0 B13R1.9 CCCCCOC1=CC=C(Br)C=C1 Q67253 [1,0,0,0,0,0|3,0,0]=4 1 B13R1.9 CCCCNCC1=CC=C(Br)C=C1 P37132 [1,0,0,0,0,0|2,0,1]=4 2 B13R1.9 CCCCNCC1=CC=C(C)C=C1 P40822 [1,0,0,0,0,0|2,0,1]=4 3 B13R1.9 CCCCNCC1=CC=C(Cl)C=C1 P40821 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.9 CCCCNCC1=CC=C(F)C=C1 P37135 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.9 OCCCCOC1=CC=C(O)C=C1 P41131 [1,0,0,0,0,0|3,0,0]=4 6 B13R1.24 CCCCNC(=O)C1=CC=CC=C1 P51456 [1,0,0,0,0,0|1,0,0]=2 7 B13R1.24 NCCCNC(=O)C1=CC=CC=C1 M23319 [1,0,0,0,0,0|2,0,0]=3 8 B15R1.30 CCCCNNC(=O)C1=CC=C(Br)C=C1 O33956 [0,1,0,0,0,0|2,0,0]=3 9 B15R1.38 CC1=CC=C(S(=O)(=O)OCCCF)C=C1 P38893 [0,1,0,0,0,0|3,0,0]=4 10 B15R1.882 CN(C)CCNC(=O)C1=CC=C(N)C=C1 P40228 [0,1,0,0,0,0|3,0,0]=4 11 B15R2.91 NC1=CC=C(C(=O)N2CCCC2)C=C1 P37398 [0,0,0,1,0,0|2,0,0]=3 12 B15R2.91 O=C(C1=NC=C(Br)C=C1)N2CCCC2 Q66571 [0,0,0,1,0,0|3,0,0]=4 13 B12R1.1 CNCCOC1=CC=C(N)C=C1 P39260 [2,0,0,0,0,0|2,0,0]=4 14 B12R1.1 COCCOC1=CC=C(N)C=C1 P38759 [2,0,0,0,0,0|2,0,0]=4 15 B12R1.1 ClC1=CC=C(OCCCBr)C=C1 P39095 [2,0,0,0,0,0|2,0,0]=4 16 B12R1.1 FC1=CC=C(OCCCBr)C=C1 P42593 [2,0,0,0,0,0|2,0,0]=4 17 B12R1.1 NCCCCC1=CC=C(O)C=C1 P39592 [2,0,0,0,0,0|1,0,1]=4 18 B12R1.1 NCCCOC1=CC=C(F)C=C1 P42484 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.8 CNCCOCC1=CC=CC=C1 P36478 [2,0,0,0,0,0|1,0,1]=4 20 B12R1.8 CNCCOCC1=CC=CC=C1 P36772 [2,0,0,0,0,0|1,0,1]=4 21 B12R1.8 NCCCOCC1=CC=CC=C1 P40697 [2,0,0,0,0,0|1,0,1]=4 22 B12R1.16 CCOC(=O)C1=CC=C(C)N=C1 Q51912 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 10446 [2,0,0,0,0,0|1,0,0]=3 24 B12R1.16 CCOC(=O)C1=CN=C(Br)C=C1 Q67365 [2,0,0,0,0,0|2,0,0]=4 25 B12R1.16 CCOC(=O)C1=CN=C(O)N=C1 S72555 [2,0,0,0,0,0|2,0,0]=4 26 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 Q68117 [2,0,0,0,0,0|2,0,0]=4 27 B12R1.16 CCOC(=O)C1=NC=C(C)C=C1 Q68855 [2,0,0,0,0,0|2,0,0]=4 28 B12R1.16 CCOC(=O)C1=NN=C(O)C=C1 P43230 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.16 N#CCC(=O)C1=CC=C(O)C=C1 P36522 [2,0,0,0,0,0|1,0,1]=4 30 B12R1.30 NCCNC(=O)C1=CC=CC=C1 P41078 [2,0,0,0,0,0|2,0,0]=4 31 B14R1.776 CCCCNCC1=CC=C(OC)C=C1 P38362 [1,1,0,0,0,0|1,0,1]=4 32 B14R1.776 COC1=CC=C(COCCCN)C=C1 P40182 [1,1,0,0,0,0|1,0,1]=4 33 B14R1.926 CCCNC(=O)C1=CC=C(C#N)C=C1 P35760 [1,1,0,0,0,0|2,0,0]=4 34 B14R1.38 O=C(CCNCCO)C1=CC=CC=C1 L20547 [1,1,0,0,0,0|2,0,0]=4 35 B16R1.1713 CCCCNC(=O)C1=CC=C(B(O)O)C=C1 Q66386 [0,2,0,0,0,0|1,0,0]=3 36 B14R2.8719 O=C1CCCOC2=CC(Br)=CC=C12 Q69898 [1,0,0,1,0,0|2,0,0]=4 37 B14R2.10606 O=C(C1=CC=C(Br)C=C1)C2CCC2 O28282 [1,0,0,1,0,0|1,0,0]=3 38 B14R2.10606 O=C(C1=CC=C(Br)C=C1)C2CNC2 O33557 [1,0,0,1,0,0|2,0,0]=4 39 B14R2.10606 O=C(C1=CC=C(Br)C=C1)C2CNC2 S70292 [1,0,0,1,0,0|2,0,0]=4 40 B14R2.10606 O=C(C1=CC=C(Cl)C=C1)C2CNC2 P36044 [1,0,0,1,0,0|2,0,0]=4 41 B14R2.10606 O=C(C1=CC=C(F)C=C1)C2CNC2 P41099 [1,0,0,1,0,0|2,0,0]=4 42 B14R2.114 O=C(C1=CC=CC=C1)C2CCCN2 O28153 [1,0,0,1,0,0|2,0,0]=4 43 B14R2.114 O=C(C1=CC=CC=C1)C2CCNC2 O28127 [1,0,0,1,0,0|2,0,0]=4 44 B16R2.120 NC1=CC=C(C(=O)N2CCCCC2)C=C1 P38116 [0,1,0,1,0,0|2,0,0]=4 45 B16R2.120 NC1=CC=C(C(=O)N2CCOCC2)C=C1 P45534 [0,1,0,1,0,0|2,0,0]=4 46 B16R2.120 O=C(C1=CC=C(Br)C=C1)C2CCNCC2 O28903 [0,1,0,1,0,0|2,0,0]=4 47 B16R2.120 O=C(C1=CC=C(F)C=C1)C2CCCNC2 P42428 [0,1,0,1,0,0|2,0,0]=4 48 B16R2.46 O=CC1=CC=C(C(=O)N2CCCC2)C=C1 P35999 [0,1,0,1,0,0|1,0,1]=4 49 B16R2.138 NC1=CC=C(C(=O)N2CCCC2)C=C1N O29387 [0,1,0,1,0,0|2,0,0]=4 50 B16R2.138 O=C(C1=CC=C(Br)C(F)=C1)N2CCCC2 Q67627 [0,1,0,1,0,0|2,0,0]=4 51 B16R2.319 O=C(C1=CC=C(Cl)C=C1Cl)C2CCCC2 M22794 [0,1,0,1,0,0|2,0,0]=4