0 B11R1.17 CC1=C(CN=[N+]=[N-])C=CC=C1 ALBB-014198 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.17 N#CCCN1C=CC=CC1=O ALBB-025514 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.17 NCCCC1=C(Cl)C=CC=C1 ALBB-027051 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.17 NCCCN1C=CC=CC1=O ALBB-025519 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.4 CC1=CC=CC=C1CNN ALBB-012492 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.17 BrCCCC1=CC=CN=C1 ALBB-021980 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.17 ClCCCC1=CC=NC=C1 ALBB-022002 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.17 NCCCC1=CC=NC=C1 ALBB-022001 [1,0,0,0,0,0|3,0,0]=4 8 B12R1.267 NCCOCC1=CC=CC=C1Cl ALBB-010307 [0,1,0,0,0,0|2,0,0]=3 9 B12R1.371 NC(CO)CC1=CC=CC=C1F ALBB-033341 [0,1,0,0,0,0|2,1,0]=4 10 B12R1.1631 CC1=C(OCCN)C(Cl)=CC=C1 ALBB-023887 [0,1,0,0,0,0|3,0,0]=4 11 B12R2.24 NC1CCC2=C(C=CC=C2)C1 ALBB-025644 [0,0,0,1,0,0|3,0,0]=4 12 B12R2.41 C1=CC=C2OCCNCC2=C1 ALBB-011885 [0,0,0,1,0,0|3,0,0]=4 13 B12R2.1081 OC1=C2CCNCC2=CC=C1 ALBB-029016 [0,0,0,1,0,0|1,0,0]=2 14 B10R1.29 CNCCN1C=CN=C1C ALBB-022652 [0,0,0,0,1,0|3,0,0]=4 15 B9R1.8 CCNC1=CC=CN=C1 ALBB-028026 [2,0,0,0,0,0|2,0,0]=4 16 B9R1.8 NCCC1=NC=CN=C1 ALBB-014355 [2,0,0,0,0,0|2,0,0]=4 17 B9R1.8 NCCC1=NC=CN=C1 ALBB-014355 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.15 CNC1=NC=CN=C1Cl ALBB-014886 [2,0,0,0,0,0|2,0,0]=4 19 B9R1.15 NCC1=CC=CN=C1Cl ALBB-022798 [2,0,0,0,0,0|1,0,0]=3 20 B9R1.15 NCC1=CC=CN=C1N ALBB-014428 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.15 NCC1=CC=CN=C1N ALBB-014428 [2,0,0,0,0,0|2,0,0]=4 22 B11R1.13 CNCC1=CC=CN(C)C1=O ALBB-034596 [1,1,0,0,0,0|2,0,0]=4 23 B11R1.222 CNC(=O)C1=CC=CN=C1Cl ALBB-011986 [1,1,0,0,0,0|1,0,1]=4 24 B11R1.1 CC1=CC=C(CCCN)C=C1 ALBB-027049 [1,1,0,0,0,0|2,0,0]=4 25 B11R1.1 NCCCC1=CC=C(Cl)C=C1 ALBB-027052 [1,1,0,0,0,0|2,0,0]=4 26 B11R1.1 NCCCC1=CC=C(F)C=C1 ALBB-027050 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.24 CC1=CC=CC(CCCN)=C1 ALBB-027048 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.28 C=CCCNC1=CC=CC=C1 ALBB-032058 [1,1,0,0,0,0|1,0,1]=4 29 B11R1.28 CCNCCC1=CC=CC=C1 ALBB-034844 [1,1,0,0,0,0|0,0,0]=2 30 B11R1.91 CC(N)COC1=CC=CC=C1 ALBB-027081 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.91 N=C(N)CCC1=CC=CC=C1 ALBB-016699 [1,1,0,0,0,0|2,0,0]=4 32 B13R1.158 CN(C)CCOC1=C(N)C=CC=C1 ALBB-030778 [0,2,0,0,0,0|1,0,0]=3 33 B13R1.555 C=CCCNCC1=CC=CC=C1Cl ALBB-033611 [0,2,0,0,0,0|1,0,1]=4 34 B13R1.2872 CC(CN)CC1=C(Cl)C=CC(Cl)=C1 ALBB-025421 [0,2,0,0,0,0|2,0,0]=4 35 B11R2.20 C1=CC=C2SCCNC2=C1 ALBB-006553 [1,0,0,1,0,0|2,0,0]=4 36 B11R2.20 C1=CC=C2SCCNC2=C1 ALBB-006553 [1,0,0,1,0,0|2,0,0]=4 37 B13R2.4820 CC1=C2OCCNCC2=CC=C1 ALBB-034784 [0,1,0,1,0,0|1,0,0]=3 38 B13R2.1 CNCC1=COC2=CC=CC=C12 ALBB-018337 [0,1,0,1,0,0|1,0,1]=4 39 B13R2.18 ClC1=CC=CC=C1C2CCCN2 ALBB-009853 [0,1,0,1,0,0|1,0,0]=3 40 B13R2.18 FC1=CC=CC=C1C2CCNC2 ALBB-012826 [0,1,0,1,0,0|0,1,0]=3 41 B13R2.26 CNCC1=CC2=CC=CC=C2S1 ALBB-015188 [0,1,0,1,0,0|1,0,1]=4 42 B13R2.3683 CC1CCC2=CC(O)=CC=C2N1 ALBB-036480 [0,1,0,1,0,0|2,0,0]=4 43 B9R1.12 CNCCC1=CNN=C1 ALBB-006775 [1,0,0,0,1,0|2,0,0]=4 44 B9R1.12 CNCCC1=CNN=C1 ALBB-006775 [1,0,0,0,1,0|2,0,0]=4