0 B8R1.8 CNCC1=CC=CO1 ALBB-012372 [0,0,0,0,0,0|2,1,0]=3 1 B8R1.8 CNCC1=CC=CO1 ALBB-012372 [0,0,0,0,0,0|2,1,0]=3 2 B8R1.8 N#CCN1C=CC=N1 ALBB-004614 [0,0,0,0,0,0|2,0,2]=4 3 B8R1.8 NCCC1=NC=NN1 ALBB-014149 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.7 OCCN1C=C(Br)C=N1 ALBB-003673 [0,1,0,0,0,0|3,0,0]=4 5 B9R1.11 CC(CN)N1C=CN=C1 ALBB-027293 [0,1,0,0,0,0|3,0,0]=4 6 B9R1.11 C\C(=N\O)C1=CC=CS1 ALBB-021403 [0,1,0,0,0,0|2,0,1]=4 7 B9R1.12 CNCCN1C=CC=N1 ALBB-022642 [0,1,0,0,0,0|2,0,0]=3 8 B9R1.12 CNCCN1C=CN=C1 ALBB-022641 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.12 N#CCCN1C=CC=C1 ALBB-021294 [0,1,0,0,0,0|2,0,1]=4 10 B9R1.12 O=C=NCC1=CC=CO1 ALBB-007541 [0,1,0,0,0,0|1,1,1]=4 11 B9R1.12 O=C=NCC1=CC=CS1 ALBB-014437 [0,1,0,0,0,0|1,0,1]=3 12 B9R1.12 S=C=NCC1=CC=CO1 ALBB-013134 [0,1,0,0,0,0|1,1,1]=4 13 B9R1.13 CN(C)CC1=CC=CN1 ALBB-008697 [0,1,0,0,0,0|3,0,0]=4 14 B9R1.13 O=C(O)CC1=CC=CN1 ALBB-026954 [0,1,0,0,0,0|2,0,1]=4 15 B9R2.3 C1=NC2=C(CCC2)N1 ALBB-027475 [0,0,0,1,0,0|3,0,0]=4 16 B9R1.8 CNCC1=NC=NC=C1 ALBB-018329 [0,0,0,0,0,1|3,0,0]=4 17 B9R1.8 N#CCC1=CC=CN=N1 ALBB-034088 [0,0,0,0,0,1|1,0,2]=4 18 B8R1.1 CC1=CN=C(CN)S1 ALBB-015203 [1,1,0,0,0,0|1,0,0]=3 19 B8R1.1 CC1=CN=C(CO)S1 ALBB-026952 [1,1,0,0,0,0|2,0,0]=4 20 B8R1.1 NC1=NC=C(CO)S1 ALBB-022646 [1,1,0,0,0,0|2,0,0]=4 21 B8R1.1 NCC1=CN=C(N)S1 ALBB-022645 [1,1,0,0,0,0|1,0,0]=3 22 B8R1.7 NC(=O)C1=CC=CS1 ALBB-019885 [1,1,0,0,0,0|0,0,1]=3 23 B8R1.11 CC1=C(CO)SC=N1 ALBB-030274 [1,1,0,0,0,0|2,0,0]=4 24 B8R1.11 CN1C=CC=C1C[O-] ALBB-026962 [1,1,0,0,0,0|2,0,0]=4 25 B8R1.11 CN1C=CN=C1CN ALBB-008650 [1,1,0,0,0,0|2,0,0]=4 26 B10R1.1 NNCC1=CC=C(Cl)C=C1 ALBB-022671 [0,1,0,0,0,1|2,0,0]=4 27 B10R1.1 NNCC1=CC=C(F)C=C1 ALBB-022656 [0,1,0,0,0,1|2,0,0]=4 28 B10R1.4 NNCC1=C(F)C=CC=C1 ALBB-022654 [0,1,0,0,0,1|2,0,0]=4 29 B10R1.10 NNCC1=CC(F)=CC=C1 ALBB-022655 [0,1,0,0,0,1|2,0,0]=4 30 B10R1.17 CCNCC1=CC=NC=C1 ALBB-021284 [0,1,0,0,0,1|2,0,0]=4 31 B10R1.17 NCCCC1=NC=CC=C1 ALBB-012423 [0,1,0,0,0,1|1,0,0]=3 32 B10R1.17 NC\C=C\C1=CC=CC=C1 ALBB-015040 [0,1,0,0,0,1|1,0,1]=4 33 B10R1.17 OCCNC1=CC=CC=C1 ALBB-020698 [0,1,0,0,0,1|2,0,0]=4 34 B10R1.18 CC(N)CC1=CC=CN=C1 ALBB-010767 [0,1,0,0,0,1|1,0,0]=3 35 B10R1.18 CC(N)CC1=CC=CN=C1 ALBB-010767 [0,1,0,0,0,1|1,0,0]=3 36 B10R1.18 N=C(N)CC1=NC=CC=C1 ALBB-004970 [0,1,0,0,0,1|1,0,1]=4 37 B10R1.14 CCC(=O)C1=CC=C(Br)S1 ALBB-002876 [0,2,0,0,0,0|1,0,1]=4 38 B10R1.16 CC1=CSC(CCCN)=N1 ALBB-011822 [0,2,0,0,0,0|1,0,0]=3 39 B10R1.11 CCCC(N)C1=CC=CS1 ALBB-006746 [0,2,0,0,0,0|1,0,0]=3 40 B10R1.23 CC(C)C(N)C1=CC=CS1 ALBB-020881 [0,2,0,0,0,0|1,0,0]=3 41 B10R1.66 O=[N+]([O-])CCC1=CC=CO1 ALBB-019776 [0,2,0,0,0,0|0,1,1]=4