0 B7R1.2 CC1CCC(C)N1 3H31-5-0R [0,0,0,0,0,0|2,0,1]=3 1 B7R1.2 CC1CNC(=S)N1 7H67-1-34 [0,0,0,0,0,0|2,1,0]=3 2 B7R1.2 CC1COC(=O)N1 4H56-1-0P2 [0,0,0,0,0,0|2,0,0]=2 3 B7R1.2 CN1CC[C@@H](N)C1 3H30-1-R1 [0,0,0,0,0,0|3,0,1]=4 4 B7R1.2 CN1CC[C@H](N)C1 3H30-1-S0 [0,0,0,0,0,0|3,0,1]=4 5 B7R1.2 NC1CNC(=O)C1 4H48-1-6A [0,0,0,0,0,0|3,0,0]=3 6 B7R1.2 N[C@@H]1CC[C@H](O)C1 4256-5-40 [0,0,0,0,0,0|2,0,2]=4 7 B7R1.2 N[C@@H]1CNC(=O)C1 4H48-5-S0 [0,0,0,0,0,0|3,0,0]=3 8 B7R1.2 N[C@H]1CC[C@@H](O)C1 4256-5-44 [0,0,0,0,0,0|2,0,2]=4 9 B7R1.2 N[C@H]1CC[C@H](O)C1 4256-5-45 [0,0,0,0,0,0|2,0,2]=4 10 B7R1.2 O[C@H]1CC[C@@H](O)C1 2204-1-0D [0,0,0,0,0,0|2,0,2]=4 11 B6R1.2 C[C@H]1CCCN1 3H31-1-S2 [1,0,0,0,0,0|1,0,1]=3 12 B6R1.2 I[C@H]1CCOC1 2H10-H-S1 [1,0,0,0,0,0|3,0,0]=4 13 B6R1.2 O=C1CCNN1 4H48-5-FV [1,0,0,0,0,0|2,0,0]=3 14 B8R1.1 C=CC1COC(=O)C1 2H25-1-2G [0,1,0,0,0,0|2,0,1]=4 15 B8R1.1 CN1CCC(CCl)C1 3H32-5-HY [0,1,0,0,0,0|3,0,0]=4 16 B8R1.1 CN1CC[C@@H](CO)C1 4H56-1-RZ [0,1,0,0,0,0|3,0,0]=4 17 B8R1.1 CN1CC[C@H](CN)C1 3H30-1-DU [0,1,0,0,0,0|3,0,0]=4 18 B8R1.1 NCC1CNC(=O)C1 4H48-1-HY [0,1,0,0,0,0|2,0,0]=3 19 B8R1.1 NCC1CNC(=O)C1 4H48-5-B2 [0,1,0,0,0,0|2,0,0]=3 20 B8R1.1 NC[C@@H]1CCC(=O)N1 4H48-1-S0 [0,1,0,0,0,0|1,0,0]=2 21 B8R1.1 NC[C@@H]1CNC(=O)C1 4H48-1-RC [0,1,0,0,0,0|2,0,0]=3 22 B8R1.1 NC[C@@H]1CNC(=O)C1 4H48-5-R7 [0,1,0,0,0,0|2,0,0]=3 23 B8R1.18 C[C@@H]1NC(=O)OC1=O 4H56-1-S0C [0,1,0,0,0,0|2,0,1]=4 24 B8R1.51 O=C1CCS(=O)(=O)C1 6H63-1-09 [0,1,0,0,0,0|3,0,0]=4 25 B6R0.1 CCC(C)CNC 3131-5-05 [0,0,1,0,0,0|3,0,0]=4 26 B6R0.1 CCNC(=O)CBr 4148-9-03 [0,0,1,0,0,0|2,0,0]=3 27 B6R0.2 CC(=O)OC(C)Cl 2123-5-21 [0,0,1,0,0,0|1,0,0]=2 28 B6R0.4 C=CCCC(C)Br 1300-9-21 [0,0,1,0,0,0|2,0,0]=3 29 B6R0.4 CC(C)CCON 4147-5-07 [0,0,1,0,0,0|3,0,0]=4 30 B6R0.4 O=C(O)\C=C\CCl 2321-5-03 [0,0,1,0,0,0|1,0,2]=4 31 B8R2.34 C1CC2CCC1N2 3H31-1-0Z [0,0,0,1,0,0|2,0,1]=4 32 B6R1.4 N[C@@H]1CC[C@@H]1O 4256-5-Z2 [0,0,0,0,1,0|1,0,2]=4 33 B6R1.5 C=C1CC(N)C1 3330-5-00 [0,0,0,0,1,0|3,0,0]=4 34 B6R1.5 CN1CC(=O)C1 4H17-5-2E [0,0,0,0,1,0|2,0,0]=3 35 B6R1.5 C[C@H]1C[C@@H](N)C1 3230-5-Z1 [0,0,0,0,1,0|2,0,1]=4 36 B6R1.5 O=C1CC(Br)C1 2217-9-03 [0,0,0,0,1,0|2,0,0]=3 37 B6R1.5 O=C1CC(F)C1 2217-3-0D [0,0,0,0,1,0|2,0,0]=3 38 B6R1.5 O=C1CC(O)C1 2220-1-00 [0,0,0,0,1,0|2,0,0]=3 39 B8R1.3 N[C@H]1CCC(=O)NC1 4H48-5-SH [0,0,0,0,0,1|2,0,0]=3 40 B8R1.3 O=C1CCC(Br)CC1 2217-9-01 [0,0,0,0,0,1|2,0,0]=3 41 B8R1.3 O=C1CCC(F)CC1 2217-3-06 [0,0,0,0,0,1|2,0,0]=3 42 B8R1.4 CC1CCNC(C)C1 3H33-5-1C [0,0,0,0,0,1|2,0,1]=4 43 B8R1.4 C[C@@H]1CN(C)CCN1 4H22-1-67 [0,0,0,0,0,1|3,0,0]=4 44 B8R1.4 C[C@@H]1C[C@H](O)CCN1 4H56-5-R7 [0,0,0,0,0,1|1,0,2]=4 45 B8R1.4 C[C@H]1CNC[C@H](C)O1 4H31-1-2B [0,0,0,0,0,1|1,0,1]=3 46 B8R1.4 C[C@H]1C[C@@H](O)CCN1 4H56-5-1R [0,0,0,0,0,1|1,0,2]=4 47 B8R1.4 O=C1CCCC(Br)C1 2217-9-0B [0,0,0,0,0,1|2,0,0]=3 48 B8R1.4 O=C1CCCC(Cl)C1 2217-5-08 [0,0,0,0,0,1|2,0,0]=3 49 B8R1.4 O=C1CSCC(=O)C1 6H18-1-01 [0,0,0,0,0,1|2,0,1]=4 50 B5R0.1 C=CCC(C)N 3230-5-0A [1,0,1,0,0,0|1,0,1]=4 51 B5R0.1 NCCC(N)=O 4148-5-0C [1,0,1,0,0,0|2,0,0]=4 52 B5R0.2 CCO\C=C/Br 2307-9-01 [1,0,1,0,0,0|1,0,1]=4 53 B7R0.2 CC(C)CC(=O)CBr 2117-9-09 [0,1,1,0,0,0|2,0,0]=4 54 B7R0.2 CC(C)NC(=O)CBr 4148-9-0A [0,1,1,0,0,0|2,0,0]=4 55 B7R0.2 CC(CCl)CC(=O)Cl 2116-5-20 [0,1,1,0,0,0|2,0,0]=4 56 B7R0.16 CC(C)C(F)C(=O)O 2121-3-0K [0,1,1,0,0,0|2,0,0]=4 57 B7R0.4 CNCCOC(C)=O 4133-5-03 [0,1,1,0,0,0|2,0,0]=4 58 B7R0.4 O=C(Cl)OCCCF 2123-7-29 [0,1,1,0,0,0|2,0,0]=4 59 B7R0.4 O=C(O)CCCCO 2120-1-00 [0,1,1,0,0,0|0,0,0]=2 60 B7R1.1 BrC[C@H]1CCCO1 2H10-9-R1 [1,1,0,0,0,0|0,0,1]=3 61 B7R1.1 CN[C@@H]1CCNC1 3H31-5-RK [1,1,0,0,0,0|2,0,0]=4 62 B7R1.1 FC[C@@H]1CCCN1 3H31-7-58 [1,1,0,0,0,0|1,0,1]=4 63 B7R1.1 NC[C@@H]1CCOC1 4H56-1-S15 [1,1,0,0,0,0|2,0,0]=4 64 B7R1.1 NC[C@H]1CCCN1 3H30-1-2R [1,1,0,0,0,0|1,0,1]=4 65 B7R1.1 NC[C@H]1CCOC1 4H56-1-R07 [1,1,0,0,0,0|2,0,0]=4 66 B7R1.1 NC[C@H]1CCOC1 4H56-5-RC [1,1,0,0,0,0|2,0,0]=4 67 B7R1.1 OC[C@@H]1CCOC1 2H10-1-S0 [1,1,0,0,0,0|2,0,0]=4 68 B7R1.4 O=C1CCCC1Br 2215-9-00 [1,1,0,0,0,0|1,0,0]=3 69 B7R1.4 O=C1OCC[C@@H]1O 2H29-1-S0 [1,1,0,0,0,0|0,0,0]=2 70 B7R1.14 CC1(N)CCCC1 3230-5-22 [1,1,0,0,0,0|1,0,1]=4 71 B7R1.14 N=S1(=O)CCCC1 8H69-1-3T [1,1,0,0,0,0|2,0,0]=4 72 B7R1.8 O=C1CCC1CO 2220-1-06 [0,1,0,0,1,0|0,0,0]=2 73 B7R1.17 CC1(C)CCC1=O 2217-1-0L [0,1,0,0,1,0|0,0,0]=2 74 B7R1.17 CC1(C)CCC1O 2202-1-0E [0,1,0,0,1,0|0,0,2]=4 75 B7R1.10 COC1CC(=O)C1 2217-1-0B [0,1,0,0,1,0|1,0,0]=3 76 B7R1.10 O=C1CC(CCl)C1 2217-5-07 [0,1,0,0,1,0|1,0,0]=3 77 B7R1.16 CC1(C)CC(=O)C1 2217-1-0K [0,1,0,0,1,0|1,0,0]=3 78 B7R1.16 CC1(N)CC(=O)C1 4256-5-0F [0,1,0,0,1,0|1,0,0]=3 79 B9R1.10 O=C1CCC(F)(F)CN1 4H48-3-3G [0,1,0,0,0,1|2,0,0]=4 80 B9R1.69 CN1CCC(=O)NC1=O 4H18-1-33 [0,1,0,0,0,1|2,0,0]=4 81 B9R1.69 O=C1CCC(Br)C(=O)N1 4H48-9-99 [0,1,0,0,0,1|2,0,0]=4 82 B9R1.2 CSC1=NC(=O)CCN1 8H66-1-8S [0,1,0,0,0,1|1,0,1]=4 83 B9R1.2 O=C1CC(CO)CCN1 4H56-1-042 [0,1,0,0,0,1|1,0,0]=3 84 B9R1.2 O=C1CCCC(CO)C1 2220-1-01 [0,1,0,0,0,1|1,0,0]=3 85 B9R1.34 CC1CC(=O)CC(C)N1 4H17-5-1U [0,1,0,0,0,1|1,0,0]=3 86 B9R1.35 O=C1CCC(C(=O)Cl)N1 4H48-5-DJ [0,2,0,0,0,0|1,0,1]=4 87 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 2229-1-R2 [0,2,0,0,0,0|1,0,1]=4 88 B9R1.35 O=C1CC[C@H](C(=O)O)C1 2229-1-S2 [0,2,0,0,0,0|1,0,1]=4 89 B7R1.27 CCC1(C)ON1C 4H56-1-03N [0,0,1,1,0,0|2,0,0]=4 90 B7R1.12 CC1CC1C(N)=O 4248-1-12 [0,0,1,1,0,0|2,0,0]=4 91 B7R1.12 C[C@@H]1C[C@H]1C(=O)O 2221-1-31 [0,0,1,1,0,0|2,0,0]=4 92 B7R1.12 C[C@H]1C[C@@H]1C(=O)O 2221-1-12 [0,0,1,1,0,0|2,0,0]=4 93 B7R1.18 CC(O)C1CNC1 4H02-5-0E [0,0,1,1,0,0|2,0,0]=4 94 B7R1.18 NC(=O)C1CCN1 4H48-5-2R [0,0,1,1,0,0|2,0,0]=4 95 B7R1.18 O=C(O)C1CCO1 2H21-1-68 [0,0,1,1,0,0|1,0,0]=3 96 B7R1.18 O=C(O)C1CSC1 6H66-1-63 [0,0,1,1,0,0|1,0,0]=3 97 B7R2.11 C1NC2CC1C2 3H31-5-0M [1,0,0,1,0,0|1,0,1]=4 98 B9R2.139 O=C1CC2(CC2)CO1 2H25-1-2H [0,1,0,1,0,0|2,0,0]=4 99 B5R0.5 CC(C)C(C)O 2102-1-03 [0,0,1,0,1,0|0,0,2]=4 100 B5R1.2 CC1CCN1 3H31-5-4U [1,0,0,0,1,0|1,0,0]=3 101 B5R1.2 IC1CCC1 1200-H-02 [1,0,0,0,1,0|1,0,1]=4