0 B12R1.32 CNCC(F)CC1=CC=CC=C1 F2147-5623 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.28 [N-]=[N+]=NCCC1=CC=CC=C1 F2157-0470 [1,0,0,0,0,0|2,0,1]=4 2 B11R1.40 C=CC(N)CC1=CC=CC=C1 F8884-0173 [1,0,0,0,0,0|2,0,0]=3 3 B11R1.40 FC(CBr)CC1=CC=CC=C1 F1967-2969 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.40 NCC(F)CC1=CC=CC=C1 F2147-5622 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 F0001-2353 [1,0,0,0,0,0|1,0,2]=4 6 B11R1.40 OCC(F)CC1=CC=CC=C1 F2147-5621 [1,0,0,0,0,0|1,0,2]=4 7 B13R2.26 CNCC1CC2=C(C=CC=C2)C1 F2147-2622 [0,0,0,1,0,0|3,0,0]=4 8 B13R2.26 [N-]=[N+]=NC1CC2=CC=CC=C2C1 F1908-3181 [0,0,0,1,0,0|2,0,1]=4 9 B11R1.16 C#CCC(C)C1=CC=CC=C1 F2147-2803 [0,0,0,0,1,0|2,0,1]=4 10 B11R1.16 C=CCC(N)C1=CC=CC=C1 F8882-5630 [0,0,0,0,1,0|3,0,0]=4 11 B11R1.16 C=CC[C@@H](N)C1=CC=CC=C1 F1913-5289 [0,0,0,0,1,0|3,0,0]=4 12 B11R1.16 C=CC[C@H](N)C1=CC=CC=C1 F1913-5290 [0,0,0,0,1,0|3,0,0]=4 13 B10R1.17 NOCCC1=CC=CC=C1 F1631-0190 [2,0,0,0,0,0|2,0,0]=4 14 B10R1.18 CC(N)CC1=CC=NC=C1 F2196-0112 [2,0,0,0,0,0|1,0,0]=3 15 B12R1.8 FCCNCCC1=CC=CC=C1 F1913-6494 [1,1,0,0,0,0|1,0,1]=4 16 B12R1.30 C=CCCC(N)C1=CC=CC=C1 F2147-8745 [1,1,0,0,0,0|2,0,0]=4 17 B12R1.30 C=CCCC(N)C1=CC=CC=C1 F2147-8746 [1,1,0,0,0,0|2,0,0]=4 18 B12R1.30 C=CCC[C@@H](N)C1=CC=CC=C1 F1913-5354 [1,1,0,0,0,0|2,0,0]=4 19 B12R1.30 C=CCC[C@H](N)C1=CC=CC=C1 F1913-5355 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.43 CC(CC1=CN=CN=C1)C(=O)O F8884-9364 [1,1,0,0,0,0|2,0,0]=4 21 B12R1.43 CC(OC1=CC=NC=C1)C(=O)O F2197-7574 [1,1,0,0,0,0|2,0,0]=4 22 B12R1.43 CC(OC1=NC=CC=C1)C(=O)O F2197-7559 [1,1,0,0,0,0|2,0,0]=4 23 B12R1.43 O=C(O)C(F)CC1=CC=CC=C1 F2147-5620 [1,1,0,0,0,0|1,0,0]=3 24 B12R1.43 O=C(O)C(F)CC1=CC=CC=N1 F1913-0171 [1,1,0,0,0,0|2,0,0]=4 25 B12R1.43 O=C(O)C(F)CC1=CC=CN=C1 F1913-0148 [1,1,0,0,0,0|2,0,0]=4 26 B12R1.43 O=C(O)C(F)CC1=CC=NC=C1 F1913-0172 [1,1,0,0,0,0|2,0,0]=4 27 B12R1.49 C=CC(N)CC1=CC=C(Br)C=C1 F8884-0594 [1,1,0,0,0,0|2,0,0]=4 28 B12R1.49 C=CC(N)CC1=CC=C(F)C=C1 F8884-0490 [1,1,0,0,0,0|2,0,0]=4 29 B12R1.50 C=CC(N)CC1=CC(Br)=CC=C1 F8887-0140 [1,1,0,0,0,0|2,0,0]=4 30 B12R1.194 C#CC(C)(C)CC1=CC=CC=C1 F2147-6117 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.194 CC(C)(C=O)CC1=CC=CC=C1 F2147-6116 [1,1,0,0,0,0|0,0,0]=2 32 B12R1.194 CC(C)(CBr)CC1=CC=CC=C1 F8884-2428 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.194 CC(C)(CCl)CC1=CC=CC=C1 F8884-1463 [1,1,0,0,0,0|1,0,1]=4 34 B12R1.194 CC(C)(CN)CC1=CC=CC=C1 F2147-6112 [1,1,0,0,0,0|1,0,1]=4 35 B12R1.371 C=CC(N)CC1=C(F)C=CC=C1 F8887-0145 [1,1,0,0,0,0|2,0,0]=4 36 B14R1.818 CC(CC(=O)O)NCC1=CC=CN=C1 F1911-3157 [0,1,0,0,0,1|2,0,0]=4 37 B14R1.818 CC(CC(=O)O)NCC1=CC=NC=C1 F1911-3265 [0,1,0,0,0,1|2,0,0]=4 38 B12R2.23 O=C1CCC1C2=CC=CC=C2 F8880-8488 [1,0,0,1,0,0|1,0,0]=3 39 B14R2.52 O=C1CSC2=CC=CC=C2C(=O)N1 F2197-0341 [0,0,0,1,0,1|1,0,1]=4 40 B14R2.101 C1=CC=C(SCC2CCCN2)C=C1 F2167-0500 [0,0,0,1,0,1|1,0,1]=4 41 B14R2.436 O=C1CC(COC2=CC=CC=C2)C1 F2147-4876 [0,0,0,1,0,1|1,0,0]=3 42 B14R2.436 O=C1CC(COC2=CC=NC=C2)C1 F2147-4411 [0,0,0,1,0,1|2,0,0]=4 43 B14R2.436 O=C1CC(COC2=NC=CC=C2)C1 F2147-4393 [0,0,0,1,0,1|2,0,0]=4 44 B14R2.1019 COC1=CC2=CC=CC=C2C(=O)N1 F2147-8706 [0,1,0,1,0,0|0,0,2]=4 45 B14R2.1019 CSC1=NC2=CC=CC=C2C(=O)N1 F1907-2282 [0,1,0,1,0,0|1,0,1]=4 46 B14R2.1019 NCC1CC(=O)C2=CC=CC=C2O1 F2147-8368 [0,1,0,1,0,0|2,0,0]=4 47 B10R1.27 CC(C=O)CC1=NOC=C1 F2147-8178 [1,0,0,0,1,0|2,0,0]=4