0 B8R1.7 CC(=O)C1=CCCC1 2417-1-0J [0,0,0,0,0,0|2,0,1]=3 1 B8R1.7 CC(=O)C1CCCC1 2217-1-0X [0,0,0,0,0,0|2,0,0]=2 2 B8R1.7 CC(=O)C1CCNC1 4H17-5-3H [0,0,0,0,0,0|3,0,0]=3 3 B8R1.7 CC(C)C1CCCC1 1200-1-13 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.7 CC(C)C1CCCN1 3H31-5-Y8 [0,0,0,0,0,0|2,0,1]=3 5 B8R1.7 CC(C)[C@@H]1CCCN1 3H31-1-SJ [0,0,0,0,0,0|2,0,1]=3 6 B8R1.7 CC(C)[C@H]1CCCN1 3H31-1-RJ [0,0,0,0,0,0|2,0,1]=3 7 B8R1.7 FC(F)[C@@H]1CCCN1 3H31-7-S2 [0,0,0,0,0,0|2,0,1]=3 8 B8R1.7 N=C(N)C1CCCC1 3241-5-00 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.7 N=C(N)N1CCCC1 3H41-5-00 [0,0,0,0,0,0|4,0,0]=4 10 B8R1.7 N=C(N)N1CCCC1 3H41-9-02 [0,0,0,0,0,0|4,0,0]=4 11 B8R1.7 N=C(N)N1CCCC1 4H41-1-X3 [0,0,0,0,0,0|4,0,0]=4 12 B8R1.7 NC(=O)C1CC=CC1 4448-1-01 [0,0,0,0,0,0|2,0,2]=4 13 B8R1.7 NC(=O)C1CCNC1 4H48-5-72 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.7 NC(=O)C1CCOC1 4H48-1-AP [0,0,0,0,0,0|3,0,0]=3 15 B8R1.7 NC(=O)[C@@H]1CCNC1 4H48-5-R1 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.7 NC(=S)N1CCCC1 7H69-1-05 [0,0,0,0,0,0|3,1,0]=4 17 B8R1.7 O=C(O)C1C=CCN1 4H21-1-6F [0,0,0,0,0,0|0,0,2]=2 18 B8R1.7 O=C(O)C1CCCC1 2221-1-Y5 [0,0,0,0,0,0|1,0,0]=1 19 B8R1.7 O=C(O)C1CCCN1 4H58-1-010 [0,0,0,0,0,0|0,0,0]=0 20 B8R1.7 O=C(O)C1CCCO1 2H21-1-26 [0,0,0,0,0,0|1,0,0]=1 21 B8R1.7 O=C(O)[C@@H]1CCNC1 4H21-1-R5 [0,0,0,0,0,0|2,0,0]=2 22 B8R1.7 O=C(O)[C@@H]1CCOC1 2H21-1-R2 [0,0,0,0,0,0|2,0,0]=2 23 B8R1.7 O=[N+]([O-])C1CCCC1 4254-1-02 [0,0,0,0,0,0|2,0,1]=3 24 B8R1.7 OB(O)C1CCOC1 6H60-1-2R [0,0,0,0,0,0|3,0,1]=4 25 B8R1.7 [C@@H]1(C(=O)O)CCCN1 4H21-1-0P [0,0,0,0,0,0|0,0,0]=0 26 B7R1.1 BrCC1CCCO1 2H10-9-X0 [1,0,0,0,0,0|2,0,1]=4 27 B7R1.1 Br[Mg]C1CCCC1 9612-9-0H [1,0,0,0,0,0|3,0,0]=4 28 B7R1.1 Br[Mg]C1CCCC1 9612-9-0J [1,0,0,0,0,0|3,0,0]=4 29 B7R1.1 CCC1CCCC1 1200-1-15 [1,0,0,0,0,0|2,0,1]=4 30 B7R1.1 CCC1CCCN1 3H31-1-7G [1,0,0,0,0,0|1,0,1]=3 31 B7R1.1 ClCC1CCCO1 2H10-5-0F [1,0,0,0,0,0|2,0,1]=4 32 B7R1.1 Cl[Mg]C1CCCC1 9212-5-02 [1,0,0,0,0,0|3,0,0]=4 33 B7R1.1 Cl[Mg]C1CCCC1 9212-5-03 [1,0,0,0,0,0|3,0,0]=4 34 B7R1.1 N#CC1CCCN1 3H37-5-Y9 [1,0,0,0,0,0|1,0,1]=3 35 B7R1.1 N#C[C@@H]1CCCN1 4H37-3-S1 [1,0,0,0,0,0|1,0,1]=3 36 B7R1.1 N#C[C@@H]1CSCN1 7H37-5-05 [1,0,0,0,0,0|2,0,1]=4 37 B7R1.1 N#C[C@H]1CCCN1 3H37-1-R0 [1,0,0,0,0,0|1,0,1]=3 38 B7R1.1 N#C[C@H]1CCCN1 4H37-3-R1 [1,0,0,0,0,0|1,0,1]=3 39 B7R1.1 NCC1CCCC1 3230-1-0E [1,0,0,0,0,0|2,0,1]=4 40 B7R1.1 NCC1CCCC1 3233-5-00 [1,0,0,0,0,0|2,0,1]=4 41 B7R1.1 NCC1CCCO1 4H30-1-81 [1,0,0,0,0,0|2,0,1]=4 42 B7R1.1 NC[C@@H]1CCCN1 3H30-5-S1 [1,0,0,0,0,0|1,0,1]=3 43 B7R1.1 NC[C@H]1CCCO1 4H56-1-R44 [1,0,0,0,0,0|2,0,1]=4 44 B7R1.1 NNC1CCCC1 3239-1-00 [1,0,0,0,0,0|3,0,0]=4 45 B7R1.1 O=CC1=CCCC1 2415-1-03 [1,0,0,0,0,0|1,0,1]=3 46 B7R1.1 O=CC1CCCC1 2215-1-01 [1,0,0,0,0,0|1,0,0]=2 47 B7R1.1 O=CC1CCCO1 2H15-1-0Q [1,0,0,0,0,0|1,0,0]=2 48 B7R1.1 OCC1CCNC1 4H56-1-PB [1,0,0,0,0,0|2,0,1]=4 49 B7R1.1 OC[C@@H]1OCCS1 6H01-1-R0 [1,0,0,0,0,0|2,0,1]=4 50 B7R1.1 OC[C@H]1CCCO1 2H10-1-63 [1,0,0,0,0,0|1,0,1]=3 51 B7R1.1 OC[C@H]1CCNC1 4H56-1-S00 [1,0,0,0,0,0|2,0,1]=4 52 B7R1.1 ON=C1CCCC1 4247-1-03 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.11 CCC(C)C1CCCN1 3H31-1-DY [0,1,0,0,0,0|2,0,1]=4 54 B9R1.11 CNC(=O)C1CCCN1 4H48-5-G1 [0,1,0,0,0,0|1,0,0]=2 55 B9R1.11 COC(=O)C1=CCSC1 6H23-1-0W [0,1,0,0,0,0|2,0,1]=4 56 B9R1.11 COC(=O)C1CCCO1 2H23-1-0J [0,1,0,0,0,0|1,0,0]=2 57 B9R1.11 COC(=O)C1CCOC1 2H23-1-44 [0,1,0,0,0,0|2,0,0]=3 58 B9R1.11 COC(=O)N1CCCC1 4H56-1-DL [0,1,0,0,0,0|2,0,0]=3 59 B9R1.11 COC(=O)[C@@H]1CCNC1 4H22-3-02 [0,1,0,0,0,0|2,0,0]=3 60 B9R1.11 COC(=O)[C@@H]1CCNC1 4H57-5-R2 [0,1,0,0,0,0|2,0,0]=3 61 B9R1.11 COC(=O)[C@@H]1CCOC1 2H23-1-R1 [0,1,0,0,0,0|2,0,0]=3 62 B9R1.11 COC(=O)[C@H]1CCNC1 4H22-3-03 [0,1,0,0,0,0|2,0,0]=3 63 B9R1.11 COC(=O)[C@H]1CCNC1 4H57-5-S2 [0,1,0,0,0,0|2,0,0]=3 64 B9R1.19 CC(C)(C)C1CCCN1 3H33-5-1R [0,1,0,0,0,0|2,0,1]=4 65 B9R1.19 CC(C)(O)[C@@H]1CCCN1 4H56-1-S05 [0,1,0,0,0,0|1,0,1]=3 66 B9R1.19 FC(F)(F)[C@H]1CCCN1 3H31-3-X3 [0,1,0,0,0,0|2,0,1]=4 67 B9R1.35 CC(=O)C1CCC(=O)O1 2H25-1-36 [0,1,0,0,0,0|2,0,1]=4 68 B9R1.35 CC(=O)N1CC[C@@H](O)C1 4H56-1-PC [0,1,0,0,0,0|3,0,0]=4 69 B9R1.35 CC1NC(C(=O)O)CS1 8H21-1-72 [0,1,0,0,0,0|1,0,0]=2 70 B9R1.35 CN1CCC(C(=O)O)C1 4H21-5-0C [0,1,0,0,0,0|2,0,0]=3 71 B9R1.35 CN1CC[C@@H](C(=O)O)C1 4H58-5-3S [0,1,0,0,0,0|2,0,0]=3 72 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 4H21-1-S3 [0,1,0,0,0,0|0,0,0]=1 73 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 4H21-5-0M [0,1,0,0,0,0|0,0,0]=1 74 B9R1.35 NC(=O)C1CC(O)CN1 4H48-1-NP [0,1,0,0,0,0|1,0,0]=2 75 B9R1.35 NC1CCC(C(=O)O)C1 4257-5-04 [0,1,0,0,0,0|1,0,0]=2 76 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 4H57-5-X2 [0,1,0,0,0,0|0,0,0]=1 77 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 4H58-1-JN [0,1,0,0,0,0|0,0,0]=1 78 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 4257-1-09 [0,1,0,0,0,0|1,0,0]=2 79 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 4H21-3-24 [0,1,0,0,0,0|0,0,0]=1 80 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 4H56-7-63 [0,1,0,0,0,0|0,0,0]=1 81 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 4H58-3-X7 [0,1,0,0,0,0|0,0,0]=1 82 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 4H58-5-4C [0,1,0,0,0,0|0,0,0]=1 83 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 4H58-3-X5 [0,1,0,0,0,0|0,0,0]=1 84 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 4H29-1-26 [0,1,0,0,0,0|0,0,0]=1 85 B9R1.35 O=C1CCC(C(=O)O)C1 2229-1-06 [0,1,0,0,0,0|1,0,1]=3 86 B9R1.35 O=C1CCC(C(=O)O)N1 4H58-1-009 [0,1,0,0,0,0|0,0,1]=2 87 B9R1.35 O=C1CN[C@H](C(=O)O)C1 4H33-9-0A [0,1,0,0,0,0|0,0,1]=2 88 B9R1.35 O=C1NC(C(=O)O)CO1 4H58-1-346 [0,1,0,0,0,0|1,0,1]=3 89 B9R1.35 O=C1NCC(C(=O)O)N1 4H29-1-1Q [0,1,0,0,0,0|1,0,1]=3 90 B9R1.35 O=C1N[C@@H](C(=O)O)CO1 4H58-1-R15 [0,1,0,0,0,0|1,0,1]=3 91 B9R1.35 O=C1N[C@H](C(=O)O)CO1 4H58-1-S15 [0,1,0,0,0,0|1,0,1]=3 92 B9R1.41 CC1CNCC1C(=O)O 4H58-1-044 [0,1,0,0,0,0|2,0,0]=3 93 B9R1.41 CN1CCCC1C(=O)O 4H21-1-FK [0,1,0,0,0,0|0,0,0]=1 94 B9R1.41 NN1CCC[C@@H]1C(=O)O 4H57-1-28 [0,1,0,0,0,0|0,0,0]=1 95 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O 4257-5-09 [0,1,0,0,0,0|1,0,0]=2 96 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O 4257-5-08 [0,1,0,0,0,0|1,0,0]=2 97 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O 4257-5-10 [0,1,0,0,0,0|1,0,0]=2 98 B9R1.163 CC(=O)C1(O)CCCC1 2217-1-1M [0,1,0,0,0,0|2,0,0]=3 99 B9R1.163 CC1(C(=O)O)CCCO1 2H21-1-0R [0,1,0,0,0,0|1,0,0]=2 100 B9R1.163 C[C@@]1(C(=O)O)CCCN1 4H57-1-06 [0,1,0,0,0,0|0,0,0]=1 101 B9R1.163 C[C@]1(C(=O)O)CCCN1 4H21-1-TA [0,1,0,0,0,0|0,0,0]=1 102 B9R1.163 NC1(C(=O)O)CCCC1 4257-1-04 [0,1,0,0,0,0|1,0,0]=2 103 B9R1.163 NC1(C(=O)O)CCOC1 4H57-1-05 [0,1,0,0,0,0|2,0,0]=3 104 B9R1.163 N[C@]1(C(=O)O)CCNC1 4H57-5-08 [0,1,0,0,0,0|2,0,0]=3 105 B9R1.163 O=C(O)C1(F)CCCC1 2221-3-0C [0,1,0,0,0,0|1,0,0]=2 106 B9R1.163 O=C(O)C1(O)CCCC1 2229-1-0X [0,1,0,0,0,0|1,0,0]=2 107 B7R0.4 C=C(Br)CCCCC 1300-9-09 [0,0,1,0,0,0|3,0,0]=4 108 B7R0.4 C=C(C)CCCCC 1300-1-36 [0,0,1,0,0,0|3,0,0]=4 109 B7R0.4 C=C(Cl)CCCCC 1300-5-27 [0,0,1,0,0,0|3,0,0]=4 110 B7R0.4 C=CCCCC(=O)O 2321-1-0P [0,0,1,0,0,0|1,0,1]=3 111 B7R0.4 CC(=O)CCCC#N 4137-1-0V [0,0,1,0,0,0|1,0,2]=4 112 B7R0.4 CC(=O)CCCCCl 2117-5-05 [0,0,1,0,0,0|2,0,0]=3 113 B7R0.4 CC(=O)COCCBr 2117-9-07 [0,0,1,0,0,0|3,0,0]=4 114 B7R0.4 CC(=O)COCCCl 2117-5-0B [0,0,1,0,0,0|3,0,0]=4 115 B7R0.4 CC(=O)NCCCN 4148-5-0D [0,0,1,0,0,0|2,0,0]=3 116 B7R0.4 CC(=O)NCCCO 4156-1-Y9 [0,0,1,0,0,0|3,0,0]=4 117 B7R0.4 CC(=O)OCCCCl 2123-5-0U [0,0,1,0,0,0|3,0,0]=4 118 B7R0.4 CC(=O)OCCCF 2123-3-1D [0,0,1,0,0,0|3,0,0]=4 119 B7R0.4 CCCCCC(C)=O 2117-1-14 [0,0,1,0,0,0|2,0,0]=3 120 B7R0.4 CCCCCC(C)O 2102-1-05 [0,0,1,0,0,0|2,0,1]=4 121 B7R0.4 CCCCCC(N)=O 4148-1-1F [0,0,1,0,0,0|2,0,0]=3 122 B7R0.4 CCCCOC(=O)Cl 2116-5-31 [0,0,1,0,0,0|3,0,0]=4 123 B7R0.4 CCCCOC(N)=O 4156-1-2H [0,0,1,0,0,0|3,0,0]=4 124 B7R0.4 CCCCSC(C)=O 6166-1-0F [0,0,1,0,0,0|3,0,0]=4 125 B7R0.4 CCCOCC(=O)O 2121-1-0F [0,0,1,0,0,0|1,0,0]=2 126 B7R0.4 CCC\C=C\C(C)=O 2317-1-0B [0,0,1,0,0,0|2,0,1]=4 127 B7R0.4 CCOCCC(=O)O 2121-1-0E [0,0,1,0,0,0|2,0,0]=3 128 B7R0.4 CN(C)CCCCN 3132-1-00 [0,0,1,0,0,0|3,0,0]=4 129 B7R0.4 COCCCC(=O)O 2121-1-51 [0,0,1,0,0,0|2,0,0]=3 130 B7R0.4 C\C=C\CCC(=O)O 2321-1-X1 [0,0,1,0,0,0|1,0,2]=4 131 B7R0.4 N#CCCCC(=O)O 4137-1-0M [0,0,1,0,0,0|0,0,2]=3 132 B7R0.4 NCCCCC(=O)O 4157-1-22 [0,0,1,0,0,0|0,0,0]=1 133 B7R0.4 NOCCCC(=O)O 4147-9-01 [0,0,1,0,0,0|1,0,0]=2 134 B7R0.4 O=C(Cl)CCCCBr 2116-D-X0 [0,0,1,0,0,0|2,0,0]=3 135 B7R0.4 O=C(Cl)OCCCCl 2123-5-0S [0,0,1,0,0,0|3,0,0]=4 136 B7R0.4 O=C(O)CCCCCl 2121-5-05 [0,0,1,0,0,0|1,0,0]=2 137 B7R0.4 O=C(O)COCCCl 2121-5-01 [0,0,1,0,0,0|2,0,0]=3 138 B7R0.4 O=C([O-])CCCCO 2129-1-1E [0,0,1,0,0,0|1,0,1]=3 139 B7R0.5 C#CCC(N)C(=O)O 4557-1-01 [0,0,1,0,0,0|0,0,2]=3 140 B7R0.5 C#CC[C@@H](N)C(=O)O 4557-1-R3 [0,0,1,0,0,0|0,0,2]=3 141 B7R0.5 C#CC[C@H](N)C(=O)O 4557-1-S3 [0,0,1,0,0,0|0,0,2]=3 142 B7R0.5 C=CC[C@@H](N)C(=O)O 4357-1-01 [0,0,1,0,0,0|0,0,2]=3 143 B7R0.5 CCCC(Br)C(=O)O 2121-9-0C [0,0,1,0,0,0|1,0,0]=2 144 B7R0.5 CCCC(C)C(=O)O 2121-1-0R [0,0,1,0,0,0|1,0,0]=2 145 B7R0.5 CCC[C@@H](N)C(=O)O 4157-1-RA [0,0,1,0,0,0|0,0,0]=1 146 B7R0.5 CC\C=C(/C)C(=O)O 2321-1-0R [0,0,1,0,0,0|1,0,1]=3 147 B7R0.5 CNCC(N)C(=O)O 4157-5-00 [0,0,1,0,0,0|1,0,0]=2 148 B7R0.5 CNC[C@H](N)C(=O)O 4157-1-SK [0,0,1,0,0,0|1,0,0]=2 149 B7R0.5 COCC(N)C(=O)O 4157-1-18 [0,0,1,0,0,0|1,0,0]=2 150 B7R0.5 COC[C@@H](N)C(=O)O 4157-5-R0 [0,0,1,0,0,0|1,0,0]=2 151 B7R0.5 COC[C@H](N)C(=O)O 4157-1-S3 [0,0,1,0,0,0|1,0,0]=2 152 B7R0.5 NC(CCO)C(=O)O 4157-1-0D [0,0,1,0,0,0|1,0,0]=2 153 B7R0.5 NCCC(N)C(=O)O 4157-5-04 [0,0,1,0,0,0|1,0,0]=2 154 B7R0.5 NCC[C@@H](F)C(=O)O 4157-3-R0 [0,0,1,0,0,0|2,0,0]=3 155 B7R0.5 NCC[C@H](F)C(=O)O 4157-3-S0 [0,0,1,0,0,0|2,0,0]=3 156 B7R0.5 NCC[C@H](N)C(=O)O 4157-1-SG [0,0,1,0,0,0|1,0,0]=2 157 B7R0.5 O=C(Br)C(Br)CCBr 2116-9-00 [0,0,1,0,0,0|3,0,0]=4 158 B7R0.15 CCN(CC)C(C)=O 4148-1-0J [0,0,1,0,0,0|3,0,0]=4 159 B7R0.15 CCN(CC)C(N)=O 4153-1-0C [0,0,1,0,0,0|3,0,0]=4 160 B7R0.15 CNC(CS)C(=O)O 8161-5-02 [0,0,1,0,0,0|1,0,0]=2 161 B7R0.15 CN[C@@H](CO)C(=O)O 4157-1-59 [0,0,1,0,0,0|1,0,0]=2 162 B7R0.15 N#CC(CN)C(=O)O 4158-1-37 [0,0,1,0,0,0|3,0,0]=4 163 B7R0.15 O=C(O)C(CBr)CBr 2121-9-X9 [0,0,1,0,0,0|3,0,0]=4 164 B9R2.39 O=C1CC2CCC1C2 2217-1-39 [0,0,0,1,0,0|2,0,0]=3 165 B9R2.39 O=C1NC2CCC1C2 4H48-1-CD [0,0,0,1,0,0|2,0,0]=3 166 B9R2.39 O=C1OC2CCC1C2 2H25-1-2A [0,0,0,1,0,0|1,0,0]=2 167 B9R2.39 OC1CC2CCC1C2 2202-1-07 [0,0,0,1,0,0|2,0,1]=4 168 B9R2.39 OC1CC2CCC1O2 2H10-1-24 [0,0,0,1,0,0|2,0,1]=4 169 B9R2.39 [C@H]12CC[C@@H](C1)[C@H](O)C2 2202-1-1B [0,0,0,1,0,0|2,0,1]=4 170 B7R1.18 CC(=O)C1CCC1 2217-1-0N [0,0,0,0,1,0|1,0,0]=2 171 B7R1.18 CC(=O)N1CCC1 4H48-1-35 [0,0,0,0,1,0|2,0,0]=3 172 B7R1.18 CC(O)C1CCC1 2202-1-0Y [0,0,0,0,1,0|1,0,1]=3 173 B7R1.18 NC(=O)C1CCC1 4248-1-0H [0,0,0,0,1,0|1,0,0]=2 174 B7R1.18 NC(=O)C1CNC1 4H48-1-BC [0,0,0,0,1,0|2,0,0]=3 175 B7R1.18 NC(=O)C1CNC1 4H48-5-7Z [0,0,0,0,1,0|2,0,0]=3 176 B7R1.18 O=C(O)C1CCC1 2221-1-10 [0,0,0,0,1,0|0,0,0]=1 177 B7R1.18 O=C(O)C1CCN1 4H57-1-98 [0,0,0,0,1,0|0,0,0]=1 178 B7R1.18 O=C(O)C1COC1 2H21-1-66 [0,0,0,0,1,0|1,0,0]=2 179 B7R1.18 O=C(O)[C@@H]1CCN1 4H57-1-29 [0,0,0,0,1,0|0,0,0]=1 180 B7R1.18 OB(O)C1CCC1 6260-1-02 [0,0,0,0,1,0|1,0,1]=3 181 B9R1.6 CC(=O)C1=CNCCC1 4H17-1-2M [0,0,0,0,0,1|1,0,1]=3 182 B9R1.6 CC(=O)C1CCCCC1 2217-1-X2 [0,0,0,0,0,1|2,0,0]=3 183 B9R1.6 CC(=O)C1CCCCN1 4H17-1-9U [0,0,0,0,0,1|1,0,0]=2 184 B9R1.6 CC(=O)C1CCCNC1 4H17-5-3L [0,0,0,0,0,1|1,0,0]=2 185 B9R1.6 CC(=O)C1CCNCC1 4H17-5-3M [0,0,0,0,0,1|2,0,0]=3 186 B9R1.6 CC(=O)N1CCCCC1 4H48-1-0A1 [0,0,0,0,0,1|3,0,0]=4 187 B9R1.6 CC(=O)N1CCOCC1 4H48-1-JK [0,0,0,0,0,1|3,0,0]=4 188 B9R1.6 CC(C)C1CCCCN1 3H33-5-1T [0,0,0,0,0,1|2,0,1]=4 189 B9R1.6 CC(C)C1CNCCN1 3H31-1-BP [0,0,0,0,0,1|2,0,1]=4 190 B9R1.6 CC(C)[C@@H]1COCCN1 4H56-1-R52 [0,0,0,0,0,1|2,0,1]=4 191 B9R1.6 CC(C)[C@H]1CNCCN1 3H31-5-X1 [0,0,0,0,0,1|2,0,1]=4 192 B9R1.6 CC(C)[C@H]1COCCN1 4H56-1-S52 [0,0,0,0,0,1|2,0,1]=4 193 B9R1.6 CC(O)C1CCNCC1 4H02-1-0J [0,0,0,0,0,1|2,0,1]=4 194 B9R1.6 FC(F)C1CCCNC1 3H31-7-0K [0,0,0,0,0,1|2,0,1]=4 195 B9R1.6 N=C(N)C1CCCCC1 3241-5-03 [0,0,0,0,0,1|3,0,0]=4 196 B9R1.6 N=C(N)C1CCOCC1 4H41-1-04 [0,0,0,0,0,1|3,0,0]=4 197 B9R1.6 N=C(N)C1CCOCC1 4H41-5-00 [0,0,0,0,0,1|3,0,0]=4 198 B9R1.6 NC(=O)C1=CNCCC1 4H48-1-6Q [0,0,0,0,0,1|1,0,1]=3 199 B9R1.6 NC(=O)C1CCCCC1 4248-1-X2 [0,0,0,0,0,1|2,0,0]=3 200 B9R1.6 NC(=O)C1CCCCN1 4H48-1-01R [0,0,0,0,0,1|1,0,0]=2 201 B9R1.6 NC(=O)[C@@H]1CCCNC1 4H48-1-8A [0,0,0,0,0,1|1,0,0]=2 202 B9R1.6 NC(=O)[C@@H]1CCCNC1 4H48-5-R0 [0,0,0,0,0,1|1,0,0]=2 203 B9R1.6 NC(=O)[C@H]1CCCNC1 4H48-1-9A [0,0,0,0,0,1|1,0,0]=2 204 B9R1.6 NC(=O)[C@H]1CCCNC1 4H48-5-64 [0,0,0,0,0,1|1,0,0]=2 205 B9R1.6 NC(=S)C1CCOCC1 8H67-1-Y4 [0,0,0,0,0,1|2,1,0]=4 206 B9R1.6 O=C(Cl)C1CC=CCC1 2416-5-00 [0,0,0,0,0,1|2,0,1]=4 207 B9R1.6 O=C(Cl)C1CCCCO1 2H16-5-18 [0,0,0,0,0,1|2,0,0]=3 208 B9R1.6 O=C(Cl)N1CCCCC1 4H16-5-0S [0,0,0,0,0,1|3,0,0]=4 209 B9R1.6 O=C(Cl)N1CCOCC1 4H16-5-28 [0,0,0,0,0,1|3,0,0]=4 210 B9R1.6 O=C(O)C1=CCCCO1 2H21-1-0W [0,0,0,0,0,1|1,0,1]=3 211 B9R1.6 O=C(O)C1CCC=CO1 2H21-1-17 [0,0,0,0,0,1|1,0,1]=3 212 B9R1.6 O=C(O)C1CCCCC1 2221-1-22 [0,0,0,0,0,1|1,0,0]=2 213 B9R1.6 O=C(O)C1CCCCO1 2H21-1-0Y [0,0,0,0,0,1|1,0,0]=2 214 B9R1.6 O=C(O)C1CCCNC1 4H57-1-W6 [0,0,0,0,0,1|0,0,0]=1 215 B9R1.6 O=C(O)C1CCCSC1 6H66-1-41 [0,0,0,0,0,1|1,0,0]=2 216 B9R1.6 O=C(O)C1CCNCC1 4H21-5-66 [0,0,0,0,0,1|1,0,0]=2 217 B9R1.6 O=C(O)C1CCSCC1 6H21-1-Y0 [0,0,0,0,0,1|1,0,0]=2 218 B9R1.6 O=C(O)C1CNCCN1 4H57-1-27 [0,0,0,0,0,1|0,0,0]=1 219 B9R1.6 O=C(O)C1CNCCN1 4H57-5-05 [0,0,0,0,0,1|0,0,0]=1 220 B9R1.6 O=C(O)C1CNCCO1 4H58-1-011 [0,0,0,0,0,1|1,0,0]=2 221 B9R1.6 O=C(O)C1CSCCN1 8H21-5-01 [0,0,0,0,0,1|0,0,0]=1 222 B9R1.6 O=C(O)[C@@H]1CCCCN1 4H58-1-SE [0,0,0,0,0,1|0,0,0]=1 223 B9R1.6 O=C(O)[C@@H]1CNCCO1 4H58-5-SA [0,0,0,0,0,1|1,0,0]=2 224 B9R1.6 O=C(O)[C@@H]1COCCN1 4H56-1-S55 [0,0,0,0,0,1|0,0,0]=1 225 B9R1.6 O=C(O)[C@@H]1COCCN1 4H58-5-S9 [0,0,0,0,0,1|0,0,0]=1 226 B9R1.6 O=C(O)[C@H]1CCCNC1 4H57-1-S1 [0,0,0,0,0,1|0,0,0]=1 227 B9R1.6 O=C(O)[C@H]1CNCCN1 4H57-1-R3 [0,0,0,0,0,1|0,0,0]=1 228 B9R1.6 O=C(O)[C@H]1COCCN1 4H21-1-29 [0,0,0,0,0,1|0,0,0]=1 229 B9R1.13 CC(=O)NC1CCCC1 4248-1-0F [0,0,0,0,0,1|2,0,0]=3 230 B9R1.13 CC(=O)N[C@@H]1CCNC1 4H48-1-R3 [0,0,0,0,0,1|3,0,0]=4 231 B9R1.13 CC(=O)N[C@H]1CCNC1 4H48-1-S4 [0,0,0,0,0,1|3,0,0]=4 232 B9R1.13 CN(C)C[C@@H]1CCCN1 3H31-5-S0 [0,0,0,0,0,1|3,0,0]=4 233 B9R1.13 NC(=O)CN1CCCC1 4H48-1-030 [0,0,0,0,0,1|3,0,0]=4 234 B9R1.13 NC(=S)NC1CCCC1 7167-1-31 [0,0,0,0,0,1|2,1,0]=4 235 B9R1.13 O=C(O)C=C1CCCC1 2221-1-1B [0,0,0,0,0,1|1,0,1]=3 236 B9R1.13 O=C(O)CC1CCCO1 2H21-1-0B [0,0,0,0,0,1|1,0,0]=2 237 B9R1.13 O=C(O)CC1CCNC1 4H21-1-W3 [0,0,0,0,0,1|2,0,0]=3 238 B9R1.13 O=C(O)CC1CCNC1 4H58-1-H4 [0,0,0,0,0,1|2,0,0]=3 239 B9R1.13 O=C(O)CC1CCOC1 2H21-1-59 [0,0,0,0,0,1|2,0,0]=3 240 B6R0.4 C=C(Br)CCCC 1300-9-19 [1,0,1,0,0,0|2,0,0]=4 241 B6R0.4 C=CCCC(=O)O 2321-1-0D [1,0,1,0,0,0|0,0,2]=4 242 B6R0.4 CC(=O)CCCBr 2117-9-0A [1,0,1,0,0,0|2,0,0]=4 243 B6R0.4 CCCCC(=N)N 3141-1-03 [1,0,1,0,0,0|2,0,0]=4 244 B6R0.4 CCCCC(=O)Br 2116-9-0A [1,0,1,0,0,0|1,0,0]=3 245 B6R0.4 CCCCC(C)=O 2117-1-11 [1,0,1,0,0,0|1,0,0]=3 246 B6R0.4 CCCCC(C)O 2102-1-07 [1,0,1,0,0,0|1,0,1]=4 247 B6R0.4 CCCCC(N)=O 4148-1-0P [1,0,1,0,0,0|1,0,0]=3 248 B6R0.4 CCCC[C@H](C)O 2102-1-S0 [1,0,1,0,0,0|1,0,1]=4 249 B6R0.4 CCCNC(N)=O 4153-1-00 [1,0,1,0,0,0|1,0,0]=3 250 B6R0.4 CCCOC(=O)Cl 2116-5-30 [1,0,1,0,0,0|2,0,0]=4 251 B6R0.4 CCCOC(N)=O 4156-1-2G [1,0,1,0,0,0|2,0,0]=4 252 B6R0.4 CCCSC(C)=O 6166-1-0A [1,0,1,0,0,0|2,0,0]=4 253 B6R0.4 CCNCC(=O)O 4158-1-76 [1,0,1,0,0,0|0,0,0]=2 254 B6R0.4 CCOCC(=O)O 2121-1-20 [1,0,1,0,0,0|1,0,0]=3 255 B6R0.4 CC\C=C\C(=O)O 2321-1-X5 [1,0,1,0,0,0|0,0,2]=4 256 B6R0.4 CNCCC(=O)O 4157-1-11 [1,0,1,0,0,0|1,0,0]=3 257 B6R0.4 COCCC(=O)Cl 2116-5-0C [1,0,1,0,0,0|2,0,0]=4 258 B6R0.4 COCCC(=O)O 2123-1-63 [1,0,1,0,0,0|1,0,0]=3 259 B6R0.4 CSCCC(=O)Cl 6166-5-01 [1,0,1,0,0,0|2,0,0]=4 260 B6R0.4 CSCCC(C)=O 6166-1-0J [1,0,1,0,0,0|2,0,0]=4 261 B6R0.4 N#CCCC(=O)O 4137-1-00 [1,0,1,0,0,0|0,0,2]=4 262 B6R0.4 O=C(Cl)CCCBr 2116-D-01 [1,0,1,0,0,0|2,0,0]=4 263 B6R0.4 O=C(O)CCCBr 2121-9-05 [1,0,1,0,0,0|1,0,0]=3 264 B6R0.4 O=C([O-])CNCO 4158-1-62 [1,0,1,0,0,0|1,0,1]=4 265 B6R0.6 C#CCCCCN 3530-1-03 [1,0,1,0,0,0|1,0,1]=4 266 B6R0.6 C=CCCCCC 1300-1-X2 [1,0,1,0,0,0|2,0,0]=4 267 B6R0.6 C=CCCCCCl 1300-5-14 [1,0,1,0,0,0|2,0,0]=4 268 B6R0.6 CCCCCCN 3130-1-07 [1,0,1,0,0,0|1,0,1]=4 269 B6R0.6 CCCNCCC 3131-1-18 [1,0,1,0,0,0|1,0,1]=4 270 B6R0.6 CCCNCCO 4131-1-02 [1,0,1,0,0,0|0,0,1]=3 271 B6R0.6 CCC\C=C\C=O 2315-1-08 [1,0,1,0,0,0|1,0,1]=4 272 B6R0.6 N#CCCCCN 3137-5-05 [1,0,1,0,0,0|1,0,1]=4 273 B6R0.6 NCCCCCO 4156-1-0A [1,0,1,0,0,0|0,0,1]=3 274 B6R0.6 NCCSCCO 8166-1-13 [1,0,1,0,0,0|1,0,1]=4 275 B6R0.6 O=CCCCC=O 2115-1-07 [1,0,1,0,0,0|1,0,1]=4 276 B6R0.6 O=CCCCCCl 2115-5-00 [1,0,1,0,0,0|1,0,0]=3 277 B6R0.6 O=CCCCCO 2120-1-05 [1,0,1,0,0,0|1,0,0]=3 278 B6R0.6 O=COCCCCl 2123-5-0V [1,0,1,0,0,0|2,0,0]=4 279 B6R0.6 O=COCCCF 2123-3-1F [1,0,1,0,0,0|2,0,0]=4 280 B6R0.6 OCCCCCO 2104-1-0B [1,0,1,0,0,0|1,0,1]=4 281 B6R0.1 CCCC(C)C=O 2115-1-12 [1,0,1,0,0,0|1,0,0]=3 282 B6R0.1 CCCC(N)C#N 3137-5-03 [1,0,1,0,0,0|1,0,1]=4 283 B6R0.1 CCC[C@@H](N)CO 4156-1-72 [1,0,1,0,0,0|0,0,1]=3 284 B6R0.1 CCC[C@H](N)CO 4156-1-70 [1,0,1,0,0,0|0,0,1]=3 285 B6R0.3 C=C(Br)C(C)CC 1300-9-17 [1,0,1,0,0,0|2,0,0]=4 286 B6R0.3 CC(CBr)C(=O)O 2121-9-0A [1,0,1,0,0,0|1,0,0]=3 287 B6R0.3 CC(CS)C(=O)O 6261-1-00 [1,0,1,0,0,0|1,0,0]=3 288 B6R0.3 CCC(Br)C(=O)Br 2116-9-09 [1,0,1,0,0,0|2,0,0]=4 289 B6R0.3 CCC(Br)C(=O)Cl 2116-D-02 [1,0,1,0,0,0|2,0,0]=4 290 B6R0.3 CCC(Br)C(=O)O 2121-9-15 [1,0,1,0,0,0|1,0,0]=3 291 B6R0.3 CCC(C)B(O)O 6160-1-05 [1,0,1,0,0,0|1,0,1]=4 292 B6R0.3 CCC(O)C(=O)O 2129-1-1J [1,0,1,0,0,0|1,0,0]=3 293 B6R0.3 CCC(S)C(C)=O 6161-1-00 [1,0,1,0,0,0|2,0,0]=4 294 B6R0.3 CC[C@@H](Cl)C(=O)O 2121-5-R0 [1,0,1,0,0,0|1,0,0]=3 295 B6R0.3 CC[C@@H](O)C(=O)O 2129-1-RF [1,0,1,0,0,0|1,0,0]=3 296 B6R0.3 CC[C@H](C)C(=O)O 2121-1-S0 [1,0,1,0,0,0|0,0,0]=2 297 B6R0.3 CC[C@H](Cl)C(=O)O 2121-5-S0 [1,0,1,0,0,0|1,0,0]=3 298 B6R0.3 CC[C@H](N)C(N)=O 4148-5-S0 [1,0,1,0,0,0|1,0,0]=3 299 B6R0.3 CNC(C)C(=O)O 4157-1-0A [1,0,1,0,0,0|0,0,0]=2 300 B6R0.3 CO[C@@H](C)C(=O)O 2121-1-S1 [1,0,1,0,0,0|1,0,0]=3 301 B6R0.3 CO[C@H](C)C(=O)O 2121-1-R1 [1,0,1,0,0,0|1,0,0]=3 302 B6R0.3 NC(CS)C(=O)O 8161-5-00 [1,0,1,0,0,0|1,0,0]=3 303 B6R0.3 NCC(N)C(=O)O 4157-1-27 [1,0,1,0,0,0|1,0,0]=3 304 B6R0.3 NCC(N)C(=O)O 4157-5-02 [1,0,1,0,0,0|1,0,0]=3 305 B6R0.3 NCC(O)C(=O)O 4157-1-47 [1,0,1,0,0,0|2,0,0]=4 306 B6R0.3 NC[C@@H](N)C(=O)O 4157-5-R5 [1,0,1,0,0,0|1,0,0]=3 307 B6R0.3 NC[C@H](N)C(=O)O 4157-5-S5 [1,0,1,0,0,0|1,0,0]=3 308 B6R0.3 NC[C@H](O)C(=O)O 4156-1-SR [1,0,1,0,0,0|2,0,0]=4 309 B6R0.3 N[C@@H](CCl)C(=O)O 4157-5-R3 [1,0,1,0,0,0|1,0,0]=3 310 B6R0.3 N[C@@H](CS)C(=O)O 8161-5-R2 [1,0,1,0,0,0|1,0,0]=3 311 B6R0.3 N[C@H](CS)C(=O)O 8161-5-S2 [1,0,1,0,0,0|1,0,0]=3 312 B6R0.3 O=C(O)C(Br)CBr 2121-9-06 [1,0,1,0,0,0|2,0,0]=4 313 B6R0.3 O=C(O)C(F)CF 2121-3-1P [1,0,1,0,0,0|2,0,0]=4 314 B6R0.9 CCC(C=O)CC 2115-1-0D [1,0,1,0,0,0|1,0,0]=3 315 B6R0.9 CCC(CC)CO 2101-1-0C [1,0,1,0,0,0|1,0,1]=4 316 B6R0.9 CCC(CC)NC 3131-1-0G [1,0,1,0,0,0|1,0,1]=4 317 B6R0.9 CCC(CO)OC 2107-1-0G [1,0,1,0,0,0|1,0,1]=4 318 B6R1.2 CC1CCCN1 3H31-1-46 [2,0,0,0,0,0|0,0,1]=3 319 B6R1.2 CC1CCCN1 3H33-5-32 [2,0,0,0,0,0|0,0,1]=3 320 B6R1.2 CC1NCCS1 7H70-1-1N [2,0,0,0,0,0|1,0,1]=4 321 B6R1.2 C[C@@H]1CCCN1 3H31-1-X0 [2,0,0,0,0,0|0,0,1]=3 322 B6R1.2 FC1CCCC1 1200-3-10 [2,0,0,0,0,0|2,0,0]=4 323 B6R1.2 IC1CCCC1 1200-H-00 [2,0,0,0,0,0|2,0,0]=4 324 B6R1.2 NC1CCCC1 3230-1-04 [2,0,0,0,0,0|2,0,0]=4 325 B6R1.2 O=C1NCCO1 4H56-1-03K [2,0,0,0,0,0|1,0,1]=4 326 B6R1.2 O=S1CCCC1 6267-1-00 [2,0,0,0,0,0|2,0,0]=4 327 B8R0.5 CCC\C(C)=C\C(=O)O 2321-1-21 [0,1,1,0,0,0|1,0,1]=4 328 B8R0.6 C=CCCCC(=O)OC 2324-1-0B [0,1,1,0,0,0|1,0,1]=4 329 B8R0.6 CCCCCC(=O)OC 2123-1-90 [0,1,1,0,0,0|1,0,0]=3 330 B8R0.6 CCC\C=C\C(=O)OC 2323-1-0D [0,1,1,0,0,0|1,0,1]=4 331 B8R0.6 CCNCCC(=O)OC 4158-1-0D [0,1,1,0,0,0|2,0,0]=4 332 B8R0.6 COC(=O)CCCC#N 4137-1-0F [0,1,1,0,0,0|0,0,2]=4 333 B8R0.6 COC(=O)CCCCBr 2123-9-14 [0,1,1,0,0,0|1,0,0]=3 334 B8R0.6 COC(=O)CCCCCl 2123-5-1C [0,1,1,0,0,0|1,0,0]=3 335 B8R0.6 COC(=O)CCCCN 4158-5-0A [0,1,1,0,0,0|0,0,0]=2 336 B8R0.6 COC(=O)COCCBr 2123-9-0B [0,1,1,0,0,0|2,0,0]=4 337 B8R0.6 COC(=O)COCCCl 2123-5-0H [0,1,1,0,0,0|2,0,0]=4 338 B8R0.6 COC(=O)OCCCCl 2128-5-0P [0,1,1,0,0,0|2,0,0]=4 339 B8R0.6 COCCCC(=O)OC G311-A-58 [0,1,1,0,0,0|2,0,0]=4 340 B8R0.6 O=C(CO)OCCCCl 2129-5-0C [0,1,1,0,0,0|2,0,0]=4 341 B8R0.6 O=C(CO)OCCCF 2129-3-0N [0,1,1,0,0,0|2,0,0]=4 342 B8R0.7 C#CCCCCC(=O)O 2521-1-04 [0,1,1,0,0,0|1,0,0]=3 343 B8R0.7 C=CCCCCC(=O)O 2321-1-0N [0,1,1,0,0,0|1,0,0]=3 344 B8R0.7 C=CCOCCC(=O)O 2321-1-0Q [0,1,1,0,0,0|1,0,1]=4 345 B8R0.7 CC(=O)CCOCCBr 2117-9-00 [0,1,1,0,0,0|2,0,0]=4 346 B8R0.7 CC(=O)CCOCCCl 2117-5-0A [0,1,1,0,0,0|2,0,0]=4 347 B8R0.7 CC(=O)COCCCCl 2117-5-0D [0,1,1,0,0,0|2,0,0]=4 348 B8R0.7 CC(=O)COCCCF 2117-3-1G [0,1,1,0,0,0|2,0,0]=4 349 B8R0.7 CC(=O)OCCCCBr 2123-9-19 [0,1,1,0,0,0|2,0,0]=4 350 B8R0.7 CC(=O)OCCCCCl 2123-5-0W [0,1,1,0,0,0|2,0,0]=4 351 B8R0.7 CC(=O)OCCCCI 2123-H-02 [0,1,1,0,0,0|2,0,0]=4 352 B8R0.7 CCCCC#CC(=O)O 2521-1-0A [0,1,1,0,0,0|1,0,1]=4 353 B8R0.7 CCCCCCC(C)=O 2117-1-X1 [0,1,1,0,0,0|2,0,0]=4 354 B8R0.7 CCCCOCC(=O)O 2121-1-52 [0,1,1,0,0,0|1,0,0]=3 355 B8R0.7 COCCOCC(=O)Cl 2116-5-12 [0,1,1,0,0,0|2,0,0]=4 356 B8R0.7 COCCOCC(=O)O 2121-1-33A [0,1,1,0,0,0|1,0,0]=3 357 B8R0.7 COCCOCC(=O)O 2121-1-33B [0,1,1,0,0,0|1,0,0]=3 358 B8R0.7 COCCOCC(=O)O 2121-1-33C [0,1,1,0,0,0|1,0,0]=3 359 B8R0.7 N=C(N)NCCCCN 8164-1-06 [0,1,1,0,0,0|2,0,0]=4 360 B8R0.7 NC(=O)CCCCCBr 4148-9-07 [0,1,1,0,0,0|2,0,0]=4 361 B8R0.7 NCCCCCC(=O)O 4157-1-0B [0,1,1,0,0,0|0,0,0]=2 362 B8R0.7 O=C(O)CCCCCCl 2121-5-06 [0,1,1,0,0,0|1,0,0]=3 363 B8R0.7 O=C(O)CCCCCO 2129-1-0D [0,1,1,0,0,0|1,0,0]=3 364 B8R0.8 C#CCC[C@@H](N)C(=O)O 4557-1-R1 [0,1,1,0,0,0|1,0,1]=4 365 B8R0.8 CC(=O)N(C)CCCN 4148-5-0E [0,1,1,0,0,0|2,0,0]=4 366 B8R0.8 CCCCC(Br)C(=O)O 2121-9-16 [0,1,1,0,0,0|1,0,0]=3 367 B8R0.8 CCCCC(C)C(=O)O 2121-1-0S [0,1,1,0,0,0|1,0,0]=3 368 B8R0.8 CCC\C=C(/C)C(=O)O 2321-1-0S [0,1,1,0,0,0|1,0,1]=4 369 B8R0.8 COCC[C@H](N)C(=O)O 4157-5-S8 [0,1,1,0,0,0|2,0,0]=4 370 B8R0.8 CSCCC(N)C(=O)O 8166-1-00 [0,1,1,0,0,0|2,0,0]=4 371 B8R0.8 NOCC[C@H](N)C(=O)O 4157-1-08 [0,1,1,0,0,0|1,0,0]=3 372 B8R0.8 [C@H](N)(CCSC)C(=O)O 8166-1-S5 [0,1,1,0,0,0|2,0,0]=4 373 B8R0.9 CCC(Cl)CCC(=O)Cl 2116-5-23 [0,1,1,0,0,0|2,0,0]=4 374 B8R0.28 C=C(C)CCCC(=O)O 2321-1-18 [0,1,1,0,0,0|1,0,1]=4 375 B8R0.28 CC(=O)CCCC(=O)O 2129-1-0X [0,1,1,0,0,0|1,0,1]=4 376 B8R0.28 CC(=O)CCCC(C)C 2117-1-0E [0,1,1,0,0,0|2,0,0]=4 377 B8R0.28 CC(=O)COCC(C)F 2117-3-1F [0,1,1,0,0,0|2,0,0]=4 378 B8R0.28 CC(C)CCCC(=O)O 2121-1-15 [0,1,1,0,0,0|1,0,0]=3 379 B8R0.28 NC(=O)COCC(=O)O 4148-1-23 [0,1,1,0,0,0|1,0,1]=4 380 B8R0.28 O=C(O)CCCC(=O)O 2121-1-25 [0,1,1,0,0,0|1,0,1]=4 381 B8R0.28 O=C(O)CNCC(=O)O 4157-1-48 [0,1,1,0,0,0|1,0,1]=4 382 B8R0.2 CCC(C)C(=O)C(=O)O 2129-1-1A [0,1,1,0,0,0|1,0,1]=4 383 B8R0.2 CCC(O)C(Cl)C(=O)O 2129-5-03 [0,1,1,0,0,0|1,0,0]=3 384 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O 2121-5-0B [0,1,1,0,0,0|1,0,0]=3 385 B8R0.3 C#CC[C@@H](N)C(=O)OC 4558-1-00 [0,1,1,0,0,0|0,0,2]=4 386 B8R0.3 C=CCC(N)C(=O)OC 4358-5-00 [0,1,1,0,0,0|0,0,2]=4 387 B8R0.3 CCCC(N)C(=O)OC 4158-5-0M [0,1,1,0,0,0|0,0,0]=2 388 B8R0.3 CCC[C@H](N)C(=O)OC 4158-1-S00 [0,1,1,0,0,0|0,0,0]=2 389 B8R0.3 CCC[C@H](N)C(=O)OC 4158-5-SH [0,1,1,0,0,0|0,0,0]=2 390 B8R0.3 COC(=O)C(C)CCCl 2123-5-1K [0,1,1,0,0,0|2,0,0]=4 391 B8R0.12 C=CC[C@@](C)(N)C(=O)O 4357-1-R1 [0,1,1,0,0,0|0,0,2]=4 392 B8R0.12 CC(C)(CCN)C(=O)O 4157-1-49 [0,1,1,0,0,0|2,0,0]=4 393 B8R0.12 CC(C)(CCN)C(=O)O 4157-5-11 [0,1,1,0,0,0|2,0,0]=4 394 B8R0.12 CCC[C@@](C)(N)C(=O)O 4157-1-RB [0,1,1,0,0,0|0,0,0]=2 395 B8R0.12 CCOC(C)(C)C(=O)O 2121-1-0T [0,1,1,0,0,0|1,0,0]=3 396 B8R0.12 NCCC(F)(F)C(=O)O 4157-3-21 [0,1,1,0,0,0|2,0,0]=4 397 B8R0.12 NCCC(F)(F)C(=O)O 4157-7-02 [0,1,1,0,0,0|2,0,0]=4 398 B8R0.15 COC(CCN)C(=O)O 4157-1-57 [0,1,1,0,0,0|2,0,0]=4 399 B8R0.23 CC(=O)CC(C)C(=O)O 2129-1-0G [0,1,1,0,0,0|1,0,1]=4 400 B8R0.23 CC(=O)O[C@@H](C)C(=O)O 2123-1-S2 [0,1,1,0,0,0|1,0,1]=4 401 B8R0.23 CC(C)CC(Br)C(=O)O 2121-9-0D [0,1,1,0,0,0|1,0,0]=3 402 B8R0.23 CC(C)CC(O)C(=O)O 2129-1-0U [0,1,1,0,0,0|1,0,0]=3 403 B8R0.23 CC(C)C[C@@H](O)C(=O)O 2129-1-RB [0,1,1,0,0,0|1,0,0]=3 404 B8R0.23 CC(C)C[C@H](Cl)C(=O)O 2121-5-S2 [0,1,1,0,0,0|1,0,0]=3 405 B8R0.23 CC(C)C[C@H](F)C(=O)O 2121-3-S2 [0,1,1,0,0,0|1,0,0]=3 406 B8R0.23 CC(C)C[C@H](N)C(N)=O 4158-5-02 [0,1,1,0,0,0|1,0,0]=3 407 B8R0.23 CS(=O)C[C@H](N)C(=O)O 8162-1-R0 [0,1,1,0,0,0|1,0,0]=3 408 B8R0.23 NC(=O)CC(N)C(=O)O 4157-1-26 [0,1,1,0,0,0|1,0,1]=4 409 B8R0.23 NC(=O)C[C@H](N)C(=O)O 5157-1-01 [0,1,1,0,0,0|1,0,1]=4 410 B8R0.23 NC(CC(=O)O)C(=O)O 4157-1-0G [0,1,1,0,0,0|1,0,1]=4 411 B8R0.23 N[C@@H](CS(=O)O)C(=O)O 8157-1-02 [0,1,1,0,0,0|2,0,0]=4 412 B8R0.18 CCC(C(C)=O)C(C)=O 2118-1-08 [0,1,1,0,0,0|2,0,0]=4 413 B8R0.20 COC(=O)C(OC)OC 2123-1-79 [0,1,1,0,0,0|2,0,0]=4 414 B8R0.36 CCC(Br)(CC)C(=O)Br 2116-9-07 [0,1,1,0,0,0|2,0,0]=4 415 B8R0.36 CCC(Br)(CC)C(=O)O 2121-9-0E [0,1,1,0,0,0|1,0,0]=3 416 B8R0.36 CCC(C)(CC)C(=O)O 2121-1-39 [0,1,1,0,0,0|1,0,0]=3 417 B8R0.36 CCC(N)(CC)C(=O)O 4157-1-50 [0,1,1,0,0,0|1,0,0]=3 418 B8R1.1 O=C1CC[C@@H](CO)N1 4H48-1-KC [1,1,0,0,0,0|0,0,2]=4 419 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 4H56-5-D4 [1,1,0,0,0,0|0,0,1]=3 420 B8R1.8 COCC1CCCN1 4H33-5-0Q [1,1,0,0,0,0|0,0,1]=3 421 B8R1.8 COC[C@H]1CCCN1 4H07-1-Z4 [1,1,0,0,0,0|0,0,1]=3 422 B8R1.8 OCCC1CCCN1 4H01-1-41 [1,1,0,0,0,0|0,0,1]=3 423 B8R1.11 CN1CCC[C@@H]1CN 3H32-1-AF [1,1,0,0,0,0|1,0,1]=4 424 B8R1.11 CN1CCC[C@H]1CO 4H01-1-S1 [1,1,0,0,0,0|0,0,1]=3 425 B8R1.11 NN1CCC[C@H]1CO 4H56-1-JT [1,1,0,0,0,0|0,0,1]=3 426 B8R1.11 N[C@H]1CCC[C@H]1CO 4256-5-27 [1,1,0,0,0,0|1,0,1]=4 427 B8R1.52 C[C@@]1(CO)CCCN1 4H56-5-A1 [1,1,0,0,0,0|0,0,1]=3 428 B8R1.23 C=C1CC(C(=O)Cl)C1 2316-5-04 [0,1,0,0,1,0|1,0,1]=4 429 B8R1.23 CC(=O)N1CC(O)C1 4H48-1-LQ [0,1,0,0,1,0|2,0,0]=4 430 B8R1.23 CC1CC(C(=O)O)C1 2221-1-0B [0,1,0,0,1,0|0,0,0]=2 431 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 2221-1-29 [0,1,0,0,1,0|0,0,0]=2 432 B8R1.23 NC1CC(C(=O)O)C1 4257-1-29 [0,1,0,0,1,0|0,0,0]=2 433 B8R1.23 NC1CC(C(=O)O)C1 4257-5-14 [0,1,0,0,1,0|0,0,0]=2 434 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 4257-5-01 [0,1,0,0,1,0|0,0,0]=2 435 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 4257-5-07 [0,1,0,0,1,0|0,0,0]=2 436 B8R1.23 O=C(O)C1CC(F)C1 2221-3-09 [0,1,0,0,1,0|0,0,0]=2 437 B8R1.23 O=C(O)C1CC(O)C1 2229-1-89 [0,1,0,0,1,0|0,0,0]=2 438 B8R1.38 C#CC(=O)C1CCC1 2517-1-02 [0,1,0,0,1,0|1,0,0]=3 439 B8R1.38 COC(=O)C1CCC1 2223-1-0N [0,1,0,0,1,0|0,0,0]=2 440 B8R1.38 COC(=O)C1CCN1 4H23-5-33 [0,1,0,0,1,0|0,0,0]=2 441 B8R1.38 COC(=O)[C@@H]1CCN1 4H23-5-S1 [0,1,0,0,1,0|0,0,0]=2 442 B8R1.38 COC(=O)[C@H]1CCN1 4H58-5-C4 [0,1,0,0,1,0|0,0,0]=2 443 B8R1.38 NCC(=O)N1CCC1 4H58-5-7F [0,1,0,0,1,0|2,0,0]=4 444 B8R1.38 N\C(=N/O)C1CCC1 4247-1-13 [0,1,0,0,1,0|1,0,0]=3 445 B8R1.38 O=C(CBr)N1CCC1 4H48-9-14 [0,1,0,0,1,0|2,0,0]=4 446 B8R1.78 CC(=O)C1(C)COC1 2H17-1-83 [0,1,0,0,1,0|2,0,0]=4 447 B8R1.78 CC1(C(=O)O)CCC1 2221-1-25 [0,1,0,0,1,0|0,0,0]=2 448 B8R1.78 NC1(C(=O)O)CCC1 4257-1-06 [0,1,0,0,1,0|0,0,0]=2 449 B8R1.78 NC1(C(=O)O)CCC1 4257-5-13 [0,1,0,0,1,0|0,0,0]=2 450 B8R1.78 NC1(C(=O)O)CNC1 4H57-1-58 [0,1,0,0,1,0|1,0,0]=3 451 B8R1.78 NC1(C(=O)O)CNC1 4H57-5-13 [0,1,0,0,1,0|1,0,0]=3 452 B8R1.78 NC1(C(=O)O)COC1 4H57-1-68 [0,1,0,0,1,0|1,0,0]=3 453 B8R1.78 NC1(C(=O)O)CSC1 8H57-1-25 [0,1,0,0,1,0|1,0,0]=3 454 B8R1.78 O=C(O)C1(Br)CCC1 2221-9-10 [0,1,0,0,1,0|0,0,0]=2 455 B8R1.78 O=C(O)C1(O)CCC1 2229-1-70 [0,1,0,0,1,0|0,0,0]=2 456 B10R1.13 CC1CCC(C(N)=O)CN1 4H48-1-A6 [0,1,0,0,0,1|1,0,0]=3 457 B10R1.13 CN1CCN(C(=O)O)CC1 4H56-1-962 [0,1,0,0,0,1|2,0,0]=4 458 B10R1.13 NC1CCC(C(=O)O)CC1 4257-5-0B [0,1,0,0,0,1|1,0,0]=3 459 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 4257-5-X0 [0,1,0,0,0,1|1,0,0]=3 460 B10R1.13 O=C(O)C1CCC(Cl)CC1 2221-5-00 [0,1,0,0,0,1|1,0,0]=3 461 B10R1.13 O=C(O)C1CCC(O)CC1 2221-1-1M [0,1,0,0,0,1|1,0,0]=3 462 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 4H57-5-17 [0,1,0,0,0,1|0,0,0]=2 463 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 2229-1-1G [0,1,0,0,0,1|1,0,0]=3 464 B10R1.13 O=C1CCC(C(=O)O)=NN1 4H29-1-Z6 [0,1,0,0,0,1|0,0,2]=4 465 B10R1.13 O=C1CCC(C(=O)O)CN1 4H58-1-A5 [0,1,0,0,0,1|0,0,1]=3 466 B10R1.15 COC(=O)C1=CCNCC1 4H23-5-5L [0,1,0,0,0,1|1,0,1]=4 467 B10R1.15 COC(=O)C1=COCCC1 2H23-1-68 [0,1,0,0,0,1|1,0,1]=4 468 B10R1.15 COC(=O)C1CCCCC1 2223-1-56 [0,1,0,0,0,1|1,0,0]=3 469 B10R1.15 COC(=O)C1CCCCN1 4H23-1-9K [0,1,0,0,0,1|0,0,0]=2 470 B10R1.15 COC(=O)C1CCCCO1 2H23-1-1D [0,1,0,0,0,1|1,0,0]=3 471 B10R1.15 COC(=O)C1CCCNC1 4H58-1-YW [0,1,0,0,0,1|0,0,0]=2 472 B10R1.15 COC(=O)C1CCCOC1 2H23-1-45 [0,1,0,0,0,1|1,0,0]=3 473 B10R1.15 COC(=O)C1CCSCC1 6H66-1-0E [0,1,0,0,0,1|1,0,0]=3 474 B10R1.15 COC(=O)C1CNCCO1 4H23-1-59 [0,1,0,0,0,1|1,0,0]=3 475 B10R1.15 COC(=O)C1CNCCO1 4H56-5-JH [0,1,0,0,0,1|1,0,0]=3 476 B10R1.15 COC(=O)C1COCCN1 4H23-1-J3 [0,1,0,0,0,1|0,0,0]=2 477 B10R1.15 COC(=O)C1COCCN1 4H58-5-8X [0,1,0,0,0,1|0,0,0]=2 478 B10R1.15 COC(=O)N1CCCCC1 4H56-1-08A [0,1,0,0,0,1|2,0,0]=4 479 B10R1.15 COC(=O)N1CCNCC1 4H56-1-0BZ [0,1,0,0,0,1|2,0,0]=4 480 B10R1.15 COC(=O)[C@@H]1CCCCN1 4H56-5-S1 [0,1,0,0,0,1|0,0,0]=2 481 B10R1.15 COC(=O)[C@@H]1CCCNC1 4H23-1-R5 [0,1,0,0,0,1|0,0,0]=2 482 B10R1.15 COC(=O)[C@H]1CCCCN1 4H56-5-R1 [0,1,0,0,0,1|0,0,0]=2 483 B10R1.15 N=C(NO)C1CCCCC1 4247-1-14 [0,1,0,0,0,1|2,0,0]=4 484 B10R1.15 NNC(=O)C1CCOCC1 4H56-1-398 [0,1,0,0,0,1|2,0,0]=4 485 B10R1.15 N\C(=N/O)C1CCOCC1 4H47-1-54 [0,1,0,0,0,1|2,0,0]=4 486 B10R1.28 CS(=O)(=O)C1CCCNC1 8H63-5-04 [0,1,0,0,0,1|1,0,1]=4 487 B10R1.28 O=S(=O)(O)C1CCCNC1 8H64-1-68 [0,1,0,0,0,1|1,0,0]=3 488 B10R1.61 CC(=O)C1CCCCC1=O 2218-1-0G [0,1,0,0,0,1|2,0,0]=4 489 B10R1.61 CC1=C(C(=O)O)CCCO1 2H21-1-W8 [0,1,0,0,0,1|1,0,1]=4 490 B10R1.61 CC1CCCC=C1C(=O)O 2421-1-12 [0,1,0,0,0,1|1,0,1]=4 491 B10R1.61 CC1CCCCC1C(=O)O 2221-1-1J [0,1,0,0,0,1|1,0,0]=3 492 B10R1.61 CC1CNCCC1C(=O)O 4H58-5-6B [0,1,0,0,0,1|1,0,0]=3 493 B10R1.61 CN1CCCC[C@@H]1C(=O)O 4H56-1-JS [0,1,0,0,0,1|0,0,0]=2 494 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O 4257-1-19 [0,1,0,0,0,1|1,0,0]=3 495 B10R1.61 N[C@H]1C=CCC[C@H]1C(=O)O 4457-5-04 [0,1,0,0,0,1|1,0,1]=4 496 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O 4457-5-00 [0,1,0,0,0,1|1,0,1]=4 497 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O 4457-5-05 [0,1,0,0,0,1|1,0,1]=4 498 B10R1.61 O=C(O)C1CCCCC1O 2229-1-1P [0,1,0,0,0,1|1,0,0]=3 499 B10R1.61 O=C(O)C1CCCNC1=O 4H58-1-21 [0,1,0,0,0,1|0,0,0]=2 500 B10R1.61 O=C(O)C1CCNCC1F 4H58-7-51 [0,1,0,0,0,1|1,0,0]=3 501 B10R1.113 CC(=O)C1CCCN(C)C1 4H17-1-2S [0,1,0,0,0,1|1,0,0]=3 502 B10R1.113 CC(=O)C1CCCN(C)C1 4H17-5-0Z [0,1,0,0,0,1|1,0,0]=3 503 B10R1.113 CC1CCCC(C(=O)O)N1 4H21-5-44 [0,1,0,0,0,1|0,0,0]=2 504 B10R1.113 CC1COCC(C(=O)O)N1 4H21-5-43 [0,1,0,0,0,1|0,0,0]=2 505 B10R1.113 CN1CCCC(C(=O)O)C1 4H21-5-Z1 [0,1,0,0,0,1|0,0,0]=2 506 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 4H21-1-R0 [0,1,0,0,0,1|0,0,0]=2 507 B10R1.113 CN1CCC[C@H](C(=O)O)C1 4H21-1-S0 [0,1,0,0,0,1|0,0,0]=2 508 B10R1.113 NC1CCCC(C(=O)O)C1 4257-1-X1 [0,1,0,0,0,1|1,0,0]=3 509 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 4257-5-0A [0,1,0,0,0,1|1,0,0]=3 510 B10R1.113 O=C(O)C1CCCC(O)C1 2229-1-0Z [0,1,0,0,0,1|1,0,0]=3 511 B10R1.113 O=C(O)C1CS(=O)CCN1 8H65-5-02 [0,1,0,0,0,1|0,0,0]=2 512 B10R1.113 O=C(O)[C@H]1C[C@@H](O)CCN1 4H29-5-0A [0,1,0,0,0,1|0,0,0]=2 513 B10R1.113 O=C1CC(C(=O)O)CCN1 4H58-1-C7 [0,1,0,0,0,1|1,0,1]=4 514 B10R1.363 CC(=O)C1(O)CCCCC1 2220-1-07 [0,1,0,0,0,1|2,0,0]=4 515 B10R1.363 CC1(C(=O)Cl)CCCCC1 2216-5-04 [0,1,0,0,0,1|2,0,0]=4 516 B10R1.363 CC1(C(=O)O)CCCCN1 4H58-5-6A [0,1,0,0,0,1|0,0,0]=2 517 B10R1.363 CC1(C(=O)O)CCCOC1 2H21-1-10 [0,1,0,0,0,1|1,0,0]=3 518 B10R1.363 CC1(C(=O)O)CCOCC1 2H21-1-11 [0,1,0,0,0,1|1,0,0]=3 519 B10R1.363 NC(=O)C1(O)CCNCC1 4H48-1-3E [0,1,0,0,0,1|2,0,0]=4 520 B10R1.363 NC1(C(=O)O)CCNCC1 4H57-1-1J [0,1,0,0,0,1|1,0,0]=3 521 B10R1.363 NC1(C(=O)O)CCOCC1 4H57-1-67 [0,1,0,0,0,1|1,0,0]=3 522 B10R1.363 NC1(C(=O)O)CCOCC1 4H57-5-0F [0,1,0,0,0,1|1,0,0]=3 523 B10R1.363 O=C(O)C1(F)CCCCC1 2221-3-X0 [0,1,0,0,0,1|1,0,0]=3 524 B10R1.363 O=C(O)C1(F)CCOCC1 2H21-3-22 [0,1,0,0,0,1|1,0,0]=3 525 B10R1.23 C[C@H](C(=O)O)N1CCCC1 4H58-1-R19 [0,1,0,0,0,1|2,0,0]=4 526 B10R1.54 O=C(O)CC1CCC(=O)O1 2H21-1-09 [0,1,0,0,0,1|1,0,1]=4 527 B10R1.6 COC(C)(C)C1CCCN1 4H07-1-3Y [0,2,0,0,0,0|1,0,1]=4 528 B10R1.11 CCNC(=O)[C@@H]1CCCN1 4158-5-SV [0,2,0,0,0,0|1,0,0]=3 529 B10R1.11 CCOC(=O)C1CCCO1 2H23-1-1B [0,2,0,0,0,0|1,0,0]=3 530 B10R1.11 CCOC(=O)C1CCNC1 4H58-5-BG [0,2,0,0,0,0|2,0,0]=4 531 B10R1.11 CCOC(=O)C1SCCS1 6H23-1-26 [0,2,0,0,0,0|2,0,0]=4 532 B10R1.11 CCOC(=O)[C@@H]1CCNC1 4H58-1-9V [0,2,0,0,0,0|2,0,0]=4 533 B10R1.11 CCOC(=O)[C@@H]1CCNC1 4H58-5-R7 [0,2,0,0,0,0|2,0,0]=4 534 B10R1.11 CCOC(=O)[C@@H]1CSCN1 8H23-5-R0 [0,2,0,0,0,0|1,0,0]=3 535 B10R1.11 CCOC(=O)[C@H]1CCCN1 4H58-5-RF [0,2,0,0,0,0|0,0,0]=2 536 B10R1.11 CCOC(=O)[C@H]1CCNC1 4H58-1-9U [0,2,0,0,0,0|2,0,0]=4 537 B10R1.11 CCOC(=O)[C@H]1CCNC1 4H58-5-S7 [0,2,0,0,0,0|2,0,0]=4 538 B10R1.14 C=C1CN[C@H](C(=O)OC)C1 4H56-1-SC [0,2,0,0,0,0|0,0,1]=3 539 B10R1.14 COC(=O)C1CC(O)CN1 4H58-1-184 [0,2,0,0,0,0|0,0,0]=2 540 B10R1.14 COC(=O)C1COC(=O)N1 4H58-1-344 [0,2,0,0,0,0|1,0,1]=4 541 B10R1.14 COC(=O)[C@@H]1COC(=O)N1 4H58-1-S14 [0,2,0,0,0,0|1,0,1]=4 542 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 4H58-7-08 [0,2,0,0,0,0|0,0,0]=2 543 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 4258-7-01 [0,2,0,0,0,0|0,0,0]=2 544 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 2229-1-92 [0,2,0,0,0,0|1,0,0]=3 545 B10R1.14 COC(=O)[C@H]1COC(=O)N1 4H58-1-R14 [0,2,0,0,0,0|1,0,1]=4 546 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 4H29-1-09 [0,2,0,0,0,0|0,0,0]=2 547 B10R1.149 COC(=O)C1=C(N)CCC1 4430-1-00 [0,2,0,0,0,0|1,0,1]=4 548 B10R1.149 COC(=O)C1CCCC1O 2229-1-0Y [0,2,0,0,0,0|1,0,0]=3 549 B10R1.149 COC(=O)C1CCOC1=O 2H29-1-0E [0,2,0,0,0,0|2,0,0]=4 550 B10R1.149 COC(=O)C1COCC1=O 2H29-1-50 [0,2,0,0,0,0|2,0,0]=4 551 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N 4258-5-10 [0,2,0,0,0,0|1,0,0]=3 552 B10R1.411 COC(=O)C1(N)CCOC1 4H58-5-3Y [0,2,0,0,0,0|2,0,0]=4 553 B10R1.411 COC(=O)[C@@]1(C)CCCN1 4H58-5-R0 [0,2,0,0,0,0|0,0,0]=2 554 B10R1.58 O=C(O)C1CC(Br)C(Br)C1 2221-9-07 [0,2,0,0,0,0|1,0,0]=3 555 B10R1.58 O=C(O)[C@@H]1C[C@@H](F)C(=O)N1 4H29-3-35 [0,2,0,0,0,0|0,0,1]=3 556 B10R1.58 O=C1N[C@@H](C(=O)O)C[C@H]1F 4H29-3-36 [0,2,0,0,0,0|0,0,1]=3 557 B10R1.59 C=C1C[C@H](N)[C@H](C(=O)O)C1 4357-1-02 [0,2,0,0,0,0|1,0,1]=4 558 B10R1.194 CN1C(=O)CC[C@H]1C(=O)O 4H56-1-GQ [0,2,0,0,0,0|0,0,1]=3 559 B10R1.194 CN1CCC(C(=O)O)C1=O 4H58-1-00L [0,2,0,0,0,0|2,0,0]=4 560 B10R1.359 CC1(C)CCC(C(=O)O)C1 2221-1-45 [0,2,0,0,0,0|1,0,0]=3 561 B10R1.359 CC1(C)OCC(C(=O)O)O1 2H21-1-39 [0,2,0,0,0,0|2,0,0]=4 562 B10R1.359 NC(=O)[C@H]1CC(F)(F)CN1 4H48-7-R0 [0,2,0,0,0,0|1,0,0]=3 563 B10R1.359 O=C(O)C1CCC(F)(F)C1 2221-3-10 [0,2,0,0,0,0|1,0,0]=3 564 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 4H57-7-S0 [0,2,0,0,0,0|0,0,0]=2 565 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 4H58-3-S0 [0,2,0,0,0,0|0,0,0]=2 566 B10R1.359 O=C(O)[C@@H]1CCC(F)(F)C1 2221-3-R0 [0,2,0,0,0,0|1,0,0]=3 567 B10R1.359 O=C(O)[C@H]1CCC(F)(F)C1 2221-3-S0 [0,2,0,0,0,0|1,0,0]=3 568 B10R1.39 CCN1CCCC1C(=O)O 4H58-1-00U [0,2,0,0,0,0|0,0,0]=2 569 B10R1.39 CCN1CCC[C@@H]1C(=O)O 4H57-1-1N [0,2,0,0,0,0|0,0,0]=2 570 B10R1.39 CCN1CCC[C@H]1C(N)=O 4H48-1-SM [0,2,0,0,0,0|1,0,0]=3 571 B10R1.128 C[C@@]1(N)CCC[C@@H]1C(=O)O 4257-5-19 [0,2,0,0,0,0|1,0,0]=3 572 B10R1.477 CC[C@@]1(C(=O)O)CCCN1 4H57-5-S6 [0,2,0,0,0,0|0,0,0]=2 573 B10R1.477 N#CC1(C(=O)O)CCCC1 4237-1-0S [0,2,0,0,0,0|1,0,0]=3 574 B8R1.4 CC1CCCC(=O)C1 2217-1-0Z [0,0,1,1,0,0|2,0,0]=4 575 B8R1.4 CC1CCCC(=O)N1 4H48-1-CH [0,0,1,1,0,0|2,0,0]=4 576 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 4H56-1-0GA [0,0,1,1,0,0|1,0,1]=4 577 B8R1.4 C[C@H]1CNC[C@H](C)O1 4H56-1-649 [0,0,1,1,0,0|1,0,1]=4 578 B8R1.4 NC1CCNC(=O)C1 4H22-1-10 [0,0,1,1,0,0|2,0,0]=4 579 B8R1.4 O=C1CCCC(=O)O1 2H26-1-0G [0,0,1,1,0,0|1,0,1]=4 580 B8R1.22 O=C1C=CCCCC1 2417-1-0D [0,0,1,1,0,0|2,0,0]=4 581 B8R1.22 O=C1CCCCSC1 6H66-1-10 [0,0,1,1,0,0|2,0,0]=4 582 B8R1.22 O=C1CNCCCN1 4H48-1-4S [0,0,1,1,0,0|1,0,0]=3 583 B8R1.34 O=C(O)CC1CCC1 2221-1-52 [0,0,1,1,0,0|1,0,0]=3 584 B8R1.34 O=C(O)CC1COC1 2H21-1-45 [0,0,1,1,0,0|2,0,0]=4 585 B8R1.35 O=C(O)CCC1CC1 2221-1-24 [0,0,1,1,0,0|1,0,0]=3 586 B8R1.43 NCC1CC1C(=O)O 4257-5-05 [0,0,1,1,0,0|0,0,0]=2 587 B8R1.72 CC1(O)CCCNC1 4H56-1-NY [0,0,1,1,0,0|1,0,1]=4 588 B8R1.5 CC1CCCNC1=O 4H48-1-MX [0,0,1,1,0,0|2,0,0]=4 589 B8R1.5 N[C@@H]1CCCC[C@@H]1O 4256-5-0B [0,0,1,1,0,0|1,0,1]=4 590 B8R1.5 N[C@@H]1CCCC[C@@H]1O 4256-5-29 [0,0,1,1,0,0|1,0,1]=4 591 B8R1.5 N[C@@H]1CCCC[C@H]1O 4256-5-0C [0,0,1,1,0,0|1,0,1]=4 592 B8R1.5 N[C@H]1CCCC[C@@H]1O 4256-1-S1 [0,0,1,1,0,0|1,0,1]=4 593 B8R1.5 O=C1CCCCC1Br 2217-9-0C [0,0,1,1,0,0|2,0,0]=4 594 B8R1.5 O=C1CCCCC1Cl 2217-5-09 [0,0,1,1,0,0|2,0,0]=4 595 B8R1.5 O=C1CCCCC1F 2217-3-09 [0,0,1,1,0,0|2,0,0]=4 596 B8R1.18 C=C1CC(C)OC1=O 2H25-1-3A [0,0,1,1,0,0|1,0,1]=4 597 B8R1.54 N[C@@H](C(=O)O)C1CC1 4257-1-R8 [0,0,1,1,0,0|0,0,0]=2 598 B8R1.63 NCC1(C(=O)O)CC1 4257-5-15 [0,0,1,1,0,0|2,0,0]=4 599 B8R1.63 O=C(O)C1(CO)CC1 2229-1-71 [0,0,1,1,0,0|2,0,0]=4 600 B8R2.34 C1CC2CC1CN2 3H31-1-1P [1,0,0,1,0,0|1,0,1]=4 601 B8R2.34 C1CC2CCC1N2 3H31-5-2E [1,0,0,1,0,0|1,0,1]=4 602 B8R2.34 C1N[C@H]2CN[C@@H]1C2 3H32-1-CF [1,0,0,1,0,0|1,0,1]=4 603 B8R2.34 C1OC2CNC1C2 4H22-1-26 [1,0,0,1,0,0|0,0,1]=3 604 B8R2.34 C1OC2CNC1C2 4H31-1-68 [1,0,0,1,0,0|0,0,1]=3 605 B8R2.34 C1O[C@@H]2CN[C@H]1C2 4H56-5-3A [1,0,0,1,0,0|0,0,1]=3 606 B8R2.34 C1O[C@H]2CN[C@@H]1C2 4H22-1-25 [1,0,0,1,0,0|0,0,1]=3 607 B8R2.34 C1O[C@H]2CN[C@@H]1C2 4H56-5-A7 [1,0,0,1,0,0|0,0,1]=3 608 B8R2.34 [C@@H]12CC[C@@H](CN1)C2 3H31-1-GY [1,0,0,1,0,0|1,0,1]=4 609 B8R2.55 C1CNC2(C1)CC2 4H22-1-X3 [1,0,0,1,0,0|1,0,1]=4 610 B10R2.62 O=C1CN2CCC1CC2 4H17-5-X6 [0,0,0,1,0,1|2,0,0]=4 611 B10R2.62 O=C1CN2CCC1CC2 4H56-1-BB [0,0,0,1,0,1|2,0,0]=4 612 B10R2.62 O=C1NC2CCC1CC2 4H48-1-AQ [0,0,0,1,0,1|2,0,0]=4 613 B10R2.62 O=C1OC2CCC1CC2 2H25-1-3N [0,0,0,1,0,1|1,0,0]=3 614 B10R2.62 OC1CC2CCC1NC2 4H56-5-1L [0,0,0,1,0,1|1,0,1]=4 615 B10R2.355 [C@@H]12CNC(C(=O)O)[C@@H]1C2 4H57-1-V0 [0,0,0,1,0,1|0,0,0]=2 616 B10R2.71 O=C1CC2CCC(C1)C2 2217-1-30 [0,0,0,1,0,1|2,0,0]=4 617 B10R2.71 O=C1CC2CCC(C1)O2 4H17-1-1Z [0,0,0,1,0,1|2,0,0]=4 618 B10R2.316 O=C1CC2(CCCC2)N1 4H48-1-09Z [0,0,0,1,0,1|2,0,0]=4 619 B10R2.348 O=C(O)C12CC(CN1)C2 4H21-5-07 [0,1,0,1,0,0|0,0,0]=2 620 B6R1.6 C#CC1CCC1 1500-1-0A [1,0,0,0,1,0|1,0,1]=4 621 B6R1.6 CNC1CCC1 3231-5-03 [1,0,0,0,1,0|2,0,0]=4 622 B6R1.6 ICC1CCC1 1200-H-01 [1,0,0,0,1,0|1,0,1]=4 623 B6R1.6 NCC1CCC1 3230-1-06 [1,0,0,0,1,0|1,0,1]=4 624 B6R1.6 NOC1CCC1 4247-5-01 [1,0,0,0,1,0|2,0,0]=4 625 B6R1.6 OCC1CCC1 2201-1-07 [1,0,0,0,1,0|0,0,1]=3 626 B6R1.6 OCC1CCN1 4H56-1-097 [1,0,0,0,1,0|0,0,1]=3 627 B6R1.6 OCC1CCO1 2H10-1-46 [1,0,0,0,1,0|1,0,1]=4 628 B6R1.6 OCC1CNC1 4H01-5-0E [1,0,0,0,1,0|1,0,1]=4 629 B6R1.6 OCC1CNC1 4H56-1-NX [1,0,0,0,1,0|1,0,1]=4 630 B6R1.6 OC[C@@H]1CCN1 4H56-1-SF [1,0,0,0,1,0|0,0,1]=3 631 B6R1.6 ON=C1CCC1 4247-1-11 [1,0,0,0,1,0|1,0,1]=4 632 B6R1.11 C=C(Br)C1CC1 1300-9-14 [0,0,0,0,2,0|2,0,0]=4 633 B6R1.11 CC(=O)C1CO1 1900-D-11 [0,0,0,0,2,0|2,0,0]=4 634 B6R1.11 NC(=O)C1CC1 4248-1-X1 [0,0,0,0,2,0|1,0,0]=3 635 B6R1.11 NC(=S)C1CC1 7267-1-08 [0,0,0,0,2,0|1,1,0]=4 636 B6R1.11 O=C([O-])C1CO1 2222-1-00 [0,0,0,0,2,0|1,0,1]=4 637 B8R1.2 C=CC1CCCCC1 1300-1-38 [1,0,0,0,0,1|2,0,0]=4 638 B8R1.2 CCC1CCCCN1 3H31-1-CW [1,0,0,0,0,1|1,0,1]=4 639 B8R1.2 CCC1CCCNC1 3H31-5-6G [1,0,0,0,0,1|1,0,1]=4 640 B8R1.2 CCC1CNCCN1 3H32-1-7C [1,0,0,0,0,1|1,0,1]=4 641 B8R1.2 CCC1COCCN1 4H56-1-0NF [1,0,0,0,0,1|1,0,1]=4 642 B8R1.2 CC[C@@H]1CNCCN1 3H31-1-RH [1,0,0,0,0,1|1,0,1]=4 643 B8R1.2 CC[C@@H]1COCCN1 4H56-1-R53 [1,0,0,0,0,1|1,0,1]=4 644 B8R1.2 CC[C@H]1CCCCN1 3H31-5-SC [1,0,0,0,0,1|1,0,1]=4 645 B8R1.2 CC[C@H]1CNCCN1 3H31-1-SH [1,0,0,0,0,1|1,0,1]=4 646 B8R1.2 CC[C@H]1COCCN1 4H44-1-39 [1,0,0,0,0,1|1,0,1]=4 647 B8R1.2 CNC1CCCNC1 3H33-5-0S [1,0,0,0,0,1|2,0,0]=4 648 B8R1.2 COC1CCCNC1 4H56-5-2V [1,0,0,0,0,1|2,0,0]=4 649 B8R1.2 CO[C@@H]1CCCNC1 4H56-5-RB [1,0,0,0,0,1|2,0,0]=4 650 B8R1.2 CO[C@H]1CCCNC1 4H56-1-794 [1,0,0,0,0,1|2,0,0]=4 651 B8R1.2 ClCC1CCCCN1 3H33-5-0G [1,0,0,0,0,1|1,0,1]=4 652 B8R1.2 N#CC1CCCCN1 3H37-1-2C [1,0,0,0,0,1|1,0,1]=4 653 B8R1.2 N#CC1CCCNC1 3H37-5-18 [1,0,0,0,0,1|1,0,1]=4 654 B8R1.2 N#C[C@H]1CCCNC1 3H37-5-S0 [1,0,0,0,0,1|1,0,1]=4 655 B8R1.2 NCC1CCCNC1 3H30-5-8F [1,0,0,0,0,1|1,0,1]=4 656 B8R1.2 O=CC1=CCCCC1 2415-1-02 [1,0,0,0,0,1|1,0,1]=4 657 B8R1.2 O=CC1=CCCSC1 6H15-1-0B [1,0,0,0,0,1|1,0,1]=4 658 B8R1.2 O=CC1CC=CCC1 2415-1-01 [1,0,0,0,0,1|1,0,1]=4 659 B8R1.2 O=CC1CCCCC1 2215-1-X0 [1,0,0,0,0,1|1,0,0]=3 660 B8R1.2 O=CC1CCNCC1 4H15-1-N2 [1,0,0,0,0,1|1,0,0]=3 661 B8R1.2 O=CC1CCSCC1 6H66-1-X0 [1,0,0,0,0,1|1,0,0]=3 662 B8R1.2 O=CN1CCNCC1 4H48-1-C1 [1,0,0,0,0,1|2,0,0]=4 663 B8R1.2 OCC1CCCCC1 2201-1-0A [1,0,0,0,0,1|1,0,1]=4 664 B8R1.2 OCC1CCCCN1 4H01-1-25 [1,0,0,0,0,1|0,0,1]=3 665 B8R1.2 OCC1CCCNC1 4H01-5-60 [1,0,0,0,0,1|0,0,1]=3 666 B8R1.2 OCC1CCCOC1 2H01-1-22 [1,0,0,0,0,1|1,0,1]=4 667 B8R1.2 OCC1CCSCC1 6H01-1-X2 [1,0,0,0,0,1|1,0,1]=4 668 B8R1.2 OCC1CNCCO1 4H56-1-321 [1,0,0,0,0,1|1,0,1]=4 669 B8R1.2 OCC1COCCN1 4H01-1-3Z [1,0,0,0,0,1|0,0,1]=3 670 B8R1.2 OC[C@@H]1CCCCN1 4H01-1-S3 [1,0,0,0,0,1|0,0,1]=3 671 B8R1.2 OC[C@@H]1CCCNC1 4H01-1-42 [1,0,0,0,0,1|0,0,1]=3 672 B8R1.2 OC[C@@H]1CCCNC1 4H33-5-R2 [1,0,0,0,0,1|0,0,1]=3 673 B8R1.2 OC[C@@H]1CNCCO1 4H56-5-S9 [1,0,0,0,0,1|1,0,1]=4 674 B8R1.2 OC[C@@H]1COCCN1 4H56-5-RE [1,0,0,0,0,1|0,0,1]=3 675 B8R1.2 OC[C@@H]1COCCO1 2H01-1-R2 [1,0,0,0,0,1|1,0,1]=4 676 B8R1.2 OC[C@H]1CCCNC1 4H01-1-43 [1,0,0,0,0,1|0,0,1]=3 677 B8R1.2 OC[C@H]1CCCNC1 4H01-5-S2 [1,0,0,0,0,1|0,0,1]=3 678 B8R1.2 OC[C@H]1CNCCO1 4H56-5-R9 [1,0,0,0,0,1|1,0,1]=4 679 B8R1.2 ONC1CCCCC1 4247-1-0B [1,0,0,0,0,1|2,0,0]=4 680 B10R1.18 CC(=O)N[C@H]1CCCNC1 4H48-4-S1 [0,0,0,0,0,2|1,0,0]=3 681 B10R1.18 NC(=O)CC1CCOCC1 4H48-1-3S [0,0,0,0,0,2|2,0,0]=4 682 B10R1.18 NC(=O)NC1CCCCC1 4253-1-02 [0,0,0,0,0,2|2,0,0]=4 683 B10R1.18 O=C(O)C=C1CCOCC1 2H21-1-1D [0,0,0,0,0,2|1,0,1]=4 684 B10R1.18 O=C(O)CC1CCCCN1 4H58-5-9H [0,0,0,0,0,2|0,0,0]=2 685 B10R1.18 O=C(O)CC1CCCNC1 4H58-1-G2 [0,0,0,0,0,2|0,0,0]=2 686 B10R1.18 O=C(O)CC1CNCCO1 4H21-5-2M [0,0,0,0,0,2|1,0,0]=3 687 B10R1.18 O=C(O)CC1COCCO1 2H21-1-49 [0,0,0,0,0,2|1,0,0]=3 688 B10R1.18 O=C(O)CN1CCOCC1 4H58-1-088 [0,0,0,0,0,2|2,0,0]=4 689 B10R1.18 O=C(O)C[C@@H]1CCCCN1 4H56-1-GP [0,0,0,0,0,2|0,0,0]=2 690 B10R1.348 NC(=O)C1CCCCCC1 4248-1-0D [0,0,0,0,0,2|2,0,0]=4 691 B10R1.348 O=C(O)C1CCCNCC1 4H58-1-H9 [0,0,0,0,0,2|0,0,0]=2 692 B10R1.66 O=C(Cl)CCC1CCCC1 2216-5-08 [0,0,0,0,0,2|2,0,0]=4 693 B10R1.66 O=C(O)CCC1CCCO1 2H21-1-0X [0,0,0,0,0,2|1,0,0]=3 694 B10R1.66 O=C(O)COC1CCCC1 2221-1-0H [0,0,0,0,0,2|1,0,0]=3