0 B12R1.6 COC1=CC=C(S(C)(=N)=O)C=C1 9069AJ [0,0,0,0,0,0|3,0,1]=4 1 B12R1.6 CS(=O)(=O)C1=CC=C(C=O)C=N1 4222AA [0,0,0,0,0,0|3,0,1]=4 2 B12R1.6 CS(=O)(=O)C1=CN=C(CN)C=C1 3069AC [0,0,0,0,0,0|2,0,0]=2 3 B12R1.6 N#CC1=CC=C(S(=O)(=O)Cl)C=N1 5690AC [0,0,0,0,0,0|2,0,2]=4 4 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 3772AC [1,0,0,0,0,0|2,0,0]=3 5 B11R1.3 NCC1=CC=C(B(O)O)C=C1 Y9279 [1,0,0,0,0,0|1,0,2]=4 6 B11R1.3 NCC1=CN=C(C(N)=O)C=C1 Y1977 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.19 CC(C)(N)C1=CC=C(N)C=C1 2445AJ [1,0,0,0,0,0|3,0,0]=4 8 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 X5539 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 3773AA [1,0,0,0,0,0|1,0,0]=2 10 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 6376AC [1,0,0,0,0,0|1,0,0]=2 11 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 9369AA [1,0,0,0,0,0|1,0,0]=2 12 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 X3141 [1,0,0,0,0,0|1,0,0]=2 13 B11R1.19 CC1=CN=C(S(C)(=O)=O)N=C1 Z2579 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.19 CS(=N)(=O)C1=CC=C(F)C=C1 9066AJ [1,0,0,0,0,0|2,0,1]=4 15 B11R1.19 NC1=NC=C(S(=O)(=O)Cl)C=N1 2906AB [1,0,0,0,0,0|3,0,0]=4 16 B11R1.19 O=S(=O)(O)C1=CC=C(F)C=C1 6175AJ [1,0,0,0,0,0|2,0,0]=3 17 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 Z2885 [1,0,0,0,0,0|2,0,0]=3 18 B13R1.140 CCNC1=CC=C(S(C)(=O)=O)C=C1 8787AH [0,1,0,0,0,0|2,0,0]=3 19 B13R1.187 CNS(=O)(=O)C1=CC=C(C=O)C=C1 3616AD [0,1,0,0,0,0|1,0,1]=3 20 B13R1.338 N=C(N)C1=CC=C(S(N)(=O)=O)C=C1 7986AB [0,1,0,0,0,0|0,0,1]=2 21 B10R1.3 NCC1=CC=C(CBr)C=C1 9484AE [2,0,0,0,0,0|2,0,0]=4 22 B10R1.3 NCC1=CC=C(CCl)C=C1 9520AE [2,0,0,0,0,0|2,0,0]=4 23 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 7866AF [2,0,0,0,0,0|0,0,2]=4 24 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 O022 [2,0,0,0,0,0|1,0,1]=4 25 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 W7688 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.28 O=S(=O)(Cl)C1=CC=NC=C1 Z4790 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.28 O=S(=O)(Cl)C1=NC=CC=C1 Y9771 [2,0,0,0,0,0|2,0,0]=4 28 B12R1.256 C[C@@H](N)C1=CC=C(C(N)=O)C=C1 8984AA [1,1,0,0,0,0|1,0,0]=3 29 B12R1.9 CCS(=O)(=O)C1=CC=C(Cl)C=C1 1182AC [1,1,0,0,0,0|2,0,0]=4 30 B12R1.9 CSS(=O)(=O)C1=CC=C(C)C=C1 4287AE [1,1,0,0,0,0|1,0,0]=3 31 B12R1.23 O=S(=O)(F)C1=CC(Cl)=C(Cl)C=C1 0468AQ [1,1,0,0,0,0|2,0,0]=4 32 B12R1.126 CC1=CC=C(S(=O)(=O)[O-])C(C)=C1 L075 [1,1,0,0,0,0|1,0,0]=3 33 B12R1.126 CS(=O)(=O)C1=CC=C(F)C=C1N 7058AC [1,1,0,0,0,0|2,0,0]=4 34 B12R1.126 O=S(=O)(F)C1=C(F)C=C(Br)C=C1 0571AQ [1,1,0,0,0,0|2,0,0]=4 35 B12R1.180 NCCC1=CC=C(S(N)(=O)=O)S1 2937AJ [0,1,0,0,1,0|1,0,0]=3 36 B14R1.4227 CC1=CC(S(N)(=O)=O)=CC=C1B(O)O V3047 [0,2,0,0,0,0|2,0,0]=4 37 B14R1.4227 NC1=CC(S(N)(=O)=O)=CC=C1C(=O)O 8386AD [0,2,0,0,0,0|1,0,1]=4 38 B14R1.719 CS(=O)(=O)C1=CC=C(C(=O)CN)C=C1 7694AC [0,2,0,0,0,0|1,0,0]=3 39 B14R1.3125 CNS(=O)(=O)C1=CC=C(N=C=S)C=C1 7658AD [0,2,0,0,0,0|1,0,1]=4 40 B14R2.3125 CS(=O)(=O)C1=CC2=C(C=CN2)C=C1 4042AE [0,1,0,1,0,0|1,0,1]=4 41 B14R2.3125 NS(=O)(=O)C1=CC=C2NC=CC2=C1 3256AB [0,1,0,1,0,0|1,0,1]=4 42 B14R2.3125 O=S(=O)(O)C1=CC2=C(C=C1)N=CN2 8979AD [0,1,0,1,0,0|1,0,1]=4 43 B14R2.3123 O=S(=O)(Cl)C1=CC=C(C2CC2)C=C1 8536AA [0,1,0,1,0,0|2,0,0]=4 44 B12R1.106 CC1=CC=C(CS(N)(=O)=O)C=C1 7376AE [1,0,0,0,0,1|0,0,0]=2