0 B14R1.623 CCOC(=O)C1=CC=CN=C1C(=O)O 6329842 [0,0,0,0,0,0|1,0,0]=1 1 B13R1.547 CNC(=O)C1=CC=CC=C1[N+](=O)[O-] 7112890190 [1,0,0,0,0,0|2,0,1]=4 2 B13R1.572 O=C(O)C1=C(NCCO)C=CC=C1 7119850442 [1,0,0,0,0,0|3,0,0]=4 3 B15R1.1239 O=C(O)C1=C(C(=O)NCCO)C=CC=C1 2353870 [0,1,0,0,0,0|1,0,0]=2 4 B15R2.1221 O=C(O)C1=C(C2CCCC2)C=CC=C1 5024891 [0,0,0,1,0,0|2,0,1]=4 5 B15R1.1274 CCOC(=O)NC1=CC=CC=C1C(N)=O 0107620427 [0,0,0,0,0,1|1,0,0]=2 6 B15R1.1274 COCC(=O)NC1=CC=CC=C1C(=O)O 7014400395 [0,0,0,0,0,1|2,0,0]=3 7 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 2832870 [2,0,0,0,0,0|0,0,0]=2 8 B12R1.121 CCCOC1=C(C=O)C=CC=C1 2083919 [2,0,0,0,0,0|2,0,0]=4 9 B12R1.308 CCCC(=O)C1=C(F)C=CC=C1 1505986 [2,0,0,0,0,0|2,0,0]=4 10 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 2832924 [2,0,0,0,0,0|0,0,1]=3 11 B12R1.308 CCOC(=O)C1=C(N)C=CC=C1 1867347 [2,0,0,0,0,0|1,0,0]=3 12 B12R1.308 CCOC(=O)C1=CC=CN=C1N 7020542808 [2,0,0,0,0,0|2,0,0]=4 13 B12R1.261 CC(C)C1=C(C(=O)O)C=CC=C1 2048899 [2,0,0,0,0,0|1,0,1]=4 14 B12R1.261 O=C(O)C1=C(C(=O)O)C=CC=C1 7211970022 [2,0,0,0,0,0|0,0,0]=2 15 B12R1.261 O=C(O)C1=C(C(=O)O)N=CC=C1 2842272 [2,0,0,0,0,0|1,0,0]=3 16 B12R1.261 O=C(O)C1=CC=CC=C1[N+](=O)[O-] 0125160260 [2,0,0,0,0,0|1,0,1]=4 17 B12R1.283 CCNC1=C(C(=O)O)C=CC=C1 7119850653 [2,0,0,0,0,0|1,0,0]=3 18 B12R1.283 CCOC1=C(C(C)=O)C=CC=C1 7016233988 [2,0,0,0,0,0|1,0,0]=3 19 B14R1.745 COC(=O)C1=C(S(=O)(=O)Cl)C=CC=C1 3057977 [1,1,0,0,0,0|1,0,1]=4 20 B14R1.745 COC(=O)C1=CC=CC=C1S(C)(=O)=O 19767668 [1,1,0,0,0,0|1,0,1]=4 21 B14R1.746 COC(=O)C1=CC=CC=C1C(=O)OC 7214190712 [1,1,0,0,0,0|0,0,0]=2 22 B16R1.960 CCOC(=O)C1=CC=CC=C1NC(=O)CCl 3165304 [0,1,0,0,0,1|1,0,0]=3 23 B16R1.4493 CCCOC(=O)NC1=CC=CC=C1C(=O)O 0107620789 [0,1,0,0,0,1|0,0,0]=2 24 B16R1.4493 CCCOC(=O)NC1=CC=CC=C1C(N)=O 0107620801 [0,1,0,0,0,1|1,0,0]=3 25 B16R1.14964 CCOC(=O)C1=CC=CC=C1C(=O)OCC 2986446 [0,2,0,0,0,0|0,0,0]=2 26 B16R1.12449 CC(C)CS(=O)(=O)C1=CC=CC=C1C(=O)O 7020618893 [0,2,0,0,0,0|2,0,0]=4 27 B14R2.215 O=C1C2=C(C=CC=C2)C(=O)N1CCl 2961686 [1,0,0,1,0,0|2,0,0]=4 28 B14R2.215 O=C1C2=C(C=CC=C2)C(=O)N1CO 7113231785 [1,0,0,1,0,0|2,0,0]=4 29 B14R2.8053 O=C(O)C1=COC2=C1C(=O)CCC2 7118560631 [0,0,0,1,1,0|2,0,0]=4 30 B12R1.316 CCOC(=O)C1=C(C=O)N=CN1 11186572 [1,0,0,0,1,0|2,0,0]=4 31 B12R1.316 CCOC(=O)C1=C(C=O)NC=N1 10390248 [1,0,0,0,1,0|2,0,0]=4 32 B14R1.965 O=CC1=CC=CC=C1NC(=O)CCCl 9958145 [1,0,0,0,0,1|2,0,0]=4 33 B14R1.744 COC(=O)C1=C(OC(C)=O)C=CC=C1 11186498 [1,0,0,0,0,1|1,0,0]=3 34 B14R1.617 CCOC(=O)C1=NC(C(=O)O)=CC=C1 1556643 [0,0,0,0,1,1|0,0,0]=2 35 B16R1.4440 CCOC(=O)COC1=C(C(N)=O)C=CC=C1 2999337 [0,0,0,0,0,2|1,0,0]=3 36 B16R1.4440 CCOC(=O)COC1=CC=CC=C1C(C)=O 7016233976 [0,0,0,0,0,2|1,0,0]=3