0 B7R0.16 CC(=O)C(Br)C(C)=O 9608AD [0,0,0,0,0,0|2,0,2]=4 1 B7R0.16 CC(C(=O)O)N(C)C 5353AD [0,0,0,0,0,0|3,0,0]=3 2 B7R0.16 CC(C)C(=O)C(=O)[O-] 4739AB [0,0,0,0,0,0|2,0,2]=4 3 B7R0.16 CC(C)C(F)C(=O)O W3426 [0,0,0,0,0,0|2,0,0]=2 4 B6R0.2 CC(=O)CC(=O)[O-] 8151AL [1,0,0,0,0,0|0,0,3]=4 5 B6R0.2 CC(O)C[N+](=O)[O-] 0004AE [1,0,0,0,0,0|1,0,1]=3 6 B6R0.2 CN(C)CC(=O)[O-] 9593AA [1,0,0,0,0,0|2,0,1]=4 7 B6R0.2 C[C@H](Br)CC(=O)O V0016 [1,0,0,0,0,0|1,0,0]=2 8 B6R0.2 NC(=O)CC(=O)O 1571AB [1,0,0,0,0,0|1,0,2]=4 9 B6R0.3 C=C(CBr)C(=O)O 1795AL [1,0,0,0,0,0|2,0,1]=4 10 B6R0.3 CC(=O)C(N)CO 6844AC [1,0,0,0,0,0|1,0,0]=2 11 B6R0.3 CC(C)[C@H](N)CO 8725AA [1,0,0,0,0,0|1,0,1]=3 12 B6R0.3 CC(CS)C(=O)O Y3236 [1,0,0,0,0,0|1,1,0]=3 13 B6R0.3 CCC(Br)C(N)=O 5224AE [1,0,0,0,0,0|2,0,0]=3 14 B6R0.3 CCC(C)C(C)=O U423 [1,0,0,0,0,0|2,0,0]=3 15 B6R0.3 CCC(O)C(=O)[O-] 8154AL [1,0,0,0,0,0|1,0,1]=3 16 B6R0.3 CCC(S)C(C)=O 9471AJ [1,0,0,0,0,0|2,0,0]=3 17 B6R0.3 CC[C@@H](C)C(=O)O 1204AL [1,0,0,0,0,0|1,0,0]=2 18 B6R0.3 CC[C@@H](C)C(N)=O 5046AB [1,0,0,0,0,0|2,0,0]=3 19 B6R0.3 CC[C@@H](Cl)C(=O)O 4152AL [1,0,0,0,0,0|1,0,0]=2 20 B6R0.3 CC[C@H](Cl)C(=O)O Z6043 [1,0,0,0,0,0|1,0,0]=2 21 B6R0.3 CN[C@H](C)C(=O)O Z5607 [1,0,0,0,0,0|2,0,0]=3 22 B6R0.3 CSC(C)C(=O)O 6148AE [1,0,0,0,0,0|2,0,0]=3 23 B6R0.3 CSC(C)C(C)=O 6125AL [1,0,0,0,0,0|3,0,0]=4 24 B6R0.3 C[C@@H](CN)C(=O)O 5862AB [1,0,0,0,0,0|2,0,0]=3 25 B6R0.3 C\C=C(\C)C(=O)O 8382AJ [1,0,0,0,0,0|1,0,2]=4 26 B6R0.3 NC(=O)C(Br)CBr 5213AL [1,0,0,0,0,0|3,0,0]=4 27 B6R0.3 NC(=O)C(N)CO 2131AB [1,0,0,0,0,0|1,0,0]=2 28 B6R0.3 NC(=O)\C(N)=N\O 6631AD [1,0,0,0,0,0|2,0,1]=4 29 B6R0.3 NC[C@H](N)C(=O)O 0179AB [1,0,0,0,0,0|1,0,0]=2 30 B6R0.3 N[C@@H](CCl)C(=O)O Z5908 [1,0,0,0,0,0|1,0,0]=2 31 B6R0.3 N[C@@H](CO)C(=O)O Z6084 [1,0,0,0,0,0|0,0,0]=1 32 B6R0.3 N[C@H](CCl)C(=O)O 5119AB [1,0,0,0,0,0|1,0,0]=2 33 B6R0.3 O=C(O)C(Br)CF 0454AQ [1,0,0,0,0,0|2,0,0]=3 34 B6R0.3 O=C(O)C(Cl)CO 0455AQ [1,0,0,0,0,0|1,0,0]=2 35 B6R0.3 O=C(O)C(O)CCl 2399AL [1,0,0,0,0,0|2,0,0]=3 36 B6R0.3 O=C([O-])C(O)CO 7310AL [1,0,0,0,0,0|1,0,1]=3 37 B8R0.2 CC(C)[C@H](N)C(=O)CCl 7355AH [0,1,0,0,0,0|2,0,0]=3 38 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O E693 [0,1,0,0,0,0|1,0,0]=2 39 B8R0.2 CNC(=O)C(N)C(C)C 6354AD [0,1,0,0,0,0|2,0,0]=3 40 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O 7348AH [0,1,0,0,0,0|1,0,0]=2 41 B8R0.2 COC(=O)C(C)C(=O)O 2314AJ [0,1,0,0,0,0|1,0,2]=4 42 B8R0.2 COC(=O)C(N)C(C)=O 0522AC [0,1,0,0,0,0|0,0,2]=3 43 B8R0.2 C[C@@H](O)[C@@H](O)[C@@H](O)C=O 5560AA [0,1,0,0,0,0|1,0,1]=3 44 B8R0.18 CC(C)[C@@H](CN)C(=O)O 5651AC [0,1,0,0,0,0|1,0,0]=2 45 B8R0.18 CC(C)[C@H](CN)C(=O)O 0748AB [0,1,0,0,0,0|1,0,0]=2 46 B8R0.18 CC(C)[C@H](CN)C(=O)O 5355AA [0,1,0,0,0,0|1,0,0]=2 47 B8R0.18 CC(C)[C@H](NO)C(=O)O Q384 [0,1,0,0,0,0|1,0,0]=2 48 B8R0.18 CCC(C(=O)O)N(C)C 5509AD [0,1,0,0,0,0|3,0,0]=4 49 B8R0.18 CNC(C(=O)O)C(C)C Z5785 [0,1,0,0,0,0|1,0,0]=2 50 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O Z5815 [0,1,0,0,0,0|0,0,0]=1 51 B8R0.27 CC(C(=O)O)C(F)(F)F 4925AB [0,1,0,0,0,0|3,0,0]=4 52 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O X9026 [0,1,0,0,0,0|1,0,0]=2 53 B8R0.27 CC(C)(C)[C@H](N)C(=O)O V9295 [0,1,0,0,0,0|1,0,0]=2 54 B8R0.27 CC(C)(O)C(N)C(=O)O 5433AJ [0,1,0,0,0,0|0,0,0]=1 55 B8R0.27 N[C@H](C(=O)O)C(F)(F)F V1389 [0,1,0,0,0,0|2,0,0]=3 56 B8R0.27 O=C(O)C(F)C(F)(F)F 1569AE [0,1,0,0,0,0|3,0,0]=4 57 B8R0.37 O=C(O)C(O)(O)C(=O)O 8187AB [0,1,0,0,0,0|2,0,1]=4 58 B8R1.50 CC1=NOC(=O)C1C W3412 [0,0,0,1,0,0|2,0,1]=4 59 B8R1.50 OC1OC[C@H](O)[C@H]1O 6453AC [0,0,0,1,0,0|1,0,2]=4 60 B8R1.54 NC(C(=O)O)C1CC1 7918AA [0,0,0,1,0,0|1,0,0]=2 61 B8R1.77 CC1(C)CC1C(N)=O 5881AD [0,0,0,1,0,0|3,0,0]=4 62 B8R1.77 O=C(O)C1CC1(Cl)Cl 5151AE [0,0,0,1,0,0|3,0,0]=4 63 B8R1.77 O=C(O)C1CC1(F)Cl 2031AL [0,0,0,1,0,0|3,0,0]=4 64 B8R0.23 C=C(C)C[C@H](N)C(=O)O 7037AH [0,0,0,0,0,1|1,0,1]=3 65 B8R0.23 CC(=O)C(N)CC(C)C 5475AB [0,0,0,0,0,1|2,0,0]=3 66 B8R0.23 CC(=O)CC(C)C(=O)O 7660AE [0,0,0,0,0,1|1,0,2]=4 67 B8R0.23 CC(C)[C@@H](N)CC(=O)O 0469AP [0,0,0,0,0,1|1,0,0]=2 68 B8R0.23 CC(C)[C@@H](N)CC(=O)O Z5862 [0,0,0,0,0,1|1,0,0]=2 69 B8R0.23 CC(C)[C@H](N)CC(=O)O Z5766 [0,0,0,0,0,1|1,0,0]=2 70 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O 9975AA [0,0,0,0,0,1|0,0,0]=1 71 B8R0.23 C[C@H](CC(=O)O)C(=O)O 9223AJ [0,0,0,0,0,1|2,0,1]=4 72 B8R0.23 NC(=O)[C@@H](N)CC(=O)O 6580AH [0,0,0,0,0,1|1,0,2]=4 73 B5R0.1 C#CCC(C)O 6664AL [2,0,0,0,0,0|1,0,1]=4 74 B5R0.1 C=CCC(C)C 6595AL [2,0,0,0,0,0|2,0,0]=4 75 B5R0.1 C=CCC(C)O 7318AF [2,0,0,0,0,0|1,0,0]=3 76 B5R0.1 CC(O)CON 3604AB [2,0,0,0,0,0|2,0,0]=4 77 B5R0.1 CNCC(C)=O 4565AF [2,0,0,0,0,0|2,0,0]=4 78 B5R0.1 COC[C@H](C)O W4988 [2,0,0,0,0,0|2,0,0]=4 79 B5R0.1 C[C@H](N)CCO 3502AC [2,0,0,0,0,0|1,0,1]=4 80 B5R0.1 NC(=O)CCO 8063AJ [2,0,0,0,0,0|1,0,0]=3 81 B5R0.1 O=C(O)CCF 6350AB [2,0,0,0,0,0|1,0,0]=3 82 B5R0.3 C=C[C@H](O)CO 1303AL [2,0,0,0,0,0|2,0,0]=4 83 B5R0.3 N\C(CO)=N\O 9010AE [2,0,0,0,0,0|1,0,1]=4 84 B5R0.5 CC(=O)C(C)F 0085AF [2,0,0,0,0,0|2,0,0]=4 85 B5R0.5 CC(N)C(C)O 7117AF [2,0,0,0,0,0|0,0,1]=3 86 B5R0.5 CC(O)C(=N)N 2094AL [2,0,0,0,0,0|1,0,1]=4 87 B5R0.5 CC(O)C(=O)O Y1768 [2,0,0,0,0,0|1,0,0]=3 88 B5R0.5 C[C@H](N)C(N)=O 7048AH [2,0,0,0,0,0|1,0,0]=3 89 B5R0.5 O=C(O)C(=O)O 7001AF [2,0,0,0,0,0|1,0,1]=4 90 B5R0.5 O=C(O)C(Cl)Br 8168AB [2,0,0,0,0,0|2,0,0]=4 91 B5R0.5 O=C(O)C(F)Br 8446AJ [2,0,0,0,0,0|2,0,0]=4 92 B5R0.5 O=C(O)C(F)Cl 4068AE [2,0,0,0,0,0|2,0,0]=4 93 B7R0.2 C=CC(C)CC(=O)O 9796AA [1,1,0,0,0,0|1,0,0]=3 94 B7R0.2 CC(O)CC(=O)NN 8247AD [1,1,0,0,0,0|1,0,0]=3 95 B7R0.2 CCC(N)CC(=O)O 2363AL [1,1,0,0,0,0|1,0,0]=3 96 B7R0.2 CC[C@@H](N)CC(=O)O 9229AJ [1,1,0,0,0,0|1,0,0]=3 97 B7R0.2 CC[C@H](N)CC(=O)O 9250AJ [1,1,0,0,0,0|1,0,0]=3 98 B7R0.2 CNC(=O)CC(=O)O 3048AE [1,1,0,0,0,0|0,0,2]=4 99 B7R0.2 COC(C)CC(=O)O 0132AA [1,1,0,0,0,0|0,0,0]=2 100 B7R0.2 NCC(N)CC(=O)O 5843AA [1,1,0,0,0,0|1,0,0]=3 101 B7R0.9 CC(=O)CC(C)(C)N 7542AF [1,1,0,0,0,0|2,0,0]=4 102 B7R0.9 CC(C)(N)CC(=O)O W7151 [1,1,0,0,0,0|1,0,0]=3 103 B7R0.5 C=CCC(N)C(=O)O 7090AA [1,1,0,0,0,0|0,0,1]=3 104 B7R0.5 CCC[C@H](O)C(=O)O Z6053 [1,1,0,0,0,0|1,0,0]=3 105 B7R0.5 CCNC(C)C(N)=O 7697AD [1,1,0,0,0,0|2,0,0]=4 106 B7R0.5 CCSC(C)C(=O)O 6924AD [1,1,0,0,0,0|1,0,0]=3 107 B7R0.5 COCC(Cl)C(=O)O 2065AB [1,1,0,0,0,0|1,0,0]=3 108 B7R0.5 COCC(N)C(C)C 9904AH [1,1,0,0,0,0|1,0,1]=4 109 B7R0.5 N#CC[C@H](N)C(=O)O V6942 [1,1,0,0,0,0|0,0,1]=3 110 B7R0.5 NC(CCBr)C(=O)O 1883AC [1,1,0,0,0,0|0,0,0]=2 111 B7R0.5 NCCC(N)C(=O)O W7673 [1,1,0,0,0,0|0,0,0]=2 112 B7R0.5 NCC[C@@H](N)C(=O)O W5006 [1,1,0,0,0,0|0,0,0]=2 113 B7R0.5 NCC[C@H](N)C(=O)O 1360AC [1,1,0,0,0,0|0,0,0]=2 114 B7R0.10 CCC(=O)C(=O)OC W5987 [1,1,0,0,0,0|1,0,1]=4 115 B7R0.10 CCC(=O)C(O)CC 8871AL [1,1,0,0,0,0|2,0,0]=4 116 B7R0.10 CN[C@@H](C)C(=O)OC 0307AB [1,1,0,0,0,0|2,0,0]=4 117 B7R0.10 COC(=O)C(Cl)CO 0534AQ [1,1,0,0,0,0|1,0,0]=3 118 B7R0.10 COC(=O)C(F)CO 0323AC [1,1,0,0,0,0|1,0,0]=3 119 B7R0.10 COC(=O)C(N)CCl W5534 [1,1,0,0,0,0|1,0,0]=3 120 B7R0.10 COC(=O)C(O)CN 7006AJ [1,1,0,0,0,0|2,0,0]=4 121 B7R0.10 OC[C@H](O)[C@@H](O)CO 8162AL [1,1,0,0,0,0|1,0,1]=4 122 B7R0.13 CC(C)(CN)C(=O)O 9909AA [1,1,0,0,0,0|2,0,0]=4 123 B7R0.13 CCC(C)(N)C(=O)O V6829 [1,1,0,0,0,0|0,0,0]=2 124 B7R0.13 NCC(F)(F)C(=O)O 5777AJ [1,1,0,0,0,0|2,0,0]=4 125 B7R0.14 CC(C)(C)[C@H](N)CO X9000 [1,1,0,0,0,0|1,0,1]=4 126 B7R0.15 CCC(OC)C(=O)O 8292AB [1,1,0,0,0,0|1,0,0]=3 127 B7R0.15 CN[C@H](CO)C(=O)O 0556AP [1,1,0,0,0,0|0,0,0]=2 128 B9R0.10 CC(C)(C)C(N)CC(=O)O 0472AB [0,1,0,0,0,1|1,0,0]=3 129 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O 0594AP [0,1,0,0,0,1|1,0,0]=3 130 B9R0.23 CCC(C)C(N)CC(=O)O 2728AE [0,1,0,0,0,1|1,0,0]=3 131 B9R0.23 COC(=O)[C@H](N)CC(=O)O 5515AA [0,1,0,0,0,1|0,0,2]=4 132 B9R0.39 CC(C)CC(CN)C(=O)O 1792AL [0,1,0,0,0,1|1,0,0]=3 133 B9R0.39 CC(C)C[C@@H](CN)C(=O)O 0447AB [0,1,0,0,0,1|1,0,0]=3 134 B9R0.39 CC(C)C[C@H](CN)C(=O)O 0749AB [0,1,0,0,0,1|1,0,0]=3 135 B9R0.39 CC(C)C[C@H](CN)C(=O)O 5990AA [0,1,0,0,0,1|1,0,0]=3 136 B9R0.39 CNC(CC(=O)O)C(=O)O V5028 [0,1,0,0,0,1|1,0,1]=4 137 B9R0.57 CC(C)(C)CC(N)C(=O)O X5326 [0,1,0,0,0,1|1,0,0]=3 138 B9R0.57 NC(CC(F)(F)F)C(=O)O 2294AB [0,1,0,0,0,1|2,0,0]=4 139 B9R0.57 NC(CC(F)(F)F)C(=O)O 5061AD [0,1,0,0,0,1|2,0,0]=4 140 B9R0.79 CC(C(=O)O)C(N)C(=O)O 0243AC [0,1,0,0,0,1|1,0,1]=4 141 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O Z3806 [0,1,0,0,0,1|1,0,0]=3 142 B9R0.6 CCNC(=O)C(N)C(C)C 2776AD [0,2,0,0,0,0|2,0,0]=4 143 B9R0.6 CCOC(=O)C(Br)C(C)Br 7846AL [0,2,0,0,0,0|2,0,0]=4 144 B9R0.25 CNC(=O)[C@@H](N)C(C)(C)C 3788AH [0,2,0,0,0,0|2,0,0]=4 145 B9R0.25 COC(=O)[C@H](N)C(C)(C)C 9567AB [0,2,0,0,0,0|1,0,0]=3 146 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC 2134AB [0,2,0,0,0,0|1,0,0]=3 147 B9R0.27 COC(=O)C(N)C(=O)OC 7671AB [0,2,0,0,0,0|0,0,2]=4 148 B9R0.27 O=C[C@@H](O)[C@@H](O)[C@H](O)CO G491 [0,2,0,0,0,0|1,0,1]=4 149 B9R0.29 CN[C@H](C(=O)OC)[C@@H](C)O 0566AP [0,2,0,0,0,0|0,0,0]=2 150 B9R0.32 COC(C)(C)C(Br)C(=O)O 1051AQ [0,2,0,0,0,0|1,0,0]=3 151 B9R0.41 CCC(CC)C(N)C(=O)O 4313AD [0,2,0,0,0,0|1,0,0]=3 152 B9R0.33 CC(C)[C@H](N=[N+]=[N-])C(=O)O 0541AP [0,2,0,0,0,0|1,0,1]=4 153 B9R0.54 CC(C)C(C(=O)O)C(=O)O W7278 [0,2,0,0,0,0|2,0,0]=4 154 B9R0.54 CC(C)C(C(=O)O)N(C)N 6879AC [0,2,0,0,0,0|1,0,0]=3 155 B9R0.54 CC(C)[C@H](C(=O)O)N(C)C 8546AH [0,2,0,0,0,0|1,0,0]=3 156 B9R0.80 CC(C)(C)C(C)(N)C(=O)O V8732 [0,2,0,0,0,0|1,0,0]=3 157 B7R1.2 CC1=NOC(=O)C1 0252AQ [1,0,0,1,0,0|1,0,1]=4 158 B7R1.2 CC1CNC(=O)C1 X7991 [1,0,0,1,0,0|2,0,0]=4 159 B7R1.2 NC1CNC(=O)C1 9509AL [1,0,0,1,0,0|2,0,0]=4 160 B7R1.2 O=C1CCC(I)C1 3588AC [1,0,0,1,0,0|2,0,0]=4 161 B7R1.2 O=C1CCC(O)N1 W1140 [1,0,0,1,0,0|2,0,0]=4 162 B7R1.4 NC1COCC1O 5780AA [1,0,0,1,0,0|0,0,1]=3 163 B7R1.4 NC1COCC1O 7148AA [1,0,0,1,0,0|0,0,1]=3 164 B7R1.4 NC1CSCC1O 0027AD [1,0,0,1,0,0|0,1,1]=4 165 B7R1.4 NN1CCCC1=O 0452AB [1,0,0,1,0,0|2,0,0]=4 166 B7R1.4 N[C@@H]1COC[C@H]1O 8700AH [1,0,0,1,0,0|0,0,1]=3 167 B7R1.4 N[C@H]1CCC[C@@H]1O 5744AC [1,0,0,1,0,0|1,0,1]=4 168 B7R1.4 N[C@H]1CCNC1=O 8251AB [1,0,0,1,0,0|1,0,0]=3 169 B7R1.4 N[C@H]1COC[C@@H]1O 4688AJ [1,0,0,1,0,0|0,0,1]=3 170 B7R1.4 O=C1CCCC1Cl W7923 [1,0,0,1,0,0|2,0,0]=4 171 B7R1.4 O=C1NCC[C@H]1O W8410 [1,0,0,1,0,0|2,0,0]=4 172 B7R1.18 NC(=O)C1CCN1 Z9521 [1,0,0,1,0,0|1,0,0]=3 173 B7R1.18 O=C(O)C1CCN1 0741AC [1,0,0,1,0,0|0,0,0]=2 174 B7R1.18 O=C(O)C1CCO1 3540AC [1,0,0,1,0,0|1,0,0]=3 175 B7R1.22 NC(CO)C1CC1 X3745 [1,0,0,1,0,0|1,0,1]=4 176 B9R1.35 CC1NC(C(=O)O)CS1 2967AE [0,0,0,1,0,1|1,1,0]=4 177 B9R1.35 NC(=O)C1CC(F)CN1 5868AC [0,0,0,1,0,1|2,0,0]=4 178 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 3174AC [0,0,0,1,0,1|2,0,0]=4 179 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 4732AJ [0,0,0,1,0,1|1,0,0]=3 180 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 1629AC [0,0,0,1,0,1|2,0,0]=4 181 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 5891AB [0,0,0,1,0,1|2,0,0]=4 182 B9R1.35 NC1CNC(C(=O)O)C1 Y7723 [0,0,0,1,0,1|1,0,0]=3 183 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Y6730 [0,0,0,1,0,1|2,0,0]=4 184 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 W4980 [0,0,0,1,0,1|1,0,0]=3 185 B9R1.35 O=C(O)C1CCC(O)C1 0331AA [0,0,0,1,0,1|1,0,0]=3 186 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Z5831 [0,0,0,1,0,1|0,0,0]=2 187 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 U345 [0,0,0,1,0,1|1,0,0]=3 188 B9R1.35 O=C1CNC(C(=O)O)C1 0294AB [0,0,0,1,0,1|0,0,2]=4 189 B9R1.69 CC1CC(=O)CCC1O 4918AC [0,0,0,1,0,1|2,0,0]=4 190 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O 8555AH [0,1,0,1,0,0|0,0,0]=2 191 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O 8692AH [0,1,0,1,0,0|0,0,0]=2 192 B9R1.101 COC(=O)C(N)C1CC1 3819AJ [0,1,0,1,0,0|1,0,0]=3 193 B9R1.110 NC(C(=O)O)C1CCC1 X5232 [0,1,0,1,0,0|1,0,0]=3 194 B9R1.110 N[C@@H](C(=O)O)C1CCC1 X5301 [0,1,0,1,0,0|1,0,0]=3 195 B9R1.106 C[C@]1(O)C(=O)OC[C@H]1O 9656AA [0,1,0,1,0,0|1,0,0]=3 196 B9R1.165 CC(N)(C(=O)O)C1CC1 V8733 [0,1,0,1,0,0|1,0,0]=3 197 B9R1.165 CC(N)(C(=O)O)C1CC1 Y9504 [0,1,0,1,0,0|1,0,0]=3 198 B9R2.143 O=C(O)C1CC12CC2 8844AA [0,0,0,2,0,0|2,0,0]=4 199 B7R0.6 CC(=O)SCC(=O)O Y7206 [1,0,0,0,0,1|0,0,2]=4 200 B7R0.6 C[C@H](O)CC[C@H](C)O 4119AB [1,0,0,0,0,1|1,0,1]=4 201 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O 7119AH [0,0,0,0,0,2|0,0,2]=4 202 B9R0.7 CC(C)CC[C@H](N)C(=O)O 7177AH [0,0,0,0,0,2|1,0,0]=3 203 B9R0.7 C[S+](C)CCC(N)C(=O)O 7555AF [0,0,0,0,0,2|2,0,0]=4 204 B9R0.53 CC(C)C[C@@H](N)CC(=O)O 5270AC [0,0,0,0,0,2|1,0,0]=3 205 B9R0.53 CC(C)C[C@@H](N)CC(=O)O 5354AA [0,0,0,0,0,2|1,0,0]=3