0 B11R1.83 CCNC1=CC=C(OC)C=C1 C-086047 [0,0,0,0,0,0|1,0,2]=3 1 B10R1.1 CCNC1=CC=C(C)C=C1 C-086048 [1,0,0,0,0,0|1,0,2]=4 2 B10R1.1 COCC1=CC=C(N)C=C1 F-369205 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.3 CCC1=CC=C(CN)C=C1 F-452455 [1,0,0,0,0,0|2,0,0]=3 4 B10R1.3 CSC1=CC=C(C#N)C=C1 F-453394 [1,0,0,0,0,0|1,1,1]=4 5 B10R1.3 CSC1=CC=C(CN)C=C1 F-452459 [1,0,0,0,0,0|1,1,0]=3 6 B10R1.3 N#CC1=CC=C(CN)C=C1 F-368585 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.3 [C-]#[N+]C1=CC=C(OC)C=C1 F-415537 [1,0,0,0,0,0|1,0,1]=3 8 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 Q-004186 [0,1,0,0,0,0|0,0,2]=3 9 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 X-015860 [0,1,0,0,0,0|1,0,2]=4 10 B12R1.71 C=CCOC1=CC=C(C#N)C=C1 F-443549 [0,1,0,0,0,0|2,0,0]=3 11 B12R1.71 CCCNC1=CC=C(OC)C=C1 C-086306 [0,1,0,0,0,0|0,0,2]=3 12 B12R1.116 CCNC1=CC=C(OCC)C=C1 C-086056 [0,1,0,0,0,0|1,0,2]=4 13 B12R2.44 COC1=CC2=C(C=C1)N=NN2 F-456295 [0,0,0,1,0,0|3,0,0]=4 14 B12R2.44 COC1=CC2=C(C=C1)NC=N2 R-015635 [0,0,0,1,0,0|2,0,0]=3 15 B12R2.44 NCC1=CC2=C(C=C1)SC=C2 F-123646 [0,0,0,1,0,0|3,0,0]=4 16 B12R2.44 O=CC1=CC2=C(C=C1)SC=C2 F-123652 [0,0,0,1,0,0|3,0,0]=4 17 B12R2.44 OCC1=CC2=C(C=C1)SC=C2 F-123659 [0,0,0,1,0,0|3,0,0]=4 18 B11R1.1 CC1=CC=C(SCC#N)C=C1 F-332738 [1,1,0,0,0,0|1,0,1]=4 19 B11R1.1 CCCNC1=CC=C(C)C=C1 C-086307 [1,1,0,0,0,0|0,0,2]=4 20 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 F-335603 [1,1,0,0,0,0|2,0,0]=4 21 B11R1.20 NC(=S)NC1=CC=C(O)C=C1 POD_63/0640 [1,1,0,0,0,0|2,0,0]=4 22 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 X-047955 [1,1,0,0,0,0|2,0,0]=4 23 B11R1.3 CCC1=CC=C(C(C)N)C=C1 Q-018484 [1,1,0,0,0,0|1,0,1]=4 24 B11R1.3 CN(C)C1=CC=C(CN)C=C1 POD_19/0399 [1,1,0,0,0,0|2,0,0]=4 25 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 F-502322 [1,1,0,0,0,0|1,0,1]=4 26 B11R1.3 COC1=CC=C(C(=N)N)C=C1 Z-002943 [1,1,0,0,0,0|1,0,0]=3 27 B11R1.3 CSC1=CC=C(C(=N)N)C=C1 F-453392 [1,1,0,0,0,0|1,1,0]=4 28 B11R1.279 COC1=C(F)C=C(C#N)C=C1 F-434771 [1,1,0,0,0,0|1,0,1]=4 29 B11R1.279 COC1=CC(Br)=C(NN)C=C1 F-435442 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.279 COC1=CC=C(CO)C=C1N F-369348 [1,1,0,0,0,0|1,0,0]=3 31 B13R1.5 COC1=CC=C(NC(=O)CN)C=C1 F-367403 [0,2,0,0,0,0|1,0,1]=4 32 B13R1.5 COC1=CC=C(NC(=O)CS)C=C1 M-316813 [0,2,0,0,0,0|1,0,1]=4 33 B13R1.35 COC1=C(Cl)C=C(CC(=O)O)C=C1 F-262597 [0,2,0,0,0,0|1,0,0]=3 34 B13R1.36 COC1=CC=C(C(N)C(C)C)C=C1 F-361524 [0,2,0,0,0,0|0,0,2]=4 35 B13R1.142 CCOC1=CC=C(CC(=N)N)C=C1 H-096055 [0,2,0,0,0,0|1,0,0]=3 36 B13R1.142 CCOC1=CC=C(CC(=O)O)C=C1 X-047703 [0,2,0,0,0,0|1,0,0]=3 37 B13R1.142 N#CCC1=CC=C(OC(F)F)C=C1 F-454075 [0,2,0,0,0,0|1,0,1]=4 38 B13R1.142 NCCC1=CC=C(OC(F)F)C=C1 F-454030 [0,2,0,0,0,0|1,0,1]=4 39 B13R1.585 CC(C)C1=CC=C(CC(=O)O)C=C1 F-262591 [0,2,0,0,0,0|2,0,0]=4 40 B13R1.653 COC1=CC(N)=C(NC(C)=O)C=C1 F-445571 [0,2,0,0,0,0|1,0,1]=4 41 B13R1.39 CCC(NC)C1=CC=C(OC)C=C1 POD_07/0939 [0,2,0,0,0,0|0,0,2]=4 42 B13R1.39 COC1=CC=C(C(C#N)C=O)C=C1 F-351615 [0,2,0,0,0,0|1,0,0]=3 43 B13R1.452 COC1=CC=C(C(O)CCN)C=C1 F-396611 [0,2,0,0,0,0|0,0,2]=4 44 B13R1.3088 CCC(N)C1=CC(C)=C(OC)C=C1 F-361390 [0,2,0,0,0,0|0,0,2]=4 45 B13R1.3088 CCC(N)C1=CC(Cl)=C(OC)C=C1 F-361402 [0,2,0,0,0,0|0,0,2]=4 46 B13R1.3 CCC1=CC=C(OCC(=O)Cl)C=C1 F-393230 [0,2,0,0,0,0|2,0,0]=4 47 B13R1.3 COC1=CC=C(OCC(C)N)C=C1 F-369339 [0,2,0,0,0,0|0,0,2]=4 48 B13R1.74 C=CCOC1=CC=C(C(=O)Cl)C=C1 F-443550 [0,2,0,0,0,0|2,0,0]=4 49 B13R1.74 C=CCOC1=CC=C(C(N)=O)C=C1 T-071968 [0,2,0,0,0,0|2,0,0]=4 50 B13R1.77 C#CCOC1=CC=C(CNC)C=C1 F-426817 [0,2,0,0,0,0|1,0,1]=4 51 B13R1.77 CCCNC1=CC=C(OCC)C=C1 C-086315 [0,2,0,0,0,0|0,0,2]=4 52 B13R1.371 COC1=CC=C(OCCCN)C=C1 M-418760 [0,2,0,0,0,0|0,0,2]=4 53 B13R2.2121 COC1=CC=C2N=C(N)NC2=C1 F-494950 [0,1,0,1,0,0|2,0,0]=4 54 B13R2.2121 COC1=CC=C2OC(N)=NC2=C1 F-494953 [0,1,0,1,0,0|2,0,0]=4 55 B13R2.669 COC1=CC2=C(C=C1)N=CN2C F-456292 [0,1,0,1,0,0|1,0,1]=4 56 B13R2.654 COC1=CC(Cl)=C2NC=NC2=C1 F-498171 [0,1,0,1,0,0|2,0,0]=4 57 B13R2.449 CCOC1=CC2=C(C=C1)N=CN2 F-456293 [0,1,0,1,0,0|2,0,0]=4 58 B13R2.449 CNCC1=CC2=C(C=C1)SC=C2 F-123647 [0,1,0,1,0,0|2,0,0]=4 59 B13R2.449 CNCC1=CC=C2OCOC2=C1 M-872085 [0,1,0,1,0,0|1,0,1]=4