0 B7R0.2 CC(=O)OC(Br)CBr SC-14499 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.2 CC(CCl)CN(C)C SC-49474 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.2 CC(CO)CN(C)C SC-49500 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.2 CCC(=O)OC(C)=O SC-96821 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.2 CCC(O)CC(C)O SC-95923 [0,0,0,0,0,0|2,0,1]=3 5 B7R0.2 COC(=O)CC(C)=O SC-65271 [0,0,0,0,0,0|3,0,1]=4 6 B6R0.1 C=CC[C@@H](O)CCl SC-30233 [1,0,0,0,0,0|3,0,0]=4 7 B6R0.1 C=CC[C@H](O)CCl SC-31067 [1,0,0,0,0,0|3,0,0]=4 8 B6R0.1 CCC(O)COC SC-95930 [1,0,0,0,0,0|3,0,0]=4 9 B6R0.1 CCCC(Br)CC SC-87780 [1,0,0,0,0,0|2,0,1]=4 10 B6R0.1 CC[C@@H](N)COC SC-48788 [1,0,0,0,0,0|3,0,0]=4 11 B6R0.1 CC[C@H](N)COC SC-48789 [1,0,0,0,0,0|3,0,0]=4 12 B6R0.1 CN(CO)CCO SC-42099 [1,0,0,0,0,0|2,0,1]=4 13 B6R0.2 C=C(C)CC(=O)O SC-31698 [1,0,0,0,0,0|0,0,2]=3 14 B6R0.2 CC(=O)CC(C)=O SC-68118 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.2 CC(C)CC(=N)N SC-40541 [1,0,0,0,0,0|2,0,0]=3 16 B6R0.2 CC(C)CC(C)Br SC-26522 [1,0,0,0,0,0|2,0,1]=4 17 B6R0.2 CC(O)CC(=O)[O-] SC-85388 [1,0,0,0,0,0|1,0,1]=3 18 B6R0.2 CN(C)CC(=O)O SC-09555 [1,0,0,0,0,0|1,0,0]=2 19 B6R0.2 CN(C)CC(=O)O SC-51828 [1,0,0,0,0,0|1,0,0]=2 20 B6R0.2 CN(C)CC(N)=S SC-62281 [1,0,0,0,0,0|2,1,0]=4 21 B6R0.2 C[C@H](O)C[C@H](C)O SC-06528 [1,0,0,0,0,0|2,0,1]=4 22 B6R0.2 O=C(O)CC(=O)O SC-77641 [1,0,0,0,0,0|2,0,1]=4 23 B6R0.2 [C@@H](C)(N)CC(=O)O SC-26546 [1,0,0,0,0,0|1,0,0]=2 24 B6R0.4 C=C(C)CCCBr SC-32900 [1,0,0,0,0,0|3,0,0]=4 25 B6R0.4 C=C(C)CCCO SC-14313 [1,0,0,0,0,0|3,0,0]=4 26 B6R0.4 C=CNCC(=O)O SC-21370 [1,0,0,0,0,0|1,0,2]=4 27 B6R0.4 CC(=O)NCCCl SC-49821 [1,0,0,0,0,0|3,0,0]=4 28 B6R0.4 CC(=O)OCCO SC-95931 [1,0,0,0,0,0|3,0,0]=4 29 B6R0.4 CCCCB(O)O SC-04512 [1,0,0,0,0,0|1,0,1]=3 30 B6R0.4 CCCOC(=O)Cl SC-19101 [1,0,0,0,0,0|2,0,0]=3 31 B6R0.4 COCCC(=N)N SC-40396 [1,0,0,0,0,0|3,0,0]=4 32 B6R0.4 N#CCCC(=O)O SC-49854 [1,0,0,0,0,0|1,0,1]=3 33 B6R0.4 N=C(N)CCCBr SC-59652 [1,0,0,0,0,0|3,0,0]=4 34 B6R0.4 N=C(N)CCCCl SC-55395 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.4 N=C(N)CCCO SC-70213 [1,0,0,0,0,0|3,0,0]=4 36 B6R0.4 NC(=O)CCCO SC-12258 [1,0,0,0,0,0|2,0,0]=3 37 B6R0.4 O=C(Cl)OCCF SC-53156 [1,0,0,0,0,0|3,0,0]=4 38 B6R0.4 O=C(O)CCCBr SC-02994 [1,0,0,0,0,0|1,0,0]=2 39 B8R0.2 CCC(C)C(N)C(=O)O SC-09608 [0,1,0,0,0,0|0,0,0]=1 40 B8R0.2 CON(C)C(=O)C(=O)O SC-32952 [0,1,0,0,0,0|2,0,1]=4 41 B8R0.2 [C@H](C)(CC)[C@@H](N)C(=O)O SC-09606 [0,1,0,0,0,0|0,0,0]=1 42 B8R0.5 CCOC(=O)CC(C)=O SC-18922 [0,1,0,0,0,0|2,0,1]=4 43 B8R0.16 CCN(CC)CC(=N)N SC-40403 [0,1,0,0,0,0|3,0,0]=4 44 B8R0.16 COC(CC(=N)N)OC SC-40215 [0,1,0,0,0,0|3,0,0]=4 45 B8R0.19 CN\C(C)=C/C(=O)OC SC-50211 [0,1,0,0,0,0|1,0,2]=4 46 B8R0.19 COC(=O)CC(O)CN SC-35083 [0,1,0,0,0,0|2,0,0]=3 47 B8R0.23 CN(CC(=O)O)C(=N)N SC-46919 [0,1,0,0,0,0|2,0,1]=4 48 B8R0.23 NC(CC(=O)O)C(=O)[O-] SC-20735 [0,1,0,0,0,0|2,0,1]=4 49 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] SC-15827 [0,1,0,0,0,0|2,0,1]=4 50 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] SC-19578 [0,1,0,0,0,0|2,0,1]=4 51 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] SC-65201 [0,1,0,0,0,0|2,0,1]=4 52 B8R0.23 O=C(O)CC(O)C(=O)O SC-19305 [0,1,0,0,0,0|2,0,1]=4 53 B8R0.23 O=C(O)CC(O)C(=O)O SC-43909 [0,1,0,0,0,0|2,0,1]=4 54 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O SC-04187 [0,1,0,0,0,0|2,0,1]=4 55 B8R0.23 O=C(O)C[C@H](Br)C(=O)O SC-26843 [0,1,0,0,0,0|2,0,1]=4 56 B8R0.34 CCC(C)(C)OC(C)=O SC-87598 [0,1,0,0,0,0|2,0,0]=3 57 B8R1.1 O=C1C=C(CBr)CO1 SC-27326 [0,0,0,1,0,0|1,0,2]=4 58 B8R1.1 O=C1NC[C@H](CCl)O1 SC-73276 [0,0,0,1,0,0|3,0,0]=4 59 B8R1.1 O=C1N[C@H](CO)CO1 SC-33358 [0,0,0,1,0,0|2,0,0]=3 60 B8R1.4 CC1CCCC(N)C1 SC-22240 [0,0,0,1,0,0|2,0,1]=4 61 B8R1.4 C[C@H]1CCCC(=O)N1 SC-51761 [0,0,0,1,0,0|2,0,0]=3 62 B8R1.4 N[C@H]1CCC[C@H](O)C1 SC-43596 [0,0,0,1,0,0|2,0,1]=4 63 B8R1.34 CC(=O)NC1CNC1 SC-48410 [0,0,0,1,0,0|3,0,0]=4 64 B8R1.34 O=C(O)C=C1CCC1 SC-67620 [0,0,0,1,0,0|0,0,2]=3 65 B8R1.51 NC1CCS(=O)(=O)C1 SC-49078 [0,0,0,1,0,0|2,0,1]=4 66 B6R0.3 C=C(I)[C@H](C)CI SC-68491 [0,0,0,0,1,0|3,0,0]=4 67 B6R0.3 C=CC(N)C(=O)O SC-83691 [0,0,0,0,1,0|1,0,2]=4 68 B6R0.3 CCC(C)C(=N)N SC-40567 [0,0,0,0,1,0|2,0,0]=3 69 B6R0.3 CCC(C)C(=O)O SC-22738 [0,0,0,0,1,0|0,0,0]=1 70 B6R0.3 CCC(Cl)C(=O)O SC-96228 [0,0,0,0,1,0|1,0,0]=2 71 B6R0.3 CCC(O)C(=N)N SC-41904 [0,0,0,0,1,0|3,0,0]=4 72 B6R0.3 CCC(O)C(=O)O SC-88990 [0,0,0,0,1,0|1,0,0]=2 73 B6R0.3 CCN(C)C(=O)Cl SC-18616 [0,0,0,0,1,0|2,0,0]=3 74 B6R0.3 CC[C@@H](Cl)C(=O)O SC-52915 [0,0,0,0,1,0|1,0,0]=2 75 B6R0.3 NC(=O)C(N)CO SC-53653 [0,0,0,0,1,0|3,0,0]=4 76 B6R0.3 NC[C@H](N)C(=O)O SC-10204 [0,0,0,0,1,0|2,0,0]=3 77 B6R0.3 N[C@@H](CCl)C(=O)O SC-21241 [0,0,0,0,1,0|2,0,0]=3 78 B6R0.3 N[C@@H](CS)C(=O)O SC-09429 [0,0,0,0,1,0|2,0,0]=3 79 B6R0.3 [C@H](O)(CN)C(=O)O SC-18368 [0,0,0,0,1,0|2,0,0]=3 80 B8R0.9 NCC(=O)CCC(=O)O SC-52394 [0,0,0,0,0,1|2,0,1]=4 81 B8R0.9 NCC(=O)NCC(=O)O SC-17448 [0,0,0,0,0,1|2,0,1]=4 82 B5R0.1 C=CCC(C)O SC-49226 [2,0,0,0,0,0|2,0,0]=4 83 B5R0.1 CNCC(=O)[O-] SC-18610 [2,0,0,0,0,0|1,0,1]=4 84 B5R0.1 COCC(=O)O SC-22928 [2,0,0,0,0,0|1,0,0]=3 85 B5R0.1 COCC(C)=O SC-81373 [2,0,0,0,0,0|2,0,0]=4 86 B5R0.1 CSCC(N)=O SC-27108 [2,0,0,0,0,0|2,0,0]=4 87 B5R0.1 O=C(O)CCF SC-53145 [2,0,0,0,0,0|1,0,0]=3 88 B5R0.2 C=COCCC SC-13613 [2,0,0,0,0,0|2,0,0]=4 89 B5R0.2 CCCCNN SC-40662 [2,0,0,0,0,0|2,0,0]=4 90 B5R0.2 CCCCNN SC-41028 [2,0,0,0,0,0|2,0,0]=4 91 B5R0.2 COCCCO SC-01427 [2,0,0,0,0,0|1,0,1]=4 92 B5R0.2 CSCCCO SC-54096 [2,0,0,0,0,0|1,0,1]=4 93 B5R0.2 OCCCCCl SC-17604 [2,0,0,0,0,0|1,0,1]=4 94 B5R0.3 CC(CCl)CBr SC-62287 [2,0,0,0,0,0|2,0,0]=4 95 B5R0.3 CC(CN)CCl SC-40011 [2,0,0,0,0,0|2,0,0]=4 96 B5R0.3 CC(CN)CN SC-50225 [2,0,0,0,0,0|2,0,0]=4 97 B5R0.3 CC(CO)CO SC-20510 [2,0,0,0,0,0|1,0,0]=3 98 B5R0.3 CCC(C)CBr SC-79299 [2,0,0,0,0,0|1,0,0]=3 99 B5R0.3 CCC(O)CN SC-40219 [2,0,0,0,0,0|2,0,0]=4 100 B5R0.3 COC(C)CO SC-97662 [2,0,0,0,0,0|1,0,0]=3 101 B5R0.3 NC[C@H](O)CO SC-45873 [2,0,0,0,0,0|2,0,0]=4 102 B5R0.3 O=CC(O)CO SC-54496 [2,0,0,0,0,0|2,0,0]=4 103 B5R0.3 OC[C@H](O)CCl SC-05684 [2,0,0,0,0,0|2,0,0]=4 104 B7R0.3 C=CCCC(C)CC SC-69778 [1,1,0,0,0,0|1,0,0]=3 105 B7R0.7 CCCC(C)CNN SC-42603 [1,1,0,0,0,0|2,0,0]=4 106 B7R0.7 CCCC(O)CCO SC-51686 [1,1,0,0,0,0|1,0,1]=4 107 B7R0.7 COCC(C)COC SC-66246 [1,1,0,0,0,0|2,0,0]=4 108 B7R0.10 CCC(C)C(C)NN SC-38614 [1,1,0,0,0,0|2,0,0]=4 109 B7R0.12 CCC(CC)CNN SC-59903 [1,1,0,0,0,0|2,0,0]=4 110 B7R0.9 CC(C)(C)CC(=O)O SC-22389 [1,1,0,0,0,0|0,0,0]=2 111 B7R0.9 CC(C)(O)CC(=N)N SC-13198 [1,1,0,0,0,0|2,0,0]=4 112 B7R0.9 CC(C)CS(N)(=O)=O SC-34991 [1,1,0,0,0,0|1,0,1]=4 113 B7R0.9 C[N+](C)(C)CC(=O)O SC-27478 [1,1,0,0,0,0|1,0,0]=3 114 B7R0.16 CC(C)C(O)C(=O)O SC-08874 [1,1,0,0,0,0|0,0,0]=2 115 B7R0.16 CC(N)C(N)C(=O)O SC-10139 [1,1,0,0,0,0|1,0,0]=3 116 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O SC-09895 [1,1,0,0,0,0|2,0,0]=4 117 B7R0.16 C[C@H](N)[C@H](N)C(=O)O SC-10141 [1,1,0,0,0,0|1,0,0]=3 118 B7R0.16 [C@@H](Cl)(C(=O)O)C(C)C SC-03021 [1,1,0,0,0,0|0,0,0]=2 119 B7R0.4 C=C(C)CCCCBr SC-31361 [1,1,0,0,0,0|2,0,0]=4 120 B7R0.4 C=C(C)CCCCO SC-32201 [1,1,0,0,0,0|2,0,0]=4 121 B7R0.4 C=CCOCC(=O)O SC-35140 [1,1,0,0,0,0|0,0,2]=4 122 B7R0.4 CC(=O)NCCCN SC-51489 [1,1,0,0,0,0|2,0,0]=4 123 B7R0.4 CCCCCC(C)O SC-81258 [1,1,0,0,0,0|1,0,1]=4 124 B7R0.4 CCC\C=C\C(=O)O SC-39942 [1,1,0,0,0,0|0,0,1]=3 125 B7R0.4 CCOCCC(=N)N SC-40468 [1,1,0,0,0,0|2,0,0]=4 126 B7R0.4 N=C(N)CCCCCl SC-55396 [1,1,0,0,0,0|2,0,0]=4 127 B7R0.4 O=C(O)CCCCCl SC-57902 [1,1,0,0,0,0|0,0,0]=2 128 B7R0.6 CC(=O)CCN(C)C SC-53808 [1,1,0,0,0,0|2,0,0]=4 129 B7R0.6 CC(=O)OCC(=O)O SC-65254 [1,1,0,0,0,0|1,0,1]=4 130 B7R0.6 CC(C)CCC(C)O SC-53086 [1,1,0,0,0,0|1,0,1]=4 131 B7R0.6 CN(C)CCC(=O)O SC-84792 [1,1,0,0,0,0|1,0,0]=3 132 B7R0.8 CP(=O)(O)CCCN SC-51052 [1,1,0,0,0,0|2,0,0]=4 133 B7R0.8 NCCCP(=O)(O)O SC-00767 [1,1,0,0,0,0|2,0,0]=4 134 B7R0.13 CC(C)(CN)C(N)=O SC-23041 [0,1,0,0,1,0|2,0,0]=4 135 B7R0.13 CC(N)(CO)C(=O)O SC-73786 [0,1,0,0,1,0|1,0,0]=3 136 B7R0.13 CC(O)(CBr)C(=O)O SC-58676 [0,1,0,0,1,0|1,0,0]=3 137 B7R0.13 CCC(C)(C)C(=O)Cl SC-18452 [0,1,0,0,1,0|1,0,0]=3 138 B7R0.13 CCC(C)(C)C(=O)O SC-15366 [0,1,0,0,1,0|0,0,0]=2 139 B7R0.13 NCC(F)(F)C(=O)O SC-22061 [0,1,0,0,1,0|2,0,0]=4 140 B7R0.13 NCC(F)(F)C(=O)O SC-51906 [0,1,0,0,1,0|2,0,0]=4 141 B9R0.7 CC(CCC(=O)O)C(=O)O SC-53293 [0,1,0,0,0,1|1,0,1]=4 142 B9R0.23 CCN(C)C(=O)CC(N)=O SC-46305 [0,1,0,0,0,1|2,0,0]=4 143 B9R0.43 COC(CCC(=O)O)OC SC-33144 [0,1,0,0,0,1|1,0,0]=3 144 B9R0.6 CCCC(C)C(N)C(=O)O SC-45629 [0,2,0,0,0,0|0,0,0]=2 145 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC SC-09632 [0,2,0,0,0,0|0,0,0]=2 146 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O SC-48910 [0,2,0,0,0,0|1,0,0]=3 147 B9R0.4 CCCC[C@@H](C)CC(=O)O SC-52448 [0,2,0,0,0,0|0,0,0]=2 148 B9R0.34 CCCC(=O)CC(=O)OC SC-27187 [0,2,0,0,0,0|1,0,1]=4 149 B9R0.34 COCC(=O)CC(=O)OC SC-49499 [0,2,0,0,0,0|1,0,1]=4 150 B9R0.53 CC(C)OC(=O)CC(=O)O SC-31951 [0,2,0,0,0,0|1,0,1]=4 151 B9R0.58 CCCS(=O)(=O)CC(=O)O SC-38522 [0,2,0,0,0,0|2,0,0]=4 152 B9R0.52 CCC(CC)CS(=O)(=O)Cl SC-34856 [0,2,0,0,0,0|1,0,1]=4 153 B9R0.52 CCC(CC)CS(N)(=O)=O SC-34388 [0,2,0,0,0,0|1,0,1]=4 154 B9R0.22 C=CC(C)(C)CC(=O)OC SC-74436 [0,2,0,0,0,0|0,0,2]=4 155 B9R0.10 NC(CC(=O)O)C(F)(F)F SC-30344 [0,2,0,0,0,0|2,0,0]=4 156 B9R0.11 CC(C)S(=O)(=O)CC(=O)O SC-38688 [0,2,0,0,0,0|2,0,0]=4 157 B7R1.1 CNC1CCOC1 SC-14941 [1,0,0,1,0,0|1,0,1]=4 158 B7R1.1 NCC1CCOC1 SC-35383 [1,0,0,1,0,0|1,0,1]=4 159 B7R1.2 CC1CCC(=O)N1 SC-89347 [1,0,0,1,0,0|1,0,0]=3 160 B7R1.2 CC1CCC(N)C1 SC-50487 [1,0,0,1,0,0|1,0,1]=4 161 B7R1.2 CC1CNC(=O)N1 SC-65644 [1,0,0,1,0,0|2,0,0]=4 162 B7R1.2 CC1CNC(=O)N1 SC-67475 [1,0,0,1,0,0|2,0,0]=4 163 B7R1.2 CC1CSC(=O)S1 SC-51669 [1,0,0,1,0,0|2,0,0]=4 164 B7R1.2 C[C@@H]1CCC(=O)O1 SC-65777 [1,0,0,1,0,0|1,0,0]=3 165 B7R1.2 C[C@@H]1COC(=O)C1 SC-45465 [1,0,0,1,0,0|1,0,0]=3 166 B7R1.2 C[C@@H]1COC(=O)N1 SC-43641 [1,0,0,1,0,0|2,0,0]=4 167 B7R1.2 C[C@@H]1COC(=O)N1 SC-51055 [1,0,0,1,0,0|2,0,0]=4 168 B7R1.2 C[C@@H]1C[C@H](O)CN1 SC-51782 [1,0,0,1,0,0|1,0,1]=4 169 B7R1.2 C[C@H]1CCC(=O)O1 SC-86851 [1,0,0,1,0,0|1,0,0]=3 170 B7R1.2 NC1CCC(O)C1 SC-45420 [1,0,0,1,0,0|1,0,1]=4 171 B7R1.2 NC1CNC(=O)C1 SC-68325 [1,0,0,1,0,0|2,0,0]=4 172 B7R1.2 N[C@H]1CNC(=O)C1 SC-52716 [1,0,0,1,0,0|2,0,0]=4 173 B7R1.2 O=C1CCC(Cl)O1 SC-69818 [1,0,0,1,0,0|2,0,0]=4 174 B7R1.2 O=C1C[C@@H](O)CO1 SC-49425 [1,0,0,1,0,0|2,0,0]=4 175 B7R1.2 OC1CCC(O)C1 SC-66165 [1,0,0,1,0,0|1,0,1]=4 176 B7R1.3 CN1CC=CCC1 SC-20668 [1,0,0,1,0,0|2,0,0]=4 177 B7R1.3 CN1CC=CCC1 SC-43820 [1,0,0,1,0,0|2,0,0]=4 178 B7R1.3 CN1CCOCC1 SC-47177 [1,0,0,1,0,0|1,0,1]=4 179 B7R1.5 CC1CC1CNN SC-60063 [1,0,0,1,0,0|2,0,0]=4 180 B7R1.6 N#CCC1CCC1 SC-39102 [1,0,0,1,0,0|1,0,1]=4 181 B7R1.10 NC[C@H]1C[C@@H](O)C1 SC-52916 [1,0,0,1,0,0|1,0,1]=4 182 B7R1.10 O=C1CN(CCl)C1 SC-39185 [1,0,0,1,0,0|2,0,0]=4 183 B7R1.12 CC1CC1C(=O)Cl SC-60998 [1,0,0,1,0,0|1,0,0]=3 184 B7R1.12 CC1CC1C(=O)O SC-71058 [1,0,0,1,0,0|0,0,0]=2 185 B7R1.20 N=C(N)CC1CC1 SC-40484 [1,0,0,1,0,0|2,0,0]=4 186 B7R1.14 CC1(O)CCCC1 SC-26720 [1,0,0,1,0,0|1,0,1]=4 187 B7R1.18 N=C(N)C1CCC1 SC-12460 [1,0,0,1,0,0|2,0,0]=4 188 B7R1.18 O=C(O)C1CCN1 SC-53260 [1,0,0,1,0,0|1,0,0]=3 189 B7R1.19 CC(=O)C1(C)CC1 SC-47849 [0,0,0,1,1,0|1,0,0]=3 190 B7R1.19 CC1(C(=O)Cl)CC1 SC-45726 [0,0,0,1,1,0|1,0,0]=3 191 B7R1.19 O=C(O)C1(Cl)CC1 SC-49481 [0,0,0,1,1,0|1,0,0]=3 192 B9R1.1 CCC1CCC(=S)CC1 SC-42360 [0,0,0,1,0,1|1,1,0]=4 193 B9R1.1 COC1CCC(=O)CO1 SC-67569 [0,0,0,1,0,1|2,0,0]=4 194 B9R1.1 O=C1CCC(CCl)CC1 SC-29343 [0,0,0,1,0,1|2,0,0]=4 195 B9R1.35 CC(=O)N1CC[C@@H](O)C1 SC-53670 [0,0,0,1,0,1|2,0,0]=4 196 B9R1.35 NC1C=C(C(=O)O)CC1 SC-51450 [0,0,0,1,0,1|1,0,1]=4 197 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 SC-23776 [0,0,0,1,0,1|2,0,0]=4 198 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 SC-24076 [0,0,0,1,0,1|2,0,0]=4 199 B9R1.35 O=C(O)C1CC(O)CN1 SC-29014 [0,0,0,1,0,1|2,0,0]=4 200 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 SC-52573 [0,0,0,1,0,1|2,0,0]=4 201 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CO1 SC-66730 [0,0,0,1,0,1|2,0,0]=4 202 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SC-52422 [0,0,0,1,0,1|2,0,0]=4 203 B9R1.69 CC1CCC(O)CC1C SC-49456 [0,0,0,1,0,1|1,0,1]=4 204 B9R1.69 CC1NC(=O)CCC1O SC-50315 [0,0,0,1,0,1|2,0,0]=4 205 B9R1.84 O=C(O)\C=C\C1CCC1 SC-14219 [0,0,0,1,0,1|0,0,1]=3 206 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-21501 [0,1,0,1,0,0|1,0,0]=3 207 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-28867 [0,1,0,1,0,0|1,0,0]=3 208 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-52270 [0,1,0,1,0,0|1,0,0]=3 209 B9R1.41 CN1CCC[C@H]1C(=O)O SC-23602 [0,1,0,1,0,0|1,0,0]=3 210 B9R1.41 NC1CCCC1C(=O)O SC-29667 [0,1,0,1,0,0|1,0,0]=3 211 B9R1.41 NC1CCNC1C(=O)O SC-49345 [0,1,0,1,0,0|1,0,0]=3 212 B9R1.41 NC1CCSC1C(=O)O SC-29866 [0,1,0,1,0,0|1,0,0]=3 213 B9R1.41 NC1CSCC1C(=O)O SC-30185 [0,1,0,1,0,0|1,0,0]=3 214 B9R1.41 O=C(O)C1CCCC1=O SC-53677 [0,1,0,1,0,0|1,0,1]=4 215 B9R1.93 C=CC1CC1(N)C(=O)O SC-69330 [0,1,0,1,0,0|0,0,2]=4 216 B9R1.93 C=CC1CC1(N)C(=O)O SC-70890 [0,1,0,1,0,0|0,0,2]=4 217 B9R1.7 CCCC1CCC(=O)O1 SC-52458 [0,1,0,1,0,0|2,0,0]=4 218 B9R1.7 NCCN1CCC(=O)C1 SC-39650 [0,1,0,1,0,0|2,0,0]=4 219 B9R1.13 CC(=O)NC1CCNC1 SC-08933 [0,1,0,1,0,0|2,0,0]=4 220 B9R1.13 CC(=O)N[C@@H]1CCNC1 SC-08932 [0,1,0,1,0,0|2,0,0]=4 221 B9R1.13 O=C(O)C=C1CCCC1 SC-36663 [0,1,0,1,0,0|0,0,2]=4 222 B9R1.13 O=C(O)CC1CCCC1 SC-65869 [0,1,0,1,0,0|0,0,0]=2 223 B9R1.13 O=C(O)CC1CCNC1 SC-48282 [0,1,0,1,0,0|0,0,0]=2 224 B9R1.38 CC1(C)CC(=O)OC1=O SC-45366 [0,1,0,1,0,0|1,0,1]=4 225 B9R1.52 C=C1CC(N)C1C(=O)O SC-29552 [0,1,0,1,0,0|0,0,2]=4 226 B9R1.2 O=C1CCCC(CCl)C1 SC-33730 [0,1,0,1,0,0|1,0,0]=3 227 B9R1.2 O=C1CCCN(CCl)C1 SC-41654 [0,1,0,1,0,0|2,0,0]=4 228 B9R1.79 COC(=O)CC1CCC1 SC-34808 [0,1,0,1,0,0|0,0,0]=2 229 B9R1.79 NCC(=O)NC1CCC1 SC-62678 [0,1,0,1,0,0|2,0,0]=4 230 B9R1.114 NS(=O)(=O)CC1CCC1 SC-34694 [0,1,0,1,0,0|1,0,1]=4 231 B9R2.20 O=C1NCC2CCC12 SC-49834 [0,0,0,2,0,0|1,0,0]=3 232 B9R2.21 O=C1CCC2CC2C1 SC-68751 [0,0,0,2,0,0|1,0,0]=3 233 B9R2.109 O=C1CCCC2CC12 SC-68708 [0,0,0,2,0,0|1,0,0]=3 234 B5R0.5 CC(=O)C(C)Br SC-44476 [1,0,0,0,1,0|2,0,0]=4 235 B5R0.5 CC(Cl)C(N)=O SC-50401 [1,0,0,0,1,0|2,0,0]=4 236 B5R0.5 CC(O)C(=O)O SC-15841 [1,0,0,0,1,0|1,0,0]=3 237 B5R0.5 CC(O)C(=O)O SC-18578 [1,0,0,0,1,0|1,0,0]=3 238 B5R0.5 CC(O)C(=O)[O-] SC-15837 [1,0,0,0,1,0|1,0,1]=4 239 B5R0.5 CC(O)C(=O)[O-] SC-18033 [1,0,0,0,1,0|1,0,1]=4 240 B5R0.5 CC(O)C(=O)[O-] SC-46260 [1,0,0,0,1,0|1,0,1]=4 241 B5R0.5 [C@@H](C)(N)C(N)=O SC-22084 [1,0,0,0,1,0|2,0,0]=4