0 B14R1.806 CC(C)(C)C1=CC=C(CC(=O)O)C=C1 OR7658 [1,0,0,0,0,0|0,0,0]=1 1 B14R1.806 CC(C)(C)C1=CC=C(NC(N)=S)C=C1 OR14394 [1,0,0,0,0,0|2,1,0]=4 2 B14R1.806 CS(=O)(=O)C1=CC=C(CC(=O)O)C=C1 OR8936 [1,0,0,0,0,0|3,0,0]=4 3 B14R1.2879 CC(C)C1=CC=C(NC(=O)CCl)C=C1 OR3111 [1,0,0,0,0,0|3,0,0]=4 4 B14R1.2879 COC(=O)CC1=CC=C([N+](=O)[O-])C=C1 OR956383 [1,0,0,0,0,0|3,0,0]=4 5 B16R1.1637 CON(C)C(=O)C1=CC=C(C(C)(C)C)C=C1 OR12107 [0,1,0,0,0,0|2,0,1]=4 6 B14R1.719 CC(C)(C)C1=CC=C(C(=O)CCl)C=C1 OR6263 [0,0,0,0,1,0|2,0,0]=3 7 B14R1.719 CC(C)(C)C1=CC=C(C(=O)NN)C=C1 OR5439 [0,0,0,0,1,0|2,0,0]=3 8 B13R1.140 CC(C)(C)C1=CC=C(CC#N)C=C1 OR6530 [2,0,0,0,0,0|1,0,1]=4 9 B13R1.140 CC(C)(C)C1=CC=C(N=C=O)C=C1 OR8491 [2,0,0,0,0,0|1,0,1]=4 10 B13R1.585 CC(C)C1=CC=C(CC(=O)O)C=C1 OR59979 [2,0,0,0,0,0|0,0,0]=2 11 B13R1.5 COC(=O)CC1=CC=C(C=O)C=C1 OR313093 [2,0,0,0,0,0|1,0,1]=4 12 B13R1.5 COC(=O)CC1=CC=C(CBr)C=C1 OR5099 [2,0,0,0,0,0|1,0,0]=3 13 B13R1.5 COC(=O)CC1=CC=C(CO)C=C1 OR55070 [2,0,0,0,0,0|1,0,0]=3 14 B15R1.23262 CC(C)(C)C1=CC=C(CS(=O)(=O)Cl)C=C1 OR300728 [1,1,0,0,0,0|1,0,1]=4 15 B17R1.9319 CC(C)(C)C1=CC=C(NC(=O)NCCCl)C=C1 OR12159 [0,2,0,0,0,0|2,0,0]=4 16 B15R2.19227 COC(=O)C1=CC=C(C2(N)CC2)C=C1 OR946502 [0,0,0,1,1,0|1,0,0]=3 17 B13R1.338 CC(=O)C1=CC=C(C(C)(C)C)C=C1 OR21926 [1,0,0,0,1,0|0,0,0]=2 18 B13R1.338 CC(C)(C)C1=CC=C(B(O)O)C=C1 OR10399 [1,0,0,0,1,0|1,0,1]=4 19 B13R1.338 CC(C)(C)C1=CC=C(C(N)=O)C=C1 OR21726 [1,0,0,0,1,0|1,0,0]=3 20 B13R1.338 CC(C)(C)C1=CC=C(C(N)=S)C=C1 OR27081 [1,0,0,0,1,0|1,1,0]=4 21 B13R1.338 CC(C)(C)C1=CN=C(C(=O)O)C=N1 OR302488 [1,0,0,0,1,0|2,0,0]=4 22 B13R1.338 CN(C)C1=CC=C(C(C)(C)C)C=C1 OR015893 [1,0,0,0,1,0|2,0,0]=4 23 B13R1.338 C[C@@H](N)C1=CC=C(C(C)(C)C)C=C1 OR15931 [1,0,0,0,1,0|1,0,1]=4 24 B13R1.338 C[C@H](N)C1=CC=C(C(C)(C)C)C=C1 OR15932 [1,0,0,0,1,0|1,0,1]=4 25 B13R1.537 COC(=O)C1=CC=C(C(C)=O)C=C1 OR13031 [1,0,0,0,1,0|1,0,1]=4 26 B13R1.537 COC(=O)C1=CC=C(C(C)O)C=C1 OR24665 [1,0,0,0,1,0|1,0,0]=3 27 B13R1.537 COC(=O)C1=CC=C([C@H](C)N)C=C1 OR52064 [1,0,0,0,1,0|1,0,0]=3