0 B10R0.4 CC(=CCCCCCCBr)C S793051 [0,0,0,0,0,0|3,0,1]=4 1 B10R0.4 CC(C)CCCCCCCO PH008704 [0,0,0,0,0,0|3,0,0]=3 2 B10R0.4 CCCCCCCCC(=N)N PH012190 [0,0,0,0,0,0|4,0,0]=4 3 B10R0.4 CCCCCCCCC(=O)N S595268 [0,0,0,0,0,0|3,0,1]=4 4 B10R0.4 CCCCCCCCC(C)N T151068 [0,0,0,0,0,0|3,0,0]=3 5 B10R0.4 CCCCCCCC[N+](=O)[O-] S917680 [0,0,0,0,0,0|3,0,0]=3 6 B10R0.4 CCCCCCCNC(=O)C R704377 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.2 CCCCCCCC(C)Br S438758 [1,0,0,0,0,0|2,0,0]=3 8 B9R0.45 CCCCCCCCNC CDS003222 [1,0,0,0,0,0|2,0,0]=3 9 B9R0.45 CCCCCCCCON PH014161 [1,0,0,0,0,0|2,0,0]=3 10 B9R0.45 CCCCCCCC[Hg]Cl S572551 [1,0,0,0,0,0|3,0,0]=4 11 B9R0.45 CCCCCCSCCO S362344 [1,0,0,0,0,0|3,0,0]=4 12 B9R0.45 CCCCCNCCCC OTV000733 [1,0,0,0,0,0|3,0,0]=4 13 B9R0.45 CCCCNCCCCO PH011467 [1,0,0,0,0,0|3,0,0]=4 14 B9R0.45 CSCCCCCCSC S347825 [1,0,0,0,0,0|2,0,1]=4 15 B11R0.40 CCCCCCCCC([NH3+])CO L498629 [0,1,0,0,0,0|3,0,0]=4 16 B11R0.148 CCCCCCCCC=C(C)C T293466 [0,1,0,0,0,0|3,0,0]=4 17 B11R0.148 CCCCCCCCCC(C)Br S452572 [0,1,0,0,0,0|3,0,0]=4 18 B11R0.148 CCCCCCCCCC(C)N S540293 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.86 CC(C)C[C@H]1CCCC[C@H]1N PH018572 [0,0,0,1,0,0|2,0,0]=3 20 B11R1.91 CN(C)CCC1CCCCN1 CBR00696 [0,0,0,1,0,0|2,0,0]=3 21 B11R1.543 CC1(CCCCCCCC1)O T211540 [0,0,0,1,0,0|2,0,1]=4 22 B8R0.4 CCCCCCCSC S570729 [2,0,0,0,0,0|0,0,1]=3 23 B8R0.4 CCCCCCC[Hg]Cl S572500 [2,0,0,0,0,0|2,0,0]=4 24 B8R0.4 CCCCCSCCO S357928 [2,0,0,0,0,0|2,0,0]=4 25 B8R0.4 CCCCNCCCC S367869 [2,0,0,0,0,0|2,0,0]=4 26 B8R0.4 CCCCNCCCC S503894 [2,0,0,0,0,0|2,0,0]=4 27 B8R0.4 CCCCNCCCC S566152 [2,0,0,0,0,0|2,0,0]=4 28 B8R0.4 CCNCCCCCO PH007898 [2,0,0,0,0,0|2,0,0]=4 29 B8R0.4 CSCCCCCCO S931667 [2,0,0,0,0,0|1,0,1]=4 30 B8R0.4 CSCCCCCSC S375896 [2,0,0,0,0,0|1,0,1]=4 31 B8R0.4 NCCCOCCCN PH000107 [2,0,0,0,0,0|2,0,0]=4 32 B8R0.4 [NH2+](CCCC)CCCC S348880 [2,0,0,0,0,0|2,0,0]=4 33 B8R0.7 CC(C)CCCCCN CDS001505 [2,0,0,0,0,0|2,0,0]=4 34 B8R0.7 CCCCCCC(C)C S430935 [2,0,0,0,0,0|2,0,0]=4 35 B8R0.7 CCCCCCC(C)Cl S564516 [2,0,0,0,0,0|2,0,0]=4 36 B8R0.7 CN(C)CCCCCN CDS002923 [2,0,0,0,0,0|2,0,0]=4 37 B10R0.6 CCCCCC(O)CC(C)C S417432 [1,1,0,0,0,0|2,0,0]=4 38 B10R0.55 CC[C@H](O)CCCCC(=O)C T263230 [1,1,0,0,0,0|1,0,1]=4 39 B10R0.74 CCCCCCCC(=O)CC S544043 [1,1,0,0,0,0|1,0,1]=4 40 B10R0.74 CCCCCCCC(=O)N[O-] S756199 [1,1,0,0,0,0|2,0,0]=4 41 B10R0.74 CCCCCCCC(O)CC CDS001495 [1,1,0,0,0,0|1,0,1]=4 42 B10R0.75 CCCCCCC(C)N(C)C S336998 [1,1,0,0,0,0|2,0,0]=4 43 B10R0.75 CCCCCCC(O)C(C)C S417424 [1,1,0,0,0,0|2,0,0]=4 44 B10R0.71 C#CCCCCCCCCC CDS001229 [1,1,0,0,0,0|2,0,0]=4 45 B10R0.71 CCCCCCCCCCF S570354 [1,1,0,0,0,0|2,0,0]=4 46 B10R0.71 CCCCCCCCSCC S570656 [1,1,0,0,0,0|1,0,1]=4 47 B10R0.71 CCCCCCCSCCO S362220 [1,1,0,0,0,0|2,0,0]=4 48 B10R0.71 CCCCCCNCCCC OTV000454 [1,1,0,0,0,0|2,0,0]=4 49 B10R0.71 CCCCCCOCCCN S392022 [1,1,0,0,0,0|1,0,0]=3 50 B10R0.71 CCCCCNCCCCC S503770 [1,1,0,0,0,0|2,0,0]=4 51 B10R0.71 COCCCCCCCCN PH012543 [1,1,0,0,0,0|0,1,0]=3 52 B10R0.71 ICCCCCCCCCI S764507 [1,1,0,0,0,0|2,0,0]=4 53 B10R0.71 [NH2+](CCCCl)CCCCCC R738158 [1,1,0,0,0,0|2,0,0]=4 54 B12R0.234 CC(=O)NCCCCCCCCN S233641 [0,2,0,0,0,0|1,0,1]=4 55 B10R1.18 CC(=O)CC1CCCCC1 CDS001548 [1,0,0,1,0,0|1,0,1]=4 56 B10R1.18 CC(C)CC1CCCCC1 S564869 [1,0,0,1,0,0|2,0,0]=4 57 B10R1.38 C[C@@]1(CCCC[C@H]1CN)O BBO000381 [1,0,0,1,0,0|1,0,1]=4 58 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1N PH016419 [1,0,0,1,0,0|1,0,1]=4 59 B10R1.64 CC(C)C[C@H]1CCC[C@H]1N PH018575 [1,0,0,1,0,0|2,0,0]=4 60 B10R1.78 CC1CCCCCCCC1 T187364 [1,0,0,1,0,0|2,0,0]=4 61 B10R1.348 O=[N+]([O-])C1CCCCCC1 S919098 [1,0,0,1,0,0|2,0,0]=4 62 B10R1.4 CC1CCCCN1CCN PH015207 [1,0,0,1,0,0|2,0,0]=4 63 B10R1.4 CCCC1CCCCC1O S365769 [1,0,0,1,0,0|2,0,0]=4 64 B10R1.4 CN1CCCCC1CCBr CBR00713 [1,0,0,1,0,0|2,0,0]=4 65 B10R1.17 BrCCCC1CCCCC1 S345016 [1,0,0,1,0,0|2,0,0]=4 66 B10R1.17 CCCCC1NCCCS1 T149721 [1,0,0,1,0,0|2,0,0]=4 67 B10R1.17 COCCC1CCCCN1 CBR00752 [1,0,0,1,0,0|0,1,0]=3 68 B10R1.17 ClCCCC1CCCCC1 R426857 [1,0,0,1,0,0|2,0,0]=4 69 B10R1.17 OCCCC1CCCCN1 CBR01786 [1,0,0,1,0,0|1,0,1]=4 70 B10R1.17 OCCCC1CCCNC1 CBR00005 [1,0,0,1,0,0|2,0,0]=4 71 B10R1.21 NCCCCN1CCCC1 PH010578 [1,0,0,1,0,0|2,0,0]=4 72 B10R1.21 NCCCOC1CCCC1 CBR01499 [1,0,0,1,0,0|2,0,0]=4 73 B10R1.85 NCCC1CCCCCC1 CBR01497 [1,0,0,1,0,0|1,0,0]=3 74 B12R1.252 CC(=O)NCCC1CCCCN1 CBR01178 [0,1,0,1,0,0|1,0,1]=4 75 B12R1.283 CC(C)N1CCCCC1CCN CBR01312 [0,1,0,1,0,0|2,0,0]=4