0 B9R1.35 CC1=CC=C(C(=O)O)N1 SC-94836 [0,0,0,0,0,0|1,0,3]=4 1 B9R1.35 CN1CCC(C(=O)O)C1 SC-71513 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 NC1=NC(C(=O)O)CS1 SC-62540 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.35 NC1=NC(C(=O)O)CS1 SC-88521 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.35 NC1C=C(C(=O)O)CC1 SC-51450 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.35 NC1CCC(C(=O)O)C1 SC-62151 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.35 NC1COC(C(=O)O)C1 SC-97560 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 SC-82495 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 SC-93696 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 SC-93674 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SC-52614 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SC-69232 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 SC-24076 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.35 O=C(O)C1CC(O)CN1 SC-03594 [0,0,0,0,0,0|2,0,2]=4 14 B9R1.35 O=C(O)C1CC(O)CN1 SC-09594 [0,0,0,0,0,0|2,0,2]=4 15 B9R1.35 O=C(O)C1CC(O)CN1 SC-29014 [0,0,0,0,0,0|2,0,2]=4 16 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 SC-89720 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 SC-52573 [0,0,0,0,0,0|2,0,2]=4 18 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CO1 SC-66730 [0,0,0,0,0,0|2,0,2]=4 19 B9R1.35 O=C(O)[C@H]1CC[C@@H](O)C1 SC-48116 [0,0,0,0,0,0|1,0,2]=3 20 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SC-48740 [0,0,0,0,0,0|2,0,2]=4 21 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SC-52422 [0,0,0,0,0,0|2,0,2]=4 22 B9R1.35 O=C1CCC(C(=O)O)C1 SC-28724 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.35 O=C1CCC(C(=O)O)N1 SC-01249 [0,0,0,0,0,0|0,0,0]=0 24 B9R1.35 O=C1CCC(C(=O)O)O1 SC-93768 [0,0,0,0,0,0|1,0,0]=1 25 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 SC-07520 [0,0,0,0,0,0|0,0,0]=0 26 B9R1.35 O=C1CN[C@H](C(=O)O)C1 SC-22199 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.35 O=C1CN[C@H](C(=O)O)C1 SC-52091 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 SC-51331 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.35 O=C1NC=C(C(=O)O)N1 SC-96089 [0,0,0,0,0,0|1,0,2]=3 30 B9R1.35 [C@@H]1(C(=O)O)CCC(=O)O1 SC-47439 [0,0,0,0,0,0|1,0,0]=1 31 B9R1.35 [C@@H]1(C(C)C)COC(=O)N1 SC-07436 [0,0,0,0,0,0|3,0,1]=4 32 B9R1.35 [C@H]1(C(=O)O)CCC(=O)N1 SC-04305 [0,0,0,0,0,0|0,0,0]=0 33 B9R1.35 [C@H]1(C(=O)O)CCC(=O)O1 SC-08888 [0,0,0,0,0,0|1,0,0]=1 34 B9R1.35 [C@H]1(C(C)C)COC(=O)N1 SC-01650 [0,0,0,0,0,0|3,0,1]=4 35 B8R1.1 C=CC1COC(=O)O1 SC-15987 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.1 C[C@H]1CC[C@@H](CO)N1 SC-91672 [1,0,0,0,0,0|1,0,2]=4 37 B8R1.1 NCC1CCC(=O)N1 SC-53656 [1,0,0,0,0,0|1,0,1]=3 38 B8R1.1 NCC1CCC(=O)N1 SC-A4485 [1,0,0,0,0,0|1,0,1]=3 39 B8R1.1 NC[C@@H]1CCC(=O)N1 SC-44056 [1,0,0,0,0,0|1,0,1]=3 40 B8R1.1 NC[C@H]1CCC(=O)N1 SC-44597 [1,0,0,0,0,0|1,0,1]=3 41 B8R1.1 NC[C@H]1CCC(=O)N1 SC-A3440 [1,0,0,0,0,0|1,0,1]=3 42 B8R1.1 O=C1CC(CO)CN1 SC-66045 [1,0,0,0,0,0|2,0,1]=4 43 B8R1.1 O=C1CCC(CO)N1 SC-19160 [1,0,0,0,0,0|0,0,1]=2 44 B8R1.1 O=C1CC[C@@H](CBr)N1 SC-23748 [1,0,0,0,0,0|1,0,1]=3 45 B8R1.1 O=C1CC[C@@H](CO)N1 SC-09020 [1,0,0,0,0,0|0,0,1]=2 46 B8R1.1 O=C1CC[C@H](CO)N1 SC-19648 [1,0,0,0,0,0|0,0,1]=2 47 B8R1.1 O=C1N[C@@H](CO)CO1 SC-33166 [1,0,0,0,0,0|1,0,1]=3 48 B8R1.1 O=C1N[C@H](CO)CO1 SC-33358 [1,0,0,0,0,0|1,0,1]=3 49 B8R1.1 [C@H]1(CBr)CCC(=O)N1 SC-23592 [1,0,0,0,0,0|1,0,1]=3 50 B8R1.7 CC(=O)C1CCCC1 SC-34558 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.7 CC(=O)C1CCCC1 SC-69830 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.7 NC(=O)C1CCCN1 SC-24789 [1,0,0,0,0,0|1,0,1]=3 53 B8R1.7 NC(=O)C1CCNC1 SC-A3191 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.7 NC(=O)[C@@H]1CCCN1 SC-06632 [1,0,0,0,0,0|1,0,1]=3 55 B8R1.7 NC(=O)[C@H]1CCCN1 SC-09817 [1,0,0,0,0,0|1,0,1]=3 56 B8R1.7 O=C(Cl)C1CCCC1 SC-45320 [1,0,0,0,0,0|2,0,1]=4 57 B8R1.7 O=C(Cl)C1CCOC1 SC-45575 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.7 O=C(O)C1=CC=CN1 SC-54396 [1,0,0,0,0,0|0,0,3]=4 59 B8R1.7 O=C(O)C1=CCCC1 SC-65352 [1,0,0,0,0,0|1,0,2]=4 60 B8R1.7 O=C(O)C1=NC=CN1 SC-13168 [1,0,0,0,0,0|1,0,2]=4 61 B8R1.7 O=C(O)C1=NCCC1 SC-A4966 [1,0,0,0,0,0|0,0,3]=4 62 B8R1.7 O=C(O)C1C=CCC1 SC-25940 [1,0,0,0,0,0|1,0,0]=2 63 B8R1.7 O=C(O)C1C=CCN1 SC-50874 [1,0,0,0,0,0|2,0,0]=3 64 B8R1.7 O=C(O)C1CCCC1 SC-18675 [1,0,0,0,0,0|1,0,1]=3 65 B8R1.7 O=C(O)C1CCCO1 SC-A4307 [1,0,0,0,0,0|1,0,1]=3 66 B8R1.7 O=C(O)C1CCCS1 SC-12921 [1,0,0,0,0,0|1,0,1]=3 67 B8R1.7 O=C(O)C1CCOC1 SC-21248 [1,0,0,0,0,0|2,0,0]=3 68 B8R1.7 O=C(O)[C@@H]1C=CCN1 SC-21522 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.7 O=C(O)[C@@H]1CCCN1 SC-09806 [1,0,0,0,0,0|0,0,1]=2 70 B8R1.7 O=C(O)[C@@H]1CCCO1 SC-07093 [1,0,0,0,0,0|1,0,1]=3 71 B8R1.7 O=C(O)[C@@H]1CCNC1 SC-48463 [1,0,0,0,0,0|2,0,0]=3 72 B8R1.7 O=C(O)[C@@H]1CCOC1 SC-25192 [1,0,0,0,0,0|2,0,0]=3 73 B8R1.7 O=C(O)[C@@H]1CSCN1 SC-77532 [1,0,0,0,0,0|1,0,1]=3 74 B8R1.7 O=C(O)[C@H]1C=CCN1 SC-52280 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.7 O=C(O)[C@H]1CCCO1 SC-07092 [1,0,0,0,0,0|1,0,1]=3 76 B8R1.7 O=C(O)[C@H]1CCNC1 SC-25206 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.7 O=C(O)[C@H]1CCOC1 SC-25181 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.7 OC(=S)[C@H]1CCCO1 SC-28168 [1,0,0,0,0,0|1,1,1]=4 79 B8R1.7 [C@@H]1(C(N)=O)CCCN1 SC-09818 [1,0,0,0,0,0|1,0,1]=3 80 B8R1.7 [C@H]1(C(=O)O)CCNC1 SC-48462 [1,0,0,0,0,0|2,0,0]=3 81 B8R1.7 [C@H]1(C(N)=O)CCCN1 SC-13550 [1,0,0,0,0,0|1,0,1]=3 82 B10R1.14 COC(=O)C1CC(=O)CO1 SC-21290 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.14 COC(=O)C1CCC(=O)C1 SC-32839 [0,1,0,0,0,0|1,0,0]=2 84 B10R1.14 COC(=O)C1CCC(O)C1 SC-A3344 [0,1,0,0,0,0|1,0,2]=4 85 B10R1.14 COC(=O)C1CNC(=O)C1 SC-49046 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 SC-24234 [0,1,0,0,0,0|0,0,0]=1 87 B10R1.14 COC(=O)[C@@H]1COC(=O)N1 SC-33725 [0,1,0,0,0,0|1,0,0]=2 88 B10R1.14 COC(=O)[C@H]1CC[C@H](O)C1 SC-84077 [0,1,0,0,0,0|1,0,2]=4 89 B10R1.14 COC(=O)[C@H]1COC(=O)N1 SC-33733 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.14 O=C1CC[C@@H](C(=O)CCl)N1 SC-48738 [0,1,0,0,0,0|1,0,0]=2 91 B10R1.194 CN1CCC(C(=O)O)C1=O SC-68665 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.359 O=C(O)C1CCC(F)(F)C1 SC-25380 [0,1,0,0,0,0|2,0,1]=4 93 B10R1.359 O=C(O)C1CCS(=O)(=O)C1 SC-29409 [0,1,0,0,0,0|2,0,0]=3 94 B8R0.8 CCCCC(N)C(=O)O SC-10365 [0,0,1,0,0,0|1,0,1]=3 95 B8R0.8 CCCC[C@@H](N)C(=O)O SC-10363 [0,0,1,0,0,0|1,0,1]=3 96 B8R0.8 CCOC[C@H](N)C(=O)O SC-68756 [0,0,1,0,0,0|2,0,1]=4 97 B8R0.8 COCC[C@@H](N)C(=O)O SC-49310 [0,0,1,0,0,0|2,0,0]=3 98 B8R0.8 CSCCC(N)C(N)=O SC-15811 [0,0,1,0,0,0|3,0,0]=4 99 B8R0.8 CSCC[C@H](N)C(=O)O SC-09744 [0,0,1,0,0,0|2,0,0]=3 100 B8R0.8 C[Se]CC[C@H](N)C(=O)O SC-19961 [0,0,1,0,0,0|2,0,0]=3 101 B8R0.8 NCCCC(N)C(=O)O SC-10385 [0,0,1,0,0,0|1,0,1]=3 102 B8R0.8 NCCCC(N)C(=O)O SC-48991 [0,0,1,0,0,0|1,0,1]=3 103 B8R0.9 CCC(=O)CCC(=O)O SC-58454 [0,0,1,0,0,0|1,0,0]=2 104 B8R0.9 CNC(=O)CCC(=O)O SC-70809 [0,0,1,0,0,0|2,0,0]=3 105 B8R0.9 COC(=O)CCC(=O)Cl SC-13608 [0,0,1,0,0,0|3,0,0]=4 106 B8R0.9 COC(=O)CCC(C)=O SC-74448 [0,0,1,0,0,0|3,0,0]=4 107 B8R0.9 COC(=O)CCC(N)=O SC-88449 [0,0,1,0,0,0|3,0,0]=4 108 B8R0.9 COC(=O)NCC(=O)O SC-01599 [0,0,1,0,0,0|1,0,0]=2 109 B8R0.9 NCC(=O)CCC(=O)O SC-15622 [0,0,1,0,0,0|2,0,0]=3 110 B8R0.9 NCC(=O)CCC(=O)O SC-52394 [0,0,1,0,0,0|2,0,0]=3 111 B8R0.15 CCCC(CC)C(=O)O SC-82317 [0,0,1,0,0,0|2,0,1]=4 112 B8R0.23 C=C(NC(C)=O)C(=O)O SC-48847 [0,0,1,0,0,0|0,0,2]=3 113 B8R0.23 CC(=O)C(C)CC(=O)O SC-21504 [0,0,1,0,0,0|3,0,0]=4 114 B8R0.23 CC(=O)NC(C)C(=O)O SC-19084 [0,0,1,0,0,0|0,0,0]=1 115 B8R0.23 CC(=O)N[C@@H](C)C(=O)O SC-09273 [0,0,1,0,0,0|0,0,0]=1 116 B8R0.23 CC(=O)O[C@@H](C)C(N)=S SC-53477 [0,0,1,0,0,0|2,1,0]=4 117 B8R0.23 CC(CC(=O)O)C(=O)O SC-51763 [0,0,1,0,0,0|2,0,0]=3 118 B8R0.23 C[C@@H](CC(=O)O)C(=O)O SC-08886 [0,0,1,0,0,0|2,0,0]=3 119 B8R0.23 NC(=O)C[C@@H](N)C(=O)O SC-09347 [0,0,1,0,0,0|3,0,0]=4 120 B8R0.23 NC(=O)NC(O)C(=O)O SC-49973 [0,0,1,0,0,0|2,0,0]=3 121 B8R0.23 O=C(O)CC(O)C(=O)O SC-19305 [0,0,1,0,0,0|3,0,0]=4 122 B8R0.23 O=C(O)CC(O)C(=O)O SC-43909 [0,0,1,0,0,0|3,0,0]=4 123 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O SC-04187 [0,0,1,0,0,0|3,0,0]=4 124 B8R0.23 O=C(O)C[C@@H](O)C(=O)O SC-05990 [0,0,1,0,0,0|3,0,0]=4 125 B8R0.23 O=C(O)C[C@H](Br)C(=O)O SC-26843 [0,0,1,0,0,0|3,0,0]=4 126 B8R0.23 [C@@H](C)(OC(C)=O)C(=O)O SC-08840 [0,0,1,0,0,0|1,0,0]=2 127 B8R0.28 C=C(C)CCCC(=O)O SC-31519 [0,0,1,0,0,0|2,0,0]=3 128 B8R0.28 CC(=O)C\C=C\C(=O)O SC-70039 [0,0,1,0,0,0|1,0,2]=4 129 B8R0.28 N=C(N)NCCC(=O)O SC-46005 [0,0,1,0,0,0|2,0,0]=3 130 B8R0.28 NC(=O)CCCC(N)=O SC-87623 [0,0,1,0,0,0|1,0,0]=2 131 B8R0.28 O=C(Cl)CCCC(=O)Cl SC-52786 [0,0,1,0,0,0|2,0,0]=3 132 B8R0.28 O=C(O)CNCC(=O)O SC-79871 [0,0,1,0,0,0|2,0,0]=3 133 B8R0.28 O=C(O)COCC(=O)O SC-93218 [0,0,1,0,0,0|2,0,0]=3 134 B8R0.28 O=C(O)\C=C\CC(=O)O SC-37894 [0,0,1,0,0,0|1,0,2]=4 135 B10R2.357 O=C(O)C1CC2CC2C1 SC-25088 [0,0,0,1,0,0|2,0,1]=4 136 B10R2.357 O=C(O)C1CC2CC2C1 SC-B7776 [0,0,0,1,0,0|2,0,1]=4 137 B10R2.357 [C@H]12C[C@H]1C[C@@H](C(N)=O)N2 SC-84318 [0,0,0,1,0,0|2,0,1]=4 138 B10R2.357 [C@H]12C[C@H]1C[C@@H](C(N)=O)N2 SC-86927 [0,0,0,1,0,0|2,0,1]=4 139 B10R2.357 [C@H]12C[C@H]1C[C@@H](C(N)=O)N2 SC-A2404 [0,0,0,1,0,0|2,0,1]=4 140 B8R1.23 C=C1CC(C(=O)O)C1 SC-20999 [0,0,0,0,1,0|2,0,0]=3 141 B8R1.23 CC(=O)N1CC(=O)C1 SC-49225 [0,0,0,0,1,0|3,0,0]=4 142 B8R1.23 CC1CC(C(=O)O)C1 SC-73078 [0,0,0,0,1,0|2,0,1]=4 143 B8R1.23 CN1CC(C(=O)O)C1 SC-49053 [0,0,0,0,1,0|3,0,0]=4 144 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SC-48610 [0,0,0,0,1,0|2,0,1]=4 145 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SC-70419 [0,0,0,0,1,0|2,0,1]=4 146 B8R1.23 O=C(O)C1CC(F)C1 SC-26589 [0,0,0,0,1,0|2,0,1]=4 147 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 SC-96294 [0,0,0,0,1,0|1,0,2]=4 148 B8R1.23 O=C1CC(C(=O)O)C1 SC-14962 [0,0,0,0,1,0|1,0,0]=2 149 B8R1.23 O=C1CC(C(=O)O)N1 SC-51258 [0,0,0,0,1,0|0,0,0]=1 150 B8R1.23 [C@@H]1(C(=O)O)CC(=O)N1 SC-15020 [0,0,0,0,1,0|0,0,0]=1 151 B10R1.13 CC(=O)N1CCC(=O)CC1 SC-18691 [0,0,0,0,0,1|3,0,0]=4 152 B10R1.13 CN1CCC(C(=O)O)CC1 SC-06275 [0,0,0,0,0,1|3,0,0]=4 153 B10R1.13 CN1CCC(C(=O)O)CC1 SC-26675 [0,0,0,0,0,1|3,0,0]=4 154 B10R1.13 CN1CCC(C(=O)O)CC1 SC-77778 [0,0,0,0,0,1|3,0,0]=4 155 B10R1.13 C[C@H]1CC[C@H](C(=O)O)CC1 SC-00751 [0,0,0,0,0,1|2,0,1]=4 156 B10R1.13 NC1CCC(C(=O)O)CC1 SC-46143 [0,0,0,0,0,1|2,0,1]=4 157 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 SC-43852 [0,0,0,0,0,1|2,0,1]=4 158 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 SC-47469 [0,0,0,0,0,1|2,0,1]=4 159 B10R1.13 O=C(O)C1CCC(O)CC1 SC-47408 [0,0,0,0,0,1|1,0,2]=4 160 B10R1.13 O=C(O)C1CCC(O)CC1 SC-84382 [0,0,0,0,0,1|1,0,2]=4 161 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 SC-51226 [0,0,0,0,0,1|0,0,2]=3 162 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 SC-B8363 [0,0,0,0,0,1|0,0,2]=3 163 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 SC-51087 [0,0,0,0,0,1|1,0,2]=4 164 B10R1.13 O=C1C=CC(C(=O)O)=NN1 SC-49079 [0,0,0,0,0,1|0,0,3]=4 165 B10R1.13 O=C1CCC(C(=O)O)CC1 SC-66056 [0,0,0,0,0,1|1,0,0]=2 166 B10R1.13 O=C1CCC(C(=O)O)CN1 SC-91365 [0,0,0,0,0,1|0,0,0]=1 167 B10R1.13 O=C1CNC(C(=O)O)CN1 SC-47913 [0,0,0,0,0,1|1,0,0]=2 168 B10R1.54 O=C(O)CC1CCC(=O)C1 SC-32553 [0,0,0,0,0,1|1,0,0]=2 169 B10R1.54 O=C1CCC(C[N+](=O)[O-])C1 SC-33861 [0,0,0,0,0,1|2,0,1]=4 170 B10R1.113 CC1CCCC(C(=O)O)C1 SC-52381 [0,0,0,0,0,1|2,0,1]=4 171 B10R1.113 CN1CCCC(C(=O)O)C1 SC-53949 [0,0,0,0,0,1|3,0,0]=4 172 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)O)C1 SC-21748 [0,0,0,0,0,1|2,0,1]=4 173 B10R1.113 NC1CCCC(C(=O)O)C1 SC-15059 [0,0,0,0,0,1|2,0,1]=4 174 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 SC-48763 [0,0,0,0,0,1|2,0,1]=4 175 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 SC-48783 [0,0,0,0,0,1|2,0,1]=4 176 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 SC-68749 [0,0,0,0,0,1|2,0,1]=4 177 B10R1.113 O=C(O)C1CNCC(O)C1 SC-26985 [0,0,0,0,0,1|1,0,2]=4 178 B10R1.113 O=C(O)C1CNCC(O)C1 SC-51267 [0,0,0,0,0,1|1,0,2]=4 179 B10R1.113 O=C1C=CC=C(C(=O)O)N1 SC-02137 [0,0,0,0,0,1|0,0,3]=4 180 B10R1.113 O=C1CC(C(=O)O)CCN1 SC-95916 [0,0,0,0,0,1|1,0,0]=2 181 B10R1.113 O=C1CCCC(C(=O)O)N1 SC-49024 [0,0,0,0,0,1|0,0,0]=1 182 B10R1.113 O=C1CCC[C@@H](C(=O)O)N1 SC-22183 [0,0,0,0,0,1|0,0,0]=1 183 B10R1.113 O=C1CCNC(C(=O)O)C1 SC-A4097 [0,0,0,0,0,1|1,0,0]=2 184 B10R1.113 O=C1CSCC(C(=O)O)N1 SC-84528 [0,0,0,0,0,1|0,0,0]=1 185 B7R0.3 COC(=O)CCC=O SC-47529 [1,0,1,0,0,0|2,0,0]=4 186 B7R0.4 C#CCCCC(=O)O SC-73017 [1,0,1,0,0,0|1,0,1]=4 187 B7R0.4 C=CCCCC(=O)O SC-93956 [1,0,1,0,0,0|1,0,0]=3 188 B7R0.4 C=CCNCC(=O)O SC-74362 [1,0,1,0,0,0|2,0,0]=4 189 B7R0.4 C=CCOCC(=O)O SC-35140 [1,0,1,0,0,0|2,0,0]=4 190 B7R0.4 C=CCOCC(=O)O SC-49027 [1,0,1,0,0,0|2,0,0]=4 191 B7R0.4 CCCNCC(=O)O SC-97541 [1,0,1,0,0,0|0,0,1]=3 192 B7R0.4 CCCSCC(=O)O SC-45283 [1,0,1,0,0,0|1,0,1]=4 193 B7R0.4 CNCCCC(=O)O SC-49793 [1,0,1,0,0,0|2,0,0]=4 194 B7R0.4 CNCCCC(=O)O SC-A2900 [1,0,1,0,0,0|2,0,0]=4 195 B7R0.4 COCCCC(=O)O SC-51378 [1,0,1,0,0,0|2,0,0]=4 196 B7R0.4 C\C=C\CCC(=O)O SC-21245 [1,0,1,0,0,0|1,0,1]=4 197 B7R0.4 NC(=O)CCCCBr SC-98143 [1,0,1,0,0,0|1,0,1]=4 198 B7R0.4 NCCCCC(=O)O SC-10120 [1,0,1,0,0,0|0,0,1]=3 199 B7R0.4 NCCCCC(=O)O SC-92391 [1,0,1,0,0,0|0,0,1]=3 200 B7R0.4 NCCCCC(N)=O SC-94858 [1,0,1,0,0,0|1,0,1]=4 201 B7R0.4 NCCCCC(N)=O SC-A4262 [1,0,1,0,0,0|1,0,1]=4 202 B7R0.4 NCCNCC(=O)O SC-21750 [1,0,1,0,0,0|1,0,1]=4 203 B7R0.4 O=C(O)CCCCBr SC-02338 [1,0,1,0,0,0|1,0,1]=4 204 B7R0.5 C#CCC(N)C(=O)O SC-70414 [1,0,1,0,0,0|0,0,2]=4 205 B7R0.5 C#CC[C@@H](N)C(=O)O SC-A2980 [1,0,1,0,0,0|0,0,2]=4 206 B7R0.5 C=CCC(N)C(=O)O SC-10031 [1,0,1,0,0,0|0,0,1]=3 207 B7R0.5 C=CCC(N)C(=O)O SC-10032 [1,0,1,0,0,0|0,0,1]=3 208 B7R0.5 C=CCC(N)C(=O)O SC-14116 [1,0,1,0,0,0|0,0,1]=3 209 B7R0.5 C=CC[C@@H](N)C(=O)O SC-25316 [1,0,1,0,0,0|0,0,1]=3 210 B7R0.5 C=CC[C@H](N)C(=O)O SC-14143 [1,0,1,0,0,0|0,0,1]=3 211 B7R0.5 CCCC(Br)C(=O)O SC-27020 [1,0,1,0,0,0|1,0,1]=4 212 B7R0.5 CCC[C@@H](C)C(=O)O SC-43566 [1,0,1,0,0,0|1,0,1]=4 213 B7R0.5 CCC[C@H](C)C(=O)O SC-67603 [1,0,1,0,0,0|1,0,1]=4 214 B7R0.5 CCC[C@H](N)C(=O)O SC-06139 [1,0,1,0,0,0|0,0,1]=3 215 B7R0.5 CCC[C@H](O)C(=O)O SC-21948 [1,0,1,0,0,0|1,0,1]=4 216 B7R0.5 COCC(N)C(=O)O SC-43930 [1,0,1,0,0,0|1,0,1]=4 217 B7R0.5 COC[C@@H](N)C(=O)O SC-44175 [1,0,1,0,0,0|1,0,1]=4 218 B7R0.5 COC[C@@H](N)C(=O)O SC-52821 [1,0,1,0,0,0|1,0,1]=4 219 B7R0.5 COC[C@H](N)C(=O)O SC-26107 [1,0,1,0,0,0|1,0,1]=4 220 B7R0.5 COC[C@H](N)C(=O)O SC-47929 [1,0,1,0,0,0|1,0,1]=4 221 B7R0.5 NC(CCO)C(=O)O SC-10290 [1,0,1,0,0,0|0,0,1]=3 222 B7R0.5 NCCC(N)C(=O)O SC-10146 [1,0,1,0,0,0|1,0,0]=3 223 B7R0.5 NCCC(N)C(=O)O SC-20723 [1,0,1,0,0,0|1,0,0]=3 224 B7R0.5 NCCC(N)C(=O)O SC-23452 [1,0,1,0,0,0|1,0,0]=3 225 B7R0.5 NCCC(N)C(=O)O SC-25055 [1,0,1,0,0,0|1,0,0]=3 226 B7R0.5 NCCC(O)C(=O)O SC-16245 [1,0,1,0,0,0|2,0,0]=4 227 B7R0.5 NCC[C@@H](O)C(=O)O SC-26595 [1,0,1,0,0,0|2,0,0]=4 228 B7R0.5 NCC[C@H](N)C(=O)O SC-10144 [1,0,1,0,0,0|1,0,0]=3 229 B7R0.5 N[C@@H](CCO)C(=O)O SC-10291 [1,0,1,0,0,0|0,0,1]=3 230 B7R0.6 C=C(C)CCC(=O)O SC-31541 [1,0,1,0,0,0|2,0,0]=4 231 B7R0.6 CC(=O)CNC(C)=O SC-72248 [1,0,1,0,0,0|1,0,0]=3 232 B7R0.6 CC(=O)NCB(O)O SC-87534 [1,0,1,0,0,0|1,0,1]=4 233 B7R0.6 CC(=O)OCC(=O)O SC-65254 [1,0,1,0,0,0|1,0,0]=3 234 B7R0.6 CC(=O)\C=C\C(=O)O SC-94119 [1,0,1,0,0,0|1,0,1]=4 235 B7R0.15 CNC(CO)C(=O)O SC-26706 [1,0,1,0,0,0|1,0,1]=4 236 B7R0.15 O=C(O)[C@H](CO)NP SC-A4575 [1,0,1,0,0,0|2,0,0]=4 237 B7R0.15 [C@@H](CO)(NC)C(=O)O SC-20914 [1,0,1,0,0,0|1,0,1]=4 238 B7R1.1 O=CC1CCCC1 SC-21778 [2,0,0,0,0,0|1,0,1]=4 239 B7R1.1 O=CC1CCCC1 SC-44728 [2,0,0,0,0,0|1,0,1]=4 240 B7R1.1 O=CC1CCNC1 SC-85271 [2,0,0,0,0,0|2,0,0]=4 241 B7R1.1 O=CC1CCOC1 SC-29081 [2,0,0,0,0,0|2,0,0]=4 242 B7R1.1 OCC1CCCN1 SC-12006 [2,0,0,0,0,0|0,0,2]=4 243 B7R1.1 OC[C@@H]1CCCN1 SC-48321 [2,0,0,0,0,0|0,0,2]=4 244 B7R1.2 CC1CCC(=O)C1 SC-93748 [2,0,0,0,0,0|1,0,1]=4 245 B7R1.2 CC1CCC(=O)N1 SC-89347 [2,0,0,0,0,0|0,0,1]=3 246 B7R1.2 CC1CNC(=O)N1 SC-65644 [2,0,0,0,0,0|1,0,1]=4 247 B7R1.2 C[C@@H]1CCC(=O)O1 SC-65777 [2,0,0,0,0,0|1,0,1]=4 248 B7R1.2 C[C@@H]1COC(=O)N1 SC-43641 [2,0,0,0,0,0|1,0,1]=4 249 B7R1.2 C[C@@H]1COC(=O)N1 SC-51055 [2,0,0,0,0,0|1,0,1]=4 250 B7R1.2 C[C@H]1CCC(=O)O1 SC-86851 [2,0,0,0,0,0|1,0,1]=4 251 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [2,0,0,0,0,0|1,0,1]=4 252 B7R1.2 O=C1CC(O)CN1 SC-29049 [2,0,0,0,0,0|2,0,0]=4 253 B7R1.2 O=C1CCC(=O)C1 SC-15331 [2,0,0,0,0,0|1,0,1]=4 254 B7R1.2 O=C1CCC(Cl)O1 SC-69818 [2,0,0,0,0,0|2,0,0]=4 255 B7R1.2 O=C1COC(=O)N1 SC-49693 [2,0,0,0,0,0|1,0,1]=4 256 B7R1.2 O=C1C[C@@H](O)CN1 SC-02616 [2,0,0,0,0,0|2,0,0]=4 257 B7R1.2 O=C1C[C@H](O)CN1 SC-13587 [2,0,0,0,0,0|2,0,0]=4 258 B7R1.2 O=C1C[C@H](O)CO1 SC-06559 [2,0,0,0,0,0|2,0,0]=4 259 B9R0.6 CCCC(C)C(N)C(=O)O SC-45629 [0,1,1,0,0,0|1,0,1]=4 260 B9R0.7 C=C(C)CC[C@H](C)C(=O)O SC-31724 [0,1,1,0,0,0|2,0,0]=4 261 B9R0.7 CC(C)=CCC(N)C(=O)O SC-22867 [0,1,1,0,0,0|1,0,1]=4 262 B9R0.7 CC(C)CC[C@H](N)C(=O)O SC-93270 [0,1,1,0,0,0|1,0,1]=4 263 B9R0.7 CC(CCC(=O)Cl)C(=O)Cl SC-25336 [0,1,1,0,0,0|2,0,0]=4 264 B9R0.7 CC(CCC(=O)O)C(=O)O SC-53293 [0,1,1,0,0,0|1,0,0]=3 265 B9R0.7 NC(=O)NC[C@H](N)C(=O)O SC-66318 [0,1,1,0,0,0|1,0,0]=3 266 B9R0.7 NC(=O)SCC(N)C(=O)O SC-25048 [0,1,1,0,0,0|1,0,0]=3 267 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O SC-94352 [0,1,1,0,0,0|1,0,0]=3 268 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O SC-05406 [0,1,1,0,0,0|0,0,0]=2 269 B9R0.7 N[C@H](CCC(=O)O)C(=O)O SC-09473 [0,1,1,0,0,0|0,0,0]=2 270 B9R0.7 N[C@H](CCC(=O)O)C(=O)O SC-49449 [0,1,1,0,0,0|0,0,0]=2 271 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O SC-24972 [0,1,1,0,0,0|1,0,0]=3 272 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] SC-20382 [0,1,1,0,0,0|1,0,1]=4 273 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] SC-88740 [0,1,1,0,0,0|1,0,1]=4 274 B9R0.8 COC(=O)C(N)CCSC SC-17534 [0,1,1,0,0,0|2,0,0]=4 275 B9R0.8 COC(=O)[C@H](N)CCCN SC-10414 [0,1,1,0,0,0|1,0,1]=4 276 B9R0.13 C=CCC[C@@H](C=C)C(=O)O SC-31454 [0,1,1,0,0,0|2,0,0]=4 277 B9R0.13 C=CCC[C@H](C=C)C(=O)O SC-31713 [0,1,1,0,0,0|2,0,0]=4 278 B9R0.47 C=CCCC[C@@H](C)C(=O)O SC-31827 [0,1,1,0,0,0|2,0,0]=4 279 B9R0.47 C=CCCC[C@H](C)C(=O)O SC-31058 [0,1,1,0,0,0|2,0,0]=4 280 B9R0.47 C=CCSCC(N)C(=O)O SC-10024 [0,1,1,0,0,0|1,0,0]=3 281 B9R0.47 C=CCSC[C@H](N)C(=O)O SC-10023 [0,1,1,0,0,0|1,0,0]=3 282 B9R0.47 CCCCCC(N)C(=O)O SC-10084 [0,1,1,0,0,0|1,0,1]=4 283 B9R0.47 CCCCCC(N)C(=O)O SC-10085 [0,1,1,0,0,0|1,0,1]=4 284 B9R0.47 CCCCC[C@@H](N)C(=O)O SC-10086 [0,1,1,0,0,0|1,0,1]=4 285 B9R0.47 CCSCCC(N)C(=O)O SC-10254 [0,1,1,0,0,0|1,0,1]=4 286 B9R0.47 CC[Se]CCC(N)C(=O)O SC-69852 [0,1,1,0,0,0|1,0,1]=4 287 B9R0.47 COCCC[C@@H](N)C(=O)O SC-49289 [0,1,1,0,0,0|0,0,2]=4 288 B9R0.47 CSCCC[C@@H](N)C(=O)O SC-49287 [0,1,1,0,0,0|0,1,1]=4 289 B9R0.47 NCCCCC(N)C(=O)O SC-06113 [0,1,1,0,0,0|1,0,1]=4 290 B9R0.47 NCCCCC(N)C(=O)O SC-09671 [0,1,1,0,0,0|1,0,1]=4 291 B9R0.47 NCCCCC(N)C(=O)O SC-19760 [0,1,1,0,0,0|1,0,1]=4 292 B9R0.47 NCCCCC(N)C(=O)O SC-20502 [0,1,1,0,0,0|1,0,1]=4 293 B9R0.47 NCCCC[C@H](N)C(=O)O SC-09670 [0,1,1,0,0,0|1,0,1]=4 294 B9R0.47 NCCCC[C@H](N)C(=O)O SC-22201 [0,1,1,0,0,0|1,0,1]=4 295 B9R0.47 [C@@H](N)(CCCCN)C(=O)O SC-07335 [0,1,1,0,0,0|1,0,1]=4 296 B9R0.51 C=CCCC(C)(C)C(=O)O SC-34922 [0,1,1,0,0,0|2,0,0]=4 297 B9R0.23 COC(=O)[C@@H](N)CC(=O)O SC-24738 [0,1,1,0,0,0|2,0,0]=4 298 B9R0.23 COC(=O)[C@H](N)CC(=O)O SC-65762 [0,1,1,0,0,0|2,0,0]=4 299 B9R0.24 CCC(=O)CCC(=O)CC SC-89953 [0,1,1,0,0,0|2,0,0]=4 300 B9R0.24 COC(=O)CCC(=O)CN SC-01776 [0,1,1,0,0,0|2,0,0]=4 301 B9R0.48 CCOC(=O)CCC(=O)O SC-48671 [0,1,1,0,0,0|1,0,0]=3 302 B9R0.48 CCOC(=O)\C=C\C(=O)O SC-17455 [0,1,1,0,0,0|1,0,1]=4 303 B9R0.39 CC(=O)N[C@H](CS)C(=O)O SC-68544 [0,1,1,0,0,0|1,0,0]=3 304 B9R0.11 CC(=O)OC(C)(C)C(=O)Br SC-17645 [0,1,1,0,0,0|2,0,0]=4 305 B9R0.11 CC(=O)OC(C)(C)C(=O)Cl SC-25915 [0,1,1,0,0,0|2,0,0]=4 306 B9R0.11 CC(C)(CC(=O)O)C(=O)O SC-26972 [0,1,1,0,0,0|2,0,0]=4 307 B9R0.1 C=CC(=O)OCCC(=O)O SC-65069 [0,1,1,0,0,0|2,0,0]=4 308 B9R0.1 CN(CCCC(=O)O)N=O SC-A4543 [0,1,1,0,0,0|2,0,0]=4 309 B9R0.1 COC(=O)CCCC(=O)O SC-85837 [0,1,1,0,0,0|1,0,0]=3 310 B9R0.1 COC(=O)CCCC(C)=O SC-A5811 [0,1,1,0,0,0|1,0,0]=3 311 B9R0.1 COC(=O)CCC[N+](=O)[O-] SC-70223 [0,1,1,0,0,0|2,0,0]=4 312 B9R0.1 COC(=O)CSCC(C)=O SC-68739 [0,1,1,0,0,0|2,0,0]=4 313 B9R0.53 CC(CC(=O)O)CC(=O)O SC-15126 [0,1,1,0,0,0|1,0,0]=3 314 B9R1.11 COC(=O)C1C=CCN1 SC-51004 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.11 COC(=O)C1CC=CC1 SC-19292 [1,1,0,0,0,0|1,0,1]=4 316 B9R1.11 COC(=O)C1CCCC1 SC-58226 [1,1,0,0,0,0|1,0,1]=4 317 B9R1.11 COC(=O)C1CCCN1 SC-01646 [1,1,0,0,0,0|0,0,1]=3 318 B9R1.11 COC(=O)C1CCCN1 SC-12256 [1,1,0,0,0,0|0,0,1]=3 319 B9R1.11 COC(=O)C1CCOC1 SC-99459 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.11 COC(=O)[C@@H]1CCCN1 SC-17303 [1,1,0,0,0,0|0,0,1]=3 321 B9R1.11 COC(=O)[C@@H]1CCNC1 SC-70520 [1,1,0,0,0,0|2,0,0]=4 322 B9R1.11 COC(=O)[C@H]1CCCN1 SC-09823 [1,1,0,0,0,0|0,0,1]=3 323 B9R1.11 COC(=O)[C@H]1CCCN1 SC-50892 [1,1,0,0,0,0|0,0,1]=3 324 B9R1.11 COC(=O)[C@H]1CCNC1 SC-98419 [1,1,0,0,0,0|2,0,0]=4 325 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-21501 [1,1,0,0,0,0|0,0,1]=3 326 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-28867 [1,1,0,0,0,0|0,0,1]=3 327 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-52270 [1,1,0,0,0,0|0,0,1]=3 328 B9R1.41 CN1CCC[C@H]1C(=O)O SC-21471 [1,1,0,0,0,0|0,0,1]=3 329 B9R1.41 CN1CCC[C@H]1C(=O)O SC-23602 [1,1,0,0,0,0|0,0,1]=3 330 B9R1.41 NC1CCCC1C(=O)O SC-29667 [1,1,0,0,0,0|1,0,1]=4 331 B9R1.41 NC1CCCC1C(=O)O SC-A3650 [1,1,0,0,0,0|1,0,1]=4 332 B9R1.41 NC1CCNC1C(=O)O SC-49345 [1,1,0,0,0,0|0,0,1]=3 333 B9R1.41 NC1CCSC1C(=O)O SC-29866 [1,1,0,0,0,0|1,0,1]=4 334 B9R1.41 NC1CSCC1C(=O)O SC-30185 [1,1,0,0,0,0|2,0,0]=4 335 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O SC-21947 [1,1,0,0,0,0|0,0,1]=3 336 B9R1.163 CC1(C(=O)O)CCCC1 SC-26150 [1,1,0,0,0,0|1,0,1]=4 337 B9R1.163 CC1(C(=O)O)CCNC1 SC-69239 [1,1,0,0,0,0|2,0,0]=4 338 B9R1.163 C[C@@]1(C(N)=O)CCCN1 SC-88089 [1,1,0,0,0,0|1,0,1]=4 339 B9R1.163 C[C@]1(C(=O)O)CCCN1 SC-87593 [1,1,0,0,0,0|0,0,1]=3 340 B9R1.163 C[C@]1(C(=O)O)CCNC1 SC-A3614 [1,1,0,0,0,0|2,0,0]=4 341 B9R1.163 NC1(C(=O)O)CC=CC1 SC-31553 [1,1,0,0,0,0|1,0,1]=4 342 B9R1.163 NC1(C(=O)O)CCCC1 SC-11054 [1,1,0,0,0,0|1,0,1]=4 343 B9R1.163 NC1(C(=O)O)CCNC1 SC-49720 [1,1,0,0,0,0|2,0,0]=4 344 B9R1.163 NC1(C(=O)O)CCOC1 SC-35949 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.163 O=C(O)C1(O)CCCC1 SC-A3517 [1,1,0,0,0,0|1,0,1]=4 346 B9R1.55 C=C1CC(C(=O)O)C1N SC-29613 [0,1,0,0,1,0|2,0,0]=4 347 B9R1.82 C=C1CC(C(=O)OC)C1 SC-48884 [0,1,0,0,1,0|2,0,0]=4 348 B9R1.82 COC(=O)C1CC(=O)C1 SC-21555 [0,1,0,0,1,0|1,0,0]=3 349 B9R1.52 C=C1CC(N)C1C(=O)O SC-29552 [0,1,0,0,1,0|1,0,0]=3 350 B11R1.3 O=CN1CCC(C(=O)O)CC1 SC-53566 [0,1,0,0,0,1|2,0,0]=4 351 B11R1.21 NC1CCC(C(=O)O)NC1=O SC-49698 [0,1,0,0,0,1|1,0,1]=4 352 B11R1.22 COC(=O)C1CCC(=O)CC1 SC-24169 [0,1,0,0,0,1|1,0,0]=3 353 B11R1.22 COC(=O)C1CCC(=O)NC1 SC-97458 [0,1,0,0,0,1|0,0,0]=2 354 B11R1.22 COC(=O)N1CCC(=O)CC1 SC-50308 [0,1,0,0,0,1|2,0,0]=4 355 B11R1.220 NC1(C(=O)O)CCC(=O)CC1 SC-66786 [0,1,0,0,0,1|1,0,0]=3 356 B11R1.727 O=C(O)C1CCS(=O)(=O)CC1 SC-B8314 [0,1,0,0,0,1|2,0,0]=4 357 B11R1.39 COC(=O)CC1CCC(=O)C1 SC-34381 [0,1,0,0,0,1|1,0,0]=3 358 B11R1.23 COC(=O)C1=CC(=O)CCC1 SC-34228 [0,1,0,0,0,1|1,0,1]=4 359 B11R1.23 COC(=O)C1CC(=O)CCO1 SC-65890 [0,1,0,0,0,1|1,0,0]=3 360 B11R1.23 COC(=O)C1CCCC(=O)C1 SC-29708 [0,1,0,0,0,1|1,0,0]=3 361 B11R1.23 COC(=O)C1CCCC(=O)N1 SC-70288 [0,1,0,0,0,1|0,0,0]=2 362 B11R1.74 NC1CC(=O)NC(C(=O)O)C1 SC-69983 [0,1,0,0,0,1|0,0,0]=2 363 B11R1.15 CCOC(=O)C1CCC(=O)C1 SC-65312 [0,2,0,0,0,0|1,0,0]=3 364 B11R1.15 CCOC(=O)C1CCC(=O)N1 SC-26956 [0,2,0,0,0,0|0,0,0]=2 365 B11R1.15 CCOC(=O)C1CCC(=O)N1 SC-49614 [0,2,0,0,0,0|0,0,0]=2 366 B11R1.15 CCOC(=O)C1CNC(=O)C1 SC-21962 [0,2,0,0,0,0|2,0,0]=4 367 B11R1.15 CCOC(=O)[C@H]1CCC(=O)N1 SC-24624 [0,2,0,0,0,0|0,0,0]=2 368 B11R1.15 O=C1CC[C@@H](C(=O)OCCl)N1 SC-69816 [0,2,0,0,0,0|0,0,0]=2 369 B11R1.44 COC(=O)C1CCC(OC)N1 SC-52730 [0,2,0,0,0,0|0,0,2]=4 370 B11R1.225 C=C1CC(N)C(C(=O)OC)C1 SC-26485 [0,2,0,0,0,0|2,0,0]=4 371 B11R1.226 COC(=O)C1CC(=O)N(C)C1 SC-49016 [0,2,0,0,0,0|2,0,0]=4 372 B11R1.226 COC(=O)C1CC(N)C(=O)N1 SC-48396 [0,2,0,0,0,0|0,0,0]=2 373 B11R1.885 COC(=O)C1(C)CCC(=O)C1 SC-A5391 [0,2,0,0,0,0|1,0,0]=3 374 B11R1.50 NC1C\C(=C/F)CC1C(=O)O SC-29685 [0,2,0,0,0,0|2,0,0]=4 375 B11R1.175 O=C(O)C1CCC(C(=O)O)C1 SC-04127 [0,2,0,0,0,0|1,0,1]=4 376 B11R1.738 NC1(C(=O)O)CCS(=O)(=O)C1 SC-29871 [0,2,0,0,0,0|2,0,0]=4 377 B9R1.6 O=C(O)C1CC=CCC1 SC-19459 [0,0,1,1,0,0|2,0,0]=4 378 B9R1.6 O=C(O)C1CC=CCC1 SC-79651 [0,0,1,1,0,0|2,0,0]=4 379 B9R1.6 O=C(O)[C@@H]1CC=CCC1 SC-92067 [0,0,1,1,0,0|2,0,0]=4 380 B9R1.6 O=C(O)[C@@H]1CCCNN1 SC-49631 [0,0,1,1,0,0|1,0,1]=4 381 B9R1.6 O=C(O)[C@H]1CC=CCC1 SC-65686 [0,0,1,1,0,0|2,0,0]=4 382 B9R1.69 NC1CCC(=O)NC1=O SC-52533 [0,0,1,1,0,0|1,0,0]=3 383 B9R1.69 NC1CCC(=O)NC1=O SC-72018 [0,0,1,1,0,0|1,0,0]=3 384 B9R1.69 NC1CCC(=O)NC1=O SC-85613 [0,0,1,1,0,0|1,0,0]=3 385 B9R1.69 N[C@@H]1CCC(=O)NC1=O SC-A2238 [0,0,1,1,0,0|1,0,0]=3 386 B9R1.69 N[C@H]1CCC(=O)NC1=O SC-A2241 [0,0,1,1,0,0|1,0,0]=3 387 B9R1.69 O=C1CCC(Br)C(=O)N1 SC-A3664 [0,0,1,1,0,0|2,0,0]=4 388 B9R1.93 C=CC1CC1(N)C(=O)O SC-69330 [0,0,1,1,0,0|1,0,0]=3 389 B9R1.93 C=CC1CC1(N)C(=O)O SC-70890 [0,0,1,1,0,0|1,0,0]=3 390 B9R1.110 NC(C(=O)O)C1CCC1 SC-94779 [0,0,1,1,0,0|1,0,1]=4 391 B9R1.112 NC(CC1CC1)C(=O)O SC-60891 [0,0,1,1,0,0|1,0,1]=4 392 B9R1.112 NC(CC1CC1)C(=O)O SC-A4366 [0,0,1,1,0,0|1,0,1]=4 393 B9R1.112 N[C@@H](CC1CC1)C(=O)O SC-20866 [0,0,1,1,0,0|1,0,1]=4 394 B9R1.84 O=C(O)CNC1CCC1 SC-53570 [0,0,1,1,0,0|1,0,1]=4 395 B9R1.53 CC(=O)OC1CC(=O)N1 SC-20312 [0,0,1,1,0,0|2,0,0]=4 396 B9R2.39 O=C1NC2C=CC1C2 SC-15307 [1,0,0,1,0,0|1,0,0]=3 397 B9R2.39 O=C1NC2C=CC1C2 SC-17066 [1,0,0,1,0,0|1,0,0]=3 398 B9R2.39 O=C1NC2CCC1C2 SC-90767 [1,0,0,1,0,0|1,0,1]=4 399 B9R2.39 [C@@H]12C=C[C@@H](C1)C(=O)N2 SC-14133 [1,0,0,1,0,0|1,0,0]=3 400 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 SC-52249 [1,0,0,1,0,0|1,0,1]=4 401 B11R2.139 C12CC(=O)CC1CC(=O)C2 SC-A4008 [0,0,0,1,0,1|2,0,0]=4 402 B7R0.16 CC(=O)C(C)C(C)=O SC-08152 [0,0,1,0,1,0|1,0,0]=3 403 B7R0.16 CC(C(=O)O)C(=O)O SC-16059 [0,0,1,0,1,0|1,0,0]=3 404 B7R1.10 O=C1CC(CO)C1 SC-86648 [1,0,0,0,1,0|1,0,1]=4 405 B7R1.18 CC(=O)C1CCC1 SC-74316 [1,0,0,0,1,0|1,0,1]=4 406 B7R1.18 NC(=O)[C@H]1CCN1 SC-42709 [1,0,0,0,1,0|1,0,0]=3 407 B7R1.18 O=C(Cl)C1CCC1 SC-46657 [1,0,0,0,1,0|1,0,1]=4 408 B7R1.18 O=C(O)C1CCC1 SC-17776 [1,0,0,0,1,0|0,0,1]=3 409 B7R1.18 O=C(O)C1CCN1 SC-53260 [1,0,0,0,1,0|0,0,0]=2 410 B7R1.18 O=C(O)C1CCO1 SC-22549 [1,0,0,0,1,0|1,0,0]=3 411 B7R1.18 O=C(O)C1COC1 SC-48326 [1,0,0,0,1,0|1,0,1]=4 412 B7R1.18 O=C(O)[C@H]1CCN1 SC-24616 [1,0,0,0,1,0|0,0,0]=2 413 B7R1.12 CC1CC1C(=O)O SC-71058 [0,0,0,0,2,0|1,0,1]=4 414 B7R1.12 O=C(O)C1CC1F SC-85228 [0,0,0,0,2,0|1,0,1]=4 415 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SC-83847 [0,0,0,0,2,0|1,0,1]=4 416 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SC-A4679 [0,0,0,0,2,0|1,0,1]=4 417 B7R1.12 O=C(O)[C@H]1C[C@H]1F SC-72913 [0,0,0,0,2,0|1,0,1]=4 418 B9R0.55 CC(=O)NCCCC(=O)O SC-46117 [0,0,1,0,0,1|1,0,0]=3 419 B9R0.55 O=C(Cl)CCCCC(=O)Cl SC-78887 [0,0,1,0,0,1|2,0,0]=4 420 B9R0.55 O=C(O)\C=C\CCC(=O)O SC-66378 [0,0,1,0,0,1|1,0,1]=4 421 B9R1.2 O=C1CCCC(CO)N1 SC-21439 [1,0,0,0,0,1|0,0,1]=3 422 B9R1.13 O=C(O)CC1CCCN1 SC-49134 [1,0,0,0,0,1|0,0,1]=3 423 B9R1.13 O=C(O)CC1CCCN1 SC-70978 [1,0,0,0,0,1|0,0,1]=3 424 B9R1.13 O=C(O)CC1CCNC1 SC-48282 [1,0,0,0,0,1|2,0,0]=4 425 B9R1.13 O=C(O)CC1CCNC1 SC-53663 [1,0,0,0,0,1|2,0,0]=4 426 B9R1.13 O=C(O)C[C@@H]1CCCN1 SC-86132 [1,0,0,0,0,1|0,0,1]=3 427 B11R1.20 CC(=O)NC1CCC(=O)CC1 SC-25634 [0,0,0,0,0,2|2,0,0]=4 428 B11R1.20 O=C(O)CC1CCC(=O)CC1 SC-52908 [0,0,0,0,0,2|1,0,0]=3 429 B11R1.20 O=C(O)CN1CCC(=O)CC1 SC-50803 [0,0,0,0,0,2|2,0,0]=4 430 B11R1.157 O=C(O)CN1CCCC(=O)C1 SC-45489 [0,0,0,0,0,2|2,0,0]=4