0 B20R2.2881207 OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb13882806 [0,0,0,0,0,0|0,0,0]=0 1 B20R2.2881207 OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb19984963 [0,0,0,0,0,0|0,0,0]=0 2 B20R2.2881207 [O-]C(=O)Cc1ccccc1Nc2c(Cl)cccc2Br Amb22055072 [0,0,0,0,0,0|0,1,1]=2 3 B20R2.2881207 [O-]C(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb1865576 [0,0,0,0,0,0|0,0,1]=1 4 B19R2.5667 CC(=O)Nc1ccccc1Oc2ccccc2Cl Amb11253881 [1,0,0,0,0,0|3,0,0]=4 5 B19R2.72172 CCCc1ccccc1Nc2c(N)cccc2Cl Amb23967982 [1,0,0,0,0,0|2,0,1]=4 6 B21R2.968752 COC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb17612674 [0,1,0,0,0,0|0,0,0]=1 7 B21R2.968752 NNC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb21848328 [0,1,0,0,0,0|1,0,0]=2 8 B21R2.2430140 Nc1cc(Cl)cc(Cl)c1Oc2ccccc2CC(O)=O Amb24080779 [0,1,0,0,0,0|2,0,0]=3 9 B21R2.2430140 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13c]1Nc2c(Cl)cc(cc2Cl)O Amb17615099 [0,1,0,0,0,0|0,0,0]=1 10 B21R2.2430140 OC(=O)Cc1ccccc1Nc2c(Cl)cc(cc2Cl)O Amb17615097 [0,1,0,0,0,0|0,0,0]=1 11 B21R2.3286539 Cc1cccc(C)c1Nc2ccc(F)cc2CC(O)=O Amb18594707 [0,1,0,0,0,0|2,0,0]=3 12 B21R2.3286539 OC(=O)Cc1cc(O)ccc1Nc2c(Cl)cccc2Cl Amb17615100 [0,1,0,0,0,0|0,0,0]=1 13 B21R2.3554388 Cc1cccc(C)c1Nc2cccc(F)c2CC(O)=O Amb18594698 [0,1,0,0,0,0|2,0,0]=3 14 B21R2.4619546 Nc1ccc(Cl)c(Cl)c1Oc2ccccc2CC(O)=O Amb22752186 [0,1,0,0,0,0|2,0,0]=3 15 B21R3.468878 O=C1C=C(c2c(Cl)cccc2Cl)c3ccccc3N1 Amb23464097 [0,0,0,1,0,0|3,0,0]=4 16 B19R2.61556 Cc1cccc(Cl)c1Nc2[n]cccc2C(O)=O Amb24018698 [0,0,0,0,1,0|2,0,0]=3 17 B19R2.61556 OC(=O)c1ccccc1Nc2c(Cl)cccc2Cl Amb17597507 [0,0,0,0,1,0|0,0,0]=1 18 B19R2.101179 OC(=O)Cc1cscc1Nc2c(Cl)cccc2Cl Amb17613638 [0,0,0,0,1,0|1,0,0]=2 19 B18R2.113512 O=Cc1ccccc1Nc2c(Cl)cccc2Cl Amb17612632 [2,0,0,0,0,0|0,0,0]=2 20 B18R2.113512 OCc1ccccc1Nc2c(Cl)cccc2Cl Amb17597315 [2,0,0,0,0,0|0,0,0]=2 21 B20R2.76051 Cc1ccccc1Nc2ccc(F)cc2CC(O)=O Amb18587653 [1,1,0,0,0,0|1,0,0]=3 22 B20R2.76051 OC(=O)Cc1cc(F)ccc1Nc2ccccc2Cl Amb18596752 [1,1,0,0,0,0|0,0,0]=2 23 B20R2.76051 OC(=O)Cc1cc(F)ccc1Nc2ccccc2F Amb18590676 [1,1,0,0,0,0|0,1,0]=3 24 B20R2.148568 Cc1ccccc1Nc2cccc(F)c2CC(O)=O Amb18587621 [1,1,0,0,0,0|1,0,0]=3 25 B20R2.148568 OC(=O)Cc1c(F)cccc1Nc2ccccc2Cl Amb18596738 [1,1,0,0,0,0|0,0,0]=2 26 B20R2.148568 OC(=O)Cc1c(cccc1F)Nc2ccccc2F Amb18590670 [1,1,0,0,0,0|0,1,0]=3 27 B20R2.155985 OC(=O)Cc1ccccc1Oc2ccc(cc2Cl)Cl Amb17597581 [1,1,0,0,0,0|1,0,0]=3 28 B20R2.23088 Cc1cc(C)c(c(c1)Cl)Nc2ncccc2C(=O)O Amb17279748 [0,1,0,0,1,0|2,0,0]=4 29 B20R2.76060 Cc1cccc(Cl)c1Nc2cc(N)ccc2C(O)=O Amb24018858 [0,1,0,0,1,0|1,0,0]=3 30 B20R2.156109 Cc1c(Nc2ccccc2C(O)=O)c(Cl)ccc1Cl Amb24103818 [0,1,0,0,1,0|1,0,0]=3 31 B20R2.156109 Cc1ccc(C)c(Cl)c1Nc2ccccc2C(O)=O Amb24103766 [0,1,0,0,1,0|1,0,0]=3 32 B20R2.156109 Cc1ccc(Cl)c(C)c1Nc2ccccc2C(O)=O Amb24103810 [0,1,0,0,1,0|2,0,0]=4 33 B20R2.156109 Cc1ccc(Cl)c(Nc2ccccc2C(O)=O)c1Cl Amb22349755 [0,1,0,0,1,0|0,0,0]=2 34 B20R2.156109 OC(=O)c1ccccc1Nc2c(Cl)ccc(c2Cl)C Amb16232021 [0,1,0,0,1,0|0,0,0]=2 35 B20R2.634996 Cc1cccc(C)c1Nc2c(F)cccc2C(O)=O Amb18267731 [0,1,0,0,1,0|2,0,0]=4 36 B20R2.659987 Cc1cc(C(O)=O)c(cc1)Nc2c(Cl)cccc2C Amb24018700 [0,1,0,0,1,0|1,0,0]=3 37 B20R2.659987 Cc1cccc(C)c1Nc2ccc(F)cc2C(O)=O Amb18587648 [0,1,0,0,1,0|2,0,0]=4 38 B20R2.659987 Cc1cccc(Cl)c1Nc2ccc(Cl)cc2C(O)=O Amb24018697 [0,1,0,0,1,0|1,0,0]=3 39 B20R2.2881267 Cc1cccc(C)c1Nc2cccc(F)c2C(O)=O Amb18587615 [0,1,0,0,1,0|2,0,0]=4 40 B22R2.7563871 CCOC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl Amb17612673 [0,2,0,0,0,0|0,0,0]=2 41 B22R2.2690946 Nc1cc(Cl)c(Cl)c(Cl)c1Oc2ccccc2CC(O)=O Amb22752197 [0,2,0,0,0,0|2,0,0]=4 42 B22R2.20613945 Oc1cc(Cl)c(Nc2ccc(O)cc2CC(O)=O)c(Cl)c1 Amb24079844 [0,2,0,0,0,0|0,0,0]=2 43 B22R2.4540275 CC(C)(C(O)=O)c1ccccc1Nc2c(F)cccc2F Amb18268585 [0,2,0,0,0,0|0,2,0]=4 44 B20R3.5070115 OC(=O)Cc1cccc2[n]c3ccccc3[n]c21 Amb23556205 [1,0,0,1,0,0|1,0,1]=4 45 B20R3.5114579 OC(=O)C1Cc2ccccc2Oc3ccccc31 Amb22500889 [1,0,0,1,0,0|2,0,0]=4 46 B20R3.5114579 OC(=O)C1Sc2ccccc2Sc3ccccc31 Amb22457175 [1,0,0,1,0,0|2,0,0]=4 47 B20R3.298877 O=C1Cc2c(N1c3c(C)cccc3C)cccc2 Amb17158403 [1,0,0,1,0,0|2,0,0]=4 48 B20R3.298877 O=C1Cc2c(N1c3c(Cl)cccc3Cl)cccc2 Amb1038304 [1,0,0,1,0,0|0,0,0]=2 49 B20R3.298877 O=C1Cc2ccccc2N1c3c(Cl)cccc3Br Amb20248252 [1,0,0,1,0,0|0,1,0]=3 50 B20R3.298877 Oc1cc2ccccc2[n]1-c3c(Cl)cccc3Cl Amb23566975 [1,0,0,1,0,0|0,0,1]=3 51 B18R2.4750 Clc1ccccc1Nc2ncncc2C(=O)O Amb17072585 [1,0,0,0,1,0|2,0,0]=4 52 B18R2.4750 Nc1ccccc1Cc2ccccc2C(O)=O Amb22461474 [1,0,0,0,1,0|2,0,0]=4 53 B18R2.4750 Nc1ccccc1Nc2ccccc2C(O)=O Amb23453306 [1,0,0,0,1,0|1,0,0]=3 54 B18R2.4750 Nc1ccccc1Sc2ccccc2C(O)=O Amb24093579 [1,0,0,0,1,0|2,0,0]=4 55 B18R2.4750 OC(=O)c1[n]cccc1Oc2ccccc2Cl Amb24082663 [1,0,0,0,1,0|2,0,0]=4 56 B18R2.4750 OC(=O)c1cccnc1Nc2ccccc2F Amb19728 [1,0,0,0,1,0|1,1,0]=4 57 B18R2.4750 OC(=O)c1cccnc1Oc2ccccc2Cl Amb1136554 [1,0,0,0,1,0|2,0,0]=4 58 B18R2.4750 OC(=O)c1cccnc1Sc2ccccc2Cl Amb2318048 [1,0,0,0,1,0|2,0,0]=4 59 B18R2.4750 [NH3+]c1ccccc1Nc2ccccc2C(O)=O Amb23453327 [1,0,0,0,1,0|1,0,0]=3 60 B18R2.4750 [NH3+]c1ccccc1Nc2ccccc2C(O)=O Amb24121500 [1,0,0,0,1,0|1,0,0]=3 61 B18R2.4750 [O-][N+](=O)c1ccccc1Nc2ccccc2Cl Amb21812041 [1,0,0,0,1,0|1,0,1]=4 62 B18R2.39251 OC(=O)c1c[s]cc1Nc2c(Cl)cccc2Cl Amb22489964 [0,0,0,0,2,0|1,0,0]=3 63 B20R2.8697 OC(=O)Cc1ccccc1\N=C\c2ccccc2Cl Amb16206672 [1,0,0,0,0,1|0,0,1]=3