0 B13R2.11634 Cn1ncc2c1NC(=O)C(Br)=C2 Amb23557009 [1,0,0,0,0,0|1,0,2]=4 1 B13R2.11634 Cn1ncc2c1NC(=O)C(Cl)=C2 Amb23509973 [1,0,0,0,0,0|1,0,2]=4 2 B13R2.11634 Cn1ncc2c1NC(=O)C(I)=C2 Amb28318421 [1,0,0,0,0,0|1,0,2]=4 3 B13R2.11634 Cn1ncc2c1NC(=O)C(O)=C2 Amb27873488 [1,0,0,0,0,0|1,0,2]=4 4 B13R2.11634 Cn1ncc2c1OC(=O)C(N)=C2 Amb18828551 [1,0,0,0,0,0|1,0,2]=4 5 B13R2.11642 CN1CC(N)Cc2ccn(C)c21 Amb18828057 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.134 COC(=O)C(N)Cc1cn(C)nn1 Amb33308869 [0,0,1,0,0,0|3,0,0]=4 7 B13R1.134 COC(=O)C(N)Cc1cnn(C)c1 Amb32663197 [0,0,1,0,0,0|2,0,0]=3 8 B13R1.134 COC(=O)C(N)Cc1cnn(C)c1 Amb33607456 [0,0,1,0,0,0|2,0,0]=3 9 B13R1.134 COC(=O)C(N)Cc1cnn(C)n1 Amb33036978 [0,0,1,0,0,0|3,0,0]=4 10 B13R1.134 COC(=O)C(O)Cc1cnn(C)c1 Amb33429244 [0,0,1,0,0,0|3,0,0]=4 11 B13R1.134 Cn1cc(CC(O)C(=O)NO)cn1 Amb27946529 [0,0,1,0,0,0|1,0,0]=2 12 B13R1.196 CC(C)C(=O)C(N)c1ccnn1C Amb35710339 [0,0,1,0,0,0|3,0,0]=4 13 B13R1.196 CC(C)C(=O)N(C)c1ccnn1C Amb27981504 [0,0,1,0,0,0|2,0,0]=3 14 B13R1.196 CC(N)C(=O)N(C)c1nnnn1C Amb28199668 [0,0,1,0,0,0|3,0,0]=4 15 B13R1.196 CC(N)C(C)C(O)c1ccnn1C Amb35624927 [0,0,1,0,0,0|2,0,1]=4 16 B13R1.2647 COC(=O)C(O)c1c(C)cnn1C Amb26847707 [0,0,1,0,0,0|3,0,0]=4 17 B13R1.2647 Cc1cnn(C)c1C(O)C(C)CN Amb26353573 [0,0,1,0,0,0|2,0,1]=4 18 B15R2.1007 Cc1ccc2c(c1)N(C)C(=O)C(N)C2 Amb28292536 [0,0,0,0,0,1|3,0,0]=4 19 B15R2.1007 Cc1ccc2c(c1)N(O)C(=O)C(N)C2 Amb22751310 [0,0,0,0,0,1|2,0,0]=3 20 B15R2.1007 Cc1ccc2c(c1)N(O)C(=O)[C@@H](N)C2 Amb27759430 [0,0,0,0,0,1|2,0,0]=3 21 B15R2.1007 NC1Cc2ccc(Br)cc2N(O)C1=O Amb26377745 [0,0,0,0,0,1|3,0,0]=4 22 B15R2.50608 CN1C(=O)C(N)CCc2cnn(C)c21 Amb35744896 [0,0,0,0,0,1|1,0,0]=2 23 B15R2.61372 Cc1cccc2c1N(C)C(=O)C(N)C2 Amb26051204 [0,0,0,0,0,1|3,0,0]=4 24 B15R2.61372 Cc1cccc2c1N(O)C(=O)[C@@H](N)C2 Amb27790952 [0,0,0,0,0,1|2,0,0]=3 25 B15R2.61372 NC1Cc2cccc(F)c2N(O)C1=O Amb28398522 [0,0,0,0,0,1|3,0,0]=4 26 B12R1.26 CNC(=O)NCc1cnn(C)c1 Amb27415772 [1,0,1,0,0,0|2,0,0]=4 27 B12R1.26 Cn1cc(CNC(=O)CO)cn1 Amb28369586 [1,0,1,0,0,0|2,0,0]=4 28 B12R1.31 Cn1cc(CC(N)CCO)cn1 Amb32946520 [1,0,1,0,0,0|1,0,1]=4 29 B12R1.104 C=C(C)C(N)Cc1cnn(C)c1 Amb35673374 [1,0,1,0,0,0|2,0,0]=4 30 B12R1.104 CC(=O)C(Br)Cc1cnn(C)c1 Amb27826677 [1,0,1,0,0,0|2,0,0]=4 31 B12R1.104 CC(=O)C(C)Cc1cnn(C)c1 Amb18792814 [1,0,1,0,0,0|2,0,0]=4 32 B12R1.104 CC(Cc1cn(C)nn1)C(=O)O Amb25836932 [1,0,1,0,0,0|2,0,0]=4 33 B12R1.104 CC(Cc1cnn(C)c1)C(=O)O Amb18986552 [1,0,1,0,0,0|1,0,0]=3 34 B12R1.104 CC(Cc1cnn(C)n1)C(=O)O Amb27645111 [1,0,1,0,0,0|2,0,0]=4 35 B12R1.104 CC(Nc1cnn(C)c1)C(=O)O Amb18270459 [1,0,1,0,0,0|2,0,0]=4 36 B12R1.104 CC(Oc1cnn(C)c1)C(=O)O Amb23509499 [1,0,1,0,0,0|2,0,0]=4 37 B12R1.104 CC(Sc1cnn(C)c1)C(N)=O Amb19045742 [1,0,1,0,0,0|2,0,0]=4 38 B12R1.104 Cc1cc(CC(N)C(=O)O)co1 Amb18826155 [1,0,1,0,0,0|2,0,0]=4 39 B12R1.104 Cc1cc(CC(N)C(=O)O)on1 Amb8439770 [1,0,1,0,0,0|2,0,0]=4 40 B12R1.104 Cc1cc(CC(N)C(N)=O)cs1 Amb25884795 [1,0,1,0,0,0|2,0,0]=4 41 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)cs1 Amb24446585 [1,0,1,0,0,0|2,0,0]=4 42 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)on1 Amb30621868 [1,0,1,0,0,0|2,0,0]=4 43 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)sn1 Amb29852558 [1,0,1,0,0,0|2,0,0]=4 44 B12R1.104 Cc1cc(C[C@H](N)C(=O)O)cs1 Amb25877757 [1,0,1,0,0,0|2,0,0]=4 45 B12R1.104 Cc1cc(C[C@H](N)C(=O)O)sn1 Amb29852559 [1,0,1,0,0,0|2,0,0]=4 46 B12R1.104 Cc1ncc(CC(N)C(=O)O)s1 Amb18822037 [1,0,1,0,0,0|2,0,0]=4 47 B12R1.104 Cc1ncc(CC(N)C(N)=O)s1 Amb33308601 [1,0,1,0,0,0|2,0,0]=4 48 B12R1.104 Cc1ncc(C[C@@H](N)C(=O)O)s1 Amb27146199 [1,0,1,0,0,0|2,0,0]=4 49 B12R1.104 Cc1ncc(C[C@H](N)C(=O)O)s1 Amb24346493 [1,0,1,0,0,0|2,0,0]=4 50 B12R1.104 Cn1cc(CC(=O)C(=O)O)cn1 Amb6715939 [1,0,1,0,0,0|1,0,1]=4 51 B12R1.104 Cn1cc(CC(F)C(=O)O)nn1 Amb27949219 [1,0,1,0,0,0|2,0,0]=4 52 B12R1.104 Cn1cc(CC(N)C(=O)O)cn1 Amb19429078 [1,0,1,0,0,0|0,0,0]=2 53 B12R1.104 Cn1cc(CC(N)C(=O)O)cn1 Amb6715945 [1,0,1,0,0,0|0,0,0]=2 54 B12R1.104 Cn1cc(CC(N)C(=O)O)nn1 Amb19000860 [1,0,1,0,0,0|1,0,0]=3 55 B12R1.104 Cn1cc(CC(N)C(N)=O)cn1 Amb27168358 [1,0,1,0,0,0|0,0,0]=2 56 B12R1.104 Cn1cc(CC(N)C(N)=O)nn1 Amb24561961 [1,0,1,0,0,0|1,0,0]=3 57 B12R1.104 Cn1cc(CC(O)C(=O)O)cn1 Amb27196865 [1,0,1,0,0,0|1,0,0]=3 58 B12R1.104 Cn1cc(CC(O)C(=O)O)nn1 Amb28206617 [1,0,1,0,0,0|2,0,0]=4 59 B12R1.104 Cn1cc(CC(S)C(=O)O)cn1 Amb18968266 [1,0,1,0,0,0|1,0,0]=3 60 B12R1.104 Cn1cc(CC(S)C(=O)O)nn1 Amb28454581 [1,0,1,0,0,0|2,0,0]=4 61 B12R1.104 Cn1cc(C[C@@H](N)C(=O)O)cn1 Amb18801206 [1,0,1,0,0,0|0,0,0]=2 62 B12R1.104 Cn1cc(C[C@@H](N)C(=O)O)nn1 Amb24699416 [1,0,1,0,0,0|1,0,0]=3 63 B12R1.104 Cn1cc(C[C@H](N)C(=O)O)cn1 Amb25740928 [1,0,1,0,0,0|0,0,0]=2 64 B12R1.104 Cn1cc(C[C@H](N)C(=O)O)nn1 Amb25737135 [1,0,1,0,0,0|1,0,0]=3 65 B12R1.104 Cn1cc(SC(F)C(=O)O)cn1 Amb27748571 [1,0,1,0,0,0|2,0,0]=4 66 B12R1.104 Cn1ccc(CC(N)C(=O)O)c1 Amb18563843 [1,0,1,0,0,0|1,0,0]=3 67 B12R1.104 Cn1ccc(CC(N)C(=O)O)n1 Amb30622858 [1,0,1,0,0,0|2,0,0]=4 68 B12R1.104 Cn1ccc(CC(N)C(=O)O)n1 Amb6890914 [1,0,1,0,0,0|2,0,0]=4 69 B12R1.104 Cn1ccc(CC(N)C(N)=O)n1 Amb26600543 [1,0,1,0,0,0|2,0,0]=4 70 B12R1.104 Cn1ccc(C[C@@H](N)C(=O)O)n1 Amb28456301 [1,0,1,0,0,0|2,0,0]=4 71 B12R1.104 Cn1ccc(C[C@H](N)C(=O)O)n1 Amb28244347 [1,0,1,0,0,0|2,0,0]=4 72 B12R1.104 Cn1cnc(CC(N)C(=O)O)c1 Amb16233066 [1,0,1,0,0,0|2,0,0]=4 73 B12R1.104 Cn1cnc(CC(N)C(=O)O)c1 Amb32651823 [1,0,1,0,0,0|2,0,0]=4 74 B12R1.104 Cn1cnc(C[C@@H](N)C(=O)O)c1 Amb22747829 [1,0,1,0,0,0|2,0,0]=4 75 B12R1.104 Cn1cnc(C[C@@H](N)C(=O)O)c1 Amb22801373 [1,0,1,0,0,0|2,0,0]=4 76 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb22349466 [1,0,1,0,0,0|2,0,0]=4 77 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb2698980 [1,0,1,0,0,0|2,0,0]=4 78 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb8629064 [1,0,1,0,0,0|2,0,0]=4 79 B12R1.104 Cn1ncc(CC(F)C(=O)O)n1 Amb28317534 [1,0,1,0,0,0|2,0,0]=4 80 B12R1.104 Cn1ncc(CC(N)C(N)=O)n1 Amb27222188 [1,0,1,0,0,0|1,0,0]=3 81 B12R1.104 Cn1ncc(CC(O)C(=O)O)n1 Amb27144353 [1,0,1,0,0,0|2,0,0]=4 82 B12R1.104 Cn1ncc(C[C@@H](N)C(=O)O)n1 Amb25910534 [1,0,1,0,0,0|1,0,0]=3 83 B12R1.104 Cn1ncc(C[C@H](N)C(=O)O)n1 Amb24456288 [1,0,1,0,0,0|1,0,0]=3 84 B12R1.104 Cn1nnc(CC(N)C(=O)O)n1 Amb27874216 [1,0,1,0,0,0|2,0,0]=4 85 B12R1.104 Cn1nnc(CC(N)C(N)=O)n1 Amb27867602 [1,0,1,0,0,0|2,0,0]=4 86 B12R1.104 Cn1nnc(C[C@@H](N)C(=O)O)n1 Amb27391747 [1,0,1,0,0,0|2,0,0]=4 87 B12R1.104 Cn1nnc(C[C@H](N)C(=O)O)n1 Amb25378201 [1,0,1,0,0,0|2,0,0]=4 88 B12R1.144 CC(N)CC(O)c1ccnn1C Amb35583747 [1,0,1,0,0,0|1,0,1]=4 89 B12R1.145 CC(Br)C(=O)Nc1ccnn1C Amb2779707 [1,0,1,0,0,0|1,0,0]=3 90 B12R1.145 CC(N)C(=O)Cc1ncnn1C Amb27251877 [1,0,1,0,0,0|2,0,0]=4 91 B12R1.145 C[C@@H](N)C(=O)Cc1ncnn1C Amb35618049 [1,0,1,0,0,0|2,0,0]=4 92 B12R1.145 C[C@H](N)C(=O)Cc1ncnn1C Amb30024538 [1,0,1,0,0,0|2,0,0]=4 93 B12R1.145 C[C@H](N)C(=O)Nc1ccnn1C Amb27806610 [1,0,1,0,0,0|0,0,0]=2 94 B12R1.145 Cc1ncsc1NC(=O)C(C)N Amb27388327 [1,0,1,0,0,0|2,0,0]=4 95 B12R1.145 Cc1ncsc1NC(=O)[C@@H](C)N Amb27748967 [1,0,1,0,0,0|2,0,0]=4 96 B12R1.468 CCC(=O)C(N)c1ccnn1C Amb35710335 [1,0,1,0,0,0|2,0,0]=4 97 B12R1.468 CCC(=O)N(C)c1ccnn1C Amb27651534 [1,0,1,0,0,0|1,0,0]=3 98 B12R1.468 CN(C(=O)CN)c1cccn1C Amb25159982 [1,0,1,0,0,0|2,0,0]=4 99 B12R1.468 COC(=O)C(O)c1ccnn1C Amb27873825 [1,0,1,0,0,0|2,0,0]=4 100 B12R1.181 CCCc1cnn(C)c1C(=O)O Amb26940746 [1,0,1,0,0,0|2,0,0]=4 101 B12R1.897 Cc1cnn(C)c1C(O)C(=O)O Amb25817455 [1,0,1,0,0,0|2,0,0]=4 102 B12R1.1589 Cc1cnn(C)c1C(O)CCN Amb26519379 [1,0,1,0,0,0|1,0,1]=4 103 B12R1.1589 Cc1cnn(C)c1[C@@H](O)CCN Amb33414287 [1,0,1,0,0,0|1,0,1]=4 104 B12R1.1589 Cc1cnn(C)c1[C@H](O)CCN Amb33414288 [1,0,1,0,0,0|1,0,1]=4 105 B12R1.2217 CCC(=O)Nc1c(N)cnn1C Amb27662975 [1,0,1,0,0,0|2,0,0]=4 106 B12R1.2217 C\C(=C/c1c(C)cnn1C)CN Amb27785670 [1,0,1,0,0,0|2,0,0]=4 107 B12R1.2217 Cc1noc(C)c1NC(=O)CN Amb27982825 [1,0,1,0,0,0|2,0,0]=4 108 B12R1.1672 Cn1ncc(CC(Cl)C=O)c1Br Amb35739068 [1,0,1,0,0,0|2,0,0]=4 109 B12R1.1672 Cn1ncc(CC(Cl)C=O)c1Cl Amb35738925 [1,0,1,0,0,0|2,0,0]=4 110 B12R2.132 Cn1ncc2c1CC(=O)CC2 Amb24687104 [2,0,0,0,0,0|1,0,0]=3 111 B12R2.132 Cn1ncc2c1NC(=O)C=C2 Amb23557006 [2,0,0,0,0,0|0,0,2]=4 112 B12R2.612 Cn1ncc2c1CCC(N)C2 Amb27953415 [2,0,0,0,0,0|1,0,1]=4 113 B14R1.59 CCOC(=O)C(N)Cc1cnn(C)c1 Amb19044423 [0,1,1,0,0,0|2,0,0]=4 114 B14R1.1030 COC(=O)C(CN)Cc1cnn(C)c1 Amb19343540 [0,1,1,0,0,0|2,0,0]=4 115 B14R1.1030 COC(=O)C(CN)Cc1cnn(C)c1 Amb7800910 [0,1,1,0,0,0|2,0,0]=4 116 B14R1.4282 COC(=O)C(N)Cc1cn(C)nc1C Amb33330596 [0,1,1,0,0,0|2,0,0]=4 117 B14R1.4282 COC(=O)C(N)Cc1cn(C)nc1C Amb33338872 [0,1,1,0,0,0|2,0,0]=4 118 B14R1.4504 CN(C(=O)C(C)(C)N)c1cccn1C Amb24644072 [0,1,1,0,0,0|2,0,0]=4 119 B14R2.1416 Cn1ncc2c1NC(=O)C(CN)=C2 Amb18222137 [1,1,0,0,0,0|0,0,2]=4 120 B14R2.25731 CC1Cc2c(N)nn(C)c2NC1=O Amb9174831 [1,1,0,0,0,0|1,0,0]=3 121 B14R2.259 Cn1cc(CC2COCC2=O)cn1 Amb35639150 [0,0,1,1,0,0|2,0,0]=4 122 B14R2.4381 CC1C(=O)NNC1c2cnn(C)c2 Amb35693819 [0,0,1,1,0,0|2,0,0]=4 123 B14R2.10825 Cn1ncc(C2CC2)c1C(O)C=O Amb35593816 [0,0,1,1,0,0|2,0,0]=4 124 B12R1.33 CNC(=O)C(Cl)c1cnn(C)c1 Amb18329814 [0,0,1,0,1,0|2,0,0]=4 125 B12R1.33 CNC(=O)C(O)c1cnn(C)c1 Amb28190124 [0,0,1,0,1,0|2,0,0]=4 126 B12R1.33 COC(=O)C(N)c1cnn(C)c1 Amb18968158 [0,0,1,0,1,0|2,0,0]=4 127 B14R1.135 Cc1cccc(CC(N)C(=O)NO)c1 Amb27226078 [0,0,1,0,0,1|2,0,0]=4 128 B14R2.8239 Cc1ccc2c(c1)NC(=O)C(N)C2 Amb17470551 [1,0,0,0,0,1|2,0,0]=4 129 B14R2.8239 Cc1ccc2c(n1)NC(=O)C(N)C2 Amb23571831 [1,0,0,0,0,1|2,0,0]=4 130 B14R2.28472 Cc1cccc2c1NC(=O)C(N)C2 Amb27632324 [1,0,0,0,0,1|2,0,0]=4