0 B18R2.270 Brc1c[n]c(cc1)NCCCc2ccccc2 Amb23920929 [0,0,0,0,0,0|4,0,0]=4 1 B18R2.270 Brc1ccc(CCCSc2ccccc2)cc1 Amb22471644 [0,0,0,0,0,0|3,0,1]=4 2 B18R2.270 Brc1ccc(CCOCc2ccccc2)cc1 Amb25322703 [0,0,0,0,0,0|3,0,1]=4 3 B18R2.270 Brc1ccc(CNOCc2ccccc2)cc1 Amb25025813 [0,0,0,0,0,0|2,0,2]=4 4 B18R2.270 Brc1ccc(cc1)OCCOc2ccccc2 Amb17291210 [0,0,0,0,0,0|4,0,0]=4 5 B18R2.270 Brc1ccc(cc1)OCCSc2ccccc2 Amb22275226 [0,0,0,0,0,0|4,0,0]=4 6 B18R2.270 Brc1ccc(cc1)OCOCc2ccccc2 Amb25745562 [0,0,0,0,0,0|4,0,0]=4 7 B18R2.270 Brc1ccc(cc1)SCCOc2ccccc2 Amb2430858 [0,0,0,0,0,0|4,0,0]=4 8 B18R2.270 Brc1ccc(cc1)\N=N\NCc2ccccc2 Amb24582456 [0,0,0,0,0,0|3,0,0]=3 9 B18R2.270 Cc1ccc(CCCNc2ccccc2)cc1 Amb23950702 [0,0,0,0,0,0|3,0,1]=4 10 B18R2.270 Cc1ccc(CCNCc2ccccc2)cc1 Amb25026145 [0,0,0,0,0,0|3,0,1]=4 11 B18R2.270 Cc1ccc(CNOCc2ccccc2)cc1 Amb24556150 [0,0,0,0,0,0|2,0,2]=4 12 B18R2.270 Cc1ccc(cc1)NCCNc2ccccc2 Amb20139092 [0,0,0,0,0,0|4,0,0]=4 13 B18R2.270 Cc1ccc(cc1)N\N=N\Cc2ccccc2 Amb22489918 [0,0,0,0,0,0|3,0,0]=3 14 B18R2.270 Cc1ccc(cc1)OCCNc2ccccc2 Amb17247794 [0,0,0,0,0,0|4,0,0]=4 15 B18R2.270 Cc1ccc(cc1)SCCOc2ccccc2 Amb2430869 [0,0,0,0,0,0|4,0,0]=4 16 B18R2.270 Cc1ccc(cc1)SCCSc2ccccc2 Amb22266321 [0,0,0,0,0,0|4,0,0]=4 17 B18R2.270 Clc1ccc(C=NNCc2ccccc2)cc1 Amb22447544 [0,0,0,0,0,0|2,0,0]=2 18 B18R2.270 Clc1ccc(C=NOCc2ccccc2)c[n]1 Amb22487960 [0,0,0,0,0,0|3,0,0]=3 19 B18R2.270 Clc1ccc(CNOCc2ccccc2)cc1 Amb25349917 [0,0,0,0,0,0|2,0,2]=4 20 B18R2.270 Clc1ccc(cc1)NCCNc2ccccc2 Amb20139074 [0,0,0,0,0,0|4,0,0]=4 21 B18R2.270 Clc1ccc(cc1)OCCSc2ccccc2 Amb22285347 [0,0,0,0,0,0|4,0,0]=4 22 B18R2.270 Clc1ccc(cc1)OCOCc2ccccc2 Amb24673858 [0,0,0,0,0,0|4,0,0]=4 23 B18R2.270 Clc1ccc(cc1)SCCOc2ccccc2 Amb2430842 [0,0,0,0,0,0|4,0,0]=4 24 B18R2.270 Clc1ccc(cc1)SCCSc2ccccc2 Amb22285350 [0,0,0,0,0,0|4,0,0]=4 25 B18R2.270 Clc1ccc(cc1)\C=C/C=N\c2ccccc2 Amb10560610 [0,0,0,0,0,0|3,0,1]=4 26 B18R2.270 Fc1ccc(CNCCc2c[n]ccc2)cc1 Amb23916062 [0,0,0,0,0,0|2,0,2]=4 27 B18R2.270 Fc1ccc(CNCCc2ccccc2)cc1 Amb22283512 [0,0,0,0,0,0|1,0,2]=3 28 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 Amb1058734 [0,0,0,0,0,0|1,0,2]=3 29 B18R2.270 Fc1ccc(cc1)NCCNc2ccccc2 Amb20139080 [0,0,0,0,0,0|4,0,0]=4 30 B18R2.270 Fc1ccc(cc1)OCCNc2ccccc2 Amb17249420 [0,0,0,0,0,0|4,0,0]=4 31 B18R2.270 Fc1ccc(cc1)OCCOc2ccccc2 Amb22275251 [0,0,0,0,0,0|4,0,0]=4 32 B18R2.270 Fc1ccc(cc1)OCCSc2ccccc2 Amb22269765 [0,0,0,0,0,0|4,0,0]=4 33 B18R2.270 Fc1ccc(cc1)SCCNc2ccccc2 Amb19148826 [0,0,0,0,0,0|4,0,0]=4 34 B18R2.270 Ic1ccc(cc1)OCCCc2ccccc2 Amb22269808 [0,0,0,0,0,0|3,0,0]=3 35 B18R2.270 Ic1ccc(cc1)OCCOc2ccccc2 Amb22269810 [0,0,0,0,0,0|4,0,0]=4 36 B18R2.270 Nc1ccc(CCNCc2ccccc2)cc1 Amb25042095 [0,0,0,0,0,0|3,0,1]=4 37 B18R2.270 Nc1ccc(cc1)NCCOc2ccccc2 Amb17248220 [0,0,0,0,0,0|4,0,0]=4 38 B18R2.270 Nc1ccc(cc1)OCCCc2ccccc2 Amb2089061 [0,0,0,0,0,0|3,0,0]=3 39 B18R2.270 Nc1ccc(cc1)SCOCc2ccccc2 Amb25811372 [0,0,0,0,0,0|4,0,0]=4 40 B18R2.270 Nc1ccc(nc1)OCCCc2ccccc2 Amb17093700 [0,0,0,0,0,0|4,0,0]=4 41 B18R2.270 Oc1ccc(cc1)SCOCc2ccccc2 Amb25746438 [0,0,0,0,0,0|3,0,0]=3 42 B18R2.270 Oc1ccc(cc1)\C=N\CCc2ccccc2 Amb1005883 [0,0,0,0,0,0|0,0,0]=0 43 B18R2.270 Oc1ccc(cc1)\N=C\CCc2ccccc2 Amb2270720 [0,0,0,0,0,0|2,0,0]=2 44 B17R2.2382 C(=C/c1ccccc1)\C=C\c2ccccc2 Amb2458220 [1,0,0,0,0,0|1,0,2]=4 45 B17R2.2382 C(CCCc1cccc[n]1)c2ccccc2 Amb24064991 [1,0,0,0,0,0|2,0,1]=4 46 B17R2.2382 C(CCCc1ccccc1)c2cc[n]cc2 Amb24097587 [1,0,0,0,0,0|2,0,1]=4 47 B17R2.2382 C(CNc1ccccc1)Nc2ccccc2 Amb22733337 [1,0,0,0,0,0|3,0,0]=4 48 B17R2.2382 C(NCCc1ccccc1)c2cccc[n]2 Amb22279533 [1,0,0,0,0,0|1,0,2]=4 49 B17R2.2382 C(N\C=C\c1ccccc1)c2ccccc2 Amb25350265 [1,0,0,0,0,0|2,0,0]=3 50 B17R2.2382 C(OCCc1ccccc1)c2ccccc2 Amb24092972 [1,0,0,0,0,0|1,0,1]=3 51 B17R2.2382 C(ON=Cc1c[n]ccc1)c2ccccc2 Amb24072697 [1,0,0,0,0,0|2,0,0]=3 52 B17R2.2382 C(O\C=N\c1ccccc1)c2ccccc2 Amb24629275 [1,0,0,0,0,0|3,0,0]=4 53 B17R2.2382 C(O\N=C\c1cc[n]cc1)c2ccccc2 Amb25370566 [1,0,0,0,0,0|2,0,0]=3 54 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 Amb15740914 [1,0,0,0,0,0|1,0,2]=4 55 B17R2.2382 c1ccc(cc1)CCNCc2ccncc2 Amb13961960 [1,0,0,0,0,0|1,0,2]=4 56 B17R2.2382 c1ccc(cc1)CNCCc2ccccc2 Amb1049050 [1,0,0,0,0,0|0,0,2]=3 57 B17R2.2382 c1ccc(cc1)CNCCc2ccccn2 Amb1397745 [1,0,0,0,0,0|1,0,2]=4 58 B17R2.2382 c1ccc(cc1)CSCCc2ccncc2 Amb1032140 [1,0,0,0,0,0|2,0,1]=4 59 B17R2.2382 c1ccc(cc1)SC\C=C\c2ccccc2 Amb2433200 [1,0,0,0,0,0|2,0,0]=3 60 B17R2.2382 c1ccc(cc1)\C=C\C=N\c2ccccc2 Amb2459649 [1,0,0,0,0,0|2,0,1]=4 61 B17R2.2382 c1ccc(cc1)\C=C\CNc2ccccn2 Amb17100159 [1,0,0,0,0,0|3,0,0]=4 62 B17R2.2382 c1ccc(cc1)\C=C\CSc2ccccn2 Amb2430228 [1,0,0,0,0,0|3,0,0]=4 63 B17R2.2382 c1ccc(cc1)\C=N/C=C\c2ccccc2 Amb10559943 [1,0,0,0,0,0|0,0,2]=3 64 B17R2.2382 c1ccc(cc1)\C=N\N=C\c2ccccc2 Amb1419561 [1,0,0,0,0,0|1,0,1]=3 65 B17R2.2382 c1ccccc1NN\N=N\c2ccccc2 Amb21953597 [1,0,0,0,0,0|3,0,0]=4 66 B19R2.57 CNc1ccc(cc1)OCCCc2ccccc2 Amb20138958 [0,1,0,0,0,0|3,0,0]=4 67 B19R2.57 COc1ccc(C=NN=Cc2ccccc2)cc1 Amb24092520 [0,1,0,0,0,0|1,0,1]=3 68 B19R2.57 COc1ccc(CCNCc2ccccc2)cc1 Amb19959919 [0,1,0,0,0,0|2,0,1]=4 69 B19R2.57 COc1ccc(cc1)NCCNc2ccccc2 Amb20139082 [0,1,0,0,0,0|3,0,0]=4 70 B19R2.57 COc1ccc(cc1)OCCNc2ccccc2 Amb17307110 [0,1,0,0,0,0|3,0,0]=4 71 B19R2.57 COc1ccc(cc1)OCCOc2ccccc2 Amb20679519 [0,1,0,0,0,0|3,0,0]=4 72 B19R2.57 COc1ccc(cc1)\C=N\CCc2ccccc2 Amb2509899 [0,1,0,0,0,0|0,0,0]=1 73 B19R2.57 N#Cc1ccc(cc1)SCCCc2ccccc2 Amb21300599 [0,1,0,0,0,0|3,0,0]=4 74 B19R2.57 OCc1ccc(cc1)OCCCc2cccnc2 Amb17256566 [0,1,0,0,0,0|3,0,0]=4 75 B19R2.286 Cc1ccc(CCC(N)Cc2ccccc2)cc1 Amb23950710 [0,1,0,0,0,0|2,0,1]=4 76 B19R2.286 O=C(Cc1ccccc1)\C=C\c2ccc(cc2)C Amb2411914 [0,1,0,0,0,0|2,0,1]=4 77 B19R2.286 Oc1ccc(cc1)\C=C\C(=O)Sc2ccccc2 Amb20248360 [0,1,0,0,0,0|2,0,1]=4 78 B19R2.295 Brc1ccc(cc1)\C=N\N=C\c2ccc(cc2)Br Amb2223032 [0,1,0,0,0,0|2,0,1]=4 79 B19R2.295 Cc1ccc(CNCCc2ccc(N)cc2)cc1 Amb18050947 [0,1,0,0,0,0|1,0,2]=4 80 B19R2.295 Cc1ccc(CON=Cc2ccc(Cl)cc2)cc1 Amb20679280 [0,1,0,0,0,0|2,0,0]=3 81 B19R2.295 Cc1ccc(cc1)\C=N/C=C/c2ccc(cc2)Cl Amb10560655 [0,1,0,0,0,0|1,0,2]=4 82 B19R2.295 Clc1ccc(cc1)/C=N/OCc2ccc(Br)cc2 Amb17733962 [0,1,0,0,0,0|2,0,0]=3 83 B19R2.295 Clc1ccc(cc1)\C=N/C=C\c2ccc(cc2)Cl Amb10559944 [0,1,0,0,0,0|1,0,2]=4 84 B19R2.295 Fc1ccc(cc1)CCNCc2ccc(cc2)Cl Amb1559437 [0,1,0,0,0,0|1,0,2]=4 85 B19R2.295 Fc1ccc(cc1)CNCCc2ccc(cc2)F Amb1068535 [0,1,0,0,0,0|1,0,2]=4 86 B19R2.295 Fc1ccc(cc1)\C=N/C=C\c2ccc(cc2)F Amb10559945 [0,1,0,0,0,0|1,0,2]=4 87 B19R2.295 Fc1ccc(cc1)\C=N\N=C\c2ccc(cc2)F Amb1088917 [0,1,0,0,0,0|2,0,1]=4 88 B19R2.295 Nc1ccc(CCNCc2ccc(Cl)cc2)cc1 Amb18550367 [0,1,0,0,0,0|1,0,2]=4 89 B19R2.295 Nc1ccc(CCNCc2ccc(F)cc2)cc1 Amb18550354 [0,1,0,0,0,0|1,0,2]=4 90 B19R2.295 Oc1ccc(cc1)\C=N/N=C\c2ccc(cc2)O Amb16224731 [0,1,0,0,0,0|1,0,1]=3 91 B19R2.4201 Brc1ccc(cc1)C(=O)CCCc2ccccc2 Amb13891835 [0,1,0,0,0,0|2,0,0]=3 92 B19R2.4201 Brc1ccc(cc1)C(=O)NOCc2ccccc2 Amb10496516 [0,1,0,0,0,0|2,0,1]=4 93 B19R2.4201 CC(=NOCc1ccccc1)c2ccc(O)cc2 Amb22480602 [0,1,0,0,0,0|1,0,0]=2 94 B19R2.4201 C\C(=N\OCc1ccccc1)\c2ccc(N)cc2 Amb24765135 [0,1,0,0,0,0|2,0,0]=3 95 B19R2.4201 Cc1ccc(cc1)C(=NOCc2ccccc2)N Amb11246070 [0,1,0,0,0,0|2,0,0]=3 96 B19R2.4201 Cc1ccc(cc1)C(=O)NCCc2ccccc2 Amb2550596 [0,1,0,0,0,0|1,0,1]=3 97 B19R2.4201 Cc1ccc(cc1)C(=O)NCCc2ccncc2 Amb1083893 [0,1,0,0,0,0|2,0,1]=4 98 B19R2.4201 Cc1ccc(cc1)C(=O)NNCc2ccccc2 Amb24073611 [0,1,0,0,0,0|2,0,1]=4 99 B19R2.4201 Cc1ccc(cc1)C(=S)NCCc2ccccc2 Amb1078635 [0,1,0,0,0,0|1,0,1]=3 100 B19R2.4201 Clc1ccc(cc1)C(=O)NCCc2ccccc2 Amb2457812 [0,1,0,0,0,0|1,0,1]=3 101 B19R2.4201 Clc1ccc(cc1)C(=O)NCCc2ccncc2 Amb16207522 [0,1,0,0,0,0|2,0,1]=4 102 B19R2.4201 Clc1ccc(cc1)C(=O)NOCc2ccccc2 Amb1942150 [0,1,0,0,0,0|2,0,1]=4 103 B19R2.4201 Fc1ccc(cc1)C(=O)NCCc2ccccn2 Amb15702209 [0,1,0,0,0,0|2,0,1]=4 104 B19R2.4201 Fc1ccc(cc1)C(=O)NCCc2ccncc2 Amb1083894 [0,1,0,0,0,0|2,0,1]=4 105 B19R2.4201 Fc1ccc(cc1)C(=O)NOCc2ccccc2 Amb15957175 [0,1,0,0,0,0|2,0,1]=4 106 B19R2.4201 Ic1ccc(cc1)C(=O)NOCc2ccccc2 Amb10496519 [0,1,0,0,0,0|2,0,1]=4 107 B19R2.4201 Nc1ccc(cc1)C(=O)CNCc2ccccc2 Amb18550897 [0,1,0,0,0,0|3,0,0]=4 108 B19R2.4201 Nc1ccc(cc1)C(=O)OCCc2ccccc2 Amb10565274 [0,1,0,0,0,0|2,0,0]=3 109 B19R2.4201 O=C(COCc1ccccc1)c2ccc(F)cc2 Amb22059046 [0,1,0,0,0,0|3,0,0]=4 110 B19R2.4201 O=C1C=CC(=CN1)C(=O)NCCc2ccccc2 Amb19176357 [0,1,0,0,0,0|1,0,2]=4 111 B19R2.4201 O=C1C=CC(=CO1)C(=O)NCCc2ccccc2 Amb19776752 [0,1,0,0,0,0|1,0,2]=4 112 B19R2.4201 Oc1ccc(cc1)C(=O)NCCc2ccccc2 Amb1234468 [0,1,0,0,0,0|0,0,1]=2 113 B19R2.4201 Oc1ccc(cc1)C(=O)OCCc2ccccc2 Amb2104053 [0,1,0,0,0,0|1,0,0]=2 114 B19R2.4201 Oc1ccc(cc1)C(=S)NCCc2ccccc2 Amb2369572 [0,1,0,0,0,0|0,0,1]=2 115 B19R2.4201 [O-][n+]1ccc(cc1)C(=O)NCCc2ccccc2 Amb11214480 [0,1,0,0,0,0|1,0,2]=4 116 B19R2.4547 Cc1cc(N)ccc1OCCCc2ccccc2 Amb21954726 [0,1,0,0,0,0|3,0,0]=4 117 B19R2.4547 Cc1ccc(c(c1)N)NCCCc2ccccc2 Amb17617733 [0,1,0,0,0,0|3,0,0]=4 118 B19R2.4547 Cc1ccc(c(c1)N)OCCCc2ccccc2 Amb17159173 [0,1,0,0,0,0|3,0,0]=4 119 B19R2.4547 Clc1ccc(c(c1)Cl)CNCCc2ccccc2 Amb1846588 [0,1,0,0,0,0|1,0,2]=4 120 B19R2.4547 Nc1cc(Br)ccc1OCCCc2ccccc2 Amb20207052 [0,1,0,0,0,0|3,0,0]=4 121 B19R2.4547 Nc1cc(F)ccc1OCCCc2ccccc2 Amb21954548 [0,1,0,0,0,0|3,0,0]=4 122 B19R2.4547 Nc1cc(I)c(cc1)NCCCc2ccccc2 Amb24017819 [0,1,0,0,0,0|3,0,0]=4 123 B19R2.4547 Nc1cc(N)c(cc1)OCCCc2ccccc2 Amb20207211 [0,1,0,0,0,0|3,0,0]=4 124 B19R2.4547 Oc1cc(O)c(CNCCc2cc[n]cc2)cc1 Amb23919980 [0,1,0,0,0,0|1,0,2]=4 125 B19R2.11839 Cc1cc(ccc1N)NCCCc2ccccc2 Amb23920748 [0,1,0,0,0,0|3,0,0]=4 126 B19R2.11839 Nc1ccc(cc1Cl)OCCCc2ccccc2 Amb23943285 [0,1,0,0,0,0|3,0,0]=4 127 B19R2.11839 Nc1ccc(cc1N)OCCCc2ccccc2 Amb19962819 [0,1,0,0,0,0|3,0,0]=4 128 B19R2.11839 Oc1cc(CCNCc2ccccc2)ccc1O Amb22751344 [0,1,0,0,0,0|2,0,1]=4 129 B19R2.11839 Oc1ccc(cc1O)CNCCc2ccccc2 Amb1837639 [0,1,0,0,0,0|0,0,2]=3 130 B19R2.11850 Brc1ccc(cc1)C=NNC(=O)c2ccccc2 Amb13958760 [0,1,0,0,0,0|2,0,1]=4 131 B19R2.11850 Brc1ccc(cc1)CNCC(c2ccccc2)O Amb1931502 [0,1,0,0,0,0|1,0,2]=4 132 B19R2.11850 Brc1ccc(cc1)\C=N/NC(=O)c2ccccc2 Amb2465850 [0,1,0,0,0,0|2,0,1]=4 133 B19R2.11850 CC(CCNc1ccc(Cl)cc1)c2ccccc2 Amb23969362 [0,1,0,0,0,0|3,0,0]=4 134 B19R2.11850 Cc1ccc(cc1)CNCC(c2ccccc2)C Amb2119967 [0,1,0,0,0,0|1,0,2]=4 135 B19R2.11850 Cc1ccc(cc1)NCCC(C)c2ccccc2 Amb23969381 [0,1,0,0,0,0|3,0,0]=4 136 B19R2.11850 Cc1ccc(cc1)\C=N\CC(c2ccccc2)O Amb10808481 [0,1,0,0,0,0|1,0,0]=2 137 B19R2.11850 Cc1ccc(cc1)\C=N\CN(c2ccccc2)C Amb10558932 [0,1,0,0,0,0|2,0,0]=3 138 B19R2.11850 Cc1ccc(cc1)\C=N\NC(=O)c2ccccc2 Amb1419559 [0,1,0,0,0,0|2,0,1]=4 139 B19R2.11850 Clc1ccc(cc1)CNCC(c2ccccc2)O Amb13957609 [0,1,0,0,0,0|1,0,2]=4 140 B19R2.11850 Clc1ccc(cc1)\C=N\NC(=O)c2ccccc2 Amb1883961 [0,1,0,0,0,0|2,0,1]=4 141 B19R2.11850 Fc1ccc(cc1)CNCC(c2ccccc2)O Amb1930762 [0,1,0,0,0,0|1,0,2]=4 142 B19R2.11850 Fc1ccc(cc1)\C=N\CC(c2ccccc2)O Amb10797618 [0,1,0,0,0,0|1,0,0]=2 143 B19R2.11850 OC(CSCc1ccc(Cl)cc1)c2ccccc2 Amb23913081 [0,1,0,0,0,0|2,0,1]=4 144 B19R2.11850 OC(CSCc1ccc(F)cc1)c2ccccc2 Amb17925898 [0,1,0,0,0,0|2,0,1]=4 145 B19R2.11850 Oc1ccc(C=NNC(=O)c2cc[n]cc2)cc1 Amb24059316 [0,1,0,0,0,0|2,0,1]=4 146 B19R2.11850 Oc1ccc(cc1)\C=N/NC(=O)c2ccccn2 Amb2472120 [0,1,0,0,0,0|2,0,1]=4 147 B19R2.11850 Oc1ccc(cc1)\C=N\NC(=O)c2ccccc2 Amb1263433 [0,1,0,0,0,0|1,0,1]=3 148 B19R2.11850 Oc1ccc(cc1)\C=N\NC(=O)c2ccccn2 Amb1806485 [0,1,0,0,0,0|2,0,1]=4 149 B19R2.11854 Cc1cc(CCNCc2ccc(O)cc2)ccc1 Amb23947409 [0,1,0,0,0,0|0,0,2]=3 150 B19R2.11854 Cc1cc(CON=Cc2ccc(Cl)cc2)ccc1 Amb21758468 [0,1,0,0,0,0|2,0,0]=3 151 B19R2.11854 Cc1ccc(CNCCc2cc(C)ccc2)cc1 Amb23947410 [0,1,0,0,0,0|1,0,2]=4 152 B19R2.11854 Cc1ccc(CNCCc2cc(N)ccc2)cc1 Amb18550401 [0,1,0,0,0,0|1,0,2]=4 153 B19R2.11854 Clc1ccc(C=NOCc2cc(Br)ccc2)cc1 Amb21758362 [0,1,0,0,0,0|2,0,0]=3 154 B19R2.11854 Fc1ccc(C=NOCc2cc(Br)ccc2)cc1 Amb21213794 [0,1,0,0,0,0|2,0,0]=3 155 B19R2.11854 Fc1ccc(C=NOCc2cccc(F)c2)cc1 Amb20678948 [0,1,0,0,0,0|2,0,0]=3 156 B19R2.11854 Nc1cc(CCNCc2ccc(Cl)cc2)ccc1 Amb18051006 [0,1,0,0,0,0|1,0,2]=4 157 B19R2.11854 Nc1cc(CCNCc2ccc(F)cc2)ccc1 Amb18550400 [0,1,0,0,0,0|1,0,2]=4 158 B19R2.11857 CC(Cc1ccc(O)cc1)NCc2ccccc2 Amb25401853 [0,1,0,0,0,0|2,0,1]=4 159 B19R2.11857 CN(Cc1ccc(O)cc1)CCc2cccc[n]2 Amb24307814 [0,1,0,0,0,0|1,0,2]=4 160 B19R2.11857 CN(Cc1ccc(cc1)O)CCc2ccccc2 Amb11033537 [0,1,0,0,0,0|0,0,2]=3 161 B19R2.11857 NC(Cc1ccc(Cl)cc1)CCc2ccccc2 Amb23918202 [0,1,0,0,0,0|2,0,1]=4 162 B19R2.11857 O=C(Cc1ccc(cc1)C)CCc2ccccc2 Amb10564303 [0,1,0,0,0,0|2,0,1]=4 163 B19R2.11857 O=C(Nc1ccc(cc1)I)CCc2ccccc2 Amb1005639 [0,1,0,0,0,0|3,0,0]=4 164 B19R2.11857 O=C(Nc1ccc(cc1)N)CCc2ccccc2 Amb1131684 [0,1,0,0,0,0|3,0,0]=4 165 B19R2.11857 O=C(Nc1ccc(cc1)O)CCc2cccnc2 Amb17256021 [0,1,0,0,0,0|3,0,0]=4 166 B19R2.11857 O=C(Oc1ccc(cc1)Br)CCc2ccccc2 Amb2563148 [0,1,0,0,0,0|3,0,0]=4 167 B19R2.11857 O=C(Oc1ccc(cc1)F)CCc2ccccc2 Amb2563151 [0,1,0,0,0,0|3,0,0]=4 168 B19R2.11857 O=S(Cc1ccc(Cl)cc1)CCc2ccccc2 Amb20963036 [0,1,0,0,0,0|2,0,1]=4 169 B19R2.11857 OC(Cc1ccc(Cl)cc1)CCc2ccccc2 Amb23918152 [0,1,0,0,0,0|2,0,1]=4 170 B19R2.11857 Oc1ccc(CC(=O)NCc2ccccc2)cc1 Amb18664014 [0,1,0,0,0,0|2,0,1]=4 171 B19R2.11857 Oc1ccc(cc1)NC(=O)OCc2ccccc2 Amb22442573 [0,1,0,0,0,0|3,0,0]=4 172 B19R2.12311 Cc1ccc(cc1)NCCCc2ccccc2Cl Amb20077489 [0,1,0,0,0,0|3,0,0]=4 173 B19R2.12311 Clc1ccc(cc1)NCCCc2ccccc2Cl Amb20076616 [0,1,0,0,0,0|3,0,0]=4 174 B19R2.12311 Fc1ccc(C=NOCc2ccccc2F)cc1 Amb20678936 [0,1,0,0,0,0|2,0,0]=3 175 B19R2.12311 Fc1ccc(cc1)NCCCc2ccccc2Cl Amb20076870 [0,1,0,0,0,0|3,0,0]=4 176 B19R2.12311 Fc1ccccc1CON=Cc2ccc(Cl)cc2 Amb20679073 [0,1,0,0,0,0|2,0,0]=3 177 B19R3.421 Brc1ccc(cc1)-c2[n]ccc3ccccc32 Amb19929885 [0,0,0,1,0,0|1,0,2]=4 178 B19R3.421 Clc1ccc(cc1)-c2[n]ccc3ccccc32 Amb22433502 [0,0,0,1,0,0|1,0,2]=4 179 B19R3.421 Clc1ccc(cc1)C2OCCc3ccccc32 Amb24069204 [0,0,0,1,0,0|2,0,1]=4 180 B19R3.421 Fc1ccc(cc1)-c2[n]ccc3ccccc32 Amb24056076 [0,0,0,1,0,0|1,0,2]=4 181 B19R3.421 Fc1ccc(cc1)C2NCCc3ccccc32 Amb22395007 [0,0,0,1,0,0|1,0,2]=4 182 B19R3.421 Nc1ccc(cc1)C2OCCc3c2cccc3 Amb13951690 [0,0,0,1,0,0|2,0,1]=4 183 B19R3.421 Nc1ccc(cc1)N2CCCc3c2cccc3 Amb1130953 [0,0,0,1,0,0|3,0,0]=4 184 B19R3.421 Nc1ccc(cc1)c2nccc3c2cccc3 Amb17194052 [0,0,0,1,0,0|1,0,2]=4 185 B19R3.421 Oc1ccc(cc1)C2=NCCc3ccccc32 Amb22371670 [0,0,0,1,0,0|0,0,0]=1 186 B19R3.421 Oc1ccc(cc1)c2nccc3c2cccn3 Amb17656275 [0,0,0,1,0,0|1,0,2]=4 187 B19R3.434 Nc1ccc(cc1)CN2CCc3c2cccc3 Amb1128741 [0,0,0,1,0,0|1,0,2]=4 188 B19R3.434 Nc1ccc(cc1)OC2CCc3ccccc32 Amb22282171 [0,0,0,1,0,0|3,0,0]=4 189 B19R3.3821 Cc1ccc(cc1)C2=NC2Cc3ccccc3 Amb10571743 [0,0,0,1,0,0|1,0,0]=2 190 B19R3.3821 Clc1ccc(cc1)C2=NC2Cc3ccccc3 Amb10571740 [0,0,0,1,0,0|1,0,0]=2 191 B19R3.4066 Cc1cc2C(CCOc2cc1)c3ccccc3 Amb24081758 [0,0,0,1,0,0|3,0,0]=4 192 B19R3.4066 Cc1ccc2CNCC(c2c1)c3ccccc3 Amb22751936 [0,0,0,1,0,0|1,0,2]=4 193 B19R3.5866 Brc1cc2c(c[n][n]2Cc3ccccc3)cc1 Amb24067226 [0,0,0,1,0,0|2,0,0]=3 194 B19R3.5866 Brc1ccc2c(c1)n(cc2)Cc3ccccc3 Amb17134475 [0,0,0,1,0,0|3,0,0]=4 195 B19R3.5866 Fc1cc2c(cc[n]2Cc3ccccc3)cc1 Amb25112226 [0,0,0,1,0,0|3,0,0]=4 196 B19R3.5866 Nc1cc2c(c[n][n]2Oc3ccccc3)cc1 Amb24067137 [0,0,0,1,0,0|3,0,0]=4 197 B19R3.5866 Oc1cc2c(c[n][n]2Cc3ccccc3)cc1 Amb25026665 [0,0,0,1,0,0|1,0,0]=2 198 B19R3.13174 Brc1ccc(cc1)NCC2Cc3ccccc32 Amb24023494 [0,0,0,1,0,0|3,0,0]=4 199 B19R3.13174 Cc1ccc(cc1)NCC2Cc3ccccc32 Amb24023507 [0,0,0,1,0,0|3,0,0]=4 200 B19R3.13174 Clc1ccc(cc1)OCC2Cc3ccccc32 Amb24023808 [0,0,0,1,0,0|3,0,0]=4 201 B19R3.13174 Fc1ccc(cc1)NCC2Cc3ccccc32 Amb24023497 [0,0,0,1,0,0|3,0,0]=4 202 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb22587996 [0,0,0,0,1,0|1,0,2]=4 203 B17R2.216 Brc1ccc(COCc2ccccc2)cc1 Amb19301961 [0,0,0,0,1,0|2,0,1]=4 204 B17R2.216 Brc1ccc(cc1)\C=N\Nc2ccccc2 Amb1196496 [0,0,0,0,1,0|2,0,0]=3 205 B17R2.216 Cc1ccc(c[n]1)SCCc2ccccc2 Amb24084799 [0,0,0,0,1,0|3,0,0]=4 206 B17R2.216 Cc1ccc(cc1)N/N=C/c2ccccc2 Amb17866642 [0,0,0,0,1,0|2,0,1]=4 207 B17R2.216 Cc1ccc(cc1)N=NSc2ccccc2 Amb22482757 [0,0,0,0,1,0|3,0,0]=4 208 B17R2.216 Cc1ccc(cc1)N\N=N\c2ccccc2 Amb1867396 [0,0,0,0,1,0|3,0,0]=4 209 B17R2.216 Cc1ccc(cc1)SCCc2ccncc2 Amb1817799 [0,0,0,0,1,0|3,0,0]=4 210 B17R2.216 Clc1ccc(CCCc2cccc[n]2)cc1 Amb24080853 [0,0,0,0,1,0|2,0,1]=4 211 B17R2.216 Clc1ccc(CCNc2ccccc2)cc1 Amb20076438 [0,0,0,0,1,0|2,0,1]=4 212 B17R2.216 Clc1ccc(\C=N\Cc2ccccc2)cc1 Amb24074074 [0,0,0,0,1,0|1,0,0]=2 213 B17R2.216 Clc1ccc(cc1)N\N=C\c2ccccc2 Amb22339280 [0,0,0,0,1,0|2,0,1]=4 214 B17R2.216 Clc1ccc(cc1)\N=N\Nc2ccccc2 Amb22440813 [0,0,0,0,1,0|3,0,0]=4 215 B17R2.216 Fc1ccc(cc1)NCCc2ccccn2 Amb16226565 [0,0,0,0,1,0|2,0,1]=4 216 B17R2.216 Fc1ccc(cc1)SCCc2ccccn2 Amb1805494 [0,0,0,0,1,0|3,0,0]=4 217 B17R2.216 Fc1ccc(cc1)SCCc2ccncc2 Amb1790776 [0,0,0,0,1,0|3,0,0]=4 218 B17R2.216 Fc1ccc(cc1)SCSc2ccccc2 Amb1147742 [0,0,0,0,1,0|3,0,0]=4 219 B17R2.216 Ic1ccc(cc1)OCCc2ccccc2 Amb20669160 [0,0,0,0,1,0|2,0,0]=3 220 B17R2.216 Nc1ccc(C=NCc2ccccc2)cc1 Amb24065813 [0,0,0,0,1,0|1,0,0]=2 221 B17R2.216 Nc1ccc(CNCc2ccccc2)cc1 Amb19009749 [0,0,0,0,1,0|1,0,2]=4 222 B17R2.216 Nc1ccc(\C=N\Cc2ccccc2)cc1 Amb24613877 [0,0,0,0,1,0|1,0,0]=2 223 B17R2.216 Nc1ccc(cc1)CCCc2ccccc2 Amb13952637 [0,0,0,0,1,0|1,0,1]=3 224 B17R2.216 Nc1ccc(cc1)COCc2ccccc2 Amb1138750 [0,0,0,0,1,0|2,0,1]=4 225 B17R2.216 Nc1ccc(cc1)NCCc2ccccc2 Amb1103721 [0,0,0,0,1,0|1,0,1]=3 226 B17R2.216 Nc1ccc(cc1)OCCc2cc[n]cc2 Amb18303893 [0,0,0,0,1,0|3,0,0]=4 227 B17R2.216 Nc1ccc(cc1)OCCc2cccc[n]2 Amb22280487 [0,0,0,0,1,0|3,0,0]=4 228 B17R2.216 Nc1ccc(cc1)OCCc2ccccc2 Amb1112778 [0,0,0,0,1,0|2,0,0]=3 229 B17R2.216 Nc1ccc(cc1)OCCc2ccccn2 Amb1995311 [0,0,0,0,1,0|3,0,0]=4 230 B17R2.216 Nc1ccc(cc1)OCCc2cccnc2 Amb17241674 [0,0,0,0,1,0|3,0,0]=4 231 B17R2.216 Oc1c[n]c(CNCc2ccccc2)cc1 Amb25196623 [0,0,0,0,1,0|1,0,2]=4 232 B17R2.216 Oc1ccc(C=NCc2ccccc2)cc1 Amb24100982 [0,0,0,0,1,0|0,0,0]=1 233 B17R2.216 Oc1ccc(COCc2ccccc2)cc1 Amb25319925 [0,0,0,0,1,0|1,0,1]=3 234 B17R2.216 Oc1ccc(cc1)NCCc2ccccc2 Amb19374629 [0,0,0,0,1,0|0,0,1]=2 235 B17R2.216 Oc1ccc(cc1)\C=N\Nc2ccccc2 Amb1241185 [0,0,0,0,1,0|1,0,0]=2 236 B17R2.216 [O-][n+]1ccc(\C=N/Nc2ccccc2)cc1 Amb22364484 [0,0,0,0,1,0|2,0,1]=4 237 B17R2.216 [O-][n+]1ccc(cc1)NCCc2ccccc2 Amb22472032 [0,0,0,0,1,0|1,0,2]=4 238 B19R2.11855 Brc1ccc(cc1)CNCCOc2ccccc2 Amb17184797 [0,0,0,0,0,1|1,0,2]=4 239 B19R2.11855 Cc1ccc(cc1)CNCCOc2ccccc2 Amb17159117 [0,0,0,0,0,1|1,0,2]=4 240 B19R2.11855 Cc1ccc(cc1)NCCCOc2ccccc2 Amb17306872 [0,0,0,0,0,1|3,0,0]=4 241 B19R2.11855 Cc1ccc(cc1)NCCNCc2ccccc2 Amb20140124 [0,0,0,0,0,1|3,0,0]=4 242 B19R2.11855 Cc1ccc(cc1)OCCNCc2ccccc2 Amb17159119 [0,0,0,0,0,1|3,0,0]=4 243 B19R2.11855 Clc1ccc(cc1)NCCCOc2ccccc2 Amb17307240 [0,0,0,0,0,1|3,0,0]=4 244 B19R2.11855 Clc1ccc(cc1)NCCNCc2ccccc2 Amb20139241 [0,0,0,0,0,1|3,0,0]=4 245 B19R2.11855 Clc1ccc(cc1)OCCCOc2ccccc2 Amb23912535 [0,0,0,0,0,1|3,0,0]=4 246 B19R2.11855 Fc1ccc(cc1)CCNCCc2ccccc2 Amb2119728 [0,0,0,0,0,1|1,0,2]=4 247 B19R2.11855 Fc1ccc(cc1)NCCCOc2ccccc2 Amb17306183 [0,0,0,0,0,1|3,0,0]=4 248 B19R2.11855 Fc1ccc(cc1)NCCNCc2ccccc2 Amb20139520 [0,0,0,0,0,1|3,0,0]=4 249 B19R2.11855 Ic1ccc(cc1)OCCCOc2ccccc2 Amb23912537 [0,0,0,0,0,1|3,0,0]=4 250 B19R2.11855 Nc1ccc(CCNCCc2ccccc2)cc1 Amb18550350 [0,0,0,0,0,1|1,0,2]=4 251 B19R2.11855 Nc1ccc(cc1)CSCCCc2ccccc2 Amb17498293 [0,0,0,0,0,1|2,0,1]=4 252 B18R2.2429 CC(Cc1ccccc1)NCc2ccccc2 Amb17618657 [1,1,0,0,0,0|0,0,2]=4 253 B18R2.2429 CC(Cc1ccccc1)NCc2ccccc2 Amb1813683 [1,1,0,0,0,0|0,0,2]=4 254 B18R2.2429 CN(Cc1ccccc1)CCc2ccccc2 Amb24073593 [1,1,0,0,0,0|0,0,2]=4 255 B18R2.2429 CN(Cc1ccccc1)CCc2ccccc2 Amb24073635 [1,1,0,0,0,0|0,0,2]=4 256 B18R2.2429 C\C(=N/Nc1ccccc1)\Cc2ccccc2 Amb11012847 [1,1,0,0,0,0|1,0,1]=4 257 B18R2.2429 NC(Cc1ccccc1)CNc2ccccc2 Amb23927061 [1,1,0,0,0,0|2,0,0]=4 258 B18R2.2429 NC(Cc1ccccc1)CSc2ccccc2 Amb23997328 [1,1,0,0,0,0|2,0,0]=4 259 B18R2.2429 N\C(\Cc1ccccc1)=N\Cc2ccccc2 Amb23569056 [1,1,0,0,0,0|0,0,2]=4 260 B18R2.2429 O=C(Cc1ccccc1)CCc2ccccc2 Amb10572893 [1,1,0,0,0,0|1,0,1]=4 261 B18R2.2429 O=S(Cc1ccccc1)CCc2ccccc2 Amb20963037 [1,1,0,0,0,0|1,0,1]=4 262 B18R2.3984 Cc1ccccc1CCNCc2ccccc2 Amb20077544 [1,1,0,0,0,0|0,0,2]=4 263 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 Amb21972793 [1,1,0,0,0,0|0,0,2]=4 264 B18R2.3984 Cc1ccccc1OCCCc2ccccc2 Amb22266357 [1,1,0,0,0,0|2,0,0]=4 265 B18R2.3984 Clc1ccccc1CCCNc2ccccc2 Amb20076466 [1,1,0,0,0,0|2,0,0]=4 266 B18R2.3984 Clc1ccccc1CON=Cc2cccc[n]2 Amb22461611 [1,1,0,0,0,0|2,0,0]=4 267 B18R2.3984 Clc1ccccc1OCCCc2ccccc2 Amb22285380 [1,1,0,0,0,0|2,0,0]=4 268 B18R2.3984 Nc1ccccc1CCNCc2ccccc2 Amb25134012 [1,1,0,0,0,0|0,0,2]=4 269 B18R2.3984 Nc1ccccc1CCOCc2ccccc2 Amb24757356 [1,1,0,0,0,0|1,0,1]=4 270 B18R2.3984 Nc1ccccc1CNCCc2ccccc2 Amb18659529 [1,1,0,0,0,0|0,0,2]=4 271 B18R2.3984 Nc1ccccc1NCCCc2ccccc2 Amb19373177 [1,1,0,0,0,0|2,0,0]=4 272 B18R2.3984 Nc1ccccc1NC\C=C/c2ccccc2 Amb10606991 [1,1,0,0,0,0|2,0,0]=4 273 B18R2.3984 Nc1ccccc1NC\C=C\c2ccccc2 Amb10070125 [1,1,0,0,0,0|2,0,0]=4 274 B18R2.3984 Nc1ccccc1OCCCc2ccccc2 Amb2094487 [1,1,0,0,0,0|2,0,0]=4 275 B18R2.3984 Nc1ccccc1SC\C=C\c2ccccc2 Amb2430231 [1,1,0,0,0,0|2,0,0]=4 276 B18R2.3984 Oc1ccccc1CNCCc2ccccc2 Amb24080734 [1,1,0,0,0,0|0,0,2]=4 277 B18R2.6483 Cc1cc(ccc1)OCC=Cc2ccccc2 Amb22266342 [1,1,0,0,0,0|2,0,0]=4 278 B18R2.6483 Clc1cc(ccc1)OCCCc2ccccc2 Amb22285373 [1,1,0,0,0,0|2,0,0]=4 279 B18R2.6483 Clc1cccc(c1)CCNCc2ccccc2 Amb17159839 [1,1,0,0,0,0|0,0,2]=4 280 B18R2.6483 Ic1cc(COCCc2ccccc2)ccc1 Amb22753538 [1,1,0,0,0,0|1,0,1]=4 281 B18R2.6483 Nc1cc(CCNCc2ccccc2)ccc1 Amb18550386 [1,1,0,0,0,0|0,0,2]=4 282 B18R2.6483 Nc1cccc(c1)OCCCc2ccccc2 Amb2094488 [1,1,0,0,0,0|2,0,0]=4 283 B18R2.7189 C=C(CNCc1ccccc1)c2ccccc2 Amb25026829 [1,1,0,0,0,0|2,0,0]=4 284 B18R2.7189 CC(c1ccccc1)CNCc2ccccc2 Amb2119082 [1,1,0,0,0,0|0,0,2]=4 285 B18R2.7189 CC(c1ccccc1)NCCc2ccccc2 Amb2119243 [1,1,0,0,0,0|0,0,2]=4 286 B18R2.7189 CC(c1ccccc1)[NH2+]CCc2ccccc2 Amb10558680 [1,1,0,0,0,0|0,0,2]=4 287 B18R2.7189 CN(CCCc1ccccc1)c2ccccc2 Amb21540830 [1,1,0,0,0,0|2,0,0]=4 288 B18R2.7189 ClC(CNCc1ccccc1)c2ccccc2 Amb25026846 [1,1,0,0,0,0|0,0,2]=4 289 B18R2.7189 NC(=NOCc1ccccc1)c2ccccc2 Amb11212592 [1,1,0,0,0,0|1,0,0]=3 290 B18R2.7189 NC(CCNc1ccccc1)c2ccccc2 Amb23927062 [1,1,0,0,0,0|2,0,0]=4 291 B18R2.7189 NC(COCc1ccccc1)c2ccccc2 Amb19374866 [1,1,0,0,0,0|1,0,1]=4 292 B18R2.7189 NC(c1ccccc1)COCc2ccccc2 Amb1126312 [1,1,0,0,0,0|1,0,1]=4 293 B18R2.7189 N[C@@H](COCc1ccccc1)c2ccccc2 Amb18016675 [1,1,0,0,0,0|1,0,1]=4 294 B18R2.7189 N[C@@H](c1ccccc1)COCc2ccccc2 Amb17061720 [1,1,0,0,0,0|1,0,1]=4 295 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 Amb21984386 [1,1,0,0,0,0|2,0,0]=4 296 B18R2.7189 O=C(COCc1ccccc1)c2ccccc2 Amb21928125 [1,1,0,0,0,0|2,0,0]=4 297 B18R2.7189 O=C(NNCc1ccccc1)c2ccccc2 Amb22485056 [1,1,0,0,0,0|1,0,1]=4 298 B18R2.7189 O=C(OCCc1ccccc1)c2c[n]ccc2 Amb24081249 [1,1,0,0,0,0|2,0,0]=4 299 B18R2.7189 O=C(c1ccccc1)CCCc2ccccc2 Amb1548163 [1,1,0,0,0,0|1,0,0]=3 300 B18R2.7189 O=C(c1ccccc1)C\C=C\c2ccccc2 Amb10567882 [1,1,0,0,0,0|1,0,1]=4 301 B18R2.7189 O=C(c1ccccc1)NCCc2ccncc2 Amb16207531 [1,1,0,0,0,0|1,0,1]=4 302 B18R2.7189 O=C(c1ccccc1)NCSc2ccccc2 Amb10559218 [1,1,0,0,0,0|1,0,1]=4 303 B18R2.7189 O=C(c1ccccc1)NOCc2ccccc2 Amb10426334 [1,1,0,0,0,0|1,0,1]=4 304 B18R2.7189 O=C(c1ccccc1)N\N=C\c2ccccc2 Amb1883960 [1,1,0,0,0,0|1,0,1]=4 305 B18R2.7189 O=C(c1ccccn1)NCCc2ccccc2 Amb2312006 [1,1,0,0,0,0|1,0,1]=4 306 B18R2.7189 OC(CCSc1ccccc1)c2ccccc2 Amb21984422 [1,1,0,0,0,0|2,0,0]=4 307 B18R2.7189 OC(COCc1ccccc1)c2ccccc2 Amb25779451 [1,1,0,0,0,0|1,0,1]=4 308 B18R2.7189 OC(c1ccccc1)CCCc2ccccc2 Amb2385846 [1,1,0,0,0,0|1,0,1]=4 309 B18R2.7189 O[C@@H](CNCc1ccccc1)c2ccccc2 Amb20240841 [1,1,0,0,0,0|0,0,2]=4 310 B18R2.7189 S=C(c1ccccc1)NCCc2ccccc2 Amb1076816 [1,1,0,0,0,0|0,0,1]=3 311 B18R2.61 CNc1ccc(cc1)OCCc2ccccc2 Amb20138951 [0,1,0,0,1,0|2,0,0]=4 312 B18R2.61 COc1ccc(\C=N\Cc2ccccc2)cc1 Amb22641102 [0,1,0,0,1,0|0,0,0]=2 313 B18R2.61 COc1ccc(cc1)N=NSc2ccccc2 Amb22448010 [0,1,0,0,1,0|2,0,0]=4 314 B18R2.61 COc1ccc(cc1)NCCc2cccc[n]2 Amb21955201 [0,1,0,0,1,0|1,0,1]=4 315 B18R2.61 COc1ccc(cc1)\C=N\Nc2ccccc2 Amb2496481 [0,1,0,0,1,0|1,0,0]=3 316 B18R2.61 N#Cc1ccc(\C=N\Nc2ccccc2)cc1 Amb22347332 [0,1,0,0,1,0|2,0,0]=4 317 B18R2.61 NCc1ccc(cc1)OCCc2ccccc2 Amb1112697 [0,1,0,0,1,0|2,0,0]=4 318 B18R2.61 NCc1ccc(cc1)OCCc2ccccc2 Amb17603139 [0,1,0,0,1,0|2,0,0]=4 319 B18R2.61 O=Cc1ccc(\C=N\Nc2ccccc2)cc1 Amb22347691 [0,1,0,0,1,0|1,0,1]=4 320 B18R2.253 Brc1ccc(cc1)C(=O)CNc2ccccc2 Amb17378024 [0,1,0,0,1,0|2,0,0]=4 321 B18R2.253 CC(=NNc1ccccc1)c2ccc(Cl)cc2 Amb24064391 [0,1,0,0,1,0|2,0,0]=4 322 B18R2.253 C\C(=N/Nc1ccccc1)\c2ccc(Br)cc2 Amb24185139 [0,1,0,0,1,0|2,0,0]=4 323 B18R2.253 Cc1ccc(cc1)C(=O)CNc2ccccc2 Amb2309092 [0,1,0,0,1,0|2,0,0]=4 324 B18R2.253 Cc1ccc(cc1)C(=O)OCc2ccccc2 Amb17883903 [0,1,0,0,1,0|2,0,0]=4 325 B18R2.253 Cc1ccc(cc1)\C(\Cl)=N\Nc2ccccc2 Amb24277034 [0,1,0,0,1,0|2,0,0]=4 326 B18R2.253 Clc1ccc(cc1)C(=O)COc2ccccc2 Amb2418787 [0,1,0,0,1,0|2,0,0]=4 327 B18R2.253 Fc1ccc(cc1)C(=O)CNc2ccccc2 Amb17344272 [0,1,0,0,1,0|2,0,0]=4 328 B18R2.253 Fc1ccc(cc1)C(=O)CSc2ccccc2 Amb1542298 [0,1,0,0,1,0|2,0,0]=4 329 B18R2.253 Ic1ccc(cc1)C(=O)NCc2ccccc2 Amb1220012 [0,1,0,0,1,0|1,0,1]=4 330 B18R2.253 Nc1ccc(cc1)C(=O)CSc2ccccc2 Amb17202016 [0,1,0,0,1,0|2,0,0]=4 331 B18R2.253 Nc1ccc(cc1)C(=S)NCc2ccccc2 Amb25024958 [0,1,0,0,1,0|1,0,1]=4 332 B18R2.253 O=C(NCc1ccccc1)c2ccc(S)cc2 Amb25745499 [0,1,0,0,1,0|0,1,1]=4 333 B18R2.253 OC(CCc1ccccc1)c2ccc(Cl)cc2 Amb24064380 [0,1,0,0,1,0|1,0,1]=4 334 B18R2.253 Oc1ccc(cc1)B(O)OCc2ccccc2 Amb22229783 [0,1,0,0,1,0|2,0,0]=4 335 B18R2.253 Oc1ccc(cc1)C(=O)CCc2ccccc2 Amb17596209 [0,1,0,0,1,0|0,0,0]=2 336 B18R2.253 Oc1ccc(cc1)C(=O)NCc2ccccc2 Amb1233844 [0,1,0,0,1,0|0,0,1]=3 337 B18R2.253 Oc1ccc(cc1)C(=O)OCc2ccccc2 Amb1229294 [0,1,0,0,1,0|1,0,0]=3 338 B18R2.253 Oc1ccc(cc1)C(=O)\C=C\c2ccccc2 Amb1555158 [0,1,0,0,1,0|0,0,2]=4 339 B18R2.257 Brc1ccc(cc1)NCC(c2ccccc2)O Amb15695374 [0,1,0,0,1,0|1,0,1]=4 340 B18R2.257 Brc1ccc(cc1)\C=N\C(c2ccccc2)C Amb1196478 [0,1,0,0,1,0|1,0,0]=3 341 B18R2.257 Cc1ccc(CCC(O)c2ccccc2)cc1 Amb23936573 [0,1,0,0,1,0|1,0,1]=4 342 B18R2.257 Cc1ccc(\C=N\C(=O)c2ccccc2)cc1 Amb22366647 [0,1,0,0,1,0|1,0,1]=4 343 B18R2.257 Cc1ccc(cc1)NCC(c2ccccc2)O Amb17142323 [0,1,0,0,1,0|1,0,1]=4 344 B18R2.257 Cc1ccc(cc1)OCC(O)c2ccccc2 Amb23913762 [0,1,0,0,1,0|2,0,0]=4 345 B18R2.257 Cc1ccc(cc1)SCC(N)c2ccccc2 Amb21988446 [0,1,0,0,1,0|2,0,0]=4 346 B18R2.257 Cc1ccc(cc1)SCC(O)c2ccccc2 Amb21988443 [0,1,0,0,1,0|2,0,0]=4 347 B18R2.257 Clc1ccc(cc1)CCC(c2ccccc2)O Amb17507970 [0,1,0,0,1,0|1,0,1]=4 348 B18R2.257 Clc1ccc(cc1)NCC(c2ccccc2)O Amb17160255 [0,1,0,0,1,0|1,0,1]=4 349 B18R2.257 Fc1ccc(cc1)CCC(c2ccccc2)O Amb17507971 [0,1,0,0,1,0|1,0,1]=4 350 B18R2.257 Fc1ccc(cc1)NCC(c2ccccc2)O Amb17142720 [0,1,0,0,1,0|1,0,1]=4 351 B18R2.257 NC(CSc1ccc(Cl)cc1)c2ccccc2 Amb21988445 [0,1,0,0,1,0|2,0,0]=4 352 B18R2.257 OC(CCc1ccc(Br)cc1)c2ccccc2 Amb23936576 [0,1,0,0,1,0|1,0,1]=4 353 B18R2.257 OC(CSc1ccc(Cl)cc1)c2ccccc2 Amb21988444 [0,1,0,0,1,0|2,0,0]=4 354 B18R2.257 Oc1ccc(cc1)\C=C\C(=O)c2ccccc2 Amb1583085 [0,1,0,0,1,0|0,0,2]=4 355 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)O Amb11033452 [0,1,0,0,1,0|0,0,2]=4 356 B18R2.266 NC(Cc1ccc(F)cc1)Cc2ccccc2 Amb20249351 [0,1,0,0,1,0|1,0,1]=4 357 B18R2.266 O=C(Cc1ccccc1)Nc2ccc(cc2)O Amb2542089 [0,1,0,0,1,0|0,0,2]=4 358 B18R2.269 Brc1ccc(cc1)\C=N\Nc2cccc(c2)Cl Amb1639597 [0,1,0,0,1,0|2,0,0]=4 359 B18R2.269 Cc1ccc(cc1)CCCc2cccc(c2)N Amb13953219 [0,1,0,0,1,0|1,0,1]=4 360 B18R2.269 Clc1cc(CCNc2ccc(Cl)cc2)ccc1 Amb22494584 [0,1,0,0,1,0|1,0,1]=4 361 B18R2.269 Clc1ccc(cc1)NCCc2cccc(Br)c2 Amb22754228 [0,1,0,0,1,0|1,0,1]=4 362 B18R2.269 Fc1cc(CCNc2ccc(Cl)cc2)ccc1 Amb22754236 [0,1,0,0,1,0|1,0,1]=4 363 B18R2.269 Fc1cc(CCNc2ccc(F)cc2)ccc1 Amb22494583 [0,1,0,0,1,0|1,0,1]=4 364 B18R2.269 Fc1ccc(cc1)CCCc2cccc(c2)N Amb13953220 [0,1,0,0,1,0|1,0,1]=4 365 B18R2.269 Fc1ccc(cc1)NCCc2cccc(Br)c2 Amb22754235 [0,1,0,0,1,0|1,0,1]=4 366 B18R2.269 Fc1ccc(cc1)NCCc2cccc(Cl)c2 Amb22754227 [0,1,0,0,1,0|1,0,1]=4 367 B18R2.269 Nc1ccc(cc1)CCCc2cccc(c2)C Amb13953215 [0,1,0,0,1,0|1,0,1]=4 368 B18R2.269 Nc1ccc(cc1)CCCc2cccc(c2)F Amb13953213 [0,1,0,0,1,0|1,0,1]=4 369 B18R2.269 Nc1ccc(cc1)CCCc2cccc(c2)O Amb13953216 [0,1,0,0,1,0|1,0,1]=4 370 B18R2.269 Nc1ccc(cc1)OCCc2cccc(c2)C Amb17247782 [0,1,0,0,1,0|2,0,0]=4 371 B18R2.269 Nc1ccc(cc1)OCCc2cccc(c2)Cl Amb17259636 [0,1,0,0,1,0|2,0,0]=4 372 B18R2.269 Oc1cc(CCNc2ccc(Cl)cc2)ccc1 Amb22753981 [0,1,0,0,1,0|1,0,1]=4 373 B18R2.269 Oc1cc(CCNc2ccc(F)cc2)ccc1 Amb22754234 [0,1,0,0,1,0|1,0,1]=4 374 B18R2.269 Oc1ccc(cc1)CCCc2cccc(c2)N Amb13953218 [0,1,0,0,1,0|0,0,1]=3 375 B18R2.274 Cc1ccc(cc1)/C=N/Nc2ccc(Br)cc2 Amb17705087 [0,1,0,0,1,0|2,0,0]=4 376 B18R2.274 Cc1ccc(cc1)CCCc2ccc(cc2)N Amb13953211 [0,1,0,0,1,0|1,0,1]=4 377 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)N Amb17247784 [0,1,0,0,1,0|2,0,0]=4 378 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)O Amb2327720 [0,1,0,0,1,0|0,0,2]=4 379 B18R2.274 Cc1ccc(cc1)NCCc2ccc(Cl)cc2 Amb20077455 [0,1,0,0,1,0|1,0,1]=4 380 B18R2.274 Clc1ccc(cc1)NCCc2ccc(Cl)cc2 Amb18932690 [0,1,0,0,1,0|1,0,1]=4 381 B18R2.274 Fc1ccc(cc1)NCCc2ccc(Cl)cc2 Amb18269951 [0,1,0,0,1,0|1,0,1]=4 382 B18R2.274 Fc1ccc(cc1)N\N=C\c2ccc(cc2)F Amb2246179 [0,1,0,0,1,0|2,0,0]=4 383 B18R2.274 Nc1ccc(cc1)CCCc2ccc(cc2)F Amb13953212 [0,1,0,0,1,0|1,0,1]=4 384 B18R2.274 Nc1ccc(cc1)CCCc2ccc(cc2)O Amb13953210 [0,1,0,0,1,0|0,0,1]=3 385 B18R2.274 Nc1ccc(cc1)OCCc2ccc(cc2)Cl Amb17259638 [0,1,0,0,1,0|2,0,0]=4 386 B18R2.274 Nc1ccc(cc1)OCCc2ccc(cc2)F Amb17249416 [0,1,0,0,1,0|2,0,0]=4 387 B18R2.274 Oc1ccc(\C=N/Nc2ccc(Br)cc2)cc1 Amb20668737 [0,1,0,0,1,0|1,0,0]=3 388 B18R2.274 Oc1ccc(cc1)CCCc2ccc(cc2)O Amb17596273 [0,1,0,0,1,0|0,0,1]=3 389 B18R2.274 Oc1ccc(cc1)CNCc2ccc(cc2)O Amb17596288 [0,1,0,0,1,0|0,0,2]=4 390 B18R2.274 Oc1ccc(cc1)\C=N\Nc2ccc(cc2)Cl Amb2244774 [0,1,0,0,1,0|1,0,0]=3 391 B18R2.274 Oc1ccc(cc1)\C=N\Nc2ccc(cc2)F Amb2246192 [0,1,0,0,1,0|1,0,0]=3 392 B18R2.4060 Clc1ccc(/C=N/Cc2ccccc2)c(Cl)c1 Amb17862963 [0,1,0,0,1,0|1,0,0]=3 393 B18R2.4060 Nc1cc(I)c(cc1)NCCc2ccccc2 Amb24017821 [0,1,0,0,1,0|1,0,1]=4 394 B18R2.4060 Nc1cc(N)c(cc1)NCCc2ccccc2 Amb19962363 [0,1,0,0,1,0|1,0,1]=4 395 B18R2.4060 Nc1cc(N)c(cc1)OCCc2ccccc2 Amb20207209 [0,1,0,0,1,0|2,0,0]=4 396 B18R2.4060 Nc1ccc(c(c1)Cl)OCCc2ccccc2 Amb1135078 [0,1,0,0,1,0|2,0,0]=4 397 B18R2.4060 Oc1ccc(c(c1)O)\C=N\Nc2ccncc2 Amb10576908 [0,1,0,0,1,0|2,0,0]=4 398 B18R2.8976 Cc1cc(ccc1N)OCCc2ccccc2 Amb21954769 [0,1,0,0,1,0|2,0,0]=4 399 B18R2.8976 Cc1ccc(cc1N)CCCc2ccccc2 Amb13953226 [0,1,0,0,1,0|1,0,1]=4 400 B18R2.8976 Cc1ccc(cc1N)OCCc2ccccc2 Amb17142349 [0,1,0,0,1,0|2,0,0]=4 401 B18R2.8976 Clc1ccc(cc1Br)NCCc2ccccc2 Amb24044400 [0,1,0,0,1,0|1,0,1]=4 402 B18R2.8976 Clc1ccc(cc1N)OCCc2ccccc2 Amb17160270 [0,1,0,0,1,0|2,0,0]=4 403 B18R2.8976 Fc1ccc(cc1F)\C=N\Nc2ccccc2 Amb2244921 [0,1,0,0,1,0|2,0,0]=4 404 B18R2.8976 Nc1ccc(cc1C)OCCc2ccccc2 Amb1116183 [0,1,0,0,1,0|2,0,0]=4 405 B18R2.8976 Nc1ccc(cc1N)OCCc2ccccc2 Amb19962818 [0,1,0,0,1,0|2,0,0]=4 406 B18R2.8976 Oc1ccc(cc1Br)\C=N\Nc2ccccn2 Amb1214470 [0,1,0,0,1,0|2,0,0]=4 407 B18R2.9237 Cc1ccc(cc1)NCCc2ccccc2C Amb20077490 [0,1,0,0,1,0|1,0,1]=4 408 B18R2.9237 Cc1ccccc1CCNc2ccc(Cl)cc2 Amb20076617 [0,1,0,0,1,0|1,0,1]=4 409 B18R2.9237 Cc1ccccc1CCNc2ccc(F)cc2 Amb20076871 [0,1,0,0,1,0|1,0,1]=4 410 B18R2.9237 Nc1ccc(cc1)CCCc2ccccc2C Amb13953217 [0,1,0,0,1,0|1,0,1]=4 411 B18R2.9237 Nc1ccc(cc1)CCCc2ccccc2F Amb13953214 [0,1,0,0,1,0|1,0,1]=4 412 B18R2.9237 Nc1ccc(cc1)OCCc2ccccc2C Amb17247779 [0,1,0,0,1,0|2,0,0]=4 413 B18R2.9237 Nc1ccc(cc1)OCCc2ccccc2Cl Amb17259634 [0,1,0,0,1,0|2,0,0]=4 414 B18R2.9237 Nc1ccc(cc1)OCCc2ccccc2F Amb17249414 [0,1,0,0,1,0|2,0,0]=4 415 B18R2.9237 Nc1ccccc1CCOc2ccc(F)cc2 Amb23950095 [0,1,0,0,1,0|2,0,0]=4 416 B18R2.9237 Nc1ccccc1CCOc2ccc(I)cc2 Amb23950105 [0,1,0,0,1,0|2,0,0]=4 417 B18R2.9237 Oc1ccc(cc1)CNCc2ccccc2C Amb17142306 [0,1,0,0,1,0|0,0,2]=4 418 B18R2.9237 Oc1ccccc1CCOc2ccc(F)cc2 Amb24089986 [0,1,0,0,1,0|2,0,0]=4 419 B20R2.81 COc1ccc(CCCNCc2ccccc2)cc1 Amb25401529 [0,1,0,0,0,1|1,0,1]=4 420 B20R2.81 COc1ccc(CNCCNc2ccccc2)cc1 Amb20139144 [0,1,0,0,0,1|0,0,2]=4 421 B20R2.81 COc1ccc(CNCCSc2ccccc2)cc1 Amb25418889 [0,1,0,0,0,1|0,0,2]=4 422 B20R2.81 COc1ccc(cc1)CNCCOc2ccccc2 Amb17162628 [0,1,0,0,0,1|0,0,2]=4 423 B20R2.81 COc1ccc(cc1)NCCCOc2ccccc2 Amb17306109 [0,1,0,0,0,1|2,0,0]=4 424 B20R2.81 COc1ccc(cc1)NCCNCc2ccccc2 Amb20139636 [0,1,0,0,0,1|2,0,0]=4 425 B20R2.81 COc1ccc(cc1)OCCCNc2ccccc2 Amb17307118 [0,1,0,0,0,1|2,0,0]=4 426 B20R2.81 COc1ccc(cc1)OCCNCc2ccccc2 Amb10608674 [0,1,0,0,0,1|2,0,0]=4 427 B20R2.81 COc1ccc(cc1)OCCNCc2ccccc2 Amb22588043 [0,1,0,0,0,1|2,0,0]=4 428 B20R2.4449 CN(CCc1ccccc1)CCc2ccc(O)cc2 Amb22750799 [0,1,0,0,0,1|0,0,2]=4 429 B20R2.15229 CN(Cc1ccccc1)CCCc2ccc(cc2)O Amb17511306 [0,1,0,0,0,1|1,0,1]=4 430 B20R2.15229 O=C(C[n+]1ccccc1)N\N=C\c2ccc(cc2)O Amb2230471 [0,1,0,0,0,1|1,0,1]=4 431 B20R2.15229 O=C(C[n+]1ccccc1)N\N=C\c2ccc(cc2)O Amb2546712 [0,1,0,0,0,1|1,0,1]=4 432 B20R2.15229 O=C(Cc1ccccc1)N\N=C\c2ccc(cc2)Br Amb1011779 [0,1,0,0,0,1|1,0,1]=4 433 B20R2.15229 O=C(Cc1ccccc1)N\N=C\c2ccc(cc2)C Amb1263400 [0,1,0,0,0,1|1,0,1]=4 434 B20R2.15229 O=C(Cc1ccccc1)N\N=C\c2ccc(cc2)Cl Amb1789998 [0,1,0,0,0,1|1,0,1]=4 435 B20R2.15229 O=C(Cc1ccccc1)N\N=C\c2ccc(cc2)F Amb1840124 [0,1,0,0,0,1|1,0,1]=4 436 B20R2.15229 O=C(Cc1ccccc1)N\N=C\c2ccc(cc2)O Amb1802737 [0,1,0,0,0,1|0,0,1]=3 437 B20R2.15229 Oc1ccc(\C=N/NC(=O)Nc2ccccc2)cc1 Amb23225828 [0,1,0,0,0,1|1,0,1]=4 438 B20R2.15229 Oc1ccc(\C=N/NC(=S)Nc2ccccc2)cc1 Amb23225843 [0,1,0,0,0,1|1,0,1]=4 439 B20R2.15232 Cc1ccc(cc1)\C=C\C\N=C\c2ccc(cc2)C Amb10560258 [0,1,0,0,0,1|1,0,1]=4 440 B20R2.15232 Nc1ccc(CCNCCc2ccc(O)cc2)cc1 Amb18550346 [0,1,0,0,0,1|0,0,2]=4 441 B20R2.15236 Nc1cc(CCNCCc2ccc(O)cc2)ccc1 Amb18550378 [0,1,0,0,0,1|0,0,2]=4 442 B20R2.15240 Oc1ccc(CCNCC(O)c2ccccc2)cc1 Amb18604500 [0,1,0,0,0,1|0,0,2]=4 443 B20R2.15829 Cc1ccc(cc1)N\C(=N/OCc2ccccc2)\C Amb10574296 [0,1,0,0,0,1|2,0,0]=4 444 B20R2.15829 O=C(Cc1ccc(Cl)cc1)CCCc2ccccc2 Amb19514772 [0,1,0,0,0,1|2,0,0]=4 445 B20R2.15829 O=C(Cc1ccc(cc1)F)NCCc2ccccc2 Amb1233551 [0,1,0,0,0,1|1,0,1]=4 446 B20R2.15829 O=C(Cc1ccc(cc1)N)NCCc2ccccc2 Amb1131536 [0,1,0,0,0,1|1,0,1]=4 447 B20R2.15829 O=C(Nc1ccc(Cl)cc1)OCCc2ccccc2 Amb22463627 [0,1,0,0,0,1|2,0,0]=4 448 B20R2.15829 O=C(Nc1ccc(cc1)C)NCCc2ccccc2 Amb2303916 [0,1,0,0,0,1|1,0,1]=4 449 B20R2.15829 O=C(Nc1ccc(cc1)F)CCCc2ccccc2 Amb1882963 [0,1,0,0,0,1|2,0,0]=4 450 B20R2.15829 Oc1ccc(cc1)NC(=O)COCc2ccccc2 Amb22233386 [0,1,0,0,0,1|2,0,0]=4 451 B20R2.15829 S=C(Nc1ccc(cc1)Br)NCCc2ccccc2 Amb1807778 [0,1,0,0,0,1|1,0,1]=4 452 B20R2.15829 S=C(Nc1ccc(cc1)C)NCCc2ccccc2 Amb1827861 [0,1,0,0,0,1|1,0,1]=4 453 B20R2.16036 Brc1ccc(cc1)C(=O)NCCOc2ccccc2 Amb2100321 [0,1,0,0,0,1|1,0,1]=4 454 B20R2.16036 Clc1ccc(cc1)C(=O)NCCOc2ccccc2 Amb10922426 [0,1,0,0,0,1|1,0,1]=4 455 B20R2.16036 Fc1ccc(cc1)C(=O)NCCSc2ccccc2 Amb244947 [0,1,0,0,0,1|1,0,1]=4 456 B20R2.16036 Ic1ccc(cc1)C(=O)NCCOc2ccccc2 Amb10922443 [0,1,0,0,0,1|1,0,1]=4 457 B20R2.16036 Nc1ccc(cc1)C(=O)CNCCc2ccccc2 Amb18051496 [0,1,0,0,0,1|1,0,1]=4 458 B20R2.16036 Nc1ccc(cc1)C(=O)OCCCc2ccccc2 Amb17307660 [0,1,0,0,0,1|2,0,0]=4 459 B20R2.16036 Nc1ccc(cc1)C(=O)OCCOc2ccccc2 Amb17307659 [0,1,0,0,0,1|2,0,0]=4 460 B20R2.16036 O=C(NCCSc1ccccc1)c2ccc(Cl)cc2 Amb21625011 [0,1,0,0,0,1|1,0,1]=4 461 B20R2.16036 Oc1ccc(cc1)C(=O)OCC=Cc2ccccc2 Amb13954040 [0,1,0,0,0,1|1,0,1]=4 462 B20R2.16036 Oc1ccc(cc1)C(=O)OCCCc2ccccc2 Amb2098772 [0,1,0,0,0,1|1,0,0]=3 463 B20R2.16036 Oc1ccc(cc1)C(=O)\C=C\CCc2ccccc2 Amb22173712 [0,1,0,0,0,1|1,0,0]=3 464 B20R2.47 COc1ccc(CNCCc2ccc(Cl)cc2)cc1 Amb22587952 [0,2,0,0,0,0|0,0,2]=4 465 B20R2.47 COc1ccc(CNCCc2ccc(F)cc2)cc1 Amb21953862 [0,2,0,0,0,0|0,0,2]=4 466 B20R2.47 COc1ccc(CNCCc2ccc(N)cc2)cc1 Amb18550353 [0,2,0,0,0,0|0,0,2]=4 467 B20R2.47 COc1ccc(cc1)CNCCc2ccc(cc2)F Amb1222980 [0,2,0,0,0,0|0,0,2]=4 468 B20R2.47 COc1ccc(cc1)\C=N\N=C\c2ccc(cc2)C Amb10574829 [0,2,0,0,0,0|1,0,1]=4 469 B20R2.47 OCc1ccc(cc1)OCCCc2ccc(cc2)C Amb17265138 [0,2,0,0,0,0|2,0,0]=4 470 B20R2.47 OCc1ccc(cc1)OCCCc2ccc(cc2)F Amb17267618 [0,2,0,0,0,0|2,0,0]=4 471 B20R2.79 COc1ccc(cc1)CNC(Cc2ccccc2)C Amb1808449 [0,2,0,0,0,0|0,0,2]=4 472 B20R2.79 COc1ccc(cc1)\C=C\C(=O)Cc2ccccc2 Amb22583962 [0,2,0,0,0,0|1,0,1]=4 473 B20R2.80 COc1ccc(CNCCc2cc(N)ccc2)cc1 Amb18550399 [0,2,0,0,0,0|0,0,2]=4 474 B20R2.80 COc1ccc(cc1)CNCCc2cccc(c2)F Amb1845974 [0,2,0,0,0,0|0,0,2]=4 475 B20R2.80 OCc1ccc(cc1)OCCCc2cccc(c2)C Amb17265135 [0,2,0,0,0,0|2,0,0]=4 476 B20R2.91 COc1ccc(cc1)CNCC(c2ccccc2)C Amb2119984 [0,2,0,0,0,0|0,0,2]=4 477 B20R2.116 COc1ccc(cc1)CN(CCc2ccccc2)C Amb10815418 [0,2,0,0,0,0|0,0,2]=4 478 B20R2.130 BrCc1ccc(cc1)C(=O)NCCc2ccccc2 Amb17332735 [0,2,0,0,0,0|1,0,1]=4 479 B20R2.130 CCc1ccc(cc1)C(=O)NCCc2ccccc2 Amb2135173 [0,2,0,0,0,0|1,0,1]=4 480 B20R2.130 CClc1ccc(cc1)C(=O)NCCc2ccccc2 Amb22045058 [0,2,0,0,0,0|1,0,1]=4 481 B20R2.130 COc1ccc(c[n]1)C(=O)OCCc2ccccc2 Amb21548440 [0,2,0,0,0,0|2,0,0]=4 482 B20R2.130 COc1ccc(cc1)C(=O)CCOc2ccccc2 Amb17265032 [0,2,0,0,0,0|2,0,0]=4 483 B20R2.130 COc1ccc(cc1)C(=O)NCCc2ccc[n]c2 Amb21447153 [0,2,0,0,0,0|1,0,1]=4 484 B20R2.130 COc1ccc(cc1)C(=O)NOCc2ccccc2 Amb10569698 [0,2,0,0,0,0|1,0,1]=4 485 B20R2.130 COc1ccc(cc1)C(=S)NCCc2ccccc2 Amb1076841 [0,2,0,0,0,0|0,0,1]=3 486 B20R2.130 COc1ccc(cn1)C(=O)NCCc2ccccc2 Amb16036925 [0,2,0,0,0,0|1,0,1]=4 487 B20R2.130 NCc1ccc(cc1)C(=O)NCCc2ccccc2 Amb1140385 [0,2,0,0,0,0|1,0,1]=4 488 B20R2.130 OCc1ccc(cc1)C(=O)NCCc2ccccc2 Amb22289341 [0,2,0,0,0,0|0,0,1]=3 489 B20R2.4584 OCCc1ccc(\C=N\OCc2ccccc2)cc1 Amb22456589 [0,2,0,0,0,0|1,0,0]=3 490 B20R2.5793 COc1ccc(cc1)CNCCc2ccccc2F Amb1803048 [0,2,0,0,0,0|0,0,2]=4 491 B20R2.5793 COc1ccc(cc1)NCCCc2ccccc2Cl Amb20077004 [0,2,0,0,0,0|2,0,0]=4 492 B20R2.5793 OCc1ccc(cc1)OCCCc2ccccc2C Amb17265132 [0,2,0,0,0,0|2,0,0]=4 493 B20R2.5793 OCc1ccc(cc1)OCCCc2ccccc2F Amb17267615 [0,2,0,0,0,0|2,0,0]=4 494 B20R2.10595 OC(=O)c1ccc(cc1)CNCCc2ccccc2 Amb2119309 [0,2,0,0,0,0|0,0,2]=4 495 B20R2.10595 [O-][N+](=O)c1ccc(cc1)\C=N\NCc2ccccc2 Amb1007057 [0,2,0,0,0,0|1,0,1]=4 496 B20R2.41159 COc1ccc(cc1Cl)CNCCc2ccccc2 Amb10590909 [0,2,0,0,0,0|0,0,2]=4 497 B20R2.286 O=C(Nc1ccc(cc1)O)CCc2ccc(cc2)C Amb17264448 [0,2,0,0,0,0|2,0,0]=4 498 B20R2.286 O=C(Nc1ccc(cc1)O)CCc2ccc(cc2)Cl Amb15645139 [0,2,0,0,0,0|2,0,0]=4 499 B20R2.286 O=C(Nc1ccc(cc1)O)CCc2ccc(cc2)F Amb17266919 [0,2,0,0,0,0|2,0,0]=4 500 B20R2.4444 CC(NC(=O)c1ccc(cc1)Cl)Cc2ccccc2 Amb1800626 [0,2,0,0,0,0|1,0,1]=4 501 B20R2.4444 CC(NC(=O)c1ccc(cc1)I)Cc2ccccc2 Amb2228756 [0,2,0,0,0,0|1,0,1]=4 502 B20R2.15224 Cc1ccc(cc1)C(=O)NCCc2ccc(cc2)N Amb17161938 [0,2,0,0,0,0|1,0,1]=4 503 B20R2.15224 Cc1ccc(cc1)CON=C(c2ccc(cc2)F)N Amb11246024 [0,2,0,0,0,0|2,0,0]=4 504 B20R2.15224 Clc1ccc(cc1)CCNC(=O)c2ccc(cc2)Cl Amb148165 [0,2,0,0,0,0|1,0,1]=4 505 B20R2.15224 Clc1ccc(cc1)CCNC(=O)c2ccc(nc2)O Amb2300101 [0,2,0,0,0,0|1,0,1]=4 506 B20R2.15224 Fc1ccc(cc1)C(=NOCc2ccc(cc2)Cl)N Amb11246009 [0,2,0,0,0,0|2,0,0]=4 507 B20R2.15224 Fc1ccc(cc1)CCNC(=O)c2ccc(cc2)F Amb1210589 [0,2,0,0,0,0|1,0,1]=4 508 B20R2.15224 Fc1ccc(cc1)CO\N=C(/c2ccc(cc2)F)\N Amb15973935 [0,2,0,0,0,0|2,0,0]=4 509 B20R2.15224 Nc1ccc(cc1)C(=O)NCCc2ccc(cc2)Cl Amb17050882 [0,2,0,0,0,0|1,0,1]=4 510 B20R2.15224 Nc1ccc(cc1)CCNC(=O)c2ccc(cc2)Cl Amb17168570 [0,2,0,0,0,0|1,0,1]=4 511 B20R2.15224 Nc1ccc(cc1)CCNC(=O)c2ccc(cc2)F Amb17162898 [0,2,0,0,0,0|1,0,1]=4 512 B20R2.15224 O=C(CCCc1ccc(Cl)cc1)c2ccc(Cl)cc2 Amb24065977 [0,2,0,0,0,0|2,0,0]=4 513 B20R2.15224 O=C(CCCc1ccc(F)cc1)c2ccc(F)cc2 Amb24066072 [0,2,0,0,0,0|2,0,0]=4 514 B20R2.15224 Oc1ccc(cc1)C(=O)CCSc2ccc(cc2)Br Amb2443532 [0,2,0,0,0,0|2,0,0]=4 515 B20R2.15224 Oc1ccc(cc1)\C=N\NC(=O)c2ccc(cc2)Cl Amb1899774 [0,2,0,0,0,0|1,0,1]=4 516 B20R2.15224 Oc1ccc(cc1)\C=N\NC(=O)c2ccc(cc2)F Amb1884712 [0,2,0,0,0,0|1,0,1]=4 517 B20R2.235921 Fc1cc(Br)ccc1CON=Cc2ccc(Cl)cc2 Amb20679081 [0,2,0,0,0,0|2,0,0]=4 518 B20R2.235921 Fc1ccc(C=NOCc2ccc(F)cc2Br)cc1 Amb21213674 [0,2,0,0,0,0|2,0,0]=4 519 B20R2.15226 Nc1ccc(cc1)C(=O)N(CCc2ccccc2)C Amb17263990 [0,2,0,0,0,0|1,0,1]=4 520 B20R2.15243 Cc1ccc(cc1)C(=O)NCC(c2ccccc2)C Amb10501001 [0,2,0,0,0,0|1,0,1]=4 521 B20R2.15243 Fc1ccc(cc1)C(=O)NCC(c2ccccc2)C Amb10500976 [0,2,0,0,0,0|1,0,1]=4 522 B20R2.15526 O=C(CCCc1ccccc1)c2cc(Cl)c(F)cc2 Amb23968644 [0,2,0,0,0,0|2,0,0]=4 523 B20R2.15526 O=C(c1ccc(c(c1)C)N)NCCc2ccccc2 Amb1133948 [0,2,0,0,0,0|1,0,1]=4 524 B20R2.15526 O=C(c1ccc(c(c1)C)N)OCCc2ccccc2 Amb17307853 [0,2,0,0,0,0|2,0,0]=4 525 B20R2.15526 O=C(c1ccc(c(c1)N)C)NCCc2ccccc2 Amb1138618 [0,2,0,0,0,0|1,0,1]=4 526 B20R2.15526 O=C(c1ccc(c(c1)N)C)OCCc2ccccc2 Amb17307873 [0,2,0,0,0,0|2,0,0]=4 527 B20R2.15526 O=C(c1ccc(c(c1)N)Cl)NCCc2ccccc2 Amb1126084 [0,2,0,0,0,0|1,0,1]=4 528 B20R2.15526 O=C(c1ccc(c(c1)N)Cl)OCCc2ccccc2 Amb17307814 [0,2,0,0,0,0|2,0,0]=4 529 B20R2.16035 Cc1cc(CCNC(=O)c2ccc(Br)cc2)ccc1 Amb23947508 [0,2,0,0,0,0|1,0,1]=4 530 B20R2.16035 Cc1ccc(cc1)C(=O)NCCc2cccc(c2)Cl Amb11229796 [0,2,0,0,0,0|1,0,1]=4 531 B20R2.16035 Fc1ccc(cc1)C(=NOCc2cccc(c2)Br)N Amb11273442 [0,2,0,0,0,0|2,0,0]=4 532 B20R2.16035 Fc1ccc(cc1)C(=NOCc2cccc(c2)Cl)N Amb11246014 [0,2,0,0,0,0|2,0,0]=4 533 B20R2.16035 Fc1ccc(cc1)C(=NOCc2cccc(c2)F)N Amb11246037 [0,2,0,0,0,0|2,0,0]=4 534 B20R2.16035 Nc1ccc(cc1)C(=O)NCCc2cccc(c2)Cl Amb17050892 [0,2,0,0,0,0|1,0,1]=4 535 B20R2.16035 O=C(NCCc1cccc(Cl)c1)c2ccc(I)cc2 Amb20702950 [0,2,0,0,0,0|1,0,1]=4 536 B20R2.16035 O=C(NCCc1cccc(F)c1)c2ccc(I)cc2 Amb20738633 [0,2,0,0,0,0|1,0,1]=4 537 B20R2.155984 Cc1cc(I)c(cc1)C(=O)NCCc2ccccc2 Amb23001205 [0,2,0,0,0,0|1,0,1]=4 538 B20R2.155984 Clc1ccc(c(c1)F)C(=O)NCCc2ccccc2 Amb15975752 [0,2,0,0,0,0|1,0,1]=4 539 B20R2.155984 Clc1ccc(c(c1)I)C(=O)NCCc2ccccc2 Amb10735077 [0,2,0,0,0,0|1,0,1]=4 540 B20R2.155984 Fc1ccc(c(c1)I)C(=O)NCCc2ccccc2 Amb10735111 [0,2,0,0,0,0|1,0,1]=4 541 B20R2.155984 Nc1ccc(c(c1)Cl)C(=O)NCCc2ccccc2 Amb1139164 [0,2,0,0,0,0|1,0,1]=4 542 B20R2.155984 Nc1ccc(c(c1)Cl)C(=O)OCCc2ccccc2 Amb17307796 [0,2,0,0,0,0|2,0,0]=4 543 B20R2.155984 O=C(OCCc1ccccc1)c2ccc(Br)cc2F Amb21537214 [0,2,0,0,0,0|2,0,0]=4 544 B20R2.23084 Cc1cc(C)c(C=NOCc2ccccc2)c(C)c1 Amb20636992 [0,2,0,0,0,0|2,0,0]=4 545 B20R2.2967 COc1cc(CNCCc2ccccc2)ccc1O Amb1049693 [0,2,0,0,0,0|0,0,2]=4 546 B20R2.2967 COc1cc(CNCCc2ccccc2)ccc1O Amb22283301 [0,2,0,0,0,0|0,0,2]=4 547 B20R2.15507 O=C(c1ccccc1)N\N=C\c2ccc(c(c2)Br)O Amb1774110 [0,2,0,0,0,0|1,0,1]=4 548 B20R2.15507 O=C(c1ccccc1)N\N=C\c2ccc(c(c2)I)O Amb1888761 [0,2,0,0,0,0|1,0,1]=4 549 B20R2.15228 Oc1ccc(cc1)C=NNC(=O)c2cccc(c2)Br Amb13961911 [0,2,0,0,0,0|1,0,1]=4 550 B20R2.15228 Oc1ccc(cc1)\C=N\NC(=O)c2cccc(c2)Br Amb1906405 [0,2,0,0,0,0|1,0,1]=4 551 B20R2.15228 Oc1ccc(cc1)\C=N\NC(=O)c2cccc(c2)O Amb1263204 [0,2,0,0,0,0|1,0,1]=4 552 B20R2.235908 Oc1ccc(cc1)\C=N\NC(=O)c2ccccc2Br Amb1895851 [0,2,0,0,0,0|1,0,1]=4 553 B20R2.235908 Oc1ccc(cc1)\C=N\NC(=O)c2ccccc2C Amb1672426 [0,2,0,0,0,0|1,0,1]=4 554 B20R2.235908 Oc1ccc(cc1)\C=N\NC(=O)c2ccccc2Cl Amb1263233 [0,2,0,0,0,0|1,0,1]=4 555 B20R2.235908 Oc1ccc(cc1)\C=N\NC(=O)c2ccccc2F Amb2252070 [0,2,0,0,0,0|1,0,1]=4 556 B20R2.235908 Oc1ccc(cc1)\C=N\NC(=O)c2ccccc2O Amb1628294 [0,2,0,0,0,0|1,0,1]=4 557 B20R2.15828 O=C(Nc1ccc(cc1)O)CCc2cccc(c2)C Amb17264446 [0,2,0,0,0,0|2,0,0]=4 558 B20R2.15828 O=C(Nc1ccc(cc1)O)CCc2cccc(c2)Cl Amb15645124 [0,2,0,0,0,0|2,0,0]=4 559 B20R2.239733 O=C(Nc1ccc(cc1)O)CCc2ccccc2C Amb17264444 [0,2,0,0,0,0|2,0,0]=4 560 B20R2.239733 O=C(Nc1ccc(cc1)O)CCc2ccccc2Cl Amb17278811 [0,2,0,0,0,0|2,0,0]=4 561 B20R2.239733 O=C(Nc1ccc(cc1)O)CCc2ccccc2F Amb15645593 [0,2,0,0,0,0|2,0,0]=4 562 B20R2.240440 Cc1ccc(\C=N\NCc2c(Cl)cccc2Cl)cc1 Amb20224423 [0,2,0,0,0,0|2,0,0]=4 563 B20R2.240440 Clc1ccc(\C=N\NCc2c(Cl)cccc2Cl)cc1 Amb20224400 [0,2,0,0,0,0|2,0,0]=4 564 B20R2.240440 Clc1cccc(Cl)c1CN\N=C\c2ccc(Br)cc2 Amb20224406 [0,2,0,0,0,0|2,0,0]=4 565 B20R2.240440 Clc1cccc(Cl)c1CN\N=C\c2ccc(I)cc2 Amb20224410 [0,2,0,0,0,0|2,0,0]=4 566 B20R2.240440 Fc1ccc(C=NOCc2c(Cl)cccc2F)cc1 Amb20678938 [0,2,0,0,0,0|2,0,0]=4 567 B20R2.240440 Fc1ccc(\C=N\NCc2c(Cl)cccc2Cl)cc1 Amb20224407 [0,2,0,0,0,0|2,0,0]=4 568 B20R2.240440 Oc1ccc(\C=N\NCc2c(Cl)cccc2Cl)cc1 Amb20224291 [0,2,0,0,0,0|1,0,0]=3 569 B18R2.4113 OC(=O)\C=C\c1cnn(c1)Cc2ccccc2 Amb1553962 [0,0,1,1,0,0|2,0,0]=4 570 B18R3.2098 C(c1[n]cc2cccc[n]21)c3ccccc3 Amb22723321 [1,0,0,1,0,0|1,0,1]=4 571 B18R3.2098 C(c1ccccc1)[n]2[n]cc3c[n]ccc23 Amb24064492 [1,0,0,1,0,0|2,0,0]=4 572 B18R3.2098 C/1Cc2ccc[n]c2\C1=C\c3ccccc3 Amb22170467 [1,0,0,1,0,0|2,0,0]=4 573 B18R3.2098 c1ccc(cc1)CC2CNc3c2cccc3 Amb17240364 [1,0,0,1,0,0|2,0,0]=4 574 B18R3.2098 c1ccc(cc1)CN2CCc3c2cccc3 Amb10610016 [1,0,0,1,0,0|0,0,2]=4 575 B18R3.2098 c1ccc(cc1)SC2CCc3c2cccc3 Amb10559917 [1,0,0,1,0,0|2,0,0]=4 576 B18R3.2098 c1ccc(cc1)[13CH2]n2nnc3c2cccc3 Amb10570594 [1,0,0,1,0,0|2,0,0]=4 577 B18R3.2108 C1CN[C@H](c2ccccc21)c3ccccc3 Amb19892402 [1,0,0,1,0,0|0,0,2]=4 578 B18R3.2108 C1CN[C@H](c2ccccc21)c3ccccc3 Amb20241852 [1,0,0,1,0,0|0,0,2]=4 579 B18R3.2108 c1ccc(cc1)C2=CCCc3c2cccc3 Amb15693427 [1,0,0,1,0,0|1,0,0]=3 580 B18R3.2108 c1ccc(cc1)C2NCCc3c2cccc3 Amb2567931 [1,0,0,1,0,0|0,0,2]=4 581 B18R3.2173 C1CCCc2ccccc2-c3ccccc31 Amb22356731 [1,0,0,1,0,0|1,0,1]=4 582 B18R3.48 Cc1ccc(cc1)C2CCc3c2cccc3 Amb10568306 [0,0,0,1,1,0|1,0,1]=4 583 B18R3.48 Clc1ccc(cc1)-c2[n]oc3ccccc32 Amb22751086 [0,0,0,1,1,0|2,0,0]=4 584 B18R3.48 Clc1ccc(cc1)c2n[nH]c3c2cccc3 Amb17229306 [0,0,0,1,1,0|2,0,0]=4 585 B18R3.48 Fc1ccc(cc1)N2CCc3ccccc23 Amb17967693 [0,0,0,1,1,0|1,0,1]=4 586 B18R3.48 Nc1ccc(cc1)N2CCc3c2cccc3 Amb1138826 [0,0,0,1,1,0|1,0,1]=4 587 B18R3.48 Oc1ccc(cc1)-c2[n][n]c3cccc[n]32 Amb21912609 [0,0,0,1,1,0|2,0,0]=4 588 B18R3.48 Oc1ccc(cc1)c2c[nH]c3c2cccc3 Amb17136868 [0,0,0,1,1,0|1,0,1]=4 589 B18R3.48 Oc1ccc(cc1)c2ncc3n2cccc3 Amb1132485 [0,0,0,1,1,0|1,0,1]=4 590 B18R3.2953 Fc1ccc(cc1)C2CC2c3ccccc3 Amb1776464 [0,0,0,1,1,0|1,0,1]=4 591 B18R3.2953 Oc1ccc(cc1)C2CC2c3ccccc3 Amb22752477 [0,0,0,1,1,0|0,0,1]=3 592 B18R3.4253 Nc1cc2c(c[n][n]2-c3ccccc3)cc1 Amb24067138 [0,0,0,1,1,0|2,0,0]=4 593 B20R3.150 Cc1ccc(cc1)C2=NNCC2c3ccccc3 Amb22371690 [0,0,0,1,0,1|1,0,0]=3 594 B20R3.150 Clc1ccc(cc1)C2=NNCC2c3ccccc3 Amb22355711 [0,0,0,1,0,1|1,0,0]=3 595 B20R3.150 Clc1ccc(cc1)N2N=CCC2c3ccccc3 Amb1815327 [0,0,0,1,0,1|2,0,0]=4 596 B20R3.150 Oc1ccc(cc1)c2cn[nH]c2c3ccccc3 Amb17137152 [0,0,0,1,0,1|1,0,1]=4 597 B20R3.153 Oc1ccc(CN2CCNc3ccccc23)cc1 Amb24045472 [0,0,0,1,0,1|0,0,2]=4 598 B20R3.20052 Clc1ccc(\C=N\C2CC2c3ccccc3)cc1 Amb22333940 [0,0,0,1,0,1|1,0,0]=3 599 B20R3.148628 Nc1cc2c(c[n][n]2OCc3ccccc3)cc1 Amb24067127 [0,0,0,1,0,1|2,0,0]=4 600 B20R3.209 COc1ccc(cc1)C2OCCc3ccccc32 Amb24068243 [0,1,0,1,0,0|1,0,1]=4 601 B20R3.209 OCc1ccc(cc1)C2NCCc3ccccc32 Amb25662003 [0,1,0,1,0,0|0,0,2]=4 602 B20R3.1330 C=Cc1cc2c(c[n][n]2Cc3ccccc3)cc1 Amb25745606 [0,1,0,1,0,0|2,0,0]=4 603 B20R3.408728 Clc1ccc(C=NC2Nc3ccccc3N2)cc1 Amb17779590 [0,1,0,1,0,0|2,0,0]=4 604 B20R3.19860 Cc1ccc(cc1)CC2N=C2c3ccc(cc3)C Amb10571744 [0,1,0,1,0,0|1,0,0]=3 605 B20R3.152 Cc1ccc(cc1)C2=NNC(S2)c3ccccc3 Amb10820033 [0,1,0,1,0,0|2,0,0]=4 606 B20R3.152 Clc1ccc(cc1)C=2CC(NN2)c3ccccc3 Amb22463217 [0,1,0,1,0,0|2,0,0]=4 607 B20R3.613 Ic1ccc(cc1)C(=O)N2CCc3c2cccc3 Amb1884865 [0,1,0,1,0,0|1,0,1]=4 608 B20R3.613 Nc1ccc(cc1)C(=O)N2CCc3c2cccc3 Amb1129837 [0,1,0,1,0,0|1,0,1]=4 609 B20R3.19396 Clc1ccc(cc1)C(=O)C2CC2c3ccccc3 Amb2422186 [0,1,0,1,0,0|2,0,0]=4 610 B20R3.19572 O=C(CC1Cc2ccccc21)c3ccc(Br)cc3 Amb24023650 [0,1,0,1,0,0|2,0,0]=4 611 B20R3.19572 O=C(CC1Cc2ccccc21)c3ccc(Cl)cc3 Amb24023652 [0,1,0,1,0,0|2,0,0]=4 612 B20R3.277437 Cc1[n][n](Cc2ccccc2)c3cc(O)ccc31 Amb25026714 [0,1,0,1,0,0|1,0,0]=3 613 B20R3.277437 Fc1cc2c(cc1)c(Br)[n][n]2Cc3ccccc3 Amb25164471 [0,1,0,1,0,0|2,0,0]=4 614 B20R3.277437 [NH3+]c1cc2c(cc1)c(Cl)[n][n]2Cc3ccccc3 Amb22452383 [0,1,0,1,0,0|2,0,0]=4 615 B20R3.94169 Oc1ccc2c(c1)nc(o2)CCc3ccccc3 Amb17479240 [0,1,0,1,0,0|2,0,0]=4 616 B20R3.94169 Oc1ccc2c(c1)oc(n2)CCc3ccccc3 Amb17479153 [0,1,0,1,0,0|2,0,0]=4 617 B20R3.119776 Fc1cc2c(c[n][n]2Cc3ccccc3)cc1I Amb25810233 [0,1,0,1,0,0|2,0,0]=4 618 B20R3.2753728 Oc1ccc(cc1)C2=NNC(=O)c3ccccc32 Amb19839280 [0,1,0,1,0,0|1,0,1]=4 619 B20R3.5840433 Nc1cc2CCC(=Cc3ccc(F)cc3)c2cc1 Amb24041364 [0,1,0,1,0,0|2,0,0]=4 620 B20R3.5840433 Nc1cc2CCC(=Cc3ccc(I)cc3)c2cc1 Amb24041424 [0,1,0,1,0,0|2,0,0]=4 621 B20R3.5840433 Oc1ccc(cc1)NC2CCc3cc(Br)ccc32 Amb23923963 [0,1,0,1,0,0|2,0,0]=4 622 B20R3.19923 Oc1ccc(cc1)NC(=O)C2Cc3ccccc32 Amb24023927 [0,1,0,1,0,0|2,0,0]=4 623 B16R2.2256 C(/C=C/c1ccccc1)c2ccccc2 Amb17779632 [1,0,0,0,1,0|0,0,1]=3 624 B16R2.2256 C(=N\Nc1ccccc1)\c2ccccc2 Amb19851492 [1,0,0,0,1,0|1,0,0]=3 625 B16R2.2256 C(CNc1ccccc1)c2ccccc2 Amb21953769 [1,0,0,0,1,0|0,0,1]=3 626 B16R2.2256 C(N=Cc1ccccc1)c2cccc[n]2 Amb22461122 [1,0,0,0,1,0|1,0,0]=3 627 B16R2.2256 C(NCc1ccccc1)c2ccccc2 Amb17743700 [1,0,0,0,1,0|0,0,2]=4 628 B16R2.2256 C(NCc1ccccc1)c2ccccc2 Amb22336232 [1,0,0,0,1,0|0,0,2]=4 629 B16R2.2256 C(NNc1ccccc1)c2ccccc2 Amb24064501 [1,0,0,0,1,0|1,0,1]=4 630 B16R2.2256 C(NNc1ccccc1)c2ccccc2 Amb24064502 [1,0,0,0,1,0|1,0,1]=4 631 B16R2.2256 C(Nc1ccccc1)Nc2ccccc2 Amb10559814 [1,0,0,0,1,0|1,0,1]=4 632 B16R2.2256 C(OCc1ccccc1)c2ccccc2 Amb22229519 [1,0,0,0,1,0|1,0,1]=4 633 B16R2.2256 C(Oc1ccccc1)Oc2ccccc2 Amb22230584 [1,0,0,0,1,0|2,0,0]=4 634 B16R2.2256 C([Se]Cc1ccccc1)c2ccccc2 Amb21950938 [1,0,0,0,1,0|1,0,1]=4 635 B16R2.2256 C([SiH2]Cc1ccccc1)c2ccccc2 Amb22347055 [1,0,0,0,1,0|0,1,1]=4 636 B16R2.2256 C(\Nc1ccccc1)=N\c2ccccc2 Amb22350571 [1,0,0,0,1,0|1,0,1]=4 637 B16R2.2256 c1ccc(cc1)CCC[n+]2ccccc2 Amb10571307 [1,0,0,0,1,0|1,0,1]=4 638 B16R2.2256 c1ccc(cc1)C[NH2+]Nc2ccccc2 Amb1787065 [1,0,0,0,1,0|1,0,1]=4 639 B16R2.2256 c1ccc(cc1)C\N=C\c2cccnc2 Amb10559477 [1,0,0,0,1,0|1,0,0]=3 640 B16R2.2256 c1ccc(cc1)NCCc2ccncc2 Amb10554585 [1,0,0,0,1,0|1,0,1]=4 641 B16R2.2256 c1ccc(cc1)SCCc2cc[nH+]cc2 Amb10554577 [1,0,0,0,1,0|2,0,0]=4 642 B16R2.2256 c1ccc(cc1)SCCc2ccncc2 Amb1781056 [1,0,0,0,1,0|2,0,0]=4 643 B16R2.2256 c1ccc(cc1)\C=N\Nc2ccccn2 Amb2224464 [1,0,0,0,1,0|2,0,0]=4 644 B16R2.2256 c1ccccc1N=C=Nc2ccccc2 Amb20621745 [1,0,0,0,1,0|1,0,1]=4 645 B16R2.2257 c1ccc(cc1)CC\N=C\c2ccco2 Amb10562391 [1,0,0,0,1,0|1,0,0]=3 646 B16R2.132 Brc1ccc(CCc2ccccc2)cc1 Amb22465238 [0,0,0,0,2,0|1,0,0]=3 647 B16R2.132 Brc1ccc(CSc2ccccc2)cc1 Amb22482416 [0,0,0,0,2,0|2,0,0]=4 648 B16R2.132 Brc1ccc(cc1)N=Nc2ccccc2 Amb21811992 [0,0,0,0,2,0|2,0,0]=4 649 B16R2.132 Brc1ccc(cc1)OCc2ccccc2 Amb2447239 [0,0,0,0,2,0|2,0,0]=4 650 B16R2.132 Brc1ccc(cc1)\C=N\c2ccccc2 Amb2227969 [0,0,0,0,2,0|1,0,0]=3 651 B16R2.132 Brc1ccc(cc1)\C=N\c2ccccn2 Amb2223098 [0,0,0,0,2,0|2,0,0]=4 652 B16R2.132 Brc1ccc(cc1)\N=N\c2ccccc2 Amb21949725 [0,0,0,0,2,0|2,0,0]=4 653 B16R2.132 Cc1ccc(cc1)C=Cc2ccccc2 Amb24323238 [0,0,0,0,2,0|1,0,1]=4 654 B16R2.132 Cc1ccc(cc1)CC[n+]2ccccc2 Amb10554470 [0,0,0,0,2,0|2,0,0]=4 655 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 Amb1651808 [0,0,0,0,2,0|1,0,1]=4 656 B16R2.132 Cc1ccc(cc1)\C=N\[n+]2ccccc2 Amb10554535 [0,0,0,0,2,0|2,0,0]=4 657 B16R2.132 Clc1ccc(cc1)N=Nc2ccccc2 Amb21811991 [0,0,0,0,2,0|2,0,0]=4 658 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 Amb10789579 [0,0,0,0,2,0|1,0,1]=4 659 B16R2.132 Clc1ccc(cc1)\C=C\c2ccccc2 Amb10568579 [0,0,0,0,2,0|1,0,1]=4 660 B16R2.132 Clc1ccc(cc1)\C=N\c2ccccc2 Amb2227970 [0,0,0,0,2,0|1,0,0]=3 661 B16R2.132 Clc1ccc(cc1)\N=C\c2ccccc2 Amb1652633 [0,0,0,0,2,0|1,0,1]=4 662 B16R2.132 Fc1ccc(C=Nc2cccc[n]2)cc1 Amb24058898 [0,0,0,0,2,0|2,0,0]=4 663 B16R2.132 Fc1ccc(CCc2ccccc2)cc1 Amb22489026 [0,0,0,0,2,0|1,0,0]=3 664 B16R2.132 Fc1ccc(cc1)N=Nc2ccccc2 Amb2390018 [0,0,0,0,2,0|2,0,0]=4 665 B16R2.132 Fc1ccc(cc1)\C=N\c2ccccc2 Amb2227967 [0,0,0,0,2,0|1,0,0]=3 666 B16R2.132 Fc1ccc(cc1)\N=C\c2ccccc2 Amb2227968 [0,0,0,0,2,0|1,0,1]=4 667 B16R2.132 Ic1ccc(COc2ccccc2)cc1 Amb25828841 [0,0,0,0,2,0|2,0,0]=4 668 B16R2.132 Ic1ccc(cc1)\N=N\c2ccccc2 Amb16764424 [0,0,0,0,2,0|2,0,0]=4 669 B16R2.132 Nc1ccc(CCc2c[n]ccc2)cc1 Amb21954208 [0,0,0,0,2,0|2,0,0]=4 670 B16R2.132 Nc1ccc(CCc2c[n]ccc2)cc1 Amb22011447 [0,0,0,0,2,0|2,0,0]=4 671 B16R2.132 Nc1ccc(CCc2cc[n]cc2)cc1 Amb21954207 [0,0,0,0,2,0|2,0,0]=4 672 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb21954210 [0,0,0,0,2,0|1,0,0]=3 673 B16R2.132 Nc1ccc(CNc2ccccc2)cc1 Amb18972361 [0,0,0,0,2,0|2,0,0]=4 674 B16R2.132 Nc1ccc(cc1)CCc2ccccc2 Amb17101879 [0,0,0,0,2,0|1,0,0]=3 675 B16R2.132 Nc1ccc(cc1)CCc2ccccn2 Amb1102660 [0,0,0,0,2,0|2,0,0]=4 676 B16R2.132 Nc1ccc(cc1)CCc2ccccn2 Amb17622183 [0,0,0,0,2,0|2,0,0]=4 677 B16R2.132 Nc1ccc(cc1)COc2ccccc2 Amb1136463 [0,0,0,0,2,0|2,0,0]=4 678 B16R2.132 Nc1ccc(cc1)OCc2ccccc2 Amb22489506 [0,0,0,0,2,0|2,0,0]=4 679 B16R2.132 Nc1ccc(cc1)\N=N/c2ccccc2 Amb20620196 [0,0,0,0,2,0|2,0,0]=4 680 B16R2.132 Nc1ccc(cc1)\N=N\c2ccccc2 Amb1348283 [0,0,0,0,2,0|2,0,0]=4 681 B16R2.132 Nc1ccc(cc1)\N=N\c2ccccc2 Amb22351540 [0,0,0,0,2,0|2,0,0]=4 682 B16R2.132 O=C1C=CC(=NSc2ccccc2)C=C1 Amb1145582 [0,0,0,0,2,0|1,0,1]=4 683 B16R2.132 Oc1ccc(CCc2ccccc2)cc1 Amb24066192 [0,0,0,0,2,0|0,0,0]=2 684 B16R2.132 Oc1ccc(cc1)C#Cc2ccccc2 Amb10610495 [0,0,0,0,2,0|0,0,2]=4 685 B16R2.132 Oc1ccc(cc1)CNc2ccccc2 Amb10609692 [0,0,0,0,2,0|1,0,0]=3 686 B16R2.132 Oc1ccc(cc1)CNc2ccccn2 Amb15694898 [0,0,0,0,2,0|2,0,0]=4 687 B16R2.132 Oc1ccc(cc1)N=Cc2ccccc2 Amb24100980 [0,0,0,0,2,0|0,0,1]=3 688 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 Amb24096852 [0,0,0,0,2,0|0,0,1]=3 689 B16R2.132 Oc1ccc(cc1)OCc2ccccc2 Amb1228378 [0,0,0,0,2,0|1,0,0]=3 690 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 Amb22353244 [0,0,0,0,2,0|1,0,0]=3 691 B16R2.132 Oc1ccc(cc1)\C=C\c2ccccn2 Amb1273313 [0,0,0,0,2,0|1,0,1]=4 692 B16R2.132 Oc1ccc(cc1)\C=C\c2ccncc2 Amb1156036 [0,0,0,0,2,0|1,0,1]=4 693 B16R2.132 Oc1ccc(cc1)\C=N\c2ccccc2 Amb2228617 [0,0,0,0,2,0|0,0,0]=2 694 B16R2.132 Oc1ccc(cc1)\N=C\c2ccccn2 Amb1981670 [0,0,0,0,2,0|1,0,1]=4 695 B16R2.132 Oc1ccc(cc1)\N=N\c2ccccc2 Amb1153077 [0,0,0,0,2,0|1,0,0]=3 696 B16R2.132 [NH3+]c1ccc(cc1)OCc2ccccc2 Amb24113829 [0,0,0,0,2,0|2,0,0]=4 697 B16R2.132 [O-][n+]1ccc(cc1)CCc2ccccc2 Amb10554548 [0,0,0,0,2,0|1,0,1]=4 698 B16R2.135 Oc1ccc(cc1)\C=N\Cc2cccs2 Amb2445170 [0,0,0,0,2,0|1,0,0]=3 699 B18R2.2525 C(N=Cc1ccccc1)\N=C\c2ccccc2 Amb24068830 [1,0,0,0,0,1|0,0,1]=3 700 B18R2.2525 C(NCC#Cc1ccccc1)c2ccccc2 Amb25341609 [1,0,0,0,0,1|1,0,1]=4 701 B18R2.2525 C(NCCNc1ccccc1)c2ccccc2 Amb24113424 [1,0,0,0,0,1|0,0,2]=4 702 B18R2.2525 C(N\C=N\Cc1ccccc1)c2ccccc2 Amb24388594 [1,0,0,0,0,1|0,0,2]=4 703 B18R2.2525 C(OCCNc1ccccc1)c2ccccc2 Amb25026408 [1,0,0,0,0,1|1,0,1]=4 704 B18R2.2525 C(ONCCc1ccccc1)c2ccccc2 Amb25231901 [1,0,0,0,0,1|0,0,2]=4 705 B18R2.2525 C([SiH2]CCCc1ccccc1)c2ccccc2 Amb22347056 [1,0,0,0,0,1|1,0,1]=4 706 B18R2.2525 N(CCc1ccccc1)CCc2ccccc2 Amb1103723 [1,0,0,0,0,1|0,0,2]=4 707 B18R2.2525 N(CCc1ccccc1)CCc2ccccc2 Amb2119307 [1,0,0,0,0,1|0,0,2]=4 708 B18R2.2525 N(Cc1ccccc1)CNCc2ccccc2 Amb16224812 [1,0,0,0,0,1|0,0,2]=4 709 B18R2.2525 c1ccc(cc1)CCCNCc2ccccc2 Amb2221082 [1,0,0,0,0,1|0,0,2]=4 710 B18R2.2525 c1ccc(cc1)CNC\C=C\c2ccccc2 Amb1855576 [1,0,0,0,0,1|1,0,0]=3 711 B18R2.2525 c1ccc(cc1)NCCNCc2ccccc2 Amb1086650 [1,0,0,0,0,1|0,0,2]=4 712 B18R2.2525 c1ccc(cc1)NCCNCc2ccccc2 Amb2196521 [1,0,0,0,0,1|0,0,2]=4 713 B20R2.15237 Fc1ccc(C=NOCCOc2ccccc2)cc1 Amb20679256 [0,0,0,0,0,2|1,0,0]=3