0 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 H-8927 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 P39137 [1,0,0,0,0,0|1,0,2]=4 2 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 P50928 [1,0,0,0,0,0|2,0,1]=4 3 B15R1.78 CNCCNC(=O)OCC1=CC=CC=C1 P40377 [0,1,0,0,0,0|2,0,1]=4 4 B15R1.78 O=C(NCCCBr)OCC1=CC=CC=C1 P38308 [0,1,0,0,0,0|2,0,1]=4 5 B15R1.78 O=C(NCCCO)OCC1=CC=CC=C1 P38657 [0,1,0,0,0,0|2,0,1]=4 6 B15R1.551 CCCNC(=O)C(N)CC1=CC=CC=C1 M23090 [0,1,0,0,0,0|1,0,2]=4 7 B15R1.741 COC(=O)CC(=O)\C=C\C1=CC=CC=C1 P37750 [0,1,0,0,0,0|2,0,1]=4 8 B15R2.38 O=C1CCCCN1CC2=CC=CC=C2 P37924 [0,0,0,1,0,0|2,0,1]=4 9 B15R2.352 C#CCOC1=CC=C2C=CC=CC2=C1 P40024 [0,0,0,1,0,0|1,0,2]=4 10 B15R2.352 NCCCC1=CC=C2C=CC=CC2=C1 P41696 [0,0,0,1,0,0|3,0,0]=4 11 B15R2.352 OCCOC1=CC=C2C=CC=CC2=C1 P35033 [0,0,0,1,0,0|2,0,0]=3 12 B12R1.27 COC(=O)CNC1=CC=CC=C1 P39503 [2,0,0,0,0,0|1,0,1]=4 13 B12R1.27 COC(=O)NCC1=CC=CC=C1 O34236 [2,0,0,0,0,0|1,0,1]=4 14 B14R1.29 CCOC(=O)CC(=O)C1=CC=CN=C1 P36964 [1,1,0,0,0,0|1,0,1]=4 15 B14R1.29 CCOC(=O)CC(=O)C1=CC=NC=C1 G-6005 [1,1,0,0,0,0|1,0,1]=4 16 B14R1.29 CCOC(=O)CC(N)C1=CC=CC=C1 Q65906 [1,1,0,0,0,0|0,0,2]=4 17 B14R1.29 CCOC(=O)CC(O)C1=CC=CC=C1 P37294 [1,1,0,0,0,0|0,0,2]=4 18 B14R1.29 CCOC(=O)C[C@@H](N)C1=CC=CC=C1 P38711 [1,1,0,0,0,0|0,0,2]=4 19 B14R1.29 CCOC(=O)C[C@H](N)C1=CC=CC=C1 P40680 [1,1,0,0,0,0|0,0,2]=4 20 B14R1.29 CCOC(=O)\C=C(/N)C1=NC=CC=C1 M23054 [1,1,0,0,0,0|1,0,0]=3 21 B14R1.32 CCOC(=O)CCC1=CC=CC(Cl)=C1 P36476 [1,1,0,0,0,0|0,0,2]=4 22 B14R1.32 CCOC(=O)CCC1=CC=CC(N)=C1 P34745 [1,1,0,0,0,0|0,0,2]=4 23 B14R1.32 CCOC(=O)CNC1=CC=CC(Cl)=C1 P39301 [1,1,0,0,0,0|1,0,1]=4 24 B14R1.502 CCOC(=O)CCC1=CC=C(C)C=C1 P36474 [1,1,0,0,0,0|0,0,2]=4 25 B14R1.502 CCOC(=O)CCC1=CC=C(Cl)C=C1 P36475 [1,1,0,0,0,0|0,0,2]=4 26 B14R1.502 CCOC(=O)CCC1=CC=C(N)C=C1 P36473 [1,1,0,0,0,0|0,0,2]=4 27 B14R1.502 CCOC(=O)CNC1=CC=C(Cl)C=C1 P39342 [1,1,0,0,0,0|1,0,1]=4 28 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)N=C1 P51616 [1,1,0,0,0,0|1,0,0]=3 29 B14R1.598 CCOC(=O)\C=C\C1=CC=CC=C1Br P34748 [1,1,0,0,0,0|0,0,0]=2 30 B14R1.598 CCOC(=O)\C=C\C1=CC=CC=C1Br Q65982 [1,1,0,0,0,0|0,0,0]=2 31 B14R1.818 CC(N)CC(=O)OCC1=CC=CC=C1 P41306 [1,1,0,0,0,0|1,0,1]=4 32 B16R1.1570 CCOC(=O)CC(=O)\C=C\C1=CC=CC=C1 P37241 [0,2,0,0,0,0|1,0,1]=4 33 B14R2.7150 CNCC1=C2C=CC=CC2=CC=C1 Q65431 [1,0,0,1,0,0|2,0,0]=4 34 B14R2.7150 NCCC1=C2C=CC=CC2=CC=C1 P37950 [1,0,0,1,0,0|2,0,0]=4 35 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 O30559 [1,0,0,1,0,0|2,0,0]=4 36 B14R2.112 NCCC1=CC=C2C=CC=CC2=C1 P39977 [1,0,0,1,0,0|2,0,0]=4 37 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 Q65489 [1,0,0,1,0,0|2,0,0]=4 38 B16R2.1054 COCOC1=CC(Br)=C2C=CC=CC2=C1 Q70007 [0,1,0,1,0,0|2,0,0]=4 39 B16R2.30336 CCCOC1=CC2=CC=C(Br)C=C2C=C1 Q67640 [0,1,0,1,0,0|1,0,0]=3 40 B16R2.30336 COCOC1=CC2=CC=C(Br)C=C2C=C1 Q67605 [0,1,0,1,0,0|2,0,0]=4 41 B12R1.32 CCOC(=O)C[N+]1=CC=CC=C1 P40561 [1,0,0,0,1,0|1,0,1]=4 42 B12R1.30 NCCNC(=O)C1=CC=CC=C1 P41078 [0,0,0,0,2,0|2,0,0]=4