,0,0,1,0|1,0,0]=3 4355 B10R1.113 OC(=O)C1=CC(=O)NC=N1 Amb18062111 [0,1,0,0,1,0|2,0,0]=4 4356 B10R1.113 OC(=O)C1=CC(=O)NN=C1 Amb19894955 [0,1,0,0,1,0|2,0,0]=4 4357 B10R1.113 OC(=O)C1=CC=CC(=O)N1 Amb19514344 [0,1,0,0,1,0|1,0,0]=3 4358 B10R1.113 OC(=O)C1=CC=CC(=O)O1 Amb18643477 [0,1,0,0,1,0|1,0,0]=3 4359 B10R1.113 OC(=O)C1=CC=NC(=O)N1 Amb19957719 [0,1,0,0,1,0|2,0,0]=4 4360 B10R1.113 OC(=O)C1=CN=CC(=O)N1 Amb22011470 [0,1,0,0,1,0|2,0,0]=4 4361 B10R1.113 OC(=O)C=1C=CNC(=S)C1 Amb19514542 [0,1,0,0,1,0|1,0,0]=3 4362 B10R1.113 OC(=O)c1[n]c(Br)cc[n]1 Amb25375744 [0,1,0,0,1,0|2,0,0]=4 4363 B10R1.113 OC(=O)c1[n]c(Cl)cc[n]1 Amb20241397 [0,1,0,0,1,0|2,0,0]=4 4364 B10R1.113 OC(=O)c1c[n][n]c(Cl)c1 Amb19895270 [0,1,0,0,1,0|2,0,0]=4 4365 B10R1.113 OC(=O)c1c[n]cc(Br)[n]1 Amb22728068 [0,1,0,0,1,0|2,0,0]=4 4366 B10R1.113 OC(=O)c1c[n]cc(F)[n]1 Amb21961694 [0,1,0,0,1,0|2,0,0]=4 4367 B10R1.113 OC(=O)c1c[n]cc(F)c1 Amb24094670 [0,1,0,0,1,0|1,0,0]=3 4368 B10R1.113 OC(=O)c1c[n]cc(I)[n]1 Amb24717007 [0,1,0,0,1,0|2,0,0]=4 4369 B10R1.113 OC(=O)c1cc(Br)c[n][n]1 Amb24712383 [0,1,0,0,1,0|2,0,0]=4 4370 B10R1.113 OC(=O)c1cc(Br)ccn1 Amb2541475 [0,1,0,0,1,0|1,0,0]=3 4371 B10R1.113 OC(=O)c1cc(Br)cnc1 Amb1232836 [0,1,0,0,1,0|1,0,0]=3 4372 B10R1.113 OC(=O)c1cc(Cl)ccn1 Amb1106613 [0,1,0,0,1,0|1,0,0]=3 4373 B10R1.113 OC(=O)c1cc(Cl)cnc1 Amb2540665 [0,1,0,0,1,0|1,0,0]=3 4374 B10R1.113 OC(=O)c1cc(F)cc[n]1 Amb19958323 [0,1,0,0,1,0|1,0,0]=3 4375 B10R1.113 OC(=O)c1cc(I)ccn1 Amb10975473 [0,1,0,0,1,0|1,0,0]=3 4376 B10R1.113 OC(=O)c1cc(I)ccn1 Amb2540668 [0,1,0,0,1,0|1,0,0]=3 4377 B10R1.113 OC(=O)c1cc(S)cc[n]1 Amb18278971 [0,1,0,0,1,0|1,0,0]=3 4378 B10R1.113 OC(=O)c1cc[nH]c(=O)c1 Amb10069108 [0,1,0,0,1,0|1,0,0]=3 4379 B10R1.113 OC(=O)c1cc[n]c(Br)[n]1 Amb22499757 [0,1,0,0,1,0|2,0,0]=4 4380 B10R1.113 OC(=O)c1cc[n]c(S)[n]1 Amb18200233 [0,1,0,0,1,0|2,0,0]=4 4381 B10R1.113 OC(=O)c1cccn(=O)c1 Amb17749046 [0,1,0,0,1,0|1,0,0]=3 4382 B10R1.113 OC(=O)c1cn[nH]c(=O)c1 Amb10603875 [0,1,0,0,1,0|2,0,0]=4 4383 B10R1.113 OC(=O)c1cncc(n1)Cl Amb10067218 [0,1,0,0,1,0|2,0,0]=4 4384 B10R1.113 OC(=S)c1cccc(F)[n]1 Amb24586609 [0,1,0,0,1,0|1,1,0]=4 4385 B10R1.113 OS(=O)c1cccc(Br)c1 Amb24626118 [0,1,0,0,1,0|1,0,0]=3 4386 B10R1.113 OS(=O)c1cccc(Cl)c1 Amb18564048 [0,1,0,0,1,0|1,0,0]=3 4387 B10R1.113 OS(=O)c1cccc(F)c1 Amb25263422 [0,1,0,0,1,0|1,0,0]=3 4388 B10R1.113 Oc1[n]c(cc[n]1)C(O)=O Amb21927951 [0,1,0,0,1,0|2,0,0]=4 4389 B10R1.113 Oc1c[n][n]c(c1)C(O)=O Amb24428124 [0,1,0,0,1,0|2,0,0]=4 4390 B10R1.113 Oc1cc(ccc1)B(O)O Amb22740112 [0,1,0,0,1,0|1,0,1]=4 4391 B10R1.113 Oc1cc(ccc1)C(=O)Br Amb24102249 [0,1,0,0,1,0|1,0,0]=3 4392 B10R1.113 Oc1cc(ccc1)N(=O)=O Amb20621867 [0,1,0,0,1,0|1,0,1]=4 4393 B10R1.113 Oc1cccc(c1)B(O)O Amb2447025 [0,1,0,0,1,0|1,0,1]=4 4394 B10R1.113 Oc1cccc(c1)C(=N)N Amb13883012 [0,1,0,0,1,0|2,0,0]=4 4395 B10R1.113 Oc1cccc(c1)C(=O)O Amb1208301 [0,1,0,0,1,0|0,0,0]=2 4396 B10R1.113 Oc1cccc(c1)P(O)=O Amb25318918 [0,1,0,0,1,0|1,0,0]=3 4397 B10R1.113 Oc1cccc(c1)[C@@H](O)C Amb13952963 [0,1,0,0,1,0|1,0,1]=4 4398 B10R1.113 Oc1cccc(c1)[C@H](O)C Amb13952964 [0,1,0,0,1,0|1,0,1]=4 4399 B10R1.113 Oc1cccc(c1)[N+](=O)[O-] Amb1929299 [0,1,0,0,1,0|1,0,1]=4 4400 B10R1.113 Oc1ccnc(c1)C(=O)O Amb1303199 [0,1,0,0,1,0|1,0,0]=3 4401 B10R1.113 Oc1cncc(c1)C(=O)[O-] Amb1775314 [0,1,0,0,1,0|1,0,1]=4 4402 B10R1.113 Sc1cccc(c1)B(O)O Amb2447106 [0,1,0,0,1,0|1,0,1]=4 4403 B10R1.113 Sc1cccc(c1)[N+](=O)[O-] Amb15694852 [0,1,0,0,1,0|1,0,1]=4 4404 B10R1.113 Sc1cccc(n1)C(=O)O Amb1208363 [0,1,0,0,1,0|1,0,0]=3 4405 B10R1.113 [O-]C(=O)c1cc(Cl)cc[n]1 Amb22831771 [0,1,0,0,1,0|1,0,1]=4 4406 B10R1.113 [O-]C(=O)c1cccc(O)c1 Amb22277134 [0,1,0,0,1,0|0,0,1]=3 4407 B10R1.113 [O-]S(=O)c1cccc(Br)c1 Amb19944408 [0,1,0,0,1,0|1,0,1]=4 4408 B10R1.113 [O-]S(=O)c1cccc(Cl)c1 Amb19944420 [0,1,0,0,1,0|1,0,1]=4 4409 B10R1.113 [O-]S(=O)c1cccc(F)c1 Amb19944445 [0,1,0,0,1,0|1,0,1]=4 4410 B10R1.113 [O-][n+]1cc(ccc1)C(=O)Cl Amb24682431 [0,1,0,0,1,0|2,0,0]=4 4411 B10R1.113 [O-][n+]1cc(ncc1)C(=O)O Amb17619655 [0,1,0,0,1,0|2,0,0]=4 4412 B10R1.113 [O-][n+]1cccc(c1)C(=O)O Amb10576565 [0,1,0,0,1,0|1,0,0]=3 4413 B10R1.363 CC1(C=CCC=C1)C(O)=O Amb25075684 [0,1,0,0,1,0|0,0,2]=4 4414 B10R1.363 CC1(CC=CC=C1)C(O)=O Amb24505165 [0,1,0,0,1,0|0,0,2]=4 4415 B10R1.23 C=C(C(O)=O)c1cc[nH]c1 Amb18561328 [0,1,0,0,1,0|1,0,1]=4 4416 B10R1.23 C=C(C(O)=O)c1ccc[nH]1 Amb24502435 [0,1,0,0,1,0|1,0,1]=4 4417 B10R1.23 CC(=O)C(N)c1cc[nH]c1 Amb25042145 [0,1,0,0,1,0|2,0,0]=4 4418 B10R1.23 CC(=O)C(N)c1ccc[s]1 Amb25836886 [0,1,0,0,1,0|2,0,0]=4 4419 B10R1.23 CC(=O)C(O)c1cc[s]c1 Amb25146543 [0,1,0,0,1,0|2,0,0]=4 4420 B10R1.23 CC(=O)C(O)c1ccc[nH]1 Amb24465067 [0,1,0,0,1,0|2,0,0]=4 4421 B10R1.23 CC(=O)C(O)c1ccc[s]1 Amb25146757 [0,1,0,0,1,0|2,0,0]=4 4422 B10R1.23 CC(=O)C(c1cccs1)Cl Amb17477839 [0,1,0,0,1,0|2,0,0]=4 4423 B10R1.23 CC(=O)[C@@H](O)c1ccoc1 Amb24709030 [0,1,0,0,1,0|2,0,0]=4 4424 B10R1.23 CC(=O)[C@H](O)c1cc[s]c1 Amb25028160 [0,1,0,0,1,0|2,0,0]=4 4425 B10R1.23 CC(=O)[C@H](O)c1ccc[s]1 Amb25146548 [0,1,0,0,1,0|2,0,0]=4 4426 B10R1.23 CC(C(=O)Cl)c1ccc[s]1 Amb24638423 [0,1,0,0,1,0|2,0,0]=4 4427 B10R1.23 CC(C(N)=O)c1ccco1 Amb25106547 [0,1,0,0,1,0|2,0,0]=4 4428 B10R1.23 CC(C(O)=O)C=1CC=CC1 Amb24480439 [0,1,0,0,1,0|0,0,1]=3 4429 B10R1.23 CC(C(O)=O)c1[nH]cc[n]1 Amb18202882 [0,1,0,0,1,0|2,0,0]=4 4430 B10R1.23 CC(C(O)=O)c1c[nH]c[n]1 Amb18202883 [0,1,0,0,1,0|2,0,0]=4 4431 B10R1.23 CC(C(O)=O)c1c[n]c[s]1 Amb23580683 [0,1,0,0,1,0|2,0,0]=4 4432 B10R1.23 CC(C(O)=O)c1cc[nH][n]1 Amb18831919 [0,1,0,0,1,0|2,0,0]=4 4433 B10R1.23 CC(C(O)=O)c1cc[nH]c1 Amb18064932 [0,1,0,0,1,0|1,0,0]=3 4434 B10R1.23 CC(C(O)=O)c1cc[n][s]1 Amb18830642 [0,1,0,0,1,0|2,0,0]=4 4435 B10R1.23 CC(C(O)=O)c1cc[s]c1 Amb18284449 [0,1,0,0,1,0|1,0,0]=3 4436 B10R1.23 CC(C(O)=O)c1ccc[nH]1 Amb18643379 [0,1,0,0,1,0|1,0,0]=3 4437 B10R1.23 CC(C(O)=O)c1coc[n]1 Amb18202773 [0,1,0,0,1,0|2,0,0]=4 4438 B10R1.23 CC(n1cccc1)C(=O)O Amb1058873 [0,1,0,0,1,0|1,0,0]=3 4439 B10R1.23 C[C@@H](C(O)=O)[n]1c[n]cc1 Amb18202909 [0,1,0,0,1,0|2,0,0]=4 4440 B10R1.23 C[C@H](C(O)=O)[n]1ccc[n]1 Amb25717004 [0,1,0,0,1,0|2,0,0]=4 4441 B10R1.23 C[C@H](C(O)=O)c1ccc[s]1 Amb24710020 [0,1,0,0,1,0|1,0,0]=3 4442 B10R1.23 C[C@H](n1cccc1)C(=O)O Amb2236277 [0,1,0,0,1,0|1,0,0]=3 4443 B10R1.23 NC(=O)C(Cl)c1cc[s]c1 Amb18185842 [0,1,0,0,1,0|2,0,0]=4 4444 B10R1.23 NC(=O)C(Cl)c1ccc[s]1 Amb18808822 [0,1,0,0,1,0|2,0,0]=4 4445 B10R1.23 NC(=O)C(N)c1c[s]cc1 Amb18949670 [0,1,0,0,1,0|2,0,0]=4 4446 B10R1.23 NC(=O)C(O)c1cc[s]c1 Amb18799781 [0,1,0,0,1,0|2,0,0]=4 4447 B10R1.23 NC(=O)C(O)c1ccc[s]1 Amb18799782 [0,1,0,0,1,0|2,0,0]=4 4448 B10R1.23 NC(=O)C(O)c1ccco1 Amb25084322 [0,1,0,0,1,0|2,0,0]=4 4449 B10R1.23 NC(=O)C(c1ccco1)N Amb17334171 [0,1,0,0,1,0|2,0,0]=4 4450 B10R1.23 NC(=O)C(c1cccs1)N Amb17334394 [0,1,0,0,1,0|2,0,0]=4 4451 B10R1.23 NC(=O)[C@@H](N)c1c[s]cc1 Amb24402944 [0,1,0,0,1,0|2,0,0]=4 4452 B10R1.23 NC(=O)[C@H](N)c1ccc[s]1 Amb25197626 [0,1,0,0,1,0|2,0,0]=4 4453 B10R1.23 NC(C(O)=O)c1[n]cc[s]1 Amb25761284 [0,1,0,0,1,0|2,0,0]=4 4454 B10R1.23 NC(C(O)=O)c1c[nH]c[n]1 Amb18202749 [0,1,0,0,1,0|2,0,0]=4 4455 B10R1.23 NC(C(O)=O)c1c[n][s]c1 Amb25101327 [0,1,0,0,1,0|2,0,0]=4 4456 B10R1.23 NC(C(O)=O)c1c[n]c[s]1 Amb18830497 [0,1,0,0,1,0|2,0,0]=4 4457 B10R1.23 NC(C(O)=O)c1c[s]c[n]1 Amb18645003 [0,1,0,0,1,0|2,0,0]=4 4458 B10R1.23 NC(C(O)=O)c1cc[nH]c1 Amb18862405 [0,1,0,0,1,0|1,0,0]=3 4459 B10R1.23 NC(C(O)=O)c1cc[n][s]1 Amb18199897 [0,1,0,0,1,0|2,0,0]=4 4460 B10R1.23 NC(C(O)=O)c1cc[n]o1 Amb25843218 [0,1,0,0,1,0|2,0,0]=4 4461 B10R1.23 NC(C(O)=O)c1cc[s][n]1 Amb24467851 [0,1,0,0,1,0|2,0,0]=4 4462 B10R1.23 NC(C(O)=O)c1ccc[nH]1 Amb18831925 [0,1,0,0,1,0|1,0,0]=3 4463 B10R1.23 NC(c1c[s]cc1)P(O)=O Amb25731986 [0,1,0,0,1,0|2,0,0]=4 4464 B10R1.23 NC(c1ccc[s]1)P(O)=O Amb25375779 [0,1,0,0,1,0|2,0,0]=4 4465 B10R1.23 N[C@@H](C(O)=O)c1[nH]cc[n]1 Amb24359279 [0,1,0,0,1,0|2,0,0]=4 4466 B10R1.23 N[C@@H](C(O)=O)c1c[n][s]c1 Amb24702828 [0,1,0,0,1,0|2,0,0]=4 4467 B10R1.23 N[C@@H](C(O)=O)c1cc[n]o1 Amb24332272 [0,1,0,0,1,0|2,0,0]=4 4468 B10R1.23 N[C@@H](C(O)=O)c1cc[s]c1 Amb22750704 [0,1,0,0,1,0|1,0,0]=3 4469 B10R1.23 N[C@@H](C(O)=O)c1ccc[s]1 Amb22747193 [0,1,0,0,1,0|1,0,0]=3 4470 B10R1.23 N[C@@H](C(O)=O)c1ccco1 Amb25068121 [0,1,0,0,1,0|1,0,0]=3 4471 B10R1.23 N[C@@H](C(O)=O)c1ccoc1 Amb25684655 [0,1,0,0,1,0|1,0,0]=3 4472 B10R1.23 N[C@H](C(O)=O)c1[n]cc[s]1 Amb25705057 [0,1,0,0,1,0|2,0,0]=4 4473 B10R1.23 N[C@H](C(O)=O)c1c[nH]c[n]1 Amb24746747 [0,1,0,0,1,0|2,0,0]=4 4474 B10R1.23 N[C@H](C(O)=O)c1cc[nH]c1 Amb25063304 [0,1,0,0,1,0|1,0,0]=3 4475 B10R1.23 OC(=O)C(=C)c1cccs1 Amb17322162 [0,1,0,0,1,0|1,0,1]=4 4476 B10R1.23 OC(=O)C(=O)C1C=CC=C1 Amb25781759 [0,1,0,0,1,0|0,0,2]=4 4477 B10R1.23 OC(=O)C(=O)c1c[s]cc1 Amb18644784 [0,1,0,0,1,0|1,0,1]=4 4478 B10R1.23 OC(=O)C(=O)c1ccc[nH]1 Amb17593524 [0,1,0,0,1,0|1,0,1]=4 4479 B10R1.23 OC(=O)C(Br)c1cc[n]o1 Amb25123809 [0,1,0,0,1,0|2,0,0]=4 4480 B10R1.23 OC(=O)C(Br)c1ccc[s]1 Amb18658431 [0,1,0,0,1,0|1,0,0]=3 4481 B10R1.23 OC(=O)C(Cl)c1cc[nH]c1 Amb18563480 [0,1,0,0,1,0|1,0,0]=3 4482 B10R1.23 OC(=O)C(F)[n]1ccc[n]1 Amb24524322 [0,1,0,0,1,0|2,0,0]=4 4483 B10R1.23 OC(=O)C(F)c1c[s]c[n]1 Amb25767685 [0,1,0,0,1,0|2,0,0]=4 4484 B10R1.23 OC(=O)C(F)c1ccco1 Amb25825778 [0,1,0,0,1,0|1,0,0]=3 4485 B10R1.23 OC(=O)C(O)c1[nH]cc[n]1 Amb25082992 [0,1,0,0,1,0|2,0,0]=4 4486 B10R1.23 OC(=O)C(O)c1[n]cc[s]1 Amb24478433 [0,1,0,0,1,0|2,0,0]=4 4487 B10R1.23 OC(=O)C(O)c1c[nH]c[n]1 Amb24479126 [0,1,0,0,1,0|2,0,0]=4 4488 B10R1.23 OC(=O)C(O)c1c[nH]cc1 Amb18862454 [0,1,0,0,1,0|1,0,0]=3 4489 B10R1.23 OC(=O)C(O)c1c[n]oc1 Amb18202500 [0,1,0,0,1,0|2,0,0]=4 4490 B10R1.23 OC(=O)C(O)c1c[s]c[n]1 Amb18830402 [0,1,0,0,1,0|2,0,0]=4 4491 B10R1.23 OC(=O)C(O)c1c[s]cc1 Amb18952015 [0,1,0,0,1,0|1,0,0]=3 4492 B10R1.23 OC(=O)C(O)c1cc[n][s]1 Amb18830401 [0,1,0,0,1,0|2,0,0]=4 4493 B10R1.23 OC(=O)C(O)c1cc[s][n]1 Amb18830400 [0,1,0,0,1,0|2,0,0]=4 4494 B10R1.23 OC(=O)C(O)c1ccc[nH]1 Amb24480945 [0,1,0,0,1,0|1,0,0]=3 4495 B10R1.23 OC(=O)C(c1ccco1)C Amb17087431 [0,1,0,0,1,0|1,0,0]=3 4496 B10R1.23 OC(=O)C(c1cccs1)C Amb10844027 [0,1,0,0,1,0|1,0,0]=3 4497 B10R1.23 OC(=O)C(c1cccs1)Cl Amb17233234 [0,1,0,0,1,0|1,0,0]=3 4498 B10R1.23 OC(=O)C(c1cccs1)N Amb1840251 [0,1,0,0,1,0|1,0,0]=3 4499 B10R1.23 OC(=O)C(c1cccs1)O Amb17232241 [0,1,0,0,1,0|1,0,0]=3 4500 B10R1.23 OC(=O)C(c1cocc1)O Amb10810585 [0,1,0,0,1,0|1,0,0]=3 4501 B10R1.23 OC(=O)C(c1cscc1)N Amb2425141 [0,1,0,0,1,0|1,0,0]=3 4502 B10R1.23 OC(=O)C(c1nccs1)C Amb10844026 [0,1,0,0,1,0|2,0,0]=4 4503 B10R1.23 OC(=O)C(n1cccn1)C Amb1138614 [0,1,0,0,1,0|2,0,0]=4 4504 B10R1.23 OC(=O)C(n1cncc1)C Amb1133434 [0,1,0,0,1,0|2,0,0]=4 4505 B10R1.23 OC(=O)[C@@H](O)c1c[s]cc1 Amb25074325 [0,1,0,0,1,0|1,0,0]=3 4506 B10R1.23 OC(=O)[C@@H](c1cccs1)C Amb10844019 [0,1,0,0,1,0|1,0,0]=3 4507 B10R1.23 OC(=O)[C@@H](c1cscc1)C Amb10844020 [0,1,0,0,1,0|1,0,0]=3 4508 B10R1.23 OC(=O)[C@H](O)c1ccco1 Amb24445445 [0,1,0,0,1,0|1,0,0]=3 4509 B10R1.23 OC(=O)[C@H](c1cscc1)C Amb10844030 [0,1,0,0,1,0|1,0,0]=3 4510 B10R1.23 OC(=O)[C@H](c1cscc1)N Amb16232233 [0,1,0,0,1,0|1,0,0]=3 4511 B10R1.23 OC(C(O)=O)[n]1c[n]cc1 Amb21953001 [0,1,0,0,1,0|2,0,0]=4 4512 B10R1.27 C#CC(=O)Cc1cc[s]c1 Amb25065037 [0,1,0,0,1,0|2,0,0]=4 4513 B10R1.27 C#CC(=O)Cc1ccc[s]1 Amb25314927 [0,1,0,0,1,0|2,0,0]=4 4514 B10R1.27 C=CC(=O)Cc1cc[s]c1 Amb24745076 [0,1,0,0,1,0|2,0,0]=4 4515 B10R1.27 CCC(=O)Cc1c[s]cc1 Amb18791601 [0,1,0,0,1,0|2,0,0]=4 4516 B10R1.27 CCC(=O)Cc1ccc[s]1 Amb18041935 [0,1,0,0,1,0|2,0,0]=4 4517 B10R1.27 CCC(=O)Cc1ccco1 Amb1102322 [0,1,0,0,1,0|2,0,0]=4 4518 B10R1.27 CNC(=O)Cc1ccc[nH]1 Amb25836782 [0,1,0,0,1,0|2,0,0]=4 4519 B10R1.27 CNC(=O)Cc1ccoc1 Amb25355859 [0,1,0,0,1,0|2,0,0]=4 4520 B10R1.27 COC(=N)Cc1ccc[s]1 Amb18799604 [0,1,0,0,1,0|2,0,0]=4 4521 B10R1.27 COC(=O)Cc1[nH]cc[n]1 Amb19944574 [0,1,0,0,1,0|2,0,0]=4 4522 B10R1.27 COC(=O)Cc1[n]cc[s]1 Amb18787677 [0,1,0,0,1,0|2,0,0]=4 4523 B10R1.27 COC(=O)Cc1c[nH][n]c1 Amb22752842 [0,1,0,0,1,0|2,0,0]=4 4524 B10R1.27 COC(=O)Cc1c[nH]c[n]1 Amb22263050 [0,1,0,0,1,0|2,0,0]=4 4525 B10R1.27 COC(=O)Cc1c[n][s]c1 Amb25069545 [0,1,0,0,1,0|2,0,0]=4 4526 B10R1.27 COC(=O)Cc1c[n]c[s]1 Amb23440683 [0,1,0,0,1,0|2,0,0]=4 4527 B10R1.27 COC(=O)Cc1c[n]co1 Amb25728316 [0,1,0,0,1,0|2,0,0]=4 4528 B10R1.27 COC(=O)Cc1cc[nH]c1 Amb24391178 [0,1,0,0,1,0|1,0,0]=3 4529 B10R1.27 COC(=O)Cc1cc[n][nH]1 Amb19304348 [0,1,0,0,1,0|2,0,0]=4 4530 B10R1.27 COC(=O)Cc1cc[n][s]1 Amb24670886 [0,1,0,0,1,0|2,0,0]=4 4531 B10R1.27 COC(=O)Cc1cc[n]o1 Amb24423354 [0,1,0,0,1,0|2,0,0]=4 4532 B10R1.27 COC(=O)Cc1ccc[nH]1 Amb25147302 [0,1,0,0,1,0|1,0,0]=3 4533 B10R1.27 COC(=O)Cc1ccco1 Amb23455987 [0,1,0,0,1,0|1,0,0]=3 4534 B10R1.27 COC(=O)Cc1cco[n]1 Amb23440842 [0,1,0,0,1,0|2,0,0]=4 4535 B10R1.27 COC(=O)Cc1coc[n]1 Amb23440855 [0,1,0,0,1,0|2,0,0]=4 4536 B10R1.27 COC(=O)Nc1ccc[s]1 Amb24418444 [0,1,0,0,1,0|2,0,0]=4 4537 B10R1.27 CSC(=O)Cc1ccc[s]1 Amb25364375 [0,1,0,0,1,0|1,1,0]=4 4538 B10R1.27 C\C(\Cc1ccco1)=N\O Amb24476867 [0,1,0,0,1,0|2,0,0]=4 4539 B10R1.27 NCC(=O)Cc1c[s]cc1 Amb18251481 [0,1,0,0,1,0|2,0,0]=4 4540 B10R1.27 NCC(=O)Cc1ccc[s]1 Amb18908487 [0,1,0,0,1,0|2,0,0]=4 4541 B10R1.27 NCC(=O)Cc1ccco1 Amb18251183 [0,1,0,0,1,0|2,0,0]=4 4542 B10R1.27 NNC(=O)Cc1ccc[nH]1 Amb25092731 [0,1,0,0,1,0|2,0,0]=4 4543 B10R1.27 NNC(=O)Cc1ccco1 Amb25143818 [0,1,0,0,1,0|2,0,0]=4 4544 B10R1.27 NNC(=O)Cc1cccs1 Amb1153785 [0,1,0,0,1,0|2,0,0]=4 4545 B10R1.27 N\C(\Cc1ccoc1)=N\O Amb24730300 [0,1,0,0,1,0|2,0,0]=4 4546 B10R1.27 O=C(Cc1ccc[s]1)CBr Amb24076613 [0,1,0,0,1,0|2,0,0]=4 4547 B10R1.27 OC(Cc1cocc1)C=O Amb24380070 [0,1,0,0,1,0|1,0,1]=4 4548 B10R1.27 OCC(=O)Cc1c[nH]c[n]1 Amb25076724 [0,1,0,0,1,0|2,0,0]=4 4549 B10R1.27 OCC(=O)Cc1c[s]cc1 Amb25096464 [0,1,0,0,1,0|1,0,0]=3 4550 B10R1.27 OCC(=O)Cc1ccc[s]1 Amb24636460 [0,1,0,0,1,0|1,0,0]=3 4551 B10R1.27 ONC(=O)Cc1c[n]c[s]1 Amb23589511 [0,1,0,0,1,0|2,0,0]=4 4552 B10R1.27 ONC(=O)Cc1ccco1 Amb25050997 [0,1,0,0,1,0|1,0,0]=3 4553 B10R1.54 CC(=O)Cc1c[n](C)cc1 Amb18243431 [0,1,0,0,1,0|2,0,0]=4 4554 B10R1.54 CC(=O)Cc1ccc(Cl)[s]1 Amb18183807 [0,1,0,0,1,0|2,0,0]=4 4555 B10R1.54 CC(=O)Cc1ccc(o1)C Amb17477800 [0,1,0,0,1,0|2,0,0]=4 4556 B10R1.54 C[n]1cc(CC(N)=O)cc1 Amb18893402 [0,1,0,0,1,0|2,0,0]=4 4557 B10R1.54 C[n]1cc(CC(O)=O)[n]c1 Amb22295902 [0,1,0,0,1,0|2,0,0]=4 4558 B10R1.54 C[n]1cc(CC(O)=O)cc1 Amb18064824 [0,1,0,0,1,0|1,0,0]=3 4559 B10R1.54 Cc1[nH]c(CC(O)=O)c[n]1 Amb18202913 [0,1,0,0,1,0|2,0,0]=4 4560 B10R1.54 Cc1[n]cc(CC(O)=O)o1 Amb18202766 [0,1,0,0,1,0|2,0,0]=4 4561 B10R1.54 Cc1c[nH]c(CC(O)=O)[n]1 Amb18202912 [0,1,0,0,1,0|2,0,0]=4 4562 B10R1.54 Cc1c[n](CC(O)=O)[n]c1 Amb22587129 [0,1,0,0,1,0|2,0,0]=4 4563 B10R1.54 Cc1c[n](CC(O)=O)c[n]1 Amb18254871 [0,1,0,0,1,0|2,0,0]=4 4564 B10R1.54 Cc1c[n]c(CC(O)=O)[s]1 Amb18286622 [0,1,0,0,1,0|2,0,0]=4 4565 B10R1.54 Cc1c[n]c(CC(O)=O)o1 Amb18831795 [0,1,0,0,1,0|2,0,0]=4 4566 B10R1.54 Cc1c[s]c(CC(C)=O)c1 Amb25146717 [0,1,0,0,1,0|2,0,0]=4 4567 B10R1.54 Cc1cc(CC(=O)Cl)[s]c1 Amb24651189 [0,1,0,0,1,0|2,0,0]=4 4568 B10R1.54 Cc1cc(CC(C)=O)c[s]1 Amb25767094 [0,1,0,0,1,0|2,0,0]=4 4569 B10R1.54 Cc1cc(CC(O)=O)[n][nH]1 Amb22283965 [0,1,0,0,1,0|2,0,0]=4 4570 B10R1.54 Cc1cc(CC(O)=O)[n][s]1 Amb18830635 [0,1,0,0,1,0|2,0,0]=4 4571 B10R1.54 Cc1cc(CC(O)=O)[s][n]1 Amb18138253 [0,1,0,0,1,0|2,0,0]=4 4572 B10R1.54 Cc1cc(CC(O)=O)c[nH]1 Amb18832122 [0,1,0,0,1,0|1,0,0]=3 4573 B10R1.54 Cc1cc(CC(O)=O)oc1 Amb18831942 [0,1,0,0,1,0|1,0,0]=3 4574 B10R1.54 Cc1cc(n[nH]1)CC(=O)O Amb1091981 [0,1,0,0,1,0|2,0,0]=4 4575 B10R1.54 Cc1cc(no1)CC(=O)O Amb17064157 [0,1,0,0,1,0|2,0,0]=4 4576 B10R1.54 Cc1ccc(CC(C)=O)[s]1 Amb25146673 [0,1,0,0,1,0|2,0,0]=4 4577 B10R1.54 Cc1ccc(CC(O)=O)[nH]1 Amb18832131 [0,1,0,0,1,0|1,0,0]=3 4578 B10R1.54 Cc1ccc(CC(O)=O)o1 Amb18960367 [0,1,0,0,1,0|1,0,0]=3 4579 B10R1.54 Cc1ccc(s1)CC(=O)O Amb2234463 [0,1,0,0,1,0|1,0,0]=3 4580 B10R1.54 Cc1ccn(n1)CC(=O)O Amb1935095 [0,1,0,0,1,0|2,0,0]=4 4581 B10R1.54 Cc1cn(nc1)CC(=O)O Amb1945752 [0,1,0,0,1,0|2,0,0]=4 4582 B10R1.54 Cc1coc(CC(C)=O)c1 Amb24694278 [0,1,0,0,1,0|2,0,0]=4 4583 B10R1.54 Cc1coc(CC(O)=O)[n]1 Amb18831793 [0,1,0,0,1,0|2,0,0]=4 4584 B10R1.54 Cc1nc(cs1)CC(=O)O Amb1105673 [0,1,0,0,1,0|2,0,0]=4 4585 B10R1.54 Cn1cc(nc1)CC(=O)O Amb13883551 [0,1,0,0,1,0|2,0,0]=4 4586 B10R1.54 Cn1ccc(n1)CC(=O)O Amb16229976 [0,1,0,0,1,0|2,0,0]=4 4587 B10R1.54 NC(=O)Cc1cc(Br)c[s]1 Amb18896728 [0,1,0,0,1,0|2,0,0]=4 4588 B10R1.54 NC(=O)Cc1ccc(s1)Br Amb17405436 [0,1,0,0,1,0|2,0,0]=4 4589 B10R1.54 NC(=O)Cc1ccc(s1)Cl Amb17400533 [0,1,0,0,1,0|2,0,0]=4 4590 B10R1.54 Nc1[n]c(CC(O)=O)co1 Amb24401131 [0,1,0,0,1,0|2,0,0]=4 4591 B10R1.54 Nc1[n]cc(CC(O)=O)o1 Amb18202644 [0,1,0,0,1,0|2,0,0]=4 4592 B10R1.54 Nc1c[n](CC(O)=O)[n]c1 Amb21961626 [0,1,0,0,1,0|2,0,0]=4 4593 B10R1.54 Nc1c[n](CC(O)=O)[n]c1 Amb22280386 [0,1,0,0,1,0|2,0,0]=4 4594 B10R1.54 Nc1c[n]c(CC(O)=O)[nH]1 Amb18831782 [0,1,0,0,1,0|2,0,0]=4 4595 B10R1.54 Nc1cc(CC(O)=O)[s]c1 Amb18830633 [0,1,0,0,1,0|1,0,0]=3 4596 B10R1.54 Nc1cc(CC(O)=O)o[n]1 Amb18202643 [0,1,0,0,1,0|2,0,0]=4 4597 B10R1.54 Nc1cc(n[nH]1)CC(=O)O Amb10603809 [0,1,0,0,1,0|2,0,0]=4 4598 B10R1.54 Nc1cc[n](CC(O)=O)[n]1 Amb22280389 [0,1,0,0,1,0|2,0,0]=4 4599 B10R1.54 OC(=O)CC1=CC(=O)NN1 Amb18202650 [0,1,0,0,1,0|2,0,0]=4 4600 B10R1.54 OC(=O)CC1=CC(=O)NO1 Amb18831605 [0,1,0,0,1,0|2,0,0]=4 4601 B10R1.54 OC(=O)CC1=CCC(=O)O1 Amb25703174 [0,1,0,0,1,0|1,0,1]=4 4602 B10R1.54 OC(=O)CC1=CNC(=O)N1 Amb24715588 [0,1,0,0,1,0|2,0,0]=4 4603 B10R1.54 OC(=O)CC1=CSC(=O)N1 Amb18534615 [0,1,0,0,1,0|2,0,0]=4 4604 B10R1.54 OC(=O)CC1CC(=O)C=C1 Amb25831069 [0,1,0,0,1,0|0,0,2]=4 4605 B10R1.54 OC(=O)CN1C=CC(=O)O1 Amb25340496 [0,1,0,0,1,0|2,0,0]=4 4606 B10R1.54 OC(=O)C[C@@H]1CC(=O)C=C1 Amb24746679 [0,1,0,0,1,0|0,0,2]=4 4607 B10R1.54 OC(=O)C[C@H]1C=CC(=O)O1 Amb25069009 [0,1,0,0,1,0|1,0,1]=4 4608 B10R1.54 OC(=O)C[n+]1ccn(c1)C Amb10573098 [0,1,0,0,1,0|2,0,0]=4 4609 B10R1.54 OC(=O)C[n]1cc(Br)[n]c1 Amb24668191 [0,1,0,0,1,0|2,0,0]=4 4610 B10R1.54 OC(=O)C[n]1cc(F)c[n]1 Amb23400566 [0,1,0,0,1,0|2,0,0]=4 4611 B10R1.54 OC(=O)C[n]1cc(S)c[n]1 Amb24687828 [0,1,0,0,1,0|2,0,0]=4 4612 B10R1.54 OC(=O)C[n]1ccc(Br)[n]1 Amb20619995 [0,1,0,0,1,0|2,0,0]=4 4613 B10R1.54 OC(=O)Cc1[n]c(Br)c[s]1 Amb24481258 [0,1,0,0,1,0|2,0,0]=4 4614 B10R1.54 OC(=O)Cc1[n]c(Cl)co1 Amb18829877 [0,1,0,0,1,0|2,0,0]=4 4615 B10R1.54 OC(=O)Cc1[n]cc(Cl)[s]1 Amb23439705 [0,1,0,0,1,0|2,0,0]=4 4616 B10R1.54 OC(=O)Cc1c[n]c(Br)[s]1 Amb18161036 [0,1,0,0,1,0|2,0,0]=4 4617 B10R1.54 OC(=O)Cc1c[n]c(S)[s]1 Amb18127410 [0,1,0,0,1,0|2,0,0]=4 4618 B10R1.54 OC(=O)Cc1c[s]c(Br)c1 Amb25312095 [0,1,0,0,1,0|1,0,0]=3 4619 B10R1.54 OC(=O)Cc1c[s]c(Cl)[n]1 Amb23439991 [0,1,0,0,1,0|2,0,0]=4 4620 B10R1.54 OC(=O)Cc1c[s]c(F)c1 Amb25290494 [0,1,0,0,1,0|1,0,0]=3 4621 B10R1.54 OC(=O)Cc1c[s]c(I)[n]1 Amb25759736 [0,1,0,0,1,0|2,0,0]=4 4622 B10R1.54 OC(=O)Cc1cc(Br)[n]o1 Amb24756693 [0,1,0,0,1,0|2,0,0]=4 4623 B10R1.54 OC(=O)Cc1cc(Cl)[n]o1 Amb18645562 [0,1,0,0,1,0|2,0,0]=4 4624 B10R1.54 OC(=O)Cc1cc(Cl)o[n]1 Amb24480665 [0,1,0,0,1,0|2,0,0]=4 4625 B10R1.54 OC(=O)Cc1cc(cs1)Br Amb10069924 [0,1,0,0,1,0|1,0,0]=3 4626 B10R1.54 OC(=O)Cc1ccc(Br)[nH]1 Amb25090619 [0,1,0,0,1,0|1,0,0]=3 4627 B10R1.54 OC(=O)Cc1ccc(F)[s]1 Amb24269131 [0,1,0,0,1,0|1,0,0]=3 4628 B10R1.54 OC(=O)Cc1ccc(F)o1 Amb25842555 [0,1,0,0,1,0|1,0,0]=3 4629 B10R1.54 OC(=O)Cc1ccc(I)o1 Amb24622567 [0,1,0,0,1,0|1,0,0]=3 4630 B10R1.54 OC(=O)Cc1ccc(s1)Br Amb2237320 [0,1,0,0,1,0|1,0,0]=3 4631 B10R1.54 OC(=O)Cc1ccc(s1)Cl Amb2235520 [0,1,0,0,1,0|1,0,0]=3 4632 B10R1.54 OC(=O)Cc1csc(n1)Br Amb17405994 [0,1,0,0,1,0|2,0,0]=4 4633 B10R1.54 OC(=O)Cn1cc(cn1)Br Amb1946097 [0,1,0,0,1,0|2,0,0]=4 4634 B10R1.54 OC(=O)Cn1cc(cn1)I Amb16186677 [0,1,0,0,1,0|2,0,0]=4 4635 B10R1.54 OC(=O)\C=C\1/C=CC(=O)O1 Amb18643475 [0,1,0,0,1,0|1,0,1]=4 4636 B10R1.54 Oc1c[n]c(CC(O)=O)[nH]1 Amb18862464 [0,1,0,0,1,0|2,0,0]=4 4637 B10R1.54 Oc1c[s]c(CC(O)=O)c1 Amb25338381 [0,1,0,0,1,0|1,0,0]=3 4638 B10R1.54 Oc1cc(CC(O)=O)[n]o1 Amb23504423 [0,1,0,0,1,0|2,0,0]=4 4639 B10R1.64 CC(=O)Cc1ccc[n]1C Amb25053401 [0,1,0,0,1,0|2,0,0]=4 4640 B10R1.64 CC(=O)Cc1sccc1C Amb17477801 [0,1,0,0,1,0|2,0,0]=4 4641 B10R1.64 C[n+]1cc[nH]c1CC(O)=O Amb25849763 [0,1,0,0,1,0|2,0,0]=4 4642 B10R1.64 C[n]1[n]ccc1CC(O)=O Amb18202914 [0,1,0,0,1,0|2,0,0]=4 4643 B10R1.64 C[n]1c[n]cc1CC(O)=O Amb18202884 [0,1,0,0,1,0|2,0,0]=4 4644 B10R1.64 C[n]1cccc1CC(N)=O Amb23459725 [0,1,0,0,1,0|2,0,0]=4 4645 B10R1.64 Cc1[nH]c[n]c1CC(O)=O Amb24126542 [0,1,0,0,1,0|2,0,0]=4 4646 B10R1.64 Cc1[n]occ1CC(O)=O Amb18202769 [0,1,0,0,1,0|2,0,0]=4 4647 B10R1.64 Cc1[s][n]cc1CC(O)=O Amb18830639 [0,1,0,0,1,0|2,0,0]=4 4648 B10R1.64 Cc1[s]c[n]c1CC(O)=O Amb25031494 [0,1,0,0,1,0|2,0,0]=4 4649 B10R1.64 Cc1c[nH][n]c1CC(O)=O Amb18831928 [0,1,0,0,1,0|2,0,0]=4 4650 B10R1.64 Cc1c[nH]cc1CC(O)=O Amb24481198 [0,1,0,0,1,0|1,0,0]=3 4651 B10R1.64 Cc1c[n]c[n]1CC(O)=O Amb18254868 [0,1,0,0,1,0|2,0,0]=4 4652 B10R1.64 Cc1c[n]oc1CC(O)=O Amb18202779 [0,1,0,0,1,0|2,0,0]=4 4653 B10R1.64 Cc1c[s]c[n+]1CC(O)=O Amb24652527 [0,1,0,0,1,0|2,0,0]=4 4654 B10R1.64 Cc1c[s]cc1CC(C)=O Amb25178146 [0,1,0,0,1,0|2,0,0]=4 4655 B10R1.64 Cc1cc[nH]c1CC(O)=O Amb23440860 [0,1,0,0,1,0|1,0,0]=3 4656 B10R1.64 Cc1cc[s]c1CC(=O)Cl Amb25223959 [0,1,0,0,1,0|2,0,0]=4 4657 B10R1.64 Cc1cocc1CC(C)=O Amb25268299 [0,1,0,0,1,0|2,0,0]=4 4658 B10R1.64 Cc1cocc1CC(O)=O Amb25025435 [0,1,0,0,1,0|1,0,0]=3 4659 B10R1.64 Cc1nccn1CC(=O)O Amb1126098 [0,1,0,0,1,0|2,0,0]=4 4660 B10R1.64 Cc1ncoc1CC(=O)O Amb17399865 [0,1,0,0,1,0|2,0,0]=4 4661 B10R1.64 Cc1o[n]cc1CC(O)=O Amb18202777 [0,1,0,0,1,0|2,0,0]=4 4662 B10R1.64 Cc1occc1CC(=O)O Amb17593534 [0,1,0,0,1,0|1,0,0]=3 4663 B10R1.64 N=C1SC=CC1CC(O)=O Amb25792504 [0,1,0,0,1,0|1,0,1]=4 4664 B10R1.64 N=C1SC=CN1CC(O)=O Amb18526855 [0,1,0,0,1,0|2,0,0]=4 4665 B10R1.64 N=C1SC=CN1CC(O)=O Amb21953894 [0,1,0,0,1,0|2,0,0]=4 4666 B10R1.64 NC(=O)C[n]1cccc1Cl Amb24549387 [0,1,0,0,1,0|2,0,0]=4 4667 B10R1.64 NC(=O)Cc1c[s]cc1Br Amb24568089 [0,1,0,0,1,0|2,0,0]=4 4668 B10R1.64 Nc1[nH][n]cc1CC(O)=O Amb24682921 [0,1,0,0,1,0|2,0,0]=4 4669 B10R1.64 Nc1[s]ccc1CC(O)=O Amb18830628 [0,1,0,0,1,0|1,0,0]=3 4670 B10R1.64 Nc1c[n][s]c1CC(O)=O Amb18830495 [0,1,0,0,1,0|2,0,0]=4 4671 B10R1.64 Nc1c[s]cc1CC(O)=O Amb24517153 [0,1,0,0,1,0|1,0,0]=3 4672 B10R1.64 Nc1cc[nH]c1CC(N)=O Amb18832087 [0,1,0,0,1,0|2,0,0]=4 4673 B10R1.64 Nc1cc[n][n]1CC(O)=O Amb24594873 [0,1,0,0,1,0|2,0,0]=4 4674 B10R1.64 Nc1cc[s]c1CC(O)=O Amb22499925 [0,1,0,0,1,0|1,0,0]=3 4675 B10R1.64 Nc1ccoc1CC(O)=O Amb18202764 [0,1,0,0,1,0|1,0,0]=3 4676 B10R1.64 Nc1o[n]cc1CC(O)=O Amb25196069 [0,1,0,0,1,0|2,0,0]=4 4677 B10R1.64 OC(=O)CC1=CCNC1=O Amb25125935 [0,1,0,0,1,0|1,0,1]=4 4678 B10R1.64 OC(=O)CC1=CCSC1=O Amb24373103 [0,1,0,0,1,0|1,0,1]=4 4679 B10R1.64 OC(=O)CC1=CNNC1=O Amb20036826 [0,1,0,0,1,0|2,0,0]=4 4680 B10R1.64 OC(=O)CC1CC=CC1=O Amb18643487 [0,1,0,0,1,0|0,0,2]=4 4681 B10R1.64 OC(=O)CN1C=CNC1=S Amb24652318 [0,1,0,0,1,0|2,0,0]=4 4682 B10R1.64 OC(=O)CN1C=CSC1=O Amb18949505 [0,1,0,0,1,0|2,0,0]=4 4683 B10R1.64 OC(=O)C[n]1cc[n]c1Cl Amb22901743 [0,1,0,0,1,0|2,0,0]=4 4684 B10R1.64 OC(=O)C[n]1cccc1Cl Amb25702744 [0,1,0,0,1,0|1,0,0]=3 4685 B10R1.64 OC(=O)Cc1[nH]c[n]c1Br Amb18176563 [0,1,0,0,1,0|2,0,0]=4 4686 B10R1.64 OC(=O)Cc1[nH]c[n]c1I Amb24575242 [0,1,0,0,1,0|2,0,0]=4 4687 B10R1.64 OC(=O)Cc1[n][nH]cc1Br Amb23555805 [0,1,0,0,1,0|2,0,0]=4 4688 B10R1.64 OC(=O)Cc1[n][nH]cc1Cl Amb25223511 [0,1,0,0,1,0|2,0,0]=4 4689 B10R1.64 OC(=O)Cc1[s]c[n]c1Br Amb18161023 [0,1,0,0,1,0|2,0,0]=4 4690 B10R1.64 OC(=O)Cc1[s]ccc1Br Amb18283686 [0,1,0,0,1,0|1,0,0]=3 4691 B10R1.64 OC(=O)Cc1[s]ccc1F Amb25088269 [0,1,0,0,1,0|1,0,0]=3 4692 B10R1.64 OC(=O)Cc1c[n][nH]c1Cl Amb25253360 [0,1,0,0,1,0|2,0,0]=4 4693 B10R1.64 OC(=O)Cc1c[s]cc1Br Amb25062150 [0,1,0,0,1,0|1,0,0]=3 4694 B10R1.64 OC(=O)Cc1cc[s]c1Br Amb18765498 [0,1,0,0,1,0|1,0,0]=3 4695 B10R1.64 OC(=O)Cc1cc[s]c1Cl Amb23504442 [0,1,0,0,1,0|1,0,0]=3 4696 B10R1.64 OC(=O)Cc1nccn1C Amb17106786 [0,1,0,0,1,0|2,0,0]=4 4697 B10R1.64 OC(=O)Cc1o[n]cc1Br Amb25223827 [0,1,0,0,1,0|2,0,0]=4 4698 B10R1.64 OC(=O)Cc1occc1Br Amb18176122 [0,1,0,0,1,0|1,0,0]=3 4699 B10R1.64 OC(=O)Cc1occc1F Amb25133593 [0,1,0,0,1,0|1,0,0]=3 4700 B10R1.64 OC(=O)Cn1nccc1C Amb1946376 [0,1,0,0,1,0|2,0,0]=4 4701 B10R1.64 OC(=O)\C=C\1/C=CCC1=O Amb18643210 [0,1,0,0,1,0|0,0,2]=4 4702 B10R1.64 Oc1[n]c[nH]c1CC(O)=O Amb18202646 [0,1,0,0,1,0|2,0,0]=4 4703 B10R1.64 Oc1[n]cc[n]1CC(O)=O Amb18202659 [0,1,0,0,1,0|2,0,0]=4 4704 B10R1.281 OP(O)(=O)Cc1ccco1 Amb24734548 [0,1,0,0,1,0|2,0,0]=4 4705 B12R1.21 C=C(Br)CNc1ccc(N)cc1 Amb24752886 [0,1,0,0,0,1|2,0,0]=4 4706 B12R1.21 C=C(Br)COc1ccc(Cl)cc1 Amb25132088 [0,1,0,0,0,1|2,0,0]=4 4707 B12R1.21 C=C(Br)COc1ccc(F)cc1 Amb25078502 [0,1,0,0,0,1|2,0,0]=4 4708 B12R1.21 C=C(Br)COc1ccc(N)cc1 Amb18971535 [0,1,0,0,0,1|2,0,0]=4 4709 B12R1.21 C=C(Br)CSc1ccc(N)cc1 Amb18969573 [0,1,0,0,0,1|2,0,0]=4 4710 B12R1.21 C=C(Cl)CNc1ccc(F)cc1 Amb18969175 [0,1,0,0,0,1|2,0,0]=4 4711 B12R1.21 C=C(Cl)CNc1ccc(N)cc1 Amb24525129 [0,1,0,0,0,1|2,0,0]=4 4712 B12R1.21 C=C(Cl)COc1ccc(Cl)cc1 Amb24484276 [0,1,0,0,0,1|2,0,0]=4 4713 B12R1.21 C=C(Cl)COc1ccc(F)cc1 Amb25084810 [0,1,0,0,0,1|2,0,0]=4 4714 B12R1.21 C=C(Cl)COc1ccc(N)cc1 Amb18971520 [0,1,0,0,0,1|2,0,0]=4 4715 B12R1.21 C=C(Cl)CSc1ccc(Br)cc1 Amb25728844 [0,1,0,0,0,1|2,0,0]=4 4716 B12R1.21 C=C(Cl)CSc1ccc(Cl)cc1 Amb25093380 [0,1,0,0,0,1|2,0,0]=4 4717 B12R1.21 C=C(Cl)CSc1ccc(F)cc1 Amb24644981 [0,1,0,0,0,1|2,0,0]=4 4718 B12R1.21 C=C(Cl)CSc1ccc(O)cc1 Amb18319929 [0,1,0,0,0,1|2,0,0]=4 4719 B12R1.21 C=C(F)COc1ccc(Br)cc1 Amb23570540 [0,1,0,0,0,1|2,0,0]=4 4720 B12R1.21 CC(=C)CNc1ccc(cc1)Br Amb17306797 [0,1,0,0,0,1|2,0,0]=4 4721 B12R1.21 CC(=C)CNc1ccc(cc1)C Amb17306884 [0,1,0,0,0,1|2,0,0]=4 4722 B12R1.21 CC(=C)CNc1ccc(cc1)Cl Amb17307251 [0,1,0,0,0,1|2,0,0]=4 4723 B12R1.21 CC(=C)CNc1ccc(cc1)F Amb17306195 [0,1,0,0,0,1|2,0,0]=4 4724 B12R1.21 CC(=C)CNc1ccc(cc1)I Amb17306249 [0,1,0,0,0,1|2,0,0]=4 4725 B12R1.21 CC(=C)COc1ccc(Cl)cc1 Amb24367387 [0,1,0,0,0,1|2,0,0]=4 4726 B12R1.21 CC(=C)COc1ccc(cc1)F Amb2444928 [0,1,0,0,0,1|2,0,0]=4 4727 B12R1.21 CC(=C)COc1ccc(cc1)N Amb2081541 [0,1,0,0,0,1|2,0,0]=4 4728 B12R1.21 CC(=C)CSc1ccc(Br)cc1 Amb25051868 [0,1,0,0,0,1|2,0,0]=4 4729 B12R1.21 CC(=C)CSc1ccc(O)cc1 Amb18796319 [0,1,0,0,0,1|2,0,0]=4 4730 B12R1.21 CC(=N)NCc1ccc(Cl)cc1 Amb24483598 [0,1,0,0,0,1|2,0,0]=4 4731 B12R1.21 CC(=O)C#Cc1ccc(Cl)cc1 Amb24645414 [0,1,0,0,0,1|1,0,1]=4 4732 B12R1.21 CC(=O)C#Cc1ccc(F)cc1 Amb24484221 [0,1,0,0,0,1|1,0,1]=4 4733 B12R1.21 CC(=O)CCC=1C=CC(=O)NC1 Amb24346528 [0,1,0,0,0,1|2,0,0]=4 4734 B12R1.21 CC(=O)CCN1C=CC(=O)C=C1 Amb24483600 [0,1,0,0,0,1|2,0,0]=4 4735 B12R1.21 CC(=O)CCc1ccc(Br)c[n]1 Amb25729593 [0,1,0,0,0,1|2,0,0]=4 4736 B12R1.21 CC(=O)CCc1ccc(Cl)[n]c1 Amb25725533 [0,1,0,0,0,1|2,0,0]=4 4737 B12R1.21 CC(=O)CNc1ccc(Cl)cc1 Amb24729554 [0,1,0,0,0,1|1,0,0]=3 4738 B12R1.21 CC(=O)COc1ccc(Br)[n]c1 Amb25346012 [0,1,0,0,0,1|2,0,0]=4 4739 B12R1.21 CC(=O)COc1ccc(Cl)[n]c1 Amb24431620 [0,1,0,0,0,1|2,0,0]=4 4740 B12R1.21 CC(=O)COc1ccc(I)[n]c1 Amb25306196 [0,1,0,0,0,1|2,0,0]=4 4741 B12R1.21 CC(=O)COc1ccc(O)cc1 Amb18646453 [0,1,0,0,0,1|1,0,0]=3 4742 B12R1.21 CC(=O)COc1ccc(cc1)Br Amb17601394 [0,1,0,0,0,1|1,0,0]=3 4743 B12R1.21 CC(=O)COc1ccc(cc1)Cl Amb1094739 [0,1,0,0,0,1|1,0,0]=3 4744 B12R1.21 CC(=O)COc1ccc(cc1)N Amb17110083 [0,1,0,0,0,1|1,0,0]=3 4745 B12R1.21 CC(=O)CSc1ccc(Br)c[n]1 Amb25318490 [0,1,0,0,0,1|2,0,0]=4 4746 B12R1.21 CC(=O)CSc1ccc(Cl)c[n]1 Amb25337175 [0,1,0,0,0,1|2,0,0]=4 4747 B12R1.21 CC(=O)CSc1ccc(nc1)N Amb17305706 [0,1,0,0,0,1|2,0,0]=4 4748 B12R1.21 CC(=O)NCC=1C=CC(=O)NC1 Amb25232374 [0,1,0,0,0,1|2,0,0]=4 4749 B12R1.21 CC(=O)NCc1ccc(Br)cc1 Amb20622638 [0,1,0,0,0,1|1,0,0]=3 4750 B12R1.21 CC(=O)NCc1ccc(cc1)O Amb10549495 [0,1,0,0,0,1|1,0,0]=3 4751 B12R1.21 CC(=O)NCc1ccc(cn1)N Amb13890645 [0,1,0,0,0,1|2,0,0]=4 4752 B12R1.21 CC(=O)NCc1ccc(nc1)Cl Amb10608428 [0,1,0,0,0,1|2,0,0]=4 4753 B12R1.21 CC(=O)NNc1ccc(N)cc1 Amb18646317 [0,1,0,0,0,1|2,0,0]=4 4754 B12R1.21 CC(=O)NNc1ccc(cc1)Br Amb1040272 [0,1,0,0,0,1|2,0,0]=4 4755 B12R1.21 CC(=O)NNc1ccc(cc1)C Amb1040273 [0,1,0,0,0,1|2,0,0]=4 4756 B12R1.21 CC(=O)NOc1ccc(N)cc1 Amb25742910 [0,1,0,0,0,1|2,0,0]=4 4757 B12R1.21 CC(=O)OCc1ccc(Cl)c[n]1 Amb25220252 [0,1,0,0,0,1|2,0,0]=4 4758 B12R1.21 CC(=O)OCc1ccc(I)cc1 Amb25687671 [0,1,0,0,0,1|1,0,0]=3 4759 B12R1.21 CC(=O)OCc1ccc(N)[n]c1 Amb24689359 [0,1,0,0,0,1|2,0,0]=4 4760 B12R1.21 CC(=O)OCc1ccc(N)c[n]1 Amb20248322 [0,1,0,0,0,1|2,0,0]=4 4761 B12R1.21 CC(=O)OCc1ccc(O)c[n]1 Amb18646673 [0,1,0,0,0,1|2,0,0]=4 4762 B12R1.21 CC(=O)OCc1ccc(O)cc1 Amb18646455 [0,1,0,0,0,1|1,0,0]=3 4763 B12R1.21 CC(=O)OCc1ccc(cc1)Cl Amb2421366 [0,1,0,0,0,1|1,0,0]=3 4764 B12R1.21 CC(=O)ONc1ccc(O)cc1 Amb24497023 [0,1,0,0,0,1|2,0,0]=4 4765 B12R1.21 CC(=O)OOc1ccc(N)cc1 Amb22233285 [0,1,0,0,0,1|2,0,0]=4 4766 B12R1.21 CC(=O)O[Hg]c1ccc(N)cc1 Amb22351859 [0,1,0,0,0,1|2,0,0]=4 4767 B12R1.21 CC(=O)SCc1ccc(Br)cc1 Amb22338619 [0,1,0,0,0,1|1,0,0]=3 4768 B12R1.21 CC(=O)SCc1ccc(Cl)[n]c1 Amb25223594 [0,1,0,0,0,1|2,0,0]=4 4769 B12R1.21 CC(=O)SCc1ccc(N)[n]c1 Amb24388564 [0,1,0,0,0,1|2,0,0]=4 4770 B12R1.21 CC(=O)SSc1ccc(O)cc1 Amb25373390 [0,1,0,0,0,1|2,0,0]=4 4771 B12R1.21 CC(=O)\C=C\c1ccc(I)cc1 Amb25736694 [0,1,0,0,0,1|1,0,1]=4 4772 B12R1.21 CC(=O)\C=C\c1ccc(N)cc1 Amb23247750 [0,1,0,0,0,1|1,0,1]=4 4773 B12R1.21 CC(=O)\N=C/c1ccc(Cl)cc1 Amb24073008 [0,1,0,0,0,1|1,0,1]=4 4774 B12R1.21 CC(=O)\N=C\c1ccc(Cl)cc1 Amb24404018 [0,1,0,0,0,1|1,0,1]=4 4775 B12R1.21 CC(=O)\N=C\c1ccc(O)cc1 Amb25059643 [0,1,0,0,0,1|1,0,1]=4 4776 B12R1.21 CC(=S)NCc1ccc(Cl)cc1 Amb25858106 [0,1,0,0,0,1|1,1,0]=4 4777 B12R1.21 CC(=S)NCc1ccc(F)cc1 Amb25139700 [0,1,0,0,0,1|1,1,0]=4 4778 B12R1.21 CC(CCc1ccc(cc1)Cl)O Amb17507284 [0,1,0,0,0,1|1,0,1]=4 4779 B12R1.21 CC(CCc1ccc(cc1)F)O Amb17507285 [0,1,0,0,0,1|1,0,1]=4 4780 B12R1.21 CC(CCc1ccc(cc1)O)O Amb1110722 [0,1,0,0,0,1|1,0,1]=4 4781 B12R1.21 CC(CNc1ccc(cc1)Br)O Amb17142609 [0,1,0,0,0,1|1,0,1]=4 4782 B12R1.21 CC(CNc1ccc(cc1)C)O Amb17138594 [0,1,0,0,0,1|1,0,1]=4 4783 B12R1.21 CC(CNc1ccc(cc1)Cl)O Amb17139127 [0,1,0,0,0,1|1,0,1]=4 4784 B12R1.21 CC(CNc1ccc(cc1)F)O Amb17138651 [0,1,0,0,0,1|1,0,1]=4 4785 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [0,1,0,0,0,1|1,0,1]=4 4786 B12R1.21 CC(O)COc1ccc(Cl)cc1 Amb24064341 [0,1,0,0,0,1|1,0,1]=4 4787 B12R1.21 CC(O)COc1ccc(F)cc1 Amb18806455 [0,1,0,0,0,1|1,0,1]=4 4788 B12R1.21 CC(O)COc1ccc(I)cc1 Amb25115077 [0,1,0,0,0,1|1,0,1]=4 4789 B12R1.21 CC(O)COc1ccc(N)cc1 Amb18290039 [0,1,0,0,0,1|1,0,1]=4 4790 B12R1.21 CC(O)CSc1ccc(F)cc1 Amb19058402 [0,1,0,0,0,1|1,0,1]=4 4791 B12R1.21 CC(O)CSc1ccc(N)cc1 Amb18969621 [0,1,0,0,0,1|1,0,1]=4 4792 B12R1.21 CC(O)CSc1ccc(O)cc1 Amb19057513 [0,1,0,0,0,1|1,0,1]=4 4793 B12R1.21 CS(=O)CCc1ccc(N)cc1 Amb18974603 [0,1,0,0,0,1|2,0,0]=4 4794 B12R1.21 CS(=O)CCc1ccc(cc1)C Amb16185126 [0,1,0,0,0,1|2,0,0]=4 4795 B12R1.21 CS(=O)COc1ccc(Br)cc1 Amb25692440 [0,1,0,0,0,1|2,0,0]=4 4796 B12R1.21 CS(=O)NCc1ccc(Br)cc1 Amb25177255 [0,1,0,0,0,1|2,0,0]=4 4797 B12R1.21 CS(=O)NCc1ccc(N)cc1 Amb24582929 [0,1,0,0,0,1|2,0,0]=4 4798 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [0,1,0,0,0,1|1,0,1]=4 4799 B12R1.21 C[C@@H](O)CNc1ccc(F)cc1 Amb25719811 [0,1,0,0,0,1|1,0,1]=4 4800 B12R1.21 C[C@@H](O)COc1ccc(F)cc1 Amb22351329 [0,1,0,0,0,1|1,0,1]=4 4801 B12R1.21 C[C@@H](O)COc1ccc(I)cc1 Amb25373827 [0,1,0,0,0,1|1,0,1]=4 4802 B12R1.21 C[C@@H](O)CSc1ccc(Cl)cc1 Amb25179956 [0,1,0,0,0,1|1,0,1]=4 4803 B12R1.21 C[C@@H](O)CSc1ccc(F)cc1 Amb25073680 [0,1,0,0,0,1|1,0,1]=4 4804 B12R1.21 C[C@H](O)CNc1ccc(Br)cc1 Amb25719810 [0,1,0,0,0,1|1,0,1]=4 4805 B12R1.21 C[C@H](O)COc1ccc(F)cc1 Amb22351296 [0,1,0,0,0,1|1,0,1]=4 4806 B12R1.21 C[C@H](O)COc1ccc(I)cc1 Amb25724275 [0,1,0,0,0,1|1,0,1]=4 4807 B12R1.21 C[C@H](O)CSc1ccc(Br)cc1 Amb24636648 [0,1,0,0,0,1|1,0,1]=4 4808 B12R1.21 C[C@H](O)CSc1ccc(F)cc1 Amb24379354 [0,1,0,0,0,1|1,0,1]=4 4809 B12R1.21 C[n+]1ccc(cc1)SCC(O)=O Amb22482794 [0,1,0,0,0,1|1,0,0]=3 4810 B12R1.21 Cc1c[n]c(CCC(O)=O)c[n]1 Amb18827880 [0,1,0,0,0,1|2,0,0]=4 4811 B12R1.21 Cc1c[n]c([n]c1)SCC(O)=O Amb18977501 [0,1,0,0,0,1|2,0,0]=4 4812 B12R1.21 Cc1ccc(CCC(C)=O)c[n]1 Amb25197877 [0,1,0,0,0,1|2,0,0]=4 4813 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [0,1,0,0,0,1|1,0,1]=4 4814 B12R1.21 Cc1ccc(CCC(N)=N)cc1 Amb18065466 [0,1,0,0,0,1|2,0,0]=4 4815 B12R1.21 Cc1ccc(CCC(O)=O)[n]c1 Amb22886574 [0,1,0,0,0,1|1,0,0]=3 4816 B12R1.21 Cc1ccc(CCC(O)=O)c[n]1 Amb18828437 [0,1,0,0,0,1|1,0,0]=3 4817 B12R1.21 Cc1ccc(CNC(C)=N)cc1 Amb24443445 [0,1,0,0,0,1|2,0,0]=4 4818 B12R1.21 Cc1ccc(CNC(C)=O)[n]c1 Amb25799544 [0,1,0,0,0,1|2,0,0]=4 4819 B12R1.21 Cc1ccc(CNC(C)=S)cc1 Amb25725010 [0,1,0,0,0,1|1,1,0]=4 4820 B12R1.21 Cc1ccc(CNC(N)=N)cc1 Amb22093607 [0,1,0,0,0,1|2,0,0]=4 4821 B12R1.21 Cc1ccc(CNC(N)=O)[n]c1 Amb25260564 [0,1,0,0,0,1|2,0,0]=4 4822 B12R1.21 Cc1ccc(CNC(N)=O)c[n]1 Amb18798406 [0,1,0,0,0,1|2,0,0]=4 4823 B12R1.21 Cc1ccc(CNC(S)=S)cc1 Amb25801420 [0,1,0,0,0,1|0,2,0]=4 4824 B12R1.21 Cc1ccc(COC(C)=O)[n]c1 Amb24086564 [0,1,0,0,0,1|2,0,0]=4 4825 B12R1.21 Cc1ccc(COC(C)=O)c[n]1 Amb22750507 [0,1,0,0,0,1|2,0,0]=4 4826 B12R1.21 Cc1ccc(CSC(N)=N)cc1 Amb20675974 [0,1,0,0,0,1|2,0,0]=4 4827 B12R1.21 Cc1ccc([n]c1)OCC(N)=O Amb25036522 [0,1,0,0,0,1|2,0,0]=4 4828 B12R1.21 Cc1ccc([n]c1)OCC(O)=O Amb24359369 [0,1,0,0,0,1|1,0,0]=3 4829 B12R1.21 Cc1ccc([n]c1)SCC(C)=O Amb24351751 [0,1,0,0,0,1|2,0,0]=4 4830 B12R1.21 Cc1ccc(\C=C/C(C)=O)cc1 Amb24422503 [0,1,0,0,0,1|1,0,1]=4 4831 B12R1.21 Cc1ccc(\C=C\C(O)=O)[n]c1 Amb24711355 [0,1,0,0,0,1|1,0,1]=4 4832 B12R1.21 Cc1ccc(\C=C\C(O)=O)c[n]1 Amb18645813 [0,1,0,0,0,1|1,0,1]=4 4833 B12R1.21 Cc1ccc(c[n]1)OCC(N)=O Amb25279476 [0,1,0,0,0,1|2,0,0]=4 4834 B12R1.21 Cc1ccc(c[n]1)OCC(O)=O Amb18991754 [0,1,0,0,0,1|1,0,0]=3 4835 B12R1.21 Cc1ccc(cc1)C#CC(N)=O Amb25725058 [0,1,0,0,0,1|1,0,1]=4 4836 B12R1.21 Cc1ccc(cc1)CC[N+](=O)[O-] Amb17400178 [0,1,0,0,0,1|1,0,1]=4 4837 B12R1.21 Cc1ccc(cc1)NCC(=C)Cl Amb18809687 [0,1,0,0,0,1|2,0,0]=4 4838 B12R1.21 Cc1ccc(cc1)NCC(C)=O Amb25068510 [0,1,0,0,0,1|1,0,0]=3 4839 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O Amb24626471 [0,1,0,0,0,1|1,0,1]=4 4840 B12R1.21 Cc1ccc(cc1)NNC(N)=O Amb24585130 [0,1,0,0,0,1|2,0,0]=4 4841 B12R1.21 Cc1ccc(cc1)NOC(C)=O Amb24073550 [0,1,0,0,0,1|2,0,0]=4 4842 B12R1.21 Cc1ccc(cc1)OCC(C)O Amb18182640 [0,1,0,0,0,1|1,0,1]=4 4843 B12R1.21 Cc1ccc(cc1)OCC(O)O Amb24588428 [0,1,0,0,0,1|0,0,2]=4 4844 B12R1.21 Cc1ccc(cc1)SCC(C)=S Amb24607333 [0,1,0,0,0,1|1,1,0]=4 4845 B12R1.21 Cc1ccc(cc1)SCC(C)O Amb19054498 [0,1,0,0,0,1|1,0,1]=4 4846 B12R1.21 Cc1ccc(cc1)SCC(N)=S Amb24552332 [0,1,0,0,0,1|1,1,0]=4 4847 B12R1.21 Cc1ccc(cc1)SNC(N)=O Amb25685349 [0,1,0,0,0,1|2,0,0]=4 4848 B12R1.21 Cc1ccc(cc1)\N=C\C(C)=O Amb25334923 [0,1,0,0,0,1|1,0,1]=4 4849 B12R1.21 Cc1ccc(cn1)C#CC(=O)O Amb2224468 [0,1,0,0,0,1|1,0,1]=4 4850 B12R1.21 Cc1ccc(nn1)OCC(=O)O Amb13783648 [0,1,0,0,0,1|2,0,0]=4 4851 B12R1.21 Cc1ccc(nn1)SCC(=O)O Amb17516089 [0,1,0,0,0,1|2,0,0]=4 4852 B12R1.21 ClC(=O)CCc1ccc(cc1)C Amb17142993 [0,1,0,0,0,1|1,0,0]=3 4853 B12R1.21 ClC(=O)CCc1ccc(cc1)Cl Amb17143273 [0,1,0,0,0,1|1,0,0]=3 4854 B12R1.21 ClC(=O)COc1ccc(cc1)Br Amb16186415 [0,1,0,0,0,1|1,0,0]=3 4855 B12R1.21 ClC(=O)COc1ccc(cc1)C Amb10880011 [0,1,0,0,0,1|1,0,0]=3 4856 B12R1.21 ClC(=O)CSc1ccc(cc1)Cl Amb17143821 [0,1,0,0,0,1|1,0,0]=3 4857 B12R1.21 ClC(=O)\C=C\c1ccc(cc1)Br Amb16230246 [0,1,0,0,0,1|1,0,1]=4 4858 B12R1.21 ClC(=O)\C=C\c1ccc(cc1)C Amb16230247 [0,1,0,0,0,1|1,0,1]=4 4859 B12R1.21 ClC(=O)\C=C\c1ccc(cc1)Cl Amb16186540 [0,1,0,0,0,1|1,0,1]=4 4860 B12R1.21 N=C(COc1ccc(cc1)F)[NH3+] Amb2434228 [0,1,0,0,0,1|2,0,0]=4 4861 B12R1.21 NC(=N)CCc1ccc(Br)cc1 Amb18571448 [0,1,0,0,0,1|2,0,0]=4 4862 B12R1.21 NC(=N)CCc1ccc(Cl)cc1 Amb18564231 [0,1,0,0,0,1|2,0,0]=4 4863 B12R1.21 NC(=N)CCc1ccc(F)cc1 Amb18563719 [0,1,0,0,0,1|2,0,0]=4 4864 B12R1.21 NC(=N)CCc1ccc(cc1)O Amb13883011 [0,1,0,0,0,1|2,0,0]=4 4865 B12R1.21 NC(=N)COc1ccc(F)cc1 Amb19894602 [0,1,0,0,0,1|2,0,0]=4 4866 B12R1.21 NC(=N)NCc1ccc(Br)cc1 Amb24369104 [0,1,0,0,0,1|2,0,0]=4 4867 B12R1.21 NC(=N)NCc1ccc(Cl)cc1 Amb19068642 [0,1,0,0,0,1|2,0,0]=4 4868 B12R1.21 NC(=N)NCc1ccc(F)cc1 Amb19886684 [0,1,0,0,0,1|2,0,0]=4 4869 B12R1.21 NC(=N)NCc1ccc(O)cc1 Amb25046511 [0,1,0,0,0,1|2,0,0]=4 4870 B12R1.21 NC(=N)NCc1ccc(cc1)C Amb13995591 [0,1,0,0,0,1|2,0,0]=4 4871 B12R1.21 NC(=N)SCc1ccc(Cl)cc1 Amb20675979 [0,1,0,0,0,1|2,0,0]=4 4872 B12R1.21 NC(=N)SCc1ccc(F)cc1 Amb20675982 [0,1,0,0,0,1|2,0,0]=4 4873 B12R1.21 NC(=N)SCc1ccc(I)cc1 Amb20675972 [0,1,0,0,0,1|2,0,0]=4 4874 B12R1.21 NC(=N)SCc1ccc(cc1)Br Amb1819103 [0,1,0,0,0,1|2,0,0]=4 4875 B12R1.21 NC(=N)SCc1ccc(cc1)C Amb11227395 [0,1,0,0,0,1|2,0,0]=4 4876 B12R1.21 NC(=O)C#Cc1ccc(Br)cc1 Amb24116419 [0,1,0,0,0,1|1,0,1]=4 4877 B12R1.21 NC(=O)C#Cc1ccc(Cl)cc1 Amb23401544 [0,1,0,0,0,1|1,0,1]=4 4878 B12R1.21 NC(=O)CCN1C=CC(=O)C=C1 Amb18788434 [0,1,0,0,0,1|2,0,0]=4 4879 B12R1.21 NC(=O)CCc1cc[n+](cc1)C Amb10553742 [0,1,0,0,0,1|2,0,0]=4 4880 B12R1.21 NC(=O)CCc1cc[n+](cc1)[O-] Amb10553010 [0,1,0,0,0,1|2,0,0]=4 4881 B12R1.21 NC(=O)CCc1ccc(cc1)Br Amb17407065 [0,1,0,0,0,1|1,0,0]=3 4882 B12R1.21 NC(=O)CCc1ccc(cc1)Cl Amb17142998 [0,1,0,0,0,1|1,0,0]=3 4883 B12R1.21 NC(=O)CNc1ccc(F)c[n]1 Amb18291151 [0,1,0,0,0,1|2,0,0]=4 4884 B12R1.21 NC(=O)CNc1ccc(cn1)N Amb1119325 [0,1,0,0,0,1|2,0,0]=4 4885 B12R1.21 NC(=O)COc1ccc(Br)[n]c1 Amb24647152 [0,1,0,0,0,1|2,0,0]=4 4886 B12R1.21 NC(=O)COc1ccc(Cl)c[n]1 Amb25724408 [0,1,0,0,0,1|2,0,0]=4 4887 B12R1.21 NC(=O)COc1ccc(cc1)F Amb2456996 [0,1,0,0,0,1|1,0,0]=3 4888 B12R1.21 NC(=O)COc1ccc(cc1)I Amb173371 [0,1,0,0,0,1|1,0,0]=3 4889 B12R1.21 NC(=O)CSc1ccc(Br)c[n]1 Amb24721451 [0,1,0,0,0,1|2,0,0]=4 4890 B12R1.21 NC(=O)CSc1ccc(O)cc1 Amb19057102 [0,1,0,0,0,1|1,0,0]=3 4891 B12R1.21 NC(=O)CSc1ccc(cc1)Br Amb1218433 [0,1,0,0,0,1|1,0,0]=3 4892 B12R1.21 NC(=O)CSc1ccc(cc1)Cl Amb1530887 [0,1,0,0,0,1|1,0,0]=3 4893 B12R1.21 NC(=O)CSc1ccc(cc1)F Amb1646201 [0,1,0,0,0,1|1,0,0]=3 4894 B12R1.21 NC(=O)NCc1ccc(Cl)[n]c1 Amb25119599 [0,1,0,0,0,1|2,0,0]=4 4895 B12R1.21 NC(=O)NCc1ccc(cc1)Br Amb1139295 [0,1,0,0,0,1|1,0,0]=3 4896 B12R1.21 NC(=O)NCc1ccc(cc1)C Amb1134976 [0,1,0,0,0,1|1,0,0]=3 4897 B12R1.21 NC(=O)NCc1ccc(cc1)Cl Amb2435054 [0,1,0,0,0,1|1,0,0]=3 4898 B12R1.21 NC(=O)NCc1ccc(cc1)F Amb1128118 [0,1,0,0,0,1|1,0,0]=3 4899 B12R1.21 NC(=O)NNc1ccc(Cl)cc1 Amb24504721 [0,1,0,0,0,1|2,0,0]=4 4900 B12R1.21 NC(=O)NNc1ccc(O)cc1 Amb24635768 [0,1,0,0,0,1|2,0,0]=4 4901 B12R1.21 NC(=O)OCc1ccc(Cl)cc1 Amb25737813 [0,1,0,0,0,1|1,0,0]=3 4902 B12R1.21 NC(=O)\C=C/c1ccc(cc1)Cl Amb17142990 [0,1,0,0,0,1|1,0,1]=4 4903 B12R1.21 NC(=O)\C=C\c1ccc(I)cc1 Amb24758181 [0,1,0,0,0,1|1,0,1]=4 4904 B12R1.21 NC(=O)\C=C\c1ccc(cc1)C Amb1662617 [0,1,0,0,0,1|1,0,1]=4 4905 B12R1.21 NC(=O)\N=C\c1ccc(Cl)cc1 Amb24557825 [0,1,0,0,0,1|1,0,1]=4 4906 B12R1.21 NC(=O)\N=N\c1ccc(Cl)cc1 Amb24355886 [0,1,0,0,0,1|2,0,0]=4 4907 B12R1.21 NC(=O)\N=N\c1ccc(O)cc1 Amb24743510 [0,1,0,0,0,1|2,0,0]=4 4908 B12R1.21 NC(=S)CCc1ccc(cc1)Cl Amb17237061 [0,1,0,0,0,1|1,1,0]=4 4909 B12R1.21 NC(=S)CNc1ccc(cc1)C Amb17233761 [0,1,0,0,0,1|1,1,0]=4 4910 B12R1.21 NC(=S)COc1ccc(cc1)F Amb1106123 [0,1,0,0,0,1|1,1,0]=4 4911 B12R1.21 NC(=S)CSc1ccc(F)cc1 Amb25112981 [0,1,0,0,0,1|1,1,0]=4 4912 B12R1.21 NC(=S)NCc1ccc(I)cc1 Amb25256040 [0,1,0,0,0,1|1,1,0]=4 4913 B12R1.21 NC(=S)NCc1ccc(cc1)F Amb1663430 [0,1,0,0,0,1|1,1,0]=4 4914 B12R1.21 NC(=[NH2+])SCc1ccc(Br)cc1 Amb22469212 [0,1,0,0,0,1|2,0,0]=4 4915 B12R1.21 NC(=[NH2+])SCc1ccc(Cl)cc1 Amb22445970 [0,1,0,0,0,1|2,0,0]=4 4916 B12R1.21 NC(=[NH2+])SCc1ccc(Cl)cc1 Amb22468389 [0,1,0,0,0,1|2,0,0]=4 4917 B12R1.21 NC(=[NH2+])SCc1ccc(cc1)C Amb2407330 [0,1,0,0,0,1|2,0,0]=4 4918 B12R1.21 NC(=[NH2+])SCc1ccc(cc1)F Amb2407314 [0,1,0,0,0,1|2,0,0]=4 4919 B12R1.21 NC(=[S+]Cc1ccc(cc1)Cl)N Amb10844822 [0,1,0,0,0,1|2,0,0]=4 4920 B12R1.21 Nc1c[n]c(NCC(O)=O)[n]c1 Amb18295965 [0,1,0,0,0,1|2,0,0]=4 4921 B12R1.21 Nc1ccc(CCC(O)=O)[n]c1 Amb24663664 [0,1,0,0,0,1|1,0,0]=3 4922 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb19958679 [0,1,0,0,0,1|1,0,0]=3 4923 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb22546430 [0,1,0,0,0,1|1,0,0]=3 4924 B12R1.21 Nc1ccc(CC[N+]([O-])=O)cc1 Amb24406773 [0,1,0,0,0,1|1,0,1]=4 4925 B12R1.21 Nc1ccc(CNC(N)=O)c[n]1 Amb24373387 [0,1,0,0,0,1|2,0,0]=4 4926 B12R1.21 Nc1ccc([n]c1)SCC(O)=O Amb18291280 [0,1,0,0,0,1|1,0,0]=3 4927 B12R1.21 Nc1ccc(\C=C\C(N)=O)cc1 Amb25365075 [0,1,0,0,0,1|1,0,1]=4 4928 B12R1.21 Nc1ccc(\C=C\C(O)=O)c[n]1 Amb19958812 [0,1,0,0,0,1|1,0,1]=4 4929 B12R1.21 Nc1ccc(c[n]1)NCC(O)=O Amb18987715 [0,1,0,0,0,1|1,0,0]=3 4930 B12R1.21 Nc1ccc(cc1)C#CC(O)=O Amb25111179 [0,1,0,0,0,1|0,0,1]=3 4931 B12R1.21 Nc1ccc(cc1)NCC(O)=O Amb18296058 [0,1,0,0,0,1|0,0,0]=2 4932 B12R1.21 Nc1ccc(cc1)NCS(O)=O Amb25732370 [0,1,0,0,0,1|1,0,0]=3 4933 B12R1.21 Nc1ccc(cc1)NNC(N)=O Amb24649955 [0,1,0,0,0,1|2,0,0]=4 4934 B12R1.21 Nc1ccc(cc1)OCC(N)=S Amb25821999 [0,1,0,0,0,1|1,1,0]=4 4935 B12R1.21 Nc1ccc(cc1)OCC(O)=O Amb22751390 [0,1,0,0,0,1|0,0,0]=2 4936 B12R1.21 Nc1ccc(cc1)\N=N\C(N)=O Amb24594998 [0,1,0,0,0,1|2,0,0]=4 4937 B12R1.21 O=C(Cl)C#Cc1ccc(Cl)cc1 Amb25331050 [0,1,0,0,0,1|1,0,1]=4 4938 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [0,1,0,0,0,1|1,0,0]=3 4939 B12R1.21 O=C(Cl)CNc1ccc(Cl)cc1 Amb24537780 [0,1,0,0,0,1|1,0,0]=3 4940 B12R1.21 O=C(Cl)OCc1ccc(Br)cc1 Amb22059767 [0,1,0,0,0,1|1,0,0]=3 4941 B12R1.21 O=C(Cl)OCc1ccc(F)cc1 Amb24471576 [0,1,0,0,0,1|1,0,0]=3 4942 B12R1.21 OB(O)CCc1ccc(Cl)cc1 Amb25667152 [0,1,0,0,0,1|1,0,1]=4 4943 B12R1.21 OB(O)CCc1ccc(F)cc1 Amb25149900 [0,1,0,0,0,1|1,0,1]=4 4944 B12R1.21 OC(=O)C#Cc1ccc(Cl)c[n]1 Amb25071800 [0,1,0,0,0,1|1,0,1]=4 4945 B12R1.21 OC(=O)C#Cc1ccc(cc1)C Amb17138496 [0,1,0,0,0,1|0,0,1]=3 4946 B12R1.21 OC(=O)C#Cc1ccc(cc1)Cl Amb10575987 [0,1,0,0,0,1|0,0,1]=3 4947 B12R1.21 OC(=O)C#Cc1ccc(cc1)F Amb17138570 [0,1,0,0,0,1|0,0,1]=3 4948 B12R1.21 OC(=O)C=Cc1ccc(I)cc1 Amb24079623 [0,1,0,0,0,1|0,0,1]=3 4949 B12R1.21 OC(=O)CCC1=CNC(=O)N=C1 Amb24541305 [0,1,0,0,0,1|2,0,0]=4 4950 B12R1.21 OC(=O)CCC=1C=CC(=O)NN1 Amb18212062 [0,1,0,0,0,1|2,0,0]=4 4951 B12R1.21 OC(=O)CCN1C=CC(=O)C=C1 Amb18534262 [0,1,0,0,0,1|1,0,0]=3 4952 B12R1.21 OC(=O)CCN1C=CC(=S)C=C1 Amb25751169 [0,1,0,0,0,1|1,0,0]=3 4953 B12R1.21 OC(=O)CC[n+]1ccc(cc1)C Amb17098177 [0,1,0,0,0,1|1,0,0]=3 4954 B12R1.21 OC(=O)CCc1[n]cc(F)c[n]1 Amb24673852 [0,1,0,0,0,1|2,0,0]=4 4955 B12R1.21 OC(=O)CCc1ccc(Br)[n]c1 Amb22292277 [0,1,0,0,0,1|1,0,0]=3 4956 B12R1.21 OC(=O)CCc1ccc(Cl)[n]c1 Amb18649204 [0,1,0,0,0,1|1,0,0]=3 4957 B12R1.21 OC(=O)CCc1ccc(F)[n]c1 Amb22886575 [0,1,0,0,0,1|1,0,0]=3 4958 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [0,1,0,0,0,1|0,0,0]=2 4959 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [0,1,0,0,0,1|0,0,0]=2 4960 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [0,1,0,0,0,1|0,0,0]=2 4961 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [0,1,0,0,0,1|0,0,0]=2 4962 B12R1.21 OC(=O)CNc1[n]cc(Br)c[n]1 Amb24343808 [0,1,0,0,0,1|2,0,0]=4 4963 B12R1.21 OC(=O)CNc1ccc(cc1)Br Amb1981434 [0,1,0,0,0,1|0,0,0]=2 4964 B12R1.21 OC(=O)CNc1ccc(cc1)C Amb1106469 [0,1,0,0,0,1|0,0,0]=2 4965 B12R1.21 OC(=O)CNc1ccc(cc1)Cl Amb1486152 [0,1,0,0,0,1|0,0,0]=2 4966 B12R1.21 OC(=O)CNc1ccc(cc1)O Amb1950558 [0,1,0,0,0,1|0,0,0]=2 4967 B12R1.21 OC(=O)CNc1ccc(cn1)N Amb17041212 [0,1,0,0,0,1|1,0,0]=3 4968 B12R1.21 OC(=O)COC=1C=CC(=O)NN1 Amb17933903 [0,1,0,0,0,1|2,0,0]=4 4969 B12R1.21 OC(=O)CON1C=CC(=O)C=C1 Amb18647100 [0,1,0,0,0,1|1,0,0]=3 4970 B12R1.21 OC(=O)COc1[n]cc(Br)c[n]1 Amb22495969 [0,1,0,0,0,1|2,0,0]=4 4971 B12R1.21 OC(=O)COc1[n]cc(Cl)c[n]1 Amb25050767 [0,1,0,0,0,1|2,0,0]=4 4972 B12R1.21 OC(=O)COc1[n]cc(I)c[n]1 Amb25280340 [0,1,0,0,0,1|2,0,0]=4 4973 B12R1.21 OC(=O)COc1ccc(F)c[n]1 Amb24748685 [0,1,0,0,0,1|1,0,0]=3 4974 B12R1.21 OC(=O)COc1ccc(cc1)Cl Amb1830178 [0,1,0,0,0,1|0,0,0]=2 4975 B12R1.21 OC(=O)COc1ccc(cc1)F Amb1210357 [0,1,0,0,0,1|0,0,0]=2 4976 B12R1.21 OC(=O)COc1ccc(cc1)I Amb1152251 [0,1,0,0,0,1|0,0,0]=2 4977 B12R1.21 OC(=O)COc1ccc(cc1)N Amb1034889 [0,1,0,0,0,1|0,0,0]=2 4978 B12R1.21 OC(=O)CSC=1C=CC(=O)NN1 Amb18538521 [0,1,0,0,0,1|2,0,0]=4 4979 B12R1.21 OC(=O)CSC=1C=CC(=S)NN1 Amb24682683 [0,1,0,0,0,1|2,0,0]=4 4980 B12R1.21 OC(=O)CSc1[n]cc(Cl)c[n]1 Amb24113231 [0,1,0,0,0,1|2,0,0]=4 4981 B12R1.21 OC(=O)CSc1[n]cc(I)c[n]1 Amb25125790 [0,1,0,0,0,1|2,0,0]=4 4982 B12R1.21 OC(=O)CSc1c[n]c(Cl)c[n]1 Amb24541262 [0,1,0,0,0,1|2,0,0]=4 4983 B12R1.21 OC(=O)CSc1ccc(F)c[n]1 Amb18976422 [0,1,0,0,0,1|1,0,0]=3 4984 B12R1.21 OC(=O)CSc1ccc(S)cc1 Amb24341890 [0,1,0,0,0,1|0,0,0]=2 4985 B12R1.21 OC(=O)CSc1ccc(cc1)Br Amb1208368 [0,1,0,0,0,1|0,0,0]=2 4986 B12R1.21 OC(=O)CSc1ccc(cc1)C Amb1197696 [0,1,0,0,0,1|0,0,0]=2 4987 B12R1.21 OC(=O)CSc1ccc(cc1)F Amb1209262 [0,1,0,0,0,1|0,0,0]=2 4988 B12R1.21 OC(=O)CSc1ccc(nc1)N Amb17305688 [0,1,0,0,0,1|1,0,0]=3 4989 B12R1.21 OC(=O)NCc1ccc(Cl)[n]c1 Amb24068954 [0,1,0,0,0,1|1,0,0]=3 4990 B12R1.21 OC(=O)\C=C/c1ccc(F)cc1 Amb24712642 [0,1,0,0,0,1|0,0,1]=3 4991 B12R1.21 OC(=O)\C=C/c1ccc(cc1)Cl Amb2553273 [0,1,0,0,0,1|0,0,1]=3 4992 B12R1.21 OC(=O)\C=C\c1ccc(Br)[n]c1 Amb21864750 [0,1,0,0,0,1|1,0,1]=4 4993 B12R1.21 OC(=O)\C=C\c1ccc(Br)c[n]1 Amb24593980 [0,1,0,0,0,1|1,0,1]=4 4994 B12R1.21 OC(=O)\C=C\c1ccc(Cl)[n]c1 Amb22002669 [0,1,0,0,0,1|1,0,1]=4 4995 B12R1.21 OC(=O)\C=C\c1ccc(F)c[n]1 Amb21962831 [0,1,0,0,0,1|1,0,1]=4 4996 B12R1.21 OC(=O)\C=C\c1ccc(cc1)Br Amb1209603 [0,1,0,0,0,1|0,0,1]=3 4997 B12R1.21 OC(=O)\C=C\c1ccc(cc1)Cl Amb1210744 [0,1,0,0,0,1|0,0,1]=3 4998 B12R1.21 OC(=O)\C=C\c1ccc(cc1)I Amb2227429 [0,1,0,0,0,1|0,0,1]=3 4999 B12R1.21 OC(=O)\C=C\c1ccc(cc1)N Amb1196689 [0,1,0,0,0,1|0,0,1]=3 5000 B12R1.21 OC(=O)\C=C\c1ccc(cc1)O Amb1207922 [0,1,0,0,0,1|0,0,1]=3 5001 B12R1.21 OC(=O)\C=C\c1ccc(cc1)S Amb17616840 [0,1,0,0,0,1|0,0,1]=3 5002 B12R1.21 Oc1c[n]c([n]c1)SCC(O)=O Amb24566737 [0,1,0,0,0,1|2,0,0]=4 5003 B12R1.21 Oc1ccc(CC=C(Cl)Cl)cc1 Amb25054845 [0,1,0,0,0,1|2,0,0]=4 5004 B12R1.21 Oc1ccc(CCC(O)=O)[n][n]1 Amb21937853 [0,1,0,0,0,1|2,0,0]=4 5005 B12R1.21 Oc1ccc(\C=C\C(O)=O)[n]c1 Amb25794684 [0,1,0,0,0,1|1,0,1]=4 5006 B12R1.21 Oc1ccc(c[n]1)\C=C\C(O)=O Amb25111280 [0,1,0,0,0,1|1,0,1]=4 5007 B12R1.21 Oc1ccc(cc1)C#CC(O)=O Amb23569631 [0,1,0,0,0,1|0,0,1]=3 5008 B12R1.21 Oc1ccc(cc1)OCC(=O)Cl Amb24467045 [0,1,0,0,0,1|1,0,0]=3 5009 B12R1.21 Oc1ccc(cc1)OCC(O)O Amb24466979 [0,1,0,0,0,1|0,0,2]=4 5010 B12R1.21 Oc1ccc(cc1)SCC(O)=O Amb18291566 [0,1,0,0,0,1|0,0,0]=2 5011 B12R1.21 [O-]C(=O)\C=C\c1ccc(cc1)C Amb10553862 [0,1,0,0,0,1|0,0,2]=4 5012 B12R1.21 [O-][N+](=O)CCc1ccc(F)cc1 Amb18542361 [0,1,0,0,0,1|1,0,1]=4 5013 B12R1.21 [O-][N+](=O)CSc1ccc(O)cc1 Amb24370952 [0,1,0,0,0,1|1,0,1]=4 5014 B12R1.21 [O-][n+]1ccc(\C=C\C(O)=O)cc1 Amb25076703 [0,1,0,0,0,1|1,0,1]=4 5015 B12R1.27 BrCC(=O)NCc1ccccc1 Amb2221074 [0,1,0,0,0,1|1,0,0]=3 5016 B12R1.27 BrCC(=O)NCc1ccccn1 Amb15701346 [0,1,0,0,0,1|2,0,0]=4 5017 B12R1.27 BrCC(=O)NCc1cccnc1 Amb17332390 [0,1,0,0,0,1|2,0,0]=4 5018 B12R1.27 BrCC(=O)NCc1ccncc1 Amb17328296 [0,1,0,0,0,1|2,0,0]=4 5019 B12R1.27 BrCC(=O)\C=C\c1ccccc1 Amb17596167 [0,1,0,0,0,1|1,0,1]=4 5020 B12R1.27 C#CC(=O)C#Cc1ccccc1 Amb24690594 [0,1,0,0,0,1|1,0,1]=4 5021 B12R1.27 C#CC(=O)CCc1cc[n]cc1 Amb24684499 [0,1,0,0,0,1|2,0,0]=4 5022 B12R1.27 C#CC(=O)CCc1ccc[n]c1 Amb25271085 [0,1,0,0,0,1|2,0,0]=4 5023 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,1,0,0,0,1|1,0,0]=3 5024 B12R1.27 C#CC(=O)CNc1ccccc1 Amb24359731 [0,1,0,0,0,1|1,0,0]=3 5025 B12R1.27 C#CC(=O)COc1ccccc1 Amb24483847 [0,1,0,0,0,1|1,0,0]=3 5026 B12R1.27 C#CC(=O)NCc1cc[n]cc1 Amb24462862 [0,1,0,0,0,1|2,0,0]=4 5027 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [0,1,0,0,0,1|1,0,0]=3 5028 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [0,1,0,0,0,1|1,0,0]=3 5029 B12R1.27 C#CC(=O)\C=C\c1ccccc1 Amb25706970 [0,1,0,0,0,1|1,0,1]=4 5030 B12R1.27 C#CC(O)CCc1ccccc1 Amb25024201 [0,1,0,0,0,1|1,0,1]=4 5031 B12R1.27 C#CC(O)COc1ccccc1 Amb25686511 [0,1,0,0,0,1|1,0,1]=4 5032 B12R1.27 C#C[C@@H](O)COc1ccccc1 Amb25205027 [0,1,0,0,0,1|1,0,1]=4 5033 B12R1.27 C#C[C@H](O)CCc1ccccc1 Amb25266374 [0,1,0,0,0,1|1,0,1]=4 5034 B12R1.27 C=C(C=O)C#Cc1ccccc1 Amb25821448 [0,1,0,0,0,1|1,0,1]=4 5035 B12R1.27 C=C(C=O)ONc1ccccc1 Amb24676829 [0,1,0,0,0,1|2,0,0]=4 5036 B12R1.27 C=C(CNc1ccccc1)C#N Amb18645075 [0,1,0,0,0,1|2,0,0]=4 5037 B12R1.27 C=C(CO)C#Cc1ccccc1 Amb24497788 [0,1,0,0,0,1|1,0,1]=4 5038 B12R1.27 C=C(CO)CNc1ccccc1 Amb24537817 [0,1,0,0,0,1|1,0,0]=3 5039 B12R1.27 C=C(COc1ccccc1)C#N Amb25739080 [0,1,0,0,0,1|2,0,0]=4 5040 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,1,0,0,0,1|1,0,0]=3 5041 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,1,0,0,0,1|1,0,0]=3 5042 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,1,0,0,0,1|1,0,0]=3 5043 B12R1.27 C=CC(O)CSc1ccccc1 Amb24273355 [0,1,0,0,0,1|1,0,1]=4 5044 B12R1.27 CC(C=Cc1ccccc1)=NO Amb24101081 [0,1,0,0,0,1|1,0,1]=4 5045 B12R1.27 CC(C=O)=C=Cc1ccccc1 Amb24452570 [0,1,0,0,0,1|1,0,1]=4 5046 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,1,0,0,0,1|1,0,1]=4 5047 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [0,1,0,0,0,1|1,0,1]=4 5048 B12R1.27 CCC(=C)CNc1ccccc1 Amb25093473 [0,1,0,0,0,1|2,0,0]=4 5049 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [0,1,0,0,0,1|2,0,0]=4 5050 B12R1.27 CCC(=O)C#Cc1ccccc1 Amb10562235 [0,1,0,0,0,1|1,0,1]=4 5051 B12R1.27 CCC(=O)NCc1ccccn1 Amb17736593 [0,1,0,0,0,1|2,0,0]=4 5052 B12R1.27 CCC(=O)NCc1ccncc1 Amb17798077 [0,1,0,0,0,1|2,0,0]=4 5053 B12R1.27 CCC(=O)O[Hg]c1ccccc1 Amb22359615 [0,1,0,0,0,1|2,0,0]=4 5054 B12R1.27 CCC(=O)\C=C/c1ccccc1 Amb25271028 [0,1,0,0,0,1|1,0,1]=4 5055 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [0,1,0,0,0,1|1,0,1]=4 5056 B12R1.27 CCC(=O)\N=N\c1ccccc1 Amb24644165 [0,1,0,0,0,1|2,0,0]=4 5057 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [0,1,0,0,0,1|1,0,1]=4 5058 B12R1.27 CCC(CNc1ccccc1)O Amb13952005 [0,1,0,0,0,1|1,0,1]=4 5059 B12R1.27 CCC(O)OCc1ccccc1 Amb25793622 [0,1,0,0,0,1|1,0,1]=4 5060 B12R1.27 CCS(=O)NCc1ccccc1 Amb25359778 [0,1,0,0,0,1|2,0,0]=4 5061 B12R1.27 CN(CNc1ccccc1)N=O Amb25690722 [0,1,0,0,0,1|2,0,0]=4 5062 B12R1.27 CNC(=N)COc1ccccc1 Amb25336063 [0,1,0,0,0,1|2,0,0]=4 5063 B12R1.27 CNC(=N)CSc1ccccc1 Amb24485624 [0,1,0,0,0,1|2,0,0]=4 5064 B12R1.27 CNC(=N)NCc1ccccc1 Amb18798221 [0,1,0,0,0,1|2,0,0]=4 5065 B12R1.27 CNC(=O)C#Cc1ccccc1 Amb2106613 [0,1,0,0,0,1|1,0,1]=4 5066 B12R1.27 CNC(=O)COc1ccc[n]c1 Amb24622499 [0,1,0,0,0,1|2,0,0]=4 5067 B12R1.27 CNC(=O)CSc1ccccn1 Amb13953848 [0,1,0,0,0,1|2,0,0]=4 5068 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [0,1,0,0,0,1|1,0,0]=3 5069 B12R1.27 CNC(=O)NCc1ccccn1 Amb2132790 [0,1,0,0,0,1|2,0,0]=4 5070 B12R1.27 CNC(=O)NCc1cccnc1 Amb2132774 [0,1,0,0,0,1|2,0,0]=4 5071 B12R1.27 CNC(=O)NCc1ccncc1 Amb2132791 [0,1,0,0,0,1|2,0,0]=4 5072 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,1,0,0,0,1|2,0,0]=4 5073 B12R1.27 CNC(=O)OCc1ccc[n]c1 Amb24532586 [0,1,0,0,0,1|2,0,0]=4 5074 B12R1.27 CNC(=O)SCc1cccc[n]1 Amb25054647 [0,1,0,0,0,1|2,0,0]=4 5075 B12R1.27 CNC(=O)\N=C\c1ccccc1 Amb24497304 [0,1,0,0,0,1|1,0,1]=4 5076 B12R1.27 CNC(=O)\N=N\c1ccccc1 Amb25313077 [0,1,0,0,0,1|2,0,0]=4 5077 B12R1.27 COC(=N)CCc1cc[n]cc1 Amb18563635 [0,1,0,0,0,1|2,0,0]=4 5078 B12R1.27 COC(=N)CCc1ccc[n]c1 Amb18563630 [0,1,0,0,0,1|2,0,0]=4 5079 B12R1.27 COC(=N)CCc1cccc[n]1 Amb18563625 [0,1,0,0,0,1|2,0,0]=4 5080 B12R1.27 COC(=N)CNc1ccccc1 Amb24597022 [0,1,0,0,0,1|1,0,0]=3 5081 B12R1.27 COC(=N)COc1ccccc1 Amb18798404 [0,1,0,0,0,1|1,0,0]=3 5082 B12R1.27 COC(=O)/C=C/c1cccnc1 Amb17844385 [0,1,0,0,0,1|1,0,1]=4 5083 B12R1.27 COC(=O)C#Cc1ccccn1 Amb1039304 [0,1,0,0,0,1|1,0,1]=4 5084 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb20668041 [0,1,0,0,0,1|1,0,1]=4 5085 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb24074160 [0,1,0,0,0,1|1,0,1]=4 5086 B12R1.27 COC(=O)CCc1c[n]c[n]c1 Amb21922892 [0,1,0,0,0,1|2,0,0]=4 5087 B12R1.27 COC(=O)CCc1cc[n][n]c1 Amb23454523 [0,1,0,0,0,1|2,0,0]=4 5088 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [0,1,0,0,0,1|1,0,0]=3 5089 B12R1.27 COC(=O)CNc1c[n]c[n]c1 Amb18270088 [0,1,0,0,0,1|2,0,0]=4 5090 B12R1.27 COC(=O)CNc1cc[n]c[n]1 Amb18788537 [0,1,0,0,0,1|2,0,0]=4 5091 B12R1.27 COC(=O)CNc1ccc[n][n]1 Amb19023174 [0,1,0,0,0,1|2,0,0]=4 5092 B12R1.27 COC(=O)CNc1ccc[n]c1 Amb18270093 [0,1,0,0,0,1|1,0,0]=3 5093 B12R1.27 COC(=O)COc1cccc[n]1 Amb24095859 [0,1,0,0,0,1|1,0,0]=3 5094 B12R1.27 COC(=O)CSc1cccc[n]1 Amb22280333 [0,1,0,0,0,1|1,0,0]=3 5095 B12R1.27 COC(=O)NCc1cc[n]c[n]1 Amb25321776 [0,1,0,0,0,1|2,0,0]=4 5096 B12R1.27 COC(=O)NCc1ccccn1 Amb17736865 [0,1,0,0,0,1|1,0,0]=3 5097 B12R1.27 COC(=O)NCc1cccnc1 Amb17790231 [0,1,0,0,0,1|1,0,0]=3 5098 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [0,1,0,0,0,1|0,0,0]=2 5099 B12R1.27 COC(=O)\C=C\c1cccc[n]1 Amb25036096 [0,1,0,0,0,1|1,0,1]=4 5100 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb10604946 [0,1,0,0,0,1|1,0,1]=4 5101 B12R1.27 COC(=O)\N=N\c1ccccc1 Amb25836861 [0,1,0,0,0,1|1,0,0]=3 5102 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [0,1,0,0,0,1|1,0,1]=4 5103 B12R1.27 CSC(=N)NCc1ccccc1 Amb25760156 [0,1,0,0,0,1|1,1,0]=4 5104 B12R1.27 CSC(=O)NCc1ccccc1 Amb24495681 [0,1,0,0,0,1|0,1,0]=3 5105 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,1,0,0,0,1|1,0,1]=4 5106 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [0,1,0,0,0,1|1,0,1]=4 5107 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,1,0,0,0,1|1,0,1]=4 5108 B12R1.27 C[C@H](CO)OCc1ccccc1 Amb25694316 [0,1,0,0,0,1|1,0,1]=4 5109 B12R1.27 C\C(=C\O)\C#Cc1ccccc1 Amb24379979 [0,1,0,0,0,1|1,0,1]=4 5110 B12R1.27 C\C(=N/O)\N=C\c1ccccc1 Amb21847007 [0,1,0,0,0,1|1,0,1]=4 5111 B12R1.27 C\C(=N/O)\N=N\c1ccccc1 Amb22731704 [0,1,0,0,0,1|2,0,0]=4 5112 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [0,1,0,0,0,1|1,0,0]=3 5113 B12R1.27 C\C(\C=O)=C/Nc1ccccc1 Amb18645511 [0,1,0,0,0,1|1,0,1]=4 5114 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [0,1,0,0,0,1|1,0,0]=3 5115 B12R1.27 C\C(\C=O)=C\Sc1ccccc1 Amb25277189 [0,1,0,0,0,1|1,0,1]=4 5116 B12R1.27 C\C(\C=O)=N/Nc1ccccc1 Amb18645673 [0,1,0,0,0,1|2,0,0]=4 5117 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [0,1,0,0,0,1|1,0,0]=3 5118 B12R1.27 C\C(\CCl)=C\Cc1ccccc1 Amb25279568 [0,1,0,0,0,1|2,0,0]=4 5119 B12R1.27 C\C(\CN)=C\Cc1ccccc1 Amb24438874 [0,1,0,0,0,1|2,0,0]=4 5120 B12R1.27 C\C(\CNc1ccccc1)=C\C Amb24636864 [0,1,0,0,0,1|2,0,0]=4 5121 B12R1.27 C\C(\CO)=N\Nc1ccccc1 Amb24619168 [0,1,0,0,0,1|2,0,0]=4 5122 B12R1.27 C\C(\COc1ccccc1)=C\Cl Amb25241242 [0,1,0,0,0,1|2,0,0]=4 5123 B12R1.27 C\C(\NCc1ccccc1)=N\O Amb25083251 [0,1,0,0,0,1|1,0,0]=3 5124 B12R1.27 C\N=C(\SCc1ccccc1)/N Amb11238902 [0,1,0,0,0,1|2,0,0]=4 5125 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [0,1,0,0,0,1|1,0,0]=3 5126 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [0,1,0,0,0,1|1,0,0]=3 5127 B12R1.27 ClCC(=O)NCc1ccccn1 Amb1651007 [0,1,0,0,0,1|2,0,0]=4 5128 B12R1.27 ClCC(=O)\C=C\c1ccccc1 Amb17594640 [0,1,0,0,0,1|1,0,1]=4 5129 B12R1.27 ClCC(CNc1ccccc1)O Amb10565986 [0,1,0,0,0,1|1,0,1]=4 5130 B12R1.27 Cl\C(\CCl)=C/Cc1ccccc1 Amb25803609 [0,1,0,0,0,1|2,0,0]=4 5131 B12R1.27 Cl\C(\CCl)=N/Cc1ccccc1 Amb24540801 [0,1,0,0,0,1|2,0,0]=4 5132 B12R1.27 Cl\C(\CSc1ccccc1)=C\Cl Amb24496037 [0,1,0,0,0,1|2,0,0]=4 5133 B12R1.27 N#CC(=O)C#Cc1ccccc1 Amb24736166 [0,1,0,0,0,1|1,0,1]=4 5134 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [0,1,0,0,0,1|1,0,0]=3 5135 B12R1.27 N#CC(=O)\C=C\c1ccccc1 Amb10069227 [0,1,0,0,0,1|1,0,1]=4 5136 B12R1.27 N#CC(O)CCc1ccccc1 Amb18177732 [0,1,0,0,0,1|1,0,1]=4 5137 B12R1.27 N#CC(O)CSc1ccccc1 Amb25051459 [0,1,0,0,0,1|1,0,1]=4 5138 B12R1.27 N#C[C@@H](O)CCc1ccccc1 Amb25073440 [0,1,0,0,0,1|1,0,1]=4 5139 B12R1.27 N#C[C@@H](O)COc1ccccc1 Amb24474239 [0,1,0,0,0,1|1,0,1]=4 5140 B12R1.27 N#C[C@H](O)CCc1ccccc1 Amb24344695 [0,1,0,0,0,1|1,0,1]=4 5141 B12R1.27 N=C(CF)NCc1ccccc1 Amb24392158 [0,1,0,0,0,1|2,0,0]=4 5142 B12R1.27 N=C(CS)NCc1ccccc1 Amb24664256 [0,1,0,0,0,1|1,1,0]=4 5143 B12R1.27 NC(CO)CNc1ccccc1 Amb25674165 [0,1,0,0,0,1|1,0,1]=4 5144 B12R1.27 NC(CO)COc1ccccc1 Amb18563798 [0,1,0,0,0,1|1,0,1]=4 5145 B12R1.27 NC(COc1ccccc1)=NN Amb18788366 [0,1,0,0,0,1|2,0,0]=4 5146 B12R1.27 NC(NCc1c[n]ccc1)=NO Amb18801032 [0,1,0,0,0,1|2,0,0]=4 5147 B12R1.27 NC(NCc1cc[n]cc1)=NO Amb18801031 [0,1,0,0,0,1|2,0,0]=4 5148 B12R1.27 NC(NCc1cccc[n]1)=NO Amb18801030 [0,1,0,0,0,1|2,0,0]=4 5149 B12R1.27 NC(NCc1ccccc1)=NO Amb18800915 [0,1,0,0,0,1|1,0,0]=3 5150 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,1,0,0,0,1|1,0,0]=3 5151 B12R1.27 NCC(=O)NCc1c[n]ccc1 Amb21959050 [0,1,0,0,0,1|2,0,0]=4 5152 B12R1.27 NCC(=O)NCc1c[n]ccc1 Amb21987915 [0,1,0,0,0,1|2,0,0]=4 5153 B12R1.27 NCC(=O)NCc1cccc[n]1 Amb21959064 [0,1,0,0,0,1|2,0,0]=4 5154 B12R1.27 NCC(=O)NCc1ccncc1 Amb13951584 [0,1,0,0,0,1|2,0,0]=4 5155 B12R1.27 NCC(=O)NNc1ccccc1 Amb18646327 [0,1,0,0,0,1|2,0,0]=4 5156 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [0,1,0,0,0,1|1,0,0]=3 5157 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,1,0,0,0,1|1,0,0]=3 5158 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,1,0,0,0,1|1,0,0]=3 5159 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb18908593 [0,1,0,0,0,1|1,0,1]=4 5160 B12R1.27 NCC(CNc1ccccc1)O Amb17138613 [0,1,0,0,0,1|1,0,1]=4 5161 B12R1.27 NCC(COc1ccccc1)O Amb1139174 [0,1,0,0,0,1|1,0,1]=4 5162 B12R1.27 NC[C@@H](O)COc1ccccc1 Amb22747719 [0,1,0,0,0,1|1,0,1]=4 5163 B12R1.27 NC\C(\F)=C\Cc1ccccc1 Amb24743578 [0,1,0,0,0,1|2,0,0]=4 5164 B12R1.27 NN=C([S-])SCc1ccccc1 Amb22446067 [0,1,0,0,0,1|1,1,0]=4 5165 B12R1.27 NNC(=O)C#Cc1ccccc1 Amb25701130 [0,1,0,0,0,1|1,0,1]=4 5166 B12R1.27 NNC(=O)CCc1cccc[n]1 Amb25299317 [0,1,0,0,0,1|2,0,0]=4 5167 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,1,0,0,0,1|1,0,0]=3 5168 B12R1.27 NNC(=O)CCc1ccncc1 Amb10553044 [0,1,0,0,0,1|2,0,0]=4 5169 B12R1.27 NNC(=O)CNc1cccc[n]1 Amb25187500 [0,1,0,0,0,1|2,0,0]=4 5170 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,1,0,0,0,1|1,0,0]=3 5171 B12R1.27 NNC(=O)CSc1ccccn1 Amb1060961 [0,1,0,0,0,1|2,0,0]=4 5172 B12R1.27 NNC(=O)SCc1ccccc1 Amb24423487 [0,1,0,0,0,1|1,0,0]=3 5173 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb25838381 [0,1,0,0,0,1|1,0,1]=4 5174 B12R1.27 NNC(=S)NCc1ccccc1 Amb1636204 [0,1,0,0,0,1|1,1,0]=4 5175 B12R1.27 N\C(\C=Cc1ccccc1)=N\O Amb25065269 [0,1,0,0,0,1|1,0,1]=4 5176 B12R1.27 N\C(\CCc1c[n]ccc1)=N/O Amb24678911 [0,1,0,0,0,1|2,0,0]=4 5177 B12R1.27 N\C(\CCc1cc[n]cc1)=N/O Amb18792640 [0,1,0,0,0,1|2,0,0]=4 5178 B12R1.27 N\C(\CCc1cccc[n]1)=N/O Amb18792639 [0,1,0,0,0,1|2,0,0]=4 5179 B12R1.27 N\C(\CCc1ccccc1)=N\N Amb18788201 [0,1,0,0,0,1|2,0,0]=4 5180 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [0,1,0,0,0,1|1,0,0]=3 5181 B12R1.27 N\C(\CNc1ccccc1)=N\O Amb24614329 [0,1,0,0,0,1|1,0,0]=3 5182 B12R1.27 N\C(\NNc1ccccc1)=N\O Amb24485684 [0,1,0,0,0,1|2,0,0]=4 5183 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [0,1,0,0,0,1|0,0,1]=3 5184 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,1,0,0,0,1|1,0,0]=3 5185 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,1,0,0,0,1|1,0,0]=3 5186 B12R1.27 O=C(CBr)NCc1cccc[n]1 Amb22587297 [0,1,0,0,0,1|2,0,0]=4 5187 B12R1.27 O=C(CCl)NCc1ccc[n]c1 Amb19373274 [0,1,0,0,0,1|2,0,0]=4 5188 B12R1.27 O=C(CCl)NNc1ccccc1 Amb22411427 [0,1,0,0,0,1|2,0,0]=4 5189 B12R1.27 O=C(CF)C#Cc1ccccc1 Amb25373340 [0,1,0,0,0,1|1,0,1]=4 5190 B12R1.27 O=C(CF)\C=C\c1ccccc1 Amb24572849 [0,1,0,0,0,1|1,0,1]=4 5191 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [0,1,0,0,0,1|1,0,0]=3 5192 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,1,0,0,0,1|1,0,0]=3 5193 B12R1.27 O=C(CS)NCc1cc[n]cc1 Amb24483850 [0,1,0,0,0,1|1,1,0]=4 5194 B12R1.27 O=C(CS)NCc1cccc[n]1 Amb25669641 [0,1,0,0,0,1|1,1,0]=4 5195 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,1,0,0,0,1|1,0,0]=3 5196 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,1,0,0,0,1|1,0,0]=3 5197 B12R1.27 O=C(\C=C\c1ccccc1)C=O Amb18126247 [0,1,0,0,0,1|0,0,2]=4 5198 B12R1.27 O=CC(CSc1ccccc1)C Amb17594629 [0,1,0,0,0,1|1,0,1]=4 5199 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [0,1,0,0,0,1|1,0,1]=4 5200 B12R1.27 O=C\C(\Cl)=C/Nc1ccccc1 Amb24603974 [0,1,0,0,0,1|1,0,1]=4 5201 B12R1.27 O=C\C(\Cl)=C\Nc1ccccc1 Amb25797781 [0,1,0,0,0,1|1,0,1]=4 5202 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [0,1,0,0,0,1|1,0,0]=3 5203 B12R1.27 O=C\C(\F)=N/Nc1ccccc1 Amb24611193 [0,1,0,0,0,1|2,0,0]=4 5204 B12R1.27 OC(C=O)C#Cc1ccccc1 Amb25375035 [0,1,0,0,0,1|0,0,2]=4 5205 B12R1.27 OCC(=O)C#Cc1ccccc1 Amb25094460 [0,1,0,0,0,1|0,0,1]=3 5206 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [0,1,0,0,0,1|1,0,0]=3 5207 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [0,1,0,0,0,1|1,0,0]=3 5208 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [0,1,0,0,0,1|1,0,0]=3 5209 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [0,1,0,0,0,1|0,0,0]=2 5210 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [0,1,0,0,0,1|0,0,0]=2 5211 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [0,1,0,0,0,1|0,0,0]=2 5212 B12R1.27 OCC(=O)NCc1ccccn1 Amb17334667 [0,1,0,0,0,1|1,0,0]=3 5213 B12R1.27 OCC(=O)NCc1cccnc1 Amb17334668 [0,1,0,0,0,1|1,0,0]=3 5214 B12R1.27 OCC(=O)NCc1ccncc1 Amb17334669 [0,1,0,0,0,1|1,0,0]=3 5215 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [0,1,0,0,0,1|0,0,1]=3 5216 B12R1.27 OCC(CNc1ccccc1)O Amb17307124 [0,1,0,0,0,1|0,0,2]=4 5217 B12R1.27 OCC(COc1ccccc1)C Amb17232599 [0,1,0,0,0,1|1,0,1]=4 5218 B12R1.27 OCC(CSc1ccccc1)Cl Amb10553704 [0,1,0,0,0,1|1,0,1]=4 5219 B12R1.27 OC[C@@H](COc1ccccc1)O Amb10982588 [0,1,0,0,0,1|0,0,2]=4 5220 B12R1.27 OC[C@@H](O)CNc1ccccc1 Amb18792912 [0,1,0,0,0,1|0,0,2]=4 5221 B12R1.27 OC[C@@H](OCc1ccccc1)C Amb17609287 [0,1,0,0,0,1|1,0,1]=4 5222 B12R1.27 OC\C(=C/Cc1ccccc1)\C Amb17594048 [0,1,0,0,0,1|1,0,0]=3 5223 B12R1.27 OC\C(\F)=C\Cc1ccccc1 Amb24661184 [0,1,0,0,0,1|1,0,0]=3 5224 B12R1.27 ONC(=O)CCc1c[n]cc[n]1 Amb25279606 [0,1,0,0,0,1|2,0,0]=4 5225 B12R1.27 ONC(=O)CCc1cc[n]cc1 Amb24577197 [0,1,0,0,0,1|1,0,0]=3 5226 B12R1.27 ONC(=O)CCc1ccc[n]c1 Amb24413046 [0,1,0,0,0,1|1,0,0]=3 5227 B12R1.27 ONC(=O)CCc1cccc[n]1 Amb24703542 [0,1,0,0,0,1|1,0,0]=3 5228 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [0,1,0,0,0,1|0,0,0]=2 5229 B12R1.27 ONC(=O)\C=C\c1cc[n]cc1 Amb22346729 [0,1,0,0,0,1|1,0,1]=4 5230 B12R1.27 ONC(=O)\C=C\c1cc[n]cc1 Amb24565929 [0,1,0,0,0,1|1,0,1]=4 5231 B12R1.27 ONC(=S)NCc1ccccc1 Amb25823184 [0,1,0,0,0,1|0,1,0]=3 5232 B12R1.27 O[C@H](CCl)CNc1ccccc1 Amb24426200 [0,1,0,0,0,1|1,0,1]=4 5233 B12R1.27 O\C(\C=O)=C/Nc1ccccc1 Amb25187506 [0,1,0,0,0,1|0,0,1]=3 5234 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [0,1,0,0,0,1|1,0,0]=3 5235 B12R1.27 O\N=C(\COc1ccccc1)/N Amb1154723 [0,1,0,0,0,1|1,0,0]=3 5236 B12R1.27 [NH4]OP(=O)OCc1ccccc1 Amb22346178 [0,1,0,0,0,1|1,0,0]=3 5237 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,1,0,0,0,1|1,0,0]=3 5238 B12R1.43 BrC(C(=O)C)Cc1ccncc1 Amb17507815 [0,1,0,0,0,1|2,0,0]=4 5239 B12R1.43 BrC(C(=O)O)C[n+]1ccccc1 Amb1030017 [0,1,0,0,0,1|1,0,0]=3 5240 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,1,0,0,0,1|0,0,0]=2 5241 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,1,0,0,0,1|0,0,0]=2 5242 B12R1.43 Br\C(=C/c1ccccc1)\C(=O)C Amb17596166 [0,1,0,0,0,1|1,0,1]=4 5243 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,1,0,0,0,1|1,0,0]=3 5244 B12R1.43 C=C(Cc1ccccc1)C(N)=S Amb24359154 [0,1,0,0,0,1|1,1,0]=4 5245 B12R1.43 C=C(F)C(=O)Cc1ccccc1 Amb25205433 [0,1,0,0,0,1|2,0,0]=4 5246 B12R1.43 C=C(Oc1ccccc1)C(O)=O Amb24692764 [0,1,0,0,0,1|0,0,1]=3 5247 B12R1.43 C=C(Sc1ccccc1)C(N)=O Amb24739855 [0,1,0,0,0,1|1,0,1]=4 5248 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,1,0,0,0,1|2,0,0]=4 5249 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,1,0,0,0,1|2,0,0]=4 5250 B12R1.43 CC(=Cc1ccccc1)C(=O)Cl Amb24061289 [0,1,0,0,0,1|1,0,1]=4 5251 B12R1.43 CC(=O)C(=C)Oc1ccccc1 Amb25714243 [0,1,0,0,0,1|1,0,1]=4 5252 B12R1.43 CC(=O)C(=O)Cc1c[n]ccc1 Amb24556780 [0,1,0,0,0,1|2,0,0]=4 5253 B12R1.43 CC(=O)C(=O)Cc1cc[n]cc1 Amb24555440 [0,1,0,0,0,1|2,0,0]=4 5254 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,1,0,0,0,1|1,0,0]=3 5255 B12R1.43 CC(=O)C(C)Cc1cc[n]cc1 Amb25303664 [0,1,0,0,0,1|2,0,0]=4 5256 B12R1.43 CC(=O)C(C)Oc1cccc[n]1 Amb25120521 [0,1,0,0,0,1|2,0,0]=4 5257 B12R1.43 CC(=O)C(C)Sc1cc[n]cc1 Amb25792214 [0,1,0,0,0,1|2,0,0]=4 5258 B12R1.43 CC(=O)C(Cc1ccccn1)Br Amb17507813 [0,1,0,0,0,1|2,0,0]=4 5259 B12R1.43 CC(=O)C(Cc1ccccn1)Cl Amb17507767 [0,1,0,0,0,1|2,0,0]=4 5260 B12R1.43 CC(=O)C(Cc1cccnc1)Br Amb17507814 [0,1,0,0,0,1|2,0,0]=4 5261 B12R1.43 CC(=O)C(Cc1cccnc1)Cl Amb17507768 [0,1,0,0,0,1|2,0,0]=4 5262 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,1,0,0,0,1|1,0,0]=3 5263 B12R1.43 CC(=O)C(Oc1cccnc1)C Amb2407640 [0,1,0,0,0,1|2,0,0]=4 5264 B12R1.43 CC(=O)N(C)Cc1cc[n]cc1 Amb25152576 [0,1,0,0,0,1|2,0,0]=4 5265 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,1,0,0,0,1|2,0,0]=4 5266 B12R1.43 CC(=O)N(O)Cc1ccccc1 Amb25297453 [0,1,0,0,0,1|1,0,0]=3 5267 B12R1.43 CC(=O)[C@@H](C)Cc1cc[n]cc1 Amb25358977 [0,1,0,0,0,1|2,0,0]=4 5268 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,1,0,0,0,1|1,0,0]=3 5269 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [0,1,0,0,0,1|1,0,0]=3 5270 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,1,0,0,0,1|1,0,0]=3 5271 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,1,0,0,0,1|1,0,0]=3 5272 B12R1.43 CC(=O)[C@H](C)Cc1cc[n]cc1 Amb24380859 [0,1,0,0,0,1|2,0,0]=4 5273 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,1,0,0,0,1|1,0,0]=3 5274 B12R1.43 CC(=O)\C(\O)=C\c1ccccc1 Amb24456527 [0,1,0,0,0,1|1,0,1]=4 5275 B12R1.43 CC(=S)N(C)Cc1ccccc1 Amb24073637 [0,1,0,0,0,1|1,1,0]=4 5276 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,1,0,0,0,1|1,0,0]=3 5277 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [0,1,0,0,0,1|1,0,0]=3 5278 B12R1.43 CC(C(=O)Cl)Sc1ccccc1 Amb17143250 [0,1,0,0,0,1|1,0,0]=3 5279 B12R1.43 CC(C(=O)N)Sc1ccccc1 Amb10665761 [0,1,0,0,0,1|1,0,0]=3 5280 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,1,0,0,0,1|0,0,0]=2 5281 B12R1.43 CC(C(=O)O)Nc1ncccn1 Amb2372391 [0,1,0,0,0,1|2,0,0]=4 5282 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,1,0,0,0,1|0,0,0]=2 5283 B12R1.43 CC(C(=O)O)Sc1cnccn1 Amb2446097 [0,1,0,0,0,1|2,0,0]=4 5284 B12R1.43 CC(C(=S)N)Oc1ccccc1 Amb17233851 [0,1,0,0,0,1|1,1,0]=4 5285 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,1,0,0,0,1|1,0,1]=4 5286 B12R1.43 CC(Cc1c[n]c[n]c1)C(O)=O Amb24375035 [0,1,0,0,0,1|2,0,0]=4 5287 B12R1.43 CC(Cc1ccccc1)[N+]([O-])=O Amb17689219 [0,1,0,0,0,1|1,0,1]=4 5288 B12R1.43 CC(Nc1c[n]c[n]c1)C(O)=O Amb18270384 [0,1,0,0,0,1|2,0,0]=4 5289 B12R1.43 CC(Nc1cc[n][n]c1)C(O)=O Amb25261344 [0,1,0,0,0,1|2,0,0]=4 5290 B12R1.43 CC(Nc1cc[n]c[n]1)C(O)=O Amb18973870 [0,1,0,0,0,1|2,0,0]=4 5291 B12R1.43 CC(Nc1ccc[n][n]1)C(O)=O Amb18991526 [0,1,0,0,0,1|2,0,0]=4 5292 B12R1.43 CC(Nc1ccc[n]c1)C(O)=O Amb18270393 [0,1,0,0,0,1|1,0,0]=3 5293 B12R1.43 CC(Nc1ccccc1)P(O)=O Amb25270636 [0,1,0,0,0,1|1,0,0]=3 5294 B12R1.43 CC(O)C(=C)Cc1ccccc1 Amb25155687 [0,1,0,0,0,1|1,0,1]=4 5295 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,1,0,0,0,1|1,0,1]=4 5296 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,1,0,0,0,1|1,0,1]=4 5297 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,1,0,0,0,1|1,0,1]=4 5298 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,1,0,0,0,1|1,0,1]=4 5299 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,1,0,0,0,1|1,0,1]=4 5300 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,1,0,0,0,1|1,0,1]=4 5301 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,1,0,0,0,1|1,0,1]=4 5302 B12R1.43 CC(OC1=CC=CNN1)C(O)=O Amb25775008 [0,1,0,0,0,1|2,0,0]=4 5303 B12R1.43 CC(Oc1ccc[n]c1)C(N)=O Amb24760938 [0,1,0,0,0,1|2,0,0]=4 5304 B12R1.43 CC(Oc1ccccc1)C(C)O Amb18801039 [0,1,0,0,0,1|1,0,1]=4 5305 B12R1.43 CC(Oc1ccccc1)C(N)=N Amb18798297 [0,1,0,0,0,1|2,0,0]=4 5306 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,1,0,0,0,1|0,0,0]=2 5307 B12R1.43 CC(Sc1cc[n]c[n]1)C(O)=O Amb18973866 [0,1,0,0,0,1|2,0,0]=4 5308 B12R1.43 CC(Sc1ccc[n][n]1)C(O)=O Amb18991532 [0,1,0,0,0,1|2,0,0]=4 5309 B12R1.43 CC(Sc1ccccc1)C(N)=N Amb18805146 [0,1,0,0,0,1|2,0,0]=4 5310 B12R1.43 CN(C(=O)Cl)Cc1ccccc1 Amb17563090 [0,1,0,0,0,1|1,0,0]=3 5311 B12R1.43 CN(Cc1cc[n]cc1)C(=O)Cl Amb24357639 [0,1,0,0,0,1|2,0,0]=4 5312 B12R1.43 CN(Cc1ccc[n]c1)C(=O)Cl Amb25034672 [0,1,0,0,0,1|2,0,0]=4 5313 B12R1.43 CN(Cc1ccccc1)C(N)=N Amb22586446 [0,1,0,0,0,1|2,0,0]=4 5314 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,1,0,0,0,1|0,0,0]=2 5315 B12R1.43 C[C@@H](C(=O)O)Nc1ccncc1 Amb10604191 [0,1,0,0,0,1|1,0,0]=3 5316 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,1,0,0,0,1|1,0,1]=4 5317 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [0,1,0,0,0,1|1,0,0]=3 5318 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,1,0,0,0,1|1,0,1]=4 5319 B12R1.43 C[C@@H](Nc1[n]ccc[n]1)C(O)=O Amb24707746 [0,1,0,0,0,1|2,0,0]=4 5320 B12R1.43 C[C@@H](Nc1cccc[n]1)C(O)=O Amb24475793 [0,1,0,0,0,1|1,0,0]=3 5321 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,1,0,0,0,1|0,0,0]=2 5322 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)O Amb24382503 [0,1,0,0,0,1|1,0,1]=4 5323 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 Amb25792955 [0,1,0,0,0,1|1,0,1]=4 5324 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,1,0,0,0,1|1,0,1]=4 5325 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,1,0,0,0,1|1,0,1]=4 5326 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,1,0,0,0,1|1,0,1]=4 5327 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,1,0,0,0,1|0,0,0]=2 5328 B12R1.43 C[C@@H](Oc1ccccc1)[C@@H](C)O Amb25687748 [0,1,0,0,0,1|1,0,1]=4 5329 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)O Amb25284620 [0,1,0,0,0,1|1,0,1]=4 5330 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)O Amb24414998 [0,1,0,0,0,1|1,0,1]=4 5331 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,1,0,0,0,1|0,0,0]=2 5332 B12R1.43 C[C@H](C(=O)O)Nc1cnccn1 Amb16233069 [0,1,0,0,0,1|2,0,0]=4 5333 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,1,0,0,0,1|1,0,1]=4 5334 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,1,0,0,0,1|1,0,1]=4 5335 B12R1.43 C[C@H](Nc1c[n]cc[n]1)C(O)=O Amb25829931 [0,1,0,0,0,1|2,0,0]=4 5336 B12R1.43 C[C@H](Nc1ccc[n][n]1)C(O)=O Amb25268668 [0,1,0,0,0,1|2,0,0]=4 5337 B12R1.43 C[C@H](Nc1ccc[n]c1)C(O)=O Amb25320831 [0,1,0,0,0,1|1,0,0]=3 5338 B12R1.43 C[C@H](Nc1cccc[n]1)C(O)=O Amb24066967 [0,1,0,0,0,1|1,0,0]=3 5339 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,1,0,0,0,1|0,0,0]=2 5340 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 Amb25143432 [0,1,0,0,0,1|1,0,1]=4 5341 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,1,0,0,0,1|1,0,1]=4 5342 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,1,0,0,0,1|1,0,1]=4 5343 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,1,0,0,0,1|1,0,1]=4 5344 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,1,0,0,0,1|0,0,0]=2 5345 B12R1.43 C[C@H](Sc1cccc[n]1)C(O)=O Amb22388633 [0,1,0,0,0,1|1,0,0]=3 5346 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,1,0,0,0,1|0,0,0]=2 5347 B12R1.43 C[C@H](Sc1ccccc1)[C@H](C)O Amb24661261 [0,1,0,0,0,1|1,0,1]=4 5348 B12R1.43 C\C(=C/c1ccccc1)\C(=O)C Amb17594004 [0,1,0,0,0,1|1,0,1]=4 5349 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O Amb2099512 [0,1,0,0,0,1|0,0,1]=3 5350 B12R1.43 C\C(=C\c1ccccc1)\C(N)=O Amb24388896 [0,1,0,0,0,1|1,0,1]=4 5351 B12R1.43 C\C(=C\c1ccccc1)\C(O)=O Amb24603461 [0,1,0,0,0,1|0,0,1]=3 5352 B12R1.43 C\C(=N/c1ccccc1)\C(C)=O Amb24537849 [0,1,0,0,0,1|1,0,1]=4 5353 B12R1.43 C\C(=N\c1ccccc1)\C(O)=O Amb24068331 [0,1,0,0,0,1|0,0,1]=3 5354 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,1,0,0,0,1|1,0,0]=3 5355 B12R1.43 ClC(C(=O)C)Cc1ccncc1 Amb17507769 [0,1,0,0,0,1|2,0,0]=4 5356 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [0,1,0,0,0,1|1,0,0]=3 5357 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [0,1,0,0,0,1|1,0,0]=3 5358 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,1,0,0,0,1|0,0,0]=2 5359 B12R1.43 FC(C(=O)O)Sc1ncccn1 Amb2407790 [0,1,0,0,0,1|2,0,0]=4 5360 B12R1.43 N=C(Nc1ccccc1)C(O)=O Amb18645991 [0,1,0,0,0,1|0,0,1]=3 5361 B12R1.43 NC(=Cc1ccccc1)C(O)=O Amb24081025 [0,1,0,0,0,1|0,0,1]=3 5362 B12R1.43 NC(=N)N(N)Cc1ccccc1 Amb25760721 [0,1,0,0,0,1|2,0,0]=4 5363 B12R1.43 NC(=N)N(O)Cc1ccccc1 Amb25291446 [0,1,0,0,0,1|2,0,0]=4 5364 B12R1.43 NC(=O)C(=N)Nc1ccccc1 Amb24106231 [0,1,0,0,0,1|1,0,1]=4 5365 B12R1.43 NC(=O)C(=O)Cc1c[n]ccc1 Amb24400568 [0,1,0,0,0,1|2,0,0]=4 5366 B12R1.43 NC(=O)C(Br)Cc1ccc[n]c1 Amb25741625 [0,1,0,0,0,1|2,0,0]=4 5367 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,1,0,0,0,1|1,0,0]=3 5368 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [0,1,0,0,0,1|1,0,0]=3 5369 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,1,0,0,0,1|1,0,0]=3 5370 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,1,0,0,0,1|1,0,0]=3 5371 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,1,0,0,0,1|1,0,0]=3 5372 B12R1.43 NC(=O)C(Sc1ccccn1)C Amb13953849 [0,1,0,0,0,1|2,0,0]=4 5373 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [0,1,0,0,0,1|1,0,0]=3 5374 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,1,0,0,0,1|1,0,0]=3 5375 B12R1.43 NC(=S)C(N)Cc1ccccc1 Amb25765717 [0,1,0,0,0,1|1,1,0]=4 5376 B12R1.43 NC(=S)N(Cl)Cc1ccccc1 Amb24681100 [0,1,0,0,0,1|1,1,0]=4 5377 B12R1.43 NC(=S)[C@H](O)Cc1ccccc1 Amb24419006 [0,1,0,0,0,1|1,1,0]=4 5378 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,1,0,0,0,1|1,0,0]=3 5379 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,1,0,0,0,1|0,0,0]=2 5380 B12R1.43 NC(Cc1[n]ccc[n]1)C(O)=O Amb18995251 [0,1,0,0,0,1|2,0,0]=4 5381 B12R1.43 NC(Cc1c[n]c[n]c1)C(O)=O Amb18302429 [0,1,0,0,0,1|2,0,0]=4 5382 B12R1.43 NC(Cc1c[n]cc[n]1)C(O)=O Amb19000859 [0,1,0,0,0,1|2,0,0]=4 5383 B12R1.43 NC(Cc1cc[n]c[n]1)C(O)=O Amb19000856 [0,1,0,0,0,1|2,0,0]=4 5384 B12R1.43 NC(Cc1cc[n]cc1)C(O)=O Amb22728340 [0,1,0,0,0,1|1,0,0]=3 5385 B12R1.43 NC(Cc1ccc[n][n]1)C(O)=O Amb18827268 [0,1,0,0,0,1|2,0,0]=4 5386 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22301544 [0,1,0,0,0,1|1,0,0]=3 5387 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22497387 [0,1,0,0,0,1|1,0,0]=3 5388 B12R1.43 NC(Cc1cccc[n]1)C(O)=O Amb22234042 [0,1,0,0,0,1|1,0,0]=3 5389 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [0,1,0,0,0,1|1,0,0]=3 5390 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [0,1,0,0,0,1|0,1,0]=3 5391 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,1,0,0,0,1|0,0,0]=2 5392 B12R1.43 NC(Cc1ccccc1)P(O)O Amb25227409 [0,1,0,0,0,1|1,0,1]=4 5393 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,1,0,0,0,1|0,0,0]=2 5394 B12R1.43 NC(Nc1ccccc1)C(=O)Cl Amb24558423 [0,1,0,0,0,1|1,0,0]=3 5395 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,1,0,0,0,1|0,0,0]=2 5396 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,1,0,0,0,1|0,0,0]=2 5397 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,1,0,0,0,1|0,0,0]=2 5398 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,1,0,0,0,1|0,0,0]=2 5399 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,1,0,0,0,1|0,0,0]=2 5400 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [0,1,0,0,0,1|1,0,0]=3 5401 B12R1.43 N[C@@H](CC=1CC=CCC1)C(O)=O Amb24080592 [0,1,0,0,0,1|0,0,2]=4 5402 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,1,0,0,0,1|0,0,0]=2 5403 B12R1.43 N[C@@H](Cc1[n]ccc[n]1)C(O)=O Amb24524889 [0,1,0,0,0,1|2,0,0]=4 5404 B12R1.43 N[C@@H](Cc1c[n]c[n]c1)C(O)=O Amb19149168 [0,1,0,0,0,1|2,0,0]=4 5405 B12R1.43 N[C@@H](Cc1c[n]cc[n]1)C(O)=O Amb22801697 [0,1,0,0,0,1|2,0,0]=4 5406 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb20241997 [0,1,0,0,0,1|1,0,0]=3 5407 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb22745959 [0,1,0,0,0,1|1,0,0]=3 5408 B12R1.43 N[C@@H](Cc1ccc[n]c1)C(O)=O Amb22008701 [0,1,0,0,0,1|1,0,0]=3 5409 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,1,0,0,0,1|1,0,1]=4 5410 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,1,0,0,0,1|0,0,0]=2 5411 B12R1.43 N[C@@H](Cc1ccccc1)P(O)O Amb25828976 [0,1,0,0,0,1|1,0,1]=4 5412 B12R1.43 N[C@H](Cc1c[n]cc[n]1)C(O)=O Amb24671229 [0,1,0,0,0,1|2,0,0]=4 5413 B12R1.43 N[C@H](Cc1cc[n]cc1)C(O)=O Amb19944301 [0,1,0,0,0,1|1,0,0]=3 5414 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb19930749 [0,1,0,0,0,1|1,0,0]=3 5415 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb22008700 [0,1,0,0,0,1|1,0,0]=3 5416 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [0,1,0,0,0,1|1,0,0]=3 5417 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,1,0,0,0,1|1,0,0]=3 5418 B12R1.43 N\C(=C\c1ccc[n]c1)\C(O)=O Amb25254657 [0,1,0,0,0,1|1,0,1]=4 5419 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [0,1,0,0,0,1|1,0,1]=4 5420 B12R1.43 O=C(C(=O)N)Nc1ccccc1 Amb1859924 [0,1,0,0,0,1|1,0,1]=4 5421 B12R1.43 O=C(C(=O)O)Cc1ccncc1 Amb17477816 [0,1,0,0,0,1|1,0,0]=3 5422 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,1,0,0,0,1|1,0,0]=3 5423 B12R1.43 O=C(Nc1ccccc1)C(=O)Cl Amb24537614 [0,1,0,0,0,1|1,0,1]=4 5424 B12R1.43 O=C(Oc1ccccc1)C(=O)Cl Amb25207901 [0,1,0,0,0,1|1,0,1]=4 5425 B12R1.43 OB(O)C(Cl)Cc1ccccc1 Amb24419999 [0,1,0,0,0,1|1,0,1]=4 5426 B12R1.43 OB(O)[C@H](Cl)Cc1ccccc1 Amb25779933 [0,1,0,0,0,1|1,0,1]=4 5427 B12R1.43 OC(=O)C(=O)Cc1ccccn1 Amb17477815 [0,1,0,0,0,1|1,0,0]=3 5428 B12R1.43 OC(=O)C(=O)Cc1cccnc1 Amb17232515 [0,1,0,0,0,1|1,0,0]=3 5429 B12R1.43 OC(=O)C(=S)Cc1cccc[n]1 Amb25059246 [0,1,0,0,0,1|1,0,0]=3 5430 B12R1.43 OC(=O)C(=S)Nc1cc[n]cc1 Amb24368096 [0,1,0,0,0,1|1,0,1]=4 5431 B12R1.43 OC(=O)C(Br)Cc1c[n]c[n]c1 Amb23571329 [0,1,0,0,0,1|2,0,0]=4 5432 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,1,0,0,0,1|0,0,0]=2 5433 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,1,0,0,0,1|0,0,0]=2 5434 B12R1.43 OC(=O)C(Cc1ccccn1)O Amb17138619 [0,1,0,0,0,1|1,0,0]=3 5435 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,1,0,0,0,1|0,0,0]=2 5436 B12R1.43 OC(=O)C(F)=Cc1ccccc1 Amb24093652 [0,1,0,0,0,1|0,0,1]=3 5437 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,1,0,0,0,1|0,0,0]=2 5438 B12R1.43 OC(=O)C(F)Sc1cc[n]cc1 Amb24487398 [0,1,0,0,0,1|1,0,0]=3 5439 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,1,0,0,0,1|0,0,0]=2 5440 B12R1.43 OC(=O)C(O)Cc1c[n]c[n]c1 Amb25722221 [0,1,0,0,0,1|2,0,0]=4 5441 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,1,0,0,0,1|0,0,0]=2 5442 B12R1.43 OC(=O)C(S)Cc1cc[n]c[n]1 Amb24587068 [0,1,0,0,0,1|2,0,0]=4 5443 B12R1.43 OC(=O)C(S)Cc1cc[n]cc1 Amb18289016 [0,1,0,0,0,1|1,0,0]=3 5444 B12R1.43 OC(=O)C(S)Cc1ccc[n]c1 Amb18968269 [0,1,0,0,0,1|1,0,0]=3 5445 B12R1.43 OC(=O)C(S)Cc1cccc[n]1 Amb18289034 [0,1,0,0,0,1|1,0,0]=3 5446 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,1,0,0,0,1|0,0,0]=2 5447 B12R1.43 OC(=O)C(Sc1ccccn1)C Amb1139396 [0,1,0,0,0,1|1,0,0]=3 5448 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,1,0,0,0,1|0,0,0]=2 5449 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,1,0,0,0,1|0,0,0]=2 5450 B12R1.43 OC(=O)[C@H](Cc1cccnc1)N Amb16231985 [0,1,0,0,0,1|1,0,0]=3 5451 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,1,0,0,0,1|0,0,0]=2 5452 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,1,0,0,0,1|0,0,0]=2 5453 B12R1.43 OC(=O)[C@H](O)Cc1c[n]ccc1 Amb24726274 [0,1,0,0,0,1|1,0,0]=3 5454 B12R1.43 OC(=O)[C@H](O)Cc1cc[n]cc1 Amb25260488 [0,1,0,0,0,1|1,0,0]=3 5455 B12R1.43 OC(=O)\C(=C\c1ccccn1)\S Amb1761004 [0,1,0,0,0,1|1,0,1]=4 5456 B12R1.43 OC(=O)\C(=C\c1cccnc1)\F Amb17614474 [0,1,0,0,0,1|1,0,1]=4 5457 B12R1.43 OC(=O)\C(=C\c1cccnc1)\S Amb1761005 [0,1,0,0,0,1|1,0,1]=4 5458 B12R1.43 OC(=O)\C(\Cl)=C/c1ccccc1 Amb18648695 [0,1,0,0,0,1|0,0,1]=3 5459 B12R1.43 OC(=O)\C(\Cl)=C\c1ccccc1 Amb19651416 [0,1,0,0,0,1|0,0,1]=3 5460 B12R1.43 OC(=O)\C(\F)=C\c1cc[n]cc1 Amb24377793 [0,1,0,0,0,1|1,0,1]=4 5461 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,1,0,0,0,1|0,1,0]=3 5462 B12R1.43 OC(C(=O)O)Cc1ccncc1 Amb17138620 [0,1,0,0,0,1|1,0,0]=3 5463 B12R1.43 O\C(=C/c1ccccc1)\C(O)=O Amb18645966 [0,1,0,0,0,1|0,0,1]=3 5464 B12R1.43 S=C(C(=O)O)Nc1ccccc1 Amb10558556 [0,1,0,0,0,1|0,0,1]=3 5465 B12R1.43 S\C(=C/c1ccccc1)\C(=O)O Amb1250109 [0,1,0,0,0,1|0,0,1]=3 5466 B12R1.43 S\C(=C/c1ccncc1)\C(=O)O Amb1761003 [0,1,0,0,0,1|1,0,1]=4 5467 B12R1.43 S\C(=C\c1ccccc1)\C(=O)O Amb2550972 [0,1,0,0,0,1|0,0,1]=3 5468 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,1,0,0,0,1|0,0,0]=2 5469 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [0,1,0,0,0,1|0,0,1]=3 5470 B12R1.107 Br\C(=C/C(=O)O)\c1ccccc1 Amb10069265 [0,1,0,0,0,1|0,0,1]=3 5471 B12R1.107 C=C(CC(N)=O)c1ccccc1 Amb25798918 [0,1,0,0,0,1|1,0,0]=3 5472 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [0,1,0,0,0,1|0,0,0]=2 5473 B12R1.107 C=C(C[N+]([O-])=O)c1ccccc1 Amb25174021 [0,1,0,0,0,1|1,0,1]=4 5474 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [0,1,0,0,0,1|2,0,0]=4 5475 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [0,1,0,0,0,1|2,0,0]=4 5476 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [0,1,0,0,0,1|2,0,0]=4 5477 B12R1.107 C=C(NC(N)=O)c1ccccc1 Amb25258325 [0,1,0,0,0,1|1,0,1]=4 5478 B12R1.107 CC(=C)CC(=O)c1ccccc1 Amb18563490 [0,1,0,0,0,1|2,0,0]=4 5479 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [0,1,0,0,0,1|2,0,0]=4 5480 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [0,1,0,0,0,1|2,0,0]=4 5481 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [0,1,0,0,0,1|2,0,0]=4 5482 B12R1.107 CC(=O)CC(C)c1c[n]ccc1 Amb24691286 [0,1,0,0,0,1|2,0,0]=4 5483 B12R1.107 CC(=O)CC(C)c1cccc[n]1 Amb24370168 [0,1,0,0,0,1|2,0,0]=4 5484 B12R1.107 CC(=O)CC(c1ccccn1)O Amb1016907 [0,1,0,0,0,1|2,0,0]=4 5485 B12R1.107 CC(=O)C[C@@H](O)c1cccc[n]1 Amb25319984 [0,1,0,0,0,1|2,0,0]=4 5486 B12R1.107 CC(=O)C[C@H](C)c1c[n]ccc1 Amb25714386 [0,1,0,0,0,1|2,0,0]=4 5487 B12R1.107 CC(=O)NC(=O)c1ccccc1 Amb24073560 [0,1,0,0,0,1|1,0,1]=4 5488 B12R1.107 CC(=O)NC(=S)c1ccccc1 Amb24073591 [0,1,0,0,0,1|1,0,1]=4 5489 B12R1.107 CC(=O)NC(C)c1cc[n]cc1 Amb25150955 [0,1,0,0,0,1|2,0,0]=4 5490 B12R1.107 CC(=O)NC(C)c1cccc[n]1 Amb25150956 [0,1,0,0,0,1|2,0,0]=4 5491 B12R1.107 CC(=O)N[C@@H](C)c1cccc[n]1 Amb25134946 [0,1,0,0,0,1|2,0,0]=4 5492 B12R1.107 CC(=O)N[C@H](C)c1cccc[n]1 Amb24659356 [0,1,0,0,0,1|2,0,0]=4 5493 B12R1.107 CC(=O)OC(=C)c1ccccc1 Amb22730633 [0,1,0,0,0,1|1,0,1]=4 5494 B12R1.107 CC(=O)OC(=O)c1ccccc1 Amb17678790 [0,1,0,0,0,1|1,0,1]=4 5495 B12R1.107 CC(=O)OC(C)c1c[n]ccc1 Amb25723772 [0,1,0,0,0,1|2,0,0]=4 5496 B12R1.107 CC(=O)O[C@@H](C)c1ccccc1 Amb25144207 [0,1,0,0,0,1|1,0,0]=3 5497 B12R1.107 CC(=O)O[C@H](C)c1ccccc1 Amb25160190 [0,1,0,0,0,1|1,0,0]=3 5498 B12R1.107 CC(=O)\C=C(/S)\c1ccccc1 Amb25730212 [0,1,0,0,0,1|1,0,1]=4 5499 B12R1.107 CC(=O)\C=C(\N)/c1ccccc1 Amb25309296 [0,1,0,0,0,1|1,0,1]=4 5500 B12R1.107 CC(=O)\N=C(\N)/c1ccccc1 Amb25150972 [0,1,0,0,0,1|1,0,1]=4 5501 B12R1.107 CC(=S)N[C@@H](C)c1ccccc1 Amb24532689 [0,1,0,0,0,1|1,1,0]=4 5502 B12R1.107 CC(C)=CC(N)c1ccccc1 Amb24355884 [0,1,0,0,0,1|2,0,0]=4 5503 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [0,1,0,0,0,1|1,0,1]=4 5504 B12R1.107 CC(CC(N)=O)c1cc[n]cc1 Amb25724402 [0,1,0,0,0,1|2,0,0]=4 5505 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,1,0,0,0,1|1,1,0]=4 5506 B12R1.107 CC(CC(O)=O)c1[n]ccc[n]1 Amb25135402 [0,1,0,0,0,1|2,0,0]=4 5507 B12R1.107 CC(CC(O)=O)c1c[n]cc[n]1 Amb24487345 [0,1,0,0,0,1|2,0,0]=4 5508 B12R1.107 CC(CC(O)=O)c1cc[n]c[n]1 Amb24589784 [0,1,0,0,0,1|2,0,0]=4 5509 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [0,1,0,0,0,1|0,0,2]=4 5510 B12R1.107 CC(CN(c1ccccc1)C)O Amb17138595 [0,1,0,0,0,1|1,0,1]=4 5511 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [0,1,0,0,0,1|2,0,0]=4 5512 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,1,0,0,0,1|1,0,0]=3 5513 B12R1.107 CC(CS([O-])=O)c1ccccc1 Amb24385785 [0,1,0,0,0,1|1,0,1]=4 5514 B12R1.107 CC(NC(=O)Cl)c1ccccc1 Amb25780625 [0,1,0,0,0,1|1,0,0]=3 5515 B12R1.107 CC(NC(N)=N)c1ccccc1 Amb22284229 [0,1,0,0,0,1|2,0,0]=4 5516 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,1,0,0,0,1|1,0,1]=4 5517 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,1,0,0,0,1|1,0,1]=4 5518 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,1,0,0,0,1|1,0,1]=4 5519 B12R1.107 CC(O)CS(=O)c1ccccc1 Amb25042910 [0,1,0,0,0,1|1,0,1]=4 5520 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,1,0,0,0,1|1,0,1]=4 5521 B12R1.107 CC(OC(C)=O)c1ccccn1 Amb17912737 [0,1,0,0,0,1|2,0,0]=4 5522 B12R1.107 CC(OC(C)=O)c1ccncc1 Amb17689315 [0,1,0,0,0,1|2,0,0]=4 5523 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,1,0,0,0,1|0,0,0]=2 5524 B12R1.107 CC(c1ccccc1)NC(=N)N Amb10669498 [0,1,0,0,0,1|2,0,0]=4 5525 B12R1.107 CC(c1ccccc1)NC(=O)N Amb1135151 [0,1,0,0,0,1|1,0,0]=3 5526 B12R1.107 CC(c1ccccc1)NC(=S)N Amb1645582 [0,1,0,0,0,1|1,1,0]=4 5527 B12R1.107 CN(CC(N)=O)c1cccc[n]1 Amb25686738 [0,1,0,0,0,1|2,0,0]=4 5528 B12R1.107 CN(CC(O)=O)c1c[n]c[n]c1 Amb18268642 [0,1,0,0,0,1|2,0,0]=4 5529 B12R1.107 CN(CC(O)=O)c1cc[n]c[n]1 Amb18997546 [0,1,0,0,0,1|2,0,0]=4 5530 B12R1.107 CN(CC(O)=O)c1ccc[n]c1 Amb18268673 [0,1,0,0,0,1|1,0,0]=3 5531 B12R1.107 CN(CC(O)=O)c1cccc[n]1 Amb22275945 [0,1,0,0,0,1|1,0,0]=3 5532 B12R1.107 CN(c1ccccc1)CC(=C)C Amb10571185 [0,1,0,0,0,1|2,0,0]=4 5533 B12R1.107 CN(c1ccccc1)CC(=O)Cl Amb17142999 [0,1,0,0,0,1|1,0,0]=3 5534 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [0,1,0,0,0,1|0,0,0]=2 5535 B12R1.107 CN(c1cnccn1)CC(=O)O Amb1125195 [0,1,0,0,0,1|2,0,0]=4 5536 B12R1.107 CN(c1ncccn1)CC(=O)O Amb1130766 [0,1,0,0,0,1|2,0,0]=4 5537 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [0,1,0,0,0,1|0,0,0]=2 5538 B12R1.107 CS(=NC(N)=O)c1ccccc1 Amb24370272 [0,1,0,0,0,1|2,0,0]=4 5539 B12R1.107 CS(=O)CC(=O)c1ccccc1 Amb24741512 [0,1,0,0,0,1|2,0,0]=4 5540 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [0,1,0,0,0,1|2,0,0]=4 5541 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [0,1,0,0,0,1|2,0,0]=4 5542 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [0,1,0,0,0,1|1,0,0]=3 5543 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 Amb24663849 [0,1,0,0,0,1|1,0,1]=4 5544 B12R1.107 C[C@@H](O)CS(=O)c1ccccc1 Amb25788068 [0,1,0,0,0,1|1,0,1]=4 5545 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,1,0,0,0,1|1,0,1]=4 5546 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,1,0,0,0,1|1,0,1]=4 5547 B12R1.107 C[C@@H](SC(N)=N)c1ccccc1 Amb25807975 [0,1,0,0,0,1|2,0,0]=4 5548 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,1,0,0,0,1|0,0,0]=2 5549 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,1,0,0,0,1|1,0,1]=4 5550 B12R1.107 C[C@H](NC(N)=O)c1cccc[n]1 Amb24448704 [0,1,0,0,0,1|2,0,0]=4 5551 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [0,1,0,0,0,1|1,0,0]=3 5552 B12R1.107 C[C@H](O)CC(=C)c1ccccc1 Amb25741335 [0,1,0,0,0,1|1,0,1]=4 5553 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,1,0,0,0,1|1,0,1]=4 5554 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,1,0,0,0,1|1,0,1]=4 5555 B12R1.107 C[C@H](O)CS(=O)c1ccccc1 Amb24364273 [0,1,0,0,0,1|1,0,1]=4 5556 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,1,0,0,0,1|1,0,1]=4 5557 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,1,0,0,0,1|1,0,1]=4 5558 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,1,0,0,0,1|1,0,1]=4 5559 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,1,0,0,0,1|0,0,0]=2 5560 B12R1.107 C\C(=C/C(=O)Cl)\c1ccccc1 Amb25195673 [0,1,0,0,0,1|1,0,1]=4 5561 B12R1.107 C\C(=C/C(N)=O)\c1ccccc1 Amb24648875 [0,1,0,0,0,1|1,0,1]=4 5562 B12R1.107 C\C(=C\C(=O)Cl)\c1ccccc1 Amb25220154 [0,1,0,0,0,1|1,0,1]=4 5563 B12R1.107 C\C(=C\C(C)=O)\c1ccccc1 Amb24367599 [0,1,0,0,0,1|1,0,1]=4 5564 B12R1.107 C\C(=C\C(O)=O)\c1cc[n]cc1 Amb20626499 [0,1,0,0,0,1|1,0,1]=4 5565 B12R1.107 C\C(=C\C(O)=O)\c1ccc[n]c1 Amb20626498 [0,1,0,0,0,1|1,0,1]=4 5566 B12R1.107 C\C(=C\C(O)=O)\c1cccc[n]1 Amb24393080 [0,1,0,0,0,1|1,0,1]=4 5567 B12R1.107 C\C(=C\C(O)=O)\c1ccccc1 Amb24271190 [0,1,0,0,0,1|0,0,1]=3 5568 B12R1.107 C\C(\Cl)=C\C(Cl)c1ccccc1 Amb25277290 [0,1,0,0,0,1|2,0,0]=4 5569 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [0,1,0,0,0,1|2,0,0]=4 5570 B12R1.107 Cl\C(=C/C(=O)O)\c1ccccc1 Amb17594707 [0,1,0,0,0,1|0,0,1]=3 5571 B12R1.107 NC(=N)CC(=S)c1ccccc1 Amb24692832 [0,1,0,0,0,1|2,0,0]=4 5572 B12R1.107 NC(=O)CC(=O)c1cc[n]cc1 Amb25831179 [0,1,0,0,0,1|2,0,0]=4 5573 B12R1.107 NC(=O)CN(N)c1ccccc1 Amb25150990 [0,1,0,0,0,1|1,0,0]=3 5574 B12R1.107 NC(=O)C[C@@H](N)c1c[n]ccc1 Amb18792646 [0,1,0,0,0,1|2,0,0]=4 5575 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,1,0,0,0,1|1,0,0]=3 5576 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [0,1,0,0,0,1|1,0,0]=3 5577 B12R1.107 NC(=O)C[C@H](N)c1c[n]ccc1 Amb25137393 [0,1,0,0,0,1|2,0,0]=4 5578 B12R1.107 NC(=O)C[C@H](N)c1cccc[n]1 Amb25049883 [0,1,0,0,0,1|2,0,0]=4 5579 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [0,1,0,0,0,1|1,0,0]=3 5580 B12R1.107 NC(=O)C[P](=S)c1ccccc1 Amb24375519 [0,1,0,0,0,1|1,0,0]=3 5581 B12R1.107 NC(=O)NC(=N)c1ccccc1 Amb25337571 [0,1,0,0,0,1|1,0,1]=4 5582 B12R1.107 NC(=O)NC(=S)c1ccccc1 Amb24532795 [0,1,0,0,0,1|1,0,1]=4 5583 B12R1.107 NC(=O)\C=C(\O)/c1ccccc1 Amb24580412 [0,1,0,0,0,1|1,0,1]=4 5584 B12R1.107 NC(=S)CC(=N)c1ccccc1 Amb25337793 [0,1,0,0,0,1|1,1,0]=4 5585 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,1,0,0,0,1|1,1,0]=4 5586 B12R1.107 NC(CB(O)O)c1ccccc1 Amb24658322 [0,1,0,0,0,1|1,0,1]=4 5587 B12R1.107 NC(CC(O)=O)c1c[n]cc[n]1 Amb24377112 [0,1,0,0,0,1|2,0,0]=4 5588 B12R1.107 NC(CC(O)=O)c1cc[n]c[n]1 Amb25148500 [0,1,0,0,0,1|2,0,0]=4 5589 B12R1.107 NC(CC(O)=O)c1cccc[n]1 Amb22898991 [0,1,0,0,0,1|1,0,0]=3 5590 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [0,1,0,0,0,1|1,0,0]=3 5591 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [0,1,0,0,0,1|1,0,0]=3 5592 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,1,0,0,0,1|0,0,0]=2 5593 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [0,1,0,0,0,1|0,0,0]=2 5594 B12R1.107 N[C@@H](CC(O)=O)c1c[n]c[n]c1 Amb25324427 [0,1,0,0,0,1|2,0,0]=4 5595 B12R1.107 N[C@@H](CC(O)=O)c1c[n]cc[n]1 Amb25800392 [0,1,0,0,0,1|2,0,0]=4 5596 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb19929593 [0,1,0,0,0,1|1,0,0]=3 5597 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb20240885 [0,1,0,0,0,1|1,0,0]=3 5598 B12R1.107 N[C@@H](CC(O)=O)c1ccc[n]c1 Amb19929600 [0,1,0,0,0,1|1,0,0]=3 5599 B12R1.107 N[C@@H](CC(O)=O)c1cccc[n]1 Amb20241102 [0,1,0,0,0,1|1,0,0]=3 5600 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb19929602 [0,1,0,0,0,1|1,0,0]=3 5601 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb20241136 [0,1,0,0,0,1|1,0,0]=3 5602 B12R1.107 N[C@H](CC(O)=O)c1ccc[n]c1 Amb19929601 [0,1,0,0,0,1|1,0,0]=3 5603 B12R1.107 N[C@H](CC(O)=O)c1cccc[n]1 Amb20241101 [0,1,0,0,0,1|1,0,0]=3 5604 B12R1.107 N\C(=C/C(O)=O)\c1ccccc1 Amb22054873 [0,1,0,0,0,1|0,0,1]=3 5605 B12R1.107 N\C(=C\C(O)=O)\c1cccc[n]1 Amb24426187 [0,1,0,0,0,1|1,0,1]=4 5606 B12R1.107 N\C(=C\C(O)=O)\c1ccccc1 Amb25274098 [0,1,0,0,0,1|0,0,1]=3 5607 B12R1.107 O=C(CC(=O)[Na])c1ccccc1 Amb24364157 [0,1,0,0,0,1|1,0,0]=3 5608 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [0,1,0,0,0,1|0,0,0]=2 5609 B12R1.107 OB(O)OC(O)c1ccccc1 Amb24343472 [0,1,0,0,0,1|1,0,1]=4 5610 B12R1.107 OC(=O)CC(Cl)c1cc[n]cc1 Amb18119876 [0,1,0,0,0,1|1,0,0]=3 5611 B12R1.107 OC(=O)CC(Cl)c1ccc[n]c1 Amb18119752 [0,1,0,0,0,1|1,0,0]=3 5612 B12R1.107 OC(=O)CC(Cl)c1cccc[n]1 Amb18120042 [0,1,0,0,0,1|1,0,0]=3 5613 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,1,0,0,0,1|0,0,0]=2 5614 B12R1.107 OC(=O)CC(F)c1ccc[n]c1 Amb25823686 [0,1,0,0,0,1|1,0,0]=3 5615 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,1,0,0,0,1|0,0,0]=2 5616 B12R1.107 OC(=O)CC(O)c1cc[n]cc1 Amb18563783 [0,1,0,0,0,1|1,0,0]=3 5617 B12R1.107 OC(=O)CC(O)c1cccc[n]1 Amb18563782 [0,1,0,0,0,1|1,0,0]=3 5618 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,1,0,0,0,1|0,0,0]=2 5619 B12R1.107 OC(=O)CC(c1ccccn1)Br Amb17596297 [0,1,0,0,0,1|1,0,0]=3 5620 B12R1.107 OC(=O)CC(c1cccnc1)N Amb1993735 [0,1,0,0,0,1|1,0,0]=3 5621 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [0,1,0,0,0,1|0,0,0]=2 5622 B12R1.107 OC(=O)\C=C(\F)/c1ccccc1 Amb24426178 [0,1,0,0,0,1|0,0,1]=3 5623 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [0,1,0,0,0,1|0,2,0]=4 5624 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,1,0,0,0,1|1,0,1]=4 5625 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [0,1,0,0,0,1|1,0,1]=4 5626 B12R1.107 O[C@H](OP(O)O)c1ccccc1 Amb24675416 [0,1,0,0,0,1|1,0,1]=4 5627 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb22491482 [0,1,0,0,0,1|0,0,1]=3 5628 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb23401058 [0,1,0,0,0,1|0,0,1]=3 5629 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb1395651 [0,1,0,0,0,1|1,0,1]=4 5630 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb2563772 [0,1,0,0,0,1|1,0,1]=4 5631 B12R1.125 C=C(Br)CNc1ccccc1Cl Amb25053602 [0,1,0,0,0,1|2,0,0]=4 5632 B12R1.125 C=C(Br)CNc1ccccc1F Amb25138559 [0,1,0,0,0,1|2,0,0]=4 5633 B12R1.125 C=C(Br)CNc1ccccc1N Amb25830760 [0,1,0,0,0,1|2,0,0]=4 5634 B12R1.125 C=C(Br)COc1ccccc1F Amb24484229 [0,1,0,0,0,1|2,0,0]=4 5635 B12R1.125 C=C(Br)COc1ccccc1N Amb18971551 [0,1,0,0,0,1|2,0,0]=4 5636 B12R1.125 C=C(Br)COc1ccccc1O Amb25837219 [0,1,0,0,0,1|2,0,0]=4 5637 B12R1.125 C=C(Br)CSc1ccccc1Br Amb24372620 [0,1,0,0,0,1|2,0,0]=4 5638 B12R1.125 C=C(Br)CSc1ccccc1F Amb24720587 [0,1,0,0,0,1|2,0,0]=4 5639 B12R1.125 C=C(Br)CSc1ccccc1N Amb18969571 [0,1,0,0,0,1|2,0,0]=4 5640 B12R1.125 C=C(Cl)CNc1ccccc1Br Amb24692494 [0,1,0,0,0,1|2,0,0]=4 5641 B12R1.125 C=C(Cl)CNc1ccccc1F Amb18968750 [0,1,0,0,0,1|2,0,0]=4 5642 B12R1.125 C=C(Cl)CNc1ccccc1N Amb25100758 [0,1,0,0,0,1|2,0,0]=4 5643 B12R1.125 C=C(Cl)COc1ccccc1Cl Amb25724454 [0,1,0,0,0,1|2,0,0]=4 5644 B12R1.125 C=C(Cl)COc1ccccc1N Amb18290043 [0,1,0,0,0,1|2,0,0]=4 5645 B12R1.125 C=C(Cl)CSc1ccccc1Cl Amb24631781 [0,1,0,0,0,1|2,0,0]=4 5646 B12R1.125 C=C(Cl)CSc1ccccc1O Amb19039654 [0,1,0,0,0,1|2,0,0]=4 5647 B12R1.125 C=C(F)COc1ccccc1Br Amb23570547 [0,1,0,0,0,1|2,0,0]=4 5648 B12R1.125 CC(=C)CNc1ccccc1Br Amb17306219 [0,1,0,0,0,1|2,0,0]=4 5649 B12R1.125 CC(=C)CNc1ccccc1C Amb17306597 [0,1,0,0,0,1|2,0,0]=4 5650 B12R1.125 CC(=C)CNc1ccccc1Cl Amb18809688 [0,1,0,0,0,1|2,0,0]=4 5651 B12R1.125 CC(=C)CNc1ccccc1F Amb18800922 [0,1,0,0,0,1|2,0,0]=4 5652 B12R1.125 CC(=C)CNc1ccccc1N Amb24727221 [0,1,0,0,0,1|2,0,0]=4 5653 B12R1.125 CC(=C)COc1ccccc1Cl Amb25831212 [0,1,0,0,0,1|2,0,0]=4 5654 B12R1.125 CC(=C)COc1ccccc1F Amb25069154 [0,1,0,0,0,1|2,0,0]=4 5655 B12R1.125 CC(=C)COc1ccccc1I Amb24730906 [0,1,0,0,0,1|2,0,0]=4 5656 B12R1.125 CC(=C)COc1ccccc1N Amb2081551 [0,1,0,0,0,1|2,0,0]=4 5657 B12R1.125 CC(=C)CSc1ccccc1Br Amb25077720 [0,1,0,0,0,1|2,0,0]=4 5658 B12R1.125 CC(=C)CSc1ccccc1O Amb18791174 [0,1,0,0,0,1|2,0,0]=4 5659 B12R1.125 CC(=N)NCc1ccccc1Br Amb24476278 [0,1,0,0,0,1|2,0,0]=4 5660 B12R1.125 CC(=N)NCc1ccccc1F Amb25148439 [0,1,0,0,0,1|2,0,0]=4 5661 B12R1.125 CC(=O)C#Cc1ccccc1F Amb25767750 [0,1,0,0,0,1|1,0,1]=4 5662 B12R1.125 CC(=O)C=Cc1ccccc1O Amb24065680 [0,1,0,0,0,1|1,0,1]=4 5663 B12R1.125 CC(=O)CCC1=CC=CNC1=O Amb24404877 [0,1,0,0,0,1|2,0,0]=4 5664 B12R1.125 CC(=O)CCc1[n]cccc1Br Amb25703295 [0,1,0,0,0,1|2,0,0]=4 5665 B12R1.125 CC(=O)CCc1[n]cccc1O Amb24537666 [0,1,0,0,0,1|2,0,0]=4 5666 B12R1.125 CC(=O)CCc1c[n]ccc1Cl Amb25044219 [0,1,0,0,0,1|2,0,0]=4 5667 B12R1.125 CC(=O)CCc1cc[n]cc1Cl Amb24678607 [0,1,0,0,0,1|2,0,0]=4 5668 B12R1.125 CC(=O)CCc1ccc[n]c1Cl Amb25731066 [0,1,0,0,0,1|2,0,0]=4 5669 B12R1.125 CC(=O)CCc1ccc[n]c1N Amb25687160 [0,1,0,0,0,1|2,0,0]=4 5670 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [0,1,0,0,0,1|1,0,0]=3 5671 B12R1.125 CC(=O)CNc1ccccc1Cl Amb24552973 [0,1,0,0,0,1|1,0,0]=3 5672 B12R1.125 CC(=O)COc1cccc[n+]1[O-] Amb25357221 [0,1,0,0,0,1|2,0,0]=4 5673 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [0,1,0,0,0,1|1,0,0]=3 5674 B12R1.125 CC(=O)COc1ccccc1Cl Amb19075143 [0,1,0,0,0,1|1,0,0]=3 5675 B12R1.125 CC(=O)COc1ccccc1I Amb25692816 [0,1,0,0,0,1|1,0,0]=3 5676 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [0,1,0,0,0,1|1,0,0]=3 5677 B12R1.125 CC(=O)COc1ccccc1O Amb18646466 [0,1,0,0,0,1|1,0,0]=3 5678 B12R1.125 CC(=O)CSc1[n]cccc1Br Amb25034656 [0,1,0,0,0,1|2,0,0]=4 5679 B12R1.125 CC(=O)CSc1[n]cccc1Cl Amb25152614 [0,1,0,0,0,1|2,0,0]=4 5680 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [0,1,0,0,0,1|1,0,0]=3 5681 B12R1.125 CC(=O)NCc1[n]cccc1F Amb25333132 [0,1,0,0,0,1|2,0,0]=4 5682 B12R1.125 CC(=O)NCc1[n]cccc1O Amb25688352 [0,1,0,0,0,1|2,0,0]=4 5683 B12R1.125 CC(=O)NCc1ccc[n]c1F Amb24458330 [0,1,0,0,0,1|2,0,0]=4 5684 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [0,1,0,0,0,1|1,0,0]=3 5685 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [0,1,0,0,0,1|1,0,0]=3 5686 B12R1.125 CC(=O)NCc1ccccc1N Amb18284299 [0,1,0,0,0,1|1,0,0]=3 5687 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [0,1,0,0,0,1|1,0,0]=3 5688 B12R1.125 CC(=O)NCc1cnccc1C Amb17778543 [0,1,0,0,0,1|2,0,0]=4 5689 B12R1.125 CC(=O)NNc1ccccc1N Amb18646313 [0,1,0,0,0,1|2,0,0]=4 5690 B12R1.125 CC(=O)OCc1cc[n]cc1Br Amb25159749 [0,1,0,0,0,1|2,0,0]=4 5691 B12R1.125 CC(=O)OCc1cccc[n+]1C Amb10553787 [0,1,0,0,0,1|2,0,0]=4 5692 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [0,1,0,0,0,1|1,0,0]=3 5693 B12R1.125 CC(=O)OCc1ccccc1F Amb25788639 [0,1,0,0,0,1|1,0,0]=3 5694 B12R1.125 CC(=O)OCc1ccccc1O Amb18646465 [0,1,0,0,0,1|1,0,0]=3 5695 B12R1.125 CC(=O)SCc1ccc[n]c1N Amb24518695 [0,1,0,0,0,1|2,0,0]=4 5696 B12R1.125 CC(=O)SCc1ccccc1F Amb22231630 [0,1,0,0,0,1|1,0,0]=3 5697 B12R1.125 CC(=O)\C=C\c1ccccc1Br Amb18068027 [0,1,0,0,0,1|1,0,1]=4 5698 B12R1.125 CC(=O)\C=C\c1ccccc1C Amb17477498 [0,1,0,0,0,1|1,0,1]=4 5699 B12R1.125 CC(=O)\C=C\c1ccccc1F Amb18563599 [0,1,0,0,0,1|1,0,1]=4 5700 B12R1.125 CC(=O)\C=C\c1ccccc1O Amb1266216 [0,1,0,0,0,1|1,0,1]=4 5701 B12R1.125 CC(=O)\N=C\c1ccccc1Cl Amb24072988 [0,1,0,0,0,1|1,0,1]=4 5702 B12R1.125 CC(C)=CCc1ccccc1N Amb18645540 [0,1,0,0,0,1|2,0,0]=4 5703 B12R1.125 CC(C)=CCc1ccccc1O Amb24357144 [0,1,0,0,0,1|2,0,0]=4 5704 B12R1.125 CC(CCc1ccccc1O)O Amb17507249 [0,1,0,0,0,1|1,0,1]=4 5705 B12R1.125 CC(CNc1ccccc1Br)O Amb17142610 [0,1,0,0,0,1|1,0,1]=4 5706 B12R1.125 CC(CNc1ccccc1C)O Amb17138592 [0,1,0,0,0,1|1,0,1]=4 5707 B12R1.125 CC(CNc1ccccc1Cl)O Amb17139125 [0,1,0,0,0,1|1,0,1]=4 5708 B12R1.125 CC(CNc1ccccc1F)O Amb17138650 [0,1,0,0,0,1|1,0,1]=4 5709 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [0,1,0,0,0,1|1,0,1]=4 5710 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [0,1,0,0,0,1|1,0,1]=4 5711 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [0,1,0,0,0,1|1,0,1]=4 5712 B12R1.125 CC(O)CCc1ccccc1N Amb24485690 [0,1,0,0,0,1|1,0,1]=4 5713 B12R1.125 CC(O)CNc1ccccc1O Amb18646739 [0,1,0,0,0,1|1,0,1]=4 5714 B12R1.125 CC(O)COc1ccccc1Cl Amb25337460 [0,1,0,0,0,1|1,0,1]=4 5715 B12R1.125 CC(O)COc1ccccc1F Amb18806458 [0,1,0,0,0,1|1,0,1]=4 5716 B12R1.125 CC(O)COc1ccccc1N Amb18971553 [0,1,0,0,0,1|1,0,1]=4 5717 B12R1.125 CC(O)COc1ccccc1O Amb18646901 [0,1,0,0,0,1|1,0,1]=4 5718 B12R1.125 CC(O)CSc1ccccc1F Amb19058401 [0,1,0,0,0,1|1,0,1]=4 5719 B12R1.125 CC(O)CSc1ccccc1N Amb18969617 [0,1,0,0,0,1|1,0,1]=4 5720 B12R1.125 CC(O)CSc1ccccc1O Amb19045466 [0,1,0,0,0,1|1,0,1]=4 5721 B12R1.125 CS(=O)CCc1ccccc1N Amb18299124 [0,1,0,0,0,1|2,0,0]=4 5722 B12R1.125 CS(=O)NCc1ccccc1N Amb24600929 [0,1,0,0,0,1|2,0,0]=4 5723 B12R1.125 CS(=O)NCc1ccccc1O Amb24589168 [0,1,0,0,0,1|2,0,0]=4 5724 B12R1.125 C[C@@H](O)COc1ccccc1O Amb24689528 [0,1,0,0,0,1|1,0,1]=4 5725 B12R1.125 C[C@@H](O)CSc1ccccc1Br Amb24725913 [0,1,0,0,0,1|1,0,1]=4 5726 B12R1.125 C[C@@H](O)CSc1ccccc1Cl Amb25831408 [0,1,0,0,0,1|1,0,1]=4 5727 B12R1.125 C[C@H](O)COc1ccccc1F Amb25784865 [0,1,0,0,0,1|1,0,1]=4 5728 B12R1.125 C[C@H](O)CSc1ccccc1Br Amb24497740 [0,1,0,0,0,1|1,0,1]=4 5729 B12R1.125 C[C@H](O)CSc1ccccc1F Amb25073686 [0,1,0,0,0,1|1,0,1]=4 5730 B12R1.125 C\C(\Cl)=C\Cc1ccccc1O Amb24614705 [0,1,0,0,0,1|2,0,0]=4 5731 B12R1.125 C\C(\N)=N\Cc1ccccc1O Amb24734749 [0,1,0,0,0,1|2,0,0]=4 5732 B12R1.125 Cc1[n]c[n]cc1CCC(O)=O Amb18827881 [0,1,0,0,0,1|2,0,0]=4 5733 B12R1.125 Cc1[n]cccc1CCC(C)=O Amb25859556 [0,1,0,0,0,1|2,0,0]=4 5734 B12R1.125 Cc1[n]cccc1CCC(O)=O Amb18853387 [0,1,0,0,0,1|1,0,0]=3 5735 B12R1.125 Cc1[n]cccc1COC(C)=O Amb22750508 [0,1,0,0,0,1|2,0,0]=4 5736 B12R1.125 Cc1[n]cccc1OCC(O)=O Amb24729073 [0,1,0,0,0,1|1,0,0]=3 5737 B12R1.125 Cc1[n]cccc1\C=C\C(O)=O Amb18522806 [0,1,0,0,0,1|1,0,1]=4 5738 B12R1.125 Cc1c[n]c[n]c1CCC(O)=O Amb18827882 [0,1,0,0,0,1|2,0,0]=4 5739 B12R1.125 Cc1c[n]c[n]c1OCC(O)=O Amb18826750 [0,1,0,0,0,1|2,0,0]=4 5740 B12R1.125 Cc1c[n]ccc1OCC(O)=O Amb25705533 [0,1,0,0,0,1|1,0,0]=3 5741 B12R1.125 Cc1c[n]ccc1\C=C\C(O)=O Amb25148916 [0,1,0,0,0,1|1,0,1]=4 5742 B12R1.125 Cc1cc[n]cc1C#CC(O)=O Amb24734142 [0,1,0,0,0,1|1,0,1]=4 5743 B12R1.125 Cc1cc[n]cc1CCC(O)=O Amb18828438 [0,1,0,0,0,1|1,0,0]=3 5744 B12R1.125 Cc1cc[n]cc1CNC(N)=O Amb25737454 [0,1,0,0,0,1|2,0,0]=4 5745 B12R1.125 Cc1cc[n]cc1\C=C\C(O)=O Amb25210821 [0,1,0,0,0,1|1,0,1]=4 5746 B12R1.125 Cc1ccc[n]c1CNC(C)=O Amb22584206 [0,1,0,0,0,1|2,0,0]=4 5747 B12R1.125 Cc1ccc[n]c1COC(C)=O Amb24063548 [0,1,0,0,0,1|2,0,0]=4 5748 B12R1.125 Cc1ccc[n]c1NCC(N)=O Amb18987730 [0,1,0,0,0,1|2,0,0]=4 5749 B12R1.125 Cc1ccc[n]c1OCC(O)=O Amb25154207 [0,1,0,0,0,1|1,0,0]=3 5750 B12R1.125 Cc1ccc[n]c1SCC(C)=O Amb25136842 [0,1,0,0,0,1|2,0,0]=4 5751 B12R1.125 Cc1ccc[n]c1SCC(N)=O Amb25036514 [0,1,0,0,0,1|2,0,0]=4 5752 B12R1.125 Cc1ccc[n]c1SCC(O)=O Amb18989775 [0,1,0,0,0,1|1,0,0]=3 5753 B12R1.125 Cc1cccc[n+]1CCC(O)=O Amb24410939 [0,1,0,0,0,1|1,0,0]=3 5754 B12R1.125 Cc1ccccc1C#CC(C)=O Amb23438225 [0,1,0,0,0,1|1,0,1]=4 5755 B12R1.125 Cc1ccccc1C#CC(O)=O Amb20673097 [0,1,0,0,0,1|0,0,1]=3 5756 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [0,1,0,0,0,1|1,0,0]=3 5757 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [0,1,0,0,0,1|1,0,1]=4 5758 B12R1.125 Cc1ccccc1CCC(N)=N Amb18065464 [0,1,0,0,0,1|2,0,0]=4 5759 B12R1.125 Cc1ccccc1CNC(C)=N Amb25780309 [0,1,0,0,0,1|2,0,0]=4 5760 B12R1.125 Cc1ccccc1CNC(C)=O Amb24721874 [0,1,0,0,0,1|1,0,0]=3 5761 B12R1.125 Cc1ccccc1CNC(N)=N Amb18798204 [0,1,0,0,0,1|2,0,0]=4 5762 B12R1.125 Cc1ccccc1CNC(N)=O Amb18800799 [0,1,0,0,0,1|1,0,0]=3 5763 B12R1.125 Cc1ccccc1CNC(N)=S Amb18796346 [0,1,0,0,0,1|1,1,0]=4 5764 B12R1.125 Cc1ccccc1COC(N)=O Amb25152446 [0,1,0,0,0,1|1,0,0]=3 5765 B12R1.125 Cc1ccccc1CSC(C)=O Amb22231631 [0,1,0,0,0,1|1,0,0]=3 5766 B12R1.125 Cc1ccccc1CSC(N)=N Amb20676054 [0,1,0,0,0,1|2,0,0]=4 5767 B12R1.125 Cc1ccccc1CSC(N)=N Amb22269917 [0,1,0,0,0,1|2,0,0]=4 5768 B12R1.125 Cc1ccccc1CSC(N)=N Amb25319198 [0,1,0,0,0,1|2,0,0]=4 5769 B12R1.125 Cc1ccccc1NCC(=C)Br Amb25149783 [0,1,0,0,0,1|2,0,0]=4 5770 B12R1.125 Cc1ccccc1NCC(=C)Cl Amb18809686 [0,1,0,0,0,1|2,0,0]=4 5771 B12R1.125 Cc1ccccc1NCC(C)=O Amb25062983 [0,1,0,0,0,1|1,0,0]=3 5772 B12R1.125 Cc1ccccc1NC[C@H](C)O Amb25096984 [0,1,0,0,0,1|1,0,1]=4 5773 B12R1.125 Cc1ccccc1OCC(=C)Br Amb24484140 [0,1,0,0,0,1|2,0,0]=4 5774 B12R1.125 Cc1ccccc1OCC(=C)Cl Amb25751372 [0,1,0,0,0,1|2,0,0]=4 5775 B12R1.125 Cc1ccccc1OCC(C)O Amb18182639 [0,1,0,0,0,1|1,0,1]=4 5776 B12R1.125 Cc1ccccc1OCC(O)O Amb24420845 [0,1,0,0,0,1|0,0,2]=4 5777 B12R1.125 Cc1ccccc1OC[C@H](C)O Amb25068670 [0,1,0,0,0,1|1,0,1]=4 5778 B12R1.125 Cc1ccccc1SCC(C)=O Amb18796318 [0,1,0,0,0,1|1,0,0]=3 5779 B12R1.125 Cc1ccccc1SCC(C)O Amb19054504 [0,1,0,0,0,1|1,0,1]=4 5780 B12R1.125 Cc1ccccc1SCC(N)=N Amb18181218 [0,1,0,0,0,1|2,0,0]=4 5781 B12R1.125 Cc1ccccc1SC[N+]([O-])=O Amb25372376 [0,1,0,0,0,1|1,0,1]=4 5782 B12R1.125 Cc1ccccc1\N=N\C(N)=O Amb24429126 [0,1,0,0,0,1|2,0,0]=4 5783 B12R1.125 Cc1ccncc1C=CC(O)=O Amb17844101 [0,1,0,0,0,1|1,0,1]=4 5784 B12R1.125 Cc1nccnc1NCC(=O)O Amb17516799 [0,1,0,0,0,1|2,0,0]=4 5785 B12R1.125 Cc1nccnc1SCC(=O)O Amb17516121 [0,1,0,0,0,1|2,0,0]=4 5786 B12R1.125 ClC(=O)CCc1ccccc1F Amb10838958 [0,1,0,0,0,1|1,0,0]=3 5787 B12R1.125 ClC(=O)COc1ccccc1Br Amb16230053 [0,1,0,0,0,1|1,0,0]=3 5788 B12R1.125 ClC(=O)COc1ccccc1C Amb10880009 [0,1,0,0,0,1|1,0,0]=3 5789 B12R1.125 ClC(=O)COc1ccccc1Cl Amb16230049 [0,1,0,0,0,1|1,0,0]=3 5790 B12R1.125 ClC(=O)COc1ccccc1F Amb10880012 [0,1,0,0,0,1|1,0,0]=3 5791 B12R1.125 ClC(=O)CSc1ccccc1C Amb17143248 [0,1,0,0,0,1|1,0,0]=3 5792 B12R1.125 ClC(=O)CSc1ccccc1Cl Amb17143819 [0,1,0,0,0,1|1,0,0]=3 5793 B12R1.125 ClC(=O)\C=C/c1ccccc1Cl Amb10070071 [0,1,0,0,0,1|1,0,1]=4 5794 B12R1.125 ClC(=O)\C=C\c1ccccc1Br Amb16230254 [0,1,0,0,0,1|1,0,1]=4 5795 B12R1.125 N=C1C=CC=CN1\C=C\C(O)=O Amb25310995 [0,1,0,0,0,1|1,0,1]=4 5796 B12R1.125 NC(=N)CCc1ccccc1Br Amb18070244 [0,1,0,0,0,1|2,0,0]=4 5797 B12R1.125 NC(=N)CCc1ccccc1Cl Amb10844871 [0,1,0,0,0,1|2,0,0]=4 5798 B12R1.125 NC(=N)CCc1ccccc1F Amb18563718 [0,1,0,0,0,1|2,0,0]=4 5799 B12R1.125 NC(=N)COc1ccccc1C Amb10610301 [0,1,0,0,0,1|2,0,0]=4 5800 B12R1.125 NC(=N)COc1ccccc1O Amb25326714 [0,1,0,0,0,1|2,0,0]=4 5801 B12R1.125 NC(=N)NCc1ccccc1F Amb18798757 [0,1,0,0,0,1|2,0,0]=4 5802 B12R1.125 NC(=N)NCc1ccccc1F Amb22828135 [0,1,0,0,0,1|2,0,0]=4 5803 B12R1.125 NC(=N)SCc1ccccc1Br Amb20676051 [0,1,0,0,0,1|2,0,0]=4 5804 B12R1.125 NC(=N)SCc1ccccc1Cl Amb20676043 [0,1,0,0,0,1|2,0,0]=4 5805 B12R1.125 NC(=N)SCc1ccccc1F Amb20675985 [0,1,0,0,0,1|2,0,0]=4 5806 B12R1.125 NC(=O)C#Cc1ccccc1O Amb25227520 [0,1,0,0,0,1|1,0,1]=4 5807 B12R1.125 NC(=O)CCc1[n]cccc1O Amb25760722 [0,1,0,0,0,1|2,0,0]=4 5808 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [0,1,0,0,0,1|1,0,0]=3 5809 B12R1.125 NC(=O)CCc1ccccc1C Amb17400134 [0,1,0,0,0,1|1,0,0]=3 5810 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [0,1,0,0,0,1|1,0,0]=3 5811 B12R1.125 NC(=O)CNc1[n]cccc1Br Amb18292757 [0,1,0,0,0,1|2,0,0]=4 5812 B12R1.125 NC(=O)CNc1[n]cccc1F Amb18300629 [0,1,0,0,0,1|2,0,0]=4 5813 B12R1.125 NC(=O)CNc1ccccc1I Amb142128 [0,1,0,0,0,1|1,0,0]=3 5814 B12R1.125 NC(=O)COC1=CC=CNC1=O Amb18034616 [0,1,0,0,0,1|2,0,0]=4 5815 B12R1.125 NC(=O)COc1ccc[n]c1Cl Amb25751255 [0,1,0,0,0,1|2,0,0]=4 5816 B12R1.125 NC(=O)COc1ccc[n]c1F Amb24427080 [0,1,0,0,0,1|2,0,0]=4 5817 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,1,0,0,0,1|1,0,0]=3 5818 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [0,1,0,0,0,1|1,0,0]=3 5819 B12R1.125 NC(=O)COc1cccnc1Br Amb11946128 [0,1,0,0,0,1|2,0,0]=4 5820 B12R1.125 NC(=O)CSc1[n]cccc1Br Amb24537837 [0,1,0,0,0,1|2,0,0]=4 5821 B12R1.125 NC(=O)CSc1ccccc1Br Amb10189178 [0,1,0,0,0,1|1,0,0]=3 5822 B12R1.125 NC(=O)CSc1ccccc1N Amb1215630 [0,1,0,0,0,1|1,0,0]=3 5823 B12R1.125 NC(=O)CSc1ccccc1O Amb19045199 [0,1,0,0,0,1|1,0,0]=3 5824 B12R1.125 NC(=O)CSc1ncccc1Cl Amb16143271 [0,1,0,0,0,1|2,0,0]=4 5825 B12R1.125 NC(=O)NCc1ccccc1Cl Amb2435051 [0,1,0,0,0,1|1,0,0]=3 5826 B12R1.125 NC(=O)NCc1ccccc1F Amb1141051 [0,1,0,0,0,1|1,0,0]=3 5827 B12R1.125 NC(=O)NNc1ccccc1Br Amb24495868 [0,1,0,0,0,1|2,0,0]=4 5828 B12R1.125 NC(=O)\C=C\c1ccccc1O Amb18645808 [0,1,0,0,0,1|1,0,1]=4 5829 B12R1.125 NC(=O)\N=N\c1ccccc1Cl Amb25322006 [0,1,0,0,0,1|2,0,0]=4 5830 B12R1.125 NC(=O)\N=N\c1ccccc1O Amb24341737 [0,1,0,0,0,1|2,0,0]=4 5831 B12R1.125 NC(=S)CCc1ccccc1F Amb17234010 [0,1,0,0,0,1|1,1,0]=4 5832 B12R1.125 NC(=S)COc1ccccc1O Amb24663202 [0,1,0,0,0,1|1,1,0]=4 5833 B12R1.125 NC(=S)NCc1ccccc1Br Amb24451272 [0,1,0,0,0,1|1,1,0]=4 5834 B12R1.125 Nc1[n]cc[n]c1SCC(O)=O Amb24467963 [0,1,0,0,0,1|2,0,0]=4 5835 B12R1.125 Nc1[n]cccc1CCC(O)=O Amb25124989 [0,1,0,0,0,1|1,0,0]=3 5836 B12R1.125 Nc1[n]cccc1NCC(N)=O Amb24563744 [0,1,0,0,0,1|2,0,0]=4 5837 B12R1.125 Nc1[n]cccc1OCC(O)=O Amb18290784 [0,1,0,0,0,1|1,0,0]=3 5838 B12R1.125 Nc1c[n]ccc1NCC(O)=O Amb18987716 [0,1,0,0,0,1|1,0,0]=3 5839 B12R1.125 Nc1c[n]ccc1SCC(O)=O Amb18291275 [0,1,0,0,0,1|1,0,0]=3 5840 B12R1.125 Nc1cc[n]cc1CCC(O)=O Amb24375593 [0,1,0,0,0,1|1,0,0]=3 5841 B12R1.125 Nc1cc[n]cc1NCC(N)=O Amb25735982 [0,1,0,0,0,1|2,0,0]=4 5842 B12R1.125 Nc1cc[n]cc1\C=C\C(O)=O Amb22044028 [0,1,0,0,0,1|1,0,1]=4 5843 B12R1.125 Nc1ccc[n]c1NCC(O)=O Amb18989766 [0,1,0,0,0,1|1,0,0]=3 5844 B12R1.125 Nc1ccc[n]c1SCC(O)=O Amb18976381 [0,1,0,0,0,1|1,0,0]=3 5845 B12R1.125 Nc1ccc[n]c1\C=C\C(O)=O Amb25725011 [0,1,0,0,0,1|1,0,1]=4 5846 B12R1.125 Nc1ccccc1/C=C/C(O)=O Amb17777291 [0,1,0,0,0,1|0,0,1]=3 5847 B12R1.125 Nc1ccccc1C#CC(O)=O Amb24355867 [0,1,0,0,0,1|0,0,1]=3 5848 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [0,1,0,0,0,1|0,0,0]=2 5849 B12R1.125 Nc1ccccc1CNC(N)=O Amb18957838 [0,1,0,0,0,1|1,0,0]=3 5850 B12R1.125 Nc1ccccc1NCC(O)=O Amb18296519 [0,1,0,0,0,1|0,0,0]=2 5851 B12R1.125 Nc1ccccc1OCC(N)=S Amb25329428 [0,1,0,0,0,1|1,1,0]=4 5852 B12R1.125 Nc1ccccc1OCC([O-])=O Amb21972214 [0,1,0,0,0,1|0,0,1]=3 5853 B12R1.125 Nc1ccccc1\C=C/C(N)=O Amb25149881 [0,1,0,0,0,1|1,0,1]=4 5854 B12R1.125 O=C(Cl)C=Cc1ccccc1F Amb24090144 [0,1,0,0,0,1|1,0,1]=4 5855 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [0,1,0,0,0,1|1,0,0]=3 5856 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [0,1,0,0,0,1|1,0,0]=3 5857 B12R1.125 O=C(Cl)OCc1ccccc1Br Amb20620406 [0,1,0,0,0,1|1,0,0]=3 5858 B12R1.125 O=C(Cl)OCc1ccccc1Cl Amb21618686 [0,1,0,0,0,1|1,0,0]=3 5859 B12R1.125 O=C(Cl)OCc1ccccc1F Amb25039104 [0,1,0,0,0,1|1,0,0]=3 5860 B12R1.125 OC(=O)C#Cc1cc[n]cc1Br Amb24739870 [0,1,0,0,0,1|1,0,1]=4 5861 B12R1.125 OC(=O)C#Cc1cc[n]cc1F Amb25781264 [0,1,0,0,0,1|1,0,1]=4 5862 B12R1.125 OC(=O)C#Cc1ccccc1Br Amb25266206 [0,1,0,0,0,1|0,0,1]=3 5863 B12R1.125 OC(=O)CCC1=CC=CNC1=O Amb18262602 [0,1,0,0,0,1|1,0,0]=3 5864 B12R1.125 OC(=O)CCC1=CN=CNC1=O Amb23248037 [0,1,0,0,0,1|2,0,0]=4 5865 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb18534261 [0,1,0,0,0,1|1,0,0]=3 5866 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb21955606 [0,1,0,0,0,1|1,0,0]=3 5867 B12R1.125 OC(=O)CCN1C=CC=NC1=O Amb18989182 [0,1,0,0,0,1|2,0,0]=4 5868 B12R1.125 OC(=O)CCN1C=CC=NC1=O Amb19372721 [0,1,0,0,0,1|2,0,0]=4 5869 B12R1.125 OC(=O)CCN1C=CN=CC1=O Amb24702797 [0,1,0,0,0,1|2,0,0]=4 5870 B12R1.125 OC(=O)CCN1N=CC=CC1=O Amb18998778 [0,1,0,0,0,1|2,0,0]=4 5871 B12R1.125 OC(=O)CCc1[n]cccc1F Amb25311377 [0,1,0,0,0,1|1,0,0]=3 5872 B12R1.125 OC(=O)CCc1c[n]c[n]c1Cl Amb18821790 [0,1,0,0,0,1|2,0,0]=4 5873 B12R1.125 OC(=O)CCc1c[n]ccc1Br Amb25253329 [0,1,0,0,0,1|1,0,0]=3 5874 B12R1.125 OC(=O)CCc1c[n]ccc1Cl Amb25270751 [0,1,0,0,0,1|1,0,0]=3 5875 B12R1.125 OC(=O)CCc1cc[n]cc1Cl Amb23596515 [0,1,0,0,0,1|1,0,0]=3 5876 B12R1.125 OC(=O)CCc1ccc[n]c1Br Amb24525068 [0,1,0,0,0,1|1,0,0]=3 5877 B12R1.125 OC(=O)CCc1ccc[n]c1Cl Amb24484270 [0,1,0,0,0,1|1,0,0]=3 5878 B12R1.125 OC(=O)CCc1ccc[n]c1F Amb25295347 [0,1,0,0,0,1|1,0,0]=3 5879 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [0,1,0,0,0,1|0,0,0]=2 5880 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [0,1,0,0,0,1|0,0,0]=2 5881 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [0,1,0,0,0,1|0,0,0]=2 5882 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [0,1,0,0,0,1|0,0,0]=2 5883 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [0,1,0,0,0,1|0,0,0]=2 5884 B12R1.125 OC(=O)CCn1ccccc1=O Amb1124605 [0,1,0,0,0,1|1,0,0]=3 5885 B12R1.125 OC(=O)CNC1=NC=CNC1=O Amb25838922 [0,1,0,0,0,1|2,0,0]=4 5886 B12R1.125 OC(=O)CNc1[n]cccc1Br Amb25295571 [0,1,0,0,0,1|1,0,0]=3 5887 B12R1.125 OC(=O)CNc1[n]cccc1F Amb25777049 [0,1,0,0,0,1|1,0,0]=3 5888 B12R1.125 OC(=O)CNc1c[n]ccc1Cl Amb22495942 [0,1,0,0,0,1|1,0,0]=3 5889 B12R1.125 OC(=O)CNc1cc[n]cc1Cl Amb25119621 [0,1,0,0,0,1|1,0,0]=3 5890 B12R1.125 OC(=O)CNc1ccc[n]c1F Amb24615818 [0,1,0,0,0,1|1,0,0]=3 5891 B12R1.125 OC(=O)CNc1ccccc1C Amb1258286 [0,1,0,0,0,1|0,0,0]=2 5892 B12R1.125 OC(=O)CNc1ccccc1S Amb25124141 [0,1,0,0,0,1|0,0,0]=2 5893 B12R1.125 OC(=O)CNc1ncccc1Cl Amb2372425 [0,1,0,0,0,1|1,0,0]=3 5894 B12R1.125 OC(=O)COC1=CNC=NC1=O Amb25053897 [0,1,0,0,0,1|2,0,0]=4 5895 B12R1.125 OC(=O)COC1=NC=CNC1=O Amb25093931 [0,1,0,0,0,1|2,0,0]=4 5896 B12R1.125 OC(=O)COc1[n]c[n]cc1I Amb25697777 [0,1,0,0,0,1|2,0,0]=4 5897 B12R1.125 OC(=O)COc1[n]cccc1Cl Amb18649694 [0,1,0,0,0,1|1,0,0]=3 5898 B12R1.125 OC(=O)COc1ccccc1C Amb1215022 [0,1,0,0,0,1|0,0,0]=2 5899 B12R1.125 OC(=O)COc1ccccc1O Amb1030005 [0,1,0,0,0,1|0,0,0]=2 5900 B12R1.125 OC(=O)CSc1[n]c[n]cc1I Amb25150142 [0,1,0,0,0,1|2,0,0]=4 5901 B12R1.125 OC(=O)CSc1[n]cccc1Br Amb18979322 [0,1,0,0,0,1|1,0,0]=3 5902 B12R1.125 OC(=O)CSc1[n]cccc1F Amb18996004 [0,1,0,0,0,1|1,0,0]=3 5903 B12R1.125 OC(=O)CSc1cc[n]cc1Cl Amb23557951 [0,1,0,0,0,1|1,0,0]=3 5904 B12R1.125 OC(=O)CSc1cccc[n+]1[O-] Amb1104911 [0,1,0,0,0,1|1,0,0]=3 5905 B12R1.125 OC(=O)CSc1ccccc1Br Amb1113386 [0,1,0,0,0,1|0,0,0]=2 5906 B12R1.125 OC(=O)CSc1ccccc1C Amb1205492 [0,1,0,0,0,1|0,0,0]=2 5907 B12R1.125 OC(=O)CSc1ccccc1Cl Amb1105912 [0,1,0,0,0,1|0,0,0]=2 5908 B12R1.125 OC(=O)CSc1ccccc1F Amb1105913 [0,1,0,0,0,1|0,0,0]=2 5909 B12R1.125 OC(=O)\C=C/c1ccccc1Cl Amb10070070 [0,1,0,0,0,1|0,0,1]=3 5910 B12R1.125 OC(=O)\C=C\C1=CC=CNC1=O Amb18263181 [0,1,0,0,0,1|1,0,1]=4 5911 B12R1.125 OC(=O)\C=C\c1cc[n]cc1Br Amb18659757 [0,1,0,0,0,1|1,0,1]=4 5912 B12R1.125 OC(=O)\C=C\c1cc[n]cc1Cl Amb23590832 [0,1,0,0,0,1|1,0,1]=4 5913 B12R1.125 OC(=O)\C=C\c1cccc[n+]1[O-] Amb10552947 [0,1,0,0,0,1|1,0,1]=4 5914 B12R1.125 OC(=O)\C=C\c1ccccc1I Amb22584152 [0,1,0,0,0,1|0,0,1]=3 5915 B12R1.125 OC(=O)\C=C\c1ccccc1O Amb1935207 [0,1,0,0,0,1|0,0,1]=3 5916 B12R1.125 OC(=O)\C=C\c1ccccc1S Amb18128711 [0,1,0,0,0,1|0,0,1]=3 5917 B12R1.125 Oc1cc[n]cc1\C=C\C(O)=O Amb18646198 [0,1,0,0,0,1|1,0,1]=4 5918 B12R1.125 Oc1ccc[n]c1NCC(O)=O Amb18114848 [0,1,0,0,0,1|1,0,0]=3 5919 B12R1.125 Oc1ccc[n]c1SCC(O)=O Amb25798926 [0,1,0,0,0,1|1,0,0]=3 5920 B12R1.125 Oc1ccccc1CCC(=O)Cl Amb25808033 [0,1,0,0,0,1|1,0,0]=3 5921 B12R1.125 Oc1ccccc1SCC(O)=O Amb18294823 [0,1,0,0,0,1|0,0,0]=2 5922 B12R1.125 SC(=S)NCc1ccccc1Cl Amb25218272 [0,1,0,0,0,1|0,2,0]=4 5923 B12R1.125 [O-]C(=O)COc1ccccc1O Amb10789357 [0,1,0,0,0,1|0,0,1]=3 5924 B12R1.125 [O-][N+](=O)CCc1ccccc1C Amb17400176 [0,1,0,0,0,1|1,0,1]=4 5925 B12R1.125 [O-][N+](=O)CCc1ccccc1Cl Amb17401072 [0,1,0,0,0,1|1,0,1]=4 5926 B12R1.125 [O-][N+](=O)CCc1ccccc1F Amb17400297 [0,1,0,0,0,1|1,0,1]=4 5927 B12R1.125 [O-][N+](=O)CSc1ccccc1Cl Amb25675435 [0,1,0,0,0,1|1,0,1]=4 5928 B12R1.125 [O-][N+](=O)CSc1ccccc1F Amb24734615 [0,1,0,0,0,1|1,0,1]=4 5929 B12R1.125 [O-][n+]1ccccc1NCC(O)=O Amb24560168 [0,1,0,0,0,1|1,0,0]=3 5930 B12R1.226 Brc1cccc(c1)CNC(=N)[NH3+] Amb10071510 [0,1,0,0,0,1|2,0,0]=4 5931 B12R1.226 C=C(Br)CNc1cc(Br)ccc1 Amb25148623 [0,1,0,0,0,1|2,0,0]=4 5932 B12R1.226 C=C(Br)CNc1cccc(I)c1 Amb25682772 [0,1,0,0,0,1|2,0,0]=4 5933 B12R1.226 C=C(Br)COc1cccc(I)c1 Amb24456153 [0,1,0,0,0,1|2,0,0]=4 5934 B12R1.226 C=C(Br)COc1cccc(N)c1 Amb18971516 [0,1,0,0,0,1|2,0,0]=4 5935 B12R1.226 C=C(Br)CSc1cc(Br)ccc1 Amb25201938 [0,1,0,0,0,1|2,0,0]=4 5936 B12R1.226 C=C(Br)CSc1cccc(F)c1 Amb24381201 [0,1,0,0,0,1|2,0,0]=4 5937 B12R1.226 C=C(Br)CSc1cccc(N)c1 Amb25857187 [0,1,0,0,0,1|2,0,0]=4 5938 B12R1.226 C=C(Br)CSc1cccc(O)c1 Amb25302972 [0,1,0,0,0,1|2,0,0]=4 5939 B12R1.226 C=C(Cl)CNc1cccc(F)c1 Amb18969176 [0,1,0,0,0,1|2,0,0]=4 5940 B12R1.226 C=C(Cl)CNc1cccc(I)c1 Amb24644381 [0,1,0,0,0,1|2,0,0]=4 5941 B12R1.226 C=C(Cl)CNc1cccc(N)c1 Amb24469744 [0,1,0,0,0,1|2,0,0]=4 5942 B12R1.226 C=C(Cl)COc1cc(Cl)ccc1 Amb24484274 [0,1,0,0,0,1|2,0,0]=4 5943 B12R1.226 C=C(Cl)COc1cccc(F)c1 Amb25340679 [0,1,0,0,0,1|2,0,0]=4 5944 B12R1.226 C=C(Cl)COc1cccc(N)c1 Amb18290028 [0,1,0,0,0,1|2,0,0]=4 5945 B12R1.226 C=C(Cl)CSc1cc(Cl)ccc1 Amb24343789 [0,1,0,0,0,1|2,0,0]=4 5946 B12R1.226 C=C(Cl)CSc1cccc(N)c1 Amb25678297 [0,1,0,0,0,1|2,0,0]=4 5947 B12R1.226 C=C(Cl)CSc1cccc(O)c1 Amb25852349 [0,1,0,0,0,1|2,0,0]=4 5948 B12R1.226 C=C(F)COc1cccc(Br)c1 Amb23570548 [0,1,0,0,0,1|2,0,0]=4 5949 B12R1.226 CC(=C)CNc1cccc(N)c1 Amb24390135 [0,1,0,0,0,1|2,0,0]=4 5950 B12R1.226 CC(=C)CNc1cccc(c1)Br Amb17306224 [0,1,0,0,0,1|2,0,0]=4 5951 B12R1.226 CC(=C)CNc1cccc(c1)C Amb17306564 [0,1,0,0,0,1|2,0,0]=4 5952 B12R1.226 CC(=C)CNc1cccc(c1)Cl Amb17307143 [0,1,0,0,0,1|2,0,0]=4 5953 B12R1.226 CC(=C)CNc1cccc(c1)F Amb17306245 [0,1,0,0,0,1|2,0,0]=4 5954 B12R1.226 CC(=C)COc1cccc(Cl)c1 Amb24409848 [0,1,0,0,0,1|2,0,0]=4 5955 B12R1.226 CC(=C)COc1cccc(I)c1 Amb24582646 [0,1,0,0,0,1|2,0,0]=4 5956 B12R1.226 CC(=C)COc1cccc(c1)N Amb2081546 [0,1,0,0,0,1|2,0,0]=4 5957 B12R1.226 CC(=C)CSc1cccc(Cl)c1 Amb24355077 [0,1,0,0,0,1|2,0,0]=4 5958 B12R1.226 CC(=N)NCc1cccc(Cl)c1 Amb24632269 [0,1,0,0,0,1|2,0,0]=4 5959 B12R1.226 CC(=N)NCc1cccc(F)c1 Amb25799323 [0,1,0,0,0,1|2,0,0]=4 5960 B12R1.226 CC(=O)C=Cc1cccc(O)c1 Amb24094413 [0,1,0,0,0,1|1,0,1]=4 5961 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl Amb10808067 [0,1,0,0,0,1|1,0,1]=4 5962 B12R1.226 CC(=O)CCc1c[n]cc(F)c1 Amb25034788 [0,1,0,0,0,1|2,0,0]=4 5963 B12R1.226 CC(=O)CCc1cccc(O)[n]1 Amb24605336 [0,1,0,0,0,1|2,0,0]=4 5964 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [0,1,0,0,0,1|1,0,0]=3 5965 B12R1.226 CC(=O)CNc1cccc(Cl)c1 Amb24626052 [0,1,0,0,0,1|1,0,0]=3 5966 B12R1.226 CC(=O)COC1=CC(=O)NC=C1 Amb25734509 [0,1,0,0,0,1|2,0,0]=4 5967 B12R1.226 CC(=O)COc1c[n]cc(Br)c1 Amb24386347 [0,1,0,0,0,1|2,0,0]=4 5968 B12R1.226 CC(=O)COc1c[n]cc(Cl)c1 Amb25152535 [0,1,0,0,0,1|2,0,0]=4 5969 B12R1.226 CC(=O)COc1cccc(Cl)c1 Amb19075144 [0,1,0,0,0,1|1,0,0]=3 5970 B12R1.226 CC(=O)COc1cccc(O)c1 Amb25053053 [0,1,0,0,0,1|1,0,0]=3 5971 B12R1.226 CC(=O)COc1cccc(c1)Br Amb17226706 [0,1,0,0,0,1|1,0,0]=3 5972 B12R1.226 CC(=O)COc1cccc(c1)N Amb17110084 [0,1,0,0,0,1|1,0,0]=3 5973 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [0,1,0,0,0,1|1,0,0]=3 5974 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [0,1,0,0,0,1|1,0,0]=3 5975 B12R1.226 CC(=O)NCC1=CC(=O)NC=C1 Amb25227214 [0,1,0,0,0,1|2,0,0]=4 5976 B12R1.226 CC(=O)NCC1=CC=CC(=O)N1 Amb25256952 [0,1,0,0,0,1|2,0,0]=4 5977 B12R1.226 CC(=O)NCc1c[n]cc(Br)c1 Amb22276859 [0,1,0,0,0,1|2,0,0]=4 5978 B12R1.226 CC(=O)NCc1cc[n]c(Cl)c1 Amb24072881 [0,1,0,0,0,1|2,0,0]=4 5979 B12R1.226 CC(=O)NCc1cccc(Cl)[n]1 Amb25734187 [0,1,0,0,0,1|2,0,0]=4 5980 B12R1.226 CC(=O)NCc1cccc(I)c1 Amb25148829 [0,1,0,0,0,1|1,0,0]=3 5981 B12R1.226 CC(=O)NCc1cccc(N)c1 Amb18286659 [0,1,0,0,0,1|1,0,0]=3 5982 B12R1.226 CC(=O)NCc1cccc(O)c1 Amb18792630 [0,1,0,0,0,1|1,0,0]=3 5983 B12R1.226 CC(=O)NCc1cccc(c1)Br Amb2085743 [0,1,0,0,0,1|1,0,0]=3 5984 B12R1.226 CC(=O)NCc1cccc(c1)Cl Amb2023612 [0,1,0,0,0,1|1,0,0]=3 5985 B12R1.226 CC(=O)NCc1cccc(n1)N Amb13890642 [0,1,0,0,0,1|2,0,0]=4 5986 B12R1.226 CC(=O)NNc1cc(F)ccc1 Amb25036298 [0,1,0,0,0,1|2,0,0]=4 5987 B12R1.226 CC(=O)OCc1c[n](=O)ccc1 Amb20247038 [0,1,0,0,0,1|2,0,0]=4 5988 B12R1.226 CC(=O)OCc1cc(Br)ccn1 Amb10603159 [0,1,0,0,0,1|2,0,0]=4 5989 B12R1.226 CC(=O)OCc1cc(I)cc[n]1 Amb24063673 [0,1,0,0,0,1|2,0,0]=4 5990 B12R1.226 CC(=O)OCc1cccc(Br)c1 Amb25099120 [0,1,0,0,0,1|1,0,0]=3 5991 B12R1.226 CC(=O)OCc1cccc(Cl)[n]1 Amb25710369 [0,1,0,0,0,1|2,0,0]=4 5992 B12R1.226 CC(=O)OCc1cccc(Cl)c1 Amb25306228 [0,1,0,0,0,1|1,0,0]=3 5993 B12R1.226 CC(=O)OCc1cccc(F)c1 Amb25145061 [0,1,0,0,0,1|1,0,0]=3 5994 B12R1.226 CC(=O)OCc1cccc(N)c1 Amb22229178 [0,1,0,0,0,1|1,0,0]=3 5995 B12R1.226 CC(=O)OCc1cccc(c1)C Amb10601899 [0,1,0,0,0,1|1,0,0]=3 5996 B12R1.226 CC(=O)OCc1cccc(n1)C Amb10573711 [0,1,0,0,0,1|2,0,0]=4 5997 B12R1.226 CC(=O)SCc1cc[n]c(N)c1 Amb25793643 [0,1,0,0,0,1|2,0,0]=4 5998 B12R1.226 CC(=O)SCc1cccc(Cl)c1 Amb22231632 [0,1,0,0,0,1|1,0,0]=3 5999 B12R1.226 CC(=O)SCc1cccc(F)c1 Amb22231633 [0,1,0,0,0,1|1,0,0]=3 6000 B12R1.226 CC(=O)\C=C\c1cccc(F)c1 Amb18563600 [0,1,0,0,0,1|1,0,1]=4 6001 B12R1.226 CC(=O)\C=C\c1cccc(N)c1 Amb23247751 [0,1,0,0,0,1|1,0,1]=4 6002 B12R1.226 CC(=O)\C=C\c1cccc(c1)Br Amb10601440 [0,1,0,0,0,1|1,0,1]=4 6003 B12R1.226 CC(=O)\C=C\c1cccc(c1)C Amb17477497 [0,1,0,0,0,1|1,0,1]=4 6004 B12R1.226 CC(=O)\C=C\c1cccc(c1)O Amb17615740 [0,1,0,0,0,1|1,0,1]=4 6005 B12R1.226 CC(C)=CCc1cccc(O)c1 Amb24341888 [0,1,0,0,0,1|2,0,0]=4 6006 B12R1.226 CC(CCc1cccc(c1)C)O Amb17507253 [0,1,0,0,0,1|1,0,1]=4 6007 B12R1.226 CC(CNc1cccc(c1)Br)O Amb17142611 [0,1,0,0,0,1|1,0,1]=4 6008 B12R1.226 CC(CNc1cccc(c1)C)O Amb17138593 [0,1,0,0,0,1|1,0,1]=4 6009 B12R1.226 CC(CNc1cccc(c1)Cl)O Amb17139126 [0,1,0,0,0,1|1,0,1]=4 6010 B12R1.226 CC(CNc1cccc(c1)F)O Amb17138652 [0,1,0,0,0,1|1,0,1]=4 6011 B12R1.226 CC(O)CCc1cc(O)ccc1 Amb25251886 [0,1,0,0,0,1|1,0,1]=4 6012 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [0,1,0,0,0,1|1,0,1]=4 6013 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [0,1,0,0,0,1|1,0,1]=4 6014 B12R1.226 CC(O)CNc1cccc(I)c1 Amb24463052 [0,1,0,0,0,1|1,0,1]=4 6015 B12R1.226 CC(O)COc1cccc(F)c1 Amb18806456 [0,1,0,0,0,1|1,0,1]=4 6016 B12R1.226 CC(O)COc1cccc(I)c1 Amb24535405 [0,1,0,0,0,1|1,0,1]=4 6017 B12R1.226 CC(O)COc1cccc(N)c1 Amb18290032 [0,1,0,0,0,1|1,0,1]=4 6018 B12R1.226 CC(O)CSc1cc(O)ccc1 Amb24356234 [0,1,0,0,0,1|1,0,1]=4 6019 B12R1.226 CC(O)CSc1cccc(F)c1 Amb25698440 [0,1,0,0,0,1|1,0,1]=4 6020 B12R1.226 CS(=O)NCc1cccc(O)c1 Amb24582944 [0,1,0,0,0,1|2,0,0]=4 6021 B12R1.226 C[C@H](O)CNc1cccc(Br)c1 Amb25373826 [0,1,0,0,0,1|1,0,1]=4 6022 B12R1.226 C[C@H](O)CNc1cccc(F)c1 Amb24708973 [0,1,0,0,0,1|1,0,1]=4 6023 B12R1.226 C[C@H](O)CNc1cccc(I)c1 Amb25717242 [0,1,0,0,0,1|1,0,1]=4 6024 B12R1.226 C[C@H](O)COc1cccc(Cl)c1 Amb25037433 [0,1,0,0,0,1|1,0,1]=4 6025 B12R1.226 C[C@H](O)COc1cccc(F)c1 Amb24637453 [0,1,0,0,0,1|1,0,1]=4 6026 B12R1.226 Cc1[n]c(CCC(O)=O)cc[n]1 Amb24342069 [0,1,0,0,0,1|2,0,0]=4 6027 B12R1.226 Cc1[n]c(cc[n]1)NCC(O)=O Amb18997316 [0,1,0,0,0,1|2,0,0]=4 6028 B12R1.226 Cc1[n]c(cc[n]1)OCC(O)=O Amb25106840 [0,1,0,0,0,1|2,0,0]=4 6029 B12R1.226 Cc1[n]c(cc[n]1)SCC(O)=O Amb18997323 [0,1,0,0,0,1|2,0,0]=4 6030 B12R1.226 Cc1c[n]cc(CCC(O)=O)[n]1 Amb18827855 [0,1,0,0,0,1|2,0,0]=4 6031 B12R1.226 Cc1c[n]cc(COC(C)=O)c1 Amb24448150 [0,1,0,0,0,1|2,0,0]=4 6032 B12R1.226 Cc1cc(C=CC(O)=O)c[n]c1 Amb20668532 [0,1,0,0,0,1|1,0,1]=4 6033 B12R1.226 Cc1cc(CCB(O)O)ccc1 Amb25790748 [0,1,0,0,0,1|1,0,1]=4 6034 B12R1.226 Cc1cc(CCC(=O)Cl)ccc1 Amb18325287 [0,1,0,0,0,1|1,0,0]=3 6035 B12R1.226 Cc1cc(CCC(C)=O)cc[n]1 Amb24677051 [0,1,0,0,0,1|2,0,0]=4 6036 B12R1.226 Cc1cc(CCC(N)=N)ccc1 Amb18065465 [0,1,0,0,0,1|2,0,0]=4 6037 B12R1.226 Cc1cc(CCC(N)=O)[n]cc1 Amb25858570 [0,1,0,0,0,1|2,0,0]=4 6038 B12R1.226 Cc1cc(CCC(O)=O)[n]c[n]1 Amb18827877 [0,1,0,0,0,1|2,0,0]=4 6039 B12R1.226 Cc1cc(CCC(O)=O)[n]cc1 Amb18828439 [0,1,0,0,0,1|1,0,0]=3 6040 B12R1.226 Cc1cc(CCC(O)=O)c[n]c1 Amb22886573 [0,1,0,0,0,1|1,0,0]=3 6041 B12R1.226 Cc1cc(CCC(O)=O)cc[n]1 Amb22886572 [0,1,0,0,0,1|1,0,0]=3 6042 B12R1.226 Cc1cc(CNC(N)=N)ccc1 Amb18798205 [0,1,0,0,0,1|2,0,0]=4 6043 B12R1.226 Cc1cc(CNC(N)=O)ccc1 Amb18798292 [0,1,0,0,0,1|1,0,0]=3 6044 B12R1.226 Cc1cc(CNC(N)=S)ccc1 Amb18796347 [0,1,0,0,0,1|1,1,0]=4 6045 B12R1.226 Cc1cc(COC(C)=O)cc[n]1 Amb24487151 [0,1,0,0,0,1|2,0,0]=4 6046 B12R1.226 Cc1cc(CSC(N)=N)ccc1 Amb20676045 [0,1,0,0,0,1|2,0,0]=4 6047 B12R1.226 Cc1cc(CSC(N)=S)ccc1 Amb25113498 [0,1,0,0,0,1|1,1,0]=4 6048 B12R1.226 Cc1cc(NCC(=O)O)ncc1 Amb10597602 [0,1,0,0,0,1|1,0,0]=3 6049 B12R1.226 Cc1cc(NCC(N)=O)[n]cc1 Amb18981408 [0,1,0,0,0,1|2,0,0]=4 6050 B12R1.226 Cc1cc([n][n]c1)SCC(O)=O Amb25036242 [0,1,0,0,0,1|2,0,0]=4 6051 B12R1.226 Cc1cc([n]c[n]1)OCC(O)=O Amb18826751 [0,1,0,0,0,1|2,0,0]=4 6052 B12R1.226 Cc1cc([n]cc1)OCC(O)=O Amb25154209 [0,1,0,0,0,1|1,0,0]=3 6053 B12R1.226 Cc1cc([n]cc1)SCC(O)=O Amb18982392 [0,1,0,0,0,1|1,0,0]=3 6054 B12R1.226 Cc1cc(\C=C\C(O)=O)[n]cc1 Amb23592143 [0,1,0,0,0,1|1,0,1]=4 6055 B12R1.226 Cc1cc(\C=C\C(O)=O)c[n]c1 Amb22059615 [0,1,0,0,0,1|1,0,1]=4 6056 B12R1.226 Cc1cc(\C=C\C(O)=O)cc[n]1 Amb23535924 [0,1,0,0,0,1|1,0,1]=4 6057 B12R1.226 Cc1cc(cc[n]1)NCC(N)=O Amb25760314 [0,1,0,0,0,1|2,0,0]=4 6058 B12R1.226 Cc1cc(cc[n]1)NCC(O)=O Amb25733691 [0,1,0,0,0,1|1,0,0]=3 6059 B12R1.226 Cc1cc(cc[n]1)OCC(N)=O Amb25712042 [0,1,0,0,0,1|2,0,0]=4 6060 B12R1.226 Cc1cc(cc[n]1)OCC(O)=O Amb24450470 [0,1,0,0,0,1|1,0,0]=3 6061 B12R1.226 Cc1cc(ccc1)C#CC(O)=O Amb20673071 [0,1,0,0,0,1|0,0,1]=3 6062 B12R1.226 Cc1cc(ccc1)NCC(=C)Br Amb25122351 [0,1,0,0,0,1|2,0,0]=4 6063 B12R1.226 Cc1cc(ccc1)NCC(=C)Cl Amb18809685 [0,1,0,0,0,1|2,0,0]=4 6064 B12R1.226 Cc1cc(ccc1)NNC(N)=O Amb25061369 [0,1,0,0,0,1|2,0,0]=4 6065 B12R1.226 Cc1cc(ccc1)OCC(=C)Br Amb25840777 [0,1,0,0,0,1|2,0,0]=4 6066 B12R1.226 Cc1cc(ccc1)OCC(=C)Cl Amb25281377 [0,1,0,0,0,1|2,0,0]=4 6067 B12R1.226 Cc1cc(ccc1)OCC(O)O Amb24618797 [0,1,0,0,0,1|0,0,2]=4 6068 B12R1.226 Cc1cc(ccc1)SCC(=C)Br Amb25276089 [0,1,0,0,0,1|2,0,0]=4 6069 B12R1.226 Cc1cc(ccc1)SCC(=C)Cl Amb25160448 [0,1,0,0,0,1|2,0,0]=4 6070 B12R1.226 Cc1cc(ccc1)SCC(N)=N Amb18791179 [0,1,0,0,0,1|2,0,0]=4 6071 B12R1.226 Cc1cc(ccc1)SCC(N)=S Amb25123592 [0,1,0,0,0,1|1,1,0]=4 6072 B12R1.226 Cc1cc[n]c(CCC(O)=O)[n]1 Amb18862660 [0,1,0,0,0,1|2,0,0]=4 6073 B12R1.226 Cc1cc[n]c(COC(C)=O)c1 Amb22490556 [0,1,0,0,0,1|2,0,0]=4 6074 B12R1.226 Cc1cc[n]c(NCC(O)=O)[n]1 Amb19000702 [0,1,0,0,0,1|2,0,0]=4 6075 B12R1.226 Cc1cc[n]c([n]1)OCC(O)=O Amb23585881 [0,1,0,0,0,1|2,0,0]=4 6076 B12R1.226 Cc1cccc(C#CC(O)=O)[n]1 Amb25856502 [0,1,0,0,0,1|1,0,1]=4 6077 B12R1.226 Cc1cccc(CNC(N)=O)[n]1 Amb18792644 [0,1,0,0,0,1|2,0,0]=4 6078 B12R1.226 Cc1cccc(CSC(C)=O)[n]1 Amb25128176 [0,1,0,0,0,1|2,0,0]=4 6079 B12R1.226 Cc1cccc(NCC(N)=O)[n]1 Amb18289371 [0,1,0,0,0,1|2,0,0]=4 6080 B12R1.226 Cc1cccc([n]1)OCC(N)=O Amb25234638 [0,1,0,0,0,1|2,0,0]=4 6081 B12R1.226 Cc1cccc([n]1)OCC(O)=O Amb24389213 [0,1,0,0,0,1|1,0,0]=3 6082 B12R1.226 Cc1cccc(c1)NCC(C)=O Amb25831083 [0,1,0,0,0,1|1,0,0]=3 6083 B12R1.226 Cc1cccc(c1)OCC(C)O Amb18182641 [0,1,0,0,0,1|1,0,1]=4 6084 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O Amb25123169 [0,1,0,0,0,1|1,0,1]=4 6085 B12R1.226 Cc1cccc(c1)OC[C@H](C)O Amb25270564 [0,1,0,0,0,1|1,0,1]=4 6086 B12R1.226 Cc1cccc(c1)SCC(C)=O Amb18791171 [0,1,0,0,0,1|1,0,0]=3 6087 B12R1.226 Cc1cccc(c1)SCC(C)O Amb18318405 [0,1,0,0,0,1|1,0,1]=4 6088 B12R1.226 Cc1cccc(n1)\C=C\C(=O)O Amb10669513 [0,1,0,0,0,1|1,0,1]=4 6089 B12R1.226 ClC(=O)COc1cccc(c1)Br Amb16230149 [0,1,0,0,0,1|1,0,0]=3 6090 B12R1.226 ClC(=O)COc1cccc(c1)C Amb10880010 [0,1,0,0,0,1|1,0,0]=3 6091 B12R1.226 ClC(=O)CSc1cccc(c1)C Amb17143249 [0,1,0,0,0,1|1,0,0]=3 6092 B12R1.226 ClC(=O)CSc1cccc(c1)Cl Amb17143820 [0,1,0,0,0,1|1,0,0]=3 6093 B12R1.226 ClC(=O)\C=C\c1cccc(c1)Br Amb17145216 [0,1,0,0,0,1|1,0,1]=4 6094 B12R1.226 ClC(=O)\C=C\c1cccc(c1)Cl Amb16230245 [0,1,0,0,0,1|1,0,1]=4 6095 B12R1.226 Clc1cccc(c1)CSC(=[NH2+])N Amb2407332 [0,1,0,0,0,1|2,0,0]=4 6096 B12R1.226 NC(=N)CCc1cccc(Br)c1 Amb18571443 [0,1,0,0,0,1|2,0,0]=4 6097 B12R1.226 NC(=N)CCc1cccc(Cl)c1 Amb18564230 [0,1,0,0,0,1|2,0,0]=4 6098 B12R1.226 NC(=N)CCc1cccc(F)c1 Amb18563720 [0,1,0,0,0,1|2,0,0]=4 6099 B12R1.226 NC(=N)CSc1cccc(Br)c1 Amb25773659 [0,1,0,0,0,1|2,0,0]=4 6100 B12R1.226 NC(=N)CSc1cccc(Cl)c1 Amb18331359 [0,1,0,0,0,1|2,0,0]=4 6101 B12R1.226 NC(=N)NCc1cc(I)ccc1 Amb19883917 [0,1,0,0,0,1|2,0,0]=4 6102 B12R1.226 NC(=N)NCc1cccc(Br)c1 Amb19887565 [0,1,0,0,0,1|2,0,0]=4 6103 B12R1.226 NC(=N)NCc1cccc(Br)c1 Amb24488682 [0,1,0,0,0,1|2,0,0]=4 6104 B12R1.226 NC(=N)NCc1cccc(Cl)c1 Amb19068643 [0,1,0,0,0,1|2,0,0]=4 6105 B12R1.226 NC(=N)NCc1cccc(F)c1 Amb18798758 [0,1,0,0,0,1|2,0,0]=4 6106 B12R1.226 NC(=N)NCc1cccc(I)c1 Amb21855943 [0,1,0,0,0,1|2,0,0]=4 6107 B12R1.226 NC(=N)NCc1cccc(O)c1 Amb25176040 [0,1,0,0,0,1|2,0,0]=4 6108 B12R1.226 NC(=N)SCc1cccc(Br)c1 Amb20676039 [0,1,0,0,0,1|2,0,0]=4 6109 B12R1.226 NC(=N)SCc1cccc(Cl)c1 Amb20676057 [0,1,0,0,0,1|2,0,0]=4 6110 B12R1.226 NC(=N)SCc1cccc(F)c1 Amb20676031 [0,1,0,0,0,1|2,0,0]=4 6111 B12R1.226 NC(=N)SCc1cccc(c1)Cl Amb11227411 [0,1,0,0,0,1|2,0,0]=4 6112 B12R1.226 NC(=N)SCc1cccc(c1)F Amb13960324 [0,1,0,0,0,1|2,0,0]=4 6113 B12R1.226 NC(=N)[Se]Cc1cccc(Br)c1 Amb22330411 [0,1,0,0,0,1|2,0,0]=4 6114 B12R1.226 NC(=N)[Se]Cc1cccc(Br)c1 Amb24113414 [0,1,0,0,0,1|2,0,0]=4 6115 B12R1.226 NC(=O)CCc1c[n]cc(F)c1 Amb25821158 [0,1,0,0,0,1|2,0,0]=4 6116 B12R1.226 NC(=O)CCc1c[n]cc(O)c1 Amb25833308 [0,1,0,0,0,1|2,0,0]=4 6117 B12R1.226 NC(=O)CCc1cc(Br)cc[n]1 Amb24671371 [0,1,0,0,0,1|2,0,0]=4 6118 B12R1.226 NC(=O)CCc1cc(Cl)cc[n]1 Amb25046525 [0,1,0,0,0,1|2,0,0]=4 6119 B12R1.226 NC(=O)CCc1cccc(c1)C Amb17400135 [0,1,0,0,0,1|1,0,0]=3 6120 B12R1.226 NC(=O)CCc1cccc(c1)Cl Amb17400995 [0,1,0,0,0,1|1,0,0]=3 6121 B12R1.226 NC(=O)CNc1cc(Br)cc[n]1 Amb24518708 [0,1,0,0,0,1|2,0,0]=4 6122 B12R1.226 NC(=O)CNc1cc(I)ccn1 Amb10603477 [0,1,0,0,0,1|2,0,0]=4 6123 B12R1.226 NC(=O)CNc1cc[n]c(F)c1 Amb24342140 [0,1,0,0,0,1|2,0,0]=4 6124 B12R1.226 NC(=O)CNc1cccc(F)[n]1 Amb18973411 [0,1,0,0,0,1|2,0,0]=4 6125 B12R1.226 NC(=O)CNc1cccc(c1)Br Amb143565 [0,1,0,0,0,1|1,0,0]=3 6126 B12R1.226 NC(=O)COc1cccc(c1)Br Amb192032 [0,1,0,0,0,1|1,0,0]=3 6127 B12R1.226 NC(=O)COc1cccc(c1)I Amb181273 [0,1,0,0,0,1|1,0,0]=3 6128 B12R1.226 NC(=O)COc1cccc(c1)N Amb1112358 [0,1,0,0,0,1|1,0,0]=3 6129 B12R1.226 NC(=O)CSc1cc[n]c(Cl)c1 Amb24428360 [0,1,0,0,0,1|2,0,0]=4 6130 B12R1.226 NC(=O)CSc1cccc(Br)c1 Amb25726747 [0,1,0,0,0,1|1,0,0]=3 6131 B12R1.226 NC(=O)CSc1cccc(Cl)[n]1 Amb24461943 [0,1,0,0,0,1|2,0,0]=4 6132 B12R1.226 NC(=O)CSc1cccc(F)[n]1 Amb25792545 [0,1,0,0,0,1|2,0,0]=4 6133 B12R1.226 NC(=O)CSc1cccc(F)c1 Amb25784013 [0,1,0,0,0,1|1,0,0]=3 6134 B12R1.226 NC(=O)CSc1cccc(O)c1 Amb25102367 [0,1,0,0,0,1|1,0,0]=3 6135 B12R1.226 NC(=O)CSc1cccc(c1)C Amb17142988 [0,1,0,0,0,1|1,0,0]=3 6136 B12R1.226 NC(=O)CSc1cccc(c1)Cl Amb17143258 [0,1,0,0,0,1|1,0,0]=3 6137 B12R1.226 NC(=O)NCc1cc(Cl)cc[n]1 Amb24645032 [0,1,0,0,0,1|2,0,0]=4 6138 B12R1.226 NC(=O)NCc1cccc(Cl)[n]1 Amb25042538 [0,1,0,0,0,1|2,0,0]=4 6139 B12R1.226 NC(=O)NCc1cccc(O)c1 Amb18792735 [0,1,0,0,0,1|1,0,0]=3 6140 B12R1.226 NC(=O)NCc1cccc(c1)Cl Amb2440664 [0,1,0,0,0,1|1,0,0]=3 6141 B12R1.226 NC(=O)\C=C/c1cccc(Cl)c1 Amb24484173 [0,1,0,0,0,1|1,0,1]=4 6142 B12R1.226 NC(=O)\C=C/c1cccc(O)c1 Amb24744387 [0,1,0,0,0,1|1,0,1]=4 6143 B12R1.226 NC(=O)\C=C\c1cccc(I)c1 Amb25338405 [0,1,0,0,0,1|1,0,1]=4 6144 B12R1.226 NC(=O)\N=N\c1cc(F)ccc1 Amb24390323 [0,1,0,0,0,1|2,0,0]=4 6145 B12R1.226 NC(=S)COc1cccc(c1)[*] Amb22043508 [0,1,0,0,0,1|1,1,0]=4 6146 B12R1.226 NC(=S)CSc1cccc(F)c1 Amb24623139 [0,1,0,0,0,1|1,1,0]=4 6147 B12R1.226 NC(=S)NCc1cccc(Br)c1 Amb24720945 [0,1,0,0,0,1|1,1,0]=4 6148 B12R1.226 NC(=S)NCc1cccc(Cl)c1 Amb18333166 [0,1,0,0,0,1|1,1,0]=4 6149 B12R1.226 Nc1[n]c(CCC(O)=O)cc[n]1 Amb18827317 [0,1,0,0,0,1|2,0,0]=4 6150 B12R1.226 Nc1cc(CCC(O)=O)c[n]c1 Amb25760281 [0,1,0,0,0,1|1,0,0]=3 6151 B12R1.226 Nc1cc(CCC(O)=O)cc[n]1 Amb24105413 [0,1,0,0,0,1|1,0,0]=3 6152 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22408735 [0,1,0,0,0,1|0,0,1]=3 6153 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22757721 [0,1,0,0,0,1|0,0,1]=3 6154 B12R1.226 Nc1cc(NCC(O)=O)[n]cc1 Amb18295951 [0,1,0,0,0,1|1,0,0]=3 6155 B12R1.226 Nc1cc([n]c[n]1)SCC(O)=O Amb23247641 [0,1,0,0,0,1|2,0,0]=4 6156 B12R1.226 Nc1cc(\C=C\C(O)=O)cc[n]1 Amb25201755 [0,1,0,0,0,1|1,0,1]=4 6157 B12R1.226 Nc1cc(cc[n]1)SCC(N)=O Amb24419103 [0,1,0,0,0,1|2,0,0]=4 6158 B12R1.226 Nc1cc(ccc1)C#CC(O)=O Amb24650985 [0,1,0,0,0,1|0,0,1]=3 6159 B12R1.226 Nc1cc(ccc1)NCC(O)=O Amb18987711 [0,1,0,0,0,1|0,0,0]=2 6160 B12R1.226 Nc1cc(ccc1)SCC(O)=O Amb25700944 [0,1,0,0,0,1|0,0,0]=2 6161 B12R1.226 Nc1cc[n]c(CCC(O)=O)[n]1 Amb18827285 [0,1,0,0,0,1|2,0,0]=4 6162 B12R1.226 Nc1cc[n]c(c1)NCC(N)=O Amb18981462 [0,1,0,0,0,1|2,0,0]=4 6163 B12R1.226 Nc1cccc(CNC(N)=O)c1 Amb18962222 [0,1,0,0,0,1|1,0,0]=3 6164 B12R1.226 Nc1cccc(CNC(N)=S)c1 Amb25784758 [0,1,0,0,0,1|1,1,0]=4 6165 B12R1.226 Nc1cccc(\C=C\C(O)=O)[n]1 Amb24558794 [0,1,0,0,0,1|1,0,1]=4 6166 B12R1.226 Nc1cccc(c1)OCC(N)=S Amb24439144 [0,1,0,0,0,1|1,1,0]=4 6167 B12R1.226 Nc1cccc(c1)\C=C\C(N)=O Amb24626095 [0,1,0,0,0,1|1,0,1]=4 6168 B12R1.226 O=C(Cl)CCc1cc(Cl)ccc1 Amb24403345 [0,1,0,0,0,1|1,0,0]=3 6169 B12R1.226 O=C(Cl)CCc1cccc(Br)c1 Amb25150110 [0,1,0,0,0,1|1,0,0]=3 6170 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [0,1,0,0,0,1|1,0,0]=3 6171 B12R1.226 O=C(Cl)OCc1cccc(Br)c1 Amb24649567 [0,1,0,0,0,1|1,0,0]=3 6172 B12R1.226 OB(O)CCc1cccc(F)c1 Amb24392487 [0,1,0,0,0,1|1,0,1]=4 6173 B12R1.226 OC(=O)C#CC1=CC(=O)NC=C1 Amb24394080 [0,1,0,0,0,1|1,0,1]=4 6174 B12R1.226 OC(=O)C#Cc1c[n]cc(Br)c1 Amb24685676 [0,1,0,0,0,1|1,0,1]=4 6175 B12R1.226 OC(=O)C#Cc1c[n]cc(Cl)c1 Amb25097283 [0,1,0,0,0,1|1,0,1]=4 6176 B12R1.226 OC(=O)C#Cc1cc(Br)ccc1 Amb23504362 [0,1,0,0,0,1|0,0,1]=3 6177 B12R1.226 OC(=O)C#Cc1cc(Cl)ccc1 Amb20673086 [0,1,0,0,0,1|0,0,1]=3 6178 B12R1.226 OC(=O)C#Cc1cc(F)ccc1 Amb20673102 [0,1,0,0,0,1|0,0,1]=3 6179 B12R1.226 OC(=O)C=Cc1cc[n]c(Cl)c1 Amb20668239 [0,1,0,0,0,1|1,0,1]=4 6180 B12R1.226 OC(=O)CCC1=CC(=O)C=CN1 Amb25230528 [0,1,0,0,0,1|1,0,0]=3 6181 B12R1.226 OC(=O)CCc1c[n]cc(Cl)c1 Amb25689846 [0,1,0,0,0,1|1,0,0]=3 6182 B12R1.226 OC(=O)CCc1c[n]cc(F)c1 Amb23450303 [0,1,0,0,0,1|1,0,0]=3 6183 B12R1.226 OC(=O)CCc1cc(F)cc[n]1 Amb22886576 [0,1,0,0,0,1|1,0,0]=3 6184 B12R1.226 OC(=O)CCc1cc[n]c(Br)c1 Amb24418909 [0,1,0,0,0,1|1,0,0]=3 6185 B12R1.226 OC(=O)CCc1cc[n]c(Cl)[n]1 Amb24346496 [0,1,0,0,0,1|2,0,0]=4 6186 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [0,1,0,0,0,1|0,0,0]=2 6187 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [0,1,0,0,0,1|0,0,0]=2 6188 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [0,1,0,0,0,1|0,0,0]=2 6189 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [0,1,0,0,0,1|0,0,0]=2 6190 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [0,1,0,0,0,1|0,0,0]=2 6191 B12R1.226 OC(=O)CNC1=CC(=O)NC=N1 Amb25826293 [0,1,0,0,0,1|2,0,0]=4 6192 B12R1.226 OC(=O)CNC=1C=CNC(=O)N1 Amb18647109 [0,1,0,0,0,1|2,0,0]=4 6193 B12R1.226 OC(=O)CNC=1NC=CC(=O)N1 Amb25178880 [0,1,0,0,0,1|2,0,0]=4 6194 B12R1.226 OC(=O)CNc1[n]c(Cl)cc[n]1 Amb19889637 [0,1,0,0,0,1|2,0,0]=4 6195 B12R1.226 OC(=O)CNc1c[n]cc(Br)c1 Amb24483737 [0,1,0,0,0,1|1,0,0]=3 6196 B12R1.226 OC(=O)CNc1c[n]cc(Cl)[n]1 Amb19889628 [0,1,0,0,0,1|2,0,0]=4 6197 B12R1.226 OC(=O)CNc1cc(Br)cc[n]1 Amb24343807 [0,1,0,0,0,1|1,0,0]=3 6198 B12R1.226 OC(=O)CNc1cc(Cl)[n]c[n]1 Amb19889638 [0,1,0,0,0,1|2,0,0]=4 6199 B12R1.226 OC(=O)CNc1cc(Cl)c[n][n]1 Amb24351146 [0,1,0,0,0,1|2,0,0]=4 6200 B12R1.226 OC(=O)CNc1cc(Cl)cc[n]1 Amb24697669 [0,1,0,0,0,1|1,0,0]=3 6201 B12R1.226 OC(=O)CNc1cc[n]c(Cl)[n]1 Amb25859336 [0,1,0,0,0,1|2,0,0]=4 6202 B12R1.226 OC(=O)CNc1cccc(Br)[n]1 Amb22899453 [0,1,0,0,0,1|1,0,0]=3 6203 B12R1.226 OC(=O)CNc1cccc(Cl)[n]1 Amb25736170 [0,1,0,0,0,1|1,0,0]=3 6204 B12R1.226 OC(=O)CNc1cccc(F)c1 Amb19341704 [0,1,0,0,0,1|0,0,0]=2 6205 B12R1.226 OC(=O)CNc1cccc(c1)Cl Amb10609174 [0,1,0,0,0,1|0,0,0]=2 6206 B12R1.226 OC(=O)COc1[n]c(Cl)cc[n]1 Amb24351162 [0,1,0,0,0,1|2,0,0]=4 6207 B12R1.226 OC(=O)COc1c[n]cc(Br)c1 Amb24271218 [0,1,0,0,0,1|1,0,0]=3 6208 B12R1.226 OC(=O)COc1c[n]cc(F)c1 Amb25760871 [0,1,0,0,0,1|1,0,0]=3 6209 B12R1.226 OC(=O)COc1cc(Br)cc[n]1 Amb18660970 [0,1,0,0,0,1|1,0,0]=3 6210 B12R1.226 OC(=O)COc1cc[n]c(Br)c1 Amb18660965 [0,1,0,0,0,1|1,0,0]=3 6211 B12R1.226 OC(=O)COc1cc[n]c(Cl)[n]1 Amb24596833 [0,1,0,0,0,1|2,0,0]=4 6212 B12R1.226 OC(=O)COc1cc[n]c(Cl)c1 Amb25792389 [0,1,0,0,0,1|1,0,0]=3 6213 B12R1.226 OC(=O)COc1cccc(c1)Cl Amb1211231 [0,1,0,0,0,1|0,0,0]=2 6214 B12R1.226 OC(=O)COc1cccc(c1)F Amb1102803 [0,1,0,0,0,1|0,0,0]=2 6215 B12R1.226 OC(=O)CSC=1NC(=O)C=CN1 Amb18023193 [0,1,0,0,0,1|2,0,0]=4 6216 B12R1.226 OC(=O)CSc1cc[n]c(Cl)c1 Amb25279825 [0,1,0,0,0,1|1,0,0]=3 6217 B12R1.226 OC(=O)CSc1cccc(Cl)[n]1 Amb25835703 [0,1,0,0,0,1|1,0,0]=3 6218 B12R1.226 OC(=O)CSc1cccc(F)c1 Amb19887452 [0,1,0,0,0,1|0,0,0]=2 6219 B12R1.226 OC(=O)CSc1cccc(c1)Br Amb2372547 [0,1,0,0,0,1|0,0,0]=2 6220 B12R1.226 OC(=O)CSc1cncc(n1)Cl Amb10608613 [0,1,0,0,0,1|2,0,0]=4 6221 B12R1.226 OC(=O)CSc1nccc(=O)[nH]1 Amb1790919 [0,1,0,0,0,1|2,0,0]=4 6222 B12R1.226 OC(=O)CSc1nccc(n1)N Amb17594779 [0,1,0,0,0,1|2,0,0]=4 6223 B12R1.226 OC(=O)\C=C/c1cccc(c1)F Amb16185904 [0,1,0,0,0,1|0,0,1]=3 6224 B12R1.226 OC(=O)\C=C\C1=CC=CC(=O)N1 Amb25705720 [0,1,0,0,0,1|1,0,1]=4 6225 B12R1.226 OC(=O)\C=C\C1=CC=CC(=O)O1 Amb24425498 [0,1,0,0,0,1|1,0,1]=4 6226 B12R1.226 OC(=O)\C=C\[n+]1cccc(c1)C Amb1030018 [0,1,0,0,0,1|1,0,1]=4 6227 B12R1.226 OC(=O)\C=C\c1c[n]cc(Br)c1 Amb22491337 [0,1,0,0,0,1|1,0,1]=4 6228 B12R1.226 OC(=O)\C=C\c1c[n]cc(F)c1 Amb18283058 [0,1,0,0,0,1|1,0,1]=4 6229 B12R1.226 OC(=O)\C=C\c1cc[n]c(Br)c1 Amb19929893 [0,1,0,0,0,1|1,0,1]=4 6230 B12R1.226 OC(=O)\C=C\c1ccc[n+](c1)[O-] Amb10552948 [0,1,0,0,0,1|1,0,1]=4 6231 B12R1.226 OC(=O)\C=C\c1cccc(Br)[n]1 Amb25674136 [0,1,0,0,0,1|1,0,1]=4 6232 B12R1.226 OC(=O)\C=C\c1cccc(Cl)[n]1 Amb25060200 [0,1,0,0,0,1|1,0,1]=4 6233 B12R1.226 OC(=O)\C=C\c1cccc(F)[n]1 Amb24702245 [0,1,0,0,0,1|1,0,1]=4 6234 B12R1.226 OC(=O)\C=C\c1cccc(c1)Br Amb1207365 [0,1,0,0,0,1|0,0,1]=3 6235 B12R1.226 OC(=O)\C=C\c1cccc(c1)C Amb1212079 [0,1,0,0,0,1|0,0,1]=3 6236 B12R1.226 OC(=O)\C=C\c1cccc(c1)Cl Amb1209598 [0,1,0,0,0,1|0,0,1]=3 6237 B12R1.226 OC(=O)\C=C\c1cccc(c1)F Amb1210956 [0,1,0,0,0,1|0,0,1]=3 6238 B12R1.226 OC(=O)\C=C\c1cccc(c1)I Amb2236388 [0,1,0,0,0,1|0,0,1]=3 6239 B12R1.226 OC(=O)\C=C\c1cccc(c1)N Amb1197625 [0,1,0,0,0,1|0,0,1]=3 6240 B12R1.226 OC(=O)\C=C\c1cccc(c1)O Amb1137756 [0,1,0,0,0,1|0,0,1]=3 6241 B12R1.226 Oc1[n]c(CCC(O)=O)cc[n]1 Amb18826808 [0,1,0,0,0,1|2,0,0]=4 6242 B12R1.226 Oc1c[n]cc(CCC(O)=O)c1 Amb24435210 [0,1,0,0,0,1|1,0,0]=3 6243 B12R1.226 Oc1cc(CCC(=O)Cl)ccc1 Amb25356247 [0,1,0,0,0,1|1,0,0]=3 6244 B12R1.226 Oc1cc(CCC(O)=O)[n]c[n]1 Amb18862743 [0,1,0,0,0,1|2,0,0]=4 6245 B12R1.226 Oc1cc(cc[n]1)\C=C\C(O)=O Amb24682988 [0,1,0,0,0,1|1,0,1]=4 6246 B12R1.226 Oc1cc[n]c(CCC(O)=O)[n]1 Amb18862742 [0,1,0,0,0,1|2,0,0]=4 6247 B12R1.226 Oc1cccc(c1)C#CC(O)=O Amb23569602 [0,1,0,0,0,1|0,0,1]=3 6248 B12R1.226 Oc1cccc(c1)\C=C/C(O)=O Amb24584528 [0,1,0,0,0,1|0,0,1]=3 6249 B12R1.226 [O-][N+](=O)CCc1cccc(O)c1 Amb25141958 [0,1,0,0,0,1|1,0,1]=4 6250 B12R1.226 [O-][N+](=O)CCc1cccc(c1)C Amb17400177 [0,1,0,0,0,1|1,0,1]=4 6251 B12R1.226 [O-][N+](=O)CCc1cccc(c1)Cl Amb17401073 [0,1,0,0,0,1|1,0,1]=4 6252 B12R1.226 [O-][N+](=O)CSc1cccc(Br)c1 Amb24556304 [0,1,0,0,0,1|1,0,1]=4 6253 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [0,1,0,0,0,1|1,0,1]=4 6254 B12R1.891 CC(C)(O)COc1ccccc1 Amb18180107 [0,1,0,0,0,1|1,0,1]=4 6255 B12R1.891 CC(C)(O)CSc1ccccc1 Amb18321685 [0,1,0,0,0,1|1,0,1]=4 6256 B12R1.891 CC(CNc1ccccc1)(O)C Amb17138596 [0,1,0,0,0,1|1,0,1]=4 6257 B12R1.891 CS(=O)(=O)CCc1ccccc1 Amb24454272 [0,1,0,0,0,1|1,0,1]=4 6258 B12R1.891 CS(=O)(=O)NCc1ccccc1 Amb2435156 [0,1,0,0,0,1|1,0,1]=4 6259 B12R1.891 CS(=O)(=O)SCc1ccccc1 Amb10071891 [0,1,0,0,0,1|1,0,1]=4 6260 B12R1.891 ClS(=O)(=O)CCc1ccccc1 Amb1130049 [0,1,0,0,0,1|1,0,1]=4 6261 B12R1.891 ClS(=O)(=O)NCc1ccccc1 Amb17193929 [0,1,0,0,0,1|1,0,1]=4 6262 B12R1.891 O=S(=O)(Br)CCc1ccccc1 Amb23555507 [0,1,0,0,0,1|1,0,1]=4 6263 B12R1.891 O=S(=O)(F)CCc1ccccc1 Amb19375026 [0,1,0,0,0,1|1,0,1]=4 6264 B12R1.891 OP(=O)(\C=C\c1ccccc1)O Amb1041442 [0,1,0,0,0,1|1,0,1]=4 6265 B12R1.891 OS(=O)(=O)/C=C/c1ccccc1 Amb17672591 [0,1,0,0,0,1|1,0,1]=4 6266 B12R1.891 OS(=O)(=O)CCc1ccccc1 Amb19866568 [0,1,0,0,0,1|1,0,0]=3 6267 B12R1.891 OS(=O)(=O)CNc1cccc[n]1 Amb25040132 [0,1,0,0,0,1|2,0,0]=4 6268 B12R1.891 OS(=O)(=O)COc1cccc[n]1 Amb22051656 [0,1,0,0,0,1|2,0,0]=4 6269 B12R1.891 OS(=O)(=O)NCc1ccccc1 Amb22551828 [0,1,0,0,0,1|1,0,0]=3 6270 B12R1.891 OS(=O)(=O)\C=C\c1ccccc1 Amb22364622 [0,1,0,0,0,1|1,0,1]=4 6271 B12R1.891 OS(=O)(=O)\C=C\c1ccccc1 Amb22364623 [0,1,0,0,0,1|1,0,1]=4 6272 B12R1.891 [O-]S(=O)(=O)CCc1ccccc1 Amb22457030 [0,1,0,0,0,1|1,0,1]=4 6273 B12R1.891 [O-]S(=O)(=O)CNc1ccccc1 Amb22359475 [0,1,0,0,0,1|1,0,1]=4 6274 B12R1.891 [O-]S(=O)(=O)OCc1ccccc1 Amb24694356 [0,1,0,0,0,1|1,0,1]=4 6275 B12R1.3110 CC1(CCC(O)=O)C=CCC=C1 Amb24677697 [0,1,0,0,0,1|0,0,2]=4 6276 B12R1.210 CC(=O)CC1=CC=CC=CC1=O Amb25319891 [0,1,0,0,0,1|1,0,0]=3 6277 B12R1.210 CC(=O)NC1=CC=CC=CC1=O Amb25743434 [0,1,0,0,0,1|2,0,0]=4 6278 B12R1.210 CC(=O)OC1=CC=CC=CC1=O Amb25723301 [0,1,0,0,0,1|2,0,0]=4 6279 B12R1.210 NC(=O)\N=C/1\C=CC=CC=C1S Amb24390230 [0,1,0,0,0,1|2,0,0]=4 6280 B12R1.874 CC1CC(CC(O)=O)C=CC=C1 Amb25159497 [0,1,0,0,0,1|0,0,2]=4 6281 B12R1.1020 CC(=O)OC1=CC=CC(=O)C=C1 Amb25714392 [0,1,0,0,0,1|2,0,0]=4 6282 B12R1.1748 C=CC(=O)CC1C=CC=CC=C1 Amb25270988 [0,1,0,0,0,1|1,0,1]=4 6283 B12R1.1748 CCC(=O)CC1C=CC=CC=C1 Amb25730082 [0,1,0,0,0,1|1,0,1]=4 6284 B12R1.2197 CC(C(O)=O)C=1CC=CC=CC1 Amb24711216 [0,1,0,0,0,1|0,0,0]=2 6285 B12R1.2197 NC(C1C=CC=CC=C1)C(O)=O Amb25751352 [0,1,0,0,0,1|0,0,1]=3 6286 B12R1.4 C#Cc1ccc(CC(O)=O)[n]c1 Amb24379475 [0,2,0,0,0,0|1,0,0]=3 6287 B12R1.4 C#Cc1ccc(CC(O)=O)cc1 Amb24485430 [0,2,0,0,0,0|0,0,0]=2 6288 B12R1.4 C=C(Cl)Cc1ccc(C=O)cc1 Amb18648446 [0,2,0,0,0,0|2,0,0]=4 6289 B12R1.4 C=C(Cl)Cc1ccc(CO)cc1 Amb25261932 [0,2,0,0,0,0|2,0,0]=4 6290 B12R1.4 C=Cc1ccc(CC(O)=O)cc1 Amb25131633 [0,2,0,0,0,0|0,0,0]=2 6291 B12R1.4 CC(=C)Cc1ccc(CC)cc1 Amb22000374 [0,2,0,0,0,0|2,0,0]=4 6292 B12R1.4 CC(=C)Cc1ccc(cc1)C=C Amb25803324 [0,2,0,0,0,0|2,0,0]=4 6293 B12R1.4 CC(=O)Cc1ccc(C#N)[n]c1 Amb24728545 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.4 CC(=O)Cc1ccc(C=C)cc1 Amb25366760 [0,2,0,0,0,0|1,0,0]=3 6295 B12R1.4 CC(=O)Cc1ccc(CC)[n]c1 Amb24596665 [0,2,0,0,0,0|2,0,0]=4 6296 B12R1.4 CC(=O)Cc1ccc(CC)c[n]1 Amb24342208 [0,2,0,0,0,0|2,0,0]=4 6297 B12R1.4 CC(=O)Cc1ccc(CF)cc1 Amb25208126 [0,2,0,0,0,0|1,0,0]=3 6298 B12R1.4 CC(=O)Cc1ccc(CN)cc1 Amb18908622 [0,2,0,0,0,0|1,0,0]=3 6299 B12R1.4 CC(=O)Cc1ccc(CO)cc1 Amb24532516 [0,2,0,0,0,0|1,0,0]=3 6300 B12R1.4 CC(=O)Cc1ccc(cc1)SC Amb18893653 [0,2,0,0,0,0|1,0,0]=3 6301 B12R1.4 CC(=O)Nc1ccc(CBr)cc1 Amb25058872 [0,2,0,0,0,0|2,0,0]=4 6302 B12R1.4 CC(=O)Nc1ccc(cc1)C#C Amb21964907 [0,2,0,0,0,0|2,0,0]=4 6303 B12R1.4 CC(=O)Nc1ccc(cc1)NN Amb22229618 [0,2,0,0,0,0|2,0,0]=4 6304 B12R1.4 CC(=O)Nc1ccc(cc1)NN Amb25839733 [0,2,0,0,0,0|2,0,0]=4 6305 B12R1.4 CC(=O)Nc1ccc(cc1)NO Amb24343207 [0,2,0,0,0,0|2,0,0]=4 6306 B12R1.4 CC(=O)Nc1ccc(cc1)[Hg]Cl Amb22347642 [0,2,0,0,0,0|2,0,0]=4 6307 B12R1.4 CC(=O)Oc1ccc(CBr)cc1 Amb22727961 [0,2,0,0,0,0|2,0,0]=4 6308 B12R1.4 CC(=O)Oc1ccc(CI)cc1 Amb22753743 [0,2,0,0,0,0|2,0,0]=4 6309 B12R1.4 CC(=O)Oc1ccc(CN)cc1 Amb18251721 [0,2,0,0,0,0|2,0,0]=4 6310 B12R1.4 CC(=O)Oc1ccc(CO)cc1 Amb24056443 [0,2,0,0,0,0|2,0,0]=4 6311 B12R1.4 CC(=O)Oc1ccc(cc1)C#C Amb24643490 [0,2,0,0,0,0|2,0,0]=4 6312 B12R1.4 CC(=O)Oc1ccc(cc1)C#N Amb18645448 [0,2,0,0,0,0|2,0,0]=4 6313 B12R1.4 CC(=O)Oc1ccc(cc1)[Zn]I Amb22000486 [0,2,0,0,0,0|2,0,0]=4 6314 B12R1.4 CCc1[n]cc(CC(O)=O)c[n]1 Amb18827780 [0,2,0,0,0,0|2,0,0]=4 6315 B12R1.4 CCc1ccc(CB(O)O)cc1 Amb25692129 [0,2,0,0,0,0|1,0,1]=4 6316 B12R1.4 CCc1ccc(CC(=C)Br)cc1 Amb19928777 [0,2,0,0,0,0|2,0,0]=4 6317 B12R1.4 CCc1ccc(CC(=C)Cl)cc1 Amb22000366 [0,2,0,0,0,0|2,0,0]=4 6318 B12R1.4 CCc1ccc(CC(=O)Cl)cc1 Amb25762197 [0,2,0,0,0,0|1,0,0]=3 6319 B12R1.4 CCc1ccc(CC(O)=O)c[n]1 Amb24635308 [0,2,0,0,0,0|1,0,0]=3 6320 B12R1.4 CCc1ccc(cc1)CC(=O)N Amb17400136 [0,2,0,0,0,0|1,0,0]=3 6321 B12R1.4 CCc1ccc(cc1)CC(=S)N Amb17233641 [0,2,0,0,0,0|1,1,0]=4 6322 B12R1.4 CCc1ccc(cc1)CC(O)C Amb17477408 [0,2,0,0,0,0|1,0,1]=4 6323 B12R1.4 CCc1ccc(cc1)NC(=O)N Amb1134788 [0,2,0,0,0,0|2,0,0]=4 6324 B12R1.4 CCc1ccc(cc1)OC(N)=O Amb24091565 [0,2,0,0,0,0|2,0,0]=4 6325 B12R1.4 CNc1ccc(CC(N)=O)cc1 Amb18303217 [0,2,0,0,0,0|1,0,0]=3 6326 B12R1.4 CNc1ccc(CC(O)=O)cc1 Amb18368592 [0,2,0,0,0,0|0,0,0]=2 6327 B12R1.4 CNc1ccc(cc1)CC(=O)O Amb17305895 [0,2,0,0,0,0|0,0,0]=2 6328 B12R1.4 CNc1ccc(cc1)NC(N)=O Amb18288748 [0,2,0,0,0,0|2,0,0]=4 6329 B12R1.4 CNc1ccc(cc1)SC(N)=O Amb25667582 [0,2,0,0,0,0|2,0,0]=4 6330 B12R1.4 COc1c[n]c(CC(O)=O)c[n]1 Amb18826734 [0,2,0,0,0,0|2,0,0]=4 6331 B12R1.4 COc1ccc(CC(N)=O)c[n]1 Amb25121137 [0,2,0,0,0,0|2,0,0]=4 6332 B12R1.4 COc1ccc(CC(O)=O)[n]c1 Amb22740107 [0,2,0,0,0,0|1,0,0]=3 6333 B12R1.4 COc1ccc(CP(O)=O)cc1 Amb25281728 [0,2,0,0,0,0|1,0,0]=3 6334 B12R1.4 COc1ccc(CS([O-])=O)cc1 Amb24615932 [0,2,0,0,0,0|1,0,1]=4 6335 B12R1.4 COc1ccc(C[N+]([O-])=O)cc1 Amb23589322 [0,2,0,0,0,0|1,0,1]=4 6336 B12R1.4 COc1ccc(cc1)CC(=O)O Amb1486643 [0,2,0,0,0,0|0,0,0]=2 6337 B12R1.4 COc1ccc(cc1)CC(O)C Amb1110944 [0,2,0,0,0,0|1,0,1]=4 6338 B12R1.4 COc1ccc(cc1)C[C@@H](O)C Amb13952977 [0,2,0,0,0,0|1,0,1]=4 6339 B12R1.4 COc1ccc(cc1)C[C@H](O)C Amb13952978 [0,2,0,0,0,0|1,0,1]=4 6340 B12R1.4 COc1ccc(cc1)NC(=O)Cl Amb24497092 [0,2,0,0,0,0|2,0,0]=4 6341 B12R1.4 COc1ccc(cc1)NC(O)=O Amb23554942 [0,2,0,0,0,0|1,0,0]=3 6342 B12R1.4 CS(=O)Cc1ccc(CN)cc1 Amb18909344 [0,2,0,0,0,0|2,0,0]=4 6343 B12R1.4 CS(=O)Cc1ccc(cc1)C#N Amb24747694 [0,2,0,0,0,0|2,0,0]=4 6344 B12R1.4 CSc1[n]cc(CC(O)=O)c[n]1 Amb25351916 [0,2,0,0,0,0|2,0,0]=4 6345 B12R1.4 CSc1ccc(CC(=O)Cl)cc1 Amb25342337 [0,2,0,0,0,0|1,0,0]=3 6346 B12R1.4 CSc1ccc(CC(N)=O)cc1 Amb18893671 [0,2,0,0,0,0|1,0,0]=3 6347 B12R1.4 CSc1ccc(cc1)OC(N)=O Amb24537655 [0,2,0,0,0,0|2,0,0]=4 6348 B12R1.4 CSc1ccc(cc1)SC(N)=O Amb24373096 [0,2,0,0,0,0|2,0,0]=4 6349 B12R1.4 N#Cc1c[n]c(CC(O)=O)[n]c1 Amb25133808 [0,2,0,0,0,0|2,0,0]=4 6350 B12R1.4 N#Cc1ccc(CC(=O)Cl)cc1 Amb25084783 [0,2,0,0,0,0|1,0,0]=3 6351 B12R1.4 N#Cc1ccc(CC(O)=O)[n]c1 Amb25288479 [0,2,0,0,0,0|1,0,0]=3 6352 B12R1.4 N#Cc1ccc(cc1)NC(=O)C Amb1240564 [0,2,0,0,0,0|2,0,0]=4 6353 B12R1.4 N#Cc1ccc(cc1)OC(O)=O Amb22753299 [0,2,0,0,0,0|1,0,0]=3 6354 B12R1.4 N#[N+]c1ccc(CC(O)=O)cc1 Amb25065273 [0,2,0,0,0,0|0,0,0]=2 6355 B12R1.4 NC(=O)Cc1ccc(cc1)C#N Amb22059110 [0,2,0,0,0,0|1,0,0]=3 6356 B12R1.4 NC(=O)Cc1ccc(cc1)C=O Amb24373646 [0,2,0,0,0,0|1,0,0]=3 6357 B12R1.4 NC(=O)Nc1ccc(CO)cc1 Amb24573931 [0,2,0,0,0,0|2,0,0]=4 6358 B12R1.4 NC(=O)Oc1ccc(cc1)C#N Amb24679070 [0,2,0,0,0,0|2,0,0]=4 6359 B12R1.4 NC(=O)Sc1ccc(cc1)C#N Amb25360799 [0,2,0,0,0,0|2,0,0]=4 6360 B12R1.4 NCc1ccc(CB(O)O)cc1 Amb24459227 [0,2,0,0,0,0|1,0,1]=4 6361 B12R1.4 NCc1ccc(CC(O)=O)cc1 Amb20076037 [0,2,0,0,0,0|0,0,0]=2 6362 B12R1.4 NCc1ccc(cc1)NC(=O)C Amb205591 [0,2,0,0,0,0|2,0,0]=4 6363 B12R1.4 NCc1ccc(cc1)NC(=O)C Amb2371780 [0,2,0,0,0,0|2,0,0]=4 6364 B12R1.4 NNc1ccc(CC(O)=O)cc1 Amb21955783 [0,2,0,0,0,0|0,0,0]=2 6365 B12R1.4 NNc1ccc(CS(=O)=O)cc1 Amb25701912 [0,2,0,0,0,0|1,0,1]=4 6366 B12R1.4 O=C(Cl)Cc1ccc(CBr)cc1 Amb25721969 [0,2,0,0,0,0|1,0,0]=3 6367 B12R1.4 O=C(Cl)Cc1ccc(CCl)cc1 Amb25779327 [0,2,0,0,0,0|1,0,0]=3 6368 B12R1.4 O=Cc1ccc(cc1)SC(=O)C Amb13890380 [0,2,0,0,0,0|2,0,0]=4 6369 B12R1.4 OC(=O)CC=1C=CC(CC1)=C=O Amb25260947 [0,2,0,0,0,0|0,0,1]=3 6370 B12R1.4 OC(=O)Cc1[n]cc(c[n]1)C=O Amb24648871 [0,2,0,0,0,0|2,0,0]=4 6371 B12R1.4 OC(=O)Cc1c[n]c(CCl)[n]c1 Amb18821786 [0,2,0,0,0,0|2,0,0]=4 6372 B12R1.4 OC(=O)Cc1ccc(cc1)C=O Amb18645972 [0,2,0,0,0,0|0,0,0]=2 6373 B12R1.4 OC(=O)Cc1ccc(cc1)N=O Amb24390894 [0,2,0,0,0,0|0,0,0]=2 6374 B12R1.4 OCc1ccc(cc1)NC(=O)C Amb1110930 [0,2,0,0,0,0|2,0,0]=4 6375 B12R1.4 [13CH3]Oc1ccc(cc1)NC(=O)C Amb17616865 [0,2,0,0,0,0|2,0,0]=4 6376 B12R1.4 [C-]#[N+]c1ccc(cc1)NC(C)=O Amb25326368 [0,2,0,0,0,0|2,0,0]=4 6377 B12R1.4 [C-]#[N+]c1ccc(cc1)OC(=O)Cl Amb24615950 [0,2,0,0,0,0|2,0,0]=4 6378 B12R1.4 [C-]#[N+]c1ccc(cc1)OC(C)=O Amb25786326 [0,2,0,0,0,0|2,0,0]=4 6379 B12R1.19 CC(=O)Cc1c[n]c(Cl)c(N)c1 Amb25667114 [0,2,0,0,0,0|2,0,0]=4 6380 B12R1.19 CC(=O)Cc1cc(S)c(S)cc1 Amb25223936 [0,2,0,0,0,0|1,0,0]=3 6381 B12R1.19 CC(=O)Cc1ccc(Br)c(F)c1 Amb20622541 [0,2,0,0,0,0|1,0,0]=3 6382 B12R1.19 CC(=O)Cc1ccc(Cl)c(F)c1 Amb25069224 [0,2,0,0,0,0|1,0,0]=3 6383 B12R1.19 CC(=O)Cc1ccc(Cl)c(S)c1 Amb25216233 [0,2,0,0,0,0|1,0,0]=3 6384 B12R1.19 CC(=O)Cc1ccc(F)c(Cl)c1 Amb18893739 [0,2,0,0,0,0|1,0,0]=3 6385 B12R1.19 CC(=O)Cc1ccc(F)c(N)c1 Amb25312383 [0,2,0,0,0,0|1,0,0]=3 6386 B12R1.19 CC(=O)Cc1ccc(I)c(Br)c1 Amb24541292 [0,2,0,0,0,0|1,0,0]=3 6387 B12R1.19 CC(=O)Cc1ccc(I)c(Cl)c1 Amb24656441 [0,2,0,0,0,0|1,0,0]=3 6388 B12R1.19 CC(=O)Cc1ccc(I)c(O)c1 Amb24527857 [0,2,0,0,0,0|1,0,0]=3 6389 B12R1.19 CC(=O)Cc1ccc(N)c(C)c1 Amb25223462 [0,2,0,0,0,0|1,0,0]=3 6390 B12R1.19 CC(=O)Cc1ccc(O)c(C)c1 Amb18646039 [0,2,0,0,0,0|1,0,0]=3 6391 B12R1.19 CC(=O)Cc1ccc(O)c(I)c1 Amb25364996 [0,2,0,0,0,0|1,0,0]=3 6392 B12R1.19 CC(=O)Cc1ccc(S)c(Br)c1 Amb25376401 [0,2,0,0,0,0|1,0,0]=3 6393 B12R1.19 CC(=O)Cc1ccc(S)c(N)c1 Amb24536903 [0,2,0,0,0,0|1,0,0]=3 6394 B12R1.19 CC(=O)Cc1ccc(c(c1)N)Cl Amb17477740 [0,2,0,0,0,0|1,0,0]=3 6395 B12R1.19 CC(=O)Cc1ccc(c(c1)N)O Amb17477726 [0,2,0,0,0,0|1,0,0]=3 6396 B12R1.19 CC(=O)NC1=CC(=O)C(=O)C=C1 Amb24669099 [0,2,0,0,0,0|2,0,0]=4 6397 B12R1.19 CC(=O)Nc1cc(Br)c(Br)cc1 Amb25070749 [0,2,0,0,0,0|2,0,0]=4 6398 B12R1.19 CC(=O)Nc1ccc(Br)c(N)c1 Amb25062803 [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.19 CC(=O)Nc1ccc(Br)c(O)c1 Amb25820371 [0,2,0,0,0,0|2,0,0]=4 6400 B12R1.19 CC(=O)Nc1ccc(C)c(O)c1 Amb18646271 [0,2,0,0,0,0|2,0,0]=4 6401 B12R1.19 CC(=O)Nc1ccc(Cl)c(Br)c1 Amb25682857 [0,2,0,0,0,0|2,0,0]=4 6402 B12R1.19 CC(=O)Nc1ccc(Cl)c(F)c1 Amb25725852 [0,2,0,0,0,0|2,0,0]=4 6403 B12R1.19 CC(=O)Nc1ccc(Cl)c(S)c1 Amb25674213 [0,2,0,0,0,0|2,0,0]=4 6404 B12R1.19 CC(=O)Nc1ccc(F)c(Br)c1 Amb22411574 [0,2,0,0,0,0|2,0,0]=4 6405 B12R1.19 CC(=O)Nc1ccc(F)c(O)c1 Amb25095783 [0,2,0,0,0,0|2,0,0]=4 6406 B12R1.19 CC(=O)Nc1ccc(I)c(Br)c1 Amb25149967 [0,2,0,0,0,0|2,0,0]=4 6407 B12R1.19 CC(=O)Nc1ccc(I)c(F)c1 Amb25337887 [0,2,0,0,0,0|2,0,0]=4 6408 B12R1.19 CC(=O)Nc1ccc(N)c(Br)c1 Amb19981728 [0,2,0,0,0,0|2,0,0]=4 6409 B12R1.19 CC(=O)Nc1ccc(N)c(O)c1 Amb25858179 [0,2,0,0,0,0|2,0,0]=4 6410 B12R1.19 CC(=O)Nc1ccc(N)c(S)c1 Amb18273454 [0,2,0,0,0,0|2,0,0]=4 6411 B12R1.19 CC(=O)Nc1ccc(O)c(Br)c1 Amb24072134 [0,2,0,0,0,0|2,0,0]=4 6412 B12R1.19 CC(=O)Nc1ccc(O)c(C)c1 Amb18646272 [0,2,0,0,0,0|2,0,0]=4 6413 B12R1.19 CC(=O)Nc1ccc(O)c(F)c1 Amb19149070 [0,2,0,0,0,0|2,0,0]=4 6414 B12R1.19 CC(=O)Nc1ccc(O)c(N)c1 Amb18646491 [0,2,0,0,0,0|2,0,0]=4 6415 B12R1.19 CC(=O)Nc1ccc(S)c(N)c1 Amb18273261 [0,2,0,0,0,0|2,0,0]=4 6416 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C Amb1205546 [0,2,0,0,0,0|2,0,0]=4 6417 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br Amb10808065 [0,2,0,0,0,0|2,0,0]=4 6418 B12R1.19 CC(=O)Nc1ccc(c(c1)N)Cl Amb1114144 [0,2,0,0,0,0|2,0,0]=4 6419 B12R1.19 CC(=O)Nc1ccc(c(c1)N)F Amb1112399 [0,2,0,0,0,0|2,0,0]=4 6420 B12R1.19 CC(=O)Nc1ccc(c(c1)O)Cl Amb10071144 [0,2,0,0,0,0|2,0,0]=4 6421 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O Amb17615030 [0,2,0,0,0,0|2,0,0]=4 6422 B12R1.19 CC(=O)Oc1cc(Cl)c(Cl)cc1 Amb24483765 [0,2,0,0,0,0|2,0,0]=4 6423 B12R1.19 CC(=O)Oc1cc(O)c(O)cc1 Amb18646836 [0,2,0,0,0,0|2,0,0]=4 6424 B12R1.19 CC(=O)Oc1ccc(Cl)c(Br)c1 Amb20242655 [0,2,0,0,0,0|2,0,0]=4 6425 B12R1.19 CC(=O)Oc1ccc(Cl)c(F)c1 Amb21856451 [0,2,0,0,0,0|2,0,0]=4 6426 B12R1.19 CC(=O)Oc1ccc(Cl)c(O)c1 Amb24608659 [0,2,0,0,0,0|2,0,0]=4 6427 B12R1.19 CC(=O)Oc1ccc(F)c(N)c1 Amb22232257 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.19 CC(=O)Oc1ccc(N)c(C)c1 Amb18646268 [0,2,0,0,0,0|2,0,0]=4 6429 B12R1.19 CC(=O)Oc1ccc(N)c(O)c1 Amb24661340 [0,2,0,0,0,0|2,0,0]=4 6430 B12R1.19 CC(=O)Oc1ccc(O)c(Br)c1 Amb21929310 [0,2,0,0,0,0|2,0,0]=4 6431 B12R1.19 CC(=O)Oc1ccc(O)c(C)c1 Amb25370623 [0,2,0,0,0,0|2,0,0]=4 6432 B12R1.19 CC(=O)Oc1ccc(O)c(Cl)c1 Amb25717675 [0,2,0,0,0,0|2,0,0]=4 6433 B12R1.19 CC(=O)Sc1cc(Cl)c(Cl)cc1 Amb25856888 [0,2,0,0,0,0|2,0,0]=4 6434 B12R1.19 CC(=O)Sc1ccc(F)c(Cl)c1 Amb25713501 [0,2,0,0,0,0|2,0,0]=4 6435 B12R1.19 CC(=O)Sc1ccc(F)c(N)c1 Amb25073239 [0,2,0,0,0,0|2,0,0]=4 6436 B12R1.19 CC(=O)\N=C\1/C=C(C)C(=O)C=C1 Amb25717697 [0,2,0,0,0,0|2,0,0]=4 6437 B12R1.19 CC(=S)Cc1cc(Cl)c(Cl)cc1 Amb25148712 [0,2,0,0,0,0|1,1,0]=4 6438 B12R1.19 CC(Cc1ccc(c(c1)Cl)Cl)O Amb17140004 [0,2,0,0,0,0|1,0,1]=4 6439 B12R1.19 CC(O)Cc1cc(C)c(C)cc1 Amb18792587 [0,2,0,0,0,0|1,0,1]=4 6440 B12R1.19 CC(O)Cc1cc(F)c(F)cc1 Amb24411626 [0,2,0,0,0,0|1,0,1]=4 6441 B12R1.19 CC(O)Cc1ccc(Br)c(F)c1 Amb20622540 [0,2,0,0,0,0|1,0,1]=4 6442 B12R1.19 CC(O)Cc1ccc(F)c(Br)c1 Amb24658163 [0,2,0,0,0,0|1,0,1]=4 6443 B12R1.19 CC(O)Cc1ccc(F)c(Cl)c1 Amb25691202 [0,2,0,0,0,0|1,0,1]=4 6444 B12R1.19 CC1=CC(CC(O)=O)=NNC1=O Amb24591275 [0,2,0,0,0,0|2,0,0]=4 6445 B12R1.19 CC1=CN(CC(N)=O)C=CC1=O Amb25817017 [0,2,0,0,0,0|2,0,0]=4 6446 B12R1.19 CC1=CN(CC(O)=O)C=CC1=O Amb25791911 [0,2,0,0,0,0|1,0,0]=3 6447 B12R1.19 CC1=NC=C(CC(O)=O)NC1=O Amb18826723 [0,2,0,0,0,0|2,0,0]=4 6448 B12R1.19 CN(O)Cc1cc(O)c(F)cc1 Amb25270292 [0,2,0,0,0,0|2,0,0]=4 6449 B12R1.19 CN1C=C(CC(O)=O)C=CC1=O Amb18646686 [0,2,0,0,0,0|1,0,0]=3 6450 B12R1.19 CN1C=CC(CC(O)=O)=CC1=O Amb24390958 [0,2,0,0,0,0|1,0,0]=3 6451 B12R1.19 CN1N=C(CC(O)=O)C=CC1=O Amb18206746 [0,2,0,0,0,0|2,0,0]=4 6452 B12R1.19 CS(=O)Cc1ccc(Cl)c(N)c1 Amb18952483 [0,2,0,0,0,0|2,0,0]=4 6453 B12R1.19 Cc1[n]c(CC(O)=O)[n]cc1F Amb24708391 [0,2,0,0,0,0|2,0,0]=4 6454 B12R1.19 Cc1[n]c(CC(O)=O)ccc1Cl Amb24537820 [0,2,0,0,0,0|1,0,0]=3 6455 B12R1.19 Cc1[n]c(CC(O)=O)ccc1O Amb25234230 [0,2,0,0,0,0|1,0,0]=3 6456 B12R1.19 Cc1[n]cc(CC(O)=O)cc1C Amb25075814 [0,2,0,0,0,0|1,0,0]=3 6457 B12R1.19 Cc1[n]cc(CC(O)=O)cc1Cl Amb24761406 [0,2,0,0,0,0|1,0,0]=3 6458 B12R1.19 Cc1[n]cc(CC(O)=O)cc1N Amb25352116 [0,2,0,0,0,0|1,0,0]=3 6459 B12R1.19 Cc1c[n+](CC(O)=O)ccc1C Amb25041091 [0,2,0,0,0,0|1,0,0]=3 6460 B12R1.19 Cc1c[n]c(CC(O)=O)cc1F Amb25239129 [0,2,0,0,0,0|1,0,0]=3 6461 B12R1.19 Cc1c[n]c(CC(O)=O)cc1O Amb24537116 [0,2,0,0,0,0|1,0,0]=3 6462 B12R1.19 Cc1cc(CB(O)O)ccc1C Amb24659259 [0,2,0,0,0,0|1,0,1]=4 6463 B12R1.19 Cc1cc(CC(=O)Br)ccc1Cl Amb20620756 [0,2,0,0,0,0|1,0,0]=3 6464 B12R1.19 Cc1cc(CC(=O)Cl)ccc1C Amb19074254 [0,2,0,0,0,0|1,0,0]=3 6465 B12R1.19 Cc1cc(CC(=O)Cl)ccc1F Amb24754211 [0,2,0,0,0,0|1,0,0]=3 6466 B12R1.19 Cc1cc(CC(C)=O)ccc1C Amb18792432 [0,2,0,0,0,0|1,0,0]=3 6467 B12R1.19 Cc1cc(CC(C)=O)ccc1Cl Amb24733521 [0,2,0,0,0,0|1,0,0]=3 6468 B12R1.19 Cc1cc(CC(C)=O)ccc1F Amb18893521 [0,2,0,0,0,0|1,0,0]=3 6469 B12R1.19 Cc1cc(CC(C)=O)ccc1I Amb24603954 [0,2,0,0,0,0|1,0,0]=3 6470 B12R1.19 Cc1cc(CC(C)O)ccc1Cl Amb24457807 [0,2,0,0,0,0|1,0,1]=4 6471 B12R1.19 Cc1cc(CC(N)=O)ccc1Br Amb24100613 [0,2,0,0,0,0|1,0,0]=3 6472 B12R1.19 Cc1cc(CC(N)=O)ccc1Cl Amb25152589 [0,2,0,0,0,0|1,0,0]=3 6473 B12R1.19 Cc1cc(CC(N)=O)ccc1O Amb24390284 [0,2,0,0,0,0|1,0,0]=3 6474 B12R1.19 Cc1cc(CC(N)=S)ccc1C Amb18181024 [0,2,0,0,0,0|1,1,0]=4 6475 B12R1.19 Cc1cc(CC(N)=S)ccc1F Amb25699963 [0,2,0,0,0,0|1,1,0]=4 6476 B12R1.19 Cc1cc(CC(O)=O)[n]cc1Cl Amb22388583 [0,2,0,0,0,0|1,0,0]=3 6477 B12R1.19 Cc1cc(CC(O)=O)[n]cc1N Amb24606840 [0,2,0,0,0,0|1,0,0]=3 6478 B12R1.19 Cc1cc(CC(O)=O)[n]cc1O Amb24574254 [0,2,0,0,0,0|1,0,0]=3 6479 B12R1.19 Cc1cc(CC(O)=O)c[n]c1Br Amb24627384 [0,2,0,0,0,0|1,0,0]=3 6480 B12R1.19 Cc1cc(CC(O)=O)c[n]c1O Amb24727554 [0,2,0,0,0,0|1,0,0]=3 6481 B12R1.19 Cc1cc(CC(O)=O)ccc1I Amb25826625 [0,2,0,0,0,0|0,0,0]=2 6482 B12R1.19 Cc1cc(CS(C)=O)ccc1C Amb25093409 [0,2,0,0,0,0|2,0,0]=4 6483 B12R1.19 Cc1cc(ccc1Br)OC(C)=O Amb25236405 [0,2,0,0,0,0|2,0,0]=4 6484 B12R1.19 Cc1cc(ccc1C)OC(N)=O Amb24485686 [0,2,0,0,0,0|2,0,0]=4 6485 B12R1.19 Cc1cc(ccc1F)NC(=O)Cl Amb24399165 [0,2,0,0,0,0|2,0,0]=4 6486 B12R1.19 Cc1cc(ccc1F)NC(C)=O Amb22489949 [0,2,0,0,0,0|2,0,0]=4 6487 B12R1.19 Cc1cc(ccc1F)NC(N)=O Amb18793024 [0,2,0,0,0,0|2,0,0]=4 6488 B12R1.19 Cc1cc(ccc1F)OC(=O)Cl Amb20668405 [0,2,0,0,0,0|2,0,0]=4 6489 B12R1.19 Cc1cc(ccc1I)NC(C)=O Amb22363872 [0,2,0,0,0,0|2,0,0]=4 6490 B12R1.19 Cc1cc(ccc1I)OC(C)=O Amb25710543 [0,2,0,0,0,0|2,0,0]=4 6491 B12R1.19 Cc1cc(ccc1N)NC(N)=O Amb18279350 [0,2,0,0,0,0|2,0,0]=4 6492 B12R1.19 Cc1cc(ccc1N)SC(N)=O Amb25798450 [0,2,0,0,0,0|2,0,0]=4 6493 B12R1.19 Cc1ccc(CB(O)O)cc1Br Amb24440464 [0,2,0,0,0,0|1,0,1]=4 6494 B12R1.19 Cc1ccc(CC(C)=O)cc1Br Amb18159506 [0,2,0,0,0,0|1,0,0]=3 6495 B12R1.19 Cc1ccc(CC(C)=O)cc1F Amb25152294 [0,2,0,0,0,0|1,0,0]=3 6496 B12R1.19 Cc1ccc(CC(C)O)cc1Cl Amb24379895 [0,2,0,0,0,0|1,0,1]=4 6497 B12R1.19 Cc1ccc(CC(C)O)cc1F Amb24493460 [0,2,0,0,0,0|1,0,1]=4 6498 B12R1.19 Cc1ccc(CC(N)=N)cc1Br Amb24398229 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.19 Cc1ccc(CC(N)=O)cc1F Amb24594980 [0,2,0,0,0,0|1,0,0]=3 6500 B12R1.19 Cc1ccc(CC(N)=S)cc1Br Amb24440467 [0,2,0,0,0,0|1,1,0]=4 6501 B12R1.19 Cc1ccc(CC(N)=S)cc1F Amb24428758 [0,2,0,0,0,0|1,1,0]=4 6502 B12R1.19 Cc1ccc(CC(O)=O)[n]c1Br Amb25258919 [0,2,0,0,0,0|1,0,0]=3 6503 B12R1.19 Cc1ccc(CC(O)=O)[n]c1O Amb24656553 [0,2,0,0,0,0|1,0,0]=3 6504 B12R1.19 Cc1ccc(cc1Br)NC(C)=O Amb22831248 [0,2,0,0,0,0|2,0,0]=4 6505 B12R1.19 Cc1ccc(cc1N)OC(N)=O Amb25273467 [0,2,0,0,0,0|2,0,0]=4 6506 B12R1.19 Cc1ccc(cc1S)NC(C)=O Amb24452196 [0,2,0,0,0,0|2,0,0]=4 6507 B12R1.19 ClC(=O)Cc1ccc(c(c1)F)F Amb10841836 [0,2,0,0,0,0|1,0,0]=3 6508 B12R1.19 N=C(O)Cc1cc(F)c(F)cc1 Amb21520412 [0,2,0,0,0,0|1,0,0]=3 6509 B12R1.19 NC(=N)Cc1cc(F)c(F)cc1 Amb22497457 [0,2,0,0,0,0|2,0,0]=4 6510 B12R1.19 NC(=N)Cc1cc(O)c(O)cc1 Amb24097421 [0,2,0,0,0,0|2,0,0]=4 6511 B12R1.19 NC(=N)Cc1ccc(F)c(Br)c1 Amb25834527 [0,2,0,0,0,0|2,0,0]=4 6512 B12R1.19 NC(=N)Cc1ccc(F)c(Cl)c1 Amb25053297 [0,2,0,0,0,0|2,0,0]=4 6513 B12R1.19 NC(=O)CN1C=CC(=O)C(O)=C1 Amb25249376 [0,2,0,0,0,0|2,0,0]=4 6514 B12R1.19 NC(=O)Cc1cc(O)c(O)cc1 Amb19747005 [0,2,0,0,0,0|1,0,0]=3 6515 B12R1.19 NC(=O)Cc1ccc(Cl)c(F)c1 Amb25852391 [0,2,0,0,0,0|1,0,0]=3 6516 B12R1.19 NC(=O)Cc1ccc(F)c(Cl)c1 Amb18243881 [0,2,0,0,0,0|1,0,0]=3 6517 B12R1.19 NC(=O)Cc1ccc(N)c(O)c1 Amb24451045 [0,2,0,0,0,0|1,0,0]=3 6518 B12R1.19 NC(=O)Cc1ccc(O)c(Cl)c1 Amb25361122 [0,2,0,0,0,0|1,0,0]=3 6519 B12R1.19 NC(=O)Cc1ccc(O)c(F)c1 Amb18647117 [0,2,0,0,0,0|1,0,0]=3 6520 B12R1.19 NC(=O)Cc1ccc(c(c1)Br)F Amb11468232 [0,2,0,0,0,0|1,0,0]=3 6521 B12R1.19 NC(=O)Cc1ccc(c(c1)C)F Amb17400234 [0,2,0,0,0,0|1,0,0]=3 6522 B12R1.19 NC(=O)Nc1ccc(Br)c(Cl)c1 Amb24490262 [0,2,0,0,0,0|2,0,0]=4 6523 B12R1.19 NC(=O)Nc1ccc(Br)c(F)c1 Amb24088526 [0,2,0,0,0,0|2,0,0]=4 6524 B12R1.19 NC(=O)Nc1ccc(Cl)c(Br)c1 Amb24389204 [0,2,0,0,0,0|2,0,0]=4 6525 B12R1.19 NC(=O)Nc1ccc(Cl)c(F)c1 Amb19072135 [0,2,0,0,0,0|2,0,0]=4 6526 B12R1.19 NC(=O)Nc1ccc(F)c(Br)c1 Amb24088524 [0,2,0,0,0,0|2,0,0]=4 6527 B12R1.19 NC(=O)Nc1ccc(c(c1)Br)C Amb17248417 [0,2,0,0,0,0|2,0,0]=4 6528 B12R1.19 NC(=O)Nc1ccc(c(c1)C)C Amb1219868 [0,2,0,0,0,0|2,0,0]=4 6529 B12R1.19 NC(=O)Nc1ccc(c(c1)F)C Amb1124140 [0,2,0,0,0,0|2,0,0]=4 6530 B12R1.19 NC(=O)Nc1ccc(c(c1)F)F Amb1133848 [0,2,0,0,0,0|2,0,0]=4 6531 B12R1.19 NC(=O)Nc1ccc(c(c1)N)Cl Amb1119060 [0,2,0,0,0,0|2,0,0]=4 6532 B12R1.19 NC(=O)Nc1ccc(c(c1)N)F Amb1119177 [0,2,0,0,0,0|2,0,0]=4 6533 B12R1.19 NC(=O)Oc1cc(Cl)c(Cl)cc1 Amb22441917 [0,2,0,0,0,0|2,0,0]=4 6534 B12R1.19 NC(=O)Oc1cc(F)c(F)cc1 Amb24085478 [0,2,0,0,0,0|2,0,0]=4 6535 B12R1.19 NC(=S)Cc1ccc(Cl)c(F)c1 Amb25313719 [0,2,0,0,0,0|1,1,0]=4 6536 B12R1.19 NC1=CN(CC(O)=O)C=CC1=O Amb24751668 [0,2,0,0,0,0|1,0,0]=3 6537 B12R1.19 Nc1[n]c(CC(O)=O)ccc1Br Amb24392327 [0,2,0,0,0,0|1,0,0]=3 6538 B12R1.19 Nc1[n]cc(CC(O)=O)cc1Br Amb25830674 [0,2,0,0,0,0|1,0,0]=3 6539 B12R1.19 Nc1[n]cc(CC(O)=O)cc1Cl Amb25249823 [0,2,0,0,0,0|1,0,0]=3 6540 B12R1.19 Nc1c[n]c(CC(O)=O)cc1Cl Amb24654205 [0,2,0,0,0,0|1,0,0]=3 6541 B12R1.19 Nc1cc(CC(O)=O)[n]cc1Br Amb24424124 [0,2,0,0,0,0|1,0,0]=3 6542 B12R1.19 Nc1cc(CC(O)=O)c[n]c1F Amb25212434 [0,2,0,0,0,0|1,0,0]=3 6543 B12R1.19 Nc1cc(CC(O)=O)ccc1F Amb23400546 [0,2,0,0,0,0|0,0,0]=2 6544 B12R1.19 Nc1cc(CC(O)=O)ccc1S Amb18273633 [0,2,0,0,0,0|0,0,0]=2 6545 B12R1.19 Nc1ccc(CC(O)=O)cc1Br Amb19888251 [0,2,0,0,0,0|0,0,0]=2 6546 B12R1.19 Nc1ccc(CC(O)=O)cc1O Amb24094582 [0,2,0,0,0,0|0,0,0]=2 6547 B12R1.19 Nc1ccc(CC(O)=O)cc1S Amb18939300 [0,2,0,0,0,0|0,0,0]=2 6548 B12R1.19 Nc1ccc(cc1Br)NC(N)=O Amb25360610 [0,2,0,0,0,0|2,0,0]=4 6549 B12R1.19 Nc1ccc(cc1Cl)OC(N)=O Amb25172573 [0,2,0,0,0,0|2,0,0]=4 6550 B12R1.19 Nc1ccc(cc1F)NC(N)=O Amb24397532 [0,2,0,0,0,0|2,0,0]=4 6551 B12R1.19 O=C(Cl)Cc1ccc(F)c(Br)c1 Amb25800097 [0,2,0,0,0,0|1,0,0]=3 6552 B12R1.19 O=C(Cl)Oc1cc(Cl)c(Br)cc1 Amb24339417 [0,2,0,0,0,0|2,0,0]=4 6553 B12R1.19 O=C(Cl)Oc1cc(F)c(F)cc1 Amb25303356 [0,2,0,0,0,0|2,0,0]=4 6554 B12R1.19 O=C(Cl)Oc1ccc(F)c(Br)c1 Amb25366787 [0,2,0,0,0,0|2,0,0]=4 6555 B12R1.19 O=C(F)Nc1cc(Cl)c(Cl)cc1 Amb25324116 [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.19 OB(O)Cc1cc(Cl)c(Cl)cc1 Amb25049894 [0,2,0,0,0,0|1,0,1]=4 6557 B12R1.19 OB(O)Cc1cc(F)c(F)cc1 Amb24571272 [0,2,0,0,0,0|1,0,1]=4 6558 B12R1.19 OC(=O)CC1=COC(=O)C(=O)O1 Amb25280166 [0,2,0,0,0,0|2,0,0]=4 6559 B12R1.19 OC(=O)CN1CC(=O)C(=O)C=C1 Amb25227511 [0,2,0,0,0,0|1,0,1]=4 6560 B12R1.19 OC(=O)Cc1[n]cc(F)c(Cl)[n]1 Amb24415318 [0,2,0,0,0,0|2,0,0]=4 6561 B12R1.19 OC(=O)Cc1c[n]c(Cl)c(F)c1 Amb25299286 [0,2,0,0,0,0|1,0,0]=3 6562 B12R1.19 OC(=O)Cc1c[n]c(F)c(Br)c1 Amb25278361 [0,2,0,0,0,0|1,0,0]=3 6563 B12R1.19 OC(=O)Cc1c[n]c(F)c(Cl)c1 Amb25700313 [0,2,0,0,0,0|1,0,0]=3 6564 B12R1.19 OC(=O)Cc1c[n]c(F)c(I)c1 Amb24537017 [0,2,0,0,0,0|1,0,0]=3 6565 B12R1.19 OC(=O)Cc1cc(Br)c(Br)[n]c1 Amb24714587 [0,2,0,0,0,0|1,0,0]=3 6566 B12R1.19 OC(=O)Cc1cc(Br)c(Br)cc1 Amb22912989 [0,2,0,0,0,0|0,0,0]=2 6567 B12R1.19 OC(=O)Cc1cc(Br)c(F)c[n]1 Amb24654108 [0,2,0,0,0,0|1,0,0]=3 6568 B12R1.19 OC(=O)Cc1cc(Cl)c(Br)c[n]1 Amb24527929 [0,2,0,0,0,0|1,0,0]=3 6569 B12R1.19 OC(=O)Cc1cc(Cl)c(Cl)[n]c1 Amb25375791 [0,2,0,0,0,0|1,0,0]=3 6570 B12R1.19 OC(=O)Cc1cc(F)c(Cl)c[n]1 Amb24528252 [0,2,0,0,0,0|1,0,0]=3 6571 B12R1.19 OC(=O)Cc1ccc(Br)c(Cl)[n]1 Amb25669529 [0,2,0,0,0,0|1,0,0]=3 6572 B12R1.19 OC(=O)Cc1ccc(Br)c(Cl)c1 Amb25150069 [0,2,0,0,0,0|0,0,0]=2 6573 B12R1.19 OC(=O)Cc1ccc(Br)c(F)[n]1 Amb24731640 [0,2,0,0,0,0|1,0,0]=3 6574 B12R1.19 OC(=O)Cc1ccc(Br)c(F)c1 Amb19957841 [0,2,0,0,0,0|0,0,0]=2 6575 B12R1.19 OC(=O)Cc1ccc(Cl)c(Br)[n]1 Amb24680077 [0,2,0,0,0,0|1,0,0]=3 6576 B12R1.19 OC(=O)Cc1ccc(Cl)c(Br)c1 Amb19889378 [0,2,0,0,0,0|0,0,0]=2 6577 B12R1.19 OC(=O)Cc1ccc(Cl)c(F)[n]1 Amb25278049 [0,2,0,0,0,0|1,0,0]=3 6578 B12R1.19 OC(=O)Cc1ccc(Cl)c(S)c1 Amb24493192 [0,2,0,0,0,0|0,0,0]=2 6579 B12R1.19 OC(=O)Cc1ccc(F)c(Cl)[n]1 Amb25808019 [0,2,0,0,0,0|1,0,0]=3 6580 B12R1.19 OC(=O)Cc1ccc(F)c(Cl)c1 Amb22043655 [0,2,0,0,0,0|0,0,0]=2 6581 B12R1.19 OC(=O)Cc1ccc(F)c(I)c1 Amb24609830 [0,2,0,0,0,0|0,0,0]=2 6582 B12R1.19 OC(=O)Cc1ccc(I)c(Br)c1 Amb19888252 [0,2,0,0,0,0|0,0,0]=2 6583 B12R1.19 OC(=O)Cc1ccc(I)c(F)c1 Amb20171493 [0,2,0,0,0,0|0,0,0]=2 6584 B12R1.19 OC(=O)Cc1ccc(S)c(Br)c1 Amb24642851 [0,2,0,0,0,0|0,0,0]=2 6585 B12R1.19 OC(=O)Cc1ccc(S)c(Cl)c1 Amb25141043 [0,2,0,0,0,0|0,0,0]=2 6586 B12R1.19 OC(=O)Cc1ccc(S)c(I)c1 Amb24471611 [0,2,0,0,0,0|0,0,0]=2 6587 B12R1.19 OC(=O)Cc1ccc(c(c1)Br)C Amb17472168 [0,2,0,0,0,0|0,0,0]=2 6588 B12R1.19 OC(=O)Cc1ccc(c(c1)C)C Amb1830710 [0,2,0,0,0,0|0,0,0]=2 6589 B12R1.19 OC(=O)Cc1ccc(c(c1)C)F Amb17109125 [0,2,0,0,0,0|0,0,0]=2 6590 B12R1.19 OC(=O)Cc1ccc(c(c1)C)N Amb16185707 [0,2,0,0,0,0|0,0,0]=2 6591 B12R1.19 OC(=O)Cc1ccc(c(c1)C)O Amb16206733 [0,2,0,0,0,0|0,0,0]=2 6592 B12R1.19 OC(=O)Cc1ccc(c(c1)Cl)C Amb17470673 [0,2,0,0,0,0|0,0,0]=2 6593 B12R1.19 OC(=O)Cc1ccc(c(c1)F)Cl Amb10602668 [0,2,0,0,0,0|0,0,0]=2 6594 B12R1.19 OC(=O)Cc1ccc(c(c1)F)F Amb2234793 [0,2,0,0,0,0|0,0,0]=2 6595 B12R1.19 OC(=O)Cc1ccc(c(c1)I)N Amb16230543 [0,2,0,0,0,0|0,0,0]=2 6596 B12R1.19 OC(=O)Cc1ccc(c(c1)N)C Amb16185694 [0,2,0,0,0,0|0,0,0]=2 6597 B12R1.19 OC(=O)Cc1ccc(c(c1)N)N Amb17202020 [0,2,0,0,0,0|0,0,0]=2 6598 B12R1.19 OC(=O)Cc1ccc(c(c1)N)O Amb2420226 [0,2,0,0,0,0|0,0,0]=2 6599 B12R1.19 OC(=S)Cc1cc(F)c(F)cc1 Amb24097415 [0,2,0,0,0,0|0,1,0]=3 6600 B12R1.19 Oc1[n]cc(CC(O)=O)cc1Br Amb25212898 [0,2,0,0,0,0|1,0,0]=3 6601 B12R1.19 Oc1cc(CC(=O)Cl)ccc1O Amb24093868 [0,2,0,0,0,0|1,0,0]=3 6602 B12R1.19 Oc1cc(CC(O)=O)[n]cc1Cl Amb25267820 [0,2,0,0,0,0|1,0,0]=3 6603 B12R1.19 Oc1cc(CC(O)=O)ccc1Cl Amb23401349 [0,2,0,0,0,0|0,0,0]=2 6604 B12R1.19 Oc1cc(CC(O)=O)ccc1F Amb24066067 [0,2,0,0,0,0|0,0,0]=2 6605 B12R1.19 Oc1ccc(CC(O)=O)[n]c1Cl Amb24559596 [0,2,0,0,0,0|1,0,0]=3 6606 B12R1.19 Oc1ccc(CC(O)=O)[n]c1F Amb24756868 [0,2,0,0,0,0|1,0,0]=3 6607 B12R1.19 [18OH][13C](=[18O])Cc1ccc(c(c1)O)O Amb17613084 [0,2,0,0,0,0|0,0,0]=2 6608 B12R1.19 [O-]C(=O)Cc1cc(F)c(F)cc1 Amb24088365 [0,2,0,0,0,0|0,0,1]=3 6609 B12R1.19 [O-][N+](=O)Cc1cc(Cl)c(Cl)cc1 Amb23589316 [0,2,0,0,0,0|1,0,1]=4 6610 B12R1.20 BrC(c1ccc(cc1)F)C(=O)C Amb17142689 [0,2,0,0,0,0|1,0,0]=3 6611 B12R1.20 C=C(C(N)=O)c1ccc(Cl)cc1 Amb25829588 [0,2,0,0,0,0|1,0,1]=4 6612 B12R1.20 C=C(C(O)=O)c1ccc(N)[n]c1 Amb24415416 [0,2,0,0,0,0|1,0,1]=4 6613 B12R1.20 C=C(c1ccc(cc1)Br)C(=O)O Amb17322199 [0,2,0,0,0,0|0,0,1]=3 6614 B12R1.20 C=C(c1ccc(cc1)C)C(=O)O Amb17322163 [0,2,0,0,0,0|0,0,1]=3 6615 B12R1.20 C=C(c1ccc(cc1)Cl)C(=O)O Amb17322176 [0,2,0,0,0,0|0,0,1]=3 6616 B12R1.20 C=C(c1ccc(cc1)F)C(=O)O Amb17322166 [0,2,0,0,0,0|0,0,1]=3 6617 B12R1.20 CC(=C)C(N)c1ccc(Br)cc1 Amb24355767 [0,2,0,0,0,0|2,0,0]=4 6618 B12R1.20 CC(=C)C(N)c1ccc(Cl)cc1 Amb25035155 [0,2,0,0,0,0|2,0,0]=4 6619 B12R1.20 CC(=C)C(N)c1ccc(F)cc1 Amb24365829 [0,2,0,0,0,0|2,0,0]=4 6620 B12R1.20 CC(=C)C(N)c1ccc(I)cc1 Amb25823888 [0,2,0,0,0,0|2,0,0]=4 6621 B12R1.20 CC(=O)C(Br)c1ccc(N)cc1 Amb25364338 [0,2,0,0,0,0|1,0,0]=3 6622 B12R1.20 CC(=O)C(Br)c1ccc(O)cc1 Amb20620488 [0,2,0,0,0,0|1,0,0]=3 6623 B12R1.20 CC(=O)C(Br)c1ccc(S)cc1 Amb25351848 [0,2,0,0,0,0|1,0,0]=3 6624 B12R1.20 CC(=O)C(C)c1ccc(Br)cc1 Amb25043063 [0,2,0,0,0,0|1,0,0]=3 6625 B12R1.20 CC(=O)C(C)c1ccc(F)cc1 Amb25802289 [0,2,0,0,0,0|1,0,0]=3 6626 B12R1.20 CC(=O)C(N)c1ccc(Br)c[n]1 Amb25716232 [0,2,0,0,0,0|2,0,0]=4 6627 B12R1.20 CC(=O)C(N)c1ccc(Cl)c[n]1 Amb24349800 [0,2,0,0,0,0|2,0,0]=4 6628 B12R1.20 CC(=O)C(N)c1ccc(Cl)cc1 Amb24376685 [0,2,0,0,0,0|1,0,0]=3 6629 B12R1.20 CC(=O)C(N)c1ccc(F)[n]c1 Amb24487166 [0,2,0,0,0,0|2,0,0]=4 6630 B12R1.20 CC(=O)C(N)c1ccc(F)c[n]1 Amb24428783 [0,2,0,0,0,0|2,0,0]=4 6631 B12R1.20 CC(=O)C(N)c1ccc(I)[n]c1 Amb24427622 [0,2,0,0,0,0|2,0,0]=4 6632 B12R1.20 CC(=O)C(N)c1ccc(I)c[n]1 Amb24360228 [0,2,0,0,0,0|2,0,0]=4 6633 B12R1.20 CC(=O)C(N)c1ccc(I)cc1 Amb24483646 [0,2,0,0,0,0|1,0,0]=3 6634 B12R1.20 CC(=O)C(N)c1ccc(N)c[n]1 Amb25836837 [0,2,0,0,0,0|2,0,0]=4 6635 B12R1.20 CC(=O)C(N)c1ccc(N)cc1 Amb24487126 [0,2,0,0,0,0|1,0,0]=3 6636 B12R1.20 CC(=O)C(N)c1ccc(O)[n]c1 Amb24560279 [0,2,0,0,0,0|2,0,0]=4 6637 B12R1.20 CC(=O)C(N)c1ccc(O)c[n]1 Amb25076757 [0,2,0,0,0,0|2,0,0]=4 6638 B12R1.20 CC(=O)C(O)c1ccc(Br)cc1 Amb25816507 [0,2,0,0,0,0|1,0,0]=3 6639 B12R1.20 CC(=O)C(O)c1ccc(F)cc1 Amb24700376 [0,2,0,0,0,0|1,0,0]=3 6640 B12R1.20 CC(=O)C(O)c1ccc(O)cc1 Amb18646451 [0,2,0,0,0,0|1,0,0]=3 6641 B12R1.20 CC(=O)C(c1ccc(cc1)C)Br Amb17142262 [0,2,0,0,0,0|1,0,0]=3 6642 B12R1.20 CC(=O)C(c1ccc(cc1)C)Cl Amb17139039 [0,2,0,0,0,0|1,0,0]=3 6643 B12R1.20 CC(=O)N(N)c1ccc(Br)cc1 Amb18070169 [0,2,0,0,0,0|2,0,0]=4 6644 B12R1.20 CC(=O)N(N)c1ccc(Cl)cc1 Amb18564312 [0,2,0,0,0,0|2,0,0]=4 6645 B12R1.20 CC(=O)N(N)c1ccc(F)cc1 Amb18563834 [0,2,0,0,0,0|2,0,0]=4 6646 B12R1.20 CC(=O)N(O)c1ccc(O)cc1 Amb24567688 [0,2,0,0,0,0|2,0,0]=4 6647 B12R1.20 CC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25852918 [0,2,0,0,0,0|1,0,0]=3 6648 B12R1.20 CC(=O)[C@H](C)c1ccc(Br)cc1 Amb25848276 [0,2,0,0,0,0|1,0,0]=3 6649 B12R1.20 CC(=O)[C@H](O)c1ccc(Cl)cc1 Amb25371989 [0,2,0,0,0,0|1,0,0]=3 6650 B12R1.20 CC(=O)[C@H](O)c1ccc(O)cc1 Amb25807613 [0,2,0,0,0,0|1,0,0]=3 6651 B12R1.20 CC(C(=O)Cl)c1ccc(Br)cc1 Amb24483822 [0,2,0,0,0,0|1,0,0]=3 6652 B12R1.20 CC(C(C)O)c1ccc(I)cc1 Amb24353088 [0,2,0,0,0,0|1,0,1]=4 6653 B12R1.20 CC(C(N)=N)c1ccc(Br)cc1 Amb25799351 [0,2,0,0,0,0|2,0,0]=4 6654 B12R1.20 CC(C(N)=O)c1ccc(O)cc1 Amb24364677 [0,2,0,0,0,0|1,0,0]=3 6655 B12R1.20 CC(C(N)=S)c1ccc(Br)cc1 Amb24570080 [0,2,0,0,0,0|1,1,0]=4 6656 B12R1.20 CC(C(O)=O)N1C=CC(=O)C=C1 Amb18534254 [0,2,0,0,0,0|1,0,0]=3 6657 B12R1.20 CC(C(O)=O)c1[n]cc(Br)c[n]1 Amb24677163 [0,2,0,0,0,0|2,0,0]=4 6658 B12R1.20 CC(C(O)=O)c1[n]cc(Cl)c[n]1 Amb24687285 [0,2,0,0,0,0|2,0,0]=4 6659 B12R1.20 CC(C(O)=O)c1ccc(C)cc1 Amb17678847 [0,2,0,0,0,0|0,0,0]=2 6660 B12R1.20 CC(C(O)=O)c1ccc(Cl)[n]c1 Amb19944615 [0,2,0,0,0,0|1,0,0]=3 6661 B12R1.20 CC(C(O)=O)c1ccc(I)cc1 Amb20619418 [0,2,0,0,0,0|0,0,0]=2 6662 B12R1.20 CC(C(O)=O)c1ccc(N)cc1 Amb24113246 [0,2,0,0,0,0|0,0,0]=2 6663 B12R1.20 CC(O)C(F)c1ccc(Cl)cc1 Amb25317259 [0,2,0,0,0,0|1,0,1]=4 6664 B12R1.20 CC(O)C(N)c1ccc(I)cc1 Amb24400403 [0,2,0,0,0,0|1,0,1]=4 6665 B12R1.20 CC(O)C(N)c1ccc(S)cc1 Amb24377200 [0,2,0,0,0,0|1,0,1]=4 6666 B12R1.20 CC(O)C(O)c1ccc(Cl)cc1 Amb25107771 [0,2,0,0,0,0|1,0,1]=4 6667 B12R1.20 CC(O)C(O)c1ccc(O)cc1 Amb22329663 [0,2,0,0,0,0|1,0,1]=4 6668 B12R1.20 CC(O)[C@@H](N)c1ccc(Cl)cc1 Amb24386533 [0,2,0,0,0,0|1,0,1]=4 6669 B12R1.20 CC(O)[C@@H](N)c1ccc(N)cc1 Amb24470997 [0,2,0,0,0,0|1,0,1]=4 6670 B12R1.20 CC(O)[C@@H](N)c1ccc(O)cc1 Amb25342137 [0,2,0,0,0,0|1,0,1]=4 6671 B12R1.20 CC(O)[C@@H](N)c1ccc(S)cc1 Amb25126099 [0,2,0,0,0,0|1,0,1]=4 6672 B12R1.20 CC(O)[C@H](N)c1ccc(Br)cc1 Amb25850041 [0,2,0,0,0,0|1,0,1]=4 6673 B12R1.20 CC(O)[C@H](N)c1ccc(Cl)cc1 Amb24413930 [0,2,0,0,0,0|1,0,1]=4 6674 B12R1.20 CC(O)[C@H](N)c1ccc(O)cc1 Amb24554138 [0,2,0,0,0,0|1,0,1]=4 6675 B12R1.20 CC(c1ccc(N)cc1)C(N)=O Amb25806999 [0,2,0,0,0,0|1,0,0]=3 6676 B12R1.20 CC(c1ccc(cc1)Br)C(=O)O Amb17087424 [0,2,0,0,0,0|0,0,0]=2 6677 B12R1.20 CC(c1ccc(cc1)N)C(=O)O Amb2438888 [0,2,0,0,0,0|0,0,0]=2 6678 B12R1.20 CN(C(=O)Cl)c1ccc(F)cc1 Amb25718037 [0,2,0,0,0,0|2,0,0]=4 6679 B12R1.20 CN(C(N)=O)c1ccc(F)cc1 Amb18793023 [0,2,0,0,0,0|2,0,0]=4 6680 B12R1.20 CN(c1ccc(cc1)O)C(=O)C Amb2575449 [0,2,0,0,0,0|2,0,0]=4 6681 B12R1.20 C[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb24182093 [0,2,0,0,0,0|0,0,0]=2 6682 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(Br)cc1 Amb24382068 [0,2,0,0,0,0|1,0,1]=4 6683 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(N)cc1 Amb24537803 [0,2,0,0,0,0|1,0,1]=4 6684 B12R1.20 C[C@@H](O)[C@@H](O)c1ccc(Cl)cc1 Amb25823078 [0,2,0,0,0,0|1,0,1]=4 6685 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(Br)cc1 Amb25055183 [0,2,0,0,0,0|1,0,1]=4 6686 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(F)cc1 Amb25335384 [0,2,0,0,0,0|1,0,1]=4 6687 B12R1.20 C[C@@H](O)[C@H](O)c1ccc(O)cc1 Amb24584477 [0,2,0,0,0,0|1,0,1]=4 6688 B12R1.20 C[C@@H](c1ccc(N)cc1)C(N)=O Amb25141393 [0,2,0,0,0,0|1,0,0]=3 6689 B12R1.20 C[C@@H](c1ccc(O)cc1)C(O)=O Amb21855850 [0,2,0,0,0,0|0,0,0]=2 6690 B12R1.20 C[C@H](C(N)=O)c1ccc(Cl)cc1 Amb24723034 [0,2,0,0,0,0|1,0,0]=3 6691 B12R1.20 C[C@H](C(N)=O)c1ccc(F)cc1 Amb24401577 [0,2,0,0,0,0|1,0,0]=3 6692 B12R1.20 C[C@H](C(O)=O)c1ccc(Cl)cc1 Amb24740781 [0,2,0,0,0,0|0,0,0]=2 6693 B12R1.20 C[C@H](C(O)=O)c1ccc(N)cc1 Amb25708326 [0,2,0,0,0,0|0,0,0]=2 6694 B12R1.20 C[C@H](O)[C@@H](F)c1ccc(F)cc1 Amb25221387 [0,2,0,0,0,0|1,0,1]=4 6695 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(Cl)cc1 Amb25669590 [0,2,0,0,0,0|1,0,1]=4 6696 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(I)cc1 Amb25369710 [0,2,0,0,0,0|1,0,1]=4 6697 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(N)cc1 Amb24567692 [0,2,0,0,0,0|1,0,1]=4 6698 B12R1.20 C[C@H](O)[C@@H](O)c1ccc(Cl)cc1 Amb25058607 [0,2,0,0,0,0|1,0,1]=4 6699 B12R1.20 C[C@H](O)[C@H](N)c1ccc(Br)cc1 Amb25805244 [0,2,0,0,0,0|1,0,1]=4 6700 B12R1.20 C[C@H](O)[C@H](N)c1ccc(I)cc1 Amb25696576 [0,2,0,0,0,0|1,0,1]=4 6701 B12R1.20 C[C@H](O)[C@H](N)c1ccc(O)cc1 Amb24377198 [0,2,0,0,0,0|1,0,1]=4 6702 B12R1.20 C[C@H](O)[C@H](N)c1ccc(S)cc1 Amb25340511 [0,2,0,0,0,0|1,0,1]=4 6703 B12R1.20 C[C@H](O)[C@H](O)c1ccc(Cl)cc1 Amb25788065 [0,2,0,0,0,0|1,0,1]=4 6704 B12R1.20 C[C@H](O)[C@H](O)c1ccc(F)cc1 Amb25820217 [0,2,0,0,0,0|1,0,1]=4 6705 B12R1.20 C[C@H](c1ccc(N)cc1)C(N)=O Amb24665804 [0,2,0,0,0,0|1,0,0]=3 6706 B12R1.20 C[C@H](c1ccc(cc1)F)C(=O)O Amb10843989 [0,2,0,0,0,0|0,0,0]=2 6707 B12R1.20 Cc1c[n]c(cc1)C(=O)C(O)=O Amb24684067 [0,2,0,0,0,0|1,0,1]=4 6708 B12R1.20 Cc1ccc([n]c1)[C@@H](N)C(O)=O Amb24485647 [0,2,0,0,0,0|1,0,0]=3 6709 B12R1.20 Cc1ccc([n]c1)[C@H](N)C(O)=O Amb24358612 [0,2,0,0,0,0|1,0,0]=3 6710 B12R1.20 Cc1ccc(c[n]1)C(C)C(O)=O Amb18828385 [0,2,0,0,0,0|1,0,0]=3 6711 B12R1.20 Cc1ccc(c[n]1)C(F)C([O-])=O Amb24117186 [0,2,0,0,0,0|1,0,1]=4 6712 B12R1.20 Cc1ccc(c[n]1)C(O)C(N)=O Amb25238036 [0,2,0,0,0,0|2,0,0]=4 6713 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)C Amb17400105 [0,2,0,0,0,0|1,0,1]=4 6714 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)Cl Amb24068590 [0,2,0,0,0,0|1,0,1]=4 6715 B12R1.20 Cc1ccc(cc1)C(=O)C(N)=O Amb24100697 [0,2,0,0,0,0|1,0,1]=4 6716 B12R1.20 Cc1ccc(cc1)C(C)C(=O)Cl Amb24425440 [0,2,0,0,0,0|1,0,0]=3 6717 B12R1.20 Cc1ccc(cc1)C(C)C(N)=N Amb25081542 [0,2,0,0,0,0|2,0,0]=4 6718 B12R1.20 Cc1ccc(cc1)C(C)C(N)=O Amb25288853 [0,2,0,0,0,0|1,0,0]=3 6719 B12R1.20 Cc1ccc(cc1)C(C)[N+]([O-])=O Amb24064769 [0,2,0,0,0,0|1,0,1]=4 6720 B12R1.20 Cc1ccc(cc1)C(Cl)C(N)=O Amb19074654 [0,2,0,0,0,0|1,0,0]=3 6721 B12R1.20 Cc1ccc(cc1)C(F)C(O)=O Amb25320951 [0,2,0,0,0,0|0,0,0]=2 6722 B12R1.20 Cc1ccc(cc1)C(N)C(C)=C Amb25375128 [0,2,0,0,0,0|2,0,0]=4 6723 B12R1.20 Cc1ccc(cc1)C(N)P(O)O Amb24468804 [0,2,0,0,0,0|1,0,1]=4 6724 B12R1.20 Cc1ccc(cc1)C(O)C(C)=C Amb25098914 [0,2,0,0,0,0|2,0,0]=4 6725 B12R1.20 Cc1ccc(cc1)C(O)C(N)=N Amb24084346 [0,2,0,0,0,0|2,0,0]=4 6726 B12R1.20 Cc1ccc(cc1)C(O)C(N)=O Amb18800898 [0,2,0,0,0,0|1,0,0]=3 6727 B12R1.20 Cc1ccc(cc1)N(C)C(C)=O Amb25141388 [0,2,0,0,0,0|2,0,0]=4 6728 B12R1.20 Cc1ccc(cc1)N(C)C(N)=O Amb18788283 [0,2,0,0,0,0|2,0,0]=4 6729 B12R1.20 Cc1ccc(cc1)N(N)C(C)=O Amb18563638 [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.20 Cc1ccc(cc1)N(N)C(C)=O Amb24072440 [0,2,0,0,0,0|2,0,0]=4 6731 B12R1.20 Cc1ccc(cc1)[C@@H](C)C(O)=O Amb22736712 [0,2,0,0,0,0|0,0,0]=2 6732 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(N)=O Amb24341621 [0,2,0,0,0,0|1,0,0]=3 6733 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(O)=O Amb22747999 [0,2,0,0,0,0|0,0,0]=2 6734 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(N)=N Amb25331476 [0,2,0,0,0,0|2,0,0]=4 6735 B12R1.20 Cc1ccc(cc1)[C@@H](O)[C@H](C)O Amb24431029 [0,2,0,0,0,0|1,0,1]=4 6736 B12R1.20 Cc1ccc(cc1)[C@H](C)C(O)=O Amb22736713 [0,2,0,0,0,0|0,0,0]=2 6737 B12R1.20 Cc1ccc(cc1)[C@H](C)[C@@H](C)O Amb25343914 [0,2,0,0,0,0|1,0,1]=4 6738 B12R1.20 Cc1ccc(cc1)[C@H](C)[C@H](C)O Amb24412147 [0,2,0,0,0,0|1,0,1]=4 6739 B12R1.20 Cc1ccc(cc1)[C@H](O)C(C)=O Amb25320143 [0,2,0,0,0,0|1,0,0]=3 6740 B12R1.20 Cc1ccc(cc1)[C@H](O)C(N)=N Amb24738424 [0,2,0,0,0,0|2,0,0]=4 6741 B12R1.20 Cc1ccc(cc1)[C@H](O)[C@@H](C)O Amb25816305 [0,2,0,0,0,0|1,0,1]=4 6742 B12R1.20 Cc1ccc(cc1)[C@H](O)[C@H](C)O Amb25158064 [0,2,0,0,0,0|1,0,1]=4 6743 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)C Amb17477759 [0,2,0,0,0,0|1,0,0]=3 6744 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)N Amb1199712 [0,2,0,0,0,0|1,0,0]=3 6745 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)O Amb17261128 [0,2,0,0,0,0|0,0,0]=2 6746 B12R1.20 ClC(c1ccc(cc1)C)C(=O)Cl Amb17506249 [0,2,0,0,0,0|1,0,0]=3 6747 B12R1.20 ClC(c1ccc(cc1)C)C(=O)O Amb17234143 [0,2,0,0,0,0|0,0,0]=2 6748 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)C Amb17477762 [0,2,0,0,0,0|1,0,0]=3 6749 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)O Amb17238287 [0,2,0,0,0,0|0,0,0]=2 6750 B12R1.20 ClC(c1ccc(cc1)F)C(=O)C Amb17139154 [0,2,0,0,0,0|1,0,0]=3 6751 B12R1.20 ClC(c1ccc(cc1)F)C(=O)Cl Amb17098059 [0,2,0,0,0,0|1,0,0]=3 6752 B12R1.20 ClC(c1ccc(cc1)F)C(=O)O Amb17234610 [0,2,0,0,0,0|0,0,0]=2 6753 B12R1.20 NC(=N)C(O)c1ccc(Cl)cc1 Amb25667224 [0,2,0,0,0,0|2,0,0]=4 6754 B12R1.20 NC(=N)C(O)c1ccc(F)cc1 Amb25224827 [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.20 NC(=O)C(=O)c1ccc(Br)cc1 Amb21963977 [0,2,0,0,0,0|1,0,1]=4 6756 B12R1.20 NC(=O)C(=O)c1ccc(F)cc1 Amb25856862 [0,2,0,0,0,0|1,0,1]=4 6757 B12R1.20 NC(=O)C(=O)c1ccc(O)cc1 Amb24485532 [0,2,0,0,0,0|1,0,1]=4 6758 B12R1.20 NC(=O)C(Br)c1ccc(Br)cc1 Amb23510123 [0,2,0,0,0,0|1,0,0]=3 6759 B12R1.20 NC(=O)C(Cl)c1ccc(F)cc1 Amb18329809 [0,2,0,0,0,0|1,0,0]=3 6760 B12R1.20 NC(=O)C(Cl)c1ccc(I)cc1 Amb24373016 [0,2,0,0,0,0|1,0,0]=3 6761 B12R1.20 NC(=O)C(N)c1ccc(Br)cc1 Amb22478994 [0,2,0,0,0,0|1,0,0]=3 6762 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb19400288 [0,2,0,0,0,0|1,0,0]=3 6763 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb22433459 [0,2,0,0,0,0|1,0,0]=3 6764 B12R1.20 NC(=O)C(N)c1ccc(F)cc1 Amb22469878 [0,2,0,0,0,0|1,0,0]=3 6765 B12R1.20 NC(=O)C(O)c1ccc(Br)cc1 Amb24100617 [0,2,0,0,0,0|1,0,0]=3 6766 B12R1.20 NC(=O)C(O)c1ccc(Cl)cc1 Amb19075669 [0,2,0,0,0,0|1,0,0]=3 6767 B12R1.20 NC(=O)C(O)c1ccc(F)cc1 Amb18806073 [0,2,0,0,0,0|1,0,0]=3 6768 B12R1.20 NC(=O)C(O)c1ccc(I)cc1 Amb25700495 [0,2,0,0,0,0|1,0,0]=3 6769 B12R1.20 NC(=O)C(O)c1ccc(O)cc1 Amb18805580 [0,2,0,0,0,0|1,0,0]=3 6770 B12R1.20 NC(=O)N(O)c1ccc(Cl)cc1 Amb25201508 [0,2,0,0,0,0|2,0,0]=4 6771 B12R1.20 NC(=O)N(O)c1ccc(F)cc1 Amb25096455 [0,2,0,0,0,0|2,0,0]=4 6772 B12R1.20 NC(=O)[C@@H](N)c1ccc(Cl)cc1 Amb25152633 [0,2,0,0,0,0|1,0,0]=3 6773 B12R1.20 NC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25346222 [0,2,0,0,0,0|1,0,0]=3 6774 B12R1.20 NC(=O)[C@H](N)c1ccc(Cl)cc1 Amb25724996 [0,2,0,0,0,0|1,0,0]=3 6775 B12R1.20 NC(=O)[C@H](O)c1ccc(Cl)cc1 Amb24398035 [0,2,0,0,0,0|1,0,0]=3 6776 B12R1.20 NC(=S)C(N)c1ccc(F)cc1 Amb19374912 [0,2,0,0,0,0|1,1,0]=4 6777 B12R1.20 NC(=S)C(O)c1ccc(O)cc1 Amb24487581 [0,2,0,0,0,0|1,1,0]=4 6778 B12R1.20 NC(C(=O)Cl)c1ccc(O)cc1 Amb25100939 [0,2,0,0,0,0|1,0,0]=3 6779 B12R1.20 NC(C(O)=O)c1c[n]c(Cl)[n]c1 Amb25075738 [0,2,0,0,0,0|2,0,0]=4 6780 B12R1.20 NC(C(O)=O)c1ccc(Cl)c[n]1 Amb24081006 [0,2,0,0,0,0|1,0,0]=3 6781 B12R1.20 NC(C(O)=O)c1ccc(I)[n]c1 Amb24759938 [0,2,0,0,0,0|1,0,0]=3 6782 B12R1.20 NC(C(O)=O)c1ccc(I)cc1 Amb22899108 [0,2,0,0,0,0|0,0,0]=2 6783 B12R1.20 NC(C(O)=O)c1ccc(S)cc1 Amb24504681 [0,2,0,0,0,0|0,0,0]=2 6784 B12R1.20 NC(c1ccc(O)[n]c1)C(O)=O Amb24674057 [0,2,0,0,0,0|1,0,0]=3 6785 B12R1.20 NC(c1ccc(O)c[n]1)C(O)=O Amb24629017 [0,2,0,0,0,0|1,0,0]=3 6786 B12R1.20 NC(c1ccc(O)cc1)P(O)=O Amb25047232 [0,2,0,0,0,0|1,0,0]=3 6787 B12R1.20 NC(c1ccc(cc1)Br)C(=O)N Amb13951626 [0,2,0,0,0,0|1,0,0]=3 6788 B12R1.20 NC(c1ccc(cc1)Br)C(=O)O Amb1837854 [0,2,0,0,0,0|0,0,0]=2 6789 B12R1.20 NC(c1ccc(cc1)Br)C(O)C Amb17248848 [0,2,0,0,0,0|1,0,1]=4 6790 B12R1.20 NC(c1ccc(cc1)C)C(=O)N Amb17334619 [0,2,0,0,0,0|1,0,0]=3 6791 B12R1.20 NC(c1ccc(cc1)C)C(=O)O Amb2234620 [0,2,0,0,0,0|0,0,0]=2 6792 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)N Amb17335727 [0,2,0,0,0,0|1,0,0]=3 6793 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)O Amb1837642 [0,2,0,0,0,0|0,0,0]=2 6794 B12R1.20 NC(c1ccc(cc1)Cl)C(O)C Amb17234268 [0,2,0,0,0,0|1,0,1]=4 6795 B12R1.20 NC(c1ccc(cc1)F)C(=O)N Amb17334711 [0,2,0,0,0,0|1,0,0]=3 6796 B12R1.20 NC(c1ccc(cc1)I)C(=O)O Amb2234604 [0,2,0,0,0,0|0,0,0]=2 6797 B12R1.20 NC(c1ccc(cc1)O)C(=O)N Amb17334665 [0,2,0,0,0,0|1,0,0]=3 6798 B12R1.20 N[C@@H](C(=O)Cl)c1ccc(O)cc1 Amb24595943 [0,2,0,0,0,0|1,0,0]=3 6799 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)[n]c1 Amb25309311 [0,2,0,0,0,0|1,0,0]=3 6800 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)c[n]1 Amb25824057 [0,2,0,0,0,0|1,0,0]=3 6801 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)cc1 Amb22745984 [0,2,0,0,0,0|0,0,0]=2 6802 B12R1.20 N[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb19889601 [0,2,0,0,0,0|0,0,0]=2 6803 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)[n]c1 Amb25272929 [0,2,0,0,0,0|1,0,0]=3 6804 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)c[n]1 Amb25765185 [0,2,0,0,0,0|1,0,0]=3 6805 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)cc1 Amb19889896 [0,2,0,0,0,0|0,0,0]=2 6806 B12R1.20 N[C@@H](C(O)=O)c1ccc(I)cc1 Amb22745451 [0,2,0,0,0,0|0,0,0]=2 6807 B12R1.20 N[C@@H](c1ccc(O)[n]c1)C(O)=O Amb24365264 [0,2,0,0,0,0|1,0,0]=3 6808 B12R1.20 N[C@@H](c1ccc(cc1)C)C(=O)O Amb17621414 [0,2,0,0,0,0|0,0,0]=2 6809 B12R1.20 N[C@H](C(=O)Cl)c1ccc(O)cc1 Amb25141079 [0,2,0,0,0,0|1,0,0]=3 6810 B12R1.20 N[C@H](C(O)=O)c1ccc(Br)c[n]1 Amb24451007 [0,2,0,0,0,0|1,0,0]=3 6811 B12R1.20 N[C@H](C(O)=O)c1ccc(Cl)[n]c1 Amb25299360 [0,2,0,0,0,0|1,0,0]=3 6812 B12R1.20 N[C@H](C(O)=O)c1ccc(F)[n]c1 Amb24691564 [0,2,0,0,0,0|1,0,0]=3 6813 B12R1.20 N[C@H](C(O)=O)c1ccc(F)c[n]1 Amb24665825 [0,2,0,0,0,0|1,0,0]=3 6814 B12R1.20 N[C@H](C(O)=O)c1ccc(F)cc1 Amb19889897 [0,2,0,0,0,0|0,0,0]=2 6815 B12R1.20 N[C@H](C(O)=O)c1ccc(I)cc1 Amb24653870 [0,2,0,0,0,0|0,0,0]=2 6816 B12R1.20 N[C@H](c1ccc(O)[n]c1)C(O)=O Amb24692602 [0,2,0,0,0,0|1,0,0]=3 6817 B12R1.20 N[C@H](c1ccc(cc1)O)C(=O)N Amb15741205 [0,2,0,0,0,0|1,0,0]=3 6818 B12R1.20 Nc1ccc([n]c1)C(N)C(O)=O Amb25289878 [0,2,0,0,0,0|1,0,0]=3 6819 B12R1.20 Nc1ccc([n]c1)[C@@H](N)C(O)=O Amb24341698 [0,2,0,0,0,0|1,0,0]=3 6820 B12R1.20 Nc1ccc(c[n]1)C(O)C(O)=O Amb24591814 [0,2,0,0,0,0|1,0,0]=3 6821 B12R1.20 Nc1ccc(cc1)C(F)C(O)=O Amb25376043 [0,2,0,0,0,0|0,0,0]=2 6822 B12R1.20 Nc1ccc(cc1)C(N)C(O)=O Amb18646484 [0,2,0,0,0,0|0,0,0]=2 6823 B12R1.20 Nc1ccc(cc1)C(O)C(N)=O Amb24100608 [0,2,0,0,0,0|1,0,0]=3 6824 B12R1.20 Nc1ccc(cc1)C(O)C(O)=O Amb20668152 [0,2,0,0,0,0|0,0,0]=2 6825 B12R1.20 Nc1ccc(cc1)C(S)C(O)=O Amb25299470 [0,2,0,0,0,0|0,0,0]=2 6826 B12R1.20 Nc1ccc(cc1)[C@@H](N)C(O)=O Amb22745344 [0,2,0,0,0,0|0,0,0]=2 6827 B12R1.20 Nc1ccc(cc1)[C@H](N)C(O)=O Amb24568498 [0,2,0,0,0,0|0,0,0]=2 6828 B12R1.20 O=C(Br)C(Br)c1ccc(Br)cc1 Amb23536400 [0,2,0,0,0,0|1,0,0]=3 6829 B12R1.20 O=C(Cl)C(=O)c1ccc(Cl)cc1 Amb24068531 [0,2,0,0,0,0|1,0,1]=4 6830 B12R1.20 O=C(Cl)C(=O)c1ccc(F)cc1 Amb24068567 [0,2,0,0,0,0|1,0,1]=4 6831 B12R1.20 O=C(c1ccc(cc1)C)C(=O)O Amb1220932 [0,2,0,0,0,0|0,0,1]=3 6832 B12R1.20 O=C(c1ccc(cc1)F)C(=O)C Amb17400192 [0,2,0,0,0,0|1,0,1]=4 6833 B12R1.20 OC(=O)C(Br)c1ccc(Br)cc1 Amb23510124 [0,2,0,0,0,0|0,0,0]=2 6834 B12R1.20 OC(=O)C(Br)c1ccc(Cl)cc1 Amb18665883 [0,2,0,0,0,0|0,0,0]=2 6835 B12R1.20 OC(=O)C(Br)c1ccc(F)c[n]1 Amb24420865 [0,2,0,0,0,0|1,0,0]=3 6836 B12R1.20 OC(=O)C(Br)c1ccc(F)cc1 Amb22337461 [0,2,0,0,0,0|0,0,0]=2 6837 B12R1.20 OC(=O)C(F)c1ccc(Cl)cc1 Amb24355948 [0,2,0,0,0,0|0,0,0]=2 6838 B12R1.20 OC(=O)C(O)c1ccc(Br)c[n]1 Amb25083758 [0,2,0,0,0,0|1,0,0]=3 6839 B12R1.20 OC(=O)C(O)c1ccc(I)cc1 Amb25798219 [0,2,0,0,0,0|0,0,0]=2 6840 B12R1.20 OC(=O)C(S)c1ccc(Cl)cc1 Amb24668947 [0,2,0,0,0,0|0,0,0]=2 6841 B12R1.20 OC(=O)[C@@H](F)c1ccc(Br)cc1 Amb25112439 [0,2,0,0,0,0|0,0,0]=2 6842 B12R1.20 OC(=O)[C@@H](O)c1ccc(Br)cc1 Amb22737259 [0,2,0,0,0,0|0,0,0]=2 6843 B12R1.20 OC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb22388650 [0,2,0,0,0,0|0,0,0]=2 6844 B12R1.20 OC(=O)[C@@H](O)c1ccc(F)cc1 Amb25138794 [0,2,0,0,0,0|0,0,0]=2 6845 B12R1.20 OC(=O)[C@@H](S)c1ccc(Cl)cc1 Amb24497033 [0,2,0,0,0,0|0,0,0]=2 6846 B12R1.20 OC(=O)[C@@H](c1ccc(cc1)O)C Amb10843991 [0,2,0,0,0,0|0,0,0]=2 6847 B12R1.20 OC(=O)[C@H](F)c1ccc(Br)cc1 Amb25117435 [0,2,0,0,0,0|0,0,0]=2 6848 B12R1.20 OC(=O)[C@H](O)c1ccc(Br)cc1 Amb22737260 [0,2,0,0,0,0|0,0,0]=2 6849 B12R1.20 OC(=O)[C@H](O)c1ccc(F)cc1 Amb24059762 [0,2,0,0,0,0|0,0,0]=2 6850 B12R1.20 OC(c1ccc(cc1)F)C(=O)O Amb1218322 [0,2,0,0,0,0|0,0,0]=2 6851 B12R1.20 O[C@H](c1ccc(cc1)C)C(=O)O Amb10808019 [0,2,0,0,0,0|0,0,0]=2 6852 B12R1.20 Oc1ccc(cc1)C(=O)C(=O)Cl Amb24068578 [0,2,0,0,0,0|1,0,1]=4 6853 B12R1.20 Oc1ccc(cc1)C(=O)C(=O)O Amb16231521 [0,2,0,0,0,0|0,0,1]=3 6854 B12R1.20 Oc1ccc(cc1)[C@@H](O)C(O)=O Amb22745764 [0,2,0,0,0,0|0,0,0]=2 6855 B12R1.20 [NH3+]C(C(=O)Cl)c1ccc(O)cc1 Amb24104191 [0,2,0,0,0,0|1,0,0]=3 6856 B12R1.20 [O-]C(=O)C(=O)c1ccc(O)cc1 Amb19929368 [0,2,0,0,0,0|0,0,2]=4 6857 B12R1.20 [O-]C(=O)C(O)c1ccc(O)cc1 Amb21964739 [0,2,0,0,0,0|0,0,1]=3 6858 B12R1.20 [O-]C(=O)C(O)c1ccc(O)cc1 Amb22899121 [0,2,0,0,0,0|0,0,1]=3 6859 B12R1.20 [O-]S(=O)C(O)c1ccc(O)cc1 Amb24492510 [0,2,0,0,0,0|1,0,1]=4 6860 B12R1.49 BrCC(=O)Nc1ccc(cc1)O Amb17323368 [0,2,0,0,0,0|2,0,0]=4 6861 B12R1.49 C#CC(=O)Cc1ccc(Br)cc1 Amb24700806 [0,2,0,0,0,0|1,0,0]=3 6862 B12R1.49 C#CC(=O)Cc1ccc(Cl)cc1 Amb25710197 [0,2,0,0,0,0|1,0,0]=3 6863 B12R1.49 C#CC(=O)Cc1ccc(F)cc1 Amb25340982 [0,2,0,0,0,0|1,0,0]=3 6864 B12R1.49 C#CC(=O)Nc1ccc(Cl)cc1 Amb25216189 [0,2,0,0,0,0|2,0,0]=4 6865 B12R1.49 C#CC(=O)Nc1ccc(F)cc1 Amb24606878 [0,2,0,0,0,0|2,0,0]=4 6866 B12R1.49 C#CC(=O)Nc1ccc(I)cc1 Amb24658895 [0,2,0,0,0,0|2,0,0]=4 6867 B12R1.49 C#CC(=O)Nc1ccc(N)cc1 Amb25732765 [0,2,0,0,0,0|2,0,0]=4 6868 B12R1.49 C#CC(=O)Oc1ccc(Cl)cc1 Amb25323485 [0,2,0,0,0,0|2,0,0]=4 6869 B12R1.49 C#CC(=O)Oc1ccc(F)cc1 Amb24555375 [0,2,0,0,0,0|2,0,0]=4 6870 B12R1.49 C#CC(O)Cc1ccc(Br)cc1 Amb25756870 [0,2,0,0,0,0|1,0,1]=4 6871 B12R1.49 C#CC(O)Cc1ccc(Cl)cc1 Amb25756868 [0,2,0,0,0,0|1,0,1]=4 6872 B12R1.49 C=C(Cc1ccc(Cl)cc1)C=O Amb25733131 [0,2,0,0,0,0|1,0,0]=3 6873 B12R1.49 C=C(Cc1ccc(F)cc1)C=O Amb24380075 [0,2,0,0,0,0|1,0,0]=3 6874 B12R1.49 C=CC(=O)Cc1ccc(Br)cc1 Amb25710195 [0,2,0,0,0,0|1,0,0]=3 6875 B12R1.49 C=CC(=O)Cc1ccc(Cl)cc1 Amb25715125 [0,2,0,0,0,0|1,0,0]=3 6876 B12R1.49 C=CC(=O)Nc1ccc(N)cc1 Amb24483453 [0,2,0,0,0,0|2,0,0]=4 6877 B12R1.49 C=CC(=O)Nc1ccc(cc1)[Hg+] Amb17607706 [0,2,0,0,0,0|2,0,0]=4 6878 B12R1.49 C=CC(=O)Oc1ccc(Br)cc1 Amb22497276 [0,2,0,0,0,0|2,0,0]=4 6879 B12R1.49 C=CC(=O)Oc1ccc(Cl)cc1 Amb17933976 [0,2,0,0,0,0|2,0,0]=4 6880 B12R1.49 C=CC(=O)Oc1ccc(F)cc1 Amb25281891 [0,2,0,0,0,0|2,0,0]=4 6881 B12R1.49 C=CC(O)Cc1ccc(Br)cc1 Amb24474552 [0,2,0,0,0,0|1,0,1]=4 6882 B12R1.49 C=CC(O)Cc1ccc(Cl)cc1 Amb25686541 [0,2,0,0,0,0|1,0,1]=4 6883 B12R1.49 C=CC(O)Cc1ccc(F)cc1 Amb25832059 [0,2,0,0,0,0|1,0,1]=4 6884 B12R1.49 C=CC(O)Cc1ccc(O)cc1 Amb25735226 [0,2,0,0,0,0|1,0,1]=4 6885 B12R1.49 CC(CO)Cc1ccc(I)cc1 Amb25711706 [0,2,0,0,0,0|1,0,1]=4 6886 B12R1.49 CC(Cc1ccc(Br)cc1)C=O Amb25060263 [0,2,0,0,0,0|1,0,1]=4 6887 B12R1.49 CC(Cc1ccc(Cl)cc1)C=O Amb18648716 [0,2,0,0,0,0|1,0,1]=4 6888 B12R1.49 CC(Cc1ccc(O)cc1)C=O Amb18646060 [0,2,0,0,0,0|1,0,1]=4 6889 B12R1.49 CC(Cc1ccc(O)cc1)CO Amb25770294 [0,2,0,0,0,0|1,0,1]=4 6890 B12R1.49 CCC(=O)CN1C=CC(=O)C=C1 Amb18788345 [0,2,0,0,0,0|2,0,0]=4 6891 B12R1.49 CCC(=O)Cc1ccc(I)cc1 Amb25229794 [0,2,0,0,0,0|1,0,0]=3 6892 B12R1.49 CCC(=O)Cc1ccc(O)cc1 Amb18646040 [0,2,0,0,0,0|1,0,0]=3 6893 B12R1.49 CCC(=O)Cc1ccc(cc1)Br Amb17477612 [0,2,0,0,0,0|1,0,0]=3 6894 B12R1.49 CCC(=O)Cc1ccc(cc1)C Amb17138536 [0,2,0,0,0,0|1,0,0]=3 6895 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl Amb17139038 [0,2,0,0,0,0|1,0,0]=3 6896 B12R1.49 CCC(=O)Cc1ccc(cc1)F Amb17138600 [0,2,0,0,0,0|1,0,0]=3 6897 B12R1.49 CCC(=O)N=C1C=CC(=O)C=C1 Amb24537744 [0,2,0,0,0,0|2,0,0]=4 6898 B12R1.49 CCC(=O)Nc1ccc(cc1)I Amb254968 [0,2,0,0,0,0|2,0,0]=4 6899 B12R1.49 CCC(=O)Nc1ccc(cc1)N Amb10187476 [0,2,0,0,0,0|2,0,0]=4 6900 B12R1.49 CCC(=O)Nc1ccc(cc1)N Amb1116465 [0,2,0,0,0,0|2,0,0]=4 6901 B12R1.49 CCC(=O)Nc1ccc(cc1)O Amb2041133 [0,2,0,0,0,0|2,0,0]=4 6902 B12R1.49 CCC(=O)Oc1ccc(I)cc1 Amb24430745 [0,2,0,0,0,0|2,0,0]=4 6903 B12R1.49 CCC(=O)Oc1ccc(N)cc1 Amb18646257 [0,2,0,0,0,0|2,0,0]=4 6904 B12R1.49 CCC(=O)Oc1ccc(O)cc1 Amb18646456 [0,2,0,0,0,0|2,0,0]=4 6905 B12R1.49 CCC(=O)Sc1ccc(cc1)C Amb2447238 [0,2,0,0,0,0|2,0,0]=4 6906 B12R1.49 CCC(Cc1ccc(cc1)Br)O Amb17477579 [0,2,0,0,0,0|1,0,1]=4 6907 B12R1.49 CCC(Cc1ccc(cc1)C)O Amb17138583 [0,2,0,0,0,0|1,0,1]=4 6908 B12R1.49 CCC(Cc1ccc(cc1)Cl)O Amb17139103 [0,2,0,0,0,0|1,0,1]=4 6909 B12R1.49 CCC(Cc1ccc(cc1)F)O Amb17138637 [0,2,0,0,0,0|1,0,1]=4 6910 B12R1.49 CCS(=O)Cc1ccc(F)cc1 Amb25160320 [0,2,0,0,0,0|2,0,0]=4 6911 B12R1.49 CCS(=O)Cc1ccc(N)cc1 Amb18974551 [0,2,0,0,0,0|2,0,0]=4 6912 B12R1.49 CN(Cc1ccc(Br)cc1)OC Amb25283954 [0,2,0,0,0,0|2,0,0]=4 6913 B12R1.49 CN(Cc1ccc(F)cc1)N=O Amb25238622 [0,2,0,0,0,0|2,0,0]=4 6914 B12R1.49 CN(Cc1ccc(O)cc1)C=O Amb18792633 [0,2,0,0,0,0|2,0,0]=4 6915 B12R1.49 CNC(=O)Cc1ccc(Br)c[n]1 Amb23586125 [0,2,0,0,0,0|2,0,0]=4 6916 B12R1.49 CNC(=O)Cc1ccc(Cl)[n]c1 Amb24351704 [0,2,0,0,0,0|2,0,0]=4 6917 B12R1.49 CNC(=O)Cc1ccc(F)c[n]1 Amb24719170 [0,2,0,0,0,0|2,0,0]=4 6918 B12R1.49 CNC(=O)Cc1ccc(I)cc1 Amb25680399 [0,2,0,0,0,0|1,0,0]=3 6919 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [0,2,0,0,0,0|1,0,0]=3 6920 B12R1.49 CNC(=O)Cc1ccc(S)cc1 Amb24346465 [0,2,0,0,0,0|1,0,0]=3 6921 B12R1.49 CNC(=O)Cc1ccc(cc1)C Amb1795465 [0,2,0,0,0,0|1,0,0]=3 6922 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb1117771 [0,2,0,0,0,0|1,0,0]=3 6923 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb15740907 [0,2,0,0,0,0|1,0,0]=3 6924 B12R1.49 CNC(=O)Nc1ccc(O)cc1 Amb21858114 [0,2,0,0,0,0|2,0,0]=4 6925 B12R1.49 CNC(=O)Nc1ccc(cc1)Br Amb1794857 [0,2,0,0,0,0|2,0,0]=4 6926 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl Amb1196554 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.49 CNC(=O)Oc1ccc(Cl)cc1 Amb22446687 [0,2,0,0,0,0|2,0,0]=4 6928 B12R1.49 CNC(=O)Oc1ccc(N)cc1 Amb24063598 [0,2,0,0,0,0|2,0,0]=4 6929 B12R1.49 COC(=N)Cc1ccc(Cl)cc1 Amb19057372 [0,2,0,0,0,0|1,0,0]=3 6930 B12R1.49 COC(=N)Cc1ccc(F)cc1 Amb18180127 [0,2,0,0,0,0|1,0,0]=3 6931 B12R1.49 COC(=N)Cc1ccc(O)cc1 Amb18792627 [0,2,0,0,0,0|1,0,0]=3 6932 B12R1.49 COC(=N)Nc1ccc(Cl)cc1 Amb25075628 [0,2,0,0,0,0|2,0,0]=4 6933 B12R1.49 COC(=O)C=C1C=CN(C)C=C1 Amb24099075 [0,2,0,0,0,0|1,0,1]=4 6934 B12R1.49 COC(=O)CN1C=CC(=O)C=C1 Amb18788533 [0,2,0,0,0,0|1,0,0]=3 6935 B12R1.49 COC(=O)C[n+]1ccc(cc1)C Amb10553711 [0,2,0,0,0,0|1,0,0]=3 6936 B12R1.49 COC(=O)C[n+]1ccc(cc1)C Amb2228082 [0,2,0,0,0,0|1,0,0]=3 6937 B12R1.49 COC(=O)Cc1[n]cc(Br)c[n]1 Amb22494764 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.49 COC(=O)Cc1[n]cc(F)c[n]1 Amb21857270 [0,2,0,0,0,0|2,0,0]=4 6939 B12R1.49 COC(=O)Cc1[n]cc(O)c[n]1 Amb20248625 [0,2,0,0,0,0|2,0,0]=4 6940 B12R1.49 COC(=O)Cc1c[n]c(N)c[n]1 Amb24452100 [0,2,0,0,0,0|2,0,0]=4 6941 B12R1.49 COC(=O)Cc1cc[n+](cc1)C Amb10553717 [0,2,0,0,0,0|1,0,0]=3 6942 B12R1.49 COC(=O)Cc1ccc(Br)c[n]1 Amb22388580 [0,2,0,0,0,0|1,0,0]=3 6943 B12R1.49 COC(=O)Cc1ccc(Cl)[n]c1 Amb22494153 [0,2,0,0,0,0|1,0,0]=3 6944 B12R1.49 COC(=O)Cc1ccc(Cl)c[n]1 Amb23437494 [0,2,0,0,0,0|1,0,0]=3 6945 B12R1.49 COC(=O)Cc1ccc(I)[n]c1 Amb25223569 [0,2,0,0,0,0|1,0,0]=3 6946 B12R1.49 COC(=O)Cc1ccc(N)c[n]1 Amb20248326 [0,2,0,0,0,0|1,0,0]=3 6947 B12R1.49 COC(=O)Cc1ccc(cc1)I Amb10601390 [0,2,0,0,0,0|0,0,0]=2 6948 B12R1.49 COC(=O)Nc1ccc(C)cc1 Amb17787412 [0,2,0,0,0,0|1,0,0]=3 6949 B12R1.49 COC(=O)Nc1ccc(Cl)[n]c1 Amb22449324 [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.49 COC(=O)Nc1ccc(F)c[n]1 Amb25838414 [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.49 COC(=O)Nc1ccc(I)c[n]1 Amb24358514 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.49 COC(=O)Nc1ccc(I)cc1 Amb17861293 [0,2,0,0,0,0|1,0,0]=3 6953 B12R1.49 COC(=O)Nc1ccc(N)[n]c1 Amb18965518 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.49 COC(=O)Nc1ccc(nc1)Br Amb16982206 [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.49 COC(=O)Oc1ccc(Br)cc1 Amb25307376 [0,2,0,0,0,0|1,0,0]=3 6956 B12R1.49 COC(=O)Oc1ccc(F)cc1 Amb25821230 [0,2,0,0,0,0|1,0,0]=3 6957 B12R1.49 COC(=S)Cc1ccc(N)c[n]1 Amb24483893 [0,2,0,0,0,0|1,1,0]=4 6958 B12R1.49 COC(=S)Nc1ccc(Cl)cc1 Amb25800054 [0,2,0,0,0,0|1,1,0]=4 6959 B12R1.49 CSC(=O)Nc1ccc(Cl)cc1 Amb25326091 [0,2,0,0,0,0|1,1,0]=4 6960 B12R1.49 C[C@@H](CO)Cc1ccc(Cl)cc1 Amb25847856 [0,2,0,0,0,0|1,0,1]=4 6961 B12R1.49 C[C@@H](Cc1ccc(O)cc1)CO Amb24647774 [0,2,0,0,0,0|1,0,1]=4 6962 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [0,2,0,0,0,0|1,0,1]=4 6963 B12R1.49 C[C@H](Cc1ccc(O)cc1)CO Amb25371827 [0,2,0,0,0,0|1,0,1]=4 6964 B12R1.49 C\C(=C\c1ccc(N)cc1)\C=O Amb24605302 [0,2,0,0,0,0|1,0,1]=4 6965 B12R1.49 C\C(\C=O)=C\c1ccc(Br)cc1 Amb25823713 [0,2,0,0,0,0|1,0,1]=4 6966 B12R1.49 C\C(\C=O)=C\c1ccc(F)cc1 Amb25857570 [0,2,0,0,0,0|1,0,1]=4 6967 B12R1.49 C\C(\C=O)=C\c1ccc(I)cc1 Amb24571541 [0,2,0,0,0,0|1,0,1]=4 6968 B12R1.49 C\C(\CO)=C\c1ccc(N)cc1 Amb24536329 [0,2,0,0,0,0|1,0,1]=4 6969 B12R1.49 C\C(\Cc1ccc(Cl)cc1)=N\O Amb25159945 [0,2,0,0,0,0|1,0,0]=3 6970 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\N Amb25310183 [0,2,0,0,0,0|2,0,0]=4 6971 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\O Amb24359271 [0,2,0,0,0,0|1,0,0]=3 6972 B12R1.49 C\C(\Cc1ccc(I)cc1)=N\O Amb25258473 [0,2,0,0,0,0|1,0,0]=3 6973 B12R1.49 C\C(\Cc1ccc(O)cc1)=N\O Amb25371887 [0,2,0,0,0,0|1,0,0]=3 6974 B12R1.49 Cc1ccc(CC(=C)C=O)cc1 Amb24653692 [0,2,0,0,0,0|1,0,0]=3 6975 B12R1.49 Cc1ccc(CC(=N)NC)cc1 Amb25187482 [0,2,0,0,0,0|2,0,0]=4 6976 B12R1.49 Cc1ccc(CC(=N)OC)cc1 Amb18798199 [0,2,0,0,0,0|1,0,0]=3 6977 B12R1.49 Cc1ccc(CC(=O)C=C)cc1 Amb25069127 [0,2,0,0,0,0|1,0,0]=3 6978 B12R1.49 Cc1ccc(CC(=O)C=O)cc1 Amb24567096 [0,2,0,0,0,0|0,0,1]=3 6979 B12R1.49 Cc1ccc(CC(=O)CC)[n]c1 Amb24717709 [0,2,0,0,0,0|2,0,0]=4 6980 B12R1.49 Cc1ccc(CC(=O)CN)cc1 Amb18829243 [0,2,0,0,0,0|1,0,0]=3 6981 B12R1.49 Cc1ccc(CC(=O)CO)cc1 Amb18563613 [0,2,0,0,0,0|0,0,0]=2 6982 B12R1.49 Cc1ccc(CC(=O)NC)[n]c1 Amb25141982 [0,2,0,0,0,0|2,0,0]=4 6983 B12R1.49 Cc1ccc(CC(=O)NN)[n]c1 Amb25375047 [0,2,0,0,0,0|2,0,0]=4 6984 B12R1.49 Cc1ccc(CC(=O)NO)c[n]1 Amb25144208 [0,2,0,0,0,0|1,0,0]=3 6985 B12R1.49 Cc1ccc(CC(=O)OC)[n]c1 Amb22750281 [0,2,0,0,0,0|1,0,0]=3 6986 B12R1.49 Cc1ccc(CC(=O)OC)c[n]1 Amb24179228 [0,2,0,0,0,0|1,0,0]=3 6987 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [0,2,0,0,0,0|1,0,1]=4 6988 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [0,2,0,0,0,0|1,0,1]=4 6989 B12R1.49 Cc1ccc(CC(F)C=O)cc1 Amb24715586 [0,2,0,0,0,0|1,0,1]=4 6990 B12R1.49 Cc1ccc(CC(N)=NN)cc1 Amb18788209 [0,2,0,0,0,0|2,0,0]=4 6991 B12R1.49 Cc1ccc(CC(O)C=C)cc1 Amb25845662 [0,2,0,0,0,0|1,0,1]=4 6992 B12R1.49 Cc1ccc(CC(O)C=O)cc1 Amb24466339 [0,2,0,0,0,0|0,0,1]=3 6993 B12R1.49 Cc1ccc(CN(C)C=O)cc1 Amb24601810 [0,2,0,0,0,0|2,0,0]=4 6994 B12R1.49 Cc1ccc(CN(C)N=O)cc1 Amb25154359 [0,2,0,0,0,0|2,0,0]=4 6995 B12R1.49 Cc1ccc(CN(C)OC)cc1 Amb25048286 [0,2,0,0,0,0|2,0,0]=4 6996 B12R1.49 Cc1ccc(CS(=O)CC)cc1 Amb25160319 [0,2,0,0,0,0|2,0,0]=4 6997 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [0,2,0,0,0,0|1,0,1]=4 6998 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [0,2,0,0,0,0|1,0,1]=4 6999 B12R1.49 Cc1ccc(C[C@H](N)CO)cc1 Amb25257357 [0,2,0,0,0,0|1,0,1]=4 7000 B12R1.49 Cc1ccc(C\C(\C)=N/O)cc1 Amb24563486 [0,2,0,0,0,0|1,0,0]=3 7001 B12R1.49 Cc1ccc(NC(=O)CO)[n]c1 Amb25695406 [0,2,0,0,0,0|2,0,0]=4 7002 B12R1.49 Cc1ccc(\C=C(/O)\C=O)cc1 Amb18645658 [0,2,0,0,0,0|0,0,1]=3 7003 B12R1.49 Cc1ccc(\C=C(\C)/C=O)cc1 Amb25667362 [0,2,0,0,0,0|1,0,1]=4 7004 B12R1.49 Cc1ccc(\C=C(\C)/CO)cc1 Amb24649471 [0,2,0,0,0,0|1,0,1]=4 7005 B12R1.49 Cc1ccc(\C=C(\Cl)/C=O)cc1 Amb25674237 [0,2,0,0,0,0|1,0,1]=4 7006 B12R1.49 Cc1ccc(\C=C(\O)/C=O)cc1 Amb25179856 [0,2,0,0,0,0|0,0,1]=3 7007 B12R1.49 Cc1ccc(c[n]1)NC(=O)OC Amb24388337 [0,2,0,0,0,0|2,0,0]=4 7008 B12R1.49 Cc1ccc(cc1)NC(=O)C#N Amb24566097 [0,2,0,0,0,0|2,0,0]=4 7009 B12R1.49 Cc1ccc(cc1)NC(=O)C=O Amb25690866 [0,2,0,0,0,0|1,0,1]=4 7010 B12R1.49 Cc1ccc(cc1)NC(=O)CF Amb25857022 [0,2,0,0,0,0|2,0,0]=4 7011 B12R1.49 Cc1ccc(cc1)NC(=O)CI Amb23440933 [0,2,0,0,0,0|2,0,0]=4 7012 B12R1.49 Cc1ccc(cc1)NC(=O)CN Amb21959025 [0,2,0,0,0,0|2,0,0]=4 7013 B12R1.49 Cc1ccc(cc1)NC(=O)SC Amb25326064 [0,2,0,0,0,0|1,1,0]=4 7014 B12R1.49 Cc1ccc(cc1)NC(=S)OC Amb24452259 [0,2,0,0,0,0|1,1,0]=4 7015 B12R1.49 Cc1ccc(cc1)NC(N)=NO Amb18800912 [0,2,0,0,0,0|2,0,0]=4 7016 B12R1.49 Cc1ccc(cc1)N\C(\C)=N/O Amb24754023 [0,2,0,0,0,0|2,0,0]=4 7017 B12R1.49 Cc1ccc(cc1)OC(=O)C=C Amb24493128 [0,2,0,0,0,0|2,0,0]=4 7018 B12R1.49 Cc1ccc(cc1)OC(=O)CN Amb19115308 [0,2,0,0,0,0|2,0,0]=4 7019 B12R1.49 Cc1ccc(cc1)OC(=O)CO Amb25829911 [0,2,0,0,0,0|1,0,0]=3 7020 B12R1.49 Cc1ccc(cc1)OC(=O)OC Amb24676402 [0,2,0,0,0,0|1,0,0]=3 7021 B12R1.49 Cc1ccc(cc1)SC(=C)C=O Amb24497102 [0,2,0,0,0,0|2,0,0]=4 7022 B12R1.49 Cc1ccc(cc1)SC(=O)CCl Amb22002676 [0,2,0,0,0,0|2,0,0]=4 7023 B12R1.49 Cc1ccc(cc1)SC(=O)NC Amb25691145 [0,2,0,0,0,0|2,0,0]=4 7024 B12R1.49 Cc1ccc(cc1)[C]C(=O)OC Amb22831259 [0,2,0,0,0,0|0,0,1]=3 7025 B12R1.49 ClCC(=O)Nc1ccc(cc1)I Amb1205407 [0,2,0,0,0,0|2,0,0]=4 7026 B12R1.49 ClCC(=O)Nc1ccc(cc1)N Amb17068368 [0,2,0,0,0,0|2,0,0]=4 7027 B12R1.49 ClCC(=O)Nc1ccc(cc1)O Amb1106223 [0,2,0,0,0,0|2,0,0]=4 7028 B12R1.49 N#CC(=O)Cc1ccc(Cl)[n]c1 Amb25178952 [0,2,0,0,0,0|2,0,0]=4 7029 B12R1.49 N#CC(=O)Cc1ccc(Cl)cc1 Amb22498650 [0,2,0,0,0,0|1,0,0]=3 7030 B12R1.49 N#CC(=O)Nc1ccc(F)cc1 Amb25707940 [0,2,0,0,0,0|2,0,0]=4 7031 B12R1.49 N#CC(O)Cc1ccc(Cl)cc1 Amb25817268 [0,2,0,0,0,0|1,0,1]=4 7032 B12R1.49 N=C(Cc1ccc(O)cc1)NO Amb22494626 [0,2,0,0,0,0|1,0,0]=3 7033 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb25140389 [0,2,0,0,0,0|1,0,1]=4 7034 B12R1.49 NC(Nc1ccc(Cl)cc1)=NO Amb19075680 [0,2,0,0,0,0|2,0,0]=4 7035 B12R1.49 NC(Nc1ccc(F)cc1)=NO Amb18185589 [0,2,0,0,0,0|2,0,0]=4 7036 B12R1.49 NCC(=O)Cc1ccc(Br)c[n]1 Amb25703201 [0,2,0,0,0,0|2,0,0]=4 7037 B12R1.49 NCC(=O)Cc1ccc(Br)cc1 Amb18160380 [0,2,0,0,0,0|1,0,0]=3 7038 B12R1.49 NCC(=O)Cc1ccc(Cl)cc1 Amb18823029 [0,2,0,0,0,0|1,0,0]=3 7039 B12R1.49 NCC(=O)Cc1ccc(F)cc1 Amb18827238 [0,2,0,0,0,0|1,0,0]=3 7040 B12R1.49 NCC(=O)Cc1ccc(O)cc1 Amb25369044 [0,2,0,0,0,0|1,0,0]=3 7041 B12R1.49 NCC(=O)Nc1ccc(F)cc1 Amb21959093 [0,2,0,0,0,0|2,0,0]=4 7042 B12R1.49 NCC(=O)Nc1ccc(cc1)Br Amb10609297 [0,2,0,0,0,0|2,0,0]=4 7043 B12R1.49 NCC(=O)Nc1ccc(cc1)Br Amb1289627 [0,2,0,0,0,0|2,0,0]=4 7044 B12R1.49 NCC(=O)Nc1ccc(cc1)Cl Amb10609916 [0,2,0,0,0,0|2,0,0]=4 7045 B12R1.49 NCC(=O)Nc1ccc(cc1)O Amb13951460 [0,2,0,0,0,0|2,0,0]=4 7046 B12R1.49 NCC(=O)Oc1ccc(cc1)Br Amb17344448 [0,2,0,0,0,0|2,0,0]=4 7047 B12R1.49 NCC(=O)Oc1ccc(cc1)C Amb17334636 [0,2,0,0,0,0|2,0,0]=4 7048 B12R1.49 NCC(=O)Oc1ccc(cc1)Cl Amb17335805 [0,2,0,0,0,0|2,0,0]=4 7049 B12R1.49 NCC(=O)Oc1ccc(cc1)F Amb17334754 [0,2,0,0,0,0|2,0,0]=4 7050 B12R1.49 NCC(Cc1ccc(cc1)Br)O Amb17248849 [0,2,0,0,0,0|1,0,1]=4 7051 B12R1.49 NCC(Cc1ccc(cc1)C)O Amb17232550 [0,2,0,0,0,0|1,0,1]=4 7052 B12R1.49 NCC(Cc1ccc(cc1)Cl)O Amb17234269 [0,2,0,0,0,0|1,0,1]=4 7053 B12R1.49 NCC(Cc1ccc(cc1)F)O Amb17232703 [0,2,0,0,0,0|1,0,1]=4 7054 B12R1.49 NNC(=O)CN1C=CC(=O)C=C1 Amb24427264 [0,2,0,0,0,0|2,0,0]=4 7055 B12R1.49 NNC(=O)Cc1cc[n+]([O-])cc1 Amb25202196 [0,2,0,0,0,0|2,0,0]=4 7056 B12R1.49 NNC(=O)Cc1ccc(Cl)[n]c1 Amb22898935 [0,2,0,0,0,0|2,0,0]=4 7057 B12R1.49 NNC(=O)Cc1ccc(cc1)C Amb1921793 [0,2,0,0,0,0|1,0,0]=3 7058 B12R1.49 NNC(=O)Nc1ccc(cc1)Cl Amb2411255 [0,2,0,0,0,0|2,0,0]=4 7059 B12R1.49 NNC(=O)Nc1ccc(cc1)F Amb10839092 [0,2,0,0,0,0|2,0,0]=4 7060 B12R1.49 NNC(=O)Oc1ccc(Cl)cc1 Amb25299876 [0,2,0,0,0,0|2,0,0]=4 7061 B12R1.49 NNC(=O)Oc1ccc(O)cc1 Amb24633295 [0,2,0,0,0,0|2,0,0]=4 7062 B12R1.49 NOC(=O)Nc1ccc(F)cc1 Amb25054608 [0,2,0,0,0,0|1,0,0]=3 7063 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22225388 [0,2,0,0,0,0|1,0,1]=4 7064 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22747948 [0,2,0,0,0,0|1,0,1]=4 7065 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb22746377 [0,2,0,0,0,0|1,0,1]=4 7066 B12R1.49 N[C@@H](CO)Cc1ccc(I)cc1 Amb20242327 [0,2,0,0,0,0|1,0,1]=4 7067 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C=O Amb24106989 [0,2,0,0,0,0|1,0,1]=4 7068 B12R1.49 N[C@H](CO)Cc1ccc(Br)cc1 Amb24453435 [0,2,0,0,0,0|1,0,1]=4 7069 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb19943950 [0,2,0,0,0,0|1,0,1]=4 7070 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb22233150 [0,2,0,0,0,0|1,0,1]=4 7071 B12R1.49 N[C@H](CO)Cc1ccc(F)cc1 Amb22233151 [0,2,0,0,0,0|1,0,1]=4 7072 B12R1.49 N[C@H](CO)Cc1ccc(I)cc1 Amb25200273 [0,2,0,0,0,0|1,0,1]=4 7073 B12R1.49 N\C(\Cc1ccc(Br)cc1)=N\N Amb25056234 [0,2,0,0,0,0|2,0,0]=4 7074 B12R1.49 N\C(\Cc1ccc(Cl)cc1)=N\N Amb19045347 [0,2,0,0,0,0|2,0,0]=4 7075 B12R1.49 N\C(\Cc1ccc(F)cc1)=N\N Amb18788561 [0,2,0,0,0,0|2,0,0]=4 7076 B12R1.49 N\C(\Cc1ccc(I)cc1)=N\O Amb24454140 [0,2,0,0,0,0|1,0,0]=3 7077 B12R1.49 N\C(\Nc1ccc(O)cc1)=N\O Amb24758895 [0,2,0,0,0,0|2,0,0]=4 7078 B12R1.49 Nc1ccc(CC(=O)CBr)cc1 Amb25247650 [0,2,0,0,0,0|1,0,0]=3 7079 B12R1.49 Nc1ccc(CC(=O)NN)cc1 Amb23247868 [0,2,0,0,0,0|1,0,0]=3 7080 B12R1.49 Nc1ccc(CC(=O)NO)[n]c1 Amb25347985 [0,2,0,0,0,0|1,0,0]=3 7081 B12R1.49 Nc1ccc(CC(=O)NO)cc1 Amb25222304 [0,2,0,0,0,0|0,0,0]=2 7082 B12R1.49 Nc1ccc(CC(F)C=O)cc1 Amb25148624 [0,2,0,0,0,0|1,0,1]=4 7083 B12R1.49 Nc1ccc(CC(N)C=O)cc1 Amb24416655 [0,2,0,0,0,0|1,0,1]=4 7084 B12R1.49 Nc1ccc(C[C@H](N)CO)cc1 Amb22233152 [0,2,0,0,0,0|1,0,1]=4 7085 B12R1.49 Nc1ccc(cc1)NC(=O)NN Amb24483837 [0,2,0,0,0,0|2,0,0]=4 7086 B12R1.49 Nc1ccc(cc1)OC(=O)CO Amb24730945 [0,2,0,0,0,0|1,0,0]=3 7087 B12R1.49 O=C(CBr)Oc1ccc(Br)cc1 Amb25246512 [0,2,0,0,0,0|2,0,0]=4 7088 B12R1.49 O=C(CCl)Oc1ccc(Br)cc1 Amb22411419 [0,2,0,0,0,0|2,0,0]=4 7089 B12R1.49 O=C(CCl)Oc1ccc(F)cc1 Amb25295534 [0,2,0,0,0,0|2,0,0]=4 7090 B12R1.49 O=C(CF)Cc1ccc(Cl)cc1 Amb23454833 [0,2,0,0,0,0|1,0,0]=3 7091 B12R1.49 O=C(CF)Nc1ccc(Br)cc1 Amb24072327 [0,2,0,0,0,0|2,0,0]=4 7092 B12R1.49 O=C(CI)Nc1ccc(Br)cc1 Amb22346045 [0,2,0,0,0,0|2,0,0]=4 7093 B12R1.49 O=C(CI)Nc1ccc(F)cc1 Amb24634942 [0,2,0,0,0,0|2,0,0]=4 7094 B12R1.49 O=C(Cc1ccc(Br)cc1)CBr Amb25364120 [0,2,0,0,0,0|1,0,0]=3 7095 B12R1.49 O=C(Cc1ccc(F)cc1)CBr Amb25082934 [0,2,0,0,0,0|1,0,0]=3 7096 B12R1.49 O=C(Nc1ccc(Cl)cc1)NCl Amb25686053 [0,2,0,0,0,0|2,0,0]=4 7097 B12R1.49 O=CC(Cc1ccc(cc1)Br)Cl Amb17204706 [0,2,0,0,0,0|1,0,1]=4 7098 B12R1.49 O=CC(Cc1ccc(cc1)C)Cl Amb17204328 [0,2,0,0,0,0|1,0,1]=4 7099 B12R1.49 O=CC(Cc1ccc(cc1)Cl)Cl Amb17204403 [0,2,0,0,0,0|1,0,1]=4 7100 B12R1.49 O=CC(Cc1ccc(cc1)F)Cl Amb17204342 [0,2,0,0,0,0|1,0,1]=4 7101 B12R1.49 O=CC(F)Cc1ccc(Cl)cc1 Amb25369013 [0,2,0,0,0,0|1,0,1]=4 7102 B12R1.49 O=C\C(=C\c1ccc(cc1)Br)\C Amb17343202 [0,2,0,0,0,0|1,0,1]=4 7103 B12R1.49 O=C\C(=C\c1ccc(cc1)C)\C Amb17334499 [0,2,0,0,0,0|1,0,1]=4 7104 B12R1.49 O=C\C(=C\c1ccc(cc1)Cl)\C Amb17335458 [0,2,0,0,0,0|1,0,1]=4 7105 B12R1.49 O=C\C(=C\c1ccc(cc1)F)\C Amb17334600 [0,2,0,0,0,0|1,0,1]=4 7106 B12R1.49 O=C\C(=C\c1ccc(cc1)O)\C Amb17334556 [0,2,0,0,0,0|1,0,1]=4 7107 B12R1.49 O=C\C(\F)=C/c1ccc(Cl)cc1 Amb24697918 [0,2,0,0,0,0|1,0,1]=4 7108 B12R1.49 O=C\C(\F)=C/c1ccc(F)cc1 Amb25326695 [0,2,0,0,0,0|1,0,1]=4 7109 B12R1.49 O=C\C(\F)=C\c1ccc(F)cc1 Amb24736150 [0,2,0,0,0,0|1,0,1]=4 7110 B12R1.49 OC(Cc1ccc(Br)c[n]1)C=O Amb24492910 [0,2,0,0,0,0|1,0,1]=4 7111 B12R1.49 OC(Cc1ccc(Br)cc1)C=O Amb25856500 [0,2,0,0,0,0|0,0,1]=3 7112 B12R1.49 OC(Cc1ccc(Cl)cc1)C=O Amb25205198 [0,2,0,0,0,0|0,0,1]=3 7113 B12R1.49 OC(Cc1ccc(F)cc1)C=O Amb25731164 [0,2,0,0,0,0|0,0,1]=3 7114 B12R1.49 OC(Cc1ccc(F)cc1)CCl Amb24410753 [0,2,0,0,0,0|1,0,1]=4 7115 B12R1.49 OCC(=O)Cc1ccc(Br)cc1 Amb18069830 [0,2,0,0,0,0|0,0,0]=2 7116 B12R1.49 OCC(=O)Cc1ccc(Cl)cc1 Amb18564300 [0,2,0,0,0,0|0,0,0]=2 7117 B12R1.49 OCC(=O)Cc1ccc(F)cc1 Amb18805789 [0,2,0,0,0,0|0,0,0]=2 7118 B12R1.49 OCC(=O)Nc1ccc(F)[n]c1 Amb25781529 [0,2,0,0,0,0|2,0,0]=4 7119 B12R1.49 OCC(=O)Nc1ccc(cc1)Br Amb1111396 [0,2,0,0,0,0|1,0,0]=3 7120 B12R1.49 OCC(=O)Nc1ccc(cc1)C Amb1109727 [0,2,0,0,0,0|1,0,0]=3 7121 B12R1.49 OCC(=O)Nc1ccc(cc1)Cl Amb1111272 [0,2,0,0,0,0|1,0,0]=3 7122 B12R1.49 OCC(=O)Nc1ccc(cc1)F Amb1110979 [0,2,0,0,0,0|1,0,0]=3 7123 B12R1.49 OCC(=O)Nc1ccc(cc1)I Amb1110138 [0,2,0,0,0,0|1,0,0]=3 7124 B12R1.49 OCC(=O)Nc1ccc(cn1)Cl Amb1110187 [0,2,0,0,0,0|2,0,0]=4 7125 B12R1.49 OCC(Cc1ccc(cc1)Br)N Amb17062713 [0,2,0,0,0,0|1,0,1]=4 7126 B12R1.49 OCC(Cc1ccc(cc1)C)N Amb17062687 [0,2,0,0,0,0|1,0,1]=4 7127 B12R1.49 OCC(Cc1ccc(cc1)F)N Amb17062689 [0,2,0,0,0,0|1,0,1]=4 7128 B12R1.49 OCC(Cc1ccc(cc1)O)N Amb17062710 [0,2,0,0,0,0|1,0,1]=4 7129 B12R1.49 OCC(F)Cc1ccc(Cl)cc1 Amb25741479 [0,2,0,0,0,0|1,0,1]=4 7130 B12R1.49 OC[C@H](Cc1ccc(cc1)O)N Amb1157858 [0,2,0,0,0,0|1,0,1]=4 7131 B12R1.49 OC[C@H](F)Cc1ccc(F)cc1 Amb24749775 [0,2,0,0,0,0|1,0,1]=4 7132 B12R1.49 ONC(=O)CC=1C=CC(=O)NN1 Amb23589558 [0,2,0,0,0,0|2,0,0]=4 7133 B12R1.49 ONC(=O)Cc1ccc(I)cc1 Amb25119664 [0,2,0,0,0,0|0,0,0]=2 7134 B12R1.49 ONC(=O)Nc1ccc(I)cc1 Amb22475257 [0,2,0,0,0,0|1,0,0]=3 7135 B12R1.49 ONC(=S)Nc1ccc(F)cc1 Amb22465744 [0,2,0,0,0,0|1,1,0]=4 7136 B12R1.49 O\C(\C=O)=C/c1ccc(Cl)cc1 Amb18648698 [0,2,0,0,0,0|0,0,1]=3 7137 B12R1.49 O\C(\C=O)=C\c1ccc(F)cc1 Amb25240049 [0,2,0,0,0,0|0,0,1]=3 7138 B12R1.49 O\N=C(/Cc1ccc(cc1)O)\N Amb2224478 [0,2,0,0,0,0|1,0,0]=3 7139 B12R1.49 O\N=C(\Cc1ccc(cc1)Cl)/N Amb1114808 [0,2,0,0,0,0|1,0,0]=3 7140 B12R1.49 O\N=C(\Cc1ccc(cc1)N)/N Amb1114107 [0,2,0,0,0,0|1,0,0]=3 7141 B12R1.49 O\N=C(\Cc1ccc(cc1)O)/N Amb1113789 [0,2,0,0,0,0|1,0,0]=3 7142 B12R1.49 Oc1ccc(CC(=O)C=O)cc1 Amb25359086 [0,2,0,0,0,0|0,0,1]=3 7143 B12R1.49 Oc1ccc(CC(=O)NO)cc1 Amb24686463 [0,2,0,0,0,0|0,0,0]=2 7144 B12R1.49 Oc1ccc(CC(F)C=O)cc1 Amb24341525 [0,2,0,0,0,0|1,0,1]=4 7145 B12R1.49 Oc1ccc(CC(O)CO)cc1 Amb25092907 [0,2,0,0,0,0|0,0,2]=4 7146 B12R1.49 Oc1ccc(CN(O)N=O)cc1 Amb25249236 [0,2,0,0,0,0|1,0,0]=3 7147 B12R1.49 Oc1ccc(C[C@H](O)CO)cc1 Amb24497177 [0,2,0,0,0,0|0,0,2]=4 7148 B12R1.49 Oc1ccc(\C=C(/F)\C=O)cc1 Amb24497168 [0,2,0,0,0,0|1,0,1]=4 7149 B12R1.49 Oc1ccc(c[n]1)NC(=O)CO Amb24343557 [0,2,0,0,0,0|2,0,0]=4 7150 B12R1.49 Oc1ccc(cc1)OC(=O)CCl Amb22232555 [0,2,0,0,0,0|2,0,0]=4 7151 B12R1.49 Oc1ccc(cc1)SC(=O)CCl Amb25799516 [0,2,0,0,0,0|2,0,0]=4 7152 B12R1.49 Oc1ccc(cc1)\N=C(/O)\N=O Amb25262712 [0,2,0,0,0,0|1,0,0]=3 7153 B12R1.106 Brc1ccc(cc1)CP(=O)(O)O Amb10068620 [0,2,0,0,0,0|1,0,0]=3 7154 B12R1.106 CC(C)(O)Cc1ccc(Br)cc1 Amb18039869 [0,2,0,0,0,0|1,0,1]=4 7155 B12R1.106 CC(C)(O)Cc1ccc(I)cc1 Amb25828181 [0,2,0,0,0,0|1,0,1]=4 7156 B12R1.106 CC(C)(O)Cc1ccc(O)cc1 Amb18646533 [0,2,0,0,0,0|1,0,1]=4 7157 B12R1.106 CP(=O)(Cl)Cc1ccc(Cl)cc1 Amb25337896 [0,2,0,0,0,0|2,0,0]=4 7158 B12R1.106 CS(=O)(=O)Cc1ccc(N)cc1 Amb21959826 [0,2,0,0,0,0|1,0,1]=4 7159 B12R1.106 CS(=O)(=O)Cc1ccc(O)cc1 Amb18129612 [0,2,0,0,0,0|1,0,1]=4 7160 B12R1.106 C[C@@](N)(O)Cc1ccc(O)cc1 Amb25816965 [0,2,0,0,0,0|1,0,1]=4 7161 B12R1.106 C[C@](N)(O)Cc1ccc(I)cc1 Amb25762047 [0,2,0,0,0,0|1,0,1]=4 7162 B12R1.106 Cc1ccc(CS(C)(=O)=O)cc1 Amb25052689 [0,2,0,0,0,0|1,0,1]=4 7163 B12R1.106 Cc1ccc(CS(O)(=O)=O)cc1 Amb22298863 [0,2,0,0,0,0|1,0,0]=3 7164 B12R1.106 Cc1ccc(cc1)CP(=O)(O)O Amb10068662 [0,2,0,0,0,0|1,0,0]=3 7165 B12R1.106 Cc1ccc(cc1)CS(=O)(=O)Cl Amb1116349 [0,2,0,0,0,0|1,0,1]=4 7166 B12R1.106 Clc1ccc(cc1)CP(=O)(O)O Amb10557671 [0,2,0,0,0,0|1,0,0]=3 7167 B12R1.106 Clc1ccc(cc1)CS(=O)(=O)Cl Amb1116003 [0,2,0,0,0,0|1,0,1]=4 7168 B12R1.106 Fc1ccc(cc1)CS(=O)(=O)Cl Amb1102622 [0,2,0,0,0,0|1,0,1]=4 7169 B12R1.106 Fc1ccc(cc1)CS(=O)(=O)N Amb1129128 [0,2,0,0,0,0|1,0,1]=4 7170 B12R1.106 NS(=O)(=O)Cc1ccc(Br)cc1 Amb19375425 [0,2,0,0,0,0|1,0,1]=4 7171 B12R1.106 NS(=O)(=O)Cc1ccc(I)cc1 Amb24423685 [0,2,0,0,0,0|1,0,1]=4 7172 B12R1.106 Nc1ccc(CP(O)(O)=O)cc1 Amb22229646 [0,2,0,0,0,0|1,0,0]=3 7173 B12R1.106 Nc1ccc(CS(O)(=O)=O)cc1 Amb24063597 [0,2,0,0,0,0|1,0,0]=3 7174 B12R1.106 Nc1ccc(CS(O)(=O)=S)cc1 Amb25804728 [0,2,0,0,0,0|1,0,0]=3 7175 B12R1.106 Nc1ccc(cc1)CS(=O)(=O)C Amb13951556 [0,2,0,0,0,0|1,0,1]=4 7176 B12R1.106 Nc1ccc(cc1)OP(O)(O)=O Amb24374610 [0,2,0,0,0,0|2,0,0]=4 7177 B12R1.106 Nc1ccc(cc1)OP([O-])(O)=O Amb22731996 [0,2,0,0,0,0|2,0,0]=4 7178 B12R1.106 Nc1ccc(cc1)OP([O-])(O)=O Amb22735266 [0,2,0,0,0,0|2,0,0]=4 7179 B12R1.106 Nc1ccc(cc1)OS(O)(=O)=O Amb22001047 [0,2,0,0,0,0|2,0,0]=4 7180 B12R1.106 O=S(=O)(Br)Cc1ccc(F)cc1 Amb24715269 [0,2,0,0,0,0|1,0,1]=4 7181 B12R1.106 O=S(=O)(Cl)Cc1ccc(I)cc1 Amb19895203 [0,2,0,0,0,0|1,0,1]=4 7182 B12R1.106 OP(O)(=O)Cc1ccc(Br)c[n]1 Amb25322687 [0,2,0,0,0,0|2,0,0]=4 7183 B12R1.106 OP(O)(=O)Cc1ccc(F)cc1 Amb25236618 [0,2,0,0,0,0|1,0,0]=3 7184 B12R1.106 OP(O)(=O)Cc1ccc(I)cc1 Amb25780702 [0,2,0,0,0,0|1,0,0]=3 7185 B12R1.106 OP(O)(=O)Nc1ccc(Cl)cc1 Amb24096867 [0,2,0,0,0,0|2,0,0]=4 7186 B12R1.106 OP(O)(=O)Oc1ccc(Cl)cc1 Amb24659582 [0,2,0,0,0,0|2,0,0]=4 7187 B12R1.106 OS(=O)(=O)Cc1ccc(Br)cc1 Amb22298417 [0,2,0,0,0,0|1,0,0]=3 7188 B12R1.106 OS(=O)(=O)Cc1ccc(Cl)cc1 Amb22298420 [0,2,0,0,0,0|1,0,0]=3 7189 B12R1.106 OS(=O)(=O)Cc1ccc(F)cc1 Amb19889105 [0,2,0,0,0,0|1,0,0]=3 7190 B12R1.106 OS(=O)(=O)Oc1ccc(Cl)cc1 Amb24490250 [0,2,0,0,0,0|2,0,0]=4 7191 B12R1.106 Oc1ccc(CP(O)(O)=O)[n]c1 Amb25116021 [0,2,0,0,0,0|2,0,0]=4 7192 B12R1.106 Oc1ccc(CP(O)(O)=O)cc1 Amb22388723 [0,2,0,0,0,0|1,0,0]=3 7193 B12R1.106 Oc1ccc(CS(O)(=O)=O)cc1 Amb25773335 [0,2,0,0,0,0|1,0,0]=3 7194 B12R1.106 Oc1ccc(cc1)OP(O)(O)=O Amb25767726 [0,2,0,0,0,0|2,0,0]=4 7195 B12R1.106 Oc1ccc(cc1)OS(O)(=O)=O Amb25770612 [0,2,0,0,0,0|2,0,0]=4 7196 B12R1.106 [O-]S(=O)(=O)Cc1ccc(Br)cc1 Amb23399646 [0,2,0,0,0,0|1,0,1]=4 7197 B12R1.106 [O-]S(=O)(=O)Cc1ccc(F)cc1 Amb24442413 [0,2,0,0,0,0|1,0,1]=4 7198 B12R1.106 [O-]S(=O)(=O)Cc1ccc(O)cc1 Amb22233176 [0,2,0,0,0,0|1,0,1]=4 7199 B12R1.233 CC(=C)Cc1ccc(Cl)cc1N Amb24410096 [0,2,0,0,0,0|2,0,0]=4 7200 B12R1.233 CC(=C)Cc1ccc(F)cc1N Amb25703618 [0,2,0,0,0,0|2,0,0]=4 7201 B12R1.233 CC(=O)CN1C=CC(C)=CC1=O Amb18788348 [0,2,0,0,0,0|2,0,0]=4 7202 B12R1.233 CC(=O)Cc1ccc(Br)cc1Cl Amb24492840 [0,2,0,0,0,0|1,0,0]=3 7203 B12R1.233 CC(=O)Cc1ccc(Br)cc1F Amb19514953 [0,2,0,0,0,0|1,0,0]=3 7204 B12R1.233 CC(=O)Cc1ccc(Br)cc1O Amb24638374 [0,2,0,0,0,0|1,0,0]=3 7205 B12R1.233 CC(=O)Cc1ccc(Cl)cc1Br Amb22001574 [0,2,0,0,0,0|1,0,0]=3 7206 B12R1.233 CC(=O)Cc1ccc(Cl)cc1I Amb24727429 [0,2,0,0,0,0|1,0,0]=3 7207 B12R1.233 CC(=O)Cc1ccc(F)cc1Br Amb19373952 [0,2,0,0,0,0|1,0,0]=3 7208 B12R1.233 CC(=O)Cc1ccc(I)cc1Br Amb25312575 [0,2,0,0,0,0|1,0,0]=3 7209 B12R1.233 CC(=O)Cc1ccc(I)cc1Cl Amb25312345 [0,2,0,0,0,0|1,0,0]=3 7210 B12R1.233 CC(=O)Cc1ccc(I)cc1F Amb25209320 [0,2,0,0,0,0|1,0,0]=3 7211 B12R1.233 CC(=O)Cc1ccc(N)cc1N Amb24537165 [0,2,0,0,0,0|1,0,0]=3 7212 B12R1.233 CC(=O)Cc1ccc(O)cc1I Amb24527866 [0,2,0,0,0,0|1,0,0]=3 7213 B12R1.233 CC(=O)Cc1ccc(O)cc1N Amb24541011 [0,2,0,0,0,0|1,0,0]=3 7214 B12R1.233 CC(=O)Cc1ccc(S)cc1Br Amb24596723 [0,2,0,0,0,0|1,0,0]=3 7215 B12R1.233 CC(=O)Cc1ccc(S)cc1F Amb24656461 [0,2,0,0,0,0|1,0,0]=3 7216 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F Amb10841848 [0,2,0,0,0,0|1,0,0]=3 7217 B12R1.233 CC(=O)Nc1ccc(C)cc1F Amb17689485 [0,2,0,0,0,0|2,0,0]=4 7218 B12R1.233 CC(=O)Nc1ccc(Cl)cc1I Amb25034702 [0,2,0,0,0,0|2,0,0]=4 7219 B12R1.233 CC(=O)Nc1ccc(Cl)cc1O Amb21952712 [0,2,0,0,0,0|2,0,0]=4 7220 B12R1.233 CC(=O)Nc1ccc(F)cc1I Amb25223141 [0,2,0,0,0,0|2,0,0]=4 7221 B12R1.233 CC(=O)Nc1ccc(I)cc1Br Amb23441205 [0,2,0,0,0,0|2,0,0]=4 7222 B12R1.233 CC(=O)Nc1ccc(N)cc1C Amb21955427 [0,2,0,0,0,0|2,0,0]=4 7223 B12R1.233 CC(=O)Nc1ccc(N)cc1O Amb24429175 [0,2,0,0,0,0|2,0,0]=4 7224 B12R1.233 CC(=O)Nc1ccc(O)cc1O Amb18646675 [0,2,0,0,0,0|2,0,0]=4 7225 B12R1.233 CC(=O)Nc1ccc(cc1Br)C Amb1233517 [0,2,0,0,0,0|2,0,0]=4 7226 B12R1.233 CC(=O)Nc1ccc(cc1Br)F Amb2540025 [0,2,0,0,0,0|2,0,0]=4 7227 B12R1.233 CC(=O)Nc1ccc(cc1C)Br Amb1233518 [0,2,0,0,0,0|2,0,0]=4 7228 B12R1.233 CC(=O)Nc1ccc(cc1C)F Amb2021221 [0,2,0,0,0,0|2,0,0]=4 7229 B12R1.233 CC(=O)Nc1ccc(cc1C)I Amb1873115 [0,2,0,0,0,0|2,0,0]=4 7230 B12R1.233 CC(=O)Nc1ccc(cc1C)N Amb1115581 [0,2,0,0,0,0|2,0,0]=4 7231 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br Amb1236117 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I Amb11328226 [0,2,0,0,0,0|2,0,0]=4 7233 B12R1.233 CC(=O)Nc1ccc(cc1Cl)N Amb1239133 [0,2,0,0,0,0|2,0,0]=4 7234 B12R1.233 CC(=O)Nc1ccc(cc1F)I Amb2059636 [0,2,0,0,0,0|2,0,0]=4 7235 B12R1.233 CC(=O)Nc1ccc(cc1F)N Amb17622186 [0,2,0,0,0,0|2,0,0]=4 7236 B12R1.233 CC(=O)Nc1ccc(cc1I)Br Amb2059621 [0,2,0,0,0,0|2,0,0]=4 7237 B12R1.233 CC(=O)Nc1ccc(cc1N)Cl Amb1112837 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.233 CC(=O)Nc1ccc(cc1N)F Amb1115018 [0,2,0,0,0,0|2,0,0]=4 7239 B12R1.233 CC(=O)Nc1ccc(cc1O)Br Amb11325344 [0,2,0,0,0,0|2,0,0]=4 7240 B12R1.233 CC(=O)Oc1ccc(Br)cc1Br Amb22055049 [0,2,0,0,0,0|2,0,0]=4 7241 B12R1.233 CC(=O)Oc1ccc(Br)cc1Cl Amb24702645 [0,2,0,0,0,0|2,0,0]=4 7242 B12R1.233 CC(=O)Oc1ccc(Br)cc1F Amb24079073 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.233 CC(=O)Oc1ccc(Cl)cc1N Amb25152591 [0,2,0,0,0,0|2,0,0]=4 7244 B12R1.233 CC(=O)Oc1ccc(F)cc1Br Amb22347953 [0,2,0,0,0,0|2,0,0]=4 7245 B12R1.233 CC(=O)Oc1ccc(O)cc1Cl Amb24422452 [0,2,0,0,0,0|2,0,0]=4 7246 B12R1.233 CC(=O)Oc1ccc(O)cc1O Amb20621409 [0,2,0,0,0,0|2,0,0]=4 7247 B12R1.233 CC(=O)\N=C/1\C=CC(=O)C=C1C Amb24588933 [0,2,0,0,0,0|2,0,0]=4 7248 B12R1.233 CC(Cc1ccc(cc1Cl)Cl)O Amb17140005 [0,2,0,0,0,0|1,0,1]=4 7249 B12R1.233 CC(O)Cc1ccc(F)cc1Cl Amb19072147 [0,2,0,0,0,0|1,0,1]=4 7250 B12R1.233 CC(O)Cc1ccc(F)cc1F Amb18807308 [0,2,0,0,0,0|1,0,1]=4 7251 B12R1.233 CC(O)Cc1ccc(O)cc1O Amb18646897 [0,2,0,0,0,0|1,0,1]=4 7252 B12R1.233 CC1=CC(=O)C=CN1CC(O)=O Amb24369037 [0,2,0,0,0,0|1,0,0]=3 7253 B12R1.233 CC1=CC(=O)N(CC(N)=O)C=C1 Amb18788439 [0,2,0,0,0,0|2,0,0]=4 7254 B12R1.233 CC1=CC(=O)N(CC(O)=O)C=C1 Amb18031841 [0,2,0,0,0,0|1,0,0]=3 7255 B12R1.233 CC1=CC(=O)N(CC(O)=O)C=N1 Amb18952939 [0,2,0,0,0,0|2,0,0]=4 7256 B12R1.233 CC1=CC(=O)N(CC(O)=O)N=C1 Amb24692872 [0,2,0,0,0,0|2,0,0]=4 7257 B12R1.233 CC1=CC=C(CC(O)=O)C(=O)N1 Amb18923812 [0,2,0,0,0,0|1,0,0]=3 7258 B12R1.233 CC=1NC(=O)C(CC(O)=O)=CN1 Amb19516786 [0,2,0,0,0,0|2,0,0]=4 7259 B12R1.233 CS(=O)Cc1ccc(Br)cc1N Amb25788210 [0,2,0,0,0,0|2,0,0]=4 7260 B12R1.233 CS(=O)Cc1ccc(Cl)cc1N Amb18284711 [0,2,0,0,0,0|2,0,0]=4 7261 B12R1.233 CS(=O)Cc1ccc(F)cc1N Amb25081735 [0,2,0,0,0,0|2,0,0]=4 7262 B12R1.233 CS(=O)Cc1ccc(N)cc1Br Amb18952473 [0,2,0,0,0,0|2,0,0]=4 7263 B12R1.233 CS(=O)Cc1ccc(N)cc1Cl Amb18284174 [0,2,0,0,0,0|2,0,0]=4 7264 B12R1.233 CS(=O)Cc1ccc(N)cc1F Amb25083102 [0,2,0,0,0,0|2,0,0]=4 7265 B12R1.233 Cc1[n]c(Cl)ccc1CC(O)=O Amb20622941 [0,2,0,0,0,0|1,0,0]=3 7266 B12R1.233 Cc1[n]c(F)ccc1CC(O)=O Amb25077187 [0,2,0,0,0,0|1,0,0]=3 7267 B12R1.233 Cc1[n]c(O)[n]cc1CC(O)=O Amb24574337 [0,2,0,0,0,0|2,0,0]=4 7268 B12R1.233 Cc1[n]c(O)c(CC(O)=O)c[n]1 Amb18826731 [0,2,0,0,0,0|2,0,0]=4 7269 B12R1.233 Cc1[n]cc(CC(O)=O)c(Cl)[n]1 Amb18821788 [0,2,0,0,0,0|2,0,0]=4 7270 B12R1.233 Cc1[n]cc(CC(O)=O)c(N)[n]1 Amb18827252 [0,2,0,0,0,0|2,0,0]=4 7271 B12R1.233 Cc1c[n]c(CC(O)=O)c(F)c1 Amb25208713 [0,2,0,0,0,0|1,0,0]=3 7272 B12R1.233 Cc1cc(Br)[n]cc1CC(O)=O Amb24528501 [0,2,0,0,0,0|1,0,0]=3 7273 B12R1.233 Cc1cc(Br)c[n]c1CC(O)=O Amb22499306 [0,2,0,0,0,0|1,0,0]=3 7274 B12R1.233 Cc1cc(Br)ccc1CC(N)=O Amb24387485 [0,2,0,0,0,0|1,0,0]=3 7275 B12R1.233 Cc1cc(Br)ccc1OC(=O)Cl Amb25070133 [0,2,0,0,0,0|2,0,0]=4 7276 B12R1.233 Cc1cc(C)[n+](CC(N)=O)cc1 Amb25855395 [0,2,0,0,0,0|2,0,0]=4 7277 B12R1.233 Cc1cc(Cl)c(CC(=O)Cl)cc1 Amb25174061 [0,2,0,0,0,0|1,0,0]=3 7278 B12R1.233 Cc1cc(Cl)c(CC(O)=O)c[n]1 Amb24671104 [0,2,0,0,0,0|1,0,0]=3 7279 B12R1.233 Cc1cc(Cl)ccc1CC(C)O Amb25115948 [0,2,0,0,0,0|1,0,1]=4 7280 B12R1.233 Cc1cc(Cl)ccc1SC(C)=O Amb24532642 [0,2,0,0,0,0|2,0,0]=4 7281 B12R1.233 Cc1cc(F)ccc1CB(O)O Amb25118889 [0,2,0,0,0,0|1,0,1]=4 7282 B12R1.233 Cc1cc(F)ccc1CC(C)=C Amb24763640 [0,2,0,0,0,0|2,0,0]=4 7283 B12R1.233 Cc1cc(F)ccc1CC(N)=S Amb24758716 [0,2,0,0,0,0|1,1,0]=4 7284 B12R1.233 Cc1cc(F)ccc1OC(C)=O Amb24079689 [0,2,0,0,0,0|2,0,0]=4 7285 B12R1.233 Cc1cc(F)ccc1SC(C)=O Amb24400545 [0,2,0,0,0,0|2,0,0]=4 7286 B12R1.233 Cc1cc(I)ccc1NC(N)=O Amb25160176 [0,2,0,0,0,0|2,0,0]=4 7287 B12R1.233 Cc1cc(N)[n]cc1CC(N)=O Amb22496370 [0,2,0,0,0,0|2,0,0]=4 7288 B12R1.233 Cc1cc(N)c(CC(N)=O)cc1 Amb22913581 [0,2,0,0,0,0|1,0,0]=3 7289 B12R1.233 Cc1cc(N)c(cc1)OC(N)=O Amb25172501 [0,2,0,0,0,0|2,0,0]=4 7290 B12R1.233 Cc1cc(N)ccc1CC(O)=O Amb22886518 [0,2,0,0,0,0|0,0,0]=2 7291 B12R1.233 Cc1cc(N)ccc1OC(N)=O Amb25359457 [0,2,0,0,0,0|2,0,0]=4 7292 B12R1.233 Cc1cc(O)ccc1CC(O)=O Amb18055429 [0,2,0,0,0,0|0,0,0]=2 7293 B12R1.233 Cc1cc(O)ccc1NC(N)=O Amb25759269 [0,2,0,0,0,0|2,0,0]=4 7294 B12R1.233 Cc1cc[n+](CC([O-])=O)c(N)c1 Amb24121529 [0,2,0,0,0,0|1,0,1]=4 7295 B12R1.233 Cc1ccc(CB(O)O)c(Cl)c1 Amb25100581 [0,2,0,0,0,0|1,0,1]=4 7296 B12R1.233 Cc1ccc(CC(=O)Cl)c(C)c1 Amb22642144 [0,2,0,0,0,0|1,0,0]=3 7297 B12R1.233 Cc1ccc(CC(C)=C)c(O)c1 Amb24497369 [0,2,0,0,0,0|2,0,0]=4 7298 B12R1.233 Cc1ccc(CC(C)=O)c(I)c1 Amb25277814 [0,2,0,0,0,0|1,0,0]=3 7299 B12R1.233 Cc1ccc(CC(C)=O)c(S)c1 Amb24579737 [0,2,0,0,0,0|1,0,0]=3 7300 B12R1.233 Cc1ccc(CC(C)O)c(N)c1 Amb18646349 [0,2,0,0,0,0|1,0,1]=4 7301 B12R1.233 Cc1ccc(CC(O)=O)c(Br)[n]1 Amb25843875 [0,2,0,0,0,0|1,0,0]=3 7302 B12R1.233 Cc1ccc(CC(O)=O)c(C)[n]1 Amb18828440 [0,2,0,0,0,0|1,0,0]=3 7303 B12R1.233 Cc1ccc(CC(O)=O)c(Cl)c1 Amb20669255 [0,2,0,0,0,0|0,0,0]=2 7304 B12R1.233 Cc1ccc(CC(O)=O)c(F)[n]1 Amb25694326 [0,2,0,0,0,0|1,0,0]=3 7305 B12R1.233 Cc1ccc(CC(O)=O)c(N)[n]1 Amb25751400 [0,2,0,0,0,0|1,0,0]=3 7306 B12R1.233 Cc1ccc(CC(O)=O)c(N)c1 Amb22913563 [0,2,0,0,0,0|0,0,0]=2 7307 B12R1.233 Cc1ccc(NC(C)=O)c(Cl)c1 Amb20620660 [0,2,0,0,0,0|2,0,0]=4 7308 B12R1.233 Cc1ccc(NC(N)=O)c(O)c1 Amb18788431 [0,2,0,0,0,0|2,0,0]=4 7309 B12R1.233 Cc1ccc(NC(N)=O)c(S)c1 Amb24545939 [0,2,0,0,0,0|2,0,0]=4 7310 B12R1.233 Cc1ccc(OC(=O)Cl)c(Br)c1 Amb24384722 [0,2,0,0,0,0|2,0,0]=4 7311 B12R1.233 Cc1ccc(OC(C)=O)c(Cl)c1 Amb25106705 [0,2,0,0,0,0|2,0,0]=4 7312 B12R1.233 ClC(=O)Cc1ccc(cc1F)F Amb10841845 [0,2,0,0,0,0|1,0,0]=3 7313 B12R1.233 N=C1C=C(Cl)C=CN1CC(O)=O Amb24493621 [0,2,0,0,0,0|1,0,0]=3 7314 B12R1.233 NC(=N)Cc1ccc(Br)cc1Cl Amb25094810 [0,2,0,0,0,0|2,0,0]=4 7315 B12R1.233 NC(=N)Cc1ccc(Cl)cc1F Amb25060069 [0,2,0,0,0,0|2,0,0]=4 7316 B12R1.233 NC(=O)CN1C=CC(=O)C=C1Cl Amb25206107 [0,2,0,0,0,0|2,0,0]=4 7317 B12R1.233 NC(=O)Cc1[n]cc(F)cc1F Amb25272381 [0,2,0,0,0,0|2,0,0]=4 7318 B12R1.233 NC(=O)Cc1ccc(Cl)[n]c1Cl Amb24378132 [0,2,0,0,0,0|2,0,0]=4 7319 B12R1.233 NC(=O)Cc1ccc(Cl)[n]c1F Amb25040687 [0,2,0,0,0,0|2,0,0]=4 7320 B12R1.233 NC(=O)Cc1ccc(Cl)cc1F Amb22987607 [0,2,0,0,0,0|1,0,0]=3 7321 B12R1.233 NC(=O)Cc1ccc(F)cc1Br Amb24312447 [0,2,0,0,0,0|1,0,0]=3 7322 B12R1.233 NC(=O)Cc1ccc(F)cc1F Amb18893589 [0,2,0,0,0,0|1,0,0]=3 7323 B12R1.233 NC(=O)Cc1ccc(cc1C)C Amb17400137 [0,2,0,0,0,0|1,0,0]=3 7324 B12R1.233 NC(=O)Cc1ccc(cc1Cl)Cl Amb2154176 [0,2,0,0,0,0|1,0,0]=3 7325 B12R1.233 NC(=O)Nc1ccc(Br)cc1Cl Amb25067453 [0,2,0,0,0,0|2,0,0]=4 7326 B12R1.233 NC(=O)Nc1ccc(Cl)cc1Br Amb25733937 [0,2,0,0,0,0|2,0,0]=4 7327 B12R1.233 NC(=O)Nc1ccc(Cl)cc1F Amb18330028 [0,2,0,0,0,0|2,0,0]=4 7328 B12R1.233 NC(=O)Nc1ccc(Cl)cc1O Amb25083818 [0,2,0,0,0,0|2,0,0]=4 7329 B12R1.233 NC(=O)Nc1ccc(I)cc1Br Amb24365726 [0,2,0,0,0,0|2,0,0]=4 7330 B12R1.233 NC(=O)Nc1ccc(O)cc1F Amb25269984 [0,2,0,0,0,0|2,0,0]=4 7331 B12R1.233 NC(=O)Nc1ccc(cc1C)C Amb1105365 [0,2,0,0,0,0|2,0,0]=4 7332 B12R1.233 NC(=O)Nc1ccc(cc1C)F Amb1137100 [0,2,0,0,0,0|2,0,0]=4 7333 B12R1.233 NC(=O)Nc1ccc(cc1C)N Amb1115520 [0,2,0,0,0,0|2,0,0]=4 7334 B12R1.233 NC(=O)Nc1ccc(cc1Cl)N Amb1117171 [0,2,0,0,0,0|2,0,0]=4 7335 B12R1.233 NC(=O)Nc1ccc(cc1F)F Amb1129140 [0,2,0,0,0,0|2,0,0]=4 7336 B12R1.233 NC(=O)Nc1ccc(cc1N)Cl Amb1117321 [0,2,0,0,0,0|2,0,0]=4 7337 B12R1.233 NC(=O)Nc1ccc(cc1N)F Amb1115133 [0,2,0,0,0,0|2,0,0]=4 7338 B12R1.233 NC(=O)Oc1ccc(F)cc1F Amb24635675 [0,2,0,0,0,0|2,0,0]=4 7339 B12R1.233 NC(=O)Oc1ccc(cc1Br)F Amb10575593 [0,2,0,0,0,0|2,0,0]=4 7340 B12R1.233 NC(=S)Cc1ccc(F)cc1F Amb18329499 [0,2,0,0,0,0|1,1,0]=4 7341 B12R1.233 NC=1C=CN(CC(O)=O)C(=O)N1 Amb24059908 [0,2,0,0,0,0|2,0,0]=4 7342 B12R1.233 NC=1NC(=O)C(CC(O)=O)=CN1 Amb18647106 [0,2,0,0,0,0|2,0,0]=4 7343 B12R1.233 Nc1[nH]c(=S)c[n]c1CC(O)=O Amb24068379 [0,2,0,0,0,0|2,0,0]=4 7344 B12R1.233 Nc1c[n]c(CC(O)=O)c(Br)c1 Amb24652973 [0,2,0,0,0,0|1,0,0]=3 7345 B12R1.233 Nc1cc(Br)[n]cc1CC(O)=O Amb24501496 [0,2,0,0,0,0|1,0,0]=3 7346 B12R1.233 Nc1cc(Br)c(CC(O)=O)c[n]1 Amb25040145 [0,2,0,0,0,0|1,0,0]=3 7347 B12R1.233 Nc1cc(Br)c[n]c1CC(O)=O Amb19957635 [0,2,0,0,0,0|1,0,0]=3 7348 B12R1.233 Nc1cc(Br)ccc1CC(O)=O Amb22499464 [0,2,0,0,0,0|0,0,0]=2 7349 B12R1.233 Nc1cc(Cl)[n]cc1CC(O)=O Amb24559663 [0,2,0,0,0,0|1,0,0]=3 7350 B12R1.233 Nc1cc(Cl)ccc1CC(N)=O Amb25320990 [0,2,0,0,0,0|1,0,0]=3 7351 B12R1.233 Nc1cc(Cl)ccc1CC(O)=O Amb22262967 [0,2,0,0,0,0|0,0,0]=2 7352 B12R1.233 Nc1cc(F)[n]cc1CC(O)=O Amb25350967 [0,2,0,0,0,0|1,0,0]=3 7353 B12R1.233 Nc1cc(F)ccc1CC(O)=O Amb25783890 [0,2,0,0,0,0|0,0,0]=2 7354 B12R1.233 Nc1cc(I)ccc1CC(O)=O Amb25686085 [0,2,0,0,0,0|0,0,0]=2 7355 B12R1.233 Nc1cc(N)c(CC(N)=O)cc1 Amb25375869 [0,2,0,0,0,0|1,0,0]=3 7356 B12R1.233 Nc1cc(N)c(cc1)NC(N)=O Amb18646518 [0,2,0,0,0,0|2,0,0]=4 7357 B12R1.233 Nc1cc(O)c(CC(O)=O)cc1 Amb24739705 [0,2,0,0,0,0|0,0,0]=2 7358 B12R1.233 Nc1cc(O)ccc1CC(O)=O Amb25786404 [0,2,0,0,0,0|0,0,0]=2 7359 B12R1.233 Nc1cc(S)ccc1CC(O)=O Amb24439271 [0,2,0,0,0,0|0,0,0]=2 7360 B12R1.233 Nc1ccc(CC(O)=O)c(Br)c1 Amb18135169 [0,2,0,0,0,0|0,0,0]=2 7361 B12R1.233 Nc1ccc(CC(O)=O)c(Cl)c1 Amb24443574 [0,2,0,0,0,0|0,0,0]=2 7362 B12R1.233 Nc1ccc(CC(O)=O)c(F)[n]1 Amb25253109 [0,2,0,0,0,0|1,0,0]=3 7363 B12R1.233 Nc1ccc(CC(O)=O)c(N)c1 Amb21857590 [0,2,0,0,0,0|0,0,0]=2 7364 B12R1.233 Nc1ccc(CC(O)=O)c(S)c1 Amb25797433 [0,2,0,0,0,0|0,0,0]=2 7365 B12R1.233 Nc1ccc(NC(N)=O)c(F)c1 Amb18279319 [0,2,0,0,0,0|2,0,0]=4 7366 B12R1.233 O=C(Cl)Cc1ccc(Cl)cc1F Amb19893004 [0,2,0,0,0,0|1,0,0]=3 7367 B12R1.233 O=C(Cl)Nc1ccc(F)cc1Cl Amb24399227 [0,2,0,0,0,0|2,0,0]=4 7368 B12R1.233 O=C(Cl)Oc1ccc(Br)cc1Cl Amb24384723 [0,2,0,0,0,0|2,0,0]=4 7369 B12R1.233 O=C(Cl)Oc1ccc(Cl)cc1Br Amb25100159 [0,2,0,0,0,0|2,0,0]=4 7370 B12R1.233 O=C(Cl)Oc1ccc(Cl)cc1F Amb24493303 [0,2,0,0,0,0|2,0,0]=4 7371 B12R1.233 O=C(Cl)Oc1ccc(F)cc1Br Amb25842097 [0,2,0,0,0,0|2,0,0]=4 7372 B12R1.233 O=C(Cl)Oc1ccc(F)cc1F Amb25728314 [0,2,0,0,0,0|2,0,0]=4 7373 B12R1.233 OB(O)Cc1ccc(Br)cc1F Amb24730507 [0,2,0,0,0,0|1,0,1]=4 7374 B12R1.233 OB(O)Cc1ccc(F)cc1Br Amb24368345 [0,2,0,0,0,0|1,0,1]=4 7375 B12R1.233 OC(=O)CC1=CNC(=O)NC1=O Amb19516686 [0,2,0,0,0,0|2,0,0]=4 7376 B12R1.233 OC(=O)CC1=CNC(=S)NC1=O Amb20572752 [0,2,0,0,0,0|2,0,0]=4 7377 B12R1.233 OC(=O)CC=1C=CC(=O)NC1Cl Amb24493571 [0,2,0,0,0,0|1,0,0]=3 7378 B12R1.233 OC(=O)CN1C=CC(=O)NC1=O Amb18028580 [0,2,0,0,0,0|2,0,0]=4 7379 B12R1.233 OC(=O)CN1C=CC(=S)NC1=O Amb25294570 [0,2,0,0,0,0|2,0,0]=4 7380 B12R1.233 OC(=O)C[n+]1ccc(cc1N)C Amb2240547 [0,2,0,0,0,0|1,0,0]=3 7381 B12R1.233 OC(=O)Cc1[n]cc(Br)cc1Br Amb25696438 [0,2,0,0,0,0|1,0,0]=3 7382 B12R1.233 OC(=O)Cc1[n]cc(Br)cc1Cl Amb22499304 [0,2,0,0,0,0|1,0,0]=3 7383 B12R1.233 OC(=O)Cc1[n]cc(Br)cc1F Amb22499305 [0,2,0,0,0,0|1,0,0]=3 7384 B12R1.233 OC(=O)Cc1[n]cc(Cl)cc1Cl Amb25317901 [0,2,0,0,0,0|1,0,0]=3 7385 B12R1.233 OC(=O)Cc1[n]cc(Cl)cc1F Amb19959561 [0,2,0,0,0,0|1,0,0]=3 7386 B12R1.233 OC(=O)Cc1[n]cc(F)cc1Br Amb25798125 [0,2,0,0,0,0|1,0,0]=3 7387 B12R1.233 OC(=O)Cc1[n]cc(F)cc1F Amb24349711 [0,2,0,0,0,0|1,0,0]=3 7388 B12R1.233 OC(=O)Cc1[n]cc(F)cc1I Amb24555753 [0,2,0,0,0,0|1,0,0]=3 7389 B12R1.233 OC(=O)Cc1c[n]c(Cl)[n]c1Cl Amb23555742 [0,2,0,0,0,0|2,0,0]=4 7390 B12R1.233 OC(=O)Cc1c[n]c(Cl)cc1Cl Amb24100889 [0,2,0,0,0,0|1,0,0]=3 7391 B12R1.233 OC(=O)Cc1c[n]c(F)[n]c1F Amb25063877 [0,2,0,0,0,0|2,0,0]=4 7392 B12R1.233 OC(=O)Cc1c[n]c(F)cc1F Amb25268018 [0,2,0,0,0,0|1,0,0]=3 7393 B12R1.233 OC(=O)Cc1c[n]c(F)cc1I Amb24537019 [0,2,0,0,0,0|1,0,0]=3 7394 B12R1.233 OC(=O)Cc1ccc(Br)[n]c1Cl Amb24451732 [0,2,0,0,0,0|1,0,0]=3 7395 B12R1.233 OC(=O)Cc1ccc(Br)[n]c1F Amb24641361 [0,2,0,0,0,0|1,0,0]=3 7396 B12R1.233 OC(=O)Cc1ccc(Br)cc1Br Amb24090026 [0,2,0,0,0,0|0,0,0]=2 7397 B12R1.233 OC(=O)Cc1ccc(Br)cc1Cl Amb20171501 [0,2,0,0,0,0|0,0,0]=2 7398 B12R1.233 OC(=O)Cc1ccc(Br)cc1I Amb22737583 [0,2,0,0,0,0|0,0,0]=2 7399 B12R1.233 OC(=O)Cc1ccc(Br)cc1S Amb25720941 [0,2,0,0,0,0|0,0,0]=2 7400 B12R1.233 OC(=O)Cc1ccc(Cl)[n]c1Cl Amb18655196 [0,2,0,0,0,0|1,0,0]=3 7401 B12R1.233 OC(=O)Cc1ccc(Cl)[n]c1F Amb25150844 [0,2,0,0,0,0|1,0,0]=3 7402 B12R1.233 OC(=O)Cc1ccc(F)[n]c1I Amb24537024 [0,2,0,0,0,0|1,0,0]=3 7403 B12R1.233 OC(=O)Cc1ccc(F)cc1I Amb25825674 [0,2,0,0,0,0|0,0,0]=2 7404 B12R1.233 OC(=O)Cc1ccc(F)cc1S Amb18649262 [0,2,0,0,0,0|0,0,0]=2 7405 B12R1.233 OC(=O)Cc1ccc(I)cc1I Amb25229581 [0,2,0,0,0,0|0,0,0]=2 7406 B12R1.233 OC(=O)Cc1ccc(S)cc1Br Amb25324708 [0,2,0,0,0,0|0,0,0]=2 7407 B12R1.233 OC(=O)Cc1ccc(S)cc1Cl Amb25156628 [0,2,0,0,0,0|0,0,0]=2 7408 B12R1.233 OC(=O)Cc1ccc(S)cc1F Amb24725333 [0,2,0,0,0,0|0,0,0]=2 7409 B12R1.233 OC(=O)Cc1ccc(S)cc1I Amb24454707 [0,2,0,0,0,0|0,0,0]=2 7410 B12R1.233 OC(=O)Cc1ccc(cc1Br)C Amb17472169 [0,2,0,0,0,0|0,0,0]=2 7411 B12R1.233 OC(=O)Cc1ccc(cc1C)Br Amb17472170 [0,2,0,0,0,0|0,0,0]=2 7412 B12R1.233 OC(=O)Cc1ccc(cc1C)C Amb1829113 [0,2,0,0,0,0|0,0,0]=2 7413 B12R1.233 OC(=O)Cc1ccc(cc1C)Cl Amb17470672 [0,2,0,0,0,0|0,0,0]=2 7414 B12R1.233 OC(=O)Cc1ccc(cc1Cl)F Amb2236649 [0,2,0,0,0,0|0,0,0]=2 7415 B12R1.233 OC(=O)Cc1ccc(cc1F)C Amb10808073 [0,2,0,0,0,0|0,0,0]=2 7416 B12R1.233 OC(=O)Cc1ccc(cc1F)Cl Amb2236566 [0,2,0,0,0,0|0,0,0]=2 7417 B12R1.233 OC(=O)Cc1ccc(cc1F)O Amb10606911 [0,2,0,0,0,0|0,0,0]=2 7418 B12R1.233 OC(=O)Cc1cnc(nc1O)C Amb19134496 [0,2,0,0,0,0|2,0,0]=4 7419 B12R1.233 OC(=O)Cn1ccc(=O)[nH]c1=O Amb1157329 [0,2,0,0,0,0|2,0,0]=4 7420 B12R1.233 OC(=O)Oc1ccc(F)cc1Cl Amb22489774 [0,2,0,0,0,0|1,0,0]=3 7421 B12R1.233 OC(=S)Cc1ccc(F)cc1F Amb24090065 [0,2,0,0,0,0|0,1,0]=3 7422 B12R1.233 Oc1c[n]c(CC(O)=O)c(Br)c1 Amb25376448 [0,2,0,0,0,0|1,0,0]=3 7423 B12R1.233 Oc1c[n]c(CC(O)=O)c(Cl)c1 Amb24408932 [0,2,0,0,0,0|1,0,0]=3 7424 B12R1.233 Oc1c[n]c(CC(O)=O)c(F)c1 Amb25087116 [0,2,0,0,0,0|1,0,0]=3 7425 B12R1.233 Oc1cc(Br)c[n]c1CC(O)=O Amb25364057 [0,2,0,0,0,0|1,0,0]=3 7426 B12R1.233 Oc1cc(Cl)c(CC(O)=O)c[n]1 Amb25311588 [0,2,0,0,0,0|1,0,0]=3 7427 B12R1.233 Oc1cc(Cl)c[n]c1CC(O)=O Amb25202452 [0,2,0,0,0,0|1,0,0]=3 7428 B12R1.233 Oc1cc(Cl)ccc1CC(O)=O Amb24065961 [0,2,0,0,0,0|0,0,0]=2 7429 B12R1.233 Oc1cc(O)c(CC(O)=O)cc1 Amb18053954 [0,2,0,0,0,0|0,0,0]=2 7430 B12R1.233 Oc1cc(S)ccc1CC(O)=O Amb25775239 [0,2,0,0,0,0|0,0,0]=2 7431 B12R1.233 Oc1ccc(CC(O)=O)c(Cl)c1 Amb18556144 [0,2,0,0,0,0|0,0,0]=2 7432 B12R1.233 Oc1ccc(CC(O)=O)c(S)c1 Amb25324651 [0,2,0,0,0,0|0,0,0]=2 7433 B12R1.349 CC(=O)CC1(O)C=CC(=O)C=C1 Amb24467587 [0,2,0,0,0,0|1,0,1]=4 7434 B12R1.349 OC(=O)CC1(O)C=CC(=O)C=C1 Amb24373141 [0,2,0,0,0,0|0,0,1]=3 7435 B12R1.1819 OC(=O)CC1=CCC(O)(O)C=C1 Amb24739778 [0,2,0,0,0,0|0,0,2]=4 7436 B12R1.34 BrCC(=O)C(=O)c1ccccc1 Amb17406921 [0,2,0,0,0,0|1,0,1]=4 7437 B12R1.34 BrCC(=O)N(c1ccccc1)C Amb2081957 [0,2,0,0,0,0|2,0,0]=4 7438 B12R1.34 C#CC(=O)C(N)c1ccccc1 Amb24460507 [0,2,0,0,0,0|1,0,0]=3 7439 B12R1.34 C#CC(=O)C(O)c1ccccc1 Amb25373683 [0,2,0,0,0,0|1,0,0]=3 7440 B12R1.34 C#CC(=O)[C@H](N)c1ccccc1 Amb24426693 [0,2,0,0,0,0|1,0,0]=3 7441 B12R1.34 C#C[C@@H](O)[C@@H](O)c1ccccc1 Amb25138509 [0,2,0,0,0,0|1,0,1]=4 7442 B12R1.34 C#C[C@H](O)[C@@H](O)c1ccccc1 Amb24748425 [0,2,0,0,0,0|1,0,1]=4 7443 B12R1.34 C=C(C#N)C(N)c1ccccc1 Amb25732983 [0,2,0,0,0,0|2,0,0]=4 7444 B12R1.34 C=C(C(=O)C=C)c1ccccc1 Amb24559066 [0,2,0,0,0,0|1,0,1]=4 7445 B12R1.34 C=C(C=C)C(O)c1ccccc1 Amb25334723 [0,2,0,0,0,0|2,0,0]=4 7446 B12R1.34 C=C(C=C)[C@@H](O)c1ccccc1 Amb25215362 [0,2,0,0,0,0|2,0,0]=4 7447 B12R1.34 C=C(C=O)C(O)c1ccccc1 Amb18645656 [0,2,0,0,0,0|1,0,0]=3 7448 B12R1.34 C=C(CO)C(=O)c1ccccc1 Amb24645413 [0,2,0,0,0,0|1,0,1]=4 7449 B12R1.34 C=C(CO)C(O)c1ccccc1 Amb24671500 [0,2,0,0,0,0|1,0,0]=3 7450 B12R1.34 C=C(CO)S(=O)c1ccccc1 Amb24497581 [0,2,0,0,0,0|2,0,0]=4 7451 B12R1.34 C=CC(=O)[C@H](F)c1ccccc1 Amb24676844 [0,2,0,0,0,0|1,0,0]=3 7452 B12R1.34 C=CC(O)C(N)c1ccccc1 Amb22831164 [0,2,0,0,0,0|1,0,1]=4 7453 B12R1.34 C=CC(O)C(O)c1ccccc1 Amb24704468 [0,2,0,0,0,0|1,0,1]=4 7454 B12R1.34 C=CC(O)[C@H](N)c1ccccc1 Amb24468873 [0,2,0,0,0,0|1,0,1]=4 7455 B12R1.34 C=C[C@@H](O)[C@@H](N)c1ccccc1 Amb25375938 [0,2,0,0,0,0|1,0,1]=4 7456 B12R1.34 C=C[C@@H](O)[C@@H](O)c1ccccc1 Amb25279737 [0,2,0,0,0,0|1,0,1]=4 7457 B12R1.34 C=C[C@H](O)[C@@H](O)c1ccccc1 Amb25859224 [0,2,0,0,0,0|1,0,1]=4 7458 B12R1.34 C=C[C@H](O)[C@H](O)c1ccccc1 Amb25058473 [0,2,0,0,0,0|1,0,1]=4 7459 B12R1.34 CC(=C=C)[C@H](O)c1ccccc1 Amb24352242 [0,2,0,0,0,0|2,0,0]=4 7460 B12R1.34 CC(=C=O)C(=O)c1ccccc1 Amb24544636 [0,2,0,0,0,0|1,0,1]=4 7461 B12R1.34 CC(C(=O)C=C)c1ccccc1 Amb24537754 [0,2,0,0,0,0|1,0,0]=3 7462 B12R1.34 CC(C(=O)CBr)c1ccccc1 Amb25134301 [0,2,0,0,0,0|1,0,0]=3 7463 B12R1.34 CC(C(=O)CCl)c1ccccc1 Amb25150842 [0,2,0,0,0,0|1,0,0]=3 7464 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [0,2,0,0,0,0|1,0,0]=3 7465 B12R1.34 CC(C(=O)NN)c1ccc[n]c1 Amb25163409 [0,2,0,0,0,0|2,0,0]=4 7466 B12R1.34 CC(C(=O)NN)c1cccc[n]1 Amb25045003 [0,2,0,0,0,0|2,0,0]=4 7467 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [0,2,0,0,0,0|0,0,0]=2 7468 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [0,2,0,0,0,0|1,0,1]=4 7469 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [0,2,0,0,0,0|1,0,1]=4 7470 B12R1.34 CC(C(F)CO)c1ccccc1 Amb25316277 [0,2,0,0,0,0|1,0,1]=4 7471 B12R1.34 CC(C(N)CO)c1ccccc1 Amb18975503 [0,2,0,0,0,0|1,0,1]=4 7472 B12R1.34 CC(C(N)CO)c1ccccc1 Amb19349648 [0,2,0,0,0,0|1,0,1]=4 7473 B12R1.34 CC(C(O)C#C)c1ccccc1 Amb25700248 [0,2,0,0,0,0|1,0,1]=4 7474 B12R1.34 CC(C(O)C#N)c1ccccc1 Amb18788076 [0,2,0,0,0,0|1,0,1]=4 7475 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [0,2,0,0,0,0|1,0,1]=4 7476 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [0,2,0,0,0,0|1,0,1]=4 7477 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [0,2,0,0,0,0|1,0,1]=4 7478 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [0,2,0,0,0,0|1,0,1]=4 7479 B12R1.34 CC(N(C)C=O)c1ccccc1 Amb17672989 [0,2,0,0,0,0|2,0,0]=4 7480 B12R1.34 CC(OC)C(Cl)c1ccccc1 Amb24391584 [0,2,0,0,0,0|1,0,1]=4 7481 B12R1.34 CC(OC)C(O)c1ccccc1 Amb18801037 [0,2,0,0,0,0|1,0,1]=4 7482 B12R1.34 CC(\C(\N)=N\O)c1ccccc1 Amb24595995 [0,2,0,0,0,0|1,0,0]=3 7483 B12R1.34 CC(c1ccccc1)N(C)N=O Amb24408926 [0,2,0,0,0,0|2,0,0]=4 7484 B12R1.34 CC(c1ccccc1)\C(\N)=N\N Amb25159879 [0,2,0,0,0,0|2,0,0]=4 7485 B12R1.34 CCC(=C)C(C)c1ccccc1 Amb24617256 [0,2,0,0,0,0|2,0,0]=4 7486 B12R1.34 CCC(=C)[C@@H](O)c1ccccc1 Amb25356347 [0,2,0,0,0,0|2,0,0]=4 7487 B12R1.34 CCC(=O)C(=O)c1ccccc1 Amb17400106 [0,2,0,0,0,0|1,0,1]=4 7488 B12R1.34 CCC(=O)C(O)c1cc[n]cc1 Amb25298507 [0,2,0,0,0,0|2,0,0]=4 7489 B12R1.34 CCC(=O)C(c1ccccc1)Br Amb17596238 [0,2,0,0,0,0|1,0,0]=3 7490 B12R1.34 CCC(=O)C(c1ccccn1)Cl Amb17477741 [0,2,0,0,0,0|2,0,0]=4 7491 B12R1.34 CCC(=O)C(c1cccnc1)Cl Amb17477743 [0,2,0,0,0,0|2,0,0]=4 7492 B12R1.34 CCC(=O)C(c1ccncc1)Cl Amb17477742 [0,2,0,0,0,0|2,0,0]=4 7493 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [0,2,0,0,0,0|1,0,0]=3 7494 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [0,2,0,0,0,0|1,0,0]=3 7495 B12R1.34 CCC(=O)[C@H](N)c1ccccc1 Amb25757342 [0,2,0,0,0,0|1,0,0]=3 7496 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccccc1 Amb25760697 [0,2,0,0,0,0|1,0,1]=4 7497 B12R1.34 CC[C@@H](O)[C@H](N)c1ccccc1 Amb25301206 [0,2,0,0,0,0|1,0,1]=4 7498 B12R1.34 CC[C@H](O)[C@@H](O)c1ccccc1 Amb25280169 [0,2,0,0,0,0|1,0,1]=4 7499 B12R1.34 CN(C(=O)C#C)c1ccccc1 Amb24705229 [0,2,0,0,0,0|2,0,0]=4 7500 B12R1.34 CN(C(=O)CI)c1ccccc1 Amb23447342 [0,2,0,0,0,0|2,0,0]=4 7501 B12R1.34 CN(C(=O)CS)c1ccccc1 Amb24096794 [0,2,0,0,0,0|1,1,0]=4 7502 B12R1.34 CN(C(=O)NC)c1ccccc1 Amb24488531 [0,2,0,0,0,0|2,0,0]=4 7503 B12R1.34 CN(C(=O)OC)c1ccc[n]c1 Amb25667300 [0,2,0,0,0,0|2,0,0]=4 7504 B12R1.34 CN(C(=O)OC)c1ccccc1 Amb24612519 [0,2,0,0,0,0|1,0,0]=3 7505 B12R1.34 CN(C(N)=NO)c1ccccc1 Amb18800911 [0,2,0,0,0,0|2,0,0]=4 7506 B12R1.34 CN(N=O)C(O)c1ccccc1 Amb25343971 [0,2,0,0,0,0|2,0,0]=4 7507 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,2,0,0,0,0|1,0,1]=4 7508 B12R1.34 CNC(=O)C(C)c1ccc[n]c1 Amb25093295 [0,2,0,0,0,0|2,0,0]=4 7509 B12R1.34 CNC(=O)C(Cl)c1ccc[n]c1 Amb19075150 [0,2,0,0,0,0|2,0,0]=4 7510 B12R1.34 CNC(=O)C(N)c1cc[n]cc1 Amb24396250 [0,2,0,0,0,0|2,0,0]=4 7511 B12R1.34 CNC(=O)C(O)c1cc[n]cc1 Amb24497547 [0,2,0,0,0,0|2,0,0]=4 7512 B12R1.34 CNC(=O)C(c1ccccc1)N Amb10609276 [0,2,0,0,0,0|1,0,0]=3 7513 B12R1.34 CNC(=O)C(c1ccccc1)O Amb17400179 [0,2,0,0,0,0|1,0,0]=3 7514 B12R1.34 CNC(=O)N(N)c1ccccc1 Amb18646326 [0,2,0,0,0,0|2,0,0]=4 7515 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 Amb24682080 [0,2,0,0,0,0|1,0,0]=3 7516 B12R1.34 CNC(=O)[C@H](C)c1ccccc1 Amb25277288 [0,2,0,0,0,0|1,0,0]=3 7517 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,2,0,0,0,0|1,0,0]=3 7518 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,2,0,0,0,0|1,0,0]=3 7519 B12R1.34 CNC(=O)[C@H](c1ccccc1)N Amb17232478 [0,2,0,0,0,0|1,0,0]=3 7520 B12R1.34 CNC(=S)C(C)c1ccccc1 Amb24756688 [0,2,0,0,0,0|1,1,0]=4 7521 B12R1.34 CNC(=S)[C@@H](C)c1ccccc1 Amb24383001 [0,2,0,0,0,0|1,1,0]=4 7522 B12R1.34 COC(=C)C(=O)c1ccccc1 Amb17594034 [0,2,0,0,0,0|1,0,1]=4 7523 B12R1.34 COC(=N)C(=O)c1ccccc1 Amb24647710 [0,2,0,0,0,0|1,0,1]=4 7524 B12R1.34 COC(=N)C(C)c1ccccc1 Amb24095998 [0,2,0,0,0,0|1,0,0]=3 7525 B12R1.34 COC(=N)C(N)c1ccccc1 Amb22471822 [0,2,0,0,0,0|1,0,0]=3 7526 B12R1.34 COC(=N)[C@H](O)c1ccccc1 Amb25832728 [0,2,0,0,0,0|1,0,0]=3 7527 B12R1.34 COC(=O)C(=O)c1cc[n]cc1 Amb25370850 [0,2,0,0,0,0|1,0,1]=4 7528 B12R1.34 COC(=O)C(=O)c1cccc[n]1 Amb25735105 [0,2,0,0,0,0|1,0,1]=4 7529 B12R1.34 COC(=O)C(Br)c1cccc[n]1 Amb25381199 [0,2,0,0,0,0|1,0,0]=3 7530 B12R1.34 COC(=O)C(C)c1[n]ccc[n]1 Amb24453470 [0,2,0,0,0,0|2,0,0]=4 7531 B12R1.34 COC(=O)C(C)c1c[n]c[n]c1 Amb18801019 [0,2,0,0,0,0|2,0,0]=4 7532 B12R1.34 COC(=O)C(C)c1c[n]cc[n]1 Amb20667850 [0,2,0,0,0,0|2,0,0]=4 7533 B12R1.34 COC(=O)C(C)c1cc[n]cc1 Amb19374810 [0,2,0,0,0,0|1,0,0]=3 7534 B12R1.34 COC(=O)C(C)c1ccc[n]c1 Amb18798400 [0,2,0,0,0,0|1,0,0]=3 7535 B12R1.34 COC(=O)C(C)c1cccc[n]1 Amb19375013 [0,2,0,0,0,0|1,0,0]=3 7536 B12R1.34 COC(=O)C(Cl)c1cc[n]cc1 Amb24497439 [0,2,0,0,0,0|1,0,0]=3 7537 B12R1.34 COC(=O)C(Cl)c1ccc[n]c1 Amb19075672 [0,2,0,0,0,0|1,0,0]=3 7538 B12R1.34 COC(=O)C(Cl)c1ccc[n]c1 Amb20668455 [0,2,0,0,0,0|1,0,0]=3 7539 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [0,2,0,0,0,0|0,0,0]=2 7540 B12R1.34 COC(=O)C(N)c1[n]ccc[n]1 Amb25840293 [0,2,0,0,0,0|2,0,0]=4 7541 B12R1.34 COC(=O)C(N)c1cc[n]cc1 Amb23400053 [0,2,0,0,0,0|1,0,0]=3 7542 B12R1.34 COC(=O)C(N)c1cc[n]cc1 Amb23401700 [0,2,0,0,0,0|1,0,0]=3 7543 B12R1.34 COC(=O)C(N)c1ccc[n][n]1 Amb18827262 [0,2,0,0,0,0|2,0,0]=4 7544 B12R1.34 COC(=O)C(N)c1ccc[n]c1 Amb23401702 [0,2,0,0,0,0|1,0,0]=3 7545 B12R1.34 COC(=O)C(N)c1cccc[n]1 Amb19148994 [0,2,0,0,0,0|1,0,0]=3 7546 B12R1.34 COC(=O)C(N)c1cccc[n]1 Amb22640969 [0,2,0,0,0,0|1,0,0]=3 7547 B12R1.34 COC(=O)C(O)c1c[n]c[n]c1 Amb24715473 [0,2,0,0,0,0|2,0,0]=4 7548 B12R1.34 COC(=O)C(O)c1c[n]cc[n]1 Amb25378284 [0,2,0,0,0,0|2,0,0]=4 7549 B12R1.34 COC(=O)C(O)c1cc[n]cc1 Amb23580591 [0,2,0,0,0,0|1,0,0]=3 7550 B12R1.34 COC(=O)C(O)c1ccc[n]c1 Amb18805578 [0,2,0,0,0,0|1,0,0]=3 7551 B12R1.34 COC(=O)C(O)c1ccc[n]c1 Amb19351687 [0,2,0,0,0,0|1,0,0]=3 7552 B12R1.34 COC(=O)C(O)c1ccccc1 Amb22500374 [0,2,0,0,0,0|0,0,0]=2 7553 B12R1.34 COC(=O)C(c1ccccc1)C Amb16185437 [0,2,0,0,0,0|0,0,0]=2 7554 B12R1.34 COC(=O)C(c1ccccc1)Cl Amb1212399 [0,2,0,0,0,0|0,0,0]=2 7555 B12R1.34 COC(=O)C(c1ccccc1)N Amb1196141 [0,2,0,0,0,0|0,0,0]=2 7556 B12R1.34 COC(=O)C(c1ccccc1)N Amb1911591 [0,2,0,0,0,0|0,0,0]=2 7557 B12R1.34 COC(=O)C(c1ccccn1)N Amb13883488 [0,2,0,0,0,0|1,0,0]=3 7558 B12R1.34 COC(=O)C(c1cccnc1)N Amb13951620 [0,2,0,0,0,0|1,0,0]=3 7559 B12R1.34 COC(=O)N(N)c1ccccc1 Amb24688001 [0,2,0,0,0,0|1,0,0]=3 7560 B12R1.34 COC(=O)N(O)c1ccccc1 Amb25174008 [0,2,0,0,0,0|1,0,0]=3 7561 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [0,2,0,0,0,0|0,0,0]=2 7562 B12R1.34 COC(=O)[C@H](Cl)c1ccccc1 Amb25210876 [0,2,0,0,0,0|0,0,0]=2 7563 B12R1.34 COC(=O)[C@H](N)c1ccc[n]c1 Amb24447814 [0,2,0,0,0,0|1,0,0]=3 7564 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [0,2,0,0,0,0|0,0,0]=2 7565 B12R1.34 COC(C(c1ccccc1)N)C Amb1139088 [0,2,0,0,0,0|1,0,1]=4 7566 B12R1.34 COC(Cl)C(Cl)c1ccccc1 Amb24539299 [0,2,0,0,0,0|1,0,1]=4 7567 B12R1.34 COC(O)C(N)c1ccccc1 Amb24599253 [0,2,0,0,0,0|0,0,2]=4 7568 B12R1.34 COP(=O)[C@@H](O)c1ccccc1 Amb25065497 [0,2,0,0,0,0|1,0,0]=3 7569 B12R1.34 CO[C@H](N)[C@@H](O)c1ccccc1 Amb25322160 [0,2,0,0,0,0|1,0,1]=4 7570 B12R1.34 C[C@@H](C(=O)NN)c1ccccc1 Amb25361548 [0,2,0,0,0,0|1,0,0]=3 7571 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [0,2,0,0,0,0|0,0,0]=2 7572 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [0,2,0,0,0,0|1,0,1]=4 7573 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [0,2,0,0,0,0|1,0,1]=4 7574 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [0,2,0,0,0,0|1,0,1]=4 7575 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [0,2,0,0,0,0|1,0,1]=4 7576 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [0,2,0,0,0,0|1,0,1]=4 7577 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [0,2,0,0,0,0|1,0,1]=4 7578 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [0,2,0,0,0,0|1,0,1]=4 7579 B12R1.34 C[C@@H](OC)[C@@H](Cl)c1ccccc1 Amb25751354 [0,2,0,0,0,0|1,0,1]=4 7580 B12R1.34 C[C@@H](OC)[C@@H](O)c1ccccc1 Amb24464720 [0,2,0,0,0,0|1,0,1]=4 7581 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [0,2,0,0,0,0|1,0,1]=4 7582 B12R1.34 C[C@@H]([C@@H](F)CO)c1ccccc1 Amb24362837 [0,2,0,0,0,0|1,0,1]=4 7583 B12R1.34 C[C@@H]([C@@H](O)C#N)c1ccccc1 Amb25099408 [0,2,0,0,0,0|1,0,1]=4 7584 B12R1.34 C[C@@H]([C@@H](O)CF)c1ccccc1 Amb24372036 [0,2,0,0,0,0|1,0,1]=4 7585 B12R1.34 C[C@@H]([C@@H](O)CO)c1ccccc1 Amb24662545 [0,2,0,0,0,0|0,0,2]=4 7586 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [0,2,0,0,0,0|1,0,1]=4 7587 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [0,2,0,0,0,0|1,0,1]=4 7588 B12R1.34 C[C@H](C(=C)C=O)c1ccccc1 Amb25800041 [0,2,0,0,0,0|1,0,0]=3 7589 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [0,2,0,0,0,0|0,0,0]=2 7590 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [0,2,0,0,0,0|1,0,1]=4 7591 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [0,2,0,0,0,0|1,0,1]=4 7592 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [0,2,0,0,0,0|1,0,1]=4 7593 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [0,2,0,0,0,0|1,0,1]=4 7594 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [0,2,0,0,0,0|1,0,1]=4 7595 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [0,2,0,0,0,0|1,0,1]=4 7596 B12R1.34 C[C@H](OC)[C@@H](Cl)c1ccccc1 Amb25274934 [0,2,0,0,0,0|1,0,1]=4 7597 B12R1.34 C[C@H](OC)[C@H](O)c1ccccc1 Amb25106038 [0,2,0,0,0,0|1,0,1]=4 7598 B12R1.34 C[C@H]([C@@H](O)NC)c1ccccc1 Amb25803440 [0,2,0,0,0,0|1,0,1]=4 7599 B12R1.34 C[C@H]([C@H](N)CO)c1ccccc1 Amb24427355 [0,2,0,0,0,0|1,0,1]=4 7600 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [0,2,0,0,0,0|1,0,1]=4 7601 B12R1.34 C[C@H]([C@H](O)CO)c1ccccc1 Amb24735213 [0,2,0,0,0,0|0,0,2]=4 7602 B12R1.34 C\C(=C(\F)/C=O)\c1ccccc1 Amb24757282 [0,2,0,0,0,0|1,0,1]=4 7603 B12R1.34 C\C(=C(\F)/CO)\c1ccccc1 Amb24412960 [0,2,0,0,0,0|1,0,1]=4 7604 B12R1.34 C\C(=C\O)\C(=O)c1ccccc1 Amb24725291 [0,2,0,0,0,0|1,0,1]=4 7605 B12R1.34 C\C(=N/C)\C(N)c1ccccc1 Amb24100399 [0,2,0,0,0,0|2,0,0]=4 7606 B12R1.34 C\C(=N/N)\C(C)c1ccccc1 Amb25271286 [0,2,0,0,0,0|2,0,0]=4 7607 B12R1.34 C\C(=N/O)\C(C)c1ccccc1 Amb24518613 [0,2,0,0,0,0|1,0,0]=3 7608 B12R1.34 C\C(=N\C)\C(N)c1ccccc1 Amb24493500 [0,2,0,0,0,0|2,0,0]=4 7609 B12R1.34 C\C(=N\O)\C(O)c1ccc[n]c1 Amb24387728 [0,2,0,0,0,0|2,0,0]=4 7610 B12R1.34 C\C(\C=O)=C(\Cl)/c1ccccc1 Amb18648444 [0,2,0,0,0,0|1,0,1]=4 7611 B12R1.34 C\C(\C=O)=C(\S)/c1ccccc1 Amb18648152 [0,2,0,0,0,0|1,0,1]=4 7612 B12R1.34 C\C(\CO)=C(\O)/c1ccccc1 Amb24520521 [0,2,0,0,0,0|1,0,1]=4 7613 B12R1.34 C\C(\c1ccccc1)=C(\C)/C=O Amb18645379 [0,2,0,0,0,0|1,0,1]=4 7614 B12R1.34 C\C=C(/Cl)\C(Cl)c1ccccc1 Amb24728456 [0,2,0,0,0,0|2,0,0]=4 7615 B12R1.34 C\C=C(\Cl)/C(Cl)c1ccccc1 Amb24593524 [0,2,0,0,0,0|2,0,0]=4 7616 B12R1.34 C\C=C(\Cl)/C(O)c1ccccc1 Amb25092807 [0,2,0,0,0,0|2,0,0]=4 7617 B12R1.34 ClCC(=O)N(c1ccccc1)C Amb1207237 [0,2,0,0,0,0|2,0,0]=4 7618 B12R1.34 N#CC(O)C(F)c1ccccc1 Amb25320704 [0,2,0,0,0,0|1,0,1]=4 7619 B12R1.34 N#CC(O)[C@@H](O)c1ccccc1 Amb24353058 [0,2,0,0,0,0|1,0,1]=4 7620 B12R1.34 N#C[C@@H](O)[C@H](O)c1ccccc1 Amb25157844 [0,2,0,0,0,0|1,0,1]=4 7621 B12R1.34 N#C[C@H](O)[C@@H](F)c1ccccc1 Amb25157415 [0,2,0,0,0,0|1,0,1]=4 7622 B12R1.34 N#C[C@H](O)[C@@H](O)c1ccccc1 Amb24705594 [0,2,0,0,0,0|1,0,1]=4 7623 B12R1.34 N#C[C@H](O)[C@H](O)c1ccccc1 Amb25285601 [0,2,0,0,0,0|1,0,1]=4 7624 B12R1.34 NC(=S=O)C(N)c1ccccc1 Amb24739656 [0,2,0,0,0,0|1,0,0]=3 7625 B12R1.34 NC(C(=O)CCl)c1ccccc1 Amb24341671 [0,2,0,0,0,0|1,0,0]=3 7626 B12R1.34 NC(C(O)C#N)c1ccccc1 Amb24713669 [0,2,0,0,0,0|1,0,1]=4 7627 B12R1.34 NC(C(O)CO)c1ccccc1 Amb18646773 [0,2,0,0,0,0|0,0,2]=4 7628 B12R1.34 NC(CO)C(Cl)c1ccccc1 Amb25159303 [0,2,0,0,0,0|1,0,1]=4 7629 B12R1.34 NC(CO)C(F)c1ccccc1 Amb25299166 [0,2,0,0,0,0|1,0,1]=4 7630 B12R1.34 NC(CO)[C@H](O)c1ccccc1 Amb25247266 [0,2,0,0,0,0|1,0,1]=4 7631 B12R1.34 NCC(C(c1ccccc1)C)O Amb17232553 [0,2,0,0,0,0|1,0,1]=4 7632 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,2,0,0,0,0|1,0,1]=4 7633 B12R1.34 NC[C@@H](O)[C@H](O)c1ccccc1 Amb24401596 [0,2,0,0,0,0|1,0,1]=4 7634 B12R1.34 NC[C@H](O)[C@@H](F)c1ccccc1 Amb24678302 [0,2,0,0,0,0|1,0,1]=4 7635 B12R1.34 NC[C@H](O)[C@@H](O)c1ccccc1 Amb24461599 [0,2,0,0,0,0|1,0,1]=4 7636 B12R1.34 NC[C@H](O)[C@H](O)c1ccccc1 Amb24695219 [0,2,0,0,0,0|1,0,1]=4 7637 B12R1.34 NN(C(=O)CCl)c1ccccc1 Amb18649037 [0,2,0,0,0,0|2,0,0]=4 7638 B12R1.34 NNC(=O)C(F)c1ccccc1 Amb25799083 [0,2,0,0,0,0|1,0,0]=3 7639 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,2,0,0,0,0|1,0,0]=3 7640 B12R1.34 NNC(=O)C(S)c1ccccc1 Amb24716717 [0,2,0,0,0,0|1,0,0]=3 7641 B12R1.34 NNC(=O)C(c1ccccc1)O Amb1786264 [0,2,0,0,0,0|1,0,0]=3 7642 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,2,0,0,0,0|1,0,0]=3 7643 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,2,0,0,0,0|1,0,0]=3 7644 B12R1.34 N[C@@H](C(=O)C#N)c1ccccc1 Amb24483753 [0,2,0,0,0,0|1,0,0]=3 7645 B12R1.34 N[C@@H](C(=O)NO)c1ccccc1 Amb25061821 [0,2,0,0,0,0|0,0,0]=2 7646 B12R1.34 N[C@@H](CO)C(O)c1ccccc1 Amb24739572 [0,2,0,0,0,0|1,0,1]=4 7647 B12R1.34 N[C@@H](CO)[C@H](O)c1ccccc1 Amb24487235 [0,2,0,0,0,0|1,0,1]=4 7648 B12R1.34 N[C@H](CO)[C@@H](O)c1ccccc1 Amb25789451 [0,2,0,0,0,0|1,0,1]=4 7649 B12R1.34 N[C@H]([C@H](N)CO)c1ccccc1 Amb24558772 [0,2,0,0,0,0|1,0,1]=4 7650 B12R1.34 N\C(=N\O)\C(O)c1cc[n]cc1 Amb24652342 [0,2,0,0,0,0|2,0,0]=4 7651 B12R1.34 N\C(=N\O)\C(O)c1ccc[n]c1 Amb25101564 [0,2,0,0,0,0|2,0,0]=4 7652 B12R1.34 N\C(=N\O)\C(O)c1ccccc1 Amb22052910 [0,2,0,0,0,0|1,0,0]=3 7653 B12R1.34 N\C=C(/O)\C(=O)c1ccccc1 Amb25674167 [0,2,0,0,0,0|1,0,1]=4 7654 B12R1.34 N\C=C(\O)/C(=O)c1ccccc1 Amb25179008 [0,2,0,0,0,0|1,0,1]=4 7655 B12R1.34 O=C(CCl)C(F)c1ccccc1 Amb24390277 [0,2,0,0,0,0|1,0,0]=3 7656 B12R1.34 O=C(CCl)N(Cl)c1ccccc1 Amb25141365 [0,2,0,0,0,0|2,0,0]=4 7657 B12R1.34 O=C(O[SiH3])C(Cl)c1ccccc1 Amb25313110 [0,2,0,0,0,0|0,0,0]=2 7658 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [0,2,0,0,0,0|1,0,1]=4 7659 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [0,2,0,0,0,0|1,0,1]=4 7660 B12R1.34 O=CN(C(c1ccccc1)C)O Amb10606548 [0,2,0,0,0,0|1,0,0]=3 7661 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [0,2,0,0,0,0|1,0,1]=4 7662 B12R1.34 O=C\C(\F)=C(/F)\c1ccccc1 Amb18646831 [0,2,0,0,0,0|1,0,1]=4 7663 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [0,2,0,0,0,0|0,0,1]=3 7664 B12R1.34 OC(CCl)C(Cl)c1ccccc1 Amb25803612 [0,2,0,0,0,0|1,0,1]=4 7665 B12R1.34 OC(CO)C(F)c1ccccc1 Amb25792385 [0,2,0,0,0,0|0,0,2]=4 7666 B12R1.34 OC(c1ccccc1)\C(\F)=C\F Amb25317636 [0,2,0,0,0,0|2,0,0]=4 7667 B12R1.34 OCC(=O)C(O)c1ccc[n]c1 Amb25059701 [0,2,0,0,0,0|1,0,0]=3 7668 B12R1.34 OCC(=O)C(O)c1ccccc1 Amb24364158 [0,2,0,0,0,0|0,0,0]=2 7669 B12R1.34 OCC(=O)[C@@H](O)c1ccccc1 Amb24357245 [0,2,0,0,0,0|0,0,0]=2 7670 B12R1.34 OCC(C(c1ccccc1)O)Br Amb17596330 [0,2,0,0,0,0|1,0,1]=4 7671 B12R1.34 OCC(C(c1ccccc1)O)Cl Amb17594842 [0,2,0,0,0,0|1,0,1]=4 7672 B12R1.34 OCC(Cl)C(Cl)c1ccccc1 Amb25759065 [0,2,0,0,0,0|1,0,1]=4 7673 B12R1.34 OC[C@@H](O)C(O)c1ccccc1 Amb25332503 [0,2,0,0,0,0|0,0,2]=4 7674 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,2,0,0,0,0|0,0,2]=4 7675 B12R1.34 OC[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25678650 [0,2,0,0,0,0|1,0,1]=4 7676 B12R1.34 OC[C@H](O)[C@@H](O)c1ccccc1 Amb25816355 [0,2,0,0,0,0|0,0,2]=4 7677 B12R1.34 OC[C@H](O)[C@H](O)c1ccccc1 Amb24735337 [0,2,0,0,0,0|0,0,2]=4 7678 B12R1.34 ONC(=O)C(Cl)c1ccccc1 Amb25361902 [0,2,0,0,0,0|0,0,0]=2 7679 B12R1.34 ONC(=O)C(F)c1ccccc1 Amb25777677 [0,2,0,0,0,0|0,0,0]=2 7680 B12R1.34 ONC(=O)C(O)c1ccc[n]c1 Amb25279670 [0,2,0,0,0,0|1,0,0]=3 7681 B12R1.34 ONC(=O)C(c1ccccc1)N Amb2430893 [0,2,0,0,0,0|0,0,0]=2 7682 B12R1.34 ONC(=O)[C@@H](O)c1ccccc1 Amb25071532 [0,2,0,0,0,0|0,0,0]=2 7683 B12R1.34 ONC(=O)[C@H](O)c1ccccc1 Amb25787201 [0,2,0,0,0,0|0,0,0]=2 7684 B12R1.34 O[C@@H](CO)[C@@H](F)c1ccccc1 Amb25206688 [0,2,0,0,0,0|0,0,2]=4 7685 B12R1.34 O[C@@H](CO)[C@H](F)c1ccccc1 Amb25157359 [0,2,0,0,0,0|0,0,2]=4 7686 B12R1.34 O[C@@H]([C@@H](Cl)CO)c1ccccc1 Amb25321935 [0,2,0,0,0,0|1,0,1]=4 7687 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [0,2,0,0,0,0|0,0,1]=3 7688 B12R1.34 O[C@H](c1ccccc1)C(=O)N=O Amb25157813 [0,2,0,0,0,0|0,0,1]=3 7689 B12R1.34 O[C@H](c1ccccc1)\C(\F)=C\F Amb25157818 [0,2,0,0,0,0|2,0,0]=4 7690 B12R1.34 O\C(=C/O)\C(=O)c1ccccc1 Amb24662497 [0,2,0,0,0,0|0,0,2]=4 7691 B12R1.34 O\C(=C\O)\C(=O)c1ccccc1 Amb25358915 [0,2,0,0,0,0|0,0,2]=4 7692 B12R1.34 O\C(=N\O)\C(=O)c1ccccc1 Amb25326728 [0,2,0,0,0,0|0,0,2]=4 7693 B12R1.34 O\N=C(\Cl)/C(=O)c1ccccc1 Amb24100191 [0,2,0,0,0,0|1,0,1]=4 7694 B12R1.124 CC(=C)C(O)c1ccccc1Cl Amb25333923 [0,2,0,0,0,0|2,0,0]=4 7695 B12R1.124 CC(=C)C(O)c1ccccc1F Amb25136591 [0,2,0,0,0,0|2,0,0]=4 7696 B12R1.124 CC(=C)C(O)c1ccccc1O Amb24497319 [0,2,0,0,0,0|2,0,0]=4 7697 B12R1.124 CC(=O)C(=C)c1ccccc1O Amb24408394 [0,2,0,0,0,0|1,0,1]=4 7698 B12R1.124 CC(=O)C(=O)c1ccccc1Br Amb17406919 [0,2,0,0,0,0|1,0,1]=4 7699 B12R1.124 CC(=O)C(=O)c1ccccc1C Amb17400103 [0,2,0,0,0,0|1,0,1]=4 7700 B12R1.124 CC(=O)C(=O)c1ccccc1Cl Amb17400961 [0,2,0,0,0,0|1,0,1]=4 7701 B12R1.124 CC(=O)C(=O)c1ccccc1F Amb17400191 [0,2,0,0,0,0|1,0,1]=4 7702 B12R1.124 CC(=O)C(=O)c1ccccc1O Amb18645956 [0,2,0,0,0,0|1,0,1]=4 7703 B12R1.124 CC(=O)C(Br)c1ccccc1Br Amb24664641 [0,2,0,0,0,0|1,0,0]=3 7704 B12R1.124 CC(=O)C(C)c1ccccc1Br Amb25686339 [0,2,0,0,0,0|1,0,0]=3 7705 B12R1.124 CC(=O)C(C)c1ccccc1Cl Amb22753501 [0,2,0,0,0,0|1,0,0]=3 7706 B12R1.124 CC(=O)C(Cl)c1ccccc1N Amb25253259 [0,2,0,0,0,0|1,0,0]=3 7707 B12R1.124 CC(=O)C(N)c1[n]cccc1N Amb25189598 [0,2,0,0,0,0|2,0,0]=4 7708 B12R1.124 CC(=O)C(N)c1c[n]ccc1Cl Amb24715705 [0,2,0,0,0,0|2,0,0]=4 7709 B12R1.124 CC(=O)C(N)c1cc[n]cc1Br Amb25805508 [0,2,0,0,0,0|2,0,0]=4 7710 B12R1.124 CC(=O)C(N)c1ccc[n]c1Cl Amb25292250 [0,2,0,0,0,0|2,0,0]=4 7711 B12R1.124 CC(=O)C(N)c1ccc[n]c1S Amb25328674 [0,2,0,0,0,0|2,0,0]=4 7712 B12R1.124 CC(=O)C(N)c1ccccc1Cl Amb25265226 [0,2,0,0,0,0|1,0,0]=3 7713 B12R1.124 CC(=O)C(N)c1ccccc1S Amb24487128 [0,2,0,0,0,0|1,0,0]=3 7714 B12R1.124 CC(=O)C(O)c1ccccc1Cl Amb25248975 [0,2,0,0,0,0|1,0,0]=3 7715 B12R1.124 CC(=O)C(c1ccccc1C)Cl Amb17477626 [0,2,0,0,0,0|1,0,0]=3 7716 B12R1.124 CC(=O)C(c1ccccc1Cl)Cl Amb17477761 [0,2,0,0,0,0|1,0,0]=3 7717 B12R1.124 CC(=O)C(c1ccccc1F)Br Amb17142690 [0,2,0,0,0,0|1,0,0]=3 7718 B12R1.124 CC(=O)C(c1ccccc1F)Cl Amb17139155 [0,2,0,0,0,0|1,0,0]=3 7719 B12R1.124 CC(=O)N(C)c1ccccc1Br Amb24462353 [0,2,0,0,0,0|2,0,0]=4 7720 B12R1.124 CC(=O)N(C)c1ccccc1F Amb25151063 [0,2,0,0,0,0|2,0,0]=4 7721 B12R1.124 CC(=O)N(C)c1ccccc1O Amb18646273 [0,2,0,0,0,0|2,0,0]=4 7722 B12R1.124 CC(=O)N(N)c1ccccc1Br Amb18571906 [0,2,0,0,0,0|2,0,0]=4 7723 B12R1.124 CC(=O)N(N)c1ccccc1Cl Amb18564310 [0,2,0,0,0,0|2,0,0]=4 7724 B12R1.124 CC(=O)N(N)c1ccccc1F Amb18563833 [0,2,0,0,0,0|2,0,0]=4 7725 B12R1.124 CC(=O)N(c1ccccc1N)C Amb2444993 [0,2,0,0,0,0|2,0,0]=4 7726 B12R1.124 CC(=O)[C@@H](O)c1ccccc1F Amb25306551 [0,2,0,0,0,0|1,0,0]=3 7727 B12R1.124 CC(C(=O)Cl)c1ccccc1Br Amb24605624 [0,2,0,0,0,0|1,0,0]=3 7728 B12R1.124 CC(C(=O)Cl)c1ccccc1Cl Amb24699169 [0,2,0,0,0,0|1,0,0]=3 7729 B12R1.124 CC(C(C)O)c1ccccc1Br Amb25725772 [0,2,0,0,0,0|1,0,1]=4 7730 B12R1.124 CC(C(C)O)c1ccccc1Cl Amb25787409 [0,2,0,0,0,0|1,0,1]=4 7731 B12R1.124 CC(C(C)O)c1ccccc1O Amb24357145 [0,2,0,0,0,0|1,0,1]=4 7732 B12R1.124 CC(C(N)=O)c1ccccc1F Amb25285412 [0,2,0,0,0,0|1,0,0]=3 7733 B12R1.124 CC(C(O)=O)N1C=CC=CC1=O Amb18040083 [0,2,0,0,0,0|1,0,0]=3 7734 B12R1.124 CC(C(O)=O)N1N=CC=CC1=O Amb21937507 [0,2,0,0,0,0|2,0,0]=4 7735 B12R1.124 CC(C(O)=O)c1[n]c[n]cc1F Amb24756995 [0,2,0,0,0,0|2,0,0]=4 7736 B12R1.124 CC(C(O)=O)c1[n]cccc1Br Amb25751488 [0,2,0,0,0,0|1,0,0]=3 7737 B12R1.124 CC(C(O)=O)c1[n]cccc1Cl Amb18822248 [0,2,0,0,0,0|1,0,0]=3 7738 B12R1.124 CC(C(O)=O)c1[n]cccc1F Amb25824753 [0,2,0,0,0,0|1,0,0]=3 7739 B12R1.124 CC(C(O)=O)c1cc[n]cc1Cl Amb25850310 [0,2,0,0,0,0|1,0,0]=3 7740 B12R1.124 CC(C(O)=O)c1cc[n]cc1F Amb25682826 [0,2,0,0,0,0|1,0,0]=3 7741 B12R1.124 CC(C(c1ccccc1C)N)O Amb17232544 [0,2,0,0,0,0|1,0,1]=4 7742 B12R1.124 CC(C(c1ccccc1Cl)N)O Amb17234262 [0,2,0,0,0,0|1,0,1]=4 7743 B12R1.124 CC(C(c1ccccc1F)N)O Amb17232699 [0,2,0,0,0,0|1,0,1]=4 7744 B12R1.124 CC(O)C(N)c1ccccc1I Amb24741618 [0,2,0,0,0,0|1,0,1]=4 7745 B12R1.124 CC(O)C(N)c1ccccc1N Amb24548013 [0,2,0,0,0,0|1,0,1]=4 7746 B12R1.124 CC(O)C(N)c1ccccc1O Amb24746675 [0,2,0,0,0,0|1,0,1]=4 7747 B12R1.124 CC(O)C(O)c1ccccc1O Amb24722821 [0,2,0,0,0,0|1,0,1]=4 7748 B12R1.124 CC(O)[C@@H](N)c1ccccc1F Amb25091100 [0,2,0,0,0,0|1,0,1]=4 7749 B12R1.124 CC(O)[C@@H](N)c1ccccc1N Amb24447701 [0,2,0,0,0,0|1,0,1]=4 7750 B12R1.124 CC(O)[C@@H](O)c1ccccc1Br Amb24420423 [0,2,0,0,0,0|1,0,1]=4 7751 B12R1.124 CC(O)[C@H](N)c1ccccc1Br Amb25265718 [0,2,0,0,0,0|1,0,1]=4 7752 B12R1.124 CC(O)[C@H](N)c1ccccc1Cl Amb24341803 [0,2,0,0,0,0|1,0,1]=4 7753 B12R1.124 CC(O)[C@H](N)c1ccccc1F Amb25676286 [0,2,0,0,0,0|1,0,1]=4 7754 B12R1.124 CC(O)[C@H](N)c1ccccc1I Amb25677515 [0,2,0,0,0,0|1,0,1]=4 7755 B12R1.124 CC(O)[C@H](N)c1ccccc1O Amb25859103 [0,2,0,0,0,0|1,0,1]=4 7756 B12R1.124 CC(c1ccccc1Br)[N+]([O-])=O Amb18753221 [0,2,0,0,0,0|1,0,1]=4 7757 B12R1.124 CC(c1ccccc1O)C(O)=O Amb22228079 [0,2,0,0,0,0|0,0,0]=2 7758 B12R1.124 CC(n1cccnc1=O)C(=O)O Amb1124559 [0,2,0,0,0,0|2,0,0]=4 7759 B12R1.124 CN(C(N)=O)c1ccccc1F Amb18788752 [0,2,0,0,0,0|2,0,0]=4 7760 B12R1.124 CN(C(N)=O)c1ccccc1O Amb18646492 [0,2,0,0,0,0|2,0,0]=4 7761 B12R1.124 CN(C(N)=O)c1ccccc1S Amb25095886 [0,2,0,0,0,0|2,0,0]=4 7762 B12R1.124 CN(c1ccccc1N)C(N)=O Amb18279536 [0,2,0,0,0,0|2,0,0]=4 7763 B12R1.124 CS(=O)C(C)c1ccccc1Cl Amb25188412 [0,2,0,0,0,0|2,0,0]=4 7764 B12R1.124 C[C@@H](O)[C@@H](C)c1ccccc1N Amb24695229 [0,2,0,0,0,0|1,0,1]=4 7765 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1Br Amb25826654 [0,2,0,0,0,0|1,0,1]=4 7766 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1F Amb24484299 [0,2,0,0,0,0|1,0,1]=4 7767 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1I Amb25667335 [0,2,0,0,0,0|1,0,1]=4 7768 B12R1.124 C[C@@H](O)[C@@H](O)c1ccccc1Cl Amb25256358 [0,2,0,0,0,0|1,0,1]=4 7769 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1Br Amb24710646 [0,2,0,0,0,0|1,0,1]=4 7770 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1F Amb24417148 [0,2,0,0,0,0|1,0,1]=4 7771 B12R1.124 C[C@@H](O)[C@H](O)c1ccccc1Cl Amb25676585 [0,2,0,0,0,0|1,0,1]=4 7772 B12R1.124 C[C@@H](O)[C@H](O)c1ccccc1F Amb24397257 [0,2,0,0,0,0|1,0,1]=4 7773 B12R1.124 C[C@H](C(O)=O)c1ccccc1Cl Amb25222036 [0,2,0,0,0,0|0,0,0]=2 7774 B12R1.124 C[C@H](O)[C@@H](C)c1ccccc1N Amb24636832 [0,2,0,0,0,0|1,0,1]=4 7775 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1Br Amb25771694 [0,2,0,0,0,0|1,0,1]=4 7776 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1Cl Amb25245236 [0,2,0,0,0,0|1,0,1]=4 7777 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1F Amb25849179 [0,2,0,0,0,0|1,0,1]=4 7778 B12R1.124 C[C@H](O)[C@@H](O)c1ccccc1Cl Amb25280204 [0,2,0,0,0,0|1,0,1]=4 7779 B12R1.124 C[C@H](O)[C@@H](O)c1ccccc1O Amb25320177 [0,2,0,0,0,0|1,0,1]=4 7780 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1Cl Amb24732364 [0,2,0,0,0,0|1,0,1]=4 7781 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1F Amb24392926 [0,2,0,0,0,0|1,0,1]=4 7782 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1N Amb24487127 [0,2,0,0,0,0|1,0,1]=4 7783 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1O Amb24522959 [0,2,0,0,0,0|1,0,1]=4 7784 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1S Amb25667120 [0,2,0,0,0,0|1,0,1]=4 7785 B12R1.124 C[C@H](O)[C@H](O)c1ccccc1F Amb25220590 [0,2,0,0,0,0|1,0,1]=4 7786 B12R1.124 Cc1[n]cc[n]c1C(C)C(O)=O Amb18827787 [0,2,0,0,0,0|2,0,0]=4 7787 B12R1.124 Cc1[n]cccc1[C@@H](N)C(O)=O Amb25097107 [0,2,0,0,0,0|1,0,0]=3 7788 B12R1.124 Cc1[n]cccc1[C@H](N)C(O)=O Amb24485602 [0,2,0,0,0,0|1,0,0]=3 7789 B12R1.124 Cc1c[n]ccc1C(N)C(C)=O Amb25128027 [0,2,0,0,0,0|2,0,0]=4 7790 B12R1.124 Cc1c[n]ccc1[C@@H](N)C(O)=O Amb25121088 [0,2,0,0,0,0|1,0,0]=3 7791 B12R1.124 Cc1c[n]ccc1[C@H](N)C(O)=O Amb24487133 [0,2,0,0,0,0|1,0,0]=3 7792 B12R1.124 Cc1cc[n]cc1C(C)C(O)=O Amb25759366 [0,2,0,0,0,0|1,0,0]=3 7793 B12R1.124 Cc1cc[n]cc1C(N)C(O)=O Amb18827789 [0,2,0,0,0,0|1,0,0]=3 7794 B12R1.124 Cc1cc[n]cc1C(O)C(O)=O Amb25035168 [0,2,0,0,0,0|1,0,0]=3 7795 B12R1.124 Cc1ccc[n]c1C(=O)C(O)=O Amb25361904 [0,2,0,0,0,0|1,0,1]=4 7796 B12R1.124 Cc1ccc[n]c1C(C)C(O)=O Amb25710871 [0,2,0,0,0,0|1,0,0]=3 7797 B12R1.124 Cc1ccc[n]c1C(N)C(C)=O Amb24428767 [0,2,0,0,0,0|2,0,0]=4 7798 B12R1.124 Cc1ccc[n]c1[C@@H](N)C(O)=O Amb24546429 [0,2,0,0,0,0|1,0,0]=3 7799 B12R1.124 Cc1cccc[n+]1C(=C)C(O)=O Amb24652359 [0,2,0,0,0,0|1,0,1]=4 7800 B12R1.124 Cc1ccccc1C(=O)C(=O)Cl Amb24100489 [0,2,0,0,0,0|1,0,1]=4 7801 B12R1.124 Cc1ccccc1C(Br)C(O)=O Amb25136873 [0,2,0,0,0,0|0,0,0]=2 7802 B12R1.124 Cc1ccccc1C(C)C(=O)Cl Amb25152464 [0,2,0,0,0,0|1,0,0]=3 7803 B12R1.124 Cc1ccccc1C(C)C(C)=O Amb25204377 [0,2,0,0,0,0|1,0,0]=3 7804 B12R1.124 Cc1ccccc1C(Cl)C(N)=O Amb19074653 [0,2,0,0,0,0|1,0,0]=3 7805 B12R1.124 Cc1ccccc1C(Cl)C(O)=O Amb18564301 [0,2,0,0,0,0|0,0,0]=2 7806 B12R1.124 Cc1ccccc1C(N)C(C)=O Amb25131697 [0,2,0,0,0,0|1,0,0]=3 7807 B12R1.124 Cc1ccccc1C(N)P(O)=O Amb24433887 [0,2,0,0,0,0|1,0,0]=3 7808 B12R1.124 Cc1ccccc1C(O)C(C)=O Amb25712931 [0,2,0,0,0,0|1,0,0]=3 7809 B12R1.124 Cc1ccccc1C(O)C(N)=N Amb25159647 [0,2,0,0,0,0|2,0,0]=4 7810 B12R1.124 Cc1ccccc1C(O)C(N)=O Amb18800897 [0,2,0,0,0,0|1,0,0]=3 7811 B12R1.124 Cc1ccccc1N(C)C(=O)Cl Amb25034673 [0,2,0,0,0,0|2,0,0]=4 7812 B12R1.124 Cc1ccccc1N(C)C(C)=O Amb24085648 [0,2,0,0,0,0|2,0,0]=4 7813 B12R1.124 Cc1ccccc1N(C)C(N)=O Amb18788281 [0,2,0,0,0,0|2,0,0]=4 7814 B12R1.124 Cc1ccccc1N(N)C(C)=O Amb18563636 [0,2,0,0,0,0|2,0,0]=4 7815 B12R1.124 Cc1ccccc1N(O)C(N)=O Amb25808551 [0,2,0,0,0,0|2,0,0]=4 7816 B12R1.124 Cc1ccccc1[C@@H](C)C(O)=O Amb24426211 [0,2,0,0,0,0|0,0,0]=2 7817 B12R1.124 Cc1ccccc1[C@@H](N)C(O)=O Amb17933183 [0,2,0,0,0,0|0,0,0]=2 7818 B12R1.124 Cc1ccccc1[C@@H](N)[C@@H](C)O Amb25751402 [0,2,0,0,0,0|1,0,1]=4 7819 B12R1.124 Cc1ccccc1[C@@H](O)C(=O)Cl Amb24608093 [0,2,0,0,0,0|1,0,0]=3 7820 B12R1.124 Cc1ccccc1[C@@H](O)C(C)=O Amb24722864 [0,2,0,0,0,0|1,0,0]=3 7821 B12R1.124 Cc1ccccc1[C@H](C)C(O)=O Amb25798862 [0,2,0,0,0,0|0,0,0]=2 7822 B12R1.124 Cc1ccccc1[C@H](N)C(C)O Amb24438525 [0,2,0,0,0,0|1,0,1]=4 7823 B12R1.124 Cc1ccccc1[C@H](N)C(N)=O Amb24483792 [0,2,0,0,0,0|1,0,0]=3 7824 B12R1.124 Cc1ccccc1[C@H](N)[C@@H](C)O Amb25787588 [0,2,0,0,0,0|1,0,1]=4 7825 B12R1.124 Cc1ccccc1[C@H](N)[C@H](C)O Amb25340339 [0,2,0,0,0,0|1,0,1]=4 7826 B12R1.124 NC(=N)C(O)c1ccccc1Br Amb24100285 [0,2,0,0,0,0|2,0,0]=4 7827 B12R1.124 NC(=N)C(O)c1ccccc1Cl Amb24070108 [0,2,0,0,0,0|2,0,0]=4 7828 B12R1.124 NC(=O)C(=O)c1ccccc1Cl Amb25805251 [0,2,0,0,0,0|1,0,1]=4 7829 B12R1.124 NC(=O)C(Br)c1ccccc1Cl Amb25089052 [0,2,0,0,0,0|1,0,0]=3 7830 B12R1.124 NC(=O)C(Cl)c1ccccc1F Amb18329810 [0,2,0,0,0,0|1,0,0]=3 7831 B12R1.124 NC(=O)C(N)c1ccccc1Br Amb18282827 [0,2,0,0,0,0|1,0,0]=3 7832 B12R1.124 NC(=O)C(N)c1ccccc1F Amb19374457 [0,2,0,0,0,0|1,0,0]=3 7833 B12R1.124 NC(=O)C(N)c1ccccc1O Amb24391892 [0,2,0,0,0,0|1,0,0]=3 7834 B12R1.124 NC(=O)C(O)c1ccccc1Br Amb24123019 [0,2,0,0,0,0|1,0,0]=3 7835 B12R1.124 NC(=O)C(O)c1ccccc1Cl Amb19075671 [0,2,0,0,0,0|1,0,0]=3 7836 B12R1.124 NC(=O)C(O)c1ccccc1F Amb18806074 [0,2,0,0,0,0|1,0,0]=3 7837 B12R1.124 NC(=O)C(c1ccccc1C)N Amb17334617 [0,2,0,0,0,0|1,0,0]=3 7838 B12R1.124 NC(=O)C(c1ccccc1Cl)N Amb17335725 [0,2,0,0,0,0|1,0,0]=3 7839 B12R1.124 NC(=O)C(c1ccccc1F)N Amb17334710 [0,2,0,0,0,0|1,0,0]=3 7840 B12R1.124 NC(=O)[C@@H](N)c1ccccc1Cl Amb24483835 [0,2,0,0,0,0|1,0,0]=3 7841 B12R1.124 NC(=O)[C@@H](O)c1ccccc1Cl Amb22799808 [0,2,0,0,0,0|1,0,0]=3 7842 B12R1.124 NC(=O)[C@H](N)c1ccccc1O Amb25056722 [0,2,0,0,0,0|1,0,0]=3 7843 B12R1.124 NC(=O)[C@H](O)c1ccccc1Cl Amb24355348 [0,2,0,0,0,0|1,0,0]=3 7844 B12R1.124 NC(=S)C(O)c1ccccc1Cl Amb25159696 [0,2,0,0,0,0|1,1,0]=4 7845 B12R1.124 NC(=S)C(O)c1ccccc1F Amb25159483 [0,2,0,0,0,0|1,1,0]=4 7846 B12R1.124 NC(C(O)=O)C1=CC=CNC1=O Amb25854713 [0,2,0,0,0,0|1,0,0]=3 7847 B12R1.124 NC(C(O)=O)c1[n]cc[n]c1Cl Amb24712372 [0,2,0,0,0,0|2,0,0]=4 7848 B12R1.124 NC(C(O)=O)c1[n]cccc1Br Amb24695377 [0,2,0,0,0,0|1,0,0]=3 7849 B12R1.124 NC(C(O)=O)c1[n]cccc1Cl Amb25835423 [0,2,0,0,0,0|1,0,0]=3 7850 B12R1.124 NC(C(O)=O)c1cc[n]cc1Br Amb25327473 [0,2,0,0,0,0|1,0,0]=3 7851 B12R1.124 NC(C(O)=O)c1ccc[n]c1Br Amb24420309 [0,2,0,0,0,0|1,0,0]=3 7852 B12R1.124 NC(C(O)=O)c1ccc[n]c1Cl Amb24427947 [0,2,0,0,0,0|1,0,0]=3 7853 B12R1.124 NC(C(O)=O)c1ccc[n]c1F Amb24697660 [0,2,0,0,0,0|1,0,0]=3 7854 B12R1.124 NC(C(O)=O)c1ccc[n]c1S Amb25151059 [0,2,0,0,0,0|1,0,0]=3 7855 B12R1.124 NC(C(O)=O)c1ccccc1F Amb24331712 [0,2,0,0,0,0|0,0,0]=2 7856 B12R1.124 NC(c1[n]cccc1O)C(O)=O Amb24670280 [0,2,0,0,0,0|1,0,0]=3 7857 B12R1.124 N[C@@H](C(O)=O)c1[n]cccc1Br Amb25149962 [0,2,0,0,0,0|1,0,0]=3 7858 B12R1.124 N[C@@H](C(O)=O)c1[n]cccc1F Amb24484150 [0,2,0,0,0,0|1,0,0]=3 7859 B12R1.124 N[C@@H](C(O)=O)c1cc[n]cc1Cl Amb24648834 [0,2,0,0,0,0|1,0,0]=3 7860 B12R1.124 N[C@@H](C(O)=O)c1ccc[n]c1F Amb25295392 [0,2,0,0,0,0|1,0,0]=3 7861 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb23440362 [0,2,0,0,0,0|0,0,0]=2 7862 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb25270086 [0,2,0,0,0,0|0,0,0]=2 7863 B12R1.124 N[C@@H](C(O)=O)c1ccccc1F Amb22747759 [0,2,0,0,0,0|0,0,0]=2 7864 B12R1.124 N[C@@H](C(O)=O)c1ccccc1I Amb25055265 [0,2,0,0,0,0|0,0,0]=2 7865 B12R1.124 N[C@@H](C(O)=O)c1ccccc1S Amb24649945 [0,2,0,0,0,0|0,0,0]=2 7866 B12R1.124 N[C@@H](c1[n]cccc1O)C(O)=O Amb24635276 [0,2,0,0,0,0|1,0,0]=3 7867 B12R1.124 N[C@@H](c1c[n]ccc1O)C(O)=O Amb25751540 [0,2,0,0,0,0|1,0,0]=3 7868 B12R1.124 N[C@@H](c1ccc[n]c1O)C(O)=O Amb25087908 [0,2,0,0,0,0|1,0,0]=3 7869 B12R1.124 N[C@@H](c1ccccc1O)C(O)=O Amb22748113 [0,2,0,0,0,0|0,0,0]=2 7870 B12R1.124 N[C@H](C(O)=O)c1[n]cccc1Cl Amb25774361 [0,2,0,0,0,0|1,0,0]=3 7871 B12R1.124 N[C@H](C(O)=O)c1cc[n]cc1F Amb25150860 [0,2,0,0,0,0|1,0,0]=3 7872 B12R1.124 N[C@H](C(O)=O)c1ccccc1I Amb24637866 [0,2,0,0,0,0|0,0,0]=2 7873 B12R1.124 N[C@H](c1ccccc1O)C(O)=O Amb25134608 [0,2,0,0,0,0|0,0,0]=2 7874 B12R1.124 Nc1[n]cccc1C(=O)C(O)=O Amb24390875 [0,2,0,0,0,0|1,0,1]=4 7875 B12R1.124 Nc1c[n]ccc1C(N)C(O)=O Amb24351686 [0,2,0,0,0,0|1,0,0]=3 7876 B12R1.124 Nc1c[n]ccc1[C@@H](N)C(O)=O Amb25349329 [0,2,0,0,0,0|1,0,0]=3 7877 B12R1.124 Nc1c[n]ccc1[C@H](N)C(O)=O Amb24341560 [0,2,0,0,0,0|1,0,0]=3 7878 B12R1.124 Nc1cc[n]cc1C(=O)C(O)=O Amb24531526 [0,2,0,0,0,0|1,0,1]=4 7879 B12R1.124 Nc1cc[n]cc1[C@@H](N)C(O)=O Amb24748647 [0,2,0,0,0,0|1,0,0]=3 7880 B12R1.124 Nc1ccc[n]c1C(N)C(O)=O Amb25727218 [0,2,0,0,0,0|1,0,0]=3 7881 B12R1.124 Nc1ccccc1C(=O)C([O-])=O Amb21963722 [0,2,0,0,0,0|0,0,2]=4 7882 B12R1.124 Nc1ccccc1C(O)C(O)=O Amb18646669 [0,2,0,0,0,0|0,0,0]=2 7883 B12R1.124 Nc1ccccc1C(O)C([O-])=O Amb21963741 [0,2,0,0,0,0|0,0,1]=3 7884 B12R1.124 Nc1ccccc1[C@@H](N)C(O)=O Amb25700852 [0,2,0,0,0,0|0,0,0]=2 7885 B12R1.124 Nc1ccccc1[C@H](O)C(O)=O Amb24373910 [0,2,0,0,0,0|0,0,0]=2 7886 B12R1.124 O=C(Cl)C(Br)c1ccccc1Cl Amb24641573 [0,2,0,0,0,0|1,0,0]=3 7887 B12R1.124 OC(=O)C(=C)c1ccccc1C Amb17322164 [0,2,0,0,0,0|0,0,1]=3 7888 B12R1.124 OC(=O)C(=C)c1ccccc1Cl Amb17322174 [0,2,0,0,0,0|0,0,1]=3 7889 B12R1.124 OC(=O)C(=C)c1ccccc1F Amb17322167 [0,2,0,0,0,0|0,0,1]=3 7890 B12R1.124 OC(=O)C(=O)c1[n]cccc1F Amb24687974 [0,2,0,0,0,0|1,0,1]=4 7891 B12R1.124 OC(=O)C(=O)c1ccc[n]c1Cl Amb25714810 [0,2,0,0,0,0|1,0,1]=4 7892 B12R1.124 OC(=O)C(=O)c1ccccc1Br Amb13883630 [0,2,0,0,0,0|0,0,1]=3 7893 B12R1.124 OC(=O)C(=O)c1ccccc1C Amb16231619 [0,2,0,0,0,0|0,0,1]=3 7894 B12R1.124 OC(=O)C(=O)c1ccccc1F Amb13883629 [0,2,0,0,0,0|0,0,1]=3 7895 B12R1.124 OC(=O)C(=O)c1ccccc1N Amb17594093 [0,2,0,0,0,0|0,0,1]=3 7896 B12R1.124 OC(=O)C(=O)c1ccccc1O Amb18646415 [0,2,0,0,0,0|0,0,1]=3 7897 B12R1.124 OC(=O)C(Cl)c1ccccc1Br Amb24060809 [0,2,0,0,0,0|0,0,0]=2 7898 B12R1.124 OC(=O)C(Cl)c1ccccc1Cl Amb18066587 [0,2,0,0,0,0|0,0,0]=2 7899 B12R1.124 OC(=O)C(Cl)c1ccccc1F Amb18564556 [0,2,0,0,0,0|0,0,0]=2 7900 B12R1.124 OC(=O)C(F)N1C=CC=NC1=O Amb24362263 [0,2,0,0,0,0|2,0,0]=4 7901 B12R1.124 OC(=O)C(F)N1C=CN=CC1=O Amb24461236 [0,2,0,0,0,0|2,0,0]=4 7902 B12R1.124 OC(=O)C(F)N1N=CC=CC1=O Amb25106184 [0,2,0,0,0,0|2,0,0]=4 7903 B12R1.124 OC(=O)C(O)c1[n]cccc1F Amb25820427 [0,2,0,0,0,0|1,0,0]=3 7904 B12R1.124 OC(=O)C(O)c1ccccc1I Amb25117434 [0,2,0,0,0,0|0,0,0]=2 7905 B12R1.124 OC(=O)C(c1ccccc1Br)C Amb10844025 [0,2,0,0,0,0|0,0,0]=2 7906 B12R1.124 OC(=O)C(c1ccccc1Br)N Amb2234623 [0,2,0,0,0,0|0,0,0]=2 7907 B12R1.124 OC(=O)C(c1ccccc1C)N Amb1837192 [0,2,0,0,0,0|0,0,0]=2 7908 B12R1.124 OC(=O)C(c1ccccc1Cl)N Amb1841983 [0,2,0,0,0,0|0,0,0]=2 7909 B12R1.124 OC(=O)C(c1ccccc1F)C Amb10843985 [0,2,0,0,0,0|0,0,0]=2 7910 B12R1.124 OC(=O)C(c1ccccc1F)N Amb1837738 [0,2,0,0,0,0|0,0,0]=2 7911 B12R1.124 OC(=O)[C@@H](O)c1ccccc1F Amb22745223 [0,2,0,0,0,0|0,0,0]=2 7912 B12R1.124 OC(=O)[C@H](O)c1ccccc1F Amb24428765 [0,2,0,0,0,0|0,0,0]=2 7913 B12R1.124 Oc1ccccc1C(O)P(O)=O Amb24497278 [0,2,0,0,0,0|1,0,0]=3 7914 B12R1.124 Oc1ncccc1C(=O)C(=O)O Amb1084605 [0,2,0,0,0,0|1,0,1]=4 7915 B12R1.124 [O-]C(=O)C(O)c1ccccc1F Amb22455226 [0,2,0,0,0,0|0,0,1]=3 7916 B12R1.124 [O-]S(=O)C(O)c1ccccc1O Amb25833584 [0,2,0,0,0,0|1,0,1]=4 7917 B12R1.225 Brc1cccc(c1)C(=O)C(=O)C Amb17406920 [0,2,0,0,0,0|1,0,1]=4 7918 B12R1.225 CC(=C)C(N)c1cccc(Cl)c1 Amb25150098 [0,2,0,0,0,0|2,0,0]=4 7919 B12R1.225 CC(=C)C(N)c1cccc(F)c1 Amb25241405 [0,2,0,0,0,0|2,0,0]=4 7920 B12R1.225 CC(=C)C(N)c1cccc(I)c1 Amb24354516 [0,2,0,0,0,0|2,0,0]=4 7921 B12R1.225 CC(=C)C(O)c1cccc(I)c1 Amb24660150 [0,2,0,0,0,0|2,0,0]=4 7922 B12R1.225 CC(=O)C(Br)c1cc(Br)[n]cc1 Amb25717635 [0,2,0,0,0,0|2,0,0]=4 7923 B12R1.225 CC(=O)C(Br)c1cccc(F)c1 Amb24537119 [0,2,0,0,0,0|1,0,0]=3 7924 B12R1.225 CC(=O)C(Br)c1cccc(O)c1 Amb25253266 [0,2,0,0,0,0|1,0,0]=3 7925 B12R1.225 CC(=O)C(C)c1cccc(Br)c1 Amb22753504 [0,2,0,0,0,0|1,0,0]=3 7926 B12R1.225 CC(=O)C(C)c1cccc(Cl)c1 Amb22753502 [0,2,0,0,0,0|1,0,0]=3 7927 B12R1.225 CC(=O)C(C)c1cccc(F)c1 Amb24430167 [0,2,0,0,0,0|1,0,0]=3 7928 B12R1.225 CC(=O)C(C)c1cccc(I)c1 Amb22753511 [0,2,0,0,0,0|1,0,0]=3 7929 B12R1.225 CC(=O)C(C)c1cccc(O)c1 Amb24537925 [0,2,0,0,0,0|1,0,0]=3 7930 B12R1.225 CC(=O)C(Cl)c1cccc(F)c1 Amb24541089 [0,2,0,0,0,0|1,0,0]=3 7931 B12R1.225 CC(=O)C(N)c1c[n]cc(Br)c1 Amb25375793 [0,2,0,0,0,0|2,0,0]=4 7932 B12R1.225 CC(=O)C(N)c1cc(Br)cc[n]1 Amb25111783 [0,2,0,0,0,0|2,0,0]=4 7933 B12R1.225 CC(=O)C(N)c1cc(N)ccc1 Amb24504677 [0,2,0,0,0,0|1,0,0]=3 7934 B12R1.225 CC(=O)C(N)c1cc[n]c(O)c1 Amb24460340 [0,2,0,0,0,0|2,0,0]=4 7935 B12R1.225 CC(=O)C(N)c1cccc(Cl)[n]1 Amb25259198 [0,2,0,0,0,0|2,0,0]=4 7936 B12R1.225 CC(=O)C(N)c1cccc(F)[n]1 Amb25843808 [0,2,0,0,0,0|2,0,0]=4 7937 B12R1.225 CC(=O)C(N)c1cccc(F)c1 Amb25076722 [0,2,0,0,0,0|1,0,0]=3 7938 B12R1.225 CC(=O)C(N)c1cccc(N)[n]1 Amb25709600 [0,2,0,0,0,0|2,0,0]=4 7939 B12R1.225 CC(=O)C(O)c1cccc(F)c1 Amb24706962 [0,2,0,0,0,0|1,0,0]=3 7940 B12R1.225 CC(=O)C(c1cccc(c1)Br)Cl Amb17477760 [0,2,0,0,0,0|1,0,0]=3 7941 B12R1.225 CC(=O)C(c1cccc(c1)C)Cl Amb17477625 [0,2,0,0,0,0|1,0,0]=3 7942 B12R1.225 CC(=O)C(c1cccc(c1)Cl)Cl Amb17477763 [0,2,0,0,0,0|1,0,0]=3 7943 B12R1.225 CC(=O)C(c1cccc(c1)Cl)O Amb17611032 [0,2,0,0,0,0|1,0,0]=3 7944 B12R1.225 CC(=O)C(c1cccc(c1)O)O Amb17594122 [0,2,0,0,0,0|1,0,0]=3 7945 B12R1.225 CC(=O)N(C)c1cccc(F)c1 Amb24607920 [0,2,0,0,0,0|2,0,0]=4 7946 B12R1.225 CC(=O)N(C)c1cccc(O)c1 Amb24432229 [0,2,0,0,0,0|2,0,0]=4 7947 B12R1.225 CC(=O)N(N)c1cccc(Br)c1 Amb18070415 [0,2,0,0,0,0|2,0,0]=4 7948 B12R1.225 CC(=O)N(N)c1cccc(Cl)c1 Amb18564311 [0,2,0,0,0,0|2,0,0]=4 7949 B12R1.225 CC(=O)N(N)c1cccc(F)c1 Amb18563835 [0,2,0,0,0,0|2,0,0]=4 7950 B12R1.225 CC(=O)[C@H](O)c1cc(O)ccc1 Amb25855760 [0,2,0,0,0,0|1,0,0]=3 7951 B12R1.225 CC(=O)[C@H](O)c1cccc(Cl)c1 Amb25832686 [0,2,0,0,0,0|1,0,0]=3 7952 B12R1.225 CC(C(=O)Cl)c1cccc(Br)c1 Amb25150116 [0,2,0,0,0,0|1,0,0]=3 7953 B12R1.225 CC(C(=O)Cl)c1cccc(F)c1 Amb25125145 [0,2,0,0,0,0|1,0,0]=3 7954 B12R1.225 CC(C(C)O)c1cc(Cl)ccc1 Amb24363903 [0,2,0,0,0,0|1,0,1]=4 7955 B12R1.225 CC(C(C)O)c1cc(O)ccc1 Amb25674463 [0,2,0,0,0,0|1,0,1]=4 7956 B12R1.225 CC(C(N)=O)c1cccc(Br)c1 Amb25333205 [0,2,0,0,0,0|1,0,0]=3 7957 B12R1.225 CC(C(N)=O)c1cccc(F)c1 Amb25760785 [0,2,0,0,0,0|1,0,0]=3 7958 B12R1.225 CC(C(N)=O)c1cccc(O)c1 Amb24743243 [0,2,0,0,0,0|1,0,0]=3 7959 B12R1.225 CC(C(O)=O)c1c[n]cc(F)c1 Amb18961443 [0,2,0,0,0,0|1,0,0]=3 7960 B12R1.225 CC(C(O)=O)c1cc[n]c(Cl)c1 Amb25322122 [0,2,0,0,0,0|1,0,0]=3 7961 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb22265668 [0,2,0,0,0,0|0,0,0]=2 7962 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb24061864 [0,2,0,0,0,0|0,0,0]=2 7963 B12R1.225 CC(C(c1cccc(c1)Br)N)O Amb17248845 [0,2,0,0,0,0|1,0,1]=4 7964 B12R1.225 CC(C(c1cccc(c1)C)N)O Amb17232547 [0,2,0,0,0,0|1,0,1]=4 7965 B12R1.225 CC(C(c1cccc(c1)Cl)N)O Amb17234265 [0,2,0,0,0,0|1,0,1]=4 7966 B12R1.225 CC(O)C(N)c1cc(F)ccc1 Amb18199109 [0,2,0,0,0,0|1,0,1]=4 7967 B12R1.225 CC(O)C(N)c1cc(N)ccc1 Amb24504719 [0,2,0,0,0,0|1,0,1]=4 7968 B12R1.225 CC(O)C(N)c1cc(S)ccc1 Amb25840847 [0,2,0,0,0,0|1,0,1]=4 7969 B12R1.225 CC(O)C(O)c1cc(F)ccc1 Amb25244367 [0,2,0,0,0,0|1,0,1]=4 7970 B12R1.225 CC(O)[C@@H](N)c1cc(Cl)ccc1 Amb25840441 [0,2,0,0,0,0|1,0,1]=4 7971 B12R1.225 CC(O)[C@@H](N)c1cc(I)ccc1 Amb25034880 [0,2,0,0,0,0|1,0,1]=4 7972 B12R1.225 CC(O)[C@@H](N)c1cc(S)ccc1 Amb25308042 [0,2,0,0,0,0|1,0,1]=4 7973 B12R1.225 CC(O)[C@H](N)c1cc(F)ccc1 Amb25721022 [0,2,0,0,0,0|1,0,1]=4 7974 B12R1.225 CC(O)[C@H](N)c1cc(O)ccc1 Amb25751697 [0,2,0,0,0,0|1,0,1]=4 7975 B12R1.225 CC(c1cc(O)[n]c[n]1)C(O)=O Amb25234290 [0,2,0,0,0,0|2,0,0]=4 7976 B12R1.225 CC(c1cc(O)ccc1)C(O)=O Amb18646445 [0,2,0,0,0,0|0,0,0]=2 7977 B12R1.225 CN(C(=O)Cl)c1cccc(F)c1 Amb25735378 [0,2,0,0,0,0|2,0,0]=4 7978 B12R1.225 CN(C(N)=O)c1cccc(F)c1 Amb18788753 [0,2,0,0,0,0|2,0,0]=4 7979 B12R1.225 CN(C(N)=O)c1cccc(O)c1 Amb24356761 [0,2,0,0,0,0|2,0,0]=4 7980 B12R1.225 CN(c1cc(N)ccc1)C(N)=O Amb18944888 [0,2,0,0,0,0|2,0,0]=4 7981 B12R1.225 C[C@@H](C(O)=O)c1cccc(F)c1 Amb25108167 [0,2,0,0,0,0|0,0,0]=2 7982 B12R1.225 C[C@@H](C(O)=O)c1cccc(N)c1 Amb24182071 [0,2,0,0,0,0|0,0,0]=2 7983 B12R1.225 C[C@@H](O)[C@@H](N)c1cc(Cl)ccc1 Amb24437217 [0,2,0,0,0,0|1,0,1]=4 7984 B12R1.225 C[C@@H](O)[C@@H](N)c1cc(O)ccc1 Amb25794132 [0,2,0,0,0,0|1,0,1]=4 7985 B12R1.225 C[C@@H](O)[C@@H](O)c1cc(Cl)ccc1 Amb24355161 [0,2,0,0,0,0|1,0,1]=4 7986 B12R1.225 C[C@@H](O)[C@H](N)c1cc(Br)ccc1 Amb24758910 [0,2,0,0,0,0|1,0,1]=4 7987 B12R1.225 C[C@@H](O)[C@H](N)c1cc(Cl)ccc1 Amb24368391 [0,2,0,0,0,0|1,0,1]=4 7988 B12R1.225 C[C@@H](O)[C@H](N)c1cc(N)ccc1 Amb25106841 [0,2,0,0,0,0|1,0,1]=4 7989 B12R1.225 C[C@@H](O)[C@H](O)c1cc(Cl)ccc1 Amb25158199 [0,2,0,0,0,0|1,0,1]=4 7990 B12R1.225 C[C@H](C(N)=O)c1cccc(Cl)c1 Amb25730493 [0,2,0,0,0,0|1,0,0]=3 7991 B12R1.225 C[C@H](C(O)=O)c1cccc(Cl)c1 Amb25124032 [0,2,0,0,0,0|0,0,0]=2 7992 B12R1.225 C[C@H](O)[C@@H](F)c1cc(Cl)ccc1 Amb25343856 [0,2,0,0,0,0|1,0,1]=4 7993 B12R1.225 C[C@H](O)[C@@H](F)c1cc(F)ccc1 Amb24431044 [0,2,0,0,0,0|1,0,1]=4 7994 B12R1.225 C[C@H](O)[C@@H](N)c1cc(Br)ccc1 Amb25238682 [0,2,0,0,0,0|1,0,1]=4 7995 B12R1.225 C[C@H](O)[C@@H](N)c1cc(Cl)ccc1 Amb25076736 [0,2,0,0,0,0|1,0,1]=4 7996 B12R1.225 C[C@H](O)[C@@H](N)c1cc(S)ccc1 Amb24554119 [0,2,0,0,0,0|1,0,1]=4 7997 B12R1.225 C[C@H](O)[C@H](N)c1cc(Cl)ccc1 Amb25761316 [0,2,0,0,0,0|1,0,1]=4 7998 B12R1.225 C[C@H](O)[C@H](O)c1cc(F)ccc1 Amb25220949 [0,2,0,0,0,0|1,0,1]=4 7999 B12R1.225 C[C@H]([C@@H](C)O)c1cc(Cl)ccc1 Amb25803016 [0,2,0,0,0,0|1,0,1]=4 8000 B12R1.225 C[C@H](c1cc(O)ccc1)C(O)=O Amb24677825 [0,2,0,0,0,0|0,0,0]=2 8001 B12R1.225 Cc1[n]c(cc[n]1)C(C)C(O)=O Amb18827827 [0,2,0,0,0,0|2,0,0]=4 8002 B12R1.225 Cc1c[n]cc(c1)C(N)C(C)=O Amb25189486 [0,2,0,0,0,0|2,0,0]=4 8003 B12R1.225 Cc1cc([n]c[n]1)C(C)C(O)=O Amb25034886 [0,2,0,0,0,0|2,0,0]=4 8004 B12R1.225 Cc1cc([n]c[n]1)C(N)C(O)=O Amb18827276 [0,2,0,0,0,0|2,0,0]=4 8005 B12R1.225 Cc1cc([n]cc1)C(O)C(O)=O Amb20246917 [0,2,0,0,0,0|1,0,0]=3 8006 B12R1.225 Cc1cc([n]cc1)[C@@H](N)C(O)=O Amb24462152 [0,2,0,0,0,0|1,0,0]=3 8007 B12R1.225 Cc1cc(c[n]c1)C(N)C(O)=O Amb24488617 [0,2,0,0,0,0|1,0,0]=3 8008 B12R1.225 Cc1cc(c[n]c1)[C@H](N)C(O)=O Amb24485701 [0,2,0,0,0,0|1,0,0]=3 8009 B12R1.225 Cc1cc(cc[n]1)C(C)C(O)=O Amb24584555 [0,2,0,0,0,0|1,0,0]=3 8010 B12R1.225 Cc1cc(cc[n]1)C(N)C(O)=O Amb18827868 [0,2,0,0,0,0|1,0,0]=3 8011 B12R1.225 Cc1cc(ccc1)C(=O)C(O)=O Amb18645964 [0,2,0,0,0,0|0,0,1]=3 8012 B12R1.225 Cc1cc(ccc1)C(Br)C(O)=O Amb25136874 [0,2,0,0,0,0|0,0,0]=2 8013 B12R1.225 Cc1cc(ccc1)C(C)C(=O)Cl Amb25152463 [0,2,0,0,0,0|1,0,0]=3 8014 B12R1.225 Cc1cc(ccc1)C(Cl)C(N)=O Amb19074652 [0,2,0,0,0,0|1,0,0]=3 8015 B12R1.225 Cc1cc(ccc1)C(Cl)C(O)=O Amb18564302 [0,2,0,0,0,0|0,0,0]=2 8016 B12R1.225 Cc1cc(ccc1)C(F)C(N)=O Amb25117936 [0,2,0,0,0,0|1,0,0]=3 8017 B12R1.225 Cc1cc(ccc1)C(O)C(=O)Cl Amb24095714 [0,2,0,0,0,0|1,0,0]=3 8018 B12R1.225 Cc1cc(ccc1)C(O)C(N)=O Amb18800895 [0,2,0,0,0,0|1,0,0]=3 8019 B12R1.225 Cc1cc(ccc1)N(C)C(N)=O Amb18788282 [0,2,0,0,0,0|2,0,0]=4 8020 B12R1.225 Cc1cc(ccc1)N(N)C(N)=O Amb25152377 [0,2,0,0,0,0|2,0,0]=4 8021 B12R1.225 Cc1cc(ccc1)[C@@H](C)C(O)=O Amb25065324 [0,2,0,0,0,0|0,0,0]=2 8022 B12R1.225 Cc1cc(ccc1)[C@@H](F)C(N)=O Amb24399357 [0,2,0,0,0,0|1,0,0]=3 8023 B12R1.225 Cc1cc(ccc1)[C@@H](N)C(O)=O Amb24182070 [0,2,0,0,0,0|0,0,0]=2 8024 B12R1.225 Cc1cc(ccc1)[C@H]([NH3+])C([O-])=O Amb24068288 [0,2,0,0,0,0|0,0,1]=3 8025 B12R1.225 Cc1cc[n]c([n]1)C(C)C(O)=O Amb24732375 [0,2,0,0,0,0|2,0,0]=4 8026 B12R1.225 Cc1cccc([n]1)C(O)C(O)=O Amb20246916 [0,2,0,0,0,0|1,0,0]=3 8027 B12R1.225 Cc1cccc(c1)C(=C)C(=O)O Amb17322165 [0,2,0,0,0,0|0,0,1]=3 8028 B12R1.225 Cc1cccc(c1)C(=O)C(=O)C Amb17400104 [0,2,0,0,0,0|1,0,1]=4 8029 B12R1.225 Cc1cccc(c1)C(O)C(C)=O Amb25801127 [0,2,0,0,0,0|1,0,0]=3 8030 B12R1.225 Cc1cccc(c1)N(C)C(C)=O Amb24413264 [0,2,0,0,0,0|2,0,0]=4 8031 B12R1.225 Cc1cccc(c1)N(N)C(C)=O Amb18563637 [0,2,0,0,0,0|2,0,0]=4 8032 B12R1.225 Cc1cccc(c1)[C@@H](C)C(C)=O Amb25707020 [0,2,0,0,0,0|1,0,0]=3 8033 B12R1.225 Cc1cccc(c1)[C@@H](C)[C@@H](C)O Amb25357646 [0,2,0,0,0,0|1,0,1]=4 8034 B12R1.225 Cc1cccc(c1)[C@H](C)C(C)=O Amb25143362 [0,2,0,0,0,0|1,0,0]=3 8035 B12R1.225 Cc1cccc(c1)[C@H](N)[C@@H](C)O Amb25081648 [0,2,0,0,0,0|1,0,1]=4 8036 B12R1.225 Cc1cccc(c1)[C@H](N)[C@H](C)O Amb24426831 [0,2,0,0,0,0|1,0,1]=4 8037 B12R1.225 Clc1cccc(c1)C(=C)C(=O)O Amb17322175 [0,2,0,0,0,0|0,0,1]=3 8038 B12R1.225 Clc1cccc(c1)C(=O)C(=O)C Amb17400962 [0,2,0,0,0,0|1,0,1]=4 8039 B12R1.225 Fc1cccc(c1)C(=C)C(=O)O Amb17322168 [0,2,0,0,0,0|0,0,1]=3 8040 B12R1.225 Fc1cccc(c1)C(=O)C(=O)C Amb17400193 [0,2,0,0,0,0|1,0,1]=4 8041 B12R1.225 NC(=N)C(O)c1cccc(Cl)c1 Amb25144070 [0,2,0,0,0,0|2,0,0]=4 8042 B12R1.225 NC(=O)C(=O)c1cc(Cl)ccc1 Amb24696640 [0,2,0,0,0,0|1,0,1]=4 8043 B12R1.225 NC(=O)C(Cl)c1cc(Cl)ccc1 Amb25089760 [0,2,0,0,0,0|1,0,0]=3 8044 B12R1.225 NC(=O)C(Cl)c1cccc(Br)c1 Amb22059075 [0,2,0,0,0,0|1,0,0]=3 8045 B12R1.225 NC(=O)C(Cl)c1cccc(F)c1 Amb18329808 [0,2,0,0,0,0|1,0,0]=3 8046 B12R1.225 NC(=O)C(N)c1cccc(Cl)c1 Amb22487627 [0,2,0,0,0,0|1,0,0]=3 8047 B12R1.225 NC(=O)C(N)c1cccc(F)c1 Amb18949669 [0,2,0,0,0,0|1,0,0]=3 8048 B12R1.225 NC(=O)C(O)c1cc(O)ccc1 Amb18805579 [0,2,0,0,0,0|1,0,0]=3 8049 B12R1.225 NC(=O)C(O)c1cccc(Br)c1 Amb24123026 [0,2,0,0,0,0|1,0,0]=3 8050 B12R1.225 NC(=O)C(O)c1cccc(Cl)c1 Amb19075670 [0,2,0,0,0,0|1,0,0]=3 8051 B12R1.225 NC(=O)C(O)c1cccc(F)c1 Amb18806072 [0,2,0,0,0,0|1,0,0]=3 8052 B12R1.225 NC(=O)C(O)c1cccc(I)c1 Amb24554086 [0,2,0,0,0,0|1,0,0]=3 8053 B12R1.225 NC(=O)C(c1cccc(c1)Br)N Amb13951644 [0,2,0,0,0,0|1,0,0]=3 8054 B12R1.225 NC(=O)C(c1cccc(c1)C)N Amb17334618 [0,2,0,0,0,0|1,0,0]=3 8055 B12R1.225 NC(=O)C(c1cccc(c1)Cl)N Amb17335726 [0,2,0,0,0,0|1,0,0]=3 8056 B12R1.225 NC(=O)C(c1cccc(c1)O)N Amb17334666 [0,2,0,0,0,0|1,0,0]=3 8057 B12R1.225 NC(=O)[C@H](O)c1cccc(Cl)c1 Amb24443861 [0,2,0,0,0,0|1,0,0]=3 8058 B12R1.225 NC(=S)C(O)c1cccc(Cl)c1 Amb25041787 [0,2,0,0,0,0|1,1,0]=4 8059 B12R1.225 NC(C(=O)Cl)c1cc(Cl)ccc1 Amb25764846 [0,2,0,0,0,0|1,0,0]=3 8060 B12R1.225 NC(C(O)=O)c1c[n]cc(Cl)c1 Amb25149922 [0,2,0,0,0,0|1,0,0]=3 8061 B12R1.225 NC(C(O)=O)c1c[n]cc(F)c1 Amb25751298 [0,2,0,0,0,0|1,0,0]=3 8062 B12R1.225 NC(C(O)=O)c1cc[n]c(F)c1 Amb24599975 [0,2,0,0,0,0|1,0,0]=3 8063 B12R1.225 NC(C(O)=O)c1cccc(Br)[n]1 Amb25828657 [0,2,0,0,0,0|1,0,0]=3 8064 B12R1.225 NC(C(O)=O)c1cccc(Cl)[n]1 Amb24531519 [0,2,0,0,0,0|1,0,0]=3 8065 B12R1.225 NC(C(O)=O)c1cccc(F)[n]1 Amb24487122 [0,2,0,0,0,0|1,0,0]=3 8066 B12R1.225 NC(c1cc(O)cc[n]1)C(O)=O Amb24410976 [0,2,0,0,0,0|1,0,0]=3 8067 B12R1.225 NC(c1cc(O)ccc1)C(O)=O Amb21959949 [0,2,0,0,0,0|0,0,0]=2 8068 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(Br)c1 Amb24532664 [0,2,0,0,0,0|1,0,0]=3 8069 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(Cl)c1 Amb25736271 [0,2,0,0,0,0|1,0,0]=3 8070 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(F)c1 Amb25299280 [0,2,0,0,0,0|1,0,0]=3 8071 B12R1.225 N[C@@H](C(O)=O)c1cc(Br)cc[n]1 Amb25270715 [0,2,0,0,0,0|1,0,0]=3 8072 B12R1.225 N[C@@H](C(O)=O)c1cc(Cl)cc[n]1 Amb24417076 [0,2,0,0,0,0|1,0,0]=3 8073 B12R1.225 N[C@@H](C(O)=O)c1cc[n]c(Br)c1 Amb25082617 [0,2,0,0,0,0|1,0,0]=3 8074 B12R1.225 N[C@@H](C(O)=O)c1cccc(Br)c1 Amb25122869 [0,2,0,0,0,0|0,0,0]=2 8075 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)[n]1 Amb25046108 [0,2,0,0,0,0|1,0,0]=3 8076 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb22899025 [0,2,0,0,0,0|0,0,0]=2 8077 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb23399639 [0,2,0,0,0,0|0,0,0]=2 8078 B12R1.225 N[C@@H](C(O)=O)c1cccc(I)c1 Amb24342192 [0,2,0,0,0,0|0,0,0]=2 8079 B12R1.225 N[C@@H](C(O)=O)c1cccc(S)c1 Amb25361957 [0,2,0,0,0,0|0,0,0]=2 8080 B12R1.225 N[C@@H](c1cc(O)c[n]c1)C(O)=O Amb25724341 [0,2,0,0,0,0|1,0,0]=3 8081 B12R1.225 N[C@@H](c1cc(O)ccc1)C(O)=O Amb25294728 [0,2,0,0,0,0|0,0,0]=2 8082 B12R1.225 N[C@@H](c1cccc(O)[n]1)C(O)=O Amb24406730 [0,2,0,0,0,0|1,0,0]=3 8083 B12R1.225 N[C@H](C(O)=O)c1c[n]cc(Br)c1 Amb24461604 [0,2,0,0,0,0|1,0,0]=3 8084 B12R1.225 N[C@H](C(O)=O)c1c[n]cc(Cl)c1 Amb24583875 [0,2,0,0,0,0|1,0,0]=3 8085 B12R1.225 N[C@H](C(O)=O)c1cc(Br)cc[n]1 Amb24756460 [0,2,0,0,0,0|1,0,0]=3 8086 B12R1.225 N[C@H](C(O)=O)c1cc(Cl)cc[n]1 Amb24707713 [0,2,0,0,0,0|1,0,0]=3 8087 B12R1.225 N[C@H](C(O)=O)c1cc[n]c(Br)c1 Amb24695338 [0,2,0,0,0,0|1,0,0]=3 8088 B12R1.225 N[C@H](C(O)=O)c1cccc(Br)c1 Amb25150059 [0,2,0,0,0,0|0,0,0]=2 8089 B12R1.225 N[C@H](C(O)=O)c1cccc(Cl)c1 Amb19889600 [0,2,0,0,0,0|0,0,0]=2 8090 B12R1.225 Nc1c[n]cc(c1)C(N)C(O)=O Amb25152306 [0,2,0,0,0,0|1,0,0]=3 8091 B12R1.225 Nc1c[n]cc(c1)[C@@H](N)C(O)=O Amb24485432 [0,2,0,0,0,0|1,0,0]=3 8092 B12R1.225 Nc1c[n]cc(c1)[C@H](N)C(O)=O Amb24422889 [0,2,0,0,0,0|1,0,0]=3 8093 B12R1.225 Nc1cc(cc[n]1)[C@@H](N)C(O)=O Amb25667081 [0,2,0,0,0,0|1,0,0]=3 8094 B12R1.225 Nc1cc(cc[n]1)[C@H](N)C(O)=O Amb24452048 [0,2,0,0,0,0|1,0,0]=3 8095 B12R1.225 Nc1cc(ccc1)C(N)C(O)=O Amb18646483 [0,2,0,0,0,0|0,0,0]=2 8096 B12R1.225 Nc1cc(ccc1)C(O)C(O)=O Amb18646668 [0,2,0,0,0,0|0,0,0]=2 8097 B12R1.225 Nc1cc[n]c(c1)[C@@H](N)C(O)=O Amb24364737 [0,2,0,0,0,0|1,0,0]=3 8098 B12R1.225 Nc1cc[n]c(c1)[C@H](N)C(O)=O Amb25106778 [0,2,0,0,0,0|1,0,0]=3 8099 B12R1.225 Nc1cccc(c1)N(C(=O)C)C Amb10975760 [0,2,0,0,0,0|2,0,0]=4 8100 B12R1.225 O=C(Cl)C(F)c1cc(F)ccc1 Amb25689085 [0,2,0,0,0,0|1,0,0]=3 8101 B12R1.225 OC(=O)C(=O)c1cc(Br)ccc1 Amb18135081 [0,2,0,0,0,0|0,0,1]=3 8102 B12R1.225 OC(=O)C(=O)c1cc(Cl)ccc1 Amb18649007 [0,2,0,0,0,0|0,0,1]=3 8103 B12R1.225 OC(=O)C(=O)c1cc(F)ccc1 Amb18646830 [0,2,0,0,0,0|0,0,1]=3 8104 B12R1.225 OC(=O)C(Br)c1cc(Br)ccc1 Amb25053820 [0,2,0,0,0,0|0,0,0]=2 8105 B12R1.225 OC(=O)C(Br)c1cccc(Cl)c1 Amb25302971 [0,2,0,0,0,0|0,0,0]=2 8106 B12R1.225 OC(=O)C(Cl)c1cc(Cl)ccc1 Amb18066588 [0,2,0,0,0,0|0,0,0]=2 8107 B12R1.225 OC(=O)C(Cl)c1cccc(Br)c1 Amb18582806 [0,2,0,0,0,0|0,0,0]=2 8108 B12R1.225 OC(=O)C(O)c1c[n]cc(Br)c1 Amb25829664 [0,2,0,0,0,0|1,0,0]=3 8109 B12R1.225 OC(=O)C(O)c1c[n]cc(F)c1 Amb25131443 [0,2,0,0,0,0|1,0,0]=3 8110 B12R1.225 OC(=O)C(O)c1cccc(I)c1 Amb25223767 [0,2,0,0,0,0|0,0,0]=2 8111 B12R1.225 OC(=O)C(c1cccc(c1)Br)C Amb10602488 [0,2,0,0,0,0|0,0,0]=2 8112 B12R1.225 OC(=O)C(c1cccc(c1)Br)N Amb2431609 [0,2,0,0,0,0|0,0,0]=2 8113 B12R1.225 OC(=O)C(c1cccc(c1)C)C Amb17232469 [0,2,0,0,0,0|0,0,0]=2 8114 B12R1.225 OC(=O)C(c1cccc(c1)C)N Amb1840070 [0,2,0,0,0,0|0,0,0]=2 8115 B12R1.225 OC(=O)C(c1cccc(c1)Cl)N Amb1840776 [0,2,0,0,0,0|0,0,0]=2 8116 B12R1.225 OC(=O)C(c1cccc(c1)F)C Amb17232662 [0,2,0,0,0,0|0,0,0]=2 8117 B12R1.225 OC(=O)C(c1cccc(c1)F)N Amb2431604 [0,2,0,0,0,0|0,0,0]=2 8118 B12R1.225 OC(=O)[C@@H](O)c1cccc(Cl)c1 Amb22388644 [0,2,0,0,0,0|0,0,0]=2 8119 B12R1.225 OC(=O)[C@@H](O)c1cccc(F)c1 Amb24429173 [0,2,0,0,0,0|0,0,0]=2 8120 B12R1.225 OC(=O)[C@H](O)c1cccc(Br)c1 Amb24604441 [0,2,0,0,0,0|0,0,0]=2 8121 B12R1.225 OC(=O)[C@H](O)c1cccc(Cl)c1 Amb22351582 [0,2,0,0,0,0|0,0,0]=2 8122 B12R1.225 OC(C(=O)Cl)c1cccc(F)c1 Amb24068439 [0,2,0,0,0,0|1,0,0]=3 8123 B12R1.225 Oc1cccc(c1)C(S)C(O)=O Amb25295477 [0,2,0,0,0,0|0,0,0]=2 8124 B12R1.225 Oc1cccc(c1)[C@@H](O)C(O)=O Amb25036246 [0,2,0,0,0,0|0,0,0]=2 8125 B12R1.253 CC(=C)C(C)(N)c1ccccc1 Amb18645556 [0,2,0,0,0,0|2,0,0]=4 8126 B12R1.253 CC(=O)C(C)(N)c1ccccc1 Amb24738601 [0,2,0,0,0,0|1,0,0]=3 8127 B12R1.253 CC(=O)C(F)(F)c1ccc[n]c1 Amb25770743 [0,2,0,0,0,0|2,0,0]=4 8128 B12R1.253 CC(=O)C(F)(F)c1cccc[n]1 Amb24414131 [0,2,0,0,0,0|2,0,0]=4 8129 B12R1.253 CC(=O)C(F)(F)c1ccccc1 Amb24105402 [0,2,0,0,0,0|1,0,0]=3 8130 B12R1.253 CC(=O)C(c1cccnc1)(O)C Amb1084728 [0,2,0,0,0,0|2,0,0]=4 8131 B12R1.253 CC(Br)(C(O)=O)c1ccccc1 Amb18135055 [0,2,0,0,0,0|0,0,0]=2 8132 B12R1.253 CC(C)(C(N)=S)c1ccccc1 Amb18791064 [0,2,0,0,0,0|1,1,0]=4 8133 B12R1.253 CC(C)(C(O)=O)c1c[n]c[n]c1 Amb18962097 [0,2,0,0,0,0|2,0,0]=4 8134 B12R1.253 CC(C)(C(O)=O)c1c[n]cc[n]1 Amb18827857 [0,2,0,0,0,0|2,0,0]=4 8135 B12R1.253 CC(C)(C(O)=O)c1cc[n]c[n]1 Amb18827921 [0,2,0,0,0,0|2,0,0]=4 8136 B12R1.253 CC(C)(C(O)=O)c1cc[n]cc1 Amb18828397 [0,2,0,0,0,0|1,0,0]=3 8137 B12R1.253 CC(C)(C(O)=O)c1ccc[n][n]1 Amb25769960 [0,2,0,0,0,0|2,0,0]=4 8138 B12R1.253 CC(C)(C(O)=O)c1ccc[n]c1 Amb18285914 [0,2,0,0,0,0|1,0,0]=3 8139 B12R1.253 CC(C)(C(O)=O)c1cccc[n]1 Amb19930001 [0,2,0,0,0,0|1,0,0]=3 8140 B12R1.253 CC(C)(C(O)=O)c1ccccc1 Amb17773441 [0,2,0,0,0,0|0,0,0]=2 8141 B12R1.253 CC(C)(C([O-])=O)c1cccc[n]1 Amb19944551 [0,2,0,0,0,0|1,0,1]=4 8142 B12R1.253 CC(C)(C([O-])=O)c1ccncc1 Amb17748502 [0,2,0,0,0,0|1,0,1]=4 8143 B12R1.253 CC(Cl)(C(O)=O)c1ccccc1 Amb18649035 [0,2,0,0,0,0|0,0,0]=2 8144 B12R1.253 CC(F)(C(N)=O)c1cccc[n]1 Amb22547024 [0,2,0,0,0,0|2,0,0]=4 8145 B12R1.253 CC(F)(C(N)=O)c1ccccc1 Amb22547011 [0,2,0,0,0,0|1,0,0]=3 8146 B12R1.253 CC(F)(C(O)=O)c1ccccc1 Amb22547630 [0,2,0,0,0,0|0,0,0]=2 8147 B12R1.253 CC(N)(C(O)=O)c1c[n]c[n]c1 Amb25840848 [0,2,0,0,0,0|2,0,0]=4 8148 B12R1.253 CC(N)(C(O)=O)c1c[n]cc[n]1 Amb25339411 [0,2,0,0,0,0|2,0,0]=4 8149 B12R1.253 CC(N)(c1c[n]ccc1)C(N)=O Amb18281146 [0,2,0,0,0,0|2,0,0]=4 8150 B12R1.253 CC(N)(c1cc[n]cc1)C(N)=O Amb18949666 [0,2,0,0,0,0|2,0,0]=4 8151 B12R1.253 CC(N)(c1cccc[n]1)C(N)=O Amb18949664 [0,2,0,0,0,0|2,0,0]=4 8152 B12R1.253 CC(O)(C(N)=O)c1cc[n]cc1 Amb18801016 [0,2,0,0,0,0|2,0,0]=4 8153 B12R1.253 CC(O)(C(N)=O)c1ccc[n]c1 Amb18801015 [0,2,0,0,0,0|2,0,0]=4 8154 B12R1.253 CC(O)(C(N)=O)c1cccc[n]1 Amb18801014 [0,2,0,0,0,0|2,0,0]=4 8155 B12R1.253 CC(O)(c1c[n]ccc1)C(O)=O Amb18951996 [0,2,0,0,0,0|1,0,0]=3 8156 B12R1.253 CC(O)(c1cc[n]c[n]1)C(O)=O Amb25335828 [0,2,0,0,0,0|2,0,0]=4 8157 B12R1.253 CC(O)(c1cc[n]cc1)C(O)=O Amb18952010 [0,2,0,0,0,0|1,0,0]=3 8158 B12R1.253 CC(O)(c1cccc[n]1)C(O)=O Amb18952001 [0,2,0,0,0,0|1,0,0]=3 8159 B12R1.253 CC(O)(c1cccc[sH]1)C(O)=O Amb22547022 [0,2,0,0,0,0|1,0,0]=3 8160 B12R1.253 CC(O)(c1ccccc1)C(O)=O Amb22347941 [0,2,0,0,0,0|0,0,0]=2 8161 B12R1.253 CC(O)C(C)(C)c1ccccc1 Amb18177805 [0,2,0,0,0,0|1,0,1]=4 8162 B12R1.253 CC(O)C(C)(N)c1ccccc1 Amb24678253 [0,2,0,0,0,0|1,0,1]=4 8163 B12R1.253 CS(=O)C(C)(C)c1ccccc1 Amb24388215 [0,2,0,0,0,0|2,0,0]=4 8164 B12R1.253 C[C@@H](O)C(C)(C)c1ccccc1 Amb24459428 [0,2,0,0,0,0|1,0,1]=4 8165 B12R1.253 C[C@@H](O)[C@@](C)(O)c1ccccc1 Amb24421586 [0,2,0,0,0,0|1,0,1]=4 8166 B12R1.253 C[C@@H](O)[C@](C)(F)c1ccccc1 Amb25234752 [0,2,0,0,0,0|1,0,1]=4 8167 B12R1.253 C[C@@H](O)[C@](C)(O)c1ccccc1 Amb25098651 [0,2,0,0,0,0|1,0,1]=4 8168 B12R1.253 C[C@@](F)(C(O)=O)c1ccccc1 Amb25279569 [0,2,0,0,0,0|0,0,0]=2 8169 B12R1.253 C[C@@](N)(C(O)=O)c1c[n]c[n]c1 Amb24443519 [0,2,0,0,0,0|2,0,0]=4 8170 B12R1.253 C[C@@](N)(C(O)=O)c1c[n]cc[n]1 Amb25142458 [0,2,0,0,0,0|2,0,0]=4 8171 B12R1.253 C[C@@](N)(C(O)=O)c1ccc[n]c1 Amb24716336 [0,2,0,0,0,0|1,0,0]=3 8172 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22225774 [0,2,0,0,0,0|0,0,0]=2 8173 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22747027 [0,2,0,0,0,0|0,0,0]=2 8174 B12R1.253 C[C@@](N)(c1ccccc1)C(N)=O Amb24341528 [0,2,0,0,0,0|1,0,0]=3 8175 B12R1.253 C[C@@](O)(C(N)=N)c1ccccc1 Amb25061216 [0,2,0,0,0,0|2,0,0]=4 8176 B12R1.253 C[C@@](O)(C(N)=O)c1ccccc1 Amb24595768 [0,2,0,0,0,0|1,0,0]=3 8177 B12R1.253 C[C@H](O)C(C)(C)c1ccccc1 Amb24461815 [0,2,0,0,0,0|1,0,1]=4 8178 B12R1.253 C[C@H](O)[C@@](C)(F)c1ccccc1 Amb25356375 [0,2,0,0,0,0|1,0,1]=4 8179 B12R1.253 C[C@](F)(C(O)=O)c1ccccc1 Amb25100972 [0,2,0,0,0,0|0,0,0]=2 8180 B12R1.253 C[C@](N)(C(O)=O)c1cc[n]cc1 Amb24341761 [0,2,0,0,0,0|1,0,0]=3 8181 B12R1.253 C[C@](N)(C(O)=O)c1cccc[n]1 Amb24562027 [0,2,0,0,0,0|1,0,0]=3 8182 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb19929597 [0,2,0,0,0,0|0,0,0]=2 8183 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb25692685 [0,2,0,0,0,0|0,0,0]=2 8184 B12R1.253 C[C@](N)(c1ccccc1)C(N)=O Amb25374916 [0,2,0,0,0,0|1,0,0]=3 8185 B12R1.253 C[C@](O)(c1ccccc1)C(O)=O Amb22226510 [0,2,0,0,0,0|0,0,0]=2 8186 B12R1.253 C[Si](C)(C(N)=O)c1ccccc1 Amb24497249 [0,2,0,0,0,0|1,1,0]=4 8187 B12R1.253 NC(=O)C(c1ccccc1)(F)F Amb1104586 [0,2,0,0,0,0|1,0,0]=3 8188 B12R1.253 NC(=O)C(c1ccccc1)(N)C Amb13952027 [0,2,0,0,0,0|1,0,0]=3 8189 B12R1.253 NC(=O)C(c1ccccn1)(F)F Amb10840433 [0,2,0,0,0,0|2,0,0]=4 8190 B12R1.253 NC(=S)C(Cl)(Cl)c1ccccc1 Amb19148545 [0,2,0,0,0,0|1,1,0]=4 8191 B12R1.253 NC(O)(c1ccccc1)C(O)=O Amb24092513 [0,2,0,0,0,0|0,0,0]=2 8192 B12R1.253 O=C(F)C(F)(F)c1ccccc1 Amb25108603 [0,2,0,0,0,0|1,0,0]=3 8193 B12R1.253 OC(=O)C(Cl)(Br)c1ccccc1 Amb25679634 [0,2,0,0,0,0|0,0,0]=2 8194 B12R1.253 OC(=O)C(Cl)(Cl)c1ccccc1 Amb25674448 [0,2,0,0,0,0|0,0,0]=2 8195 B12R1.253 OC(=O)C(F)(Cl)c1ccccc1 Amb24532752 [0,2,0,0,0,0|0,0,0]=2 8196 B12R1.253 OC(=O)C(F)(F)c1c[n]c[n]c1 Amb18185804 [0,2,0,0,0,0|2,0,0]=4 8197 B12R1.253 OC(=O)C(F)(F)c1cc[n]c[n]1 Amb24387276 [0,2,0,0,0,0|2,0,0]=4 8198 B12R1.253 OC(=O)C(F)(F)c1cc[n]cc1 Amb23585649 [0,2,0,0,0,0|1,0,0]=3 8199 B12R1.253 OC(=O)C(F)(F)c1ccc[n]c1 Amb18183748 [0,2,0,0,0,0|1,0,0]=3 8200 B12R1.253 OC(=O)C(F)(F)c1cccc[n]1 Amb20668303 [0,2,0,0,0,0|1,0,0]=3 8201 B12R1.253 OC(=O)C(O)(O)c1ccccc1 Amb25684790 [0,2,0,0,0,0|0,0,0]=2 8202 B12R1.253 OC(=O)C(c1ccccc1)(F)F Amb1197472 [0,2,0,0,0,0|0,0,0]=2 8203 B12R1.253 OC(=O)C(c1ccccc1)(N)C Amb10711147 [0,2,0,0,0,0|0,0,0]=2 8204 B12R1.253 OC(=O)C(c1ccccn1)(F)F Amb10840437 [0,2,0,0,0,0|1,0,0]=3 8205 B12R1.253 OC(F)C(F)(F)c1ccccc1 Amb25206683 [0,2,0,0,0,0|1,0,1]=4 8206 B12R1.253 [2H]C([2H])(C(O)=O)c1ccccc1 Amb22353301 [0,2,0,0,0,0|0,0,0]=2 8207 B12R1.253 [O-][N+](=O)C(F)(F)c1ccccc1 Amb24616890 [0,2,0,0,0,0|1,0,1]=4 8208 B12R1.478 C/C(O)=C(/C=O)c1ccccc1 Amb17777663 [0,2,0,0,0,0|1,0,1]=4 8209 B12R1.478 C=C=C(C(O)=O)c1ccccc1 Amb24717361 [0,2,0,0,0,0|0,0,1]=3 8210 B12R1.478 C=CC(C(N)=O)c1ccccc1 Amb25361995 [0,2,0,0,0,0|1,0,0]=3 8211 B12R1.478 C=CC(C(O)=O)c1ccccc1 Amb18645652 [0,2,0,0,0,0|0,0,0]=2 8212 B12R1.478 C=NC(C(O)=O)c1ccccc1 Amb24068840 [0,2,0,0,0,0|0,0,0]=2 8213 B12R1.478 CC(=C)C(NN)c1ccccc1 Amb24438127 [0,2,0,0,0,0|2,0,0]=4 8214 B12R1.478 CC(=C)[C@@H](CO)c1ccccc1 Amb25157975 [0,2,0,0,0,0|2,0,0]=4 8215 B12R1.478 CC(=O)C(/c1ccccc1)=C\N Amb17777807 [0,2,0,0,0,0|1,0,1]=4 8216 B12R1.478 CC(=O)C(=C=O)c1ccccc1 Amb25730145 [0,2,0,0,0,0|1,0,1]=4 8217 B12R1.478 CC(=O)C(=[N+]=[N-])c1ccccc1 Amb17593995 [0,2,0,0,0,0|1,0,1]=4 8218 B12R1.478 CC(=O)C(C=C)c1ccccc1 Amb24736196 [0,2,0,0,0,0|1,0,0]=3 8219 B12R1.478 CC(=O)C(C=N)c1ccccc1 Amb21952033 [0,2,0,0,0,0|1,0,0]=3 8220 B12R1.478 CC(=O)C(C=O)c1ccccc1 Amb18126328 [0,2,0,0,0,0|1,0,0]=3 8221 B12R1.478 CC(=O)C(CC)c1c[n]ccc1 Amb24448949 [0,2,0,0,0,0|2,0,0]=4 8222 B12R1.478 CC(=O)C(CC)c1cc[n]cc1 Amb25354421 [0,2,0,0,0,0|2,0,0]=4 8223 B12R1.478 CC(=O)C(CCl)c1ccccc1 Amb24565751 [0,2,0,0,0,0|1,0,0]=3 8224 B12R1.478 CC(=O)C(CN)c1ccccc1 Amb25148601 [0,2,0,0,0,0|1,0,0]=3 8225 B12R1.478 CC(=O)C(CO)c1ccccc1 Amb21962499 [0,2,0,0,0,0|1,0,0]=3 8226 B12R1.478 CC(=O)C(N=O)c1ccccc1 Amb25322912 [0,2,0,0,0,0|1,0,0]=3 8227 B12R1.478 CC(=O)C(OC)c1c[n]ccc1 Amb25115527 [0,2,0,0,0,0|2,0,0]=4 8228 B12R1.478 CC(=O)N(C=C)c1ccccc1 Amb24563080 [0,2,0,0,0,0|2,0,0]=4 8229 B12R1.478 CC(=O)\C(=C\C)\c1ccccc1 Amb24378467 [0,2,0,0,0,0|1,0,1]=4 8230 B12R1.478 CC(=O)\C(=C\N)\c1ccccc1 Amb25238332 [0,2,0,0,0,0|1,0,1]=4 8231 B12R1.478 CC(=O)\C(=N\O)\c1ccccc1 Amb24700799 [0,2,0,0,0,0|1,0,1]=4 8232 B12R1.478 CC(O)C(NC)c1ccccc1 Amb18646387 [0,2,0,0,0,0|1,0,1]=4 8233 B12R1.478 CC(O)C(OC)c1ccccc1 Amb25700350 [0,2,0,0,0,0|1,0,1]=4 8234 B12R1.478 CC(O)C(SC)c1ccccc1 Amb25796298 [0,2,0,0,0,0|1,0,1]=4 8235 B12R1.478 CCC(C(N)=N)c1ccccc1 Amb24726150 [0,2,0,0,0,0|2,0,0]=4 8236 B12R1.478 CCC(C(O)=O)c1c[n]c[n]c1 Amb18300654 [0,2,0,0,0,0|2,0,0]=4 8237 B12R1.478 CCC(C(O)=O)c1c[n]cc[n]1 Amb18827856 [0,2,0,0,0,0|2,0,0]=4 8238 B12R1.478 CCC(C(O)=O)c1cc[n]c[n]1 Amb18827920 [0,2,0,0,0,0|2,0,0]=4 8239 B12R1.478 CCC(C(O)=O)c1ccc[n]c1 Amb18999434 [0,2,0,0,0,0|1,0,0]=3 8240 B12R1.478 CCC(C(O)=O)c1cccc[n]1 Amb25116759 [0,2,0,0,0,0|1,0,0]=3 8241 B12R1.478 CCC(c1ccccc1)[N+]([O-])=O Amb24730815 [0,2,0,0,0,0|1,0,1]=4 8242 B12R1.478 CCN(c1ccccc1)C(=O)Cl Amb17563104 [0,2,0,0,0,0|2,0,0]=4 8243 B12R1.478 CCN(c1ccccc1)C(=O)N Amb1138727 [0,2,0,0,0,0|2,0,0]=4 8244 B12R1.478 CC[C@@H](C(=O)Cl)c1ccccc1 Amb25207875 [0,2,0,0,0,0|1,0,0]=3 8245 B12R1.478 CC[C@@H](C(N)=O)c1ccccc1 Amb25034606 [0,2,0,0,0,0|1,0,0]=3 8246 B12R1.478 CNC(C(O)=O)c1cc[n]cc1 Amb23555580 [0,2,0,0,0,0|1,0,0]=3 8247 B12R1.478 CNC(C(O)=O)c1cccc[n]1 Amb25159848 [0,2,0,0,0,0|1,0,0]=3 8248 B12R1.478 CNC(C(O)=O)c1ccccc1 Amb19346335 [0,2,0,0,0,0|0,0,0]=2 8249 B12R1.478 CNC(c1ccccc1)C(=O)N Amb17334616 [0,2,0,0,0,0|1,0,0]=3 8250 B12R1.478 CNC(c1ccccn1)C(=O)N Amb17334638 [0,2,0,0,0,0|2,0,0]=4 8251 B12R1.478 CNC(c1cccnc1)C(=O)N Amb17334639 [0,2,0,0,0,0|2,0,0]=4 8252 B12R1.478 CNC(c1ccncc1)C(=O)N Amb17334640 [0,2,0,0,0,0|2,0,0]=4 8253 B12R1.478 CN[C@@H](c1ccccc1)C(=O)O Amb16183859 [0,2,0,0,0,0|0,0,0]=2 8254 B12R1.478 CN[C@H](c1ccccc1)C(=O)O Amb16183947 [0,2,0,0,0,0|0,0,0]=2 8255 B12R1.478 COC(C(O)=O)c1c[n]c[n]c1 Amb24607583 [0,2,0,0,0,0|2,0,0]=4 8256 B12R1.478 COC(C([O-])=O)c1ccccc1 Amb23440840 [0,2,0,0,0,0|0,0,1]=3 8257 B12R1.478 COC(C([O-])=O)c1ccccc1 Amb24325342 [0,2,0,0,0,0|0,0,1]=3 8258 B12R1.478 COC(c1ccccc1)C(=O)C Amb10562726 [0,2,0,0,0,0|1,0,0]=3 8259 B12R1.478 COC(c1ccccc1)C(=O)N Amb10769824 [0,2,0,0,0,0|1,0,0]=3 8260 B12R1.478 COC(c1ccccc1)C(=O)O Amb2099459 [0,2,0,0,0,0|0,0,0]=2 8261 B12R1.478 CO[C@@H](C(N)=O)c1ccccc1 Amb25363386 [0,2,0,0,0,0|1,0,0]=3 8262 B12R1.478 CS(=O)[C@@H](CO)c1ccccc1 Amb25831961 [0,2,0,0,0,0|2,0,0]=4 8263 B12R1.478 CSC(C(N)=O)c1ccccc1 Amb25066103 [0,2,0,0,0,0|1,0,0]=3 8264 B12R1.478 CSC(C(O)=O)c1ccccc1 Amb18971615 [0,2,0,0,0,0|0,0,0]=2 8265 B12R1.478 C[C@@H](O)[C@@H](C#N)c1ccccc1 Amb25357376 [0,2,0,0,0,0|1,0,1]=4 8266 B12R1.478 C[C@@H](O)[C@@H](C=C)c1ccccc1 Amb25069723 [0,2,0,0,0,0|1,0,1]=4 8267 B12R1.478 C[C@@H](O)[C@@H](CC)c1ccccc1 Amb25347649 [0,2,0,0,0,0|1,0,1]=4 8268 B12R1.478 C[C@@H](O)[C@@H](CN)c1ccccc1 Amb24627923 [0,2,0,0,0,0|1,0,1]=4 8269 B12R1.478 C[C@@H](O)[C@@H](SC)c1ccccc1 Amb25332276 [0,2,0,0,0,0|1,0,1]=4 8270 B12R1.478 C[C@H](O)[C@@H](CO)c1ccccc1 Amb25179958 [0,2,0,0,0,0|1,0,1]=4 8271 B12R1.478 C[C@H](O)[C@@H](OC)c1ccccc1 Amb24403890 [0,2,0,0,0,0|1,0,1]=4 8272 B12R1.478 C[C@H](O)[C@H](CC)c1ccccc1 Amb24497690 [0,2,0,0,0,0|1,0,1]=4 8273 B12R1.478 C[C@H](O)[C@H](NC)c1ccccc1 Amb24341991 [0,2,0,0,0,0|1,0,1]=4 8274 B12R1.478 C\N=C(\C(O)=O)/c1ccccc1 Amb24652432 [0,2,0,0,0,0|0,0,1]=3 8275 B12R1.478 N#CC(C(O)=O)c1cc[n]cc1 Amb24669640 [0,2,0,0,0,0|1,0,0]=3 8276 B12R1.478 N#CC(C(O)=O)c1ccc[n]c1 Amb24487451 [0,2,0,0,0,0|1,0,0]=3 8277 B12R1.478 N#CC(c1ccccc1)C(=O)C Amb2504502 [0,2,0,0,0,0|1,0,0]=3 8278 B12R1.478 N#CC(c1ccccc1)C(=O)O Amb1783147 [0,2,0,0,0,0|0,0,0]=2 8279 B12R1.478 N#C\C(=C(/O)\C)\c1ccccc1 Amb2385739 [0,2,0,0,0,0|1,0,1]=4 8280 B12R1.478 NC(=N)C(CO)c1ccccc1 Amb25061991 [0,2,0,0,0,0|2,0,0]=4 8281 B12R1.478 NC(=O)C(C#N)c1ccccc1 Amb18787947 [0,2,0,0,0,0|1,0,0]=3 8282 B12R1.478 NC(=O)C(CN)c1cccc[n]1 Amb23571970 [0,2,0,0,0,0|2,0,0]=4 8283 B12R1.478 NC(=O)C(CN)c1ccccc1 Amb18999177 [0,2,0,0,0,0|1,0,0]=3 8284 B12R1.478 NC(=O)C(CO)c1ccccc1 Amb22233190 [0,2,0,0,0,0|1,0,0]=3 8285 B12R1.478 NC(=O)C(NO)c1ccccc1 Amb24373087 [0,2,0,0,0,0|1,0,0]=3 8286 B12R1.478 NC(=O)N(N=O)c1ccccc1 Amb20000996 [0,2,0,0,0,0|2,0,0]=4 8287 B12R1.478 NC(=O)\C(=C\Cl)\c1ccccc1 Amb24538838 [0,2,0,0,0,0|1,0,1]=4 8288 B12R1.478 NC(=O)\C(=C\O)\c1ccccc1 Amb25231959 [0,2,0,0,0,0|1,0,1]=4 8289 B12R1.478 NC(=O)\C(=N/F)\c1ccccc1 Amb25708534 [0,2,0,0,0,0|1,0,1]=4 8290 B12R1.478 NC(=O)\C(=N\F)\c1ccccc1 Amb25336557 [0,2,0,0,0,0|1,0,1]=4 8291 B12R1.478 NC(=O)\C(=N\N)\c1ccccc1 Amb25785115 [0,2,0,0,0,0|1,0,1]=4 8292 B12R1.478 NC(=O)\C(=N\O)\c1ccccc1 Amb23481030 [0,2,0,0,0,0|1,0,1]=4 8293 B12R1.478 NC(=S)C(C#N)c1ccccc1 Amb24400626 [0,2,0,0,0,0|1,1,0]=4 8294 B12R1.478 NCC(B(O)O)c1ccccc1 Amb25840910 [0,2,0,0,0,0|1,0,1]=4 8295 B12R1.478 NCC(C(O)=O)c1c[n]cc[n]1 Amb18827270 [0,2,0,0,0,0|2,0,0]=4 8296 B12R1.478 NCC(C(O)=O)c1cc[n]c[n]1 Amb18827271 [0,2,0,0,0,0|2,0,0]=4 8297 B12R1.478 NCC(c1ccccn1)C(=O)O Amb17400194 [0,2,0,0,0,0|1,0,0]=3 8298 B12R1.478 NCC(c1ccncc1)C(=O)O Amb17400195 [0,2,0,0,0,0|1,0,0]=3 8299 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22756742 [0,2,0,0,0,0|0,0,0]=2 8300 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22757442 [0,2,0,0,0,0|0,0,0]=2 8301 B12R1.478 NC[C@H](C(O)=O)c1ccccc1 Amb24674068 [0,2,0,0,0,0|0,0,0]=2 8302 B12R1.478 NNC(c1ccccc1)C(=O)O Amb17400196 [0,2,0,0,0,0|0,0,0]=2 8303 B12R1.478 NNC(c1ccccn1)C(=O)O Amb17400231 [0,2,0,0,0,0|1,0,0]=3 8304 B12R1.478 NNC(c1cccnc1)C(=O)O Amb17400232 [0,2,0,0,0,0|1,0,0]=3 8305 B12R1.478 NNC(c1ccncc1)C(=O)O Amb17400233 [0,2,0,0,0,0|1,0,0]=3 8306 B12R1.478 NN[C@@H](C(O)=O)c1ccccc1 Amb24562213 [0,2,0,0,0,0|0,0,0]=2 8307 B12R1.478 NN[C@H](C(O)=O)c1ccccc1 Amb25132135 [0,2,0,0,0,0|0,0,0]=2 8308 B12R1.478 N\N=C(/C(O)=O)\c1ccccc1 Amb24068345 [0,2,0,0,0,0|0,0,1]=3 8309 B12R1.478 N\N=C(\C(O)=O)/c1ccccc1 Amb25701762 [0,2,0,0,0,0|0,0,1]=3 8310 B12R1.478 O=C(Cl)C(CCl)c1ccccc1 Amb25159574 [0,2,0,0,0,0|1,0,0]=3 8311 B12R1.478 OC(=O)C(CBr)c1ccccc1 Amb24097514 [0,2,0,0,0,0|0,0,0]=2 8312 B12R1.478 OC(=O)C(CCl)c1ccccc1 Amb24099910 [0,2,0,0,0,0|0,0,0]=2 8313 B12R1.478 OC(=O)C(CF)c1ccccc1 Amb25201999 [0,2,0,0,0,0|0,0,0]=2 8314 B12R1.478 OC(=O)C(CS)c1ccccc1 Amb18303086 [0,2,0,0,0,0|0,0,0]=2 8315 B12R1.478 OC(=O)[C@@H](CF)c1ccccc1 Amb24470137 [0,2,0,0,0,0|0,0,0]=2 8316 B12R1.478 OC(=O)[C@@H](CO)c1ccccc1 Amb25109240 [0,2,0,0,0,0|0,0,0]=2 8317 B12R1.478 OC(=O)[C@H](NO)c1ccccc1 Amb25700967 [0,2,0,0,0,0|0,0,0]=2 8318 B12R1.478 OC(=O)\C(=C\O)\c1ccccc1 Amb24598641 [0,2,0,0,0,0|0,0,1]=3 8319 B12R1.478 OC(=O)\C(=N\O)\c1ccc[n]c1 Amb24590212 [0,2,0,0,0,0|1,0,1]=4 8320 B12R1.478 OC(=O)\C(=N\O)\c1cccc[n]1 Amb25279584 [0,2,0,0,0,0|1,0,1]=4 8321 B12R1.478 OC(=O)\C(=N\O)\c1ccccc1 Amb22230611 [0,2,0,0,0,0|0,0,1]=3 8322 B12R1.478 O\N=C(\c1ccccc1)/C(=O)N Amb2153257 [0,2,0,0,0,0|1,0,1]=4 8323 B12R1.478 [C-]#[N+]C(C(O)=O)c1ccccc1 Amb25290234 [0,2,0,0,0,0|0,0,0]=2 8324 B12R1.478 [C@H](C)(O)C(CC)c1ccccc1 Amb17678947 [0,2,0,0,0,0|1,0,1]=4 8325 B12R1.478 [NH3+]CC(C(O)=O)c1ccccc1 Amb22546483 [0,2,0,0,0,0|0,0,0]=2 8326 B12R1.478 [O-]\C=C(\c1ccccc1)/C(=O)C Amb10553866 [0,2,0,0,0,0|1,0,1]=4 8327 B12R1.564 CC(C)(O)C(N)c1ccccc1 Amb18646373 [0,2,0,0,0,0|1,0,1]=4 8328 B12R1.564 CC(C)(O)C(N)c1ccccc1 Amb22748963 [0,2,0,0,0,0|1,0,1]=4 8329 B12R1.564 CC(C)(O)C(O)c1ccccc1 Amb17776964 [0,2,0,0,0,0|1,0,1]=4 8330 B12R1.564 CC(C)(O)[C@@H](N)c1ccccc1 Amb23399663 [0,2,0,0,0,0|1,0,1]=4 8331 B12R1.564 CC(C)(O)[C@@H](O)c1ccccc1 Amb25065481 [0,2,0,0,0,0|1,0,1]=4 8332 B12R1.564 CC(C)(O)[C@H](N)c1ccccc1 Amb25667178 [0,2,0,0,0,0|1,0,1]=4 8333 B12R1.564 CC(P(=O)(O)O)c1ccccc1 Amb10975962 [0,2,0,0,0,0|1,0,0]=3 8334 B12R1.564 CC(c1cccc[n]1)S(O)(=O)=O Amb22267287 [0,2,0,0,0,0|2,0,0]=4 8335 B12R1.564 CC(c1ccccc1)S(=O)(=O)Cl Amb22752088 [0,2,0,0,0,0|1,0,1]=4 8336 B12R1.564 CC(c1ccccc1)S(=O)(=O)F Amb24761366 [0,2,0,0,0,0|1,0,1]=4 8337 B12R1.564 CC(c1ccccc1)S(N)(=O)=O Amb19075244 [0,2,0,0,0,0|1,0,1]=4 8338 B12R1.564 CP(O)(=O)C(N)c1ccccc1 Amb25772757 [0,2,0,0,0,0|1,0,0]=3 8339 B12R1.564 NC(P(=O)(O)O)c1ccccc1 Amb1148498 [0,2,0,0,0,0|1,0,0]=3 8340 B12R1.564 NC(c1cc[n]cc1)P(O)(O)=O Amb24596428 [0,2,0,0,0,0|2,0,0]=4 8341 B12R1.564 NC(c1ccccc1)S(O)(=O)=O Amb22472999 [0,2,0,0,0,0|1,0,0]=3 8342 B12R1.564 O=S(=O)(Cl)C(Cl)c1ccccc1 Amb25335421 [0,2,0,0,0,0|1,0,1]=4 8343 B12R1.564 O=S(=O)(Cl)C(F)c1ccccc1 Amb25349761 [0,2,0,0,0,0|1,0,1]=4 8344 B12R1.564 OC(S(=O)(=O)O)c1ccccc1 Amb17594875 [0,2,0,0,0,0|1,0,0]=3 8345 B12R1.564 OC(c1c[n]ccc1)P(O)(O)=O Amb24115853 [0,2,0,0,0,0|2,0,0]=4 8346 B12R1.564 OC(c1c[n]ccc1)S(O)(=O)=O Amb22453547 [0,2,0,0,0,0|2,0,0]=4 8347 B12R1.564 OC(c1cc[n]cc1)P(O)(O)=O Amb24115854 [0,2,0,0,0,0|2,0,0]=4 8348 B12R1.564 OC(c1cccc[n]1)P(O)(O)=O Amb25051455 [0,2,0,0,0,0|2,0,0]=4 8349 B12R1.564 OP(O)(=O)C(=O)c1ccccc1 Amb22230257 [0,2,0,0,0,0|1,0,1]=4 8350 B12R1.564 [O-]S(=O)(=O)C(Cl)c1ccccc1 Amb22364808 [0,2,0,0,0,0|1,0,1]=4 8351 B12R1.2206 CC(C(O)=O)C1(O)CC=CC=C1 Amb25122114 [0,2,0,0,0,0|0,0,2]=4 8352 B12R1.32 BrCCC(=O)Nc1ccccc1 Amb16191990 [0,2,0,0,0,0|2,0,0]=4 8353 B12R1.32 C#CCC(=O)Cc1cc[n]cc1 Amb18800091 [0,2,0,0,0,0|2,0,0]=4 8354 B12R1.32 C#CCC(=O)Cc1ccc[n]c1 Amb18800090 [0,2,0,0,0,0|2,0,0]=4 8355 B12R1.32 C#CCC(=O)Cc1cccc[n]1 Amb18800088 [0,2,0,0,0,0|2,0,0]=4 8356 B12R1.32 C#CCC(=O)Cc1ccccc1 Amb18799925 [0,2,0,0,0,0|1,0,0]=3 8357 B12R1.32 C#CCC(O)Cc1ccccc1 Amb18800362 [0,2,0,0,0,0|1,0,1]=4 8358 B12R1.32 C#CC[C@@H](O)Cc1ccccc1 Amb24497745 [0,2,0,0,0,0|1,0,1]=4 8359 B12R1.32 C=C(Cc1ccccc1)N=[N+]=[N-] Amb25207816 [0,2,0,0,0,0|2,0,0]=4 8360 B12R1.32 C=C(N=C=O)Sc1ccccc1 Amb24653764 [0,2,0,0,0,0|2,0,0]=4 8361 B12R1.32 C=C=CC(=O)Cc1ccccc1 Amb25713668 [0,2,0,0,0,0|1,0,0]=3 8362 B12R1.32 C=C=CC(O)Cc1ccccc1 Amb24420844 [0,2,0,0,0,0|1,0,1]=4 8363 B12R1.32 C=C=C[C@H](O)Cc1ccccc1 Amb25158000 [0,2,0,0,0,0|1,0,1]=4 8364 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [0,2,0,0,0,0|2,0,0]=4 8365 B12R1.32 C=CNC(=O)Oc1ccccc1 Amb25159436 [0,2,0,0,0,0|2,0,0]=4 8366 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,2,0,0,0,0|0,0,0]=2 8367 B12R1.32 C=NNC(=O)Nc1ccccc1 Amb24488786 [0,2,0,0,0,0|2,0,0]=4 8368 B12R1.32 C=NOC(=O)Nc1ccccc1 Amb24420620 [0,2,0,0,0,0|1,0,0]=3 8369 B12R1.32 CC#CC(=O)Nc1ccccc1 Amb17940360 [0,2,0,0,0,0|2,0,0]=4 8370 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [0,2,0,0,0,0|1,0,1]=4 8371 B12R1.32 CCNC(=O)Cc1c[n]ccc1 Amb25725646 [0,2,0,0,0,0|2,0,0]=4 8372 B12R1.32 CCNC(=O)Cc1cc[n]cc1 Amb25205151 [0,2,0,0,0,0|2,0,0]=4 8373 B12R1.32 CCNC(=O)Nc1ccccc1 Amb1233665 [0,2,0,0,0,0|2,0,0]=4 8374 B12R1.32 CCNC(=O)Sc1ccccc1 Amb25827115 [0,2,0,0,0,0|2,0,0]=4 8375 B12R1.32 CCNC(=S)Cc1ccccc1 Amb24066800 [0,2,0,0,0,0|1,1,0]=4 8376 B12R1.32 CCO/C(C)=N/c1ccccc1 Amb17939699 [0,2,0,0,0,0|2,0,0]=4 8377 B12R1.32 CCOC(=N)Cc1cc[n]cc1 Amb18800815 [0,2,0,0,0,0|2,0,0]=4 8378 B12R1.32 CCOC(=N)Cc1cccc[n]1 Amb18792558 [0,2,0,0,0,0|2,0,0]=4 8379 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [0,2,0,0,0,0|1,0,0]=3 8380 B12R1.32 CCOC(=N)Nc1ccccc1 Amb24496991 [0,2,0,0,0,0|2,0,0]=4 8381 B12R1.32 CCOC(=O)C=C1C=COC=C1 Amb25848212 [0,2,0,0,0,0|1,0,1]=4 8382 B12R1.32 CCOC(=O)C[n+]1ccncc1 Amb2228081 [0,2,0,0,0,0|2,0,0]=4 8383 B12R1.32 CCOC(=O)Cc1c[n]c[n]c1 Amb18801018 [0,2,0,0,0,0|2,0,0]=4 8384 B12R1.32 CCOC(=O)Cc1c[n]cc[n]1 Amb23399648 [0,2,0,0,0,0|2,0,0]=4 8385 B12R1.32 CCOC(=O)Cc1c[n]ccc1 Amb22478803 [0,2,0,0,0,0|1,0,0]=3 8386 B12R1.32 CCOC(=O)Cc1cc[n]c[n]1 Amb22001936 [0,2,0,0,0,0|2,0,0]=4 8387 B12R1.32 CCOC(=O)Cc1cc[n]cc1 Amb20621993 [0,2,0,0,0,0|1,0,0]=3 8388 B12R1.32 CCOC(=O)Cc1ccc[n][n]1 Amb23440008 [0,2,0,0,0,0|2,0,0]=4 8389 B12R1.32 CCOC(=O)Cc1ncccn1 Amb17935863 [0,2,0,0,0,0|2,0,0]=4 8390 B12R1.32 CCOC(=O)N[n+]1ccccc1 Amb10560832 [0,2,0,0,0,0|2,0,0]=4 8391 B12R1.32 CCSC(=O)Nc1ccccc1 Amb24310273 [0,2,0,0,0,0|1,1,0]=4 8392 B12R1.32 CC\N=C(\N)/Cc1ccccc1 Amb23569052 [0,2,0,0,0,0|2,0,0]=4 8393 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,2,0,0,0,0|2,0,0]=4 8394 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [0,2,0,0,0,0|1,0,1]=4 8395 B12R1.32 COCC(=O)Nc1ccncc1 Amb1832638 [0,2,0,0,0,0|2,0,0]=4 8396 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,2,0,0,0,0|1,0,1]=4 8397 B12R1.32 CONC(=O)Cc1c[n]c[n]c1 Amb25851913 [0,2,0,0,0,0|2,0,0]=4 8398 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,2,0,0,0,0|0,0,0]=2 8399 B12R1.32 CONC(=O)Oc1ccccc1 Amb16969957 [0,2,0,0,0,0|1,0,0]=3 8400 B12R1.32 CONC(=S)Nc1ccccc1 Amb24497042 [0,2,0,0,0,0|1,1,0]=4 8401 B12R1.32 CO\N=C(\N)/Cc1c[n]ccc1 Amb25669996 [0,2,0,0,0,0|2,0,0]=4 8402 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,2,0,0,0,0|1,1,0]=4 8403 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [0,2,0,0,0,0|1,0,1]=4 8404 B12R1.32 C[SiH2]OC(=O)Nc1ccccc1 Amb24682546 [0,2,0,0,0,0|1,0,0]=3 8405 B12R1.32 C\C(=C/C=O)\Nc1ccccc1 Amb18645507 [0,2,0,0,0,0|2,0,0]=4 8406 B12R1.32 C\C(=C/C=O)\Oc1ccccc1 Amb25326052 [0,2,0,0,0,0|2,0,0]=4 8407 B12R1.32 C\C(=C/C=O)\Sc1ccccc1 Amb18648150 [0,2,0,0,0,0|2,0,0]=4 8408 B12R1.32 C\C(=C\C=O)\Nc1ccccc1 Amb24611198 [0,2,0,0,0,0|2,0,0]=4 8409 B12R1.32 C\C(=C\c1ccccc1)\N=C=O Amb25231758 [0,2,0,0,0,0|1,0,1]=4 8410 B12R1.32 C\C(\CC=O)=C/c1ccccc1 Amb18126261 [0,2,0,0,0,0|1,0,1]=4 8411 B12R1.32 C\C(\CCO)=C\c1ccccc1 Amb24576953 [0,2,0,0,0,0|1,0,1]=4 8412 B12R1.32 C\C(\Cc1cc[n]cc1)=N\OC Amb25763716 [0,2,0,0,0,0|2,0,0]=4 8413 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [0,2,0,0,0,0|1,0,0]=3 8414 B12R1.32 C\C(\Cc1ccccc1)=C\C#N Amb24595292 [0,2,0,0,0,0|2,0,0]=4 8415 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [0,2,0,0,0,0|2,0,0]=4 8416 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb24497299 [0,2,0,0,0,0|2,0,0]=4 8417 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [0,2,0,0,0,0|1,0,1]=4 8418 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [0,2,0,0,0,0|1,0,1]=4 8419 B12R1.32 ClCCC(=O)Oc1ccccc1 Amb16230794 [0,2,0,0,0,0|2,0,0]=4 8420 B12R1.32 Cl\C(\Cc1ccccc1)=C/CCl Amb25035226 [0,2,0,0,0,0|2,0,0]=4 8421 B12R1.32 Cl\C(\Cc1ccccc1)=C\CCl Amb24563867 [0,2,0,0,0,0|2,0,0]=4 8422 B12R1.32 N#CCC(=O)Cc1ccccc1 Amb17232286 [0,2,0,0,0,0|1,0,0]=3 8423 B12R1.32 N#CCC(=O)Nc1ccccc1 Amb1634628 [0,2,0,0,0,0|2,0,0]=4 8424 B12R1.32 N#CCC(=O)Oc1ccccc1 Amb18645449 [0,2,0,0,0,0|2,0,0]=4 8425 B12R1.32 N#CC[C@H](O)Cc1ccccc1 Amb24386953 [0,2,0,0,0,0|1,0,1]=4 8426 B12R1.32 N#CNC(=O)Cc1ccccc1 Amb25149956 [0,2,0,0,0,0|1,0,0]=3 8427 B12R1.32 N=C(Cc1ccccc1)NC#N Amb25289104 [0,2,0,0,0,0|2,0,0]=4 8428 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,2,0,0,0,0|2,0,0]=4 8429 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,2,0,0,0,0|2,0,0]=4 8430 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,2,0,0,0,0|2,0,0]=4 8431 B12R1.32 NCCC(Cc1ccccc1)O Amb17232552 [0,2,0,0,0,0|1,0,1]=4 8432 B12R1.32 NCCS(=O)Cc1ccccc1 Amb18306046 [0,2,0,0,0,0|2,0,0]=4 8433 B12R1.32 NN(CCO)Cc1ccccc1 Amb18646608 [0,2,0,0,0,0|2,0,0]=4 8434 B12R1.32 NOCC(=O)Nc1ccc[n]c1 Amb25690769 [0,2,0,0,0,0|2,0,0]=4 8435 B12R1.32 NOCC(=O)Nc1cccc[n]1 Amb25761175 [0,2,0,0,0,0|2,0,0]=4 8436 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [0,2,0,0,0,0|1,0,0]=3 8437 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,2,0,0,0,0|1,0,0]=3 8438 B12R1.32 N\N=C\C(=O)Cc1ccccc1 Amb25046103 [0,2,0,0,0,0|1,0,0]=3 8439 B12R1.32 O=C(C#CBr)Nc1ccccc1 Amb24621200 [0,2,0,0,0,0|2,0,0]=4 8440 B12R1.32 O=C(C=C=O)Nc1ccccc1 Amb24441652 [0,2,0,0,0,0|1,0,1]=4 8441 B12R1.32 O=C(CCF)Nc1ccccc1 Amb25276540 [0,2,0,0,0,0|2,0,0]=4 8442 B12R1.32 O=C(CCI)Nc1ccccc1 Amb23447340 [0,2,0,0,0,0|2,0,0]=4 8443 B12R1.32 O=C(Cc1c[n]ccc1)N=C=O Amb25071469 [0,2,0,0,0,0|1,0,1]=4 8444 B12R1.32 O=C(Cc1cccc[n]1)N=C=O Amb25204303 [0,2,0,0,0,0|1,0,1]=4 8445 B12R1.32 O=C(Cc1cccc[n]1)N=C=S Amb25675541 [0,2,0,0,0,0|1,1,0]=4 8446 B12R1.32 O=C(Cc1ccccc1)\C=C\Cl Amb25216983 [0,2,0,0,0,0|1,0,0]=3 8447 B12R1.32 O=C(N=C=O)Oc1ccccc1 Amb22348017 [0,2,0,0,0,0|1,0,1]=4 8448 B12R1.32 O=C(NC#N)Nc1ccccc1 Amb17939016 [0,2,0,0,0,0|2,0,0]=4 8449 B12R1.32 O=C(NC=O)Nc1ccccc1 Amb22347423 [0,2,0,0,0,0|1,0,1]=4 8450 B12R1.32 O=C(Nc1ccccc1)N=C=S Amb24724734 [0,2,0,0,0,0|1,1,0]=4 8451 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [0,2,0,0,0,0|2,0,0]=4 8452 B12R1.32 O=C=NC(=O)Cc1ccccc1 Amb17232352 [0,2,0,0,0,0|0,0,1]=3 8453 B12R1.32 OC(Cc1ccccc1)C#CCl Amb25156729 [0,2,0,0,0,0|1,0,1]=4 8454 B12R1.32 OC(Cc1ccccc1)CC#N Amb17232368 [0,2,0,0,0,0|1,0,1]=4 8455 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [0,2,0,0,0,0|1,0,1]=4 8456 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [0,2,0,0,0,0|0,0,2]=4 8457 B12R1.32 OCCN(O)Cc1ccccc1 Amb25284514 [0,2,0,0,0,0|1,0,1]=4 8458 B12R1.32 OCNC(=O)C[n+]1ccccc1 Amb25046777 [0,2,0,0,0,0|1,0,0]=3 8459 B12R1.32 OCNC(=O)Oc1ccccc1 Amb10552983 [0,2,0,0,0,0|1,0,0]=3 8460 B12R1.32 ON=CC(Cl)=Cc1ccccc1 Amb24061196 [0,2,0,0,0,0|1,0,1]=4 8461 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,2,0,0,0,0|1,0,0]=3 8462 B12R1.32 O\C=C/C(=S)Nc1ccccc1 Amb24495245 [0,2,0,0,0,0|1,1,0]=4 8463 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [0,2,0,0,0,0|0,0,0]=2 8464 B12R1.32 O\C=C\C(=S)Nc1ccccc1 Amb24592387 [0,2,0,0,0,0|1,1,0]=4 8465 B12R1.32 O\N=C\C(=O)Cc1ccccc1 Amb24577781 [0,2,0,0,0,0|0,0,0]=2 8466 B12R1.32 O\N=C\C(=O)Nc1ccccc1 Amb1205570 [0,2,0,0,0,0|1,0,0]=3 8467 B12R1.32 O\N=C\C(Br)=Cc1ccccc1 Amb25852504 [0,2,0,0,0,0|1,0,1]=4 8468 B12R1.32 O\N=C\C(Cl)=Cc1ccccc1 Amb25855465 [0,2,0,0,0,0|1,0,1]=4 8469 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [0,2,0,0,0,0|0,0,2]=4 8470 B12R1.32 S=C(Cc1ccccc1)S[Mg]Cl Amb22264564 [0,2,0,0,0,0|0,2,0]=4 8471 B12R1.32 SCCC(=O)Nc1ccccc1 Amb17305724 [0,2,0,0,0,0|1,1,0]=4 8472 B12R1.32 [C-]#[N+]CC(=O)Nc1ccccc1 Amb25695864 [0,2,0,0,0,0|2,0,0]=4 8473 B12R1.32 [K]ONC(=O)Cc1ccccc1 Amb10558422 [0,2,0,0,0,0|0,0,0]=2 8474 B12R1.32 [N-]=[N+]=CC(=O)Oc1ccccc1 Amb24576332 [0,2,0,0,0,0|2,0,0]=4 8475 B12R1.32 [N-]=[N+]=NC(=O)Nc1ccccc1 Amb25233093 [0,2,0,0,0,0|2,0,0]=4 8476 B12R1.50 C#CC(=O)Cc1cc(Cl)cc[n]1 Amb25371934 [0,2,0,0,0,0|2,0,0]=4 8477 B12R1.50 C#CC(=O)Cc1cccc(Br)c1 Amb25042972 [0,2,0,0,0,0|1,0,0]=3 8478 B12R1.50 C#CC(=O)Cc1cccc(Cl)[n]1 Amb25202731 [0,2,0,0,0,0|2,0,0]=4 8479 B12R1.50 C#CC(=O)Oc1cccc(Br)c1 Amb25680293 [0,2,0,0,0,0|2,0,0]=4 8480 B12R1.50 C#CC(=O)Oc1cccc(F)c1 Amb25859643 [0,2,0,0,0,0|2,0,0]=4 8481 B12R1.50 C#CC(O)Cc1cccc(Br)c1 Amb24713259 [0,2,0,0,0,0|1,0,1]=4 8482 B12R1.50 C#CC(O)Cc1cccc(Cl)c1 Amb24362185 [0,2,0,0,0,0|1,0,1]=4 8483 B12R1.50 C#CC(O)Cc1cccc(F)c1 Amb25209915 [0,2,0,0,0,0|1,0,1]=4 8484 B12R1.50 C=CC(=O)Cc1c[n]cc(Br)c1 Amb25849642 [0,2,0,0,0,0|2,0,0]=4 8485 B12R1.50 C=CC(=O)Cc1cc[n]c(N)c1 Amb25840227 [0,2,0,0,0,0|2,0,0]=4 8486 B12R1.50 C=CC(=O)Cc1cccc(Br)c1 Amb24450582 [0,2,0,0,0,0|1,0,0]=3 8487 B12R1.50 C=CC(=O)Cc1cccc(N)c1 Amb25809299 [0,2,0,0,0,0|1,0,0]=3 8488 B12R1.50 C=CC(=O)Nc1cccc(N)c1 Amb24740871 [0,2,0,0,0,0|2,0,0]=4 8489 B12R1.50 C=CC(=O)Oc1cccc(F)c1 Amb25156555 [0,2,0,0,0,0|2,0,0]=4 8490 B12R1.50 C=CC(O)Cc1cccc(Cl)c1 Amb25343968 [0,2,0,0,0,0|1,0,1]=4 8491 B12R1.50 CC(CO)Cc1cc(Br)ccc1 Amb25729945 [0,2,0,0,0,0|1,0,1]=4 8492 B12R1.50 CC(CO)Cc1cc(Cl)ccc1 Amb25212222 [0,2,0,0,0,0|1,0,1]=4 8493 B12R1.50 CC(CO)Cc1cc(F)ccc1 Amb25228330 [0,2,0,0,0,0|1,0,1]=4 8494 B12R1.50 CC(Cc1cc(O)ccc1)CO Amb24579423 [0,2,0,0,0,0|1,0,1]=4 8495 B12R1.50 CC(Cc1cccc(Cl)c1)C=O Amb25804355 [0,2,0,0,0,0|1,0,1]=4 8496 B12R1.50 CC(Cc1cccc(F)c1)NO Amb25056304 [0,2,0,0,0,0|1,0,1]=4 8497 B12R1.50 CC(Cc1cccc(I)c1)C=O Amb25850018 [0,2,0,0,0,0|1,0,1]=4 8498 B12R1.50 CC(Cc1cccc(N)c1)C=O Amb25251154 [0,2,0,0,0,0|1,0,1]=4 8499 B12R1.50 CCC(=O)Cc1cc(Br)c[n]c1 Amb25339304 [0,2,0,0,0,0|2,0,0]=4 8500 B12R1.50 CCC(=O)Cc1cccc(c1)Br Amb17477613 [0,2,0,0,0,0|1,0,0]=3 8501 B12R1.50 CCC(=O)Cc1cccc(c1)C Amb17138543 [0,2,0,0,0,0|1,0,0]=3 8502 B12R1.50 CCC(=O)Cc1cccc(c1)Cl Amb17139042 [0,2,0,0,0,0|1,0,0]=3 8503 B12R1.50 CCC(=O)Cc1cccc(c1)F Amb17138604 [0,2,0,0,0,0|1,0,0]=3 8504 B12R1.50 CCC(=O)Nc1cccc(c1)Br Amb1885365 [0,2,0,0,0,0|2,0,0]=4 8505 B12R1.50 CCC(=O)Nc1cccc(c1)N Amb1118353 [0,2,0,0,0,0|2,0,0]=4 8506 B12R1.50 CCC(=O)Nc1cccc(c1)O Amb2025988 [0,2,0,0,0,0|2,0,0]=4 8507 B12R1.50 CCC(=O)Oc1cccc(Br)c1 Amb25219957 [0,2,0,0,0,0|2,0,0]=4 8508 B12R1.50 CCC(=O)Oc1cccc(Cl)c1 Amb25800916 [0,2,0,0,0,0|2,0,0]=4 8509 B12R1.50 CCC(=O)Oc1cccc(F)c1 Amb25153440 [0,2,0,0,0,0|2,0,0]=4 8510 B12R1.50 CCC(=O)Oc1cccc(I)c1 Amb25220812 [0,2,0,0,0,0|2,0,0]=4 8511 B12R1.50 CCC(=O)Oc1cccc(O)c1 Amb22167292 [0,2,0,0,0,0|2,0,0]=4 8512 B12R1.50 CCC(Cc1cccc(c1)Br)O Amb17477580 [0,2,0,0,0,0|1,0,1]=4 8513 B12R1.50 CCC(Cc1cccc(c1)C)O Amb17138582 [0,2,0,0,0,0|1,0,1]=4 8514 B12R1.50 CCC(Cc1cccc(c1)Cl)O Amb17139102 [0,2,0,0,0,0|1,0,1]=4 8515 B12R1.50 CCC(Cc1cccc(c1)F)O Amb17138636 [0,2,0,0,0,0|1,0,1]=4 8516 B12R1.50 CCS(=O)Cc1cc(N)ccc1 Amb18977540 [0,2,0,0,0,0|2,0,0]=4 8517 B12R1.50 CN(Cc1cccc(Br)c1)OC Amb25317009 [0,2,0,0,0,0|2,0,0]=4 8518 B12R1.50 CN(Cc1cccc(Cl)c1)N=O Amb25053417 [0,2,0,0,0,0|2,0,0]=4 8519 B12R1.50 CN(Cc1cccc(Cl)c1)OC Amb24557097 [0,2,0,0,0,0|2,0,0]=4 8520 B12R1.50 CNC(=N)Cc1cccc(Br)c1 Amb25830995 [0,2,0,0,0,0|2,0,0]=4 8521 B12R1.50 CNC(=O)C[n+]1cccc(O)c1 Amb25663671 [0,2,0,0,0,0|2,0,0]=4 8522 B12R1.50 CNC(=O)Cc1cc(Cl)cc[n]1 Amb25102643 [0,2,0,0,0,0|2,0,0]=4 8523 B12R1.50 CNC(=O)Cc1cccc(Br)c1 Amb23111023 [0,2,0,0,0,0|1,0,0]=3 8524 B12R1.50 CNC(=O)Cc1cccc(Cl)c1 Amb22984156 [0,2,0,0,0,0|1,0,0]=3 8525 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [0,2,0,0,0,0|1,0,0]=3 8526 B12R1.50 CNC(=O)Cc1cccc(c1)C Amb2106610 [0,2,0,0,0,0|1,0,0]=3 8527 B12R1.50 CNC(=O)Nc1cc(F)ccc1 Amb22435126 [0,2,0,0,0,0|2,0,0]=4 8528 B12R1.50 CNC(=O)Nc1cccc(c1)I Amb11258974 [0,2,0,0,0,0|2,0,0]=4 8529 B12R1.50 CNC(=O)Oc1cccc(Cl)c1 Amb24309165 [0,2,0,0,0,0|2,0,0]=4 8530 B12R1.50 CNC(=O)Oc1cccc(F)c1 Amb25674242 [0,2,0,0,0,0|2,0,0]=4 8531 B12R1.50 CNC(=O)Oc1cccc(O)c1 Amb24063537 [0,2,0,0,0,0|2,0,0]=4 8532 B12R1.50 COC(=N)Cc1cccc(Br)c1 Amb25046776 [0,2,0,0,0,0|1,0,0]=3 8533 B12R1.50 COC(=N)Cc1cccc(Cl)c1 Amb19057373 [0,2,0,0,0,0|1,0,0]=3 8534 B12R1.50 COC(=N)Cc1cccc(F)c1 Amb18788552 [0,2,0,0,0,0|1,0,0]=3 8535 B12R1.50 COC(=O)CC1=CC(=O)NC=N1 Amb25311905 [0,2,0,0,0,0|2,0,0]=4 8536 B12R1.50 COC(=O)C[n+]1cc(Br)ccc1 Amb24389497 [0,2,0,0,0,0|1,0,0]=3 8537 B12R1.50 COC(=O)C[n+]1cccc(c1)O Amb11238724 [0,2,0,0,0,0|1,0,0]=3 8538 B12R1.50 COC(=O)Cc1[n]c(Br)cc[n]1 Amb24483869 [0,2,0,0,0,0|2,0,0]=4 8539 B12R1.50 COC(=O)Cc1[n]c(F)cc[n]1 Amb24679461 [0,2,0,0,0,0|2,0,0]=4 8540 B12R1.50 COC(=O)Cc1[n]c(I)cc[n]1 Amb24579042 [0,2,0,0,0,0|2,0,0]=4 8541 B12R1.50 COC(=O)Cc1[n]c(O)cc[n]1 Amb18646856 [0,2,0,0,0,0|2,0,0]=4 8542 B12R1.50 COC(=O)Cc1c[n]cc(Br)c1 Amb21857140 [0,2,0,0,0,0|1,0,0]=3 8543 B12R1.50 COC(=O)Cc1c[n]cc(O)c1 Amb25808579 [0,2,0,0,0,0|1,0,0]=3 8544 B12R1.50 COC(=O)Cc1cc(Cl)[n]c[n]1 Amb24074128 [0,2,0,0,0,0|2,0,0]=4 8545 B12R1.50 COC(=O)Cc1cc(Cl)cc[n]1 Amb22752816 [0,2,0,0,0,0|1,0,0]=3 8546 B12R1.50 COC(=O)Cc1cc(Cl)cc[n]1 Amb22899188 [0,2,0,0,0,0|1,0,0]=3 8547 B12R1.50 COC(=O)Cc1cc(F)cc[n]1 Amb24747640 [0,2,0,0,0,0|1,0,0]=3 8548 B12R1.50 COC(=O)Cc1cc[n]c(Br)[n]1 Amb24663544 [0,2,0,0,0,0|2,0,0]=4 8549 B12R1.50 COC(=O)Cc1cc[n]c(Br)c1 Amb24483854 [0,2,0,0,0,0|1,0,0]=3 8550 B12R1.50 COC(=O)Cc1cc[n]c(Cl)[n]1 Amb23440850 [0,2,0,0,0,0|2,0,0]=4 8551 B12R1.50 COC(=O)Cc1cc[n]c(F)c1 Amb25106259 [0,2,0,0,0,0|1,0,0]=3 8552 B12R1.50 COC(=O)Cc1cc[n]c(N)[n]1 Amb24365949 [0,2,0,0,0,0|2,0,0]=4 8553 B12R1.50 COC(=O)Cc1cc[n]c(N)c1 Amb25299195 [0,2,0,0,0,0|1,0,0]=3 8554 B12R1.50 COC(=O)Cc1cccc(Br)[n]1 Amb22232089 [0,2,0,0,0,0|1,0,0]=3 8555 B12R1.50 COC(=O)Cc1cccc(F)[n]1 Amb24422962 [0,2,0,0,0,0|1,0,0]=3 8556 B12R1.50 COC(=O)Cc1cccc(N)[n]1 Amb25336485 [0,2,0,0,0,0|1,0,0]=3 8557 B12R1.50 COC(=O)Cc1cccc(S)c1 Amb22490996 [0,2,0,0,0,0|0,0,0]=2 8558 B12R1.50 COC(=O)Cc1cccc(c1)N Amb10071208 [0,2,0,0,0,0|0,0,0]=2 8559 B12R1.50 COC(=O)Cc1cccc(n1)Cl Amb10976128 [0,2,0,0,0,0|1,0,0]=3 8560 B12R1.50 COC(=O)Nc1c[n]cc(Br)c1 Amb25732556 [0,2,0,0,0,0|2,0,0]=4 8561 B12R1.50 COC(=O)Nc1c[n]cc(I)c1 Amb24331628 [0,2,0,0,0,0|2,0,0]=4 8562 B12R1.50 COC(=O)Nc1cc(Cl)ccn1 Amb10070699 [0,2,0,0,0,0|2,0,0]=4 8563 B12R1.50 COC(=O)Nc1cccc(C)c1 Amb17731515 [0,2,0,0,0,0|1,0,0]=3 8564 B12R1.50 COC(=O)Nc1cccc(I)c1 Amb25774750 [0,2,0,0,0,0|1,0,0]=3 8565 B12R1.50 COC(=O)Nc1cccc(c1)Cl Amb1625032 [0,2,0,0,0,0|1,0,0]=3 8566 B12R1.50 COC(=O)Nc1cccc(c1)N Amb17622185 [0,2,0,0,0,0|1,0,0]=3 8567 B12R1.50 COC(=O)Oc1cc(N)ccc1 Amb25759843 [0,2,0,0,0,0|1,0,0]=3 8568 B12R1.50 COC(=S)Nc1cccc(O)c1 Amb25311054 [0,2,0,0,0,0|1,1,0]=4 8569 B12R1.50 CSC(=O)Nc1cccc(N)c1 Amb24531527 [0,2,0,0,0,0|1,1,0]=4 8570 B12R1.50 C[n+]1cc(ccc1)NC(=O)OC Amb24225243 [0,2,0,0,0,0|2,0,0]=4 8571 B12R1.50 C\C(=C/c1cccc(N)c1)\C=O Amb25264395 [0,2,0,0,0,0|1,0,1]=4 8572 B12R1.50 C\C(\C=O)=C\c1cccc(F)c1 Amb25857569 [0,2,0,0,0,0|1,0,1]=4 8573 B12R1.50 C\C(\C=O)=C\c1cccc(I)c1 Amb24493268 [0,2,0,0,0,0|1,0,1]=4 8574 B12R1.50 C\C(\CO)=C\c1cc(O)ccc1 Amb25369722 [0,2,0,0,0,0|1,0,1]=4 8575 B12R1.50 C\C(\Cc1cc(O)ccc1)=N/O Amb24487234 [0,2,0,0,0,0|1,0,0]=3 8576 B12R1.50 C\C(\Cc1cc(O)ccc1)=N\O Amb25227653 [0,2,0,0,0,0|1,0,0]=3 8577 B12R1.50 C\C(\Cc1cccc(Br)c1)=N\O Amb24634595 [0,2,0,0,0,0|1,0,0]=3 8578 B12R1.50 C\C(\Cc1cccc(Cl)c1)=N\N Amb24636219 [0,2,0,0,0,0|2,0,0]=4 8579 B12R1.50 C\C(\Cc1cccc(F)c1)=N\N Amb25725343 [0,2,0,0,0,0|2,0,0]=4 8580 B12R1.50 C\C(\Cc1cccc(F)c1)=N\O Amb25225688 [0,2,0,0,0,0|1,0,0]=3 8581 B12R1.50 Cc1cc(CC(=N)OC)ccc1 Amb18798192 [0,2,0,0,0,0|1,0,0]=3 8582 B12R1.50 Cc1cc(CC(=O)C=C)ccc1 Amb25278058 [0,2,0,0,0,0|1,0,0]=3 8583 B12R1.50 Cc1cc(CC(=O)CBr)ccc1 Amb25089939 [0,2,0,0,0,0|1,0,0]=3 8584 B12R1.50 Cc1cc(CC(=O)CN)ccc1 Amb18829247 [0,2,0,0,0,0|1,0,0]=3 8585 B12R1.50 Cc1cc(CC(=O)CO)ccc1 Amb18563612 [0,2,0,0,0,0|0,0,0]=2 8586 B12R1.50 Cc1cc(CC(=O)NN)[n]cc1 Amb24501374 [0,2,0,0,0,0|2,0,0]=4 8587 B12R1.50 Cc1cc(CC(=O)NN)cc[n]1 Amb24615780 [0,2,0,0,0,0|2,0,0]=4 8588 B12R1.50 Cc1cc(CC(=O)NO)ccc1 Amb18798398 [0,2,0,0,0,0|0,0,0]=2 8589 B12R1.50 Cc1cc(CC(=O)OC)cc[n]1 Amb23441228 [0,2,0,0,0,0|1,0,0]=3 8590 B12R1.50 Cc1cc(CC(N)=NN)ccc1 Amb18798212 [0,2,0,0,0,0|2,0,0]=4 8591 B12R1.50 Cc1cc(CC(O)C#C)ccc1 Amb24457341 [0,2,0,0,0,0|1,0,1]=4 8592 B12R1.50 Cc1cc(CC(O)C=C)ccc1 Amb24431083 [0,2,0,0,0,0|1,0,1]=4 8593 B12R1.50 Cc1cc(CC(O)CCl)ccc1 Amb24711431 [0,2,0,0,0,0|1,0,1]=4 8594 B12R1.50 Cc1cc(CC(O)CO)ccc1 Amb24397224 [0,2,0,0,0,0|0,0,2]=4 8595 B12R1.50 Cc1cc(C[C@@H](N)CO)ccc1 Amb24362986 [0,2,0,0,0,0|1,0,1]=4 8596 B12R1.50 Cc1cc(C[C@@H](O)C=C)ccc1 Amb25155807 [0,2,0,0,0,0|1,0,1]=4 8597 B12R1.50 Cc1cc(C[C@@H](O)CCl)ccc1 Amb24652370 [0,2,0,0,0,0|1,0,1]=4 8598 B12R1.50 Cc1cc(\C=C(/F)\C=O)ccc1 Amb24497238 [0,2,0,0,0,0|1,0,1]=4 8599 B12R1.50 Cc1cc(cc[n]1)NC(=O)CO Amb25776188 [0,2,0,0,0,0|2,0,0]=4 8600 B12R1.50 Cc1cc(cc[n]1)NC(=O)OC Amb25358566 [0,2,0,0,0,0|2,0,0]=4 8601 B12R1.50 Cc1cc(ccc1)NC(=O)C#C Amb25252501 [0,2,0,0,0,0|2,0,0]=4 8602 B12R1.50 Cc1cc(ccc1)NC(=O)C=O Amb24468252 [0,2,0,0,0,0|1,0,1]=4 8603 B12R1.50 Cc1cc(ccc1)NC(=O)CN Amb21958998 [0,2,0,0,0,0|2,0,0]=4 8604 B12R1.50 Cc1cc(ccc1)NC(=O)SC Amb24743264 [0,2,0,0,0,0|1,1,0]=4 8605 B12R1.50 Cc1cc(ccc1)NC(=S)OC Amb25743468 [0,2,0,0,0,0|1,1,0]=4 8606 B12R1.50 Cc1cc(ccc1)NC(N)=NO Amb18800913 [0,2,0,0,0,0|2,0,0]=4 8607 B12R1.50 Cc1cc(ccc1)OC(=O)C=C Amb25330984 [0,2,0,0,0,0|2,0,0]=4 8608 B12R1.50 Cc1cc(ccc1)OC(=O)CC Amb25198730 [0,2,0,0,0,0|2,0,0]=4 8609 B12R1.50 Cc1cc(ccc1)OC(=O)CN Amb19115307 [0,2,0,0,0,0|2,0,0]=4 8610 B12R1.50 Cc1cc(ccc1)OC(=O)CO Amb25160233 [0,2,0,0,0,0|1,0,0]=3 8611 B12R1.50 Cc1cc[n]c(CC(=O)OC)c1 Amb22750287 [0,2,0,0,0,0|1,0,0]=3 8612 B12R1.50 Cc1cccc(CC(=O)NC)[n]1 Amb25315061 [0,2,0,0,0,0|2,0,0]=4 8613 B12R1.50 Cc1cccc(CC(=O)NN)[n]1 Amb24501362 [0,2,0,0,0,0|2,0,0]=4 8614 B12R1.50 Cc1cccc(CC(=O)OC)[n]1 Amb21857032 [0,2,0,0,0,0|1,0,0]=3 8615 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [0,2,0,0,0,0|1,0,1]=4 8616 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [0,2,0,0,0,0|1,0,1]=4 8617 B12R1.50 Cc1cccc(CN(C)OC)c1 Amb24474494 [0,2,0,0,0,0|2,0,0]=4 8618 B12R1.50 Cc1cccc(CS(=O)CC)c1 Amb24408190 [0,2,0,0,0,0|2,0,0]=4 8619 B12R1.50 Cc1cccc(C\C(\C)=N\O)c1 Amb24487383 [0,2,0,0,0,0|1,0,0]=3 8620 B12R1.50 Cc1cccc(C\C(\N)=N\O)[n]1 Amb25102864 [0,2,0,0,0,0|2,0,0]=4 8621 B12R1.50 Cc1cccc(NC(=O)NO)[n]1 Amb19516360 [0,2,0,0,0,0|2,0,0]=4 8622 B12R1.50 ClCC(=O)Nc1cccc(c1)Br Amb1207240 [0,2,0,0,0,0|2,0,0]=4 8623 B12R1.50 ClCC(=O)Nc1cccc(c1)F Amb1643744 [0,2,0,0,0,0|2,0,0]=4 8624 B12R1.50 ClCC(=O)Nc1cccc(c1)I Amb1635732 [0,2,0,0,0,0|2,0,0]=4 8625 B12R1.50 ICC(=O)Nc1cccc(c1)C Amb16207226 [0,2,0,0,0,0|2,0,0]=4 8626 B12R1.50 N#CC(O)Cc1cccc(F)c1 Amb24372046 [0,2,0,0,0,0|1,0,1]=4 8627 B12R1.50 NC(CO)Cc1cc(F)ccc1 Amb22751648 [0,2,0,0,0,0|1,0,1]=4 8628 B12R1.50 NC(CO)Cc1cc(I)ccc1 Amb24694473 [0,2,0,0,0,0|1,0,1]=4 8629 B12R1.50 NC(Nc1cccc(Cl)c1)=NO Amb19075679 [0,2,0,0,0,0|2,0,0]=4 8630 B12R1.50 NC(Nc1cccc(F)c1)=NO Amb18806076 [0,2,0,0,0,0|2,0,0]=4 8631 B12R1.50 NCC(=O)Cc1cc(Br)ccc1 Amb18160371 [0,2,0,0,0,0|1,0,0]=3 8632 B12R1.50 NCC(=O)Cc1cc(Cl)ccc1 Amb18823030 [0,2,0,0,0,0|1,0,0]=3 8633 B12R1.50 NCC(=O)Cc1cc(F)ccc1 Amb18199528 [0,2,0,0,0,0|1,0,0]=3 8634 B12R1.50 NCC(=O)Cc1cc(O)ccc1 Amb18251724 [0,2,0,0,0,0|1,0,0]=3 8635 B12R1.50 NCC(=O)Nc1cccc(O)c1 Amb18951677 [0,2,0,0,0,0|2,0,0]=4 8636 B12R1.50 NCC(=O)Nc1cccc(c1)Cl Amb15740916 [0,2,0,0,0,0|2,0,0]=4 8637 B12R1.50 NCC(=O)Oc1cccc(c1)Br Amb17344447 [0,2,0,0,0,0|2,0,0]=4 8638 B12R1.50 NCC(=O)Oc1cccc(c1)C Amb17334635 [0,2,0,0,0,0|2,0,0]=4 8639 B12R1.50 NCC(=O)Oc1cccc(c1)Cl Amb17335804 [0,2,0,0,0,0|2,0,0]=4 8640 B12R1.50 NCC(=O)Oc1cccc(c1)F Amb17334753 [0,2,0,0,0,0|2,0,0]=4 8641 B12R1.50 NCC(Cc1cccc(c1)Br)O Amb17248846 [0,2,0,0,0,0|1,0,1]=4 8642 B12R1.50 NCC(Cc1cccc(c1)C)O Amb17232548 [0,2,0,0,0,0|1,0,1]=4 8643 B12R1.50 NCC(Cc1cccc(c1)Cl)O Amb17234266 [0,2,0,0,0,0|1,0,1]=4 8644 B12R1.50 NCC(O)Cc1cc(F)ccc1 Amb18563898 [0,2,0,0,0,0|1,0,1]=4 8645 B12R1.50 NNC(=O)Cc1cc[n]c(Cl)c1 Amb25169036 [0,2,0,0,0,0|2,0,0]=4 8646 B12R1.50 NNC(=O)Cc1cccc(I)c1 Amb25092748 [0,2,0,0,0,0|1,0,0]=3 8647 B12R1.50 NNC(=O)Cc1cccc(O)c1 Amb18788433 [0,2,0,0,0,0|1,0,0]=3 8648 B12R1.50 NNC(=O)Cc1cccc(c1)C Amb10075484 [0,2,0,0,0,0|1,0,0]=3 8649 B12R1.50 NNC(=O)Nc1cc(O)ccc1 Amb25159314 [0,2,0,0,0,0|2,0,0]=4 8650 B12R1.50 NNC(=O)Oc1cccc(Cl)c1 Amb25772432 [0,2,0,0,0,0|2,0,0]=4 8651 B12R1.50 N[C@@H](Cc1cc(O)ccc1)CO Amb22233156 [0,2,0,0,0,0|1,0,1]=4 8652 B12R1.50 N[C@H](CO)Cc1cc(Cl)ccc1 Amb22233154 [0,2,0,0,0,0|1,0,1]=4 8653 B12R1.50 N\C(\Cc1c[n]cc(Br)c1)=N\O Amb24399589 [0,2,0,0,0,0|2,0,0]=4 8654 B12R1.50 N\C(\Cc1cc(O)ccc1)=N\O Amb25103462 [0,2,0,0,0,0|1,0,0]=3 8655 B12R1.50 N\C(\Cc1cccc(Br)c1)=N\N Amb25149906 [0,2,0,0,0,0|2,0,0]=4 8656 B12R1.50 N\C(\Cc1cccc(Cl)c1)=N\N Amb19045348 [0,2,0,0,0,0|2,0,0]=4 8657 B12R1.50 N\C(\Cc1cccc(F)c1)=N\N Amb18788562 [0,2,0,0,0,0|2,0,0]=4 8658 B12R1.50 N\C(\Cc1cccc(O)[n]1)=N\O Amb24514716 [0,2,0,0,0,0|2,0,0]=4 8659 B12R1.50 Nc1cc(CC(=O)CN)cc[n]1 Amb25062881 [0,2,0,0,0,0|2,0,0]=4 8660 B12R1.50 Nc1cc(ccc1)NC(=N)NO Amb24610737 [0,2,0,0,0,0|2,0,0]=4 8661 B12R1.50 Nc1cc(ccc1)OC(=O)CN Amb25291404 [0,2,0,0,0,0|2,0,0]=4 8662 B12R1.50 Nc1cccc(C[C@H](N)CO)c1 Amb22233155 [0,2,0,0,0,0|1,0,1]=4 8663 B12R1.50 Nc1cccc(C\C(\N)=N/O)c1 Amb24711722 [0,2,0,0,0,0|1,0,0]=3 8664 B12R1.50 O=C(CF)Cc1cc(Cl)ccc1 Amb23454832 [0,2,0,0,0,0|1,0,0]=3 8665 B12R1.50 O=C(CS)Nc1cccc(I)c1 Amb22270162 [0,2,0,0,0,0|1,1,0]=4 8666 B12R1.50 O=C(Cc1cc(Br)ccc1)CBr Amb22233785 [0,2,0,0,0,0|1,0,0]=3 8667 B12R1.50 O=C(Cc1cccc(Br)c1)C=O Amb24402453 [0,2,0,0,0,0|0,0,1]=3 8668 B12R1.50 O=C(Cc1cccc(Cl)c1)CBr Amb24627962 [0,2,0,0,0,0|1,0,0]=3 8669 B12R1.50 O=CC(Cc1cccc(c1)Br)Cl Amb17204708 [0,2,0,0,0,0|1,0,1]=4 8670 B12R1.50 O=CC(Cc1cccc(c1)C)Cl Amb17204327 [0,2,0,0,0,0|1,0,1]=4 8671 B12R1.50 O=CC(Cc1cccc(c1)Cl)Cl Amb17204402 [0,2,0,0,0,0|1,0,1]=4 8672 B12R1.50 O=CC(Cc1cccc(c1)F)Cl Amb17204343 [0,2,0,0,0,0|1,0,1]=4 8673 B12R1.50 O=CC(F)Cc1cccc(Cl)c1 Amb24341527 [0,2,0,0,0,0|1,0,1]=4 8674 B12R1.50 O=C\C(=C\c1cccc(c1)Br)\C Amb17343200 [0,2,0,0,0,0|1,0,1]=4 8675 B12R1.50 O=C\C(=C\c1cccc(c1)C)\C Amb17334497 [0,2,0,0,0,0|1,0,1]=4 8676 B12R1.50 O=C\C(=C\c1cccc(c1)Cl)\C Amb17335456 [0,2,0,0,0,0|1,0,1]=4 8677 B12R1.50 O=C\C(=C\c1cccc(c1)O)\C Amb17334558 [0,2,0,0,0,0|1,0,1]=4 8678 B12R1.50 OC(Cc1cc(Cl)ccc1)CCl Amb25780609 [0,2,0,0,0,0|1,0,1]=4 8679 B12R1.50 OC(Cc1cccc(Br)c1)C=O Amb25802176 [0,2,0,0,0,0|0,0,1]=3 8680 B12R1.50 OC(Cc1cccc(Cl)c1)C=O Amb25107935 [0,2,0,0,0,0|0,0,1]=3 8681 B12R1.50 OC(Cc1cccc(F)c1)C=O Amb25047798 [0,2,0,0,0,0|0,0,1]=3 8682 B12R1.50 OC(Cc1cccc(F)c1)CCl Amb25266882 [0,2,0,0,0,0|1,0,1]=4 8683 B12R1.50 OCC(=O)Cc1cc(Br)ccc1 Amb18572003 [0,2,0,0,0,0|0,0,0]=2 8684 B12R1.50 OCC(=O)Cc1cc(Cl)ccc1 Amb18564304 [0,2,0,0,0,0|0,0,0]=2 8685 B12R1.50 OCC(=O)Cc1cc(F)ccc1 Amb25232023 [0,2,0,0,0,0|0,0,0]=2 8686 B12R1.50 OCC(=O)Nc1c[n]cc(F)c1 Amb25279689 [0,2,0,0,0,0|2,0,0]=4 8687 B12R1.50 OCC(=O)Nc1cc(Cl)cc[n]1 Amb24346619 [0,2,0,0,0,0|2,0,0]=4 8688 B12R1.50 OCC(=O)Nc1cc[n]c(Cl)c1 Amb25761181 [0,2,0,0,0,0|2,0,0]=4 8689 B12R1.50 OCC(=O)Nc1cccc(c1)Cl Amb1110353 [0,2,0,0,0,0|1,0,0]=3 8690 B12R1.50 OCC(=O)Nc1cccc(c1)F Amb1110282 [0,2,0,0,0,0|1,0,0]=3 8691 B12R1.50 OCC(=O)Oc1cccc(Cl)c1 Amb25043439 [0,2,0,0,0,0|1,0,0]=3 8692 B12R1.50 OCC(Cc1cccc(c1)Br)N Amb17062712 [0,2,0,0,0,0|1,0,1]=4 8693 B12R1.50 OCC(Cc1cccc(c1)C)N Amb17062686 [0,2,0,0,0,0|1,0,1]=4 8694 B12R1.50 OCC(Cc1cccc(c1)Cl)N Amb17062695 [0,2,0,0,0,0|1,0,1]=4 8695 B12R1.50 OCC(Cc1cccc(c1)O)N Amb17062711 [0,2,0,0,0,0|1,0,1]=4 8696 B12R1.50 OCC(O)Cc1cccc(Cl)c1 Amb25281635 [0,2,0,0,0,0|0,0,2]=4 8697 B12R1.50 OCC(S)Cc1cc(F)ccc1 Amb25177551 [0,2,0,0,0,0|0,1,1]=4 8698 B12R1.50 ONC(=O)Cc1cccc(Br)c1 Amb25751442 [0,2,0,0,0,0|0,0,0]=2 8699 B12R1.50 ONC(=O)Cc1cccc(Cl)c1 Amb19075673 [0,2,0,0,0,0|0,0,0]=2 8700 B12R1.50 O\C(\C=O)=C/c1cccc(F)c1 Amb25130617 [0,2,0,0,0,0|0,0,1]=3 8701 B12R1.50 O\N=C(\Cc1cccc(c1)Cl)/N Amb1117604 [0,2,0,0,0,0|1,0,0]=3 8702 B12R1.50 Oc1cc(CC(=O)NO)ccc1 Amb18788532 [0,2,0,0,0,0|0,0,0]=2 8703 B12R1.50 Oc1cc(CC(F)C=O)ccc1 Amb25836660 [0,2,0,0,0,0|1,0,1]=4 8704 B12R1.50 Oc1cc(ccc1)NC(=O)CS Amb24072204 [0,2,0,0,0,0|1,1,0]=4 8705 B12R1.50 Oc1cc(ccc1)OC(=O)CCl Amb18649457 [0,2,0,0,0,0|2,0,0]=4 8706 B12R1.50 Oc1cccc(CC(O)CO)c1 Amb24497069 [0,2,0,0,0,0|0,0,2]=4 8707 B12R1.118 C#CC(CO)Cc1ccccc1 Amb25105982 [0,2,0,0,0,0|1,0,1]=4 8708 B12R1.118 C=C=C(CCl)Cc1ccccc1 Amb25211674 [0,2,0,0,0,0|2,0,0]=4 8709 B12R1.118 C=C=C(CO)Cc1ccccc1 Amb25777134 [0,2,0,0,0,0|1,0,0]=3 8710 B12R1.118 C=C=C(Cc1ccccc1)C=O Amb25123884 [0,2,0,0,0,0|1,0,0]=3 8711 B12R1.118 C=C\C(\C=O)=C\c1ccccc1 Amb24553053 [0,2,0,0,0,0|1,0,1]=4 8712 B12R1.118 CCN(Cc1ccccc1)C=O Amb25034769 [0,2,0,0,0,0|2,0,0]=4 8713 B12R1.118 CCN(Cc1ccccc1)N=O Amb24376725 [0,2,0,0,0,0|2,0,0]=4 8714 B12R1.118 CC\C(\Cc1ccccc1)=N\N Amb25057429 [0,2,0,0,0,0|2,0,0]=4 8715 B12R1.118 CC\C(\Nc1ccccc1)=N\O Amb24356045 [0,2,0,0,0,0|2,0,0]=4 8716 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [0,2,0,0,0,0|1,0,1]=4 8717 B12R1.118 CN\C(\Cc1ccccc1)=N/N Amb18788196 [0,2,0,0,0,0|2,0,0]=4 8718 B12R1.118 CN\C(\Cc1ccccc1)=N\O Amb25376955 [0,2,0,0,0,0|1,0,0]=3 8719 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [0,2,0,0,0,0|1,0,1]=4 8720 B12R1.118 COC(Cc1ccccc1)C#N Amb25681947 [0,2,0,0,0,0|1,0,1]=4 8721 B12R1.118 CO[SiH](Cc1ccccc1)C=C Amb22231750 [0,2,0,0,0,0|1,1,0]=4 8722 B12R1.118 CO\C(=C\c1ccccc1)\C=O Amb17594035 [0,2,0,0,0,0|0,0,1]=3 8723 B12R1.118 CO\C(\C=O)=C/c1ccc[n]c1 Amb25713631 [0,2,0,0,0,0|1,0,1]=4 8724 B12R1.118 C\C=C(/C=O)\Oc1ccccc1 Amb24697807 [0,2,0,0,0,0|2,0,0]=4 8725 B12R1.118 C\C=C(/Cc1ccccc1)\C=O Amb18645376 [0,2,0,0,0,0|1,0,0]=3 8726 B12R1.118 C\C=C(\C=O)/Sc1ccccc1 Amb18648151 [0,2,0,0,0,0|2,0,0]=4 8727 B12R1.118 C\C=C(\Cc1ccccc1)/C=O Amb25743406 [0,2,0,0,0,0|1,0,0]=3 8728 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [0,2,0,0,0,0|1,0,1]=4 8729 B12R1.118 N#CC(Cc1ccccc1)C=O Amb22371309 [0,2,0,0,0,0|1,0,1]=4 8730 B12R1.118 N#C\C(=C/O)\Sc1ccccc1 Amb25687961 [0,2,0,0,0,0|2,0,0]=4 8731 B12R1.118 N#C\C(\C=O)=C/c1ccccc1 Amb24566216 [0,2,0,0,0,0|1,0,1]=4 8732 B12R1.118 N#C\C(\C=O)=C\c1ccccc1 Amb18644900 [0,2,0,0,0,0|1,0,1]=4 8733 B12R1.118 N#C\C(\Cc1ccc[n]c1)=C/O Amb25357837 [0,2,0,0,0,0|2,0,0]=4 8734 B12R1.118 NCC(CO)Cc1ccccc1 Amb22899484 [0,2,0,0,0,0|1,0,1]=4 8735 B12R1.118 N\C=C(\Cc1ccccc1)/C#N Amb24743507 [0,2,0,0,0,0|2,0,0]=4 8736 B12R1.118 O=CC(=Cc1ccccc1)C=O Amb18645276 [0,2,0,0,0,0|0,0,2]=4 8737 B12R1.118 O=C\C(\CCl)=C\c1ccccc1 Amb25669592 [0,2,0,0,0,0|1,0,1]=4 8738 B12R1.118 O=C\C(\Cc1ccccc1)=C/Cl Amb25300287 [0,2,0,0,0,0|1,0,0]=3 8739 B12R1.118 OCC(CO)=Cc1ccccc1 Amb25077955 [0,2,0,0,0,0|0,0,2]=4 8740 B12R1.118 OC\C(\Cc1ccccc1)=C\F Amb25037074 [0,2,0,0,0,0|1,0,0]=3 8741 B12R1.118 OC\C(\Cc1ccccc1)=N\O Amb25052256 [0,2,0,0,0,0|0,0,1]=3 8742 B12R1.118 O\C=C(/C=O)\Oc1ccccc1 Amb24625847 [0,2,0,0,0,0|1,0,0]=3 8743 B12R1.118 O\C=C(/Cc1cccnc1)\C#N Amb10605347 [0,2,0,0,0,0|2,0,0]=4 8744 B12R1.118 O\C=C(\Cc1ccncc1)/C#N Amb10605342 [0,2,0,0,0,0|2,0,0]=4 8745 B12R1.194 C#CC(Cc1ccccc1)(O)C Amb1083082 [0,2,0,0,0,0|1,0,1]=4 8746 B12R1.194 C=CS(=O)(=O)Cc1ccccc1 Amb2459233 [0,2,0,0,0,0|1,0,1]=4 8747 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [0,2,0,0,0,0|1,0,1]=4 8748 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [0,2,0,0,0,0|1,0,1]=4 8749 B12R1.194 CC(Cl)(CO)Cc1ccccc1 Amb25115909 [0,2,0,0,0,0|1,0,1]=4 8750 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [0,2,0,0,0,0|1,0,1]=4 8751 B12R1.194 CC(O)(Cc1ccccc1)C#N Amb18177733 [0,2,0,0,0,0|1,0,1]=4 8752 B12R1.194 CC(O)(Cc1ccccc1)NN Amb25361538 [0,2,0,0,0,0|1,0,1]=4 8753 B12R1.194 CNS(=O)(=O)Cc1ccccc1 Amb1125735 [0,2,0,0,0,0|1,0,1]=4 8754 B12R1.194 COC(Cc1ccccc1)(C)C Amb10555866 [0,2,0,0,0,0|1,0,1]=4 8755 B12R1.194 COP(O)(=O)Cc1ccccc1 Amb25353668 [0,2,0,0,0,0|1,0,0]=3 8756 B12R1.194 CO[Si](C)(C)Cc1ccccc1 Amb22167044 [0,2,0,0,0,0|1,1,0]=4 8757 B12R1.194 C[C@@](O)(Cc1ccccc1)C=O Amb24539297 [0,2,0,0,0,0|0,0,1]=3 8758 B12R1.194 C[C@@](O)(Cc1ccccc1)CO Amb25817130 [0,2,0,0,0,0|0,0,2]=4 8759 B12R1.194 C[C@](O)(Cc1ccccc1)CO Amb24474165 [0,2,0,0,0,0|0,0,2]=4 8760 B12R1.194 NCC(Cc1ccccc1)(O)C Amb17082131 [0,2,0,0,0,0|1,0,1]=4 8761 B12R1.194 O=CC(F)(F)Cc1ccccc1 Amb24424443 [0,2,0,0,0,0|1,0,1]=4 8762 B12R1.194 O=S(=O)(CCl)Cc1ccccc1 Amb22364602 [0,2,0,0,0,0|1,0,1]=4 8763 B12R1.194 OCC(F)(Cl)Cc1ccccc1 Amb25182929 [0,2,0,0,0,0|1,0,1]=4 8764 B12R1.194 OCC(F)(F)Cc1ccccc1 Amb25847026 [0,2,0,0,0,0|1,0,1]=4 8765 B12R1.194 ONC(Cc1ccccc1)(C)C Amb17615684 [0,2,0,0,0,0|1,0,1]=4 8766 B12R1.371 BrCC(=O)Nc1ccccc1F Amb2089069 [0,2,0,0,0,0|2,0,0]=4 8767 B12R1.371 BrCC(=O)Nc1ccccc1O Amb17325450 [0,2,0,0,0,0|2,0,0]=4 8768 B12R1.371 C#CC(=O)Cc1ccccc1Br Amb24483898 [0,2,0,0,0,0|1,0,0]=3 8769 B12R1.371 C#CC(=O)Nc1ccccc1Cl Amb23556962 [0,2,0,0,0,0|2,0,0]=4 8770 B12R1.371 C#CC(=O)Nc1ccccc1I Amb25149785 [0,2,0,0,0,0|2,0,0]=4 8771 B12R1.371 C#CC(=O)Oc1ccccc1F Amb24498038 [0,2,0,0,0,0|2,0,0]=4 8772 B12R1.371 C=C(Cc1ccccc1Cl)C=O Amb25373181 [0,2,0,0,0,0|1,0,0]=3 8773 B12R1.371 C=C(Cc1ccccc1F)C=O Amb25674264 [0,2,0,0,0,0|1,0,0]=3 8774 B12R1.371 C=CC(=O)Cc1cc[n]cc1Cl Amb25160000 [0,2,0,0,0,0|2,0,0]=4 8775 B12R1.371 C=CC(=O)Cc1ccccc1Cl Amb24350181 [0,2,0,0,0,0|1,0,0]=3 8776 B12R1.371 C=CC(=O)Nc1ccccc1O Amb18645794 [0,2,0,0,0,0|2,0,0]=4 8777 B12R1.371 C=CC(=O)Oc1ccccc1Br Amb25156556 [0,2,0,0,0,0|2,0,0]=4 8778 B12R1.371 C=CC(O)Cc1ccccc1Br Amb24523932 [0,2,0,0,0,0|1,0,1]=4 8779 B12R1.371 CC(CO)Cc1ccccc1Br Amb25208316 [0,2,0,0,0,0|1,0,1]=4 8780 B12R1.371 CC(CO)Cc1ccccc1Cl Amb25039912 [0,2,0,0,0,0|1,0,1]=4 8781 B12R1.371 CC(Cc1ccccc1Br)C=O Amb25324057 [0,2,0,0,0,0|1,0,1]=4 8782 B12R1.371 CC(Cc1ccccc1F)C=O Amb24429443 [0,2,0,0,0,0|1,0,1]=4 8783 B12R1.371 CC(Cc1ccccc1I)C=O Amb24437612 [0,2,0,0,0,0|1,0,1]=4 8784 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [0,2,0,0,0,0|1,0,1]=4 8785 B12R1.371 CCC(=O)CN1C=CC=CC1=O Amb18800894 [0,2,0,0,0,0|2,0,0]=4 8786 B12R1.371 CCC(=O)Cc1ccccc1Br Amb19148340 [0,2,0,0,0,0|1,0,0]=3 8787 B12R1.371 CCC(=O)Cc1ccccc1C Amb17138542 [0,2,0,0,0,0|1,0,0]=3 8788 B12R1.371 CCC(=O)Cc1ccccc1Cl Amb17139041 [0,2,0,0,0,0|1,0,0]=3 8789 B12R1.371 CCC(=O)Cc1ccccc1F Amb17138603 [0,2,0,0,0,0|1,0,0]=3 8790 B12R1.371 CCC(=O)Cc1ccccc1O Amb18646038 [0,2,0,0,0,0|1,0,0]=3 8791 B12R1.371 CCC(=O)Nc1ccccc1Br Amb2222500 [0,2,0,0,0,0|2,0,0]=4 8792 B12R1.371 CCC(=O)Nc1ccccc1I Amb1788758 [0,2,0,0,0,0|2,0,0]=4 8793 B12R1.371 CCC(=O)Nc1ccccc1N Amb1114296 [0,2,0,0,0,0|2,0,0]=4 8794 B12R1.371 CCC(=O)Oc1ccccc1F Amb25039137 [0,2,0,0,0,0|2,0,0]=4 8795 B12R1.371 CCC(=O)Oc1ccccc1N Amb24743412 [0,2,0,0,0,0|2,0,0]=4 8796 B12R1.371 CCC(=O)Oc1ccccc1O Amb22167293 [0,2,0,0,0,0|2,0,0]=4 8797 B12R1.371 CCC(Cc1ccccc1C)O Amb17138581 [0,2,0,0,0,0|1,0,1]=4 8798 B12R1.371 CCC(Cc1ccccc1Cl)O Amb17139101 [0,2,0,0,0,0|1,0,1]=4 8799 B12R1.371 CCC(Cc1ccccc1F)O Amb17138635 [0,2,0,0,0,0|1,0,1]=4 8800 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [0,2,0,0,0,0|1,0,1]=4 8801 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [0,2,0,0,0,0|1,0,1]=4 8802 B12R1.371 CCS(=O)Cc1ccccc1F Amb24449347 [0,2,0,0,0,0|2,0,0]=4 8803 B12R1.371 CCS(=O)Cc1ccccc1N Amb18290934 [0,2,0,0,0,0|2,0,0]=4 8804 B12R1.371 CCS(=O)Cc1ccccc1O Amb18648969 [0,2,0,0,0,0|2,0,0]=4 8805 B12R1.371 CN(Cc1ccccc1Cl)OC Amb25284132 [0,2,0,0,0,0|2,0,0]=4 8806 B12R1.371 CN(Cc1ccccc1F)C=O Amb25211597 [0,2,0,0,0,0|2,0,0]=4 8807 B12R1.371 CN(Cc1ccccc1O)C=O Amb25349061 [0,2,0,0,0,0|2,0,0]=4 8808 B12R1.371 CN(Cc1ccccc1O)N=O Amb25780455 [0,2,0,0,0,0|2,0,0]=4 8809 B12R1.371 CNC(=N)Cc1ccccc1F Amb24483570 [0,2,0,0,0,0|2,0,0]=4 8810 B12R1.371 CNC(=O)CN1C=CC=CC1=O Amb25789798 [0,2,0,0,0,0|2,0,0]=4 8811 B12R1.371 CNC(=O)C[n+]1ccccc1Br Amb25663673 [0,2,0,0,0,0|2,0,0]=4 8812 B12R1.371 CNC(=O)Cc1[n]cccc1F Amb24673177 [0,2,0,0,0,0|2,0,0]=4 8813 B12R1.371 CNC(=O)Cc1ccc[n]c1N Amb25728841 [0,2,0,0,0,0|2,0,0]=4 8814 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [0,2,0,0,0,0|1,0,0]=3 8815 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [0,2,0,0,0,0|1,0,0]=3 8816 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [0,2,0,0,0,0|1,0,0]=3 8817 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [0,2,0,0,0,0|1,0,0]=3 8818 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [0,2,0,0,0,0|1,0,0]=3 8819 B12R1.371 CNC(=O)Nc1ccccc1Br Amb11316867 [0,2,0,0,0,0|2,0,0]=4 8820 B12R1.371 CNC(=O)Nc1ccccc1F Amb2444100 [0,2,0,0,0,0|2,0,0]=4 8821 B12R1.371 CNC(=O)Nc1ccccc1I Amb14010753 [0,2,0,0,0,0|2,0,0]=4 8822 B12R1.371 CNC(=O)Nc1ccccc1N Amb25242450 [0,2,0,0,0,0|2,0,0]=4 8823 B12R1.371 CNC(=O)Oc1ccccc1Cl Amb22479442 [0,2,0,0,0,0|2,0,0]=4 8824 B12R1.371 CNC(=O)Oc1ccccc1F Amb24669113 [0,2,0,0,0,0|2,0,0]=4 8825 B12R1.371 CNC(=O)Oc1ccccc1N Amb24429125 [0,2,0,0,0,0|2,0,0]=4 8826 B12R1.371 CNC(=O)Oc1ccccc1O Amb18646674 [0,2,0,0,0,0|2,0,0]=4 8827 B12R1.371 COC(=N)Cc1ccccc1Cl Amb19074651 [0,2,0,0,0,0|1,0,0]=3 8828 B12R1.371 COC(=N)Cc1ccccc1F Amb18792903 [0,2,0,0,0,0|1,0,0]=3 8829 B12R1.371 COC(=O)CC1=CN=CNC1=O Amb22959758 [0,2,0,0,0,0|2,0,0]=4 8830 B12R1.371 COC(=O)CC1=NC=CNC1=O Amb25317862 [0,2,0,0,0,0|2,0,0]=4 8831 B12R1.371 COC(=O)CN1C=CC=CC1=O Amb18805575 [0,2,0,0,0,0|1,0,0]=3 8832 B12R1.371 COC(=O)CN1C=CC=CC1=S Amb24192816 [0,2,0,0,0,0|1,0,0]=3 8833 B12R1.371 COC(=O)CN1C=CC=NC1=O Amb18788735 [0,2,0,0,0,0|2,0,0]=4 8834 B12R1.371 COC(=O)CN1C=CN=CC1=O Amb25070285 [0,2,0,0,0,0|2,0,0]=4 8835 B12R1.371 COC(=O)CN1C=NC=CC1=O Amb25721309 [0,2,0,0,0,0|2,0,0]=4 8836 B12R1.371 COC(=O)CN1N=CC=CC1=O Amb18793019 [0,2,0,0,0,0|2,0,0]=4 8837 B12R1.371 COC(=O)C[n+]1ccccc1C Amb16224766 [0,2,0,0,0,0|1,0,0]=3 8838 B12R1.371 COC(=O)C[n+]1ccccc1Cl Amb25848252 [0,2,0,0,0,0|1,0,0]=3 8839 B12R1.371 COC(=O)Cc1[n]c[n]cc1Cl Amb22496246 [0,2,0,0,0,0|2,0,0]=4 8840 B12R1.371 COC(=O)Cc1[n]cccc1Br Amb22263925 [0,2,0,0,0,0|1,0,0]=3 8841 B12R1.371 COC(=O)Cc1[n]cccc1Cl Amb22750289 [0,2,0,0,0,0|1,0,0]=3 8842 B12R1.371 COC(=O)Cc1c[n]c[n]c1N Amb24586546 [0,2,0,0,0,0|2,0,0]=4 8843 B12R1.371 COC(=O)Cc1c[n]ccc1Br Amb25248822 [0,2,0,0,0,0|1,0,0]=3 8844 B12R1.371 COC(=O)Cc1c[n]ccc1Cl Amb25333659 [0,2,0,0,0,0|1,0,0]=3 8845 B12R1.371 COC(=O)Cc1c[n]ccc1N Amb24524861 [0,2,0,0,0,0|1,0,0]=3 8846 B12R1.371 COC(=O)Cc1cc[n]cc1Br Amb22586456 [0,2,0,0,0,0|1,0,0]=3 8847 B12R1.371 COC(=O)Cc1cc[n]cc1N Amb22371407 [0,2,0,0,0,0|1,0,0]=3 8848 B12R1.371 COC(=O)Cc1ccc[n]c1Cl Amb22396231 [0,2,0,0,0,0|1,0,0]=3 8849 B12R1.371 COC(=O)Cc1ccccc1I Amb22749395 [0,2,0,0,0,0|0,0,0]=2 8850 B12R1.371 COC(=O)Cc1ccccc1N Amb20623565 [0,2,0,0,0,0|0,0,0]=2 8851 B12R1.371 COC(=O)Cn1ncccc1=O Amb13949864 [0,2,0,0,0,0|2,0,0]=4 8852 B12R1.371 COC(=O)Nc1[n]cccc1Br Amb24454429 [0,2,0,0,0,0|2,0,0]=4 8853 B12R1.371 COC(=O)Nc1[n]cccc1Cl Amb25339981 [0,2,0,0,0,0|2,0,0]=4 8854 B12R1.371 COC(=O)Nc1[n]cccc1N Amb18646705 [0,2,0,0,0,0|2,0,0]=4 8855 B12R1.371 COC(=O)Nc1c[n]ccc1Cl Amb24525628 [0,2,0,0,0,0|2,0,0]=4 8856 B12R1.371 COC(=O)Nc1c[n]ccc1N Amb24443744 [0,2,0,0,0,0|2,0,0]=4 8857 B12R1.371 COC(=O)Nc1c[n]ccc1O Amb25847626 [0,2,0,0,0,0|2,0,0]=4 8858 B12R1.371 COC(=O)Nc1cc[n]cc1Br Amb24737452 [0,2,0,0,0,0|2,0,0]=4 8859 B12R1.371 COC(=O)Nc1cc[n]cc1I Amb25160208 [0,2,0,0,0,0|2,0,0]=4 8860 B12R1.371 COC(=O)Nc1cc[n]cc1N Amb18967350 [0,2,0,0,0,0|2,0,0]=4 8861 B12R1.371 COC(=O)Nc1cc[n]cc1O Amb25829808 [0,2,0,0,0,0|2,0,0]=4 8862 B12R1.371 COC(=O)Nc1ccc[n]c1O Amb24369945 [0,2,0,0,0,0|2,0,0]=4 8863 B12R1.371 COC(=O)Nc1cccc[n+]1C Amb2237836 [0,2,0,0,0,0|2,0,0]=4 8864 B12R1.371 COC(=O)Nc1ccccc1C Amb17846660 [0,2,0,0,0,0|1,0,0]=3 8865 B12R1.371 COC(=O)Nc1cccnc1Cl Amb17737912 [0,2,0,0,0,0|2,0,0]=4 8866 B12R1.371 COC(=O)Nc1ncccc1C Amb17739509 [0,2,0,0,0,0|2,0,0]=4 8867 B12R1.371 COC(=O)Oc1ccc[n]c1N Amb24594850 [0,2,0,0,0,0|2,0,0]=4 8868 B12R1.371 COC(=O)Oc1ccccc1N Amb25337714 [0,2,0,0,0,0|1,0,0]=3 8869 B12R1.371 COC(=O)\C=C\1/C=CC=CN1C Amb24099067 [0,2,0,0,0,0|1,0,1]=4 8870 B12R1.371 COC(C)Cc1ccccc1O Amb18646540 [0,2,0,0,0,0|1,0,1]=4 8871 B12R1.371 C[C@@H](Cc1ccccc1O)CO Amb24633514 [0,2,0,0,0,0|1,0,1]=4 8872 B12R1.371 C[C@H](CO)Cc1ccccc1Cl Amb25157925 [0,2,0,0,0,0|1,0,1]=4 8873 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [0,2,0,0,0,0|1,0,1]=4 8874 B12R1.371 C[C@H](Cc1ccccc1O)CO Amb25094364 [0,2,0,0,0,0|1,0,1]=4 8875 B12R1.371 C\C(\C=O)=C\c1ccccc1Br Amb24639745 [0,2,0,0,0,0|1,0,1]=4 8876 B12R1.371 C\C(\C=O)=C\c1ccccc1Cl Amb25827711 [0,2,0,0,0,0|1,0,1]=4 8877 B12R1.371 C\C(\C=O)=C\c1ccccc1F Amb25793939 [0,2,0,0,0,0|1,0,1]=4 8878 B12R1.371 C\C(\CO)=C/c1ccccc1O Amb25838654 [0,2,0,0,0,0|1,0,1]=4 8879 B12R1.371 C\C(\CO)=C\c1ccccc1Br Amb25335085 [0,2,0,0,0,0|1,0,1]=4 8880 B12R1.371 C\C(\CO)=C\c1ccccc1Cl Amb24557711 [0,2,0,0,0,0|1,0,1]=4 8881 B12R1.371 C\C(\CO)=C\c1ccccc1F Amb24700903 [0,2,0,0,0,0|1,0,1]=4 8882 B12R1.371 C\C(\CO)=C\c1ccccc1O Amb18646032 [0,2,0,0,0,0|1,0,1]=4 8883 B12R1.371 C\C(\Cc1ccccc1Cl)=N\N Amb25106628 [0,2,0,0,0,0|2,0,0]=4 8884 B12R1.371 C\C(\Cc1ccccc1Cl)=N\O Amb25290972 [0,2,0,0,0,0|1,0,0]=3 8885 B12R1.371 C\C(\Cc1ccccc1F)=N\O Amb25252610 [0,2,0,0,0,0|1,0,0]=3 8886 B12R1.371 C\C(\Cc1ccccc1I)=N\N Amb24525431 [0,2,0,0,0,0|2,0,0]=4 8887 B12R1.371 C\C(\Cc1ccccc1O)=C/C Amb25130619 [0,2,0,0,0,0|2,0,0]=4 8888 B12R1.371 C\C(\Cc1ccccc1O)=C\C Amb24380771 [0,2,0,0,0,0|2,0,0]=4 8889 B12R1.371 C\C(\Cc1ccccc1O)=N\O Amb25211004 [0,2,0,0,0,0|1,0,0]=3 8890 B12R1.371 Cc1[n]c[n]cc1CC(=O)OC Amb24656554 [0,2,0,0,0,0|2,0,0]=4 8891 B12R1.371 Cc1[n]cccc1CC(=O)NO Amb24448842 [0,2,0,0,0,0|1,0,0]=3 8892 B12R1.371 Cc1[n]cccc1CC(=O)OC Amb25139680 [0,2,0,0,0,0|1,0,0]=3 8893 B12R1.371 Cc1[n]cccc1C\C(\N)=N\O Amb25683975 [0,2,0,0,0,0|2,0,0]=4 8894 B12R1.371 Cc1cc[n]cc1C\C(\N)=N\O Amb25268577 [0,2,0,0,0,0|2,0,0]=4 8895 B12R1.371 Cc1ccc[n]c1CC(=O)OC Amb22750241 [0,2,0,0,0,0|1,0,0]=3 8896 B12R1.371 Cc1ccc[n]c1C\C(\N)=N\O Amb25098173 [0,2,0,0,0,0|2,0,0]=4 8897 B12R1.371 Cc1ccc[n]c1NC(=O)CO Amb25355071 [0,2,0,0,0,0|2,0,0]=4 8898 B12R1.371 Cc1cccc[n+]1CC(=O)OC Amb25683216 [0,2,0,0,0,0|1,0,0]=3 8899 B12R1.371 Cc1ccccc1CC(=N)OC Amb18798191 [0,2,0,0,0,0|1,0,0]=3 8900 B12R1.371 Cc1ccccc1CC(=O)C#C Amb25209391 [0,2,0,0,0,0|1,0,0]=3 8901 B12R1.371 Cc1ccccc1CC(=O)C=C Amb25678802 [0,2,0,0,0,0|1,0,0]=3 8902 B12R1.371 Cc1ccccc1CC(=O)CN Amb18829246 [0,2,0,0,0,0|1,0,0]=3 8903 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [0,2,0,0,0,0|0,0,0]=2 8904 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,2,0,0,0,0|1,0,1]=4 8905 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [0,2,0,0,0,0|1,0,1]=4 8906 B12R1.371 Cc1ccccc1CC(N)=NN Amb18788207 [0,2,0,0,0,0|2,0,0]=4 8907 B12R1.371 Cc1ccccc1CC(O)C#C Amb25764953 [0,2,0,0,0,0|1,0,1]=4 8908 B12R1.371 Cc1ccccc1CC(O)C=O Amb25789140 [0,2,0,0,0,0|0,0,1]=3 8909 B12R1.371 Cc1ccccc1CC(O)CCl Amb25258048 [0,2,0,0,0,0|1,0,1]=4 8910 B12R1.371 Cc1ccccc1CC(O)CO Amb24615514 [0,2,0,0,0,0|0,0,2]=4 8911 B12R1.371 Cc1ccccc1CN(C)C=O Amb25088109 [0,2,0,0,0,0|2,0,0]=4 8912 B12R1.371 Cc1ccccc1C[C@H](O)CC Amb25157887 [0,2,0,0,0,0|1,0,1]=4 8913 B12R1.371 Cc1ccccc1C\C(\C)=N/N Amb24458307 [0,2,0,0,0,0|2,0,0]=4 8914 B12R1.371 Cc1ccccc1NC(=O)C#C Amb24749543 [0,2,0,0,0,0|2,0,0]=4 8915 B12R1.371 Cc1ccccc1NC(=O)CN Amb21958991 [0,2,0,0,0,0|2,0,0]=4 8916 B12R1.371 Cc1ccccc1NC(=O)CN Amb22587979 [0,2,0,0,0,0|2,0,0]=4 8917 B12R1.371 Cc1ccccc1NC(=S)NO Amb24342052 [0,2,0,0,0,0|1,1,0]=4 8918 B12R1.371 Cc1ccccc1NC(=S)OC Amb25783782 [0,2,0,0,0,0|1,1,0]=4 8919 B12R1.371 Cc1ccccc1NC(N)=NO Amb18800914 [0,2,0,0,0,0|2,0,0]=4 8920 B12R1.371 Cc1ccccc1OC(=O)CN Amb19115306 [0,2,0,0,0,0|2,0,0]=4 8921 B12R1.371 Cc1ccccc1OC(=O)OC Amb24474007 [0,2,0,0,0,0|1,0,0]=3 8922 B12R1.371 Cc1ccccc1SC(=C)CO Amb25271481 [0,2,0,0,0,0|2,0,0]=4 8923 B12R1.371 Cc1ccccc1SC(=O)CCl Amb25054637 [0,2,0,0,0,0|2,0,0]=4 8924 B12R1.371 Cc1ccccc1\C=C(\C)/C=O Amb25230198 [0,2,0,0,0,0|1,0,1]=4 8925 B12R1.371 Cc1ccccc1\C=C(\F)/C=O Amb24612450 [0,2,0,0,0,0|1,0,1]=4 8926 B12R1.371 Cc1ccccc1\C=C(\F)/CO Amb24407513 [0,2,0,0,0,0|1,0,1]=4 8927 B12R1.371 ClCC(=O)Nc1ccccc1Br Amb1201720 [0,2,0,0,0,0|2,0,0]=4 8928 B12R1.371 ClCC(=O)Nc1ccccc1C Amb1644314 [0,2,0,0,0,0|2,0,0]=4 8929 B12R1.371 ClCC(=O)Oc1ccccc1O Amb17594841 [0,2,0,0,0,0|2,0,0]=4 8930 B12R1.371 Fc1ccccc1NC(=O)CS Amb17683551 [0,2,0,0,0,0|1,1,0]=4 8931 B12R1.371 ICC(=O)Nc1ccccc1C Amb16207229 [0,2,0,0,0,0|2,0,0]=4 8932 B12R1.371 N=C(CN1C=CC=CC1=O)NO Amb22497561 [0,2,0,0,0,0|2,0,0]=4 8933 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [0,2,0,0,0,0|1,0,1]=4 8934 B12R1.371 NC(CO)Cc1ccccc1I Amb25200271 [0,2,0,0,0,0|1,0,1]=4 8935 B12R1.371 NC(Cc1ccccc1Cl)=NN Amb19045351 [0,2,0,0,0,0|2,0,0]=4 8936 B12R1.371 NC(Cc1ccccc1O)CO Amb18827210 [0,2,0,0,0,0|1,0,1]=4 8937 B12R1.371 NC(Nc1ccccc1Cl)=NO Amb19075681 [0,2,0,0,0,0|2,0,0]=4 8938 B12R1.371 NC(Nc1ccccc1F)=NO Amb18185590 [0,2,0,0,0,0|2,0,0]=4 8939 B12R1.371 NCC(=O)Cc1[n]cccc1Br Amb25705674 [0,2,0,0,0,0|2,0,0]=4 8940 B12R1.371 NCC(=O)Cc1ccccc1Br Amb25667280 [0,2,0,0,0,0|1,0,0]=3 8941 B12R1.371 NCC(=O)Cc1ccccc1Cl Amb18909368 [0,2,0,0,0,0|1,0,0]=3 8942 B12R1.371 NCC(=O)Cc1ccccc1F Amb18827239 [0,2,0,0,0,0|1,0,0]=3 8943 B12R1.371 NCC(=O)Nc1ccccc1Br Amb1105100 [0,2,0,0,0,0|2,0,0]=4 8944 B12R1.371 NCC(=O)Nc1ccccc1Br Amb2277974 [0,2,0,0,0,0|2,0,0]=4 8945 B12R1.371 NCC(=O)Nc1ccccc1Cl Amb15740955 [0,2,0,0,0,0|2,0,0]=4 8946 B12R1.371 NCC(=O)Nc1ccccc1O Amb18646493 [0,2,0,0,0,0|2,0,0]=4 8947 B12R1.371 NCC(=O)Oc1ccccc1Br Amb17344446 [0,2,0,0,0,0|2,0,0]=4 8948 B12R1.371 NCC(=O)Oc1ccccc1C Amb17334634 [0,2,0,0,0,0|2,0,0]=4 8949 B12R1.371 NCC(=O)Oc1ccccc1Cl Amb17335803 [0,2,0,0,0,0|2,0,0]=4 8950 B12R1.371 NCC(=O)Oc1ccccc1F Amb17334752 [0,2,0,0,0,0|2,0,0]=4 8951 B12R1.371 NCC(Cc1ccccc1C)O Amb17232545 [0,2,0,0,0,0|1,0,1]=4 8952 B12R1.371 NCC(Cc1ccccc1Cl)O Amb17234263 [0,2,0,0,0,0|1,0,1]=4 8953 B12R1.371 NCC(Cc1ccccc1F)O Amb17232700 [0,2,0,0,0,0|1,0,1]=4 8954 B12R1.371 NCC(O)Cc1ccccc1Br Amb18069447 [0,2,0,0,0,0|1,0,1]=4 8955 B12R1.371 NNC(=O)CN1C=CC=CC1=O Amb18028594 [0,2,0,0,0,0|2,0,0]=4 8956 B12R1.371 NNC(=O)Cc1ccc[n]c1Cl Amb25112883 [0,2,0,0,0,0|2,0,0]=4 8957 B12R1.371 NNC(=O)Cc1ccccc1Br Amb22484618 [0,2,0,0,0,0|1,0,0]=3 8958 B12R1.371 NNC(=O)Cc1ccccc1F Amb1126168 [0,2,0,0,0,0|1,0,0]=3 8959 B12R1.371 NNC(=O)Cc1ccccc1I Amb25334643 [0,2,0,0,0,0|1,0,0]=3 8960 B12R1.371 NNC(=O)Nc1ccccc1F Amb2413750 [0,2,0,0,0,0|2,0,0]=4 8961 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [0,2,0,0,0,0|1,0,1]=4 8962 B12R1.371 N[C@@H](CO)Cc1ccccc1F Amb25331070 [0,2,0,0,0,0|1,0,1]=4 8963 B12R1.371 N[C@H](CO)Cc1ccccc1Br Amb24424605 [0,2,0,0,0,0|1,0,1]=4 8964 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [0,2,0,0,0,0|1,0,1]=4 8965 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [0,2,0,0,0,0|1,0,1]=4 8966 B12R1.371 N\C(\CN1C=CC=CC1=O)=N/O Amb19226291 [0,2,0,0,0,0|2,0,0]=4 8967 B12R1.371 N\C(\CN1C=CC=CC1=O)=N\O Amb19514267 [0,2,0,0,0,0|2,0,0]=4 8968 B12R1.371 N\C(\Cc1[n]cccc1Br)=N\O Amb25356700 [0,2,0,0,0,0|2,0,0]=4 8969 B12R1.371 N\C(\Cc1ccccc1F)=N\N Amb18788566 [0,2,0,0,0,0|2,0,0]=4 8970 B12R1.371 Nc1[n]cccc1CC(=O)CN Amb25836617 [0,2,0,0,0,0|2,0,0]=4 8971 B12R1.371 Nc1[n]cccc1CC(=O)NN Amb24347801 [0,2,0,0,0,0|2,0,0]=4 8972 B12R1.371 Nc1[n]cccc1CC(O)C=O Amb24388693 [0,2,0,0,0,0|1,0,1]=4 8973 B12R1.371 Nc1cc[n]cc1CC(O)C=O Amb25115388 [0,2,0,0,0,0|1,0,1]=4 8974 B12R1.371 Nc1ccccc1CC(=O)NN Amb25072774 [0,2,0,0,0,0|1,0,0]=3 8975 B12R1.371 Nc1ccccc1CC(N)CO Amb25712145 [0,2,0,0,0,0|1,0,1]=4 8976 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [0,2,0,0,0,0|1,0,1]=4 8977 B12R1.371 Nc1ccccc1NC(=O)CN Amb18251735 [0,2,0,0,0,0|2,0,0]=4 8978 B12R1.371 Nc1ccccc1NC(=O)CN Amb25163855 [0,2,0,0,0,0|2,0,0]=4 8979 B12R1.371 O=C(CBr)Cc1ccccc1I Amb25352153 [0,2,0,0,0,0|1,0,0]=3 8980 B12R1.371 O=C(CBr)Nc1ccccc1Br Amb19980971 [0,2,0,0,0,0|2,0,0]=4 8981 B12R1.371 O=C(CBr)Nc1ccccc1I Amb24353297 [0,2,0,0,0,0|2,0,0]=4 8982 B12R1.371 O=C(CCl)Cc1ccccc1I Amb25253621 [0,2,0,0,0,0|1,0,0]=3 8983 B12R1.371 O=C(CCl)Nc1ccccc1S Amb25149933 [0,2,0,0,0,0|2,0,0]=4 8984 B12R1.371 O=C(CCl)Oc1ccccc1Cl Amb24121334 [0,2,0,0,0,0|2,0,0]=4 8985 B12R1.371 O=C(CCl)Oc1ccccc1F Amb23442007 [0,2,0,0,0,0|2,0,0]=4 8986 B12R1.371 O=C(CF)Cc1ccccc1Cl Amb23454831 [0,2,0,0,0,0|1,0,0]=3 8987 B12R1.371 O=C(CF)Nc1ccccc1Cl Amb24532736 [0,2,0,0,0,0|2,0,0]=4 8988 B12R1.371 O=C(Cc1ccccc1Cl)CBr Amb25312032 [0,2,0,0,0,0|1,0,0]=3 8989 B12R1.371 O=CC(Cc1ccccc1Br)Cl Amb17204707 [0,2,0,0,0,0|1,0,1]=4 8990 B12R1.371 O=CC(Cc1ccccc1C)Cl Amb17204326 [0,2,0,0,0,0|1,0,1]=4 8991 B12R1.371 O=CC(Cc1ccccc1Cl)Cl Amb17204401 [0,2,0,0,0,0|1,0,1]=4 8992 B12R1.371 O=CC(Cc1ccccc1F)Cl Amb17204341 [0,2,0,0,0,0|1,0,1]=4 8993 B12R1.371 O=CC(Cl)Cc1ccccc1I Amb25827697 [0,2,0,0,0,0|1,0,1]=4 8994 B12R1.371 O=CC(F)Cc1ccccc1Cl Amb25148636 [0,2,0,0,0,0|1,0,1]=4 8995 B12R1.371 O=CC(F)Cc1ccccc1F Amb24341410 [0,2,0,0,0,0|1,0,1]=4 8996 B12R1.371 O=C\C(=C\c1ccccc1C)\C Amb17334495 [0,2,0,0,0,0|1,0,1]=4 8997 B12R1.371 O=C\C(=C\c1ccccc1Cl)\C Amb17335454 [0,2,0,0,0,0|1,0,1]=4 8998 B12R1.371 O=C\C(=C\c1ccccc1F)\C Amb17334598 [0,2,0,0,0,0|1,0,1]=4 8999 B12R1.371 OC(Cc1[n]cccc1Br)C=O Amb25817354 [0,2,0,0,0,0|1,0,1]=4 9000 B12R1.371 OC(Cc1cc[n]cc1Cl)C=O Amb25789139 [0,2,0,0,0,0|1,0,1]=4 9001 B12R1.371 OC(Cc1ccccc1F)C=O Amb24554950 [0,2,0,0,0,0|0,0,1]=3 9002 B12R1.371 OC(Cc1ccccc1F)CCl Amb24355863 [0,2,0,0,0,0|1,0,1]=4 9003 B12R1.371 OCC(=O)Cc1ccccc1Cl Amb18564303 [0,2,0,0,0,0|0,0,0]=2 9004 B12R1.371 OCC(=O)Cc1ccccc1F Amb18805788 [0,2,0,0,0,0|0,0,0]=2 9005 B12R1.371 OCC(=O)Nc1cc[n]cc1Br Amb25048123 [0,2,0,0,0,0|2,0,0]=4 9006 B12R1.371 OCC(=O)Nc1ccccc1Br Amb1109988 [0,2,0,0,0,0|1,0,0]=3 9007 B12R1.371 OCC(=O)Nc1ccccc1C Amb1110662 [0,2,0,0,0,0|1,0,0]=3 9008 B12R1.371 OCC(=O)Nc1ccccc1Cl Amb1111147 [0,2,0,0,0,0|1,0,0]=3 9009 B12R1.371 OCC(=O)Nc1ccccc1F Amb1109775 [0,2,0,0,0,0|1,0,0]=3 9010 B12R1.371 OCC(=O)Nc1cccnc1Cl Amb1110552 [0,2,0,0,0,0|2,0,0]=4 9011 B12R1.371 OCC(=O)Oc1ccccc1Cl Amb25072212 [0,2,0,0,0,0|1,0,0]=3 9012 B12R1.371 OCC(=O)Oc1ccccc1F Amb25122488 [0,2,0,0,0,0|1,0,0]=3 9013 B12R1.371 OCC(=O)Oc1ccccc1I Amb25056604 [0,2,0,0,0,0|1,0,0]=3 9014 B12R1.371 OCC(Cc1ccccc1C)N Amb17062685 [0,2,0,0,0,0|1,0,1]=4 9015 B12R1.371 OCC(Cc1ccccc1Cl)N Amb17062694 [0,2,0,0,0,0|1,0,1]=4 9016 B12R1.371 OCC(Cc1ccccc1F)N Amb17062688 [0,2,0,0,0,0|1,0,1]=4 9017 B12R1.371 ON(Cc1ccccc1Cl)C=O Amb22469654 [0,2,0,0,0,0|1,0,0]=3 9018 B12R1.371 O\C(\C=O)=C/c1ccccc1F Amb24532563 [0,2,0,0,0,0|0,0,1]=3 9019 B12R1.371 O\C(\C=O)=C\c1ccccc1F Amb24621919 [0,2,0,0,0,0|0,0,1]=3 9020 B12R1.371 O\N=C(\Cc1ccccc1C)/N Amb1118586 [0,2,0,0,0,0|1,0,0]=3 9021 B12R1.371 O\N=C(\Cc1ccccc1Cl)/N Amb10205341 [0,2,0,0,0,0|1,0,0]=3 9022 B12R1.371 Oc1ccc[n]c1NC(=O)CO Amb24497858 [0,2,0,0,0,0|2,0,0]=4 9023 B12R1.371 Oc1ccccc1CC(=O)CCl Amb25376294 [0,2,0,0,0,0|1,0,0]=3 9024 B12R1.371 Oc1ccccc1CC(F)C=O Amb25148635 [0,2,0,0,0,0|1,0,1]=4 9025 B12R1.371 Oc1ccccc1CN(O)N=O Amb25287208 [0,2,0,0,0,0|1,0,0]=3 9026 B12R1.371 Oc1ccccc1NC(=O)CF Amb25835152 [0,2,0,0,0,0|2,0,0]=4 9027 B12R1.371 Oc1ccccc1NC(=O)CS Amb24724665 [0,2,0,0,0,0|1,1,0]=4 9028 B12R1.371 Oc1ccccc1OC(=O)NO Amb24631630 [0,2,0,0,0,0|1,0,0]=3 9029 B12R1.371 SCC(=O)Nc1ccccc1F Amb1210638 [0,2,0,0,0,0|1,1,0]=4 9030 B12R1.75 C#Cc1[n]cccc1CC(O)=O Amb25089290 [0,2,0,0,0,0|1,0,0]=3 9031 B12R1.75 C#Cc1ccc[n]c1CC(O)=O Amb25783196 [0,2,0,0,0,0|1,0,0]=3 9032 B12R1.75 C#Cc1ccccc1CC(N)=O Amb23399900 [0,2,0,0,0,0|1,0,0]=3 9033 B12R1.75 C#Cc1ccccc1CC(O)=O Amb25201062 [0,2,0,0,0,0|0,0,0]=2 9034 B12R1.75 C=Cc1c[n]ccc1CC(O)=O Amb25703899 [0,2,0,0,0,0|1,0,0]=3 9035 B12R1.75 C=Cc1ccc[n]c1CC(O)=O Amb25715270 [0,2,0,0,0,0|1,0,0]=3 9036 B12R1.75 C=Cc1cccc[n+]1CC(N)=O Amb25722860 [0,2,0,0,0,0|2,0,0]=4 9037 B12R1.75 C=Cc1ccccc1NC(N)=O Amb24726165 [0,2,0,0,0,0|2,0,0]=4 9038 B12R1.75 CC(=C)Cc1ccccc1C=O Amb24070179 [0,2,0,0,0,0|2,0,0]=4 9039 B12R1.75 CC(=C)Cc1ccccc1CC Amb21961879 [0,2,0,0,0,0|2,0,0]=4 9040 B12R1.75 CC(=C)Cc1ccccc1CO Amb24748495 [0,2,0,0,0,0|2,0,0]=4 9041 B12R1.75 CC(=O)Cc1[n]cccc1C#N Amb18645312 [0,2,0,0,0,0|2,0,0]=4 9042 B12R1.75 CC(=O)Cc1cc[n]cc1C#N Amb24669167 [0,2,0,0,0,0|2,0,0]=4 9043 B12R1.75 CC(=O)Cc1cc[n]cc1OC Amb24574281 [0,2,0,0,0,0|2,0,0]=4 9044 B12R1.75 CC(=O)Cc1ccc[n]c1NC Amb25034989 [0,2,0,0,0,0|2,0,0]=4 9045 B12R1.75 CC(=O)Cc1ccc[n]c1OC Amb25371751 [0,2,0,0,0,0|2,0,0]=4 9046 B12R1.75 CC(=O)Cc1ccccc1C=C Amb24691712 [0,2,0,0,0,0|1,0,0]=3 9047 B12R1.75 CC(=O)Cc1ccccc1C=O Amb18645650 [0,2,0,0,0,0|1,0,0]=3 9048 B12R1.75 CC(=O)Cc1ccccc1CN Amb18908621 [0,2,0,0,0,0|1,0,0]=3 9049 B12R1.75 CC(=O)Cc1ccccc1CO Amb24736343 [0,2,0,0,0,0|1,0,0]=3 9050 B12R1.75 CC(=O)Nc1ccccc1C#C Amb25783787 [0,2,0,0,0,0|2,0,0]=4 9051 B12R1.75 CC(=O)Nc1ccccc1CCl Amb24635762 [0,2,0,0,0,0|2,0,0]=4 9052 B12R1.75 CC(=O)Nc1ccccc1CN Amb19341300 [0,2,0,0,0,0|2,0,0]=4 9053 B12R1.75 CC(=O)Nc1ccccc1N=O Amb24446438 [0,2,0,0,0,0|2,0,0]=4 9054 B12R1.75 CC(=O)Nc1ccccc1NN Amb24586260 [0,2,0,0,0,0|2,0,0]=4 9055 B12R1.75 CC(=O)Nc1ccccc1NO Amb25678573 [0,2,0,0,0,0|2,0,0]=4 9056 B12R1.75 CC(=O)Oc1ccccc1C#C Amb23412358 [0,2,0,0,0,0|2,0,0]=4 9057 B12R1.75 CC(=O)Oc1ccccc1C=C Amb18798087 [0,2,0,0,0,0|2,0,0]=4 9058 B12R1.75 CC(=O)Oc1ccccc1CBr Amb22737638 [0,2,0,0,0,0|2,0,0]=4 9059 B12R1.75 CC(=O)Oc1ccccc1CC Amb22230209 [0,2,0,0,0,0|2,0,0]=4 9060 B12R1.75 CC(=O)Oc1ccccc1CN Amb22284286 [0,2,0,0,0,0|2,0,0]=4 9061 B12R1.75 CC(=O)Oc1ccccc1CO Amb24077558 [0,2,0,0,0,0|2,0,0]=4 9062 B12R1.75 CC(=O)Sc1ccccc1SC Amb24571197 [0,2,0,0,0,0|2,0,0]=4 9063 B12R1.75 CC(O)Cc1ccccc1C#N Amb24474257 [0,2,0,0,0,0|1,0,1]=4 9064 B12R1.75 CCc1[n]cccc1CC(O)=O Amb24609693 [0,2,0,0,0,0|1,0,0]=3 9065 B12R1.75 CCc1c[n]ccc1CC(O)=O Amb18828382 [0,2,0,0,0,0|1,0,0]=3 9066 B12R1.75 CCc1ccccc1CC(=C)Br Amb22000372 [0,2,0,0,0,0|2,0,0]=4 9067 B12R1.75 CCc1ccccc1CC(=C)Cl Amb22000367 [0,2,0,0,0,0|2,0,0]=4 9068 B12R1.75 CCc1ccccc1CC(=O)O Amb10844300 [0,2,0,0,0,0|0,0,0]=2 9069 B12R1.75 CCc1ccccc1NC(=O)N Amb1128108 [0,2,0,0,0,0|2,0,0]=4 9070 B12R1.75 CCc1ccccc1OC(N)=O Amb25101550 [0,2,0,0,0,0|2,0,0]=4 9071 B12R1.75 CNc1ccccc1CC(N)=O Amb18303203 [0,2,0,0,0,0|1,0,0]=3 9072 B12R1.75 CNc1ccccc1NC(N)=O Amb25771826 [0,2,0,0,0,0|2,0,0]=4 9073 B12R1.75 COc1[n]cc[n]c1CC(O)=O Amb18826735 [0,2,0,0,0,0|2,0,0]=4 9074 B12R1.75 COc1cc[n]cc1CC(O)=O Amb24468546 [0,2,0,0,0,0|1,0,0]=3 9075 B12R1.75 COc1ccc[n]c1CC(O)=O Amb20247607 [0,2,0,0,0,0|1,0,0]=3 9076 B12R1.75 COc1ccccc1CC(=O)N Amb1829532 [0,2,0,0,0,0|1,0,0]=3 9077 B12R1.75 COc1ccccc1CC(=O)O Amb2209376 [0,2,0,0,0,0|0,0,0]=2 9078 B12R1.75 COc1ccccc1CC(=S)N Amb17233848 [0,2,0,0,0,0|1,1,0]=4 9079 B12R1.75 COc1ccccc1CP(O)=O Amb25850733 [0,2,0,0,0,0|1,0,0]=3 9080 B12R1.75 COc1ccccc1C[C@@H](O)C Amb13952973 [0,2,0,0,0,0|1,0,1]=4 9081 B12R1.75 COc1ccccc1C[C@H](O)C Amb13952974 [0,2,0,0,0,0|1,0,1]=4 9082 B12R1.75 COc1ccccc1C[N+]([O-])=O Amb23589321 [0,2,0,0,0,0|1,0,1]=4 9083 B12R1.75 COc1ccccc1NC(=O)Cl Amb25040346 [0,2,0,0,0,0|2,0,0]=4 9084 B12R1.75 COc1ccccc1NC(=O)N Amb1195897 [0,2,0,0,0,0|2,0,0]=4 9085 B12R1.75 COc1ccccc1NS(O)=O Amb24100486 [0,2,0,0,0,0|2,0,0]=4 9086 B12R1.75 COc1ccccc1OC(=O)Cl Amb21618687 [0,2,0,0,0,0|2,0,0]=4 9087 B12R1.75 COc1ccccc1OC(=O)N Amb2099602 [0,2,0,0,0,0|2,0,0]=4 9088 B12R1.75 CS(=O)Cc1ccccc1CN Amb18909345 [0,2,0,0,0,0|2,0,0]=4 9089 B12R1.75 CS(=O)Cc1ccccc1CO Amb25157918 [0,2,0,0,0,0|2,0,0]=4 9090 B12R1.75 CS(=O)Cc1ccccc1NC Amb25057568 [0,2,0,0,0,0|2,0,0]=4 9091 B12R1.75 CSc1ccccc1CC(=O)O Amb17106781 [0,2,0,0,0,0|0,0,0]=2 9092 B12R1.75 CSc1ccccc1NC(=O)N Amb1218379 [0,2,0,0,0,0|2,0,0]=4 9093 B12R1.75 N#Cc1[n]cccc1CC(O)=O Amb24406625 [0,2,0,0,0,0|1,0,0]=3 9094 B12R1.75 N#Cc1ccc[n]c1CC(O)=O Amb25777212 [0,2,0,0,0,0|1,0,0]=3 9095 B12R1.75 NC(=O)Cc1ccc[n]c1C#N Amb25232615 [0,2,0,0,0,0|2,0,0]=4 9096 B12R1.75 NC(=O)Cc1ccc[n]c1CO Amb24635766 [0,2,0,0,0,0|2,0,0]=4 9097 B12R1.75 NC(=O)Cc1ccccc1C#N Amb23412355 [0,2,0,0,0,0|1,0,0]=3 9098 B12R1.75 NC(=O)Cc1ccccc1CN Amb24673076 [0,2,0,0,0,0|1,0,0]=3 9099 B12R1.75 NC(=O)Nc1ccccc1CO Amb18792741 [0,2,0,0,0,0|2,0,0]=4 9100 B12R1.75 NC(=O)Oc1ccccc1CCl Amb24740728 [0,2,0,0,0,0|2,0,0]=4 9101 B12R1.75 NC(=S)Cc1ccccc1C#N Amb25198327 [0,2,0,0,0,0|1,1,0]=4 9102 B12R1.75 NCC1C=CC=CN1CC(O)=O Amb24710352 [0,2,0,0,0,0|1,0,1]=4 9103 B12R1.75 NCc1ccccc1CC(=O)Cl Amb24079850 [0,2,0,0,0,0|1,0,0]=3 9104 B12R1.75 NCc1ccccc1NC(=O)C Amb1112133 [0,2,0,0,0,0|2,0,0]=4 9105 B12R1.75 NCc1ccccc1NC(=O)N Amb1109841 [0,2,0,0,0,0|2,0,0]=4 9106 B12R1.75 NCc1ccccc1OC(=O)C Amb10669545 [0,2,0,0,0,0|2,0,0]=4 9107 B12R1.75 NNc1ccccc1CC(O)=O Amb18646504 [0,2,0,0,0,0|0,0,0]=2 9108 B12R1.75 O=C(Cl)Oc1ccccc1C=O Amb24375240 [0,2,0,0,0,0|2,0,0]=4 9109 B12R1.75 O=C(Cl)Oc1ccccc1CCl Amb25731852 [0,2,0,0,0,0|2,0,0]=4 9110 B12R1.75 OC(=O)CC/1=CC=CC\C1=N\O Amb24365975 [0,2,0,0,0,0|0,0,1]=3 9111 B12R1.75 OC(=O)Cc1ccccc1C=O Amb18645971 [0,2,0,0,0,0|0,0,0]=2 9112 B12R1.75 OC(=O)Cc1ccccc1CBr Amb18134778 [0,2,0,0,0,0|0,0,0]=2 9113 B12R1.75 OC(=O)Cc1ccccc1CO Amb18646479 [0,2,0,0,0,0|0,0,0]=2 9114 B12R1.75 OC(=O)Cc1ccccc1SS Amb24682800 [0,2,0,0,0,0|0,0,0]=2 9115 B12R1.75 OCc1ccccc1NC(=O)C Amb13952729 [0,2,0,0,0,0|2,0,0]=4 9116 B12R1.75 [C-]#[N+]c1ccccc1CC(O)=O Amb25801967 [0,2,0,0,0,0|0,0,0]=2 9117 B12R1.127 C=C(Cl)Cc1cc(Cl)ccc1O Amb24653393 [0,2,0,0,0,0|2,0,0]=4 9118 B12R1.127 CC(=C)CC1=CC(=O)C=CC1=O Amb24408448 [0,2,0,0,0,0|2,0,0]=4 9119 B12R1.127 CC(=C)Cc1cc(Br)ccc1O Amb25260697 [0,2,0,0,0,0|2,0,0]=4 9120 B12R1.127 CC(=C)Cc1cc(F)ccc1O Amb19887331 [0,2,0,0,0,0|2,0,0]=4 9121 B12R1.127 CC(=C)Cc1cc(O)ccc1O Amb25674254 [0,2,0,0,0,0|2,0,0]=4 9122 B12R1.127 CC(=O)CN1C=C(Br)C=CC1=O Amb25337233 [0,2,0,0,0,0|2,0,0]=4 9123 B12R1.127 CC(=O)CN1C=C(C)C=CC1=O Amb18378270 [0,2,0,0,0,0|2,0,0]=4 9124 B12R1.127 CC(=O)CN1C=C(Cl)C=CC1=O Amb18405102 [0,2,0,0,0,0|2,0,0]=4 9125 B12R1.127 CC(=O)CN1C=C(F)C=CC1=O Amb18405245 [0,2,0,0,0,0|2,0,0]=4 9126 B12R1.127 CC(=O)Cc1cc(Br)ccc1Cl Amb25048409 [0,2,0,0,0,0|1,0,0]=3 9127 B12R1.127 CC(=O)Cc1cc(Br)ccc1I Amb25223591 [0,2,0,0,0,0|1,0,0]=3 9128 B12R1.127 CC(=O)Cc1cc(Cl)ccc1F Amb18893741 [0,2,0,0,0,0|1,0,0]=3 9129 B12R1.127 CC(=O)Cc1cc(Cl)ccc1O Amb18649017 [0,2,0,0,0,0|1,0,0]=3 9130 B12R1.127 CC(=O)Cc1cc(F)[n]cc1F Amb25212622 [0,2,0,0,0,0|2,0,0]=4 9131 B12R1.127 CC(=O)Cc1cc(F)ccc1Br Amb19373906 [0,2,0,0,0,0|1,0,0]=3 9132 B12R1.127 CC(=O)Cc1cc(F)ccc1Cl Amb24562849 [0,2,0,0,0,0|1,0,0]=3 9133 B12R1.127 CC(=O)Cc1cc(F)ccc1F Amb18183584 [0,2,0,0,0,0|1,0,0]=3 9134 B12R1.127 CC(=O)Cc1cc(F)ccc1N Amb24628133 [0,2,0,0,0,0|1,0,0]=3 9135 B12R1.127 CC(=O)Cc1cc(I)ccc1O Amb24351050 [0,2,0,0,0,0|1,0,0]=3 9136 B12R1.127 CC(=O)Cc1cc(N)ccc1Cl Amb24743857 [0,2,0,0,0,0|1,0,0]=3 9137 B12R1.127 CC(=O)Cc1cc(N)ccc1O Amb24664568 [0,2,0,0,0,0|1,0,0]=3 9138 B12R1.127 CC(=O)Cc1cc(N)ccc1S Amb24637295 [0,2,0,0,0,0|1,0,0]=3 9139 B12R1.127 CC(=O)Cc1cc(O)ccc1Br Amb25223777 [0,2,0,0,0,0|1,0,0]=3 9140 B12R1.127 CC(=O)Cc1cc(O)ccc1I Amb25338413 [0,2,0,0,0,0|1,0,0]=3 9141 B12R1.127 CC(=O)Cc1cc(O)ccc1N Amb24537047 [0,2,0,0,0,0|1,0,0]=3 9142 B12R1.127 CC(=O)Cc1cc(S)ccc1S Amb25268556 [0,2,0,0,0,0|1,0,0]=3 9143 B12R1.127 CC(=O)NC1=CC(=O)C=CC1=O Amb22361114 [0,2,0,0,0,0|2,0,0]=4 9144 B12R1.127 CC(=O)Nc1cc(Br)ccc1Br Amb22757120 [0,2,0,0,0,0|2,0,0]=4 9145 B12R1.127 CC(=O)Nc1cc(Br)ccc1F Amb19959125 [0,2,0,0,0,0|2,0,0]=4 9146 B12R1.127 CC(=O)Nc1cc(Br)ccc1I Amb12013768 [0,2,0,0,0,0|2,0,0]=4 9147 B12R1.127 CC(=O)Nc1cc(Br)ccc1N Amb18659994 [0,2,0,0,0,0|2,0,0]=4 9148 B12R1.127 CC(=O)Nc1cc(C)ccc1Br Amb2246707 [0,2,0,0,0,0|2,0,0]=4 9149 B12R1.127 CC(=O)Nc1cc(C)ccc1C Amb2435550 [0,2,0,0,0,0|2,0,0]=4 9150 B12R1.127 CC(=O)Nc1cc(C)ccc1F Amb2444098 [0,2,0,0,0,0|2,0,0]=4 9151 B12R1.127 CC(=O)Nc1cc(Cl)ccc1Br Amb21856607 [0,2,0,0,0,0|2,0,0]=4 9152 B12R1.127 CC(=O)Nc1cc(Cl)ccc1F Amb24105642 [0,2,0,0,0,0|2,0,0]=4 9153 B12R1.127 CC(=O)Nc1cc(Cl)ccc1N Amb1117685 [0,2,0,0,0,0|2,0,0]=4 9154 B12R1.127 CC(=O)Nc1cc(F)ccc1Br Amb25841594 [0,2,0,0,0,0|2,0,0]=4 9155 B12R1.127 CC(=O)Nc1cc(F)ccc1Cl Amb25224390 [0,2,0,0,0,0|2,0,0]=4 9156 B12R1.127 CC(=O)Nc1cc(F)ccc1N Amb25829055 [0,2,0,0,0,0|2,0,0]=4 9157 B12R1.127 CC(=O)Nc1cc(I)ccc1Br Amb24425920 [0,2,0,0,0,0|2,0,0]=4 9158 B12R1.127 CC(=O)Nc1cc(I)ccc1O Amb25822886 [0,2,0,0,0,0|2,0,0]=4 9159 B12R1.127 CC(=O)Nc1cc(N)ccc1F Amb1120031 [0,2,0,0,0,0|2,0,0]=4 9160 B12R1.127 CC(=O)Nc1cc(N)ccc1F Amb13949175 [0,2,0,0,0,0|2,0,0]=4 9161 B12R1.127 CC(=O)Nc1cc(N)ccc1N Amb25697126 [0,2,0,0,0,0|2,0,0]=4 9162 B12R1.127 CC(=O)Nc1cc(N)ccc1O Amb10975426 [0,2,0,0,0,0|2,0,0]=4 9163 B12R1.127 CC(=O)Nc1cc(O)ccc1C Amb22750083 [0,2,0,0,0,0|2,0,0]=4 9164 B12R1.127 CC(=O)Nc1cc(O)ccc1Cl Amb24096488 [0,2,0,0,0,0|2,0,0]=4 9165 B12R1.127 CC(=O)Nc1cc(O)ccc1O Amb18646682 [0,2,0,0,0,0|2,0,0]=4 9166 B12R1.127 CC(=O)Oc1cc(Br)ccc1Cl Amb10071364 [0,2,0,0,0,0|2,0,0]=4 9167 B12R1.127 CC(=O)Oc1cc(C)ccc1O Amb25807511 [0,2,0,0,0,0|2,0,0]=4 9168 B12R1.127 CC(=O)Oc1cc(Cl)ccc1Cl Amb24604981 [0,2,0,0,0,0|2,0,0]=4 9169 B12R1.127 CC(=O)Oc1cc(N)ccc1Br Amb24525581 [0,2,0,0,0,0|2,0,0]=4 9170 B12R1.127 CC(=O)Oc1cc(N)ccc1Cl Amb18649202 [0,2,0,0,0,0|2,0,0]=4 9171 B12R1.127 CC(=O)Oc1cc(O)ccc1Cl Amb24497312 [0,2,0,0,0,0|2,0,0]=4 9172 B12R1.127 CC(=O)Sc1cc(O)ccc1O Amb25128221 [0,2,0,0,0,0|2,0,0]=4 9173 B12R1.127 CC(O)CC1=CC(=O)C=CC1=O Amb25713045 [0,2,0,0,0,0|1,0,1]=4 9174 B12R1.127 CC(O)Cc1cc(Br)ccc1F Amb25054364 [0,2,0,0,0,0|1,0,1]=4 9175 B12R1.127 CC(O)Cc1cc(Cl)ccc1Br Amb24456478 [0,2,0,0,0,0|1,0,1]=4 9176 B12R1.127 CC(O)Cc1cc(F)ccc1Br Amb20623764 [0,2,0,0,0,0|1,0,1]=4 9177 B12R1.127 CC(O)Cc1cc(F)ccc1Cl Amb25731169 [0,2,0,0,0,0|1,0,1]=4 9178 B12R1.127 CC(O)Cc1cc(F)ccc1F Amb18802842 [0,2,0,0,0,0|1,0,1]=4 9179 B12R1.127 CC(O)Cc1cc(F)ccc1O Amb25347598 [0,2,0,0,0,0|1,0,1]=4 9180 B12R1.127 CC(O)Cc1cc(O)ccc1Cl Amb25768522 [0,2,0,0,0,0|1,0,1]=4 9181 B12R1.127 CC=1C=CC(=N)N(CC(O)=O)N1 Amb25708486 [0,2,0,0,0,0|2,0,0]=4 9182 B12R1.127 CC=1C=CC(=O)N(CC(N)=O)C1 Amb19127540 [0,2,0,0,0,0|2,0,0]=4 9183 B12R1.127 CC=1C=CC(=O)N(CC(O)=O)C1 Amb18031842 [0,2,0,0,0,0|1,0,0]=3 9184 B12R1.127 CC=1C=CC(=O)N(CC(O)=O)N1 Amb18015245 [0,2,0,0,0,0|2,0,0]=4 9185 B12R1.127 CC=1C=CC(=O)NC1CC(O)=O Amb25159755 [0,2,0,0,0,0|1,0,0]=3 9186 B12R1.127 CC=1C=CC(=[NH2+])N(CC(C)=O)C1 Amb20661239 [0,2,0,0,0,0|2,0,0]=4 9187 B12R1.127 CC=1C=NC(=O)N(CC(O)=O)C1 Amb25343069 [0,2,0,0,0,0|2,0,0]=4 9188 B12R1.127 CS(=O)Cc1cc(F)ccc1N Amb18282180 [0,2,0,0,0,0|2,0,0]=4 9189 B12R1.127 CS(=O)Cc1cc(N)ccc1Cl Amb18952484 [0,2,0,0,0,0|2,0,0]=4 9190 B12R1.127 C[C@@H](O)Cc1cc(F)ccc1Br Amb24684950 [0,2,0,0,0,0|1,0,1]=4 9191 B12R1.127 C[C@@H](O)Cc1cc(F)ccc1Cl Amb25056681 [0,2,0,0,0,0|1,0,1]=4 9192 B12R1.127 C[C@@H](O)Cc1cc(F)ccc1F Amb25854314 [0,2,0,0,0,0|1,0,1]=4 9193 B12R1.127 C[C@H](O)Cc1cc(F)ccc1O Amb25735123 [0,2,0,0,0,0|1,0,1]=4 9194 B12R1.127 Cc1[n]c(CC(O)=O)c(C)c[n]1 Amb18827799 [0,2,0,0,0,0|2,0,0]=4 9195 B12R1.127 Cc1[n]cc(Br)cc1CC(O)=O Amb24541036 [0,2,0,0,0,0|1,0,0]=3 9196 B12R1.127 Cc1[n]cc(N)cc1CC(O)=O Amb24727709 [0,2,0,0,0,0|1,0,0]=3 9197 B12R1.127 Cc1[n]cc(O)cc1CC(O)=O Amb25239088 [0,2,0,0,0,0|1,0,0]=3 9198 B12R1.127 Cc1c[n]c(F)cc1CC(O)=O Amb24390800 [0,2,0,0,0,0|1,0,0]=3 9199 B12R1.127 Cc1c[n]c(N)[n]c1CC(O)=O Amb18827246 [0,2,0,0,0,0|2,0,0]=4 9200 B12R1.127 Cc1c[n]c(O)[n]c1CC(O)=O Amb18826726 [0,2,0,0,0,0|2,0,0]=4 9201 B12R1.127 Cc1c[n]c(O)cc1CC(O)=O Amb25060186 [0,2,0,0,0,0|1,0,0]=3 9202 B12R1.127 Cc1cc(CC(=C)Br)c(O)cc1 Amb25771134 [0,2,0,0,0,0|2,0,0]=4 9203 B12R1.127 Cc1cc(CC(=C)Cl)c(O)cc1 Amb25768443 [0,2,0,0,0,0|2,0,0]=4 9204 B12R1.127 Cc1cc(CC(=O)Cl)c(C)cc1 Amb19074255 [0,2,0,0,0,0|1,0,0]=3 9205 B12R1.127 Cc1cc(CC(=O)Cl)c(F)cc1 Amb25283219 [0,2,0,0,0,0|1,0,0]=3 9206 B12R1.127 Cc1cc(CC(=O)O)c(cc1)Cl Amb2235268 [0,2,0,0,0,0|0,0,0]=2 9207 B12R1.127 Cc1cc(CC(=O)O)c(cc1)F Amb10606908 [0,2,0,0,0,0|0,0,0]=2 9208 B12R1.127 Cc1cc(CC(=O)O)c(cc1)O Amb13884848 [0,2,0,0,0,0|0,0,0]=2 9209 B12R1.127 Cc1cc(CC(C)O)c(C)cc1 Amb18792586 [0,2,0,0,0,0|1,0,1]=4 9210 B12R1.127 Cc1cc(CC(N)=O)c(Br)cc1 Amb24070094 [0,2,0,0,0,0|1,0,0]=3 9211 B12R1.127 Cc1cc(CC(O)=O)c(C)[n][n]1 Amb25174635 [0,2,0,0,0,0|2,0,0]=4 9212 B12R1.127 Cc1cc(CC(O)=O)c(I)cc1 Amb25150062 [0,2,0,0,0,0|0,0,0]=2 9213 B12R1.127 Cc1cc(CC(O)=O)c(N)cc1 Amb22913627 [0,2,0,0,0,0|0,0,0]=2 9214 B12R1.127 Cc1cc(CC(O)=O)c(O)c[n]1 Amb24638283 [0,2,0,0,0,0|1,0,0]=3 9215 B12R1.127 Cc1cc(NC(N)=O)c(Br)cc1 Amb25703936 [0,2,0,0,0,0|2,0,0]=4 9216 B12R1.127 Cc1cc(NC(N)=O)c(O)cc1 Amb24408161 [0,2,0,0,0,0|2,0,0]=4 9217 B12R1.127 Cc1cc(OC(=O)Cl)c(C)cc1 Amb25728315 [0,2,0,0,0,0|2,0,0]=4 9218 B12R1.127 Cc1cc(OC(=O)Cl)c(F)cc1 Amb24410383 [0,2,0,0,0,0|2,0,0]=4 9219 B12R1.127 Cc1ccc(Br)[n]c1CC(O)=O Amb25312297 [0,2,0,0,0,0|1,0,0]=3 9220 B12R1.127 Cc1ccc(Br)c(CC(O)=O)[n]1 Amb24375682 [0,2,0,0,0,0|1,0,0]=3 9221 B12R1.127 Cc1ccc(Br)cc1CC(C)=O Amb18159517 [0,2,0,0,0,0|1,0,0]=3 9222 B12R1.127 Cc1ccc(Br)cc1CC(C)O Amb25291053 [0,2,0,0,0,0|1,0,1]=4 9223 B12R1.127 Cc1ccc(Br)cc1OC(=O)Cl Amb24702765 [0,2,0,0,0,0|2,0,0]=4 9224 B12R1.127 Cc1ccc(C)[n]c1CC(C)=O Amb24652868 [0,2,0,0,0,0|2,0,0]=4 9225 B12R1.127 Cc1ccc(Cl)c(c1)OC(=O)Cl Amb25039103 [0,2,0,0,0,0|2,0,0]=4 9226 B12R1.127 Cc1ccc(Cl)c(c1)OC(C)=O Amb25065935 [0,2,0,0,0,0|2,0,0]=4 9227 B12R1.127 Cc1ccc(Cl)cc1CC(=C)Br Amb24536632 [0,2,0,0,0,0|2,0,0]=4 9228 B12R1.127 Cc1ccc(Cl)cc1CC(C)O Amb24748277 [0,2,0,0,0,0|1,0,1]=4 9229 B12R1.127 Cc1ccc(Cl)cc1OC(=O)Cl Amb24360772 [0,2,0,0,0,0|2,0,0]=4 9230 B12R1.127 Cc1ccc(Cl)cc1OC(C)=O Amb25333281 [0,2,0,0,0,0|2,0,0]=4 9231 B12R1.127 Cc1ccc(F)[n]c1CC(O)=O Amb25196038 [0,2,0,0,0,0|1,0,0]=3 9232 B12R1.127 Cc1ccc(F)c(CC(O)=O)[n]1 Amb24697652 [0,2,0,0,0,0|1,0,0]=3 9233 B12R1.127 Cc1ccc(F)c(c1)OC(C)=O Amb25206512 [0,2,0,0,0,0|2,0,0]=4 9234 B12R1.127 Cc1ccc(F)cc1CB(O)O Amb25068733 [0,2,0,0,0,0|1,0,1]=4 9235 B12R1.127 Cc1ccc(F)cc1CC(=O)Cl Amb24549559 [0,2,0,0,0,0|1,0,0]=3 9236 B12R1.127 Cc1ccc(F)cc1CC(C)O Amb25376746 [0,2,0,0,0,0|1,0,1]=4 9237 B12R1.127 Cc1ccc(F)cc1SC(C)=O Amb24415329 [0,2,0,0,0,0|2,0,0]=4 9238 B12R1.127 Cc1ccc(I)cc1CC(O)=O Amb25148837 [0,2,0,0,0,0|0,0,0]=2 9239 B12R1.127 Cc1ccc(I)cc1OC(C)=O Amb25107464 [0,2,0,0,0,0|2,0,0]=4 9240 B12R1.127 Cc1ccc(N)[n]c1CC(O)=O Amb25268525 [0,2,0,0,0,0|1,0,0]=3 9241 B12R1.127 Cc1ccc(N)c(CC(C)=C)c1 Amb24358625 [0,2,0,0,0,0|2,0,0]=4 9242 B12R1.127 Cc1ccc(N)c(CC(N)=O)c1 Amb22913641 [0,2,0,0,0,0|1,0,0]=3 9243 B12R1.127 Cc1ccc(N)c(CC(O)=O)[n]1 Amb24433811 [0,2,0,0,0,0|1,0,0]=3 9244 B12R1.127 Cc1ccc(N)cc1OC(N)=O Amb25137912 [0,2,0,0,0,0|2,0,0]=4 9245 B12R1.127 Cc1ccc(O)c(CC(C)=C)c1 Amb24691766 [0,2,0,0,0,0|2,0,0]=4 9246 B12R1.127 Cc1ccc(O)c(CC(O)=O)[n]1 Amb18646676 [0,2,0,0,0,0|1,0,0]=3 9247 B12R1.127 Cc1ccc(O)cc1CC(O)=O Amb25320728 [0,2,0,0,0,0|0,0,0]=2 9248 B12R1.127 Cc1ccc(cc1CC(=O)Cl)Br Amb16230801 [0,2,0,0,0,0|1,0,0]=3 9249 B12R1.127 Cc1ccc(cc1CC(=O)O)Br Amb16230556 [0,2,0,0,0,0|0,0,0]=2 9250 B12R1.127 Cc1ccc(cc1CC(=O)O)C Amb2234758 [0,2,0,0,0,0|0,0,0]=2 9251 B12R1.127 Cc1ccc(cc1CC(=O)O)Cl Amb17470671 [0,2,0,0,0,0|0,0,0]=2 9252 B12R1.127 Cc1ccc(cc1CC(=S)N)C Amb17233642 [0,2,0,0,0,0|1,1,0]=4 9253 B12R1.127 Cc1ccc(cc1NC(=O)C)Cl Amb1205554 [0,2,0,0,0,0|2,0,0]=4 9254 B12R1.127 Cc1ccc(cc1NC(=O)C)N Amb1112396 [0,2,0,0,0,0|2,0,0]=4 9255 B12R1.127 Cc1ccc(cc1NC(=O)N)C Amb1141219 [0,2,0,0,0,0|2,0,0]=4 9256 B12R1.127 Cc1ccc(cc1NC(=O)N)F Amb1138933 [0,2,0,0,0,0|2,0,0]=4 9257 B12R1.127 Cc1ccc(cc1OC(=O)N)C Amb10575591 [0,2,0,0,0,0|2,0,0]=4 9258 B12R1.127 ClC(=O)Cc1cc(Cl)ccc1Cl Amb10071976 [0,2,0,0,0,0|1,0,0]=3 9259 B12R1.127 N=C1C=CC(Cl)=NN1CC(O)=O Amb22489547 [0,2,0,0,0,0|2,0,0]=4 9260 B12R1.127 NC(=N)Cc1cc(Cl)ccc1F Amb24485500 [0,2,0,0,0,0|2,0,0]=4 9261 B12R1.127 NC(=N)Cc1cc(F)ccc1Cl Amb25034754 [0,2,0,0,0,0|2,0,0]=4 9262 B12R1.127 NC(=O)CN1C=C(Br)C=CC1=O Amb22067852 [0,2,0,0,0,0|2,0,0]=4 9263 B12R1.127 NC(=O)CN1C=C(Cl)C=CC1=O Amb18404968 [0,2,0,0,0,0|2,0,0]=4 9264 B12R1.127 NC(=O)CN1C=C(F)C=CC1=O Amb18405164 [0,2,0,0,0,0|2,0,0]=4 9265 B12R1.127 NC(=O)CN1C=C(N)C=CC1=O Amb18030031 [0,2,0,0,0,0|2,0,0]=4 9266 B12R1.127 NC(=O)Cc1cc(Br)c[n]c1Cl Amb25300722 [0,2,0,0,0,0|2,0,0]=4 9267 B12R1.127 NC(=O)Cc1cc(Br)ccc1F Amb24406455 [0,2,0,0,0,0|1,0,0]=3 9268 B12R1.127 NC(=O)Cc1cc(Br)ccc1I Amb25848558 [0,2,0,0,0,0|1,0,0]=3 9269 B12R1.127 NC(=O)Cc1cc(Cl)ccc1Cl Amb25840429 [0,2,0,0,0,0|1,0,0]=3 9270 B12R1.127 NC(=O)Cc1cc(Cl)ccc1F Amb18243882 [0,2,0,0,0,0|1,0,0]=3 9271 B12R1.127 NC(=O)Cc1cc(Cl)ccc1O Amb25123282 [0,2,0,0,0,0|1,0,0]=3 9272 B12R1.127 NC(=O)Cc1cc(F)[n]cc1F Amb25829972 [0,2,0,0,0,0|2,0,0]=4 9273 B12R1.127 NC(=O)Cc1cc(F)ccc1F Amb18893587 [0,2,0,0,0,0|1,0,0]=3 9274 B12R1.127 NC(=O)Cc1cc(O)ccc1O Amb18646678 [0,2,0,0,0,0|1,0,0]=3 9275 B12R1.127 NC(=O)Nc1cc(Br)ccc1Cl Amb24724473 [0,2,0,0,0,0|2,0,0]=4 9276 B12R1.127 NC(=O)Nc1cc(Cl)ccc1Br Amb25332848 [0,2,0,0,0,0|2,0,0]=4 9277 B12R1.127 NC(=O)Nc1cc(Cl)ccc1O Amb25809394 [0,2,0,0,0,0|2,0,0]=4 9278 B12R1.127 NC(=O)Nc1cc(F)ccc1Br Amb24088521 [0,2,0,0,0,0|2,0,0]=4 9279 B12R1.127 NC(=O)Nc1cc(N)ccc1C Amb1112470 [0,2,0,0,0,0|2,0,0]=4 9280 B12R1.127 NC(=O)Nc1cc(N)ccc1F Amb1115345 [0,2,0,0,0,0|2,0,0]=4 9281 B12R1.127 NC(=O)Nc1cc(O)ccc1N Amb24671591 [0,2,0,0,0,0|2,0,0]=4 9282 B12R1.127 NC(=S)Cc1cc(Cl)ccc1Cl Amb24532605 [0,2,0,0,0,0|1,1,0]=4 9283 B12R1.127 NC(=S)Cc1cc(Cl)ccc1F Amb24554824 [0,2,0,0,0,0|1,1,0]=4 9284 B12R1.127 NC(=S)Cc1cc(F)ccc1Cl Amb24391984 [0,2,0,0,0,0|1,1,0]=4 9285 B12R1.127 NC(=S)Cc1cc(F)ccc1F Amb19070724 [0,2,0,0,0,0|1,1,0]=4 9286 B12R1.127 NC=1C=CC(=O)N(CC(O)=O)C1 Amb18030049 [0,2,0,0,0,0|1,0,0]=3 9287 B12R1.127 Nc1[n]cc(F)cc1CC(O)=O Amb25300777 [0,2,0,0,0,0|1,0,0]=3 9288 B12R1.127 Nc1c[n]c(Br)cc1CC(O)=O Amb25691065 [0,2,0,0,0,0|1,0,0]=3 9289 B12R1.127 Nc1c[n]c(F)cc1CC(O)=O Amb25376135 [0,2,0,0,0,0|1,0,0]=3 9290 B12R1.127 Nc1cc(CC(=O)S)c(Cl)cc1 Amb24600026 [0,2,0,0,0,0|0,1,0]=3 9291 B12R1.127 Nc1cc(CC(O)=O)c(Br)c[n]1 Amb24668005 [0,2,0,0,0,0|1,0,0]=3 9292 B12R1.127 Nc1cc(CC(O)=O)c(Cl)c[n]1 Amb25208160 [0,2,0,0,0,0|1,0,0]=3 9293 B12R1.127 Nc1cc(CC(O)=O)c(Cl)cc1 Amb24406588 [0,2,0,0,0,0|0,0,0]=2 9294 B12R1.127 Nc1cc(CC(O)=O)c(N)cc1 Amb24547123 [0,2,0,0,0,0|0,0,0]=2 9295 B12R1.127 Nc1ccc(Br)[n]c1CC(O)=O Amb25802851 [0,2,0,0,0,0|1,0,0]=3 9296 B12R1.127 Nc1ccc(Br)c(CC(O)=O)[n]1 Amb25096466 [0,2,0,0,0,0|1,0,0]=3 9297 B12R1.127 Nc1ccc(Br)c(c1)OC(N)=O Amb25086977 [0,2,0,0,0,0|2,0,0]=4 9298 B12R1.127 Nc1ccc(Cl)c(CC(O)=O)[n]1 Amb25039145 [0,2,0,0,0,0|1,0,0]=3 9299 B12R1.127 Nc1ccc(Cl)cc1CC(O)=O Amb24665725 [0,2,0,0,0,0|0,0,0]=2 9300 B12R1.127 Nc1ccc(F)[n]c1CC(O)=O Amb25255630 [0,2,0,0,0,0|1,0,0]=3 9301 B12R1.127 Nc1ccc(F)cc1CC(O)=O Amb24414015 [0,2,0,0,0,0|0,0,0]=2 9302 B12R1.127 Nc1ccc(F)cc1NC(N)=O Amb25736414 [0,2,0,0,0,0|2,0,0]=4 9303 B12R1.127 Nc1ccc(I)cc1CC(O)=O Amb24591356 [0,2,0,0,0,0|0,0,0]=2 9304 B12R1.127 Nc1ccc(c[n+]1CC(=O)N)Br Amb1803168 [0,2,0,0,0,0|2,0,0]=4 9305 B12R1.127 Nc1ccc(cc1NC(=O)N)Cl Amb1112601 [0,2,0,0,0,0|2,0,0]=4 9306 B12R1.127 O=C(Cl)Cc1cc(Cl)ccc1F Amb24464624 [0,2,0,0,0,0|1,0,0]=3 9307 B12R1.127 O=C(Cl)Cc1cc(F)ccc1Br Amb25082339 [0,2,0,0,0,0|1,0,0]=3 9308 B12R1.127 O=C(Cl)Cc1cc(F)ccc1Cl Amb22737787 [0,2,0,0,0,0|1,0,0]=3 9309 B12R1.127 O=C(Cl)Oc1cc(Br)ccc1F Amb24466499 [0,2,0,0,0,0|2,0,0]=4 9310 B12R1.127 O=C(Cl)Oc1cc(F)ccc1Cl Amb25055520 [0,2,0,0,0,0|2,0,0]=4 9311 B12R1.127 O=C(Cl)Oc1cc(F)ccc1F Amb24413400 [0,2,0,0,0,0|2,0,0]=4 9312 B12R1.127 OB(O)Cc1cc(Cl)ccc1Br Amb25768343 [0,2,0,0,0,0|1,0,1]=4 9313 B12R1.127 OB(O)Cc1cc(Cl)ccc1Cl Amb24406381 [0,2,0,0,0,0|1,0,1]=4 9314 B12R1.127 OB(O)Cc1cc(F)ccc1Br Amb25682288 [0,2,0,0,0,0|1,0,1]=4 9315 B12R1.127 OB(O)Cc1cc(F)ccc1Cl Amb25842578 [0,2,0,0,0,0|1,0,1]=4 9316 B12R1.127 OC(=O)CC1=CC(=O)C=CC1=O Amb25784024 [0,2,0,0,0,0|0,0,0]=2 9317 B12R1.127 OC(=O)CC1=CC(=O)N=NC1=O Amb25706128 [0,2,0,0,0,0|2,0,0]=4 9318 B12R1.127 OC(=O)CC1=CC(=O)NNC1=O Amb19516662 [0,2,0,0,0,0|2,0,0]=4 9319 B12R1.127 OC(=O)CC1=CC(Br)=CNC1=O Amb24450539 [0,2,0,0,0,0|1,0,0]=3 9320 B12R1.127 OC(=O)CN1C=C(Br)C=CC1=O Amb18031844 [0,2,0,0,0,0|1,0,0]=3 9321 B12R1.127 OC(=O)CN1C=C(Cl)C=CC1=O Amb18028574 [0,2,0,0,0,0|1,0,0]=3 9322 B12R1.127 OC(=O)CN1C=C(F)C=CC1=O Amb18040621 [0,2,0,0,0,0|1,0,0]=3 9323 B12R1.127 OC(=O)CN1N=C(Cl)C=CC1=O Amb19516663 [0,2,0,0,0,0|2,0,0]=4 9324 B12R1.127 OC(=O)CN1N=C(O)C=CC1=O Amb19796631 [0,2,0,0,0,0|2,0,0]=4 9325 B12R1.127 OC(=O)CN1NC(=O)C=CC1=O Amb18372539 [0,2,0,0,0,0|2,0,0]=4 9326 B12R1.127 OC(=O)C[13c]1[13cH][13c](O)[13cH][13cH][13c]1O Amb17614983 [0,2,0,0,0,0|0,0,0]=2 9327 B12R1.127 OC(=O)Cc1[n]c(F)ccc1Cl Amb25667072 [0,2,0,0,0,0|1,0,0]=3 9328 B12R1.127 OC(=O)Cc1cc(Br)[n]cc1Br Amb25288968 [0,2,0,0,0,0|1,0,0]=3 9329 B12R1.127 OC(=O)Cc1cc(Br)[n]cc1Cl Amb25148898 [0,2,0,0,0,0|1,0,0]=3 9330 B12R1.127 OC(=O)Cc1cc(Br)c[n]c1Cl Amb25307882 [0,2,0,0,0,0|1,0,0]=3 9331 B12R1.127 OC(=O)Cc1cc(Br)ccc1Cl Amb21962763 [0,2,0,0,0,0|0,0,0]=2 9332 B12R1.127 OC(=O)Cc1cc(Br)ccc1S Amb24493051 [0,2,0,0,0,0|0,0,0]=2 9333 B12R1.127 OC(=O)Cc1cc(Cl)[n][n]c1Cl Amb24444438 [0,2,0,0,0,0|2,0,0]=4 9334 B12R1.127 OC(=O)Cc1cc(Cl)[n]cc1Br Amb25150056 [0,2,0,0,0,0|1,0,0]=3 9335 B12R1.127 OC(=O)Cc1cc(Cl)[n]cc1F Amb24341716 [0,2,0,0,0,0|1,0,0]=3 9336 B12R1.127 OC(=O)Cc1cc(Cl)c[n]c1Br Amb24483724 [0,2,0,0,0,0|1,0,0]=3 9337 B12R1.127 OC(=O)Cc1cc(Cl)ccc1I Amb22473108 [0,2,0,0,0,0|0,0,0]=2 9338 B12R1.127 OC(=O)Cc1cc(Cl)ccc1S Amb18130831 [0,2,0,0,0,0|0,0,0]=2 9339 B12R1.127 OC(=O)Cc1cc(F)[n]cc1Br Amb25363993 [0,2,0,0,0,0|1,0,0]=3 9340 B12R1.127 OC(=O)Cc1cc(F)[n]cc1Cl Amb24428982 [0,2,0,0,0,0|1,0,0]=3 9341 B12R1.127 OC(=O)Cc1cc(F)[n]cc1F Amb24485538 [0,2,0,0,0,0|1,0,0]=3 9342 B12R1.127 OC(=O)Cc1cc(F)[n]cc1I Amb24537022 [0,2,0,0,0,0|1,0,0]=3 9343 B12R1.127 OC(=O)Cc1cc(F)c[n]c1Cl Amb25808750 [0,2,0,0,0,0|1,0,0]=3 9344 B12R1.127 OC(=O)Cc1cc(F)c[n]c1I Amb25244185 [0,2,0,0,0,0|1,0,0]=3 9345 B12R1.127 OC(=O)Cc1cc(F)ccc1Cl Amb10808097 [0,2,0,0,0,0|0,0,0]=2 9346 B12R1.127 OC(=O)Cc1cc(F)ccc1I Amb19516381 [0,2,0,0,0,0|0,0,0]=2 9347 B12R1.127 OC(=O)Cc1cc(F)ccc1S Amb24513778 [0,2,0,0,0,0|0,0,0]=2 9348 B12R1.127 OC(=O)Cc1cc(I)c[n]c1F Amb24537021 [0,2,0,0,0,0|1,0,0]=3 9349 B12R1.127 OC(=O)Cc1cc(I)ccc1Br Amb22735949 [0,2,0,0,0,0|0,0,0]=2 9350 B12R1.127 OC(=O)Cc1cc(I)ccc1Cl Amb22473105 [0,2,0,0,0,0|0,0,0]=2 9351 B12R1.127 OC(=O)Cc1cc(I)ccc1S Amb24492970 [0,2,0,0,0,0|0,0,0]=2 9352 B12R1.127 OC(=O)Cc1cc(S)ccc1F Amb25304666 [0,2,0,0,0,0|0,0,0]=2 9353 B12R1.127 OC(=O)Oc1cc(Cl)ccc1Cl Amb10552922 [0,2,0,0,0,0|1,0,0]=3 9354 B12R1.127 Oc1[n]cc(Cl)cc1CC(O)=O Amb25359916 [0,2,0,0,0,0|1,0,0]=3 9355 B12R1.127 Oc1[n]cc(F)cc1CC(O)=O Amb24379453 [0,2,0,0,0,0|1,0,0]=3 9356 B12R1.127 Oc1c[n]c(F)cc1CC(O)=O Amb25700892 [0,2,0,0,0,0|1,0,0]=3 9357 B12R1.127 Oc1cc(CC(O)=O)c(Br)c[n]1 Amb25195351 [0,2,0,0,0,0|1,0,0]=3 9358 B12R1.127 Oc1cc(CC(O)=O)c(F)[n]c1 Amb24484245 [0,2,0,0,0,0|1,0,0]=3 9359 B12R1.127 Oc1ccc(Br)c(CC(O)=O)[n]1 Amb25732599 [0,2,0,0,0,0|1,0,0]=3 9360 B12R1.127 Oc1ccc(Br)cc1CC(O)=O Amb20076031 [0,2,0,0,0,0|0,0,0]=2 9361 B12R1.127 Oc1ccc(Cl)c(CC(O)=O)c1 Amb22481871 [0,2,0,0,0,0|0,0,0]=2 9362 B12R1.127 Oc1ccc(F)c(CC(O)=O)c1 Amb22738938 [0,2,0,0,0,0|0,0,0]=2 9363 B12R1.127 Oc1ccc(S)cc1CC(O)=O Amb24493181 [0,2,0,0,0,0|0,0,0]=2 9364 B12R1.127 Oc1ccc(cc1CC(=O)O)Cl Amb13884852 [0,2,0,0,0,0|0,0,0]=2 9365 B12R1.127 Oc1ccc(cc1CC(=O)O)F Amb13884851 [0,2,0,0,0,0|0,0,0]=2 9366 B12R1.127 [O-][N+](=O)Cc1cc(Br)ccc1F Amb25751473 [0,2,0,0,0,0|1,0,1]=4 9367 B12R1.151 CC(C)(O)Cc1ccccc1Cl Amb18027328 [0,2,0,0,0,0|1,0,1]=4 9368 B12R1.151 CP(O)(=O)Oc1ccccc1O Amb25834392 [0,2,0,0,0,0|2,0,0]=4 9369 B12R1.151 CS(=O)(=O)Cc1ccccc1Cl Amb25160354 [0,2,0,0,0,0|1,0,1]=4 9370 B12R1.151 Cc1ccccc1CS(=O)(=O)Cl Amb1116256 [0,2,0,0,0,0|1,0,1]=4 9371 B12R1.151 Cc1ccccc1CS(O)(=O)=O Amb22299020 [0,2,0,0,0,0|1,0,0]=3 9372 B12R1.151 Cc1ccccc1OS(O)(=O)=O Amb24715874 [0,2,0,0,0,0|2,0,0]=4 9373 B12R1.151 Clc1ccccc1CS(=O)(=O)Cl Amb1115627 [0,2,0,0,0,0|1,0,1]=4 9374 B12R1.151 Clc1ccccc1CS(=O)(=O)N Amb1025098 [0,2,0,0,0,0|1,0,1]=4 9375 B12R1.151 Fc1ccccc1CC(O)(C)C Amb17102024 [0,2,0,0,0,0|1,0,1]=4 9376 B12R1.151 NS(=O)(=O)Cc1ccccc1Br Amb19149315 [0,2,0,0,0,0|1,0,1]=4 9377 B12R1.151 Nc1ccccc1CS(=O)(=O)C Amb13951621 [0,2,0,0,0,0|1,0,1]=4 9378 B12R1.151 Nc1ccccc1CS(N)(=O)=O Amb18957700 [0,2,0,0,0,0|1,0,1]=4 9379 B12R1.151 Nc1ccccc1OS(O)(=O)=O Amb25762337 [0,2,0,0,0,0|2,0,0]=4 9380 B12R1.151 O=S(=O)(Cl)Cc1ccccc1I Amb19895204 [0,2,0,0,0,0|1,0,1]=4 9381 B12R1.151 O=S(=O)(F)Cc1ccccc1Cl Amb20667652 [0,2,0,0,0,0|1,0,1]=4 9382 B12R1.151 OS(=O)(=O)Cc1cc[n]cc1Cl Amb24566509 [0,2,0,0,0,0|2,0,0]=4 9383 B12R1.151 OS(=O)(=O)Cc1ccccc1Cl Amb22171083 [0,2,0,0,0,0|1,0,0]=3 9384 B12R1.151 OS(=O)(=O)Cc1ccccc1F Amb22298425 [0,2,0,0,0,0|1,0,0]=3 9385 B12R1.151 Oc1ccccc1OP(O)(O)=O Amb24434627 [0,2,0,0,0,0|2,0,0]=4 9386 B12R1.151 Oc1ccccc1OS(O)(=O)=O Amb25142646 [0,2,0,0,0,0|2,0,0]=4 9387 B12R1.151 [O-]S(=O)(=O)Cc1ccccc1Br Amb22476694 [0,2,0,0,0,0|1,0,1]=4 9388 B12R1.151 [O-]S(=O)(=O)Cc1ccccc1Cl Amb22484799 [0,2,0,0,0,0|1,0,1]=4 9389 B12R1.224 CC(=O)CN1C=CC=C(Br)C1=O Amb25074447 [0,2,0,0,0,0|2,0,0]=4 9390 B12R1.224 CC(=O)CN1C=CC=C(C)C1=O Amb18405643 [0,2,0,0,0,0|2,0,0]=4 9391 B12R1.224 CC(=O)Cc1c[n]cc(N)c1Cl Amb25139112 [0,2,0,0,0,0|2,0,0]=4 9392 B12R1.224 CC(=O)Cc1cccc(Br)c1Br Amb24537168 [0,2,0,0,0,0|1,0,0]=3 9393 B12R1.224 CC(=O)Cc1cccc(Br)c1F Amb24497412 [0,2,0,0,0,0|1,0,0]=3 9394 B12R1.224 CC(=O)Cc1cccc(Br)c1N Amb24743854 [0,2,0,0,0,0|1,0,0]=3 9395 B12R1.224 CC(=O)Cc1cccc(C)c1O Amb25854956 [0,2,0,0,0,0|1,0,0]=3 9396 B12R1.224 CC(=O)Cc1cccc(Cl)c1F Amb25751296 [0,2,0,0,0,0|1,0,0]=3 9397 B12R1.224 CC(=O)Cc1cccc(Cl)c1N Amb25208691 [0,2,0,0,0,0|1,0,0]=3 9398 B12R1.224 CC(=O)Cc1cccc(F)c1Cl Amb25058127 [0,2,0,0,0,0|1,0,0]=3 9399 B12R1.224 CC(=O)Cc1cccc(F)c1F Amb18801721 [0,2,0,0,0,0|1,0,0]=3 9400 B12R1.224 CC(=O)Cc1cccc(F)c1I Amb25313367 [0,2,0,0,0,0|1,0,0]=3 9401 B12R1.224 CC(=O)Cc1cccc(F)c1S Amb25376298 [0,2,0,0,0,0|1,0,0]=3 9402 B12R1.224 CC(=O)Cc1cccc(I)c1Br Amb24696970 [0,2,0,0,0,0|1,0,0]=3 9403 B12R1.224 CC(=O)Cc1cccc(I)c1I Amb25325186 [0,2,0,0,0,0|1,0,0]=3 9404 B12R1.224 CC(=O)Cc1cccc(O)c1Br Amb25856928 [0,2,0,0,0,0|1,0,0]=3 9405 B12R1.224 CC(=O)Cc1cccc(O)c1C Amb25237270 [0,2,0,0,0,0|1,0,0]=3 9406 B12R1.224 CC(=O)Cc1cccc(O)c1F Amb24549740 [0,2,0,0,0,0|1,0,0]=3 9407 B12R1.224 CC(=O)Cc1cccc(O)c1N Amb25267957 [0,2,0,0,0,0|1,0,0]=3 9408 B12R1.224 CC(=O)Cc1cccc(O)c1O Amb24487382 [0,2,0,0,0,0|1,0,0]=3 9409 B12R1.224 CC(=O)Cc1cccc(S)c1I Amb24664659 [0,2,0,0,0,0|1,0,0]=3 9410 B12R1.224 CC(=O)Cc1cccc(S)c1N Amb24565985 [0,2,0,0,0,0|1,0,0]=3 9411 B12R1.224 CC(=O)Cc1cccc(S)c1S Amb24679456 [0,2,0,0,0,0|1,0,0]=3 9412 B12R1.224 CC(=O)Nc1cccc(Br)c1Cl Amb24371638 [0,2,0,0,0,0|2,0,0]=4 9413 B12R1.224 CC(=O)Nc1cccc(C)c1N Amb24417935 [0,2,0,0,0,0|2,0,0]=4 9414 B12R1.224 CC(=O)Nc1cccc(F)c1Cl Amb25123831 [0,2,0,0,0,0|2,0,0]=4 9415 B12R1.224 CC(=O)Nc1cccc(F)c1F Amb25150957 [0,2,0,0,0,0|2,0,0]=4 9416 B12R1.224 CC(=O)Nc1cccc(F)c1I Amb24390697 [0,2,0,0,0,0|2,0,0]=4 9417 B12R1.224 CC(=O)Nc1cccc(N)c1F Amb22170357 [0,2,0,0,0,0|2,0,0]=4 9418 B12R1.224 CC(=O)Nc1cccc(O)c1Cl Amb24096480 [0,2,0,0,0,0|2,0,0]=4 9419 B12R1.224 CC(=O)Nc1cccc(c1C)C Amb2435547 [0,2,0,0,0,0|2,0,0]=4 9420 B12R1.224 CC(=O)Nc1cccc(c1F)Cl Amb10841583 [0,2,0,0,0,0|2,0,0]=4 9421 B12R1.224 CC(=O)Oc1cccc(Cl)c1Cl Amb24670130 [0,2,0,0,0,0|2,0,0]=4 9422 B12R1.224 CC(=O)Oc1cccc(F)c1F Amb20247706 [0,2,0,0,0,0|2,0,0]=4 9423 B12R1.224 CC(=O)Oc1cccc(O)c1C Amb24690655 [0,2,0,0,0,0|2,0,0]=4 9424 B12R1.224 CC(=O)Oc1cccc(O)c1N Amb25049247 [0,2,0,0,0,0|2,0,0]=4 9425 B12R1.224 CC(Cc1cccc(c1Cl)Cl)O Amb17477733 [0,2,0,0,0,0|1,0,1]=4 9426 B12R1.224 CC(O)Cc1cccc(Br)c1F Amb20623597 [0,2,0,0,0,0|1,0,1]=4 9427 B12R1.224 CC(O)Cc1cccc(F)c1Br Amb20669288 [0,2,0,0,0,0|1,0,1]=4 9428 B12R1.224 CC(O)Cc1cccc(F)c1F Amb18802843 [0,2,0,0,0,0|1,0,1]=4 9429 B12R1.224 CC(O)Cc1cccc(O)c1O Amb25143405 [0,2,0,0,0,0|1,0,1]=4 9430 B12R1.224 CC1=C(CC(O)=O)N=CNC1=O Amb18826768 [0,2,0,0,0,0|2,0,0]=4 9431 B12R1.224 CC1=CC=CN(CC(N)=O)C1=O Amb18378036 [0,2,0,0,0,0|2,0,0]=4 9432 B12R1.224 CC1=CC=CN(CC(O)=O)C1=O Amb17992859 [0,2,0,0,0,0|1,0,0]=3 9433 B12R1.224 CC1=CC=CN(CC([O-])=O)C1=O Amb19115293 [0,2,0,0,0,0|1,0,1]=4 9434 B12R1.224 CC1=CC=NN(CC(O)=O)C1=N Amb24426174 [0,2,0,0,0,0|2,0,0]=4 9435 B12R1.224 CC1=NC=CN(CC(O)=O)C1=O Amb24365970 [0,2,0,0,0,0|2,0,0]=4 9436 B12R1.224 CN1C(CC(O)=O)=CC=CC1=O Amb25772802 [0,2,0,0,0,0|1,0,0]=3 9437 B12R1.224 CN1C(CC(O)=O)=NC=CC1=O Amb25228114 [0,2,0,0,0,0|2,0,0]=4 9438 B12R1.224 CN1C=CC=C(CC(O)=O)C1=O Amb18646687 [0,2,0,0,0,0|1,0,0]=3 9439 B12R1.224 CN1N=CC=C(CC(O)=O)C1=O Amb18646869 [0,2,0,0,0,0|2,0,0]=4 9440 B12R1.224 Cc1[n]c[n]c(CC(O)=O)c1C Amb18827801 [0,2,0,0,0,0|2,0,0]=4 9441 B12R1.224 Cc1[n]ccc(CC(O)=O)c1Br Amb24362295 [0,2,0,0,0,0|1,0,0]=3 9442 B12R1.224 Cc1[n]ccc(CC(O)=O)c1C Amb24743971 [0,2,0,0,0,0|1,0,0]=3 9443 B12R1.224 Cc1[n]ccc(CC(O)=O)c1Cl Amb25087770 [0,2,0,0,0,0|1,0,0]=3 9444 B12R1.224 Cc1[n]ccc(CC(O)=O)c1F Amb25138634 [0,2,0,0,0,0|1,0,0]=3 9445 B12R1.224 Cc1[n]ccc(CC(O)=O)c1N Amb24450291 [0,2,0,0,0,0|1,0,0]=3 9446 B12R1.224 Cc1c(Br)c[n]cc1CC(O)=O Amb25242776 [0,2,0,0,0,0|1,0,0]=3 9447 B12R1.224 Cc1c(Br)cc[n]c1CC(O)=O Amb25249927 [0,2,0,0,0,0|1,0,0]=3 9448 B12R1.224 Cc1c(Br)cccc1CC(C)=O Amb25045525 [0,2,0,0,0,0|1,0,0]=3 9449 B12R1.224 Cc1c(CC(=O)O)cccc1Cl Amb17470670 [0,2,0,0,0,0|0,0,0]=2 9450 B12R1.224 Cc1c(CC(=O)O)cccc1F Amb10808075 [0,2,0,0,0,0|0,0,0]=2 9451 B12R1.224 Cc1c(CC(=O)O)cccc1N Amb16185693 [0,2,0,0,0,0|0,0,0]=2 9452 B12R1.224 Cc1c(CC(O)=O)[n]ccc1O Amb24696874 [0,2,0,0,0,0|1,0,0]=3 9453 B12R1.224 Cc1c(Cl)cc[n]c1CC(O)=O Amb25057189 [0,2,0,0,0,0|1,0,0]=3 9454 B12R1.224 Cc1c(Cl)cccc1CC(C)=C Amb25048025 [0,2,0,0,0,0|2,0,0]=4 9455 B12R1.224 Cc1c(F)cccc1NC(N)=O Amb18799023 [0,2,0,0,0,0|2,0,0]=4 9456 B12R1.224 Cc1c(I)cccc1CC(O)=O Amb25064243 [0,2,0,0,0,0|0,0,0]=2 9457 B12R1.224 Cc1c(I)cccc1NC(C)=O Amb24627602 [0,2,0,0,0,0|2,0,0]=4 9458 B12R1.224 Cc1c(N)cccc1CS(C)=O Amb18282192 [0,2,0,0,0,0|2,0,0]=4 9459 B12R1.224 Cc1c(NC(=O)C)cccc1F Amb2441391 [0,2,0,0,0,0|2,0,0]=4 9460 B12R1.224 Cc1c(NC(=O)C)cccc1N Amb1117137 [0,2,0,0,0,0|2,0,0]=4 9461 B12R1.224 Cc1c(NC(=O)N)cccc1C Amb1219867 [0,2,0,0,0,0|2,0,0]=4 9462 B12R1.224 Cc1c[n]cc(CC(O)=O)c1N Amb24566583 [0,2,0,0,0,0|1,0,0]=3 9463 B12R1.224 Cc1cccc(CC(C)=C)c1O Amb24364130 [0,2,0,0,0,0|2,0,0]=4 9464 B12R1.224 Cc1cccc(CC(C)=O)c1Br Amb24702721 [0,2,0,0,0,0|1,0,0]=3 9465 B12R1.224 Cc1cccc(CC(C)=O)c1Cl Amb25159774 [0,2,0,0,0,0|1,0,0]=3 9466 B12R1.224 Cc1cccc(CC(C)=O)c1I Amb25209535 [0,2,0,0,0,0|1,0,0]=3 9467 B12R1.224 Cc1cccc(CC(C)=O)c1S Amb24574996 [0,2,0,0,0,0|1,0,0]=3 9468 B12R1.224 Cc1cccc(CC(N)=O)c1Br Amb24493245 [0,2,0,0,0,0|1,0,0]=3 9469 B12R1.224 Cc1cccc(CC(O)=O)c1I Amb24532656 [0,2,0,0,0,0|0,0,0]=2 9470 B12R1.224 Cc1cccc(CC(O)=O)c1O Amb25727685 [0,2,0,0,0,0|0,0,0]=2 9471 B12R1.224 Cc1cccc(CS(C)=O)c1N Amb18648793 [0,2,0,0,0,0|2,0,0]=4 9472 B12R1.224 Cc1cccc(NC(N)=O)c1Br Amb25690134 [0,2,0,0,0,0|2,0,0]=4 9473 B12R1.224 Cc1cccc(OC(C)=O)c1Cl Amb25832255 [0,2,0,0,0,0|2,0,0]=4 9474 B12R1.224 Cc1cccc(OC(C)=O)c1F Amb24475723 [0,2,0,0,0,0|2,0,0]=4 9475 B12R1.224 Cc1cccc(SC(C)=O)c1C Amb25667057 [0,2,0,0,0,0|2,0,0]=4 9476 B12R1.224 Cc1cccc(c1F)CC(=O)O Amb10842022 [0,2,0,0,0,0|0,0,0]=2 9477 B12R1.224 Cc1cccc(c1N)CC(=O)O Amb16185680 [0,2,0,0,0,0|0,0,0]=2 9478 B12R1.224 NC(=N)Cc1cccc(Cl)c1F Amb25097092 [0,2,0,0,0,0|2,0,0]=4 9479 B12R1.224 NC(=N)Cc1cccc(F)c1Br Amb24724365 [0,2,0,0,0,0|2,0,0]=4 9480 B12R1.224 NC(=O)CN1C=CC=C(Br)C1=O Amb25056428 [0,2,0,0,0,0|2,0,0]=4 9481 B12R1.224 NC(=O)CN1C=CC=C(N)C1=O Amb18284714 [0,2,0,0,0,0|2,0,0]=4 9482 B12R1.224 NC(=O)Cc1cc[n]c(F)c1Cl Amb24493405 [0,2,0,0,0,0|2,0,0]=4 9483 B12R1.224 NC(=O)Cc1cc[n]c(O)c1Br Amb24685990 [0,2,0,0,0,0|2,0,0]=4 9484 B12R1.224 NC(=O)Cc1cccc(F)c1F Amb24678906 [0,2,0,0,0,0|1,0,0]=3 9485 B12R1.224 NC(=O)Cc1cccc(O)c1F Amb24525782 [0,2,0,0,0,0|1,0,0]=3 9486 B12R1.224 NC(=O)Cc1cccc(O)c1O Amb24366004 [0,2,0,0,0,0|1,0,0]=3 9487 B12R1.224 NC(=O)Nc1cccc(Br)c1F Amb24088523 [0,2,0,0,0,0|2,0,0]=4 9488 B12R1.224 NC(=O)Nc1cccc(F)c1Br Amb24088520 [0,2,0,0,0,0|2,0,0]=4 9489 B12R1.224 NC(=O)Nc1cccc(F)c1F Amb18794299 [0,2,0,0,0,0|2,0,0]=4 9490 B12R1.224 NC(=O)Nc1cccc(c1C)N Amb1111873 [0,2,0,0,0,0|2,0,0]=4 9491 B12R1.224 NC(=O)Oc1cccc(Cl)c1Cl Amb25142023 [0,2,0,0,0,0|2,0,0]=4 9492 B12R1.224 NC(=S)Cc1cccc(Cl)c1Cl Amb22043831 [0,2,0,0,0,0|1,1,0]=4 9493 B12R1.224 NC(=S)Cc1cccc(F)c1Cl Amb24341954 [0,2,0,0,0,0|1,1,0]=4 9494 B12R1.224 NC1=CC=CN(CC(O)=O)C1=O Amb18958865 [0,2,0,0,0,0|1,0,0]=3 9495 B12R1.224 NC1=CC=CN(CC(O)=O)C1=O Amb22100425 [0,2,0,0,0,0|1,0,0]=3 9496 B12R1.224 Nc1[n]ccc(CC(O)=O)c1Br Amb25804281 [0,2,0,0,0,0|1,0,0]=3 9497 B12R1.224 Nc1c(Br)[n]ccc1CC(O)=O Amb24652972 [0,2,0,0,0,0|1,0,0]=3 9498 B12R1.224 Nc1c(Cl)[n]ccc1CC(O)=O Amb25223255 [0,2,0,0,0,0|1,0,0]=3 9499 B12R1.224 Nc1c(Cl)cccc1CC(O)=O Amb25043268 [0,2,0,0,0,0|0,0,0]=2 9500 B12R1.224 Nc1c(F)[n]ccc1CC(O)=O Amb25212433 [0,2,0,0,0,0|1,0,0]=3 9501 B12R1.224 Nc1cc[n]c(CC(O)=O)c1Br Amb24501502 [0,2,0,0,0,0|1,0,0]=3 9502 B12R1.224 Nc1cc[n]c(CC(O)=O)c1F Amb24664474 [0,2,0,0,0,0|1,0,0]=3 9503 B12R1.224 Nc1cccc(CC(O)=O)c1N Amb25716769 [0,2,0,0,0,0|0,0,0]=2 9504 B12R1.224 Nc1cccc(CC(O)=O)c1S Amb25244530 [0,2,0,0,0,0|0,0,0]=2 9505 B12R1.224 Nc1cccc(NC(N)=O)c1Cl Amb24377713 [0,2,0,0,0,0|2,0,0]=4 9506 B12R1.224 O=C(Cl)Cc1cccc(F)c1F Amb22738936 [0,2,0,0,0,0|1,0,0]=3 9507 B12R1.224 O=C(Cl)Nc1cccc(Cl)c1F Amb25258874 [0,2,0,0,0,0|2,0,0]=4 9508 B12R1.224 O=C(Cl)Oc1cccc(Cl)c1F Amb25701652 [0,2,0,0,0,0|2,0,0]=4 9509 B12R1.224 OC(=O)CC=1C=CNC(=O)C1F Amb24475474 [0,2,0,0,0,0|1,0,0]=3 9510 B12R1.224 OC(=O)CC=1N=CNC(=O)C1Br Amb25346907 [0,2,0,0,0,0|2,0,0]=4 9511 B12R1.224 OC(=O)CC=1N=CNC(=O)C1Cl Amb24737997 [0,2,0,0,0,0|2,0,0]=4 9512 B12R1.224 OC(=O)CN1C=CC=C(Br)C1=O Amb18040581 [0,2,0,0,0,0|1,0,0]=3 9513 B12R1.224 OC(=O)CN1C=CC=C(O)C1=O Amb23569197 [0,2,0,0,0,0|1,0,0]=3 9514 B12R1.224 OC(=O)CN1C=CNC(=O)C1=O Amb18647254 [0,2,0,0,0,0|2,0,0]=4 9515 B12R1.224 OC(=O)Cc1[n]ccc(Br)c1Cl Amb24527928 [0,2,0,0,0,0|1,0,0]=3 9516 B12R1.224 OC(=O)Cc1[n]ccc(Cl)c1Br Amb24741312 [0,2,0,0,0,0|1,0,0]=3 9517 B12R1.224 OC(=O)Cc1[n]ccc(Cl)c1F Amb24528251 [0,2,0,0,0,0|1,0,0]=3 9518 B12R1.224 OC(=O)Cc1[n]ccc(F)c1Cl Amb24528249 [0,2,0,0,0,0|1,0,0]=3 9519 B12R1.224 OC(=O)Cc1[n]ccc(F)c1F Amb25351804 [0,2,0,0,0,0|1,0,0]=3 9520 B12R1.224 OC(=O)Cc1[n]ccc(I)c1F Amb25303188 [0,2,0,0,0,0|1,0,0]=3 9521 B12R1.224 OC(=O)Cc1c[n]cc(Br)c1Cl Amb24563984 [0,2,0,0,0,0|1,0,0]=3 9522 B12R1.224 OC(=O)Cc1c[n]cc(F)c1I Amb24537023 [0,2,0,0,0,0|1,0,0]=3 9523 B12R1.224 OC(=O)Cc1c[n]cc(I)c1F Amb25235019 [0,2,0,0,0,0|1,0,0]=3 9524 B12R1.224 OC(=O)Cc1cc[n]c(Br)c1Br Amb24727024 [0,2,0,0,0,0|1,0,0]=3 9525 B12R1.224 OC(=O)Cc1cc[n]c(Br)c1Cl Amb25766573 [0,2,0,0,0,0|1,0,0]=3 9526 B12R1.224 OC(=O)Cc1cc[n]c(Cl)c1Br Amb25729908 [0,2,0,0,0,0|1,0,0]=3 9527 B12R1.224 OC(=O)Cc1cc[n]c(Cl)c1Cl Amb25055257 [0,2,0,0,0,0|1,0,0]=3 9528 B12R1.224 OC(=O)Cc1cc[n]c(F)c1Br Amb24431210 [0,2,0,0,0,0|1,0,0]=3 9529 B12R1.224 OC(=O)Cc1cccc(Br)c1Br Amb24758840 [0,2,0,0,0,0|0,0,0]=2 9530 B12R1.224 OC(=O)Cc1cccc(Br)c1Cl Amb24105354 [0,2,0,0,0,0|0,0,0]=2 9531 B12R1.224 OC(=O)Cc1cccc(Cl)c1Br Amb25377023 [0,2,0,0,0,0|0,0,0]=2 9532 B12R1.224 OC(=O)Cc1cccc(Cl)c1I Amb25055749 [0,2,0,0,0,0|0,0,0]=2 9533 B12R1.224 OC(=O)Cc1cccc(F)c1Cl Amb21864853 [0,2,0,0,0,0|0,0,0]=2 9534 B12R1.224 OC(=O)Cc1cccc(I)c1Br Amb24077201 [0,2,0,0,0,0|0,0,0]=2 9535 B12R1.224 OC(=O)Cc1cccc(I)c1F Amb24350838 [0,2,0,0,0,0|0,0,0]=2 9536 B12R1.224 OC(=O)Cc1cccc(I)c1S Amb24686666 [0,2,0,0,0,0|0,0,0]=2 9537 B12R1.224 OC(=O)Cc1cccc(S)c1Cl Amb24493083 [0,2,0,0,0,0|0,0,0]=2 9538 B12R1.224 OC(=O)Cc1cccc(c1Br)F Amb10838913 [0,2,0,0,0,0|0,0,0]=2 9539 B12R1.224 OC(=O)Cc1cccc(c1F)Br Amb10838814 [0,2,0,0,0,0|0,0,0]=2 9540 B12R1.224 Oc1[n]ccc(CC(O)=O)c1Br Amb25040059 [0,2,0,0,0,0|1,0,0]=3 9541 B12R1.224 Oc1[n]ccc(CC(O)=O)c1Cl Amb25667203 [0,2,0,0,0,0|1,0,0]=3 9542 B12R1.224 Oc1c(Br)cc[n]c1CC(O)=O Amb24628234 [0,2,0,0,0,0|1,0,0]=3 9543 B12R1.224 Oc1c(F)cccc1CC(O)=O Amb18825809 [0,2,0,0,0,0|0,0,0]=2 9544 B12R1.224 Oc1c[n]cc(CC(O)=O)c1Br Amb25376450 [0,2,0,0,0,0|1,0,0]=3 9545 B12R1.224 Oc1c[n]cc(CC(O)=O)c1Cl Amb25270193 [0,2,0,0,0,0|1,0,0]=3 9546 B12R1.224 Oc1c[n]cc(CC(O)=O)c1F Amb24708296 [0,2,0,0,0,0|1,0,0]=3 9547 B12R1.224 Oc1cc[n]c(CC(O)=O)c1Br Amb25208497 [0,2,0,0,0,0|1,0,0]=3 9548 B12R1.224 Oc1cc[n]c(CC(O)=O)c1Cl Amb25249784 [0,2,0,0,0,0|1,0,0]=3 9549 B12R1.224 Oc1cccc(CC(O)=O)c1Br Amb25691466 [0,2,0,0,0,0|0,0,0]=2 9550 B12R1.224 Oc1cccc(CC(O)=O)c1Cl Amb25295328 [0,2,0,0,0,0|0,0,0]=2 9551 B12R1.224 Oc1cccc(CC(O)=O)c1F Amb24055926 [0,2,0,0,0,0|0,0,0]=2 9552 B12R1.224 Oc1cccc(CC(O)=O)c1O Amb18646840 [0,2,0,0,0,0|0,0,0]=2 9553 B12R1.224 [O-][N+](=O)Cc1cccc(Cl)c1Cl Amb23589313 [0,2,0,0,0,0|1,0,1]=4 9554 B12R1.391 CC1(C)C=CC=CC1CC(O)=O Amb24056149 [0,2,0,0,0,0|0,0,2]=4 9555 B12R1.1009 CC(=C)Cc1c(O)cccc1O Amb25751607 [0,2,0,0,0,0|2,0,0]=4 9556 B12R1.1009 CC(=O)CN1C(=O)C=CC=C1C Amb18800892 [0,2,0,0,0,0|2,0,0]=4 9557 B12R1.1009 CC(=O)Cc1c(Br)cccc1Br Amb23402715 [0,2,0,0,0,0|1,0,0]=3 9558 B12R1.1009 CC(=O)Cc1c(Br)cccc1I Amb24651204 [0,2,0,0,0,0|1,0,0]=3 9559 B12R1.1009 CC(=O)Cc1c(C)cccc1C Amb25380895 [0,2,0,0,0,0|1,0,0]=3 9560 B12R1.1009 CC(=O)Cc1c(N)cccc1Br Amb24579217 [0,2,0,0,0,0|1,0,0]=3 9561 B12R1.1009 CC(=O)Cc1c(N)cccc1C Amb24536774 [0,2,0,0,0,0|1,0,0]=3 9562 B12R1.1009 CC(=O)Cc1c(O)[n]ccc1O Amb24639736 [0,2,0,0,0,0|2,0,0]=4 9563 B12R1.1009 CC(=O)Cc1c(O)cccc1I Amb24527865 [0,2,0,0,0,0|1,0,0]=3 9564 B12R1.1009 CC(=O)Cc1c(O)cccc1S Amb24598630 [0,2,0,0,0,0|1,0,0]=3 9565 B12R1.1009 CC(=O)Cc1c(S)cccc1I Amb24628123 [0,2,0,0,0,0|1,0,0]=3 9566 B12R1.1009 CC(=O)Nc1c(Br)cccc1Br Amb25335081 [0,2,0,0,0,0|2,0,0]=4 9567 B12R1.1009 CC(=O)Nc1c(C)cccc1O Amb10608364 [0,2,0,0,0,0|2,0,0]=4 9568 B12R1.1009 CC(=O)Nc1c(Cl)cccc1Cl Amb2523075 [0,2,0,0,0,0|2,0,0]=4 9569 B12R1.1009 CC(=O)Nc1c(F)cccc1Br Amb25725814 [0,2,0,0,0,0|2,0,0]=4 9570 B12R1.1009 CC(=O)Nc1c(N)cccc1Cl Amb18946675 [0,2,0,0,0,0|2,0,0]=4 9571 B12R1.1009 CC(=O)Oc1c(Br)cccc1Br Amb22055048 [0,2,0,0,0,0|2,0,0]=4 9572 B12R1.1009 CC(=O)Oc1c(C)cccc1F Amb10840590 [0,2,0,0,0,0|2,0,0]=4 9573 B12R1.1009 CC(=O)Sc1c(N)cccc1Cl Amb25113970 [0,2,0,0,0,0|2,0,0]=4 9574 B12R1.1009 CC(=O)\N=C/1\C(Cl)=CC=CC1=O Amb24072842 [0,2,0,0,0,0|2,0,0]=4 9575 B12R1.1009 CC(Cc1c(Cl)cccc1Cl)O Amb17477734 [0,2,0,0,0,0|1,0,1]=4 9576 B12R1.1009 CC(O)Cc1c(F)cccc1Br Amb20623598 [0,2,0,0,0,0|1,0,1]=4 9577 B12R1.1009 CC(O)Cc1c(F)cccc1Cl Amb19060249 [0,2,0,0,0,0|1,0,1]=4 9578 B12R1.1009 CC1=CC=CC(=N)N1CC(O)=O Amb24651154 [0,2,0,0,0,0|1,0,0]=3 9579 B12R1.1009 CC1=CC=CC(=O)N1CC(N)=O Amb18798523 [0,2,0,0,0,0|2,0,0]=4 9580 B12R1.1009 CC1=CC=CC(=O)N1CC(O)=O Amb18031843 [0,2,0,0,0,0|1,0,0]=3 9581 B12R1.1009 CC=1N=CNC(=O)C1CC(O)=O Amb18953069 [0,2,0,0,0,0|2,0,0]=4 9582 B12R1.1009 CS(=O)Cc1c(Cl)cccc1Cl Amb25093408 [0,2,0,0,0,0|2,0,0]=4 9583 B12R1.1009 CS(=O)Cc1c(F)cccc1F Amb25160167 [0,2,0,0,0,0|2,0,0]=4 9584 B12R1.1009 CS(=O)Cc1c(N)cccc1Br Amb18952482 [0,2,0,0,0,0|2,0,0]=4 9585 B12R1.1009 CS(=O)Cc1c(N)cccc1Cl Amb24483547 [0,2,0,0,0,0|2,0,0]=4 9586 B12R1.1009 CS(=O)Cc1c(N)cccc1F Amb24693455 [0,2,0,0,0,0|2,0,0]=4 9587 B12R1.1009 Cc1[n]c[n]c(C)c1CC(O)=O Amb18282112 [0,2,0,0,0,0|2,0,0]=4 9588 B12R1.1009 Cc1[n]ccc(Br)c1CC(O)=O Amb24754134 [0,2,0,0,0,0|1,0,0]=3 9589 B12R1.1009 Cc1[n]ccc(Cl)c1CC(O)=O Amb25837467 [0,2,0,0,0,0|1,0,0]=3 9590 B12R1.1009 Cc1[n]ccc(N)c1CC(O)=O Amb24743813 [0,2,0,0,0,0|1,0,0]=3 9591 B12R1.1009 Cc1cc[n]c(F)c1CC(O)=O Amb25697067 [0,2,0,0,0,0|1,0,0]=3 9592 B12R1.1009 Cc1cccc(Br)c1CC(O)=O Amb25148896 [0,2,0,0,0,0|0,0,0]=2 9593 B12R1.1009 Cc1cccc(Br)c1NC(C)=O Amb24450198 [0,2,0,0,0,0|2,0,0]=4 9594 B12R1.1009 Cc1cccc(C)c1CB(O)O Amb24423026 [0,2,0,0,0,0|1,0,1]=4 9595 B12R1.1009 Cc1cccc(C)c1CC(N)=O Amb25798842 [0,2,0,0,0,0|1,0,0]=3 9596 B12R1.1009 Cc1cccc(C)c1CC(N)=S Amb24576065 [0,2,0,0,0,0|1,1,0]=4 9597 B12R1.1009 Cc1cccc(C)c1OC(=O)Cl Amb25775735 [0,2,0,0,0,0|2,0,0]=4 9598 B12R1.1009 Cc1cccc(C)c1OC(N)=O Amb24366010 [0,2,0,0,0,0|2,0,0]=4 9599 B12R1.1009 Cc1cccc(Cl)c1CC(C)=O Amb24638123 [0,2,0,0,0,0|1,0,0]=3 9600 B12R1.1009 Cc1cccc(Cl)c1CC(N)=O Amb25712711 [0,2,0,0,0,0|1,0,0]=3 9601 B12R1.1009 Cc1cccc(Cl)c1OC(C)=O Amb24079947 [0,2,0,0,0,0|2,0,0]=4 9602 B12R1.1009 Cc1cccc(F)c1CC(C)=O Amb25217162 [0,2,0,0,0,0|1,0,0]=3 9603 B12R1.1009 Cc1cccc(F)c1CC(O)=O Amb24057248 [0,2,0,0,0,0|0,0,0]=2 9604 B12R1.1009 Cc1cccc(F)c1NC(C)=O Amb25243963 [0,2,0,0,0,0|2,0,0]=4 9605 B12R1.1009 Cc1cccc(I)c1CC(O)=O Amb24579484 [0,2,0,0,0,0|0,0,0]=2 9606 B12R1.1009 Cc1cccc(N)c1CC(O)=O Amb25831074 [0,2,0,0,0,0|0,0,0]=2 9607 B12R1.1009 Cc1cccc(O)c1NC(N)=O Amb24416388 [0,2,0,0,0,0|2,0,0]=4 9608 B12R1.1009 Cc1cccc([S-])c1NC(N)=O Amb25835078 [0,2,0,0,0,0|2,0,0]=4 9609 B12R1.1009 N=C1C=CNC(=O)N1CC(O)=O Amb24060051 [0,2,0,0,0,0|2,0,0]=4 9610 B12R1.1009 NC(=N)Cc1c(F)cccc1Cl Amb20669585 [0,2,0,0,0,0|2,0,0]=4 9611 B12R1.1009 NC(=O)CN1C(Cl)=CC=CC1=O Amb22474008 [0,2,0,0,0,0|2,0,0]=4 9612 B12R1.1009 NC(=O)Cc1c(Br)cccc1Br Amb23402716 [0,2,0,0,0,0|1,0,0]=3 9613 B12R1.1009 NC(=O)Nc1c(C)cccc1C Amb1132330 [0,2,0,0,0,0|2,0,0]=4 9614 B12R1.1009 NC(=O)Nc1c(Cl)cccc1Cl Amb25105136 [0,2,0,0,0,0|2,0,0]=4 9615 B12R1.1009 NC(=O)Nc1c(F)cccc1Br Amb24088522 [0,2,0,0,0,0|2,0,0]=4 9616 B12R1.1009 NC(=S)Cc1c(F)cccc1Cl Amb17237929 [0,2,0,0,0,0|1,1,0]=4 9617 B12R1.1009 Nc1c[n]cc(Br)c1CC(O)=O Amb24501495 [0,2,0,0,0,0|1,0,0]=3 9618 B12R1.1009 Nc1cc[n]c(F)c1CC(O)=O Amb25350733 [0,2,0,0,0,0|1,0,0]=3 9619 B12R1.1009 Nc1cccc(Br)c1OC(N)=O Amb25172575 [0,2,0,0,0,0|2,0,0]=4 9620 B12R1.1009 Nc1cccc(Cl)c1NC(N)=O Amb18946629 [0,2,0,0,0,0|2,0,0]=4 9621 B12R1.1009 Nc1cccc(Cl)c1OC(N)=O Amb25129124 [0,2,0,0,0,0|2,0,0]=4 9622 B12R1.1009 Nc1cccc(O)c1CC(O)=O Amb24493065 [0,2,0,0,0,0|0,0,0]=2 9623 B12R1.1009 Nc1cccc(S)c1CC(O)=O Amb25298559 [0,2,0,0,0,0|0,0,0]=2 9624 B12R1.1009 O=C(Cl)Cc1c(Cl)c[n]cc1Cl Amb24511722 [0,2,0,0,0,0|2,0,0]=4 9625 B12R1.1009 O=C(Cl)Oc1c(Cl)cccc1Cl Amb25039102 [0,2,0,0,0,0|2,0,0]=4 9626 B12R1.1009 OB(O)Cc1c(Cl)cccc1Cl Amb21962206 [0,2,0,0,0,0|1,0,1]=4 9627 B12R1.1009 OB(O)Cc1c(F)cccc1Cl Amb25667135 [0,2,0,0,0,0|1,0,1]=4 9628 B12R1.1009 OB(O)Cc1c(F)cccc1F Amb25127209 [0,2,0,0,0,0|1,0,1]=4 9629 B12R1.1009 OC(=O)CN1C(=O)NC=CC1=O Amb18647253 [0,2,0,0,0,0|2,0,0]=4 9630 B12R1.1009 OC(=O)CN1C(Br)=CC=CC1=O Amb18542989 [0,2,0,0,0,0|1,0,0]=3 9631 B12R1.1009 OC(=O)Cc1c(C)cccc1C Amb17470448 [0,2,0,0,0,0|0,0,0]=2 9632 B12R1.1009 OC(=O)Cc1c(Cl)[n]c[n]c1Cl Amb18176363 [0,2,0,0,0,0|2,0,0]=4 9633 B12R1.1009 OC(=O)Cc1c(Cl)[n]ccc1Br Amb25222703 [0,2,0,0,0,0|1,0,0]=3 9634 B12R1.1009 OC(=O)Cc1c(Cl)[n]ccc1Cl Amb25696677 [0,2,0,0,0,0|1,0,0]=3 9635 B12R1.1009 OC(=O)Cc1c(Cl)c[n]cc1Cl Amb22011726 [0,2,0,0,0,0|1,0,0]=3 9636 B12R1.1009 OC(=O)Cc1c(Cl)cc[n]c1Br Amb25211094 [0,2,0,0,0,0|1,0,0]=3 9637 B12R1.1009 OC(=O)Cc1c(Cl)cccc1Br Amb24467586 [0,2,0,0,0,0|0,0,0]=2 9638 B12R1.1009 OC(=O)Cc1c(Cl)cccc1I Amb25095357 [0,2,0,0,0,0|0,0,0]=2 9639 B12R1.1009 OC(=O)Cc1c(F)[n]ccc1Cl Amb25249963 [0,2,0,0,0,0|1,0,0]=3 9640 B12R1.1009 OC(=O)Cc1c(F)[n]ccc1F Amb24485645 [0,2,0,0,0,0|1,0,0]=3 9641 B12R1.1009 OC(=O)Cc1c(F)[n]ccc1I Amb24537018 [0,2,0,0,0,0|1,0,0]=3 9642 B12R1.1009 OC(=O)Cc1c(F)c[n]cc1Br Amb25346767 [0,2,0,0,0,0|1,0,0]=3 9643 B12R1.1009 OC(=O)Cc1c(F)c[n]cc1I Amb25265363 [0,2,0,0,0,0|1,0,0]=3 9644 B12R1.1009 OC(=O)Cc1c(F)cc[n]c1Br Amb25311518 [0,2,0,0,0,0|1,0,0]=3 9645 B12R1.1009 OC(=O)Cc1c(F)cccc1Br Amb22738935 [0,2,0,0,0,0|0,0,0]=2 9646 B12R1.1009 OC(=O)Cc1c(I)cccc1I Amb24700263 [0,2,0,0,0,0|0,0,0]=2 9647 B12R1.1009 OC(=O)Cc1c(O)[n]c[n]c1O Amb25685090 [0,2,0,0,0,0|2,0,0]=4 9648 B12R1.1009 OC(=O)Cc1c(O)cccc1O Amb18646833 [0,2,0,0,0,0|0,0,0]=2 9649 B12R1.1009 OC(=O)Cc1c(S)cccc1I Amb25156606 [0,2,0,0,0,0|0,0,0]=2 9650 B12R1.1009 Oc1c[n]cc(F)c1CC(O)=O Amb25364461 [0,2,0,0,0,0|1,0,0]=3 9651 B12R1.1009 Oc1cccc(Cl)c1CC(O)=O Amb24607310 [0,2,0,0,0,0|0,0,0]=2 9652 B12R1.1009 Oc1cccc(S)c1CC(O)=O Amb25156559 [0,2,0,0,0,0|0,0,0]=2 9653 B12R1.1009 [O-]S(=O)Cc1c(Cl)cccc1Cl Amb25062649 [0,2,0,0,0,0|1,0,1]=4 9654 B12R1.1009 [O-]S(=O)Cc1c(F)cccc1Cl Amb22275254 [0,2,0,0,0,0|1,0,1]=4 9655 B12R1.101 CC(=C)Cc1cc(N)cc(O)c1 Amb25268203 [0,2,0,0,0,0|2,0,0]=4 9656 B12R1.101 CC(=O)CC1=CC(=O)C=C(C)O1 Amb25142731 [0,2,0,0,0,0|2,0,0]=4 9657 B12R1.101 CC(=O)Cc1cc(C)cc(C)c1 Amb18792430 [0,2,0,0,0,0|1,0,0]=3 9658 B12R1.101 CC(=O)Cc1cc(C)cc(n1)C Amb1995167 [0,2,0,0,0,0|2,0,0]=4 9659 B12R1.101 CC(=O)Cc1cc(Cl)cc(c1)Cl Amb10844980 [0,2,0,0,0,0|1,0,0]=3 9660 B12R1.101 CC(=O)Cc1cc(F)cc(Br)c1 Amb24069984 [0,2,0,0,0,0|1,0,0]=3 9661 B12R1.101 CC(=O)Cc1cc(F)cc(I)c1 Amb25224740 [0,2,0,0,0,0|1,0,0]=3 9662 B12R1.101 CC(=O)Cc1cc(I)cc(I)c1 Amb25195560 [0,2,0,0,0,0|1,0,0]=3 9663 B12R1.101 CC(=O)Cc1cc(N)cc(Br)c1 Amb24566648 [0,2,0,0,0,0|1,0,0]=3 9664 B12R1.101 CC(=O)Cc1cc(N)cc(Cl)c1 Amb25208692 [0,2,0,0,0,0|1,0,0]=3 9665 B12R1.101 CC(=O)Cc1cc(N)cc(O)c1 Amb24537048 [0,2,0,0,0,0|1,0,0]=3 9666 B12R1.101 CC(=O)Cc1cc(O)cc(Cl)c1 Amb25320363 [0,2,0,0,0,0|1,0,0]=3 9667 B12R1.101 CC(=O)Cc1cc(O)cc(F)c1 Amb24497411 [0,2,0,0,0,0|1,0,0]=3 9668 B12R1.101 CC(=O)Cc1cc(O)cc(I)c1 Amb24527867 [0,2,0,0,0,0|1,0,0]=3 9669 B12R1.101 CC(=O)Cc1cc(O)cc(O)c1 Amb25757391 [0,2,0,0,0,0|1,0,0]=3 9670 B12R1.101 CC(=O)Nc1cc(Br)cc(c1)Br Amb10071133 [0,2,0,0,0,0|2,0,0]=4 9671 B12R1.101 CC(=O)Nc1cc(C)cc(c1)Br Amb16981794 [0,2,0,0,0,0|2,0,0]=4 9672 B12R1.101 CC(=O)Nc1cc(F)cc(Cl)c1 Amb25790587 [0,2,0,0,0,0|2,0,0]=4 9673 B12R1.101 CC(=O)Nc1cc(F)cc(I)c1 Amb24438514 [0,2,0,0,0,0|2,0,0]=4 9674 B12R1.101 CC(=O)Nc1cc(F)cc(c1)F Amb10842044 [0,2,0,0,0,0|2,0,0]=4 9675 B12R1.101 CC(=O)Nc1cc(N)cc(Br)c1 Amb24497425 [0,2,0,0,0,0|2,0,0]=4 9676 B12R1.101 CC(=O)Nc1cc(N)cc(N)c1 Amb23571439 [0,2,0,0,0,0|2,0,0]=4 9677 B12R1.101 CC(=O)Nc1cc(O)cc(C)c1 Amb25072789 [0,2,0,0,0,0|2,0,0]=4 9678 B12R1.101 CC(=O)Nc1cc(O)cc(Cl)c1 Amb24072162 [0,2,0,0,0,0|2,0,0]=4 9679 B12R1.101 CC(=O)Nc1cc(O)cc(F)c1 Amb25285500 [0,2,0,0,0,0|2,0,0]=4 9680 B12R1.101 CC(=O)Oc1cc(Br)cc(c1)Br Amb10071363 [0,2,0,0,0,0|2,0,0]=4 9681 B12R1.101 CC(=O)Oc1cc(Cl)cc(Cl)c1 Amb25783328 [0,2,0,0,0,0|2,0,0]=4 9682 B12R1.101 CC(=O)Oc1cc(F)cc(Br)c1 Amb24412814 [0,2,0,0,0,0|2,0,0]=4 9683 B12R1.101 CC(=O)Oc1cc(F)cc(F)c1 Amb25354726 [0,2,0,0,0,0|2,0,0]=4 9684 B12R1.101 CC(=O)Sc1cc(F)cc(F)c1 Amb25060086 [0,2,0,0,0,0|2,0,0]=4 9685 B12R1.101 CC(O)Cc1cc(C)cc(C)c1 Amb18792584 [0,2,0,0,0,0|1,0,1]=4 9686 B12R1.101 CC(O)Cc1cc(Cl)cc(Br)c1 Amb24403812 [0,2,0,0,0,0|1,0,1]=4 9687 B12R1.101 CC(O)Cc1cc(F)cc(Br)c1 Amb20622474 [0,2,0,0,0,0|1,0,1]=4 9688 B12R1.101 CC(O)Cc1cc(F)cc(Cl)c1 Amb24363617 [0,2,0,0,0,0|1,0,1]=4 9689 B12R1.101 CC(O)Cc1cc(F)cc(F)c1 Amb18794304 [0,2,0,0,0,0|1,0,1]=4 9690 B12R1.101 CC1=CC(=O)C=C(CC(O)=O)O1 Amb22284839 [0,2,0,0,0,0|1,0,0]=3 9691 B12R1.101 CC1=CC(=O)NC(CC(O)=O)=C1 Amb18827341 [0,2,0,0,0,0|1,0,0]=3 9692 B12R1.101 CC=1NC(=O)C=C(CC(O)=O)N1 Amb18042157 [0,2,0,0,0,0|2,0,0]=4 9693 B12R1.101 CN(O)Cc1cc(F)cc(F)c1 Amb25228129 [0,2,0,0,0,0|2,0,0]=4 9694 B12R1.101 CS(=O)Cc1cc(N)cc(F)c1 Amb25266936 [0,2,0,0,0,0|2,0,0]=4 9695 B12R1.101 C[C@@H](O)Cc1cc(Cl)cc(Cl)c1 Amb25121357 [0,2,0,0,0,0|1,0,1]=4 9696 B12R1.101 Cc1[n]c(CC(O)=O)cc(C)[n]1 Amb18827884 [0,2,0,0,0,0|2,0,0]=4 9697 B12R1.101 Cc1c[n+](CC(N)=O)cc(C)c1 Amb24401687 [0,2,0,0,0,0|2,0,0]=4 9698 B12R1.101 Cc1c[n+](CC(O)=O)cc(C)c1 Amb25743021 [0,2,0,0,0,0|1,0,0]=3 9699 B12R1.101 Cc1cc(CC(C)=C)cc(Cl)c1 Amb25071263 [0,2,0,0,0,0|2,0,0]=4 9700 B12R1.101 Cc1cc(CC(C)=O)cc(Cl)c1 Amb24346455 [0,2,0,0,0,0|1,0,0]=3 9701 B12R1.101 Cc1cc(CC(C)=O)cc(S)c1 Amb25254857 [0,2,0,0,0,0|1,0,0]=3 9702 B12R1.101 Cc1cc(CC(C)O)cc(F)c1 Amb24671649 [0,2,0,0,0,0|1,0,1]=4 9703 B12R1.101 Cc1cc(CC(N)=S)cc(C)c1 Amb18181023 [0,2,0,0,0,0|1,1,0]=4 9704 B12R1.101 Cc1cc(CC(O)=O)[n]c(Br)c1 Amb25731655 [0,2,0,0,0,0|1,0,0]=3 9705 B12R1.101 Cc1cc(CC(O)=O)[n]c(Cl)c1 Amb25053355 [0,2,0,0,0,0|1,0,0]=3 9706 B12R1.101 Cc1cc(CC(O)=O)[n]c(I)c1 Amb24604418 [0,2,0,0,0,0|1,0,0]=3 9707 B12R1.101 Cc1cc(CC(O)=O)[n]c(N)[n]1 Amb24695809 [0,2,0,0,0,0|2,0,0]=4 9708 B12R1.101 Cc1cc(CC(O)=O)[n]c(O)[n]1 Amb18862740 [0,2,0,0,0,0|2,0,0]=4 9709 B12R1.101 Cc1cc(CC(O)=O)cc(Br)[n]1 Amb24562809 [0,2,0,0,0,0|1,0,0]=3 9710 B12R1.101 Cc1cc(CC(O)=O)cc(Br)c1 Amb22737640 [0,2,0,0,0,0|0,0,0]=2 9711 B12R1.101 Cc1cc(CC(O)=O)cc(C)[n]1 Amb24178910 [0,2,0,0,0,0|1,0,0]=3 9712 B12R1.101 Cc1cc(CC(O)=O)cc(Cl)c1 Amb24393329 [0,2,0,0,0,0|0,0,0]=2 9713 B12R1.101 Cc1cc(CC(O)=O)cc(I)[n]1 Amb25235277 [0,2,0,0,0,0|1,0,0]=3 9714 B12R1.101 Cc1cc(CC(O)=O)cc(N)[n]1 Amb25060106 [0,2,0,0,0,0|1,0,0]=3 9715 B12R1.101 Cc1cc(CC(O)=O)cc(N)c1 Amb25751361 [0,2,0,0,0,0|0,0,0]=2 9716 B12R1.101 Cc1cc(CN(C)O)cc(O)c1 Amb25223291 [0,2,0,0,0,0|2,0,0]=4 9717 B12R1.101 Cc1cc(Cl)[n]c(CC(O)=O)[n]1 Amb25842779 [0,2,0,0,0,0|2,0,0]=4 9718 B12R1.101 Cc1cc(Cl)cc(CC(O)=O)[n]1 Amb25349313 [0,2,0,0,0,0|1,0,0]=3 9719 B12R1.101 Cc1cc(I)cc(CC(O)=O)[n]1 Amb25850019 [0,2,0,0,0,0|1,0,0]=3 9720 B12R1.101 Cc1cc(O)[n]c(CC(O)=O)[n]1 Amb24725172 [0,2,0,0,0,0|2,0,0]=4 9721 B12R1.101 Cc1cc(O)cc(CC(O)=O)[n]1 Amb25156678 [0,2,0,0,0,0|1,0,0]=3 9722 B12R1.101 Cc1cc(cc(C)c1)OC(=O)Cl Amb25342049 [0,2,0,0,0,0|2,0,0]=4 9723 B12R1.101 Cc1cc(cc(F)c1)NC(N)=O Amb25069137 [0,2,0,0,0,0|2,0,0]=4 9724 B12R1.101 NC(=N)Cc1cc(F)cc(F)c1 Amb18793574 [0,2,0,0,0,0|2,0,0]=4 9725 B12R1.101 NC(=O)Cc1cc(Br)cc(I)c1 Amb25357454 [0,2,0,0,0,0|1,0,0]=3 9726 B12R1.101 NC(=O)Cc1cc(Cl)cc(Cl)c1 Amb22443513 [0,2,0,0,0,0|1,0,0]=3 9727 B12R1.101 NC(=O)Cc1cc(O)[n]c(O)c1 Amb24373804 [0,2,0,0,0,0|2,0,0]=4 9728 B12R1.101 NC(=O)Nc1cc(C)cc(c1)C Amb1138650 [0,2,0,0,0,0|2,0,0]=4 9729 B12R1.101 NC(=O)Nc1cc(F)cc(Br)c1 Amb24088525 [0,2,0,0,0,0|2,0,0]=4 9730 B12R1.101 NC(=O)Nc1cc(F)cc(Cl)c1 Amb25850607 [0,2,0,0,0,0|2,0,0]=4 9731 B12R1.101 NC(=O)Nc1cc(F)cc(c1)F Amb1141218 [0,2,0,0,0,0|2,0,0]=4 9732 B12R1.101 NC(=S)Cc1cc(Cl)cc(Cl)c1 Amb24358258 [0,2,0,0,0,0|1,1,0]=4 9733 B12R1.101 NC(=S)Cc1cc(F)cc(c1)F Amb10610676 [0,2,0,0,0,0|1,1,0]=4 9734 B12R1.101 NC(O)Cc1cc(O)cc(O)c1 Amb25706069 [0,2,0,0,0,0|1,0,1]=4 9735 B12R1.101 NC=1NC(=O)C=C(CC(O)=O)N1 Amb18826209 [0,2,0,0,0,0|2,0,0]=4 9736 B12R1.101 Nc1cc(CC(O)=O)[n]c(Cl)c1 Amb24493011 [0,2,0,0,0,0|1,0,0]=3 9737 B12R1.101 Nc1cc(CC(O)=O)[n]c(N)c1 Amb25132688 [0,2,0,0,0,0|1,0,0]=3 9738 B12R1.101 Nc1cc(CC(O)=O)cc(Br)c1 Amb24641525 [0,2,0,0,0,0|0,0,0]=2 9739 B12R1.101 Nc1cc(I)cc(CC(O)=O)[n]1 Amb25329764 [0,2,0,0,0,0|1,0,0]=3 9740 B12R1.101 Nc1cc(O)[n]c(CC(O)=O)[n]1 Amb18224409 [0,2,0,0,0,0|2,0,0]=4 9741 B12R1.101 O=C(Cl)CC=1C=C(Cl)NC(=O)C1 Amb25213117 [0,2,0,0,0,0|2,0,0]=4 9742 B12R1.101 O=C(Cl)Oc1cc(Cl)cc(Cl)c1 Amb25676783 [0,2,0,0,0,0|2,0,0]=4 9743 B12R1.101 OC(=O)CC1=CC(=O)NC(=O)N1 Amb18533265 [0,2,0,0,0,0|2,0,0]=4 9744 B12R1.101 OC(=O)CC1=CC(=O)NC(=O)N1 Amb20662184 [0,2,0,0,0,0|2,0,0]=4 9745 B12R1.101 OC(=O)Cc1[n]c(Cl)cc(Cl)[n]1 Amb25223765 [0,2,0,0,0,0|2,0,0]=4 9746 B12R1.101 OC(=O)Cc1cc(Br)[n]c(Br)c1 Amb25040643 [0,2,0,0,0,0|1,0,0]=3 9747 B12R1.101 OC(=O)Cc1cc(Br)[n]c(I)c1 Amb24547120 [0,2,0,0,0,0|1,0,0]=3 9748 B12R1.101 OC(=O)Cc1cc(Br)cc(I)[n]1 Amb25682491 [0,2,0,0,0,0|1,0,0]=3 9749 B12R1.101 OC(=O)Cc1cc(Br)cc(I)c1 Amb22737584 [0,2,0,0,0,0|0,0,0]=2 9750 B12R1.101 OC(=O)Cc1cc(C)cc(c1)C Amb1090650 [0,2,0,0,0,0|0,0,0]=2 9751 B12R1.101 OC(=O)Cc1cc(C)cc(c1)F Amb2236565 [0,2,0,0,0,0|0,0,0]=2 9752 B12R1.101 OC(=O)Cc1cc(Cl)[n]c(Cl)[n]1 Amb24666732 [0,2,0,0,0,0|2,0,0]=4 9753 B12R1.101 OC(=O)Cc1cc(Cl)[n]c(Cl)c1 Amb25148715 [0,2,0,0,0,0|1,0,0]=3 9754 B12R1.101 OC(=O)Cc1cc(Cl)[n]c(I)c1 Amb25682372 [0,2,0,0,0,0|1,0,0]=3 9755 B12R1.101 OC(=O)Cc1cc(Cl)cc(Br)[n]1 Amb25721020 [0,2,0,0,0,0|1,0,0]=3 9756 B12R1.101 OC(=O)Cc1cc(Cl)cc(Cl)[n]1 Amb18780112 [0,2,0,0,0,0|1,0,0]=3 9757 B12R1.101 OC(=O)Cc1cc(Cl)cc(I)[n]1 Amb25793050 [0,2,0,0,0,0|1,0,0]=3 9758 B12R1.101 OC(=O)Cc1cc(Cl)cc(I)c1 Amb25667339 [0,2,0,0,0,0|0,0,0]=2 9759 B12R1.101 OC(=O)Cc1cc(Cl)cc(c1)Cl Amb17471135 [0,2,0,0,0,0|0,0,0]=2 9760 B12R1.101 OC(=O)Cc1cc(F)[n]c(F)c1 Amb24433348 [0,2,0,0,0,0|1,0,0]=3 9761 B12R1.101 OC(=O)Cc1cc(F)cc(I)[n]1 Amb25156573 [0,2,0,0,0,0|1,0,0]=3 9762 B12R1.101 OC(=O)Cc1cc(F)cc(I)c1 Amb25857015 [0,2,0,0,0,0|0,0,0]=2 9763 B12R1.101 OC(=O)Cc1cc(F)cc(S)c1 Amb25273123 [0,2,0,0,0,0|0,0,0]=2 9764 B12R1.101 OC(=O)Cc1cc(F)cc(c1)Br Amb10841821 [0,2,0,0,0,0|0,0,0]=2 9765 B12R1.101 OC(=O)Cc1cc(I)cc(Br)[n]1 Amb24623124 [0,2,0,0,0,0|1,0,0]=3 9766 B12R1.101 OC(=O)Cc1cc(I)cc(Cl)[n]1 Amb25308037 [0,2,0,0,0,0|1,0,0]=3 9767 B12R1.101 OC(=O)Cc1cc(I)cc(F)[n]1 Amb25817073 [0,2,0,0,0,0|1,0,0]=3 9768 B12R1.101 OC(=O)Cc1cc(I)cc(I)c1 Amb24483686 [0,2,0,0,0,0|0,0,0]=2 9769 B12R1.101 OC(=O)Cc1cc(S)cc(Cl)c1 Amb25326087 [0,2,0,0,0,0|0,0,0]=2 9770 B12R1.101 OC(=S)Cc1cc(Cl)cc(Cl)c1 Amb24097429 [0,2,0,0,0,0|0,1,0]=3 9771 B12R1.101 Oc1[n]c(CC(O)=O)cc(O)[n]1 Amb18862833 [0,2,0,0,0,0|2,0,0]=4 9772 B12R1.101 Oc1cc(Br)cc(CC(O)=O)[n]1 Amb25720945 [0,2,0,0,0,0|1,0,0]=3 9773 B12R1.101 Oc1cc(CC(O)=O)[n]c(F)c1 Amb24445333 [0,2,0,0,0,0|1,0,0]=3 9774 B12R1.101 Oc1cc(CC(O)=O)[n]c(I)c1 Amb25143536 [0,2,0,0,0,0|1,0,0]=3 9775 B12R1.101 Oc1cc(CC(O)=O)cc(Br)[n]1 Amb24493054 [0,2,0,0,0,0|1,0,0]=3 9776 B12R1.101 Oc1cc(CC(O)=O)cc(Cl)[n]1 Amb25667195 [0,2,0,0,0,0|1,0,0]=3 9777 B12R1.119 Brc1cccc(c1)CC(O)(C)C Amb17407186 [0,2,0,0,0,0|1,0,1]=4 9778 B12R1.119 CC(C)(O)Cc1cccc(N)c1 Amb24653910 [0,2,0,0,0,0|1,0,1]=4 9779 B12R1.119 CS(=O)(=O)Cc1cccc(Cl)c1 Amb25133925 [0,2,0,0,0,0|1,0,1]=4 9780 B12R1.119 CS(=O)(=O)Cc1cccc(O)c1 Amb23443324 [0,2,0,0,0,0|1,0,1]=4 9781 B12R1.119 Cc1cc(CS(=O)(=O)F)ccc1 Amb25277030 [0,2,0,0,0,0|1,0,1]=4 9782 B12R1.119 Cc1cc(CS(O)(=O)=O)ccc1 Amb19888650 [0,2,0,0,0,0|1,0,0]=3 9783 B12R1.119 Cc1cccc(CS(C)(=O)=O)c1 Amb25092773 [0,2,0,0,0,0|1,0,1]=4 9784 B12R1.119 Cc1cccc(CS([O-])(=O)=O)c1 Amb17872258 [0,2,0,0,0,0|1,0,1]=4 9785 B12R1.119 Cc1cccc(c1)CC(O)(C)C Amb17102022 [0,2,0,0,0,0|1,0,1]=4 9786 B12R1.119 Cc1cccc(c1)CP(=O)(O)O Amb10068661 [0,2,0,0,0,0|1,0,0]=3 9787 B12R1.119 Cc1cccc(c1)CS(=O)(=O)Cl Amb1114112 [0,2,0,0,0,0|1,0,1]=4 9788 B12R1.119 Clc1cccc(c1)CC(O)(C)C Amb17102025 [0,2,0,0,0,0|1,0,1]=4 9789 B12R1.119 Clc1cccc(c1)CS(=O)(=O)Cl Amb1102573 [0,2,0,0,0,0|1,0,1]=4 9790 B12R1.119 Fc1cccc(c1)CC(O)(C)C Amb17102023 [0,2,0,0,0,0|1,0,1]=4 9791 B12R1.119 Fc1cccc(c1)CS(=O)(=O)Cl Amb1113749 [0,2,0,0,0,0|1,0,1]=4 9792 B12R1.119 Fc1cccc(c1)CS(=O)(=O)[O-] Amb10064441 [0,2,0,0,0,0|1,0,1]=4 9793 B12R1.119 NS(=O)(=O)Cc1cccc(Br)c1 Amb19889317 [0,2,0,0,0,0|1,0,1]=4 9794 B12R1.119 NS(=O)(=O)Cc1cccc(I)c1 Amb25714689 [0,2,0,0,0,0|1,0,1]=4 9795 B12R1.119 Nc1cc(CP(O)(O)=O)ccc1 Amb25270696 [0,2,0,0,0,0|1,0,0]=3 9796 B12R1.119 Nc1cc(CS(=O)(=O)Cl)ccc1 Amb25709628 [0,2,0,0,0,0|1,0,1]=4 9797 B12R1.119 Nc1cc(CS(O)(=O)=O)ccc1 Amb25139400 [0,2,0,0,0,0|1,0,0]=3 9798 B12R1.119 Nc1cc(CS(O)(=O)=S)ccc1 Amb25260401 [0,2,0,0,0,0|1,0,0]=3 9799 B12R1.119 Nc1cc(ccc1)OP(O)(O)=O Amb25779912 [0,2,0,0,0,0|2,0,0]=4 9800 B12R1.119 Nc1cc(ccc1)OS(O)(=O)=O Amb25210883 [0,2,0,0,0,0|2,0,0]=4 9801 B12R1.119 Nc1cccc(c1)CS(=O)(=O)C Amb13951661 [0,2,0,0,0,0|1,0,1]=4 9802 B12R1.119 O=S(=O)(Cl)Cc1cccc(I)c1 Amb19895205 [0,2,0,0,0,0|1,0,1]=4 9803 B12R1.119 OS(=O)(=O)Cc1cccc(Cl)c1 Amb22298422 [0,2,0,0,0,0|1,0,0]=3 9804 B12R1.119 OS(=O)(=O)Cc1cccc(F)c1 Amb22298423 [0,2,0,0,0,0|1,0,0]=3 9805 B12R1.119 Oc1cc(CS(=O)(=O)Cl)ccc1 Amb24532746 [0,2,0,0,0,0|1,0,1]=4 9806 B12R1.119 Oc1cccc(CP(O)(O)=O)c1 Amb22388858 [0,2,0,0,0,0|1,0,0]=3 9807 B12R1.119 Oc1cccc(c1)OS(O)(=O)=O Amb25142744 [0,2,0,0,0,0|2,0,0]=4 9808 B12R1.438 BrCc1cccc(c1)OC(=O)C Amb10071923 [0,2,0,0,0,0|2,0,0]=4 9809 B12R1.438 C#Cc1c[n]cc(CC(O)=O)c1 Amb24738440 [0,2,0,0,0,0|1,0,0]=3 9810 B12R1.438 C#Cc1cc(CC(O)=O)cc[n]1 Amb25360790 [0,2,0,0,0,0|1,0,0]=3 9811 B12R1.438 C#Cc1cc[n]c(CC(O)=O)c1 Amb25798489 [0,2,0,0,0,0|1,0,0]=3 9812 B12R1.438 C#Cc1cccc(CC(N)=O)c1 Amb23399901 [0,2,0,0,0,0|1,0,0]=3 9813 B12R1.438 C#Cc1cccc(CC(O)=O)c1 Amb23399902 [0,2,0,0,0,0|0,0,0]=2 9814 B12R1.438 C=Cc1cc(ccc1)NC(N)=O Amb25053904 [0,2,0,0,0,0|2,0,0]=4 9815 B12R1.438 CC(=O)Cc1cc(C#N)[n]cc1 Amb25364646 [0,2,0,0,0,0|2,0,0]=4 9816 B12R1.438 CC(=O)Cc1cc(CC)c[n]c1 Amb25241802 [0,2,0,0,0,0|2,0,0]=4 9817 B12R1.438 CC(=O)Cc1cc(CO)[n]cc1 Amb25243310 [0,2,0,0,0,0|2,0,0]=4 9818 B12R1.438 CC(=O)Cc1cc[n]c(c1)C=O Amb25247501 [0,2,0,0,0,0|2,0,0]=4 9819 B12R1.438 CC(=O)Cc1cccc(C#N)[n]1 Amb25292953 [0,2,0,0,0,0|2,0,0]=4 9820 B12R1.438 CC(=O)Cc1cccc([n]1)OC Amb24675749 [0,2,0,0,0,0|2,0,0]=4 9821 B12R1.438 CC(=O)Nc1cc(ccc1)NN Amb24072198 [0,2,0,0,0,0|2,0,0]=4 9822 B12R1.438 CC(=O)Nc1cc(ccc1)NO Amb24497294 [0,2,0,0,0,0|2,0,0]=4 9823 B12R1.438 CC(=O)Nc1cccc(C=C)c1 Amb24668949 [0,2,0,0,0,0|2,0,0]=4 9824 B12R1.438 CC(=O)Nc1cccc(CBr)c1 Amb24487473 [0,2,0,0,0,0|2,0,0]=4 9825 B12R1.438 CC(=O)Nc1cccc(c1)C=O Amb18645817 [0,2,0,0,0,0|2,0,0]=4 9826 B12R1.438 CC(=O)Oc1cc(ccc1)C#C Amb24549292 [0,2,0,0,0,0|2,0,0]=4 9827 B12R1.438 CC(=O)Oc1cc(ccc1)[Zn]I Amb22000485 [0,2,0,0,0,0|2,0,0]=4 9828 B12R1.438 CC(=O)Oc1cccc(CCl)c1 Amb20667902 [0,2,0,0,0,0|2,0,0]=4 9829 B12R1.438 CC(=O)Oc1cccc(CN)c1 Amb25700880 [0,2,0,0,0,0|2,0,0]=4 9830 B12R1.438 CC(=O)Oc1cccc(CO)c1 Amb24056445 [0,2,0,0,0,0|2,0,0]=4 9831 B12R1.438 CC(=O)Sc1cc(ccc1)OC Amb25837474 [0,2,0,0,0,0|2,0,0]=4 9832 B12R1.438 CC(O)Cc1cc(CBr)ccc1 Amb22008290 [0,2,0,0,0,0|1,0,1]=4 9833 B12R1.438 CCc1cc(CC(N)=O)ccc1 Amb24362531 [0,2,0,0,0,0|1,0,0]=3 9834 B12R1.438 CCc1cc(CC(O)=O)[n]c[n]1 Amb18827800 [0,2,0,0,0,0|2,0,0]=4 9835 B12R1.438 CCc1cc(C[C@@H](C)O)ccc1 Amb25205044 [0,2,0,0,0,0|1,0,1]=4 9836 B12R1.438 CCc1cc(ccc1)OC(=O)Cl Amb24360368 [0,2,0,0,0,0|2,0,0]=4 9837 B12R1.438 CCc1cc(ccc1)OC(N)=O Amb24102142 [0,2,0,0,0,0|2,0,0]=4 9838 B12R1.438 CCc1cc[n]c(CC(O)=O)[n]1 Amb18827854 [0,2,0,0,0,0|2,0,0]=4 9839 B12R1.438 CCc1cc[n]c(CC(O)=O)c1 Amb18828432 [0,2,0,0,0,0|1,0,0]=3 9840 B12R1.438 CCc1cccc(CC(O)=O)[n]1 Amb18828389 [0,2,0,0,0,0|1,0,0]=3 9841 B12R1.438 CCc1cccc(c1)CC(=O)O Amb10844304 [0,2,0,0,0,0|0,0,0]=2 9842 B12R1.438 CCc1cccc(c1)NC(=O)N Amb1132162 [0,2,0,0,0,0|2,0,0]=4 9843 B12R1.438 CNc1cc(ccc1)NC(N)=O Amb18967645 [0,2,0,0,0,0|2,0,0]=4 9844 B12R1.438 CNc1cc(ccc1)OC(N)=O Amb24407290 [0,2,0,0,0,0|2,0,0]=4 9845 B12R1.438 CNc1cccc(CC(N)=O)[n]1 Amb25300931 [0,2,0,0,0,0|2,0,0]=4 9846 B12R1.438 CNc1cccc(CC(O)=O)[n]1 Amb25039913 [0,2,0,0,0,0|1,0,0]=3 9847 B12R1.438 COc1c[n]cc(CC(O)=O)c1 Amb20247609 [0,2,0,0,0,0|1,0,0]=3 9848 B12R1.438 COc1cc(CC(O)=O)cc[n]1 Amb20247912 [0,2,0,0,0,0|1,0,0]=3 9849 B12R1.438 COc1cc(ccc1)OC(=O)Cl Amb25244421 [0,2,0,0,0,0|2,0,0]=4 9850 B12R1.438 COc1cc[n]c(CC(O)=O)[n]1 Amb24580078 [0,2,0,0,0,0|2,0,0]=4 9851 B12R1.438 COc1cc[n]c(CC(O)=O)c1 Amb25279462 [0,2,0,0,0,0|1,0,0]=3 9852 B12R1.438 COc1cccc(CC(O)=O)[n]1 Amb20247608 [0,2,0,0,0,0|1,0,0]=3 9853 B12R1.438 COc1cccc(CC(O)=S)c1 Amb25132921 [0,2,0,0,0,0|0,1,0]=3 9854 B12R1.438 COc1cccc(C[C@@H](C)O)c1 Amb22896917 [0,2,0,0,0,0|1,0,1]=4 9855 B12R1.438 COc1cccc(c1)CC(O)C Amb17477577 [0,2,0,0,0,0|1,0,1]=4 9856 B12R1.438 COc1cccc(c1)NC(=O)C Amb1208566 [0,2,0,0,0,0|2,0,0]=4 9857 B12R1.438 COc1cccc(c1)NC(=O)N Amb1126089 [0,2,0,0,0,0|2,0,0]=4 9858 B12R1.438 CS(=O)Cc1cc(CN)ccc1 Amb18909343 [0,2,0,0,0,0|2,0,0]=4 9859 B12R1.438 CS(=O)Cc1cc(ccc1)NC Amb25787976 [0,2,0,0,0,0|2,0,0]=4 9860 B12R1.438 CSc1cc(CC(O)=O)[n]c[n]1 Amb22495962 [0,2,0,0,0,0|2,0,0]=4 9861 B12R1.438 CSc1cc[n]c(CC(O)=O)[n]1 Amb24524010 [0,2,0,0,0,0|2,0,0]=4 9862 B12R1.438 CSc1cccc(CC(=O)Cl)c1 Amb25350775 [0,2,0,0,0,0|1,0,0]=3 9863 B12R1.438 CSc1cccc(CC(C)O)c1 Amb25357489 [0,2,0,0,0,0|1,0,1]=4 9864 B12R1.438 CSc1cccc(c1)CC(=O)O Amb10070613 [0,2,0,0,0,0|0,0,0]=2 9865 B12R1.438 C[C@@H](O)Cc1cc(C=O)ccc1 Amb22896919 [0,2,0,0,0,0|1,0,1]=4 9866 B12R1.438 ClCc1cccc(c1)NC(=O)C Amb13952511 [0,2,0,0,0,0|2,0,0]=4 9867 B12R1.438 N#Cc1cc(ccc1)OC(=O)Cl Amb24455196 [0,2,0,0,0,0|2,0,0]=4 9868 B12R1.438 N#Cc1cccc(CB(O)O)c1 Amb24457266 [0,2,0,0,0,0|1,0,1]=4 9869 B12R1.438 N#Cc1cccc(CC(=O)Cl)c1 Amb25241736 [0,2,0,0,0,0|1,0,0]=3 9870 B12R1.438 N#Cc1cccc(CS(O)=O)c1 Amb24551973 [0,2,0,0,0,0|1,0,0]=3 9871 B12R1.438 NC(=O)C[n+]1cc(ccc1)C#N Amb24390233 [0,2,0,0,0,0|2,0,0]=4 9872 B12R1.438 NC(=O)Cc1cc(ccc1)C#N Amb24648609 [0,2,0,0,0,0|1,0,0]=3 9873 B12R1.438 NC(=O)Nc1cccc(CO)c1 Amb18792734 [0,2,0,0,0,0|2,0,0]=4 9874 B12R1.438 NCc1cc(CC(O)=O)ccc1 Amb25309107 [0,2,0,0,0,0|0,0,0]=2 9875 B12R1.438 NCc1cccc(c1)NC(=O)C Amb1113463 [0,2,0,0,0,0|2,0,0]=4 9876 B12R1.438 NCc1cccc(c1)NC(=O)N Amb1129992 [0,2,0,0,0,0|2,0,0]=4 9877 B12R1.438 O=C(Cl)Oc1cccc(CCl)c1 Amb25159623 [0,2,0,0,0,0|2,0,0]=4 9878 B12R1.438 OC(=O)Cc1cc(CBr)ccc1 Amb21962543 [0,2,0,0,0,0|0,0,0]=2 9879 B12R1.438 OC(=O)Cc1cc(CF)[n]cc1 Amb25267835 [0,2,0,0,0,0|1,0,0]=3 9880 B12R1.438 OC(=O)Cc1cc(CF)cc[n]1 Amb24654166 [0,2,0,0,0,0|1,0,0]=3 9881 B12R1.438 OC(=O)Cc1cc(CO)[n]cc1 Amb25720486 [0,2,0,0,0,0|1,0,0]=3 9882 B12R1.438 OC(=O)Cc1cc(CO)ccc1 Amb25727579 [0,2,0,0,0,0|0,0,0]=2 9883 B12R1.438 OC(=O)Cc1cc([n]cc1)[ClH]O Amb24733428 [0,2,0,0,0,0|1,0,0]=3 9884 B12R1.438 OC(=O)Cc1cc(ccc1)OBr Amb22438948 [0,2,0,0,0,0|0,0,0]=2 9885 B12R1.438 OC(=O)Cc1cccc(C=O)[n]1 Amb25111154 [0,2,0,0,0,0|1,0,0]=3 9886 B12R1.438 OC(=O)Cc1cccc(c1)C=O Amb22750419 [0,2,0,0,0,0|0,0,0]=2 9887 B12R1.438 OCc1cccc(c1)NC(=O)C Amb13952040 [0,2,0,0,0,0|2,0,0]=4 9888 B10R1.16 C=CC\C=C/1\CCC(=O)O1 Amb24420121 [0,0,1,1,0,0|0,0,2]=4 9889 B10R1.16 O=C1C=C\C(=C\C=C\Cl)\O1 Amb24649603 [0,0,1,1,0,0|1,0,1]=4 9890 B10R1.39 C=Cc1cc[s]c1C(O)=O Amb24651100 [0,0,1,1,0,0|1,0,1]=4 9891 B10R1.66 OC(=O)C=Cc1ccc[s]1 Amb24076486 [0,0,1,1,0,0|1,0,1]=4 9892 B10R1.66 OC(=O)CCC=1CC=CC1 Amb25264551 [0,0,1,1,0,0|0,0,2]=4 9893 B10R1.66 OC(=O)CCc1cc[nH]c1 Amb18562783 [0,0,1,1,0,0|1,0,1]=4 9894 B10R1.66 OC(=O)CCc1ccc[nH]1 Amb10602142 [0,0,1,1,0,0|1,0,1]=4 9895 B10R1.66 OC(=O)CCc1ccco1 Amb1153073 [0,0,1,1,0,0|1,0,1]=4 9896 B10R1.66 OC(=O)CCc1cccs1 Amb1154297 [0,0,1,1,0,0|1,0,1]=4 9897 B10R1.66 OC(=O)CCc1ccoc1 Amb18643489 [0,0,1,1,0,0|1,0,1]=4 9898 B10R1.66 OC(=O)CCc1cscc1 Amb1153814 [0,0,1,1,0,0|1,0,1]=4 9899 B10R1.66 OC(=O)CCn1cccc1 Amb1130611 [0,0,1,1,0,0|1,0,1]=4 9900 B10R1.66 OC(=O)CN[n]1cccc1 Amb25042233 [0,0,1,1,0,0|2,0,0]=4 9901 B10R1.66 OC(=O)CNc1cc[s]c1 Amb25322129 [0,0,1,1,0,0|2,0,0]=4 9902 B10R1.66 OC(=O)COc1cc[s]c1 Amb18126122 [0,0,1,1,0,0|2,0,0]=4 9903 B10R1.66 OC(=O)CSc1c[nH]cc1 Amb17593930 [0,0,1,1,0,0|2,0,0]=4 9904 B10R1.66 OC(=O)CSc1ccc[nH]1 Amb18644915 [0,0,1,1,0,0|2,0,0]=4 9905 B10R1.66 OC(=O)\C=C/c1cscc1 Amb10071559 [0,0,1,1,0,0|1,0,1]=4 9906 B10R1.66 OC(=O)\C=C\[n]1cccc1 Amb18643139 [0,0,1,1,0,0|1,0,1]=4 9907 B10R1.66 OC(=O)\C=C\c1cc[nH]c1 Amb18643122 [0,0,1,1,0,0|1,0,1]=4 9908 B10R1.66 OC(=O)\C=C\c1ccc[nH]1 Amb18643136 [0,0,1,1,0,0|1,0,1]=4 9909 B10R1.66 OC(=O)\C=C\c1cscc1 Amb1154295 [0,0,1,1,0,0|1,0,1]=4 9910 B10R1.78 O=C1CC=CCC=CC=C1 Amb24603480 [0,0,1,1,0,0|1,0,1]=4 9911 B10R1.86 C=CCC1C=CC1C(O)=O Amb24412291 [0,0,1,1,0,0|0,0,2]=4 9912 B10R1.144 C=C\C=C\C1CC1C(O)=O Amb24470771 [0,0,1,1,0,0|0,0,2]=4 9913 B10R1.162 O=C1CC=CC=C(C=O)N1 Amb25325277 [0,0,1,1,0,0|2,0,0]=4 9914 B10R1.348 NC(=O)C1C=CC=CC=C1 Amb24611356 [0,0,1,1,0,0|1,0,0]=3 9915 B10R1.348 NC(=O)N1C=CC=CC=C1 Amb24078430 [0,0,1,1,0,0|2,0,0]=4 9916 B10R1.348 OC(=O)C1C=CCCC=C1 Amb24480705 [0,0,1,1,0,0|0,0,2]=4 9917 B10R1.348 OC(=O)C=1C=COC=CC1 Amb25132139 [0,0,1,1,0,0|1,0,1]=4 9918 B10R1.348 OC(=O)[C@@H]1CC=CCC=C1 Amb24411248 [0,0,1,1,0,0|0,0,2]=4 9919 B10R2.6 C1NC1c2ccccc2 Amb25082886 [1,0,0,1,0,0|1,0,1]=4 9920 B10R2.6 C1O[C@@H]1c2c[n]ccc2 Amb25758556 [1,0,0,1,0,0|1,0,1]=4 9921 B10R2.6 C1O[C@@H]1c2cc[n]cc2 Amb24103202 [1,0,0,1,0,0|1,0,1]=4 9922 B10R2.6 C1O[C@@H]1c2cccc[n]2 Amb24481607 [1,0,0,1,0,0|1,0,1]=4 9923 B10R2.6 C1O[C@H]1c2cc[n]cc2 Amb24103149 [1,0,0,1,0,0|1,0,1]=4 9924 B10R2.6 C1O[C@H]1c2cccc[n]2 Amb24101968 [1,0,0,1,0,0|1,0,1]=4 9925 B10R2.6 C1SC1c2ccccc2 Amb17666888 [1,0,0,1,0,0|0,1,1]=4 9926 B10R2.6 C=1NC1c2ccccc2 Amb25848069 [1,0,0,1,0,0|1,0,1]=4 9927 B10R2.6 O1CC1c2ccncc2 Amb17090250 [1,0,0,1,0,0|1,0,1]=4 9928 B10R2.6 c1ccc(cn1)C2CO2 Amb17090249 [1,0,0,1,0,0|1,0,1]=4 9929 B10R2.6 c1ccc(nc1)C2CO2 Amb17090248 [1,0,0,1,0,0|1,0,1]=4 9930 B10R2.7 C1C=Cc2[n]cccc21 Amb22496284 [1,0,0,1,0,0|2,0,0]=4 9931 B10R2.7 C1C=Cc2ccc[n]c21 Amb21963524 [1,0,0,1,0,0|2,0,0]=4 9932 B10R2.7 C1C=Nc2[n]cccc21 Amb21927360 [1,0,0,1,0,0|2,0,0]=4 9933 B10R2.7 C1C=Nc2ccc[n]c21 Amb24099986 [1,0,0,1,0,0|2,0,0]=4 9934 B10R2.7 C1COc2[n]cccc21 Amb25337454 [1,0,0,1,0,0|1,0,1]=4 9935 B10R2.7 C1COc2c[n]ccc21 Amb22372207 [1,0,0,1,0,0|1,0,1]=4 9936 B10R2.7 C1COc2cc[n]cc21 Amb24101562 [1,0,0,1,0,0|1,0,1]=4 9937 B10R2.7 C1COc2ccc[n]c21 Amb23455396 [1,0,0,1,0,0|1,0,1]=4 9938 B10R2.7 C1CPc2ccccc21 Amb24477880 [1,0,0,1,0,0|1,0,1]=4 9939 B10R2.7 C1CSc2ccccc21 Amb24101549 [1,0,0,1,0,0|0,1,1]=4 9940 B10R2.7 C1C[n+]2ccccc2O1 Amb22364467 [1,0,0,1,0,0|1,0,1]=4 9941 B10R2.7 C1N=Cc2ccccc21 Amb20241766 [1,0,0,1,0,0|2,0,0]=4 9942 B10R2.7 C1NCc2ccccc12 Amb17739945 [1,0,0,1,0,0|2,0,0]=4 9943 B10R2.7 C1OSc2ccccc21 Amb25250664 [1,0,0,1,0,0|1,1,0]=4 9944 B10R2.7 C1Oc2ccccc2S1 Amb21963815 [1,0,0,1,0,0|1,0,1]=4 9945 B10R2.7 C1SCc2ccccc21 Amb21962922 [1,0,0,1,0,0|2,0,0]=4 9946 B10R2.7 [bH]1oc2ccccc2o1 Amb22731069 [1,0,0,1,0,0|2,0,0]=4 9947 B10R2.7 c1[nH]c2ccccc2[p]1 Amb24340147 [1,0,0,1,0,0|2,0,0]=4 9948 B10R2.7 c1[n]c2ccc[n]c2o1 Amb18100438 [1,0,0,1,0,0|2,0,0]=4 9949 B10R2.7 c1[n]c2ccccc2[se]1 Amb22346204 [1,0,0,1,0,0|1,1,0]=4 9950 B10R2.7 c1[n]ccc2[n]coc21 Amb24098524 [1,0,0,1,0,0|2,0,0]=4 9951 B10R2.7 c1[n]ccc2oc[n]c21 Amb24478645 [1,0,0,1,0,0|2,0,0]=4 9952 B10R2.7 c1[n]ccc2occc21 Amb19895064 [1,0,0,1,0,0|1,0,1]=4 9953 B10R2.7 c1cc[n]c2occc21 Amb21963452 [1,0,0,1,0,0|1,0,1]=4 9954 B10R2.7 c1ccc2[n+](c1)OCC2 Amb10560834 [1,0,0,1,0,0|1,0,1]=4 9955 B10R2.7 c1ccc2c(c1)C=CC2 Amb2383760 [1,0,0,1,0,0|1,0,0]=3 9956 B10R2.7 c1ccc2c(c1)NCC2 Amb1869493 [1,0,0,1,0,0|1,0,1]=4 9957 B10R2.7 c1ccc2c(c1)[nH+]cs2 Amb16205278 [1,0,0,1,0,0|1,1,0]=4 9958 B10R2.7 c1ccc2c(c1)[nH+]cs2 Amb16205847 [1,0,0,1,0,0|1,1,0]=4 9959 B10R2.7 c1ccc2c(c1)onc2 Amb1233398 [1,0,0,1,0,0|1,0,1]=4 9960 B10R2.7 c1cnc2c(c1)occ2 Amb16185654 [1,0,0,1,0,0|1,0,1]=4 9961 B10R2.7 c1cnc2c(c1)ocn2 Amb17194206 [1,0,0,1,0,0|2,0,0]=4 9962 B10R2.7 c1ncc2c(c1)cco2 Amb10067356 [1,0,0,1,0,0|1,0,1]=4 9963 B10R2.320 BrC1=Cc2ccccc21 Amb20248944 [1,0,0,1,0,0|1,0,1]=4 9964 B10R2.320 CC1Cc2ccccc12 Amb17778870 [1,0,0,1,0,0|1,0,1]=4 9965 B10R2.320 ClC1=Cc2ccccc21 Amb24402931 [1,0,0,1,0,0|1,0,1]=4 9966 B10R2.320 ClC1Cc2ccccc12 Amb17778800 [1,0,0,1,0,0|1,0,1]=4 9967 B10R2.320 O=C1CC2C1=CC=CC2 Amb10603965 [1,0,0,1,0,0|0,0,2]=4 9968 B10R2.320 O=C1Cc2[n]cccc21 Amb24061107 [1,0,0,1,0,0|1,0,0]=3 9969 B10R2.320 O=C1Cc2c[n]ccc21 Amb24587705 [1,0,0,1,0,0|1,0,0]=3 9970 B10R2.320 O=C1Cc2ccc[n]c21 Amb24479915 [1,0,0,1,0,0|1,0,0]=3 9971 B10R2.320 O=C1Nc2[n]cccc21 Amb24061210 [1,0,0,1,0,0|2,0,0]=4 9972 B10R2.320 O=C1Nc2c[n]ccc21 Amb24635548 [1,0,0,1,0,0|2,0,0]=4 9973 B10R2.320 OC1=Cc2ccccc21 Amb22002555 [1,0,0,1,0,0|0,0,1]=3 9974 B10R2.320 OC1Cc2c[n]ccc21 Amb24478648 [1,0,0,1,0,0|1,0,1]=4 9975 B10R2.320 OC1Cc2ccccc12 Amb17778676 [1,0,0,1,0,0|0,0,1]=3 9976 B10R2.320 O[C@@H]1Cc2ccccc21 Amb25676494 [1,0,0,1,0,0|0,0,1]=3 9977 B10R2.320 O[C@H]1Cc2ccccc21 Amb24704470 [1,0,0,1,0,0|0,0,1]=3 9978 B10R2.320 [NH3+]C1Cc2ccccc12 Amb17778877 [1,0,0,1,0,0|1,0,1]=4 9979 B10R2.2 O=C1C[n]2cccc2N1 Amb24089146 [0,0,0,1,1,0|2,0,0]=4 9980 B10R2.2 O=C1Cc2c(C1)cc[nH]2 Amb13883726 [0,0,0,1,1,0|2,0,0]=4 9981 B10R2.2 O=C1Cc2cc[s]c2C1 Amb18203007 [0,0,0,1,1,0|2,0,0]=4 9982 B10R2.2 O=C1Cc2cc[s]c2N1 Amb24513841 [0,0,0,1,1,0|2,0,0]=4 9983 B10R2.2 O=C1Cc2ccc[n]2C1 Amb22236118 [0,0,0,1,1,0|2,0,0]=4 9984 B10R2.2 O=C1Cc2ccoc2C1 Amb18203345 [0,0,0,1,1,0|2,0,0]=4 9985 B10R2.2 O=C1Cc2cocc2C1 Amb24405440 [0,0,0,1,1,0|2,0,0]=4 9986 B10R2.2 O=C1Nc2c(C1)scc2 Amb15692243 [0,0,0,1,1,0|2,0,0]=4 9987 B12R2.11 OC1CC1Cc2ccccc2 Amb25145316 [0,0,0,1,0,1|1,0,1]=4 9988 B12R2.11 OC1CC1Sc2ccccc2 Amb25788139 [0,0,0,1,0,1|1,0,1]=4 9989 B12R2.11 O[C@H]1C[C@@H]1Cc2ccccc2 Amb25326057 [0,0,0,1,0,1|1,0,1]=4 9990 B12R2.11 O[C@H]1C[C@@H]1Sc2ccccc2 Amb24745857 [0,0,0,1,0,1|1,0,1]=4 9991 B12R2.22 O=C1CC(C1)c2cc[n]cc2 Amb24407200 [0,0,0,1,0,1|2,0,0]=4 9992 B12R2.22 O=C1CC(C1)c2ccc[n]c2 Amb25151161 [0,0,0,1,0,1|2,0,0]=4 9993 B12R2.22 O=C1CC(N1)c2ccc[n]c2 Amb25322297 [0,0,0,1,0,1|2,0,0]=4 9994 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [0,0,0,1,0,1|1,0,0]=3 9995 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [0,0,0,1,0,1|1,0,0]=3 9996 B12R2.22 OC1CC(=C1)c2ccccc2 Amb25198298 [0,0,0,1,0,1|1,0,1]=4 9997 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [0,0,0,1,0,1|1,0,1]=4 9998 B12R2.22 OC1CN(C1)c2ccccc2 Amb23598700 [0,0,0,1,0,1|1,0,1]=4 9999 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [0,0,0,1,0,1|1,0,1]=4 10000 B12R2.24 BrC=1CCc2ccccc2C1 Amb25726468 [0,0,0,1,0,1|2,0,0]=4 10001 B12R2.24 BrC=1CNc2ccccc2C1 Amb24381392 [0,0,0,1,0,1|2,0,0]=4 10002 B12R2.24 C1Oc2ccncc2NC1=O Amb13890254 [0,0,0,1,0,1|2,0,0]=4 10003 B12R2.24 C=C1Cc2ccccc2CC1 Amb25151359 [0,0,0,1,0,1|2,0,0]=4 10004 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [0,0,0,1,0,1|2,0,0]=4 10005 B12R2.24 CC1=Nc2c(CC1)cccc2 Amb10553816 [0,0,0,1,0,1|2,0,0]=4 10006 B12R2.24 CC1=Nc2c(SC1)cccc2 Amb10976510 [0,0,0,1,0,1|2,0,0]=4 10007 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,0,0,1,0,1|1,0,1]=4 10008 B12R2.24 CC1CNc2c(O1)cccc2 Amb17097653 [0,0,0,1,0,1|1,0,1]=4 10009 B12R2.24 CC=1CNc2ccccc2C1 Amb18559652 [0,0,0,1,0,1|2,0,0]=4 10010 B12R2.24 CC=1COc2ccccc2C1 Amb24484437 [0,0,0,1,0,1|2,0,0]=4 10011 B12R2.24 CC=1CSc2ccccc2C1 Amb24485796 [0,0,0,1,0,1|2,0,0]=4 10012 B12R2.24 ClC1=CCc2c(N1)cccc2 Amb15691607 [0,0,0,1,0,1|2,0,0]=4 10013 B12R2.24 ClC1CCc2ccccc2O1 Amb24509296 [0,0,0,1,0,1|1,0,1]=4 10014 B12R2.24 ClC=1COc2ccccc2N1 Amb18118341 [0,0,0,1,0,1|2,0,0]=4 10015 B12R2.24 ClC=1NCc2ccccc2N1 Amb24728260 [0,0,0,1,0,1|2,0,0]=4 10016 B12R2.24 FC1CNc2ccccc2O1 Amb25301702 [0,0,0,1,0,1|1,0,1]=4 10017 B12R2.24 FC=1CNc2ccccc2C1 Amb25063014 [0,0,0,1,0,1|2,0,0]=4 10018 B12R2.24 N=C1CN=c2ccccc2=C1 Amb24061571 [0,0,0,1,0,1|2,0,0]=4 10019 B12R2.24 NC1=Nc2c(CC1)cccc2 Amb2373583 [0,0,0,1,0,1|2,0,0]=4 10020 B12R2.24 NC1=Nc2c(SC1)cccc2 Amb19136101 [0,0,0,1,0,1|2,0,0]=4 10021 B12R2.24 NC1=Nc2c(SC1)cccc2 Amb1918677 [0,0,0,1,0,1|2,0,0]=4 10022 B12R2.24 NC1CNc2ccccc2O1 Amb24417784 [0,0,0,1,0,1|1,0,1]=4 10023 B12R2.24 NC=1CNc2ccccc2C1 Amb25079184 [0,0,0,1,0,1|2,0,0]=4 10024 B12R2.24 NC=1COc2ccccc2N1 Amb18124903 [0,0,0,1,0,1|2,0,0]=4 10025 B12R2.24 NC=1NCc2ccccc2N1 Amb18644339 [0,0,0,1,0,1|2,0,0]=4 10026 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,0,0,1,0,1|1,0,1]=4 10027 B12R2.24 O=C1C=C2C=CC=CC2=CO1 Amb25242585 [0,0,0,1,0,1|1,0,1]=4 10028 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,0,0,1,0,1|2,0,0]=4 10029 B12R2.24 O=C1C=Cc2cc[n]cc2O1 Amb24395883 [0,0,0,1,0,1|1,0,1]=4 10030 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [0,0,0,1,0,1|1,0,1]=4 10031 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,0,0,1,0,1|0,0,1]=3 10032 B12R2.24 O=C1C=Cc2ccccc2S1 Amb20663396 [0,0,0,1,0,1|0,1,1]=4 10033 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [0,0,0,1,0,1|1,0,1]=4 10034 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [0,0,0,1,0,1|1,0,1]=4 10035 B12R2.24 O=C1CCN2C=CC=CC2=N1 Amb17749056 [0,0,0,1,0,1|2,0,0]=4 10036 B12R2.24 O=C1CCc2[n]cccc2N1 Amb25095800 [0,0,0,1,0,1|2,0,0]=4 10037 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [0,0,0,1,0,1|1,0,0]=3 10038 B12R2.24 O=C1CCc2c[n]c[n]c2O1 Amb25685469 [0,0,0,1,0,1|2,0,0]=4 10039 B12R2.24 O=C1CCc2c[n]ccc2N1 Amb22899719 [0,0,0,1,0,1|2,0,0]=4 10040 B12R2.24 O=C1CCc2ccc[n]c2N1 Amb21960778 [0,0,0,1,0,1|2,0,0]=4 10041 B12R2.24 O=C1CN2C=CC=CC2=NC1 Amb25301630 [0,0,0,1,0,1|2,0,0]=4 10042 B12R2.24 O=C1CNc2c[n]ccc2N1 Amb18202157 [0,0,0,1,0,1|2,0,0]=4 10043 B12R2.24 O=C1CNc2cc[n]cc2N1 Amb18025377 [0,0,0,1,0,1|2,0,0]=4 10044 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,0,0,1,0,1|0,0,0]=2 10045 B12R2.24 O=C1CNc2ncccc2N1 Amb17948510 [0,0,0,1,0,1|2,0,0]=4 10046 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [0,0,0,1,0,1|1,0,0]=3 10047 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [0,0,0,1,0,1|1,0,0]=3 10048 B12R2.24 O=C1COc2c[n]ccc2N1 Amb22899221 [0,0,0,1,0,1|2,0,0]=4 10049 B12R2.24 O=C1CSc2c(N1)cccc2 Amb1007458 [0,0,0,1,0,1|1,0,0]=3 10050 B12R2.24 O=C1CSc2c[n]ccc2N1 Amb24389346 [0,0,0,1,0,1|2,0,0]=4 10051 B12R2.24 O=C1CSc2cc[n]cc2N1 Amb20622817 [0,0,0,1,0,1|2,0,0]=4 10052 B12R2.24 O=C1CSc2ccc[n]c2N1 Amb24563510 [0,0,0,1,0,1|2,0,0]=4 10053 B12R2.24 O=C1C[n+]2ccccc2CN1 Amb24342049 [0,0,0,1,0,1|2,0,0]=4 10054 B12R2.24 O=C1Cc2[n]cccc2CC1 Amb22292032 [0,0,0,1,0,1|2,0,0]=4 10055 B12R2.24 O=C1Cc2c[n]ccc2CC1 Amb24093783 [0,0,0,1,0,1|2,0,0]=4 10056 B12R2.24 O=C1Cc2cc[n]cc2CN1 Amb25760054 [0,0,0,1,0,1|2,0,0]=4 10057 B12R2.24 O=C1Cc2ccc[n]c2CN1 Amb24513882 [0,0,0,1,0,1|2,0,0]=4 10058 B12R2.24 O=C1Cc2ccc[n]c2CO1 Amb22494099 [0,0,0,1,0,1|2,0,0]=4 10059 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [0,0,0,1,0,1|1,0,0]=3 10060 B12R2.24 O=C1Cc2ccccc2N=C1 Amb24078566 [0,0,0,1,0,1|1,0,1]=4 10061 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [0,0,0,1,0,1|1,0,0]=3 10062 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [0,0,0,1,0,1|2,0,0]=4 10063 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [0,0,0,1,0,1|1,0,0]=3 10064 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [0,0,0,1,0,1|0,0,1]=3 10065 B12R2.24 O=C1NCC2=CC=COC2=N1 Amb24085483 [0,0,0,1,0,1|2,0,0]=4 10066 B12R2.24 O=C1NCc2[n]cccc2N1 Amb24085488 [0,0,0,1,0,1|2,0,0]=4 10067 B12R2.24 O=C1NCc2c(N1)cccc2 Amb10603974 [0,0,0,1,0,1|1,0,0]=3 10068 B12R2.24 O=C1NCc2ccccc2S1 Amb24713217 [0,0,0,1,0,1|0,1,0]=3 10069 B12R2.24 O=C1Nc2[n]cccc2CO1 Amb24634652 [0,0,0,1,0,1|2,0,0]=4 10070 B12R2.24 O=C1Nc2ccccc2C=N1 Amb20653982 [0,0,0,1,0,1|1,0,1]=4 10071 B12R2.24 O=C1Nc2ccccc2C=N1 Amb22752711 [0,0,0,1,0,1|1,0,1]=4 10072 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [0,0,0,1,0,1|1,0,0]=3 10073 B12R2.24 O=C1Nc2ccccc2CS1 Amb24509578 [0,0,0,1,0,1|1,0,0]=3 10074 B12R2.24 O=C1OCc2ccccc2O1 Amb24536007 [0,0,0,1,0,1|0,0,0]=2 10075 B12R2.24 O=c1[nH]nc2c(c1)cccc2 Amb16204922 [0,0,0,1,0,1|2,0,0]=4 10076 B12R2.24 O=c1ccc2c(o1)cccc2 Amb1802468 [0,0,0,1,0,1|0,0,1]=3 10077 B12R2.24 O=c1ccc2c[n]ccc2o1 Amb24100794 [0,0,0,1,0,1|1,0,1]=4 10078 B12R2.24 O=c1cnc2c([nH]1)cccc2 Amb1352017 [0,0,0,1,0,1|1,0,1]=4 10079 B12R2.24 O=c1ncc2c([nH]1)cccc2 Amb2569659 [0,0,0,1,0,1|1,0,1]=4 10080 B12R2.24 OC1=COc2ccccc2O1 Amb24060689 [0,0,0,1,0,1|0,0,2]=4 10081 B12R2.24 OC1=Nc2c(NC1)cccc2 Amb2373483 [0,0,0,1,0,1|1,0,0]=3 10082 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,0,0,1,0,1|0,0,2]=4 10083 B12R2.24 OC1CNc2ccccc2O1 Amb24485948 [0,0,0,1,0,1|0,0,2]=4 10084 B12R2.24 OC1COc2c(O1)cccc2 Amb10552971 [0,0,0,1,0,1|0,0,2]=4 10085 B12R2.24 OC1CSc2ccccc2O1 Amb25072247 [0,0,0,1,0,1|0,0,2]=4 10086 B12R2.24 OC1Cc2ccccc2NC1 Amb23590875 [0,0,0,1,0,1|1,0,1]=4 10087 B12R2.24 OC1Cc2ccccc2OC1 Amb22498287 [0,0,0,1,0,1|1,0,1]=4 10088 B12R2.24 OC1Cc2ccccc2SC1 Amb25832476 [0,0,0,1,0,1|1,0,1]=4 10089 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [0,0,0,1,0,1|1,0,1]=4 10090 B12R2.24 OC=1COc2ccccc2C1 Amb22498277 [0,0,0,1,0,1|1,0,0]=3 10091 B12R2.24 OC=1COc2ccccc2N1 Amb22330533 [0,0,0,1,0,1|1,0,0]=3 10092 B12R2.24 ON1Cc2ccccc2CC1 Amb24533074 [0,0,0,1,0,1|2,0,0]=4 10093 B12R2.24 O[13c]1[13cH][13c]2[13cH][13cH][13cH][13cH][13c]2[13cH][13cH]1 Amb22055903 [0,0,0,1,0,1|1,0,1]=4 10094 B12R2.24 O[C@@H]1Cc2ccccc2CC1 Amb25149682 [0,0,0,1,0,1|1,0,1]=4 10095 B12R2.24 O[C@H]1Cc2ccccc2CC1 Amb25043599 [0,0,0,1,0,1|1,0,1]=4 10096 B12R2.24 O[C@H]1Cc2ccccc2NC1 Amb24426871 [0,0,0,1,0,1|1,0,1]=4 10097 B12R2.24 Oc1cc2ccccc2cc1 Amb21973568 [0,0,0,1,0,1|1,0,1]=4 10098 B12R2.24 Oc1ccc2c(n1)cccc2 Amb1818223 [0,0,0,1,0,1|1,0,1]=4 10099 B12R2.24 Oc1ncc2c(c1)cccc2 Amb10068513 [0,0,0,1,0,1|1,0,1]=4 10100 B12R2.24 Oc1ncc2c(n1)cccc2 Amb1971493 [0,0,0,1,0,1|1,0,1]=4 10101 B12R2.24 Oc1nnc2c(c1)cccc2 Amb10552926 [0,0,0,1,0,1|2,0,0]=4 10102 B12R2.24 S=C1C=Cc2ccccc2O1 Amb21884783 [0,0,0,1,0,1|0,1,1]=4 10103 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,0,0,1,0,1|1,1,0]=4 10104 B12R2.24 S=C1CCc2ccccc2O1 Amb24104591 [0,0,0,1,0,1|0,1,0]=3 10105 B12R2.24 S=C1COc2c(N1)cccc2 Amb10070958 [0,0,0,1,0,1|1,1,0]=4 10106 B12R2.24 S=C1CSc2c(N1)cccc2 Amb1147064 [0,0,0,1,0,1|1,1,0]=4 10107 B12R2.24 S=C1Cc2ccccc2CN1 Amb24538124 [0,0,0,1,0,1|1,1,0]=4 10108 B12R2.24 S=C1NCc2c(S1)cccc2 Amb10562262 [0,0,0,1,0,1|0,2,0]=4 10109 B12R2.24 S=C1Nc2ccccc2CS1 Amb19221474 [0,0,0,1,0,1|1,1,0]=4 10110 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [0,0,0,1,0,1|1,0,1]=4 10111 B12R2.2057 C(Oc1ccccc1)C2CO2 Amb22366990 [0,0,0,1,0,1|1,0,1]=4 10112 B12R2.2057 C1C=C1CNc2ccccc2 Amb25824311 [0,0,0,1,0,1|2,0,0]=4 10113 B12R2.2057 C1OC1CCc2ccccc2 Amb24105379 [0,0,0,1,0,1|1,0,1]=4 10114 B12R2.2057 C1O[C@@H]1CSc2ccccc2 Amb25680899 [0,0,0,1,0,1|1,0,1]=4 10115 B12R2.2057 C1O[C@@H]1OCc2ccccc2 Amb24631881 [0,0,0,1,0,1|1,0,1]=4 10116 B12R2.2403 N[C@]1(O)CCc2ccccc12 Amb24472858 [0,0,0,1,0,1|1,0,1]=4 10117 B12R2.2403 OC1(Br)CNc2ccccc12 Amb25195439 [0,0,0,1,0,1|1,0,1]=4 10118 B12R2.2403 OP1(=O)OCc2ccccc12 Amb25149207 [0,0,0,1,0,1|1,0,0]=3 10119 B12R2.3190 CC(=O)N1Cc2ccccc12 Amb25148191 [0,0,0,1,0,1|1,0,0]=3 10120 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [0,0,0,1,0,1|1,0,1]=4 10121 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [0,0,0,1,0,1|1,0,1]=4 10122 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [0,0,0,1,0,1|1,0,1]=4 10123 B12R2.3190 NC(=N)C1Cc2ccccc21 Amb25152697 [0,0,0,1,0,1|2,0,0]=4 10124 B12R2.3190 NC(=O)C1=Cc2ccccc21 Amb25169267 [0,0,0,1,0,1|1,0,1]=4 10125 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [0,0,0,1,0,1|1,0,0]=3 10126 B12R2.3190 NC(=S)C1Cc2ccccc21 Amb25152696 [0,0,0,1,0,1|1,1,0]=4 10127 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [0,0,0,1,0,1|1,0,0]=3 10128 B12R2.3190 O=C(Cl)C=1C=C2C=CC=CC21 Amb25779648 [0,0,0,1,0,1|1,0,1]=4 10129 B12R2.3190 OC(=O)C1=Cc2c1cccc2 Amb17593654 [0,0,0,1,0,1|0,0,1]=3 10130 B12R2.1041 O=C1C=C2C=CC=CC=C2N1 Amb22170323 [0,0,0,1,0,1|1,0,1]=4 10131 B12R2.1041 O=C1C=C2C=CC=CC=C2O1 Amb25378715 [0,0,0,1,0,1|0,0,1]=3 10132 B12R2.1041 O=C1NC2=CC=CC=CC2N1 Amb24707366 [0,0,0,1,0,1|2,0,0]=4 10133 B12R2.79 CC1OC1c2ccc(cc2)Br Amb1127215 [0,1,0,1,0,0|1,0,1]=4 10134 B12R2.79 CC1OC1c2ccc(cc2)C Amb1142227 [0,1,0,1,0,0|1,0,1]=4 10135 B12R2.79 CC1OC1c2ccc(cc2)Cl Amb1132631 [0,1,0,1,0,0|1,0,1]=4 10136 B12R2.79 CC1OC1c2ccc(cc2)F Amb1137217 [0,1,0,1,0,0|1,0,1]=4 10137 B12R2.79 C[C@@H]1O[C@@H]1c2ccc(F)cc2 Amb24515103 [0,1,0,1,0,0|1,0,1]=4 10138 B12R2.79 Cc1ccc(cc1)C2CC2O Amb24527656 [0,1,0,1,0,0|1,0,1]=4 10139 B12R2.79 OC1CC1c2ccc(F)cc2 Amb24639281 [0,1,0,1,0,0|1,0,1]=4 10140 B12R2.89 CC(=O)C1c2ccc(Cl)cc21 Amb24091408 [0,1,0,1,0,0|1,0,0]=3 10141 B12R2.294 Clc1ccc(CC2CO2)cc1 Amb24712110 [0,1,0,1,0,0|1,0,1]=4 10142 B12R2.294 Fc1ccc(CC2CO2)cc1 Amb24390098 [0,1,0,1,0,0|1,0,1]=4 10143 B12R2.294 Oc1ccc(CC2CO2)cc1 Amb25338853 [0,1,0,1,0,0|1,0,1]=4 10144 B12R2.606 Brc1cc2[n]c(I)oc2cc1 Amb24541057 [0,1,0,1,0,0|2,0,0]=4 10145 B12R2.606 Brc1ccc2c(c1)nc(o2)Cl Amb17130871 [0,1,0,1,0,0|2,0,0]=4 10146 B12R2.606 Brc1ccc2c(c1)nc(o2)S Amb17572350 [0,1,0,1,0,0|1,1,0]=4 10147 B12R2.606 Brc1ccc2c(c1)oc(n2)C Amb17304999 [0,1,0,1,0,0|2,0,0]=4 10148 B12R2.606 Brc1ccc2c(c1)oc(n2)N Amb16234007 [0,1,0,1,0,0|2,0,0]=4 10149 B12R2.606 Brc1ccc2c(c1)sc(=O)[nH]2 Amb16208009 [0,1,0,1,0,0|1,1,0]=4 10150 B12R2.606 CC1=CC2=NC(=O)N=C2C=C1 Amb25201830 [0,1,0,1,0,0|2,0,0]=4 10151 B12R2.606 CC1Cc2cc(Cl)ccc2O1 Amb25189357 [0,1,0,1,0,0|1,0,1]=4 10152 B12R2.606 CC=1Cc2ccc(Br)cc2C1 Amb25148299 [0,1,0,1,0,0|2,0,0]=4 10153 B12R2.606 CC=1Cc2ccc(F)cc2C1 Amb24543675 [0,1,0,1,0,0|2,0,0]=4 10154 B12R2.606 CC=1Cc2ccc(N)cc2C1 Amb24484410 [0,1,0,1,0,0|2,0,0]=4 10155 B12R2.606 CN1Cc2cc(Cl)ccc2O1 Amb25311751 [0,1,0,1,0,0|2,0,0]=4 10156 B12R2.606 Cc1[n]c2cc(I)ccc2o1 Amb25055254 [0,1,0,1,0,0|2,0,0]=4 10157 B12R2.606 Cc1[n]c2cc(N)ccc2o1 Amb22263315 [0,1,0,1,0,0|2,0,0]=4 10158 B12R2.606 Cc1[n]c2cc(S)ccc2o1 Amb25795358 [0,1,0,1,0,0|2,0,0]=4 10159 B12R2.606 Cc1[n]c2ccc(F)cc2o1 Amb22347783 [0,1,0,1,0,0|2,0,0]=4 10160 B12R2.606 Cc1c[n]c2NC(=O)Cc2c1 Amb23437022 [0,1,0,1,0,0|2,0,0]=4 10161 B12R2.606 Cc1cc2CC(=O)Cc2cc1 Amb22230005 [0,1,0,1,0,0|1,0,0]=3 10162 B12R2.606 Cc1cc2N=C(N)Cc2cc1 Amb24078907 [0,1,0,1,0,0|2,0,0]=4 10163 B12R2.606 Cc1cc2NC(=O)Cc2[n]c1 Amb19958797 [0,1,0,1,0,0|2,0,0]=4 10164 B12R2.606 Cc1cc2NC(=O)Cc2c[n]1 Amb24329960 [0,1,0,1,0,0|2,0,0]=4 10165 B12R2.606 Cc1cc2NC(=O)Cc2cc1 Amb18243502 [0,1,0,1,0,0|1,0,0]=3 10166 B12R2.606 Cc1cc2NC(=O)Nc2cc1 Amb18035797 [0,1,0,1,0,0|2,0,0]=4 10167 B12R2.606 Cc1cc2NC(=O)Oc2[n]c1 Amb18616386 [0,1,0,1,0,0|2,0,0]=4 10168 B12R2.606 Cc1cc2NC(=O)Oc2cc1 Amb18013200 [0,1,0,1,0,0|1,0,0]=3 10169 B12R2.606 Cc1cc2NC(=O)Sc2cc1 Amb21857458 [0,1,0,1,0,0|1,1,0]=4 10170 B12R2.606 Cc1cc2NC(=S)Oc2cc1 Amb18010779 [0,1,0,1,0,0|1,1,0]=4 10171 B12R2.606 Cc1cc2OC(=O)Nc2cc1 Amb19650748 [0,1,0,1,0,0|1,0,0]=3 10172 B12R2.606 Cc1cc2OC(=S)Nc2cc1 Amb19668260 [0,1,0,1,0,0|1,1,0]=4 10173 B12R2.606 Cc1cc2SC(=O)Nc2cc1 Amb20241149 [0,1,0,1,0,0|1,1,0]=4 10174 B12R2.606 Cc1cc2SC(=O)Oc2cc1 Amb25252500 [0,1,0,1,0,0|1,0,0]=3 10175 B12R2.606 Cc1cc2[n]c([SH3])oc2cc1 Amb18046736 [0,1,0,1,0,0|1,1,0]=4 10176 B12R2.606 Cc1cc2cc(Br)ccc2o1 Amb25147883 [0,1,0,1,0,0|1,0,1]=4 10177 B12R2.606 Cc1cc2cc(F)ccc2o1 Amb24071388 [0,1,0,1,0,0|1,0,1]=4 10178 B12R2.606 Cc1cc2cc(O)ccc2o1 Amb21962993 [0,1,0,1,0,0|1,0,1]=4 10179 B12R2.606 Cc1cc2ccc(Br)cc2o1 Amb24372162 [0,1,0,1,0,0|1,0,1]=4 10180 B12R2.606 Cc1cc2ccc(F)cc2o1 Amb24091691 [0,1,0,1,0,0|1,0,1]=4 10181 B12R2.606 Cc1cc2ccc(N)cc2o1 Amb24084619 [0,1,0,1,0,0|1,0,1]=4 10182 B12R2.606 Cc1cc2ccc(O)cc2o1 Amb18124875 [0,1,0,1,0,0|1,0,1]=4 10183 B12R2.606 Cc1cc2oc(Br)[n]c2cc1 Amb25121633 [0,1,0,1,0,0|2,0,0]=4 10184 B12R2.606 Cc1ccc2CC(=O)Nc2[n]1 Amb23437023 [0,1,0,1,0,0|2,0,0]=4 10185 B12R2.606 Cc1ccc2N=C(N)Cc2c1 Amb24078905 [0,1,0,1,0,0|2,0,0]=4 10186 B12R2.606 Cc1ccc2NC(=O)Oc2[n]1 Amb18103261 [0,1,0,1,0,0|2,0,0]=4 10187 B12R2.606 Cc1ccc2OC(=O)Nc2[n]1 Amb22497822 [0,1,0,1,0,0|2,0,0]=4 10188 B12R2.606 Cc1ccc2SC(=O)Cc2c1 Amb22757360 [0,1,0,1,0,0|0,1,0]=3 10189 B12R2.606 Cc1ccc2c(c1)[nH]c(=O)o2 Amb2148994 [0,1,0,1,0,0|1,0,0]=3 10190 B12R2.606 Cc1ccc2c(c1)[nH]c(=S)o2 Amb1150128 [0,1,0,1,0,0|1,1,0]=4 10191 B12R2.606 Cc1ccc2c(c1)nc(o2)Cl Amb10607789 [0,1,0,1,0,0|2,0,0]=4 10192 B12R2.606 Cc1ccc2c(c1)nc(o2)S Amb10244497 [0,1,0,1,0,0|1,1,0]=4 10193 B12R2.606 Cc1ccc2c(c1)oc(n2)Cl Amb17130865 [0,1,0,1,0,0|2,0,0]=4 10194 B12R2.606 Cc1ccc2c(c1)oc(n2)N Amb10608455 [0,1,0,1,0,0|2,0,0]=4 10195 B12R2.606 Cc1ccc2n(c1)oc(=O)n2 Amb10552730 [0,1,0,1,0,0|2,0,0]=4 10196 B12R2.606 Cc1ccn2c(c1)nc(=O)o2 Amb10552728 [0,1,0,1,0,0|2,0,0]=4 10197 B12R2.606 Clc1[n]c2cc(I)ccc2o1 Amb24637293 [0,1,0,1,0,0|2,0,0]=4 10198 B12R2.606 Clc1[n]c2ccc(Br)cc2o1 Amb24610611 [0,1,0,1,0,0|2,0,0]=4 10199 B12R2.606 Clc1[n]c2ccc(I)cc2o1 Amb24743739 [0,1,0,1,0,0|2,0,0]=4 10200 B12R2.606 Clc1cc2[n]c(Br)oc2cc1 Amb22499264 [0,1,0,1,0,0|2,0,0]=4 10201 B12R2.606 Clc1ccc2c(c1)[nH]c(=O)[nH]2 Amb2222077 [0,1,0,1,0,0|2,0,0]=4 10202 B12R2.606 Clc1ccc2c(c1)nc(o2)Cl Amb1102726 [0,1,0,1,0,0|2,0,0]=4 10203 B12R2.606 Clc1ccc2c(c1)nc(o2)N Amb1153987 [0,1,0,1,0,0|2,0,0]=4 10204 B12R2.606 Clc1ccc2c(c1)nc(o2)N Amb2099609 [0,1,0,1,0,0|2,0,0]=4 10205 B12R2.606 Clc1ccc2c(c1)nc(o2)O Amb17611147 [0,1,0,1,0,0|1,0,1]=4 10206 B12R2.606 Clc1ccc2c(c1)nc(o2)S Amb17570424 [0,1,0,1,0,0|1,1,0]=4 10207 B12R2.606 Clc1ccc2c(c1)oc(n2)N Amb10244538 [0,1,0,1,0,0|2,0,0]=4 10208 B12R2.606 Fc1[n]c2cc(Cl)ccc2o1 Amb24696705 [0,1,0,1,0,0|2,0,0]=4 10209 B12R2.606 Fc1[n]c2ccc(Cl)cc2o1 Amb24696706 [0,1,0,1,0,0|2,0,0]=4 10210 B12R2.606 Fc1[n]c2ccc(I)cc2o1 Amb25248684 [0,1,0,1,0,0|2,0,0]=4 10211 B12R2.606 Fc1cc2CC(=O)Nc2nc1 Amb13890137 [0,1,0,1,0,0|2,0,0]=4 10212 B12R2.606 Fc1cc2NC(=S)Oc2cc1 Amb22549268 [0,1,0,1,0,0|1,1,0]=4 10213 B12R2.606 Fc1cc2OC(=S)Nc2cc1 Amb22496770 [0,1,0,1,0,0|1,1,0]=4 10214 B12R2.606 Fc1cc2OC(=S)Oc2cc1 Amb25175830 [0,1,0,1,0,0|1,1,0]=4 10215 B12R2.606 Fc1cc2[n]c(I)oc2cc1 Amb24695668 [0,1,0,1,0,0|2,0,0]=4 10216 B12R2.606 Fc1cc2[n]c([SH3])oc2cc1 Amb18547330 [0,1,0,1,0,0|1,1,0]=4 10217 B12R2.606 Fc1cc2cc(Br)ccc2o1 Amb24556297 [0,1,0,1,0,0|1,0,1]=4 10218 B12R2.606 Fc1cc2oc(Cl)[n]c2cc1 Amb19958013 [0,1,0,1,0,0|2,0,0]=4 10219 B12R2.606 Fc1cc2oc(F)[n]c2cc1 Amb24679148 [0,1,0,1,0,0|2,0,0]=4 10220 B12R2.606 Fc1cc2oc(S)[n]c2cc1 Amb20676317 [0,1,0,1,0,0|1,1,0]=4 10221 B12R2.606 Fc1ccc2=CC(=O)N=c2c1 Amb15691715 [0,1,0,1,0,0|1,0,1]=4 10222 B12R2.606 Fc1ccc2c(c1)nc(o2)Cl Amb17130872 [0,1,0,1,0,0|2,0,0]=4 10223 B12R2.606 Fc1ccc2c(c1)nc(o2)N Amb10608448 [0,1,0,1,0,0|2,0,0]=4 10224 B12R2.606 Fc1ccc2c(c1)nc(o2)S Amb17570143 [0,1,0,1,0,0|1,1,0]=4 10225 B12R2.606 Fc1ccc2c(c1)oc(n2)N Amb10608501 [0,1,0,1,0,0|2,0,0]=4 10226 B12R2.606 Ic1ccc2c(c1)cc(o2)C Amb2447107 [0,1,0,1,0,0|1,0,1]=4 10227 B12R2.606 N=C1Nc2ccc(Cl)cc2O1 Amb22015189 [0,1,0,1,0,0|2,0,0]=4 10228 B12R2.606 N=C1Oc2cc(O)ccc2S1 Amb18048507 [0,1,0,1,0,0|2,0,0]=4 10229 B12R2.606 NC1=CC2=NC(=O)N=C2C=C1 Amb20239357 [0,1,0,1,0,0|2,0,0]=4 10230 B12R2.606 NC=1Cc2ccc(F)cc2N1 Amb24078906 [0,1,0,1,0,0|2,0,0]=4 10231 B12R2.606 Nc1[n]c2ccc(Cl)cc2o1 Amb22275992 [0,1,0,1,0,0|2,0,0]=4 10232 B12R2.606 Nc1[n]c2ccc(I)cc2o1 Amb25127674 [0,1,0,1,0,0|2,0,0]=4 10233 B12R2.606 Nc1[n]c2ccc(O)cc2o1 Amb24355166 [0,1,0,1,0,0|2,0,0]=4 10234 B12R2.606 Nc1c[n]c2NC(=O)Cc2c1 Amb22372205 [0,1,0,1,0,0|2,0,0]=4 10235 B12R2.606 Nc1c[n]c2NC(=O)Cc2c1 Amb24087850 [0,1,0,1,0,0|2,0,0]=4 10236 B12R2.606 Nc1cc2=CC(=O)N=c2cc1 Amb24081357 [0,1,0,1,0,0|1,0,1]=4 10237 B12R2.606 Nc1cc2CC(=O)Cc2cc1 Amb24081328 [0,1,0,1,0,0|1,0,0]=3 10238 B12R2.606 Nc1cc2CC(O)Cc2cc1 Amb20667809 [0,1,0,1,0,0|1,0,1]=4 10239 B12R2.606 Nc1cc2NC(=O)Cc2[n]c1 Amb24330175 [0,1,0,1,0,0|2,0,0]=4 10240 B12R2.606 Nc1cc2NC(=O)Cc2cc1 Amb22492356 [0,1,0,1,0,0|1,0,0]=3 10241 B12R2.606 Nc1cc2NC(=O)Nc2cc1 Amb18547319 [0,1,0,1,0,0|2,0,0]=4 10242 B12R2.606 Nc1cc2NC(=O)Nc2cc1 Amb19884065 [0,1,0,1,0,0|2,0,0]=4 10243 B12R2.606 Nc1cc2NC(=O)Oc2[n]c1 Amb18103257 [0,1,0,1,0,0|2,0,0]=4 10244 B12R2.606 Nc1cc2NC(=O)Oc2cc1 Amb18363345 [0,1,0,1,0,0|1,0,0]=3 10245 B12R2.606 Nc1cc2NC(=O)Sc2cc1 Amb18199615 [0,1,0,1,0,0|1,1,0]=4 10246 B12R2.606 Nc1cc2OC(=O)Nc2[n]c1 Amb18034497 [0,1,0,1,0,0|2,0,0]=4 10247 B12R2.606 Nc1cc2OC(=O)Nc2cc1 Amb18363360 [0,1,0,1,0,0|1,0,0]=3 10248 B12R2.606 Nc1cc2OC(=O)Oc2cc1 Amb24679263 [0,1,0,1,0,0|1,0,0]=3 10249 B12R2.606 Nc1cc2OC(=O)Sc2cc1 Amb25178505 [0,1,0,1,0,0|1,0,0]=3 10250 B12R2.606 Nc1cc2SC(=O)Nc2cc1 Amb18199617 [0,1,0,1,0,0|1,1,0]=4 10251 B12R2.606 Nc1cc2[n]c(Br)oc2cc1 Amb25151666 [0,1,0,1,0,0|2,0,0]=4 10252 B12R2.606 Nc1cc2[n]c(Cl)oc2cc1 Amb22500759 [0,1,0,1,0,0|2,0,0]=4 10253 B12R2.606 Nc1cc2[n]c(N)oc2cc1 Amb22500301 [0,1,0,1,0,0|2,0,0]=4 10254 B12R2.606 Nc1cc2[n]c(O)[nH]c2cc1 Amb22058711 [0,1,0,1,0,0|2,0,0]=4 10255 B12R2.606 Nc1cc2[n]c(O)oc2cc1 Amb22058717 [0,1,0,1,0,0|1,0,1]=4 10256 B12R2.606 Nc1cc2[s]c(O)[n]c2cc1 Amb18126441 [0,1,0,1,0,0|1,1,0]=4 10257 B12R2.606 Nc1cc2oc(Cl)[n]c2cc1 Amb22500570 [0,1,0,1,0,0|2,0,0]=4 10258 B12R2.606 Nc1cc2oc(F)[n]c2cc1 Amb25239547 [0,1,0,1,0,0|2,0,0]=4 10259 B12R2.606 Nc1cc2oc(I)[n]c2cc1 Amb25247626 [0,1,0,1,0,0|2,0,0]=4 10260 B12R2.606 Nc1cc2oc(N)[n]c2cc1 Amb24126307 [0,1,0,1,0,0|2,0,0]=4 10261 B12R2.606 Nc1cc2oc(N)cc2cc1 Amb24093514 [0,1,0,1,0,0|1,0,1]=4 10262 B12R2.606 Nc1ccc2=NC(=O)N=c2c1 Amb17942889 [0,1,0,1,0,0|2,0,0]=4 10263 B12R2.606 Nc1ccc2CC(=O)Nc2[n]1 Amb22445227 [0,1,0,1,0,0|2,0,0]=4 10264 B12R2.606 Nc1ccc2OC(=O)Cc2c1 Amb18124942 [0,1,0,1,0,0|0,0,0]=2 10265 B12R2.606 Nc1ccc2c(c1)cc(o2)C Amb1084261 [0,1,0,1,0,0|1,0,1]=4 10266 B12R2.606 Nc1ccc2c(c1)nc(o2)C Amb1153762 [0,1,0,1,0,0|2,0,0]=4 10267 B12R2.606 Nc1ccc2c(c1)oc(n2)C Amb1091910 [0,1,0,1,0,0|2,0,0]=4 10268 B12R2.606 O=C1C=c2cc(Br)ccc2=N1 Amb24081436 [0,1,0,1,0,0|1,0,1]=4 10269 B12R2.606 O=C1C=c2cc(Cl)ccc2=N1 Amb24081484 [0,1,0,1,0,0|1,0,1]=4 10270 B12R2.606 O=C1C=c2cc(F)ccc2=N1 Amb24062918 [0,1,0,1,0,0|1,0,1]=4 10271 B12R2.606 O=C1C=c2ccc(Br)cc2=N1 Amb24081603 [0,1,0,1,0,0|1,0,1]=4 10272 B12R2.606 O=C1C=c2ccc(Cl)cc2=N1 Amb24081608 [0,1,0,1,0,0|1,0,1]=4 10273 B12R2.606 O=C1CC2=CNC(Br)=CC2=N1 Amb24723216 [0,1,0,1,0,0|2,0,0]=4 10274 B12R2.606 O=C1CC2=CNC(Cl)=CC2=N1 Amb25360086 [0,1,0,1,0,0|2,0,0]=4 10275 B12R2.606 O=C1CN2C=C(Br)C=CC2=N1 Amb24095331 [0,1,0,1,0,0|2,0,0]=4 10276 B12R2.606 O=C1Cc2[n]cc(Br)cc2N1 Amb19958795 [0,1,0,1,0,0|2,0,0]=4 10277 B12R2.606 O=C1Cc2[n]cc(Cl)cc2N1 Amb20671407 [0,1,0,1,0,0|2,0,0]=4 10278 B12R2.606 O=C1Cc2[n]cc(F)cc2N1 Amb22491965 [0,1,0,1,0,0|2,0,0]=4 10279 B12R2.606 O=C1Cc2[n]cc(I)cc2N1 Amb22008637 [0,1,0,1,0,0|2,0,0]=4 10280 B12R2.606 O=C1Cc2c(C1)cc(cc2)Br Amb15692702 [0,1,0,1,0,0|1,0,0]=3 10281 B12R2.606 O=C1Cc2c(C1)cc(cc2)Cl Amb15692715 [0,1,0,1,0,0|1,0,0]=3 10282 B12R2.606 O=C1Cc2c(C1)cc(cc2)F Amb15692713 [0,1,0,1,0,0|1,0,0]=3 10283 B12R2.606 O=C1Cc2c(C1)cc(cc2)[NH3+] Amb10576589 [0,1,0,1,0,0|1,0,0]=3 10284 B12R2.606 O=C1Cc2c(N1)cc(cc2)Cl Amb1151862 [0,1,0,1,0,0|1,0,0]=3 10285 B12R2.606 O=C1Cc2c[n]c(Br)cc2N1 Amb24330392 [0,1,0,1,0,0|2,0,0]=4 10286 B12R2.606 O=C1Cc2c[n]c(F)cc2N1 Amb24329954 [0,1,0,1,0,0|2,0,0]=4 10287 B12R2.606 O=C1Cc2cc(Br)[n]cc2N1 Amb18770201 [0,1,0,1,0,0|2,0,0]=4 10288 B12R2.606 O=C1Cc2cc(Br)ccc2O1 Amb22236116 [0,1,0,1,0,0|0,0,0]=2 10289 B12R2.606 O=C1Cc2cc(Br)ccc2S1 Amb18140875 [0,1,0,1,0,0|0,1,0]=3 10290 B12R2.606 O=C1Cc2cc(Cl)[n]cc2N1 Amb19957667 [0,1,0,1,0,0|2,0,0]=4 10291 B12R2.606 O=C1Cc2cc(Cl)c[n]c2N1 Amb19958903 [0,1,0,1,0,0|2,0,0]=4 10292 B12R2.606 O=C1Cc2cc(Cl)ccc2O1 Amb22756853 [0,1,0,1,0,0|0,0,0]=2 10293 B12R2.606 O=C1Cc2cc(F)ccc2O1 Amb24071358 [0,1,0,1,0,0|0,0,0]=2 10294 B12R2.606 O=C1Cc2cc(I)c[n]c2N1 Amb22002118 [0,1,0,1,0,0|2,0,0]=4 10295 B12R2.606 O=C1Cc2cc(I)ccc2C1 Amb20241288 [0,1,0,1,0,0|1,0,0]=3 10296 B12R2.606 O=C1Cc2cc(I)ccc2N1 Amb22233073 [0,1,0,1,0,0|1,0,0]=3 10297 B12R2.606 O=C1Cc2ccc(Br)[n]c2N1 Amb22754555 [0,1,0,1,0,0|2,0,0]=4 10298 B12R2.606 O=C1Cc2ccc(Br)[n]c2O1 Amb25247807 [0,1,0,1,0,0|1,0,0]=3 10299 B12R2.606 O=C1Cc2ccc(Br)cc2O1 Amb25301569 [0,1,0,1,0,0|0,0,0]=2 10300 B12R2.606 O=C1Cc2ccc(Cl)[n]c2N1 Amb19957663 [0,1,0,1,0,0|2,0,0]=4 10301 B12R2.606 O=C1Cc2ccc(Cl)cc2O1 Amb25060206 [0,1,0,1,0,0|0,0,0]=2 10302 B12R2.606 O=C1Cc2ccc(Cl)cc2S1 Amb24519015 [0,1,0,1,0,0|0,1,0]=3 10303 B12R2.606 O=C1Cc2ccc(F)[n]c2C1 Amb24463141 [0,1,0,1,0,0|2,0,0]=4 10304 B12R2.606 O=C1Cc2ccc(F)[n]c2N1 Amb23437026 [0,1,0,1,0,0|2,0,0]=4 10305 B12R2.606 O=C1Cc2ccc(I)cc2N1 Amb22169709 [0,1,0,1,0,0|1,0,0]=3 10306 B12R2.606 O=C1Nc2[n]c(Br)ccc2O1 Amb22494169 [0,1,0,1,0,0|2,0,0]=4 10307 B12R2.606 O=C1Nc2[n]cc(Br)cc2O1 Amb18034496 [0,1,0,1,0,0|2,0,0]=4 10308 B12R2.606 O=C1Nc2[n]cc(Cl)cc2O1 Amb21856148 [0,1,0,1,0,0|2,0,0]=4 10309 B12R2.606 O=C1Nc2[n]cc(I)cc2O1 Amb25149017 [0,1,0,1,0,0|2,0,0]=4 10310 B12R2.606 O=C1Nc2c(C1)cc(cc2)Br Amb2455684 [0,1,0,1,0,0|1,0,0]=3 10311 B12R2.606 O=C1Nc2c(C1)cc(cc2)C Amb2236443 [0,1,0,1,0,0|1,0,0]=3 10312 B12R2.606 O=C1Nc2c(C1)cc(cc2)F Amb1102621 [0,1,0,1,0,0|1,0,0]=3 10313 B12R2.606 O=C1Nc2c(C1)cc(cc2)S Amb1111575 [0,1,0,1,0,0|1,0,0]=3 10314 B12R2.606 O=C1Nc2cc(Br)c[n]c2O1 Amb18561000 [0,1,0,1,0,0|2,0,0]=4 10315 B12R2.606 O=C1Nc2cc(Br)ccc2N1 Amb18034501 [0,1,0,1,0,0|2,0,0]=4 10316 B12R2.606 O=C1Nc2cc(Br)ccc2O1 Amb18036630 [0,1,0,1,0,0|1,0,0]=3 10317 B12R2.606 O=C1Nc2cc(Br)ccc2S1 Amb19665260 [0,1,0,1,0,0|1,1,0]=4 10318 B12R2.606 O=C1Nc2cc(Cl)c[n]c2O1 Amb18102875 [0,1,0,1,0,0|2,0,0]=4 10319 B12R2.606 O=C1Nc2cc(Cl)ccc2N1 Amb18042952 [0,1,0,1,0,0|2,0,0]=4 10320 B12R2.606 O=C1Nc2cc(Cl)ccc2O1 Amb18036632 [0,1,0,1,0,0|1,0,0]=3 10321 B12R2.606 O=C1Nc2cc(Cl)ccc2S1 Amb19894618 [0,1,0,1,0,0|1,1,0]=4 10322 B12R2.606 O=C1Nc2cc(F)c[n]c2O1 Amb18616413 [0,1,0,1,0,0|2,0,0]=4 10323 B12R2.606 O=C1Nc2cc(F)ccc2N1 Amb18043072 [0,1,0,1,0,0|2,0,0]=4 10324 B12R2.606 O=C1Nc2cc(F)ccc2O1 Amb18539349 [0,1,0,1,0,0|1,0,0]=3 10325 B12R2.606 O=C1Nc2cc(F)ccc2S1 Amb20241293 [0,1,0,1,0,0|1,1,0]=4 10326 B12R2.606 O=C1Nc2cc(I)ccc2N1 Amb22547718 [0,1,0,1,0,0|2,0,0]=4 10327 B12R2.606 O=C1Nc2cc(I)ccc2O1 Amb20248800 [0,1,0,1,0,0|1,0,0]=3 10328 B12R2.606 O=C1Nc2cc(S)ccc2N1 Amb18177825 [0,1,0,1,0,0|2,0,0]=4 10329 B12R2.606 O=C1Nc2cc(S)ccc2O1 Amb25128149 [0,1,0,1,0,0|1,0,0]=3 10330 B12R2.606 O=C1Nc2ccc(Br)cc2O1 Amb18034498 [0,1,0,1,0,0|1,0,0]=3 10331 B12R2.606 O=C1Nc2ccc(Br)cc2S1 Amb19650720 [0,1,0,1,0,0|1,1,0]=4 10332 B12R2.606 O=C1Nc2ccc(Br)cc2S1 Amb22343819 [0,1,0,1,0,0|1,1,0]=4 10333 B12R2.606 O=C1Nc2ccc(Cl)cc2O1 Amb19650717 [0,1,0,1,0,0|1,0,0]=3 10334 B12R2.606 O=C1Nc2ccc(Cl)cc2S1 Amb20241151 [0,1,0,1,0,0|1,1,0]=4 10335 B12R2.606 O=C1Nc2ccc(F)cc2O1 Amb19516859 [0,1,0,1,0,0|1,0,0]=3 10336 B12R2.606 O=C1Nc2ccc(F)cc2S1 Amb20240773 [0,1,0,1,0,0|1,1,0]=4 10337 B12R2.606 O=C1Nc2ccc(I)cc2O1 Amb21927507 [0,1,0,1,0,0|1,0,0]=3 10338 B12R2.606 O=C1Nc2ccc(S)cc2O1 Amb18177849 [0,1,0,1,0,0|1,0,0]=3 10339 B12R2.606 O=C1Oc2cc(Br)ccc2O1 Amb22276978 [0,1,0,1,0,0|1,0,0]=3 10340 B12R2.606 O=C1Oc2ccc(Br)cc2S1 Amb25089311 [0,1,0,1,0,0|1,0,0]=3 10341 B12R2.606 O=c1[nH]c2cc(S)ccc2[s]1 Amb24071672 [0,1,0,1,0,0|1,1,0]=4 10342 B12R2.606 OC1Cc2c(C1)cc(cc2)Br Amb15692813 [0,1,0,1,0,0|1,0,1]=4 10343 B12R2.606 OC1Cc2cc(F)ccc2C1 Amb25149468 [0,1,0,1,0,0|1,0,1]=4 10344 B12R2.606 O[C@@H]1Cc2cc(Br)ccc2C1 Amb24453425 [0,1,0,1,0,0|1,0,1]=4 10345 B12R2.606 Oc1[nH]c2ccc(Br)cc2[n]1 Amb22037110 [0,1,0,1,0,0|2,0,0]=4 10346 B12R2.606 Oc1[n]c2ccc(Br)cc2o1 Amb22039795 [0,1,0,1,0,0|1,0,1]=4 10347 B12R2.606 Oc1[n]c2ccc(I)cc2[s]1 Amb25720170 [0,1,0,1,0,0|1,1,0]=4 10348 B12R2.606 Oc1c[n]c2NC(=O)Cc2c1 Amb24082486 [0,1,0,1,0,0|2,0,0]=4 10349 B12R2.606 Oc1cc2NC(=O)Cc2[n]c1 Amb24329816 [0,1,0,1,0,0|2,0,0]=4 10350 B12R2.606 Oc1cc2NC(=O)Cc2c[n]1 Amb24329976 [0,1,0,1,0,0|2,0,0]=4 10351 B12R2.606 Oc1cc2NC(=O)Nc2cc1 Amb18547320 [0,1,0,1,0,0|2,0,0]=4 10352 B12R2.606 Oc1cc2NC(=O)Oc2cc1 Amb18547322 [0,1,0,1,0,0|1,0,0]=3 10353 B12R2.606 Oc1cc2NC(=O)Sc2cc1 Amb23401339 [0,1,0,1,0,0|1,1,0]=4 10354 B12R2.606 Oc1cc2OC(=O)Cc2cc1 Amb21963230 [0,1,0,1,0,0|0,0,0]=2 10355 B12R2.606 Oc1cc2OC(=O)Nc2cc1 Amb18547321 [0,1,0,1,0,0|1,0,0]=3 10356 B12R2.606 Oc1cc2OC(=O)Oc2cc1 Amb25062522 [0,1,0,1,0,0|1,0,0]=3 10357 B12R2.606 Oc1cc2OC(=O)Sc2cc1 Amb18805791 [0,1,0,1,0,0|1,0,0]=3 10358 B12R2.606 Oc1cc2SC(=O)Nc2cc1 Amb23401297 [0,1,0,1,0,0|1,1,0]=4 10359 B12R2.606 Oc1cc2SC(=O)Oc2cc1 Amb17988927 [0,1,0,1,0,0|1,0,0]=3 10360 B12R2.606 Oc1cc2[nH]c(O)cc2cc1 Amb24702551 [0,1,0,1,0,0|1,0,1]=4 10361 B12R2.606 Oc1cc2[n]c(Cl)oc2cc1 Amb24721744 [0,1,0,1,0,0|2,0,0]=4 10362 B12R2.606 Oc1cc2cc(Cl)ccc2o1 Amb25163555 [0,1,0,1,0,0|0,0,2]=4 10363 B12R2.606 Oc1cc2cc(F)ccc2[nH]1 Amb20669652 [0,1,0,1,0,0|1,0,1]=4 10364 B12R2.606 Oc1cc2cc(O)[nH]c2cc1 Amb24089087 [0,1,0,1,0,0|1,0,1]=4 10365 B12R2.606 Oc1cc2ccc(Br)cc2[nH]1 Amb24716802 [0,1,0,1,0,0|1,0,1]=4 10366 B12R2.606 Oc1cc2oc(Br)[n]c2cc1 Amb25239470 [0,1,0,1,0,0|2,0,0]=4 10367 B12R2.606 Oc1cc2oc(F)[n]c2cc1 Amb25247611 [0,1,0,1,0,0|2,0,0]=4 10368 B12R2.606 Oc1cc2oc(S)[n]c2cc1 Amb25735153 [0,1,0,1,0,0|1,1,0]=4 10369 B12R2.606 Oc1ccc2NC(=O)Cc2[n]1 Amb24329731 [0,1,0,1,0,0|2,0,0]=4 10370 B12R2.606 Oc1ccc2NC(=S)Cc2c1 Amb25189379 [0,1,0,1,0,0|1,1,0]=4 10371 B12R2.606 Oc1ccc2OC(O)Cc2c1 Amb25358813 [0,1,0,1,0,0|0,0,2]=4 10372 B12R2.606 Oc1ccc2c(c1)nc(o2)C Amb17479202 [0,1,0,1,0,0|2,0,0]=4 10373 B12R2.606 Oc1ccc2c(c1)sc(=S)o2 Amb1017369 [0,1,0,1,0,0|1,1,0]=4 10374 B12R2.606 S=C1Nc2cc(Br)ccc2O1 Amb22491526 [0,1,0,1,0,0|1,1,0]=4 10375 B12R2.606 S=C1Nc2cc(Cl)ccc2O1 Amb20665381 [0,1,0,1,0,0|1,1,0]=4 10376 B12R2.606 S=C1Nc2ccc(Br)cc2O1 Amb19958219 [0,1,0,1,0,0|1,1,0]=4 10377 B12R2.606 S=C1Nc2ccc(Cl)cc2O1 Amb19075682 [0,1,0,1,0,0|1,1,0]=4 10378 B12R2.606 Sc1[n]c2cc(I)ccc2o1 Amb22584154 [0,1,0,1,0,0|1,1,0]=4 10379 B12R2.606 Sc1cc2[n]c(Cl)oc2cc1 Amb25223563 [0,1,0,1,0,0|2,0,0]=4 10380 B12R2.606 [18OH][13c]1[15n]c2cc(Cl)ccc2o1 Amb22338933 [0,1,0,1,0,0|1,0,1]=4 10381 B12R2.606 [SH3]c1[n]c2cc(Br)ccc2o1 Amb18547410 [0,1,0,1,0,0|1,1,0]=4 10382 B12R2.606 [SH3]c1[n]c2cc(Cl)ccc2o1 Amb18046759 [0,1,0,1,0,0|1,1,0]=4 10383 B12R2.606 [SH3]c1[n]c2ccc(Br)cc2o1 Amb18046796 [0,1,0,1,0,0|1,1,0]=4 10384 B12R2.18 BrC1N2C=CC=CC2=NC1=O Amb17844936 [0,1,0,1,0,0|2,0,0]=4 10385 B12R2.18 BrC1Oc2ccccc2C1Br Amb25694128 [0,1,0,1,0,0|1,0,1]=4 10386 B12R2.18 Brc1c2ccccc2oc1Br Amb24105084 [0,1,0,1,0,0|1,0,1]=4 10387 B12R2.18 C=C1C(=O)Nc2ccccc12 Amb17779246 [0,1,0,1,0,0|1,0,1]=4 10388 B12R2.18 C=C1C(O)Cc2ccccc21 Amb24576594 [0,1,0,1,0,0|1,0,1]=4 10389 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,1,0,1,0,0|1,0,0]=3 10390 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [0,1,0,1,0,0|1,0,0]=3 10391 B12R2.18 C=C1Oc2ccccc2C1O Amb25852741 [0,1,0,1,0,0|1,0,0]=3 10392 B12R2.18 CC1=Cc2ccccc2C1Br Amb24757677 [0,1,0,1,0,0|2,0,0]=4 10393 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,1,0,1,0,0|1,0,1]=4 10394 B12R2.18 CC1C(=O)Cc2cc[n]cc21 Amb24456658 [0,1,0,1,0,0|2,0,0]=4 10395 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [0,1,0,1,0,0|1,0,0]=3 10396 B12R2.18 CC1C(=O)N=C2C=CC=CN21 Amb24102443 [0,1,0,1,0,0|2,0,0]=4 10397 B12R2.18 CC1C(=O)Nc2ccc[n]c21 Amb24330952 [0,1,0,1,0,0|2,0,0]=4 10398 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [0,1,0,1,0,0|0,0,0]=2 10399 B12R2.18 CC1C(=O)Sc2ccccc21 Amb24519014 [0,1,0,1,0,0|0,1,0]=3 10400 B12R2.18 CC1C(=S)Nc2ccccc21 Amb23571295 [0,1,0,1,0,0|1,1,0]=4 10401 B12R2.18 CC1C(O)Cc2ccccc21 Amb20622729 [0,1,0,1,0,0|1,0,1]=4 10402 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [0,1,0,1,0,0|1,0,1]=4 10403 B12R2.18 CC1Oc2ccccc2C1O Amb24572207 [0,1,0,1,0,0|1,0,1]=4 10404 B12R2.18 CC=1C(=O)CN2C=CC=CC21 Amb25151212 [0,1,0,1,0,0|2,0,0]=4 10405 B12R2.18 CC=1C(=O)OC2=COC=CC21 Amb19133147 [0,1,0,1,0,0|1,0,1]=4 10406 B12R2.18 CC=1c2ccccc2CC1C Amb21948330 [0,1,0,1,0,0|2,0,0]=4 10407 B12R2.18 CN1C(=C)Oc2ccccc12 Amb24102381 [0,1,0,1,0,0|2,0,0]=4 10408 B12R2.18 CN1C(=O)Cc2cc[n]cc12 Amb22491400 [0,1,0,1,0,0|2,0,0]=4 10409 B12R2.18 CN1C(=O)Cc2ccc[n]c12 Amb24334650 [0,1,0,1,0,0|2,0,0]=4 10410 B12R2.18 CN1C(=O)Nc2ccccc12 Amb18537193 [0,1,0,1,0,0|2,0,0]=4 10411 B12R2.18 CN1C(=O)Oc2ccc[n]c12 Amb18407346 [0,1,0,1,0,0|2,0,0]=4 10412 B12R2.18 CN1C(=O)Oc2ccccc12 Amb18043105 [0,1,0,1,0,0|1,0,0]=3 10413 B12R2.18 CN1C(=O)Sc2ccccc12 Amb19654015 [0,1,0,1,0,0|1,1,0]=4 10414 B12R2.18 CN1C(=S)Oc2ccccc12 Amb19664828 [0,1,0,1,0,0|1,1,0]=4 10415 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [0,1,0,1,0,0|1,0,1]=4 10416 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1O Amb25344981 [0,1,0,1,0,0|1,0,1]=4 10417 B12R2.18 C[C@@H]1[C@@H](O)Cc2ccccc21 Amb25176418 [0,1,0,1,0,0|1,0,1]=4 10418 B12R2.18 C[C@@H]1[C@H](O)Cc2ccccc21 Amb24546023 [0,1,0,1,0,0|1,0,1]=4 10419 B12R2.18 C[n+]1c(C)oc2c1cccc2 Amb10573332 [0,1,0,1,0,0|2,0,0]=4 10420 B12R2.18 Cc1c(Br)oc2ccccc21 Amb24451202 [0,1,0,1,0,0|1,0,1]=4 10421 B12R2.18 Cc1c(F)oc2ccccc21 Amb24084180 [0,1,0,1,0,0|1,0,1]=4 10422 B12R2.18 Cc1c(N)oc2ccccc21 Amb18202306 [0,1,0,1,0,0|1,0,1]=4 10423 B12R2.18 Cc1c(O)[nH]c2ccccc21 Amb25709196 [0,1,0,1,0,0|1,0,1]=4 10424 B12R2.18 Cc1c(O)[s]c2ccccc21 Amb24574173 [0,1,0,1,0,0|0,1,1]=4 10425 B12R2.18 Cc1oc2ccccc2c1Br Amb18773210 [0,1,0,1,0,0|1,0,1]=4 10426 B12R2.18 Cl[C@@H]1Oc2ccccc2[C@@H]1Cl Amb24563414 [0,1,0,1,0,0|1,0,1]=4 10427 B12R2.18 Cl[C@H]1Oc2ccccc2[C@@H]1Cl Amb25258397 [0,1,0,1,0,0|1,0,1]=4 10428 B12R2.18 Cl[C@H]1Oc2ccccc2[C@H]1Cl Amb24711440 [0,1,0,1,0,0|1,0,1]=4 10429 B12R2.18 Clc1c2ccccc2oc1Cl Amb25145878 [0,1,0,1,0,0|1,0,1]=4 10430 B12R2.18 Cn1c(=O)[nH]c2c1cccc2 Amb1159144 [0,1,0,1,0,0|2,0,0]=4 10431 B12R2.18 Cn1c(=O)oc2c1cccc2 Amb1905664 [0,1,0,1,0,0|1,0,0]=3 10432 B12R2.18 FC1Oc2ccccc2C1F Amb24101526 [0,1,0,1,0,0|1,0,1]=4 10433 B12R2.18 NC1=Nc2ccccc2C1=O Amb24078927 [0,1,0,1,0,0|2,0,0]=4 10434 B12R2.18 NC1C(=O)Nc2[n]cccc21 Amb22295971 [0,1,0,1,0,0|2,0,0]=4 10435 B12R2.18 NC1C(O)Nc2ccccc21 Amb25722216 [0,1,0,1,0,0|1,0,1]=4 10436 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [0,1,0,1,0,0|1,0,1]=4 10437 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [0,1,0,1,0,0|1,0,1]=4 10438 B12R2.18 NC1N2C=CC=CC2=NC1=O Amb17937478 [0,1,0,1,0,0|2,0,0]=4 10439 B12R2.18 NC1[C@H](O)Cc2ccccc21 Amb24401902 [0,1,0,1,0,0|1,0,1]=4 10440 B12R2.18 NN1C(=O)Nc2ccccc12 Amb18124952 [0,1,0,1,0,0|2,0,0]=4 10441 B12R2.18 NN1C(=O)Oc2ccccc12 Amb18644412 [0,1,0,1,0,0|1,0,0]=3 10442 B12R2.18 N[C@@H]1C(=O)Nc2ccccc21 Amb24554831 [0,1,0,1,0,0|1,0,0]=3 10443 B12R2.18 N[C@@H]1C(=O)Oc2ccccc21 Amb25324246 [0,1,0,1,0,0|0,0,0]=2 10444 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [0,1,0,1,0,0|1,0,1]=4 10445 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [0,1,0,1,0,0|1,0,1]=4 10446 B12R2.18 N[C@@H]1Cc2ccccc2C1O Amb25209005 [0,1,0,1,0,0|1,0,1]=4 10447 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [0,1,0,1,0,0|1,0,1]=4 10448 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [0,1,0,1,0,0|1,0,1]=4 10449 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [0,1,0,1,0,0|1,0,1]=4 10450 B12R2.18 N[C@@H]1[C@@H](O)Cc2c1cccc2 Amb10842191 [0,1,0,1,0,0|1,0,1]=4 10451 B12R2.18 N[C@@H]1[C@H](O)Cc2ccccc12 Amb17779311 [0,1,0,1,0,0|1,0,1]=4 10452 B12R2.18 N[C@H]1C(O)Cc2ccccc21 Amb24427360 [0,1,0,1,0,0|1,0,1]=4 10453 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [0,1,0,1,0,0|1,0,1]=4 10454 B12R2.18 N[C@H]1[C@H](O)Cc2c1cccc2 Amb10842210 [0,1,0,1,0,0|1,0,1]=4 10455 B12R2.18 Nc1[n]c2ccccc2[n]1O Amb24429903 [0,1,0,1,0,0|2,0,0]=4 10456 B12R2.18 O=C1C(=Nc2c1cccc2)Cl Amb17594117 [0,1,0,1,0,0|2,0,0]=4 10457 B12R2.18 O=C1C(=S)Nc2c1cccc2 Amb17594053 [0,1,0,1,0,0|1,1,0]=4 10458 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [0,1,0,1,0,0|1,0,1]=4 10459 B12R2.18 O=C1C(F)Cc2c1cccc2 Amb17593723 [0,1,0,1,0,0|1,0,1]=4 10460 B12R2.18 O=C1C(I)Cc2c1cccc2 Amb16232280 [0,1,0,1,0,0|1,0,1]=4 10461 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [0,1,0,1,0,0|1,0,1]=4 10462 B12R2.18 O=C1Cc2c(N1C)cccc2 Amb1398903 [0,1,0,1,0,0|1,0,0]=3 10463 B12R2.18 O=C1Cc2c(N1N)cccc2 Amb10560115 [0,1,0,1,0,0|1,0,0]=3 10464 B12R2.18 O=C1Cc2ccccc2C1Br Amb21987890 [0,1,0,1,0,0|1,0,0]=3 10465 B12R2.18 O=C1Cc2ccccc2C1F Amb25142685 [0,1,0,1,0,0|1,0,0]=3 10466 B12R2.18 O=C1Cc2ccccc2C1[Na] Amb24605330 [0,1,0,1,0,0|1,0,0]=3 10467 B12R2.18 O=C1Nc2c(C1Br)cccc2 Amb2228105 [0,1,0,1,0,0|1,0,0]=3 10468 B12R2.18 O=C1Nc2c(C1C)cccn2 Amb17617196 [0,1,0,1,0,0|2,0,0]=4 10469 B12R2.18 O=C1Nc2c(C1N)cccc2 Amb1052761 [0,1,0,1,0,0|1,0,0]=3 10470 B12R2.18 O=C1Nc2c(C1N)cccc2 Amb1154822 [0,1,0,1,0,0|1,0,0]=3 10471 B12R2.18 O=C1Oc2ccccc2C1Cl Amb25124107 [0,1,0,1,0,0|0,0,0]=2 10472 B12R2.18 O=C1[C@@H](Br)Cc2ccccc21 Amb24669064 [0,1,0,1,0,0|1,0,1]=4 10473 B12R2.18 O=C1[C@H](Br)Cc2ccccc21 Amb25827588 [0,1,0,1,0,0|1,0,1]=4 10474 B12R2.18 OC1C(=O)Oc2ccccc21 Amb24102222 [0,1,0,1,0,0|0,0,0]=2 10475 B12R2.18 OC1C(Br)Cc2c1cccc2 Amb1159074 [0,1,0,1,0,0|1,0,1]=4 10476 B12R2.18 OC1C(F)Cc2ccccc21 Amb24423988 [0,1,0,1,0,0|1,0,1]=4 10477 B12R2.18 OC1C(N)Cc2c1cccc2 Amb2383051 [0,1,0,1,0,0|1,0,1]=4 10478 B12R2.18 OC1Cc2ccccc2C1=O Amb25342077 [0,1,0,1,0,0|0,0,1]=3 10479 B12R2.18 OC1Cc2ccccc2C1Br Amb25785578 [0,1,0,1,0,0|1,0,1]=4 10480 B12R2.18 OC1Cc2ccccc2C1F Amb24672733 [0,1,0,1,0,0|1,0,1]=4 10481 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [0,1,0,1,0,0|0,0,2]=4 10482 B12R2.18 OC1Cc2ccccc2C1S Amb24430077 [0,1,0,1,0,0|0,1,1]=4 10483 B12R2.18 OC1Nc2ccccc2C1O Amb24090494 [0,1,0,1,0,0|1,0,1]=4 10484 B12R2.18 OC1Oc2ccccc2C1=O Amb24061518 [0,1,0,1,0,0|1,0,1]=4 10485 B12R2.18 ON1C(=O)Cc2ccc[n]c12 Amb24082462 [0,1,0,1,0,0|1,0,0]=3 10486 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [0,1,0,1,0,0|0,0,0]=2 10487 B12R2.18 ON1C(=O)Nc2cc[n]cc12 Amb24742462 [0,1,0,1,0,0|2,0,0]=4 10488 B12R2.18 ON1C(=O)Nc2ccc[n]c12 Amb24595260 [0,1,0,1,0,0|2,0,0]=4 10489 B12R2.18 ON1Nc2ccccc2C1=O Amb24078896 [0,1,0,1,0,0|2,0,0]=4 10490 B12R2.18 O[C@@H]1C(Br)Cc2ccccc21 Amb25061997 [0,1,0,1,0,0|1,0,1]=4 10491 B12R2.18 O[C@@H]1Cc2ccccc2C1=O Amb24725355 [0,1,0,1,0,0|0,0,1]=3 10492 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1Cl Amb24650956 [0,1,0,1,0,0|1,0,1]=4 10493 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1O Amb22800784 [0,1,0,1,0,0|0,0,2]=4 10494 B12R2.18 O[C@@H]1Oc2ccccc2[C@H]1O Amb25284399 [0,1,0,1,0,0|0,0,2]=4 10495 B12R2.18 O[C@@H]1Sc2ccccc2[C@@H]1O Amb25215688 [0,1,0,1,0,0|0,1,1]=4 10496 B12R2.18 O[C@@H]1[C@@H](F)Cc2ccccc21 Amb25200299 [0,1,0,1,0,0|1,0,1]=4 10497 B12R2.18 O[C@@H]1[C@H](F)Cc2ccccc21 Amb25176954 [0,1,0,1,0,0|1,0,1]=4 10498 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [0,1,0,1,0,0|1,0,0]=3 10499 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1Br Amb24682797 [0,1,0,1,0,0|1,0,1]=4 10500 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1F Amb25240021 [0,1,0,1,0,0|1,0,1]=4 10501 B12R2.18 O[C@H]1Cc2ccccc2[C@H]1O Amb22230411 [0,1,0,1,0,0|0,0,2]=4 10502 B12R2.18 O[C@H]1Sc2ccccc2[C@H]1O Amb25256602 [0,1,0,1,0,0|0,1,1]=4 10503 B12R2.18 O[C@H]1[C@H](Cl)Cc2ccccc21 Amb24519428 [0,1,0,1,0,0|1,0,1]=4 10504 B12R2.18 O[C@H]1[C@H](O)Cc2c1cccc2 Amb10982589 [0,1,0,1,0,0|0,0,2]=4 10505 B12R2.18 O[n]1c(Br)[n]c2ccccc12 Amb24472376 [0,1,0,1,0,0|2,0,0]=4 10506 B12R2.18 Oc1[s]c2ccccc2c1Cl Amb23590879 [0,1,0,1,0,0|0,1,1]=4 10507 B12R2.18 Oc1c(Br)[s]c2ccccc21 Amb25309520 [0,1,0,1,0,0|2,0,0]=4 10508 B12R2.18 Oc1c(S)[nH]c2ccccc21 Amb24085063 [0,1,0,1,0,0|1,1,0]=4 10509 B12R2.18 Oc1c(S)[s]c2ccccc21 Amb24518700 [0,1,0,1,0,0|1,1,0]=4 10510 B12R2.18 Oc1c2ccccc2oc1O Amb24060920 [0,1,0,1,0,0|0,0,2]=4 10511 B12R2.18 [NH3+][C@@H]1Cc2ccccc2[C@H]1O Amb22224837 [0,1,0,1,0,0|1,0,1]=4 10512 B12R2.23 BrC1COC1c2ccccc2 Amb24484887 [0,1,0,1,0,0|1,0,1]=4 10513 B12R2.23 Br[C@@H]1CO[C@H]1c2ccccc2 Amb25198843 [0,1,0,1,0,0|1,0,1]=4 10514 B12R2.23 O=C1CCC1c2ccc[n]c2 Amb24472315 [0,1,0,1,0,0|2,0,0]=4 10515 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|1,0,0]=3 10516 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,1,0,0|2,0,0]=4 10517 B12R2.23 O=C1CN=C1c2ccccc2 Amb25151517 [0,1,0,1,0,0|1,0,1]=4 10518 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [0,1,0,1,0,0|1,0,0]=3 10519 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|0,0,0]=2 10520 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,1,0,1,0,0|1,0,1]=4 10521 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,1,0,0|1,0,1]=4 10522 B12R2.23 O[C@@H]1CC[C@H]1c2ccccc2 Amb24620488 [0,1,0,1,0,0|1,0,1]=4 10523 B12R2.23 O[C@@H]1CS[C@H]1c2ccccc2 Amb25334761 [0,1,0,1,0,0|0,1,1]=4 10524 B12R2.23 O[C@H]1CS[C@H]1c2ccccc2 Amb25176781 [0,1,0,1,0,0|0,1,1]=4 10525 B12R2.2075 FC(C1CO1)c2ccccc2 Amb24611783 [0,1,0,1,0,0|1,0,1]=4 10526 B12R2.2075 O[C@@H]([C@H]1CO1)c2ccccc2 Amb24700386 [0,1,0,1,0,0|1,0,1]=4 10527 B12R2.2075 O[C@H]([C@@H]1CO1)c2ccccc2 Amb24718405 [0,1,0,1,0,0|1,0,1]=4 10528 B12R2.27 BrCC1OC1c2ccccc2 Amb25695964 [0,1,0,1,0,0|1,0,1]=4 10529 B12R2.27 BrC[C@@H]1O[C@@H]1c2ccccc2 Amb24540282 [0,1,0,1,0,0|1,0,1]=4 10530 B12R2.27 BrC[C@H]1O[C@@H]1c2ccccc2 Amb25287176 [0,1,0,1,0,0|1,0,1]=4 10531 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [0,1,0,1,0,0|1,0,1]=4 10532 B12R2.27 COC1OC1c2ccccc2 Amb24613179 [0,1,0,1,0,0|0,0,2]=4 10533 B12R2.27 ClCC1OC1c2ccccc2 Amb25169273 [0,1,0,1,0,0|1,0,1]=4 10534 B12R2.27 ClC[C@H]1O[C@@H]1c2ccccc2 Amb24568308 [0,1,0,1,0,0|1,0,1]=4 10535 B12R2.27 ClC[C@H]1O[C@H]1c2ccccc2 Amb24562256 [0,1,0,1,0,0|1,0,1]=4 10536 B12R2.27 N#CC1OC1c2ccccc2 Amb17593640 [0,1,0,1,0,0|1,0,1]=4 10537 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [0,1,0,1,0,0|1,0,1]=4 10538 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,1,0,1,0,0|1,0,1]=4 10539 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [0,1,0,1,0,0|1,0,1]=4 10540 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [0,1,0,1,0,0|0,0,1]=3 10541 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [0,1,0,1,0,0|1,0,1]=4 10542 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,1,0,1,0,0|1,0,1]=4 10543 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [0,1,0,1,0,0|1,0,1]=4 10544 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,1,0,1,0,0|1,0,1]=4 10545 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,1,0,1,0,0|0,0,2]=4 10546 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,1,0,1,0,0|0,0,2]=4 10547 B12R2.32 BrCC1Cc2c(O1)cccc2 Amb17040446 [0,1,0,1,0,0|1,0,1]=4 10548 B12R2.32 BrC[C@H]1Cc2ccccc2O1 Amb25695955 [0,1,0,1,0,0|1,0,1]=4 10549 B12R2.32 BrCc1[n]c2ccccc2o1 Amb21856130 [0,1,0,1,0,0|2,0,0]=4 10550 B12R2.32 C#Cc1cc2ccccc2o1 Amb22490055 [0,1,0,1,0,0|1,0,1]=4 10551 B12R2.32 C=Cc1[n]c2ccccc2o1 Amb24602813 [0,1,0,1,0,0|2,0,0]=4 10552 B12R2.32 C=Cc1cc2ccccc2o1 Amb24470459 [0,1,0,1,0,0|1,0,1]=4 10553 B12R2.32 CNc1nc2c(o1)cccc2 Amb1162733 [0,1,0,1,0,0|2,0,0]=4 10554 B12R2.32 COC1Cc2ccccc2O1 Amb24084536 [0,1,0,1,0,0|0,0,2]=4 10555 B12R2.32 COc1cc2c([nH]1)cccc2 Amb15690762 [0,1,0,1,0,0|1,0,1]=4 10556 B12R2.32 COc1cc2ccccc2[s]1 Amb25130500 [0,1,0,1,0,0|0,1,1]=4 10557 B12R2.32 CSC=1Cc2ccccc2N1 Amb24474025 [0,1,0,1,0,0|1,1,0]=4 10558 B12R2.32 CSc1cc2ccccc2o1 Amb24101348 [0,1,0,1,0,0|0,1,1]=4 10559 B12R2.32 ClCC=1Cc2ccccc2C1 Amb24359917 [0,1,0,1,0,0|2,0,0]=4 10560 B12R2.32 FCc1[n]c2ccccc2o1 Amb24101298 [0,1,0,1,0,0|2,0,0]=4 10561 B12R2.32 FCc1cc2ccccc2o1 Amb24627366 [0,1,0,1,0,0|1,0,1]=4 10562 B12R2.32 ICC1Cc2ccccc2O1 Amb23513694 [0,1,0,1,0,0|1,0,1]=4 10563 B12R2.32 ICc1[n]c2ccccc2o1 Amb25731165 [0,1,0,1,0,0|2,0,0]=4 10564 B12R2.32 N#CC1Cc2ccccc2O1 Amb24384661 [0,1,0,1,0,0|1,0,1]=4 10565 B12R2.32 N#CC=1Cc2ccccc2C1 Amb18643732 [0,1,0,1,0,0|2,0,0]=4 10566 B12R2.32 N#Cc1[n]c2ccccc2o1 Amb18644085 [0,1,0,1,0,0|2,0,0]=4 10567 B12R2.32 NCC1Cc2c(O1)cccc2 Amb1088943 [0,1,0,1,0,0|1,0,1]=4 10568 B12R2.32 NCC=1Cc2ccccc2C1 Amb25178878 [0,1,0,1,0,0|2,0,0]=4 10569 B12R2.32 NCc1nc2c(o1)cccc2 Amb1102725 [0,1,0,1,0,0|2,0,0]=4 10570 B12R2.32 NN=C1Cc2ccccc2C1 Amb25279861 [0,1,0,1,0,0|2,0,0]=4 10571 B12R2.32 NNC=1Cc2ccccc2N1 Amb18644335 [0,1,0,1,0,0|2,0,0]=4 10572 B12R2.32 NNc1nc2c(o1)cccc2 Amb1148180 [0,1,0,1,0,0|2,0,0]=4 10573 B12R2.32 NOc1[n]c2ccccc2[s]1 Amb24101178 [0,1,0,1,0,0|1,1,0]=4 10574 B12R2.32 NOc1cc2ccccc2o1 Amb24621929 [0,1,0,1,0,0|0,0,2]=4 10575 B12R2.32 O=CC1Cc2ccccc2C1 Amb18124789 [0,1,0,1,0,0|1,0,1]=4 10576 B12R2.32 O=CC=1Cc2ccccc2C1 Amb18644150 [0,1,0,1,0,0|1,0,0]=3 10577 B12R2.32 O=CC=1Cc2ccccc2N1 Amb24078943 [0,1,0,1,0,0|1,0,0]=3 10578 B12R2.32 O=Cc1[n]c2c[n]ccc2o1 Amb18831407 [0,1,0,1,0,0|2,0,0]=4 10579 B12R2.32 O=Cc1[n]c2cc[n]cc2o1 Amb18831409 [0,1,0,1,0,0|2,0,0]=4 10580 B12R2.32 O=Cc1[n]c2ccc[n]c2o1 Amb18831406 [0,1,0,1,0,0|2,0,0]=4 10581 B12R2.32 O=Cc1cc2[n]cccc2o1 Amb18124810 [0,1,0,1,0,0|1,0,1]=4 10582 B12R2.32 O=Cc1cc2c(o1)cccc2 Amb1156936 [0,1,0,1,0,0|0,0,1]=3 10583 B12R2.32 O=Cc1cc2c(s1)cccc2 Amb2447439 [0,1,0,1,0,0|0,1,1]=4 10584 B12R2.32 O=Cc1cc2c[n]ccc2o1 Amb18124811 [0,1,0,1,0,0|1,0,1]=4 10585 B12R2.32 O=Cc1cc2cc[n]cc2o1 Amb18644311 [0,1,0,1,0,0|1,0,1]=4 10586 B12R2.32 O=Cc1cc2ccc[n]c2o1 Amb18202346 [0,1,0,1,0,0|1,0,1]=4 10587 B12R2.32 O=Nc1[n]c2ccccc2[s]1 Amb24518886 [0,1,0,1,0,0|1,1,0]=4 10588 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [0,1,0,1,0,0|1,0,1]=4 10589 B12R2.32 OCC1Cc2ccccc2S1 Amb24513744 [0,1,0,1,0,0|0,1,1]=4 10590 B12R2.32 OCC=1Cc2ccccc2C1 Amb22494117 [0,1,0,1,0,0|1,0,0]=3 10591 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,1,0,1,0,0|1,0,1]=4 10592 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,1,0,1,0,0|1,0,1]=4 10593 B12R2.32 OCc1cc2c(o1)cccc2 Amb1156663 [0,1,0,1,0,0|0,0,2]=4 10594 B12R2.32 O\N=C/1\Cc2ccccc2O1 Amb24727728 [0,1,0,1,0,0|0,0,1]=3 10595 B12R2.32 SCc1[n]c2ccccc2o1 Amb25232011 [0,1,0,1,0,0|1,1,0]=4 10596 B12R2.32 [N-]=[N+]=C1Cc2ccccc2N1 Amb24651394 [0,1,0,1,0,0|2,0,0]=4 10597 B12R2.37 CC1=C(C1=O)c2ccccc2 Amb1914070 [0,1,0,1,0,0|1,0,1]=4 10598 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [0,1,0,1,0,0|1,0,1]=4 10599 B12R2.37 Cc1c(-c2ccccc2)c1=O Amb17917365 [0,1,0,1,0,0|1,0,1]=4 10600 B12R2.37 NC=1C(=O)C1c2ccccc2 Amb24509252 [0,1,0,1,0,0|1,0,1]=4 10601 B12R2.37 O=C1C(Cl)=C1c2ccccc2 Amb25759566 [0,1,0,1,0,0|1,0,1]=4 10602 B12R2.37 OC=1C(=O)C1c2ccccc2 Amb24631580 [0,1,0,1,0,0|0,0,1]=3 10603 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [0,1,0,1,0,0|1,0,1]=4 10604 B12R2.3511 COC(=O)C1c2ccccc21 Amb25270277 [0,1,0,1,0,0|0,0,0]=2 10605 B12R2.19 OC12CC(=O)OC1C=CC=C2 Amb24485854 [0,1,0,1,0,0|0,0,2]=4 10606 B12R2.95 O=P1(Cl)Oc2ccccc2O1 Amb22001051 [0,1,0,1,0,0|2,0,0]=4 10607 B12R2.95 O=S1(=O)Cc2ccccc2N1 Amb20623051 [0,1,0,1,0,0|1,0,1]=4 10608 B12R2.95 O=S1(=O)Oc2c(O1)cccc2 Amb2424595 [0,1,0,1,0,0|2,0,0]=4 10609 B12R2.95 OP1(=O)Oc2ccccc2O1 Amb24117135 [0,1,0,1,0,0|2,0,0]=4 10610 B12R2.115 CC1OC1c2ccccc2F Amb24433748 [0,1,0,1,0,0|1,0,1]=4 10611 B12R2.115 CC1OC1c2ccccc2O Amb24087256 [0,1,0,1,0,0|1,0,1]=4 10612 B12R2.115 Cc1ccccc1C2CC2O Amb24526800 [0,1,0,1,0,0|1,0,1]=4 10613 B12R2.202 Brc1[n]c2cccc(I)c2o1 Amb24615942 [0,1,0,1,0,0|2,0,0]=4 10614 B12R2.202 Brc1cccc2[n]c(I)oc21 Amb25267938 [0,1,0,1,0,0|2,0,0]=4 10615 B12R2.202 CC1=CC=CC2=CC(=O)CN21 Amb25152687 [0,1,0,1,0,0|2,0,0]=4 10616 B12R2.202 CC1=CC=CC2=CC(=O)N=C21 Amb22015159 [0,1,0,1,0,0|1,0,1]=4 10617 B12R2.202 CC1=CC=CC2=NC(=O)C=C21 Amb25760133 [0,1,0,1,0,0|1,0,1]=4 10618 B12R2.202 CC1=CC=CC2=NC(=O)CN21 Amb24071605 [0,1,0,1,0,0|2,0,0]=4 10619 B12R2.202 CC1=CC=CC2=NC(=O)N=C21 Amb24448904 [0,1,0,1,0,0|2,0,0]=4 10620 B12R2.202 CC1=CC=CN2CC(=O)N=C21 Amb24095324 [0,1,0,1,0,0|2,0,0]=4 10621 B12R2.202 CC1Cc2c(O)cccc2O1 Amb18125115 [0,1,0,1,0,0|1,0,1]=4 10622 B12R2.202 CC1Cc2c(O1)c(Cl)ccc2 Amb10610597 [0,1,0,1,0,0|1,0,1]=4 10623 B12R2.202 CC1Cc2cccc(N)c2O1 Amb18124986 [0,1,0,1,0,0|1,0,1]=4 10624 B12R2.202 CC=1Cc2c(Br)cccc2C1 Amb20171409 [0,1,0,1,0,0|2,0,0]=4 10625 B12R2.202 CC=1Cc2cccc(Br)c2C1 Amb22295787 [0,1,0,1,0,0|2,0,0]=4 10626 B12R2.202 CC=1Cc2cccc(Cl)c2C1 Amb19887828 [0,1,0,1,0,0|2,0,0]=4 10627 B12R2.202 CC=1Cc2cccc(N)c2C1 Amb25265228 [0,1,0,1,0,0|2,0,0]=4 10628 B12R2.202 Cc1[n]c2c(Br)cccc2o1 Amb24702542 [0,1,0,1,0,0|2,0,0]=4 10629 B12R2.202 Cc1[n]c2c(Cl)cccc2o1 Amb25188771 [0,1,0,1,0,0|2,0,0]=4 10630 B12R2.202 Cc1[n]c2c(F)cccc2o1 Amb25675736 [0,1,0,1,0,0|2,0,0]=4 10631 B12R2.202 Cc1[n]c2c(O)cccc2o1 Amb23590660 [0,1,0,1,0,0|2,0,0]=4 10632 B12R2.202 Cc1[n]c2c(S)cccc2o1 Amb25325158 [0,1,0,1,0,0|2,0,0]=4 10633 B12R2.202 Cc1[n]c2cccc(O)c2o1 Amb25773425 [0,1,0,1,0,0|2,0,0]=4 10634 B12R2.202 Cc1[n]ccc2CC(=O)Nc21 Amb24329967 [0,1,0,1,0,0|2,0,0]=4 10635 B12R2.202 Cc1[n]ccc2NC(=O)Cc21 Amb24329926 [0,1,0,1,0,0|2,0,0]=4 10636 B12R2.202 Cc1c[n]cc2NC(=O)Cc21 Amb24330039 [0,1,0,1,0,0|2,0,0]=4 10637 B12R2.202 Cc1cc2c(Br)cccc2o1 Amb18773209 [0,1,0,1,0,0|1,0,1]=4 10638 B12R2.202 Cc1cc2c(O)cccc2o1 Amb24402449 [0,1,0,1,0,0|1,0,1]=4 10639 B12R2.202 Cc1cc2c(o1)c(N)ccc2 Amb1084281 [0,1,0,1,0,0|1,0,1]=4 10640 B12R2.202 Cc1cc2cccc(Br)c2o1 Amb18176126 [0,1,0,1,0,0|1,0,1]=4 10641 B12R2.202 Cc1cc[n]c2CC(=O)Nc21 Amb19958798 [0,1,0,1,0,0|2,0,0]=4 10642 B12R2.202 Cc1cc[n]c2NC(=O)Cc21 Amb23437021 [0,1,0,1,0,0|2,0,0]=4 10643 B12R2.202 Cc1cc[n]c2OC(=O)Nc21 Amb18616372 [0,1,0,1,0,0|2,0,0]=4 10644 B12R2.202 Cc1cccc2CC(=O)Cc21 Amb24513885 [0,1,0,1,0,0|1,0,0]=3 10645 B12R2.202 Cc1cccc2CC(=O)Oc21 Amb24103832 [0,1,0,1,0,0|0,0,0]=2 10646 B12R2.202 Cc1cccc2CC(=O)Sc21 Amb24518980 [0,1,0,1,0,0|0,1,0]=3 10647 B12R2.202 Cc1cccc2CC(=S)Nc21 Amb24560964 [0,1,0,1,0,0|1,1,0]=4 10648 B12R2.202 Cc1cccc2CC(O)Oc21 Amb24358468 [0,1,0,1,0,0|0,0,2]=4 10649 B12R2.202 Cc1cccc2N=C(C)Cc12 Amb22503918 [0,1,0,1,0,0|2,0,0]=4 10650 B12R2.202 Cc1cccc2NC(=O)Cc21 Amb21963242 [0,1,0,1,0,0|1,0,0]=3 10651 B12R2.202 Cc1cccc2NC(=O)Nc21 Amb19895585 [0,1,0,1,0,0|2,0,0]=4 10652 B12R2.202 Cc1cccc2NC(=O)Oc21 Amb18046723 [0,1,0,1,0,0|1,0,0]=3 10653 B12R2.202 Cc1cccc2OC(=O)Nc21 Amb19895586 [0,1,0,1,0,0|1,0,0]=3 10654 B12R2.202 Cc1cccc2SC(=O)Cc21 Amb24743430 [0,1,0,1,0,0|0,1,0]=3 10655 B12R2.202 Cc1cccc2SC(=O)Nc21 Amb21858016 [0,1,0,1,0,0|1,1,0]=4 10656 B12R2.202 Cc1cccc2SC(=O)Oc21 Amb25201609 [0,1,0,1,0,0|1,0,0]=3 10657 B12R2.202 Cc1cccc2[nH]c(=O)[s]c21 Amb24092172 [0,1,0,1,0,0|1,1,0]=4 10658 B12R2.202 Cc1cccc2[n]c(Br)oc21 Amb25121995 [0,1,0,1,0,0|2,0,0]=4 10659 B12R2.202 Cc1cccc2[n]c([SH3])oc21 Amb18046734 [0,1,0,1,0,0|1,1,0]=4 10660 B12R2.202 Cc1cccc2[s]c(O)cc21 Amb25248933 [0,1,0,1,0,0|0,1,1]=4 10661 B12R2.202 Cc1cccc2cc(O)oc21 Amb25163540 [0,1,0,1,0,0|0,0,2]=4 10662 B12R2.202 Cc1cccc2oc(C)[n]c12 Amb22497198 [0,1,0,1,0,0|2,0,0]=4 10663 B12R2.202 Cc1cccc2oc(Cl)[n]c21 Amb18182661 [0,1,0,1,0,0|2,0,0]=4 10664 B12R2.202 Cc1cccc2oc(F)[n]c21 Amb25270379 [0,1,0,1,0,0|2,0,0]=4 10665 B12R2.202 Cc1nc2c(o1)c(Br)ccc2 Amb17571386 [0,1,0,1,0,0|2,0,0]=4 10666 B12R2.202 Cc1nc2c(o1)c(Cl)ccc2 Amb17570127 [0,1,0,1,0,0|2,0,0]=4 10667 B12R2.202 Cc1nc2c(o1)c(F)ccc2 Amb17570005 [0,1,0,1,0,0|2,0,0]=4 10668 B12R2.202 Cc1nc2c(o1)c(N)ccc2 Amb17052938 [0,1,0,1,0,0|2,0,0]=4 10669 B12R2.202 Cc1oc2c(n1)cccc2C Amb17569989 [0,1,0,1,0,0|2,0,0]=4 10670 B12R2.202 Clc1[n]c2c(Br)cccc2o1 Amb25311743 [0,1,0,1,0,0|2,0,0]=4 10671 B12R2.202 Clc1cccc2[n]c(Br)oc21 Amb25188551 [0,1,0,1,0,0|2,0,0]=4 10672 B12R2.202 Clc1cccc2[n]c(Cl)oc12 Amb22499645 [0,1,0,1,0,0|2,0,0]=4 10673 B12R2.202 Clc1cccc2oc(=O)[nH]c12 Amb17735125 [0,1,0,1,0,0|1,0,0]=3 10674 B12R2.202 Clc1cccc2oc(Cl)[n]c12 Amb24057288 [0,1,0,1,0,0|2,0,0]=4 10675 B12R2.202 Fc1[n]c2cccc(Br)c2o1 Amb24664605 [0,1,0,1,0,0|2,0,0]=4 10676 B12R2.202 Fc1cccc2[n]c(Br)oc21 Amb25071587 [0,1,0,1,0,0|2,0,0]=4 10677 B12R2.202 Fc1cccc2[n]c(Cl)oc21 Amb22499646 [0,1,0,1,0,0|2,0,0]=4 10678 B12R2.202 Fc1cccc2[n]c([SH3])oc21 Amb18547331 [0,1,0,1,0,0|1,1,0]=4 10679 B12R2.202 Fc1cccc2oc(Cl)[n]c21 Amb22371540 [0,1,0,1,0,0|2,0,0]=4 10680 B12R2.202 Fc1cccc2oc(S)[n]c21 Amb22551849 [0,1,0,1,0,0|1,1,0]=4 10681 B12R2.202 Ic1cccc2[n]c(I)oc12 Amb24727455 [0,1,0,1,0,0|2,0,0]=4 10682 B12R2.202 NC=1C=CNC2=NC(=O)CC21 Amb22752075 [0,1,0,1,0,0|2,0,0]=4 10683 B12R2.202 NC=1Cc2c(O)cccc2N1 Amb24078930 [0,1,0,1,0,0|2,0,0]=4 10684 B12R2.202 NC=1Cc2cccc(F)c2N1 Amb24078908 [0,1,0,1,0,0|2,0,0]=4 10685 B12R2.202 Nc1[n]c2c(Br)cccc2o1 Amb22497671 [0,1,0,1,0,0|2,0,0]=4 10686 B12R2.202 Nc1[n]c2c(Cl)cccc2o1 Amb22233876 [0,1,0,1,0,0|2,0,0]=4 10687 B12R2.202 Nc1[n]c2c(I)cccc2o1 Amb25847816 [0,1,0,1,0,0|2,0,0]=4 10688 B12R2.202 Nc1[n]c2c(O)cccc2o1 Amb22500282 [0,1,0,1,0,0|2,0,0]=4 10689 B12R2.202 Nc1[n]c2c(S)cccc2o1 Amb25365301 [0,1,0,1,0,0|2,0,0]=4 10690 B12R2.202 Nc1[n]c2cccc(I)c2o1 Amb25296218 [0,1,0,1,0,0|2,0,0]=4 10691 B12R2.202 Nc1[n]c2cccc(O)c2o1 Amb25832737 [0,1,0,1,0,0|2,0,0]=4 10692 B12R2.202 Nc1c[n]cc2NC(=O)Cc21 Amb24330062 [0,1,0,1,0,0|2,0,0]=4 10693 B12R2.202 Nc1cc2cccc(N)c2o1 Amb24093562 [0,1,0,1,0,0|1,0,1]=4 10694 B12R2.202 Nc1cc[n]c2CC(=O)Nc21 Amb24329904 [0,1,0,1,0,0|2,0,0]=4 10695 B12R2.202 Nc1cc[n]c2NC(=O)Oc21 Amb25351907 [0,1,0,1,0,0|2,0,0]=4 10696 B12R2.202 Nc1cccc2CC(=O)Cc21 Amb24672546 [0,1,0,1,0,0|1,0,0]=3 10697 B12R2.202 Nc1cccc2CC(=O)Nc21 Amb18202250 [0,1,0,1,0,0|1,0,0]=3 10698 B12R2.202 Nc1cccc2CC(O)Cc21 Amb19148550 [0,1,0,1,0,0|1,0,1]=4 10699 B12R2.202 Nc1cccc2C[C@@H](O)Cc21 Amb25840361 [0,1,0,1,0,0|1,0,1]=4 10700 B12R2.202 Nc1cccc2NC(=O)Cc21 Amb18124888 [0,1,0,1,0,0|1,0,0]=3 10701 B12R2.202 Nc1cccc2NC(=O)Nc21 Amb19516030 [0,1,0,1,0,0|2,0,0]=4 10702 B12R2.202 Nc1cccc2NC(=O)Nc21 Amb22275963 [0,1,0,1,0,0|2,0,0]=4 10703 B12R2.202 Nc1cccc2NC(=O)Oc21 Amb18363317 [0,1,0,1,0,0|1,0,0]=3 10704 B12R2.202 Nc1cccc2NC(=O)Sc21 Amb18827719 [0,1,0,1,0,0|1,1,0]=4 10705 B12R2.202 Nc1cccc2NC(=S)Oc21 Amb24356891 [0,1,0,1,0,0|1,1,0]=4 10706 B12R2.202 Nc1cccc2OC(=O)Nc21 Amb18626326 [0,1,0,1,0,0|1,0,0]=3 10707 B12R2.202 Nc1cccc2SC(=O)Nc21 Amb24742733 [0,1,0,1,0,0|1,1,0]=4 10708 B12R2.202 Nc1cccc2[n]c(Cl)oc21 Amb22500571 [0,1,0,1,0,0|2,0,0]=4 10709 B12R2.202 Nc1cccc2[n]c(I)oc21 Amb25223387 [0,1,0,1,0,0|2,0,0]=4 10710 B12R2.202 Nc1cccc2[n]c(N)oc12 Amb25769432 [0,1,0,1,0,0|2,0,0]=4 10711 B12R2.202 Nc1cccc2oc(Cl)[n]c21 Amb22500572 [0,1,0,1,0,0|2,0,0]=4 10712 B12R2.202 Nc1cccc2oc(N)[n]c12 Amb25840529 [0,1,0,1,0,0|2,0,0]=4 10713 B12R2.202 Nc1nc2c(o1)c(Br)ccc2 Amb17571410 [0,1,0,1,0,0|2,0,0]=4 10714 B12R2.202 Nc1nc2c(o1)c(C)ccc2 Amb17569995 [0,1,0,1,0,0|2,0,0]=4 10715 B12R2.202 Nc1nc2c(o1)c(Cl)ccc2 Amb12805626 [0,1,0,1,0,0|2,0,0]=4 10716 B12R2.202 Nc1nc2c(o1)c(F)ccc2 Amb17570011 [0,1,0,1,0,0|2,0,0]=4 10717 B12R2.202 Nc1oc2c(n1)c(C)ccc2 Amb10608515 [0,1,0,1,0,0|2,0,0]=4 10718 B12R2.202 O=C1C=C2C(F)=CC=CC2=N1 Amb19958328 [0,1,0,1,0,0|1,0,1]=4 10719 B12R2.202 O=C1C=C2C=CC=C(F)C2=N1 Amb25719420 [0,1,0,1,0,0|1,0,1]=4 10720 B12R2.202 O=C1CC2=C(C=CCC2=O)N1 Amb24651436 [0,1,0,1,0,0|1,0,1]=4 10721 B12R2.202 O=C1CC=2C=CCC(=O)C2N1 Amb24574298 [0,1,0,1,0,0|1,0,1]=4 10722 B12R2.202 O=C1Cc2[n]ccc(Br)c2N1 Amb23437024 [0,1,0,1,0,0|2,0,0]=4 10723 B12R2.202 O=C1Cc2[n]ccc(Cl)c2N1 Amb23437025 [0,1,0,1,0,0|2,0,0]=4 10724 B12R2.202 O=C1Cc2c(Br)[n]ccc2N1 Amb24329985 [0,1,0,1,0,0|2,0,0]=4 10725 B12R2.202 O=C1Cc2c(Br)c[n]cc2N1 Amb19958993 [0,1,0,1,0,0|2,0,0]=4 10726 B12R2.202 O=C1Cc2c(Br)cccc2O1 Amb25692291 [0,1,0,1,0,0|0,0,0]=2 10727 B12R2.202 O=C1Cc2c(C1)cccc2Br Amb10842164 [0,1,0,1,0,0|1,0,0]=3 10728 B12R2.202 O=C1Cc2c(C1)cccc2Cl Amb15692714 [0,1,0,1,0,0|1,0,0]=3 10729 B12R2.202 O=C1Cc2c(Cl)[n]ccc2N1 Amb24329981 [0,1,0,1,0,0|2,0,0]=4 10730 B12R2.202 O=C1Cc2c(Cl)c[n]cc2N1 Amb23437353 [0,1,0,1,0,0|2,0,0]=4 10731 B12R2.202 O=C1Cc2c(Cl)cccc2O1 Amb25325237 [0,1,0,1,0,0|0,0,0]=2 10732 B12R2.202 O=C1Cc2c(F)[n]ccc2N1 Amb24329947 [0,1,0,1,0,0|2,0,0]=4 10733 B12R2.202 O=C1Cc2c(F)c[n]cc2N1 Amb23437348 [0,1,0,1,0,0|2,0,0]=4 10734 B12R2.202 O=C1Cc2c(F)cc[n]c2N1 Amb19958779 [0,1,0,1,0,0|2,0,0]=4 10735 B12R2.202 O=C1Cc2c(I)cc[n]c2N1 Amb22008638 [0,1,0,1,0,0|2,0,0]=4 10736 B12R2.202 O=C1Cc2c(N1)c(Br)ccc2 Amb10068560 [0,1,0,1,0,0|1,0,0]=3 10737 B12R2.202 O=C1Cc2c[n]cc(Br)c2N1 Amb23439519 [0,1,0,1,0,0|2,0,0]=4 10738 B12R2.202 O=C1Cc2cc[n]c(Br)c2N1 Amb23437352 [0,1,0,1,0,0|2,0,0]=4 10739 B12R2.202 O=C1Cc2cc[n]c(Cl)c2N1 Amb23437351 [0,1,0,1,0,0|2,0,0]=4 10740 B12R2.202 O=C1Cc2cc[n]c(F)c2N1 Amb24330029 [0,1,0,1,0,0|2,0,0]=4 10741 B12R2.202 O=C1Cc2cccc(F)c2C1 Amb20241287 [0,1,0,1,0,0|1,0,0]=3 10742 B12R2.202 O=C1Cc2cccc(I)c2N1 Amb22044237 [0,1,0,1,0,0|1,0,0]=3 10743 B12R2.202 O=C1Nc2c(Br)[n]ccc2O1 Amb23400098 [0,1,0,1,0,0|2,0,0]=4 10744 B12R2.202 O=C1Nc2c(Br)cccc2S1 Amb21856963 [0,1,0,1,0,0|1,1,0]=4 10745 B12R2.202 O=C1Nc2c(C1)c(Br)ccc2 Amb2455680 [0,1,0,1,0,0|1,0,0]=3 10746 B12R2.202 O=C1Nc2c(C1)c(Br)ccn2 Amb10602621 [0,1,0,1,0,0|2,0,0]=4 10747 B12R2.202 O=C1Nc2c(C1)c(Cl)ccc2 Amb2429960 [0,1,0,1,0,0|1,0,0]=3 10748 B12R2.202 O=C1Nc2c(C1)c(Cl)ccn2 Amb10602653 [0,1,0,1,0,0|2,0,0]=4 10749 B12R2.202 O=C1Nc2c(C1)c(I)ccc2 Amb10975741 [0,1,0,1,0,0|1,0,0]=3 10750 B12R2.202 O=C1Nc2c(Cl)cccc2S1 Amb20240721 [0,1,0,1,0,0|1,1,0]=4 10751 B12R2.202 O=C1Nc2c(Cl)cccc2S1 Amb22343827 [0,1,0,1,0,0|1,1,0]=4 10752 B12R2.202 O=C1Nc2c(F)cccc2O1 Amb24056004 [0,1,0,1,0,0|1,0,0]=3 10753 B12R2.202 O=C1Nc2c(F)cccc2S1 Amb21864813 [0,1,0,1,0,0|1,1,0]=4 10754 B12R2.202 O=C1Nc2cccc(Br)c2N1 Amb23412383 [0,1,0,1,0,0|2,0,0]=4 10755 B12R2.202 O=C1Nc2cccc(Br)c2O1 Amb18046774 [0,1,0,1,0,0|1,0,0]=3 10756 B12R2.202 O=C1Nc2cccc(Br)c2S1 Amb21857452 [0,1,0,1,0,0|1,1,0]=4 10757 B12R2.202 O=C1Nc2cccc(Cl)c2O1 Amb18547329 [0,1,0,1,0,0|1,0,0]=3 10758 B12R2.202 O=C1Nc2cccc(Cl)c2S1 Amb22233980 [0,1,0,1,0,0|1,1,0]=4 10759 B12R2.202 O=C1Nc2cccc(F)c2N1 Amb20668116 [0,1,0,1,0,0|2,0,0]=4 10760 B12R2.202 O=C1Nc2cccc(F)c2O1 Amb18046724 [0,1,0,1,0,0|1,0,0]=3 10761 B12R2.202 O=C1Nc2cccc(F)c2S1 Amb23412133 [0,1,0,1,0,0|1,1,0]=4 10762 B12R2.202 O=c1[nH]c2cccc(I)c2[nH]1 Amb24082441 [0,1,0,1,0,0|2,0,0]=4 10763 B12R2.202 O=c1on2c(n1)cccc2C Amb10565835 [0,1,0,1,0,0|2,0,0]=4 10764 B12R2.202 OC1Cc2cccc(Br)c2C1 Amb22749195 [0,1,0,1,0,0|1,0,1]=4 10765 B12R2.202 Oc1[nH]c2c(S)cccc2[n]1 Amb25219058 [0,1,0,1,0,0|2,0,0]=4 10766 B12R2.202 Oc1[nH]c2cccc(Cl)c2[n]1 Amb23448520 [0,1,0,1,0,0|2,0,0]=4 10767 B12R2.202 Oc1[nH]c2cccc(F)c2[n]1 Amb22059591 [0,1,0,1,0,0|2,0,0]=4 10768 B12R2.202 Oc1[n]ccc2CC(=O)Nc21 Amb24329999 [0,1,0,1,0,0|2,0,0]=4 10769 B12R2.202 Oc1[n]ccc2NC(=O)Cc21 Amb24329937 [0,1,0,1,0,0|2,0,0]=4 10770 B12R2.202 Oc1cc2c(Br)cccc2[nH]1 Amb25281822 [0,1,0,1,0,0|1,0,1]=4 10771 B12R2.202 Oc1cc2cccc(Cl)c2o1 Amb25303909 [0,1,0,1,0,0|0,0,2]=4 10772 B12R2.202 Oc1cc[n]c2CC(=O)Nc21 Amb24330172 [0,1,0,1,0,0|2,0,0]=4 10773 B12R2.202 Oc1cc[n]c2NC(=O)Cc21 Amb24082481 [0,1,0,1,0,0|2,0,0]=4 10774 B12R2.202 Oc1cccc2CC(=O)Cc21 Amb18124871 [0,1,0,1,0,0|1,0,0]=3 10775 B12R2.202 Oc1cccc2CC(=O)Nc21 Amb23571286 [0,1,0,1,0,0|1,0,0]=3 10776 B12R2.202 Oc1cccc2CC(=O)Oc21 Amb25838761 [0,1,0,1,0,0|0,0,0]=2 10777 B12R2.202 Oc1cccc2CC(O)Cc12 Amb25838763 [0,1,0,1,0,0|1,0,1]=4 10778 B12R2.202 Oc1cccc2NC(=O)Nc21 Amb22755775 [0,1,0,1,0,0|2,0,0]=4 10779 B12R2.202 Oc1cccc2NC(=O)Sc21 Amb25223233 [0,1,0,1,0,0|1,1,0]=4 10780 B12R2.202 Oc1cccc2OC(=O)Cc21 Amb18125056 [0,1,0,1,0,0|0,0,0]=2 10781 B12R2.202 Oc1cccc2OC(=O)Oc21 Amb24377062 [0,1,0,1,0,0|1,0,0]=3 10782 B12R2.202 Oc1cccc2OC(=O)Sc21 Amb21972556 [0,1,0,1,0,0|1,0,0]=3 10783 B12R2.202 Oc1cccc2OC(=S)Nc21 Amb20242193 [0,1,0,1,0,0|1,1,0]=4 10784 B12R2.202 Oc1cccc2OS(=O)Oc21 Amb25713661 [0,1,0,1,0,0|2,0,0]=4 10785 B12R2.202 Oc1cccc2[nH]c(=O)oc21 Amb24092113 [0,1,0,1,0,0|1,0,0]=3 10786 B12R2.202 Oc1cccc2[n]c(F)oc21 Amb24628075 [0,1,0,1,0,0|2,0,0]=4 10787 B12R2.202 Oc1cccc2[s]c(O)[n]c12 Amb23400021 [0,1,0,1,0,0|1,1,0]=4 10788 B12R2.202 Oc1cccc2cc(Cl)oc21 Amb24628355 [0,1,0,1,0,0|1,0,1]=4 10789 B12R2.202 Oc1cccc2oc(=O)[nH]c21 Amb24070358 [0,1,0,1,0,0|1,0,0]=3 10790 B12R2.202 Oc1cccc2oc(=S)[nH]c12 Amb17935908 [0,1,0,1,0,0|1,1,0]=4 10791 B12R2.202 Oc1cccc2oc(Cl)cc21 Amb24743824 [0,1,0,1,0,0|1,0,1]=4 10792 B12R2.202 Oc1cccc2oc(I)[n]c21 Amb24591035 [0,1,0,1,0,0|2,0,0]=4 10793 B12R2.202 S=C1Nc2c(I)cccc2O1 Amb25242819 [0,1,0,1,0,0|1,1,0]=4 10794 B12R2.202 S=C1Nc2cccc(Cl)c2O1 Amb22347784 [0,1,0,1,0,0|1,1,0]=4 10795 B12R2.202 Sc1nc2c(o1)c(Br)ccc2 Amb17572352 [0,1,0,1,0,0|1,1,0]=4 10796 B12R2.202 Sc1nc2c(o1)c(C)ccc2 Amb17570121 [0,1,0,1,0,0|1,1,0]=4 10797 B12R2.202 Sc1nc2c(o1)c(Cl)ccc2 Amb17570425 [0,1,0,1,0,0|1,1,0]=4 10798 B12R2.202 Sc1nc2c(o1)c(F)ccc2 Amb17570144 [0,1,0,1,0,0|1,1,0]=4 10799 B12R2.202 Sc1oc2c(n1)c(C)ccc2 Amb16187018 [0,1,0,1,0,0|1,1,0]=4 10800 B12R2.202 [SH3]c1[n]c2cccc(Br)c2o1 Amb18046797 [0,1,0,1,0,0|1,1,0]=4 10801 B12R2.202 [SH3]c1[n]c2cccc(Cl)c2o1 Amb18046760 [0,1,0,1,0,0|1,1,0]=4 10802 B12R2.225 Cc1ccccc1CC2CO2 Amb25122222 [0,1,0,1,0,0|1,0,1]=4 10803 B12R2.225 Clc1ccccc1CC2CO2 Amb25094935 [0,1,0,1,0,0|1,0,1]=4 10804 B12R2.225 Oc1ccccc1CC2CO2 Amb24364096 [0,1,0,1,0,0|1,0,1]=4 10805 B12R2.225 Oc1ccccc1C[C@@H]2CO2 Amb24724020 [0,1,0,1,0,0|1,0,1]=4 10806 B12R2.80 CC1OC1c2cc(Br)ccc2 Amb24731635 [0,1,0,1,0,0|1,0,1]=4 10807 B12R2.80 CC1OC1c2cc(F)ccc2 Amb25114831 [0,1,0,1,0,0|1,0,1]=4 10808 B12R2.80 CC1OC1c2cccc(c2)Cl Amb1138203 [0,1,0,1,0,0|1,0,1]=4 10809 B12R2.80 Cc1cccc(c1)C2OC2C Amb25131968 [0,1,0,1,0,0|1,0,1]=4 10810 B12R2.80 Clc1cccc(c1)C2OC2Cl Amb24441572 [0,1,0,1,0,0|1,0,1]=4 10811 B12R2.80 Clc1cccc(c1)[C@@H]2O[C@H]2Cl Amb25179053 [0,1,0,1,0,0|1,0,1]=4 10812 B12R2.80 OC1CC1c2cc(F)ccc2 Amb24756969 [0,1,0,1,0,0|1,0,1]=4 10813 B12R2.1095 CC1(O)Cc2cccc(Br)c12 Amb24509611 [0,1,0,1,0,0|1,0,1]=4 10814 B12R2.1095 CC1(O)Cc2cccc(Cl)c12 Amb17844001 [0,1,0,1,0,0|1,0,1]=4 10815 B12R2.1095 CC1(O)Cc2cccc(F)c12 Amb24485933 [0,1,0,1,0,0|1,0,1]=4 10816 B12R2.1286 Fc1cc(CC2CO2)ccc1 Amb24558530 [0,1,0,1,0,0|1,0,1]=4 10817 B12R3.12 c1ccc2c(c1)C3OC3C2 Amb1131588 [0,0,0,2,0,0|1,0,1]=4 10818 B12R3.1612 C1c2cc3c1c[n]cc3o2 Amb24061004 [0,0,0,2,0,0|2,0,0]=4 10819 B8R0.8 C=C(CCC=C)C(O)=O Amb18642395 [0,0,1,0,1,0|0,0,2]=4 10820 B8R0.8 C=C(C\C=C/Cl)C(O)=O Amb24462692 [0,0,1,0,1,0|1,0,1]=4 10821 B8R0.8 C=C(C\C=C\Cl)C(O)=O Amb25174909 [0,0,1,0,1,0|1,0,1]=4 10822 B8R0.8 C=C\C=C\C(N)C(O)=O Amb24476635 [0,0,1,0,1,0|1,0,1]=4 10823 B8R0.8 C\C(=C/C=C/C)\C(O)=O Amb18642423 [0,0,1,0,1,0|0,0,2]=4 10824 B8R0.8 C\C(=C/CC=C)\C(O)=O Amb18642394 [0,0,1,0,1,0|0,0,2]=4 10825 B8R0.8 C\C(=C\CC=C)\C(O)=O Amb25264925 [0,0,1,0,1,0|0,0,2]=4 10826 B8R0.8 C\C=C\C=C(Br)C(O)=O Amb25294936 [0,0,1,0,1,0|1,0,1]=4 10827 B8R0.8 C\C=C\C=C(Cl)C(O)=O Amb25259369 [0,0,1,0,1,0|1,0,1]=4 10828 B8R0.8 C\C=C\C=C(F)C(O)=O Amb24514833 [0,0,1,0,1,0|1,0,1]=4 10829 B8R0.8 C\C=C\C=C(O)C(O)=O Amb24550203 [0,0,1,0,1,0|1,0,1]=4 10830 B8R0.8 OC(=O)C(=O)\C=C\C=O Amb24392793 [0,0,1,0,1,0|2,0,0]=4 10831 B8R0.15 C=CCC(=C=C)C(O)=O Amb25666226 [0,0,1,0,1,0|0,0,2]=4 10832 B8R0.15 C=CC\C(=C/Cl)\C(O)=O Amb24409542 [0,0,1,0,1,0|1,0,1]=4 10833 B8R0.15 C=C\C(=C/C=O)\C(O)=O Amb25103697 [0,0,1,0,1,0|1,0,0]=3 10834 B8R0.15 C\C=C(\CC=C)/C(O)=O Amb25304688 [0,0,1,0,1,0|0,0,2]=4 10835 B8R1.8 C=CCc1c[nH]cc1 Amb24426386 [1,0,0,0,1,0|2,0,0]=4 10836 B8R1.8 C=CCc1ccc[nH]1 Amb25075519 [1,0,0,0,1,0|2,0,0]=4 10837 B8R1.8 C=CCc1cocc1 Amb24729373 [1,0,0,0,1,0|2,0,0]=4 10838 B8R1.8 O=CC[n]1c[n]cc1 Amb24580294 [1,0,0,0,1,0|2,0,0]=4 10839 B8R1.8 O=CC[n]1cccc1 Amb18203408 [1,0,0,0,1,0|1,0,0]=3 10840 B8R1.8 O=CCc1c[nH][n]c1 Amb25216022 [1,0,0,0,1,0|2,0,0]=4 10841 B8R1.8 O=CCc1c[nH]c[n]1 Amb18124130 [1,0,0,0,1,0|2,0,0]=4 10842 B8R1.8 O=CCc1c[n]co1 Amb24653904 [1,0,0,0,1,0|2,0,0]=4 10843 B8R1.8 O=CCc1c[n]oc1 Amb24502003 [1,0,0,0,1,0|2,0,0]=4 10844 B8R1.8 O=CCc1c[s]c[n]1 Amb24469342 [1,0,0,0,1,0|2,0,0]=4 10845 B8R1.8 O=CCc1ccc[nH]1 Amb24763675 [1,0,0,0,1,0|1,0,0]=3 10846 B8R1.8 O=CCc1ccco1 Amb17089526 [1,0,0,0,1,0|1,0,0]=3 10847 B8R1.8 O=CCc1cccs1 Amb17089527 [1,0,0,0,1,0|1,0,0]=3 10848 B8R1.8 O=CCc1cocc1 Amb18641576 [1,0,0,0,1,0|1,0,0]=3 10849 B8R1.8 O=COc1ccc[nH]1 Amb24756546 [1,0,0,0,1,0|2,0,0]=4 10850 B8R1.8 OCCC1=CCC=C1 Amb25700126 [1,0,0,0,1,0|0,0,2]=4 10851 B8R1.8 OCCC1C=CC=C1 Amb25356398 [1,0,0,0,1,0|0,0,2]=4 10852 B8R1.8 OCCC=1CC=CC1 Amb25795365 [1,0,0,0,1,0|0,0,2]=4 10853 B8R1.8 OCCc1c[nH]cc1 Amb18860246 [1,0,0,0,1,0|1,0,1]=4 10854 B8R1.8 OCCc1ccc[nH]1 Amb17593146 [1,0,0,0,1,0|1,0,1]=4 10855 B8R1.8 OCCc1ccco1 Amb17089516 [1,0,0,0,1,0|1,0,1]=4 10856 B8R1.8 OCCc1cccs1 Amb2099445 [1,0,0,0,1,0|1,0,1]=4 10857 B8R1.8 OCCc1cocc1 Amb25802261 [1,0,0,0,1,0|1,0,1]=4 10858 B8R1.8 ONCc1c[nH]cc1 Amb25677397 [1,0,0,0,1,0|2,0,0]=4 10859 B8R1.8 ONCc1ccc[nH]1 Amb25071150 [1,0,0,0,1,0|2,0,0]=4 10860 B8R1.8 ONCc1ccc[s]1 Amb23449451 [1,0,0,0,1,0|2,0,0]=4 10861 B8R1.8 ONCc1ccco1 Amb23449450 [1,0,0,0,1,0|2,0,0]=4 10862 B8R1.7 C=C(O)c1ccc[s]1 Amb24061433 [0,0,0,0,2,0|2,0,0]=4 10863 B8R1.7 CC(=O)C1=C[CH-]C=C1 Amb2227554 [0,0,0,0,2,0|1,0,1]=4 10864 B8R1.7 CC(=O)C1C=CC=C1 Amb25358886 [0,0,0,0,2,0|1,0,1]=4 10865 B8R1.7 CC(=O)C=1C=CCC1 Amb24334264 [0,0,0,0,2,0|1,0,1]=4 10866 B8R1.7 CC(=O)c1ccc[nH]1 Amb1151321 [0,0,0,0,2,0|2,0,0]=4 10867 B8R1.7 CC(=O)c1ccc[se]1 Amb17673999 [0,0,0,0,2,0|2,0,0]=4 10868 B8R1.7 CC(=O)c1cocc1 Amb2440799 [0,0,0,0,2,0|2,0,0]=4 10869 B8R1.7 CC(C)=C1C=CC=C1 Amb22043296 [0,0,0,0,2,0|2,0,0]=4 10870 B8R1.7 ClC(=O)c1cccs1 Amb1157175 [0,0,0,0,2,0|2,0,0]=4 10871 B8R1.7 ClC(=O)n1cccc1 Amb17938699 [0,0,0,0,2,0|2,0,0]=4 10872 B8R1.7 NC(=O)c1cc[nH]c1 Amb18893397 [0,0,0,0,2,0|2,0,0]=4 10873 B8R1.7 NC(=O)c1ccc[nH]1 Amb10068201 [0,0,0,0,2,0|2,0,0]=4 10874 B8R1.7 NC(=O)n1cccc1 Amb17938700 [0,0,0,0,2,0|2,0,0]=4 10875 B8R1.7 O=C(Br)c1cc[s]c1 Amb24062599 [0,0,0,0,2,0|2,0,0]=4 10876 B8R1.7 O=C(Br)c1ccc[nH]1 Amb24465473 [0,0,0,0,2,0|2,0,0]=4 10877 B8R1.7 O=C(Br)c1ccco1 Amb24093659 [0,0,0,0,2,0|2,0,0]=4 10878 B8R1.7 O=C(Cl)c1ccc[nH]1 Amb24090836 [0,0,0,0,2,0|2,0,0]=4 10879 B8R1.7 O=C(F)c1ccco1 Amb25223795 [0,0,0,0,2,0|2,0,0]=4 10880 B8R1.7 O=C(F)c1ccoc1 Amb24579234 [0,0,0,0,2,0|2,0,0]=4 10881 B8R1.7 OC(=O)C1=CC=CC1 Amb10574923 [0,0,0,0,2,0|0,0,1]=3 10882 B8R1.7 OC(=O)C=1C=CCN1 Amb25178644 [0,0,0,0,2,0|1,0,1]=4 10883 B8R1.7 OC(=O)C=1CC=CC1 Amb24553923 [0,0,0,0,2,0|0,0,1]=3 10884 B8R1.7 OC(=O)[n]1c[n]cc1 Amb19861089 [0,0,0,0,2,0|2,0,0]=4 10885 B8R1.7 OC(=O)c1[n]cco1 Amb22899196 [0,0,0,0,2,0|2,0,0]=4 10886 B8R1.7 OC(=O)c1c[nH]cn1 Amb1969735 [0,0,0,0,2,0|2,0,0]=4 10887 B8R1.7 OC(=O)c1c[nH]nc1 Amb10610070 [0,0,0,0,2,0|2,0,0]=4 10888 B8R1.7 OC(=O)c1c[nH]nc1 Amb1934821 [0,0,0,0,2,0|2,0,0]=4 10889 B8R1.7 OC(=O)c1c[s]c[n]1 Amb21953919 [0,0,0,0,2,0|2,0,0]=4 10890 B8R1.7 OC(=O)c1cc[nH]c1 Amb17942956 [0,0,0,0,2,0|1,0,0]=3 10891 B8R1.7 OC(=O)c1cc[s][n]1 Amb19894963 [0,0,0,0,2,0|2,0,0]=4 10892 B8R1.7 OC(=O)c1ccc[nH]1 Amb1154382 [0,0,0,0,2,0|1,0,0]=3 10893 B8R1.7 OC(=O)c1ccc[pH]1 Amb24690352 [0,0,0,0,2,0|1,0,0]=3 10894 B8R1.7 OC(=O)c1ccc[s]1 Amb22730855 [0,0,0,0,2,0|1,0,0]=3 10895 B8R1.7 OC(=O)c1ccn[nH]1 Amb1301347 [0,0,0,0,2,0|2,0,0]=4 10896 B8R1.7 OC(=O)c1ccno1 Amb1152220 [0,0,0,0,2,0|2,0,0]=4 10897 B8R1.7 OC(=O)c1ccns1 Amb1091955 [0,0,0,0,2,0|2,0,0]=4 10898 B8R1.7 OC(=O)c1cnco1 Amb1158212 [0,0,0,0,2,0|2,0,0]=4 10899 B8R1.7 OC(=O)c1cncs1 Amb1158214 [0,0,0,0,2,0|2,0,0]=4 10900 B8R1.7 OC(=O)c1cocn1 Amb10071584 [0,0,0,0,2,0|2,0,0]=4 10901 B8R1.7 OC(=O)c1cscc1 Amb1156673 [0,0,0,0,2,0|1,0,0]=3 10902 B8R1.7 OC(=O)c1cscn1 Amb17039667 [0,0,0,0,2,0|2,0,0]=4 10903 B8R1.7 OC(=O)c1cscn1 Amb2455731 [0,0,0,0,2,0|2,0,0]=4 10904 B8R1.7 OC(=S)[n]1cccc1 Amb24060867 [0,0,0,0,2,0|1,1,0]=4 10905 B8R1.7 OC(=S)c1ccco1 Amb20621386 [0,0,0,0,2,0|1,1,0]=4 10906 B8R1.7 OS(=O)c1c[nH]cc1 Amb18221892 [0,0,0,0,2,0|2,0,0]=4 10907 B8R1.7 OS(=O)c1ccc[nH]1 Amb24651386 [0,0,0,0,2,0|2,0,0]=4 10908 B8R1.7 OS(=O)c1ccc[s]1 Amb18063457 [0,0,0,0,2,0|2,0,0]=4 10909 B8R1.7 [O-]C(=O)c1ccco1 Amb22748857 [0,0,0,0,2,0|1,0,1]=4 10910 B8R1.7 [O-]C(=O)c1ccco1 Amb22753185 [0,0,0,0,2,0|1,0,1]=4 10911 B8R1.7 [O-]C(=O)c1cccs1 Amb10067272 [0,0,0,0,2,0|1,0,1]=4 10912 B8R1.7 [O-]C(=O)c1cccs1 Amb10071470 [0,0,0,0,2,0|1,0,1]=4 10913 B8R1.34 OC(=O)CC=1CCC1 Amb24397299 [0,0,0,0,2,0|0,0,2]=4 10914 B10R1.85 Cl\C=C\C=1CC=CC=CC1 Amb24529939 [1,0,0,0,0,1|1,0,1]=4 10915 B10R1.85 NCCC=1C=COC=CC1 Amb24615627 [1,0,0,0,0,1|1,0,1]=4 10916 B10R1.85 O=C=NC1=CC=CCC=C1 Amb25690426 [1,0,0,0,0,1|1,0,1]=4 10917 B10R1.85 O=C=NC1=CCC=CC=C1 Amb24381422 [1,0,0,0,0,1|1,0,1]=4 10918 B10R1.85 O=CC=C1C=CC=CC=C1 Amb24070046 [1,0,0,0,0,1|0,0,1]=3 10919 B10R1.85 O=CCC1C=CC=CC=C1 Amb24663757 [1,0,0,0,0,1|0,0,1]=3 10920 B10R1.85 OCCC1C=CC=CC=C1 Amb24469413 [1,0,0,0,0,1|0,0,2]=4 10921 B12R1.252 BrC(=C)CNCc1ccccc1 Amb1774594 [0,0,0,0,0,2|2,0,0]=4 10922 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,0,0,0,0,2|2,0,0]=4 10923 B12R1.252 C=C(Cl)CNCc1ccccc1 Amb19004833 [0,0,0,0,0,2|2,0,0]=4 10924 B12R1.252 C=C(F)CNCc1ccccc1 Amb25060778 [0,0,0,0,0,2|2,0,0]=4 10925 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [0,0,0,0,0,2|2,0,0]=4 10926 B12R1.252 CC(=C)CNCc1ccccc1 Amb10608684 [0,0,0,0,0,2|2,0,0]=4 10927 B12R1.252 CC(=C)CNCc1ccccc1 Amb17622487 [0,0,0,0,0,2|2,0,0]=4 10928 B12R1.252 CC(=N)NCCc1ccccc1 Amb25148437 [0,0,0,0,0,2|2,0,0]=4 10929 B12R1.252 CC(=O)C#CSc1ccccc1 Amb25767013 [0,0,0,0,0,2|1,0,1]=4 10930 B12R1.252 CC(=O)CCCc1cccc[n]1 Amb22284162 [0,0,0,0,0,2|2,0,0]=4 10931 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [0,0,0,0,0,2|2,0,0]=4 10932 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [0,0,0,0,0,2|2,0,0]=4 10933 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [0,0,0,0,0,2|1,0,0]=3 10934 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [0,0,0,0,0,2|1,0,0]=3 10935 B12R1.252 CC(=O)NCCc1cccc[n]1 Amb22751848 [0,0,0,0,0,2|2,0,0]=4 10936 B12R1.252 CC(=O)NCCc1ccncc1 Amb1066478 [0,0,0,0,0,2|2,0,0]=4 10937 B12R1.252 CC(=O)NOCc1ccc[n]c1 Amb24420633 [0,0,0,0,0,2|2,0,0]=4 10938 B12R1.252 CC(=O)NOCc1cccc[n]1 Amb25077790 [0,0,0,0,0,2|2,0,0]=4 10939 B12R1.252 CC(=O)NOCc1ccccc1 Amb10571914 [0,0,0,0,0,2|1,0,0]=3 10940 B12R1.252 CC(=O)OCOc1cccc[n]1 Amb24100497 [0,0,0,0,0,2|2,0,0]=4 10941 B12R1.252 CC(=O)O[Hg]Cc1ccccc1 Amb22347638 [0,0,0,0,0,2|1,0,0]=3 10942 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [0,0,0,0,0,2|1,0,1]=4 10943 B12R1.252 CC(=O)SCCc1ccccn1 Amb17619708 [0,0,0,0,0,2|2,0,0]=4 10944 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb10565265 [0,0,0,0,0,2|1,0,1]=4 10945 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb25735703 [0,0,0,0,0,2|1,0,1]=4 10946 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb25179518 [0,0,0,0,0,2|1,0,0]=3 10947 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [0,0,0,0,0,2|1,0,1]=4 10948 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb25179665 [0,0,0,0,0,2|1,0,1]=4 10949 B12R1.252 CC(=O)\C=N/Nc1ccccc1 Amb11012875 [0,0,0,0,0,2|1,0,1]=4 10950 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [0,0,0,0,0,2|1,0,1]=4 10951 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,0,0,0,0,2|2,0,0]=4 10952 B12R1.252 CC(C)=NNCc1ccccc1 Amb24421246 [0,0,0,0,0,2|2,0,0]=4 10953 B12R1.252 CC(CCCc1ccccc1)O Amb17138575 [0,0,0,0,0,2|1,0,1]=4 10954 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [0,0,0,0,0,2|1,0,1]=4 10955 B12R1.252 CC(O)CNNc1ccccc1 Amb24719484 [0,0,0,0,0,2|1,0,1]=4 10956 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb24645318 [0,0,0,0,0,2|1,0,1]=4 10957 B12R1.252 CC(O)C\N=N\c1ccccc1 Amb25855784 [0,0,0,0,0,2|1,0,1]=4 10958 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [0,0,0,0,0,2|2,0,0]=4 10959 B12R1.252 CS(=O)NOCc1ccccc1 Amb24620390 [0,0,0,0,0,2|2,0,0]=4 10960 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [0,0,0,0,0,2|1,0,1]=4 10961 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [0,0,0,0,0,2|1,0,1]=4 10962 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb25846224 [0,0,0,0,0,2|1,0,1]=4 10963 B12R1.252 C[C@@H](O)C\N=C\c1ccccc1 Amb25369326 [0,0,0,0,0,2|1,0,1]=4 10964 B12R1.252 C[C@H](O)CC#Cc1ccccc1 Amb24593809 [0,0,0,0,0,2|1,0,1]=4 10965 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [0,0,0,0,0,2|1,0,1]=4 10966 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb25080010 [0,0,0,0,0,2|1,0,1]=4 10967 B12R1.252 C[C@H](O)C\N=C\c1ccccc1 Amb24642411 [0,0,0,0,0,2|1,0,1]=4 10968 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [0,0,0,0,0,2|1,0,0]=3 10969 B12R1.252 ClC(Cl)=CCNc1ccccc1 Amb25160645 [0,0,0,0,0,2|2,0,0]=4 10970 B12R1.252 NC(=N)CNCc1ccccc1 Amb25031584 [0,0,0,0,0,2|2,0,0]=4 10971 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736089 [0,0,0,0,0,2|2,0,0]=4 10972 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736599 [0,0,0,0,0,2|2,0,0]=4 10973 B12R1.252 NC(=N)NNCc1ccccc1 Amb10553070 [0,0,0,0,0,2|2,0,0]=4 10974 B12R1.252 NC(=N)NNCc1ccccc1 Amb18563641 [0,0,0,0,0,2|2,0,0]=4 10975 B12R1.252 NC(=N)NOCc1ccccc1 Amb24651150 [0,0,0,0,0,2|2,0,0]=4 10976 B12R1.252 NC(=N)SCCc1ccccc1 Amb20675983 [0,0,0,0,0,2|2,0,0]=4 10977 B12R1.252 NC(=O)CCNc1ccc[n]c1 Amb25241565 [0,0,0,0,0,2|2,0,0]=4 10978 B12R1.252 NC(=O)CNCc1cccnc1 Amb10609111 [0,0,0,0,0,2|2,0,0]=4 10979 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [0,0,0,0,0,2|2,0,0]=4 10980 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [0,0,0,0,0,2|2,0,0]=4 10981 B12R1.252 NC(=O)C\C=C\c1ccccc1 Amb24470049 [0,0,0,0,0,2|1,0,0]=3 10982 B12R1.252 NC(=O)C\N=C\c1ccccc1 Amb24485689 [0,0,0,0,0,2|1,0,0]=3 10983 B12R1.252 NC(=O)NCCc1ccc[n]c1 Amb19515015 [0,0,0,0,0,2|2,0,0]=4 10984 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [0,0,0,0,0,2|1,0,0]=3 10985 B12R1.252 NC(=O)NCCc1ccncc1 Amb10553043 [0,0,0,0,0,2|2,0,0]=4 10986 B12R1.252 NC(=O)NN=Cc1ccccc1 Amb2389840 [0,0,0,0,0,2|1,0,1]=4 10987 B12R1.252 NC(=O)NNCc1ccccc1 Amb24063820 [0,0,0,0,0,2|1,0,0]=3 10988 B12R1.252 NC(=O)NOCc1cccc[n]1 Amb24343576 [0,0,0,0,0,2|2,0,0]=4 10989 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [0,0,0,0,0,2|1,0,0]=3 10990 B12R1.252 NC(=O)N\C=C\c1ccccc1 Amb25362141 [0,0,0,0,0,2|1,0,1]=4 10991 B12R1.252 NC(=O)N\N=N\c1ccccc1 Amb24417714 [0,0,0,0,0,2|2,0,0]=4 10992 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [0,0,0,0,0,2|1,0,0]=3 10993 B12R1.252 NC(=O)\C=N\Nc1ccccc1 Amb25241203 [0,0,0,0,0,2|1,0,1]=4 10994 B12R1.252 NC(=S)CCNc1ccccc1 Amb17233757 [0,0,0,0,0,2|1,1,0]=4 10995 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,0,0,0,0,2|1,1,0]=4 10996 B12R1.252 NC(=S)CNCc1ccccc1 Amb17233758 [0,0,0,0,0,2|1,1,0]=4 10997 B12R1.252 NC(=S)C\C=C\c1ccccc1 Amb25112081 [0,0,0,0,0,2|1,1,0]=4 10998 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [0,0,0,0,0,2|1,1,0]=4 10999 B12R1.252 NC(=S)NCSc1ccccc1 Amb25725067 [0,0,0,0,0,2|1,1,0]=4 11000 B12R1.252 NC(=S)NNCc1ccccc1 Amb2439185 [0,0,0,0,0,2|1,1,0]=4 11001 B12R1.252 N[13C](=O)N\N=C\c1ccccc1 Amb17608784 [0,0,0,0,0,2|1,0,1]=4 11002 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [0,0,0,0,0,2|1,0,0]=3 11003 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [0,0,0,0,0,2|1,0,0]=3 11004 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [0,0,0,0,0,2|1,0,0]=3 11005 B12R1.252 OB(O)CCCc1ccccc1 Amb21928056 [0,0,0,0,0,2|1,0,1]=4 11006 B12R1.252 OB(O)\C=C\Cc1ccccc1 Amb21856558 [0,0,0,0,0,2|1,0,1]=4 11007 B12R1.252 OC(=O)C#CCc1c[n]ccc1 Amb24684542 [0,0,0,0,0,2|1,0,0]=3 11008 B12R1.252 OC(=O)C#CCc1cc[n]cc1 Amb25299055 [0,0,0,0,0,2|1,0,0]=3 11009 B12R1.252 OC(=O)C#CCc1cccc[n]1 Amb25700659 [0,0,0,0,0,2|1,0,0]=3 11010 B12R1.252 OC(=O)C#COc1ccccc1 Amb24634223 [0,0,0,0,0,2|0,0,1]=3 11011 B12R1.252 OC(=O)C=C=Cc1ccccc1 Amb25102534 [0,0,0,0,0,2|0,0,1]=3 11012 B12R1.252 OC(=O)CC#Cc1c[n]ccc1 Amb25159668 [0,0,0,0,0,2|1,0,0]=3 11013 B12R1.252 OC(=O)CC#Cc1cc[n]cc1 Amb24423393 [0,0,0,0,0,2|1,0,0]=3 11014 B12R1.252 OC(=O)CC#Cc1ccccc1 Amb18296382 [0,0,0,0,0,2|0,0,0]=2 11015 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [0,0,0,0,0,2|0,0,0]=2 11016 B12R1.252 OC(=O)CCCc1[n]ccc[n]1 Amb18862661 [0,0,0,0,0,2|2,0,0]=4 11017 B12R1.252 OC(=O)CCCc1c[n]c[n]c1 Amb18827885 [0,0,0,0,0,2|2,0,0]=4 11018 B12R1.252 OC(=O)CCCc1cc[n]cc1 Amb19929548 [0,0,0,0,0,2|1,0,0]=3 11019 B12R1.252 OC(=O)CCCc1cccc[n]1 Amb19356883 [0,0,0,0,0,2|1,0,0]=3 11020 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [0,0,0,0,0,2|0,0,0]=2 11021 B12R1.252 OC(=O)CCCc1ccccn1 Amb1099328 [0,0,0,0,0,2|1,0,0]=3 11022 B12R1.252 OC(=O)CCCc1cccnc1 Amb17232526 [0,0,0,0,0,2|1,0,0]=3 11023 B12R1.252 OC(=O)CCCc1ccncc1 Amb1099336 [0,0,0,0,0,2|1,0,0]=3 11024 B12R1.252 OC(=O)CCNc1c[n]c[n]c1 Amb18933238 [0,0,0,0,0,2|2,0,0]=4 11025 B12R1.252 OC(=O)CCNc1cc[n]c[n]1 Amb19011486 [0,0,0,0,0,2|2,0,0]=4 11026 B12R1.252 OC(=O)CCNc1ccc[n]c1 Amb18269696 [0,0,0,0,0,2|1,0,0]=3 11027 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [0,0,0,0,0,2|0,0,0]=2 11028 B12R1.252 OC(=O)CCNc1ccccn1 Amb10609119 [0,0,0,0,0,2|1,0,0]=3 11029 B12R1.252 OC(=O)CCNc1ncccn1 Amb1109664 [0,0,0,0,0,2|2,0,0]=4 11030 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [0,0,0,0,0,2|0,0,0]=2 11031 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [0,0,0,0,0,2|0,0,0]=2 11032 B12R1.252 OC(=O)CCSc1ccccn1 Amb1133894 [0,0,0,0,0,2|1,0,0]=3 11033 B12R1.252 OC(=O)CNCc1c[n]cc[n]1 Amb19030033 [0,0,0,0,0,2|2,0,0]=4 11034 B12R1.252 OC(=O)CNCc1ccccn1 Amb1111426 [0,0,0,0,0,2|1,0,0]=3 11035 B12R1.252 OC(=O)CNCc1ccccn1 Amb13951702 [0,0,0,0,0,2|1,0,0]=3 11036 B12R1.252 OC(=O)CNCc1cccnc1 Amb1111197 [0,0,0,0,0,2|1,0,0]=3 11037 B12R1.252 OC(=O)CNCc1ccncc1 Amb1110916 [0,0,0,0,0,2|1,0,0]=3 11038 B12R1.252 OC(=O)CNNc1ccccc1 Amb25258415 [0,0,0,0,0,2|0,0,0]=2 11039 B12R1.252 OC(=O)COCc1ccncc1 Amb13883046 [0,0,0,0,0,2|1,0,0]=3 11040 B12R1.252 OC(=O)CONc1c[n]cc[n]1 Amb25237158 [0,0,0,0,0,2|2,0,0]=4 11041 B12R1.252 OC(=O)CONc1cc[n]c[n]1 Amb24623526 [0,0,0,0,0,2|2,0,0]=4 11042 B12R1.252 OC(=O)CONc1cccc[n]1 Amb24497875 [0,0,0,0,0,2|1,0,0]=3 11043 B12R1.252 OC(=O)CSCc1ccccn1 Amb1126746 [0,0,0,0,0,2|1,0,0]=3 11044 B12R1.252 OC(=O)CSCc1cccnc1 Amb1129471 [0,0,0,0,0,2|1,0,0]=3 11045 B12R1.252 OC(=O)CSCc1ccncc1 Amb1134758 [0,0,0,0,0,2|1,0,0]=3 11046 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [0,0,0,0,0,2|0,0,0]=2 11047 B12R1.252 OC(=O)C\C=C\c1cc[n]cc1 Amb24571194 [0,0,0,0,0,2|1,0,0]=3 11048 B12R1.252 OC(=O)C\C=C\c1cccc[n]1 Amb25073201 [0,0,0,0,0,2|1,0,0]=3 11049 B12R1.252 OC(=O)C\N=C/c1cc[n]cc1 Amb25273885 [0,0,0,0,0,2|1,0,0]=3 11050 B12R1.252 OC(=O)C\N=C\c1ccccc1 Amb24627161 [0,0,0,0,0,2|0,0,0]=2 11051 B12R1.252 OC(=O)\C=C\Cc1ccc[n]c1 Amb25849857 [0,0,0,0,0,2|1,0,0]=3 11052 B12R1.252 OC(=O)\C=C\Cc1cccc[n]1 Amb25696841 [0,0,0,0,0,2|1,0,0]=3 11053 B12R1.252 OC(=O)\C=C\Nc1ccccc1 Amb25315667 [0,0,0,0,0,2|0,0,1]=3 11054 B12R1.252 OC(=O)\C=C\Oc1ccccc1 Amb18645970 [0,0,0,0,0,2|0,0,1]=3 11055 B12R1.252 OC(=O)\C=C\Sc1cc[n]cc1 Amb25856304 [0,0,0,0,0,2|1,0,1]=4 11056 B12R1.252 OC(=O)\C=C\Sc1ccccc1 Amb1661597 [0,0,0,0,0,2|0,0,1]=3 11057 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [0,0,0,0,0,2|0,0,0]=2 11058 B12R1.252 OC(=O)\C=N/Nc1ccccc1 Amb24068313 [0,0,0,0,0,2|0,0,1]=3 11059 B12R1.252 OC(=O)\C=N\Nc1cccc[n]1 Amb24100362 [0,0,0,0,0,2|1,0,1]=4 11060 B12R1.252 OC(=O)\C=N\Nc1ccccc1 Amb17594064 [0,0,0,0,0,2|0,0,1]=3 11061 B12R1.252 [O-]C(=O)/C=C/Sc1ccccc1 Amb17913132 [0,0,0,0,0,2|0,0,2]=4 11062 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [0,0,0,0,0,2|0,0,1]=3 11063 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [0,0,0,0,0,2|0,0,1]=3 11064 B12R1.1392 NC(=O)CC=1C=CC=CC=CC1 Amb24607336 [0,0,0,0,0,2|1,0,0]=3 11065 B12R1.1392 NC(=O)\C=C\1/C=CC=CCC=C1 Amb24519387 [0,0,0,0,0,2|1,0,1]=4 11066 B12R1.1392 OC(=O)CC=1C=CC=CC=CC1 Amb24740143 [0,0,0,0,0,2|0,0,0]=2 11067 B12R1.1392 OC(=O)CN1CC=CC=CC=C1 Amb24438667 [0,0,0,0,0,2|1,0,0]=3