0 B11R1.17 NC1=C(OCCO)C=CN=C1 HB097-1 [0,1,0,0,0,0|2,0,0]=3 1 B11R1.17 NC1=CC=CN=C1OCCO HB026-1 [0,1,0,0,0,0|2,0,0]=3 2 B11R1.17 NC1=NC=CC=C1CCCO HB034-1 [0,1,0,0,0,0|1,0,0]=2 3 B11R1.17 OCC#CC1=C(Cl)C=CN=C1 HB100-1 [0,1,0,0,0,0|1,0,2]=4 4 B11R1.17 OCCCC1=C(O)C=CN=C1 HB104-1 [0,1,0,0,0,0|1,0,0]=2 5 B11R1.17 OCCOC1=NC=CC=C1O HB001-1 [0,1,0,0,0,0|2,0,0]=3 6 B11R1.24 OCC#CC1=CC(Br)=CN=C1 HB114-1 [0,1,0,0,0,0|1,0,2]=4 7 B11R1.40 N[C@@H](CBr)CC1=CC=CC=C1 RC756-1 [0,1,0,0,0,0|1,0,0]=2 8 B11R1.40 N[C@H](CBr)CC1=CC=CC=C1 RC814-1 [0,1,0,0,0,0|1,0,0]=2 9 B11R2.20 C1=CN=C2CCCOC2=C1 HC494-1 [0,0,0,1,0,0|1,0,0]=2 10 B11R2.20 C1=CN=C2OCCNC2=C1 HC443-1 [0,0,0,1,0,0|2,0,0]=3 11 B11R2.20 C1=CN=C2OCCOC2=C1 HC524-1 [0,0,0,1,0,0|2,0,0]=3 12 B11R2.20 C1=NC=C2CCCOC2=C1 HC495-1 [0,0,0,1,0,0|1,0,0]=2 13 B11R2.20 C1=NC=C2OCCNC2=C1 HC442-1 [0,0,0,1,0,0|2,0,0]=3 14 B10R1.11 O[C@@H](CCCl)C1=CC=CS1 RC624-1 [0,1,0,0,1,0|2,0,0]=4 15 B12R1.21 C[C@@H](N)CCC1=CC=C(O)C=C1 RC824-1 [0,2,0,0,0,0|1,0,0]=3 16 B12R1.69 OCCOC1=NC=C(Br)C=C1O HB328-1 [0,2,0,0,0,0|2,0,0]=4 17 B12R1.69 OCCOC1=NC=C(Cl)C=C1O HB347-1 [0,2,0,0,0,0|2,0,0]=4 18 B12R1.34 C=CC(C)[C@H](O)C1=CC=CC=C1 RC637-1 [0,2,0,0,0,0|1,0,1]=4 19 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 AD381-1 [0,2,0,0,0,0|0,0,1]=3 20 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CN=C1 AD1099-1 [0,2,0,0,0,0|1,0,1]=4 21 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 AL380-1 [0,2,0,0,0,0|0,0,1]=3 22 B12R1.107 N[C@H](CC(=O)O)C1=CC=CN=C1 AL1098-1 [0,2,0,0,0,0|1,0,1]=4 23 B12R1.374 NC1=C(CCCO)C=C(F)C=N1 HB294-1 [0,2,0,0,0,0|1,0,0]=3 24 B12R1.374 NC1=NC=C(I)C=C1CCCO HB499-1 [0,2,0,0,0,0|1,0,0]=3 25 B12R1.374 OCCCC1=C(Cl)N=CC(F)=C1 HB297-1 [0,2,0,0,0,0|1,0,0]=3 26 B12R1.374 OCCCC1=C(O)N=CC(F)=C1 HB296-1 [0,2,0,0,0,0|1,0,0]=3 27 B12R1.27 NC[C@@H](O)COC1=CC=CC=C1 RC815-1 [0,2,0,0,0,0|1,0,0]=3 28 B12R1.27 NC[C@H](O)COC1=CC=CC=C1 RC816-1 [0,2,0,0,0,0|1,0,0]=3 29 B12R1.252 C[C@@H](N)CCCC1=CN=CC=C1 RC823-1 [0,2,0,0,0,0|2,0,0]=4 30 B12R1.252 C[C@H](N)CCCC1=CN=CC=C1 RC822-1 [0,2,0,0,0,0|2,0,0]=4 31 B12R1.43 C[C@@H](CC1=CC=CC=C1)N(C)C RC827-1 [0,2,0,0,0,0|2,0,0]=4 32 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O AL216-1 [0,2,0,0,0,0|1,0,1]=4 33 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O AL201-1 [0,2,0,0,0,0|1,0,1]=4 34 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O AL181-1 [0,2,0,0,0,0|1,0,1]=4 35 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O AD217-1 [0,2,0,0,0,0|1,0,1]=4 36 B12R1.43 N[C@H](CC1=CN=CC=C1)C(=O)O AD205-1 [0,2,0,0,0,0|1,0,1]=4 37 B12R2.24 BrC1=CN=C2NCCOC2=C1 HC447-1 [0,1,0,1,0,0|2,0,0]=4 38 B12R2.24 BrC1=CN=C2OCCOC2=C1 HC525-1 [0,1,0,1,0,0|2,0,0]=4 39 B12R2.24 BrC1=NC2=C(C=C1)NCCO2 HC468-1 [0,1,0,1,0,0|2,0,0]=4 40 B12R2.24 C[C@@H]1CC2=CC=CC=C2C=N1 RC818-1 [0,1,0,1,0,0|2,0,0]=4 41 B12R2.24 ClC1=CN=C2OCCOC2=C1 HC546-1 [0,1,0,1,0,0|2,0,0]=4 42 B12R2.24 FC1=CN=C2OCCCC2=C1 HC500-1 [0,1,0,1,0,0|1,0,0]=3 43 B12R2.24 IC1=CC=C2OCCCC2=N1 HC501-1 [0,1,0,1,0,0|1,0,0]=3 44 B12R2.24 IC1=CN=C2OCCOC2=C1 HC528-1 [0,1,0,1,0,0|2,0,0]=4 45 B12R2.24 IC1=NC2=C(C=C1)NCCO2 HC467-1 [0,1,0,1,0,0|2,0,0]=4 46 B12R2.24 NC1=CN=C2OCCCC2=C1 HC504-1 [0,1,0,1,0,0|1,0,0]=3 47 B12R2.24 NC1=CN=C2OCCOC2=C1 HC542-1 [0,1,0,1,0,0|2,0,0]=4 48 B12R2.24 OC1=CN=C2OCCCC2=C1 HC521-1 [0,1,0,1,0,0|1,0,0]=3 49 B12R2.24 OC1=CN=C2OCCOC2=C1 HC538-1 [0,1,0,1,0,0|2,0,0]=4 50 B12R2.1081 BrC1=C2NCCOC2=CN=C1 HC459-1 [0,1,0,1,0,0|2,0,0]=4 51 B12R2.1081 ClC1=C2OCCOC2=NC=C1 HC529-1 [0,1,0,1,0,0|2,0,0]=4 52 B12R2.1081 IC1=C2OCCCC2=CN=C1 HC496-1 [0,1,0,1,0,0|1,0,0]=3 53 B12R2.1081 IC1=C2OCCOC2=NC=C1 HC527-1 [0,1,0,1,0,0|2,0,0]=4 54 B12R2.1081 IC1=NC=CC2=C1OCCO2 HC571-1 [0,1,0,1,0,0|2,0,0]=4 55 B12R2.1081 NC1=C2OCCOC2=NC=C1 HC531-1 [0,1,0,1,0,0|2,0,0]=4 56 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 RC812-1 [0,1,0,1,0,0|0,0,0]=2 57 B12R2.1081 N[C@H]1CCOC2=CC=CC=C21 RC811-1 [0,1,0,1,0,0|0,0,0]=2 58 B12R2.1081 OC1=C2OCCOC2=NC=C1 HC533-1 [0,1,0,1,0,0|2,0,0]=4