0 B20R2.156109 Cc1c(Nc2ccccc2C(O)=O)c(Cl)ccc1Cl Amb24103818 [0,0,0,0,0,0|2,0,0]=2 1 B20R2.156109 Cc1ccc(C)c(Cl)c1Nc2ccccc2C(O)=O Amb24103766 [0,0,0,0,0,0|1,0,0]=1 2 B20R2.156109 Cc1ccc(Cl)c(C)c1Nc2ccccc2C(O)=O Amb24103810 [0,0,0,0,0,0|3,0,0]=3 3 B20R2.156109 Cc1ccc(Cl)c(Nc2ccccc2C(O)=O)c1Cl Amb22349755 [0,0,0,0,0,0|0,0,0]=0 4 B20R2.156109 OC(=O)c1ccccc1Nc2c(Cl)ccc(c2Cl)C Amb16232021 [0,0,0,0,0,0|0,0,0]=0 5 B19R2.4430 CC(=O)c1ccccc1Nc2cccc(Cl)c2Cl Amb18931344 [1,0,0,0,0,0|2,0,0]=3 6 B19R2.4430 CC1=CC=CN(Cc2ccccc2C(O)=O)C1=O Amb18542477 [1,0,0,0,0,0|3,0,0]=4 7 B19R2.4430 Cc1c(Cl)cccc1Nc2[n]cccc2C(O)=O Amb19132975 [1,0,0,0,0,0|3,0,0]=4 8 B19R2.4430 Cc1c(Cl)cccc1Nc2[n]cccc2C(O)=O Amb22552490 [1,0,0,0,0,0|3,0,0]=4 9 B19R2.4430 Cc1c(Cl)cccc1Nc2ccccc2C(C)=O Amb18931356 [1,0,0,0,0,0|3,0,0]=4 10 B19R2.4430 Cc1cccc(Nc2ccccc2C([O-])=O)c1C Amb24109319 [1,0,0,0,0,0|1,0,1]=3 11 B19R2.4430 Cc1cccc(Nc2ccccc2[N+]([O-])=O)c1C Amb17912971 [1,0,0,0,0,0|2,0,1]=4 12 B19R2.4430 NC(=O)c1cccnc1Nc2cccc(c2C)C Amb17255629 [1,0,0,0,0,0|3,0,0]=4 13 B19R2.4430 OC(=O)c1ccccc1Nc2cccc(c2C)C Amb1017188 [1,0,0,0,0,0|1,0,0]=2 14 B19R2.4430 OC(=O)c1ccccc1Nc2cccc(c2C)C Amb10565084 [1,0,0,0,0,0|1,0,0]=2 15 B19R2.4430 OC(=O)c1ccccc1Nc2cccc(c2C)C Amb10565085 [1,0,0,0,0,0|1,0,0]=2 16 B19R2.4430 OC(=O)c1cccnc1Nc2cccc(c2C)Cl Amb17616621 [1,0,0,0,0,0|3,0,0]=4 17 B19R2.4430 OC(=O)c1cccnc1Nc2cccc(c2C)Cl Amb2100060 [1,0,0,0,0,0|3,0,0]=4 18 B19R2.4430 OC(=O)c1cccnc1Oc2cccc(c2C)C Amb1141848 [1,0,0,0,0,0|3,0,0]=4 19 B19R2.4555 CC(=O)c1ccccc1Nc2cc(F)ccc2F Amb18268460 [1,0,0,0,0,0|2,1,0]=4 20 B19R2.4555 CC1=CN(Cc2ccccc2C(O)=O)C(=O)C=C1 Amb18542475 [1,0,0,0,0,0|3,0,0]=4 21 B19R2.4555 Cc1cc(Nc2ccccc2C(O)=O)c(C)cc1 Amb23465412 [1,0,0,0,0,0|1,0,0]=2 22 B19R2.4555 Cc1ccc(C)c(Nc2ccccc2[N+]([O-])=O)c1 Amb17912973 [1,0,0,0,0,0|2,0,1]=4 23 B19R2.4555 Cc1ccc(Cl)cc1Nc2ccccc2C(O)=O Amb18931135 [1,0,0,0,0,0|2,0,0]=3 24 B19R2.4555 Cc1ccc(c(c1)Nc2ncccc2C(=O)N)C Amb17255626 [1,0,0,0,0,0|3,0,0]=4 25 B19R2.4555 Cc1ccc(c(c1)Oc2ncccc2C(=O)O)C Amb1133468 [1,0,0,0,0,0|3,0,0]=4 26 B19R2.4555 Cc1ccc(c(c1)Sc2ncccc2C(=O)O)C Amb1107638 [1,0,0,0,0,0|3,0,0]=4 27 B19R2.61556 Cc1cccc(Cl)c1Nc2[n]cccc2C(O)=O Amb24018698 [1,0,0,0,0,0|2,0,0]=3 28 B19R2.61556 OC(=O)c1ccccc1Nc2c(Cl)cccc2Cl Amb17597507 [1,0,0,0,0,0|0,0,0]=1 29 B21R2.467861 CCc1ccc(C)c(Nc2ccccc2C(O)=O)c1C Amb24092875 [0,1,0,0,0,0|2,0,0]=3 30 B21R2.467861 OCc1ccc(c(c1Cl)Nc2ccccc2C(=O)O)Cl Amb17615551 [0,1,0,0,0,0|0,0,0]=1 31 B21R2.811289 Cc1ccc(Cl)c(Nc2ccccc2C(=O)OC)c1Cl Amb24095731 [0,1,0,0,0,0|0,0,0]=1 32 B21R2.2429607 OC(=O)c1ccccc1Nc2c(Cl)c(Cl)cc(Cl)c2Cl Amb24101919 [0,1,0,0,0,0|1,0,0]=2 33 B21R2.4619546 Nc1ccc(Cl)c(Cl)c1Oc2ccccc2CC(O)=O Amb22752186 [0,0,0,0,0,1|3,0,0]=4 34 B18R2.1037 OCc1ccccc1Nc2cccc(Cl)c2Cl Amb23440450 [2,0,0,0,0,0|1,0,1]=4 35 B18R2.3919 CC(=O)c1ccccc1Nc2cc(Cl)ccc2 Amb18931363 [2,0,0,0,0,0|2,0,0]=4 36 B18R2.3919 CC(=O)c1ccccc1Nc2cc(F)ccc2 Amb18931371 [2,0,0,0,0,0|2,0,0]=4 37 B18R2.3919 Cc1cc(ccc1)Oc2ccc[n]c2C(O)=O Amb18660277 [2,0,0,0,0,0|2,0,0]=4 38 B18R2.3919 Cc1cccc(c1)Nc2ccccc2[N+](=O)[O-] Amb11219397 [2,0,0,0,0,0|1,0,1]=4 39 B18R2.3919 Cc1cccc(c1)Nc2ncccc2C(=O)N Amb17247739 [2,0,0,0,0,0|2,0,0]=4 40 B18R2.3919 Cc1cccc(c1)Nc2ncccc2C(=O)O Amb2100187 [2,0,0,0,0,0|1,0,0]=3 41 B18R2.3919 Cc1cccc(c1)Oc2ncccc2C(=O)O Amb1140459 [2,0,0,0,0,0|2,0,0]=4 42 B18R2.3919 OC(=O)c1ccccc1Sc2cc(Cl)ccc2 Amb24089799 [2,0,0,0,0,0|2,0,0]=4 43 B18R2.4750 Clc1ccccc1Nc2ncncc2C(=O)O Amb17072585 [2,0,0,0,0,0|2,0,0]=4 44 B18R2.4750 Nc1ccccc1Cc2ccccc2C(O)=O Amb22461474 [2,0,0,0,0,0|2,0,0]=4 45 B18R2.4750 Nc1ccccc1Nc2ccccc2C(O)=O Amb23453306 [2,0,0,0,0,0|1,0,0]=3 46 B18R2.4750 Nc1ccccc1Sc2ccccc2C(O)=O Amb24093579 [2,0,0,0,0,0|2,0,0]=4 47 B18R2.4750 OC(=O)c1[n]cccc1Oc2ccccc2Cl Amb24082663 [2,0,0,0,0,0|2,0,0]=4 48 B18R2.4750 OC(=O)c1cccnc1Nc2ccccc2F Amb19728 [2,0,0,0,0,0|1,1,0]=4 49 B18R2.4750 OC(=O)c1cccnc1Oc2ccccc2Cl Amb1136554 [2,0,0,0,0,0|2,0,0]=4 50 B18R2.4750 OC(=O)c1cccnc1Sc2ccccc2Cl Amb2318048 [2,0,0,0,0,0|2,0,0]=4 51 B18R2.4750 [NH3+]c1ccccc1Nc2ccccc2C(O)=O Amb23453327 [2,0,0,0,0,0|1,0,0]=3 52 B18R2.4750 [NH3+]c1ccccc1Nc2ccccc2C(O)=O Amb24121500 [2,0,0,0,0,0|1,0,0]=3 53 B18R2.4750 [O-][N+](=O)c1ccccc1Nc2ccccc2Cl Amb21812041 [2,0,0,0,0,0|1,0,1]=4 54 B18R2.1020 Cc1cc(Cc2ccccc2C=O)c(O)cc1 Amb24070145 [2,0,0,0,0,0|2,0,0]=4 55 B18R2.113512 O=Cc1ccccc1Nc2c(Cl)cccc2Cl Amb17612632 [2,0,0,0,0,0|0,0,0]=2 56 B18R2.113512 OCc1ccccc1Nc2c(Cl)cccc2Cl Amb17597315 [2,0,0,0,0,0|0,0,1]=3 57 B20R2.3543 OCc1cccc(c1C)Nc2ccccc2C(=O)O Amb17615548 [1,1,0,0,0,0|1,0,0]=3 58 B20R2.153212 Cc1c(Cl)cccc1Nc2cccc(F)c2C(O)=O Amb18596734 [1,1,0,0,0,0|2,0,0]=4 59 B20R2.153212 Cc1cccc(Nc2cccc(F)c2C(O)=O)c1C Amb18587616 [1,1,0,0,0,0|1,0,0]=3 60 B20R2.155940 Cc1c(Cl)c(O)ccc1Nc2ccccc2C(O)=O Amb24102016 [1,1,0,0,0,0|2,0,0]=4 61 B20R2.155940 OC(=O)c1ccccc1Nc2ccc(F)c(F)c2F Amb18268330 [1,1,0,0,0,0|1,1,0]=4 62 B20R2.248768 COC(=O)c1ccccc1Nc2nccc(c2N)C Amb17214207 [1,1,0,0,0,0|2,0,0]=4 63 B20R2.248768 Cc1cccc(Nc2ccccc2C(=O)OC)c1C Amb20407503 [1,1,0,0,0,0|1,0,0]=3 64 B20R2.248768 [Na]OC(=O)c1ccccc1Nc2cccc(c2C)C Amb16224785 [1,1,0,0,0,0|1,0,0]=3 65 B20R2.659785 Cc1c(Cl)cccc1Nc2ccc(F)cc2C(O)=O Amb18596748 [1,1,0,0,0,0|2,0,0]=4 66 B20R2.659785 Cc1c(F)cccc1Nc2ccc(N)cc2C(O)=O Amb23932036 [1,1,0,0,0,0|2,0,0]=4 67 B20R2.659785 Cc1cc(C(O)=O)c(cc1)Nc2cccc(Cl)c2C Amb18267870 [1,1,0,0,0,0|2,0,0]=4 68 B20R2.659785 Cc1cc(C(O)=O)c(cc1)Nc2cccc(Cl)c2Cl Amb18267853 [1,1,0,0,0,0|1,0,0]=3 69 B20R2.659785 Cc1cccc(Nc2ccc(F)cc2C(O)=O)c1C Amb18587649 [1,1,0,0,0,0|1,0,0]=3 70 B20R2.659785 Cc1cccc(Nc2ccc(N)cc2C(N)=O)c1C Amb23004791 [1,1,0,0,0,0|2,0,0]=4 71 B20R2.659785 Cc1cccc(Nc2ccc(N)cc2C(O)=O)c1C Amb23308912 [1,1,0,0,0,0|1,0,0]=3 72 B20R2.659785 Nc1cc(C(O)=O)c(cc1)Nc2cccc(Cl)c2Cl Amb23308919 [1,1,0,0,0,0|1,0,0]=3 73 B20R2.659785 Nc1cc(c(cc1)Nc2cccc(Cl)c2Cl)C(N)=O Amb23004997 [1,1,0,0,0,0|2,0,0]=4 74 B20R2.2861016 Cc1c(cc(Cl)cc1Cl)Nc2ccccc2C(O)=O Amb24102005 [1,1,0,0,0,0|2,0,0]=4 75 B20R2.2861016 Nc1c(cc(Cl)cc1Cl)Nc2ccccc2C(O)=O Amb24101937 [1,1,0,0,0,0|2,0,0]=4 76 B20R2.2861016 OC(=O)c1ccccc1Nc2cc(Cl)cc(Cl)c2Cl Amb24101921 [1,1,0,0,0,0|1,0,0]=3 77 B20R2.41174 COc1ccc(F)cc1Nc2ccccc2C(O)=O Amb18931247 [1,1,0,0,0,0|2,0,0]=4 78 B20R2.41174 Cc1cc(Nc2ccccc2C(O)=O)c(cc1)OC Amb23465422 [1,1,0,0,0,0|1,0,0]=3 79 B20R2.41174 Cc1cc(Sc2ccccc2C(O)=O)c(cc1)C#N Amb23945995 [1,1,0,0,0,0|2,0,0]=4 80 B20R2.156003 Cc1ccc(c(c1)C(=O)c2ccccc2C(=O)O)C Amb1207491 [1,1,0,0,0,0|2,0,0]=4 81 B20R2.156003 Clc1ccc(c(c1)C(=O)c2ccccc2C(=O)O)Cl Amb1197434 [1,1,0,0,0,0|2,0,0]=4 82 B20R2.156003 Nc1ccc(c(c1)C(=O)c2ccccc2C(=O)O)Cl Amb16204976 [1,1,0,0,0,0|2,0,0]=4 83 B20R2.658711 Cc1cc(C(O)=O)c(cc1)Nc2cc(F)ccc2F Amb18930878 [1,1,0,0,0,0|1,1,0]=4 84 B20R2.658711 Cc1cc(Nc2ccc(F)cc2C(O)=O)c(C)cc1 Amb18587645 [1,1,0,0,0,0|1,0,0]=3 85 B20R2.658711 Cc1cc(Nc2ccc(N)cc2C(N)=O)c(C)cc1 Amb23004810 [1,1,0,0,0,0|2,0,0]=4 86 B20R2.658711 Cc1ccc(Cl)cc1Nc2ccc(F)cc2C(O)=O Amb18596749 [1,1,0,0,0,0|2,0,0]=4 87 B20R2.658711 Cc1ccc(Cl)cc1Nc2ccc(N)cc2C(O)=O Amb23308917 [1,1,0,0,0,0|2,0,0]=4 88 B20R2.658711 OC(=O)c1cc(F)ccc1Nc2cc(F)ccc2F Amb18930784 [1,1,0,0,0,0|1,1,0]=4 89 B20R2.658814 Cc1cc(Nc2cccc(F)c2C(O)=O)c(C)cc1 Amb18587612 [1,1,0,0,0,0|1,0,0]=3 90 B20R2.658814 Cc1ccc(Cl)cc1Nc2cccc(F)c2C(O)=O Amb18596735 [1,1,0,0,0,0|2,0,0]=4 91 B20R2.23088 Cc1cc(C)c(c(c1)Cl)Nc2ncccc2C(=O)O Amb17279748 [1,1,0,0,0,0|2,0,0]=4 92 B20R2.76060 Cc1cccc(Cl)c1Nc2cc(N)ccc2C(O)=O Amb24018858 [1,1,0,0,0,0|1,0,0]=3 93 B20R2.634996 Cc1cccc(C)c1Nc2c(F)cccc2C(O)=O Amb18267731 [1,1,0,0,0,0|2,0,0]=4 94 B20R2.659987 Cc1cc(C(O)=O)c(cc1)Nc2c(Cl)cccc2C Amb24018700 [1,1,0,0,0,0|1,0,0]=3 95 B20R2.659987 Cc1cccc(C)c1Nc2ccc(F)cc2C(O)=O Amb18587648 [1,1,0,0,0,0|2,0,0]=4 96 B20R2.659987 Cc1cccc(Cl)c1Nc2ccc(Cl)cc2C(O)=O Amb24018697 [1,1,0,0,0,0|1,0,0]=3 97 B20R2.1310804 COC(=O)c1ccccc1Nc2c(Cl)cccc2Cl Amb24060804 [1,1,0,0,0,0|0,0,0]=2 98 B20R2.2881267 Cc1cccc(C)c1Nc2cccc(F)c2C(O)=O Amb18587615 [1,1,0,0,0,0|2,0,0]=4 99 B22R2.20483129 OC(=O)c1ccccc1Nc2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl Amb24106756 [0,2,0,0,0,0|1,0,0]=3 100 B20R2.156087 Cc1ccc(Cl)c(c1Cl)N2C=C(C=CC2=O)C(O)=O Amb23937389 [0,0,1,1,0,0|1,0,0]=3 101 B20R3.101461 O=C1OC(c2ccccc21)c3cc(Cl)ccc3Cl Amb22466906 [1,0,0,1,0,0|2,0,0]=4 102 B22R3.2988215 O=C1OC(c2c(Cl)c(Cl)cc(Cl)c2Cl)c3ccccc31 Amb22466913 [0,1,0,1,0,0|2,0,0]=4 103 B18R2.3926 OC(=O)c1cccnc1c2cccc(c2C)C Amb17247729 [1,0,0,0,1,0|2,0,0]=4 104 B18R2.3926 OC(=O)c1ncccc1c2cccc(c2C)C Amb17247730 [1,0,0,0,1,0|2,0,0]=4 105 B18R2.4045 Cc1ccc(c(c1)c2ccccc2C(=O)O)N Amb17135425 [1,0,0,0,1,0|1,0,0]=3 106 B18R2.4045 Cc1ccc(c(c1)c2cccnc2C(=O)O)C Amb17247708 [1,0,0,0,1,0|2,0,0]=4 107 B18R2.4045 Clc1ccc(c(c1)c2ccccc2C(=O)O)Cl Amb17136356 [1,0,0,0,1,0|1,0,0]=3 108 B18R2.4045 Fc1ccc(c(c1)c2ccccc2C(=O)O)F Amb17135608 [1,0,0,0,1,0|1,1,0]=4 109 B18R2.4045 Fc1ccc(c(c1)c2ccccc2C(=O)O)O Amb17321245 [1,0,0,0,1,0|2,0,0]=4 110 B18R2.58790 Cc1cc(C)[s]c1Nc2ccccc2C(O)=O Amb22749431 [1,0,0,0,1,0|2,0,0]=4 111 B18R2.39251 OC(=O)c1c[s]cc1Nc2c(Cl)cccc2Cl Amb22489964 [1,0,0,0,1,0|1,0,0]=3 112 B20R2.95550 CC(=O)c1ccccc1NCc2c(F)cccc2Cl Amb20782577 [1,0,0,0,0,1|1,1,0]=4 113 B20R2.95550 ClC(=O)c1ccccc1OCc2c(Cl)cccc2Cl Amb16186458 [1,0,0,0,0,1|2,0,0]=4 114 B20R2.95550 NC(=O)c1ccccc1OCc2c(Cl)cccc2Cl Amb1215570 [1,0,0,0,0,1|2,0,0]=4 115 B20R2.95550 OC(=O)c1ccc[n]c1NCc2c(Cl)cccc2Cl Amb23469744 [1,0,0,0,0,1|1,0,0]=3 116 B20R2.95550 OC(=O)c1ccccc1NCc2c(Cl)cccc2Cl Amb2099697 [1,0,0,0,0,1|0,0,0]=2 117 B20R2.2881207 OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb13882806 [1,0,0,0,0,1|0,0,0]=2 118 B20R2.2881207 OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb19984963 [1,0,0,0,0,1|0,0,0]=2 119 B20R2.2881207 [O-]C(=O)Cc1ccccc1Nc2c(Cl)cccc2Br Amb22055072 [1,0,0,0,0,1|0,1,1]=4 120 B20R2.2881207 [O-]C(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb1865576 [1,0,0,0,0,1|0,0,1]=3