0 B9R1.13 O=C(Cl)CN1C=CN=C1 4H16-5-0D [0,0,0,0,0,0|4,0,0]=4 1 B8R1.8 NCCC1=CC=CS1 7H30-5-0B [1,0,0,0,0,0|1,1,1]=4 2 B10R1.23 NC(C(=O)O)C1=CSC=C1 8H66-5-4C [0,1,0,0,0,0|3,0,0]=4 3 B10R1.27 COC(=O)CC1=CNC=N1 4H23-5-5A [0,1,0,0,0,0|2,0,0]=3 4 B10R1.54 CC(=O)NC1C=CC(=O)O1 4H58-1-327 [0,1,0,0,0,0|1,0,1]=3 5 B10R1.54 CN(C)CC1=CC(Br)=CS1 7H66-9-20 [0,1,0,0,0,0|2,1,0]=4 6 B10R1.54 NC1=CC(CC(=O)O)=NN1 4H57-1-65 [0,1,0,0,0,0|3,0,0]=4 7 B10R1.54 O=C(O)CC1=NC(Cl)=CS1 8H70-5-23 [0,1,0,0,0,0|2,1,0]=4 8 B8R1.7 CC(=O)C1=CNN=C1 4H17-1-3L [0,0,0,0,1,0|3,0,0]=4 9 B8R1.7 CC(=O)C1=NC=CN1 4H17-1-3M [0,0,0,0,1,0|2,0,0]=3 10 B8R1.7 CC(N)C1=CC=CO1 4H56-1-1T [0,0,0,0,1,0|1,0,1]=3 11 B8R1.7 CC(N)C1=CN=CO1 4H30-1-39 [0,0,0,0,1,0|2,0,1]=4 12 B8R1.7 NC(=O)C1=CC=NO1 4H48-1-H4 [0,0,0,0,1,0|2,0,0]=3 13 B10R1.18 CC(C)CC1=CC=NC=C1 3H32-5-JC [0,0,0,0,0,1|2,0,1]=4 14 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 2702-1-X0 [0,0,0,0,0,1|1,0,2]=4 15 B10R1.18 O=C([O-])CC1=CC=NN=C1 4H58-1-QC [0,0,0,0,0,1|3,0,0]=4 16 B10R1.18 O=C([O-])CC1=NC=CC=N1 4H58-1-QD [0,0,0,0,0,1|2,0,0]=3 17 B7R0.4 C\C=C\C=C\C(C)=O 2317-1-0E [1,0,1,0,0,0|1,0,0]=3 18 B7R1.1 CCC1=CSC=N1 7H70-1-2D [2,0,0,0,0,0|2,0,0]=4 19 B7R1.1 CCC1=NN=CO1 4H56-1-03D [2,0,0,0,0,0|2,0,0]=4 20 B7R1.1 NCC1=NC=CO1 4H30-5-54 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.7 CCCC1=CC=C(Br)S1 5H66-9-26 [1,1,0,0,0,0|0,1,1]=4 22 B9R1.11 NCC(O)C1=CC=CO1 4H30-1-T0 [1,1,0,0,0,0|1,0,1]=4 23 B9R1.12 O=CSCC1=CC=CO1 6H66-1-1D [1,1,0,0,0,0|0,0,0]=2 24 B9R1.35 CC(=O)C1=CC(C)=NS1 8H15-1-0F [0,1,0,0,1,0|1,1,0]=4 25 B9R1.35 CC(=O)C1=CC=C(Br)O1 2H17-9-30 [0,1,0,0,1,0|0,0,0]=2 26 B9R1.35 CC(=O)C1=NC=C(Br)S1 8H70-9-16 [0,1,0,0,1,0|1,1,0]=4 27 B9R1.35 CC(=O)N1C=CC(N)=C1 4H48-1-WC [0,1,0,0,1,0|2,0,0]=4 28 B9R1.35 O=C(O)C1=CC(I)=CN1 4H21-H-0D [0,1,0,0,1,0|2,0,0]=4 29 B9R1.41 CC(O)C1=C(Br)C=CO1 2H02-9-00 [0,1,0,0,1,0|0,0,2]=4 30 B9R1.41 O=C(O)C1=C(Br)C=CO1 2H21-9-0K [0,1,0,0,1,0|1,0,0]=3 31 B11R1.20 CC(=O)NC1=CC=C(Cl)N=C1 4H48-5-HJ [0,1,0,0,0,1|2,0,0]=4 32 B11R1.20 NC1=CC=C(CC(=O)O)C=N1 4H57-1-02 [0,1,0,0,0,1|2,0,0]=4 33 B11R1.36 NC(C(=O)O)C1=CC=CC=N1 4H57-5-24 [0,1,0,0,0,1|2,0,0]=4 34 B11R1.36 O=C(Cl)C(O)C1=CC=CC=C1 2616-5-0C [0,1,0,0,0,1|2,0,0]=4 35 B11R1.40 CNC(=O)OC1=CC=CC=C1 4656-1-7R [0,1,0,0,0,1|2,0,0]=4 36 B11R1.40 COC(=O)CC1=CC=NN=C1 4H58-1-AW [0,1,0,0,0,1|2,0,0]=4 37 B11R1.40 O=C(CCl)NC1=CC=NC=C1 4H48-5-CA [0,1,0,0,0,1|2,0,0]=4 38 B11R1.86 CC(=O)NC1=NC=CC=C1N 4H48-1-97 [0,1,0,0,0,1|2,0,0]=4 39 B11R1.86 CC(=O)NC1=NN=CC=C1C 4H48-1-WE [0,1,0,0,0,1|2,0,0]=4 40 B11R1.86 NC(=O)CC1=CC=CC=C1I 4648-H-06 [0,1,0,0,0,1|2,0,0]=4 41 B11R1.157 CC(=O)NC1=CC(C)=CN=N1 4H48-1-WF [0,1,0,0,0,1|2,0,0]=4 42 B11R1.157 CC(=O)NC1=CC(N)=NC=N1 4H48-1-B1 [0,1,0,0,0,1|2,0,0]=4 43 B11R1.157 O=C(O)CC1=CN=CC(F)=C1 4H58-3-1L [0,1,0,0,0,1|2,0,0]=4 44 B11R1.25 COC(=O)CCC1=CC=CN1 4H23-1-8N [0,1,0,0,0,1|1,0,0]=3 45 B11R1.25 COC(=O)CCN1C=CC=C1 4H23-1-JH [0,1,0,0,0,1|2,0,0]=4 46 B11R1.25 COC(=O)\C=C\C1=CC=CN1 4H23-1-8P [0,1,0,0,0,1|1,0,1]=4 47 B11R1.77 CC(=O)CC(=O)C1=CC=CO1 2H18-1-09 [0,1,0,0,0,1|0,0,0]=2 48 B11R1.31 COC(=O)C(=O)C1=CC=CN1 4H29-1-4Y [0,2,0,0,0,0|1,0,1]=4 49 B11R1.39 COC(=O)CN1C=C(N)C=N1 4H58-5-91 [0,2,0,0,0,0|2,0,0]=4 50 B11R2.10 O=C1CC2=C(C=NC=C2)N1 4H48-5-69 [0,0,0,1,0,1|2,0,0]=4 51 B11R2.10 O=C1CN2C=CC=CC2=N1 4H48-9-98 [0,0,0,1,0,1|2,0,0]=4 52 B11R1.91 NC(=O)CCC1=CC=CC=N1 4H48-1-VK [0,0,0,0,0,2|2,0,0]=4 53 B11R1.91 NC(=O)CCC1=CC=CN=C1 4H48-1-VL [0,0,0,0,0,2|2,0,0]=4 54 B11R1.91 NC(=O)CCC1=CC=NC=C1 4H48-1-VM [0,0,0,0,0,2|2,0,0]=4 55 B11R1.91 O=C(Cl)CCC1=CC=CN=C1 4H16-5-67 [0,0,0,0,0,2|2,0,0]=4 56 B11R1.91 O=C(Cl)CNC1=CC=CC=C1 4631-5-00 [0,0,0,0,0,2|2,0,0]=4 57 B11R1.172 CC(=O)NCCN1C=CC=C1 4H48-1-01X [0,0,0,0,0,2|2,0,0]=4