0 B17R2.193 Cc1cc(NCc2ccccc2)ncc1N Amb17213757 [0,0,0,0,0,0|4,0,0]=4 1 B17R2.193 Cc1cc(OCc2ccccc2)ncc1Br Amb26617283 [0,0,0,0,0,0|4,0,0]=4 2 B17R2.193 Cc1cc(OCc2ccccc2)ncc1N Amb25766806 [0,0,0,0,0,0|4,0,0]=4 3 B17R2.193 Cc1ccc(OCc2ccccc2)cc1O Amb23568466 [0,0,0,0,0,0|4,0,0]=4 4 B17R2.193 Cc1cnc(NCc2ccccc2)cc1N Amb27170234 [0,0,0,0,0,0|4,0,0]=4 5 B17R2.193 Cc1cnc(OCc2ccccc2)cc1N Amb27833059 [0,0,0,0,0,0|4,0,0]=4 6 B17R2.193 Nc1ccc(OCc2ccccc2)cc1O Amb25131155 [0,0,0,0,0,0|4,0,0]=4 7 B17R2.193 Oc1cc(OCc2ccccc2)ccc1Br Amb27762383 [0,0,0,0,0,0|4,0,0]=4 8 B17R2.193 Oc1cc(OCc2ccccc2)ccc1Cl Amb28343858 [0,0,0,0,0,0|4,0,0]=4 9 B17R2.193 Oc1cc(OCc2ccccc2)ccc1F Amb24548672 [0,0,0,0,0,0|4,0,0]=4 10 B17R2.193 Oc1cc(OCc2ccccc2)ccc1I Amb27653012 [0,0,0,0,0,0|4,0,0]=4 11 B17R2.193 Oc1cc(OCc2ccccc2)ccc1S Amb33080666 [0,0,0,0,0,0|3,1,0]=4 12 B17R2.193 Oc1ccc(NCc2ccccc2)cc1O Amb27413633 [0,0,0,0,0,0|3,0,1]=4 13 B17R2.193 Oc1ccc(OCc2ccccc2)cc1O Amb27164683 [0,0,0,0,0,0|3,0,1]=4 14 B16R2.132 Brc1ccc(COc2ccccc2)nc1 Amb28457102 [1,0,0,0,0,0|3,0,0]=4 15 B16R2.132 Brc1ccc(CSc2ccccc2)nc1 Amb27475623 [1,0,0,0,0,0|3,0,0]=4 16 B16R2.132 Brc1ccc(NCc2ccccc2)nc1 Amb2618039 [1,0,0,0,0,0|3,0,0]=4 17 B16R2.132 Brc1ccc(OCc2ccccc2)nc1 Amb20241254 [1,0,0,0,0,0|3,0,0]=4 18 B16R2.132 Brc1ccc(OCc2ccccc2)nn1 Amb28125807 [1,0,0,0,0,0|2,0,1]=4 19 B16R2.132 Brc1ccc(SCc2ccccc2)nc1 Amb27610829 [1,0,0,0,0,0|3,0,0]=4 20 B16R2.132 Cc1ccc(CCc2ccccc2)cc1 Amb26640344 [1,0,0,0,0,0|3,0,0]=4 21 B16R2.132 Cc1ccc(NCc2ccccc2)nn1 Amb18975341 [1,0,0,0,0,0|2,0,1]=4 22 B16R2.132 Cc1ccc(OCc2ccccc2)nn1 Amb22488645 [1,0,0,0,0,0|2,0,1]=4 23 B16R2.132 Clc1ccc(NCc2ccccc2)nn1 Amb3092807 [1,0,0,0,0,0|2,0,1]=4 24 B16R2.132 Clc1ccc(OCc2ccccc2)nc1 Amb24082317 [1,0,0,0,0,0|3,0,0]=4 25 B16R2.132 Clc1ccc(OCc2ccccc2)nn1 Amb6255403 [1,0,0,0,0,0|2,0,1]=4 26 B16R2.132 Clc1ccc(SCc2ccccc2)nn1 Amb8873141 [1,0,0,0,0,0|2,0,1]=4 27 B16R2.132 Fc1ccc(NCc2ccccc2)nc1 Amb18975390 [1,0,0,0,0,0|3,0,0]=4 28 B16R2.132 Fc1ccc(OCc2ccccc2)nc1 Amb19959570 [1,0,0,0,0,0|3,0,0]=4 29 B16R2.132 NC1=NNC(CCc2ccccc2)=NN1 Amb20414087 [1,0,0,0,0,0|3,0,0]=4 30 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb17101879 [1,0,0,0,0,0|3,0,0]=4 31 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb21954210 [1,0,0,0,0,0|3,0,0]=4 32 B16R2.132 Nc1ccc(NCc2ccccc2)nc1 Amb836910 [1,0,0,0,0,0|3,0,0]=4 33 B16R2.132 Nc1ccc(OCc2ccccc2)nc1 Amb1124881 [1,0,0,0,0,0|3,0,0]=4 34 B16R2.132 Nc1cnc(CCc2ccccc2)nc1 Amb17486617 [1,0,0,0,0,0|3,0,0]=4 35 B16R2.132 O=C1C=CC(NCc2ccccc2)=CN1 Amb27851180 [1,0,0,0,0,0|2,0,0]=3 36 B16R2.132 O=C1N=CC(SCc2ccccc2)=CN1 Amb33038297 [1,0,0,0,0,0|3,0,0]=4 37 B16R2.132 Oc1ccc(OCc2ccccc2)nc1 Amb2699422 [1,0,0,0,0,0|2,0,1]=4 38 B16R2.132 SC1=NNC(CCc2ccccc2)=NN1 Amb20414061 [1,0,0,0,0,0|2,1,0]=4 39 B16R2.252 Brc1ccnc(NCc2ccccc2)c1 Amb19959554 [1,0,0,0,0,0|3,0,0]=4 40 B16R2.252 Brc1ccnc(OCc2ccccc2)c1 Amb19959540 [1,0,0,0,0,0|3,0,0]=4 41 B16R2.252 Cc1ccnc(NCc2ccccc2)c1 Amb3940048 [1,0,0,0,0,0|3,0,0]=4 42 B16R2.252 Cc1ccnc(OCc2ccccc2)c1 Amb25369515 [1,0,0,0,0,0|3,0,0]=4 43 B16R2.252 Clc1ccnc(CCc2ccccc2)n1 Amb27487923 [1,0,0,0,0,0|3,0,0]=4 44 B16R2.252 Clc1ccnc(NCc2ccccc2)c1 Amb27774226 [1,0,0,0,0,0|3,0,0]=4 45 B16R2.252 Clc1ccnc(OCc2ccccc2)c1 Amb22236357 [1,0,0,0,0,0|3,0,0]=4 46 B16R2.252 Clc1ccnc(SCc2ccccc2)c1 Amb22236362 [1,0,0,0,0,0|3,0,0]=4 47 B16R2.252 Fc1ccnc(CCc2ccccc2)n1 Amb35649263 [1,0,0,0,0,0|3,0,0]=4 48 B16R2.252 Ic1ccnc(OCc2ccccc2)c1 Amb22498332 [1,0,0,0,0,0|3,0,0]=4 49 B16R2.252 Nc1ccnc(NCc2ccccc2)c1 Amb17337415 [1,0,0,0,0,0|3,0,0]=4 50 B16R2.252 Nc1ccnc(OCc2ccccc2)c1 Amb18981531 [1,0,0,0,0,0|3,0,0]=4 51 B16R2.252 Nc1ccnc(SCc2ccccc2)c1 Amb18981546 [1,0,0,0,0,0|3,0,0]=4 52 B16R2.252 O=C1C=CN=C(CCc2ccccc2)N1 Amb19039013 [1,0,0,0,0,0|2,0,1]=4 53 B16R2.252 OC1C=C(CCc2ccccc2)CNC1 Amb32989186 [1,0,0,0,0,0|1,0,2]=4 54 B16R2.252 Oc1cccc(CCc2ccccc2)c1 Amb8388641 [1,0,0,0,0,0|2,0,0]=3 55 B16R2.252 Oc1cccc(CNc2ccccc2)c1 Amb3546319 [1,0,0,0,0,0|3,0,0]=4 56 B16R2.252 Oc1cccc(COc2ccccc2)c1 Amb23443322 [1,0,0,0,0,0|3,0,0]=4 57 B16R2.252 Oc1cccc(NCc2ccccc2)c1 Amb6734931 [1,0,0,0,0,0|3,0,0]=4 58 B16R2.252 Oc1cccc(OCc2ccccc2)c1 Amb33528500 [1,0,0,0,0,0|3,0,0]=4 59 B16R2.252 Oc1cncc(OCc2ccccc2)c1 Amb25903369 [1,0,0,0,0,0|2,0,1]=4 60 B18R2.2562 Cc1cc(NCc2ccccc2)ncc1C=O Amb23579583 [0,1,0,0,0,0|3,0,0]=4 61 B18R2.2562 Cc1cc(OCc2ccccc2)ncc1C=O Amb23579608 [0,1,0,0,0,0|3,0,0]=4 62 B18R2.2562 O=Cc1ccc(OCc2ccccc2)cc1O Amb2613116 [0,1,0,0,0,0|3,0,0]=4 63 B18R2.2686 OCc1cc(OCc2ccccc2)ncc1Cl Amb27471498 [0,1,0,0,0,0|3,0,0]=4 64 B18R2.32351 Cc1cnc(CSc2ccccc2)c(C)c1O Amb21987938 [0,1,0,0,0,0|3,0,0]=4 65 B16R2.124 O=C1C=CN(Cc2ccccc2)C=C1O Amb27624619 [0,0,0,0,1,0|3,0,0]=4 66 B16R2.124 Oc1ccc(Cc2ccccc2)cc1O Amb24060583 [0,0,0,0,1,0|2,0,1]=4 67 B16R2.2884 Cc1cn(CCc2ccccc2)nc1N Amb32701789 [0,0,0,0,1,0|3,0,0]=4 68 B16R2.2884 Cc1nn(CCc2ccccc2)cc1N Amb32706743 [0,0,0,0,1,0|3,0,0]=4 69 B16R2.2884 Cn1nc(CCc2ccccc2)cc1N Amb8848916 [0,0,0,0,1,0|3,0,0]=4 70 B16R2.2884 Nc1nn(CCc2ccccc2)cc1Br Amb32701790 [0,0,0,0,1,0|3,0,0]=4 71 B16R2.2884 Nc1nn(CCc2ccccc2)cc1Cl Amb32701786 [0,0,0,0,1,0|3,0,0]=4 72 B16R2.5952 NN1C(=S)NN=C1CCc2ccccc2 Amb19800034 [0,0,0,0,1,0|2,1,0]=4 73 B18R2.8976 Cc1cc(NCCc2ccccc2)ncc1N Amb17213764 [0,0,0,0,0,1|3,0,0]=4 74 B15R1.5919 NC(=O)\C=C\C(=O)NCc1ccccc1 Amb1251671 [1,0,1,0,0,0|2,0,0]=4 75 B15R2.2195 c1ccc(CCc2ccccc2)cc1 Amb17678850 [2,0,0,0,0,0|2,0,0]=4 76 B15R2.2195 c1ccc(CCc2ccccn2)cc1 Amb5494186 [2,0,0,0,0,0|1,0,0]=3 77 B15R2.2195 c1ccc(CCc2ccccn2)nc1 Amb2713299 [2,0,0,0,0,0|2,0,0]=4 78 B15R2.2195 c1ccc(CCc2cccnc2)nc1 Amb6769550 [2,0,0,0,0,0|2,0,0]=4 79 B15R2.2195 c1ccc(CCc2cnccn2)cc1 Amb15695191 [2,0,0,0,0,0|2,0,0]=4 80 B15R2.2195 c1ccc(CNc2ccccn2)cc1 Amb1087875 [2,0,0,0,0,0|2,0,0]=4 81 B15R2.2195 c1ccc(COc2ccccn2)cc1 Amb16191945 [2,0,0,0,0,0|2,0,0]=4 82 B15R2.2195 c1ccc(CSc2ccccn2)cc1 Amb3862159 [2,0,0,0,0,0|2,0,0]=4 83 B15R2.2195 c1ccc(CSc2cccnn2)cc1 Amb25785634 [2,0,0,0,0,0|1,0,1]=4 84 B15R2.2195 c1ccc(NCc2ccccn2)cc1 Amb6356069 [2,0,0,0,0,0|2,0,0]=4 85 B17R2.48 O=Cc1ccc(OCc2ccccc2)nc1 Amb22002193 [1,1,0,0,0,0|2,0,0]=4 86 B17R2.48 O=Cc1cnc(CCc2ccccc2)nc1 Amb20413104 [1,1,0,0,0,0|2,0,0]=4 87 B17R2.192 O=C1C=CC(C(=O)Nc2ccccc2)=NN1 Amb19176424 [1,1,0,0,0,0|1,0,1]=4 88 B17R2.207 Cc1ccc(\C=C\C2=NNC(=O)C=C2)cc1 Amb21933377 [1,1,0,0,0,0|0,0,2]=4 89 B17R2.207 Fc1ccc(CNC2=NNC(=S)C=C2)cc1 Amb32423343 [1,1,0,0,0,0|1,1,0]=4 90 B17R2.207 O=C1CNC(CCc2ccc(Cl)cc2)=NN1 Amb18454656 [1,1,0,0,0,0|1,0,1]=4 91 B17R2.5360 O=C1NN=C(NCc2ccccc2)C(=O)N1 Amb18967942 [1,1,0,0,0,0|2,0,0]=4 92 B17R2.5360 O=C1NN=C(SCc2ccccc2)C(=S)N1 Amb18525276 [1,1,0,0,0,0|2,0,0]=4 93 B17R2.1819 OCc1ccnc(CCc2ccccc2)n1 Amb33540049 [1,1,0,0,0,0|2,0,0]=4 94 B17R2.1819 OCc1ccnc(OCc2ccccc2)c1 Amb28060887 [1,1,0,0,0,0|2,0,0]=4 95 B17R2.3212 Nc1cc(O)nc(CCc2ccccc2)n1 Amb19923596 [1,1,0,0,0,0|2,0,0]=4 96 B17R2.3212 O=C1C=C(O)C=C(CCc2ccccc2)O1 Amb22753984 [1,1,0,0,0,0|2,0,0]=4 97 B17R2.3212 Oc1cc(O)cc(CCc2ccccc2)c1 Amb15692016 [1,1,0,0,0,0|2,0,0]=4 98 B17R2.5273 NC(Cc1ccccc1)c2cc(O)ncn2 Amb18866627 [1,1,0,0,0,0|2,0,0]=4 99 B17R2.5273 NC(Cc1ccccc1)c2nccc(O)n2 Amb18225399 [1,1,0,0,0,0|2,0,0]=4 100 B17R2.5293 NC(Cc1cccc(O)c1)c2ccccc2 Amb18300564 [1,1,0,0,0,0|2,0,0]=4 101 B17R2.5293 NC(Cc1cccc(O)c1)c2ccccc2 Amb33549620 [1,1,0,0,0,0|2,0,0]=4 102 B17R2.5300 Nc1cccc(CCc2cc(O)ncn2)c1 Amb18225383 [1,1,0,0,0,0|2,0,0]=4 103 B17R2.5300 Nc1cccc(CCc2nccc(O)n2)c1 Amb18225381 [1,1,0,0,0,0|2,0,0]=4 104 B17R2.5300 Oc1cc(CCc2cccc(Br)c2)ncn1 Amb18888869 [1,1,0,0,0,0|2,0,0]=4 105 B17R2.5300 Oc1ccnc(CCc2cccc(Br)c2)n1 Amb18888868 [1,1,0,0,0,0|2,0,0]=4 106 B17R2.41893 Nc1ccccc1CCc2cc(O)ncn2 Amb18225380 [1,1,0,0,0,0|2,0,0]=4 107 B17R2.41893 Nc1ccccc1CCc2nccc(O)n2 Amb18225379 [1,1,0,0,0,0|2,0,0]=4 108 B17R2.41893 Oc1cc(CCc2ccccc2Br)ncn1 Amb18888866 [1,1,0,0,0,0|2,0,0]=4 109 B17R2.41893 Oc1ccnc(CCc2ccccc2Br)n1 Amb18888865 [1,1,0,0,0,0|2,0,0]=4 110 B17R2.5352 O=C1NC(=O)N(Cc2ccccc2)C=C1O Amb27614333 [0,1,0,0,1,0|2,0,0]=4 111 B17R2.2600 Cc1nc(CCc2ccccc2)sc1CO Amb17250913 [0,1,0,0,1,0|2,0,0]=4 112 B17R2.8671 CC1=C([C@@H](N)Cc2ccccc2)ONC1=O Amb18169586 [0,1,0,0,1,0|2,0,0]=4 113 B19R2.91860 O=C(O)c1cnc(CCc2ccccc2)nc1O Amb19923768 [0,2,0,0,0,0|2,0,0]=4 114 B17R2.5637 NC(=O)c1cc(OCc2ccccc2)no1 Amb10604451 [0,0,1,1,0,0|1,0,0]=3 115 B17R2.5637 O=C(O)c1cc(CCc2ccccc2)no1 Amb24174872 [0,0,1,1,0,0|1,0,0]=3 116 B17R3.50084 Oc1cccc2c1-c3ccccc3CC2 Amb32415240 [1,0,0,1,0,0|2,0,0]=4 117 B15R2.29 Brc1ccc(Cc2ccccc2)nc1 Amb25673195 [1,0,0,0,1,0|2,0,0]=4 118 B15R2.29 Clc1ccc(Cc2ccccc2)nn1 Amb2427199 [1,0,0,0,1,0|1,0,1]=4 119 B15R2.29 Fc1ccc(Cc2ccccc2)nc1 Amb24517032 [1,0,0,0,1,0|2,0,0]=4 120 B15R2.29 Nc1ccc(Cc2ccccc2)nc1 Amb18191583 [1,0,0,0,1,0|2,0,0]=4 121 B15R2.29 Nc1ccc(Cc2ccccc2)nn1 Amb18822485 [1,0,0,0,1,0|1,0,1]=4 122 B15R2.29 O=C1C=CC(Cc2ccccc2)=CO1 Amb27755369 [1,0,0,0,1,0|2,0,0]=4 123 B15R2.29 O=C1C=CC(Oc2ccccc2)=NN1 Amb26961886 [1,0,0,0,1,0|1,0,0]=3 124 B15R2.29 Oc1ccc(Cc2ccccc2)nc1 Amb18649107 [1,0,0,0,1,0|1,0,1]=4 125 B15R2.100 O=C1C=CC(NCc2ccco2)=NN1 Amb26431642 [1,0,0,0,1,0|2,0,0]=4 126 B15R2.100 O=C1C=CC(NCc2ccoc2)=NN1 Amb28201590 [1,0,0,0,1,0|2,0,0]=4 127 B15R2.283 Cc1ccn(CCc2ccccc2)n1 Amb24348125 [1,0,0,0,1,0|2,0,0]=4 128 B15R2.283 Nc1cc(CCc2ccccc2)no1 Amb33529147 [1,0,0,0,1,0|2,0,0]=4 129 B15R2.283 Nc1ccn(CCc2ccccc2)n1 Amb7173304 [1,0,0,0,1,0|2,0,0]=4 130 B15R2.283 Nc1csc(CCc2ccccc2)n1 Amb28341882 [1,0,0,0,1,0|2,0,0]=4 131 B15R2.283 Nc1nc(CCc2ccccc2)cs1 Amb17238165 [1,0,0,0,1,0|2,0,0]=4 132 B15R2.283 O=C1CSC(CCc2ccccc2)=N1 Amb4381581 [1,0,0,0,1,0|1,0,1]=4 133 B15R2.283 O=C1NN=C(CCc2ccccn2)N1 Amb35722967 [1,0,0,0,1,0|2,0,0]=4 134 B15R2.283 O=C1NN=C(CSc2ccccc2)O1 Amb25285848 [1,0,0,0,1,0|2,0,0]=4 135 B15R2.283 Oc1csc(CCc2ccccc2)n1 Amb27418813 [1,0,0,0,1,0|1,0,1]=4 136 B15R2.31 Oc1cc(Cc2ccccc2)ncn1 Amb9174456 [1,0,0,0,1,0|2,0,0]=4 137 B15R2.31 Oc1cccc(Cc2ccccc2)c1 Amb10602238 [1,0,0,0,1,0|2,0,0]=4 138 B15R2.31 Oc1ccnc(Cc2cccnc2)c1 Amb27628895 [1,0,0,0,1,0|2,0,0]=4 139 B15R2.31 Oc1cncc(Cc2ccccc2)c1 Amb4466318 [1,0,0,0,1,0|1,0,1]=4 140 B15R2.94 CC1=CC(c2ccccc2)=CNC1=O Amb27454275 [0,0,0,0,2,0|2,0,0]=4 141 B15R2.94 CC1=CC(c2ccccc2)=NNC1=O Amb22034430 [0,0,0,0,2,0|1,0,0]=3 142 B15R2.94 Cc1cnc(-c2ccccc2)cc1O Amb27634087 [0,0,0,0,2,0|2,0,0]=4 143 B15R2.94 NC1=CC(c2ccccc2)=CNC1=O Amb18538522 [0,0,0,0,2,0|2,0,0]=4 144 B15R2.94 NC1=CC(c2ccccc2)=NNC1=O Amb18016084 [0,0,0,0,2,0|1,0,0]=3 145 B15R2.94 O=C1NC=C(c2ccccc2)C=C1F Amb25935149 [0,0,0,0,2,0|2,0,0]=4 146 B15R2.94 O=C1NC=C(c2ccccc2)C=C1O Amb27629139 [0,0,0,0,2,0|1,0,0]=3 147 B15R2.94 O=C1NN=C(c2ccccc2)CC1O Amb28340508 [0,0,0,0,2,0|0,0,2]=4 148 B15R2.94 Oc1cc(-c2ccccc2)ncc1Cl Amb28284541 [0,0,0,0,2,0|2,0,0]=4 149 B15R2.314 CC1=C[C@H](Cc2ccccc2)NC1=O Amb27602226 [0,0,0,0,2,0|1,0,1]=4 150 B15R2.314 CC1=C\C(=C/c2ccccc2)NC1=O Amb28118377 [0,0,0,0,2,0|1,0,1]=4 151 B15R2.314 CC1=C\C(=C\c2ccccc2)NC1=O Amb27248402 [0,0,0,0,2,0|1,0,1]=4 152 B15R2.314 O=C1N=C(Cc2ccccc2)NC1=O Amb28044485 [0,0,0,0,2,0|1,0,1]=4 153 B17R2.216 Brc1ccc(CNCc2ccccc2)nc1 Amb27223602 [1,0,0,0,0,1|2,0,0]=4 154 B17R2.216 Brc1ccc(NCCc2ccccc2)nc1 Amb6623061 [1,0,0,0,0,1|2,0,0]=4 155 B17R2.216 Clc1ccc(CNCc2ccccc2)nc1 Amb28342095 [1,0,0,0,0,1|2,0,0]=4 156 B17R2.216 Clc1ccc(NCCc2ccccc2)nn1 Amb6645304 [1,0,0,0,0,1|1,0,1]=4 157 B17R2.216 Clc1ccc(OCCc2ccccc2)nn1 Amb9208566 [1,0,0,0,0,1|1,0,1]=4 158 B17R2.216 Nc1ccc(NCCc2ccccc2)nc1 Amb5786808 [1,0,0,0,0,1|2,0,0]=4 159 B17R2.216 Nc1ccc(OCCc2ccccc2)nc1 Amb7790211 [1,0,0,0,0,1|2,0,0]=4 160 B17R2.216 O=C1C=CC(CNCc2ccccc2)=CN1 Amb27866225 [1,0,0,0,0,1|1,0,0]=3 161 B17R2.5301 Nc1ccnc(NCCc2ccccc2)c1 Amb17340020 [1,0,0,0,0,1|2,0,0]=4 162 B17R2.5301 Oc1cc(COCc2ccccc2)ncn1 Amb22167140 [1,0,0,0,0,1|2,0,0]=4 163 B17R2.5301 Oc1cccc(CNCc2ccccc2)c1 Amb6687458 [1,0,0,0,0,1|2,0,0]=4 164 B17R2.5301 Oc1cccc(OCCc2ccccc2)c1 Amb8837429 [1,0,0,0,0,1|2,0,0]=4