0 B12R1.891 CS(=O)(=O)CCC1CCCCN1 Z2188172198 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.891 CS(=O)(=O)CCN1CCNCC1 Z1263529671 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.891 CS(=O)(=O)NCC1CCNCC1 Z285141528 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.891 NS(=O)(=O)CCC1CCCCC1 Z1400796472 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.891 NS(=O)(=O)CCC1CCCCN1 Z3156156900 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.891 NS(=O)(=O)CCN1CCNCC1 Z825378758 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.891 O=S(=O)(F)CCC1CCCCC1 Z2907445833 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.891 O=S(=O)(F)CCC1CCCCN1 Z3069147322 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.891 O=S(=O)(F)CCC1CCCNC1 Z4297384656 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.891 O=S(=O)(F)CCC1CCNCC1 Z4302465000 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.891 O=S(=O)(F)CCC1CCOCC1 Z2907429169 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.891 O=S(=O)(O)CCN1CCOCC1 Z1079084978 [0,0,0,0,0,0|0,0,0]=0 12 B11R1.91 CC(=O)CCN1CCOCC1 Z53116541 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.91 CC(=O)CCN1CCSCC1 Z906169788 [1,0,0,0,0,0|2,1,0]=4 14 B11R1.91 CC(N)CCN1CCOCC1 Z1267881637 [1,0,0,0,0,0|3,0,0]=4 15 B11R1.91 CC(O)CCN1CCOCC1 Z854196274 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.91 CS(=O)CCN1CCNCC1 Z1255523344 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.91 N=C(N)CCN1CCOCC1 Z4607148849 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.91 O=C(O)CCC1CCCCC1 Z104479892 [1,0,0,0,0,0|3,0,0]=4 19 B11R1.91 O=C(O)CCC1CCNCC1 Z364250128 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.91 O=C(O)CCC1CCOCC1 Z979765670 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.91 O=C(O)CCN1CCCCC1 Z744843478 [1,0,0,0,0,0|2,0,0]=3 22 B11R1.91 O=C(O)CCN1CCNCC1 Z57683717 [1,0,0,0,0,0|2,0,0]=3 23 B11R1.91 O=C(O)CCN1CCOCC1 Z57683745 [1,0,0,0,0,0|1,0,0]=2 24 B11R1.91 O=C(O)COC1CCOCC1 Z802587584 [1,0,0,0,0,0|3,0,0]=4 25 B13R1.157 CC1COCCC1CNS(=O)(=O)C Z2069929930 [0,1,0,0,0,0|3,0,0]=4 26 B13R1.254 CCS(=O)(=O)NCC1CCOCC1 Z977622122 [0,1,0,0,0,0|3,0,0]=4 27 B13R1.512 CS(=O)(=O)CCN1CCC(CC1)N Z608054110 [0,1,0,0,0,0|2,0,0]=3 28 B13R1.838 CS(=O)(=O)CCN1CCC=C(C1)Br Z1994169928 [0,1,0,0,0,0|2,0,1]=4 29 B13R1.838 CS(=O)(=O)CCN1CCNC(=O)C1 Z46334763 [0,1,0,0,0,0|2,0,1]=4 30 B13R2.222 O=S1(=O)CCN2CCNCC2C1 Z2234185649 [0,0,0,1,0,0|2,0,0]=3 31 B13R2.8076 NS(=O)(=O)C1CC2CCC1CC2 Z2217316103 [0,0,0,1,0,0|3,0,0]=4 32 B13R2.8076 O=S(=O)(F)C1CC2CCC1CC2 Z1509058801 [0,0,0,1,0,0|3,0,0]=4 33 B13R2.11462 O=S1(=O)CC2(CCOCC2)CN1 Z3487473394 [0,0,0,1,0,0|3,0,0]=4 34 B13R2.11462 O=S1(=O)CCC2(C1)CCNCC2 Z3024360017 [0,0,0,1,0,0|3,0,0]=4 35 B11R1.509 CS(=O)(=O)CC1CCNCC1 Z1954803302 [0,0,0,0,1,0|3,0,0]=4 36 B11R1.509 NS(=O)(=O)CC1CCCCC1 Z734461532 [0,0,0,0,1,0|3,0,0]=4 37 B11R1.509 NS(=O)(=O)CC1CCNCC1 Z1263602407 [0,0,0,0,1,0|3,0,0]=4 38 B11R1.509 NS(=O)(=O)CC1CCOCC1 Z979764962 [0,0,0,0,1,0|2,0,0]=3 39 B11R1.509 NS(=O)(=O)NC1CCOCC1 Z741768586 [0,0,0,0,1,0|3,0,0]=4 40 B11R1.509 O=S(=O)(F)CC1CCCCC1 Z991753780 [0,0,0,0,1,0|3,0,0]=4 41 B11R1.509 O=S(=O)(F)CC1CCNCC1 Z2230803840 [0,0,0,0,1,0|3,0,0]=4 42 B11R1.509 O=S(=O)(F)CC1CCOCC1 Z1270173079 [0,0,0,0,1,0|2,0,0]=3 43 B11R1.510 CC(C)(O)CCN1CCCC1 Z1318238681 [0,0,0,0,1,0|3,0,0]=4 44 B11R1.510 NS(=O)(=O)CCC1CCCO1 Z1258831406 [0,0,0,0,1,0|3,0,0]=4 45 B11R1.510 O=S(=O)(F)CCC1CCCO1 Z2907416621 [0,0,0,0,1,0|3,0,0]=4 46 B13R1.3523 NS(=O)(=O)CCOC1CCCCC1 Z1206904517 [0,0,0,0,0,1|3,0,0]=4 47 B13R1.3523 NS(=O)(=O)NCCC1CCNCC1 Z3492404705 [0,0,0,0,0,1|3,0,0]=4 48 B10R0.22 COCCOCCS(=O)(=O)N Z1205743463 [1,0,1,0,0,0|2,0,0]=4 49 B10R0.109 CN(CCN)CCS(=O)(=O)C Z2785824794 [1,0,1,0,0,0|2,0,0]=4 50 B10R0.4 CCOCCCCCC(=O)O Z1219750577 [1,0,1,0,0,0|2,0,0]=4 51 B10R1.17 C#CCCN1CCOCC1 Z840363678 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.17 CNCCN1CCOCC1 Z138328496 [2,0,0,0,0,0|2,0,0]=4 53 B10R1.17 ClCCCN1CCOCC1 Z440824950 [2,0,0,0,0,0|2,0,0]=4 54 B10R1.17 O=CCCC1CCOCC1 Z993017668 [2,0,0,0,0,0|2,0,0]=4 55 B10R1.17 OCCCC1CCOCC1 Z993012578 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.17 OCCCN1CCCCC1 Z169222610 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.17 OCCCN1CCNCC1 Z1262250863 [2,0,0,0,0,0|2,0,0]=4 58 B10R1.17 OCCCN1CCOCC1 Z149158826 [2,0,0,0,0,0|1,0,0]=3 59 B10R1.17 OCCCN1CCSCC1 Z425793714 [2,0,0,0,0,0|1,1,0]=4 60 B12R1.21 CC1CCN(CC1)CCC(=O)O Z53118087 [1,1,0,0,0,0|2,0,0]=4 61 B12R1.21 CN1CCN(CC1)CCC(=O)O Z53116013 [1,1,0,0,0,0|2,0,0]=4 62 B12R1.21 O=C(O)CCN1CCC(CC1)O Z803145326 [1,1,0,0,0,0|2,0,0]=4 63 B12R1.27 COC(=O)CCN1CCNCC1 Z803145360 [1,1,0,0,0,0|2,0,0]=4 64 B12R1.27 N/C(=N\O)/CCN1CCOCC1 Z57493560 [1,1,0,0,0,0|2,0,0]=4 65 B12R1.27 NNC(=O)CCN1CCOCC1 Z56964376 [1,1,0,0,0,0|2,0,0]=4 66 B12R1.43 CC(CN1CCCCC1)C(=O)O Z418974874 [1,1,0,0,0,0|2,0,0]=4 67 B12R1.43 CC(CN1CCOCC1)C(=O)O Z57683747 [1,1,0,0,0,0|1,0,0]=3 68 B12R1.43 NC(CC1CCOCC1)C(=O)O Z979764268 [1,1,0,0,0,0|2,0,0]=4 69 B12R1.43 NC(CN1CCCCC1)C(=O)O Z1526503304 [1,1,0,0,0,0|2,0,0]=4 70 B12R1.43 NC(CN1CCOCC1)C(=O)O Z1762658242 [1,1,0,0,0,0|1,0,0]=3 71 B12R1.226 NC1CCCN(C1)CCC(=O)O Z4449634242 [1,1,0,0,0,0|2,0,0]=4 72 B12R1.3110 NC1(CCOCC1)CCC(=O)O Z2935002206 [1,1,0,0,0,0|2,0,0]=4 73 B14R1.131 CC1CCN(CC1)CCNS(=O)(=O)C Z414693058 [0,1,0,0,0,1|2,0,0]=4 74 B14R1.147 CC1CCCN(C1)CCNS(=O)(=O)C Z416358474 [0,1,0,0,0,1|2,0,0]=4 75 B14R1.242 CC1COCCN1CCNS(=O)(=O)C Z1127187407 [0,1,0,0,0,1|1,0,0]=3 76 B14R1.433 CC(CN1CCOCC1)NS(=O)(=O)C Z416360310 [0,1,0,0,0,1|1,0,0]=3 77 B14R1.3098 CC(CNS(=O)(=O)C)N1CCOCC1 Z365120422 [0,1,0,0,0,1|1,0,0]=3 78 B14R1.10526 CC(C(=O)N1CCOCC1)S(=O)(=O)C Z417007884 [0,2,0,0,0,0|1,0,1]=4 79 B14R1.14097 CC1(CCN(CC1)CCS(=O)(=O)C)C Z1039253836 [0,2,0,0,0,0|2,0,0]=4 80 B14R1.2162 CCC1CN(CCS1)CCS(=O)(=O)C Z1289796174 [0,2,0,0,0,0|1,1,0]=4 81 B12R1.2230 CS(=O)(=O)C1CCCCCNC1 Z3324768494 [0,0,1,1,0,0|2,0,0]=4 82 B12R2.22 O[C@H]1C[C@@H](C1)N2CCOCC2 Z1931496098 [1,0,0,1,0,0|2,0,0]=4 83 B12R2.93 O=S1(=O)NCC12CCOCC2 Z3333341568 [1,0,0,1,0,0|2,0,0]=4 84 B12R2.250 O=C(O)C1CC12CCOCC2 Z979743428 [1,0,0,1,0,0|2,0,0]=4 85 B12R2.1392 O=C(O)C1CN2CCC1CC2 Z274488408 [1,0,0,1,0,0|2,0,0]=4 86 B12R2.4340 NS(=O)(=O)C1CC2C1CCC2 Z2901650443 [0,0,0,1,1,0|2,0,0]=4 87 B12R2.4359 NS(=O)(=O)C1C[C@@H]2CC[C@H]1C2 Z2358421531 [0,0,0,1,1,0|2,0,0]=4 88 B12R2.4359 O=S(=O)(F)C1C[C@@H]2CC[C@H]1C2 Z2298064283 [0,0,0,1,1,0|2,0,0]=4 89 B14R2.403 O=S1(=O)CCC(C1)N2CCNCC2 Z90123333 [0,0,0,1,0,1|2,0,0]=4 90 B10R1.18 C[C@@H](O)CN1CCOCC1 Z1585898729 [1,0,0,0,1,0|2,0,0]=4 91 B10R1.18 O=C(O)CC1CCOCC1 Z440605396 [1,0,0,0,1,0|2,0,0]=4 92 B10R1.18 O=C(O)CN1CCCCC1 Z1171978832 [1,0,0,0,1,0|2,0,0]=4 93 B10R1.18 O=C(O)CN1CCNCC1 Z2887863329 [1,0,0,0,1,0|2,0,0]=4 94 B10R1.18 O=C(O)CN1CCOCC1 Z1270246390 [1,0,0,0,1,0|1,0,0]=3 95 B10R1.66 NC(=O)CCN1CCCC1 Z1800456308 [1,0,0,0,1,0|2,0,0]=4 96 B10R1.66 O=C(O)CCC1CCCC1 Z104478044 [1,0,0,0,1,0|2,0,0]=4 97 B10R1.66 O=C(O)CCC1CCOC1 Z975825286 [1,0,0,0,1,0|2,0,0]=4 98 B10R1.66 O=C([O-])CCN1CCCC1 Z398513132 [1,0,0,0,1,0|1,0,1]=4 99 B10R1.28 CS(=O)(=O)N1CCNCC1 Z131021938 [0,0,0,0,2,0|2,0,0]=4 100 B10R1.28 CS(=O)(=O)N1CCOCC1 Z53825008 [0,0,0,0,2,0|1,0,0]=3 101 B10R1.28 NS(=O)(=O)C1CCOCC1 Z916970164 [0,0,0,0,2,0|2,0,0]=4 102 B10R1.28 NS(=O)(=O)N1CCCCC1 Z300095616 [0,0,0,0,2,0|2,0,0]=4 103 B10R1.28 NS(=O)(=O)N1CCNCC1 Z235569558 [0,0,0,0,2,0|2,0,0]=4 104 B10R1.28 NS(=O)(=O)N1CCOCC1 Z300107782 [0,0,0,0,2,0|1,0,0]=3 105 B10R1.28 O=S(=O)(F)C1CCOCC1 Z1238548165 [0,0,0,0,2,0|2,0,0]=4 106 B10R1.28 O=S(=O)(F)N1CCCCC1 Z1255495196 [0,0,0,0,2,0|2,0,0]=4 107 B10R1.28 O=S(=O)(F)N1CCNCC1 Z3548694214 [0,0,0,0,2,0|2,0,0]=4 108 B10R1.281 NS(=O)(=O)CC1CCCC1 Z804900564 [0,0,0,0,2,0|2,0,0]=4 109 B10R1.281 O=S(=O)(F)CC1CCOC1 Z1140035581 [0,0,0,0,2,0|2,0,0]=4 110 B10R1.209 NS(=O)(=O)CCC1CCC1 Z1827533128 [0,0,0,0,2,0|2,0,0]=4 111 B12R1.252 CC(=O)NCCN1CCOCC1 Z32409842 [1,0,0,0,0,1|2,0,0]=4 112 B12R1.252 NC(=O)NCCN1CCOCC1 Z1262250846 [1,0,0,0,0,1|2,0,0]=4 113 B12R1.252 O=C(O)CCCC1CCOCC1 Z1209411166 [1,0,0,0,0,1|2,0,0]=4 114 B12R1.252 O=C(O)CCCN1CCCCC1 Z600397690 [1,0,0,0,0,1|2,0,0]=4 115 B12R1.252 O=C(O)CCCN1CCNCC1 Z5247767817 [1,0,0,0,0,1|2,0,0]=4 116 B12R1.252 O=C(O)CCOC1CCOCC1 Z802587588 [1,0,0,0,0,1|2,0,0]=4 117 B12R1.1343 O=C(O)CCN1CCCCCC1 Z1171978831 [1,0,0,0,0,1|2,0,0]=4 118 B14R1.3331 CS(=O)(=O)NCCCN1CCCCC1 Z133778732 [0,0,0,0,0,2|2,0,0]=4 119 B14R1.3331 CS(=O)(=O)NCCCN1CCOCC1 Z55257621 [0,0,0,0,0,2|1,0,0]=3 120 B14R1.3331 CS(=O)(=O)NCCCN1CCSCC1 Z1021240742 [0,0,0,0,0,2|1,1,0]=4