0 B5R0.2 CCNCCF AIFCHEM-94537421854 [1,0,0,0,0,0|2,0,0]=3 1 B7R0.3 CCCNC(=O)CO AIFCHEM-94532683616 [0,1,0,0,0,0|1,0,2]=4 2 B7R0.3 CCNCC(=O)NC AIFCHEM-94562545297 [0,1,0,0,0,0|1,0,2]=4 3 B7R0.3 CCNCC(O)CO AIFCHEM-94537423573 [0,1,0,0,0,0|1,0,0]=2 4 B7R0.3 CCNC[C@@H](O)CO AIFCHEM-94537424167 [0,1,0,0,0,0|1,0,0]=2 5 B7R0.3 CCNC[C@H](O)CO AIFCHEM-94537423528 [0,1,0,0,0,0|1,0,0]=2 6 B7R0.5 CCN[C@H](C)C(C)C AIFCHEM-94576822751 [0,1,0,0,0,0|2,0,0]=3 7 B7R0.7 CCNC(C)CCO AIFCHEM-94537419746 [0,1,0,0,0,0|2,0,0]=3 8 B7R0.7 CCN[C@@H](C)CCO AIFCHEM-94537423556 [0,1,0,0,0,0|2,0,0]=3 9 B7R0.7 CCN[C@H](C)CCO AIFCHEM-94537423557 [0,1,0,0,0,0|2,0,0]=3 10 B7R0.11 CCNC(C)(C)CO AIFCHEM-94576816069 [0,1,0,0,0,0|3,0,0]=4 11 B7R0.12 CCN(CC)CCO AIFCHEM-94537412135 [0,1,0,0,0,0|3,0,0]=4 12 B7R0.12 CCNC(CC)CC AIFCHEM-94537423572 [0,1,0,0,0,0|2,0,0]=3 13 B7R0.12 CCNC(CC)CO AIFCHEM-94537427642 [0,1,0,0,0,0|1,0,0]=2 14 B7R0.12 CCN[C@@H](CC)CO AIFCHEM-94537423216 [0,1,0,0,0,0|1,0,0]=2 15 B7R0.12 CCN[C@H](CC)CO AIFCHEM-94537423217 [0,1,0,0,0,0|1,0,0]=2 16 B7R1.5 CCNC1CC1F AIFCHEM-94597362816 [0,0,0,1,0,0|3,0,0]=4 17 B7R1.5 CCN[C@@H]1C[C@@H]1F AIFCHEM-94537415225 [0,0,0,1,0,0|3,0,0]=4 18 B7R1.5 CCN[C@@H]1C[C@H]1C AIFCHEM-94559010888 [0,0,0,1,0,0|2,0,0]=3 19 B7R1.5 CCN[C@@H]1C[C@H]1F AIFCHEM-94537412393 [0,0,0,1,0,0|3,0,0]=4 20 B7R1.5 CCN[C@H]1C[C@@H]1F AIFCHEM-94537416447 [0,0,0,1,0,0|3,0,0]=4 21 B7R1.5 CCN[C@H]1C[C@H]1F AIFCHEM-94537415224 [0,0,0,1,0,0|3,0,0]=4 22 B7R1.10 CCN1CC(C1)C AIFCHEM-94537427297 [0,0,0,1,0,0|2,0,0]=3 23 B6R0.4 CCNCC(C)C AIFCHEM-94537422162 [1,1,0,0,0,0|1,0,0]=3 24 B6R0.6 CCCNCCO AIFCHEM-94577775848 [1,1,0,0,0,0|1,0,0]=3 25 B6R0.6 CCNCCCO AIFCHEM-94537415438 [1,1,0,0,0,0|1,0,0]=3 26 B8R0.5 CC(C)CN(C)CCO AIFCHEM-94548507073 [0,2,0,0,0,0|2,0,0]=4 27 B8R0.5 CCCN(C)CC(C)O AIFCHEM-94569013631 [0,2,0,0,0,0|2,0,0]=4 28 B8R0.16 CCN(CC)C[C@H](C)O AIFCHEM-94537424757 [0,2,0,0,0,0|2,0,0]=4 29 B8R0.19 CCC(C)CN(C)CC AIFCHEM-94563261342 [0,2,0,0,0,0|1,0,0]=3 30 B8R0.24 CCN(C)CC(C)(C)O AIFCHEM-94537424326 [0,2,0,0,0,0|2,0,0]=4 31 B8R0.1 CCCCN(C)CCC AIFCHEM-94523040043 [0,2,0,0,0,0|2,0,0]=4 32 B8R0.1 CCCN(C)CCSC AIFCHEM-94607179096 [0,2,0,0,0,0|2,0,0]=4 33 B8R0.1 CCCNC(=O)COC AIFCHEM-5791287162 [0,2,0,0,0,0|0,0,2]=4 34 B8R0.1 COCC(C)NCCO AIFCHEM-94577779767 [0,2,0,0,0,0|2,0,0]=4 35 B8R0.6 CCC(=O)NCCOC AIFCHEM-94526499594 [0,2,0,0,0,0|0,0,2]=4 36 B8R0.6 CCC(C)CNCCF AIFCHEM-5871243420 [0,2,0,0,0,0|1,0,0]=3 37 B8R0.6 CCCNCC(O)CO AIFCHEM-94569020656 [0,2,0,0,0,0|1,0,0]=3 38 B8R0.6 CCCNC[C@@H](O)CO AIFCHEM-94569021250 [0,2,0,0,0,0|1,0,0]=3 39 B8R0.6 CCCNC[C@H](O)CO AIFCHEM-94521369678 [0,2,0,0,0,0|1,0,0]=3 40 B8R0.6 CCN(C)CCCCO AIFCHEM-94537421494 [0,2,0,0,0,0|2,0,0]=4 41 B8R0.8 CC(C)C(C)NCCO AIFCHEM-94522506272 [0,2,0,0,0,0|2,0,0]=4 42 B8R0.8 CCCNC(C)C(C)O AIFCHEM-94547073103 [0,2,0,0,0,0|1,0,0]=3 43 B8R0.9 CC(C)CNC(C)CO AIFCHEM-6145692687 [0,2,0,0,0,0|2,0,0]=4 44 B8R0.9 CC(C)CN[C@@H](C)CO AIFCHEM-94572978911 [0,2,0,0,0,0|2,0,0]=4 45 B8R0.9 CC(C)CN[C@H](C)CO AIFCHEM-94572979978 [0,2,0,0,0,0|2,0,0]=4 46 B8R0.11 CCCNC(CO)CO AIFCHEM-94569022033 [0,2,0,0,0,0|1,0,0]=3 47 B8R0.11 CCNCC(OC)OC AIFCHEM-94537418718 [0,2,0,0,0,0|1,0,0]=3 48 B8R0.11 OCC(CO)NCCF AIFCHEM-94606750251 [0,2,0,0,0,0|2,0,0]=4 49 B8R0.11 OCCNC(CO)CO AIFCHEM-94606744085 [0,2,0,0,0,0|2,0,0]=4 50 B8R0.14 CCNC(C)C(C)(C)C AIFCHEM-94537421030 [0,2,0,0,0,0|2,0,0]=4 51 B8R0.14 CCN[C@@H](C)C(C)(C)C AIFCHEM-94537418739 [0,2,0,0,0,0|2,0,0]=4 52 B8R0.14 CCN[C@H](C)C(C)(C)C AIFCHEM-94537420101 [0,2,0,0,0,0|2,0,0]=4 53 B8R0.15 CCCN(CC)C(=O)C AIFCHEM-99350620485 [0,2,0,0,0,0|1,0,1]=4 54 B8R0.15 CCN[C@@H](CC)[C@@H](C)O AIFCHEM-94537421997 [0,2,0,0,0,0|1,0,0]=3 55 B8R0.22 CCC[C@@H](CO)NCC AIFCHEM-94607957860 [0,2,0,0,0,0|0,0,0]=2 56 B8R0.22 CCC[C@H](CO)NCC AIFCHEM-94537425599 [0,2,0,0,0,0|0,0,0]=2 57 B8R0.22 CCN(CCO)CCO AIFCHEM-94537415530 [0,2,0,0,0,0|2,0,0]=4 58 B8R1.9 CCNC[C@@H]1C[C@H]1C AIFCHEM-94537417631 [0,1,0,1,0,0|1,0,0]=3 59 B8R1.10 CCCNC1CCC1 AIFCHEM-94576044199 [0,1,0,1,0,0|1,0,0]=3 60 B8R1.38 CCN(C)C1COC1 AIFCHEM-6097848012 [0,1,0,1,0,0|2,0,0]=4 61 B8R1.41 CCCNC1(CC1)C AIFCHEM-94569023712 [0,1,0,1,0,0|1,0,0]=3 62 B8R1.6 CCCN1CC(C1)F AIFCHEM-94569020674 [0,1,0,1,0,0|2,0,0]=4 63 B8R1.6 CCNC1CC(C1)F AIFCHEM-94537414225 [0,1,0,1,0,0|2,0,0]=4 64 B8R1.6 CCN[C@H]1C[C@@H](C1)F AIFCHEM-94537415214 [0,1,0,1,0,0|2,0,0]=4 65 B8R1.6 CCN[C@H]1C[C@H](C1)F AIFCHEM-94537415213 [0,1,0,1,0,0|2,0,0]=4 66 B8R1.8 CCNC1CCOC1 AIFCHEM-94537426578 [0,1,0,1,0,0|1,0,0]=3 67 B8R1.8 CCN[C@@H]1CCOC1 AIFCHEM-94537412237 [0,1,0,1,0,0|1,0,0]=3 68 B8R1.8 CCN[C@H]1CCOC1 AIFCHEM-94585471465 [0,1,0,1,0,0|1,0,0]=3 69 B8R1.12 CCN1CC[C@@H]1CO AIFCHEM-94554359495 [0,1,0,1,0,0|1,0,0]=3 70 B8R1.12 CCN1CC[C@H]1CO AIFCHEM-94537411744 [0,1,0,1,0,0|1,0,0]=3