0 B12R2.18 CN1C(=O)NC2=CC=CC=C21 CS-0035509 [0,0,0,0,0,0|2,0,0]=2 1 B11R2.1 BrC1=CNC2=NC=NC=C12 CS-W019834 [1,0,0,0,0,0|3,0,0]=4 2 B11R2.1 CC1=CNC2=NC=CC=C12 CS-B0512 [1,0,0,0,0,0|2,0,0]=3 3 B11R2.1 ClC1=CNC2=C1C=CC=N2 CS-0003968 [1,0,0,0,0,0|2,0,0]=3 4 B11R2.1 IC1=CNC2=NC=CC=C12 CS-0004128 [1,0,0,0,0,0|2,0,0]=3 5 B11R2.1 NC1=NNC2=NC=CC=C12 CS-M2176 [1,0,0,0,0,0|3,0,0]=4 6 B11R2.10 CC1=CC2=CC=CC=C2N1 CS-W007556 [1,0,0,0,0,0|3,0,0]=4 7 B11R2.10 ClC1=NC2=CC=CC=C2N1 CS-W016291 [1,0,0,0,0,0|2,0,1]=4 8 B11R2.10 N=C1NC2=CC=CC=C2S1 CS-W018140 [1,0,0,0,0,0|3,0,0]=4 9 B11R2.10 O=C1CC2=C(C=CC=C2)C1 CS-W020518 [1,0,0,0,0,0|3,0,0]=4 10 B11R2.10 S=C1NC2=CC=CC=C2N1 CS-W023180 [1,0,0,0,0,0|1,1,0]=3 11 B11R2.10 S=C1NC2=CC=CC=C2S1 CS-W017829 [1,0,0,0,0,0|2,1,0]=4 12 B11R2.10 SC1=NC2=C(N=CC=C2)N1 CS-0043982 [1,0,0,0,0,0|0,1,1]=3 13 B13R2.359 CC1(C)C(=O)NC2=C1C=CC=C2 CS-W009190 [0,1,0,0,0,0|3,0,0]=4 14 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O CS-W010873 [0,1,0,0,0,0|2,0,1]=4 15 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O CS-W007383 [0,1,0,0,0,0|2,0,1]=4 16 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O CS-W007549 [0,1,0,0,0,0|2,0,1]=4 17 B13R2.3028 O=C1NC2=C(C=C(I)C=C2)C1=O CS-0041245 [0,1,0,0,0,0|2,0,1]=4 18 B13R2.4825 O=C1NC2=C(C=CC=C2F)C1=O CS-W009274 [0,1,0,0,0,0|2,0,1]=4 19 B13R2.4856 O=C1NC2=C(C1=O)C(Br)=CC=C2 CS-W008631 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 CS-W019313 [0,0,1,0,0,0|3,0,0]=4 21 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 CS-D1423 [0,0,1,0,0,0|3,0,0]=4 22 B11R1.40 C=CC(=O)NC1=CC=CC=C1 CS-W019368 [0,0,1,0,0,0|3,0,0]=4 23 B13R2.328 O=C1NC2=CC=CC=C2C(=O)O1 CS-M0780 [0,0,0,0,0,1|2,0,1]=4 24 B10R1.15 N\N=C(/O)C1=CN=CC=C1 CS-W013333 [1,0,1,0,0,0|2,0,0]=4 25 B10R1.18 N=C(O)NC1=CC=CC=C1 CS-W017760 [1,0,1,0,0,0|2,0,0]=4 26 B10R1.20 CNC1=NC=CC=C1CO CS-W023173 [1,0,1,0,0,0|1,0,1]=4 27 B10R1.61 CC(=O)C1=CC=CN=C1N CS-0002197 [1,0,1,0,0,0|2,0,0]=4 28 B10R1.61 NC1=NC=CC=C1[N+](=O)[O-] CS-D1021 [1,0,1,0,0,0|0,0,2]=4 29 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 CS-W017965 [1,0,1,0,0,0|2,0,0]=4 30 B10R1.61 O=C(O)C1=CC=CN=C1F CS-D0952 [1,0,1,0,0,0|2,0,0]=4 31 B10R2.7 C1=CC2=C(C=NC=N2)N1 CS-W022388 [2,0,0,0,0,0|2,0,0]=4 32 B10R2.7 C1=CC2=C(N=C1)N=CO2 CS-0044085 [2,0,0,0,0,0|1,0,1]=4 33 B10R2.7 C1=CN=C2NN=CC2=C1 CS-W000643 [2,0,0,0,0,0|2,0,0]=4 34 B12R2.203 ClC1=C2C(Br)=CNC2=NC=C1 CS-B0488 [1,1,0,0,0,0|2,0,0]=4 35 B12R2.32 O=CC1=NC2=CC=CC=C2N1 CS-W004873 [1,1,0,0,0,0|1,0,1]=4 36 B12R2.202 O=C1CC2=C(C=CC=C2Cl)N1 CS-W022163 [1,1,0,0,0,0|2,0,0]=4 37 B12R2.202 O=C1NC2=C(Cl)C=CC=C2S1 CS-0030555 [1,1,0,0,0,0|2,0,0]=4 38 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 CS-W019563 [1,1,0,0,0,0|1,0,0]=3 39 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 CS-W008941 [1,1,0,0,0,0|2,0,0]=4 40 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 CS-W008657 [1,1,0,0,0,0|2,0,0]=4 41 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 CS-W022467 [1,1,0,0,0,0|2,0,0]=4 42 B12R2.606 O=C1NC2=CC=C(Cl)C=C2N1 CS-W020374 [1,1,0,0,0,0|1,0,0]=3 43 B12R2.606 OC1=CC=C2NC(=S)NC2=C1 CS-0040540 [1,1,0,0,0,0|1,1,0]=4 44 B12R2.606 OC1=NC2=C(N=CC(Br)=C2)N1 CS-W005620 [1,1,0,0,0,0|0,0,2]=4 45 B12R2.606 S=C1NC2=CC=C(Cl)C=C2N1 CS-0094540 [1,1,0,0,0,0|1,1,0]=4 46 B12R2.24 O=C1COC2=CC=CN=C2N1 CS-W002009 [0,0,1,1,0,0|1,0,0]=3