0 B11R1.3 CCC1=CC=C(C(C)N)C=C1 4003786 [1,0,0,0,0,0|3,0,0]=4 1 B11R1.3 CCC1=CC=C(C(C)N)C=C1 4087794 [1,0,0,0,0,0|3,0,0]=4 2 B11R1.3 CCC1=CC=C([C@@H](C)N)C=C1 4106468 [1,0,0,0,0,0|3,0,0]=4 3 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 4092777 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 4043316 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 4035889 [1,0,0,0,0,0|2,0,0]=3 6 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 4085301 [1,0,0,0,0,0|1,0,0]=2 7 B11R1.19 CS(=O)(=O)C1=CN=C(Cl)C=C1 4036589 [1,0,0,0,0,0|3,0,0]=4 8 B13R1.38 COC1=C(Cl)C=C(S(=O)(=O)Cl)C=C1 4032260 [0,1,0,0,0,0|3,0,0]=4 9 B13R1.38 COC1=C(F)C=C(S(=O)(=O)Cl)C=C1 4026924 [0,1,0,0,0,0|3,0,0]=4 10 B13R1.38 COC1=CC=C(S(=O)(=O)Cl)C=C1Br 4040623 [0,1,0,0,0,0|3,0,0]=4 11 B13R1.140 CCOC1=CC=C(S(=O)(=O)Cl)C=C1 4011788 [0,1,0,0,0,0|2,0,0]=3 12 B13R1.338 CC(=O)C1=CC=C(S(=O)(=O)Cl)C=C1 4001661 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.338 CC(C)C1=CC=C(S(=O)(=O)Cl)C=C1 3002707 [0,1,0,0,0,0|2,0,0]=3 14 B13R1.338 CC(N)C1=CC=C(S(C)(=O)=O)C=C1 4032337 [0,1,0,0,0,0|1,0,0]=2 15 B13R1.338 NC(=O)C1=CC=C(S(=O)(=O)Cl)C=C1 4020382 [0,1,0,0,0,0|1,0,1]=3 16 B11R1.45 CCC1=CC=C(S(=O)(=O)Cl)S1 4011740 [0,0,0,0,1,0|3,0,0]=4 17 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 4009816 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 4089351 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.5 CNC(=O)C1=CC=C(CCl)C=C1 4033046 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 4034036 [1,1,0,0,0,0|1,0,0]=3 21 B12R1.5 CNC(=O)C1=CC=C(CO)C=C1 4032667 [1,1,0,0,0,0|2,0,0]=4 22 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 4043756 [1,1,0,0,0,0|1,0,1]=4 23 B12R1.23 CC1=C(N)C=C(S(C)(=O)=O)C=C1 4043521 [1,1,0,0,0,0|1,0,0]=3 24 B12R1.23 CC1=CC=C(S(=O)(=O)Cl)C=C1C 3002405 [1,1,0,0,0,0|1,0,0]=3 25 B12R1.23 CC1=CC=C(S(N)(=O)=O)C=C1N 4028971 [1,1,0,0,0,0|0,0,0]=2 26 B12R1.23 NC1=C(O)C=C(S(N)(=O)=O)C=C1 4044822 [1,1,0,0,0,0|0,0,0]=2 27 B12R1.23 NC1=CC(S(N)(=O)=O)=CC=C1Cl 5701002 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.126 CC1=CC(Cl)=CC=C1S(=O)(=O)Cl 4035429 [1,1,0,0,0,0|2,0,0]=4 29 B14R1.144 CCOC1=C(C)C=C(S(=O)(=O)Cl)C=C1 4033658 [0,2,0,0,0,0|2,0,0]=4 30 B14R1.66 CCCCC1=CC=C(S(=O)(=O)Cl)C=C1 3001853 [0,2,0,0,0,0|2,0,0]=4 31 B14R1.719 CCC(C)C1=CC=C(S(=O)(=O)Cl)C=C1 3002181 [0,2,0,0,0,0|2,0,0]=4 32 B14R1.719 CCC(N)C1=CC=C(S(C)(=O)=O)C=C1 4033287 [0,2,0,0,0,0|1,0,0]=3 33 B14R1.719 CNC(=O)C1=CC=C(S(=O)(=O)Cl)C=C1 4041446 [0,2,0,0,0,0|1,0,1]=4 34 B14R1.213 CN(C)S(=O)(=O)C1=CC=C(CN)C=C1 4032017 [0,2,0,0,0,0|0,0,0]=2 35 B14R1.3332 NS(=O)(=O)C1=CC=C(S(=O)(=O)Cl)C=C1 4043062 [0,2,0,0,0,0|2,0,0]=4 36 B10R1.55 CC1=CC=C(S(=O)(=O)Cl)S1 4004665 [1,0,0,0,1,0|2,0,0]=4 37 B12R1.106 CS(=O)(=O)CC1=CC=C(N)C=C1 4035478 [1,0,0,0,0,1|1,0,0]=3 38 B12R1.106 CS(=O)(=O)NC1=CC=C(N)C=C1 4033052 [1,0,0,0,0,1|1,0,0]=3 39 B12R1.106 O=S(=O)(Cl)CC1=CC=C(F)C=C1 4032430 [1,0,0,0,0,1|2,0,0]=4