0 B10R1.66 CC(=O)CCN1C=CC=N1 4033649 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.66 O=C(O)CCC1=CC=NO1 4018161 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.66 O=C(O)CCC1=CSC=C1 4014842 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.66 O=C(O)CCN1C=CC=C1 4027042 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.66 O=C(O)CCN1C=CC=N1 4004233 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.66 O=C(O)CCN1C=CC=N1 4089879 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.66 O=C(O)\C=C\C1=CC=CS1 3002329 [0,0,0,0,0,0|2,1,1]=4 7 B9R1.12 NCCCC1=CC=CO1 4028902 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.12 O=C=NCC1=CC=CS1 4012287 [1,0,0,0,0,0|1,1,1]=4 9 B9R1.12 O=CCCN1C=CC=N1 4010920 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.25 O=C(CBr)NCC1=CC=CO1 4023685 [0,1,0,0,0,0|1,0,0]=2 11 B11R1.25 O=C(CCl)NCC1=CC=CO1 3015664 [0,1,0,0,0,0|1,0,0]=2 12 B11R1.35 NC(CC1=CC=CO1)C(=O)O 4141555 [0,1,0,0,0,0|2,0,0]=3 13 B11R1.75 O=C(O)CCC1=CC(Br)=NO1 4002825 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.75 O=C(O)CCC1=CC(Cl)=NO1 4002889 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.75 O=C(O)CCC1=CC(O)=NO1 4027380 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.510 CC(C)(C)NCC1=CC=CO1 4089556 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.510 CC(C)(C)NCC1=CC=CO1 9071656 [0,1,0,0,0,0|2,0,1]=4 18 B9R1.13 CC(=O)CC1=CC=CS1 4041410 [0,0,0,0,1,0|0,1,0]=2 19 B9R1.13 CC(=O)CN1C=CC=N1 4027130 [0,0,0,0,1,0|2,0,0]=3 20 B9R1.13 CC(=O)CN1C=NC=N1 4001637 [0,0,0,0,1,0|3,0,0]=4 21 B9R1.13 CC(=O)CN1C=NC=N1 4089126 [0,0,0,0,1,0|3,0,0]=4 22 B9R1.13 O=C(O)CC1=CC=NN1 4004807 [0,0,0,0,1,0|3,0,0]=4 23 B9R1.13 O=C(O)CC1=CSC=N1 2402341 [0,0,0,0,1,0|3,0,0]=4 24 B9R1.13 O=C(O)CN1C=CC=C1 4027952 [0,0,0,0,1,0|3,0,0]=4 25 B9R1.13 O=C(O)CN1C=CC=N1 2402291 [0,0,0,0,1,0|3,0,0]=4 26 B11R1.91 O=C(O)CCC1=CC=NC=C1 4004170 [0,0,0,0,0,1|3,0,0]=4 27 B11R1.91 O=C(O)CCC1=NC=CC=C1 4004241 [0,0,0,0,0,1|3,0,0]=4 28 B11R1.91 O=C(O)CCC1=NC=CN=C1 4003578 [0,0,0,0,0,1|3,0,0]=4 29 B11R1.172 CC(C)CNCC1=CC=CO1 9071652 [0,0,0,0,0,1|2,0,1]=4 30 B8R1.8 CNCC1=CC=CO1 2102243 [2,0,0,0,0,0|1,0,0]=3 31 B8R1.8 CNCC1=CC=CS1 4100657 [2,0,0,0,0,0|1,1,0]=4 32 B8R1.8 NCCC1=CC=CO1 4100671 [2,0,0,0,0,0|1,0,1]=4 33 B10R1.16 CCNCC1=CC=C(C)O1 4030468 [1,1,0,0,0,0|1,0,1]=4 34 B10R1.16 CCNCC1=CC=C(C)O1 4089639 [1,1,0,0,0,0|1,0,1]=4 35 B10R1.21 CCCNCC1=CC=CO1 9070945 [1,1,0,0,0,0|1,0,1]=4 36 B10R1.21 OCCNCC1=CC=CO1 9072041 [1,1,0,0,0,0|1,0,1]=4 37 B10R1.27 CCC(=O)CC1=CC=CO1 4027298 [1,1,0,0,0,0|1,0,1]=4 38 B10R1.54 CC(=O)CC1=NC(C)=NO1 4002241 [0,1,0,0,1,0|2,0,0]=4 39 B12R1.21 CC(=O)NCC1=CC=C(Cl)N=C1 4035228 [0,1,0,0,0,1|2,0,0]=4 40 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 4023673 [0,1,0,0,0,1|2,0,0]=4 41 B12R1.226 CC(=O)NCC1=CC(Br)=CC=C1 9070602 [0,1,0,0,0,1|2,0,0]=4 42 B12R1.26 COC(=O)CCC1=CC(Br)=NO1 4042604 [0,2,0,0,0,0|2,0,0]=4 43 B12R1.51 O=C(CCCl)NCC1=CC=CO1 5344117 [0,2,0,0,0,0|1,0,0]=3 44 B12R1.51 O=C(CCCl)NCC1=CC=CS1 7248309 [0,2,0,0,0,0|1,1,0]=4 45 B12R1.103 NC(CC(=O)O)C1=CC=C(Br)O1 4009499 [0,2,0,0,0,0|2,0,0]=4 46 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 4002962 [0,0,0,1,0,1|2,0,0]=4 47 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 4030655 [0,0,0,1,0,1|2,0,0]=4 48 B8R1.7 CC(=O)C1=NC=CN1 4040695 [0,0,0,0,2,0|2,0,0]=4 49 B8R1.7 N=C(N)C1=CC=CO1 4030998 [0,0,0,0,2,0|2,0,0]=4