0 B12R1.252 O=C(O)CCSC1=NC=CC=C1 BB53-1033 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.252 O=C(O)CNCC1=NC=CC=C1 BB52-9714 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.28 OCCCSC1=NC=CC=C1 BB52-9523 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.28 OCCNCC1=CC=NC=C1 BB53-0514 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.28 OCCNCC1=NC=CC=C1 BB52-9143 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.45 O=C(O)CNC(=O)C1=CC=CN=C1 BB52-0617 [0,1,0,0,0,0|2,0,1]=4 6 B13R1.45 O=C(O)CNC(=O)C1=CC=NC=C1 BB53-0208 [0,1,0,0,0,0|2,0,1]=4 7 B13R1.45 O=C(O)CNC(=O)C1=NC=CC=C1 BB53-0717 [0,1,0,0,0,0|2,0,1]=4 8 B13R1.348 CC(CC(=O)O)SC1=NC=CC=C1 BB53-0715 [0,1,0,0,0,0|2,0,0]=3 9 B13R1.351 CC(CSC1=NC=CC=C1)C(=O)O BB53-0290 [0,1,0,0,0,0|2,0,0]=3 10 B13R1.351 O=C(O)C(=O)NCC1=CC=CN=C1 BB52-9157 [0,1,0,0,0,0|2,0,1]=4 11 B13R1.351 O=C(O)C(=O)NCC1=CC=NC=C1 BB52-9602 [0,1,0,0,0,0|2,0,1]=4 12 B13R1.351 O=C(O)C(=O)NCC1=NC=CC=C1 BB53-0207 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.91 O=C(O)CCC1=CC=NC=C1 BB52-8563 [0,0,0,0,1,0|1,0,0]=2 14 B11R1.91 O=C(O)CCC1=NC=CC=C1 BB52-8590 [0,0,0,0,1,0|1,0,0]=2 15 B11R1.91 O=C(O)CSC1=NC=CC=C1 BB52-3334 [0,0,0,0,1,0|2,0,0]=3 16 B11R1.91 O=C(O)CSC1=NC=CC=N1 BB52-1566 [0,0,0,0,1,0|3,0,0]=4 17 B11R1.172 O=C(O)CNCC1=CC=CO1 BB52-9976 [0,0,0,0,1,0|2,0,0]=3 18 B13R1.337 O=C(O)CCNCC1=CC=CN=C1 BB52-9061 [0,0,0,0,0,1|1,0,0]=2 19 B13R1.337 O=C(O)CCNCC1=CC=NC=C1 BB52-9205 [0,0,0,0,0,1|1,0,0]=2 20 B13R1.337 O=C(O)CCNCC1=NC=CC=C1 BB52-8938 [0,0,0,0,0,1|1,0,0]=2 21 B10R1.17 OCCSC1=NC=CC=C1 BB52-9072 [2,0,0,0,0,0|2,0,0]=4 22 B12R1.8 OCCCNCC1=CC=CN=C1 BB52-8972 [1,1,0,0,0,0|1,0,1]=4 23 B12R1.8 OCCCNCC1=CC=NC=C1 BB52-9759 [1,1,0,0,0,0|1,0,1]=4 24 B12R1.8 OCCCNCC1=NC=CC=C1 BB53-1152 [1,1,0,0,0,0|1,0,1]=4 25 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 BB12-5413 [0,1,0,0,1,0|1,0,0]=3 26 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 BB12-5412 [0,1,0,0,1,0|0,0,0]=2 27 B14R1.420 O=C(O)CCNC(=O)C1=CC=NC=C1 BB53-0917 [0,1,0,0,0,1|1,0,1]=4 28 B14R1.420 O=C(O)CCNC(=O)C1=CN=CC=C1 BB53-1088 [0,1,0,0,0,1|1,0,1]=4 29 B14R1.420 O=C(O)CCNC(=O)C1=NC=CC=C1 BB53-1066 [0,1,0,0,0,1|1,0,1]=4 30 B14R1.818 CC(CC(=O)O)NCC1=CC=CN=C1 BB52-9510 [0,1,0,0,0,1|1,0,0]=3 31 B14R1.818 CC(CC(=O)O)NCC1=CC=NC=C1 BB52-9220 [0,1,0,0,0,1|1,0,0]=3 32 B14R1.818 CC(CC(=O)O)NCC1=NC=CC=C1 BB52-9809 [0,1,0,0,0,1|1,0,0]=3 33 B14R1.6449 CC(CNCC1=CC=CN=C1)C(=O)O BB52-9188 [0,1,0,0,0,1|1,0,0]=3 34 B14R1.6449 CC(CNCC1=CC=NC=C1)C(=O)O BB52-9687 [0,1,0,0,0,1|1,0,0]=3 35 B14R1.6449 CC(CNCC1=NC=CC=C1)C(=O)O BB53-1023 [0,1,0,0,0,1|1,0,0]=3 36 B12R2.41 C1=CC2=C(C=C1)OCCNC2 BB51-1528 [1,0,0,1,0,0|1,0,1]=4 37 B14R2.2 O=C(O)CN1C=CC2=CC=CC=C21 BB52-0789 [0,0,0,1,0,1|0,0,2]=4 38 B14R2.2 O=C(O)CN1C=NC2=CC=CC=C21 BB52-0153 [0,0,0,1,0,1|1,0,1]=4 39 B14R2.2 O=C(O)CN1CCC2=CC=CC=C21 BB52-9272 [0,0,0,1,0,1|0,0,0]=2 40 B14R2.768 O=C(O)CC1=NC2=CC=CC=C2N1 BB52-0905 [0,1,0,1,0,0|1,0,1]=4 41 B14R2.781 O=C(O)C1=CC2=CC=CC=C2OC1 BB51-1488 [0,1,0,1,0,0|1,0,1]=4 42 B14R2.738 CC1CC(=O)NC2=CC=CC=C2N1 BB52-0226 [0,1,0,1,0,0|2,0,0]=4 43 B14R2.741 CC1CNC2=CC=CC=C2NC1=O BB52-0222 [0,1,0,1,0,0|2,0,0]=4 44 B14R2.95 O=C(CBr)N1CCC2=CC=CC=C21 BB53-1072 [0,1,0,1,0,0|2,0,0]=4 45 B14R2.95 O=C(CS)N1CCC2=CC=CC=C21 BB52-7352 [0,1,0,1,0,0|1,1,0]=4