0 B9R1.35 CC(=O)C1CCC(=O)O1 CS-0246380 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.35 CC(C)C1CCC(=O)C1 CS-0564316 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.35 CC1=CN=C(C(=O)O)N1 CS-0503572 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.35 CC1=CN=C(C(=O)O)N1 CS-0714683 [0,0,0,0,0,0|2,0,2]=4 4 B9R1.35 CC1=NC(C(=O)O)CC1 CS-0664249 [0,0,0,0,0,0|1,0,1]=2 5 B9R1.35 CC1=NC=C(C(=O)O)N1 CS-0714442 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.35 CC1CCC(C(=O)O)O1 CS-0231104 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.35 CN1CCC(C(=O)O)C1 CS-W003333 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.35 CN1CC[C@H](C(=O)O)C1 CS-0053278 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 CS-0309404 [0,0,0,0,0,0|1,0,1]=2 10 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 CS-0089834 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 CS-0170850 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 CS-0184631 [0,0,0,0,0,0|1,0,1]=2 13 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 CS-0184567 [0,0,0,0,0,0|1,0,1]=2 14 B9R1.35 C[C@H]1CN[C@H](C(=O)O)C1 CS-0183084 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.35 NC1=CC=C(C(=O)O)N1 CS-0197463 [0,0,0,0,0,0|1,0,3]=4 16 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 CS-0001905 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.35 O=C(O)C1=CN=C(Br)N1 CS-0458935 [0,0,0,0,0,0|2,0,2]=4 18 B9R1.35 O=C(O)C1=NC=C(I)N1 CS-0781488 [0,0,0,0,0,0|2,0,2]=4 19 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 CS-0645142 [0,0,0,0,0,0|1,0,2]=3 20 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 CS-0129823 [0,0,0,0,0,0|1,0,2]=3 21 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 CS-0782222 [0,0,0,0,0,0|1,0,2]=3 22 B9R1.35 O=C(O)[C@H]1CC[C@@H](O)C1 CS-0310402 [0,0,0,0,0,0|1,0,2]=3 23 B9R1.35 O=C1NC(C(=O)O)CO1 CS-0238859 [0,0,0,0,0,0|1,0,0]=1 24 B9R1.35 O=C1NC(C(=O)O)CS1 CS-0727383 [0,0,0,0,0,0|1,0,0]=1 25 B9R1.35 O=C1NC(C(F)F)CO1 CS-0185275 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.35 O=C1NC=C(C(=O)O)O1 CS-0626781 [0,0,0,0,0,0|2,0,2]=4 27 B9R1.35 O=C1NCC(C(=O)O)O1 CS-0029944 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.35 O=C1N[C@H](C(F)F)CO1 CS-0053175 [0,0,0,0,0,0|3,0,1]=4 29 B8R1.1 C#C[C@H]1COC(=O)N1 CS-0357495 [1,0,0,0,0,0|2,0,1]=4 30 B8R1.1 COC1CCC(=O)N1 CS-0255733 [1,0,0,0,0,0|2,0,0]=3 31 B8R1.1 C[C@@H]1CC[C@H](CO)N1 CS-0223902 [1,0,0,0,0,0|1,0,2]=4 32 B8R1.1 NCC1COC(=O)N1 CS-0051192 [1,0,0,0,0,0|2,0,1]=4 33 B8R1.1 NC[C@@H]1CCC(=O)N1 CS-0053135 [1,0,0,0,0,0|1,0,1]=3 34 B8R1.1 NC[C@H]1CCC(=O)N1 CS-W021139 [1,0,0,0,0,0|1,0,1]=3 35 B8R1.1 O=C1CCC(CBr)N1 CS-0166600 [1,0,0,0,0,0|1,0,1]=3 36 B8R1.1 O=C1CCC(CBr)O1 CS-M2142 [1,0,0,0,0,0|2,0,1]=4 37 B8R1.1 O=C1CCC(CI)O1 CS-0512428 [1,0,0,0,0,0|2,0,1]=4 38 B8R1.1 O=C1C[C@H](CO)CN1 CS-0471470 [1,0,0,0,0,0|2,0,1]=4 39 B8R1.7 CC(=O)C1CCCO1 CS-0450373 [1,0,0,0,0,0|2,0,1]=4 40 B8R1.7 CC(=O)C1CCCS1 CS-0240192 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.7 CC(=O)[C@@H]1CCCN1 CS-0341964 [1,0,0,0,0,0|1,0,1]=3 42 B8R1.7 CC(O)C1CCCN1 CS-0258928 [1,0,0,0,0,0|1,0,2]=4 43 B8R1.7 NC(=O)C1CSCN1 CS-0222864 [1,0,0,0,0,0|2,0,1]=4 44 B8R1.7 NC(=O)[C@@H]1CCNC1 CS-0007631 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.7 NC(=O)[C@H]1CCCN1 CS-0099967 [1,0,0,0,0,0|1,0,1]=3 46 B8R1.7 O=C(O)[C@@H]1COCN1 CS-W022930 [1,0,0,0,0,0|1,0,1]=3 47 B10R1.14 COC(=O)C1CCC(Br)C1 CS-0049106 [0,1,0,0,0,0|2,0,1]=4 48 B10R1.14 COC(=O)C1CNC(=O)N1 CS-0222849 [0,1,0,0,0,0|1,0,0]=2 49 B10R1.14 COC(=O)C1CNC(=O)O1 CS-0074511 [0,1,0,0,0,0|2,0,0]=3 50 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 CS-0368641 [0,1,0,0,0,0|2,0,1]=4 51 B10R1.14 COC(=O)[C@@H]1CC[C@@H](O)C1 CS-0055660 [0,1,0,0,0,0|1,0,2]=4 52 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 CS-0048900 [0,1,0,0,0,0|1,0,2]=4 53 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 CS-0506296 [0,1,0,0,0,0|1,0,2]=4 54 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 CS-0038415 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.14 O=C1CC[C@@H](C(=O)O[Na])N1 CS-0132824 [0,1,0,0,0,0|0,0,0]=1 56 B10R1.31 CCC1CCC(C(=O)O)C1 CS-0245115 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.31 CCC1CC[C@@H](C(=O)O)N1 CS-0521358 [0,1,0,0,0,0|1,0,1]=3 58 B10R1.31 CCN1CCC(C(=O)O)C1 CS-0317656 [0,1,0,0,0,0|3,0,0]=4 59 B10R1.55 CS(=O)(=O)C1CCC(=O)C1 CS-0225836 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.55 O=C1CC[C@@H](C(F)(F)F)N1 CS-0215145 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.58 CN1C[C@@H](C(=O)O)CC1=O CS-0476244 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.58 CN1C[C@@H](C(=O)O)NC1=O CS-0076403 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.194 CC1C(=O)OCC1C(=O)O CS-0312931 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.359 CC1(C)CCC(C(=O)O)C1 CS-0224441 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.359 CC1(C)CCC(C(=O)O)N1 CS-0055105 [0,1,0,0,0,0|1,0,1]=3 66 B10R1.359 CC1(C)CCC(C(=O)O)N1 CS-0495421 [0,1,0,0,0,0|1,0,1]=3 67 B10R1.359 CC1(C)CCC(C(=O)O)O1 CS-0466254 [0,1,0,0,0,0|2,0,1]=4 68 B10R1.359 O=C(O)[C@@H]1CCC(F)(F)C1 CS-0053636 [0,1,0,0,0,0|2,0,1]=4 69 B10R1.359 O=C(O)[C@H]1CCC(F)(F)C1 CS-0054812 [0,1,0,0,0,0|2,0,1]=4 70 B10R1.470 CN1CCC(F)(C(=O)O)C1 CS-0467918 [0,1,0,0,0,0|3,0,0]=4 71 B10R1.470 C[C@@]1(C(=O)O)CCC(=O)N1 CS-0184538 [0,1,0,0,0,0|0,0,0]=1 72 B8R0.8 C#CCCC(O)C(=O)O CS-0225203 [0,0,1,0,0,0|2,0,1]=4 73 B8R0.8 C#CCC[C@@H](N)C(=O)O CS-0522226 [0,0,1,0,0,0|1,0,1]=3 74 B8R0.8 C=CCCC(N)C(=O)O CS-0447649 [0,0,1,0,0,0|1,0,0]=2 75 B8R0.8 CC#CCC(N)C(=O)O CS-0972162 [0,0,1,0,0,0|1,0,2]=4 76 B8R0.8 CC#CC[C@H](N)C(=O)O CS-W021164 [0,0,1,0,0,0|1,0,2]=4 77 B8R0.8 CC(CCCN)C(=O)O CS-0224463 [0,0,1,0,0,0|2,0,1]=4 78 B8R0.8 CCCC[C@H](C)C(=O)O CS-0452966 [0,0,1,0,0,0|2,0,1]=4 79 B8R0.8 CCCC[C@H](N)C(N)=O CS-0152443 [0,0,1,0,0,0|2,0,1]=4 80 B8R0.8 CSCCC(N)C(N)=O CS-0292574 [0,0,1,0,0,0|3,0,0]=4 81 B8R0.8 N[C@@H](CCCO)C(=O)O CS-0437642 [0,0,1,0,0,0|0,0,2]=3 82 B8R0.9 C#CC(=O)NCC(=O)O CS-0251452 [0,0,1,0,0,0|0,0,2]=3 83 B8R0.9 CCC(=O)CCC(=O)O CS-0207493 [0,0,1,0,0,0|1,0,0]=2 84 B8R0.9 CCC(=O)CCC(C)=O CS-0211119 [0,0,1,0,0,0|2,0,0]=3 85 B8R0.9 CCC(=O)COC(C)=O CS-0359350 [0,0,1,0,0,0|3,0,0]=4 86 B8R0.9 CNC(=O)NCC(=O)O CS-0247574 [0,0,1,0,0,0|1,0,0]=2 87 B8R0.9 CNC(=O)\C=C/C(=O)O CS-0454952 [0,0,1,0,0,0|2,0,1]=4 88 B8R0.9 NNC(=O)CCC(=O)O CS-0521384 [0,0,1,0,0,0|3,0,0]=4 89 B8R0.9 O=C(O)CCC(=O)O[Na] CS-0198098 [0,0,1,0,0,0|3,0,0]=4 90 B8R0.15 CCOC(CC)C(=O)O CS-0251354 [0,0,1,0,0,0|2,0,1]=4 91 B8R0.23 C=C(C)CC(C)C(=O)O CS-0233161 [0,0,1,0,0,0|2,0,0]=3 92 B8R0.23 CC(=O)C(C)CC(=O)O CS-0205112 [0,0,1,0,0,0|3,0,0]=4 93 B8R0.23 CC(=O)CC(O)C(C)=O CS-0615715 [0,0,1,0,0,0|3,0,0]=4 94 B8R0.23 CC(=O)OC(C)C(=O)O CS-0204661 [0,0,1,0,0,0|1,0,0]=2 95 B8R0.23 CC(C)CC(C)C(=O)O CS-0609945 [0,0,1,0,0,0|2,0,1]=4 96 B8R0.23 CC(C)NC(C)C(=O)O CS-0249471 [0,0,1,0,0,0|1,0,1]=3 97 B8R0.23 CC(CN(C)C)C(=O)O CS-0207720 [0,0,1,0,0,0|3,0,0]=4 98 B8R0.23 NC(=O)C[C@@H](O)C(=O)O CS-0224021 [0,0,1,0,0,0|3,0,0]=4 99 B8R0.23 N[C@@H](CC(=O)O)C(=O)O CS-W013997 [0,0,1,0,0,0|3,0,0]=4 100 B8R0.23 O=C(O)CC(O)C(=O)O CS-0511758 [0,0,1,0,0,0|3,0,0]=4 101 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O CS-0452070 [0,0,1,0,0,0|3,0,0]=4 102 B8R0.23 O=C(O)C[C@H](F)C(=O)O CS-0516920 [0,0,1,0,0,0|3,0,0]=4 103 B8R0.28 CC(=O)CSCC(=O)[O-] CS-0229889 [0,0,1,0,0,0|2,0,1]=4 104 B8R0.28 CC(N)CCCC(=O)O CS-0224845 [0,0,1,0,0,0|1,0,1]=3 105 B8R0.28 NC(=O)CCCC(=O)O CS-0514587 [0,0,1,0,0,0|0,0,0]=1 106 B8R0.28 NC(=O)CNCC(=O)O CS-0346281 [0,0,1,0,0,0|1,0,0]=2 107 B10R2.178 O=C1NCC2CCC1N2 CS-0172810 [0,0,0,1,0,0|2,0,1]=4 108 B10R2.348 O=C(O)C12CCC(C1)C2 CS-0092006 [0,0,0,1,0,0|2,0,1]=4 109 B10R2.357 O=C(O)C1CC2CC2C1 CS-0046676 [0,0,0,1,0,0|2,0,1]=4 110 B10R2.357 [C@H]12C[C@H]1C[C@@H](C(=O)O)N2 CS-0248069 [0,0,0,1,0,0|1,0,1]=3 111 B10R2.357 [C@H]12C[C@H]1C[C@@H](C(N)=O)N2 CS-0135377 [0,0,0,1,0,0|2,0,1]=4 112 B8R1.23 CC(=O)N1CC(=O)C1 CS-0380562 [0,0,0,0,1,0|3,0,0]=4 113 B8R1.23 CC(O)C1CC(=O)C1 CS-0468001 [0,0,0,0,1,0|2,0,1]=4 114 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 CS-0045557 [0,0,0,0,1,0|2,0,1]=4 115 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 CS-W022614 [0,0,0,0,1,0|2,0,1]=4 116 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 CS-0047792 [0,0,0,0,1,0|2,0,1]=4 117 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 CS-0053763 [0,0,0,0,1,0|2,0,1]=4 118 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 CS-0475970 [0,0,0,0,1,0|2,0,1]=4 119 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 CS-0049707 [0,0,0,0,1,0|2,0,1]=4 120 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 CS-0047785 [0,0,0,0,1,0|2,0,1]=4 121 B8R1.23 O=C1C[C@H](C(=O)O)N1 CS-0053483 [0,0,0,0,1,0|0,0,0]=1 122 B8R1.31 CC1NCC1C(=O)O CS-0091784 [0,0,0,0,1,0|2,0,1]=4 123 B8R1.31 CN1CCC1C(=O)O CS-0056391 [0,0,0,0,1,0|2,0,0]=3 124 B8R1.31 CN1CC[C@@H]1C(=O)O CS-0052024 [0,0,0,0,1,0|2,0,0]=3 125 B8R1.31 CN1CC[C@H]1C(=O)O CS-0052023 [0,0,0,0,1,0|2,0,0]=3 126 B8R1.31 N[C@H]1CC[C@H]1C(=O)O CS-0049744 [0,0,0,0,1,0|1,0,1]=3 127 B10R1.13 CC1CCC(C(=O)O)CN1 CS-0441513 [0,0,0,0,0,1|1,0,1]=3 128 B10R1.13 CC1CCC(C(N)=O)CN1 CS-0283189 [0,0,0,0,0,1|2,0,1]=4 129 B10R1.13 CC1CNC(C(=O)O)CO1 CS-1029496 [0,0,0,0,0,1|2,0,1]=4 130 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)CN1 CS-0961785 [0,0,0,0,0,1|1,0,1]=3 131 B10R1.13 NC(=O)C1CCC(=O)NC1 CS-0222969 [0,0,0,0,0,1|1,0,0]=2 132 B10R1.13 O=C(O)C1CC=C(Br)CC1 CS-0469958 [0,0,0,0,0,1|2,0,0]=3 133 B10R1.13 O=C(O)C1CCC(F)CC1 CS-0053674 [0,0,0,0,0,1|2,0,1]=4 134 B10R1.13 O=C(O)[C@H]1CC[C@@H](F)CC1 CS-0049762 [0,0,0,0,0,1|2,0,1]=4 135 B10R1.13 O=C(O)[C@H]1CC[C@H](F)CC1 CS-0047846 [0,0,0,0,0,1|2,0,1]=4 136 B10R1.13 O=C1CN[C@H](C(=O)O)CN1 CS-0134028 [0,0,0,0,0,1|1,0,0]=2 137 B10R1.13 O=C1CN[C@H](C(=O)O)CN1 CS-0611723 [0,0,0,0,0,1|1,0,0]=2 138 B10R1.54 O=C(O)CC1CCC(=O)N1 CS-0208149 [0,0,0,0,0,1|0,0,0]=1 139 B10R1.54 O=C(O)CC1CCC(=O)O1 CS-0246139 [0,0,0,0,0,1|1,0,0]=2 140 B10R1.54 O=C(O)CC1CNC(=O)C1 CS-0130413 [0,0,0,0,0,1|2,0,0]=3 141 B10R1.54 O=C(O)CC1COC(=O)C1 CS-0040913 [0,0,0,0,0,1|2,0,0]=3 142 B10R1.54 O=C(O)CN1CCC(=O)C1 CS-0338906 [0,0,0,0,0,1|2,0,0]=3 143 B10R1.54 O=C1CCC(CN(=O)=O)C1 CS-W016421 [0,0,0,0,0,1|2,0,1]=4 144 B10R1.113 CC(=O)N1CCCC(=O)C1 CS-0069659 [0,0,0,0,0,1|3,0,0]=4 145 B10R1.113 CC(=O)N1CCNC(=O)C1 CS-0051062 [0,0,0,0,0,1|3,0,0]=4 146 B10R1.113 CC(C)C1COCC(=O)N1 CS-0309080 [0,0,0,0,0,1|2,0,1]=4 147 B10R1.113 CC1CC(C(=O)O)CCN1 CS-0056620 [0,0,0,0,0,1|2,0,1]=4 148 B10R1.113 CC1CC(C(=O)O)CCO1 CS-0058244 [0,0,0,0,0,1|2,0,1]=4 149 B10R1.113 CC1CCNC(C(=O)O)C1 CS-0291767 [0,0,0,0,0,1|2,0,1]=4 150 B10R1.113 CC1CNCC(C(=O)O)C1 CS-0184864 [0,0,0,0,0,1|2,0,1]=4 151 B10R1.113 CN1CCC[C@H](C(=O)O)C1 CS-0053280 [0,0,0,0,0,1|3,0,0]=4 152 B10R1.113 CN1CCNC(C(=O)O)C1 CS-0210659 [0,0,0,0,0,1|3,0,0]=4 153 B10R1.113 CN1CCOC(C(=O)O)C1 CS-0341790 [0,0,0,0,0,1|3,0,0]=4 154 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCN1 CS-0505268 [0,0,0,0,0,1|2,0,1]=4 155 B10R1.113 C[C@@H]1C[C@H](C(=O)O)CCO1 CS-1067435 [0,0,0,0,0,1|2,0,1]=4 156 B10R1.113 NC1CCCC(C(=O)O)C1 CS-0099366 [0,0,0,0,0,1|2,0,1]=4 157 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 CS-0962429 [0,0,0,0,0,1|2,0,1]=4 158 B10R1.113 O=C(O)C1CC(O)CCN1 CS-0973497 [0,0,0,0,0,1|1,0,2]=4 159 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](O)C1 CS-0433315 [0,0,0,0,0,1|1,0,2]=4 160 B10R1.113 O=C(O)[C@H]1CCC[C@H](O)C1 CS-0356192 [0,0,0,0,0,1|1,0,2]=4 161 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 CS-0162367 [0,0,0,0,0,1|1,0,2]=4 162 B10R1.113 O=C1CCC[C@@H](C(=O)O)C1 CS-0309668 [0,0,0,0,0,1|1,0,0]=2 163 B10R1.113 O=C1CCNC(C(=O)O)C1 CS-0476424 [0,0,0,0,0,1|1,0,0]=2 164 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 CS-0318767 [0,0,0,0,0,1|1,0,0]=2 165 B10R1.113 O=C1CNCC(C(=O)O)N1 CS-0692950 [0,0,0,0,0,1|0,0,0]=1 166 B7R0.3 C=CCNC(=O)CN CS-0232507 [1,0,1,0,0,0|2,0,0]=4 167 B7R0.3 CCC(=O)NCCN CS-0678602 [1,0,1,0,0,0|1,0,1]=4 168 B7R0.3 CCC(=O)NCCN CS-0760118 [1,0,1,0,0,0|1,0,1]=4 169 B7R0.3 CCC(=O)OCCO CS-0516698 [1,0,1,0,0,0|1,0,1]=4 170 B7R0.3 CCCNC(=O)CC CS-0225875 [1,0,1,0,0,0|1,0,1]=4 171 B7R0.4 C=CCOCC(=O)O CS-0112199 [1,0,1,0,0,0|2,0,0]=4 172 B7R0.4 CCCNCC(=O)O CS-0297938 [1,0,1,0,0,0|0,0,1]=3 173 B7R0.4 NC(=O)CCCCCl CS-0216725 [1,0,1,0,0,0|1,0,1]=4 174 B7R0.4 NCCCCC(=O)O CS-0214080 [1,0,1,0,0,0|0,0,1]=3 175 B7R0.4 NCCSCC(=O)O CS-0230315 [1,0,1,0,0,0|1,0,1]=4 176 B7R0.4 NOCCCC(=O)O CS-0225209 [1,0,1,0,0,0|1,0,0]=3 177 B7R0.4 O=C(O)CCCCO CS-W022392 [1,0,1,0,0,0|0,0,2]=4 178 B7R0.5 CCCC(N)C(N)=O CS-0832391 [1,0,1,0,0,0|1,0,1]=4 179 B7R0.5 CCC[C@@H](O)C(=O)O CS-0697299 [1,0,1,0,0,0|1,0,1]=4 180 B7R0.5 CCNC(C)C(=O)O CS-0524761 [1,0,1,0,0,0|0,0,1]=3 181 B7R0.5 CCNC(C)C(N)=O CS-0323954 [1,0,1,0,0,0|1,0,1]=4 182 B7R0.5 CCN[C@@H](C)C(=O)O CS-0524772 [1,0,1,0,0,0|0,0,1]=3 183 B7R0.5 CCN[C@H](C)C(=O)O CS-0457913 [1,0,1,0,0,0|0,0,1]=3 184 B7R0.5 CCSC(C)C(=O)O CS-0449712 [1,0,1,0,0,0|1,0,1]=4 185 B7R0.5 NCC[C@@H](O)C(=O)O CS-0214761 [1,0,1,0,0,0|2,0,0]=4 186 B7R0.5 N[C@@H](CCO)C(=O)O CS-0541796 [1,0,1,0,0,0|0,0,1]=3 187 B7R0.5 O=C(O)C(O)CCO CS-1001199 [1,0,1,0,0,0|1,0,1]=4 188 B7R0.6 CC(C)=CCC(=O)O CS-0453086 [1,0,1,0,0,0|2,0,0]=4 189 B7R0.6 CC(C)NCC(=O)O CS-0274531 [1,0,1,0,0,0|1,0,1]=4 190 B7R0.6 O=C(O)CCC(=O)O CS-0912129 [1,0,1,0,0,0|2,0,0]=4 191 B7R0.15 CCC(CN)C(=O)O CS-0680219 [1,0,1,0,0,0|1,0,1]=4 192 B7R0.15 CCC(NC)C(N)=O CS-0895915 [1,0,1,0,0,0|1,0,1]=4 193 B7R0.15 CCC(OC)C(=O)O CS-0252116 [1,0,1,0,0,0|1,0,1]=4 194 B7R0.15 CNC(CS)C(=O)O CS-0301359 [1,0,1,0,0,0|1,0,1]=4 195 B7R0.2 CC(=O)NC(C)CN CS-0521164 [1,0,1,0,0,0|1,0,1]=4 196 B7R1.1 O=CC1CCSC1 CS-0237905 [2,0,0,0,0,0|2,0,0]=4 197 B7R1.1 OCC1C=CCC1 CS-0341069 [2,0,0,0,0,0|1,0,1]=4 198 B7R1.2 CC1CCC(=O)C1 CS-0015918 [2,0,0,0,0,0|1,0,1]=4 199 B7R1.2 C[C@H]1CCC(=O)O1 CS-0233222 [2,0,0,0,0,0|1,0,1]=4 200 B7R1.2 O=C1C=C(O)CC1 CS-0319792 [2,0,0,0,0,0|1,0,1]=4 201 B7R1.2 O=C1CC[C@H](O)C1 CS-0495545 [2,0,0,0,0,0|1,0,0]=3 202 B9R0.6 CCCC(O)C(N)C(=O)O CS-0234506 [0,1,1,0,0,0|1,0,1]=4 203 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O CS-1046141 [0,1,1,0,0,0|1,0,0]=3 204 B9R0.7 C=C(CCC(=O)O)C(=O)O CS-0144510 [0,1,1,0,0,0|1,0,1]=4 205 B9R0.7 CC(=O)C(C)CCC(=O)O CS-0253545 [0,1,1,0,0,0|2,0,0]=4 206 B9R0.7 CC(=O)SC[C@H](N)C(=O)O CS-0914560 [0,1,1,0,0,0|1,0,0]=3 207 B9R0.7 CC(C)=CCC(N)C(=O)O CS-0216156 [0,1,1,0,0,0|1,0,1]=4 208 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O CS-0505173 [0,1,1,0,0,0|1,0,1]=4 209 B9R0.7 CC(C)=CC[C@H](N)C(=O)O CS-0468261 [0,1,1,0,0,0|1,0,1]=4 210 B9R0.7 C[C@H](CCC(=O)O)C(=O)O CS-0063209 [0,1,1,0,0,0|1,0,0]=3 211 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O CS-0516250 [0,1,1,0,0,0|2,0,0]=4 212 B9R0.7 N=C(N)NC[C@H](N)C(=O)O CS-W017079 [0,1,1,0,0,0|2,0,0]=4 213 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O CS-0306574 [0,1,1,0,0,0|1,0,0]=3 214 B9R0.7 O=C(O)CCC(=O)C(=O)O CS-0636767 [0,1,1,0,0,0|1,0,1]=4 215 B9R0.8 CCCC[C@@H](N)C(=O)OC CS-0454118 [0,1,1,0,0,0|1,0,1]=4 216 B9R0.8 COC(=O)[C@H](N)CCCN CS-0868382 [0,1,1,0,0,0|1,0,1]=4 217 B9R0.8 CSCC[C@H](N)C(=O)NO CS-0222618 [0,1,1,0,0,0|2,0,0]=4 218 B9R0.13 CN[C@H](CCSC)C(=O)O CS-0511331 [0,1,1,0,0,0|2,0,0]=4 219 B9R0.42 CCC(C)CC(N)C(=O)O CS-0230416 [0,1,1,0,0,0|1,0,1]=4 220 B9R0.47 C#CCCC[C@@H](N)C(=O)O CS-0522227 [0,1,1,0,0,0|1,0,1]=4 221 B9R0.47 C=CCCCC(N)C(=O)O CS-0764833 [0,1,1,0,0,0|1,0,0]=3 222 B9R0.47 C=CCCC[C@@H](N)C(=O)O CS-0416111 [0,1,1,0,0,0|1,0,0]=3 223 B9R0.47 CCCSCC(N)C(=O)O CS-0968184 [0,1,1,0,0,0|1,0,1]=4 224 B9R0.47 CCSCCC(N)C(=O)O CS-W017918 [0,1,1,0,0,0|1,0,1]=4 225 B9R0.47 COCCCC(N)C(=O)O CS-0231606 [0,1,1,0,0,0|0,0,2]=4 226 B9R0.47 NC(CSCCO)C(=O)O CS-0458421 [0,1,1,0,0,0|0,0,2]=4 227 B9R0.47 NCCCC[C@H](N)C(=O)O CS-0138346 [0,1,1,0,0,0|1,0,1]=4 228 B9R0.47 N[C@@H](CCCCO)C(=O)O CS-0266479 [0,1,1,0,0,0|0,0,2]=4 229 B9R0.47 N[C@@H](CCCNO)C(=O)O CS-0072498 [0,1,1,0,0,0|0,0,2]=4 230 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O CS-0116014 [0,1,1,0,0,0|2,0,0]=4 231 B9R0.51 C=CCCC(C)(C)C(=O)O CS-0071761 [0,1,1,0,0,0|2,0,0]=4 232 B9R0.51 CC(N)(CCCN)C(=O)O CS-0364959 [0,1,1,0,0,0|1,0,1]=4 233 B9R0.23 C=C(CC(=O)O)C(=O)OC CS-0217993 [0,1,1,0,0,0|2,0,0]=4 234 B9R0.23 COC(=O)N(C)CC(=O)O CS-0248070 [0,1,1,0,0,0|1,0,0]=3 235 B9R0.24 COC(=O)CCC(=O)CCl CS-0237825 [0,1,1,0,0,0|2,0,0]=4 236 B9R0.24 COC(=O)CNC(=O)OC CS-0209909 [0,1,1,0,0,0|1,0,0]=3 237 B9R0.48 CCCC(=O)CCC(C)=O CS-0368306 [0,1,1,0,0,0|2,0,0]=4 238 B9R0.48 CCOC(=O)CCC(N)=O CS-0172368 [0,1,1,0,0,0|2,0,0]=4 239 B9R0.48 COCC(C)NCC(=O)O CS-0258477 [0,1,1,0,0,0|1,0,1]=4 240 B9R0.48 NCCC(=O)NCC(=O)O CS-0459154 [0,1,1,0,0,0|0,0,0]=2 241 B9R0.29 CCC(C(=O)O)N(C)CC CS-0338658 [0,1,1,0,0,0|1,0,1]=4 242 B9R0.33 CC(C)C(NC=O)C(=O)O CS-0273682 [0,1,1,0,0,0|0,0,0]=2 243 B9R0.39 CC(=O)N[C@H](CO)C(=O)O CS-0139824 [0,1,1,0,0,0|1,0,0]=3 244 B9R0.39 CNC(CC(=O)O)C(=O)O CS-0208899 [0,1,1,0,0,0|2,0,0]=4 245 B9R0.39 COC(CC(=O)O)C(=O)O CS-0539587 [0,1,1,0,0,0|2,0,0]=4 246 B9R0.39 NCC(CC(=O)O)C(=O)O CS-0224627 [0,1,1,0,0,0|2,0,0]=4 247 B9R0.74 C=CCC(C)(CC)C(=O)O CS-0253026 [0,1,1,0,0,0|2,0,0]=4 248 B9R0.79 CC(C(=O)O)C(O)C(=O)O CS-0225754 [0,1,1,0,0,0|2,0,0]=4 249 B9R0.1 COC(=O)CCNC(N)=O CS-0260153 [0,1,1,0,0,0|1,0,0]=3 250 B9R0.1 O=C(O)CCNC(=O)CBr CS-0114564 [0,1,1,0,0,0|2,0,0]=4 251 B9R0.1 O=C(O)CCNC(=O)CCl CS-0317754 [0,1,1,0,0,0|2,0,0]=4 252 B9R0.53 O=C(O)CS(=O)CC(=O)O CS-W000008 [0,1,1,0,0,0|2,0,0]=4 253 B9R0.56 CS(=O)(=O)CCCC(=O)O CS-0217190 [0,1,1,0,0,0|2,0,0]=4 254 B9R1.7 C=CCC1CCC(=O)C1 CS-0243182 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.7 CNCC1CCC(=O)N1 CS-0349410 [1,1,0,0,0,0|1,0,1]=4 256 B9R1.7 CNC[C@@H]1CCC(=O)N1 CS-1039983 [1,1,0,0,0,0|1,0,1]=4 257 B9R1.7 COCC1CCC(=O)C1 CS-0243802 [1,1,0,0,0,0|1,0,1]=4 258 B9R1.7 N#CC[C@@H]1CCC(=O)N1 CS-0455260 [1,1,0,0,0,0|1,0,1]=4 259 B9R1.7 O=C1CCC(CCO)N1 CS-0215642 [1,1,0,0,0,0|0,0,1]=3 260 B9R1.125 CC1(CO)CCC(=O)N1 CS-0441560 [1,1,0,0,0,0|0,0,1]=3 261 B9R1.132 CN1C(=O)CC[C@@H]1CN CS-0502204 [1,1,0,0,0,0|1,0,1]=4 262 B9R1.132 CN1C(=O)CC[C@H]1CN CS-0502205 [1,1,0,0,0,0|1,0,1]=4 263 B9R1.11 CNC(=O)C1CCCN1 CS-0301342 [1,1,0,0,0,0|1,0,1]=4 264 B9R1.11 COC(=O)C1CCCC1 CS-0782728 [1,1,0,0,0,0|1,0,1]=4 265 B9R1.11 COC(=O)C1CCCN1 CS-0453254 [1,1,0,0,0,0|0,0,1]=3 266 B9R1.11 COC(=O)[C@@H]1CCNC1 CS-0049282 [1,1,0,0,0,0|2,0,0]=4 267 B9R1.11 COC(=O)[C@@H]1CCOC1 CS-0049283 [1,1,0,0,0,0|2,0,0]=4 268 B9R1.11 COC(=O)[C@H]1CCOC1 CS-0049276 [1,1,0,0,0,0|2,0,0]=4 269 B9R1.11 NNC(=O)C1ccCC1 CS-0514867 [1,1,0,0,0,0|2,0,0]=4 270 B9R1.11 O=C(NO)C1CCCN1 CS-1029501 [1,1,0,0,0,0|0,0,1]=3 271 B9R1.11 O=C(NO)[C@@H]1CCCN1 CS-1006077 [1,1,0,0,0,0|0,0,1]=3 272 B9R1.41 CN1CCCC1C(=O)O CS-0163377 [1,1,0,0,0,0|0,0,1]=3 273 B9R1.41 CN1CCC[C@@H]1C(N)=O CS-0757774 [1,1,0,0,0,0|1,0,1]=4 274 B9R1.41 CN1CCC[C@H]1C(=O)O CS-0183708 [1,1,0,0,0,0|0,0,1]=3 275 B9R1.41 CN1CCC[C@H]1C(=O)O CS-W002433 [1,1,0,0,0,0|0,0,1]=3 276 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O CS-0089000 [1,1,0,0,0,0|0,0,1]=3 277 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O CS-0119965 [1,1,0,0,0,0|1,0,1]=4 278 B9R1.41 NN1CCC[C@@H]1C(=O)O CS-0259367 [1,1,0,0,0,0|0,0,1]=3 279 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O CS-0130157 [1,1,0,0,0,0|1,0,1]=4 280 B9R1.41 N[C@H]1C=CC[C@H]1C(=O)O CS-0058043 [1,1,0,0,0,0|1,0,1]=4 281 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O CS-0131294 [1,1,0,0,0,0|1,0,1]=4 282 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O CS-0132060 [1,1,0,0,0,0|1,0,1]=4 283 B9R1.41 O=C(O)C1CCCC1O CS-0486250 [1,1,0,0,0,0|1,0,1]=4 284 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F CS-0505808 [1,1,0,0,0,0|0,0,1]=3 285 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O CS-0053473 [1,1,0,0,0,0|0,0,1]=3 286 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O CS-0376880 [1,1,0,0,0,0|1,0,1]=4 287 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F CS-0505766 [1,1,0,0,0,0|0,0,1]=3 288 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O CS-0049702 [1,1,0,0,0,0|0,0,1]=3 289 B9R1.163 CC1(C(=O)O)CCCS1 CS-0264676 [1,1,0,0,0,0|1,0,1]=4 290 B9R1.163 C[C@@]1(C(N)=O)CCCN1 CS-0054566 [1,1,0,0,0,0|1,0,1]=4 291 B9R1.163 NC1(C(=O)O)CCSC1 CS-0216454 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.163 N[C@@]1(C(=O)O)CCOC1 CS-0096647 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.163 O=C(O)C1(F)CCOC1 CS-0499494 [1,1,0,0,0,0|2,0,0]=4 294 B9R1.163 O=C(O)C1(O)CCNC1 CS-0611808 [1,1,0,0,0,0|2,0,0]=4 295 B9R1.163 O=C(O)C1(O)CCSC1 CS-0225089 [1,1,0,0,0,0|2,0,0]=4 296 B9R1.152 C=C1CC(C)(C(=O)O)C1 CS-0052448 [0,1,0,0,1,0|2,0,0]=4 297 B9R1.152 C=C1CC(O)(C(=O)O)C1 CS-0506279 [0,1,0,0,1,0|2,0,0]=4 298 B9R1.152 NC1(C(=O)O)CC(=O)C1 CS-0747342 [0,1,0,0,1,0|1,0,0]=3 299 B9R1.52 C[C@@H]1CN(C)[C@@H]1C(=O)O CS-0648700 [0,1,0,0,1,0|2,0,0]=4 300 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N CS-0055427 [0,1,0,0,1,0|1,0,1]=4 301 B9R1.96 CCC1CCC1C(=O)O CS-0045490 [0,1,0,0,1,0|1,0,1]=4 302 B9R1.96 N#CC1CCC1C(=O)O CS-0051917 [0,1,0,0,1,0|1,0,1]=4 303 B9R1.166 CC1(C)CCC1C(=O)O CS-0045494 [0,1,0,0,1,0|1,0,1]=4 304 B11R1.21 CC1CC(C(=O)O)CCC1=O CS-0487362 [0,1,0,0,0,1|1,0,0]=3 305 B11R1.21 CN1C[C@H](C(=O)O)CCC1=O CS-0476242 [0,1,0,0,0,1|0,0,0]=2 306 B11R1.21 CN1N=C(C(=O)O)CCC1=O CS-0139067 [0,1,0,0,0,1|0,0,1]=3 307 B11R1.22 C=C1CCC(C(=O)OC)CC1 CS-0541451 [0,1,0,0,0,1|2,0,0]=4 308 B11R1.22 COC(=O)C1CC=C(Br)CC1 CS-0780871 [0,1,0,0,0,1|2,0,0]=4 309 B11R1.22 COC(=O)[C@@H]1CCC(=O)NC1 CS-0477245 [0,1,0,0,0,1|0,0,0]=2 310 B11R1.22 COC(=O)[C@H]1CC[C@H](C)NC1 CS-0503415 [0,1,0,0,0,1|1,0,1]=4 311 B11R1.220 CC1(C(=O)O)COC(=O)OC1 CS-0225093 [0,1,0,0,0,1|2,0,0]=4 312 B11R1.220 CC1=CCC(C)(C(=O)O)CC1 CS-0906647 [0,1,0,0,0,1|2,0,0]=4 313 B11R1.220 O=C1CCC(F)(C(=O)O)CC1 CS-0474904 [0,1,0,0,0,1|1,0,0]=3 314 B11R1.727 O=C(O)C1CCC(F)(F)CN1 CS-0050734 [0,1,0,0,0,1|1,0,1]=4 315 B11R1.39 COC(=O)CC1CNC(=O)C1 CS-0441144 [0,1,0,0,0,1|2,0,0]=4 316 B11R1.39 COC(=O)C[C@@H]1CCC(=O)C1 CS-0555667 [0,1,0,0,0,1|1,0,0]=3 317 B11R1.39 COC(=O)C[C@@H]1CCC(=O)N1 CS-0471046 [0,1,0,0,0,1|0,0,0]=2 318 B11R1.80 CN1CC(CC(=O)O)CC1=O CS-0501966 [0,1,0,0,0,1|2,0,0]=4 319 B11R1.313 CN1C(=O)CCC1CC(=O)O CS-0239213 [0,1,0,0,0,1|0,0,0]=2 320 B11R1.710 O=C(O)CC1CCS(=O)(=O)C1 CS-0207213 [0,1,0,0,0,1|2,0,0]=4 321 B11R1.15 CCOC(=O)[C@@H]1CC[C@H](C)N1 CS-0454861 [0,2,0,0,0,0|1,0,1]=4 322 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)C(=O)N1 CS-0058122 [0,2,0,0,0,0|0,0,0]=2 323 B11R1.226 COC(=O)[C@@H]1C[C@H](O)C(=O)N1 CS-0058123 [0,2,0,0,0,0|0,0,0]=2 324 B11R1.175 CC(=O)N1CCC(C(=O)O)C1 CS-0467569 [0,2,0,0,0,0|2,0,0]=4 325 B11R1.489 CC1(C)CC(=O)NC1C(=O)O CS-0183814 [0,2,0,0,0,0|0,0,0]=2 326 B9R1.6 O=C(O)C1CCCNN1 CS-0758014 [0,0,1,1,0,0|1,0,1]=4 327 B9R1.6 O=C(O)[C@@H]1CCCNN1 CS-0436367 [0,0,1,1,0,0|1,0,1]=4 328 B9R1.69 N[C@H]1CCC(=O)NC1=O CS-0504406 [0,0,1,1,0,0|1,0,0]=3 329 B9R1.110 NC(C(=O)O)C1COC1 CS-0052062 [0,0,1,1,0,0|2,0,0]=4 330 B9R1.10 CC1(O)CCC(=O)NC1 CS-0465675 [0,0,1,1,0,0|1,0,1]=4 331 B9R1.49 O=C1CCNC(=O)CC1 CS-0215332 [0,0,1,1,0,0|2,0,0]=4 332 B9R1.33 C=CCC1CCOC1=O CS-0236403 [0,0,1,1,0,0|2,0,0]=4 333 B9R1.161 NC(=O)C1CC1C(=O)O CS-0051983 [0,0,1,1,0,0|2,0,0]=4 334 B9R1.53 CC(=O)CC1CC(=O)N1 CS-0726191 [0,0,1,1,0,0|1,0,0]=3 335 B9R1.53 NC1CC(CC(=O)O)C1 CS-0052288 [0,0,1,1,0,0|1,0,1]=4 336 B9R1.53 NC1CC(CC(=O)O)C1 CS-0185088 [0,0,1,1,0,0|1,0,1]=4 337 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 CS-0049761 [0,0,1,1,0,0|1,0,1]=4 338 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 CS-0185072 [0,0,1,1,0,0|1,0,1]=4 339 B9R1.66 O=C1CCCS(=O)(=O)N1 CS-0213008 [0,0,1,1,0,0|1,0,1]=4 340 B9R2.39 O=C1NC2CNC1C2 CS-0492703 [1,0,0,1,0,0|1,0,1]=4 341 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 CS-0131291 [1,0,0,1,0,0|1,0,1]=4 342 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 CS-0455963 [1,0,0,1,0,0|1,0,1]=4 343 B9R2.39 O=C1N[C@H]2CN[C@@H]1C2 CS-0779346 [1,0,0,1,0,0|1,0,1]=4 344 B9R2.139 O=C1CCC2(CC2)N1 CS-0088416 [1,0,0,1,0,0|1,0,1]=4 345 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1N2 CS-0718810 [0,0,0,1,0,1|1,0,1]=4 346 B11R2.47 O=C1CC2CCC1CC2=O CS-0160254 [0,0,0,1,0,1|2,0,0]=4 347 B11R2.47 O=C1NC2CCC1NC2=O CS-0439624 [0,0,0,1,0,1|1,0,0]=3 348 B11R2.201 O=C1OC(=O)C2CCC1C2 CS-0223296 [0,1,0,1,0,0|1,0,1]=4 349 B7R0.16 CC(C(=O)O)N(C)C CS-0205349 [0,0,1,0,1,0|2,0,0]=4 350 B7R0.16 CC(C(=O)O)N(C)C CS-0447938 [0,0,1,0,1,0|2,0,0]=4 351 B7R0.16 CC(C)=C(C)C(=O)O CS-0229947 [0,0,1,0,1,0|1,0,1]=4 352 B7R0.16 CC(C)[C@@H](C)C(=O)O CS-0273260 [0,0,1,0,1,0|1,0,1]=4 353 B7R0.16 CC(C)[C@H](C)C(=O)O CS-0447089 [0,0,1,0,1,0|1,0,1]=4 354 B7R1.8 COC1CCC1=O CS-0185211 [1,0,0,0,1,0|2,0,0]=4 355 B7R1.10 O=C1CC(CO)N1 CS-0051147 [1,0,0,0,1,0|0,0,1]=3 356 B7R1.10 O=C1C[C@@H](CO)N1 CS-0523935 [1,0,0,0,1,0|0,0,1]=3 357 B7R1.18 NC(=O)C1CCN1 CS-0005435 [1,0,0,0,1,0|1,0,0]=3 358 B7R1.18 NC(=O)C1CCN1 CS-0718838 [1,0,0,0,1,0|1,0,0]=3 359 B7R1.18 NC(=O)[C@@H]1CCN1 CS-0614448 [1,0,0,0,1,0|1,0,0]=3 360 B7R1.18 NC(=O)[C@@H]1CCN1 CS-1046018 [1,0,0,0,1,0|1,0,0]=3 361 B7R1.18 O=C(O)C1CCN1 CS-0271917 [1,0,0,0,1,0|0,0,0]=2 362 B7R1.18 O=C(O)C1CSC1 CS-0045516 [1,0,0,0,1,0|1,0,1]=4 363 B7R1.18 O=C(O)[C@@H]1CCN1 CS-0171605 [1,0,0,0,1,0|0,0,0]=2 364 B7R1.18 O=C(O)[C@H]1CCO1 CS-0148271 [1,0,0,0,1,0|1,0,0]=3 365 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O CS-0055686 [0,0,0,0,2,0|1,0,1]=4 366 B7R1.12 C[C@@H]1C[C@H]1C(=O)O CS-0308589 [0,0,0,0,2,0|1,0,1]=4 367 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I CS-0043217 [0,0,0,0,2,0|1,0,1]=4 368 B7R1.12 O=C(O)[C@H]1C[C@H]1I CS-0016517 [0,0,0,0,2,0|1,0,1]=4 369 B9R0.4 CSCCC(N)CC(=O)O CS-0201750 [0,0,1,0,0,1|2,0,0]=4 370 B9R0.55 CC(=O)CCCCC(C)=O CS-0698151 [0,0,1,0,0,1|2,0,0]=4 371 B9R0.55 NC(=O)CCCCC(=O)O CS-0516512 [0,0,1,0,0,1|0,0,0]=2 372 B9R0.55 O=C(O)CSSCC(=O)O CS-0204358 [0,0,1,0,0,1|2,0,0]=4 373 B9R1.2 CC[C@H]1CNCC(=O)N1 CS-0540601 [1,0,0,0,0,1|1,0,1]=4 374 B9R1.2 NCC1CCCC(=O)N1 CS-0136476 [1,0,0,0,0,1|1,0,1]=4 375 B9R1.2 O=C1CCC[C@H](CO)N1 CS-0214865 [1,0,0,0,0,1|0,0,1]=3 376 B9R1.13 NC(=O)CC1CCCN1 CS-0225687 [1,0,0,0,0,1|1,0,1]=4 377 B9R1.13 O=C(O)CC1CCNC1 CS-0155221 [1,0,0,0,0,1|2,0,0]=4 378 B9R1.13 O=C(O)C[C@H]1CCNC1 CS-0057281 [1,0,0,0,0,1|2,0,0]=4 379 B9R1.13 O=C(O)C[C@H]1CCOC1 CS-0054371 [1,0,0,0,0,1|2,0,0]=4 380 B11R1.20 O=C(O)CC1CCC(=O)CC1 CS-0072017 [0,0,0,0,0,2|1,0,0]=3 381 B11R1.565 O=C1CCCC(C(=O)O)CC1 CS-0171556 [0,0,0,0,0,2|1,0,0]=3 382 B11R1.75 O=C(O)CCC1CCC(=O)N1 CS-0308008 [0,0,0,0,0,2|0,0,0]=2 383 B11R1.75 O=C(O)CCC1CCC(=O)O1 CS-0342519 [0,0,0,0,0,2|1,0,0]=3 384 B11R1.497 O=C1CCCCC(C(=O)O)C1 CS-0239703 [0,0,0,0,0,2|1,0,0]=3 385 B11R1.497 O=C1CCCCC(C(=O)O)N1 CS-0261798 [0,0,0,0,0,2|0,0,0]=2