0 B23R3.1974194 C(CC(c1cccc[n]1)c2ccccc2)N3CCCCC3 Amb22751951 [0,0,0,0,0,0|1,0,0]=1 1 B23R3.1974194 C(NC(c1ccccc1)c2ccccc2)C3CNCCC3 Amb25440126 [0,0,0,0,0,0|3,0,0]=3 2 B23R3.1974194 C(OC(c1ccccc1)c2ccccc2)C3CCNCC3 Amb22489714 [0,0,0,0,0,0|3,0,0]=3 3 B23R3.1974194 C(\C=C(\c1cccc[n]1)/c2ccccc2)N3CCCCC3 Amb22751950 [0,0,0,0,0,0|1,0,2]=3 4 B23R3.1974194 C1CCN(CC1)CC=C(c2ccccc2)c3ccccc3 Amb16200466 [0,0,0,0,0,0|0,0,2]=2 5 B24R3.6559 O=C(N1CCCCC1)CC(c2ccccc2)c3ccccc3 Amb1807922 [0,1,0,0,0,0|0,0,1]=2 6 B24R3.6559 O=C(N1CCCCC1)NC(c2ccccc2)c3ccccc3 Amb2582404 [0,1,0,0,0,0|1,0,1]=3 7 B24R3.6559 O=C(N1CCNCC1)CC(c2ccccc2)c3ccccc3 Amb17080870 [0,1,0,0,0,0|1,0,1]=3 8 B24R3.6559 O=C(N1CCOCC1)NC(c2ccccc2)c3ccccc3 Amb1543020 [0,1,0,0,0,0|2,0,1]=4 9 B24R3.35684 CN1CCCCC1CCC(c2ccccc2)c3ccccc3 Amb22446315 [0,1,0,0,0,0|2,0,0]=3 10 B24R3.67298 O=C(C(c1ccccc1)c2ccccc2)NC3CCCCC3 Amb2230190 [0,1,0,0,0,0|2,0,1]=4 11 B24R3.67298 O=C(C(c1ccccc1)c2ccccc2)NN3CCCCC3 Amb1836015 [0,1,0,0,0,0|1,0,1]=3 12 B24R3.67298 O=C(N(c1ccccc1)c2ccccc2)CN3CCOCC3 Amb1008388 [0,1,0,0,0,0|2,0,1]=4 13 B24R3.89720 NN1CCN(CCC(c2ccccc2)c3ccccc3)CC1 Amb22754128 [0,1,0,0,0,0|1,0,0]=2 14 B24R3.1994292 O=P(c1ccccc1)(c2ccccc2)CCN3CCCCC3 Amb1145426 [0,1,0,0,0,0|1,0,0]=2 15 B24R3.1994292 O=P(c1ccccc1)(c2ccccc2)CCN3CCOCC3 Amb1025526 [0,1,0,0,0,0|2,0,0]=3 16 B24R3.1994292 O=P(c1ccccc1)(c2ccccc2)CNC3CCCCC3 Amb2223430 [0,1,0,0,0,0|3,0,0]=4 17 B24R3.1994292 OC(CCN1CCCCC1)(c2ccccc2)c3ccccc3 Amb24288649 [0,1,0,0,0,0|0,0,0]=1 18 B24R3.1994292 OC(c1ccccc1)(c2ccccc2)CCN3CCCCC3 Amb10843123 [0,1,0,0,0,0|0,0,0]=1 19 B24R3.1994292 OC(c1ccccc1)(c2ccccc2)CCN3CCCCC3 Amb16200465 [0,1,0,0,0,0|0,0,0]=1 20 B22R3.3728 C1NCCCC1NC(c2ccccc2)c3ccccc3 Amb24822437 [0,0,0,0,1,0|3,0,0]=4 21 B22R3.3728 C1NCCCC1OC(c2ccccc2)c3ccccc3 Amb22734464 [0,0,0,0,1,0|3,0,0]=4 22 B22R3.3728 N1CCC(CC1)OC(c2ccccc2)c3ccccc3 Amb10603778 [0,0,0,0,1,0|3,0,0]=4 23 B22R3.3728 N1CCC(CC1)OC(c2ccccc2)c3ccccc3 Amb16232553 [0,0,0,0,1,0|3,0,0]=4 24 B24R3.5775 C(c1cccc[n]1)N(CCN2CCOCC2)c3ccccc3 Amb22134984 [0,0,0,0,0,1|3,0,0]=4 25 B24R3.5791 C(C#C[SiH](c1ccccc1)c2ccccc2)N3CCCCC3 Amb22802912 [0,0,0,0,0,1|0,1,1]=3 26 B24R3.5791 C(CN1CCCCC1)OC(c2ccccc2)c3ccccc3 Amb24063922 [0,0,0,0,0,1|0,0,0]=1 27 B24R3.5791 C1CN(CCOC(c2ccccc2)c3ccccc3)CCO1 Amb21410072 [0,0,0,0,0,1|1,0,0]=2 28 B24R3.5791 N1CCN(CC1)CCOC(c2ccccc2)c3ccccc3 Amb10819046 [0,0,0,0,0,1|1,0,0]=2 29 B21R2.2905 NCCCNCCC(c1ccccc1)c2ccccc2 Amb18622347 [1,0,1,0,0,0|1,0,0]=3 30 B23R2.33724 CCCCC(=O)NCCC(c1ccccc1)c2ccccc2 Amb17736147 [0,1,1,0,0,0|0,0,1]=3 31 B23R2.62314 CCNCCNC(=O)CC(c1ccccc1)c2ccccc2 Amb25583113 [0,1,1,0,0,0|1,0,1]=4 32 B23R2.62314 CNCCCNC(=O)CC(c1ccccc1)c2ccccc2 Amb25578123 [0,1,1,0,0,0|1,0,1]=4 33 B23R2.151646 CCCCC\C=C\CC(c1ccccc1)(c2ccccc2)O Amb10564680 [0,1,1,0,0,0|1,0,1]=4 34 B23R3.15516 NN1CCN(CC(c2ccccc2)c3ccccc3)CC1 Amb18638408 [0,1,0,0,1,0|1,0,0]=3 35 B23R3.51087 OC(CN1CCCCC1)(c2ccccc2)c3ccccc3 Amb22471294 [0,1,0,0,1,0|0,0,0]=2 36 B23R3.51087 OC(c1ccccc1)(c2ccccc2)CN3CCOCC3 Amb2418115 [0,1,0,0,1,0|1,0,0]=3 37 B23R3.51087 OC(c1ccccn1)(c2ccccc2)CN3CCOCC3 Amb1087021 [0,1,0,0,1,0|2,0,0]=4 38 B23R3.51087 S=P(CN1CCSCC1)(c2ccccc2)c3ccccc3 Amb22460529 [0,1,0,0,1,0|2,0,0]=4 39 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCNCC3 Amb21953795 [0,1,0,0,1,0|1,0,1]=4 40 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCNCC3 Amb25434323 [0,1,0,0,1,0|1,0,1]=4 41 B23R3.1995413 O=C(C(c1ccccn1)c2ccccc2)N3CCCCC3 Amb16885575 [0,1,0,0,1,0|1,0,1]=4 42 B23R3.5136 N=C(NC(c1ccccc1)c2ccccc2)N3CCCC3 Amb22489360 [0,1,0,0,1,0|1,0,1]=4 43 B23R3.5136 O=C(N1CCCC1)NC(c2ccccc2)c3ccccc3 Amb2582407 [0,1,0,0,1,0|1,0,1]=4 44 B25R3.82774 O=C(N(c1ccccc1)Cc2ccccc2)CN3CCCCC3 Amb10581399 [0,1,0,0,0,1|1,0,1]=4 45 B25R3.5536141 OC(Cc1ccccc1)(CCN2CCCCC2)c3ccccc3 Amb22478061 [0,1,0,0,0,1|0,0,0]=2 46 B25R3.5536141 OC(Cc1ccccc1)(CCN2CCOCC2)c3ccccc3 Amb22455760 [0,1,0,0,0,1|1,0,0]=3 47 B25R3.20636 O=C(CNC(c1ccccc1)c2ccccc2)N3CCOCC3 Amb21372009 [0,1,0,0,0,1|1,0,1]=4 48 B25R3.20636 O=C(N1CCOCC1)CSC(c2ccccc2)c3ccccc3 Amb10665399 [0,1,0,0,0,1|1,0,1]=4 49 B25R3.25375 CC1CN(CCOC(c2ccccc2)c3ccccc3)CCO1 Amb21785941 [0,1,0,0,0,1|1,0,0]=3 50 B25R3.25375 O=C1CN(CCN1)CCOC(c2ccccc2)c3ccccc3 Amb20816941 [0,1,0,0,0,1|1,0,1]=4 51 B25R3.25375 OC1CN(CCOC(c2ccccc2)c3ccccc3)CCC1 Amb21410073 [0,1,0,0,0,1|0,0,0]=2 52 B25R3.26173 C[C@@H]1CNCCN1CCOC(c2ccccc2)c3ccccc3 Amb25493215 [0,1,0,0,0,1|1,0,0]=3 53 B25R3.26173 C[C@H]1CNCCN1CCOC(c2ccccc2)c3ccccc3 Amb25492764 [0,1,0,0,0,1|1,0,0]=3 54 B25R3.82807 O=C(CN1CCCCC1)NC(c2ccccc2)c3ccccc3 Amb1194651 [0,1,0,0,0,1|0,0,1]=3 55 B25R3.82807 OC(CN1CCCCC1)CN(c2ccccc2)c3ccccc3 Amb1349647 [0,1,0,0,0,1|1,0,0]=3 56 B25R3.82807 OC(CN1CCCCC1)CN(c2ccccc2)c3ccccc3 Amb2571814 [0,1,0,0,0,1|1,0,0]=3 57 B25R3.82807 OC(CN1CCNCC1)CN(c2ccccc2)c3ccccc3 Amb19888642 [0,1,0,0,0,1|2,0,0]=4 58 B25R3.114844 OC1CCN(CCOC(c2ccccc2)c3ccccc3)CC1 Amb20817088 [0,1,0,0,0,1|0,0,0]=2 59 B25R3.121526 Fc1ccc(cc1)C(CCCN2CCNCC2)c3ccccc3 Amb24093952 [0,1,0,0,0,1|1,0,0]=3 60 B25R3.3975663 C[Si](C#CCN1CCCCC1)(c2ccccc2)c3ccccc3 Amb21867541 [0,1,0,0,0,1|0,1,1]=4 61 B25R3.3975663 OC(C#CCN1CCOCC1)(c2ccccc2)c3ccccc3 Amb21875497 [0,1,0,0,0,1|1,0,1]=4 62 B25R3.3975663 OC(\C=C/CN1CCCCC1)(c2ccccc2)c3ccccc3 Amb23478778 [0,1,0,0,0,1|0,0,1]=3 63 B25R3.3975663 O[Si](C#CCN1CCCCC1)(c2ccccc2)c3ccccc3 Amb22802909 [0,1,0,0,0,1|0,1,1]=4 64 B25R3.6509934 O=C(CC(c1ccccc1)c2ccccc2)N3CCCNCC3 Amb24852848 [0,1,0,0,0,1|0,0,1]=3 65 B25R3.32690298 O=P(c1ccccc1)(c2ccccc2)CCN3CCCCCC3 Amb1773764 [0,1,0,0,0,1|1,0,0]=3 66 B25R3.1136 CN1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 Amb1809790 [0,2,0,0,0,0|1,0,1]=4 67 B25R3.1136 O=C(N1CCC(=O)CC1)CC(c2ccccc2)c3ccccc3 Amb131840 [0,2,0,0,0,0|0,0,2]=4 68 B25R3.23513 Clc1ccc(cc1)C(c2ccccc2)CC(=O)N3CCOCC3 Amb11003715 [0,2,0,0,0,0|1,0,1]=4 69 B25R3.25109 Clc1cccc(c1)C(c2ccccc2)CC(=O)N3CCOCC3 Amb10996594 [0,2,0,0,0,0|1,0,1]=4 70 B25R3.25109 Oc1cccc(c1)C(c2ccccc2)CC(=O)N3CCNCC3 Amb2231588 [0,2,0,0,0,0|1,0,1]=4 71 B25R3.45469 O=C(N1CCCCO1)CC(c2ccccc2F)c3ccccc3 Amb10991223 [0,2,0,0,0,0|1,0,1]=4 72 B25R3.45469 O=C(N1CCOCC1)CC(c2ccccc2Cl)c3ccccc3 Amb10993242 [0,2,0,0,0,0|1,0,1]=4 73 B25R3.45469 O=C(N1CCSCC1)CC(c2ccccc2C)c3ccccc3 Amb11003653 [0,2,0,0,0,0|1,0,1]=4 74 B25R3.45469 O=C(N1CCSCC1)CC(c2ccccc2F)c3ccccc3 Amb11003794 [0,2,0,0,0,0|1,0,1]=4 75 B25R3.68061 CC1OCCN(C1)C(=O)CC(c2ccccc2)c3ccccc3 Amb16791500 [0,2,0,0,0,0|1,0,1]=4 76 B25R3.68061 NC1CN(CCC1)C(=O)CC(c2ccccc2)c3ccccc3 Amb24855215 [0,2,0,0,0,0|0,0,1]=3 77 B25R3.83058 CC(CC(O)(c1ccccc1)c2ccccc2)N3CCCCC3 Amb22493742 [0,2,0,0,0,0|0,0,0]=2 78 B25R3.2609278 CC1COCCN1C(=O)CC(c2ccccc2)c3ccccc3 Amb16791253 [0,2,0,0,0,0|1,0,1]=4 79 B25R3.2630524 Cc1cc(O)c(cc1)C(CCN2CCOCC2)c3ccccc3 Amb22459938 [0,2,0,0,0,0|1,0,0]=3 80 B25R3.2892036 C[N+]1(C)CCCCC1CCC(c2ccccc2)c3ccccc3 Amb22446318 [0,2,0,0,0,0|2,0,0]=4 81 B25R3.82776 CC(C(O)CN1CCOCC1)(c2ccccc2)c3ccccc3 Amb22478469 [0,2,0,0,0,0|1,0,0]=3 82 B25R3.834259 Cc1ccc(cc1)C(O)(CCN2CCCCC2)c3ccccc3 Amb20249453 [0,2,0,0,0,0|0,0,0]=2 83 B25R3.834259 Clc1ccc(cc1)C(c2ccccc2)(CCN3CCOCC3)O Amb16761824 [0,2,0,0,0,0|1,0,0]=3 84 B25R3.834259 OC(CCN1CCOCC1)(c2ccccc2)c3ccc(Br)cc3 Amb23458672 [0,2,0,0,0,0|1,0,0]=3 85 B25R3.834259 OC(CCN1CCOCC1)(c2ccccc2)c3ccc(F)cc3 Amb21989429 [0,2,0,0,0,0|1,0,0]=3 86 B25R3.121401 CN1CCN(CC1)CCP(=O)(c2ccccc2)c3ccccc3 Amb1784412 [0,2,0,0,0,0|2,0,0]=4 87 B25R3.17226985 C[N+]1(C)CCC(CCC(c2ccccc2)c3ccccc3)CC1 Amb22469035 [0,2,0,0,0,0|2,0,0]=4 88 B25R3.2488225 N#CC(c1ccccc1)(c2ccccc2)CCN3CCOCC3 Amb10564100 [0,2,0,0,0,0|1,0,0]=3 89 B25R3.2488225 N#CC(c1ccccc1)(c2ccccc2)CCN3CCOCC3 Amb1254508 [0,2,0,0,0,0|1,0,0]=3 90 B23R4.1520393 C(C1c2ccccc2-c3ccccc31)N4CCCCC4 Amb22655681 [0,0,0,1,1,0|0,0,0]=2 91 B23R4.1520393 C1CCN(CC1)Cn2c3ccccc3c4c2cccc4 Amb1017909 [0,0,0,1,1,0|1,0,0]=3 92 B23R4.1520393 O1CCN(CC1)Cn2c3ccccc3c4c2cccc4 Amb2223403 [0,0,0,1,1,0|2,0,0]=4 93 B23R4.48825463 C1NC(c2ccccc2C13CCCC3)c4ccccc4 Amb22034736 [0,0,0,1,1,0|2,0,0]=4 94 B25R4.1655245 O1CCN(CC1)CCCn2c3ccccc3c4c2cccc4 Amb10560364 [0,0,0,1,0,1|2,0,0]=4 95 B25R4.2401476 OC1(CC(c2ccccc12)c3ccccc3)C4CCCCN4 Amb24099955 [0,1,0,1,0,0|2,0,0]=4 96 B25R4.114175491 OC(C1CN2CCC1CC2)(c3ccccc3)c4ccccc4 Amb19984817 [0,1,0,1,0,0|0,0,0]=2 97 B21R3.3138 C1CCC(NC1)C(c2ccccc2)c3ccccc3 Amb19134463 [0,0,0,0,2,0|2,0,0]=4 98 B21R3.3138 C1CCC(NC1)C(c2ccccc2)c3ccccc3 Amb2234982 [0,0,0,0,2,0|2,0,0]=4 99 B21R3.3138 C1CCCCC1[SiH](c2ccccc2)c3ccccc3 Amb22366537 [0,0,0,0,2,0|1,1,0]=4 100 B21R3.3138 C1CCCCN1C(c2ccccc2)c3ccccc3 Amb22445203 [0,0,0,0,2,0|0,0,0]=2 101 B21R3.3138 C1CN(CCN1)C(c2ccccc2)c3ccccc3 Amb22235631 [0,0,0,0,2,0|1,0,0]=3 102 B21R3.3138 C1CNCCC1C(c2ccccc2)c3ccccc3 Amb18563347 [0,0,0,0,2,0|2,0,0]=4 103 B21R3.3138 C1C[NH+](CCN1)C(c2ccccc2)c3ccccc3 Amb24064460 [0,0,0,0,2,0|1,0,1]=4 104 B21R3.3138 O1CCN(CC1)C(c2ccccc2)c3ccccc3 Amb10553201 [0,0,0,0,2,0|1,0,0]=3 105 B23R3.1974208 c1ccc(cc1)N(Cc2ccccc2)CCN3CCCC3 Amb17614972 [0,0,0,0,1,1|1,0,0]=3 106 B25R3.6854 C(C#CC=C(c1ccccc1)c2ccccc2)N3CCCCC3 Amb21866210 [0,0,0,0,0,2|0,0,2]=4 107 B25R3.6854 C(CCCN(c1ccccc1)c2ccccc2)N3CCCCC3 Amb22523314 [0,0,0,0,0,2|1,0,0]=3 108 B25R3.6854 C1CCN(CC1)CC#CCC(c2ccccc2)c3ccccc3 Amb10812118 [0,0,0,0,0,2|0,0,0]=2 109 B25R3.1946081 N1CCCN(CC1)CCOC(c2ccccc2)c3ccccc3 Amb10068503 [0,0,0,0,0,2|0,0,0]=2