0 B12R1.17 CCOC(=O)C1=CC(=CC=C1)F 6293 [1,0,0,0,0,0|1,1,0]=3 1 B12R1.17 CCOC(=O)C1=CC(=CC=C1)I 5004 [1,0,0,0,0,0|1,1,0]=3 2 B12R1.17 CCOC(=O)C1=CC(=CN=C1)Br 6634 [1,0,0,0,0,0|2,1,0]=4 3 B12R1.358 CC1=NC(=CC(=C1)C(=O)OC)Cl 8244 [1,0,0,0,0,0|1,0,0]=2 4 B12R1.358 COC(=O)C1=CC(=CC(=C1)Cl)Cl 8135 [1,0,0,0,0,0|1,0,0]=2 5 B12R1.358 COC(=O)C1=CC(=NC(=C1)Cl)Cl 8871 [1,0,0,0,0,0|0,0,0]=1 6 B12R1.358 COC(=O)C1=CC(=NC(=N1)Cl)Cl 10386 [1,0,0,0,0,0|1,0,0]=2 7 B14R1.6821 CCOC(=O)C1=CC(=C(C(=C1)I)N)I 10467 [0,1,0,0,0,0|1,2,0]=4 8 B12R1.313 CCOC(=O)C1=C(N=C(S1)C)C 8335 [0,0,0,0,1,0|3,0,0]=4 9 B11R1.23 CCC(=O)C1=CC(=CC=C1)F 5174 [2,0,0,0,0,0|1,1,0]=4 10 B11R1.23 COC(=O)C1=CC(=CC=C1)Cl 8550 [2,0,0,0,0,0|1,0,0]=3 11 B11R1.23 COC(=O)C1=CC(=CC=C1)I 9834 [2,0,0,0,0,0|1,1,0]=4 12 B11R1.23 COC(=O)C1=CC(=CC=C1)O 10660 [2,0,0,0,0,0|2,0,0]=4 13 B11R1.23 COC(=O)C1=NC=CC(=C1)Cl 9624 [2,0,0,0,0,0|2,0,0]=4 14 B11R1.74 C1=C(C=C(C=C1Cl)Cl)C(=O)O 5395 [2,0,0,0,0,0|1,0,0]=3 15 B11R1.74 C1=C(C=C(C=C1F)Cl)C(=O)O 10049 [2,0,0,0,0,0|1,1,0]=4 16 B11R1.74 C1=C(C=C(N=C1Cl)Cl)C(=O)O 6506 [2,0,0,0,0,0|0,0,0]=2 17 B11R1.74 CC1=NC(=CC(=C1)C(=O)O)Cl 6505 [2,0,0,0,0,0|1,0,0]=3 18 B11R1.74 c1c(nc(nc1Cl)Cl)C(=O)O D2449 [2,0,0,0,0,0|1,0,0]=3 19 B13R1.466 CCOC(=O)C1=CC(=C(C=C1)F)F 5270 [1,1,0,0,0,0|1,1,0]=4 20 B11R1.15 CCOC(=O)C1=CN=C(S1)N 6669 [1,0,0,0,1,0|2,0,0]=4 21 B11R1.199 CCOC(=O)C1=C(SC=C1)N 8800 [1,0,0,0,1,0|2,0,0]=4