0  B12R1.30  N#CSCC(=O)C1=CC=CC=C1 DP00881 [0,0,0,0,0,0|3,0,1]=4
1  B12R1.30  OCCNC(=S)C1=CC=CC=C1 S02163 [0,0,0,0,0,0|2,1,0]=3
2  B11R1.16  N#CCS(=O)C1=CC=CC=C1 NRB01569 [1,0,0,0,0,0|2,0,1]=4
3  B13R1.17  CC1=CC=C(C(=O)NCCO)C=C1 RDR03640 [0,1,0,0,0,0|2,0,0]=3
4  B13R1.17  N#CCCC(=O)C1=CC=C(Cl)C=C1 SEW02405 [0,1,0,0,0,0|2,0,1]=4
5  B13R1.17  N#CCNC(=O)C1=CC=C(Cl)C=C1 RF02552 [0,1,0,0,0,0|2,0,1]=4
6  B13R1.45  CN(C)CCC(=O)C1=CC=CC=C1 EN00044 [0,1,0,0,0,0|2,0,0]=3
7  B13R1.45  CN(C)\C=C\C(=O)C1=CC=CC=C1 CD11141 [0,1,0,0,0,0|2,0,1]=4
8  B13R1.45  NC(=O)CNC(=O)C1=CC=CC=C1 RJC02447 [0,1,0,0,0,0|2,0,1]=4
9  B13R1.47  CC(CC#N)C(=O)C1=CC=CC=C1 XBX00023 [0,1,0,0,0,0|2,0,1]=4
10  B13R1.44  O=C(NCCO)NC1=CC=CC=C1 S03160 [0,0,0,0,0,1|2,0,0]=3
11  B13R1.44  OCCNC(=S)NC1=CC=CC=C1 S01421 [0,0,0,0,0,1|2,1,0]=4
12  B12R1.3  CCC\C(=N/O)C1=NC=CC=C1 RJC00757 [1,1,0,0,0,0|1,0,1]=4
13  B12R1.16  CC1=CC=C(C(=O)CC#N)C=C1 KM01491 [1,1,0,0,0,0|1,0,1]=4
14  B12R1.17  CC1=CC=CC(C(=O)CC#N)=C1 KM01815 [1,1,0,0,0,0|1,0,1]=4
15  B12R1.17  CCOC(=O)C1=CC(Br)=CN=C1 RDP00009 [1,1,0,0,0,0|1,0,0]=3
16  B12R1.17  N#CCC(=O)C1=CC(Cl)=CC=C1 KM01406 [1,1,0,0,0,0|1,0,1]=4
17  B12R1.107  NC(=O)CC(=O)C1=CC=CC=C1 CD06497 [1,1,0,0,0,0|1,0,1]=4
18  B14R1.33  C#CCOC(=O)NC1=CC=C(Cl)C=C1 S07271 [0,1,0,0,0,1|0,0,2]=4
19  B14R1.33  CCCNC(=O)NC1=CC=C(Cl)C=C1 KM09074 [0,1,0,0,0,1|1,0,0]=3
20  B14R1.33  CCCNC(=S)NC1=CC=C(Cl)C=C1 RDR00171 [0,1,0,0,0,1|1,1,0]=4
21  B14R1.423  CC(=O)CNC(=O)CC1=CC=CC=C1 BTB09315 [0,1,0,0,0,1|1,0,1]=4
22  B14R1.423  CC(C)CNC(=O)OC1=CC=CC=C1 JFD00115 [0,1,0,0,0,1|1,0,0]=3
23  B14R1.946  CCCNC(=O)NC1=C(C)C=CC=C1 KM09906 [0,1,0,0,0,1|1,0,0]=3
24  B14R1.2523  O=C(NCCCl)C1=CC=C(Cl)C=C1Cl RDR03675 [0,2,0,0,0,0|2,0,0]=4
25  B14R1.163  COC(=O)CNC(=O)C1=CC=CC=C1 RDP00222 [0,2,0,0,0,0|1,0,1]=4
26  B14R1.1035  CSCCNC(=O)C1=CC=CC=C1N CD07085 [0,2,0,0,0,0|1,0,0]=3
27  B14R1.4230  CCCNS(=O)(=O)C1=CC=CC=C1I NRB00629 [0,2,0,0,0,0|2,0,0]=4
28  B12R2.1081  O=C1CSCC2=C1C=CC=C2 CD04109 [1,0,0,1,0,0|1,0,0]=3
29  B12R2.1081  S=C1NCCC2=CC=CC=C12 MWP00430 [1,0,0,1,0,0|1,1,0]=4
30  B12R2.2028  CN1SC(=O)C2=C1C=CC=C2 BTB03211 [1,0,0,1,0,0|1,1,0]=4
31  B14R2.19  CC1CN=C(NC2=CC=CC=C2)S1 BTB13006 [0,0,0,1,0,1|1,1,0]=4
32  B14R2.24  O=C1NCCSC1C2=CC=CC=C2 KM03386 [0,0,0,1,0,1|2,0,0]=4
33  B14R2.277  CC1=C(C2=CC=CC=C2)C(=O)NC1 BTB09329 [0,0,0,1,0,1|1,0,1]=4