0 B10R1.21 CCCNCC1=CC=CS1 BB01-5081 [0,0,0,0,0,0|1,1,0]=2 1 B10R1.21 OCCNCC1=NC=CS1 BB55-8221 [0,0,0,0,0,0|3,1,0]=4 2 B9R1.12 NCCCN1C=CC=N1 BB01-4860 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.12 O=C=NCC1=CC=CO1 BB57-0294 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.12 O=CNCC1=CC=CO1 BB01-8225 [1,0,0,0,0,0|2,0,1]=4 5 B9R1.12 OCCCN1C=CC=N1 BB05-2436 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.12 S=C=NCC1=CC=CO1 BB01-4063 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.4 CCCCNCC1=CC=CO1 BB01-5391 [0,1,0,0,0,0|0,0,0]=1 8 B11R1.4 COCCNCC1=CC=CS1 BB01-5570 [0,1,0,0,0,0|1,1,0]=3 9 B11R1.4 COCCNCC1=NC=CS1 BB55-8222 [0,1,0,0,0,0|2,1,0]=4 10 B11R1.25 CNC(C)CCC1=CC=CO1 BB01-4354 [0,1,0,0,0,0|1,0,0]=2 11 B11R1.25 O=C(CCl)NCC1=CC=CO1 BB01-5135 [0,1,0,0,0,0|2,0,1]=4 12 B11R1.29 CCCCC(=O)C1=CC=CS1 BB01-1187 [0,1,0,0,0,0|0,1,1]=3 13 B11R1.29 O=C(CCCCl)C1=CC=CS1 BB01-7805 [0,1,0,0,0,0|1,1,1]=4 14 B11R1.30 CCOC(=O)CC1=CC=CS1 BB01-7823 [0,1,0,0,0,0|1,1,1]=4 15 B11R1.28 CNCCOC1=CC=CC=C1 BB57-6363 [0,0,0,0,0,1|3,0,0]=4 16 B11R1.28 NCCCSC1=CC=CC=C1 BB57-5461 [0,0,0,0,0,1|3,0,0]=4 17 B11R1.28 NCCNCC1=CC=CC=C1 BB58-0025 [0,0,0,0,0,1|3,0,0]=4 18 B8R1.8 CNCC1=CC=CO1 BB01-5301 [2,0,0,0,0,0|1,0,0]=3 19 B8R1.8 CNCC1=CC=CS1 BB55-3486 [2,0,0,0,0,0|1,1,0]=4 20 B8R1.8 NCCC1=CC=CS1 BB01-0963 [2,0,0,0,0,0|1,1,0]=4 21 B10R1.11 CCCC(=O)C1=CC=CS1 BB55-2280 [1,1,0,0,0,0|0,1,1]=4 22 B10R1.11 CCCC(N)C1=CC=CS1 BB01-4372 [1,1,0,0,0,0|0,1,0]=3 23 B10R1.11 CCOC(=O)C1=CC=CO1 BB17-0864 [1,1,0,0,0,0|1,0,1]=4 24 B10R1.16 CC1=CC=C(CCC=O)O1 BB01-8332 [1,1,0,0,0,0|1,0,1]=4 25 B10R1.16 CCNCC1=CC=C(C)O1 BB55-8393 [1,1,0,0,0,0|1,0,0]=3 26 B10R1.66 CC(N)CCC1=CC=CO1 BB01-4327 [1,1,0,0,0,0|0,0,0]=2 27 B12R1.1 CCCCSC1=CC=C(N)C=C1 BB57-6887 [0,1,0,0,0,1|2,0,0]=4 28 B12R1.8 CCNCCOC1=CC=CC=C1 BB57-5350 [0,1,0,0,0,1|2,0,0]=4 29 B12R1.8 NCCCNCC1=CC=CC=C1 BB01-5364 [0,1,0,0,0,1|2,0,0]=4 30 B12R1.8 NCCCOCC1=CC=CC=C1 BB57-6490 [0,1,0,0,0,1|2,0,0]=4 31 B12R1.8 OCCSCCC1=CC=NC=C1 BB57-0402 [0,1,0,0,0,1|2,0,0]=4 32 B12R1.30 CCCCC(=O)C1=CC=CC=C1 BB17-2231 [0,1,0,0,0,1|1,0,1]=4 33 B12R1.252 CC(C)CNCC1=CC=CC=C1 BB58-4354 [0,1,0,0,0,1|2,0,0]=4 34 B12R1.252 CC(O)CNCC1=CC=CC=C1 BB58-2125 [0,1,0,0,0,1|2,0,0]=4 35 B12R1.37 COCCCNCC1=CC=CS1 BB01-5592 [0,2,0,0,0,0|0,1,0]=3 36 B12R1.51 CNCC(=O)NCC1=CC=CO1 BB01-4942 [0,2,0,0,0,0|1,0,1]=4 37 B12R1.255 CN(C)CCNCC1=CC=CO1 BB01-5395 [0,2,0,0,0,0|1,0,0]=3 38 B12R1.255 CN(C)CCNCC1=CC=CS1 BB01-1212 [0,2,0,0,0,0|1,1,0]=4 39 B12R1.477 CCC(=O)CCCN1C=CC=N1 BB58-4403 [0,2,0,0,0,0|2,0,0]=4 40 B12R1.477 NCC(O)COCC1=CC=CO1 BB01-6322 [0,2,0,0,0,0|1,0,0]=3 41 B12R1.29 CCCNC(=O)C1=CC=C(Br)O1 BB55-2910 [0,2,0,0,0,0|1,0,1]=4 42 B10R2.7 C1=CC2=C(CCNC2)S1 BB57-4172 [1,0,0,1,0,0|1,1,0]=4 43 B12R2.2 C1=CN=CC(C2CCCN2)=C1 BB01-7964 [0,0,0,1,0,1|2,0,0]=4 44 B12R2.1081 NC1CCCC2=C1C=CC=C2 BB01-4475 [0,0,0,1,0,1|2,0,0]=4