0 B18R2.9259 Cc1cc(CNc2ccc(F)cc2)ccc1F Amb17408175 [0,0,0,0,0,0|4,0,0]=4 1 B18R2.9259 Cc1ccc(CNc2ccc(F)cc2)cc1C Amb9629158 [0,0,0,0,0,0|4,0,0]=4 2 B18R2.9259 Cc1ccc(COc2ccc(O)cc2)cc1C Amb17248169 [0,0,0,0,0,0|4,0,0]=4 3 B18R2.9259 Cc1ccc(SCC2=CC(=O)C(O)=CO2)cc1 Amb21176408 [0,0,0,0,0,0|1,1,0]=2 4 B18R2.9259 NC1=CN=C(COc2ccc(Cl)cc2)NC1=O Amb18531754 [0,0,0,0,0,0|3,1,0]=4 5 B18R2.9259 Nc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 Amb843449 [0,0,0,0,0,0|4,0,0]=4 6 B18R2.9259 O=C1C=C(CSc2ccc(Cl)cc2)OC=C1O Amb21176402 [0,0,0,0,0,0|0,2,0]=2 7 B18R2.9259 O=C1C=C(CSc2ccc(F)cc2)OC=C1O Amb21176422 [0,0,0,0,0,0|0,1,0]=1 8 B17R2.193 NC1=CN=C(COc2ccccc2)NC1=O Amb18531749 [1,0,0,0,0,0|3,0,0]=4 9 B17R2.193 O=C1C=C(CSc2ncccn2)OC=C1O Amb18384442 [1,0,0,0,0,0|2,1,0]=4 10 B17R2.207 Cc1ccc(CNc2ccc(F)cc2)cc1 Amb3699183 [1,0,0,0,0,0|3,0,0]=4 11 B17R2.207 Cc1ccc(COc2ccc(N)cc2)cc1 Amb1121413 [1,0,0,0,0,0|3,0,0]=4 12 B17R2.207 Cc1ccc(NCc2ccc(O)cc2)cc1 Amb3547087 [1,0,0,0,0,0|3,0,0]=4 13 B17R2.207 Cc1ccc(OCc2ccc(Br)cc2)cc1 Amb24064692 [1,0,0,0,0,0|3,0,0]=4 14 B17R2.207 Clc1ccc(COc2ccc(I)cc2)cc1 Amb4985461 [1,0,0,0,0,0|2,1,0]=4 15 B17R2.207 Clc1ccc(OCc2ccc(Br)cc2)cc1 Amb4853935 [1,0,0,0,0,0|2,1,0]=4 16 B17R2.207 Fc1ccc(CCc2ccc(F)cc2)cc1 Amb2759832 [1,0,0,0,0,0|3,0,0]=4 17 B17R2.207 Fc1ccc(COc2ccc(Br)cc2)cc1 Amb6665066 [1,0,0,0,0,0|2,1,0]=4 18 B17R2.207 Fc1ccc(COc2ccc(Cl)cc2)cc1 Amb1547339 [1,0,0,0,0,0|2,1,0]=4 19 B17R2.207 Fc1ccc(NCc2ccc(Cl)cc2)cc1 Amb4313433 [1,0,0,0,0,0|3,0,0]=4 20 B17R2.207 Nc1ccc(CCc2ccc(O)cc2)cc1 Amb6298293 [1,0,0,0,0,0|3,0,0]=4 21 B17R2.207 Nc1ccc(COc2ccc(Br)cc2)cc1 Amb2371348 [1,0,0,0,0,0|2,1,0]=4 22 B17R2.207 Nc1ccc(COc2ccc(Cl)cc2)cc1 Amb1128477 [1,0,0,0,0,0|2,1,0]=4 23 B17R2.207 Nc1ccc(CSc2ccc(F)cc2)cc1 Amb2414977 [1,0,0,0,0,0|2,1,0]=4 24 B17R2.207 Nc1ccc(OCc2ccc(Br)cc2)cc1 Amb843450 [1,0,0,0,0,0|3,0,0]=4 25 B17R2.207 Nc1ccc(OCc2ccc(Cl)cc2)cc1 Amb1395344 [1,0,0,0,0,0|3,0,0]=4 26 B17R2.207 Nc1ccc(OCc2ccc(F)cc2)cc1 Amb1119010 [1,0,0,0,0,0|3,0,0]=4 27 B17R2.207 Nc1cnc(COc2ccc(F)cc2)nc1 Amb17486603 [1,0,0,0,0,0|3,0,0]=4 28 B17R2.207 Oc1ccc(C#Cc2ccc(F)cc2)cc1 Amb10839829 [1,0,0,0,0,0|2,0,1]=4 29 B17R2.207 Oc1ccc(CCc2ccc(Cl)cc2)cc1 Amb2413167 [1,0,0,0,0,0|2,1,0]=4 30 B17R2.207 Oc1ccc(CCc2ccc(O)cc2)cc1 Amb2445097 [1,0,0,0,0,0|3,0,0]=4 31 B17R2.207 Oc1ccc(CNc2ccc(Br)cc2)cc1 Amb4032194 [1,0,0,0,0,0|2,1,0]=4 32 B17R2.207 Oc1ccc(CNc2ccc(Cl)cc2)cc1 Amb4020906 [1,0,0,0,0,0|2,1,0]=4 33 B17R2.207 Oc1ccc(CNc2ccc(F)cc2)cc1 Amb4018606 [1,0,0,0,0,0|2,0,0]=3 34 B17R2.207 Oc1ccc(CNc2ccc(O)cc2)cc1 Amb6867964 [1,0,0,0,0,0|3,0,0]=4 35 B17R2.207 Oc1ccc(OCc2ccc(Br)cc2)cc1 Amb33528788 [1,0,0,0,0,0|3,0,0]=4 36 B17R2.207 Oc1ccc(\C=N\c2ccc(F)cc2)cc1 Amb2704333 [1,0,0,0,0,0|2,0,1]=4 37 B17R2.207 Oc1ccc(\C=N\c2ccc(F)cc2)cc1 Amb33715879 [1,0,0,0,0,0|2,0,1]=4 38 B17R2.215 Cc1cccc(CNc2ccc(F)cc2)c1 Amb4313254 [1,0,0,0,0,0|3,0,0]=4 39 B17R2.215 Cc1cccc(COc2ccc(N)cc2)c1 Amb1119835 [1,0,0,0,0,0|3,0,0]=4 40 B17R2.215 Clc1ccc(OCc2cccc(Br)c2)cc1 Amb30588926 [1,0,0,0,0,0|2,1,0]=4 41 B17R2.215 Fc1ccc(NCc2cccc(Cl)c2)cc1 Amb4303626 [1,0,0,0,0,0|3,0,0]=4 42 B17R2.215 Fc1ccc(NCc2cccc(F)c2)cc1 Amb6696703 [1,0,0,0,0,0|3,0,0]=4 43 B17R2.215 Fc1cccc(COc2ccc(I)cc2)c1 Amb28984096 [1,0,0,0,0,0|2,1,0]=4 44 B17R2.215 Nc1ccc(OCc2cccc(Br)c2)cc1 Amb1135336 [1,0,0,0,0,0|3,0,0]=4 45 B17R2.215 Nc1ccc(OCc2cccc(Cl)c2)cc1 Amb6245870 [1,0,0,0,0,0|3,0,0]=4 46 B17R2.215 Nc1ccc(OCc2cccc(F)c2)cc1 Amb1117692 [1,0,0,0,0,0|3,0,0]=4 47 B17R2.215 Nc1cccc(COc2ccc(Cl)cc2)c1 Amb6243774 [1,0,0,0,0,0|2,1,0]=4 48 B17R2.215 Nc1cccc(COc2ccc(F)cc2)c1 Amb6243286 [1,0,0,0,0,0|2,0,0]=3 49 B17R2.215 Nc1ccnc(COc2ccc(F)cc2)n1 Amb18067495 [1,0,0,0,0,0|3,0,0]=4 50 B17R2.215 Oc1ccc(OCc2cccc(Br)c2)cc1 Amb8837215 [1,0,0,0,0,0|3,0,0]=4 51 B17R2.215 Oc1ccc(OCc2cccc(Cl)c2)cc1 Amb9210962 [1,0,0,0,0,0|3,0,0]=4 52 B17R2.215 Oc1ccc(OCc2cccc(F)c2)cc1 Amb8837229 [1,0,0,0,0,0|3,0,0]=4 53 B17R2.215 Oc1cccc(CNc2ccc(F)cc2)c1 Amb6696810 [1,0,0,0,0,0|2,0,1]=4 54 B19R2.2679 COC1=CNC(CSc2ccc(F)cc2)=CC1=O Amb18384440 [0,1,0,0,0,0|1,1,0]=3 55 B19R2.2679 COC1=COC(CSc2ccc(C)cc2)=CC1=O Amb28487748 [0,1,0,0,0,0|1,1,0]=3 56 B19R2.2679 COC1=COC(CSc2ccc(Cl)cc2)=CC1=O Amb22471188 [0,1,0,0,0,0|0,2,0]=3 57 B19R2.2679 COC1=COC(CSc2ccc(F)cc2)=CC1=O Amb28487922 [0,1,0,0,0,0|0,1,0]=2 58 B19R2.2679 COc1ccc(CNc2ccc(F)cc2)cc1C Amb9629166 [0,1,0,0,0,0|3,0,0]=4 59 B19R2.2679 COc1ccc(CNc2ccc(F)cc2)cc1Cl Amb1882528 [0,1,0,0,0,0|3,0,0]=4 60 B19R2.2679 COc1ccc(CNc2ccc(F)cc2)cc1F Amb8841402 [0,1,0,0,0,0|3,0,0]=4 61 B19R2.2679 COc1ccc(CNc2ccc(F)cc2)cc1O Amb6696710 [0,1,0,0,0,0|2,0,1]=4 62 B19R2.2679 COc1ccc(COc2ccc(O)cc2)cc1C Amb17257086 [0,1,0,0,0,0|3,0,0]=4 63 B19R2.2679 COc1ccc(COc2ccc(O)cc2)cc1Cl Amb17271370 [0,1,0,0,0,0|3,0,0]=4 64 B19R2.2679 COc1ccc(COc2ccc(O)cc2)cc1F Amb8845162 [0,1,0,0,0,0|3,0,0]=4 65 B19R2.2847 COc1cc(CNc2ccc(F)cc2)ccc1O Amb6696693 [0,1,0,0,0,0|2,0,1]=4 66 B19R2.2847 O=Cc1cc(\N=N\c2ccc(F)cc2)ccc1O Amb20411372 [0,1,0,0,0,0|3,0,0]=4 67 B17R2.472 Cc1cc(Cc2ccc(F)cc2)ccc1N Amb17140927 [0,0,0,0,1,0|3,0,0]=4 68 B17R2.472 Cc1cc(Cc2ccc(O)cc2)ccc1O Amb17595818 [0,0,0,0,1,0|3,0,0]=4 69 B17R2.472 Cc1cc(Oc2ccc(F)cc2)ncc1N Amb24086478 [0,0,0,0,1,0|3,0,0]=4 70 B17R2.472 Cc1ccc(Cc2ccc(F)cc2)cc1N Amb17140924 [0,0,0,0,1,0|3,0,0]=4 71 B17R2.472 Nc1cc(Cc2ccc(F)cc2)ccc1Cl Amb17158075 [0,0,0,0,1,0|3,0,0]=4 72 B16R2.132 Brc1ccc(COc2ccccc2)cc1 Amb2710379 [2,0,0,0,0,0|2,0,0]=4 73 B16R2.132 Brc1ccc(COc2ccccc2)nc1 Amb28457102 [2,0,0,0,0,0|2,0,0]=4 74 B16R2.132 Brc1ccc(OCc2ccccc2)cc1 Amb2447239 [2,0,0,0,0,0|1,1,0]=4 75 B16R2.132 Cc1ccc(OCc2ccccc2)cc1 Amb4018566 [2,0,0,0,0,0|2,0,0]=4 76 B16R2.132 Clc1ccc(OCc2ccccc2)cc1 Amb2684651 [2,0,0,0,0,0|1,1,0]=4 77 B16R2.132 Fc1ccc(NCc2ccccc2)cc1 Amb3726374 [2,0,0,0,0,0|2,0,0]=4 78 B16R2.132 Fc1ccc(NCc2ccccn2)cc1 Amb6696824 [2,0,0,0,0,0|2,0,0]=4 79 B16R2.132 Fc1ccc(OCc2ccccc2)cc1 Amb2684652 [2,0,0,0,0,0|1,0,0]=3 80 B16R2.132 Fc1ccc(OCc2ccccc2)cn1 Amb27774067 [2,0,0,0,0,0|2,0,0]=4 81 B16R2.132 Fc1ccc(OCc2ccccc2)nc1 Amb19959570 [2,0,0,0,0,0|2,0,0]=4 82 B16R2.132 Fc1ccc(OCc2ccccn2)cn1 Amb28040697 [2,0,0,0,0,0|2,0,0]=4 83 B16R2.132 Ic1ccc(OCc2ccccc2)cc1 Amb2684653 [2,0,0,0,0,0|1,1,0]=4 84 B16R2.132 Ic1ccc(OCc2ccccn2)cc1 Amb20627464 [2,0,0,0,0,0|1,1,0]=4 85 B16R2.132 Nc1ccc(COc2ccccc2)cc1 Amb1136463 [2,0,0,0,0,0|2,0,0]=4 86 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb22489506 [2,0,0,0,0,0|2,0,0]=4 87 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb2719847 [2,0,0,0,0,0|2,0,0]=4 88 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb6315574 [2,0,0,0,0,0|2,0,0]=4 89 B16R2.132 Nc1ccc(OCc2ccccn2)cc1 Amb1099016 [2,0,0,0,0,0|2,0,0]=4 90 B16R2.132 Nc1ccc(OCc2ccccn2)cc1 Amb22279532 [2,0,0,0,0,0|2,0,0]=4 91 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb10609692 [2,0,0,0,0,0|2,0,0]=4 92 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb3544585 [2,0,0,0,0,0|2,0,0]=4 93 B16R2.132 Oc1ccc(OCc2ccccc2)cc1 Amb1228378 [2,0,0,0,0,0|2,0,0]=4 94 B16R2.132 Sc1ccc(OCc2ccccc2)cc1 Amb27767077 [2,0,0,0,0,0|2,0,0]=4 95 B16R2.132 [NH3+]c1ccc(OCc2ccccc2)cc1 Amb24113829 [2,0,0,0,0,0|2,0,0]=4 96 B16R2.252 Brc1cccc(COc2ccccc2)c1 Amb2724116 [2,0,0,0,0,0|2,0,0]=4 97 B16R2.252 Fc1cccc(COc2ccccc2)c1 Amb2691208 [2,0,0,0,0,0|2,0,0]=4 98 B16R2.252 Nc1cccc(COc2ccccc2)c1 Amb2724117 [2,0,0,0,0,0|2,0,0]=4 99 B16R2.252 Nc1cccc(COc2ccccc2)c1 Amb33164191 [2,0,0,0,0,0|2,0,0]=4 100 B16R2.252 O=C1C=CNC(COc2ccccc2)=N1 Amb28751007 [2,0,0,0,0,0|2,0,0]=4 101 B16R2.252 Oc1cccc(COc2ccccc2)c1 Amb23443322 [2,0,0,0,0,0|1,0,1]=4 102 B18R2.52 COc1ccc(COc2ccc(I)cc2)cc1 Amb32414064 [1,1,0,0,0,0|1,1,0]=4 103 B18R2.52 COc1ccc(COc2ccc(N)cc2)cc1 Amb6245661 [1,1,0,0,0,0|2,0,0]=4 104 B18R2.52 COc1ccc(COc2ccc(O)cc2)cc1 Amb8837261 [1,1,0,0,0,0|2,0,0]=4 105 B18R2.52 NCc1ccc(COc2ccc(F)cc2)cc1 Amb1136855 [1,1,0,0,0,0|2,0,0]=4 106 B18R2.52 NCc1ccc(COc2ccc(F)cc2)cc1 Amb28906943 [1,1,0,0,0,0|2,0,0]=4 107 B18R2.9252 Cc1ccc(COc2ccc(F)cc2N)cc1 Amb9779669 [1,1,0,0,0,0|2,0,0]=4 108 B18R2.9252 Fc1ccc(OCc2ccc(Cl)cc2)c(Br)c1 Amb6659253 [1,1,0,0,0,0|2,0,0]=4 109 B18R2.9252 Nc1cc(F)ccc1OCc2ccc(Cl)cc2 Amb17413616 [1,1,0,0,0,0|2,0,0]=4 110 B18R2.9252 Nc1cc(F)ccc1OCc2ccc(F)cc2 Amb9779670 [1,1,0,0,0,0|2,0,0]=4 111 B18R2.9252 Oc1ccc(CNc2ccc(F)cc2F)cc1 Amb6698216 [1,1,0,0,0,0|2,0,0]=4 112 B18R2.65901 Cc1cccc(COc2ccc(F)cc2N)c1 Amb9779668 [1,1,0,0,0,0|2,0,0]=4 113 B18R2.65901 Fc1cccc(COc2ccc(F)cc2Br)c1 Amb6665091 [1,1,0,0,0,0|2,0,0]=4 114 B18R2.65901 Nc1cc(F)ccc1OCc2cccc(Cl)c2 Amb17413615 [1,1,0,0,0,0|2,0,0]=4 115 B18R2.2571 COc1ccc(Cc2ccc(F)cc2)cc1N Amb17142724 [0,1,0,0,1,0|2,0,0]=4 116 B20R2.2387056 COc1ccc(COc2ccc(F)cc2N)cc1C Amb17416270 [0,2,0,0,0,0|2,0,0]=4 117 B20R2.2387056 COc1ccc(COc2ccc(F)cc2N)cc1F Amb17417805 [0,2,0,0,0,0|2,0,0]=4 118 B18R2.9260 O=C(O)c1cc(COc2ccc(F)cc2)on1 Amb1101686 [0,0,1,1,0,0|2,0,0]=4 119 B18R3.6310 O=C1C=C2CNc3ccccc3N2C=C1O Amb20413981 [1,0,0,1,0,0|2,0,0]=4 120 B16R2.124 Cc1cc(Cc2ccccc2)ccc1O Amb24065834 [1,0,0,0,1,0|2,0,0]=4 121 B16R2.124 Nc1cc(Cc2ccccc2)ccc1O Amb33552377 [1,0,0,0,1,0|2,0,0]=4 122 B16R2.124 Nc1cc(Oc2ccccc2)ccc1O Amb18555885 [1,0,0,0,1,0|2,0,0]=4 123 B16R2.124 Oc1ccc(Cc2ccccc2)cc1Cl Amb24065833 [1,0,0,0,1,0|2,0,0]=4 124 B16R2.124 Oc1ccc(Cc2ccccc2)cc1O Amb24060583 [1,0,0,0,1,0|1,0,1]=4 125 B16R2.33 Cc1ccc(Oc2ccc(O)cc2)cc1 Amb1106395 [1,0,0,0,1,0|2,0,0]=4 126 B16R2.33 Fc1ccc(Cc2ccc(F)cc2)cc1 Amb2684762 [1,0,0,0,1,0|2,0,0]=4 127 B16R2.33 Fc1ccc(Oc2ccc(Br)cc2)cc1 Amb22227903 [1,0,0,0,1,0|2,0,0]=4 128 B16R2.33 Fc1ccc(Oc2ccc(Br)cn2)cc1 Amb27773384 [1,0,0,0,1,0|2,0,0]=4 129 B16R2.33 Fc1ccc(Oc2ccc(F)cc2)cc1 Amb2684761 [1,0,0,0,1,0|2,0,0]=4 130 B16R2.33 Fc1ccc(Oc2ccc(I)cc2)cc1 Amb10841344 [1,0,0,0,1,0|2,0,0]=4 131 B16R2.33 Nc1ccc(Cc2ccc(F)cc2)cc1 Amb17101867 [1,0,0,0,1,0|2,0,0]=4 132 B16R2.33 Nc1ccc(Oc2ccc(F)cc2)cc1 Amb2721771 [1,0,0,0,1,0|2,0,0]=4 133 B16R2.33 Nc1ccc(Oc2ccc(F)cc2)cc1 Amb6760515 [1,0,0,0,1,0|2,0,0]=4 134 B16R2.33 Nc1ccc(Oc2ccc(F)cc2)nc1 Amb1135502 [1,0,0,0,1,0|2,0,0]=4 135 B16R2.33 Nc1ccc(Oc2ccc(F)cc2)nc1 Amb22587184 [1,0,0,0,1,0|2,0,0]=4 136 B16R2.33 Oc1ccc(Cc2ccc(O)cc2)cc1 Amb2710982 [1,0,0,0,1,0|2,0,0]=4 137 B16R2.33 Oc1ccc(Oc2ccc(Br)cc2)cc1 Amb7094554 [1,0,0,0,1,0|1,1,0]=4 138 B16R2.33 Oc1ccc(Oc2ccc(Cl)cc2)cc1 Amb7094545 [1,0,0,0,1,0|1,1,0]=4 139 B16R2.33 Oc1ccc(Oc2ccc(F)cc2)cc1 Amb7094538 [1,0,0,0,1,0|1,0,0]=3 140 B16R2.33 Oc1ccc(Oc2ccc(F)cc2)nc1 Amb31307891 [1,0,0,0,1,0|1,0,0]=3 141 B16R2.33 Oc1ccc(Oc2ccc(I)cc2)cc1 Amb33801467 [1,0,0,0,1,0|1,1,0]=4 142 B16R2.33 Oc1ccc(Oc2ccc(O)cc2)cc1 Amb2226950 [1,0,0,0,1,0|2,0,0]=4 143 B16R2.137 Brc1ccc(COc2ccc(I)cc2)o1 Amb27175136 [1,0,0,0,1,0|1,1,0]=4 144 B16R2.137 Cc1ccc(CNc2ccc(F)cc2)o1 Amb6696721 [1,0,0,0,1,0|2,0,0]=4 145 B16R2.137 Fc1ccc(OCc2cc(Br)no2)cc1 Amb23449488 [1,0,0,0,1,0|2,0,0]=4 146 B16R2.137 Fc1ccc(SCc2ccc(Br)o2)cc1 Amb27198849 [1,0,0,0,1,0|1,1,0]=4 147 B16R2.131 Cc1cccc(Oc2ccc(F)cc2)c1 Amb22230826 [1,0,0,0,1,0|2,0,0]=4 148 B16R2.131 Fc1ccc(Oc2cccc(Br)c2)cc1 Amb2685213 [1,0,0,0,1,0|2,0,0]=4 149 B16R2.131 Fc1ccc(Oc2cccc(I)c2)cc1 Amb2688129 [1,0,0,0,1,0|2,0,0]=4 150 B16R2.131 Nc1cccc(Cc2ccc(F)cc2)c1 Amb17139840 [1,0,0,0,1,0|2,0,0]=4 151 B16R2.131 Nc1cccc(Oc2ccc(F)cc2)c1 Amb24105794 [1,0,0,0,1,0|2,0,0]=4 152 B16R2.131 Nc1ccnc(Oc2ccc(F)cc2)c1 Amb18956421 [1,0,0,0,1,0|2,0,0]=4 153 B16R2.131 Oc1cccc(Oc2ccc(F)cc2)c1 Amb33291321 [1,0,0,0,1,0|1,0,1]=4 154 B16R2.2864 Cc1cc(-c2ccc(F)cc2)ccc1O Amb21856716 [0,0,0,0,2,0|2,0,0]=4 155 B16R2.2864 Oc1ccc(-c2ccc(F)cc2)cc1Cl Amb17137469 [0,0,0,0,2,0|2,0,0]=4 156 B16R2.2864 Oc1ccc(-c2ccc(F)cc2)cc1F Amb32666593 [0,0,0,0,2,0|2,0,0]=4 157 B18R2.274 Nc1ccc(CCOc2ccc(F)cc2)cc1 Amb9380874 [1,0,0,0,0,1|2,0,0]=4 158 B18R2.274 Oc1ccc(CNCc2ccc(F)cc2)cc1 Amb6697071 [1,0,0,0,0,1|2,0,0]=4