0 B20R2.156213 CC(C)Oc1ccc(CC2=NN=C(O)NC2=O)cc1 Amb18277580 [0,0,0,0,0,0|3,0,1]=4 1 B20R2.156213 CC(C)Oc1ccc(CC2=NN=C(S)NC2=O)cc1 Amb18277564 [0,0,0,0,0,0|3,0,1]=4 2 B20R2.156213 CC(C)Oc1ccc(Nc2ccc(Cl)cc2N)cc1 Amb7803526 [0,0,0,0,0,0|4,0,0]=4 3 B20R2.156213 CC(C)Oc1ccc(Nc2ccc(N)cc2Cl)cc1 Amb7803523 [0,0,0,0,0,0|4,0,0]=4 4 B19R2.12215 CC(C)Oc1ccc(Cc2ccc(N)cc2)cc1 Amb33625165 [1,0,0,0,0,0|2,0,0]=3 5 B19R2.47078 CCOc1ccc(Cc2cnc(N)nc2N)cc1 Amb537099 [1,0,0,0,0,0|0,0,0]=1 6 B19R2.47078 CCOc1ccc(Cc2cnc(O)nc2N)cc1 Amb17089790 [1,0,0,0,0,0|1,0,0]=2 7 B19R2.47078 CCOc1ccc(Cc2cnc(S)nc2N)cc1 Amb605268 [1,0,0,0,0,0|1,0,0]=2 8 B21R2.468194 CC(C)Oc1ccc(CC2=NN=C(NN)NC2=O)cc1 Amb18277600 [0,1,0,0,0,0|2,0,1]=4 9 B19R2.103323 CC(C)c1ccc(Cc2cnc(N)nc2N)cc1 Amb17089717 [0,0,0,0,1,0|0,0,0]=1 10 B19R2.103323 CC(C)c1ccc(Cc2cnc(O)nc2N)cc1 Amb17089786 [0,0,0,0,1,0|1,0,0]=2 11 B19R2.103323 CC(C)c1ccc(Cc2cnc(S)nc2N)cc1 Amb17089750 [0,0,0,0,1,0|1,0,0]=2 12 B19R2.103323 CN(C)c1ccc(Cc2cnc(N)nc2N)cc1 Amb17089718 [0,0,0,0,1,0|1,0,0]=2 13 B19R2.103323 CN(C)c1ccc(Cc2cnc(O)nc2N)cc1 Amb17089787 [0,0,0,0,1,0|2,0,0]=3 14 B19R2.103323 CN(C)c1ccc(Cc2cnc(S)nc2N)cc1 Amb17089751 [0,0,0,0,1,0|2,0,0]=3 15 B19R2.103323 Nc1ncc(Cc2ccc([N+](=O)[O-])cc2)c(N)n1 Amb19928905 [0,0,0,0,1,0|3,0,0]=4 16 B18R2.311 CC(C)Oc1ccc(Cc2ccccc2)cc1 Amb10808609 [2,0,0,0,0,0|2,0,0]=4 17 B18R2.4 CCOc1ccc(Nc2ccc(N)nc2)cc1 Amb7802421 [2,0,0,0,0,0|2,0,0]=4 18 B18R2.4 CCOc1ccc(Oc2ccc(N)nc2)cc1 Amb6679820 [2,0,0,0,0,0|2,0,0]=4 19 B18R2.4260 CCc1ccc(Cc2cnc(N)nc2N)cc1 Amb17089711 [2,0,0,0,0,0|0,0,0]=2 20 B18R2.4260 CCc1ccc(Cc2cnc(O)nc2N)cc1 Amb17089779 [2,0,0,0,0,0|1,0,0]=3 21 B18R2.4260 CCc1ccc(Cc2cnc(S)nc2N)cc1 Amb17089743 [2,0,0,0,0,0|1,0,0]=3 22 B18R2.4260 COc1ccc(CC2=CNC(=O)N=C2N)cc1 Amb21998235 [2,0,0,0,0,0|1,0,1]=4 23 B18R2.4260 COc1ccc(Cc2cnc(N)nc2N)cc1 Amb4417635 [2,0,0,0,0,0|0,0,0]=2 24 B18R2.4260 COc1ccc(Cc2cnc(S)nc2N)cc1 Amb17089746 [2,0,0,0,0,0|1,0,0]=3 25 B20R2.156211 CC(C)(C)c1ccc(Cc2cnc(N)nc2N)cc1 Amb17089722 [0,1,0,0,1,0|0,0,0]=2 26 B20R2.156211 CC(C)(C)c1ccc(Cc2cnc(O)nc2N)cc1 Amb17089792 [0,1,0,0,1,0|1,0,0]=3 27 B20R2.156211 CC(C)(C)c1ccc(Cc2cnc(S)nc2N)cc1 Amb17089755 [0,1,0,0,1,0|1,0,0]=3 28 B20R3.303598 Nc1nc(O)ncc1Cc2ccc3c(c2)OCO3 Amb17089795 [1,0,0,1,0,0|2,0,0]=4 29 B20R3.303598 Nc1nc(S)ncc1Cc2ccc3c(c2)OCO3 Amb17089758 [1,0,0,1,0,0|2,0,0]=4 30 B20R3.303598 Nc1ncc(Cc2ccc3c(c2)OCO3)c(N)n1 Amb3991827 [1,0,0,1,0,0|1,0,0]=3 31 B18R2.4727 CC(C)Oc1ccc(-c2cccnc2Cl)cc1 Amb17259646 [1,0,0,0,1,0|2,0,0]=4 32 B18R2.4727 CC(C)Oc1ccc(-c2cnccc2N)cc1 Amb18571898 [1,0,0,0,1,0|1,0,0]=3 33 B18R2.6290 CC(C)c1ccc(Cc2ccccc2N)cc1 Amb17142110 [1,0,0,0,1,0|2,0,0]=4 34 B18R2.271 CC(C)Oc1ccc(-c2ccc(Cl)nc2)cc1 Amb17259645 [1,0,0,0,1,0|2,0,0]=4 35 B18R2.271 CC(C)Oc1ccc(-c2ccc(N)cc2)cc1 Amb17142310 [1,0,0,0,1,0|2,0,0]=4 36 B18R2.271 CC(C)Oc1ccc(-c2ccc(N)nc2)cc1 Amb17248217 [1,0,0,0,1,0|1,0,0]=3 37 B18R2.271 CC(C)Oc1ccc(-c2ccc(N)nn2)cc1 Amb17516610 [1,0,0,0,1,0|2,0,0]=4 38 B18R2.271 CC(C)Oc1ccc(-c2cnc(N)nc2)cc1 Amb11064314 [1,0,0,0,1,0|0,0,0]=2 39 B18R2.9194 CC(C)c1ccc(Cc2ccc(N)cc2)cc1 Amb17142105 [1,0,0,0,1,0|2,0,0]=4 40 B18R2.9194 CC(C)c1ccc(Nc2ccc(N)nc2)cc1 Amb7802804 [1,0,0,0,1,0|2,0,0]=4 41 B18R2.9194 CC(C)c1ccc(Oc2ccc(N)nc2)cc1 Amb6679826 [1,0,0,0,1,0|2,0,0]=4 42 B18R2.2436 CCOc1ccc(-c2cnc(C)nc2N)cc1 Amb18572082 [1,0,0,0,1,0|1,0,0]=3 43 B18R2.2436 CCOc1ccc(-c2cnc(O)nc2N)cc1 Amb17344762 [1,0,0,0,1,0|1,0,0]=3 44 B18R2.12339 CCOc1ccc(Cc2cnn(C)c2N)cc1 Amb17090077 [1,0,0,0,1,0|2,0,0]=4 45 B18R2.3870 CC(C)Cc1ccc(-c2nc(N)sc2N)cc1 Amb3964794 [0,0,0,0,2,0|2,0,0]=4 46 B18R2.3870 CC(C)Oc1ccc(-c2cc(N)nn2C)cc1 Amb18869156 [0,0,0,0,2,0|2,0,0]=4 47 B18R2.3870 CC(C)Oc1ccc(-c2nc(N)sc2Br)cc1 Amb31187783 [0,0,0,0,2,0|2,0,0]=4 48 B18R2.3870 CC(C)Oc1ccc(-c2nc(N)sc2N)cc1 Amb18106283 [0,0,0,0,2,0|1,0,0]=3 49 B18R2.3870 CC(C)Sc1ccc(-c2nc(N)sc2N)cc1 Amb18231349 [0,0,0,0,2,0|1,1,0]=4 50 B18R2.3870 Cc1sc(N)cc1-c2ccc(OC(C)C)cc2 Amb18711080 [0,0,0,0,2,0|2,0,0]=4 51 B18R2.3870 Cc1sc(N)nc1-c2ccc(OC(C)C)cc2 Amb8835036 [0,0,0,0,2,0|2,0,0]=4 52 B18R2.4057 CC(C)c1ccc(-c2cnc(O)nc2N)cc1 Amb17344331 [0,0,0,0,2,0|1,0,0]=3 53 B18R2.4057 Cc1ncc(-c2ccc(C(C)C)cc2)c(N)n1 Amb18571626 [0,0,0,0,2,0|1,0,0]=3 54 B18R2.31532 CC(C)Oc1ccc(-c2cnn(C)c2N)cc1 Amb31099117 [0,0,0,0,2,0|2,0,0]=4 55 B18R2.31532 Cc1noc(-c2ccc(OC(C)C)cc2)c1N Amb18869463 [0,0,0,0,2,0|2,0,0]=4 56 B18R2.30869 Cc1nc(N)sc1Cc2ccc(C(C)C)cc2 Amb9289877 [0,0,0,0,2,0|2,0,0]=4 57 B18R2.132494 CC(C)c1ccc(Cc2cnn(C)c2N)cc1 Amb17090073 [0,0,0,0,2,0|2,0,0]=4 58 B20R2.15796 CC(C)COc1ccc(Nc2ccc(N)nc2)cc1 Amb17041229 [1,0,0,0,0,1|2,0,0]=4