0 B16R2.22891 Brc1cc(C(=O)O)c2c(n1)c(C)ccc2 Amb17505769 [0,0,0,0,0,0|2,0,0]=2 1 B16R2.22891 Brc1cc(C(=O)O)c2c(n1)c(F)ccc2 Amb17505772 [0,0,0,0,0,0|3,0,0]=3 2 B16R2.22891 CC(=O)c1cc(Cl)[n]c2c(Br)cccc12 Amb22496555 [0,0,0,0,0,0|4,0,0]=4 3 B16R2.22891 Cc1cc(C(=O)O)c2c(n1)c(Br)ccc2 Amb2372359 [0,0,0,0,0,0|3,0,0]=3 4 B16R2.22891 Cc1cc(C(=O)O)c2c(n1)c(Cl)ccc2 Amb1099331 [0,0,0,0,0,0|3,0,0]=3 5 B16R2.22891 Cc1cc(C(N)=O)c2cccc(C)c2n1 Amb17759361 [0,0,0,0,0,0|3,0,0]=3 6 B16R2.22891 Cc1cc(C(N)=O)c2cccc(Cl)c2[n]1 Amb18352365 [0,0,0,0,0,0|4,0,0]=4 7 B16R2.22891 Cc1cc(C(N)=O)c2cccc(F)c2[n]1 Amb19103454 [0,0,0,0,0,0|4,0,0]=4 8 B16R2.22891 Cc1cc(c2cccc(Br)c2[n]1)C(C)=O Amb18215572 [0,0,0,0,0,0|4,0,0]=4 9 B16R2.22891 Cc1cc(c2cccc(F)c2[n]1)C(C)=O Amb18215460 [0,0,0,0,0,0|4,0,0]=4 10 B16R2.22891 Cc1cc(c2cccc(O)c2[n]1)C(O)=O Amb21964256 [0,0,0,0,0,0|3,0,0]=3 11 B16R2.22891 Cc1cc2c(N)cccc2c([n]1)C(O)=O Amb19100026 [0,0,0,0,0,0|3,0,0]=3 12 B16R2.22891 Cc1cc2c([n]ccc2C)c(c1)C(C)=O Amb19104835 [0,0,0,0,0,0|3,0,0]=3 13 B16R2.22891 Cc1cc2c([n]ccc2C)c(c1)C(C)O Amb18353382 [0,0,0,0,0,0|3,0,1]=4 14 B16R2.22891 Cc1cc2c([n]ccc2C)c(c1)C(N)=O Amb18352328 [0,0,0,0,0,0|3,0,0]=3 15 B16R2.22891 Cc1cc2c([n]ccc2C)c(c1)C(N)=S Amb18352453 [0,0,0,0,0,0|3,1,0]=4 16 B16R2.22891 Cc1cc2c([n]ccc2C)c(c1)C(O)=O Amb19103866 [0,0,0,0,0,0|2,0,0]=2 17 B16R2.22891 Cc1cc[n]c2c1cc(Cl)cc2C(C)=O Amb19104826 [0,0,0,0,0,0|3,0,0]=3 18 B16R2.22891 Cc1cc[n]c2c1cc(Cl)cc2C(C)O Amb18353384 [0,0,0,0,0,0|3,0,1]=4 19 B16R2.22891 Cc1cc[n]c2c1cc(Cl)cc2C(N)=O Amb19103420 [0,0,0,0,0,0|3,0,0]=3 20 B16R2.22891 Cc1cc[n]c2c1cc(Cl)cc2C(N)=S Amb18352455 [0,0,0,0,0,0|3,1,0]=4 21 B16R2.22891 Cc1cc[n]c2c1cc(F)cc2C(N)=N Amb18352019 [0,0,0,0,0,0|4,0,0]=4 22 B16R2.22891 Cc1cc[n]c2c1cc(F)cc2C(O)=O Amb19103867 [0,0,0,0,0,0|2,0,0]=2 23 B16R2.22891 Cc1cccc2C(=CC(=O)Nc21)C(O)=O Amb18042954 [0,0,0,0,0,0|1,0,1]=2 24 B16R2.22891 Cc1cccc2c1[n]c(C)cc2C(C)=O Amb18214890 [0,0,0,0,0,0|3,0,0]=3 25 B16R2.22891 Cc1cccc2c1[n]c(C)cc2C(N)=S Amb18851020 [0,0,0,0,0,0|3,1,0]=4 26 B16R2.22891 Cc1cccc2c1[n]c(O)cc2C(N)=O Amb20513698 [0,0,0,0,0,0|2,0,0]=2 27 B16R2.22891 Clc1cc(C(=O)O)c2c(n1)c(C)ccc2 Amb17505735 [0,0,0,0,0,0|2,0,0]=2 28 B16R2.22891 O=C1CC(C(=O)O)c2c(N1)c(C)ccc2 Amb17606091 [0,0,0,0,0,0|1,0,3]=4 29 B16R2.22891 OC(=O)C1=CC(=O)Nc2c(Br)cccc21 Amb18042987 [0,0,0,0,0,0|2,0,1]=3 30 B16R2.22891 OC(=O)C1=CC(=O)Nc2c(Cl)cccc21 Amb18042970 [0,0,0,0,0,0|2,0,1]=3 31 B16R2.22891 OC(=O)C1=CC(=O)Nc2c(F)cccc21 Amb18042955 [0,0,0,0,0,0|2,0,1]=3 32 B16R2.22891 OC(=O)C1=CC(=O)Nc2c1cccc2O Amb18654828 [0,0,0,0,0,0|2,0,1]=3 33 B16R2.22891 OC(=O)C1=CC(=O)Oc2c(Cl)cccc21 Amb23569214 [0,0,0,0,0,0|2,0,1]=3 34 B16R2.22891 OC(=O)C1=CC(=O)Oc2c(F)cccc21 Amb23569211 [0,0,0,0,0,0|2,0,1]=3 35 B16R2.22891 OC(=O)c1cc(Br)cc2c1NC=CC2=O Amb19894975 [0,0,0,0,0,0|3,0,0]=3 36 B16R2.22891 Oc1cc(C(=O)O)c2c(n1)c(Br)ccc2 Amb17505838 [0,0,0,0,0,0|2,0,0]=2 37 B15R2.988 Brc1cc2ccccc2c(c1)C(=O)O Amb10608830 [1,0,0,0,0,0|1,0,0]=2 38 B15R2.988 Brc1cc2cccnc2c(c1)C(=O)O Amb1117981 [1,0,0,0,0,0|2,0,0]=3 39 B15R2.988 Brc1nc2ccccc2c(c1)C(=O)O Amb17505768 [1,0,0,0,0,0|2,0,0]=3 40 B15R2.988 CC(=O)C1=CC(=O)Nc2ccccc21 Amb25785159 [1,0,0,0,0,0|2,0,1]=4 41 B15R2.988 CC(=O)C1=CC(=O)Oc2ccccc21 Amb24574177 [1,0,0,0,0,0|2,0,1]=4 42 B15R2.988 CC(=O)c1cc(Br)[n]c2ccccc12 Amb23401262 [1,0,0,0,0,0|3,0,0]=4 43 B15R2.988 CC(=O)c1cc(Cl)[n]c2ccccc12 Amb23401251 [1,0,0,0,0,0|3,0,0]=4 44 B15R2.988 CC(=O)c1cc(Cl)cc2c[n]ccc21 Amb19104776 [1,0,0,0,0,0|3,0,0]=4 45 B15R2.988 CC(=O)c1cc(Cl)cc2ccc[n]c21 Amb19104915 [1,0,0,0,0,0|3,0,0]=4 46 B15R2.988 CC(=O)c1cc(F)cc2c[n]ccc21 Amb19104772 [1,0,0,0,0,0|3,0,0]=4 47 B15R2.988 CC(=O)c1cc(F)cc2ccc[n]c21 Amb19104898 [1,0,0,0,0,0|3,0,0]=4 48 B15R2.988 CC(N)c1cc(O)cc2ccccc21 Amb25747667 [1,0,0,0,0,0|2,0,1]=4 49 B15R2.988 CC1C=C(C(O)=O)c2ccccc2N1 Amb25327419 [1,0,0,0,0,0|2,0,1]=4 50 B15R2.988 C[C@H](N)c1cc(O)cc2ccccc21 Amb24499305 [1,0,0,0,0,0|2,0,1]=4 51 B15R2.988 C[n+]1cc2ccccc2c(c1)C(N)=O Amb22471496 [1,0,0,0,0,0|3,0,0]=4 52 B15R2.988 Cc1cc(C(O)=O)c2ccc[n]c2[n]1 Amb18821191 [1,0,0,0,0,0|3,0,0]=4 53 B15R2.988 Cc1cc(C(O)=O)c2ccc[n]c2c1 Amb25060315 [1,0,0,0,0,0|2,0,0]=3 54 B15R2.988 Cc1cc(c2ccccc2[n]1)C(C)=O Amb18214830 [1,0,0,0,0,0|3,0,0]=4 55 B15R2.988 Cc1cc2c[n]ccc2c(c1)C(C)=O Amb19104768 [1,0,0,0,0,0|3,0,0]=4 56 B15R2.988 Cc1cc2c[n]ccc2c(c1)C(N)=O Amb19103372 [1,0,0,0,0,0|3,0,0]=4 57 B15R2.988 Cc1cc2c[n]ccc2c(c1)C(O)=O Amb18352754 [1,0,0,0,0,0|2,0,0]=3 58 B15R2.988 Cc1cc2cc[n]cc2c(c1)C(O)=O Amb25665339 [1,0,0,0,0,0|2,0,0]=3 59 B15R2.988 Cc1cc2ccc[n]c2c(c1)C(C)=O Amb18353491 [1,0,0,0,0,0|3,0,0]=4 60 B15R2.988 Cc1cc2ccc[n]c2c(c1)C(N)=O Amb19103458 [1,0,0,0,0,0|3,0,0]=4 61 B15R2.988 Cc1cc2ccc[n]c2c(c1)C(O)=O Amb19103917 [1,0,0,0,0,0|2,0,0]=3 62 B15R2.988 Cc1cc2ccccc2c([n]1)C(C)=O Amb18353443 [1,0,0,0,0,0|3,0,0]=4 63 B15R2.988 Cc1cc2ccccc2c([n]1)C(N)=O Amb19103399 [1,0,0,0,0,0|3,0,0]=4 64 B15R2.988 Cc1cc2ccccc2c([n]1)C(O)=O Amb19100580 [1,0,0,0,0,0|2,0,0]=3 65 B15R2.988 Cc1cc2ccccc2c(c1)C(=O)Cl Amb25738540 [1,0,0,0,0,0|2,0,0]=3 66 B15R2.988 Cc1cc2ccccc2c(c1)C(N)=O Amb25108614 [1,0,0,0,0,0|2,0,0]=3 67 B15R2.988 Cc1cc2ccccc2c(c1)C(O)=O Amb18649277 [1,0,0,0,0,0|1,0,0]=2 68 B15R2.988 Clc1cc2cccnc2c(c1)C(=O)N Amb11468245 [1,0,0,0,0,0|3,0,0]=4 69 B15R2.988 Clc1cc2cccnc2c(c1)C(=O)O Amb1115415 [1,0,0,0,0,0|2,0,0]=3 70 B15R2.988 Clc1nc2ccccc2c(c1)C(=O)Cl Amb1106619 [1,0,0,0,0,0|3,0,0]=4 71 B15R2.988 Clc1nc2ccccc2c(c1)C(=O)O Amb1212594 [1,0,0,0,0,0|2,0,0]=3 72 B15R2.988 Fc1cc2nccnc2c(c1)C(=O)O Amb10609690 [1,0,0,0,0,0|3,0,0]=4 73 B15R2.988 NC(=N)c1cc(O)[n]c2ccccc12 Amb25126752 [1,0,0,0,0,0|3,0,0]=4 74 B15R2.988 NC(=O)C1=CC(=S)Nc2ccccc12 Amb19259105 [1,0,0,0,0,0|2,1,0]=4 75 B15R2.988 NC(=O)c1cc(Br)[n]c2ccccc12 Amb23400035 [1,0,0,0,0,0|3,0,0]=4 76 B15R2.988 NC(=O)c1cc(Br)cc2ccc[n]c21 Amb22498505 [1,0,0,0,0,0|3,0,0]=4 77 B15R2.988 NC(=O)c1cc(Br)cc2ccccc21 Amb19499029 [1,0,0,0,0,0|2,0,0]=3 78 B15R2.988 NC(=O)c1cc(Cl)cc2c[n]ccc21 Amb19103377 [1,0,0,0,0,0|3,0,0]=4 79 B15R2.988 NC(=O)c1cc(F)cc2c[n]ccc21 Amb19103374 [1,0,0,0,0,0|3,0,0]=4 80 B15R2.988 NC(=O)c1cc(F)cc2ccc[n]c21 Amb18352392 [1,0,0,0,0,0|3,0,0]=4 81 B15R2.988 Nc1[n]c2ccccc2c([n]1)C(O)=O Amb22235477 [1,0,0,0,0,0|3,0,0]=4 82 B15R2.988 Nc1cc2ccc[n]c2c(c1)C(O)=O Amb24071896 [1,0,0,0,0,0|2,0,0]=3 83 B15R2.988 Nc1cc2ccccc2c([n]1)C(O)=O Amb25140032 [1,0,0,0,0,0|2,0,0]=3 84 B15R2.988 Nc1cc2ccccc2c(c1)C(=O)Cl Amb25769681 [1,0,0,0,0,0|2,0,0]=3 85 B15R2.988 Nc1cc2ccccc2c(c1)C(N)=O Amb23511684 [1,0,0,0,0,0|2,0,0]=3 86 B15R2.988 Nc1cc2ccccc2c(c1)C(O)=O Amb19514734 [1,0,0,0,0,0|1,0,0]=2 87 B15R2.988 Nc1cc2ccccc2c(c1)C(O)=O Amb22284741 [1,0,0,0,0,0|1,0,0]=2 88 B15R2.988 Nc1cc2ccccc2c(c1)[N+]([O-])=O Amb22489137 [1,0,0,0,0,0|2,0,1]=4 89 B15R2.988 O=C(Cl)c1cc(F)cc2ccccc21 Amb24451598 [1,0,0,0,0,0|2,0,0]=3 90 B15R2.988 OB(O)c1cc(F)cc2ccccc21 Amb24354819 [1,0,0,0,0,0|2,0,1]=4 91 B15R2.988 OB(O)c1cc(I)cc2ccccc21 Amb24680145 [1,0,0,0,0,0|2,0,1]=4 92 B15R2.988 OC(=O)C1=CC(=O)C=C2C=CC=CN21 Amb24692959 [1,0,0,0,0,0|1,0,1]=3 93 B15R2.988 OC(=O)C1=CC(=O)Nc2ccccc21 Amb18013046 [1,0,0,0,0,0|1,0,1]=3 94 B15R2.988 OC(=O)C1=CC(=O)Nc2ccccc21 Amb22586945 [1,0,0,0,0,0|1,0,1]=3 95 B15R2.988 OC(=O)C1=NC(=O)Nc2ccccc21 Amb18548460 [1,0,0,0,0,0|2,0,1]=4 96 B15R2.988 OC(=O)C1=NC(=O)Nc2ccccc21 Amb22587698 [1,0,0,0,0,0|2,0,1]=4 97 B15R2.988 OC(=O)c1[n]c(Cl)cc2ccccc21 Amb25364090 [1,0,0,0,0,0|2,0,0]=3 98 B15R2.988 OC(=O)c1[n]c(S)[n]c2ccccc21 Amb19651575 [1,0,0,0,0,0|2,1,0]=4 99 B15R2.988 OC(=O)c1cc(Cl)cc2[n]cccc12 Amb25243452 [1,0,0,0,0,0|2,0,0]=3 100 B15R2.988 OC(=O)c1cc(Cl)cc2c[n]ccc21 Amb18352726 [1,0,0,0,0,0|2,0,0]=3 101 B15R2.988 OC(=O)c1cc(F)[n]c2ccccc12 Amb24677572 [1,0,0,0,0,0|2,0,0]=3 102 B15R2.988 OC(=O)c1cc(F)cc2c[n]ccc21 Amb18352619 [1,0,0,0,0,0|2,0,0]=3 103 B15R2.988 OC(=O)c1cc(F)cc2ccc[n]c21 Amb19103918 [1,0,0,0,0,0|2,0,0]=3 104 B15R2.988 OC(=O)c1cc(F)cc2ccccc21 Amb18650339 [1,0,0,0,0,0|1,0,0]=2 105 B15R2.988 OC(=O)c1cc(I)cc2ccc[n]c21 Amb24081713 [1,0,0,0,0,0|2,0,0]=3 106 B15R2.988 OC(=O)c1cc(I)cc2ccccc21 Amb19148576 [1,0,0,0,0,0|1,0,0]=2 107 B15R2.988 OC(=O)c1cc(S)[n]c2ccccc12 Amb18945338 [1,0,0,0,0,0|1,1,0]=3 108 B15R2.988 OC=1CC(c2ccccc2C1)C(O)=O Amb25109248 [1,0,0,0,0,0|0,0,2]=3 109 B15R2.988 Oc1cc(B(O)O)c2ccccc2[n]1 Amb24666285 [1,0,0,0,0,0|2,0,1]=4 110 B15R2.988 Oc1cc(C(=O)Cl)c2ccc[n]c2c1 Amb24399978 [1,0,0,0,0,0|2,0,0]=3 111 B15R2.988 Oc1cc(c2ccc[n]c2[n]1)C(O)=O Amb24082566 [1,0,0,0,0,0|2,0,0]=3 112 B15R2.988 Oc1cc(c2ccc[n]c2c1)C(O)=O Amb25181064 [1,0,0,0,0,0|1,0,0]=2 113 B15R2.988 Oc1cc2ccc[n]c2c(c1)C(=O)Cl Amb25858712 [1,0,0,0,0,0|2,0,0]=3 114 B15R2.988 Oc1cc2ccc[n]c2c(c1)C(O)=O Amb24091726 [1,0,0,0,0,0|1,0,0]=2 115 B15R2.988 Oc1cc2ccccc2c(c1)B(O)O Amb24362170 [1,0,0,0,0,0|1,0,1]=3 116 B15R2.988 Oc1cc2ccccc2c(c1)C(=O)Cl Amb25217492 [1,0,0,0,0,0|1,0,0]=2 117 B15R2.988 Oc1cc2ccccc2c(c1)C(=O)O Amb13883633 [1,0,0,0,0,0|0,0,0]=1 118 B15R2.988 Oc1nc2ccccc2c(c1)C(=O)O Amb1808556 [1,0,0,0,0,0|1,0,0]=2 119 B15R2.988 Sc1nc2ccccc2c(c1)C(=O)N Amb2371838 [1,0,0,0,0,0|2,1,0]=4 120 B15R2.988 [NH3+]c1cc2ccccc2c(c1)C(O)=O Amb22448321 [1,0,0,0,0,0|1,0,0]=2 121 B15R2.988 [O-]C(=O)C1=CC(=O)Nc2ccccc21 Amb24123051 [1,0,0,0,0,0|1,0,2]=4 122 B15R2.988 [O-][N+](=O)c1cc(O)cc2ccc[n]c21 Amb25207382 [1,0,0,0,0,0|2,0,1]=4 123 B15R2.13611 CC(=O)c1[n]ccc2c(Cl)cccc21 Amb19104793 [1,0,0,0,0,0|3,0,0]=4 124 B15R2.13611 CC(=O)c1[n]ccc2c(F)cccc21 Amb19104786 [1,0,0,0,0,0|3,0,0]=4 125 B15R2.13611 CC(=O)c1[n]ccc2c(O)cccc21 Amb24506334 [1,0,0,0,0,0|3,0,0]=4 126 B15R2.13611 CC(=O)c1cc[n]c2c(O)cccc12 Amb25093654 [1,0,0,0,0,0|3,0,0]=4 127 B15R2.13611 CC(=O)c1cccc2c(Cl)cccc21 Amb22461304 [1,0,0,0,0,0|2,0,0]=3 128 B15R2.13611 CC(=O)c1cccc2c(N)cccc21 Amb25831202 [1,0,0,0,0,0|2,0,0]=3 129 B15R2.13611 CC(=O)c1cccc2c(O)cc[n]c21 Amb24563640 [1,0,0,0,0,0|3,0,0]=4 130 B15R2.13611 CC(=O)c1cccc2c(O)cccc21 Amb25717771 [1,0,0,0,0,0|2,0,0]=3 131 B15R2.13611 CC(=O)c1cccc2c1C=CNC2=O Amb23448938 [1,0,0,0,0,0|3,0,0]=4 132 B15R2.13611 CS(=O)c1cccc2c(O)cccc12 Amb24499189 [1,0,0,0,0,0|3,0,0]=4 133 B15R2.13611 C[n+]1cccc2c(cccc12)[N+]([O-])=O Amb19869820 [1,0,0,0,0,0|2,0,1]=4 134 B15R2.13611 C[n+]1cccc2c(cccc12)[N+]([O-])=O Amb21976522 [1,0,0,0,0,0|2,0,1]=4 135 B15R2.13611 Cc1[n]ccc2c1cccc2C(O)=O Amb25061224 [1,0,0,0,0,0|1,0,0]=2 136 B15R2.13611 Cc1[n]ccc2c1cccc2[N+]([O-])=O Amb25714463 [1,0,0,0,0,0|2,0,1]=4 137 B15R2.13611 Cc1c[n]cc2c1[n]ccc2C(O)=O Amb24686217 [1,0,0,0,0,0|2,0,0]=3 138 B15R2.13611 Cc1cc[n]c2c(cccc21)B(O)O Amb25665412 [1,0,0,0,0,0|2,0,1]=4 139 B15R2.13611 Cc1cc[n]c2c1cccc2C(C)=O Amb19104829 [1,0,0,0,0,0|2,0,0]=3 140 B15R2.13611 Cc1cc[n]c2c1cccc2C(C)O Amb18353378 [1,0,0,0,0,0|2,0,1]=4 141 B15R2.13611 Cc1cc[n]c2c1cccc2C(N)=N Amb19103066 [1,0,0,0,0,0|3,0,0]=4 142 B15R2.13611 Cc1cc[n]c2c1cccc2C(N)=O Amb18352326 [1,0,0,0,0,0|2,0,0]=3 143 B15R2.13611 Cc1cc[n]c2c1cccc2C(N)=S Amb18352449 [1,0,0,0,0,0|2,1,0]=4 144 B15R2.13611 Cc1cc[n]c2c1cccc2C(O)=O Amb18649541 [1,0,0,0,0,0|1,0,0]=2 145 B15R2.13611 Cc1cccc2C(=CCCc21)C(O)=O Amb25059221 [1,0,0,0,0,0|0,0,2]=3 146 B15R2.13611 Cc1cccc2C(=CCNc21)C(O)=O Amb24644179 [1,0,0,0,0,0|1,0,1]=3 147 B15R2.13611 Cc1cccc2C(C=CCc21)C(O)=O Amb24355900 [1,0,0,0,0,0|0,0,2]=3 148 B15R2.13611 Cc1cccc2c([n]ccc21)C(N)=N Amb19103037 [1,0,0,0,0,0|3,0,0]=4 149 B15R2.13611 Cc1cccc2c([n]ccc21)C(N)=O Amb19103380 [1,0,0,0,0,0|2,0,0]=3 150 B15R2.13611 Cc1cccc2c([n]ccc21)C(N)=S Amb19103502 [1,0,0,0,0,0|2,1,0]=4 151 B15R2.13611 Cc1cccc2c([n]ccc21)C(O)=O Amb18821745 [1,0,0,0,0,0|1,0,0]=2 152 B15R2.13611 Cc1cccc2c(cccc21)B(O)O Amb25295350 [1,0,0,0,0,0|1,0,1]=3 153 B15R2.13611 Cc1cccc2c1OCC=C2C(=O)O Amb17234862 [1,0,0,0,0,0|1,0,1]=3 154 B15R2.13611 Cc1cccc2c1[n]ccc2C(N)=O Amb23400209 [1,0,0,0,0,0|2,0,0]=3 155 B15R2.13611 Cc1cccc2c1[n]ccc2C(O)=O Amb21962807 [1,0,0,0,0,0|1,0,0]=2 156 B15R2.13611 Cc1cccc2c1c[n]cc2C(O)=O Amb19110700 [1,0,0,0,0,0|1,0,0]=2 157 B15R2.13611 Cc1cccc2c1cc[n]c2C(C)=O Amb19104784 [1,0,0,0,0,0|2,0,0]=3 158 B15R2.13611 Cc1cccc2c1cc[n]c2C(C)O Amb19104627 [1,0,0,0,0,0|2,0,1]=4 159 B15R2.13611 Cc1cccc2c1cccc2C(O)=O Amb18649282 [1,0,0,0,0,0|0,0,0]=1 160 B15R2.13611 Cc1cccc2c1cccc2[C@@H](C)N Amb24471474 [1,0,0,0,0,0|2,0,1]=4 161 B15R2.13611 ClC(=O)c1cccc2c1cccc2Cl Amb10788873 [1,0,0,0,0,0|2,0,0]=3 162 B15R2.13611 ClC(=O)c1cccc2c1cccc2F Amb10839357 [1,0,0,0,0,0|2,0,0]=3 163 B15R2.13611 NC(=O)c1[n]ccc2c(Br)cccc21 Amb23536001 [1,0,0,0,0,0|3,0,0]=4 164 B15R2.13611 NC(=O)c1[n]ccc2c(Cl)cccc21 Amb19103389 [1,0,0,0,0,0|3,0,0]=4 165 B15R2.13611 NC(=O)c1[n]ccc2c(F)cccc21 Amb19103382 [1,0,0,0,0,0|3,0,0]=4 166 B15R2.13611 NC(=O)c1cccc2c(Cl)[n]ccc21 Amb25351998 [1,0,0,0,0,0|3,0,0]=4 167 B15R2.13611 NC(=O)c1cccc2c(Cl)cc[n]c21 Amb24092354 [1,0,0,0,0,0|3,0,0]=4 168 B15R2.13611 NC(=S)c1cccc2c(Br)cccc21 Amb21982215 [1,0,0,0,0,0|2,1,0]=4 169 B15R2.13611 NC(=S)c1cccc2c(Cl)cccc21 Amb21982105 [1,0,0,0,0,0|2,1,0]=4 170 B15R2.13611 Nc1cc[n]c2c1cccc2C(O)=O Amb25341399 [1,0,0,0,0,0|2,0,0]=3 171 B15R2.13611 Nc1cccc2C(=CCCc21)C(O)=O Amb25324826 [1,0,0,0,0,0|1,0,2]=4 172 B15R2.13611 Nc1cccc2C(C=CCc21)C(O)=O Amb25047156 [1,0,0,0,0,0|1,0,2]=4 173 B15R2.13611 Nc1cccc2c(cccc21)B(O)O Amb24068627 [1,0,0,0,0,0|2,0,1]=4 174 B15R2.13611 Nc1cccc2c1[n]ccc2C(O)=O Amb18649752 [1,0,0,0,0,0|2,0,0]=3 175 B15R2.13611 Nc1cccc2c1cc[n]c2C(N)=O Amb19148568 [1,0,0,0,0,0|3,0,0]=4 176 B15R2.13611 OB(O)c1cccc2c(Br)cccc21 Amb24068631 [1,0,0,0,0,0|2,0,1]=4 177 B15R2.13611 OC(=O)C1=CCCc2c(Cl)cccc21 Amb25290198 [1,0,0,0,0,0|1,0,2]=4 178 B15R2.13611 OC(=O)C1=CCCc2c(F)cccc21 Amb24634270 [1,0,0,0,0,0|1,0,2]=4 179 B15R2.13611 OC(=O)C1=CCNc2c(Cl)cccc21 Amb25033300 [1,0,0,0,0,0|2,0,1]=4 180 B15R2.13611 OC(=O)C1=CCOc2c1cccc2Cl Amb17240719 [1,0,0,0,0,0|2,0,1]=4 181 B15R2.13611 OC(=O)C1=CCOc2c1cccc2F Amb17235868 [1,0,0,0,0,0|2,0,1]=4 182 B15R2.13611 OC(=O)c1[n]ccc2c(Br)cccc21 Amb18349144 [1,0,0,0,0,0|2,0,0]=3 183 B15R2.13611 OC(=O)c1[n]ccc2c(Cl)cccc21 Amb18778234 [1,0,0,0,0,0|2,0,0]=3 184 B15R2.13611 OC(=O)c1[n]ccc2c(F)cccc21 Amb18818991 [1,0,0,0,0,0|2,0,0]=3 185 B15R2.13611 OC(=O)c1c[n]cc2c(Cl)cccc21 Amb24183769 [1,0,0,0,0,0|2,0,0]=3 186 B15R2.13611 OC(=O)c1c[n]cc2c(F)cccc21 Amb25069739 [1,0,0,0,0,0|2,0,0]=3 187 B15R2.13611 OC(=O)c1c[n]cc2c1C=CNC2=O Amb24361725 [1,0,0,0,0,0|3,0,0]=4 188 B15R2.13611 OC(=O)c1cc[n]c2c(Cl)cccc12 Amb23441881 [1,0,0,0,0,0|2,0,0]=3 189 B15R2.13611 OC(=O)c1cc[n]c2c(F)cccc12 Amb24183744 [1,0,0,0,0,0|2,0,0]=3 190 B15R2.13611 OC(=O)c1cc[n]c2c(S)cccc12 Amb18655004 [1,0,0,0,0,0|2,0,0]=3 191 B15R2.13611 OC(=O)c1cccc2c(Br)[n]ccc21 Amb18346646 [1,0,0,0,0,0|2,0,0]=3 192 B15R2.13611 OC(=O)c1cccc2c(Br)c[n]cc21 Amb24183735 [1,0,0,0,0,0|2,0,0]=3 193 B15R2.13611 OC(=O)c1cccc2c(Br)cc[n]c21 Amb25665635 [1,0,0,0,0,0|2,0,0]=3 194 B15R2.13611 OC(=O)c1cccc2c(Cl)[n]ccc21 Amb19099744 [1,0,0,0,0,0|2,0,0]=3 195 B15R2.13611 OC(=O)c1cccc2c(Cl)c[n]cc21 Amb24183753 [1,0,0,0,0,0|2,0,0]=3 196 B15R2.13611 OC(=O)c1cccc2c(Cl)cc[n]c21 Amb22899346 [1,0,0,0,0,0|2,0,0]=3 197 B15R2.13611 OC(=O)c1cccc2c(F)cc[n]c21 Amb24682239 [1,0,0,0,0,0|2,0,0]=3 198 B15R2.13611 OC(=O)c1cccc2c1C=CNC2=O Amb19100725 [1,0,0,0,0,0|2,0,0]=3 199 B15R2.13611 OC(=O)c1cccc2c1N=CNC2=O Amb21964403 [1,0,0,0,0,0|3,0,0]=4 200 B15R2.13611 OC(=O)c1cccc2c1NC=CC2=O Amb22057562 [1,0,0,0,0,0|2,0,0]=3 201 B15R2.13611 OC(=O)c1cccc2c1OC=CC2=O Amb25377276 [1,0,0,0,0,0|2,0,0]=3 202 B15R2.13611 OC(=O)c1cccc2c1cccc2Br Amb1839749 [1,0,0,0,0,0|1,0,0]=2 203 B15R2.13611 OC(=O)c1cccc2c1cccc2Cl Amb1102640 [1,0,0,0,0,0|1,0,0]=2 204 B15R2.13611 OC(=O)c1cccc2c1cccc2F Amb10839356 [1,0,0,0,0,0|1,0,0]=2 205 B15R2.13611 OC(=O)c1cccc2c1cccc2O Amb17594863 [1,0,0,0,0,0|1,0,0]=2 206 B15R2.13611 OC(=O)c1cccc2c1ccnc2Cl Amb10603412 [1,0,0,0,0,0|2,0,0]=3 207 B15R2.13611 OC(=O)c1cccc2c1nccc2O Amb13883941 [1,0,0,0,0,0|2,0,0]=3 208 B15R2.13611 OC(=O)c1ccnc2c1cccc2Br Amb13883511 [1,0,0,0,0,0|2,0,0]=3 209 B15R2.13611 OS(=O)c1cccc2c1cccc2O Amb17595572 [1,0,0,0,0,0|2,0,0]=3 210 B15R2.13611 Oc1[n]ccc2c1cccc2C(O)=O Amb22735849 [1,0,0,0,0,0|2,0,0]=3 211 B15R2.13611 Oc1cc[n]c2c1cccc2C(=O)Cl Amb25122859 [1,0,0,0,0,0|3,0,0]=4 212 B15R2.13611 Oc1cccc2c1[n]ccc2C(O)=O Amb22752839 [1,0,0,0,0,0|2,0,0]=3 213 B15R2.13611 Oc1cccc2c1cc[n]c2C(O)=O Amb25181824 [1,0,0,0,0,0|2,0,0]=3 214 B15R2.13611 [O-][N+](=O)c1cccc2c(Cl)cccc12 Amb22042001 [1,0,0,0,0,0|2,0,1]=4 215 B15R2.13611 [O-][N+](=O)c1cccc2c(F)cccc12 Amb24423699 [1,0,0,0,0,0|2,0,1]=4 216 B15R2.13611 [O-][N+](=O)c1cccc2c(O)cccc12 Amb22476206 [1,0,0,0,0,0|2,0,1]=4 217 B15R2.13611 [O-][N+](=O)c1cccc2c1cccc2Br Amb1149359 [1,0,0,0,0,0|2,0,1]=4 218 B15R2.13611 [O-][N+](=O)c1cccc2c1cccc2C Amb1798560 [1,0,0,0,0,0|1,0,1]=3 219 B15R2.13611 [O-][N+](=O)c1cccc2c1nccc2C Amb1034895 [1,0,0,0,0,0|2,0,1]=4 220 B15R2.13611 [O-][n+]1cccc2c(cccc12)C(O)=O Amb25108496 [1,0,0,0,0,0|2,0,0]=3 221 B15R2.22677 Cc1cc(C=O)c2[n]ccc(C)c2c1 Amb19103292 [1,0,0,0,0,0|2,0,0]=3 222 B15R2.22677 Cc1cc(C=O)c2cccc(Br)c2[n]1 Amb18215563 [1,0,0,0,0,0|3,0,0]=4 223 B15R2.22677 Cc1cc(C=O)c2cccc(F)c2[n]1 Amb18215447 [1,0,0,0,0,0|3,0,0]=4 224 B15R2.22677 Cc1cc(CO)c2[n]ccc(C)c2c1 Amb19104977 [1,0,0,0,0,0|2,0,1]=4 225 B15R2.22677 Cc1cc(CO)c2cccc(C)c2[n]1 Amb18214872 [1,0,0,0,0,0|2,0,1]=4 226 B15R2.22677 Cc1cc[n]c2c(C=O)cc(Cl)cc21 Amb19103294 [1,0,0,0,0,0|2,0,0]=3 227 B15R2.22677 Cc1cc[n]c2c(C=O)cc(F)cc21 Amb19103293 [1,0,0,0,0,0|2,0,0]=3 228 B15R2.22677 Cc1cc[n]c2c(CO)cc(Cl)cc21 Amb19104979 [1,0,0,0,0,0|2,0,1]=4 229 B15R2.22677 Cc1cc[n]c2c(CO)cc(F)cc21 Amb19104978 [1,0,0,0,0,0|2,0,1]=4 230 B15R2.22677 Cc1cccc2c(CN)cc(O)[n]c21 Amb18909689 [1,0,0,0,0,0|2,0,1]=4 231 B15R2.22677 Cc1cccc2c(CO)cc(O)[n]c21 Amb25098560 [1,0,0,0,0,0|1,0,1]=3 232 B17R2.63369 CCc1cccc2C(=CC(=O)Nc21)C(O)=O Amb18042964 [0,1,0,0,0,0|1,0,1]=3 233 B17R2.63369 CCc1cccc2c1nc(Cl)cc2C(=O)O Amb17505743 [0,1,0,0,0,0|2,0,0]=3 234 B17R2.63369 COc1cccc2C(=CC(=O)Nc21)C(O)=O Amb18042967 [0,1,0,0,0,0|1,0,1]=3 235 B17R2.63369 COc1cccc2c1OC(=O)C=C2C(O)=O Amb23569217 [0,1,0,0,0,0|1,0,1]=3 236 B17R2.63369 COc1cccc2c1nc(O)cc2C(=O)O Amb1060982 [0,1,0,0,0,0|1,0,0]=2 237 B17R2.63369 Cc1cc(C(N)=O)c2cccc(CC)c2[n]1 Amb18352359 [0,1,0,0,0,0|3,0,0]=4 238 B17R2.63369 Cc1cc(C(N)=O)c2cccc(OC)c2[n]1 Amb18352363 [0,1,0,0,0,0|3,0,0]=4 239 B17R2.63369 Cc1cc(c2cccc(OC)c2[n]1)C(C)=O Amb18852010 [0,1,0,0,0,0|3,0,0]=4 240 B17R2.253347 OC(=O)c1c(Br)c(Cl)[n]c2c(F)cccc12 Amb23557109 [0,1,0,0,0,0|3,0,0]=4 241 B17R2.253347 OC(=O)c1c(Br)c(Cl)[n]c2c1cccc2Cl Amb23557110 [0,1,0,0,0,0|3,0,0]=4 242 B17R2.253347 OC(=O)c1c(F)c(Br)[n]c2c1cccc2Br Amb22547367 [0,1,0,0,0,0|3,0,0]=4 243 B17R2.253459 CN1c2c(Cl)cccc2C(=CC1=O)C(O)=O Amb18545036 [0,1,0,0,0,0|2,0,1]=4 244 B17R2.253459 CN1c2c(F)cccc2C(=CC1=O)C(O)=O Amb18043005 [0,1,0,0,0,0|2,0,1]=4 245 B17R2.253459 Cc1[n]c(C(O)=O)c2cccc(N)c2c1Br Amb19101791 [0,1,0,0,0,0|3,0,0]=4 246 B17R2.253459 Cc1cccc2c1N(C)C(=O)C=C2C(O)=O Amb18545029 [0,1,0,0,0,0|1,0,1]=3 247 B17R2.265192 CC(=O)c1cc(C)[n]c2c1c(C)ccc2C Amb18353477 [0,1,0,0,0,0|3,0,0]=4 248 B17R2.265192 Cc1cc(C(=O)O)c2c(n1)c(Cl)ccc2Cl Amb17505598 [0,1,0,0,0,0|3,0,0]=4 249 B17R2.265192 Cc1cc(C(O)=O)c2c([n]1)c(F)ccc2F Amb18352832 [0,1,0,0,0,0|3,0,0]=4 250 B17R2.265192 Cc1cc(c2c(Cl)ccc(C)c2[n]1)C(C)=O Amb19104874 [0,1,0,0,0,0|3,0,0]=4 251 B17R2.265192 Cc1ccc(C)c2C(=CC(=O)Nc12)C(O)=O Amb18042961 [0,1,0,0,0,0|1,0,1]=3 252 B17R2.265192 Cc1ccc(C)c2c1[n]c(C)cc2C(N)=O Amb18352361 [0,1,0,0,0,0|3,0,0]=4 253 B17R2.265192 Cc1ccc(Cl)c2C(=CC(=O)Nc21)C(O)=O Amb18042974 [0,1,0,0,0,0|1,0,1]=3 254 B17R2.265192 Cc1ccc(F)c2NC(=O)C=C(C(O)=O)c21 Amb23590830 [0,1,0,0,0,0|2,0,1]=4 255 B17R2.265192 Cc1ccc(F)c2[n]c(Cl)cc(C(O)=O)c21 Amb23590831 [0,1,0,0,0,0|3,0,0]=4 256 B17R2.265192 Clc1cc(C(=O)O)c2c(n1)c(C)ccc2C Amb17505740 [0,1,0,0,0,0|2,0,0]=3 257 B17R2.265192 Clc1cc(C(=O)O)c2c(n1)c(C)ccc2Cl Amb17505747 [0,1,0,0,0,0|2,0,0]=3 258 B17R2.265192 OC(=O)C1=CC(=O)Nc2c(Cl)ccc(F)c21 Amb23590840 [0,1,0,0,0,0|2,0,1]=4 259 B17R2.265192 OC(=O)C1=CC(=O)Nc2c1c(Cl)ccc2Cl Amb18545014 [0,1,0,0,0,0|2,0,1]=4 260 B17R2.265192 OC(=O)c1cc(Cl)[n]c2c1c(F)ccc2Cl Amb23590841 [0,1,0,0,0,0|3,0,0]=4 261 B17R2.265718 Cc1c(Cl)ccc2C(=CC(=O)Nc21)C(O)=O Amb18042973 [0,1,0,0,0,0|1,0,1]=3 262 B17R2.265718 Cc1cc(C(=O)O)c2c(n1)c(Cl)c(cc2)Cl Amb17505599 [0,1,0,0,0,0|3,0,0]=4 263 B17R2.265718 Cc1cc(C(N)=O)c2ccc(Cl)c(C)c2[n]1 Amb19103459 [0,1,0,0,0,0|3,0,0]=4 264 B17R2.265718 Cc1cc(c2ccc(Cl)c(C)c2[n]1)C(C)=O Amb18851898 [0,1,0,0,0,0|3,0,0]=4 265 B17R2.265718 Cc1ccc2C(=CC(=O)Nc2c1C)C(O)=O Amb18042959 [0,1,0,0,0,0|1,0,1]=3 266 B17R2.265718 Cc1ccc2c([n]c(C)cc2C(C)=O)c1C Amb18215226 [0,1,0,0,0,0|3,0,0]=4 267 B17R2.265718 Cc1ccc2c([n]c(C)cc2C(O)=O)c1C Amb22586734 [0,1,0,0,0,0|2,0,0]=3 268 B17R2.265718 Clc1cc(C(=O)O)c2c(n1)c(C)c(cc2)C Amb17505738 [0,1,0,0,0,0|2,0,0]=3 269 B17R2.265718 Clc1cc(C(=O)O)c2c(n1)c(C)c(cc2)Cl Amb17505746 [0,1,0,0,0,0|2,0,0]=3 270 B17R2.265718 OC(=O)C1=CC(=O)Nc2c1ccc(Cl)c2Cl Amb18545016 [0,1,0,0,0,0|2,0,1]=4 271 B17R2.265718 OC(=O)C1=CC(=O)Nc2c1ccc(F)c2F Amb23590834 [0,1,0,0,0,0|2,0,1]=4 272 B17R2.265718 OC(=O)c1cc(Cl)[n]c2c1ccc(F)c2F Amb24081053 [0,1,0,0,0,0|3,0,0]=4 273 B17R2.358451 CNC(=O)c1cc(C)[n]c2c1cccc2C Amb20369872 [0,1,0,0,0,0|3,0,0]=4 274 B17R2.358451 CNC(=O)c1cc(O)[n]c2c(Cl)cccc12 Amb20513712 [0,1,0,0,0,0|3,0,0]=4 275 B17R2.358451 COC(=O)c1cc(Br)cc2c1NC=CC2=O Amb19929466 [0,1,0,0,0,0|3,0,0]=4 276 B17R2.358451 COC(=O)c1cc(Br)cc2c1nccc2Cl Amb10975454 [0,1,0,0,0,0|3,0,0]=4 277 B17R2.358451 COC(=O)c1cc(Cl)[n]c2c(Br)cccc12 Amb22497739 [0,1,0,0,0,0|3,0,0]=4 278 B17R2.358451 Cc1cc(C(=O)NO)c2cccc(Cl)c2[n]1 Amb18352632 [0,1,0,0,0,0|3,0,0]=4 279 B17R2.358451 Cc1cc(C(=O)NO)c2cccc(F)c2[n]1 Amb18352618 [0,1,0,0,0,0|3,0,0]=4 280 B17R2.358451 Cc1cc2c(Br)cccc2c([n]1)C(=O)OC Amb18349218 [0,1,0,0,0,0|3,0,0]=4 281 B17R2.358451 Cc1cc2c([n]ccc2C)c(c1)C(=O)NO Amb19103667 [0,1,0,0,0,0|2,0,0]=3 282 B17R2.358451 Cc1cc[n]c2c1cc(Cl)cc2C(=O)NO Amb19103669 [0,1,0,0,0,0|2,0,0]=3 283 B17R2.358451 Cc1cc[n]c2c1cc(F)cc2C(=O)OC Amb19103761 [0,1,0,0,0,0|2,0,0]=3 284 B17R2.358451 Cc1cccc2c1[n]c(C)cc2C(=O)NO Amb19103698 [0,1,0,0,0,0|2,0,0]=3 285 B17R2.358451 Cc1cccc2c1[n]c(O)cc2C(=O)NC Amb20513701 [0,1,0,0,0,0|2,0,0]=3 286 B17R2.880626 Brc1cc(C)c2c(c1)c(cc(n2)C)C(=O)O Amb1070724 [0,1,0,0,0,0|2,0,0]=3 287 B17R2.880626 Cc1cc(C(O)=O)c2[n]c(C)cc(C)c2c1 Amb19103862 [0,1,0,0,0,0|2,0,0]=3 288 B17R2.880626 Cc1cc(C)[n]c2c1cc(Cl)cc2C(C)=O Amb19104827 [0,1,0,0,0,0|3,0,0]=4 289 B17R2.880626 Cc1cc(C)[n]c2c1cc(Cl)cc2C(O)=O Amb18352800 [0,1,0,0,0,0|2,0,0]=3 290 B17R2.880626 Cc1cc(C)[n]c2c1cc(F)cc2C(N)=O Amb18352324 [0,1,0,0,0,0|3,0,0]=4 291 B17R2.880626 Cc1cc(C)c2c(c1)c(cc(n2)Cl)C(=O)O Amb17505739 [0,1,0,0,0,0|2,0,0]=3 292 B17R2.880626 Cc1cc(C)c2c(c1)c(cc(n2)O)C(=O)O Amb2582786 [0,1,0,0,0,0|1,0,0]=2 293 B17R2.880626 Cc1cc(C)c2nc(C)cc(C(N)=O)c2c1 Amb17688935 [0,1,0,0,0,0|3,0,0]=4 294 B17R2.880626 Cc1cc(Cl)c2cc(F)cc(C(O)=O)c2[n]1 Amb18352850 [0,1,0,0,0,0|3,0,0]=4 295 B17R2.880626 Cc1cc(Cl)cc2C(=CC(=O)Nc21)C(O)=O Amb18042975 [0,1,0,0,0,0|1,0,1]=3 296 B17R2.880626 Cc1cc(F)cc2C(=CC(=O)Nc21)C(O)=O Amb23590843 [0,1,0,0,0,0|1,0,1]=3 297 B17R2.880626 Cc1cc(F)cc2c1[n]c(Cl)cc2C(O)=O Amb23590842 [0,1,0,0,0,0|2,0,0]=3 298 B17R2.880626 Cc1cc(c2NC(=O)C=C(C)c2c1)S(O)=O Amb23533761 [0,1,0,0,0,0|3,0,0]=4 299 B17R2.880626 Cc1cc(c2[n]c(C)cc(C)c2c1)C(C)=O Amb18353452 [0,1,0,0,0,0|3,0,0]=4 300 B17R2.880626 Cc1cc2C(=CC(=O)Nc2c(C)c1)C(O)=O Amb18042960 [0,1,0,0,0,0|1,0,1]=3 301 B17R2.880626 Cc1cc2c(cc(O)[n]c2c(F)c1)C(O)=O Amb18946423 [0,1,0,0,0,0|2,0,0]=3 302 B17R2.880626 Clc1cc(C)c2c(c1)c(cc(n2)Cl)C(=O)O Amb17505748 [0,1,0,0,0,0|2,0,0]=3 303 B17R2.880626 Clc1cc(Cl)c2c(c1)c(cc(n2)C)C(=O)O Amb17505600 [0,1,0,0,0,0|3,0,0]=4 304 B17R2.880626 OC(=O)C1=CC(=O)Nc2c(Br)cc(Cl)cc21 Amb18043000 [0,1,0,0,0,0|2,0,1]=4 305 B17R2.880626 OC(=O)C1=CC(=O)Nc2c1cc(Cl)cc2Cl Amb18545018 [0,1,0,0,0,0|2,0,1]=4 306 B17R2.880626 OC(=O)C1=CC(=O)Nc2c1cc(F)cc2F Amb18545008 [0,1,0,0,0,0|2,0,1]=4 307 B15R1.256 Cc1[n]cccc1NC(=O)\C=C/C(O)=O Amb24725011 [0,0,1,0,0,0|2,0,1]=4 308 B15R1.256 Cc1cc[n]cc1NC(=O)\C=C/C(O)=O Amb24600854 [0,0,1,0,0,0|2,0,1]=4 309 B15R1.256 Cc1cc[n]cc1NC(=O)\C=C\C(O)=O Amb25074251 [0,0,1,0,0,0|2,0,1]=4 310 B15R1.256 Cc1cccnc1NC(=O)/C=C/C(O)=O Amb17788405 [0,0,1,0,0,0|2,0,1]=4 311 B15R1.256 O=C(Nc1ccccc1Br)\C=C/C(=O)O Amb1811548 [0,0,1,0,0,0|2,0,1]=4 312 B15R1.256 O=C(Nc1ccccc1C)\C=C/C(=O)N Amb1254950 [0,0,1,0,0,0|2,0,1]=4 313 B15R1.256 O=C(Nc1ccccc1C)\C=C/C(=O)O Amb2459400 [0,0,1,0,0,0|1,0,1]=3 314 B15R1.256 O=C(Nc1ccccc1C)\C=C\C(=O)N Amb1234982 [0,0,1,0,0,0|2,0,1]=4 315 B15R1.256 O=C(Nc1ccccc1Cl)\C=C/C(=O)O Amb1268161 [0,0,1,0,0,0|2,0,1]=4 316 B15R1.256 O=C(Nc1ccccc1F)\C=C\C(=O)O Amb1227855 [0,0,1,0,0,0|2,0,1]=4 317 B15R1.256 O=C(Nc1ccccc1N)\C=C\C(=O)O Amb2223035 [0,0,1,0,0,0|2,0,1]=4 318 B15R1.256 O=C(Nc1ccccc1O)\C=C/C(=O)O Amb2503624 [0,0,1,0,0,0|2,0,1]=4 319 B15R1.559 C\C=C\CNc1ccc(Br)cc1C(O)=O Amb25286534 [0,0,1,0,0,0|2,0,1]=4 320 B15R1.8317 OC(=O)CC(c1cccc(c1)C)C(=O)O Amb17239702 [0,0,1,0,0,0|1,0,2]=4 321 B15R2.9274 C[n]1[n]cc2c(cc(Br)cc12)C(O)=O Amb24067409 [0,0,0,0,1,0|3,0,0]=4 322 B15R2.9274 Cc1[n][s]c2c1cc(Cl)cc2C(O)=O Amb24615980 [0,0,0,0,1,0|3,0,0]=4 323 B15R2.9274 Cc1c[s]c2c1cc(Cl)cc2C(O)=O Amb25239666 [0,0,0,0,1,0|2,0,0]=3 324 B15R2.9274 Cc1c[s]c2c1cc(F)cc2C(O)=O Amb25310016 [0,0,0,0,1,0|2,0,0]=3 325 B15R2.9274 Cc1c[s]c2c1cc(N)cc2C(O)=O Amb24712822 [0,0,0,0,1,0|2,0,0]=3 326 B15R2.9274 Cc1cc(C(O)=O)c2[s]cc(N)c2c1 Amb25230308 [0,0,0,0,1,0|3,0,0]=4 327 B15R2.9274 Cc1cc(C(O)=O)c2cc[n](C)c2[n]1 Amb18819592 [0,0,0,0,1,0|3,0,0]=4 328 B15R2.9274 Cc1cc(c2[s]cc(O)c2c1)C(O)=O Amb24599094 [0,0,0,0,1,0|3,0,0]=4 329 B15R2.9274 Cc1cc2c(F)c[s]c2c(c1)C(O)=O Amb24574828 [0,0,0,0,1,0|3,0,0]=4 330 B15R2.9274 Cc1cc2c(I)c[nH]c2c(c1)C(O)=O Amb24683970 [0,0,0,0,1,0|3,0,0]=4 331 B15R2.9274 Cc1cc2c(I)c[s]c2c(c1)C(O)=O Amb24656289 [0,0,0,0,1,0|3,0,0]=4 332 B15R2.9274 Cc1cc2c([nH]cc2C)c(c1)C(O)=O Amb24368573 [0,0,0,0,1,0|2,0,0]=3 333 B15R2.9274 Cc1cc2c(cc[n]2C)c(c1)C(O)=O Amb25320337 [0,0,0,0,1,0|2,0,0]=3 334 B15R2.9274 Cc1cc2c(occ2C)c(c1)C(O)=O Amb24506421 [0,0,0,0,1,0|2,0,0]=3 335 B15R2.9274 Nc1c[s]c2c1cc(Br)cc2C(O)=O Amb24640546 [0,0,0,0,1,0|3,0,0]=4 336 B15R2.9274 Nc1c[s]c2c1cc(S)cc2C(O)=O Amb25203286 [0,0,0,0,1,0|2,1,0]=4 337 B15R2.9274 Nc1cc2c(Cl)c[s]c2c(c1)C(O)=O Amb24542010 [0,0,0,0,1,0|3,0,0]=4 338 B15R2.9274 Nc1cc2c(S)c[s]c2c(c1)C(O)=O Amb25247839 [0,0,0,0,1,0|3,0,0]=4 339 B15R2.9274 OC(=O)c1cc(Br)cc2c(F)c[s]c21 Amb24539540 [0,0,0,0,1,0|3,0,0]=4 340 B15R2.9274 OC(=O)c1cc(Br)cc2c1C=CC2=O Amb24714644 [0,0,0,0,1,0|2,0,0]=3 341 B15R2.9274 OC(=O)c1cc(Cl)cc2c(F)c[s]c21 Amb24542473 [0,0,0,0,1,0|3,0,0]=4 342 B15R2.9274 OC(=O)c1cc(Cl)cc2c(I)c[s]c21 Amb24561466 [0,0,0,0,1,0|3,0,0]=4 343 B15R2.9274 OC(=O)c1cc(Cl)cc2c1[s]cc2Cl Amb24537400 [0,0,0,0,1,0|3,0,0]=4 344 B15R2.9274 OC(=O)c1cc(F)cc2c(Br)c[s]c21 Amb24539527 [0,0,0,0,1,0|3,0,0]=4 345 B15R2.9274 OC(=O)c1cc(F)cc2c(Cl)c[s]c21 Amb24542291 [0,0,0,0,1,0|3,0,0]=4 346 B15R2.9274 OC(=O)c1cc(I)cc2c(S)c[s]c21 Amb25203594 [0,0,0,0,1,0|3,0,0]=4 347 B15R2.9274 OC(=O)c1cc(O)cc2c1CCC2=O Amb25690201 [0,0,0,0,1,0|1,0,2]=4 348 B15R2.9274 OC(=O)c1cc(S)cc2c(Cl)c[s]c21 Amb25230324 [0,0,0,0,1,0|2,1,0]=4 349 B15R2.9274 OC(=O)c1cc(S)cc2c(I)c[s]c21 Amb25203585 [0,0,0,0,1,0|2,1,0]=4 350 B15R2.9274 Oc1c[s]c2c1cc(F)cc2C(O)=O Amb25329005 [0,0,0,0,1,0|3,0,0]=4 351 B15R2.9274 Oc1c[s]c2c1cc(I)cc2C(O)=O Amb25203656 [0,0,0,0,1,0|3,0,0]=4 352 B15R2.9274 Oc1cc(c2[s]cc(I)c2c1)C(O)=O Amb24746857 [0,0,0,0,1,0|2,0,0]=3 353 B15R2.9274 Oc1cc(c2[s]cc(S)c2c1)C(O)=O Amb25203571 [0,0,0,0,1,0|2,0,0]=3 354 B15R2.13460 CC1=CC=CC2=C(C(O)=O)C(=O)ON21 Amb25783983 [0,0,0,0,1,0|2,0,1]=4 355 B15R2.13460 Cc1[nH]c2c(Br)cccc2c1C(O)=O Amb18695177 [0,0,0,0,1,0|3,0,0]=4 356 B15R2.13460 Cc1[nH]c2c(Cl)cccc2c1C(O)=O Amb18064739 [0,0,0,0,1,0|3,0,0]=4 357 B15R2.13460 Cc1[nH]c2c(F)cccc2c1C(O)=O Amb18064736 [0,0,0,0,1,0|3,0,0]=4 358 B15R2.13460 Cc1[nH]c2c(N)cccc2c1C(O)=O Amb18819569 [0,0,0,0,1,0|3,0,0]=4 359 B15R2.13460 Cc1[n]ccc2c1[nH]c(C)c2C(O)=O Amb24330339 [0,0,0,0,1,0|3,0,0]=4 360 B15R2.13460 Cc1[s]c2c(Br)cccc2c1C(O)=O Amb24650832 [0,0,0,0,1,0|3,0,0]=4 361 B15R2.13460 Cc1[s]c2c(F)cccc2c1C(O)=O Amb25848077 [0,0,0,0,1,0|3,0,0]=4 362 B15R2.13460 Cc1[s]c2c(N)cccc2c1C(O)=O Amb24604085 [0,0,0,0,1,0|3,0,0]=4 363 B15R2.13460 Cc1[s]c2c(S)cccc2c1C(O)=O Amb25326880 [0,0,0,0,1,0|3,0,0]=4 364 B15R2.13460 Cc1[s]c2c(cccc2O)c1C(O)=O Amb25259345 [0,0,0,0,1,0|3,0,0]=4 365 B15R2.13460 Cc1c[n]cc2c1[nH]c(C)c2C(O)=O Amb24330338 [0,0,0,0,1,0|3,0,0]=4 366 B15R2.13460 Cc1cccc2c(B(O)O)c(O)[s]c21 Amb24670633 [0,0,0,0,1,0|2,0,1]=4 367 B15R2.13460 Cc1cccc2c(C(O)=O)c(C)[n][n]12 Amb18863501 [0,0,0,0,1,0|3,0,0]=4 368 B15R2.13460 Cc1cccc2c1[nH]c(C)c2C(C)=O Amb18064691 [0,0,0,0,1,0|3,0,0]=4 369 B15R2.13460 Cc1cccc2c1[nH]c(C)c2C(N)=O Amb24660499 [0,0,0,0,1,0|3,0,0]=4 370 B15R2.13460 Cc1cccc2c1[nH]c(C)c2C(O)=O Amb18064676 [0,0,0,0,1,0|2,0,0]=3 371 B15R2.13460 Cc1cccc2c1[nH]c(Cl)c2C(C)=O Amb18556671 [0,0,0,0,1,0|3,0,0]=4 372 B15R2.13460 Cc1cccc2c1[nH]c(Cl)c2C(O)=O Amb18556686 [0,0,0,0,1,0|2,0,0]=3 373 B15R2.13460 Cc1cccc2c1[s]c(Br)c2C(O)=O Amb24639451 [0,0,0,0,1,0|2,0,0]=3 374 B15R2.13460 Cc1cccc2c1[s]c(Cl)c2C(O)=O Amb25292971 [0,0,0,0,1,0|2,0,0]=3 375 B15R2.13460 Cc1cccc2c1[s]c(F)c2C(O)=O Amb25196800 [0,0,0,0,1,0|2,0,0]=3 376 B15R2.13460 Cc1cccc2c1[s]c(I)c2C(O)=O Amb24599138 [0,0,0,0,1,0|2,0,0]=3 377 B15R2.13460 Cc1cccc2c1[s]c(O)c2[N+]([O-])=O Amb25250133 [0,0,0,0,1,0|2,0,1]=4 378 B15R2.13460 Cc1cccc2c1[s]c(S)c2C(O)=O Amb24744915 [0,0,0,0,1,0|1,1,0]=3 379 B15R2.13460 Cc1oc2c(F)cccc2c1C(O)=O Amb25781750 [0,0,0,0,1,0|3,0,0]=4 380 B15R2.13460 Nc1[n]ccc2c(C(O)=O)c(O)[nH]c21 Amb25381423 [0,0,0,0,1,0|3,0,0]=4 381 B15R2.13460 Nc1[s]c2c(Cl)cccc2c1C(O)=O Amb24541836 [0,0,0,0,1,0|3,0,0]=4 382 B15R2.13460 Nc1[s]c2c(F)cccc2c1C(O)=O Amb24547264 [0,0,0,0,1,0|3,0,0]=4 383 B15R2.13460 Nc1[s]c2c(I)cccc2c1C(O)=O Amb24713776 [0,0,0,0,1,0|3,0,0]=4 384 B15R2.13460 Nc1[s]c2c(S)cccc2c1C(O)=O Amb25203284 [0,0,0,0,1,0|3,0,0]=4 385 B15R2.13460 Nc1[s]c2c(cccc2O)c1C(O)=O Amb25203256 [0,0,0,0,1,0|3,0,0]=4 386 B15R2.13460 Nc1cccc2c1[s]c(Br)c2C(O)=O Amb24757918 [0,0,0,0,1,0|3,0,0]=4 387 B15R2.13460 Nc1cccc2c1[s]c(S)c2C(O)=O Amb25230210 [0,0,0,0,1,0|2,1,0]=4 388 B15R2.13460 OC(=O)c1c(Br)[s]c2c(F)cccc12 Amb24759460 [0,0,0,0,1,0|3,0,0]=4 389 B15R2.13460 OC(=O)c1c(C)nc2n1cccc2C Amb1101126 [0,0,0,0,1,0|3,0,0]=4 390 B15R2.13460 OC(=O)c1c(Cl)[nH]c2c(F)cccc12 Amb18556949 [0,0,0,0,1,0|3,0,0]=4 391 B15R2.13460 OC(=O)c1c(Cl)[s]c2c(F)cccc12 Amb24561202 [0,0,0,0,1,0|3,0,0]=4 392 B15R2.13460 OC(=O)c1c(Cl)[s]c2c(S)cccc12 Amb25247929 [0,0,0,0,1,0|3,0,0]=4 393 B15R2.13460 OC(=O)c1c(F)[s]c2c(Br)cccc12 Amb25325438 [0,0,0,0,1,0|3,0,0]=4 394 B15R2.13460 OC(=O)c1c(F)[s]c2c(Cl)cccc12 Amb24623634 [0,0,0,0,1,0|3,0,0]=4 395 B15R2.13460 OC(=O)c1c(I)[s]c2c(S)cccc12 Amb25326886 [0,0,0,0,1,0|3,0,0]=4 396 B15R2.13460 OC(=O)c1c(S)[s]c2c(I)cccc12 Amb25329049 [0,0,0,0,1,0|2,1,0]=4 397 B15R2.13460 OC(=O)c1c2cccc(Br)c2[s]c1Br Amb25214889 [0,0,0,0,1,0|3,0,0]=4 398 B15R2.13460 OC(=O)c1c2cccc(Cl)c2[nH]c1Cl Amb18557040 [0,0,0,0,1,0|3,0,0]=4 399 B15R2.13460 OC(=O)c1c2cccc(Cl)c2[s]c1Cl Amb24537398 [0,0,0,0,1,0|3,0,0]=4 400 B15R2.13460 OC(=O)c1c2cccc(F)c2[s]c1F Amb25250197 [0,0,0,0,1,0|3,0,0]=4 401 B15R2.13460 OC(=O)c1c2cccc(I)c2[nH]c1I Amb24067911 [0,0,0,0,1,0|3,0,0]=4 402 B15R2.13460 Oc1cccc2c1[s]c(Cl)c2C(O)=O Amb24616491 [0,0,0,0,1,0|3,0,0]=4 403 B15R2.13460 Oc1cccc2c1[s]c(I)c2C(O)=O Amb24746859 [0,0,0,0,1,0|3,0,0]=4 404 B15R2.13631 C[n]1cc(C(O)=O)c2cccc(Br)c12 Amb18246694 [0,0,0,0,1,0|3,0,0]=4 405 B15R2.13631 C[n]1cc(C(O)=O)c2cccc(Cl)c12 Amb18562399 [0,0,0,0,1,0|3,0,0]=4 406 B15R2.13631 C[n]1cc(C(O)=O)c2cccc(F)c12 Amb18562398 [0,0,0,0,1,0|3,0,0]=4 407 B15R2.13631 Cc1cccc2C(OC(=O)c21)C(O)=O Amb18817911 [0,0,0,0,1,0|1,0,2]=4 408 B15R2.13631 Cc1cccc2[C@H](CC(=O)c21)C(O)=O Amb25112021 [0,0,0,0,1,0|0,0,3]=4 409 B15R2.13631 Cc1cccc2c([n]c(Br)[n]21)C(O)=O Amb25100493 [0,0,0,0,1,0|3,0,0]=4 410 B15R2.13631 Cc1cccc2c1[n](C)[n]c2C(O)=O Amb24349689 [0,0,0,0,1,0|3,0,0]=4 411 B15R2.13631 Cc1cccc2c1[n](C)cc2C(C)=O Amb18562413 [0,0,0,0,1,0|3,0,0]=4 412 B15R2.13631 Cc1cccc2c1[n](C)cc2C(O)=O Amb18064421 [0,0,0,0,1,0|2,0,0]=3 413 B17R2.37531 CC(=O)OC1=CC(=O)Nc2c1cccc2C Amb23533719 [0,0,0,0,0,1|2,0,1]=4 414 B17R2.37531 Cc1cc(CC(N)=O)c2[n]ccc(C)c2c1 Amb18353167 [0,0,0,0,0,1|3,0,0]=4 415 B17R2.37531 Cc1cc(CC(O)=O)c2cccc(Cl)c2[n]1 Amb18851585 [0,0,0,0,0,1|3,0,0]=4 416 B17R2.37531 Cc1cc[n]c2c(CC(N)=O)cc(Cl)cc21 Amb18353169 [0,0,0,0,0,1|3,0,0]=4 417 B17R2.37531 Cc1cc[n]c2c(CC(O)=O)cc(F)cc21 Amb18352909 [0,0,0,0,0,1|2,0,0]=3 418 B17R2.37531 Cc1cccc2C(CC(O)=O)=CC(=O)Nc21 Amb18532432 [0,0,0,0,0,1|1,0,1]=3 419 B14R1.159 CC(=O)\C=C\C=Cc1ccccc1Br Amb25711471 [1,0,1,0,0,0|2,0,0]=4 420 B14R1.159 Cc1cc[n]cc1\C=C\C=CC(O)=O Amb24702833 [1,0,1,0,0,0|1,0,0]=3 421 B14R1.159 Cc1ccccc1C=C\C=C\C(C)=O Amb24535161 [1,0,1,0,0,0|1,0,0]=3 422 B14R1.159 NC(=O)C=C\C=C\c1ccccc1O Amb25211015 [1,0,1,0,0,0|2,0,0]=4 423 B14R1.159 Nc1ccccc1\C=C\C=C\C(O)=O Amb25672523 [1,0,1,0,0,0|1,0,0]=3 424 B14R1.159 OC(=O)\C=C\C=Cc1ccccc1Br Amb24507304 [1,0,1,0,0,0|1,0,0]=3 425 B14R1.159 OC(=O)\C=C\COc1ccccc1C Amb17235344 [1,0,1,0,0,0|1,0,1]=4 426 B14R1.159 Oc1ccccc1C=C\C=C\C(O)=O Amb24540816 [1,0,1,0,0,0|1,0,0]=3 427 B14R1.423 C\C(=C/c1ccccc1)\C=C\C(=O)N Amb17143047 [1,0,1,0,0,0|2,0,0]=4 428 B14R1.423 C\C(=C\c1ccccc1)\C=CC(=O)Cl Amb24572859 [1,0,1,0,0,0|2,0,0]=4 429 B14R1.423 C\C(=C\c1ccccc1)\C=CC(N)=O Amb25260950 [1,0,1,0,0,0|2,0,0]=4 430 B14R1.423 C\C(=C\c1ccccc1)\C=C\C(=O)Cl Amb25041060 [1,0,1,0,0,0|2,0,0]=4 431 B14R1.423 NC(=O)\C=C\C(\Cl)=C\c1ccccc1 Amb24695423 [1,0,1,0,0,0|2,0,0]=4 432 B14R1.423 O=C(Nc1ccccc1)\C=C/C(=O)O Amb2459372 [1,0,1,0,0,0|1,0,1]=4 433 B14R1.423 O=C(Nc1ccccc1)\C=C\C(=O)O Amb1227856 [1,0,1,0,0,0|1,0,1]=4 434 B14R1.67 CO\C=C\c1ccc(Cl)cc1C(O)=O Amb24336647 [1,0,1,0,0,0|2,0,0]=4 435 B14R1.903 C\C=C\CNc1ccccc1C(O)=O Amb18650848 [1,0,1,0,0,0|1,0,1]=4 436 B14R1.712 C=C[C@@H](N)c1cc(O)cc(c1)C(O)=O Amb24347095 [1,0,1,0,0,0|1,0,1]=4 437 B14R1.6455 CC(=O)\C(=C\C(O)=O)\c1ccccc1 Amb25138778 [1,0,1,0,0,0|2,0,0]=4 438 B14R1.6455 OC(=O)\C(=C/C(=O)O)\c1ccccc1 Amb2431775 [1,0,1,0,0,0|1,0,0]=3 439 B14R1.351 COc1cc(O)cc(c1C=O)C(O)=O Amb24426258 [1,0,1,0,0,0|2,0,0]=4 440 B14R2.1146 Cc1cc2c[n]ccc2c(C=O)c1 Amb18352159 [2,0,0,0,0,0|2,0,0]=4 441 B14R2.1146 Cc1cc2ccc[n]c2c(C=O)c1 Amb18352235 [2,0,0,0,0,0|2,0,0]=4 442 B14R2.1146 Cc1cc2ccccc2c(C=O)[n]1 Amb18352214 [2,0,0,0,0,0|2,0,0]=4 443 B14R2.1146 Cc1cc2ccccc2c(C=O)c1 Amb18647392 [2,0,0,0,0,0|1,0,0]=3 444 B14R2.1146 N#Cc1cc(O)cc2ccccc21 Amb25226865 [2,0,0,0,0,0|1,0,1]=4 445 B14R2.1146 Nc1cc2ccccc2c(CO)c1 Amb25099616 [2,0,0,0,0,0|1,0,1]=4 446 B14R2.1146 O=C1C=C(C=O)c2ccccc2N1 Amb24749077 [2,0,0,0,0,0|1,0,1]=4 447 B14R2.1146 O=C1C=C(C=O)c2ccccc2O1 Amb18127145 [2,0,0,0,0,0|1,0,1]=4 448 B14R2.1146 O=C1Cc2ccccc2C(=C1)C=O Amb24722849 [2,0,0,0,0,0|0,0,2]=4 449 B14R2.1146 O=Cc1[n]c(Br)cc2ccccc21 Amb18135786 [2,0,0,0,0,0|2,0,0]=4 450 B14R2.1146 O=Cc1cc(Br)[n]c2ccccc21 Amb23412000 [2,0,0,0,0,0|2,0,0]=4 451 B14R2.1146 O=Cc1cc(Br)cc2ccc[n]c21 Amb19515108 [2,0,0,0,0,0|2,0,0]=4 452 B14R2.1146 O=Cc1cc(Cl)cc2c[n]ccc21 Amb18351863 [2,0,0,0,0,0|2,0,0]=4 453 B14R2.1146 O=Cc1cc(Cl)cc2ccc[n]c21 Amb18352261 [2,0,0,0,0,0|2,0,0]=4 454 B14R2.1146 O=Cc1cc(F)cc2c[n]ccc21 Amb18352197 [2,0,0,0,0,0|2,0,0]=4 455 B14R2.1146 O=Cc1cc(F)cc2ccc[n]c21 Amb19103338 [2,0,0,0,0,0|2,0,0]=4 456 B14R2.1146 O=Cc1cc(I)cc2ccccc21 Amb25154879 [2,0,0,0,0,0|1,0,0]=3 457 B14R2.1146 OCc1cc(Br)cc2ccccc21 Amb24697542 [2,0,0,0,0,0|1,0,1]=4 458 B14R2.1146 OCc1cc(Cl)cc2ccccc21 Amb25123973 [2,0,0,0,0,0|1,0,1]=4 459 B14R2.1146 OCc1cc(I)cc2ccccc21 Amb25737695 [2,0,0,0,0,0|1,0,1]=4 460 B14R2.1146 Oc1cc(C=O)c2ccc[n]c2c1 Amb24665801 [2,0,0,0,0,0|1,0,0]=3 461 B14R2.1146 Oc1cc2ccccc2c(C=O)c1 Amb18126871 [2,0,0,0,0,0|0,0,0]=2 462 B14R2.1146 Oc1cc2ccccc2c(CBr)c1 Amb25727678 [2,0,0,0,0,0|1,0,1]=4 463 B14R2.1146 Oc1cc2ccccc2c(CCl)c1 Amb25087109 [2,0,0,0,0,0|1,0,1]=4 464 B14R2.1146 Oc1cc2ccccc2c(c1)N=O Amb25094403 [2,0,0,0,0,0|1,0,0]=3 465 B14R2.31359 CC(=C)c1cccc2ccccc21 Amb25130722 [2,0,0,0,0,0|2,0,0]=4 466 B14R2.31359 CC(=O)c1[n]ccc2ccccc21 Amb19104782 [2,0,0,0,0,0|2,0,0]=4 467 B14R2.31359 CC(=O)c1c[n]cc2ccccc21 Amb18353441 [2,0,0,0,0,0|2,0,0]=4 468 B14R2.31359 CC(=O)c1cccc2[n]cccc12 Amb22295846 [2,0,0,0,0,0|2,0,0]=4 469 B14R2.31359 CC(=O)c1cccc2c[n]ccc21 Amb18793963 [2,0,0,0,0,0|2,0,0]=4 470 B14R2.31359 CC(=O)c1cccc2cc[n]cc21 Amb19104765 [2,0,0,0,0,0|2,0,0]=4 471 B14R2.31359 CC(=O)c1ccnc2c1cccc2 Amb10982506 [2,0,0,0,0,0|2,0,0]=4 472 B14R2.31359 C[C@@H](O)c1cccc2ccccc21 Amb20240628 [2,0,0,0,0,0|1,0,1]=4 473 B14R2.31359 C[C@H](O)c1cccc2ccccc21 Amb19888382 [2,0,0,0,0,0|1,0,1]=4 474 B14R2.31359 NC(=N)c1cccc2ccccc21 Amb22232871 [2,0,0,0,0,0|2,0,0]=4 475 B14R2.31359 NC(=O)c1[n]ccc2ccccc21 Amb18183687 [2,0,0,0,0,0|2,0,0]=4 476 B14R2.31359 NC(=O)c1[n]ccc2ccccc21 Amb22465307 [2,0,0,0,0,0|2,0,0]=4 477 B14R2.31359 NC(=O)c1c[n]cc2ccccc21 Amb19103394 [2,0,0,0,0,0|2,0,0]=4 478 B14R2.31359 NC(=O)c1cccc2c[n]ccc21 Amb19103340 [2,0,0,0,0,0|2,0,0]=4 479 B14R2.31359 NC(=O)c1cccc2cc[n]cc21 Amb18352241 [2,0,0,0,0,0|2,0,0]=4 480 B14R2.31359 NC(=O)c1ccnc2c1cccc2 Amb10553804 [2,0,0,0,0,0|2,0,0]=4 481 B14R2.31359 NC(=S)c1cccc2c1cccc2 Amb1114815 [2,0,0,0,0,0|1,1,0]=4 482 B14R2.31359 NC(O)c1cccc2ccccc21 Amb24536082 [2,0,0,0,0,0|1,0,1]=4 483 B14R2.31359 O=C(Cl)c1[n]ccc2ccccc21 Amb18279331 [2,0,0,0,0,0|2,0,0]=4 484 B14R2.31359 O=C(Cl)c1cccc2[n]cccc12 Amb18280683 [2,0,0,0,0,0|2,0,0]=4 485 B14R2.31359 O=C(Cl)c1cccc2cc[n]cc21 Amb25242608 [2,0,0,0,0,0|2,0,0]=4 486 B14R2.31359 O=C(Cl)c1cccc2ccc[n]c21 Amb18948482 [2,0,0,0,0,0|2,0,0]=4 487 B14R2.31359 O=C(F)c1cccc2ccccc21 Amb25123971 [2,0,0,0,0,0|1,0,0]=3 488 B14R2.31359 O=S(Cl)c1cccc2ccccc21 Amb24737164 [2,0,0,0,0,0|2,0,0]=4 489 B14R2.31359 OB(c1cccc2c1cccc2)O Amb2383494 [2,0,0,0,0,0|1,0,1]=4 490 B14R2.31359 OC(=O)C1=CCCc2c1cccc2 Amb17232997 [2,0,0,0,0,0|0,0,2]=4 491 B14R2.31359 OC(=O)C1=CCOc2c1cccc2 Amb17233165 [2,0,0,0,0,0|1,0,1]=4 492 B14R2.31359 OC(=O)C1C=CCc2ccccc21 Amb18127206 [2,0,0,0,0,0|0,0,2]=4 493 B14R2.31359 OC(=O)C1CC=Cc2ccccc21 Amb25139390 [2,0,0,0,0,0|0,0,2]=4 494 B14R2.31359 OC(=O)[C@H]1C=CCc2ccccc21 Amb25059202 [2,0,0,0,0,0|0,0,2]=4 495 B14R2.31359 OC(=O)c1[nH+]ccc2c1cccc2 Amb2540134 [2,0,0,0,0,0|1,0,0]=3 496 B14R2.31359 OC(=O)c1[n][n]cc2ccccc21 Amb21962037 [2,0,0,0,0,0|2,0,0]=4 497 B14R2.31359 OC(=O)c1[n]ccc2c[n]ccc21 Amb18197835 [2,0,0,0,0,0|2,0,0]=4 498 B14R2.31359 OC(=O)c1[n]ccc2cc[n]cc21 Amb18197834 [2,0,0,0,0,0|2,0,0]=4 499 B14R2.31359 OC(=O)c1[n]ccc2ccc[n]c21 Amb18197833 [2,0,0,0,0,0|2,0,0]=4 500 B14R2.31359 OC(=O)c1c[n]cc2c[n]ccc21 Amb18197812 [2,0,0,0,0,0|2,0,0]=4 501 B14R2.31359 OC(=O)c1c[n]cc2ccccc21 Amb22490836 [2,0,0,0,0,0|1,0,0]=3 502 B14R2.31359 OC(=O)c1cc[n]c2c[n]ccc12 Amb23439294 [2,0,0,0,0,0|2,0,0]=4 503 B14R2.31359 OC(=O)c1cc[n]c2cc[n]cc12 Amb23455348 [2,0,0,0,0,0|2,0,0]=4 504 B14R2.31359 OC(=O)c1ccc[n+]2ccccc21 Amb25040618 [2,0,0,0,0,0|1,0,0]=3 505 B14R2.31359 OC(=O)c1cccc2C=CCOc12 Amb23558900 [2,0,0,0,0,0|1,0,1]=4 506 B14R2.31359 OC(=O)c1cccc2C=CCSc12 Amb24373246 [2,0,0,0,0,0|1,0,1]=4 507 B14R2.31359 OC(=O)c1cccc2[n]c[n]cc21 Amb24423389 [2,0,0,0,0,0|2,0,0]=4 508 B14R2.31359 OC(=O)c1cccc2c1cccn2 Amb1106270 [2,0,0,0,0,0|1,0,0]=3 509 B14R2.31359 OC(=O)c1cccc2c1ccnc2 Amb1995128 [2,0,0,0,0,0|1,0,0]=3 510 B14R2.31359 OC(=O)c1cccc2c1nccn2 Amb2548375 [2,0,0,0,0,0|2,0,0]=4 511 B14R2.31359 OC(=O)c1cccc2c[n][n]cc21 Amb23401820 [2,0,0,0,0,0|2,0,0]=4 512 B14R2.31359 OC(=O)c1cccc2c[n]c[n]c21 Amb22500590 [2,0,0,0,0,0|2,0,0]=4 513 B14R2.31359 OC(=O)c1cccc2ccccc12 Amb17748952 [2,0,0,0,0,0|0,0,0]=2 514 B14R2.31359 OC(=O)c1ccnc2c1cccc2 Amb1229911 [2,0,0,0,0,0|1,0,0]=3 515 B14R2.31359 OC(=O)c1cncc2c1cccc2 Amb2372594 [2,0,0,0,0,0|1,0,0]=3 516 B14R2.31359 OC(=S)c1cccc2ccccc21 Amb25228148 [2,0,0,0,0,0|0,1,0]=3 517 B14R2.31359 OP(=O)c1cccc2c1cccc2 Amb10571111 [2,0,0,0,0,0|1,0,0]=3 518 B14R2.31359 OS(=O)c1cccc2[n]cccc12 Amb24546018 [2,0,0,0,0,0|2,0,0]=4 519 B14R2.31359 SC(=S)c1cccc2ccccc21 Amb24411021 [2,0,0,0,0,0|0,2,0]=4 520 B14R2.31359 [O-]C(=O)c1cccc2ccccc21 Amb22045548 [2,0,0,0,0,0|0,0,1]=3 521 B14R2.31359 [O-]S(=O)c1cccc2ccccc21 Amb25828768 [2,0,0,0,0,0|1,0,1]=4 522 B14R2.1078 Brc1cccc2c(C=O)cccc12 Amb17777197 [2,0,0,0,0,0|1,0,0]=3 523 B14R2.1078 C=Cc1cccc2c(N)cccc21 Amb24602456 [2,0,0,0,0,0|2,0,0]=4 524 B14R2.1078 Cc1[n]ccc2c(C=O)cccc21 Amb24534469 [2,0,0,0,0,0|1,0,0]=3 525 B14R2.1078 Cc1cc[n]c2c(C=O)cccc21 Amb19103285 [2,0,0,0,0,0|1,0,0]=3 526 B14R2.1078 Cc1cc[n]c2c(CO)cccc21 Amb19104971 [2,0,0,0,0,0|1,0,1]=4 527 B14R2.1078 Cc1cccc2c(C=O)[n]ccc21 Amb18351938 [2,0,0,0,0,0|1,0,0]=3 528 B14R2.1078 Cc1cccc2c(C=O)cccc21 Amb18647393 [2,0,0,0,0,0|0,0,0]=2 529 B14R2.1078 Cc1cccc2c(CBr)cccc21 Amb25784692 [2,0,0,0,0,0|1,0,1]=4 530 B14R2.1078 Cc1cccc2c(CO)[n]ccc21 Amb18352700 [2,0,0,0,0,0|1,0,1]=4 531 B14R2.1078 Cc1cccc2c(CO)cc[n]c21 Amb23400204 [2,0,0,0,0,0|1,0,1]=4 532 B14R2.1078 Cc1cccc2c(cccc21)C#N Amb25337700 [2,0,0,0,0,0|1,0,1]=4 533 B14R2.1078 Cc1cccc2c1[n]ccc2NO Amb24344707 [2,0,0,0,0,0|2,0,0]=4 534 B14R2.1078 Cc1cccc2c1cccc2OC Amb24470008 [2,0,0,0,0,0|2,0,0]=4 535 B14R2.1078 Nc1cccc2c(C=O)[n]ccc21 Amb25707883 [2,0,0,0,0,0|2,0,0]=4 536 B14R2.1078 Nc1cccc2c(CO)cccc21 Amb25053338 [2,0,0,0,0,0|1,0,1]=4 537 B14R2.1078 O=Cc1[n]ccc2c(Br)cccc21 Amb23535996 [2,0,0,0,0,0|2,0,0]=4 538 B14R2.1078 O=Cc1[n]ccc2c(Cl)cccc21 Amb18352007 [2,0,0,0,0,0|2,0,0]=4 539 B14R2.1078 O=Cc1[n]ccc2c(F)cccc21 Amb18351996 [2,0,0,0,0,0|2,0,0]=4 540 B14R2.1078 O=Cc1c[n]cc2c(Br)cccc21 Amb25312689 [2,0,0,0,0,0|2,0,0]=4 541 B14R2.1078 O=Cc1c[n]cc2c(F)cccc21 Amb24511812 [2,0,0,0,0,0|2,0,0]=4 542 B14R2.1078 O=Cc1cccc2c(Cl)cccc21 Amb24357366 [2,0,0,0,0,0|1,0,0]=3 543 B14R2.1078 O=Cc1cccc2c1cc[nH]c2=O Amb16233407 [2,0,0,0,0,0|2,0,0]=4 544 B14R2.1078 O=Cc1cccc2c1cccc2F Amb10839358 [2,0,0,0,0,0|1,0,0]=3 545 B14R2.1078 OCc1cccc2c(Br)cccc21 Amb24615668 [2,0,0,0,0,0|1,0,1]=4 546 B14R2.1078 OCc1cccc2c(Cl)cccc21 Amb24531880 [2,0,0,0,0,0|1,0,1]=4 547 B14R2.1078 OCc1cccc2c(F)cccc21 Amb24559934 [2,0,0,0,0,0|1,0,1]=4 548 B14R2.1078 Oc1cccc2c(C=O)cccc21 Amb24433301 [2,0,0,0,0,0|1,0,0]=3 549 B14R2.8045 CC1=CC(=O)c2cccc(C)c2N1 Amb18178053 [2,0,0,0,0,0|2,0,0]=4 550 B14R2.8045 CC1=CC=CN2C(=O)C=C(O)N=C21 Amb18010819 [2,0,0,0,0,0|2,0,0]=4 551 B14R2.8045 Cc1cc(N)c2cccc(C)c2c1 Amb18126817 [2,0,0,0,0,0|2,0,0]=4 552 B14R2.8045 Cc1cc(O)c2c(n1)c(C)ccc2 Amb1099190 [2,0,0,0,0,0|2,0,0]=4 553 B14R2.8045 Cc1cc(O)c2cccc(C)c2c1 Amb25282819 [2,0,0,0,0,0|1,0,0]=3 554 B14R2.8045 Cc1cc(O)c2cccc(Cl)c2c1 Amb25319973 [2,0,0,0,0,0|2,0,0]=4 555 B14R2.8045 Cc1cc(O)cc2c1[n]ccc2C Amb24631193 [2,0,0,0,0,0|1,0,1]=4 556 B14R2.8045 Cc1cc[n]c2c(O)cc(F)cc21 Amb24445984 [2,0,0,0,0,0|2,0,0]=4 557 B14R2.8045 Cc1cccc2C(=O)C=C(N)Oc21 Amb25123399 [2,0,0,0,0,0|2,0,0]=4 558 B14R2.8045 Cc1cccc2C(=O)NC(Cl)=Cc21 Amb24444402 [2,0,0,0,0,0|2,0,0]=4 559 B14R2.8045 Cc1cccc2C(O)=CC(=O)Nc21 Amb19517153 [2,0,0,0,0,0|1,0,1]=4 560 B14R2.8045 Cc1cccc2C(O)=CC(=O)Oc21 Amb19667408 [2,0,0,0,0,0|1,0,1]=4 561 B14R2.8045 Cc1cccc2c(N)cc(O)[n]c21 Amb21950907 [2,0,0,0,0,0|2,0,0]=4 562 B14R2.8045 Cc1cccc2c1cc(N)cc2N Amb25336513 [2,0,0,0,0,0|2,0,0]=4 563 B14R2.8045 OC1=CC(=O)c2cccc(F)c2O1 Amb25820524 [2,0,0,0,0,0|2,0,0]=4 564 B14R2.8045 Oc1cc(=O)n2c(n1)c(C)ccc2 Amb2232996 [2,0,0,0,0,0|2,0,0]=4 565 B14R2.8045 Oc1cc(Cl)c2c(c1)c(Cl)ccc2 Amb17595772 [2,0,0,0,0,0|2,0,0]=4 566 B14R2.8045 Oc1cc(O)c2cccc(Cl)c2[n]1 Amb23449371 [2,0,0,0,0,0|2,0,0]=4 567 B16R1.85 Cc1c(NC(=O)\C=C/C(=O)O)cccc1C Amb2459425 [0,1,1,0,0,0|1,0,1]=4 568 B16R1.85 Cc1c(NC(=O)\C=C/C(=O)O)cccc1Cl Amb1350454 [0,1,1,0,0,0|1,0,1]=4 569 B16R1.85 Cc1c(NC(=O)\C=C\C(=O)O)cccc1C Amb1349192 [0,1,1,0,0,0|1,0,1]=4 570 B16R1.85 Cc1c(NC(=O)\C=C\C(=O)O)cccc1Cl Amb1572408 [0,1,1,0,0,0|1,0,1]=4 571 B16R1.1369 CCc1ccccc1NC(=O)\C=C/C(=O)O Amb2459523 [0,1,1,0,0,0|1,0,1]=4 572 B16R1.1369 CSc1ccccc1NC(=O)\C=C/C(=O)O Amb2581411 [0,1,1,0,0,0|1,0,1]=4 573 B16R1.7412 OC(=O)\C=C(/C(=O)Nc1ccccc1C)\C Amb1269956 [0,1,1,0,0,0|1,0,1]=4 574 B16R1.7488 Cc1ccc(cc1NC(=O)C=CC(=O)O)Cl Amb15702605 [0,1,1,0,0,0|1,0,1]=4 575 B16R1.7488 Cc1ccc(cc1NC(=O)\C=C/C(=O)O)C Amb1351570 [0,1,1,0,0,0|1,0,1]=4 576 B16R1.11232 Cc1cccc(C)c1NC(=O)C=CC(O)=O Amb24062743 [0,1,1,0,0,0|1,0,1]=4 577 B16R1.11232 Cc1cccc(Cl)c1NC(=O)\C=C\C(O)=O Amb22478076 [0,1,1,0,0,0|1,0,1]=4 578 B16R1.11232 O=C(Nc1c(C)cccc1C)\C=C/C(=O)O Amb2387129 [0,1,1,0,0,0|1,0,1]=4 579 B16R1.11390 O=C(Nc1ccc(cc1C)I)\C=C/C(=O)O Amb1395074 [0,1,1,0,0,0|1,0,1]=4 580 B16R1.7464 Cc1ccc(cc1\C(=C\C(=O)O)\C(=O)O)C Amb17341583 [0,1,1,0,0,0|1,0,0]=3 581 B16R1.7464 OC(=O)\C(=C/C(=O)O)\c1cc(F)ccc1F Amb17344019 [0,1,1,0,0,0|2,0,0]=4 582 B16R1.16548 OC(=O)\C=C(/c1ccc(c(c1)Cl)C)\C(=O)O Amb1766286 [0,1,1,0,0,0|2,0,0]=4 583 B16R1.16548 OC(=O)\C=C(\c1ccc(c(c1)C)C)/C(=O)O Amb17341582 [0,1,1,0,0,0|1,0,0]=3 584 B16R1.16548 OC(=O)\C=C(\c1ccc(c(c1)C)F)/C(=O)O Amb17342953 [0,1,1,0,0,0|1,0,0]=3 585 B16R1.16548 OC(=O)\C=C(\c1ccc(c(c1)F)F)/C(=O)O Amb17344020 [0,1,1,0,0,0|2,0,0]=4 586 B16R1.19832 COc1cccc(c1)\C(=C\C(=O)O)\C(=O)O Amb17342311 [0,1,1,0,0,0|1,0,0]=3 587 B16R1.72553 C\C=C\Cc1c(cc(O)cc1C(O)=O)OC Amb22752265 [0,1,1,0,0,0|1,0,1]=4 588 B16R2.1618 COc1cc2ccccc2c(c1)B(O)O Amb21964023 [1,1,0,0,0,0|1,0,1]=4 589 B16R2.1618 COc1cc2cccnc2c(c1)C(=O)O Amb17595401 [1,1,0,0,0,0|1,0,0]=3 590 B16R2.1618 CSc1cc(C(O)=O)c2ccccc2[n]1 Amb18281639 [1,1,0,0,0,0|1,1,0]=4 591 B16R2.1618 N#Cc1cc2ccccc2c(c1)C(O)=O Amb19148575 [1,1,0,0,0,0|1,0,0]=3 592 B16R2.1618 NNc1cc(C(O)=O)c2ccccc2n1 Amb17666384 [1,1,0,0,0,0|2,0,0]=4 593 B16R2.1618 OC(=O)c1cc(NO)[n]c2ccccc21 Amb24456736 [1,1,0,0,0,0|1,0,0]=3 594 B16R2.3996 Oc1cc2ccccc2c(c1)S(=O)(=O)N Amb16204965 [1,1,0,0,0,0|1,0,1]=4 595 B16R2.3996 Oc1cc2ccccc2c(c1)S(=O)(=O)O Amb17596128 [1,1,0,0,0,0|1,0,0]=3 596 B16R2.12541 Brc1ccc2c(c1)nc(cc2C(=O)O)C Amb2372058 [1,1,0,0,0,0|2,0,0]=4 597 B16R2.12541 Cc1cc2NC(=O)C=C(C(O)=O)c2cc1 Amb18042956 [1,1,0,0,0,0|1,0,1]=4 598 B16R2.12541 Cc1ccc2c(c1)nc(cc2C(=O)O)Br Amb17505770 [1,1,0,0,0,0|2,0,0]=4 599 B16R2.12541 Cc1ccc2c(c1)nc(cc2C(=O)O)C Amb1102664 [1,1,0,0,0,0|2,0,0]=4 600 B16R2.12541 Cc1ccc2c(c1)nc(cc2C(=O)O)Cl Amb17505736 [1,1,0,0,0,0|2,0,0]=4 601 B16R2.12541 Cc1ccc2c(c1)nc(cc2C(=O)O)O Amb1102663 [1,1,0,0,0,0|1,0,0]=3 602 B16R2.12541 Cc1ccc2c(cc(N)cc2C(O)=O)[n]1 Amb24091986 [1,1,0,0,0,0|2,0,0]=4 603 B16R2.12541 Fc1ccc2c(c1)nc(cc2C(=O)O)Br Amb17505773 [1,1,0,0,0,0|2,0,0]=4 604 B16R2.12541 Fc1ccc2c(c1)nc(cc2C(=O)O)C Amb1127787 [1,1,0,0,0,0|2,0,0]=4 605 B16R2.12541 OC(=O)C1=CC(=O)Nc2cc(Br)ccc21 Amb18042988 [1,1,0,0,0,0|1,0,1]=4 606 B16R2.12541 OC(=O)C1=CC(=O)Nc2cc(Cl)ccc21 Amb18042965 [1,1,0,0,0,0|1,0,1]=4 607 B16R2.12541 OC(=O)C1=CC(=O)Nc2cc(F)ccc21 Amb18545006 [1,1,0,0,0,0|1,0,1]=4 608 B16R2.12541 OC(=O)c1cc(Cl)cc2cc(Br)c[n]c21 Amb22235237 [1,1,0,0,0,0|2,0,0]=4 609 B16R2.12541 Oc1cc(c2ccc(F)cc2[n]1)C(O)=O Amb18042950 [1,1,0,0,0,0|1,0,0]=3 610 B16R2.22312 CC(=O)c1cc(C)c(c2c1cccc2)C Amb17595260 [1,1,0,0,0,0|2,0,0]=4 611 B16R2.22312 CN1C=C(C(O)=O)c2ccccc2C1=O Amb18548499 [1,1,0,0,0,0|2,0,0]=4 612 B16R2.22312 CN1c2ccccc2C(=CC1=O)C(O)=O Amb18545028 [1,1,0,0,0,0|1,0,1]=4 613 B16R2.22312 Cc1c2ccccc2c([n]c1C)C(O)=O Amb23560127 [1,1,0,0,0,0|2,0,0]=4 614 B16R2.22312 NN1C=C(C(O)=O)c2ccccc2C1=O Amb23525034 [1,1,0,0,0,0|2,0,0]=4 615 B16R2.22312 Nc1cc(c2ccc[n]c2c1O)C(O)=O Amb24091999 [1,1,0,0,0,0|2,0,0]=4 616 B16R2.22312 OC(=O)c1cc(Cl)c(Cl)c2cc[n]cc21 Amb18352701 [1,1,0,0,0,0|2,0,0]=4 617 B16R2.22312 OC(=O)c1cc(F)c(Br)c2ccc[n]c12 Amb23448977 [1,1,0,0,0,0|2,0,0]=4 618 B16R2.23374 CC1=C(C(O)=O)c2ccccc2NC1=O Amb19550613 [1,1,0,0,0,0|1,0,1]=4 619 B16R2.23374 OC(=O)C=1c2ccccc2NC(=O)C1O Amb22903161 [1,1,0,0,0,0|1,0,1]=4 620 B16R2.23374 OC(=O)c1c(Br)c(Cl)[n]c2ccccc21 Amb23557104 [1,1,0,0,0,0|2,0,0]=4 621 B16R2.23374 OC(=O)c1c(F)c(Br)[n]c2ccccc21 Amb22547376 [1,1,0,0,0,0|2,0,0]=4 622 B16R2.23374 OC(=O)c1c(F)c(F)cc2c1cccc2 Amb1028077 [1,1,0,0,0,0|1,0,0]=3 623 B16R2.23374 OC(=O)c1c(O)c(Cl)nc2c1cccc2 Amb10067833 [1,1,0,0,0,0|2,0,0]=4 624 B16R2.23374 OC(=O)c1c(O)c(O)cc2c1cccc2 Amb1816220 [1,1,0,0,0,0|0,0,0]=2 625 B16R2.23502 Brc1ccc2c(c1)c(cc(n2)C)C(=O)O Amb1085833 [1,1,0,0,0,0|2,0,0]=4 626 B16R2.23502 Cc1cc(C(O)=O)c2[n]c(C)ccc2c1 Amb18352794 [1,1,0,0,0,0|2,0,0]=4 627 B16R2.23502 Cc1cc2C(=CC(=O)Nc2cc1)C(O)=O Amb18042953 [1,1,0,0,0,0|1,0,1]=4 628 B16R2.23502 Cc1ccc2c(c1)c(cc(n2)Br)C(=O)O Amb17505771 [1,1,0,0,0,0|2,0,0]=4 629 B16R2.23502 Cc1ccc2c(c1)c(cc(n2)Cl)C(=O)O Amb17505737 [1,1,0,0,0,0|2,0,0]=4 630 B16R2.23502 Cc1ccc2cc(Cl)cc(C(O)=O)c2[n]1 Amb19103858 [1,1,0,0,0,0|2,0,0]=4 631 B16R2.23502 Cc1ccc2cc(F)cc(C(O)=O)c2[n]1 Amb19103857 [1,1,0,0,0,0|2,0,0]=4 632 B16R2.23502 Fc1ccc2c(c1)c(cc(n2)Br)C(=O)O Amb17505774 [1,1,0,0,0,0|2,0,0]=4 633 B16R2.23502 Fc1ccc2c(c1)c(cc(n2)C)C(=O)O Amb1270908 [1,1,0,0,0,0|2,0,0]=4 634 B16R2.23502 Fc1ccc2c(c1)c(cc(n2)O)C(=O)O Amb10607400 [1,1,0,0,0,0|1,0,0]=3 635 B16R2.23502 NC(=O)c1cc(O)[n]c2ccc(F)cc21 Amb20513700 [1,1,0,0,0,0|2,0,0]=4 636 B16R2.23502 OC(=O)C1=CC(=O)Nc2ccc(Br)cc21 Amb18545022 [1,1,0,0,0,0|1,0,1]=4 637 B16R2.23502 OC(=O)C1=CC(=O)Nc2ccc(Cl)cc21 Amb18545007 [1,1,0,0,0,0|1,0,1]=4 638 B16R2.23502 OC(=O)C1=CC(=O)Nc2ccc(F)cc21 Amb18042957 [1,1,0,0,0,0|1,0,1]=4 639 B16R2.23502 OC(=O)C1=CC(=O)Oc2ccc(Br)cc21 Amb23569213 [1,1,0,0,0,0|1,0,1]=4 640 B16R2.23502 OC(=O)C1=CC(=O)Oc2ccc(Cl)cc21 Amb23569216 [1,1,0,0,0,0|1,0,1]=4 641 B16R2.23502 OC(=O)C1=CC(=O)Oc2ccc(F)cc21 Amb23569212 [1,1,0,0,0,0|1,0,1]=4 642 B16R2.23502 OC(=O)c1cc(Cl)[n]c2ccc(Br)cc21 Amb17659282 [1,1,0,0,0,0|2,0,0]=4 643 B16R2.33951 CNC(=O)c1cc(N)cc2ccccc21 Amb23511685 [1,1,0,0,0,0|2,0,0]=4 644 B16R2.33951 CNC(=O)c1cc(O)nc2c1cccc2 Amb11220351 [1,1,0,0,0,0|2,0,0]=4 645 B16R2.33951 COC(=O)C1=CC(=O)Nc2ccccc12 Amb20032816 [1,1,0,0,0,0|1,0,1]=4 646 B16R2.33951 COC(=O)c1cc(Br)[n]c2ccccc12 Amb22640985 [1,1,0,0,0,0|2,0,0]=4 647 B16R2.33951 COC(=O)c1cc(Br)cc2ccc[n]c21 Amb22498260 [1,1,0,0,0,0|2,0,0]=4 648 B16R2.33951 COC(=O)c1cc(Br)cc2ccccc21 Amb21937115 [1,1,0,0,0,0|1,0,0]=3 649 B16R2.33951 COC(=O)c1cc(Cl)nc2c1cccc2 Amb1099332 [1,1,0,0,0,0|2,0,0]=4 650 B16R2.33951 COC(=O)c1cc(F)cc2ccc[n]c21 Amb18352792 [1,1,0,0,0,0|2,0,0]=4 651 B16R2.33951 COC(=O)c1cc(N)[n]c2ccccc12 Amb23401287 [1,1,0,0,0,0|2,0,0]=4 652 B16R2.33951 COC(=O)c1cc(N)cc2ccccc21 Amb23511683 [1,1,0,0,0,0|1,0,0]=3 653 B16R2.33951 Cc1cc2c[n]ccc2c(c1)C(=O)NO Amb19103620 [1,1,0,0,0,0|2,0,0]=4 654 B16R2.33951 Cc1cc2ccc[n]c2c(c1)C(=O)OC Amb18352791 [1,1,0,0,0,0|2,0,0]=4 655 B16R2.33951 Cc1cc2ccccc2c([n]1)C(=O)OC Amb18349179 [1,1,0,0,0,0|2,0,0]=4 656 B16R2.33951 ONC(=O)c1cc(Cl)cc2c[n]ccc21 Amb18352536 [1,1,0,0,0,0|2,0,0]=4 657 B16R2.33951 ONC(=O)c1cc(F)cc2c[n]ccc21 Amb18352534 [1,1,0,0,0,0|2,0,0]=4 658 B16R2.33951 ONC(=O)c1cc(F)cc2ccc[n]c21 Amb18352634 [1,1,0,0,0,0|2,0,0]=4 659 B16R2.126927 Cc1cc(C(O)=O)c2c(Cl)cccc2[n]1 Amb18945335 [1,1,0,0,0,0|2,0,0]=4 660 B16R2.126927 Cc1nc2cccc(c2c(c1)C(=O)O)Br Amb1109917 [1,1,0,0,0,0|2,0,0]=4 661 B16R2.126927 Oc1cc(c2c(Br)cccc2[n]1)C(O)=O Amb24455127 [1,1,0,0,0,0|1,0,0]=3 662 B16R2.126927 Oc1cc(c2c(Cl)cccc2[n]1)C(O)=O Amb18279558 [1,1,0,0,0,0|1,0,0]=3 663 B16R2.22858 Cc1ccc2c(Cl)[n]ccc2c1C(O)=O Amb21963334 [1,1,0,0,0,0|2,0,0]=4 664 B16R2.22858 OC(=O)c1c(F)c[n]c2c(Br)cccc12 Amb22547352 [1,1,0,0,0,0|2,0,0]=4 665 B16R2.22858 OC(=O)c1c2[n]ccc(Cl)c2ccc1Cl Amb22547590 [1,1,0,0,0,0|2,0,0]=4 666 B16R2.22886 Cc1cc[n]c2c1cccc2S(O)(=O)=O Amb24070549 [1,1,0,0,0,0|2,0,0]=4 667 B16R2.22898 Cc1c[n]c(C(O)=O)c2cccc(Br)c21 Amb18349151 [1,1,0,0,0,0|2,0,0]=4 668 B16R2.22898 Cc1cccc2c([n]cc(Br)c21)C(N)=O Amb18350242 [1,1,0,0,0,0|2,0,0]=4 669 B16R2.22898 OC(=O)c1[n]cc(Br)c2c1cccc2Br Amb19101891 [1,1,0,0,0,0|2,0,0]=4 670 B16R2.24441 Cc1ccc(Br)c2c([n]ccc21)C(O)=O Amb18349152 [1,1,0,0,0,0|1,0,0]=3 671 B16R2.24441 Cc1ccc(Br)c2cc[n]c(C(O)=O)c21 Amb19100597 [1,1,0,0,0,0|2,0,0]=4 672 B16R2.24441 Cc1ccc(Cl)c2[n]ccc(C(O)=O)c21 Amb25133182 [1,1,0,0,0,0|2,0,0]=4 673 B16R2.24441 Nc1ccc(Br)c2cc[n]c(C(O)=O)c21 Amb19100018 [1,1,0,0,0,0|2,0,0]=4 674 B16R2.24441 Nc1ccc(F)c2c([n]ccc21)C(O)=O Amb19100020 [1,1,0,0,0,0|2,0,0]=4 675 B16R2.24441 Nc1ccc(F)c2cc[n]c(C(O)=O)c21 Amb19100014 [1,1,0,0,0,0|2,0,0]=4 676 B16R2.24441 OC(=O)C1=CCCc2c1c(C)ccc2C Amb17237449 [1,1,0,0,0,0|0,0,2]=4 677 B16R2.24441 OC(=O)C1=CCOc2c1c(C)ccc2C Amb17237985 [1,1,0,0,0,0|1,0,1]=4 678 B16R2.24441 OC(=O)c1[n]ccc2c(Br)ccc(Cl)c21 Amb18349161 [1,1,0,0,0,0|2,0,0]=4 679 B16R2.24441 OC(=O)c1[n]ccc2c(F)ccc(Br)c21 Amb19100607 [1,1,0,0,0,0|2,0,0]=4 680 B16R2.24441 OC(=O)c1cc[n]c2c(Cl)ccc(F)c12 Amb24340942 [1,1,0,0,0,0|2,0,0]=4 681 B16R2.24441 OC(=O)c1cc[n]c2c1c(Cl)ccc2Cl Amb25325018 [1,1,0,0,0,0|2,0,0]=4 682 B16R2.24441 OC(=O)c1cc[n]c2c1c(F)ccc2F Amb25033951 [1,1,0,0,0,0|2,0,0]=4 683 B16R2.26166 CC1=CC(=O)c2cccc(C(O)=O)c2N1 Amb18011629 [1,1,0,0,0,0|2,0,0]=4 684 B16R2.26166 Cc1cc(C)[n]c2c1cccc2C(C)=O Amb18353446 [1,1,0,0,0,0|2,0,0]=4 685 B16R2.26166 Cc1cc(C)[n]c2c1cccc2C(O)=O Amb19103860 [1,1,0,0,0,0|1,0,0]=3 686 B16R2.26166 Cc1cc(C)c2c(c1)C(=CCC2)C(=O)O Amb17237448 [1,1,0,0,0,0|0,0,2]=4 687 B16R2.26166 Cc1cc(C)c2c(c1)C(=CCO2)C(=O)O Amb17237983 [1,1,0,0,0,0|1,0,1]=4 688 B16R2.26166 Cc1cc(F)c2[n]ccc(C(O)=O)c2c1 Amb23448978 [1,1,0,0,0,0|2,0,0]=4 689 B16R2.26166 Cc1cc(F)cc2c1[n]ccc2C(O)=O Amb23448975 [1,1,0,0,0,0|1,0,0]=3 690 B16R2.26166 Cc1cc(S)c2cccc(C(O)=O)c2[n]1 Amb24120188 [1,1,0,0,0,0|2,0,0]=4 691 B16R2.26166 Cc1cc2c([n]ccc2C(O)=O)c(C)[n]1 Amb25803352 [1,1,0,0,0,0|2,0,0]=4 692 B16R2.26166 Nc1cc(Br)cc2c([n]ccc21)C(O)=O Amb19100012 [1,1,0,0,0,0|2,0,0]=4 693 B16R2.26166 Nc1cc(F)cc2c([n]ccc21)C(O)=O Amb19100010 [1,1,0,0,0,0|2,0,0]=4 694 B16R2.26166 OC(=O)c1[n]ccc2c1cc(Cl)cc2Cl Amb18349145 [1,1,0,0,0,0|2,0,0]=4 695 B16R2.26166 OC(=O)c1cc[n]c2c(Cl)cc(F)cc12 Amb25331362 [1,1,0,0,0,0|2,0,0]=4 696 B16R2.26166 OC(=O)c1cc[n]c2c1cc(Cl)cc2Cl Amb25252589 [1,1,0,0,0,0|2,0,0]=4 697 B16R2.26166 OC(=O)c1cc[n]c2c1cc(F)cc2F Amb25331361 [1,1,0,0,0,0|2,0,0]=4 698 B16R2.26166 OC(=O)c1cccc2c1cc(Br)cc2Br Amb20248854 [1,1,0,0,0,0|1,0,0]=3 699 B16R2.26166 OC(=O)c1cccc2c1cc(F)cc2F Amb20248875 [1,1,0,0,0,0|1,0,0]=3 700 B16R2.33905 COC(=O)c1[n]ccc2c(Br)cccc21 Amb18349211 [1,1,0,0,0,0|2,0,0]=4 701 B16R2.33905 COC(=O)c1[n]ccc2c(N)cccc21 Amb19100619 [1,1,0,0,0,0|2,0,0]=4 702 B16R2.33905 COC(=O)c1cc[n]c2c(Br)cccc12 Amb21857682 [1,1,0,0,0,0|2,0,0]=4 703 B16R2.33905 COC(=O)c1cc[n]c2c(Cl)cccc12 Amb25855175 [1,1,0,0,0,0|2,0,0]=4 704 B16R2.33905 COC(=O)c1cccc2c(Br)cc[n]c21 Amb22899343 [1,1,0,0,0,0|2,0,0]=4 705 B16R2.33905 COC(=O)c1cccc2c(Cl)cc[n]c21 Amb22899345 [1,1,0,0,0,0|2,0,0]=4 706 B16R2.33905 COC(=O)c1cccc2c(N)c[n]cc12 Amb24183748 [1,1,0,0,0,0|2,0,0]=4 707 B16R2.33905 COC(=O)c1cccc2c(N)cc[n]c12 Amb22899344 [1,1,0,0,0,0|2,0,0]=4 708 B16R2.33905 COC(=O)c1cccc2c(N)cccc12 Amb24083208 [1,1,0,0,0,0|1,0,0]=3 709 B16R2.33905 COC(=O)c1cccc2c(O)cc[n]c12 Amb22057530 [1,1,0,0,0,0|2,0,0]=4 710 B16R2.33905 COC(=O)c1cccc2c(O)cccc12 Amb19958554 [1,1,0,0,0,0|1,0,0]=3 711 B16R2.33905 COC(=O)c1cccc2c1C=CNC2=O Amb22490776 [1,1,0,0,0,0|2,0,0]=4 712 B16R2.33905 COC(=O)c1cccc2c1NC=CC2=O Amb22057564 [1,1,0,0,0,0|2,0,0]=4 713 B16R2.33905 COC(=O)c1cccc2c1cccc2Cl Amb10788874 [1,1,0,0,0,0|1,0,0]=3 714 B16R2.33905 Cc1cc[n]c2c1[n]ccc2C(=O)OC Amb25085583 [1,1,0,0,0,0|2,0,0]=4 715 B16R2.33905 Cc1cc[n]c2c1cccc2C(=O)NO Amb18352564 [1,1,0,0,0,0|1,0,0]=3 716 B16R2.33905 Cc1cccc2c1[n]ccc2C(=O)OC Amb23400207 [1,1,0,0,0,0|1,0,0]=3 717 B16R2.33905 Cc1cccc2c1c[n]cc2C(=O)NC Amb17971688 [1,1,0,0,0,0|2,0,0]=4 718 B16R2.33905 Cc1cccc2c1c[n]cc2C(=O)OC Amb19110695 [1,1,0,0,0,0|1,0,0]=3 719 B16R2.33905 NNC(=O)c1cccc2c(Br)cccc21 Amb21968713 [1,1,0,0,0,0|2,0,0]=4 720 B16R2.33905 NNC(=O)c1cccc2c(Cl)cccc21 Amb21968714 [1,1,0,0,0,0|2,0,0]=4 721 B16R2.33905 ONC(=O)c1[n]ccc2c(Cl)cccc21 Amb19103637 [1,1,0,0,0,0|2,0,0]=4 722 B16R2.33905 ONC(=O)c1cc[n]c2c(Br)cccc12 Amb23589534 [1,1,0,0,0,0|2,0,0]=4 723 B16R2.33905 ONC(=O)c1cc[n]c2c(F)cccc12 Amb23589533 [1,1,0,0,0,0|2,0,0]=4 724 B16R2.33905 ONC(=O)c1cccc2c(Br)cccc21 Amb23551823 [1,1,0,0,0,0|1,0,0]=3 725 B16R2.33905 ONC(=O)c1cccc2c(Cl)cccc21 Amb23551826 [1,1,0,0,0,0|1,0,0]=3 726 B16R2.36827 CCc1cccc2c1OCC=C2C(=O)O Amb17237981 [1,1,0,0,0,0|1,0,1]=4 727 B16R2.36827 CCc1cccc2c1[n]ccc2C(O)=O Amb23585705 [1,1,0,0,0,0|1,0,0]=3 728 B16R2.36827 COc1cccc2c([n]ccc21)C(N)=O Amb19103386 [1,1,0,0,0,0|2,0,0]=4 729 B16R2.36827 COc1cccc2c(cccc21)B(O)O Amb24068654 [1,1,0,0,0,0|1,0,1]=4 730 B16R2.36827 COc1cccc2c(cccc21)C(O)=O Amb18653798 [1,1,0,0,0,0|0,0,0]=2 731 B16R2.36827 COc1cccc2c1OCC=C2C(=O)O Amb17238753 [1,1,0,0,0,0|1,0,1]=4 732 B16R2.36827 COc1cccc2c1[nH+]ccc2C(O)=O Amb24113229 [1,1,0,0,0,0|1,0,0]=3 733 B16R2.36827 COc1cccc2c1[n]ccc2C(O)=O Amb23592245 [1,1,0,0,0,0|1,0,0]=3 734 B16R2.36827 NNc1cccc2c(cccc21)C(O)=O Amb24106346 [1,1,0,0,0,0|1,0,0]=3 735 B16R2.98784 CN1c2cc[n]c(C(O)=O)c2C=CC1=O Amb23592152 [1,1,0,0,0,0|2,0,0]=4 736 B16R2.98784 Cc1c(Cl)ccc2c1[n]ccc2C(O)=O Amb24470731 [1,1,0,0,0,0|1,0,0]=3 737 B16R2.98784 Cc1c(F)ccc2c1[n]ccc2C(O)=O Amb25761402 [1,1,0,0,0,0|1,0,0]=3 738 B16R2.98784 Cc1ccc2c([n]ccc2C(O)=O)c1C Amb25727744 [1,1,0,0,0,0|1,0,0]=3 739 B16R2.98784 Cc1ccc2c([n]ccc2C(O)=O)c1F Amb23448974 [1,1,0,0,0,0|2,0,0]=4 740 B16R2.98784 Nc1c(Br)ccc2c([n]ccc21)C(O)=O Amb19100024 [1,1,0,0,0,0|2,0,0]=4 741 B16R2.98784 Nc1c(F)ccc2c1[n]ccc2C(O)=O Amb23448955 [1,1,0,0,0,0|2,0,0]=4 742 B16R2.98784 OC(=O)C1=CCOc2c1ccc(c2C)C Amb17237982 [1,1,0,0,0,0|1,0,1]=4 743 B16R2.98784 OC(=O)c1[n]ccc2c(Br)c(Cl)ccc21 Amb19100612 [1,1,0,0,0,0|2,0,0]=4 744 B16R2.98784 OC(=O)c1[n]ccc2c(Br)c(F)ccc21 Amb19100604 [1,1,0,0,0,0|2,0,0]=4 745 B16R2.98784 OC(=O)c1cc[n]c2c(Br)c(F)ccc12 Amb23448952 [1,1,0,0,0,0|2,0,0]=4 746 B16R2.98784 OC(=O)c1cccc2c1ccc(c2F)O Amb10604316 [1,1,0,0,0,0|1,0,0]=3 747 B16R2.98784 Oc1c(F)ccc2c1[n]ccc2C(O)=O Amb23448954 [1,1,0,0,0,0|2,0,0]=4 748 B16R2.40090 Cc1cc(C=O)c2ccc(C)c(C)c2[n]1 Amb18215211 [1,1,0,0,0,0|2,0,0]=4 749 B16R2.40108 Cc1cc(C)c2cc(F)cc(C=O)c2[n]1 Amb18352219 [1,1,0,0,0,0|2,0,0]=4 750 B16R2.40108 Cc1cc(Cl)cc2c(C=O)cc(C)[n]c12 Amb18851936 [1,1,0,0,0,0|2,0,0]=4 751 B16R2.40112 Cc1ccc(C)c2c(C=O)cc(C)[n]c12 Amb18352251 [1,1,0,0,0,0|2,0,0]=4 752 B16R2.40112 Cc1ccc(Cl)c2c(C=O)cc(C)[n]c12 Amb18352257 [1,1,0,0,0,0|2,0,0]=4 753 B16R2.173217 COC(=O)c1cc(Br)cc2c1cc[n]2C Amb24183381 [0,1,0,0,1,0|2,0,0]=4 754 B16R2.333268 Cc1c2cc(N)cc(C(O)=O)c2[nH]c1C Amb18784641 [0,1,0,0,1,0|2,0,0]=4 755 B16R2.36581 Cc1[nH]c2c(CC)cccc2c1C(O)=O Amb18562710 [0,1,0,0,1,0|2,0,0]=4 756 B16R2.36581 Cc1[nH]c2c(cccc2c1C(O)=O)OC Amb18064742 [0,1,0,0,1,0|2,0,0]=4 757 B16R2.98754 Cc1c(Cl)ccc2c1[nH]c(C)c2C(O)=O Amb18761640 [0,1,0,0,1,0|2,0,0]=4 758 B16R2.98754 Cc1c2[nH]c(Cl)c(C(O)=O)c2ccc1Cl Amb18557111 [0,1,0,0,1,0|2,0,0]=4 759 B16R2.98754 Cc1ccc2c(C(O)=O)c(C)[nH]c2c1C Amb18785922 [0,1,0,0,1,0|2,0,0]=4 760 B16R2.98754 Cc1ccc2c([nH]c(Cl)c2C(O)=O)c1C Amb18058281 [0,1,0,0,1,0|2,0,0]=4 761 B16R2.127396 Cc1cccc2c1[n](C)c(C)c2C(O)=O Amb18894968 [0,1,0,0,1,0|2,0,0]=4 762 B16R2.127396 Cc1cccc2c1[n](C)c(Cl)c2C(O)=O Amb18556693 [0,1,0,0,1,0|2,0,0]=4 763 B16R2.132899 Cc1ccc(C)c2c1[nH]c(C)c2C(O)=O Amb18785923 [0,1,0,0,1,0|2,0,0]=4 764 B16R2.137817 Cc1cc(Br)cc2c1[nH]c(C)c2C(O)=O Amb25140244 [0,1,0,0,1,0|2,0,0]=4 765 B16R2.137817 Cc1cc2c([nH]c(C)c2C(O)=O)c(C)c1 Amb18785956 [0,1,0,0,1,0|2,0,0]=4 766 B16R2.137817 Cc1cc2c([s]c(C)c2C(O)=O)c(C)c1 Amb24545252 [0,1,0,0,1,0|2,0,0]=4 767 B16R2.174043 Cc1cccc2c1[s]c(C)c2C(=O)OC Amb25030744 [0,1,0,0,1,0|2,0,0]=4 768 B16R2.24455 Cc1ccc(C)c2c1c(c[n]2C)C(O)=O Amb18894982 [0,1,0,0,1,0|2,0,0]=4 769 B16R2.24455 OC(=O)C1=CC(c2c1c(C)ccc2C)C Amb17237453 [0,1,0,0,1,0|1,0,1]=4 770 B16R2.36862 CCc1cccc2c1[n](C)cc2C(O)=O Amb18562396 [0,1,0,0,1,0|2,0,0]=4 771 B16R2.36862 COc1cccc2c1C(C)C=C2C(=O)O Amb17237987 [0,1,0,0,1,0|1,0,1]=4 772 B16R2.36862 COc1cccc2c1[n](C)cc2C(O)=O Amb18562400 [0,1,0,0,1,0|2,0,0]=4 773 B16R2.97887 Cc1c(Cl)ccc2c1[n](C)cc2C(O)=O Amb18245250 [0,1,0,0,1,0|2,0,0]=4 774 B16R2.97887 Cc1ccc2c(c1C)[n](C)cc2C(O)=O Amb18894969 [0,1,0,0,1,0|2,0,0]=4 775 B16R2.355451 Cc1cc(C)c2c(c1)C(=CC2C)C(=O)O Amb17237452 [0,1,0,0,1,0|1,0,1]=4 776 B16R2.355451 Cc1cc2c(c(C)c1)[n](C)cc2C(O)=O Amb18894970 [0,1,0,0,1,0|2,0,0]=4 777 B18R2.105464 COc1cccc2C(CC(O)=O)=CC(=O)Nc21 Amb18023968 [0,1,0,0,0,1|1,0,1]=4 778 B18R2.105464 Cc1cc(CC(O)=O)c2cccc(CC)c2[n]1 Amb18851098 [0,1,0,0,0,1|2,0,0]=4 779 B18R2.119944 Cc1cc[n]c2c1cc(cc2NC(C)=O)OC Amb22497290 [0,1,0,0,0,1|2,0,0]=4 780 B18R2.508820 Cc1c2OC(=O)C=C(CC(O)=O)c2ccc1O Amb19650848 [0,1,0,0,0,1|1,0,1]=4 781 B18R2.508820 Cc1ccc2C(CC(O)=O)=CC(=O)Nc2c1C Amb23440623 [0,1,0,0,0,1|1,0,1]=4 782 B18R2.1184098 Cc1cc(C)c2[n]c(C)cc(CC(O)=O)c2c1 Amb18215269 [0,1,0,0,0,1|2,0,0]=4 783 B18R2.1184098 Cc1cc(C)c2cc(F)cc(CC(O)=O)c2[n]1 Amb18352902 [0,1,0,0,0,1|2,0,0]=4 784 B18R2.1184098 Cc1cc(Cl)cc2c(CC(O)=O)cc(C)[n]c12 Amb18215916 [0,1,0,0,0,1|2,0,0]=4 785 B18R2.1834045 Cc1cc(CC(=O)OC)c2cccc(C)c2[n]1 Amb18353089 [0,1,0,0,0,1|2,0,0]=4 786 B18R2.1834045 Cc1cc[n]c2c1cc(F)cc2CC(=O)OC Amb18353053 [0,1,0,0,0,1|2,0,0]=4 787 B18R2.522384 CC(C)c1cccc2C(=CC(=O)Nc21)C(O)=O Amb18042971 [0,2,0,0,0,0|1,0,1]=4 788 B18R2.776322 Cc1cc(C(=O)NO)c2cccc(CC)c2[n]1 Amb18352622 [0,2,0,0,0,0|2,0,0]=4 789 B18R2.776322 Cc1cc(C(=O)NO)c2cccc(OC)c2[n]1 Amb19103701 [0,2,0,0,0,0|2,0,0]=4 790 B18R2.776515 CCc1cccc2C(=CC(=O)N(C)c21)C(O)=O Amb18043009 [0,2,0,0,0,0|1,0,1]=4 791 B18R2.776515 COc1cccc2C(=CC(=O)N(C)c21)C(O)=O Amb18043011 [0,2,0,0,0,0|1,0,1]=4 792 B18R2.817308 COc1ccc(Cl)c2C(=CC(=O)Nc12)C(O)=O Amb18545013 [0,2,0,0,0,0|1,0,1]=4 793 B18R2.817308 COc1ccc(c2c1nc(C)cc2C(=O)O)C Amb17505588 [0,2,0,0,0,0|2,0,0]=4 794 B18R2.817308 COc1ccc(c2c1nc(C)cc2C(=O)O)Cl Amb17505597 [0,2,0,0,0,0|2,0,0]=4 795 B18R2.817308 COc1ccc(c2c1nc(Cl)cc2C(=O)O)C Amb17505745 [0,2,0,0,0,0|2,0,0]=4 796 B18R2.817308 Cc1ccc(OC)c2NC(=O)C=C(c12)C(O)=O Amb18545010 [0,2,0,0,0,0|1,0,1]=4 797 B18R2.832365 Cc1cc(OC)c2cc(F)cc(C(O)=O)c2[n]1 Amb18352862 [0,2,0,0,0,0|2,0,0]=4 798 B18R2.59641 OC(=O)c1cc(c2cccc(Br)c2[n]1)C(O)=O Amb23455295 [0,2,0,0,0,0|2,0,0]=4 799 B18R2.1988833 COc1cc(C(O)=O)c2ccc(F)c(F)c2[n]1 Amb24074003 [0,2,0,0,0,0|2,0,0]=4 800 B18R2.505008 Cc1ccc(C)c2c1C(=CC(=O)N2C)C(O)=O Amb18043006 [0,2,0,0,0,0|1,0,1]=4 801 B18R2.505008 Cc1ccc(Cl)c2c1N(C)C(=O)C=C2C(O)=O Amb18545041 [0,2,0,0,0,0|1,0,1]=4 802 B18R2.977240 Cc1cc(Cl)cc2c1N(C)C(=O)C=C2C(O)=O Amb18043017 [0,2,0,0,0,0|1,0,1]=4 803 B18R2.977240 Cc1cc2C(=CC(=O)N(C)c2c(C)c1)C(O)=O Amb18545034 [0,2,0,0,0,0|1,0,1]=4 804 B18R2.1263174 Cc1c(Cl)ccc2c1N(C)C(=O)C=C2C(O)=O Amb18545040 [0,2,0,0,0,0|1,0,1]=4 805 B18R2.1263174 Cc1ccc2C(=CC(=O)N(C)c2c1C)C(O)=O Amb18545033 [0,2,0,0,0,0|1,0,1]=4 806 B18R2.707639 Cc1cc(C(=O)OC)c2c(Cl)ccc(C)c2[n]1 Amb19103809 [0,2,0,0,0,0|2,0,0]=4 807 B18R2.707639 Cc1ccc(C)c2c1[n]c(C)cc2C(=O)NO Amb18352625 [0,2,0,0,0,0|2,0,0]=4 808 B18R2.707620 Cc1cc(C(=O)NO)c2ccc(Cl)c(C)c2[n]1 Amb19103711 [0,2,0,0,0,0|2,0,0]=4 809 B18R2.707620 Cc1ccc2c([n]c(C)cc2C(=O)OC)c1C Amb18352752 [0,2,0,0,0,0|2,0,0]=4 810 B18R2.631167 Cc1cccc2c1[n]c(O)cc2C(=O)NCC Amb20513706 [0,2,0,0,0,0|2,0,0]=4 811 B18R2.707635 Cc1cc(C(=O)NO)c2[n]c(C)cc(C)c2c1 Amb19103664 [0,2,0,0,0,0|2,0,0]=4 812 B18R2.707635 Cc1cc(C)[n]c2c1cc(Cl)cc2C(=O)NO Amb18352574 [0,2,0,0,0,0|2,0,0]=4 813 B18R2.707635 Cc1cc(C)[n]c2c1cc(F)cc2C(=O)OC Amb19103758 [0,2,0,0,0,0|2,0,0]=4 814 B18R2.707635 Cc1cc(C)c2[n]c(C)cc(C(=O)NO)c2c1 Amb18352620 [0,2,0,0,0,0|2,0,0]=4 815 B18R2.707635 Cc1cc(Cl)cc2c1[n]c(C)cc2C(=O)OC Amb19103806 [0,2,0,0,0,0|2,0,0]=4 816 B16R2.477 OC(=O)\C=C\C1=Cc2c(OC1)cccc2 Amb1106144 [0,0,1,1,0,0|2,0,0]=4 817 B16R2.477 OC(=O)\C=C\c1ccc2c(c1)cccc2 Amb1129250 [0,0,1,1,0,0|1,0,1]=4 818 B16R2.477 OC(=O)\C=C\c1cnc2c(c1)cccc2 Amb2419347 [0,0,1,1,0,0|2,0,0]=4 819 B16R2.2996 Cc1cc(c(O)cc1)-c2ccccc2C Amb21965564 [0,0,1,1,0,0|2,0,0]=4 820 B16R2.2996 Cc1ccccc1-c2cc(F)ccc2O Amb21965565 [0,0,1,1,0,0|2,0,0]=4 821 B16R2.2996 Cc1ccccc1C2=CC(=O)C=CC2=O Amb22228084 [0,0,1,1,0,0|1,0,1]=4 822 B16R2.2996 Oc1cc(-c2ccccc2Cl)c(O)cc1 Amb22336418 [0,0,1,1,0,0|2,0,0]=4 823 B16R2.2996 Oc1cc(-c2ccccc2Cl)c(O)cc1 Amb22729340 [0,0,1,1,0,0|2,0,0]=4 824 B16R2.22630 Nc1cccc2oc(\C=C/C(O)=O)[n]c21 Amb18108348 [0,0,1,1,0,0|2,0,0]=4 825 B16R2.22630 OC(=O)\C=C\c1cn2c(n1)cccc2C Amb17308173 [0,0,1,1,0,0|2,0,0]=4 826 B16R2.93202 Cc1cccc2\C(=C\C(O)=O)\C(=O)Nc21 Amb18062984 [0,0,1,1,0,0|1,0,1]=4 827 B16R2.321 Cc1cc(C(O)=O)c(cc1)-c2ccc[nH]2 Amb25265981 [0,0,1,1,0,0|2,0,0]=4 828 B16R2.321 Cc1cc(C(O)=O)c(cc1)-c2ccco2 Amb24722057 [0,0,1,1,0,0|2,0,0]=4 829 B16R2.321 Fc1ccc(c(c1)C(=O)O)c2cccs2 Amb1109354 [0,0,1,1,0,0|2,0,0]=4 830 B16R2.321 Nc1cc(C(O)=O)c(cc1)-c2ccc[s]2 Amb18067465 [0,0,1,1,0,0|2,0,0]=4 831 B16R2.321 OC(=O)c1cc(Br)ccc1-c2ccc[nH]2 Amb25858994 [0,0,1,1,0,0|2,0,0]=4 832 B16R2.321 OC(=O)c1cc(Br)ccc1-c2ccc[s]2 Amb25193717 [0,0,1,1,0,0|2,0,0]=4 833 B16R2.321 OC(=O)c1cc(F)ccc1-c2ccco2 Amb25702886 [0,0,1,1,0,0|2,0,0]=4 834 B16R2.321 Oc1cc(c(cc1)-[n]2cccc2)C(O)=O Amb18954498 [0,0,1,1,0,0|1,0,1]=4 835 B16R2.12130 Cc1ccc2[n]ccc(c2c1O)C(O)=O Amb24099697 [0,0,1,1,0,0|2,0,0]=4 836 B16R2.2825 Cc1cc(cc(c1)C(O)=O)-c2ccco2 Amb24729007 [0,0,1,1,0,0|2,0,0]=4 837 B16R2.2825 Nc1cc(cc(c1)C(O)=O)-c2ccc[s]2 Amb18067541 [0,0,1,1,0,0|2,0,0]=4 838 B16R2.2825 OC(=O)c1cc(cc(F)c1)-c2ccc[nH]2 Amb24543648 [0,0,1,1,0,0|2,0,0]=4 839 B16R2.2825 OC(=O)c1cc(cc(F)c1)-c2ccco2 Amb25326230 [0,0,1,1,0,0|2,0,0]=4 840 B16R2.2825 Oc1cc(cc([n]1)-c2ccc[s]2)C(O)=O Amb19887432 [0,0,1,1,0,0|2,0,0]=4 841 B16R2.22890 Cc1cc[n]c2c(F)cc(cc21)C(O)=O Amb19103865 [0,0,1,1,0,0|2,0,0]=4 842 B16R2.22890 Cc1cccc2c(Cl)cc([n]c21)C(O)=O Amb25671242 [0,0,1,1,0,0|2,0,0]=4 843 B16R2.22890 Cc1cccc2c1OC(=CC2=O)C(O)=O Amb18654431 [0,0,1,1,0,0|1,0,1]=4 844 B16R2.22890 Cc1cccc2c1[n]c(cc2C)C(O)=O Amb19103868 [0,0,1,1,0,0|2,0,0]=4 845 B16R2.22890 Cc1cccc2c1cc(cc2O)C(O)=O Amb18669676 [0,0,1,1,0,0|0,0,0]=2 846 B16R2.22890 OC(=O)c1cc(O)c2c(n1)c(C)ccc2 Amb10075341 [0,0,1,1,0,0|1,0,0]=3 847 B16R2.22890 OC(=O)c1cc(O)c2c(n1)c(O)ccc2 Amb2222985 [0,0,1,1,0,0|2,0,0]=4 848 B16R2.22890 Oc1cc([n]c2c1cccc2Br)C(O)=O Amb22755616 [0,0,1,1,0,0|2,0,0]=4 849 B16R2.22890 Oc1cc([n]c2c1cccc2F)C(O)=O Amb20171181 [0,0,1,1,0,0|2,0,0]=4 850 B16R2.22890 Oc1cc(cc2c1cccc2Cl)C(O)=O Amb18137533 [0,0,1,1,0,0|1,0,0]=3 851 B16R2.22890 Oc1cc(cc2c1cccc2F)C(O)=O Amb18669678 [0,0,1,1,0,0|1,0,0]=3 852 B16R2.2911 Cc1cc(c(O)cc1)-c2cc(C)ccc2 Amb21965587 [0,0,1,1,0,0|2,0,0]=4 853 B16R2.2911 Cc1cc(ccc1)-c2cc(F)ccc2O Amb21965588 [0,0,1,1,0,0|2,0,0]=4 854 B16R2.2911 Cc1cc(ccc1)C2=CC(N)=CNC2=O Amb18566214 [0,0,1,1,0,0|2,0,0]=4 855 B16R2.12021 Cc1cc2\C(=C\C(O)=O)\C(=O)Nc2cc1 Amb18062970 [0,0,1,1,0,0|2,0,0]=4 856 B16R2.23501 Cc1cc2c(C=C(OC2=O)C(O)=O)cc1 Amb19826207 [0,0,1,1,0,0|1,0,1]=4 857 B16R2.23501 Cc1cc2c(cc1)cc(cc2O)C(O)=O Amb18669675 [0,0,1,1,0,0|0,0,0]=2 858 B16R2.23501 Cc1ccc2NC(=CC(=O)c2c1)C(O)=O Amb19270146 [0,0,1,1,0,0|1,0,1]=4 859 B16R2.23501 Cc1ccc2OC(=CC(=O)c2c1)C(O)=O Amb17995432 [0,0,1,1,0,0|1,0,1]=4 860 B16R2.23501 Cc1ccc2c(c1)c(=O)cc(o2)C(=O)O Amb1214635 [0,0,1,1,0,0|1,0,1]=4 861 B16R2.23501 Cc1ccc2cc(cc(C)c2[n]1)C(O)=O Amb19103856 [0,0,1,1,0,0|2,0,0]=4 862 B16R2.23501 Nc1cc2c(cc1)cc(cc2O)C(O)=O Amb22752089 [0,0,1,1,0,0|1,0,0]=3 863 B16R2.23501 Nc1ccc2[n]c(cc(O)c2c1)C(O)=O Amb22057771 [0,0,1,1,0,0|2,0,0]=4 864 B16R2.23501 Oc1cc([n]c2ccc(Br)cc12)C(O)=O Amb22057769 [0,0,1,1,0,0|2,0,0]=4 865 B16R2.23501 Oc1cc([n]c2ccc(Cl)cc12)C(O)=O Amb22057766 [0,0,1,1,0,0|2,0,0]=4 866 B16R2.23501 Oc1cc([n]c2ccc(F)cc12)C(O)=O Amb22057768 [0,0,1,1,0,0|2,0,0]=4 867 B16R2.23501 Oc1cc(cc2ccc(Cl)cc12)C(O)=O Amb18137532 [0,0,1,1,0,0|1,0,0]=3 868 B16R2.23501 Oc1cc(cc2ccc(F)cc12)C(O)=O Amb18669677 [0,0,1,1,0,0|1,0,0]=3 869 B16R2.23501 Oc1cc2c(cc(cc2O)C(O)=O)cc1 Amb24087937 [0,0,1,1,0,0|1,0,0]=3 870 B16R2.23501 Oc1cc2c(cc1)[n]c(cc2O)C(O)=O Amb23455323 [0,0,1,1,0,0|2,0,0]=4 871 B16R3.53461 Nc1cc2cccc3NC(=O)c(c1)c23 Amb18648867 [1,0,0,1,0,0|2,0,0]=4 872 B16R3.53461 O=C1Nc2cccc3cc(Cl)cc1c32 Amb24434957 [1,0,0,1,0,0|2,0,0]=4 873 B16R3.53461 Oc1cc2cccc3NC(=O)c(c1)c23 Amb22476705 [1,0,0,1,0,0|1,0,0]=3 874 B16R3.29373 Brc1ccc2NC(=O)c3cccc1c23 Amb17845567 [1,0,0,1,0,0|2,0,0]=4 875 B16R3.29373 Cc1ccc2CC(O)c3cccc1c32 Amb24337517 [1,0,0,1,0,0|1,0,1]=4 876 B16R3.29373 Clc1ccc2NC(=O)c3cccc1c23 Amb17755404 [1,0,0,1,0,0|2,0,0]=4 877 B16R3.29373 Ic1ccc2NC(=O)c3cccc1c23 Amb17666367 [1,0,0,1,0,0|2,0,0]=4 878 B16R3.29373 Nc1ccc2CC(=O)c3cccc1c32 Amb25288162 [1,0,0,1,0,0|2,0,0]=4 879 B16R3.29373 Nc1ccc2NC(=O)c3cccc1c23 Amb17750245 [1,0,0,1,0,0|2,0,0]=4 880 B16R3.29373 Nc1ccc2NC(=O)c3cccc1c32 Amb22042504 [1,0,0,1,0,0|2,0,0]=4 881 B16R3.29373 O=C1Cc2ccc(Br)c3cccc1c32 Amb25135309 [1,0,0,1,0,0|2,0,0]=4 882 B16R3.29373 O=C1Cc2ccc(Cl)c3cccc1c32 Amb24556463 [1,0,0,1,0,0|2,0,0]=4 883 B16R3.29373 O=C1Nc2ccc(F)c3cccc1c32 Amb25785543 [1,0,0,1,0,0|2,0,0]=4 884 B16R3.29373 O=C1Oc2ccc(Br)c3cccc1c32 Amb25165116 [1,0,0,1,0,0|1,0,0]=3 885 B16R3.29373 O=C1Sc2c3c1cccc3c(cc2)Br Amb1147783 [1,0,0,1,0,0|1,1,0]=4 886 B16R3.29373 Oc1ccc2CC(=O)c3cccc1c32 Amb18648854 [1,0,0,1,0,0|2,0,0]=4 887 B16R3.29373 Oc1ccc2NC(=O)c3cccc1c23 Amb17855081 [1,0,0,1,0,0|2,0,0]=4 888 B16R3.29373 Oc1ccc2OC(=O)c3cccc1c32 Amb18649224 [1,0,0,1,0,0|1,0,0]=3 889 B14R1.160 Cc1ccccc1C(=O)\C=C\C(O)=O Amb18650403 [0,0,1,0,1,0|0,0,1]=3 890 B14R1.160 Cc1ccccc1S(=O)\C=C\C(O)=O Amb25133234 [0,0,1,0,1,0|1,0,1]=4 891 B14R1.160 Cc1ccccc1\C(\C)=C/CC(O)=O Amb24439378 [0,0,1,0,1,0|1,0,1]=4 892 B14R1.160 Nc1ccccc1C(=O)\C=C\C(O)=O Amb25101565 [0,0,1,0,1,0|1,0,1]=4 893 B14R1.160 OC(=O)\C=C\C(=O)c1ccccc1F Amb24639153 [0,0,1,0,1,0|1,0,1]=4 894 B14R1.160 OC(=O)\C=C\C(=O)c1ccccc1O Amb18650990 [0,0,1,0,1,0|1,0,1]=4 895 B14R1.160 OC(=O)\C=C\C(O)c1ccccc1Cl Amb24336588 [0,0,1,0,1,0|1,0,1]=4 896 B14R1.337 C\C(=C/C(=O)O)\Cc1ccccc1C Amb17234894 [0,0,1,0,1,0|1,0,1]=4 897 B14R1.337 C\C(=C/C(O)=O)\Nc1ccccc1C Amb24348086 [0,0,1,0,1,0|2,0,0]=4 898 B14R1.4894 OC(=O)Cc1c(C)cccc1C(=O)O Amb17470871 [0,0,1,0,1,0|1,0,1]=4 899 B14R1.4926 Cc1cccc(CC(O)=O)c1C(O)=O Amb24415415 [0,0,1,0,1,0|1,0,1]=4 900 B14R1.4926 Cc1cccc(CC(O)=O)c1C(O)=S Amb24471380 [0,0,1,0,1,0|1,0,1]=4 901 B14R1.3110 OC(=O)\C=C(\c1cccn1C)/C(=O)O Amb17595131 [0,0,1,0,1,0|2,0,0]=4 902 B14R1.4402 CC(C)=C(C(O)=O)c1cc(C)ccc1 Amb25351065 [0,0,1,0,1,0|1,0,1]=4 903 B14R1.4402 OC(=O)C(c1cccc(c1)C)C(=O)O Amb17336777 [0,0,1,0,1,0|1,0,1]=4 904 B14R2.628 Cc1cc(C(O)=O)c2cc[nH]c2c1 Amb24183467 [1,0,0,0,1,0|2,0,0]=4 905 B14R2.628 Cc1cc2cc[nH]c2c(c1)C(O)=O Amb22886592 [1,0,0,0,1,0|2,0,0]=4 906 B14R2.628 Fc1cc2cc[nH]c2c(c1)C(=O)O Amb16185931 [1,0,0,0,1,0|2,0,0]=4 907 B14R2.628 Nc1cc2cc[nH]c2c(c1)C(O)=O Amb18197034 [1,0,0,0,1,0|2,0,0]=4 908 B14R2.628 OC(=O)c1cc(Br)cc2cc[nH]c21 Amb18731626 [1,0,0,0,1,0|2,0,0]=4 909 B14R2.628 OC(=O)c1cc(Cl)cc2[nH]ccc12 Amb24331593 [1,0,0,0,1,0|2,0,0]=4 910 B14R2.628 OC(=O)c1cc(Cl)cc2ccoc21 Amb25322033 [1,0,0,0,1,0|2,0,0]=4 911 B14R2.628 OC(=O)c1cc(F)cc2[nH]ccc12 Amb22001911 [1,0,0,0,1,0|2,0,0]=4 912 B14R2.628 OC(=O)c1cc(F)cc2ccoc21 Amb24730872 [1,0,0,0,1,0|2,0,0]=4 913 B14R2.628 OC(=O)c1cc(I)cc2[nH]ccc12 Amb24331594 [1,0,0,0,1,0|2,0,0]=4 914 B14R2.628 OC(=O)c1cc(I)cc2cc[nH]c21 Amb24330510 [1,0,0,0,1,0|2,0,0]=4 915 B14R2.628 Oc1cc2cc[nH]c2c(c1)C(O)=O Amb18196467 [1,0,0,0,1,0|1,0,0]=3 916 B14R2.642 CC(=O)c1c(O)[nH]c2c1cccc2 Amb17594425 [1,0,0,0,1,0|2,0,0]=4 917 B14R2.642 CC(=O)c1c(O)cc2cccc[n]21 Amb18197446 [1,0,0,0,1,0|2,0,0]=4 918 B14R2.642 CC=1Cc2ccccc2C1C(O)=O Amb18127221 [1,0,0,0,1,0|1,0,1]=4 919 B14R2.642 Cc1c[n]2ccccc2c1C(O)=O Amb25774379 [1,0,0,0,1,0|2,0,0]=4 920 B14R2.642 Cc1cc2cccc[n]2c1C(O)=O Amb18197447 [1,0,0,0,1,0|2,0,0]=4 921 B14R2.642 Nc1[s]c2ccccc2c1C(O)=O Amb24710310 [1,0,0,0,1,0|2,0,0]=4 922 B14R2.642 Nc1c[n]2ccccc2c1C(O)=O Amb23440782 [1,0,0,0,1,0|2,0,0]=4 923 B14R2.642 Nc1oc2ccccc2c1C(O)=O Amb25381130 [1,0,0,0,1,0|2,0,0]=4 924 B14R2.642 OC(=O)C1=C(Cl)Cc2ccccc12 Amb25772788 [1,0,0,0,1,0|1,0,1]=4 925 B14R2.642 OC(=O)[n]1c(I)cc2ccccc12 Amb24067772 [1,0,0,0,1,0|2,0,0]=4 926 B14R2.642 OC(=O)c1c(Br)c[n]2ccccc21 Amb18731617 [1,0,0,0,1,0|2,0,0]=4 927 B14R2.642 OC(=O)c1c(Br)cc2cccc[n]21 Amb18731616 [1,0,0,0,1,0|2,0,0]=4 928 B14R2.642 OC(=O)c1c(Cl)[s]c2ccccc21 Amb24490222 [1,0,0,0,1,0|2,0,0]=4 929 B14R2.642 OC(=O)c1c(F)[s]c2ccccc21 Amb25783998 [1,0,0,0,1,0|2,0,0]=4 930 B14R2.642 OC(=O)c1c(F)cc2cccc[n]21 Amb25770675 [1,0,0,0,1,0|2,0,0]=4 931 B14R2.642 Oc1[n]c2cccc[n]2c1C(O)=O Amb18178488 [1,0,0,0,1,0|2,0,0]=4 932 B14R2.642 Oc1[s]c2ccccc2c1C(O)=O Amb25240870 [1,0,0,0,1,0|1,0,0]=3 933 B14R2.642 Oc1cc2cccc[n]2c1C(O)=O Amb18196437 [1,0,0,0,1,0|1,0,0]=3 934 B14R2.25733 CC(=O)C1=CC(=O)c2ccccc12 Amb24434540 [1,0,0,0,1,0|1,0,1]=4 935 B14R2.25733 CC1=CC(C(O)=O)c2ccccc12 Amb17778894 [1,0,0,0,1,0|1,0,1]=4 936 B14R2.25733 Cc1cc(C(O)=O)[n]2ccccc21 Amb18149683 [1,0,0,0,1,0|2,0,0]=4 937 B14R2.25733 Cc1cc(C(O)=O)c2cccc[n]21 Amb25288146 [1,0,0,0,1,0|2,0,0]=4 938 B14R2.25733 NC(=O)c1c[n](O)c2ccccc21 Amb24432748 [1,0,0,0,1,0|2,0,0]=4 939 B14R2.25733 Nc1cc(C(O)=O)c2cccc[n]21 Amb18196958 [1,0,0,0,1,0|2,0,0]=4 940 B14R2.25733 OC(=O)C1=CC(=O)c2ccccc12 Amb25127805 [1,0,0,0,1,0|0,0,1]=3 941 B14R2.25733 OC(=O)C1=CC(c2c1cccc2)C Amb17232998 [1,0,0,0,1,0|1,0,1]=4 942 B14R2.25733 OC(=O)C1=NC(=O)c2ccccc12 Amb24650988 [1,0,0,0,1,0|1,0,1]=4 943 B14R2.25733 OC(=O)c1cn(c2c1cccc2)C Amb1215332 [1,0,0,0,1,0|2,0,0]=4 944 B14R2.25733 Oc1[s]c(c2ccc[n]c12)C(O)=O Amb25859396 [1,0,0,0,1,0|2,0,0]=4 945 B14R2.4 C[n]1[n]cc2c(cccc12)C(O)=O Amb21928006 [1,0,0,0,1,0|2,0,0]=4 946 B14R2.4 C[n]1c[n]c2c(cccc12)C(O)=O Amb24075443 [1,0,0,0,1,0|2,0,0]=4 947 B14R2.4 C[n]1ccc2c(cccc12)C(N)=O Amb23400183 [1,0,0,0,1,0|2,0,0]=4 948 B14R2.4 Cc1[n]cc2c(ccc[n]21)C(O)=O Amb24406725 [1,0,0,0,1,0|2,0,0]=4 949 B14R2.4 Cc1[n]oc2c1cccc2C(O)=O Amb24613175 [1,0,0,0,1,0|2,0,0]=4 950 B14R2.4 Cc1c[n]c2c(ccc[n]21)C(O)=O Amb24097882 [1,0,0,0,1,0|2,0,0]=4 951 B14R2.4 Cc1coc2c1cccc2C(O)=O Amb25362105 [1,0,0,0,1,0|1,0,0]=3 952 B14R2.4 Nc1c[nH]c2c1cccc2C(O)=O Amb24593260 [1,0,0,0,1,0|2,0,0]=4 953 B14R2.4 OC(=O)c1cccc2c(I)c[nH]c21 Amb23439518 [1,0,0,0,1,0|2,0,0]=4 954 B14R2.4 OC(=O)c1cccc2c1C=NC2=O Amb22015322 [1,0,0,0,1,0|2,0,0]=4 955 B14R2.8032 CC(=O)c1c[nH]c2c1cccc2C Amb16232276 [1,0,0,0,1,0|2,0,0]=4 956 B14R2.8032 Cc1[n]ccc2c1[nH]cc2C(O)=O Amb24329401 [1,0,0,0,1,0|2,0,0]=4 957 B14R2.8032 Cc1cc[nH]c2c1[n]cc2C(O)=O Amb25305511 [1,0,0,0,1,0|2,0,0]=4 958 B14R2.8032 Cc1cc[n]c2c1[nH]cc2C(O)=O Amb24329861 [1,0,0,0,1,0|2,0,0]=4 959 B14R2.8032 Cc1ccc[n]2c([n]cc21)C(O)=O Amb25708729 [1,0,0,0,1,0|2,0,0]=4 960 B14R2.8032 Cc1cccc2c(c[n][n]21)C(O)=O Amb18862914 [1,0,0,0,1,0|2,0,0]=4 961 B14R2.8032 Cc1cccc2c(cc[n]12)C(C)=O Amb24341397 [1,0,0,0,1,0|2,0,0]=4 962 B14R2.8032 Cc1cccc2c(coc12)C(O)=O Amb17836120 [1,0,0,0,1,0|1,0,0]=3 963 B14R2.8032 Cc1cccc2c1CC=C2C(=O)O Amb17232996 [1,0,0,0,1,0|0,0,1]=3 964 B14R2.8032 Nc1cccc2c1[nH]cc2C(O)=O Amb23403348 [1,0,0,0,1,0|2,0,0]=4 965 B14R2.8032 OC(=O)C1=CCc2c1cccc2Cl Amb17236119 [1,0,0,0,1,0|1,0,1]=4 966 B14R2.8032 OC(=O)C1=CCc2c1cccc2F Amb17233387 [1,0,0,0,1,0|1,0,1]=4 967 B14R2.8032 OC(=O)c1c[nH]c2c1cccc2Cl Amb17063343 [1,0,0,0,1,0|2,0,0]=4 968 B14R2.8032 OC(=O)c1c[s]c2c(Br)cccc12 Amb25743683 [1,0,0,0,1,0|2,0,0]=4 969 B14R2.8032 OC(=O)c1c[s]c2c(F)cccc12 Amb25285198 [1,0,0,0,1,0|2,0,0]=4 970 B14R2.8032 OC(=O)c1cnc2n1cccc2C Amb2439207 [1,0,0,0,1,0|2,0,0]=4 971 B14R2.8032 OC(=O)c1coc2c(Br)cccc12 Amb25155204 [1,0,0,0,1,0|2,0,0]=4 972 B14R2.8032 OC(=O)c1coc2c(F)cccc12 Amb25770729 [1,0,0,0,1,0|2,0,0]=4 973 B14R2.8032 Oc1cccc2c1[nH]cc2C(O)=O Amb22494121 [1,0,0,0,1,0|2,0,0]=4 974 B14R2.1938 C[n]1ccc2c(C=O)cc(Br)cc12 Amb25224064 [1,0,0,0,1,0|2,0,0]=4 975 B14R2.1938 Cc1c[s]c2c(C=O)cc(I)cc21 Amb24561729 [1,0,0,0,1,0|2,0,0]=4 976 B14R2.1938 Cc1c[s]c2c(C=O)cc(S)cc21 Amb24581280 [1,0,0,0,1,0|1,1,0]=4 977 B14R2.1938 Cc1c[s]c2c1cc(O)cc2CO Amb25199116 [1,0,0,0,1,0|1,0,1]=4 978 B14R2.1938 Nc1c[s]c2c(C=O)cc(O)cc21 Amb25196855 [1,0,0,0,1,0|2,0,0]=4 979 B14R2.1938 Oc1cc(C=O)c2[s]cc(O)c2c1 Amb25237858 [1,0,0,0,1,0|2,0,0]=4 980 B14R2.4220 Cc1cccc2c(C=O)c(Br)[nH]c21 Amb25710499 [1,0,0,0,1,0|2,0,0]=4 981 B14R2.4220 Cc1cccc2c(C=O)c(Cl)[s]c21 Amb18675055 [1,0,0,0,1,0|2,0,0]=4 982 B14R2.4220 Cc1cccc2c(C=O)c(F)[s]c21 Amb24542043 [1,0,0,0,1,0|2,0,0]=4 983 B14R2.4220 O\C=C\1/C(=O)Nc2c1cccc2C Amb17039812 [1,0,0,0,1,0|1,0,1]=4 984 B14R2.4220 Oc1[s]c2c(F)cccc2c1C=O Amb25290775 [1,0,0,0,1,0|2,0,0]=4 985 B14R2.4220 Oc1[s]c2c(I)cccc2c1C=O Amb24655147 [1,0,0,0,1,0|2,0,0]=4 986 B14R2.4220 Oc1[s]c2c(S)cccc2c1C=O Amb25252320 [1,0,0,0,1,0|2,0,0]=4 987 B16R1.7414 Cc1ccccc1NC(=O)N\C=C\C(O)=O Amb22960289 [0,0,1,0,0,1|1,0,1]=4 988 B16R1.7303 OC(=O)C\C(=C/c1cccc(c1)C)\C(=O)O Amb17471731 [0,0,1,0,0,1|1,0,1]=4 989 B16R2.3995 CC(=O)Nc1cc(N)cc2c1cccc2 Amb10069340 [1,0,0,0,0,1|2,0,0]=4 990 B16R2.3995 Cc1cc2c[n]ccc2c(CC(O)=O)c1 Amb19103925 [1,0,0,0,0,1|2,0,0]=4 991 B16R2.3995 Cc1cc2ccccc2c(CC(O)=O)[n]1 Amb18352886 [1,0,0,0,0,1|2,0,0]=4 992 B16R2.3995 OC(=O)CC1=CC(=O)Nc2ccccc21 Amb18003939 [1,0,0,0,0,1|1,0,1]=4 993 B16R2.3995 OC(=O)CC1=CC(=O)Oc2ccccc21 Amb18785160 [1,0,0,0,0,1|1,0,1]=4 994 B16R2.3995 OC(=O)Cc1cc(=O)[nH]c2c1cccc2 Amb1421560 [1,0,0,0,0,1|1,0,1]=4 995 B16R2.3995 OC(=O)Cc1cc(C)nc2c1cccc2 Amb17237253 [1,0,0,0,0,1|2,0,0]=4 996 B16R2.3995 OC(=O)Cc1cc(Cl)cc2c[n]ccc21 Amb19103932 [1,0,0,0,0,1|2,0,0]=4 997 B16R2.3995 OC(=O)Cc1cc(F)cc2c[n]ccc21 Amb19103929 [1,0,0,0,0,1|2,0,0]=4 998 B16R2.3995 OC(=O)Cc1cc(F)cc2ccc[n]c21 Amb19104031 [1,0,0,0,0,1|2,0,0]=4 999 B16R2.22885 CC(=O)Nc1cccc2c(N)cccc12 Amb17777123 [1,0,0,0,0,1|2,0,0]=4 1000 B16R2.22885 CC(=O)Nc1cccc2c(O)cccc21 Amb18653492 [1,0,0,0,0,1|2,0,0]=4 1001 B16R2.22885 CC(=O)Nc1cccc2c1ccc[n+]2C Amb19869821 [1,0,0,0,0,1|2,0,0]=4 1002 B16R2.22885 CC(=O)Nc1cccc2c1ccc[n+]2C Amb21976524 [1,0,0,0,0,1|2,0,0]=4 1003 B16R2.22885 Cc1cc[n]c2c(CC(N)=O)cccc21 Amb19104205 [1,0,0,0,0,1|2,0,0]=4 1004 B16R2.22885 Cc1cccc2c(CC(O)=O)[n]ccc21 Amb19103935 [1,0,0,0,0,1|1,0,0]=3 1005 B16R2.22885 OC(=O)Cc1[n]ccc2c(Br)cccc21 Amb25298704 [1,0,0,0,0,1|2,0,0]=4 1006 B16R2.22885 OC(=O)Cc1[n]ccc2c(F)cccc21 Amb19103937 [1,0,0,0,0,1|2,0,0]=4 1007 B16R2.126889 Cc1cccc2C=C(C(O)=O)C(=O)Nc21 Amb18527837 [0,0,0,0,1,1|1,0,1]=4 1008 B16R2.126889 Cc1cccc2[n]c(c(N)cc21)C(O)=O Amb23400464 [0,0,0,0,1,1|1,0,0]=3 1009 B16R2.126889 Nc1cc2c(Br)cccc2[n]c1C(O)=O Amb23400461 [0,0,0,0,1,1|2,0,0]=4 1010 B16R2.126889 Nc1cc2c(Cl)cccc2[n]c1C(O)=O Amb23400462 [0,0,0,0,1,1|2,0,0]=4 1011 B16R2.126889 Nc1cc2c(F)cccc2[n]c1C(O)=O Amb23400463 [0,0,0,0,1,1|2,0,0]=4 1012 B16R2.126889 OC(=O)c1cc2cccc(c2nc1C)C Amb1994370 [0,0,0,0,1,1|2,0,0]=4 1013 B16R2.22914 Cc1cccc2c1[n](C)cc2CC(O)=O Amb18064290 [0,0,0,0,1,1|2,0,0]=4 1014 B16R2.126928 Cc1cccc2cc(cc(O)c21)C(O)=O Amb24087966 [0,0,0,0,1,1|0,0,0]=2 1015 B16R2.126928 Nc1cccc2cc(cc(O)c21)C(O)=O Amb24088015 [0,0,0,0,1,1|1,0,0]=3 1016 B16R2.126928 OC(=O)C1=CC(=O)c2c(cccc2O)O1 Amb19665281 [0,0,0,0,1,1|1,0,1]=4 1017 B16R2.126928 OC(=O)c1cc2cccc(O)c2c(O)c1 Amb24087922 [0,0,0,0,1,1|1,0,0]=3 1018 B16R2.126928 Oc1cc(cc2cccc(Cl)c12)C(O)=O Amb24088018 [0,0,0,0,1,1|1,0,0]=3 1019 B18R2.481171 Cc1cc(CCC(O)=O)c2[n]ccc(C)c2c1 Amb19106167 [0,0,0,0,0,2|2,0,0]=4 1020 B18R2.481171 Cc1cc(NCC(O)=O)c2cccc(C)c2[n]1 Amb24120272 [0,0,0,0,0,2|2,0,0]=4 1021 B18R2.481171 Cc1cc[n]c2c1cc(Cl)cc2CCC(O)=O Amb19106169 [0,0,0,0,0,2|2,0,0]=4 1022 B18R2.481171 Cc1cc[n]c2c1cc(F)cc2\C=C\C(O)=O Amb18354884 [0,0,0,0,0,2|2,0,0]=4 1023 B18R2.481171 Cc1cccc2c1[n]c(C)cc2OCC(O)=O Amb21955176 [0,0,0,0,0,2|2,0,0]=4