0 B9R1.35 C=C(Br)C1COC(=O)C1 T254126 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC1=NOC(C1)C(=O)O CBR01505 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.35 NC1=N[C@@H](CS1)C(=O)O PH008387 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O CDS009904 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.35 O=C(O)[C@@H]1CC(CN1)O PH018681 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.35 O=C1NC=C(N1)C(=O)O CBR00002 [0,0,0,0,0,0|1,0,2]=3 6 B8R1.1 CCC1COC(=O)N1 CBR02121 [1,0,0,0,0,0|2,0,1]=4 7 B8R1.1 NC[C@H]1CCC(=O)N1 CDS019095 [1,0,0,0,0,0|1,0,1]=3 8 B8R1.1 O=C1CC(CN1)CO CDS002555 [1,0,0,0,0,0|2,0,1]=4 9 B8R1.1 O=C1CCC(O1)CCl PH010125 [1,0,0,0,0,0|2,0,1]=4 10 B8R1.7 NC(=O)C1CCCC1 EME00440 [1,0,0,0,0,0|2,0,1]=4 11 B8R1.7 NC(=O)C1CCCN1 CDS008010 [1,0,0,0,0,0|1,0,1]=3 12 B8R1.7 O=C(O)C1=NC=CN1 CDS019334 [1,0,0,0,0,0|1,0,2]=4 13 B8R1.7 O=C(O)C1C=CCO1 CDS025234 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.7 O=C(O)C1CCNC1 CDS007406 [1,0,0,0,0,0|2,0,0]=3 15 B8R1.7 O=C(O)[C@@H]1CSCN1 PH000111 [1,0,0,0,0,0|1,0,1]=3 16 B8R1.7 S=C([S-])C1CCCN1 R128589 [1,0,0,0,0,0|0,2,1]=4 17 B10R1.14 COC(=O)C1CCC(=O)C1 SYX00133 [0,1,0,0,0,0|1,0,0]=2 18 B10R1.31 CCC1NC(CS1)C(=O)O S982571 [0,1,0,0,0,0|2,0,1]=4 19 B10R1.31 O=CC1=CC=C(N1)C(=O)O CDS004821 [0,1,0,0,0,0|0,0,3]=4 20 B10R1.58 CN1CC(CC1=O)C(=O)N PH010329 [0,1,0,0,0,0|3,0,0]=4 21 B10R1.58 CN1CC(CC1=O)C(=O)O PH009903 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.59 C[C@H]1OC(=O)N[C@@H]1C(=O)O PH017276 [0,1,0,0,0,0|1,0,0]=2 23 B10R1.194 CC(=O)C1COC(=O)C1=O PH009433 [0,1,0,0,0,0|3,0,0]=4 24 B10R1.194 CC1C(=O)CCC1C(=O)O PH018686 [0,1,0,0,0,0|1,0,0]=2 25 B10R1.359 CC1(NC(CS1)C(=O)O)C S71006 [0,1,0,0,0,0|2,0,1]=4 26 B10R1.359 CC1(NC(CS1)C(=O)O)C S942316 [0,1,0,0,0,0|2,0,1]=4 27 B10R1.470 CC1=CC(CC1)(C)C(=O)N T183784 [0,1,0,0,0,0|3,0,0]=4 28 B8R0.8 CCCCC(N)C(=O)N CDS003890 [0,0,1,0,0,0|2,0,1]=4 29 B8R0.8 CSCCC(O)C(=O)O PH000120 [0,0,1,0,0,0|3,0,0]=4 30 B8R0.8 NCCCC(N)C(=O)O S594881 [0,0,1,0,0,0|1,0,1]=3 31 B8R0.8 [C@H](N)(CSCC)C(=O)O S361615 [0,0,1,0,0,0|2,0,1]=4 32 B8R0.9 C(=C\C(=O)NC)\C(=O)O R436445 [0,0,1,0,0,0|2,0,1]=4 33 B8R0.9 C(=C\C(=O)NC)\C(=O)O S626813 [0,0,1,0,0,0|2,0,1]=4 34 B8R0.9 C=C(C)CNC(=O)CCl PH008781 [0,0,1,0,0,0|3,0,0]=4 35 B8R0.9 CCC(=O)CCC(=O)O S574090 [0,0,1,0,0,0|1,0,0]=2 36 B8R0.9 CCC(=O)COC(=O)C S362409 [0,0,1,0,0,0|3,0,0]=4 37 B8R0.9 CCC(=O)NC=C(Cl)Cl S196908 [0,0,1,0,0,0|2,0,1]=4 38 B8R0.9 COC(=O)NCC(=O)O CDS020780 [0,0,1,0,0,0|1,0,0]=2 39 B8R0.9 NCC(=O)NCC(=O)O S456829 [0,0,1,0,0,0|1,0,0]=2 40 B8R0.9 O=C(O)CNC(=O)CCl S451770 [0,0,1,0,0,0|1,0,0]=2 41 B8R0.23 CC(=O)C(C)CC(=O)O CDS000200 [0,0,1,0,0,0|3,0,0]=4 42 B8R0.23 CC(=O)NC(C)C(=O)N S784060 [0,0,1,0,0,0|1,0,0]=2 43 B8R0.23 CC(=O)NC(C)C(=O)O S783099 [0,0,1,0,0,0|0,0,0]=1 44 B8R0.23 CC(=O)ON(C)C(=O)C S295159 [0,0,1,0,0,0|3,0,0]=4 45 B8R0.23 CC(C)NC(C)C(=O)O PH010417 [0,0,1,0,0,0|1,0,1]=3 46 B8R0.23 CC(C)OC(C)C(=O)O CBR00291 [0,0,1,0,0,0|2,0,1]=4 47 B8R0.23 CC(CN(C)C)C(=O)O CBR01551 [0,0,1,0,0,0|3,0,0]=4 48 B8R0.23 NC(=O)CC(Br)C(=O)O PH007627 [0,0,1,0,0,0|3,0,0]=4 49 B8R0.23 OC(=O)[C@H](O)CC(=O)N PH009423 [0,0,1,0,0,0|3,0,0]=4 50 B8R0.28 CC(=O)CCCC(=O)N PH008391 [0,0,1,0,0,0|1,0,0]=2 51 B8R0.28 CC(=O)CCC[N+](=O)[O-] S885983 [0,0,1,0,0,0|2,0,1]=4 52 B8R0.28 CC(=O)CCOC(=O)C PH003361 [0,0,1,0,0,0|3,0,0]=4 53 B8R0.28 CC(=O)COCC(=O)C S38912 [0,0,1,0,0,0|3,0,0]=4 54 B8R0.28 CC(C)CCCC(=O)O CDS003381 [0,0,1,0,0,0|2,0,1]=4 55 B8R0.28 N=C(N)SCCC(=O)O S351814 [0,0,1,0,0,0|2,0,0]=3 56 B8R0.28 NC(=O)CCCC(=O)O CBR00275 [0,0,1,0,0,0|0,0,0]=1 57 B8R0.28 NC(=O)COCC(=O)N PH008890 [0,0,1,0,0,0|2,0,0]=3 58 B8R0.28 NC(=O)COCC(=O)O CBR00075 [0,0,1,0,0,0|1,0,0]=2 59 B8R0.28 NC(=O)CSCC(=O)N S365033 [0,0,1,0,0,0|2,0,0]=3 60 B8R0.28 NC(=O)CSCC(=O)O EME00128 [0,0,1,0,0,0|1,0,0]=2 61 B8R0.28 NC(=S)SCCC(=O)O S347884 [0,0,1,0,0,0|1,1,0]=3 62 B8R1.23 O=C(O)C1CC(C1)F CDS023094 [0,0,0,0,1,0|2,0,1]=4 63 B8R1.23 O=C(O)C1CC(C1)O CDS022840 [0,0,0,0,1,0|1,0,2]=4 64 B8R1.23 O=C1CC(C1)C(=O)O CDS004694 [0,0,0,0,1,0|1,0,0]=2 65 B10R1.13 CN1CCC(CC1)C(=O)O PH009778 [0,0,0,0,0,1|3,0,0]=4 66 B10R1.13 N1N=C(C=CC1=O)C(=O)O S909475 [0,0,0,0,0,1|0,0,3]=4 67 B10R1.13 NC1CCC(CC1)C(=O)O CDS000161 [0,0,0,0,0,1|2,0,1]=4 68 B10R1.13 O=C(O)C1CCC(CC1)F MNO000187 [0,0,0,0,0,1|2,0,1]=4 69 B10R1.13 O=C1C=CC(=NN1)C(=O)O CDS015149 [0,0,0,0,0,1|0,0,3]=4 70 B10R1.13 O=C1CCC(=NN1)C(=O)O PH011086 [0,0,0,0,0,1|0,0,1]=2 71 B10R1.13 [C@@H]1(CC[C@H](CC1)C(=O)O)O ANV00233 [0,0,0,0,0,1|1,0,2]=4 72 B10R1.54 CN1CCC(C1)CC(=O)O CBR02303 [0,0,0,0,0,1|3,0,0]=4 73 B10R1.113 CN1CCCC(C1)C(=O)O CDS003577 [0,0,0,0,0,1|3,0,0]=4 74 B10R1.113 CN1CCCC(C1)C(=O)O CDS015858 [0,0,0,0,0,1|3,0,0]=4 75 B10R1.113 CN1CCNC(C1)C(=O)O CBR02466 [0,0,0,0,0,1|3,0,0]=4 76 B10R1.113 CN1CCOC(C1)C(=O)O CDS009752 [0,0,0,0,0,1|3,0,0]=4 77 B10R1.113 NC1CCCC(C1)C(=O)O CDS000338 [0,0,0,0,0,1|2,0,1]=4 78 B10R1.113 O=C(O)C1CNCC(C1)O CDS021813 [0,0,0,0,0,1|1,0,2]=4 79 B10R1.113 O=C1CCCC(N1)C(=O)O CDS003761 [0,0,0,0,0,1|0,0,0]=1 80 B7R0.4 C=CCOCC(=O)O CDS023318 [1,0,1,0,0,0|2,0,0]=4 81 B7R0.4 CCOCCC(=O)O S448745 [1,0,1,0,0,0|2,0,0]=4 82 B7R0.4 CNCCCC(=O)O PH006886 [1,0,1,0,0,0|2,0,0]=4 83 B7R0.4 COCCCC(=O)O CDS021485 [1,0,1,0,0,0|2,0,0]=4 84 B7R0.4 CSCCCC(=O)O OTV000795 [1,0,1,0,0,0|2,0,0]=4 85 B7R0.4 N#CCCCC(=O)O CDS007802 [1,0,1,0,0,0|0,0,2]=4 86 B7R0.4 NC(=O)CCCCO S441481 [1,0,1,0,0,0|0,0,1]=3 87 B7R0.4 NC(=O)COCCO S449792 [1,0,1,0,0,0|1,0,1]=4 88 B7R0.4 NCCNCC(=O)O CDS000144 [1,0,1,0,0,0|1,0,1]=4 89 B7R0.4 NCCOCC(=O)O T160229 [1,0,1,0,0,0|1,0,1]=4 90 B7R0.5 C#CC[C@@H](N)C(=O)O CDS005053 [1,0,1,0,0,0|0,0,2]=4 91 B7R0.5 C(=O)NC(C)C(=O)O L159670 [1,0,1,0,0,0|0,0,0]=2 92 B7R0.5 CC(OC=O)C(=O)O PH007044 [1,0,1,0,0,0|1,0,0]=3 93 B7R0.5 CCN[C@@H](C)C(=O)N CDS021310 [1,0,1,0,0,0|1,0,1]=4 94 B7R0.5 CCOC(C)C(=O)O CBR01494 [1,0,1,0,0,0|1,0,1]=4 95 B7R0.5 CCSC(C)C(=O)O CBR01403 [1,0,1,0,0,0|1,0,1]=4 96 B7R0.5 CNCC(C)C(=O)O CBR01429 [1,0,1,0,0,0|2,0,0]=4 97 B7R0.5 CSC[C@@H](C)C(=O)O PH009560 [1,0,1,0,0,0|2,0,0]=4 98 B7R0.5 NCCC(N)C(=O)O PH018181 [1,0,1,0,0,0|1,0,0]=3 99 B7R0.6 NC(=O)NCC(=O)O L100056 [1,0,1,0,0,0|1,0,0]=3 100 B7R0.6 NC(=S)NCC(=O)O S521191 [1,0,1,0,0,0|1,1,0]=4 101 B7R0.6 O=C(O)CCC(=O)O S427594 [1,0,1,0,0,0|2,0,0]=4 102 B7R0.15 CCC(NN)C(=O)O PH009006 [1,0,1,0,0,0|1,0,0]=3 103 B7R0.15 CCC(NO)C(=O)O S283789 [1,0,1,0,0,0|0,0,1]=3 104 B7R0.2 C=CC(C)OC(=O)C S413755 [1,0,1,0,0,0|2,0,0]=4 105 B7R0.2 CC(=O)NC(C)C=O PH018360 [1,0,1,0,0,0|0,0,0]=2 106 B7R1.1 O=CC1CCCO1 CDS005466 [2,0,0,0,0,0|1,0,1]=4 107 B7R1.1 OCC1CCCN1 CDS000339 [2,0,0,0,0,0|0,0,2]=4 108 B7R1.2 CC1COC(=O)N1 CBR01603 [2,0,0,0,0,0|1,0,1]=4 109 B7R1.2 C[C@H]1COC(=O)N1 ANV00127 [2,0,0,0,0,0|1,0,1]=4 110 B7R1.2 O=C1CC(CO1)O S672874 [2,0,0,0,0,0|2,0,0]=4 111 B7R1.2 O=C1C[C@H](CO1)O CDS000753 [2,0,0,0,0,0|2,0,0]=4 112 B9R0.7 CC(=O)OC[C@H](N)C(=O)O CDS020792 [0,1,1,0,0,0|1,0,0]=3 113 B9R0.7 C[S+](C)CCC(N)C(=O)O S582026 [0,1,1,0,0,0|2,0,0]=4 114 B9R0.7 C[S+](C)CCC(N)C(=O)O S859427 [0,1,1,0,0,0|2,0,0]=4 115 B9R0.7 NC(=O)CC[C@H](N)C(=O)N CDS008161 [0,1,1,0,0,0|1,0,0]=3 116 B9R0.7 NC(=O)OCC(N)C(=O)O PH008887 [0,1,1,0,0,0|1,0,0]=3 117 B9R0.7 NC(CCC(=O)O)C(=O)[O-] R464414 [0,1,1,0,0,0|0,0,1]=3 118 B9R0.7 NC(CCC(=O)[O-])C(=O)[O-] S595179 [0,1,1,0,0,0|0,0,1]=3 119 B9R0.7 [C@@H](N)(CCC(=O)N)C(=O)O S452084 [0,1,1,0,0,0|0,0,0]=2 120 B9R0.7 [C@H](N)(CCC(=O)[O-])C(=O)O S372226 [0,1,1,0,0,0|0,0,0]=2 121 B9R0.47 [C@@H](N)(CSCCO)C(=O)O PH010771 [0,1,1,0,0,0|0,0,2]=4 122 B9R0.23 C=C(CC(=O)O)C(=O)OC R434264 [0,1,1,0,0,0|2,0,0]=4 123 B9R0.23 COC(=O)C(N)CC(=O)O CDS006063 [0,1,1,0,0,0|2,0,0]=4 124 B9R0.23 COC(=O)C(O)CC(=O)O CDS005345 [0,1,1,0,0,0|2,0,0]=4 125 B9R0.23 CSC(=S)N(C)CC(=O)O PH009443 [0,1,1,0,0,0|1,1,0]=4 126 B9R0.23 O=C(O)CC(Br)C(=O)CBr S563242 [0,1,1,0,0,0|2,0,0]=4 127 B9R0.24 CCC(=O)NNC(=O)CC S889598 [0,1,1,0,0,0|2,0,0]=4 128 B9R0.24 COC(=O)CNC(=O)CN R701602 [0,1,1,0,0,0|1,0,0]=3 129 B9R0.48 C(=C\C(=O)NCC)\C(=O)O S441392 [0,1,1,0,0,0|1,0,1]=4 130 B9R0.48 C=C(C)CNC(=O)NCC S805793 [0,1,1,0,0,0|2,0,0]=4 131 B9R0.48 C=C(C)CNC(=O)OCC S36022 [0,1,1,0,0,0|2,0,0]=4 132 B9R0.48 CCOC(=S)SCC(=O)O S390321 [0,1,1,0,0,0|1,1,0]=4 133 B9R0.48 CCSC(=S)NCC(=O)O S500496 [0,1,1,0,0,0|0,1,0]=3 134 B9R0.48 NCCC(=O)NCC(=O)O S451169 [0,1,1,0,0,0|0,0,0]=2 135 B9R0.15 C=CCC(CCC)C(=O)O PH004878 [0,1,1,0,0,0|2,0,0]=4 136 B9R0.33 C(=O)NC(C(=O)O)C(C)C S756725 [0,1,1,0,0,0|0,0,0]=2 137 B9R0.39 CC(=O)NC(CO)C(=O)N S784052 [0,1,1,0,0,0|2,0,0]=4 138 B9R0.39 CC(=O)NC(CO)C(=O)N S787175 [0,1,1,0,0,0|2,0,0]=4 139 B9R0.39 NC(=O)N[C@@H](CS)C(=O)O CDS006442 [0,1,1,0,0,0|1,0,0]=3 140 B9R0.39 O=C(O)CC(CS)C(=O)O PH008619 [0,1,1,0,0,0|2,0,0]=4 141 B9R0.39 [C@@H](CC)(NC(=O)C)C(=O)O S777684 [0,1,1,0,0,0|0,0,0]=2 142 B9R0.39 [C@H](CC(=O)O)(NC)C(=O)O R426059 [0,1,1,0,0,0|2,0,0]=4 143 B9R0.11 C=C(C)CC(C)(C)C(=O)O PH007652 [0,1,1,0,0,0|2,0,0]=4 144 B9R0.11 CC(=O)CC(C)(C)C(=O)O PH002522 [0,1,1,0,0,0|1,0,0]=3 145 B9R0.11 CC(C)(NC(=O)N)C(=O)O L159352 [0,1,1,0,0,0|1,0,0]=3 146 B9R0.79 CC(=O)C(C)C(C)C(=O)C S35395 [0,1,1,0,0,0|2,0,0]=4 147 B9R0.1 C=C(Br)CCCC(=O)OC T287547 [0,1,1,0,0,0|2,0,0]=4 148 B9R0.1 COC(=O)CSCC(=O)C PH010376 [0,1,1,0,0,0|2,0,0]=4 149 B9R0.1 NCC(=O)NCCC(=O)O S601128 [0,1,1,0,0,0|1,0,0]=3 150 B9R0.53 C=C(CC(=O)O)CC(=O)O PH009650 [0,1,1,0,0,0|1,0,1]=4 151 B9R0.53 CC(=O)SC(C)CC(=O)O S357278 [0,1,1,0,0,0|2,0,0]=4 152 B9R0.53 CC(CC(=O)N)CC(=O)N S595306 [0,1,1,0,0,0|1,0,0]=3 153 B9R0.56 CS(=O)(=O)CCCC(=O)O OTV000796 [0,1,1,0,0,0|2,0,0]=4 154 B9R1.125 CC1(CCC(=O)N1)C#N PH001391 [1,1,0,0,0,0|1,0,1]=4 155 B9R1.125 CC1(COC(=O)N1)CO S756229 [1,1,0,0,0,0|1,0,1]=4 156 B9R1.125 C[C@]1(CCC(=O)O1)CO T272442 [1,1,0,0,0,0|1,0,1]=4 157 B9R1.133 O=S1(=O)CCC(N1)CO PH018393 [1,1,0,0,0,0|1,0,1]=4 158 B9R1.133 O=S1(=O)CC[C@@H](N1)CO PH018887 [1,1,0,0,0,0|1,0,1]=4 159 B9R1.133 O=S1(=O)CC[C@H](N1)CO PH018886 [1,1,0,0,0,0|1,0,1]=4 160 B9R1.11 CNC(=O)C1CCCN1 CDS023077 [1,1,0,0,0,0|1,0,1]=4 161 B9R1.11 COC(=O)C1CCCN1 CDS003215 [1,1,0,0,0,0|0,0,1]=3 162 B9R1.11 COC(=O)C1CCCN1 CDS004943 [1,1,0,0,0,0|0,0,1]=3 163 B9R1.11 COC(=O)[C@@H]1CCOC1 PHB00042 [1,1,0,0,0,0|2,0,0]=4 164 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O CDS009161 [1,1,0,0,0,0|0,0,1]=3 165 B9R1.163 O=C(O)C1(CCCC1)O CBR00072 [1,1,0,0,0,0|1,0,1]=4 166 B9R1.163 O=C(O)C1(CCSC1)O PH001084 [1,1,0,0,0,0|2,0,0]=4 167 B11R1.39 COC(=O)/C=C/1\NC(=O)CS1 PH010287 [0,1,0,0,0,1|1,0,1]=4 168 B11R1.80 CC(=O)CC1CC(C(=O)O1)C T161233 [0,1,0,0,0,1|2,0,0]=4 169 B11R1.645 O=C(O)C[C@@H]1NC(=O)NC1=O S782580 [0,1,0,0,0,1|1,0,1]=4 170 B11R1.710 O=C(O)CC1CCS(=O)(=O)C1 PH010368 [0,1,0,0,0,1|2,0,0]=4 171 B11R1.74 N1C(=O)CC(CC1=O)C(=O)O S859974 [0,1,0,0,0,1|1,0,1]=4 172 B11R1.74 O=C1CC(=O)CC(C1)C(=O)O T172553 [0,1,0,0,0,1|1,0,0]=3 173 B11R1.74 O=C1CC(NC(=O)N1)C(=O)O S941646 [0,1,0,0,0,1|0,0,1]=3 174 B11R1.74 O=C1CC(NC(=S)N1)C(=O)O PH008666 [0,1,0,0,0,1|0,1,1]=4 175 B11R1.15 CCOC(=O)[C@@H]1CSC(=O)N1 R751480 [0,2,0,0,0,0|1,0,0]=3 176 B11R1.44 COC(=O)C1CCC(=N1)OC PH015636 [0,2,0,0,0,0|0,0,2]=4 177 B11R1.226 COC(=O)C1CC(=O)N(C1)C PH011738 [0,2,0,0,0,0|2,0,0]=4 178 B11R1.866 COC(=O)C1CCS(=O)(=O)N1 PH015984 [0,2,0,0,0,0|1,0,0]=3 179 B11R1.885 COC(=O)C1(C=C(CC1)C)C T178314 [0,2,0,0,0,0|2,0,0]=4 180 B11R1.175 O=C(O)C1CSC(N1)C(=O)O CDS000186 [0,2,0,0,0,0|1,0,1]=4 181 B11R1.489 CC1(OC(=O)CC1C(=O)O)C S462535 [0,2,0,0,0,0|2,0,0]=4 182 B9R1.6 O=C(O)C1CCSCN1 CBR00886 [0,0,1,1,0,0|2,0,0]=4 183 B9R1.112 N[C@@H](CC1CC1)C(=O)O CDS007244 [0,0,1,1,0,0|1,0,1]=4 184 B9R1.33 C=CCC1CCOC1=O T230685 [0,0,1,1,0,0|2,0,0]=4 185 B9R1.161 [C@@H]1(C[C@H]1C(=O)O)C(=O)O T177067 [0,0,1,1,0,0|2,0,0]=4 186 B9R2.39 O=C1CC2C=CC1C2 T227005 [1,0,0,1,0,0|2,0,0]=4 187 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1N2 BBO000411 [0,0,0,1,0,1|1,0,1]=4 188 B11R2.60 O=C1CCN2N1CCC2=O PH000259 [0,1,0,1,0,0|2,0,0]=4 189 B11R2.201 O=C1OC(=O)C2CCC1C2 S757330 [0,1,0,1,0,0|1,0,1]=4 190 B7R0.16 C=C(C)C(C)C(=O)C S304417 [0,0,1,0,1,0|2,0,0]=4 191 B7R0.16 CC(=O)N(C)C(=O)C S511196 [0,0,1,0,1,0|2,0,0]=4 192 B7R0.16 O=C(O)C(Br)C(=O)O PH003362 [0,0,1,0,1,0|2,0,0]=4 193 B7R1.18 NC(=O)C1CCC1 S680745 [1,0,0,0,1,0|1,0,1]=4 194 B7R1.18 O=C(O)C1CCN1 CDS008419 [1,0,0,0,1,0|0,0,0]=2 195 B9R0.4 CCCCC(N)CC(=O)O CBR00513 [0,0,1,0,0,1|1,0,1]=4 196 B9R0.55 NC(=O)CSCCC(=O)O EME00025 [0,0,1,0,0,1|0,0,0]=2 197 B9R0.55 NC(=O)NCCNC(=O)N S347906 [0,0,1,0,0,1|2,0,0]=4 198 B9R0.55 O=C(O)CCSCC(=O)O PH001934 [0,0,1,0,0,1|1,0,0]=3 199 B9R0.55 O=C([O-])CCCCC(=O)[O-] S566012 [0,0,1,0,0,1|1,0,1]=4 200 B9R1.2 C=CC1CCCC(=O)O1 T220795 [1,0,0,0,0,1|2,0,0]=4 201 B9R1.2 CCC1COCC(=O)N1 CBR01631 [1,0,0,0,0,1|1,0,1]=4 202 B9R1.13 O=C(O)CC1CCCO1 CDS001898 [1,0,0,0,0,1|1,0,1]=4 203 B11R1.75 CC(=O)CCC1CCC(=O)C1 T242535 [0,0,0,0,0,2|2,0,0]=4 204 B11R1.75 O=C(O)CCC1CCC(=O)N1 PH009802 [0,0,0,0,0,2|0,0,0]=2 205 B11R1.157 O=C(O)CC1CCCC(=O)C1 PH018197 [0,0,0,0,0,2|1,0,0]=3 206 B11R1.157 O=C(O)CN1CCNC(=O)C1 CBR00238 [0,0,0,0,0,2|2,0,0]=4