0 B11R1.509 CS(=O)(=O)CC1CCCNC1 CBR02440 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.509 CS(=O)(=O)NC1CCNCC1 CBR02346 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.509 CS(=O)(=O)NC1CCNCC1 CDS013122 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.509 NS(=O)(=O)NC1CCCCC1 PH000616 [0,0,0,0,0,0|1,0,0]=1 4 B11R1.509 O=S(=O)(Cl)CC1CCCCO1 CDS012288 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.509 O=S(=O)(Cl)CC1COCCO1 CBR01773 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.18 CC(=O)CC1CCCCC1 CDS001548 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.18 CC(=O)NC1CCCCC1 PH004244 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.18 CC(=O)NC1CCNCC1 CDS000127 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.18 CN(C)NC1CCCCC1 PH001375 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.18 N=C(N)NC1CCCCC1 L255009 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.18 NC(=O)NC1CCCCC1 S375047 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.18 NC(=S)NC1CCCCC1 PH002195 [1,0,0,0,0,0|2,1,0]=4 13 B10R1.18 O=C(O)CC1CCCCN1 R409952 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.18 O=C(O)CC1CCCNC1 PH010234 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.18 O=C(O)CC1CCNCC1 CBR01414 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.18 O=C(O)CC1CCNCC1 CDS007853 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.18 O=C(O)CC1CCNCC1 CDS021798 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.18 O=C(O)CC1CCOCC1 CDS006056 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.18 O=C(O)CN1CCCCC1 CDS005123 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.18 O=C(O)CN1CCCCC1 L481130 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.18 OB(O)CC1CCCCC1 CDS004056 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.106 CS(=O)(=O)NC1CCC(CC1)O CDS023771 [0,1,0,0,0,0|1,0,0]=2 23 B12R1.564 CN(C1CCCCC1)S(=O)(=O)Cl CDS013353 [0,1,0,0,0,0|1,0,0]=2 24 B10R0.22 CCCCCCOS(=O)(=O)[O-] S617164 [0,0,1,0,0,0|1,0,1]=3 25 B12R2.7433 [C@H]12CC=CC[C@H]1N2S(=O)(=O)C T175382 [0,0,0,1,0,0|1,0,2]=4 26 B10R1.28 CC(C)(O)C1CCCCC1 T294985 [0,0,0,0,1,0|3,0,0]=4 27 B10R1.28 CS(=O)(=O)N1CCNCC1 CDS003655 [0,0,0,0,1,0|3,0,0]=4 28 B10R1.28 CS(=O)(=O)N1CCOCC1 S799971 [0,0,0,0,1,0|3,0,0]=4 29 B10R1.28 NS(=O)(=O)N1CCCCC1 PH010400 [0,0,0,0,1,0|2,0,0]=3 30 B10R1.28 O=S(=O)(O)C1CCCCC1 PH018131 [0,0,0,0,1,0|0,0,0]=1 31 B12R1.891 CS(=O)(=O)OCC1CCCCC1 T220728 [0,0,0,0,0,1|2,0,0]=3 32 B12R1.891 CS(=O)(=O)OCC1CCOCC1 SYX00044 [0,0,0,0,0,1|3,0,0]=4 33 B12R1.891 O=S(=O)(O)CCC1CCCCN1 PH007384 [0,0,0,0,0,1|2,0,0]=3 34 B9R0.14 CCCC(CC)NC(=O)N S502553 [1,0,1,0,0,0|2,0,0]=4 35 B9R0.38 CCCCCCS(=O)(=O)[O-] R426628 [1,0,1,0,0,0|0,0,1]=3 36 B11R0.159 CCCCCCCCS(=O)(=O)N PH010261 [0,1,1,0,0,0|2,0,0]=4 37 B11R0.159 CCCCCCCNS(=O)(=O)C T170321 [0,1,1,0,0,0|1,0,0]=3 38 B11R1.20 CC(=O)NC1CCC(CC1)O CDS000512 [1,1,0,0,0,0|2,0,0]=4 39 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)N PH018847 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.40 CCC(=O)NC1CCCCC1 PH004228 [1,1,0,0,0,0|2,0,0]=4 41 B11R1.40 CNC(=O)NC1CCCCC1 S604569 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.40 O=C(CI)NC1CCCCC1 PH006183 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.40 O=C(NO)NC1CCCCC1 PH008314 [1,1,0,0,0,0|1,0,0]=3 44 B11R1.86 CC1CCCCC1CC(=O)O L127892 [1,1,0,0,0,0|2,0,0]=4 45 B11R1.928 CC(=O)NC1(CCCCC1)C PH011306 [1,1,0,0,0,0|2,0,0]=4 46 B11R1.928 O=C(O)CC1(CCCCC1)O CDS001976 [1,1,0,0,0,0|2,0,0]=4 47 B11R1.7 CCS(=O)(=O)C1CCNCC1 OTV000793 [0,1,0,0,1,0|2,0,0]=4 48 B11R1.7 O=S(=O)(CCl)C1CCCCC1 T300756 [0,1,0,0,1,0|1,0,0]=3 49 B11R1.19 CC1CCC(CC1)S(=O)(=O)[O-] PH016281 [0,1,0,0,1,0|0,0,1]=3 50 B11R1.19 CS(=O)(=O)N1CCC(CC1)N CDS003815 [0,1,0,0,1,0|2,0,0]=4 51 B11R1.19 CS(=O)(=O)N1CCC(CC1)O CDS023379 [0,1,0,0,1,0|2,0,0]=4 52 B11R1.155 CC1CCCN(C1)S(=O)(=O)Cl CDS019510 [0,1,0,0,1,0|2,0,0]=4 53 B11R1.155 O=C1CCCC(C1)S(=O)(=O)[O-] R537829 [0,1,0,0,1,0|0,0,2]=4 54 B11R1.573 O=S(=O)([O-])C1(CCCCC1)O S510300 [0,1,0,0,1,0|0,0,1]=3 55 B11R1.575 O=S(=O)([Na])OC1(CCCC1)O R153311 [0,1,0,0,1,0|2,0,0]=4 56 B13R1.352 CS(=O)(=O)CC(=O)C1CCCCC1 S244449 [0,1,0,0,0,1|2,0,0]=4 57 B13R1.352 CS(=O)(=O)CC(=O)C1CCCCC1 S280070 [0,1,0,0,0,1|2,0,0]=4 58 B13R1.3421 CC1CC(CC(C1)OS(=O)(=O)[O-])C R750379 [0,2,0,0,0,0|1,0,1]=4 59 B11R1.510 O=S(=O)(O)OCC1CCCN1 PH009286 [0,0,1,1,0,0|2,0,0]=4 60 B11R1.1121 CS(=O)(=O)N1CCCNCC1 CBR00825 [0,0,1,1,0,0|2,0,0]=4 61 B11R1.1121 O=S(=O)(Cl)N1CCCCCC1 CDS005838 [0,0,1,1,0,0|1,0,0]=3 62 B11R1.1121 O=S(=O)(O)C1CCCCCC1 PH016292 [0,0,1,1,0,0|1,0,0]=3 63 B11R2.10 [C@H]12CCCC[C@@H]1CC(=O)N2 T299146 [1,0,0,1,0,0|2,0,0]=4 64 B11R2.59 O=S1(=O)C=C2C1CCCC2 T163414 [1,0,0,1,0,0|1,0,1]=4 65 B13R2.18448 CS(=O)(=O)N1CC2C1CCCC2 T170364 [0,0,0,1,0,1|1,0,0]=3 66 B9R1.6 CC(=O)C1CCCCC1 PH000084 [1,0,0,0,1,0|2,0,0]=4 67 B9R1.6 O=C(O)C1CCCCO1 CDS015473 [1,0,0,0,1,0|2,0,0]=4 68 B9R1.6 O=C(O)C1CCCOC1 CDS010407 [1,0,0,0,1,0|2,0,0]=4 69 B9R1.13 NC(=O)NC1CCCC1 S345148 [1,0,0,0,1,0|2,0,0]=4 70 B11R1.91 CC(O)CNC1CCCCC1 PH010876 [1,0,0,0,0,1|2,0,0]=4 71 B11R1.91 CC(O)CNC1CCCCC1 S509108 [1,0,0,0,0,1|2,0,0]=4 72 B11R1.91 NC(=O)NCC1CCCCC1 S517046 [1,0,0,0,0,1|2,0,0]=4 73 B11R1.91 O=C(O)CNC1CCCCC1 PH010418 [1,0,0,0,0,1|1,0,0]=3 74 B11R1.742 NC(=O)NC1CCCCCC1 S344907 [1,0,0,0,0,1|2,0,0]=4 75 B13R1.3523 O=S(=O)(O)CCCN1CCCCC1 S551732 [0,0,0,0,0,2|2,0,0]=4