0 B17R2.193 Cc1nc(OCc2ccccc2)ncc1Br Amb28343465 [0,0,0,0,0,0|4,0,0]=4 1 B17R2.193 Nc1nc(NCc2ccccc2)ncc1F Amb27156202 [0,0,0,0,0,0|4,0,0]=4 2 B16R2.132 Brc1cnc(COc2ccccc2)nc1 Amb32420643 [1,0,0,0,0,0|3,0,0]=4 3 B16R2.132 Brc1cnc(NCc2ccccc2)nc1 Amb4553621 [1,0,0,0,0,0|3,0,0]=4 4 B16R2.132 Brc1cnc(OCc2ccccc2)nc1 Amb22047371 [1,0,0,0,0,0|3,0,0]=4 5 B16R2.132 Brc1cnc(SCc2ccccc2)nc1 Amb21856640 [1,0,0,0,0,0|3,0,0]=4 6 B16R2.132 Clc1cnc(NCc2ccccc2)nc1 Amb2796321 [1,0,0,0,0,0|3,0,0]=4 7 B16R2.132 Ic1cnc(NCc2ccccc2)nc1 Amb28140258 [1,0,0,0,0,0|3,0,0]=4 8 B16R2.132 NC1=NNC(CCc2ccccc2)=NN1 Amb20414087 [1,0,0,0,0,0|2,0,1]=4 9 B16R2.132 Nc1cnc(CCc2ccccc2)nc1 Amb17486617 [1,0,0,0,0,0|2,0,0]=3 10 B16R2.132 Nc1cnc(CCc2ccccn2)nc1 Amb18566220 [1,0,0,0,0,0|3,0,0]=4 11 B16R2.132 Nc1cnc(CCc2cccnc2)nc1 Amb18566221 [1,0,0,0,0,0|3,0,0]=4 12 B16R2.132 Nc1cnc(CCc2ccncc2)nc1 Amb18566222 [1,0,0,0,0,0|3,0,0]=4 13 B16R2.132 Nc1cnc(COc2ccccc2)nc1 Amb17486585 [1,0,0,0,0,0|3,0,0]=4 14 B16R2.132 Nc1cnc(CSc2ccccc2)nc1 Amb17486579 [1,0,0,0,0,0|3,0,0]=4 15 B16R2.132 Nc1cnc(NCc2ccccc2)nc1 Amb18290412 [1,0,0,0,0,0|3,0,0]=4 16 B16R2.132 Nc1cnc(OCc2ccccc2)nc1 Amb18972705 [1,0,0,0,0,0|3,0,0]=4 17 B16R2.132 O=C1C=CC(NCc2ccccc2)=CN1 Amb27851180 [1,0,0,0,0,0|3,0,0]=4 18 B16R2.132 SC1=NNC(CCc2ccccc2)=NN1 Amb20414061 [1,0,0,0,0,0|1,1,1]=4 19 B16R2.252 Brc1ccnc(OCc2ccccc2)n1 Amb25671334 [1,0,0,0,0,0|3,0,0]=4 20 B16R2.252 Cc1ccnc(NCc2ccccc2)n1 Amb8425341 [1,0,0,0,0,0|3,0,0]=4 21 B16R2.252 Cc1ccnc(OCc2ccccc2)n1 Amb24445301 [1,0,0,0,0,0|3,0,0]=4 22 B16R2.252 Clc1ccnc(CCc2ccccc2)n1 Amb27487923 [1,0,0,0,0,0|2,0,0]=3 23 B16R2.252 Clc1ccnc(CCc2ccccn2)n1 Amb30007483 [1,0,0,0,0,0|3,0,0]=4 24 B16R2.252 Clc1ccnc(CSc2ccccc2)n1 Amb26466183 [1,0,0,0,0,0|3,0,0]=4 25 B16R2.252 Clc1ccnc(NCc2ccccc2)n1 Amb22749353 [1,0,0,0,0,0|3,0,0]=4 26 B16R2.252 Fc1ccnc(CCc2ccccc2)n1 Amb35649263 [1,0,0,0,0,0|2,0,0]=3 27 B16R2.252 Fc1ccnc(CCc2ccccn2)n1 Amb35653745 [1,0,0,0,0,0|3,0,0]=4 28 B16R2.252 Fc1ccnc(COc2ccccc2)n1 Amb29883447 [1,0,0,0,0,0|3,0,0]=4 29 B16R2.252 Fc1ccnc(CSc2ccccc2)n1 Amb29883299 [1,0,0,0,0,0|3,0,0]=4 30 B16R2.252 Nc1ccnc(COc2ccccc2)n1 Amb33531353 [1,0,0,0,0,0|3,0,0]=4 31 B16R2.252 Nc1ccnc(NCc2ccccc2)n1 Amb20248765 [1,0,0,0,0,0|3,0,0]=4 32 B16R2.252 Nc1ccnc(OCc2ccccc2)n1 Amb19957527 [1,0,0,0,0,0|3,0,0]=4 33 B16R2.252 O=C1C=CN=C(CCc2ccccc2)N1 Amb19039013 [1,0,0,0,0,0|1,0,2]=4 34 B16R2.252 Oc1cccc(CCc2ccccc2)c1 Amb8388641 [1,0,0,0,0,0|3,0,0]=4 35 B16R2.252 Oc1cccc(NCc2ccccc2)n1 Amb27767162 [1,0,0,0,0,0|3,0,0]=4 36 B18R2.276 Cc1nnc(C(N)Cc2ccccc2)nc1C Amb18868124 [0,1,0,0,0,0|2,0,1]=4 37 B18R2.2562 Nc1nc(SCc2ccccc2)ncc1C=O Amb24094569 [0,1,0,0,0,0|3,0,0]=4 38 B18R2.2686 COc1nc(NCc2ccccc2)ncc1Br Amb27872944 [0,1,0,0,0,0|3,0,0]=4 39 B18R2.9259 Cc1nnc(CCc2ccc(N)cc2)nc1C Amb18868115 [0,1,0,0,0,0|2,0,1]=4 40 B18R2.38706 Cc1nc(CCc2ccccc2)nc(C)c1N Amb31098289 [0,1,0,0,0,0|3,0,0]=4 41 B18R2.39765 Cc1nnc(CCc2ccccc2N)nc1C Amb18868109 [0,1,0,0,0,0|2,0,1]=4 42 B18R2.65908 Cc1nnc(CCc2cccc(N)c2)nc1C Amb18868112 [0,1,0,0,0,0|2,0,1]=4 43 B16R2.124 Clc1nc(Cc2ccccc2)ncc1I Amb27407534 [0,0,0,0,1,0|3,0,0]=4 44 B16R2.124 Fc1nc(Cc2ccccc2)ncc1Br Amb35642352 [0,0,0,0,1,0|3,0,0]=4 45 B16R2.124 Fc1nc(Cc2ccccc2)ncc1I Amb35634415 [0,0,0,0,1,0|3,0,0]=4 46 B16R2.5952 NN1C(=S)NN=C1CCc2ccccc2 Amb19800034 [0,0,0,0,1,0|2,1,0]=4 47 B18R2.8976 Cc1cnc(COCc2ccccc2)nc1N Amb28137199 [0,0,0,0,0,1|3,0,0]=4 48 B15R2.2195 c1ccc(CCc2ccccn2)cc1 Amb5494186 [2,0,0,0,0,0|2,0,0]=4 49 B15R2.2195 c1ccc(CCc2cnccn2)cc1 Amb15695191 [2,0,0,0,0,0|1,0,1]=4 50 B15R2.2195 c1ccc(CSc2ncccn2)cc1 Amb1263972 [2,0,0,0,0,0|2,0,0]=4 51 B15R2.2195 c1ccc(OCc2ncccn2)cc1 Amb27181427 [2,0,0,0,0,0|2,0,0]=4 52 B17R2.48 O=Cc1cnc(CCc2ccccc2)nc1 Amb20413104 [1,1,0,0,0,0|1,0,0]=3 53 B17R2.48 O=Cc1cnc(COc2ccccc2)nc1 Amb20413086 [1,1,0,0,0,0|2,0,0]=4 54 B17R2.48 O=Cc1cnc(NCc2ccccc2)nc1 Amb841060 [1,1,0,0,0,0|2,0,0]=4 55 B17R2.48 O=Cc1cnc(SCc2ccccc2)nc1 Amb10607882 [1,1,0,0,0,0|2,0,0]=4 56 B17R2.207 Cc1ccc(CCc2ncc(N)cn2)cc1 Amb18066723 [1,1,0,0,0,0|2,0,0]=4 57 B17R2.207 Nc1cnc(CCc2ccc(Br)cc2)nc1 Amb18596179 [1,1,0,0,0,0|2,0,0]=4 58 B17R2.207 Nc1cnc(CCc2ccc(Cl)cc2)nc1 Amb18070831 [1,1,0,0,0,0|2,0,0]=4 59 B17R2.207 Nc1cnc(CCc2ccc(F)cc2)nc1 Amb18067273 [1,1,0,0,0,0|2,0,0]=4 60 B17R2.207 O=C1CNC(CCc2ccc(Cl)cc2)=NN1 Amb18454656 [1,1,0,0,0,0|0,0,2]=4 61 B17R2.215 Cc1cccc(CCc2ncc(N)cn2)c1 Amb18066721 [1,1,0,0,0,0|2,0,0]=4 62 B17R2.215 Nc1cnc(CCc2cccc(Br)c2)nc1 Amb18596177 [1,1,0,0,0,0|2,0,0]=4 63 B17R2.215 Nc1cnc(CCc2cccc(Cl)c2)nc1 Amb18070830 [1,1,0,0,0,0|2,0,0]=4 64 B17R2.215 Nc1cnc(CCc2cccc(F)c2)nc1 Amb18570092 [1,1,0,0,0,0|2,0,0]=4 65 B17R2.496 Cc1ccccc1CCc2ncc(N)cn2 Amb18066719 [1,1,0,0,0,0|2,0,0]=4 66 B17R2.496 Nc1cnc(CCc2ccccc2Br)nc1 Amb18596182 [1,1,0,0,0,0|2,0,0]=4 67 B17R2.496 Nc1cnc(CCc2ccccc2Cl)nc1 Amb18070829 [1,1,0,0,0,0|2,0,0]=4 68 B17R2.496 Nc1cnc(CCc2ccccc2F)nc1 Amb18570090 [1,1,0,0,0,0|2,0,0]=4 69 B17R2.1819 OCc1ccnc(CCc2ccccc2)n1 Amb33540049 [1,1,0,0,0,0|1,0,0]=3 70 B17R2.3212 Cc1cc(O)nc(NCc2ccccc2)n1 Amb577562 [1,1,0,0,0,0|2,0,0]=4 71 B17R2.3212 Cc1cc(O)nc(SCc2ccccc2)n1 Amb586591 [1,1,0,0,0,0|2,0,0]=4 72 B17R2.3212 Nc1cc(O)nc(CCc2ccccc2)n1 Amb19923596 [1,1,0,0,0,0|1,0,0]=3 73 B17R2.3212 Nc1cc(O)nc(SCc2ccccc2)n1 Amb2496166 [1,1,0,0,0,0|2,0,0]=4 74 B17R2.3212 Oc1cc(F)nc(NCc2ccccc2)n1 Amb22437175 [1,1,0,0,0,0|2,0,0]=4 75 B17R2.3212 Oc1cc(O)nc(NCc2ccccc2)n1 Amb26526597 [1,1,0,0,0,0|2,0,0]=4 76 B17R2.5273 Cc1ccnc(C(N)Cc2ccccc2)n1 Amb18225197 [1,1,0,0,0,0|2,0,0]=4 77 B17R2.5273 NC(Cc1ccccc1)c2nccc(O)n2 Amb18225399 [1,1,0,0,0,0|1,0,0]=3 78 B17R2.5300 Cc1cccc(CCc2nccc(N)n2)c1 Amb18066708 [1,1,0,0,0,0|2,0,0]=4 79 B17R2.5300 Cc1ccnc(CCc2cccc(Br)c2)n1 Amb18888040 [1,1,0,0,0,0|2,0,0]=4 80 B17R2.5300 Cc1ccnc(CCc2cccc(N)c2)n1 Amb18866467 [1,1,0,0,0,0|2,0,0]=4 81 B17R2.5300 Nc1cccc(CCc2nccc(O)n2)c1 Amb18225381 [1,1,0,0,0,0|1,0,0]=3 82 B17R2.5300 Nc1cccc(CSc2nccc(O)n2)c1 Amb9208381 [1,1,0,0,0,0|2,0,0]=4 83 B17R2.5300 Nc1cccc(OCc2nccc(O)n2)c1 Amb18225810 [1,1,0,0,0,0|2,0,0]=4 84 B17R2.5300 Nc1ccnc(CCc2cccc(Cl)c2)n1 Amb18070824 [1,1,0,0,0,0|2,0,0]=4 85 B17R2.5300 Nc1ccnc(CCc2cccc(F)c2)n1 Amb18570088 [1,1,0,0,0,0|2,0,0]=4 86 B17R2.5300 Oc1ccnc(CCc2cccc(Br)c2)n1 Amb18888868 [1,1,0,0,0,0|1,0,0]=3 87 B17R2.5300 Oc1ccnc(SCc2cccc(Br)c2)n1 Amb1897957 [1,1,0,0,0,0|2,0,0]=4 88 B17R2.41893 Cc1ccccc1CCc2nccc(N)n2 Amb18066707 [1,1,0,0,0,0|2,0,0]=4 89 B17R2.41893 Cc1ccnc(CCc2ccccc2Br)n1 Amb18888038 [1,1,0,0,0,0|2,0,0]=4 90 B17R2.41893 Cc1ccnc(CCc2ccccc2N)n1 Amb18866465 [1,1,0,0,0,0|2,0,0]=4 91 B17R2.41893 Nc1ccccc1CCc2nccc(O)n2 Amb18225379 [1,1,0,0,0,0|1,0,0]=3 92 B17R2.41893 Nc1ccccc1OCc2nccc(O)n2 Amb18225812 [1,1,0,0,0,0|2,0,0]=4 93 B17R2.41893 Nc1ccnc(CCc2ccccc2Cl)n1 Amb18574480 [1,1,0,0,0,0|2,0,0]=4 94 B17R2.41893 Nc1ccnc(CCc2ccccc2F)n1 Amb18570087 [1,1,0,0,0,0|2,0,0]=4 95 B17R2.41893 Oc1ccnc(CCc2ccccc2Br)n1 Amb18888865 [1,1,0,0,0,0|1,0,0]=3 96 B17R2.2600 Cc1nc(CCc2ccccc2)sc1CO Amb17250913 [0,1,0,0,1,0|2,0,0]=4 97 B17R2.8671 CC1=C([C@@H](N)Cc2ccccc2)ONC1=O Amb18169586 [0,1,0,0,1,0|2,0,0]=4 98 B19R2.91860 Cc1nc(CCc2ccccc2)ncc1C(=O)O Amb20413138 [0,2,0,0,0,0|2,0,0]=4 99 B19R2.91860 O=C(O)c1cnc(CCc2ccccc2)nc1O Amb19923768 [0,2,0,0,0,0|1,0,0]=3 100 B19R2.91860 O=C(O)c1cnc(SCc2ccccc2)nc1O Amb2503819 [0,2,0,0,0,0|2,0,0]=4 101 B19R2.12418 O=C(O)c1nc(CCc2ccccc2)ncc1Br Amb17486784 [0,2,0,0,0,0|2,0,0]=4 102 B17R2.5637 NC(=O)c1cc(OCc2ccccc2)no1 Amb10604451 [0,0,1,1,0,0|2,0,0]=4 103 B17R2.5637 O=C(O)c1cc(CCc2ccccc2)no1 Amb24174872 [0,0,1,1,0,0|2,0,0]=4 104 B17R3.2431 Fc1ccnc(C2Cc3ccccc32)n1 Amb35649262 [1,0,0,1,0,0|2,0,0]=4 105 B15R2.29 Nc1cnc(Cc2ccccc2)nc1 Amb8836182 [1,0,0,0,1,0|2,0,0]=4 106 B15R2.29 O=C1C=CC(Oc2ccccc2)=NN1 Amb26961886 [1,0,0,0,1,0|2,0,0]=4 107 B15R2.283 Brc1nc(CCc2ccccc2)ns1 Amb28045318 [1,0,0,0,1,0|2,0,0]=4 108 B15R2.283 Ic1nc(CCc2ccccc2)ns1 Amb27413479 [1,0,0,0,1,0|2,0,0]=4 109 B15R2.283 Nc1cc(CCc2ccccc2)no1 Amb33529147 [1,0,0,0,1,0|2,0,0]=4 110 B15R2.283 Nc1cnc(CCc2ccccc2)o1 Amb18564480 [1,0,0,0,1,0|2,0,0]=4 111 B15R2.283 Nc1cnn(CCc2ccccc2)n1 Amb32702378 [1,0,0,0,1,0|2,0,0]=4 112 B15R2.283 Nc1csc(CCc2ccccc2)n1 Amb28341882 [1,0,0,0,1,0|2,0,0]=4 113 B15R2.283 Nc1nc(CCc2ccccc2)ns1 Amb18292122 [1,0,0,0,1,0|2,0,0]=4 114 B15R2.283 O=C1CN=C(CCc2ccccn2)N1 Amb35722969 [1,0,0,0,1,0|1,0,1]=4 115 B15R2.283 O=C1CSC(CCc2ccccc2)=N1 Amb4381581 [1,0,0,0,1,0|1,0,1]=4 116 B15R2.283 O=C1N=C(CNc2ccccc2)NN1 Amb19804621 [1,0,0,0,1,0|1,0,1]=4 117 B15R2.283 O=C1N=C(NCc2ccccc2)SN1 Amb27182464 [1,0,0,0,1,0|2,0,0]=4 118 B15R2.283 O=C1NC(CCc2ccccn2)=NO1 Amb35722966 [1,0,0,0,1,0|2,0,0]=4 119 B15R2.283 O=C1NC(COc2ccccc2)=NO1 Amb19073783 [1,0,0,0,1,0|2,0,0]=4 120 B15R2.283 O=C1NC(OCc2ccccc2)=NO1 Amb27588052 [1,0,0,0,1,0|2,0,0]=4 121 B15R2.283 O=C1NN=C(CCc2ccccn2)N1 Amb35722967 [1,0,0,0,1,0|1,0,1]=4 122 B15R2.283 O=C1NN=C(CSc2ccccc2)O1 Amb25285848 [1,0,0,0,1,0|2,0,0]=4 123 B15R2.283 Oc1csc(CCc2ccccc2)n1 Amb27418813 [1,0,0,0,1,0|1,0,1]=4 124 B15R2.283 Sc1nc(CCc2ccccc2)no1 Amb27419282 [1,0,0,0,1,0|1,1,0]=4 125 B15R2.31 Clc1ccnc(Cc2ccccc2)n1 Amb33532354 [1,0,0,0,1,0|2,0,0]=4 126 B15R2.31 Fc1ccnc(Cc2ccccc2)n1 Amb35653635 [1,0,0,0,1,0|2,0,0]=4 127 B15R2.31 Nc1ccnc(Cc2ccccc2)n1 Amb18959417 [1,0,0,0,1,0|2,0,0]=4 128 B15R2.31 Oc1cccc(Cc2ccccc2)n1 Amb4450119 [1,0,0,0,1,0|2,0,0]=4 129 B15R2.94 CC1=CC(c2ccccc2)=NNC1=O Amb22034430 [0,0,0,0,2,0|2,0,0]=4 130 B15R2.94 Cc1cnc(-c2ccccc2)nc1O Amb24308907 [0,0,0,0,2,0|2,0,0]=4 131 B15R2.94 Cc1nnc(-c2ccccc2)nc1O Amb2434456 [0,0,0,0,2,0|1,0,1]=4 132 B15R2.94 NC1=CC(c2ccccc2)=NNC1=O Amb18016084 [0,0,0,0,2,0|2,0,0]=4 133 B15R2.94 NC1=NC(c2ccncc2)=NNC1=O Amb27667670 [0,0,0,0,2,0|2,0,0]=4 134 B15R2.94 O=C1NC=C(c2ccccc2)C=C1O Amb27629139 [0,0,0,0,2,0|2,0,0]=4 135 B15R2.94 O=C1NN=C(c2ccccc2)CC1O Amb28340508 [0,0,0,0,2,0|1,0,1]=4 136 B15R2.314 O=C1N=C(Cc2ccccc2)NC1=O Amb28044485 [0,0,0,0,2,0|0,0,1]=3 137 B17R2.216 Brc1cnc(CNCc2ccccc2)nc1 Amb24078771 [1,0,0,0,0,1|2,0,0]=4 138 B17R2.216 Brc1cnc(NCCc2ccccc2)nc1 Amb4553625 [1,0,0,0,0,1|2,0,0]=4 139 B17R2.216 Nc1cnc(CCOc2ccccc2)nc1 Amb17486619 [1,0,0,0,0,1|2,0,0]=4 140 B17R2.216 O=C1C=CC(CNCc2ccccc2)=CN1 Amb27866225 [1,0,0,0,0,1|2,0,0]=4