0 B7R0.3 C#CCNC(=O)CCl 4548-5-X1 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.1 CCC(C)CNC 3131-5-05 [1,0,0,0,0,0|2,0,1]=4 2 B6R0.1 CCNC(=O)CBr 4148-9-03 [1,0,0,0,0,0|2,0,0]=3 3 B6R0.4 CN(C)CCCBr 3132-9-02 [1,0,0,0,0,0|3,0,0]=4 4 B6R0.6 CCNCCOC 4156-1-3Q [1,0,0,0,0,0|2,0,0]=3 5 B8R0.1 CCOC(=O)CCC#N 4137-1-0R [0,1,0,0,0,0|1,0,1]=3 6 B8R0.1 COCCN(C)CCO 4156-1-74 [0,1,0,0,0,0|3,0,0]=4 7 B8R0.3 C=CC[C@H](N)C(=O)OC 4358-1-S0 [0,1,0,0,0,0|1,0,2]=4 8 B8R0.3 CCCC(Br)C(=O)OC 2123-9-0L [0,1,0,0,0,0|1,0,0]=2 9 B8R0.3 CCC[C@@H](N)C(=O)OC 4158-1-R00 [0,1,0,0,0,0|1,0,0]=2 10 B8R0.6 CCCCOC(=O)C=O 2129-1-0S [0,1,0,0,0,0|1,0,1]=3 11 B8R0.6 CCCSCC(=O)OC 6166-1-0C [0,1,0,0,0,0|1,0,0]=2 12 B8R0.6 CNCCCC(=O)OC 4133-5-00 [0,1,0,0,0,0|1,0,0]=2 13 B8R0.6 COC(=O)OCCCF 2128-3-97 [0,1,0,0,0,0|2,0,0]=3 14 B8R0.9 C=CC(=O)OCC(C)O 2124-1-02 [0,1,0,0,0,0|1,0,2]=4 15 B8R0.9 CCC(=O)NCC(C)C 4148-1-0W [0,1,0,0,0,0|1,0,0]=2 16 B8R0.19 COC(=O)C[C@@H](O)CCl 2129-5-R0 [0,1,0,0,0,0|2,0,0]=3 17 B8R1.1 C=CC1COC(=O)C1 2H25-1-2G [0,0,0,1,0,0|1,0,2]=4 18 B8R1.1 CCN1CC[C@H](N)C1 3H33-5-24 [0,0,0,1,0,0|2,0,1]=4 19 B8R1.1 CN1CCC(CCl)C1 3H32-5-HY [0,0,0,1,0,0|3,0,0]=4 20 B8R1.1 CN1CC[C@@H](CO)C1 4H56-1-RZ [0,0,0,1,0,0|3,0,0]=4 21 B8R1.1 CN1CC[C@H](CN)C1 3H30-1-DU [0,0,0,1,0,0|3,0,0]=4 22 B8R1.1 NCC1CNC(=O)C1 4H48-1-HY [0,0,0,1,0,0|2,0,0]=3 23 B8R1.1 NCC1CNC(=O)C1 4H48-5-B2 [0,0,0,1,0,0|2,0,0]=3 24 B8R1.1 NC[C@@H]1CCC(=O)N1 4H48-1-S0 [0,0,0,1,0,0|2,0,0]=3 25 B8R1.1 NC[C@@H]1CNC(=O)C1 4H48-1-RC [0,0,0,1,0,0|2,0,0]=3 26 B8R1.1 NC[C@@H]1CNC(=O)C1 4H48-5-R7 [0,0,0,1,0,0|2,0,0]=3 27 B8R1.2 CC[C@@H]1CCCCN1 3H31-5-RC [0,0,0,1,0,0|1,0,1]=3 28 B8R1.2 CC[C@@H]1CNCCO1 4H56-1-R50 [0,0,0,1,0,0|1,0,2]=4 29 B8R1.2 CC[C@H]1CNCCO1 4H56-1-S50 [0,0,0,1,0,0|1,0,2]=4 30 B8R1.2 COC1CCCCC1 2207-1-07 [0,0,0,1,0,0|2,0,1]=4 31 B8R1.2 OC[C@H]1CCCCN1 4H01-1-R3 [0,0,0,1,0,0|2,0,1]=4 32 B8R1.3 CN1CCC(Br)CC1 3H32-9-AF [0,0,0,1,0,0|2,0,1]=4 33 B8R1.3 N[C@H]1CCC(=O)NC1 4H48-5-SH [0,0,0,1,0,0|2,0,0]=3 34 B8R1.3 O=C1CCC(Br)CC1 2217-9-01 [0,0,0,1,0,0|1,0,0]=2 35 B8R1.3 O=C1CCC(F)CC1 2217-3-06 [0,0,0,1,0,0|1,0,0]=2 36 B8R1.5 CC1COCCC1=O 2H17-1-79 [0,0,0,1,0,0|1,0,0]=2 37 B8R1.5 C[C@@H]1CNCCN1C 3H31-1-R0 [0,0,0,1,0,0|3,0,0]=4 38 B8R1.5 C[C@H]1CNCCN1C 3H31-1-S0 [0,0,0,1,0,0|3,0,0]=4 39 B8R1.5 O=C1CCOCC1Cl 2H17-5-24 [0,0,0,1,0,0|2,0,0]=3 40 B8R1.10 CNCCC1CCC1 3231-1-07 [0,0,0,1,0,0|2,0,1]=4 41 B8R1.22 C=C1OCCCCO1 2H10-1-71 [0,0,0,1,0,0|3,0,0]=4 42 B8R1.22 CC1CCCCCN1 3H31-1-F4 [0,0,0,1,0,0|2,0,1]=4 43 B8R1.38 NC(CO)C1CCC1 4256-5-57 [0,0,0,1,0,0|2,0,1]=4 44 B8R1.38 N[C@@H](CO)C1CCC1 4256-5-R1 [0,0,0,1,0,0|2,0,1]=4 45 B8R1.38 N[C@H](CO)C1CCC1 4256-5-S1 [0,0,0,1,0,0|2,0,1]=4 46 B8R1.38 O=C(CBr)C1CCC1 2217-9-0A [0,0,0,1,0,0|1,0,0]=2 47 B8R1.47 CCN1CC(CN)C1 3H30-1-LG [0,0,0,1,0,0|3,0,0]=4 48 B5R0.1 NCCC(N)=O 4148-5-0C [2,0,0,0,0,0|2,0,0]=4 49 B5R0.2 CNCCSC 7166-5-02 [2,0,0,0,0,0|2,0,0]=4 50 B5R0.2 FCCCCF 1100-3-44 [2,0,0,0,0,0|2,0,0]=4 51 B5R0.2 NCCCCCl 3130-5-07 [2,0,0,0,0,0|2,0,0]=4 52 B7R0.2 CC(C)CC(=O)CBr 2117-9-09 [1,1,0,0,0,0|1,0,0]=3 53 B7R0.2 CC(C)NC(=O)CBr 4148-9-0A [1,1,0,0,0,0|2,0,0]=4 54 B7R0.10 CN[C@H](C)C(=O)OC 4158-5-RJ [1,1,0,0,0,0|2,0,0]=4 55 B7R0.10 COC(=O)C(O)CN 4158-5-50 [1,1,0,0,0,0|2,0,0]=4 56 B7R0.10 COC(=O)[C@H](C)CO 2129-1-RC [1,1,0,0,0,0|2,0,0]=4 57 B7R0.4 CNCCOC(C)=O 4133-5-03 [1,1,0,0,0,0|1,0,0]=3 58 B7R0.4 O=C(Cl)OCCCF 2123-7-29 [1,1,0,0,0,0|2,0,0]=4 59 B7R0.4 O=C(O)CCCCO 2120-1-00 [1,1,0,0,0,0|1,0,0]=3 60 B7R0.1 CCCCSCCO 6166-1-0L [1,1,0,0,0,0|1,0,0]=3 61 B9R0.5 CCOC(=O)CCCC#N 4137-1-0Y [0,2,0,0,0,0|0,0,1]=3 62 B9R0.5 CCOC(=O)OCCCF 2128-3-A7 [0,2,0,0,0,0|1,0,0]=3 63 B9R0.5 [C-]#[N+]CCCC(=O)OCC 4137-1-0Q [0,2,0,0,0,0|0,0,1]=3 64 B9R0.34 CCOC(=O)CC(O)CCl 2129-5-07 [0,2,0,0,0,0|1,0,0]=3 65 B9R0.34 CCOC(=O)CC(O)CI 2129-H-02 [0,2,0,0,0,0|1,0,0]=3 66 B9R0.27 CCC(=O)C(C)C(=O)OC 2129-1-1F [0,2,0,0,0,0|1,0,1]=4 67 B9R0.27 CCC(C)C(C)C(C)CC 1100-1-X4 [0,2,0,0,0,0|1,0,1]=4 68 B9R0.24 CCC(C)CCC(C)CC 1100-1-X1 [0,2,0,0,0,0|1,0,1]=4 69 B9R0.24 CC[C@@H](O)CC[C@H](O)CC 2104-1-0G [0,2,0,0,0,0|0,0,2]=4 70 B9R0.24 COC(=O)CCS(=O)OC 6165-1-07 [0,2,0,0,0,0|2,0,0]=4 71 B9R0.46 COC(=O)CCCN=[N+]=[N-] 4142-1-00 [0,2,0,0,0,0|2,0,0]=4 72 B9R0.47 CCCCCC(C)C(C)C 1100-1-08 [0,2,0,0,0,0|1,0,1]=4 73 B9R0.50 CCN(CC)CCCCBr 3132-9-01 [0,2,0,0,0,0|2,0,0]=4 74 B9R0.50 CCN(CC)CCCCCl 3132-5-09 [0,2,0,0,0,0|2,0,0]=4 75 B9R0.22 CCC(C)CC(C)(C)CC 1100-1-15 [0,2,0,0,0,0|1,0,1]=4 76 B7R1.2 CC1COC(=O)N1 4H56-1-0P2 [1,0,0,1,0,0|2,0,0]=4 77 B7R1.2 NC1CNC(=O)C1 4H48-1-6A [1,0,0,1,0,0|2,0,0]=4 78 B7R1.2 N[C@@H]1CNC(=O)C1 4H48-5-S0 [1,0,0,1,0,0|2,0,0]=4 79 B7R1.4 O=C1CCCC1Br 2215-9-00 [1,0,0,1,0,0|1,0,0]=3 80 B7R1.4 O=C1OCC[C@@H]1O 2H29-1-S0 [1,0,0,1,0,0|2,0,0]=4 81 B7R1.8 O=C1CCC1CO 2220-1-06 [1,0,0,1,0,0|1,0,0]=3 82 B7R1.12 CC1CC1C(N)=O 4248-1-12 [1,0,0,1,0,0|1,0,0]=3 83 B7R1.12 C[C@@H]1C[C@H]1C(=O)O 2221-1-31 [1,0,0,1,0,0|1,0,0]=3 84 B7R1.12 C[C@H]1C[C@@H]1C(=O)O 2221-1-12 [1,0,0,1,0,0|1,0,0]=3 85 B7R1.14 CC1(N)CCCC1 3230-5-22 [1,0,0,1,0,0|1,0,1]=4 86 B7R1.14 N=S1(=O)CCCC1 8H69-1-3T [1,0,0,1,0,0|2,0,0]=4 87 B7R1.18 CC(N)C1CCC1 3230-5-0B [1,0,0,1,0,0|1,0,1]=4 88 B7R1.18 NC(=O)C1CCN1 4H48-5-2R [1,0,0,1,0,0|2,0,0]=4 89 B7R1.18 O=C(O)C1CCO1 2H21-1-68 [1,0,0,1,0,0|2,0,0]=4 90 B7R1.18 O=C(O)C1CSC1 6H66-1-63 [1,0,0,1,0,0|2,0,0]=4 91 B7R1.20 NC(=S)CC1CC1 7267-1-05 [1,0,0,1,0,0|1,1,0]=4 92 B7R1.24 C1=CCCNCC1 3H31-5-9D [1,0,0,1,0,0|1,0,1]=4 93 B9R1.2 CCC1CCCC(O)C1 2202-1-13 [0,1,0,1,0,0|0,0,2]=4 94 B9R1.2 O=C1CC(CO)CCN1 4H56-1-042 [0,1,0,1,0,0|1,0,0]=3 95 B9R1.2 O=C1CCCC(CO)C1 2220-1-01 [0,1,0,1,0,0|1,0,0]=3 96 B9R1.7 CN1CCC(CCO)C1 4H56-1-782 [0,1,0,1,0,0|2,0,0]=4 97 B9R1.8 CCC[C@@H]1CCCCN1 3H31-5-RD [0,1,0,1,0,0|1,0,1]=4 98 B9R1.8 CCC[C@H]1CCCCN1 3H31-5-SD [0,1,0,1,0,0|1,0,1]=4 99 B9R1.8 OCC[C@@H]1CCCCN1 4H56-1-S20 [0,1,0,1,0,0|1,0,1]=4 100 B9R1.8 OCC[C@@H]1CCCCN1 4H56-5-SD [0,1,0,1,0,0|1,0,1]=4 101 B9R1.15 CCN1CCNCC1=O 4H48-1-00D [0,1,0,1,0,0|1,0,0]=3 102 B9R1.15 CN[C@@H]1CCCC[C@H]1O 4256-5-37 [0,1,0,1,0,0|0,0,2]=4 103 B9R1.15 COC1COCCC1=O 2H17-1-84 [0,1,0,1,0,0|1,0,0]=3 104 B9R1.15 NC[C@@H]1CCCC[C@H]1N 3230-1-00 [0,1,0,1,0,0|1,0,1]=4 105 B9R1.33 O=C1NCCN1CCCl 4H53-5-0L [0,1,0,1,0,0|2,0,0]=4 106 B9R1.49 CN1CCCC(N)CC1 3H32-1-AY [0,1,0,1,0,0|1,0,1]=4 107 B9R1.50 O=C1NCCCCCN1 4H53-1-0G [0,1,0,1,0,0|1,0,0]=3 108 B9R1.73 CCOC(=O)C1CCC1 2223-1-55 [0,1,0,1,0,0|0,0,0]=2 109 B9R1.5 CC1CCNCCN1C 3H31-1-9T [0,1,0,1,0,0|2,0,0]=4 110 B9R1.5 N[C@@H]1CCCCC[C@H]1O 4256-1-47 [0,1,0,1,0,0|0,0,2]=4 111 B9R1.11 CNC(=O)C1CCNC1 4H48-5-FZ [0,1,0,1,0,0|1,0,0]=3 112 B9R1.11 CNC(=O)[C@@H]1CCCN1 4H48-5-SF [0,1,0,1,0,0|1,0,0]=3 113 B9R1.11 COC(=O)[C@@H]1CCCO1 2H23-1-S2 [0,1,0,1,0,0|1,0,0]=3 114 B9R1.82 COC(=O)C1CC(Br)C1 2223-9-05 [0,1,0,1,0,0|1,0,0]=3 115 B9R1.82 COC(=O)[C@H]1C[C@H](Br)C1 2223-9-00 [0,1,0,1,0,0|1,0,0]=3 116 B9R1.82 O=C(CCl)N1CC(O)C1 4H48-5-DZ [0,1,0,1,0,0|2,0,0]=4 117 B9R1.88 COC(=O)C1CC1CN 4258-5-14 [0,1,0,1,0,0|1,0,0]=3 118 B9R1.186 COC(=O)C1(C)CCN1 4H23-5-2Z [0,1,0,1,0,0|2,0,0]=4 119 B9R1.186 COC(=O)C1(C)CNC1 4H58-5-3V [0,1,0,1,0,0|2,0,0]=4 120 B9R1.186 COC(=O)C1(C)COC1 2H23-1-0Q [0,1,0,1,0,0|2,0,0]=4 121 B9R1.186 COC(=O)C1(F)CNC1 4H58-7-43 [0,1,0,1,0,0|2,0,0]=4 122 B9R1.186 COC(=O)C1(N)COC1 4H58-1-AJ [0,1,0,1,0,0|2,0,0]=4 123 B9R1.1 CC1CCC(CCl)CC1 1200-6-00 [0,1,0,1,0,0|1,0,1]=4 124 B9R1.1 CN1CCC(CBr)CC1 3H32-9-5T [0,1,0,1,0,0|2,0,0]=4 125 B9R1.1 COC1CCC(N)CC1 4233-5-04 [0,1,0,1,0,0|1,0,1]=4 126 B9R1.1 NC[C@H]1CC[C@H](O)CC1 4256-5-46 [0,1,0,1,0,0|0,0,2]=4 127 B9R1.81 COC(=O)[C@H]1CC[C@@H]1N 4258-5-E1 [0,1,0,1,0,0|1,0,0]=3 128 B9R1.89 CCN1CCCCCC1 3H32-1-FY [0,1,0,1,0,0|2,0,0]=4 129 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 2229-1-R2 [0,1,0,1,0,0|1,0,1]=4 130 B9R1.35 O=C1CC[C@H](C(=O)O)C1 2229-1-S2 [0,1,0,1,0,0|1,0,1]=4 131 B9R1.106 CC1(C)C(=O)NCC1N 4H48-1-HR [0,1,0,1,0,0|2,0,0]=4 132 B9R1.110 CN(C)C(=O)C1CCN1 4H48-5-2S [0,1,0,1,0,0|2,0,0]=4 133 B9R1.10 CC1(C)CCC(N)CC1 3230-5-24 [0,1,0,1,0,0|1,0,1]=4 134 B9R1.10 CC1(O)CCC(N)CC1 4256-1-67 [0,1,0,1,0,0|1,0,1]=4 135 B9R1.10 C[C@]1(O)CC[C@H](N)CC1 4256-1-50 [0,1,0,1,0,0|1,0,1]=4 136 B9R1.10 O=C1CCC(F)(F)CN1 4H48-3-3G [0,1,0,1,0,0|2,0,0]=4 137 B9R2.39 [C@H]12CC[C@@H](C1)[C@@H](N)C2 3233-5-05 [0,0,0,2,0,0|1,0,1]=4 138 B9R2.139 O=C1CC2(CC2)CO1 2H25-1-2H [0,0,0,2,0,0|1,0,0]=3 139 B9R2.49 C1CC2CCC1CN2 3H31-5-0B [0,0,0,2,0,0|1,0,1]=4 140 B9R2.7 O=C1N[C@@H]2CCC[C@H]12 4H48-1-Z10 [0,0,0,2,0,0|1,0,0]=3 141 B9R2.7 [C@H]12C=CC[C@H]1C(=O)C2 2417-1-15 [0,0,0,2,0,0|0,0,2]=4