0 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 ALBB-028043 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 ALBB-019900 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.22 O=C(NO)C1=CC=C(F)C=C1 ALBB-033760 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 ALBB-025270 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.1 CNCC1=CC=C(Br)C=C1 ALBB-021485 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.1 CNCC1=CC=C(O)C=C1 ALBB-004091 [1,0,0,0,0,0|1,0,1]=3 6 B10R1.13 NC(=O)C1=CC=C(N)N=C1 ALBB-025399 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.5 CNC(=O)C1=CC=C(C=O)C=C1 ALBB-033068 [0,1,0,0,0,0|1,0,1]=3 8 B12R1.5 CNC(=O)C1=CC=C(CBr)C=C1 ALBB-036363 [0,1,0,0,0,0|2,0,0]=3 9 B12R1.5 COC(=O)C1=CC=C(CBr)N=C1 ALBB-027194 [0,1,0,0,0,0|2,0,0]=3 10 B12R1.5 COC(=O)C1=CC=C(CCl)N=C1 ALBB-032723 [0,1,0,0,0,0|2,0,0]=3 11 B12R1.5 COC(=O)C1=CC=C(CN)N=C1 ALBB-027189 [0,1,0,0,0,0|2,0,0]=3 12 B12R1.16 CCOC(=O)C1=NC=C(O)C=C1 ALBB-028014 [0,1,0,0,0,0|1,0,0]=2 13 B12R1.367 CC1=C(C)C=C(C(=O)NN)C=C1 ALBB-021345 [0,1,0,0,0,0|3,0,0]=4 14 B12R1.367 CCC(=O)C1=CC(C)=C(Br)N=C1 ALBB-031119 [0,1,0,0,0,0|3,0,0]=4 15 B12R2.612 CC1=NOC2=CC(O)=CC=C21 ALBB-016000 [0,0,0,1,0,0|3,0,0]=4 16 B10R1.14 COC(=O)C1=CC(Cl)=NO1 ALBB-035811 [0,0,0,0,1,0|3,0,0]=4 17 B10R1.14 COC(=O)C1=CC(N)=NN1 ALBB-014008 [0,0,0,0,1,0|3,0,0]=4 18 B9R1.1 OCC1=CC=C(O)N=C1 ALBB-016810 [2,0,0,0,0,0|1,0,1]=4 19 B9R1.6 N=C(N)C1=CC=CC=C1 ALBB-021313 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.6 O=C(O)C1=CC=CN=N1 ALBB-012268 [2,0,0,0,0,0|2,0,0]=4 21 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 ALBB-013748 [1,1,0,0,0,0|1,0,0]=3 22 B11R1.3 CNC1=NC=C(C(=O)O)C=C1 ALBB-032746 [1,1,0,0,0,0|2,0,0]=4 23 B11R1.3 NC(=O)C1=CC=C(CO)C=C1 ALBB-036361 [1,1,0,0,0,0|1,0,0]=3 24 B11R1.3 NCC1=CC=C(C(=O)O)C=N1 ALBB-032727 [1,1,0,0,0,0|2,0,0]=4 25 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 ALBB-016433 [1,1,0,0,0,0|2,0,0]=4 26 B11R1.21 CC1=CC=C(C(N)=O)C=C1Br ALBB-019160 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.21 CN1C=CC(C(=O)O)=CC1=O ALBB-025033 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.166 NC1=C(C(=O)O)C=NC(O)=N1 ALBB-017210 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 ALBB-013779 [1,1,0,0,0,0|1,0,1]=4 30 B11R1.23 CNC(=O)C1=CC=NC(Cl)=C1 ALBB-004236 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.23 CNC(=O)C1=NC(Cl)=CC=C1 ALBB-022383 [1,1,0,0,0,0|2,0,0]=4 32 B11R1.222 CNC(=O)C1=CC=CN=C1Cl ALBB-011986 [1,1,0,0,0,0|2,0,0]=4 33 B11R1.222 COC(=N)C1=CC=CNC1=O ALBB-010781 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.222 COC(=O)C1=C(O)N=CN=C1 ALBB-017425 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.15 CCOC(=O)C1=CC(N)=CS1 ALBB-034164 [0,1,0,0,1,0|2,0,0]=4 36 B11R1.44 COC(=O)C1=CC(CCl)=CS1 ALBB-004388 [0,1,0,0,1,0|2,0,0]=4 37 B11R1.44 COC(=O)C1=CC(CN)=CS1 ALBB-030530 [0,1,0,0,1,0|2,0,0]=4 38 B11R1.44 COC(=O)C1=CC=C(CBr)S1 ALBB-004387 [0,1,0,0,1,0|2,0,0]=4 39 B11R1.44 COC(=O)C1=CC=C(CN)O1 ALBB-027648 [0,1,0,0,1,0|2,0,0]=4 40 B11R1.44 COC(=O)C1=CC=C(CO)O1 ALBB-004522 [0,1,0,0,1,0|1,0,0]=3 41 B11R1.226 COC(=O)C1=CC(C)=C(C)O1 ALBB-023710 [0,1,0,0,1,0|2,0,0]=4 42 B13R1.36 CN(C)C(=O)C1=CC=C(C=O)C=C1 ALBB-033069 [0,2,0,0,0,0|1,0,1]=4 43 B13R1.36 CN(C)C(=O)C1=CC=C(CBr)C=C1 ALBB-036364 [0,2,0,0,0,0|2,0,0]=4 44 B13R1.36 CN(C)C(=O)C1=CC=C(CN)C=C1 ALBB-022347 [0,2,0,0,0,0|2,0,0]=4 45 B13R1.95 COC1=CC(F)=C(C(=O)CN)C=C1 ALBB-035724 [0,2,0,0,0,0|2,0,0]=4 46 B13R1.537 CCC(=O)C1=CC=C(N(C)C)C=C1 ALBB-034459 [0,2,0,0,0,0|2,0,0]=4 47 B13R1.537 COC(=O)C1=CC=C(C(Br)Br)N=C1 ALBB-032724 [0,2,0,0,0,0|2,0,0]=4 48 B13R1.537 COC(=O)C1=CC=C(C(Cl)Cl)N=C1 ALBB-032725 [0,2,0,0,0,0|2,0,0]=4 49 B13R1.17 NC1=CC=C(C(=O)NCCO)C=C1 ALBB-010419 [0,2,0,0,0,0|2,0,0]=4 50 B13R2.2130 COC1=CC=C2C(=O)COC2=C1 ALBB-014714 [0,1,0,1,0,0|2,0,0]=4 51 B9R1.35 CC1=CC(C(=O)O)=CS1 ALBB-000918 [1,0,0,0,1,0|2,0,0]=4 52 B9R1.11 COC(=O)C1=CC=NO1 ALBB-027244 [1,0,0,0,1,0|2,0,0]=4 53 B9R1.11 COC(=O)C1=CNN=C1 ALBB-016380 [1,0,0,0,1,0|2,0,0]=4 54 B9R1.11 COC(=O)C1=CNN=C1 ALBB-016380 [1,0,0,0,1,0|2,0,0]=4 55 B11R1.40 O=C(CBr)NC1=CC=CC=C1 ALBB-011957 [1,0,0,0,0,1|2,0,0]=4