0  B11R1.91  CN(C)CCC1=NC=CC=C1 SB01680 [0,0,0,0,0,0|3,0,0]=3
1  B11R1.91  N=C(N)COC1=CC=CC=C1 MO07572 [0,0,0,0,0,0|3,0,1]=4
2  B11R1.91  N=C(N)CSC1=CC=CC=C1 SPB05877 [0,0,0,0,0,0|3,0,1]=4
3  B11R1.91  NC(=S)CSC1=CC=CC=C1 KM04192 [0,0,0,0,0,0|2,1,1]=4
4  B10R1.17  NCCOC1=CC=CC=C1 RF03254 [1,0,0,0,0,0|2,0,0]=3
5  B12R1.21  O=C(O)CSC1=CC=C(Cl)C=C1 RF00560 [0,1,0,0,0,0|2,0,1]=4
6  B12R1.21  O=C(O)CSC1=CC=C(F)C=C1 KM09206 [0,1,0,0,0,0|2,0,1]=4
7  B12R1.27  COC(=O)CSC1=CC=CC=C1 TL00707 [0,1,0,0,0,0|1,0,2]=4
8  B12R1.27  N\C(COC1=CC=CC=C1)=N/O SPB02646 [0,1,0,0,0,0|2,0,1]=4
9  B9R1.8  CNCC1=CC=CN=C1 TL00368 [2,0,0,0,0,0|2,0,0]=4
10  B9R1.8  CNCC1=CC=NC=C1 MO00914 [2,0,0,0,0,0|2,0,0]=4
11  B9R1.8  OCCC1=CC=CN=C1 KM09875 [2,0,0,0,0,0|1,0,0]=3
12  B11R1.17  NCCOC1=CC=CC=C1Cl RF03300 [1,1,0,0,0,0|2,0,0]=4
13  B11R1.28  NCCOCC1=CC=CC=C1 MO07103 [1,1,0,0,0,0|1,0,0]=3
14  B11R1.28  S=C=NCCC1=CC=CC=C1 TL00242 [1,1,0,0,0,0|0,1,1]=4
15  B11R1.40  N\C(CC1=CC=CC=C1)=N/O S01215 [1,1,0,0,0,0|1,0,1]=4
16  B13R1.158  CN(C)CCOC1=C(N)C=CC=C1 CC51314 [0,1,0,0,0,1|2,0,0]=4
17  B13R1.513  CN(C)CCOC1=CC=C(Br)C=C1 CC51510 [0,1,0,0,0,1|2,0,0]=4
18  B13R1.513  CN(C)CCOC1=CC=C(N)C=C1 CC51514 [0,1,0,0,0,1|2,0,0]=4
19  B13R1.513  O=C(O)CCCC1=CC=C(Br)C=C1 MO01273 [0,1,0,0,0,1|1,0,1]=4
20  B13R1.164  O=C(O)CCC1=CC=C(Cl)C=C1Cl SEW04678 [0,2,0,0,0,0|1,0,1]=4
21  B11R2.20  C1=CC2=C(N=C1)NCCO2 CC60830 [1,0,0,1,0,0|2,0,0]=4
22  B11R2.20  C1=CC=C2OCCNC2=C1 MAY00300 [1,0,0,1,0,0|1,0,0]=3
23  B13R2.155  N[C@@H]1CCC2=CC=C(O)C=C2C1 NP43558 [0,1,0,1,0,0|1,0,0]=3
24  B13R2.57  N#CC1CNC2=CC=CC=C2O1 CC29716 [0,1,0,1,0,0|1,0,1]=4
25  B13R2.57  OCC1COC2=CC=CC=C2C1 CC25809 [0,1,0,1,0,0|1,0,0]=3