0 B12R1.28 CC1=CC=CC(CSCCN)=C1 7766-5-03 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.28 CCCCCC1CCCC(=O)O1 2H25-1-18 [0,0,0,0,0,0|0,0,4]=4 2 B12R1.28 NCCSCC1=CC=CC(Cl)=C1 7766-5-02 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.24 CC1=CC=CC(CCCO)=N1 4H56-1-893 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.24 CCCNC1=CC=CC(Br)=N1 3H33-D-0A [1,0,0,0,0,0|3,0,0]=4 5 B11R1.28 BrCCCCC1=CC=CC=C1 1700-9-Z4 [1,0,0,0,0,0|2,0,0]=3 6 B11R1.28 C#CCCCC1=CC=CC=C1 1900-1-Y0 [1,0,0,0,0,0|1,0,2]=4 7 B11R1.28 CCCCNC1=CC=CC=C1 3631-1-X4 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.28 ClCCNCC1=CC=CC=C1 3731-5-X5 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.28 NCCOCC1=CC=CC=C1 4756-5-X8 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.28 OCCCCC1=CC=CC=C1 2701-1-00 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.28 OCCNCC1=CC=CC=C1 4656-1-71 [1,0,0,0,0,0|3,0,0]=4 12 B13R1.16 CCCCOC1=CC=CC(F)=C1F 2607-3-46 [0,1,0,0,0,0|3,0,0]=4 13 B13R1.55 CCCCCC1=CC(O)=CC(O)=C1 2704-1-0G [0,1,0,0,0,0|1,0,1]=3 14 B13R2.13 BrC1=CC=CC(N2CCCC2)=C1 3H32-9-P7 [0,0,0,1,0,0|3,0,0]=4 15 B13R2.13 BrC1=CC=CC(N2CCCC2)=N1 3H32-9-1L [0,0,0,1,0,0|3,0,0]=4 16 B13R2.13 NC1=CC=CC(N2CCCC2)=C1 3H30-1-Z6 [0,0,0,1,0,0|3,0,0]=4 17 B10R0.71 CCCCC\C=C\CCC=O 2315-1-X1 [1,0,1,0,0,0|0,0,2]=4 18 B10R1.17 BrCCCC1=CC=CC=C1 1700-9-Z5 [2,0,0,0,0,0|2,0,0]=4 19 B10R1.17 CCNCC1=CC=CC=C1 3731-1-04 [2,0,0,0,0,0|2,0,0]=4 20 B10R1.17 CCNCC1=CC=CC=N1 3H31-1-3M [2,0,0,0,0,0|2,0,0]=4 21 B10R1.17 CNCCC1=CC=CC=N1 3H31-1-Q6 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.17 NCCCC1=CC=CC=C1 3H30-1-H6 [2,0,0,0,0,0|2,0,0]=4 23 B10R1.17 OCCCC1=CC=CC=N1 4H56-1-LM [2,0,0,0,0,0|2,0,0]=4 24 B12R1.382 CCCOC1=CC=CC(C=O)=C1 2615-1-0B [1,1,0,0,0,0|2,0,0]=4 25 B12R1.1 CCCCCC1=CC=C(Br)C=C1 1700-9-W7 [1,1,0,0,0,0|1,0,0]=3 26 B12R1.1 CCCCCC1=CC=C(Cl)C=C1 1700-5-57 [1,1,0,0,0,0|1,0,0]=3 27 B12R1.1 CCCCCC1=CC=C(F)C=C1 1700-3-45 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.1 CCCCCC1=CC=C(I)C=C1 1700-H-04 [1,1,0,0,0,0|1,0,0]=3 29 B12R1.1 CCCCOC1=CC=C(N)C=C1 4630-1-08 [1,1,0,0,0,0|2,0,0]=4 30 B12R1.8 BrCCCCCC1=CC=CC=C1 1700-9-09 [1,1,0,0,0,0|1,0,0]=3 31 B12R1.8 BrCCCOCC1=CC=CC=C1 2707-9-13 [1,1,0,0,0,0|2,0,0]=4 32 B12R1.8 CNCCCCC1=CC=CC=C1 3632-5-X2 [1,1,0,0,0,0|1,0,0]=3 33 B12R1.30 CCCCC(=O)C1=CC=CC=C1 2617-1-15 [1,1,0,0,0,0|1,0,1]=4 34 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 2607-1-S4 [1,1,0,0,0,0|2,0,0]=4 35 B12R1.267 CCCCCC1=NC=NC=C1Br 3H32-9-Z8 [1,1,0,0,0,0|2,0,0]=4 36 B12R2.2 C1=CC=C(C2CCCN2)C=C1 P911-A-43 [1,0,0,1,0,0|2,0,0]=4 37 B12R2.2 C1=CC=C(C2CCCN2)N=C1 3H32-1-Q0 [1,0,0,1,0,0|2,0,0]=4 38 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 3731-1-03 [1,0,0,1,0,0|2,0,0]=4 39 B14R2.21 BrC1=CC=CC(N2CCCCC2)=C1 3H32-9-FT [0,1,0,1,0,0|2,0,0]=4 40 B14R2.21 BrC1=CC=CC(N2CCCCC2)=N1 3H32-9-3T [0,1,0,1,0,0|2,0,0]=4