0 B10R1.119 CC1=C(C)C(O)=CC=C1O BBL027769 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.119 CC1=C(Cl)C(N)=CC=C1Cl BBL003432 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.119 CC1=C(O)C(=O)C=CN1C BBL036482 [0,0,0,0,0,0|0,0,0]=0 3 B10R1.119 CC1=CC=C(N)C(O)=C1C BBL002402 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.3 CC1=C(O)C(=O)C=CO1 BBL011669 [1,0,0,0,0,0|1,0,0]=2 5 B9R1.3 CC1=C(O)OC=CC1=O BBL029401 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.3 CC1=CC=CC(C)=C1O BBL011609 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.3 CC1=CC=CC(N)=C1O BBL000343 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.3 NC1=CC=CC(Cl)=C1O BBL025753 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.3 OC1=CC=CC(O)=C1O BBL011607 [1,0,0,0,0,0|2,0,1]=4 10 B9R1.69 CC1=C(F)C=C(N)C=C1 BBL100253 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.69 CC1=C(N)C=C(N)C=C1 BBL011285 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.69 CC1=CC(=O)C=CC1=O BBL037012 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.69 CC1=CC(C)=C(O)C=C1 BBL011443 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.69 CC1=CC(N)=C(N)C=C1 BBL013178 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.69 CC1=CC(N)=C(O)C=C1 BBL001485 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.69 CC1=CC(O)=C(N)C=C1 BBL002991 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.69 NC1=CC=C(Cl)C=C1O BBL018708 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.32 CC1=C(C)C(Br)=C(O)C(N)=C1 BBL000350 [0,1,0,0,0,0|2,0,1]=4 19 B11R1.32 CC1=CC(=O)C(C)=C(C)C1=O BBL100342 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.32 CN1C(=O)C=C(O)N(C)C1=O BBL007161 [0,1,0,0,0,0|3,0,0]=4 21 B9R1.37 CC1=C(Br)C(Br)=NN1C BBL028662 [0,0,0,0,1,0|3,0,0]=4 22 B9R1.37 CC1=C(Br)C(N)=NN1C BBL040976 [0,0,0,0,1,0|3,0,0]=4 23 B9R1.37 CC1=C(Cl)C(N)=NN1C BBL040758 [0,0,0,0,1,0|3,0,0]=4 24 B9R1.37 CC1=NN(C)C(C)=C1I BBL028829 [0,0,0,0,1,0|3,0,0]=4 25 B9R1.37 CC1=NN(C)C(C)=C1N BBL012617 [0,0,0,0,1,0|3,0,0]=4 26 B8R1.4 CC1=CC(C)=NC=C1 BBL027575 [2,0,0,0,0,0|1,0,1]=4 27 B8R1.4 [O-][N+]1=CC=CC(O)=C1 BBL027566 [2,0,0,0,0,0|1,0,1]=4 28 B8R1.5 CC1=CC=NC=C1C BBL027583 [2,0,0,0,0,0|2,0,0]=4 29 B8R1.5 C[N+]1=CC=CC=C1Cl BBL011337 [2,0,0,0,0,0|1,0,1]=4 30 B8R1.5 NC1=C(O)C=CC=N1 BBL009590 [2,0,0,0,0,0|1,0,1]=4 31 B8R1.5 OC1=C(O)N=CC=C1 BBL027572 [2,0,0,0,0,0|1,0,1]=4 32 B8R1.5 OC1=CC=CN=C1Br BBL013305 [2,0,0,0,0,0|1,0,1]=4 33 B8R1.3 O=C1C=CC(=O)C=C1 BBL010327 [2,0,0,0,0,0|2,0,0]=4 34 B10R1.2 CCC1=C(O)C(=O)C=CO1 BBL036457 [1,1,0,0,0,0|1,0,0]=3 35 B10R1.2 O=CC1=C(O)C(O)=CC=C1 BBL000528 [1,1,0,0,0,0|2,0,0]=4 36 B10R1.22 CC1=CC(N)=C(O)C(C)=C1 BBL008044 [1,1,0,0,0,0|2,0,0]=4 37 B10R1.22 CC1=CC(N)=CC(C)=C1O BBL003443 [1,1,0,0,0,0|2,0,0]=4 38 B10R1.22 CC1=CC(N)=CC(N)=C1C BBL002799 [1,1,0,0,0,0|2,0,0]=4 39 B10R1.245 COC1=C(C)NC=CC1=O BBL029879 [1,1,0,0,0,0|0,0,0]=2 40 B10R1.25 O=CC1=CC=C(O)C=C1O BBL012171 [1,1,0,0,0,0|2,0,0]=4 41 B10R1.118 CC1=CC(N)=C(O)C=C1C BBL009518 [1,1,0,0,0,0|1,0,1]=4 42 B10R1.118 O=C1C=C(O)C(=O)C=C1O BBL011605 [1,1,0,0,0,0|2,0,0]=4 43 B10R1.176 CC1=C(C)C=C(CN)C=C1 BBL037742 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.256 CC1=NN(C)C(C)=C1CO BBL029032 [0,1,0,0,1,0|2,0,0]=4 45 B12R1.544 CC1=C(O)C(=O)C=CN1CCO BBL036878 [0,2,0,0,0,0|0,0,0]=2 46 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 BBL023509 [0,2,0,0,0,0|1,0,0]=3 47 B8R1.50 CC1=C(Br)C=NN1C BBL031474 [1,0,0,0,1,0|2,0,0]=4