0 B13R1.14 NCC(=O)NNC1=CC=C(C=C1)F Z1450029704 [1,0,0,0,0,0|3,0,0]=4 1 B13R1.14 NCC(O)COC1=CC=C(C=C1)F Z271072308 [1,0,0,0,0,0|1,0,1]=3 2 B13R1.14 NCC(O)COC1=CC=C(C=C1)I Z381428032 [1,0,0,0,0,0|1,1,1]=4 3 B13R1.14 NNC(=O)CNC1=CC=C(C=C1)F Z56968886 [1,0,0,0,0,0|3,0,0]=4 4 B13R1.14 NNC(=O)COC1=CC=C(C=C1)Br Z56797458 [1,0,0,0,0,0|2,1,0]=4 5 B13R1.14 NNC(=O)COC1=CC=C(C=C1)Cl Z56862620 [1,0,0,0,0,0|2,1,0]=4 6 B13R1.14 NNC(=O)COC1=CC=C(C=C1)F Z56933789 [1,0,0,0,0,0|2,0,0]=3 7 B13R1.14 O=C(CCl)COC1=CC=C(C=C1)Cl Z1269140193 [1,0,0,0,0,0|2,1,0]=4 8 B15R2.100 FC1=CC=C(C=C1)CCC2=NNC=C2 Z5551480145 [0,0,0,1,0,0|3,0,0]=4 9 B15R2.275 NCC1=CC=C(O1)C2=CC=C(C=C2)F Z235352177 [0,0,0,1,0,0|3,0,0]=4 10 B13R1.145 NCC(CO)CC1=CC=C(C=C1)F Z285055048 [0,0,0,0,1,0|1,0,2]=4 11 B12R1.1 CC1=CC=C(C=C1)OCCCN Z285166764 [2,0,0,0,0,0|1,0,1]=4 12 B12R1.1 FC1=CC=C(C=C1)OCCCBr Z90122147 [2,0,0,0,0,0|1,0,1]=4 13 B12R1.1 FC1=CC=C(C=C1)OCCCCl Z56347250 [2,0,0,0,0,0|1,0,1]=4 14 B12R1.1 NCCCOC1=CC=C(C=C1)F Z271006096 [2,0,0,0,0,0|0,0,1]=3 15 B12R1.1 NCCCSC1=CC=C(C=C1)F Z56988241 [2,0,0,0,0,0|0,1,1]=4 16 B12R1.1 OCCCOC1=CC=C(C=C1)F Z228585902 [2,0,0,0,0,0|1,0,1]=4 17 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F Z406376784 [2,0,0,0,0,0|2,0,0]=4 18 B12R1.21 CC(N)COC1=CC=C(C=C1)F Z271017038 [2,0,0,0,0,0|0,0,2]=4 19 B12R1.21 CC1=CC=C(C=C1)OCC(=O)N Z19732046 [2,0,0,0,0,0|2,0,0]=4 20 B12R1.21 CC1=CC=C(C=C1)OCC(=S)N Z295396970 [2,0,0,0,0,0|2,0,0]=4 21 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F Z87614992 [2,0,0,0,0,0|2,0,0]=4 22 B12R1.21 NC(=O)COC1=CC=C(C=C1)Br Z19725712 [2,0,0,0,0,0|1,1,0]=4 23 B12R1.21 NC(=O)COC1=CC=C(C=C1)F Z19734788 [2,0,0,0,0,0|1,0,0]=3 24 B12R1.21 NC(=O)COC1=CC=C(C=C1)I Z25086979 [2,0,0,0,0,0|1,1,0]=4 25 B12R1.21 NC(=O)COC1=CC=C(C=C1)N Z239127428 [2,0,0,0,0,0|2,0,0]=4 26 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [2,0,0,0,0,0|2,0,0]=4 27 B12R1.21 NC(=O)CSC1=CC=C(C=C1)F Z16034821 [2,0,0,0,0,0|1,1,0]=4 28 B12R1.21 NC(=S)COC1=CC=C(C=C1)Cl Z295395122 [2,0,0,0,0,0|1,1,0]=4 29 B12R1.21 O=C(O)COC1=CC=C(C=C1)F Z56978034 [2,0,0,0,0,0|2,0,0]=4 30 B12R1.27 N/C(=N\O)/COC1=CC=CC=C1 Z104341168 [2,0,0,0,0,0|2,0,0]=4 31 B12R1.27 NCC(=O)CCC1=CC=CC=C1 Z3719299469 [2,0,0,0,0,0|2,0,0]=4 32 B12R1.27 NCC(O)COC1=CC=CC=C1 Z271072310 [2,0,0,0,0,0|1,0,1]=4 33 B12R1.27 O=C(CCl)COC1=CC=CC=C1 Z1255416714 [2,0,0,0,0,0|2,0,0]=4 34 B14R1.134 CC(OC1=CC=C(C=C1)F)C(=O)NN Z56946056 [1,1,0,0,0,0|2,0,0]=4 35 B14R1.833 NCC(O)COC1=CC(=C(C=C1)F)F Z431603932 [1,1,0,0,0,0|1,0,1]=4 36 B14R1.536 NCC(CC1=CC=C(C=C1)F)C(=O)N Z367446796 [0,1,0,0,1,0|1,0,1]=4 37 B14R1.536 NCC(OC1=CC=C(C=C1)F)C(=O)O Z1508667025 [0,1,0,0,1,0|1,0,1]=4 38 B14R2.134 N#CC1=CC2=C(C=CC(=C2)F)OC1 Z1579867946 [1,0,0,1,0,0|0,0,2]=4 39 B14R2.1060 CC1=C(OC2=C1C=C(C=C2)Br)CN Z3491571821 [0,0,0,1,1,0|1,1,0]=4 40 B14R2.1060 CC1=C(OC2=C1C=C(C=C2)Cl)CN Z3477155541 [0,0,0,1,1,0|1,1,0]=4 41 B14R2.1060 CC1=C(OC2=C1C=C(C=C2)F)CN Z1269638565 [0,0,0,1,1,0|1,0,0]=3 42 B12R1.49 CC(CN)OC1=CC=C(C=C1)F Z274779140 [1,0,0,0,1,0|0,0,2]=4 43 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F Z1889902528 [1,0,0,0,1,0|1,0,0]=3 44 B12R1.49 NNC(=O)CC1=CC=C(C=C1)F Z56347387 [1,0,0,0,1,0|2,0,0]=4 45 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)F Z316174768 [1,0,0,0,1,0|2,0,0]=4 46 B12R1.49 O=C(CO)CC1=CC=C(C=C1)F Z906206828 [1,0,0,0,1,0|2,0,0]=4