0 B12R2.2786 CC1(C2CCC1(C(=O)C2)Br)C T204315 [0,0,0,0,0,0|1,0,2]=3 1 B12R2.2786 CC1(C2CCC1(C(C2)Cl)C)C T331201 [0,0,0,0,0,0|1,0,0]=1 2 B12R2.2786 CC1(C2CCC1(C(C2)N)C)C T277967 [0,0,0,0,0,0|1,0,0]=1 3 B12R2.2786 CC1(C2CCC1(C(C2)O)C)C PH000115 [0,0,0,0,0,0|0,0,0]=0 4 B11R2.732 CC1(C2CCC1C(=O)C2)C S461490 [1,0,0,0,0,0|0,0,2]=3 5 B13R2.6173 C1(CC2CCC1(C2(C)C)C)NC T276154 [0,1,0,0,0,0|1,0,0]=2 6 B13R2.6173 CC1\2CCC(C1(C)C)C/C2=N\O R522899 [0,1,0,0,0,0|0,0,1]=2 7 B13R2.16542 [C@@H]12CC[C@@](C1(C)C)(C(=O)C2Br)C S373192 [0,1,0,0,0,0|0,0,2]=3 8 B13R2.16844 C(=O)C12CCC(C1(C)C)CC2=O T235342 [0,1,0,0,0,0|0,0,3]=4 9 B13R2.16844 CC1(C2CCC1(C(=O)C2)CBr)C T280038 [0,1,0,0,0,0|0,0,2]=3 10 B13R2.16844 CC1(C2CCC1(C(=O)C2)CI)C T287881 [0,1,0,0,0,0|0,0,2]=3 11 B13R2.18788 CC12CCC(C1(C)CBr)CC2=O T195197 [0,1,0,0,0,0|0,0,2]=3 12 B11R1.21 CC1CC[C@H](CC1=O)C(C)C T218626 [0,0,1,0,0,0|0,0,2]=3 13 B11R1.1386 CC1(CCCC1(C)C(=O)O)C T278106 [0,0,1,0,0,0|1,0,1]=3 14 B10R1.13 CC(C)N1CCC(CC1)N CDS007349 [1,0,1,0,0,0|2,0,0]=4 15 B10R1.13 CC(C)N1CCC(CC1)N L480754 [1,0,1,0,0,0|2,0,0]=4 16 B10R1.13 CC1CCC(CC1)C(C)O PH000605 [1,0,1,0,0,0|1,0,0]=3 17 B10R1.13 CN(C)C1CCC(CC1)N CDS010169 [1,0,1,0,0,0|2,0,0]=4 18 B10R1.113 CC(C)C1CCCC(=O)C1 S883786 [1,0,1,0,0,0|0,0,2]=4 19 B10R1.133 CC1(CCCN1CCCl)C PH019547 [1,0,1,0,0,0|2,0,0]=4 20 B10R1.61 CC(O)C1CCCCC1O S362417 [1,0,1,0,0,0|1,0,0]=3 21 B12R1.23 C=C1CC[C@@H](C[C@H]1O)C(C)(C)C T263818 [0,1,1,0,0,0|0,0,2]=4 22 B12R1.367 CC1CCC(CC1S)C(C)CS S409138 [0,1,1,0,0,0|0,1,0]=3 23 B12R1.1274 CC(C)[C@H]1CCC(C(C1)O)(C)O T218375 [0,1,1,0,0,0|0,0,0]=2 24 B12R1.904 CC(C)(C)[C@@]1(CCCC[C@H]1Cl)O T245119 [0,1,1,0,0,0|2,0,0]=4 25 B12R1.3889 CC1CCC(C1(C)C)(C)C(=O)O T216380 [0,1,1,0,0,0|0,0,1]=3 26 B14R2.27073 C(=O)NC1CC2CCC1(C2(C)C)C T176117 [0,2,0,0,0,0|0,0,1]=3 27 B14R2.27073 CC1(C2CCC1(C(C2)N=C=O)C)C T293490 [0,2,0,0,0,0|0,0,1]=3 28 B14R2.62291 CN(N)C1CC2CCC1(C2(C)C)C PH012510 [0,2,0,0,0,0|1,0,0]=3 29 B14R2.17233 CC12CCC(C1(C)CBr)C(C2=O)Br S957798 [0,2,0,0,0,0|0,0,2]=4 30 B14R2.86733 CC1(C2CCC1(C(=O)C2Br)CBr)C L119113 [0,2,0,0,0,0|0,0,2]=4 31 B14R2.47207 CC1(C2CCC1(C(=O)C2)CBr)CBr T283673 [0,2,0,0,0,0|0,0,2]=4 32 B10R0.75 CCCCCCC(C)N(C)C S336998 [0,0,2,0,0,0|2,0,0]=4 33 B10R0.75 CCCCCCC(O)C(C)C S417424 [0,0,2,0,0,0|2,0,0]=4 34 B10R0.142 CCC(C)C(C)(O)C(C)CC S504785 [0,0,2,0,0,0|2,0,0]=4 35 B12R2.1040 CC1(CC2C=CC1CC2O)C T263982 [0,0,1,1,0,0|0,0,2]=4 36 B12R2.3906 [C@H]12C[C@H]([C@@H](C[C@H]1C2(C)C)O)C T280585 [0,0,1,1,0,0|0,0,0]=2 37 B12R2.5952 CC12CCC(C1(C)C)CNC2 T176249 [0,0,1,1,0,0|2,0,0]=4 38 B12R2.509 [C@@H]12CC[C@@](C1)([C@@H](C2(C)C)O)C CDS012478 [0,0,1,1,0,0|2,0,0]=4 39 B12R3.1317 O=C1CC2CCC1C23CC3 T294403 [1,0,0,1,0,0|0,0,2]=4 40 B14R3.4448 CC12CSCC13CCC2CC3=O T235393 [0,1,0,1,0,0|0,0,2]=4