0 B10R1.58 CC(=O)C1=CC(C)=C(Cl)S1 038280 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.35 CC(=O)C1=CC(Cl)=CS1 033141 [1,0,0,0,0,0|2,0,0]=3 2 B9R1.35 CC1=CNC(C(=O)O)=C1 040049 [1,0,0,0,0,0|1,0,0]=2 3 B9R1.35 O=C(O)C1=CC(Cl)=CN1 237313 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.35 O=S([O-])C1=CC=C(Br)S1 035601 [1,0,0,0,0,0|1,1,1]=4 5 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 028026 [0,1,0,0,0,0|2,0,0]=3 6 B11R1.21 CC1=C(Cl)C=CC(C(=O)Cl)=C1 062746 [0,0,0,0,0,1|2,0,0]=3 7 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Br)C=C1 038130 [0,0,0,0,0,1|3,0,0]=4 8 B11R1.74 CC1=CC(C(=O)Cl)=CC(Br)=C1 062789 [0,0,0,0,0,1|2,1,0]=4 9 B8R1.18 CC1=CC(=O)NC1=O 105167 [2,0,0,0,0,0|2,0,0]=4 10 B10R1.14 COC(=O)C1=CC=C(Br)N1 092635 [1,1,0,0,0,0|1,1,0]=4 11 B10R1.31 CCC1=CC=C(C(=O)O)S1 014517 [1,1,0,0,0,0|1,0,0]=3 12 B10R1.59 O=C(O)C1=C(Cl)C=C(Br)S1 093789 [1,1,0,0,0,0|0,1,0]=3 13 B10R1.59 O=C(O)C1=C(I)C=C(Br)S1 093792 [1,1,0,0,0,0|0,1,0]=3 14 B10R1.59 O=C(O)C1=C(I)C=C(I)S1 093793 [1,1,0,0,0,0|0,1,0]=3 15 B12R1.56 O=C(O)C1=CC=C(Br)C(CO)=C1 211450 [0,1,0,0,0,1|1,1,0]=4 16 B12R1.232 CC1=C(C(=O)O)C=C(Cl)C(Br)=C1 069444 [0,1,0,0,0,1|2,0,0]=4 17 B12R1.232 CC1=CC(C(=O)O)=C(Cl)C=C1F 075720 [0,1,0,0,0,1|1,1,0]=4 18 B12R1.232 CC1=CC(Cl)=C(Cl)C=C1C(=O)O 214354 [0,1,0,0,0,1|2,0,0]=4 19 B12R1.232 NC1=CC(C(=O)O)=C(Br)C=C1Cl 038736 [0,1,0,0,0,1|2,0,0]=4 20 B12R1.893 CC1=C(C(=O)O)C=CC(Br)=C1Cl 069689 [0,1,0,0,0,1|2,0,0]=4 21 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1C 069412 [0,1,0,0,0,1|1,0,0]=3 22 B12R1.893 O=C(O)C1=C(Cl)C(Cl)=C(Br)C=C1 069695 [0,1,0,0,0,1|2,0,0]=4 23 B12R1.893 O=C(O)C1=C(F)C(Cl)=C(Cl)C=C1 069713 [0,1,0,0,0,1|2,0,0]=4 24 B12R1.1005 CC1=C(Br)C(Cl)=CC(C(=O)O)=C1 214350 [0,1,0,0,0,1|1,1,0]=4 25 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Br 069416 [0,1,0,0,0,1|1,1,0]=4 26 B12R1.1005 O=C(O)C1=CC(Cl)=C(Br)C(F)=C1 097814 [0,1,0,0,0,1|2,0,0]=4 27 B12R1.1005 O=C(O)C1=CC(Cl)=C(Cl)C(Cl)=C1 092536 [0,1,0,0,0,1|2,0,0]=4 28 B12R1.11 CCC1=CC(C(=O)O)=CC(C)=C1 038647 [0,1,0,0,0,1|2,0,0]=4 29 B12R1.358 COC(=O)C1=CC(N)=NC(Cl)=C1 105309 [0,1,0,0,0,1|2,0,0]=4 30 B12R1.511 CC1=C(C(=O)O)C=C(Cl)C=C1Br 098519 [0,1,0,0,0,1|2,0,0]=4 31 B12R1.511 CC1=C(C(=O)O)C=C(Cl)C=C1F 075734 [0,1,0,0,0,1|2,0,0]=4 32 B12R1.511 CC1=CC(Br)=CC(C(=O)O)=C1Br 062774 [0,1,0,0,0,1|1,1,0]=4 33 B12R1.511 CC1=CC(Br)=CC(C(=O)O)=C1Cl 062775 [0,1,0,0,0,1|1,1,0]=4 34 B12R1.511 CC1=CC(Br)=CC(C(=O)O)=C1I 062773 [0,1,0,0,0,1|1,1,0]=4 35 B12R1.511 CC1=CC(C(=O)O)=C(F)C(Br)=C1 098564 [0,1,0,0,0,1|1,1,0]=4 36 B12R1.511 O=C(O)C1=C(Cl)C(Br)=CC(Cl)=C1 098343 [0,1,0,0,0,1|2,0,0]=4 37 B12R1.511 O=C(O)C1=CC(Cl)=CC(Br)=C1F 302730 [0,1,0,0,0,1|2,0,0]=4 38 B12R1.511 O=C(O)C1=CC(Cl)=CC(F)=C1Cl 232127 [0,1,0,0,0,1|2,0,0]=4