0 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 4031120 [0,0,0,0,0,0|2,0,1]=3 1 B11R2.1 O=C1NCC2=CC=CC=C12 4041876 [1,0,0,0,0,0|2,0,1]=4 2 B11R2.36 FC1=CC=C2NN=CC2=C1 4028455 [1,0,0,0,0,0|2,0,1]=4 3 B11R2.36 NC1=CC2=C(C=C1)COC2 4100713 [1,0,0,0,0,0|2,0,0]=3 4 B11R1.22 CCC(N)C1=CC=C(F)C=C1 4110680 [0,0,1,0,0,0|3,0,0]=4 5 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 5101702 [0,0,1,0,0,0|2,1,0]=4 6 B11R1.22 CC[C@@H](N)C1=CC=C(F)C=C1 4104518 [0,0,1,0,0,0|3,0,0]=4 7 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 4107200 [0,0,1,0,0,0|3,0,0]=4 8 B11R1.22 CNC(C)C1=CC=C(F)C=C1 4027169 [0,0,1,0,0,0|3,0,0]=4 9 B11R1.22 CNC(C)C1=CC=C(F)C=C1 4090293 [0,0,1,0,0,0|3,0,0]=4 10 B11R1.24 NCCCC1=CC(F)=CC=C1 4019785 [0,0,1,0,0,0|3,0,0]=4 11 B13R2.3683 O=C1CCC2=CC(F)=CC=C2N1 4043551 [0,0,0,0,0,1|2,0,1]=4 12 B10R1.13 CC1=CC=C(B(O)O)C=C1 4200596 [1,0,1,0,0,0|1,0,0]=3 13 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 4089129 [1,0,1,0,0,0|0,1,0]=3 14 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 4201816 [1,0,1,0,0,0|0,1,0]=3 15 B10R1.30 CCC1=CC(F)=CC=C1O 4031684 [1,0,1,0,0,0|1,0,0]=3 16 B10R1.61 NC1=CC=NC=C1B(O)O 4067674 [1,0,1,0,0,0|2,0,0]=4 17 B12R1.367 COC(=O)C1=CC(N)=C(F)C=C1 4040035 [0,1,1,0,0,0|1,0,1]=4 18 B12R1.367 COC(=O)C1=CC(N)=C(F)C=C1 4090013 [0,1,1,0,0,0|1,0,1]=4 19 B12R1.28 OCCSCC1=CC(F)=CC=C1 9071407 [0,1,1,0,0,0|1,1,0]=4 20 B12R1.452 COC1=NC(C)=C(B(O)O)C=C1 4095035 [0,1,1,0,0,0|2,0,0]=4 21 B12R1.452 COC1=NC=C(B(O)O)C(C)=C1 4098871 [0,1,1,0,0,0|2,0,0]=4