0 B14R2.20 CC1=NC(C2=CC=C(O)C=C2)=NO1 BB52-8111 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.20 CC1=NN(C2=CC=C(Br)C=C2)C=C1 BB31-5464 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=CS1 BB52-5140 [0,0,0,0,0,0|0,2,2]=4 3 B14R2.20 NC1=NC(C2=CC=C(F)C=C2)=CS1 BB52-1702 [0,0,0,0,0,0|0,2,2]=4 4 B14R2.20 NC1=NC(C2=CC=C(O)C=C2)=NN1 BB52-6443 [0,0,0,0,0,0|3,0,1]=4 5 B13R2.10 O=C1N=C(C2=CC=CC=C2)NO1 BB31-2554 [1,0,0,0,0,0|2,0,1]=4 6 B13R2.12 BrC1=CC=C(C2=NC=CO2)C=C1 BB31-3632 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.12 BrC1=CC=C(C2=NC=CS2)C=C1 BB32-1131 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.12 BrC1=CC=C(C2CCNC2)C=C1 BB31-9195 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.12 FC1=CC=C(C2=COC=N2)C=C1 BB32-3604 [1,0,0,0,0,0|0,1,2]=4 10 B15R2.275 CC1=CC=C(C2=NOC(CN)=N2)C=C1 BB52-8304 [0,1,0,0,0,0|2,0,1]=4 11 B15R2.275 NCC1=NC(C2=CC=C(Cl)C=C2)=NO1 BB52-8310 [0,1,0,0,0,0|1,1,1]=4 12 B15R2.275 NCC1=NC(C2=CC=C(F)C=C2)=NO1 BB10-5742 [0,1,0,0,0,0|1,1,1]=4 13 B15R2.275 NNC1=NC(C2=CC=C(Br)C=C2)=CS1 BB52-5377 [0,1,0,0,0,0|0,1,2]=4 14 B13R1.14 COC(=O)CCC1=CC=C(C)C=C1 BB32-3522 [0,0,1,0,0,0|3,0,0]=4 15 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 BB31-4540 [0,0,1,0,0,0|2,1,0]=4 16 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 BB32-1808 [0,0,1,0,0,0|3,0,0]=4 17 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)C1 BB31-4694 [0,0,0,0,1,0|2,0,0]=3 18 B15R2.28 NC1=NC(C2=CC=C(Br)C=C2)=CC=N1 BB52-7321 [0,0,0,0,0,1|1,0,2]=4 19 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 BB31-5440 [1,0,1,0,0,0|2,0,0]=4 20 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 BB31-5414 [1,0,1,0,0,0|2,0,0]=4 21 B14R1.10 COC(=O)C[C@@H](N)C1=CC=C(Br)C=C1 BB31-5327 [0,1,1,0,0,0|2,0,0]=4 22 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(Br)C=C1 BB31-2342 [0,1,1,0,0,0|2,0,0]=4 23 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 BB52-8301 [1,1,0,0,0,0|1,0,1]=4 24 B12R1.20 CC(C(=O)O)C1=CC=C(Br)C=C1 BB32-2376 [0,0,1,0,1,0|1,0,0]=3 25 B12R1.20 CC(C(=O)O)C1=CC=C(N)C=C1 BB32-3174 [0,0,1,0,1,0|2,0,0]=4 26 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 BB32-0141 [0,0,1,0,1,0|2,0,0]=4 27 B12R2.22 N[C@H]1C[C@H](C2=CC=CC=C2)C1 BB31-3001 [1,0,0,0,1,0|1,0,1]=4 28 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 BB32-3180 [1,0,0,0,1,0|1,0,1]=4 29 B12R2.2302 BrC1=CC=C(C2CCC2)C=C1 BB32-2056 [1,0,0,0,1,0|1,0,1]=4 30 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 BB31-9844 [0,0,0,0,2,0|0,0,1]=3 31 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 BB31-3897 [0,0,0,0,2,0|0,1,1]=4 32 B14R2.21 O=C1COC[C@H](C2=CC=CC=C2)N1 BB31-8770 [1,0,0,0,0,1|1,0,1]=4