0 B9R1.69 CC1=CC=C(N)C(S)=C1 203553 [0,0,0,0,0,0|3,1,0]=4 1 B9R1.69 CC1=CC=C(S)C(N)=C1 203537 [0,0,0,0,0,0|3,1,0]=4 2 B9R1.69 CC1=CC=C(S)C([NH3+])=C1 203538 [0,0,0,0,0,0|3,1,0]=4 3 B9R1.69 CC1=CC=C([NH3+])C(S)=C1 203554 [0,0,0,0,0,0|3,1,0]=4 4 B9R1.69 NC1=CC(Br)=CC=C1S 203542 [0,0,0,0,0,0|2,2,0]=4 5 B9R1.69 NC1=CC(F)=CC=C1S 203544 [0,0,0,0,0,0|2,2,0]=4 6 B9R1.69 NC1=CC(N)=C(O)C=C1 RT-R05-066 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.69 NC1=CC=C(Br)C=C1S 203557 [0,0,0,0,0,0|2,2,0]=4 8 B9R1.69 NC1=CC=C(Cl)C=C1S 203555 [0,0,0,0,0,0|2,1,0]=3 9 B9R1.69 NC1=CC=C(F)C=C1S 203559 [0,0,0,0,0,0|2,2,0]=4 10 B9R1.69 [NH3+]C1=CC(Br)=CC=C1S 203541 [0,0,0,0,0,0|2,2,0]=4 11 B9R1.69 [NH3+]C1=CC(Cl)=CC=C1S 203539 [0,0,0,0,0,0|2,1,0]=3 12 B9R1.69 [NH3+]C1=CC(F)=CC=C1S 203543 [0,0,0,0,0,0|2,2,0]=4 13 B9R1.69 [NH3+]C1=CC=C(Br)C=C1S 203558 [0,0,0,0,0,0|2,2,0]=4 14 B9R1.69 [NH3+]C1=CC=C(Cl)C=C1S 203556 [0,0,0,0,0,0|2,1,0]=3 15 B9R1.69 [NH3+]C1=CC=C(F)C=C1S 203560 [0,0,0,0,0,0|2,2,0]=4 16 B8R1.3 CC1=NC=C(Br)C=C1 201345 [1,0,0,0,0,0|1,1,1]=4 17 B8R1.3 CC1=NC=C(Cl)C=C1 201146 [1,0,0,0,0,0|1,0,1]=3 18 B8R1.3 CC1=NC=C(N)C=C1 201145 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.22 NC1=C(Cl)C=C(Cl)C=C1S 203814 [0,1,0,0,0,0|2,1,0]=4 20 B10R1.22 NC1=CC(Cl)=CC(Cl)=C1S 203813 [0,1,0,0,0,0|2,1,0]=4 21 B10R1.118 NC1=CC(Cl)=C(Cl)C=C1S 203816 [0,1,0,0,0,0|2,1,0]=4 22 B10R1.119 CC1=NC=C(Cl)C(Br)=C1Cl 202825 [0,1,0,0,0,0|2,0,1]=4 23 B10R1.119 CC1=NC=C(Cl)C(Cl)=C1Br 202829 [0,1,0,0,0,0|2,0,1]=4 24 B10R1.119 CC1=NC=C(Cl)C(Cl)=C1Cl 201005 [0,1,0,0,0,0|2,0,1]=4 25 B10R1.119 CC1=NC=C(Cl)C(N)=C1Br 202827 [0,1,0,0,0,0|2,0,1]=4 26 B10R1.119 CC1=NC=C(Cl)C(N)=C1Cl 201151 [0,1,0,0,0,0|2,0,1]=4 27 B10R1.119 NC1=C(Cl)C(Cl)=CC=C1S 203817 [0,1,0,0,0,0|2,1,0]=4 28 B10R1.119 NC1=C(Cl)C=CC(Cl)=C1S 203818 [0,1,0,0,0,0|2,1,0]=4 29 B10R1.119 NC1=CC=C(Cl)C(Cl)=C1S 203815 [0,1,0,0,0,0|2,1,0]=4 30 B10R1.119 [NH3+]C1=C(Cl)C=CC(Cl)=C1S 203820 [0,1,0,0,0,0|2,1,0]=4 31 B9R1.3 NC1=C(Cl)C=CC=C1S 203525 [1,1,0,0,0,0|1,1,0]=4 32 B9R1.3 NC1=CC=CC(Cl)=C1S 203571 [1,1,0,0,0,0|2,0,0]=4 33 B9R1.3 [NH3+]C1=C(Cl)C=CC=C1S 203588 [1,1,0,0,0,0|1,1,0]=4 34 B9R1.3 [NH3+]C1=CC=CC(Cl)=C1S 203141 [1,1,0,0,0,0|2,0,0]=4