0 B12R1.51 CNCC(=O)NCC1=CC=CO1 BB01-4942 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.51 N#CCC(=O)NCC1=CC=CO1 BB57-0635 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.4 CCCCNCC1=CC=CO1 BB01-5391 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.25 CNC(C)CCC1=CC=CO1 BB01-4354 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.25 O=C(CCl)NCC1=CC=CO1 BB01-5135 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.25 O=C(CCl)NCC1=CC=CS1 BB01-5542 [1,0,0,0,0,0|2,1,0]=4 6 B13R1.33 CCOC(=O)CC(N)C1=CC=CS1 BB01-4138 [0,1,0,0,0,0|0,1,0]=2 7 B13R1.554 CCC(Br)C(=O)NCC1=CC=CO1 BB01-5120 [0,1,0,0,0,0|2,0,0]=3 8 B13R1.554 CCC(Br)C(=O)NCC1=CC=CS1 BB01-5543 [0,1,0,0,0,0|2,1,0]=4 9 B11R1.30 CCOC(=O)CC1=CC=CS1 BB01-7823 [0,0,0,0,1,0|0,1,0]=2 10 B11R1.30 CCOC(=O)CN1C=CC=N1 BB55-7404 [0,0,0,0,1,0|2,0,0]=3 11 B11R1.30 CCOC(=O)CN1C=CN=C1 BB55-6794 [0,0,0,0,1,0|3,0,0]=4 12 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 BB01-6364 [0,0,0,0,0,1|2,0,0]=3 13 B13R1.404 CCOC(=O)CCCN1C=CC=N1 BB58-3243 [0,0,0,0,0,1|2,0,0]=3 14 B10R1.66 CC(N)CCC1=CC=CO1 BB01-4327 [2,0,0,0,0,0|1,0,1]=4 15 B10R1.66 O=C(O)CCN1C=CC=C1 BB01-6486 [2,0,0,0,0,0|2,0,0]=4 16 B10R1.66 O=C(O)CCN1C=CC=N1 BB58-3552 [2,0,0,0,0,0|2,0,0]=4 17 B10R1.66 O=C(O)\C=C\C1=CC=CO1 BB55-6068 [2,0,0,0,0,0|0,0,2]=4 18 B12R1.26 COC(=O)CCN1C=C(C)C=N1 BB57-1421 [1,1,0,0,0,0|2,0,0]=4 19 B12R1.108 COC(=O)C(N)CC1=CN=CN1 BB01-7956 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.264 CC(Br)C(=O)NCC1=CC=CS1 BB01-5547 [1,1,0,0,0,0|1,1,0]=4 21 B12R1.31 CCOC(=O)CC1=CSC(N)=N1 BB01-2528 [0,1,0,0,1,0|2,0,0]=4 22 B12R1.31 CCOC(=O)CN1C=C(C)C=N1 BB57-1418 [0,1,0,0,1,0|2,0,0]=4 23 B12R1.55 CCOC(=O)C(=O)C1=CC=CS1 BB01-6280 [0,1,0,0,1,0|0,1,1]=4 24 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=C1 BB01-6210 [0,1,0,0,0,1|1,0,1]=4 25 B14R1.29 CCOC(=O)CC(=O)C1=CC=CN=C1 BB57-0252 [0,1,0,0,0,1|1,0,1]=4 26 B14R1.29 CCOC(=O)CC(=O)C1=CC=NC=C1 BB01-4764 [0,1,0,0,0,1|1,0,1]=4 27 B14R1.32 CCOC(=O)CNC1=CC(Cl)=CC=C1 BB58-0799 [0,1,0,0,0,1|2,0,0]=4 28 B14R1.32 CCOC(=O)COC1=CC(Cl)=CC=C1 BB05-4906 [0,1,0,0,0,1|2,0,0]=4 29 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 BB57-7139 [0,1,0,0,0,1|1,0,0]=3 30 B14R1.502 CCOC(=O)CNC1=CC=C(Br)C=C1 BB58-0805 [0,1,0,0,0,1|2,0,0]=4 31 B14R1.502 CCOC(=O)CNC1=CC=C(I)C=C1 BB58-3146 [0,1,0,0,0,1|2,0,0]=4 32 B14R1.598 CCOC(=O)CNC1=C(Cl)C=CC=C1 BB58-0800 [0,1,0,0,0,1|2,0,0]=4 33 B14R1.6454 CC(C)NC(=O)CNCC1=CC=CO1 BB01-5020 [0,1,0,0,0,1|1,0,0]=3 34 B14R1.524 CCOC(=O)\C(C#N)=C/C1=CC=CO1 BB57-6629 [0,2,0,0,0,0|0,0,2]=4 35 B14R2.249 O=C1CC(=O)CC(C2=CC=CO2)C1 BB01-3843 [0,1,0,1,0,0|1,0,1]=4 36 B10R1.11 CCCC(=O)C1=CC=CS1 BB55-2280 [0,0,0,0,2,0|1,1,0]=4 37 B10R1.11 CCOC(=O)C1=CC=CO1 BB17-0864 [0,0,0,0,2,0|0,0,0]=2 38 B10R1.11 CCOC(=O)C1=CC=NN1 BB05-1622 [0,0,0,0,2,0|2,0,0]=4 39 B14R1.520 CCOC(=O)CCNC1=CC=CC=C1 BB01-5849 [0,0,0,0,0,2|1,0,0]=3 40 B14R1.609 CCOC(=O)CCNCC1=CC=CS1 BB01-3571 [0,0,0,0,0,2|0,1,0]=3