0 B9R1.12 CCNCC1=CC=CO1 BBL013868 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.12 NCCCC1=CC=CO1 BBL030544 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.12 S=C=NCC1=CC=CO1 BBL009998 [0,0,0,0,0,0|1,1,1]=3 3 B8R1.8 NCCC1=CC=CS1 BBL001466 [1,0,0,0,0,0|1,1,1]=4 4 B10R1.16 CCNCC1=CC=C(C)O1 BBL000395 [0,1,0,0,0,0|2,0,1]=4 5 B10R1.21 CNCCCC1=CC=CO1 BBL030347 [0,1,0,0,0,0|2,0,1]=4 6 B10R1.21 OCCNCC1=CC=CO1 BBL000057 [0,1,0,0,0,0|1,0,2]=4 7 B10R1.27 CCC(=O)CC1=CC=CO1 BBL029638 [0,1,0,0,0,0|2,0,1]=4 8 B10R1.66 CC(=O)CCC1=CC=CO1 BBL028608 [0,1,0,0,0,0|1,0,0]=2 9 B10R1.66 CC(=O)CCN1C=CC=N1 BBL037748 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.66 CC(C)NCC1=CC=CO1 BBL030424 [0,1,0,0,0,0|2,0,1]=4 11 B10R1.66 CC(N)CCC1=CC=CO1 BBL028734 [0,1,0,0,0,0|2,0,1]=4 12 B10R1.66 O=C(Cl)\C=C\C1=CC=CO1 BBL037199 [0,1,0,0,0,0|1,0,1]=3 13 B10R1.66 O=C(O)CCC1=CC=CO1 BBL027515 [0,1,0,0,0,0|1,0,0]=2 14 B10R1.66 O=C(O)CCN1C=CC=C1 BBL008565 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.66 O=C(O)CCN1C=CC=N1 BBL015777 [0,1,0,0,0,0|3,0,0]=4 16 B10R1.66 O=C(O)\C=C\C1=CC=CO1 BBL023478 [0,1,0,0,0,0|1,0,1]=3 17 B10R1.66 O=C(O)\C=C\C1=CC=CS1 BBL037013 [0,1,0,0,0,0|1,1,1]=4 18 B10R1.66 O=[N+]([O-])CCC1=CC=CO1 BBL030613 [0,1,0,0,0,0|2,0,0]=3 19 B7R1.1 NCC1=CC=CO1 BBL011620 [2,0,0,0,0,0|1,0,0]=3 20 B7R1.1 O=CC1=CN=CN1 BBL029981 [2,0,0,0,0,0|2,0,0]=4 21 B7R1.1 O=CC1=CSC=C1 BBL012656 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.13 CC(=O)CN1C=CC=N1 BBL040015 [1,1,0,0,0,0|2,0,0]=4 23 B9R1.13 CC(N)CC1=CC=CO1 BBL030348 [1,1,0,0,0,0|1,0,1]=4 24 B9R1.13 O=C(Cl)CC1=CC=CS1 BBL027527 [1,1,0,0,0,0|0,1,0]=3 25 B9R1.13 O=C(O)CC1=CSC=C1 BBL025878 [1,1,0,0,0,0|2,0,0]=4 26 B9R1.13 O=C(O)CN1C=CC=N1 BBL008568 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.91 CC(=O)CCC1=CC=CC=C1 BBL011439 [0,1,0,0,0,1|2,0,0]=4 28 B11R1.91 NC(=O)NCC1=CC=CC=C1 BBL013146 [0,1,0,0,0,1|2,0,0]=4 29 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 BBL011517 [0,1,0,0,0,1|1,1,0]=4 30 B11R1.91 O=C(O)CCC1=CC=CC=C1 BBL011572 [0,1,0,0,0,1|2,0,0]=4 31 B11R1.77 NC(CC(=O)O)C1=CC=CO1 BBL005138 [0,2,0,0,0,0|1,0,0]=3 32 B11R1.77 NC(CC(=O)O)C1=CC=CS1 BBL004480 [0,2,0,0,0,0|1,1,0]=4 33 B11R1.75 CC1=CC=C(\C=C\C(=O)Cl)O1 BBL037200 [0,2,0,0,0,0|1,0,1]=4 34 B11R1.75 CC1=CC=C(\C=C\C(=O)O)O1 BBL023058 [0,2,0,0,0,0|1,0,1]=4 35 B11R1.75 NC(=O)CCC1=CC(Cl)=NO1 BBL033068 [0,2,0,0,0,0|2,0,0]=4 36 B11R1.75 O=C(O)CCC1=CC(Cl)=NO1 BBL009742 [0,2,0,0,0,0|2,0,0]=4 37 B11R1.75 O=C(O)CCC1=CC(O)=NO1 BBL010802 [0,2,0,0,0,0|2,0,0]=4 38 B11R1.25 NCC(=O)NCC1=CC=CO1 BBL011189 [0,2,0,0,0,0|1,0,0]=3 39 B11R1.25 O=C(CCl)NCC1=CC=CO1 BBL008375 [0,2,0,0,0,0|1,0,0]=3 40 B11R1.172 O=C(O)CNCC1=CC=CO1 BBL011870 [0,2,0,0,0,0|1,0,0]=3 41 B11R2.106 O=C1CCCC2=C1C=CN2 BBL010663 [0,1,0,1,0,0|2,0,0]=4