0 B17R2.7396 c1cc(CCCN2CCCNCC2)ccn1 Amb18067967 [0,0,0,0,0,0|4,0,0]=4 1 B17R2.7396 c1ccc(CCCN2CCCNCC2)cc1 Amb22586775 [0,0,0,0,0,0|3,0,0]=3 2 B17R2.7396 c1ccc(CCCN2CCCNCC2)cc1 Amb6248285 [0,0,0,0,0,0|3,0,0]=3 3 B17R2.7396 c1ccc(CCCN2CCCNCC2)nc1 Amb18067960 [0,0,0,0,0,0|4,0,0]=4 4 B17R2.7396 c1ccc(CCNC2CCCCCC2)cc1 Amb6695462 [0,0,0,0,0,0|0,0,0]=0 5 B17R2.7396 c1ccc(CNCC2CCCCCN2)cc1 Amb27611535 [0,0,0,0,0,0|3,0,0]=3 6 B17R2.7396 c1ccc(COCC2CCNCCO2)cc1 Amb34932473 [0,0,0,0,0,0|4,0,0]=4 7 B17R2.7396 c1ccc(COCC2CNCCCO2)cc1 Amb27783983 [0,0,0,0,0,0|4,0,0]=4 8 B17R2.7396 c1ccc(CONC2=NCCCCC2)cc1 Amb27984566 [0,0,0,0,0,0|2,0,1]=3 9 B17R2.7396 c1ccc(CONC2=NCCCCN2)cc1 Amb35736568 [0,0,0,0,0,0|3,0,1]=4 10 B17R2.7396 c1ccc(CONC2COCCOC2)cc1 Amb27243577 [0,0,0,0,0,0|3,0,0]=3 11 B17R2.7396 c1ccc(NCCN2CCCCCC2)cc1 Amb17243468 [0,0,0,0,0,0|3,0,0]=3 12 B17R2.7396 c1ccc(OCCN2CCCCCC2)cc1 Amb17243800 [0,0,0,0,0,0|3,0,0]=3 13 B17R2.7396 c1ccc(OCCN2CCCNCC2)cc1 Amb8852654 [0,0,0,0,0,0|4,0,0]=4 14 B17R2.7396 c1cncc(CCCN2CCCNCC2)c1 Amb18067963 [0,0,0,0,0,0|4,0,0]=4 15 B18R2.4796 CC1CCNCCN1CCCc2ccccc2 Amb17581223 [0,1,0,0,0,0|3,0,0]=4 16 B18R2.4796 OC1CCCCCC1CNCc2ccccc2 Amb27752300 [0,1,0,0,0,0|2,0,0]=3 17 B18R2.4796 O[C@@H]1CCCCC[C@@H]1CNCc2ccccc2 Amb24273852 [0,1,0,0,0,0|2,0,0]=3 18 B18R2.4796 O[C@H]1CCCCC[C@H]1CNCc2ccccc2 Amb6357282 [0,1,0,0,0,0|2,0,0]=3 19 B18R2.31194 Cc1cccc(CCCN2CCCNCC2)c1 Amb17250396 [0,1,0,0,0,0|3,0,0]=4 20 B18R2.31194 Cc1cccc(NCCN2CCCCCC2)c1 Amb17250450 [0,1,0,0,0,0|3,0,0]=4 21 B18R2.31194 Cc1cccc(OCCN2CCCCCC2)c1 Amb17250974 [0,1,0,0,0,0|3,0,0]=4 22 B18R2.31194 Clc1cccc(CCCN2CCCNCC2)c1 Amb17263111 [0,1,0,0,0,0|3,0,0]=4 23 B18R2.31194 Clc1cccc(CON=C2CCCCCC2)c1 Amb10605570 [0,1,0,0,0,0|1,0,2]=4 24 B18R2.31194 Clc1cccc(NCCN2CCCCCC2)c1 Amb17263135 [0,1,0,0,0,0|3,0,0]=4 25 B18R2.31194 Fc1cccc(CCCN2CCCNCC2)c1 Amb17253205 [0,1,0,0,0,0|3,0,0]=4 26 B18R2.31194 Fc1cccc(NCCN2CCCCCC2)c1 Amb17253218 [0,1,0,0,0,0|3,0,0]=4 27 B18R2.31194 Nc1cccc(CCCN2CCCCCC2)c1 Amb17050712 [0,1,0,0,0,0|2,0,0]=3 28 B18R2.31194 Nc1cccc(CCNC2CCCCCC2)c1 Amb18050984 [0,1,0,0,0,0|0,0,0]=1 29 B18R2.31194 Nc1cccc(OCCN2CCCCCC2)c1 Amb9026482 [0,1,0,0,0,0|3,0,0]=4 30 B18R2.39342 CC1CCCC(NOCc2ccccc2)CC1 Amb27944364 [0,1,0,0,0,0|1,0,0]=2 31 B18R2.39613 Cc1ccccc1CCCN2CCCNCC2 Amb17250395 [0,1,0,0,0,0|3,0,0]=4 32 B18R2.39613 Cc1ccccc1NCCN2CCCCCC2 Amb17250449 [0,1,0,0,0,0|3,0,0]=4 33 B18R2.39613 Cc1ccccc1OCCN2CCCCCC2 Amb17250972 [0,1,0,0,0,0|3,0,0]=4 34 B18R2.39613 Clc1ccccc1CCCN2CCCNCC2 Amb17263110 [0,1,0,0,0,0|3,0,0]=4 35 B18R2.39613 Clc1ccccc1NCCN2CCCCCC2 Amb17263134 [0,1,0,0,0,0|3,0,0]=4 36 B18R2.39613 Fc1ccccc1CCCN2CCCNCC2 Amb17253204 [0,1,0,0,0,0|3,0,0]=4 37 B18R2.39613 Fc1ccccc1NCCN2CCCCCC2 Amb17253216 [0,1,0,0,0,0|3,0,0]=4 38 B18R2.39613 Fc1ccccc1OCCN2CCCCCC2 Amb17253715 [0,1,0,0,0,0|3,0,0]=4 39 B18R2.39613 Nc1ccccc1CCCN2CCCCCC2 Amb17050687 [0,1,0,0,0,0|2,0,0]=3 40 B18R2.39613 Nc1ccccc1OCCN2CCCCCC2 Amb845151 [0,1,0,0,0,0|3,0,0]=4 41 B18R2.72590 CC(Cc1ccccc1)CN2CCCNCC2 Amb17250482 [0,1,0,0,0,0|3,0,0]=4 42 B18R2.72590 CN(Cc1ccccc1)CC2CCCCCN2 Amb27656838 [0,1,0,0,0,0|3,0,0]=4 43 B18R2.72819 CC(CNC1CCCCCC1)c2ccccc2 Amb6644914 [0,1,0,0,0,0|0,0,0]=1 44 B18R2.72819 CN(CCN1CCCCCC1)c2ccccc2 Amb17250452 [0,1,0,0,0,0|3,0,0]=4 45 B18R2.72819 NC(CCN1CCCCCC1)c2ccccc2 Amb6715128 [0,1,0,0,0,0|2,0,0]=3 46 B18R2.72819 O=C(CCN1CCCCCC1)c2ccccc2 Amb9683781 [0,1,0,0,0,0|2,0,1]=4 47 B18R2.72819 O=C(CNC1CCCCCC1)c2ccccc2 Amb17344904 [0,1,0,0,0,0|0,0,1]=2 48 B18R2.72819 OC(CNC1CCCCCC1)c2ccccc2 Amb9242105 [0,1,0,0,0,0|0,0,0]=1 49 B18R2.72819 OC(CNC1CCCCCC1)c2ccccn2 Amb17157816 [0,1,0,0,0,0|1,0,0]=2 50 B18R2.72819 OC(CNC1CCCCCC1)c2cccnc2 Amb17157817 [0,1,0,0,0,0|1,0,0]=2 51 B18R2.72819 OC(CNC1CCCCCC1)c2ccncc2 Amb17157818 [0,1,0,0,0,0|1,0,0]=2 52 B18R2.94225 Cc1ccc(CCCN2CCCNCC2)cc1 Amb17250397 [0,1,0,0,0,0|3,0,0]=4 53 B18R2.94225 Cc1ccc(NCCN2CCCCCC2)cc1 Amb17250451 [0,1,0,0,0,0|3,0,0]=4 54 B18R2.94225 Cc1ccc(OCCN2CCCCCC2)cc1 Amb17250976 [0,1,0,0,0,0|3,0,0]=4 55 B18R2.94225 Clc1ccc(CCCN2CCCNCC2)cc1 Amb17263112 [0,1,0,0,0,0|3,0,0]=4 56 B18R2.94225 Clc1ccc(NCCN2CCCCCC2)cc1 Amb17263136 [0,1,0,0,0,0|3,0,0]=4 57 B18R2.94225 Fc1ccc(CCCN2CCCNCC2)cc1 Amb17253206 [0,1,0,0,0,0|3,0,0]=4 58 B18R2.94225 Fc1ccc(NCCN2CCCCCC2)cc1 Amb17253217 [0,1,0,0,0,0|3,0,0]=4 59 B18R2.94225 Fc1ccc(OCCN2CCCCCC2)cc1 Amb17253717 [0,1,0,0,0,0|3,0,0]=4 60 B18R2.94225 Nc1ccc(CCCN2CCCCCC2)cc1 Amb17050736 [0,1,0,0,0,0|2,0,0]=3 61 B18R2.94225 Nc1ccc(OCCN2CCCCCC2)cc1 Amb2722218 [0,1,0,0,0,0|3,0,0]=4 62 B18R2.128576 C[C@@H](NCc1ccccc1)C2CCCCCC2 Amb28253349 [0,1,0,0,0,0|2,0,0]=3 63 B18R2.128576 O=C(CCc1ccccc1)N2CCCNCC2 Amb1137982 [0,1,0,0,0,0|3,0,0]=4 64 B18R2.128576 O=C(CNc1ccccc1)N2CCCCCC2 Amb6707049 [0,1,0,0,0,0|3,0,0]=4 65 B18R2.128576 O=C(NCc1ccccc1)C2CCCCCC2 Amb28056753 [0,1,0,0,0,0|2,0,0]=3 66 B18R2.128576 O=C(NCc1ccccc1)C2CCCCCN2 Amb23585568 [0,1,0,0,0,0|3,0,0]=4 67 B18R2.128576 O=C(NCc1ccccc1)C2CCCSCC2 Amb30031384 [0,1,0,0,0,0|3,0,0]=4 68 B18R2.128576 S=C(NCc1ccccc1)N2CCCCCC2 Amb1205822 [0,1,0,0,0,0|3,0,0]=4 69 B16R1.643 BrCCCCCCCOCc1ccccc1 Amb35825168 [0,0,1,0,0,0|3,0,0]=4 70 B16R1.643 CCCCCCCCCC[n+]1ccccc1 Amb33756884 [0,0,1,0,0,0|2,0,0]=3 71 B16R1.643 CCCCCCCCCCc1ccccc1 Amb2690277 [0,0,1,0,0,0|1,0,0]=2 72 B16R1.643 CCCCCCCCCCc1ccccn1 Amb22235252 [0,0,1,0,0,0|2,0,0]=3 73 B16R1.643 CCCCCCCCCCc1cccnc1 Amb22235256 [0,0,1,0,0,0|2,0,0]=3 74 B16R1.643 CCCCCCCCCCc1ccncc1 Amb22235261 [0,0,1,0,0,0|2,0,0]=3 75 B16R1.643 CCCCCCCCCSc1ccccc1 Amb17666877 [0,0,1,0,0,0|2,0,0]=3 76 B16R1.643 CCCCCCCCNCc1ccccc1 Amb2615374 [0,0,1,0,0,0|2,0,0]=3 77 B16R1.643 CCCCCCCCNCc1ccccn1 Amb5262462 [0,0,1,0,0,0|3,0,0]=4 78 B16R1.643 CCCCCCCCNCc1cccnc1 Amb5261542 [0,0,1,0,0,0|3,0,0]=4 79 B16R1.643 CCCCCCCCNCc1ccncc1 Amb5261541 [0,0,1,0,0,0|3,0,0]=4 80 B16R1.643 CCCCCCCNOCc1ccccc1 Amb25728538 [0,0,1,0,0,0|1,0,0]=2 81 B16R1.643 CCCCCCNCCCc1ccccc1 Amb6619983 [0,0,1,0,0,0|2,0,0]=3 82 B16R1.643 CCCCCNCCCOc1ccccc1 Amb17308699 [0,0,1,0,0,0|3,0,0]=4 83 B16R1.643 CCCCCOCCNCc1ccccc1 Amb28192694 [0,0,1,0,0,0|3,0,0]=4 84 B16R1.643 CCCCNCCCCOc1ccccc1 Amb8560057 [0,0,1,0,0,0|3,0,0]=4 85 B16R1.643 CCCCNCCCOCc1ccccc1 Amb27465693 [0,0,1,0,0,0|3,0,0]=4 86 B16R1.643 CCCCOCCCNCc1ccccc1 Amb875687 [0,0,1,0,0,0|3,0,0]=4 87 B16R1.643 CCCNCCCCOCc1ccccc1 Amb27872978 [0,0,1,0,0,0|3,0,0]=4 88 B16R1.643 CCCNCCCNOCc1ccccc1 Amb27452700 [0,0,1,0,0,0|2,0,0]=3 89 B16R1.643 CCNCCCCCOCc1ccccc1 Amb28192688 [0,0,1,0,0,0|3,0,0]=4 90 B16R1.643 CSCCCCCCNCc1ccccc1 Amb27213097 [0,0,1,0,0,0|3,0,0]=4 91 B16R1.643 NCCCCCCCNCc1ccccc1 Amb27166875 [0,0,1,0,0,0|3,0,0]=4 92 B16R1.643 OCCCCCCCCCc1ccccc1 Amb10807554 [0,0,1,0,0,0|2,0,0]=3 93 B16R1.643 OCCCCCCNOCc1ccccc1 Amb27197325 [0,0,1,0,0,0|2,0,0]=3 94 B16R1.1694 CCCCCC(O)CNCc1ccccc1 Amb8630549 [0,0,1,0,0,0|3,0,0]=4 95 B16R1.1694 CCCCCC(O)COCc1ccccc1 Amb28146530 [0,0,1,0,0,0|3,0,0]=4 96 B16R1.1694 CCCCNC(C)COCc1ccccc1 Amb27214311 [0,0,1,0,0,0|3,0,0]=4 97 B16R1.1694 CCCCOC(C)OCCc1ccccc1 Amb3777426 [0,0,1,0,0,0|2,0,0]=3 98 B16R1.4525 CCCCC(CC)CNCc1ccccn1 Amb2716290 [0,0,1,0,0,0|3,0,0]=4 99 B16R1.4525 CCCCC(CC)CNCc1ccccn1 Amb5716808 [0,0,1,0,0,0|3,0,0]=4 100 B16R1.4525 CCCCC(COCc1ccccc1)NC Amb28137221 [0,0,1,0,0,0|3,0,0]=4 101 B16R1.4525 CCCC[C@H](CC)CNCc1ccccc1 Amb28292669 [0,0,1,0,0,0|2,0,0]=3 102 B16R1.4525 CCCNC(CC)COCc1ccccc1 Amb27162779 [0,0,1,0,0,0|3,0,0]=4 103 B16R1.4640 CCCC(CCC)CNCc1ccccc1 Amb27751316 [0,0,1,0,0,0|2,0,0]=3 104 B16R1.4640 CCCC(CCCl)CNCc1ccccc1 Amb27219571 [0,0,1,0,0,0|3,0,0]=4 105 B16R1.4640 CCCC(CCO)CNCc1ccccc1 Amb27267675 [0,0,1,0,0,0|3,0,0]=4 106 B16R1.4640 COCC(COC)NOCc1ccccc1 Amb27634545 [0,0,1,0,0,0|3,0,0]=4 107 B18R3.13566 c1ccc(C2NCC23CCCCCC3)cc1 Amb32674581 [0,0,0,1,0,0|2,0,0]=3 108 B16R2.2256 C(/CCc1ccccc1)=C2/CCCNC2 Amb31116284 [0,0,0,0,1,0|2,0,1]=4 109 B16R2.2256 C(CCc1ccccc1)=C2CCNCC2 Amb31116281 [0,0,0,0,1,0|2,0,1]=4 110 B16R2.2256 c1cc(CNCC2CCCCC2)ccn1 Amb876052 [0,0,0,0,1,0|3,0,0]=4 111 B16R2.2256 c1ccc(CCCC2CCCCN2)cc1 Amb2235003 [0,0,0,0,1,0|2,0,0]=3 112 B16R2.2256 c1ccc(CCCC2CCCCN2)cc1 Amb28750995 [0,0,0,0,1,0|2,0,0]=3 113 B16R2.2256 c1ccc(CCCC2CCCNC2)cc1 Amb21959215 [0,0,0,0,1,0|2,0,0]=3 114 B16R2.2256 c1ccc(CCCC2CCNCC2)cc1 Amb22754372 [0,0,0,0,1,0|2,0,0]=3 115 B16R2.2256 c1ccc(CCCC2CCNCC2)cc1 Amb2694474 [0,0,0,0,1,0|2,0,0]=3 116 B16R2.2256 c1ccc(CCCN2CCNCC2)cc1 Amb1110026 [0,0,0,0,1,0|3,0,0]=4 117 B16R2.2256 c1ccc(CCNC2=NCCCS2)cc1 Amb1103981 [0,0,0,0,1,0|2,0,1]=4 118 B16R2.2256 c1ccc(CCNC2CCCCC2)cc1 Amb2118405 [0,0,0,0,1,0|0,0,0]=1 119 B16R2.2256 c1ccc(CCNC2CCCCC2)cc1 Amb6695554 [0,0,0,0,1,0|0,0,0]=1 120 B16R2.2256 c1ccc(CCNC2CCCSC2)nc1 Amb19033220 [0,0,0,0,1,0|2,0,0]=3 121 B16R2.2256 c1ccc(CCNC2CCOCC2)cc1 Amb9472409 [0,0,0,0,1,0|1,0,0]=2 122 B16R2.2256 c1ccc(CCNC2CCOCC2)nc1 Amb9472401 [0,0,0,0,1,0|2,0,0]=3 123 B16R2.2256 c1ccc(CCOC2CCCNC2)cc1 Amb6701444 [0,0,0,0,1,0|2,0,0]=3 124 B16R2.2256 c1ccc(CCOC2CCNCC2)cc1 Amb13951333 [0,0,0,0,1,0|2,0,0]=3 125 B16R2.2256 c1ccc(CCOC2CCNCC2)cc1 Amb33531496 [0,0,0,0,1,0|2,0,0]=3 126 B16R2.2256 c1ccc(CC[NH2+]C2CCCCC2)cc1 Amb4012528 [0,0,0,0,1,0|0,0,1]=2 127 B16R2.2256 c1ccc(CNCC2CCCCC2)cc1 Amb1832421 [0,0,0,0,1,0|2,0,0]=3 128 B16R2.2256 c1ccc(CNCC2CCCCC2)cc1 Amb6335354 [0,0,0,0,1,0|2,0,0]=3 129 B16R2.2256 c1ccc(CNCC2CCCCC2)nc1 Amb876051 [0,0,0,0,1,0|3,0,0]=4 130 B16R2.2256 c1ccc(CNCC2CCCCO2)cc1 Amb9258689 [0,0,0,0,1,0|3,0,0]=4 131 B16R2.2256 c1ccc(CNCC2CCCNC2)cc1 Amb17238239 [0,0,0,0,1,0|3,0,0]=4 132 B16R2.2256 c1ccc(CNCC2CCNCC2)cc1 Amb1926957 [0,0,0,0,1,0|3,0,0]=4 133 B16R2.2256 c1ccc(CNCC2CCOCC2)cc1 Amb2683681 [0,0,0,0,1,0|3,0,0]=4 134 B16R2.2256 c1ccc(CNC[C@@H]2CCCNC2)cc1 Amb28251942 [0,0,0,0,1,0|3,0,0]=4 135 B16R2.2256 c1ccc(COCC2CCCCN2)cc1 Amb17061768 [0,0,0,0,1,0|3,0,0]=4 136 B16R2.2256 c1ccc(COCC2CCCNC2)cc1 Amb17061784 [0,0,0,0,1,0|3,0,0]=4 137 B16R2.2256 c1ccc(COCC2CCCNC2)cc1 Amb21954470 [0,0,0,0,1,0|3,0,0]=4 138 B16R2.2256 c1ccc(COCC2CCNCC2)cc1 Amb21954838 [0,0,0,0,1,0|3,0,0]=4 139 B16R2.2256 c1ccc(COCC2CCNCC2)cc1 Amb5400491 [0,0,0,0,1,0|3,0,0]=4 140 B16R2.2256 c1ccc(CONC2CCCCC2)cc1 Amb27946501 [0,0,0,0,1,0|1,0,0]=2 141 B16R2.2256 c1ccc(CONC2CCCOC2)cc1 Amb27443746 [0,0,0,0,1,0|2,0,0]=3 142 B16R2.2256 c1ccc(CONC2CCCSC2)cc1 Amb27882398 [0,0,0,0,1,0|2,0,0]=3 143 B16R2.2256 c1ccc(CSCC2CCCCN2)cc1 Amb22395623 [0,0,0,0,1,0|3,0,0]=4 144 B16R2.2256 c1ccc(CSCC2CCCCN2)cc1 Amb35745832 [0,0,0,0,1,0|3,0,0]=4 145 B16R2.2256 c1ccc(CSCC2CCCNC2)cc1 Amb22395604 [0,0,0,0,1,0|3,0,0]=4 146 B16R2.2256 c1ccc(CSCC2CCCNC2)cc1 Amb35745831 [0,0,0,0,1,0|3,0,0]=4 147 B16R2.2256 c1ccc(CSCC2CCNCC2)cc1 Amb22395588 [0,0,0,0,1,0|3,0,0]=4 148 B16R2.2256 c1ccc(CSCC2CCNCC2)cc1 Amb35745673 [0,0,0,0,1,0|3,0,0]=4 149 B16R2.2256 c1ccc(NCCN2CCCCC2)cc1 Amb7173351 [0,0,0,0,1,0|3,0,0]=4 150 B16R2.2256 c1ccc(OCCC2CCCCN2)cc1 Amb9212480 [0,0,0,0,1,0|3,0,0]=4 151 B16R2.2256 c1ccc(OCCC2CCCNC2)cc1 Amb19021002 [0,0,0,0,1,0|3,0,0]=4 152 B16R2.2256 c1ccc(OCCC2CCNCC2)cc1 Amb9212481 [0,0,0,0,1,0|3,0,0]=4 153 B16R2.2256 c1ccc(OCCN2CCCCC2)cc1 Amb10813707 [0,0,0,0,1,0|3,0,0]=4 154 B16R2.2256 c1ccc(SCCC2CCCCN2)cc1 Amb2574969 [0,0,0,0,1,0|3,0,0]=4 155 B16R2.2256 c1ccc(SCCC2CCCCN2)cc1 Amb5544286 [0,0,0,0,1,0|3,0,0]=4 156 B16R2.2256 c1ccc(SCCC2CCNCC2)cc1 Amb22395689 [0,0,0,0,1,0|3,0,0]=4 157 B16R2.2256 c1cnc(CCNC2CCCCC2)nc1 Amb33495857 [0,0,0,0,1,0|2,0,0]=3 158 B16R2.2256 c1cncc(CNCC2CCCCC2)c1 Amb2119328 [0,0,0,0,1,0|3,0,0]=4 159 B16R2.2256 c1cncc(CNCC2CCCCC2)c1 Amb6729801 [0,0,0,0,1,0|3,0,0]=4 160 B16R2.5334 C(=C\C1CCCCCN1)/c2ccccc2 Amb20667768 [0,0,0,0,1,0|1,0,2]=4 161 B16R2.5334 C1=CC(NCc2ccccc2)CCCC1 Amb27951551 [0,0,0,0,1,0|0,0,2]=3 162 B16R2.5334 c1cc(CCN2CCCNCC2)ccn1 Amb535198 [0,0,0,0,1,0|3,0,0]=4 163 B16R2.5334 c1cc(CNC2CCCCCC2)ccn1 Amb6723808 [0,0,0,0,1,0|1,0,0]=2 164 B16R2.5334 c1ccc(CCN2CCCNCC2)cc1 Amb1112294 [0,0,0,0,1,0|2,0,0]=3 165 B16R2.5334 c1ccc(CCN2CCCNCC2)cc1 Amb6806679 [0,0,0,0,1,0|2,0,0]=3 166 B16R2.5334 c1ccc(CCN2CCCNCC2)nc1 Amb535206 [0,0,0,0,1,0|3,0,0]=4 167 B16R2.5334 c1ccc(CNC2=NCCCCC2)cc1 Amb576782 [0,0,0,0,1,0|1,0,1]=3 168 B16R2.5334 c1ccc(CNC2=NCCCCN2)cc1 Amb30036185 [0,0,0,0,1,0|2,0,1]=4 169 B16R2.5334 c1ccc(CNC2CCCCCC2)cc1 Amb6687352 [0,0,0,0,1,0|0,0,0]=1 170 B16R2.5334 c1ccc(CNC2CCCCCC2)nc1 Amb5262458 [0,0,0,0,1,0|1,0,0]=2 171 B16R2.5334 c1ccc(CNC2CCCNCC2)cc1 Amb25390701 [0,0,0,0,1,0|1,0,0]=2 172 B16R2.5334 c1ccc(CNC2CCCSCC2)cc1 Amb29860660 [0,0,0,0,1,0|1,0,0]=2 173 B16R2.5334 c1ccc(CNC2COCCOC2)cc1 Amb27767421 [0,0,0,0,1,0|2,0,0]=3 174 B16R2.5334 c1cncc(CCN2CCCNCC2)c1 Amb17238606 [0,0,0,0,1,0|3,0,0]=4 175 B16R2.5334 c1cncc(CNC2CCCCCC2)c1 Amb6729787 [0,0,0,0,1,0|1,0,0]=2 176 B16R2.5334 c1ncc(CNC2CCCCCC2)cn1 Amb18300800 [0,0,0,0,1,0|2,0,0]=3 177 B16R2.5335 c1csc(CCNC2CCCCCC2)c1 Amb6697733 [0,0,0,0,1,0|1,0,0]=2 178 B18R2.126804 c1ccc(CCNC2CCCCCCC2)cc1 Amb6620031 [0,0,0,0,0,1|0,0,0]=1 179 B18R2.126804 c1ccc(CONC2CCCCCCC2)cc1 Amb28066406 [0,0,0,0,0,1|1,0,0]=2 180 B18R2.126806 C(=C\c1ccccc1)/CNC2CCCCCC2 Amb22536696 [0,0,0,0,0,1|0,0,1]=2 181 B18R2.126806 c1ccc(CNCCC2CCCCCC2)cc1 Amb27267735 [0,0,0,0,0,1|1,0,0]=2 182 B18R2.126806 c1ccc(CNCCN2CCCNCC2)cc1 Amb27960241 [0,0,0,0,0,1|3,0,0]=4 183 B18R2.126806 c1ccc(CNCCN2CCCOCC2)cc1 Amb27241541 [0,0,0,0,0,1|3,0,0]=4 184 B18R2.126806 c1ccc(COCCC2CCCCCN2)cc1 Amb27803558 [0,0,0,0,0,1|2,0,0]=3 185 B18R2.126806 c1ccc(COCCN2CCCCCC2)cc1 Amb27779576 [0,0,0,0,0,1|2,0,0]=3 186 B18R2.126806 c1ccc(OCCCN2CCCNCC2)cc1 Amb8852597 [0,0,0,0,0,1|3,0,0]=4 187 B15R1.35 BrCCCCCCCCc1ccccc1 Amb2685442 [1,0,1,0,0,0|1,0,0]=3 188 B15R1.35 BrCCCCCCOCc1ccccc1 Amb22002106 [1,0,1,0,0,0|2,0,0]=4 189 B15R1.35 C#CCCCCCNCc1ccccc1 Amb27767099 [1,0,1,0,0,0|0,0,2]=4 190 B15R1.35 CCCCCCCCCc1ccccc1 Amb8513457 [1,0,1,0,0,0|0,0,0]=2 191 B15R1.35 CCCCCCCCCc1ccccn1 Amb22235251 [1,0,1,0,0,0|1,0,0]=3 192 B15R1.35 CCCCCCCCCc1cccnc1 Amb22235255 [1,0,1,0,0,0|1,0,0]=3 193 B15R1.35 CCCCCCCCCc1ccncc1 Amb22235259 [1,0,1,0,0,0|1,0,0]=3 194 B15R1.35 CCCCCCCCNc1ccccc1 Amb7794398 [1,0,1,0,0,0|1,0,0]=3 195 B15R1.35 CCCCCCCCNc1ccncc1 Amb10602375 [1,0,1,0,0,0|2,0,0]=4 196 B15R1.35 CCCCCCCCOc1ccccc1 Amb22733742 [1,0,1,0,0,0|1,0,0]=3 197 B15R1.35 CCCCCCCNCc1ccccc1 Amb3726358 [1,0,1,0,0,0|0,0,0]=2 198 B15R1.35 CCCCCCCNCc1ccccn1 Amb7757181 [1,0,1,0,0,0|1,0,0]=3 199 B15R1.35 CCCCCCCNCc1cccnc1 Amb838088 [1,0,1,0,0,0|1,0,0]=3 200 B15R1.35 CCCCCCCNCc1ccncc1 Amb837790 [1,0,1,0,0,0|1,0,0]=3 201 B15R1.35 CCCCCCNCCc1ccccc1 Amb6653642 [1,0,1,0,0,0|0,0,0]=2 202 B15R1.35 CCCCCNCCOc1ccccc1 Amb17239453 [1,0,1,0,0,0|2,0,0]=4 203 B15R1.35 CCCCNCCCOc1ccccc1 Amb8559933 [1,0,1,0,0,0|2,0,0]=4 204 B15R1.35 CCCCNCCOCc1ccccc1 Amb28322610 [1,0,1,0,0,0|2,0,0]=4 205 B15R1.35 CCCC\C=C\CNCc1ccccc1 Amb25144402 [1,0,1,0,0,0|0,0,2]=4 206 B15R1.35 CCCNCCCCOc1ccccc1 Amb17308626 [1,0,1,0,0,0|2,0,0]=4 207 B15R1.35 CCCNCCCOCc1ccccc1 Amb27870345 [1,0,1,0,0,0|2,0,0]=4 208 B15R1.35 COCCCCCNCc1ccccc1 Amb24338874 [1,0,1,0,0,0|1,0,0]=3 209 B15R1.35 COCCOCCNCc1ccccc1 Amb9783994 [1,0,1,0,0,0|2,0,0]=4 210 B15R1.35 CSCCCCNOCc1ccccc1 Amb27267574 [1,0,1,0,0,0|2,0,0]=4 211 B15R1.35 CSCCNCCNCc1ccccc1 Amb27471043 [1,0,1,0,0,0|2,0,0]=4 212 B15R1.35 CSCCOCCNCc1ccccc1 Amb27463882 [1,0,1,0,0,0|2,0,0]=4 213 B15R1.35 C\C=C\CCCCNCc1ccccc1 Amb27238562 [1,0,1,0,0,0|0,0,2]=4 214 B15R1.35 ClCCCCCCNCc1ccccc1 Amb8385088 [1,0,1,0,0,0|1,0,0]=3 215 B15R1.35 ICCCCCCNCc1ccccc1 Amb27401746 [1,0,1,0,0,0|1,0,0]=3 216 B15R1.35 ICCCCCCOCc1ccccc1 Amb24437731 [1,0,1,0,0,0|2,0,0]=4 217 B15R1.35 N#CCCCCCNCc1ccccc1 Amb27413919 [1,0,1,0,0,0|1,0,1]=4 218 B15R1.35 NCCCCCNOCc1ccccc1 Amb24410164 [1,0,1,0,0,0|2,0,0]=4 219 B15R1.35 NCCCCSCCCc1ccccc1 Amb17500951 [1,0,1,0,0,0|2,0,0]=4 220 B15R1.35 OCCCCCCCCc1ccccc1 Amb2690301 [1,0,1,0,0,0|1,0,0]=3 221 B15R1.35 OCCCCCCNCc1ccccc1 Amb24081563 [1,0,1,0,0,0|1,0,0]=3 222 B15R1.35 OCCCCCCOCc1ccccc1 Amb25184362 [1,0,1,0,0,0|2,0,0]=4 223 B15R1.35 OCCCCCNCCc1ccccc1 Amb876024 [1,0,1,0,0,0|1,0,0]=3 224 B15R1.35 OCCNCCCNCc1ccccc1 Amb879683 [1,0,1,0,0,0|2,0,0]=4 225 B15R1.35 OCCNCCNCCc1ccccc1 Amb22511415 [1,0,1,0,0,0|2,0,0]=4 226 B15R1.35 OCCOCCCNCc1ccccc1 Amb27829653 [1,0,1,0,0,0|2,0,0]=4 227 B15R1.35 OCCOCCNCCc1ccccc1 Amb6736103 [1,0,1,0,0,0|2,0,0]=4 228 B15R1.157 C=CCCC(C)NCCc1ccccc1 Amb33442261 [1,0,1,0,0,0|0,0,2]=4 229 B15R1.157 CC(CCCO)NCCc1ccccc1 Amb33363320 [1,0,1,0,0,0|1,0,0]=3 230 B15R1.157 CCCCC(C)CNCc1ccccc1 Amb27879524 [1,0,1,0,0,0|2,0,0]=4 231 B15R1.157 CCCCC(C)NOCc1ccccc1 Amb27774270 [1,0,1,0,0,0|1,0,0]=3 232 B15R1.157 CCCOC(C)OCCc1ccccc1 Amb22168245 [1,0,1,0,0,0|2,0,0]=4 233 B15R1.157 CCOCC(C)NOCc1ccccc1 Amb27754581 [1,0,1,0,0,0|2,0,0]=4 234 B17R1.11 CCCCCCCCCCc1ccc(Br)cc1 Amb22234838 [0,1,1,0,0,0|1,0,0]=3 235 B17R1.11 CCCCCCCCCCc1ccc(N)cc1 Amb2720761 [0,1,1,0,0,0|1,0,0]=3 236 B17R1.11 CCCCCCCCCCc1ccc(N)cc1 Amb2722941 [0,1,1,0,0,0|1,0,0]=3 237 B17R1.11 CCCCCCCCNCc1ccc(Br)cc1 Amb5261537 [0,1,1,0,0,0|2,0,0]=4 238 B17R1.11 CCCCCCCCNCc1ccc(C)cc1 Amb5261535 [0,1,1,0,0,0|2,0,0]=4 239 B17R1.11 CCCCCCCCNCc1ccc(Cl)cc1 Amb5261536 [0,1,1,0,0,0|2,0,0]=4 240 B17R1.11 CCCCCCCCNCc1ccc(F)cc1 Amb5261543 [0,1,1,0,0,0|2,0,0]=4 241 B17R1.716 CCCCCCCCNCc1cccc(Br)c1 Amb5261586 [0,1,1,0,0,0|2,0,0]=4 242 B17R1.716 CCCCCCCCNCc1cccc(Cl)c1 Amb5261688 [0,1,1,0,0,0|2,0,0]=4 243 B17R1.716 CCCCCCCCOCc1cccc(N)c1 Amb7790727 [0,1,1,0,0,0|2,0,0]=4 244 B17R1.754 CCCCCCCCCC(=O)c1ccccc1 Amb8515238 [0,1,1,0,0,0|1,0,1]=4 245 B17R1.754 CCCCCCCNCC(C)c1ccccc1 Amb6888029 [0,1,1,0,0,0|0,0,0]=2 246 B17R1.1242 BrCCCCCCCCCCc1ccccc1 Amb2685406 [0,1,1,0,0,0|1,0,0]=3 247 B17R1.1242 BrCCCCCCCCOCc1ccccc1 Amb32410436 [0,1,1,0,0,0|2,0,0]=4 248 B17R1.1242 CCCCCCCCNOCc1ccccc1 Amb25683173 [0,1,1,0,0,0|1,0,0]=3 249 B17R1.1242 CCCCCCCNC\C=C\c1ccccc1 Amb837825 [0,1,1,0,0,0|0,0,1]=3 250 B17R1.1242 CCCCCCNCCCOc1ccccc1 Amb17308733 [0,1,1,0,0,0|2,0,0]=4 251 B17R1.1242 CCCCCNCCCCOc1ccccc1 Amb17308705 [0,1,1,0,0,0|2,0,0]=4 252 B17R1.1242 COCCCCCNC\C=C\c1ccccc1 Amb23958841 [0,1,1,0,0,0|1,0,1]=4 253 B17R1.1242 COCCOCCCNOCc1ccccc1 Amb27470645 [0,1,1,0,0,0|2,0,0]=4 254 B17R1.1242 OCCCCCCCCCCc1ccncc1 Amb8439699 [0,1,1,0,0,0|2,0,0]=4 255 B17R1.1287 CCCCCCCC(=O)NCc1ccccc1 Amb1214396 [0,1,1,0,0,0|2,0,0]=4 256 B17R1.1287 CCCCCCCC(=O)OCc1ccccc1 Amb26474121 [0,1,1,0,0,0|2,0,0]=4 257 B17R1.1292 CCCCCCCNC(=S)Nc1ccccc1 Amb6876221 [0,1,1,0,0,0|1,0,1]=4 258 B17R1.1311 CC(C)CCCCCNOCc1ccccc1 Amb27648443 [0,1,1,0,0,0|1,0,0]=3 259 B17R1.1450 CCCCCCCCCOc1ccccc1N Amb7794175 [0,1,1,0,0,0|2,0,0]=4 260 B17R1.1450 CCCCCCCCNCc1ccccc1C Amb5261693 [0,1,1,0,0,0|2,0,0]=4 261 B17R1.1450 CCCCCCCCNCc1ccccc1Cl Amb5261687 [0,1,1,0,0,0|2,0,0]=4 262 B17R1.1450 CCCCCCCCNCc1ccccc1F Amb5261692 [0,1,1,0,0,0|2,0,0]=4 263 B17R1.7823 CCCCCCC(N)COCc1ccccc1 Amb27232158 [0,1,1,0,0,0|2,0,0]=4 264 B17R1.29550 CCCCCC(C)(C)CNCc1ccccc1 Amb27781364 [0,1,1,0,0,0|2,0,0]=4 265 B17R1.5 CCCCN(CC)CCCc1ccc(N)cc1 Amb17505405 [0,1,1,0,0,0|2,0,0]=4 266 B17R1.4100 CCCCC(CC)C(=O)OCc1ccccc1 Amb24388585 [0,1,1,0,0,0|2,0,0]=4 267 B17R1.4975 CCCCC(CC)COCc1cccc(N)c1 Amb7790480 [0,1,1,0,0,0|2,0,0]=4 268 B17R1.4975 CCCCN(CC)CCCc1cccc(N)c1 Amb17227864 [0,1,1,0,0,0|2,0,0]=4 269 B17R1.7964 CCC(C)CC(CC)NOCc1ccccc1 Amb27944260 [0,1,1,0,0,0|1,0,0]=3 270 B17R1.755 CCCN(CCC)CCCc1ccc(N)cc1 Amb17504996 [0,1,1,0,0,0|2,0,0]=4 271 B17R1.755 CCCN(CCC)CCCc1ccc(O)cc1 Amb17511314 [0,1,1,0,0,0|2,0,0]=4 272 B17R1.5146 CCCN(CCC)CCC(O)c1ccccc1 Amb21984414 [0,1,1,0,0,0|2,0,0]=4 273 B17R1.5164 CCCN(CCC)CCCc1cccc(N)c1 Amb17226934 [0,1,1,0,0,0|2,0,0]=4 274 B17R1.5164 CCCN(CCC)CCCc1cccc(O)c1 Amb17511290 [0,1,1,0,0,0|2,0,0]=4 275 B17R1.18646 CCCC(CCC)C(=O)NCc1ccccc1 Amb8452591 [0,1,1,0,0,0|2,0,0]=4 276 B17R2.143 CN(Cc1ccccc1)CC2CCCCC2 Amb17242885 [0,1,0,0,1,0|2,0,0]=4 277 B17R2.143 NC(Cc1ccccc1)CC2CCCCC2 Amb13952816 [0,1,0,0,1,0|1,0,0]=3 278 B17R2.143 NC(Cc1ccccc1)CC2CCCCC2 Amb33330374 [0,1,0,0,1,0|1,0,0]=3 279 B17R2.143 NC(Cc1ccccc1)CN2CCCCC2 Amb13952822 [0,1,0,0,1,0|2,0,0]=4 280 B17R2.143 NC(Cc1ccccc1)CN2CCCCC2 Amb6715564 [0,1,0,0,1,0|2,0,0]=4 281 B17R2.143 N[C@@H](Cc1ccccc1)CN2CCCCC2 Amb34913977 [0,1,0,0,1,0|2,0,0]=4 282 B17R2.143 N[C@@H](Cc1ccccc1)CN2CCCCC2 Amb5782179 [0,1,0,0,1,0|2,0,0]=4 283 B17R2.143 N[C@H](Cc1ccccc1)CN2CCCCC2 Amb34912503 [0,1,0,0,1,0|2,0,0]=4 284 B17R2.143 O=C(Cc1ccccc1)CC2CCCCC2 Amb33328895 [0,1,0,0,1,0|1,0,1]=4 285 B17R2.143 O=C(Cc1ccccc1)NC2CCNCC2 Amb10205349 [0,1,0,0,1,0|1,0,1]=4 286 B17R2.143 O=C(Cc1ccccc1)NC2CCNCC2 Amb6251622 [0,1,0,0,1,0|1,0,1]=4 287 B17R2.143 O=C(Nc1ccccc1)NC2CCCCC2 Amb1195899 [0,1,0,0,1,0|1,0,1]=4 288 B17R2.216 Brc1ccc(CCCC2CCCNC2)cc1 Amb33332190 [0,1,0,0,1,0|2,0,0]=4 289 B17R2.216 Brc1ccc(CCCC2CCNCC2)cc1 Amb33332151 [0,1,0,0,1,0|2,0,0]=4 290 B17R2.216 Brc1ccc(CCOC2CCCNC2)cc1 Amb33334093 [0,1,0,0,1,0|2,0,0]=4 291 B17R2.216 Brc1ccc(CCOC2CCNCC2)cc1 Amb33334092 [0,1,0,0,1,0|2,0,0]=4 292 B17R2.216 CC1CCC(CNCc2ccccc2)CC1 Amb27410866 [0,1,0,0,1,0|2,0,0]=4 293 B17R2.216 CC1CCC(NOCc2ccccc2)CN1 Amb27867708 [0,1,0,0,1,0|2,0,0]=4 294 B17R2.216 CN1CCC(NCCc2ccccc2)CC1 Amb6355660 [0,1,0,0,1,0|1,0,0]=3 295 B17R2.216 CN1CCC(NCCc2ccccc2)CC1 Amb8468239 [0,1,0,0,1,0|1,0,0]=3 296 B17R2.216 Cc1ccc(CCCC2CCCNC2)cc1 Amb18570265 [0,1,0,0,1,0|2,0,0]=4 297 B17R2.216 Cc1ccc(CCCC2CCNCC2)cc1 Amb18570264 [0,1,0,0,1,0|2,0,0]=4 298 B17R2.216 Cc1ccc(CCNC2CCCCC2)cc1 Amb17242902 [0,1,0,0,1,0|0,0,0]=2 299 B17R2.216 Cc1ccc(CNCC2CCCCC2)cc1 Amb6623253 [0,1,0,0,1,0|2,0,0]=4 300 B17R2.216 Clc1ccc(CCCC2CCCNC2)cc1 Amb18071315 [0,1,0,0,1,0|2,0,0]=4 301 B17R2.216 Clc1ccc(CCCC2CCNCC2)cc1 Amb18071314 [0,1,0,0,1,0|2,0,0]=4 302 B17R2.216 Clc1ccc(CCNC2CCCCC2)cc1 Amb6629972 [0,1,0,0,1,0|0,0,0]=2 303 B17R2.216 Fc1ccc(CCCC2CCCNC2)cc1 Amb18068817 [0,1,0,0,1,0|2,0,0]=4 304 B17R2.216 Fc1ccc(CCCC2CCNCC2)cc1 Amb18068816 [0,1,0,0,1,0|2,0,0]=4 305 B17R2.216 Fc1ccc(CCNC2CCCCC2)cc1 Amb6689453 [0,1,0,0,1,0|0,0,0]=2 306 B17R2.216 Fc1ccc(CCOC2CCCNC2)cc1 Amb33319208 [0,1,0,0,1,0|2,0,0]=4 307 B17R2.216 Fc1ccc(CCOC2CCNCC2)cc1 Amb10576308 [0,1,0,0,1,0|2,0,0]=4 308 B17R2.216 NC1CCN(CCCc2ccccc2)CC1 Amb5757213 [0,1,0,0,1,0|2,0,0]=4 309 B17R2.216 NC1CCN(CCCc2ccccc2)CC1 Amb7969741 [0,1,0,0,1,0|2,0,0]=4 310 B17R2.216 Nc1ccc(CCCN2CCCCC2)cc1 Amb17050733 [0,1,0,0,1,0|2,0,0]=4 311 B17R2.216 Nc1ccc(OCCC2CCCCC2)cc1 Amb2098776 [0,1,0,0,1,0|2,0,0]=4 312 B17R2.216 OC1CCC(COCc2ccccc2)CC1 Amb27421465 [0,1,0,0,1,0|2,0,0]=4 313 B17R2.216 OC1CCN(CCCc2ccccc2)CC1 Amb13977376 [0,1,0,0,1,0|2,0,0]=4 314 B17R2.216 O[C@H]1CC[C@@H](CNCc2ccccc2)CC1 Amb27815163 [0,1,0,0,1,0|2,0,0]=4 315 B17R2.216 O[C@H]1CC[C@@H](COCc2ccccc2)CC1 Amb27211126 [0,1,0,0,1,0|2,0,0]=4 316 B17R2.216 O[C@H]1CC[C@H](COCc2ccccc2)CC1 Amb27421597 [0,1,0,0,1,0|2,0,0]=4 317 B17R2.2342 CC(CCc1ccccc1)C2CCNCC2 Amb32951866 [0,1,0,0,1,0|2,0,0]=4 318 B17R2.2342 CC(CNC1CCCCC1)c2ccccc2 Amb6617053 [0,1,0,0,1,0|0,0,0]=2 319 B17R2.2342 CC(NCC1CCCCC1)c2ccccc2 Amb1835391 [0,1,0,0,1,0|2,0,0]=4 320 B17R2.2342 CC(NCC1CCCCC1)c2ccccc2 Amb6537900 [0,1,0,0,1,0|2,0,0]=4 321 B17R2.2342 CN(CCc1ccccc1)C2CCNCC2 Amb8395708 [0,1,0,0,1,0|1,0,0]=3 322 B17R2.2342 ClC(CNC1CCCCC1)c2ccccc2 Amb17596517 [0,1,0,0,1,0|0,0,0]=2 323 B17R2.2342 NC(CCN1CCCCC1)c2ccccc2 Amb6715569 [0,1,0,0,1,0|2,0,0]=4 324 B17R2.2342 NC(CCc1ccccc1)C2CCCCC2 Amb17141037 [0,1,0,0,1,0|1,0,0]=3 325 B17R2.2342 NC(CCc1ccccc1)C2CCCNC2 Amb32687874 [0,1,0,0,1,0|2,0,0]=4 326 B17R2.2342 NC(CCc1ccccc1)C2CCNCC2 Amb32687875 [0,1,0,0,1,0|2,0,0]=4 327 B17R2.2342 O=C(CCc1ccccc1)C2CCCCC2 Amb6303746 [0,1,0,0,1,0|1,0,0]=3 328 B17R2.2342 O=C(CCc1ccccc1)C2CCCNC2 Amb10607455 [0,1,0,0,1,0|2,0,0]=4 329 B17R2.2342 O=C(CCc1ccccc1)C2CCNCC2 Amb17242861 [0,1,0,0,1,0|2,0,0]=4 330 B17R2.2342 O=C(CNC1CCCCC1)c2ccccc2 Amb17318154 [0,1,0,0,1,0|0,0,1]=3 331 B17R2.2342 O=C(NCc1ccccc1)C2CCCCC2 Amb6361048 [0,1,0,0,1,0|2,0,0]=4 332 B17R2.2342 O=C(OCc1ccccc1)C2CCCCC2 Amb26599141 [0,1,0,0,1,0|2,0,0]=4 333 B17R2.2342 OC(CCN1CCCCC1)c2ccccc2 Amb578757 [0,1,0,0,1,0|2,0,0]=4 334 B17R2.2342 OC(CCc1ccccc1)C2CCCCC2 Amb17141117 [0,1,0,0,1,0|1,0,0]=3 335 B17R2.2342 OC(CCc1ccccc1)C2CCNCC2 Amb10607457 [0,1,0,0,1,0|2,0,0]=4 336 B17R2.2342 OC(CNC1CCCCC1)c2ccccc2 Amb1785206 [0,1,0,0,1,0|0,0,0]=2 337 B17R2.2342 OC(CNC1CCCCC1)c2ccccn2 Amb17141340 [0,1,0,0,1,0|1,0,0]=3 338 B17R2.2342 OC(CNC1CCCCC1)c2cccnc2 Amb17141341 [0,1,0,0,1,0|1,0,0]=3 339 B17R2.2342 OC(CNC1CCCCC1)c2ccncc2 Amb17141342 [0,1,0,0,1,0|1,0,0]=3 340 B17R2.2342 OC(CNC1CCNCC1)c2ccccc2 Amb19008335 [0,1,0,0,1,0|1,0,0]=3 341 B17R2.3956 BrC1CCCCC1OCCc2ccccc2 Amb33349401 [0,1,0,0,1,0|1,0,0]=3 342 B17R2.3956 CC1CCCCC1CNCc2ccccc2 Amb27227475 [0,1,0,0,1,0|2,0,0]=4 343 B17R2.3956 CC1CCCCC1NOCc2ccccc2 Amb28255199 [0,1,0,0,1,0|1,0,0]=3 344 B17R2.3956 CC1COCCC1NOCc2ccccc2 Amb27213575 [0,1,0,0,1,0|2,0,0]=4 345 B17R2.3956 CC1NCCCC1NOCc2ccccc2 Amb27846858 [0,1,0,0,1,0|2,0,0]=4 346 B17R2.3956 Cc1ccccc1CCCC2CCCNC2 Amb18570261 [0,1,0,0,1,0|2,0,0]=4 347 B17R2.3956 Cc1ccccc1CCCC2CCNCC2 Amb18570260 [0,1,0,0,1,0|2,0,0]=4 348 B17R2.3956 Cc1ccccc1CCNC2CCCCC2 Amb17242893 [0,1,0,0,1,0|0,0,0]=2 349 B17R2.3956 ClC1CCCCC1CNCc2ccccc2 Amb27816137 [0,1,0,0,1,0|2,0,0]=4 350 B17R2.3956 Clc1ccccc1CCCC2CCCNC2 Amb18576661 [0,1,0,0,1,0|2,0,0]=4 351 B17R2.3956 Clc1ccccc1CCCC2CCNCC2 Amb18576660 [0,1,0,0,1,0|2,0,0]=4 352 B17R2.3956 Clc1ccccc1CCNC2CCCCC2 Amb17254019 [0,1,0,0,1,0|0,0,0]=2 353 B17R2.3956 Fc1ccccc1CCCC2CCCNC2 Amb21968450 [0,1,0,0,1,0|2,0,0]=4 354 B17R2.3956 Fc1ccccc1CCCC2CCNCC2 Amb21968442 [0,1,0,0,1,0|2,0,0]=4 355 B17R2.3956 Fc1ccccc1CCNC2CCCCC2 Amb6693105 [0,1,0,0,1,0|0,0,0]=2 356 B17R2.3956 IC1CCCCC1OCCc2ccccc2 Amb32710186 [0,1,0,0,1,0|1,0,0]=3 357 B17R2.3956 Nc1ccccc1CCCN2CCCCC2 Amb17050684 [0,1,0,0,1,0|2,0,0]=4 358 B17R2.3956 Nc1ccccc1OCCC2CCCCC2 Amb20204041 [0,1,0,0,1,0|2,0,0]=4 359 B17R2.3956 OC1CCCCC1CNCc2ccccc2 Amb27251259 [0,1,0,0,1,0|2,0,0]=4 360 B17R2.3956 OC1CCCCC1NOCc2ccccc2 Amb27611589 [0,1,0,0,1,0|1,0,0]=3 361 B17R2.3956 O[C@H]1CCCC[C@H]1CNCc2ccccc2 Amb6357281 [0,1,0,0,1,0|2,0,0]=4 362 B17R2.5301 Brc1cccc(CCCC2CCCNC2)c1 Amb33435394 [0,1,0,0,1,0|2,0,0]=4 363 B17R2.5301 Brc1cccc(CCCC2CCNCC2)c1 Amb33435395 [0,1,0,0,1,0|2,0,0]=4 364 B17R2.5301 Brc1cccc(CCOC2CCCNC2)c1 Amb33434409 [0,1,0,0,1,0|2,0,0]=4 365 B17R2.5301 Brc1cccc(CCOC2CCNCC2)c1 Amb33434408 [0,1,0,0,1,0|2,0,0]=4 366 B17R2.5301 Cc1cccc(CCCC2CCCNC2)c1 Amb18570263 [0,1,0,0,1,0|2,0,0]=4 367 B17R2.5301 Cc1cccc(CCCC2CCNCC2)c1 Amb18570262 [0,1,0,0,1,0|2,0,0]=4 368 B17R2.5301 Cc1cccc(CCNC2CCCCC2)c1 Amb17242898 [0,1,0,0,1,0|0,0,0]=2 369 B17R2.5301 Clc1cccc(CCCC2CCCNC2)c1 Amb18071313 [0,1,0,0,1,0|2,0,0]=4 370 B17R2.5301 Clc1cccc(CCCC2CCNCC2)c1 Amb18071312 [0,1,0,0,1,0|2,0,0]=4 371 B17R2.5301 Clc1cccc(CCNC2CCCCC2)c1 Amb17254024 [0,1,0,0,1,0|0,0,0]=2 372 B17R2.5301 Fc1cccc(CCCC2CCCNC2)c1 Amb18068815 [0,1,0,0,1,0|2,0,0]=4 373 B17R2.5301 Fc1cccc(CCCC2CCNCC2)c1 Amb18570921 [0,1,0,0,1,0|2,0,0]=4 374 B17R2.5301 NC1CCCC(NOCc2ccccc2)C1 Amb27954839 [0,1,0,0,1,0|1,0,0]=3 375 B17R2.5301 NC1CCCN(CCCc2ccccc2)C1 Amb17471660 [0,1,0,0,1,0|2,0,0]=4 376 B17R2.5301 Nc1cccc(CCCN2CCCCC2)c1 Amb17050709 [0,1,0,0,1,0|2,0,0]=4 377 B17R2.5301 Nc1cccc(CCNC2CCCCC2)c1 Amb18050980 [0,1,0,0,1,0|0,0,0]=2 378 B17R2.5301 O[C@@H]1CCCC(CNCc2ccccc2)C1 Amb28251232 [0,1,0,0,1,0|2,0,0]=4 379 B17R2.24812 CC1(OCCc2ccccc2)CCNCC1 Amb33082323 [0,1,0,0,1,0|2,0,0]=4 380 B17R2.24812 FC1(CCCc2ccccc2)CCNCC1 Amb33967399 [0,1,0,0,1,0|2,0,0]=4 381 B17R2.24812 NC1(CCOc2ccccc2)CCCCC1 Amb17074992 [0,1,0,0,1,0|2,0,0]=4 382 B17R2.24812 OC1(CCCc2ccccc2)CCCNC1 Amb33082997 [0,1,0,0,1,0|2,0,0]=4 383 B17R2.24812 OC1(CCCc2ccccc2)CCNCC1 Amb32954526 [0,1,0,0,1,0|2,0,0]=4 384 B17R2.24812 OC1(CNCc2ccccc2)CCCCC1 Amb19006536 [0,1,0,0,1,0|2,0,0]=4 385 B17R2.3395 BrC1CCCCCC1OCc2ccccc2 Amb26514675 [0,1,0,0,1,0|1,0,0]=3 386 B17R2.3395 CC1CCNCCN1CCc2ccccc2 Amb17579943 [0,1,0,0,1,0|2,0,0]=4 387 B17R2.3395 IC1CCCCCC1OCc2ccccc2 Amb25215900 [0,1,0,0,1,0|1,0,0]=3 388 B17R2.3395 O=C1NCCCC[C@@H]1NCc2ccccc2 Amb27879547 [0,1,0,0,1,0|1,0,1]=4 389 B17R2.3395 O=C1NCCCC[C@H]1NCc2ccccc2 Amb25049296 [0,1,0,0,1,0|1,0,1]=4 390 B17R2.3395 O[C@@H]1CCCCC[C@H]1NCc2ccccc2 Amb27458806 [0,1,0,0,1,0|0,0,0]=2 391 B17R2.19530 Cc1cccc(CCN2CCCNCC2)c1 Amb17243426 [0,1,0,0,1,0|2,0,0]=4 392 B17R2.19530 Cc1cccc(CNC2CCCCCC2)c1 Amb6622605 [0,1,0,0,1,0|0,0,0]=2 393 B17R2.19530 Clc1cccc(CCN2CCCNCC2)c1 Amb17254549 [0,1,0,0,1,0|2,0,0]=4 394 B17R2.19530 Clc1cccc(CNC2CCCCCC2)c1 Amb6654311 [0,1,0,0,1,0|0,0,0]=2 395 B17R2.19530 Nc1cccc(CCN2CCCCCC2)c1 Amb17050653 [0,1,0,0,1,0|1,0,0]=3 396 B17R2.19530 Nc1cccc(CCN2CCCNCC2)c1 Amb18050282 [0,1,0,0,1,0|2,0,0]=4 397 B17R2.19530 Oc1cccc(CCN2CCCCCC2)c1 Amb17511220 [0,1,0,0,1,0|1,0,0]=3 398 B17R2.19530 Oc1cccc(CNC2CCCCCC2)c1 Amb6723845 [0,1,0,0,1,0|0,0,0]=2 399 B17R2.19966 CC1CN(CCc2ccccc2)CCCN1 Amb17579934 [0,1,0,0,1,0|2,0,0]=4 400 B17R2.19966 CC1CNCCN(CCc2ccccc2)C1 Amb18979353 [0,1,0,0,1,0|2,0,0]=4 401 B17R2.20642 Brc1ccccc1CNC2CCCCCC2 Amb6723850 [0,1,0,0,1,0|0,0,0]=2 402 B17R2.20642 Cc1ccccc1CCN2CCCNCC2 Amb17243423 [0,1,0,0,1,0|2,0,0]=4 403 B17R2.20642 Cc1ccccc1CNC2CCCCCC2 Amb6656968 [0,1,0,0,1,0|0,0,0]=2 404 B17R2.20642 Clc1ccccc1CCN2CCCNCC2 Amb17254546 [0,1,0,0,1,0|2,0,0]=4 405 B17R2.20642 Clc1ccccc1CNC2CCCCCC2 Amb6657453 [0,1,0,0,1,0|0,0,0]=2 406 B17R2.20642 Fc1ccccc1CCN2CCCNCC2 Amb17245683 [0,1,0,0,1,0|2,0,0]=4 407 B17R2.20642 Fc1ccccc1CNC2CCCCCC2 Amb6697908 [0,1,0,0,1,0|0,0,0]=2 408 B17R2.20642 Nc1ccccc1CCN2CCCCCC2 Amb5733555 [0,1,0,0,1,0|1,0,0]=3 409 B17R2.24159 CC1CCCC(NCc2ccccc2)CC1 Amb27611575 [0,1,0,0,1,0|0,0,0]=2 410 B17R2.24159 CC1CCN(CCc2ccccc2)CCN1 Amb18979354 [0,1,0,0,1,0|2,0,0]=4 411 B17R2.24159 CN1CCCC(NCc2ccccc2)CC1 Amb28352206 [0,1,0,0,1,0|1,0,0]=3 412 B17R2.24159 O=C1CCCC(OCc2ccccc2)CC1 Amb24698830 [0,1,0,0,1,0|1,0,1]=4 413 B17R2.24159 OC1C=CC(NCc2ccccc2)CCC1 Amb28068876 [0,1,0,0,1,0|0,0,2]=4 414 B17R2.45538 CC(CN1CCCNCC1)c2ccccc2 Amb17243420 [0,1,0,0,1,0|2,0,0]=4 415 B17R2.45538 ClC(CN1CCCCCC1)c2ccccc2 Amb17546746 [0,1,0,0,1,0|1,0,0]=3 416 B17R2.45538 NC(CN1CCCCCC1)c2ccccc2 Amb1138695 [0,1,0,0,1,0|1,0,0]=3 417 B17R2.45538 N[C@@H](CC1CCCCCC1)c2ncccn2 Amb32716319 [0,1,0,0,1,0|2,0,0]=4 418 B17R2.45538 O=C(CC1CCCCCN1)c2ccccc2 Amb20622588 [0,1,0,0,1,0|1,0,1]=4 419 B17R2.45538 O=C(CC1CCCCCN1)c2ccccc2 Amb22157209 [0,1,0,0,1,0|1,0,1]=4 420 B17R2.45538 O=C(CN1CCCCCC1)c2ccccc2 Amb9216822 [0,1,0,0,1,0|1,0,1]=4 421 B17R2.45538 OC(CC1CCCCCN1)c2ccccc2 Amb20622711 [0,1,0,0,1,0|1,0,0]=3 422 B17R2.45538 OC(CN1CCCCCC1)c2ccccc2 Amb579194 [0,1,0,0,1,0|1,0,0]=3 423 B17R2.45538 OC(CN1CCCCCC1)c2ccccn2 Amb17141347 [0,1,0,0,1,0|2,0,0]=4 424 B17R2.45538 OC(CN1CCCCCC1)c2cccnc2 Amb17141349 [0,1,0,0,1,0|2,0,0]=4 425 B17R2.45538 OC(CN1CCCCCC1)c2ccncc2 Amb17141351 [0,1,0,0,1,0|2,0,0]=4 426 B17R2.45538 OC(CN1CCCNCC1)c2ccccc2 Amb18036028 [0,1,0,0,1,0|2,0,0]=4 427 B17R2.45575 CN(Cc1ccccc1)C2CCCNCC2 Amb22059340 [0,1,0,0,1,0|1,0,0]=3 428 B17R2.45575 CN(Cc1ccccn1)C2CCCNCC2 Amb33212437 [0,1,0,0,1,0|2,0,0]=4 429 B17R2.45575 CN(Cc1ccccn1)C2CCCNCC2 Amb33266025 [0,1,0,0,1,0|2,0,0]=4 430 B17R2.45575 O=C(Nc1ccccc1)C2CCCCCC2 Amb35788381 [0,1,0,0,1,0|1,0,1]=4 431 B17R2.57108 Cc1ccc(CCN2CCCNCC2)cc1 Amb17243428 [0,1,0,0,1,0|2,0,0]=4 432 B17R2.57108 Cc1ccc(CNC2CCCCCC2)cc1 Amb6620281 [0,1,0,0,1,0|0,0,0]=2 433 B17R2.57108 Clc1ccc(CCN2CCCNCC2)cc1 Amb17254542 [0,1,0,0,1,0|2,0,0]=4 434 B17R2.57108 Clc1ccc(CNC2CCCCCC2)cc1 Amb6615538 [0,1,0,0,1,0|0,0,0]=2 435 B17R2.57108 Fc1ccc(CCN2CCCNCC2)cc1 Amb17245680 [0,1,0,0,1,0|2,0,0]=4 436 B17R2.57108 Fc1ccc(CNC2CCCCCC2)cc1 Amb6697093 [0,1,0,0,1,0|0,0,0]=2 437 B17R2.57108 Nc1ccc(CCN2CCCCCC2)cc1 Amb2722136 [0,1,0,0,1,0|1,0,0]=3 438 B17R2.57108 Nc1ccc(CCN2CCCNCC2)cc1 Amb18549645 [0,1,0,0,1,0|2,0,0]=4 439 B17R2.57108 Oc1ccc(CCN2CCCCCC2)cc1 Amb17511250 [0,1,0,0,1,0|1,0,0]=3 440 B17R2.57108 Oc1ccc(CNC2CCCCCC2)cc1 Amb6723795 [0,1,0,0,1,0|0,0,0]=2 441 B17R2.167379 OC1(C#Cc2ccccc2)CCCCCC1 Amb3378425 [0,1,0,0,1,0|0,0,2]=4 442 B17R2.45682 OC(CNC1CCCCCC1)c2ccco2 Amb17141780 [0,1,0,0,1,0|1,0,0]=3 443 B17R2.45682 OC(CNC1CCCCCC1)c2cccs2 Amb17158843 [0,1,0,0,1,0|1,0,0]=3 444 B19R2.5548 OC1CCCCCCC1CNCc2ccccc2 Amb27272642 [0,1,0,0,0,1|2,0,0]=4 445 B19R2.5548 O[C@H]1CCCCCC[C@H]1CNCc2ccccc2 Amb27273342 [0,1,0,0,0,1|2,0,0]=4 446 B19R2.48105 Nc1cccc(CCNC2CCCCCCC2)c1 Amb18050981 [0,1,0,0,0,1|0,0,0]=2 447 B19R2.113678 CN(Cc1ccccc1)CC2CCCCCCN2 Amb28351236 [0,1,0,0,0,1|2,0,0]=4 448 B19R2.210909 O=C(NCc1ccccc1)C2CCCCCCC2 Amb27189280 [0,1,0,0,0,1|2,0,0]=4 449 B19R2.151669 Fc1ccc(CNCCN2CCCCCC2)cc1 Amb23915137 [0,1,0,0,0,1|2,0,0]=4 450 B19R2.210921 N=C(NCc1ccccc1)NC2CCCSCC2 Amb35684863 [0,1,0,0,0,1|1,0,1]=4 451 B19R2.210921 O=C(CNc1ccccc1)NC2CCCCCC2 Amb15965875 [0,1,0,0,0,1|0,0,1]=3 452 B19R2.210921 O=C(NC1CCCCNC1)OCc2ccccc2 Amb22233016 [0,1,0,0,0,1|1,0,1]=4 453 B19R2.210921 O=C(NC1CCCOCC1)OCc2ccccc2 Amb27223032 [0,1,0,0,0,1|1,0,1]=4 454 B19R2.210921 O=C(NCc1ccccc1)NC2CCCNCC2 Amb27639159 [0,1,0,0,0,1|1,0,1]=4 455 B19R2.210921 O=C(NCc1ccccc1)NC2CCCOCC2 Amb28430403 [0,1,0,0,0,1|1,0,1]=4 456 B19R2.210921 O=C(NCc1ccccc1)NC2CCCSCC2 Amb35692784 [0,1,0,0,0,1|1,0,1]=4 457 B19R2.210921 O=C(N[C@H]1CCCCNC1)OCc2ccccc2 Amb23401464 [0,1,0,0,0,1|1,0,1]=4 458 B19R2.210921 OC(COc1ccccc1)CN2CCCCCC2 Amb9784496 [0,1,0,0,0,1|2,0,0]=4 459 B19R2.1033509 O=C(NOCc1ccccc1)C2CCCCCC2 Amb27492071 [0,1,0,0,0,1|1,0,0]=3 460 B19R2.1033509 O=C(NOCc1ccccc1)N2CCCCCC2 Amb27986731 [0,1,0,0,0,1|2,0,0]=4 461 B19R2.7325 CN(Cc1ccccc1)CC2CCCCCC2N Amb17490357 [0,2,0,0,0,0|2,0,0]=4 462 B19R2.7325 CN(Cc1ccccc1)CC2CCCCCC2O Amb27674193 [0,2,0,0,0,0|2,0,0]=4 463 B19R2.14268 N#CC1CCCCCC1NOCc2ccccc2 Amb27818389 [0,2,0,0,0,0|1,0,0]=3 464 B19R2.150540 Nc1cc(CCCN2CCCCCC2)ccc1Cl Amb17227398 [0,2,0,0,0,0|2,0,0]=4 465 B19R2.150540 Nc1cc(CCCN2CCCCCC2)ccc1O Amb17227380 [0,2,0,0,0,0|2,0,0]=4 466 B19R2.483846 Nc1cccc(CC(=O)NC2CCCCCC2)c1 Amb17048910 [0,2,0,0,0,0|0,0,1]=3 467 B19R2.484029 Cc1cccc(C(O)CNC2CCCCCC2)c1 Amb17160170 [0,2,0,0,0,0|0,0,0]=2 468 B19R2.484029 Nc1cccc(C(=O)CNC2CCCCCC2)c1 Amb18051520 [0,2,0,0,0,0|0,0,1]=3 469 B19R2.484029 Nc1cccc(C(O)CCN2CCCCCC2)c1 Amb17220194 [0,2,0,0,0,0|2,0,0]=4 470 B19R2.484029 Nc1cccc(C(O)CNC2CCCCCC2)c1 Amb18875688 [0,2,0,0,0,0|0,0,0]=2 471 B19R2.484029 OC(CNC1CCCCCC1)c2cccc(Cl)c2 Amb17165909 [0,2,0,0,0,0|0,0,0]=2 472 B19R2.955196 Nc1cccc(CCC(=O)N2CCCCCC2)c1 Amb8941602 [0,2,0,0,0,0|2,0,0]=4 473 B19R2.555578 CC1(C)CCCC(NOCc2ccccc2)CC1 Amb27495072 [0,2,0,0,0,0|1,0,0]=3 474 B19R2.503619 Nc1ccccc1CCC(=O)N2CCCCCC2 Amb8941601 [0,2,0,0,0,0|2,0,0]=4 475 B19R2.503720 Nc1ccccc1CC(=O)NC2CCCCCC2 Amb8999154 [0,2,0,0,0,0|0,0,1]=3 476 B19R2.594269 Cc1ccccc1C(O)CNC2CCCCCC2 Amb17160169 [0,2,0,0,0,0|0,0,0]=2 477 B19R2.594269 Nc1ccccc1C(O)CCN2CCCCCC2 Amb17227404 [0,2,0,0,0,0|2,0,0]=4 478 B19R2.594269 OC(CNC1CCCCCC1)c2ccccc2Cl Amb17165908 [0,2,0,0,0,0|0,0,0]=2 479 B19R2.594269 OC(CNC1CCCCCC1)c2ccccc2F Amb17161243 [0,2,0,0,0,0|0,0,0]=2 480 B19R2.151823 CC(Cc1ccc(N)cc1)NC2CCCCCC2 Amb18050892 [0,2,0,0,0,0|0,0,0]=2 481 B19R2.151823 Nc1ccc(CC(=O)NC2CCCCCC2)cc1 Amb8858855 [0,2,0,0,0,0|0,0,1]=3 482 B19R2.1033353 CC(NC1CCCCCC1)C(O)c2ccccc2 Amb18092967 [0,2,0,0,0,0|0,0,0]=2 483 B19R2.1033353 N[C@@H](C(=O)NC1CCCCCC1)c2ccccc2 Amb18528242 [0,2,0,0,0,0|0,0,1]=3 484 B19R2.1033353 O=C(NC1CCCCCC1)C(=O)c2ccccc2 Amb17350204 [0,2,0,0,0,0|0,0,2]=4 485 B19R2.1033353 O=C(NC1CCCCCC1)C(Cl)c2ccccc2 Amb8999212 [0,2,0,0,0,0|0,0,1]=3 486 B19R2.1033353 O=C(NC1CCCCCC1)C(O)c2ccccc2 Amb17412033 [0,2,0,0,0,0|0,0,1]=3 487 B19R2.150147 Cc1ccc(C(O)CNC2CCCCCC2)cc1 Amb17160171 [0,2,0,0,0,0|0,0,0]=2 488 B19R2.150147 Nc1ccc(C(=O)CNC2CCCCCC2)cc1 Amb18051498 [0,2,0,0,0,0|0,0,1]=3 489 B19R2.150147 Nc1ccc(C(O)CCN2CCCCCC2)cc1 Amb17220161 [0,2,0,0,0,0|2,0,0]=4 490 B19R2.150147 O=C(CNC1CCCCCC1)c2ccc(F)cc2 Amb17314110 [0,2,0,0,0,0|0,0,1]=3 491 B19R2.150147 OC(CNC1CCCCCC1)c2ccc(Cl)cc2 Amb17165910 [0,2,0,0,0,0|0,0,0]=2 492 B19R2.150147 OC(CNC1CCCCCC1)c2ccc(F)cc2 Amb17161244 [0,2,0,0,0,0|0,0,0]=2 493 B19R2.150671 Nc1ccc(CCC(=O)N2CCCCCC2)cc1 Amb8941603 [0,2,0,0,0,0|2,0,0]=4 494 B19R2.444023 N#CC(NCc1ccccc1)C2CCCCCC2 Amb27266254 [0,2,0,0,0,0|2,0,0]=4 495 B19R2.3146392 NC1(C(=O)OCc2ccccc2)CCCCCC1 Amb28386917 [0,2,0,0,0,0|2,0,0]=4 496 B19R2.319398 N#CC1(COCc2ccccc2)CCCCCC1 Amb28351050 [0,2,0,0,0,0|2,0,0]=4 497 B17R2.3 CCCCCCCn1cnc2ccccc21 Amb1744549 [0,0,1,1,0,0|1,0,1]=4 498 B17R2.3 NCCCCCCN1CCc2ccccc21 Amb2613446 [0,0,1,1,0,0|1,0,0]=3 499 B17R2.87 CCCC1CCCCN1Cc2ccccc2 Amb27260303 [0,0,1,1,0,0|2,0,0]=4 500 B17R2.242 COCCN1CCNCC1c2ccccc2 Amb17580127 [0,0,1,1,0,0|2,0,0]=4 501 B17R2.262 OCC1CNCCN1CCc2ccccc2 Amb17580132 [0,0,1,1,0,0|2,0,0]=4 502 B17R2.1085 CCC1CCNC1CCCc2ccccc2 Amb3789299 [0,0,1,1,0,0|2,0,0]=4 503 B17R2.1085 NCC1CCCC1NOCc2ccccc2 Amb27464267 [0,0,1,1,0,0|2,0,0]=4 504 B17R2.2382 c1ccc(CCNCC2CCCCC2)cc1 Amb6695474 [0,0,1,1,0,0|0,0,0]=2 505 B17R2.2382 c1ccc(CCOCC2CCNCC2)cc1 Amb10576307 [0,0,1,1,0,0|2,0,0]=4 506 B17R2.2382 c1ccc(CCOCC2CCNCC2)cc1 Amb5837362 [0,0,1,1,0,0|2,0,0]=4 507 B17R2.2382 c1ccc(CNCCC2CCCCC2)cc1 Amb27591474 [0,0,1,1,0,0|2,0,0]=4 508 B17R2.2382 c1ccc(CONCC2CCCSC2)cc1 Amb28066321 [0,0,1,1,0,0|2,0,0]=4 509 B17R2.2382 c1ccc(CONCC2CCNCC2)cc1 Amb27228435 [0,0,1,1,0,0|2,0,0]=4 510 B17R2.3290 CCCNCCC1CC1Cc2ccccc2 Amb33229830 [0,0,1,1,0,0|2,0,0]=4 511 B17R2.7393 c1ccc(CNC2CCCCCCC2)cc1 Amb5261845 [0,0,1,1,0,0|2,0,0]=4 512 B17R2.7398 c1cnc2c(c1)CCCCCCCCCC2 Amb6356795 [0,0,1,1,0,0|2,0,0]=4 513 B17R2.9156 c1ccc(CONCCCNC2CC2)cc1 Amb28067121 [0,0,1,1,0,0|2,0,0]=4 514 B17R2.145 CCCN1CC(C)NCC1c2ccccc2 Amb17579902 [0,0,1,1,0,0|1,0,0]=3 515 B17R2.4462 CCOC1CC(NOCc2ccccc2)C1 Amb27470535 [0,0,1,1,0,0|2,0,0]=4 516 B17R2.5714 CC(NOCc1ccccc1)C2CCNC2 Amb27785984 [0,0,1,1,0,0|2,0,0]=4 517 B17R2.5714 CC(NOCc1ccccc1)C2CCOC2 Amb27452811 [0,0,1,1,0,0|2,0,0]=4 518 B17R2.81378 BrCC1(OCCc2ccccc2)CCCC1 Amb33349276 [0,0,1,1,0,0|2,0,0]=4 519 B17R2.81378 ICC1(OCCc2ccccc2)CCCC1 Amb32710253 [0,0,1,1,0,0|2,0,0]=4 520 B17R2.81378 N#CC1(NCCc2ccccc2)CCCC1 Amb17044981 [0,0,1,1,0,0|1,0,1]=4 521 B17R2.81378 OCC1(NCCc2ccccc2)CCCC1 Amb20667613 [0,0,1,1,0,0|1,0,0]=3 522 B17R2.47256 CCCC1(CNCc2ccccc2)CCC1 Amb28137016 [0,0,1,1,0,0|2,0,0]=4 523 B17R3.8 c1ccc(C2CNC3=C2CCCC3)cc1 Amb17595290 [0,0,0,1,1,0|0,0,2]=4 524 B17R3.8 c1ccc(C2CNC3CCCCC32)cc1 Amb9783189 [0,0,0,1,1,0|0,0,0]=2 525 B17R3.8 c1ccc(C2CNC3CCOCC32)cc1 Amb32652113 [0,0,0,1,1,0|1,0,0]=3 526 B17R3.8 c1ccc2c(c1)CCC2C3CCCCN3 Amb33146060 [0,0,0,1,1,0|2,0,0]=4 527 B17R3.8 c1ccc2c(c1)CCC2C3CCCNC3 Amb33146118 [0,0,0,1,1,0|2,0,0]=4 528 B17R3.8 c1ccc2c(c1)CCC2C3CCNCC3 Amb18669537 [0,0,0,1,1,0|2,0,0]=4 529 B17R3.8 c1ccc2c(c1)CCN2C3CCNCC3 Amb21957926 [0,0,0,1,1,0|1,0,0]=3 530 B17R3.8 c1ccc2c(c1)CCN2C3CCNCC3 Amb33532867 [0,0,0,1,1,0|1,0,0]=3 531 B17R3.8 c1ccc2c(c1)NCC2C3CCCCC3 Amb32405757 [0,0,0,1,1,0|2,0,0]=4 532 B17R3.8 c1ccc2c(c1)ncn2C3CCCCC3 Amb2241423 [0,0,0,1,1,0|1,0,1]=4 533 B17R3.8 c1ccc2c(c1)nnn2C3CCCCC3 Amb10560120 [0,0,0,1,1,0|2,0,0]=4 534 B17R3.1921 c1ccc(CNC2C3CCCCC32)cc1 Amb28322125 [0,0,0,1,1,0|2,0,0]=4 535 B17R3.1938 c1ccc(CNCC2C3CCCC32)cc1 Amb27803335 [0,0,0,1,1,0|2,0,0]=4 536 B17R3.8701 c1ccc(C2NCC23CCCCC3)cc1 Amb28906300 [0,0,0,1,1,0|2,0,0]=4 537 B17R3.8750 c1ccc(CONC2CC[C@@H]3C[C@H]23)cc1 Amb27842973 [0,0,0,1,1,0|1,0,0]=3 538 B17R3.127936 c1ccc2c(c1)CCCC23CCCNC3 Amb20667631 [0,0,0,1,1,0|2,0,0]=4 539 B17R3.127936 c1ccc2c(c1)CCCC23CCNCC3 Amb13888247 [0,0,0,1,1,0|2,0,0]=4 540 B17R3.127936 c1ccc2c(c1)CCCC23CCNCC3 Amb13888544 [0,0,0,1,1,0|2,0,0]=4 541 B17R3.127936 c1ccc2c(c1)CCOC23CCNCC3 Amb20171382 [0,0,0,1,1,0|2,0,0]=4 542 B17R3.127936 c1ccc2c(c1)CCOC23CCNCC3 Amb20203703 [0,0,0,1,1,0|2,0,0]=4 543 B17R3.127936 c1ccc2c(c1)CCOC23CCNCC3 Amb24184211 [0,0,0,1,1,0|2,0,0]=4 544 B17R3.127936 c1ccc2c(c1)CNCC23CCCCC3 Amb17106476 [0,0,0,1,1,0|2,0,0]=4 545 B17R3.8717 c1ccc(CNC2CCCC3CC32)cc1 Amb27596182 [0,0,0,1,1,0|0,0,0]=2 546 B17R3.8729 c1ccc(CNC2CCC3CC3C2)cc1 Amb35679948 [0,0,0,1,1,0|0,0,0]=2 547 B17R3.8730 c1ccc(CNC2C[C@H]3CCC[C@@H]23)cc1 Amb32698073 [0,0,0,1,1,0|0,0,0]=2 548 B17R3.8762 c1ccc(CN2C3CCC2CNC3)cc1 Amb10601688 [0,0,0,1,1,0|1,0,0]=3 549 B17R3.8762 c1ccc(CN2C3CCC2CNC3)cc1 Amb21964034 [0,0,0,1,1,0|1,0,0]=3 550 B17R3.8762 c1ccc(CN2C3CCC2COC3)cc1 Amb24183635 [0,0,0,1,1,0|1,0,0]=3 551 B17R3.8762 c1ccc(CN2[C@H]3CC[C@@H]2CNC3)cc1 Amb25841012 [0,0,0,1,1,0|1,0,0]=3 552 B17R3.8762 c1ccc(CN2[C@H]3CC[C@@H]2COC3)cc1 Amb22756621 [0,0,0,1,1,0|1,0,0]=3 553 B17R3.9112 c1ccc2c(c1)COC23CCCNCC3 Amb22263556 [0,0,0,1,1,0|2,0,0]=4 554 B17R3.9114 c1ccc(C2OC23CCCCCC3)cc1 Amb10606552 [0,0,0,1,1,0|1,0,0]=3 555 B17R3.120952 c1ccc(CNC23CCCCC2C3)cc1 Amb30017322 [0,0,0,1,1,0|0,0,0]=2 556 B17R3.123661 c1cc2c(o1)C3(CCCCCC3)NCC2 Amb32647816 [0,0,0,1,1,0|1,0,0]=3 557 B17R3.123661 c1cc2c(o1)C3(CCCOCC3)NCC2 Amb32647745 [0,0,0,1,1,0|2,0,0]=4 558 B17R3.123661 c1cc2c(o1)C3(CCCSCC3)NCC2 Amb32647943 [0,0,0,1,1,0|2,0,0]=4 559 B17R3.123661 c1cc2c(o1)CCNC23CCCCCC3 Amb32647481 [0,0,0,1,1,0|1,0,0]=3 560 B17R3.123661 c1cc2c(o1)CCNC23CCCOCC3 Amb32647418 [0,0,0,1,1,0|2,0,0]=4 561 B17R3.123661 c1cc2c(o1)CCNC23CCCSCC3 Amb32647612 [0,0,0,1,1,0|2,0,0]=4 562 B17R3.123661 c1cc2c(s1)C3(CCCCCC3)NCC2 Amb32646950 [0,0,0,1,1,0|1,0,0]=3 563 B17R3.123661 c1cc2c(s1)C3(CCCOCC3)NCC2 Amb32646884 [0,0,0,1,1,0|2,0,0]=4 564 B17R3.123661 c1cc2c(s1)C3(CCCSCC3)NCC2 Amb32647065 [0,0,0,1,1,0|2,0,0]=4 565 B17R3.123661 c1cc2c(s1)CCNC23CCCCCC3 Amb32646540 [0,0,0,1,1,0|1,0,0]=3 566 B17R3.123661 c1cc2c(s1)CCNC23CCCOCC3 Amb32646497 [0,0,0,1,1,0|2,0,0]=4 567 B17R3.123661 c1cc2c(s1)CCNC23CCCSCC3 Amb32647323 [0,0,0,1,1,0|2,0,0]=4 568 B19R3.1761485 c1ccc(CN2CCC3CCCNCC32)cc1 Amb27853131 [0,0,0,1,0,1|2,0,0]=4 569 B19R3.1761485 c1ccc(CN2CC[C@@H]3CCCNC[C@H]32)cc1 Amb18752269 [0,0,0,1,0,1|2,0,0]=4 570 B19R3.1761485 c1ccc(CN2CC[C@@H]3CCNCC[C@H]32)cc1 Amb18752268 [0,0,0,1,0,1|2,0,0]=4 571 B19R3.1761485 c1ccc(CN2CC[C@@H]3CNCCC[C@H]32)cc1 Amb18752271 [0,0,0,1,0,1|2,0,0]=4 572 B19R3.19241 c1ccc(CONC2CCN3CCC2C3)cc1 Amb27197670 [0,1,0,1,0,0|2,0,0]=4 573 B19R3.8930 O=C1CC2CCC(C1)N2CCc3ccccc3 Amb29082925 [0,1,0,1,0,0|0,0,1]=3 574 B19R3.3008068 Nc1cccc2c1cnn2C3CCCCCC3 Amb33217994 [0,1,0,1,0,0|1,0,1]=4 575 B19R3.158561 O=C1Nc2ccccc2N1C3CCCCCC3 Amb18538733 [0,1,0,1,0,0|1,0,1]=4 576 B19R3.681041 O=C(Cc1ccccc1)NC23CCC2CNC3 Amb32678857 [0,1,0,1,0,0|1,0,1]=4 577 B19R3.16967 O=C(NCc1ccccc1)C2C3CCCCC32 Amb9681668 [0,1,0,1,0,0|2,0,0]=4 578 B19R3.16972 O=C(NCc1ccccc1)C2CCC3CC3C2 Amb35678610 [0,1,0,1,0,0|2,0,0]=4 579 B19R3.90881 O=C1NC(c2ccccc2)C13CCCCCC3 Amb32665311 [0,1,0,1,0,0|2,0,0]=4 580 B19R3.1696735 O=C(NCc1ccccc1)C23CCCCC2C3 Amb35692403 [0,1,0,1,0,0|2,0,0]=4 581 B19R3.1696742 O=C(NCc1ccccc1)C2CCCC3CC32 Amb35640031 [0,1,0,1,0,0|2,0,0]=4 582 B15R1.528 CCCCCCCCCCc1ccco1 Amb21963042 [0,0,1,0,1,0|2,0,0]=4 583 B15R1.528 CCCCCCCCCCc1ccsc1 Amb2696541 [0,0,1,0,1,0|2,0,0]=4 584 B15R1.78 C=CCCCC(C)NCc1ccccc1 Amb27767197 [0,0,1,0,1,0|0,0,2]=4 585 B15R1.78 CC(CCCCCl)NCc1ccccc1 Amb28346093 [0,0,1,0,1,0|1,0,0]=3 586 B15R1.78 CC(CCCCN)NCc1ccccc1 Amb28254223 [0,0,1,0,1,0|1,0,0]=3 587 B15R1.78 CC(CCc1ccccc1)NCCCO Amb6733614 [0,0,1,0,1,0|2,0,0]=4 588 B15R1.78 CCCCCC(=O)NCc1ccccc1 Amb3360906 [0,0,1,0,1,0|1,0,1]=4 589 B15R1.78 CCCCCC(C)NCc1ccccn1 Amb6721508 [0,0,1,0,1,0|1,0,0]=3 590 B15R1.78 CCCCC[C@@H](C)NCc1ccccc1 Amb27774019 [0,0,1,0,1,0|0,0,0]=2 591 B15R1.78 CCCCNC(C)COc1ccccc1 Amb4022456 [0,0,1,0,1,0|2,0,0]=4 592 B15R1.78 CCCNCC(C)OCc1ccccc1 Amb27268156 [0,0,1,0,1,0|2,0,0]=4 593 B15R1.78 CCSCCC(C)NCc1ccccc1 Amb27484291 [0,0,1,0,1,0|1,0,0]=3 594 B15R1.78 COCCNC(C)CCc1ccccc1 Amb6685614 [0,0,1,0,1,0|2,0,0]=4 595 B15R1.1376 CCCCCC(C)NCCc1cccs1 Amb6633561 [0,0,1,0,1,0|1,0,0]=3 596 B15R1.3919 CCCCC(CC)NCCc1cccs1 Amb33496389 [0,0,1,0,1,0|1,0,0]=3 597 B15R1.3921 CCCCC(CC)COc1ccccc1 Amb22493614 [0,0,1,0,1,0|1,0,0]=3 598 B15R1.3921 CCCCC(CC)NCc1ccccc1 Amb27495307 [0,0,1,0,1,0|0,0,0]=2 599 B15R1.3921 CCCCC(CC)NCc1ccccn1 Amb33496390 [0,0,1,0,1,0|1,0,0]=3 600 B15R1.3921 CCCCC(CC)NCc1cccnc1 Amb33496394 [0,0,1,0,1,0|1,0,0]=3 601 B15R1.3921 CCCC[C@@H](CO)NCc1ccccc1 Amb27767129 [0,0,1,0,1,0|1,0,0]=3 602 B15R1.3921 CSCCC(CN)NCc1ccccc1 Amb28062650 [0,0,1,0,1,0|2,0,0]=4 603 B15R1.3921 CSCCC(CO)NCc1ccccc1 Amb27635172 [0,0,1,0,1,0|2,0,0]=4 604 B15R1.3981 CCCC(CCC)NCCc1cccs1 Amb6697863 [0,0,1,0,1,0|1,0,0]=3 605 B15R1.3983 CCCC(CCC)NCc1ccccc1 Amb6687462 [0,0,1,0,1,0|0,0,0]=2 606 B15R1.3983 CCCC(CCC)NCc1ccccn1 Amb6699172 [0,0,1,0,1,0|1,0,0]=3 607 B15R1.3983 CCCC(CCC)NCc1cccnc1 Amb6729916 [0,0,1,0,1,0|1,0,0]=3 608 B15R1.3983 COCC(COC)NCc1ccccc1 Amb27252615 [0,0,1,0,1,0|2,0,0]=4 609 B15R1.3983 OCCC(CCO)NCc1ccccc1 Amb26380435 [0,0,1,0,1,0|2,0,0]=4 610 B15R2.2195 C1=C(CCc2ccccc2)CCCC1 Amb24573687 [0,0,0,0,2,0|0,0,2]=4 611 B15R2.2195 C1=C(NCc2ccccc2)CCCC1 Amb27971831 [0,0,0,0,2,0|0,0,2]=4 612 B15R2.2195 C1=CC(NCc2ccccc2)CCC1 Amb27790807 [0,0,0,0,2,0|0,0,2]=4 613 B15R2.2195 C1=CCC(NCc2ccccc2)CC1 Amb28119064 [0,0,0,0,2,0|0,0,2]=4 614 B15R2.2195 c1cc(CCC2CCCCN2)ccn1 Amb18564793 [0,0,0,0,2,0|2,0,0]=4 615 B15R2.2195 c1cc(CCC2CCCNC2)ccn1 Amb28411650 [0,0,0,0,2,0|2,0,0]=4 616 B15R2.2195 c1cc(CCC2CCNCC2)ccn1 Amb25074516 [0,0,0,0,2,0|2,0,0]=4 617 B15R2.2195 c1cc(CCC2CCNCC2)ccn1 Amb32916286 [0,0,0,0,2,0|2,0,0]=4 618 B15R2.2195 c1cc(CNC2CCCCC2)ccn1 Amb6336182 [0,0,0,0,2,0|1,0,0]=3 619 B15R2.2195 c1cc(CNC2CCCCC2)ncn1 Amb18996577 [0,0,0,0,2,0|2,0,0]=4 620 B15R2.2195 c1cc(CNC2CCNCC2)ccn1 Amb18971373 [0,0,0,0,2,0|2,0,0]=4 621 B15R2.2195 c1cc(CNC2CCOCC2)ccn1 Amb9472533 [0,0,0,0,2,0|2,0,0]=4 622 B15R2.2195 c1cc(NCC2CCCCC2)ccn1 Amb2383012 [0,0,0,0,2,0|2,0,0]=4 623 B15R2.2195 c1ccc(CCC2CCCCN2)cc1 Amb21955492 [0,0,0,0,2,0|1,0,0]=3 624 B15R2.2195 c1ccc(CCC2CCCCN2)cc1 Amb9768272 [0,0,0,0,2,0|1,0,0]=3 625 B15R2.2195 c1ccc(CCC2CCCCN2)nc1 Amb8009599 [0,0,0,0,2,0|2,0,0]=4 626 B15R2.2195 c1ccc(CCC2CCCNC2)cc1 Amb17234784 [0,0,0,0,2,0|1,0,0]=3 627 B15R2.2195 c1ccc(CCC2CCCNC2)nc1 Amb28136028 [0,0,0,0,2,0|2,0,0]=4 628 B15R2.2195 c1ccc(CCC2CCNCC2)cc1 Amb1678050 [0,0,0,0,2,0|1,0,0]=3 629 B15R2.2195 c1ccc(CCC2CCNCC2)cc1 Amb21955259 [0,0,0,0,2,0|1,0,0]=3 630 B15R2.2195 c1ccc(CCC2CCNCC2)nc1 Amb35826784 [0,0,0,0,2,0|2,0,0]=4 631 B15R2.2195 c1ccc(CCC2CNCCN2)cc1 Amb15695193 [0,0,0,0,2,0|2,0,0]=4 632 B15R2.2195 c1ccc(CCC2CNCCO2)cc1 Amb18559583 [0,0,0,0,2,0|2,0,0]=4 633 B15R2.2195 c1ccc(CCC2CNCCO2)cc1 Amb32411933 [0,0,0,0,2,0|2,0,0]=4 634 B15R2.2195 c1ccc(CCC2COCCN2)cc1 Amb18564883 [0,0,0,0,2,0|2,0,0]=4 635 B15R2.2195 c1ccc(CCN2CCCNC2)cc1 Amb18650670 [0,0,0,0,2,0|2,0,0]=4 636 B15R2.2195 c1ccc(CCN2CCNCC2)cc1 Amb1675352 [0,0,0,0,2,0|2,0,0]=4 637 B15R2.2195 c1ccc(CCN2CCNCC2)cc1 Amb6806665 [0,0,0,0,2,0|2,0,0]=4 638 B15R2.2195 c1ccc(CCN2CCOCC2)cc1 Amb4404766 [0,0,0,0,2,0|2,0,0]=4 639 B15R2.2195 c1ccc(CCN2CCSCC2)cc1 Amb26481920 [0,0,0,0,2,0|2,0,0]=4 640 B15R2.2195 c1ccc(CC[C@@H]2COCCN2)cc1 Amb32695510 [0,0,0,0,2,0|2,0,0]=4 641 B15R2.2195 c1ccc(CC[C@H]2CCCNC2)cc1 Amb28135487 [0,0,0,0,2,0|1,0,0]=3 642 B15R2.2195 c1ccc(CC[C@H]2CNCCN2)cc1 Amb15690735 [0,0,0,0,2,0|2,0,0]=4 643 B15R2.2195 c1ccc(CC[C@H]2CNCCO2)cc1 Amb28076955 [0,0,0,0,2,0|2,0,0]=4 644 B15R2.2195 c1ccc(CC[C@H]2COCCN2)cc1 Amb32695511 [0,0,0,0,2,0|2,0,0]=4 645 B15R2.2195 c1ccc(CNC2CCCCC2)cc1 Amb6399806 [0,0,0,0,2,0|0,0,0]=2 646 B15R2.2195 c1ccc(CNC2CCCCC2)nc1 Amb6336183 [0,0,0,0,2,0|1,0,0]=3 647 B15R2.2195 c1ccc(CNC2CCCNC2)cc1 Amb18980431 [0,0,0,0,2,0|1,0,0]=3 648 B15R2.2195 c1ccc(CNC2CCCOC2)cc1 Amb25331139 [0,0,0,0,2,0|1,0,0]=3 649 B15R2.2195 c1ccc(CNC2CCCSC2)cc1 Amb18301746 [0,0,0,0,2,0|1,0,0]=3 650 B15R2.2195 c1ccc(CNC2CCCSC2)nc1 Amb18999011 [0,0,0,0,2,0|2,0,0]=4 651 B15R2.2195 c1ccc(CNC2CCNCC2)cc1 Amb18971352 [0,0,0,0,2,0|1,0,0]=3 652 B15R2.2195 c1ccc(CNC2CCNCC2)cc1 Amb19892673 [0,0,0,0,2,0|1,0,0]=3 653 B15R2.2195 c1ccc(CNC2CCNCC2)nc1 Amb18971361 [0,0,0,0,2,0|2,0,0]=4 654 B15R2.2195 c1ccc(CNC2CCNCC2)nc1 Amb21964944 [0,0,0,0,2,0|2,0,0]=4 655 B15R2.2195 c1ccc(CNC2CCNCC2)nc1 Amb22272081 [0,0,0,0,2,0|2,0,0]=4 656 B15R2.2195 c1ccc(CNC2CCOCC2)cc1 Amb2683678 [0,0,0,0,2,0|1,0,0]=3 657 B15R2.2195 c1ccc(CNC2CCOCC2)nc1 Amb6760800 [0,0,0,0,2,0|2,0,0]=4 658 B15R2.2195 c1ccc(CNC2CCOCC2)nc1 Amb9472435 [0,0,0,0,2,0|2,0,0]=4 659 B15R2.2195 c1ccc(CNC2CCSCC2)nc1 Amb9248927 [0,0,0,0,2,0|2,0,0]=4 660 B15R2.2195 c1ccc(CNC2NCCCN2)cc1 Amb28123489 [0,0,0,0,2,0|2,0,0]=4 661 B15R2.2195 c1ccc(CNN2CCCCC2)nc1 Amb27267645 [0,0,0,0,2,0|2,0,0]=4 662 B15R2.2195 c1ccc(CNN2CCOCC2)cc1 Amb27201186 [0,0,0,0,2,0|2,0,0]=4 663 B15R2.2195 c1ccc(CN[C@@H]2CCCOC2)cc1 Amb28370538 [0,0,0,0,2,0|1,0,0]=3 664 B15R2.2195 c1ccc(CN[C@@H]2CCCOC2)nc1 Amb28125399 [0,0,0,0,2,0|2,0,0]=4 665 B15R2.2195 c1ccc(COC2CCCCO2)cc1 Amb22347804 [0,0,0,0,2,0|2,0,0]=4 666 B15R2.2195 c1ccc(COC2CCCNC2)cc1 Amb13948967 [0,0,0,0,2,0|2,0,0]=4 667 B15R2.2195 c1ccc(COC2CCCNC2)cc1 Amb3941330 [0,0,0,0,2,0|2,0,0]=4 668 B15R2.2195 c1ccc(COC2CCNCC2)cc1 Amb1694183 [0,0,0,0,2,0|2,0,0]=4 669 B15R2.2195 c1ccc(COC2CCNCC2)cc1 Amb22492328 [0,0,0,0,2,0|2,0,0]=4 670 B15R2.2195 c1ccc(COC2CCNCC2)cc1 Amb2699331 [0,0,0,0,2,0|2,0,0]=4 671 B15R2.2195 c1ccc(CO[C@@H]2CCCNC2)cc1 Amb27642370 [0,0,0,0,2,0|2,0,0]=4 672 B15R2.2195 c1ccc(CSC2CCCCC2)cc1 Amb4018886 [0,0,0,0,2,0|1,0,0]=3 673 B15R2.2195 c1ccc(CSC2CCCCC2)nc1 Amb26026299 [0,0,0,0,2,0|2,0,0]=4 674 B15R2.2195 c1ccc(CSC2CCNCC2)cc1 Amb17502145 [0,0,0,0,2,0|2,0,0]=4 675 B15R2.2195 c1ccc(CSC2CCNCC2)cc1 Amb35745763 [0,0,0,0,2,0|2,0,0]=4 676 B15R2.2195 c1ccc(NCC2CCCCC2)cc1 Amb32837042 [0,0,0,0,2,0|1,0,0]=3 677 B15R2.2195 c1ccc(NCC2CCCCC2)cc1 Amb4313930 [0,0,0,0,2,0|1,0,0]=3 678 B15R2.2195 c1ccc(NCC2CCCCC2)nc1 Amb33528303 [0,0,0,0,2,0|2,0,0]=4 679 B15R2.2195 c1ccc(NCC2CCCCN2)cc1 Amb18972359 [0,0,0,0,2,0|2,0,0]=4 680 B15R2.2195 c1ccc(NCC2CCCNC2)cc1 Amb17234995 [0,0,0,0,2,0|2,0,0]=4 681 B15R2.2195 c1ccc(NCC2CCCSC2)cc1 Amb28062043 [0,0,0,0,2,0|2,0,0]=4 682 B15R2.2195 c1ccc(NCC2CCNCC2)cc1 Amb17234994 [0,0,0,0,2,0|2,0,0]=4 683 B15R2.2195 c1ccc(NCC2CCOCC2)cc1 Amb18973948 [0,0,0,0,2,0|2,0,0]=4 684 B15R2.2195 c1ccc(NCC2CCSCC2)cc1 Amb35694843 [0,0,0,0,2,0|2,0,0]=4 685 B15R2.2195 c1ccc(NCN2CCCCC2)cc1 Amb27877786 [0,0,0,0,2,0|2,0,0]=4 686 B15R2.2195 c1ccc(NNC2CCCCC2)cc1 Amb8383606 [0,0,0,0,2,0|1,0,0]=3 687 B15R2.2195 c1ccc(OCC2CCCCN2)cc1 Amb4135032 [0,0,0,0,2,0|2,0,0]=4 688 B15R2.2195 c1ccc(OCC2CCCNC2)cc1 Amb21954822 [0,0,0,0,2,0|2,0,0]=4 689 B15R2.2195 c1ccc(OCC2CCCNC2)cc1 Amb9716829 [0,0,0,0,2,0|2,0,0]=4 690 B15R2.2195 c1ccc(OCC2CCNCC2)cc1 Amb10610158 [0,0,0,0,2,0|2,0,0]=4 691 B15R2.2195 c1ccc(OCC2CCNCC2)cc1 Amb6281484 [0,0,0,0,2,0|2,0,0]=4 692 B15R2.2195 c1ccc(OC[C@@H]2CCCNC2)cc1 Amb27746817 [0,0,0,0,2,0|2,0,0]=4 693 B15R2.2195 c1ccc(SCC2CCCCN2)cc1 Amb22395621 [0,0,0,0,2,0|2,0,0]=4 694 B15R2.2195 c1ccc(SCC2CCCCN2)cc1 Amb35745534 [0,0,0,0,2,0|2,0,0]=4 695 B15R2.2195 c1ccc(SCC2CCCNC2)cc1 Amb18980875 [0,0,0,0,2,0|2,0,0]=4 696 B15R2.2195 c1ccc(SCC2CCCNC2)cc1 Amb21984737 [0,0,0,0,2,0|2,0,0]=4 697 B15R2.2195 c1ccc(SCC2CCNCC2)cc1 Amb18981032 [0,0,0,0,2,0|2,0,0]=4 698 B15R2.2195 c1ccc(SCC2CCNCC2)cc1 Amb21984732 [0,0,0,0,2,0|2,0,0]=4 699 B15R2.2195 c1cnc(CCC2CCCCC2)cn1 Amb27478608 [0,0,0,0,2,0|2,0,0]=4 700 B15R2.2195 c1cnc(CNC2CCCCC2)nc1 Amb18300319 [0,0,0,0,2,0|2,0,0]=4 701 B15R2.2195 c1cncc(CCC2CCCCN2)c1 Amb8009995 [0,0,0,0,2,0|2,0,0]=4 702 B15R2.2195 c1cncc(CCC2CCCNC2)c1 Amb27251596 [0,0,0,0,2,0|2,0,0]=4 703 B15R2.2195 c1cncc(CCC2CCNCC2)c1 Amb24709287 [0,0,0,0,2,0|2,0,0]=4 704 B15R2.2195 c1cncc(CNC2CCCCC2)c1 Amb6355967 [0,0,0,0,2,0|1,0,0]=3 705 B15R2.2195 c1cncc(CNC2CCCCC2)c1 Amb8469126 [0,0,0,0,2,0|1,0,0]=3 706 B15R2.2195 c1cncc(CNC2CCCNC2)c1 Amb18293198 [0,0,0,0,2,0|2,0,0]=4 707 B15R2.2195 c1cncc(CNC2CCCSC2)c1 Amb18999021 [0,0,0,0,2,0|2,0,0]=4 708 B15R2.2195 c1cncc(CNC2CCNCC2)c1 Amb19892591 [0,0,0,0,2,0|2,0,0]=4 709 B15R2.2195 c1cncc(CNC2CCOCC2)c1 Amb9472534 [0,0,0,0,2,0|2,0,0]=4 710 B15R2.2195 c1cncc(CN[C@@H]2CCCNC2)c1 Amb27788688 [0,0,0,0,2,0|2,0,0]=4 711 B15R2.2195 c1cncc(CSC2CCCCC2)c1 Amb27959707 [0,0,0,0,2,0|2,0,0]=4 712 B15R2.2195 c1cncc(NCC2CCCCC2)c1 Amb2382999 [0,0,0,0,2,0|2,0,0]=4 713 B15R2.2195 c1cncc(OCC2CCCCC2)c1 Amb27189333 [0,0,0,0,2,0|2,0,0]=4 714 B15R2.2195 c1ncc(CNC2CCCCC2)cn1 Amb18996443 [0,0,0,0,2,0|2,0,0]=4 715 B15R2.2196 c1ccc(CCCC2CCCN2)cc1 Amb3788434 [0,0,0,0,2,0|2,0,0]=4 716 B15R2.2196 c1ccc(CCCC2CCNC2)cc1 Amb21959199 [0,0,0,0,2,0|2,0,0]=4 717 B15R2.2196 c1ccc(CCNC2CCCC2)cc1 Amb2097978 [0,0,0,0,2,0|0,0,0]=2 718 B15R2.2196 c1ccc(CCNC2CCCC2)cc1 Amb6695463 [0,0,0,0,2,0|0,0,0]=2 719 B15R2.2196 c1ccc(CCNC2CCOC2)cc1 Amb20667617 [0,0,0,0,2,0|1,0,0]=3 720 B15R2.2196 c1ccc(CCNC2CCOC2)cc1 Amb22059244 [0,0,0,0,2,0|1,0,0]=3 721 B15R2.2196 c1ccc(CCNC2CCSC2)nc1 Amb6694366 [0,0,0,0,2,0|2,0,0]=4 722 B15R2.2196 c1ccc(CCOC2CCNC2)cc1 Amb19073404 [0,0,0,0,2,0|2,0,0]=4 723 B15R2.2196 c1ccc(CNCC2CCCC2)cc1 Amb8952618 [0,0,0,0,2,0|2,0,0]=4 724 B15R2.2196 c1ccc(CONC2CCCC2)cc1 Amb27213650 [0,0,0,0,2,0|1,0,0]=3 725 B15R2.2196 c1ccc(CONC2CCSC2)cc1 Amb27213077 [0,0,0,0,2,0|2,0,0]=4 726 B15R2.2196 c1cnc(CCNC2CCCC2)nc1 Amb33495856 [0,0,0,0,2,0|2,0,0]=4 727 B15R2.2196 c1cnn(CCNC2CCCCC2)c1 Amb19024655 [0,0,0,0,2,0|2,0,0]=4 728 B15R2.2196 c1csc(CCNC2CCCCC2)n1 Amb17315498 [0,0,0,0,2,0|2,0,0]=4 729 B15R2.2196 c1csc(CCNC2CCCSC2)c1 Amb19033222 [0,0,0,0,2,0|2,0,0]=4 730 B15R2.2196 c1csc(CCNC2CCOCC2)c1 Amb28991362 [0,0,0,0,2,0|2,0,0]=4 731 B15R2.2196 c1csc(CCNC2CCOCC2)c1 Amb9472425 [0,0,0,0,2,0|2,0,0]=4 732 B15R2.2196 c1csc(CCNC2CCSCC2)c1 Amb9249018 [0,0,0,0,2,0|2,0,0]=4 733 B15R2.2167 C(=C1CCCCCC1)c2ccccc2 Amb10606580 [0,0,0,0,2,0|0,0,2]=4 734 B15R2.2167 c1cc(CC2CCCCNC2)ccn1 Amb27197856 [0,0,0,0,2,0|2,0,0]=4 735 B15R2.2167 c1cc(CC2CCCNCC2)ccn1 Amb27252596 [0,0,0,0,2,0|2,0,0]=4 736 B15R2.2167 c1cc(NC2CCCCNC2)ccn1 Amb28146661 [0,0,0,0,2,0|2,0,0]=4 737 B15R2.2167 c1cc(NC2CCCOCC2)ccn1 Amb27766857 [0,0,0,0,2,0|2,0,0]=4 738 B15R2.2167 c1cc(NC2CCCSCC2)ccn1 Amb35692704 [0,0,0,0,2,0|2,0,0]=4 739 B15R2.2167 c1ccc(CC2CCCCCN2)nc1 Amb2237254 [0,0,0,0,2,0|2,0,0]=4 740 B15R2.2167 c1ccc(CC2CCCCNC2)cc1 Amb25167909 [0,0,0,0,2,0|1,0,0]=3 741 B15R2.2167 c1ccc(CC2CCCNCC2)cc1 Amb27629922 [0,0,0,0,2,0|1,0,0]=3 742 B15R2.2167 c1ccc(CC2COCCOC2)cc1 Amb26559424 [0,0,0,0,2,0|2,0,0]=4 743 B15R2.2167 c1ccc(CN2CCCCCC2)cc1 Amb1925686 [0,0,0,0,2,0|1,0,0]=3 744 B15R2.2167 c1ccc(CN2CCCCCC2)nc1 Amb27233074 [0,0,0,0,2,0|2,0,0]=4 745 B15R2.2167 c1ccc(CN2CCCNCC2)cc1 Amb1672618 [0,0,0,0,2,0|2,0,0]=4 746 B15R2.2167 c1ccc(CN2CCCNCC2)cc1 Amb19373311 [0,0,0,0,2,0|2,0,0]=4 747 B15R2.2167 c1ccc(CN2CCCOCC2)cc1 Amb22750166 [0,0,0,0,2,0|2,0,0]=4 748 B15R2.2167 c1ccc(NC2=NCCCCC2)cc1 Amb22549304 [0,0,0,0,2,0|1,0,1]=4 749 B15R2.2167 c1ccc(NC2=NCCCCC2)cc1 Amb3466931 [0,0,0,0,2,0|1,0,1]=4 750 B15R2.2167 c1ccc(NC2CCCCCC2)cc1 Amb6685075 [0,0,0,0,2,0|0,0,0]=2 751 B15R2.2167 c1ccc(NC2CCCCNC2)cc1 Amb25869964 [0,0,0,0,2,0|1,0,0]=3 752 B15R2.2167 c1ccc(NC2CCCNCC2)cc1 Amb32412596 [0,0,0,0,2,0|1,0,0]=3 753 B15R2.2167 c1ccc(NC2CCCNCC2)nc1 Amb27758523 [0,0,0,0,2,0|2,0,0]=4 754 B15R2.2167 c1ccc(NC2CCCSCC2)cc1 Amb35684891 [0,0,0,0,2,0|1,0,0]=3 755 B15R2.2167 c1ccc(NC2CCCSCC2)nc1 Amb35691434 [0,0,0,0,2,0|2,0,0]=4 756 B15R2.2167 c1ccc(OC2CCCCCC2)cc1 Amb27754766 [0,0,0,0,2,0|1,0,0]=3 757 B15R2.2167 c1ccc(OC2CCCCNC2)cc1 Amb17040624 [0,0,0,0,2,0|2,0,0]=4 758 B15R2.2167 c1ccc(OC2CCCNCC2)cc1 Amb27401695 [0,0,0,0,2,0|2,0,0]=4 759 B15R2.2167 c1ccc(SC2CCCCNC2)cc1 Amb17040638 [0,0,0,0,2,0|2,0,0]=4 760 B15R2.2167 c1cnc(NC2CCCCCC2)cn1 Amb8858348 [0,0,0,0,2,0|2,0,0]=4 761 B15R2.2167 c1cncc(CN2CCCCCC2)c1 Amb1838068 [0,0,0,0,2,0|2,0,0]=4 762 B15R2.2167 c1cncc(NC2CCCSCC2)c1 Amb35684892 [0,0,0,0,2,0|2,0,0]=4 763 B15R2.3805 c1cc(CCN2CCCCCC2)cs1 Amb27602403 [0,0,0,0,2,0|2,0,0]=4 764 B15R2.3805 c1cc(CNC2CCCCCC2)cs1 Amb1155430 [0,0,0,0,2,0|1,0,0]=3 765 B15R2.3805 c1cc(CNC2CCCCCC2)sn1 Amb30008411 [0,0,0,0,2,0|2,0,0]=4 766 B15R2.3805 c1cc(CNC2CCCOCC2)cs1 Amb28239415 [0,0,0,0,2,0|2,0,0]=4 767 B15R2.3805 c1cc(CNC2CCCSCC2)co1 Amb35684894 [0,0,0,0,2,0|2,0,0]=4 768 B15R2.3805 c1cc(CNC2CCCSCC2)cs1 Amb35691556 [0,0,0,0,2,0|2,0,0]=4 769 B15R2.3805 c1cc(NCC2CCCCCC2)cs1 Amb27387352 [0,0,0,0,2,0|2,0,0]=4 770 B15R2.3805 c1coc(CNC2CCCCCC2)c1 Amb1112646 [0,0,0,0,2,0|1,0,0]=3 771 B15R2.3805 c1coc(CNC2CCCSCC2)c1 Amb35684895 [0,0,0,0,2,0|2,0,0]=4 772 B15R2.3805 c1csc(CNC2CCCCCC2)c1 Amb6723805 [0,0,0,0,2,0|1,0,0]=3 773 B15R2.3805 c1csc(CNC2CCCCCC2)n1 Amb17339550 [0,0,0,0,2,0|2,0,0]=4 774 B15R2.3805 c1csc(CNC2CCCOCC2)c1 Amb25855256 [0,0,0,0,2,0|2,0,0]=4 775 B15R2.3805 c1csc(CNC2CCCSCC2)c1 Amb35691555 [0,0,0,0,2,0|2,0,0]=4 776 B15R2.3805 c1ncc(CNC2CCCCCC2)s1 Amb18996528 [0,0,0,0,2,0|2,0,0]=4 777 B17R1.4049 CCCNC(CC)CCOCc1ccccc1 Amb27774512 [0,0,1,0,0,1|2,0,0]=4 778 B17R1.18598 CCOC(CNCCc1ccccc1)OCC Amb22524370 [0,0,1,0,0,1|2,0,0]=4