0  B13R1.45  CC(C)NCC(=O)C1=CC=CC=C1 76887 [1,0,0,0,0,0|1,0,1]=3
1  B13R1.45  C[C@H](O)CNC(=O)C1=CC=CC=C1 32386 [1,0,0,0,0,0|2,0,0]=3
2  B15R2.59  CC(C)C1=NC(C2=CC=CC=C2)=CN1 AC9819 [0,0,0,1,0,0|2,0,1]=4
3  B15R2.59  CC(C)[C@@H]1COC(C2=CC=CC=C2)=N1 V10335 [0,0,0,1,0,0|3,0,0]=4
4  B15R2.59  CC(C)[C@@H]1COC(C2=CC=CC=C2)=N1 V10358 [0,0,0,1,0,0|3,0,0]=4
5  B13R1.713  CN(C)\C=C(\C#N)C1=CC=CC=C1 90706 [0,0,0,0,1,0|2,0,1]=4
6  B12R1.30  CCCCC(=O)C1=CC=NC=C1 N14246 [2,0,0,0,0,0|1,0,1]=4
7  B12R1.30  CCCCC(=O)C1=NC=CC=C1 N12234 [2,0,0,0,0,0|1,0,1]=4
8  B12R1.30  O=C(OCCO)C1=CC=CC=C1 E72195 [2,0,0,0,0,0|2,0,0]=4
9  B12R1.30  O=C(SCCS)C1=CC=CC=C1 D76612 [2,0,0,0,0,0|2,0,0]=4
10  B14R1.149  CN(C)\C=C\C(=O)C1=CC=CC(Cl)=C1 31172 [1,1,0,0,0,0|1,0,1]=4
11  B14R1.678  CN(C)CCC(=O)C1=CC=C(O)C=C1 75641 [1,1,0,0,0,0|1,0,1]=4
12  B14R2.403  CC1(C)CN=C(C2=CC=CC=C2)O1 V10355 [1,0,0,1,0,0|1,0,1]=4
13  B14R2.792  O=C(OC[C@H]1CO1)C2=CC=CC=C2 56433 [1,0,0,1,0,0|2,0,0]=4
14  B14R2.2  C[C@H](O)CC1=CNC2=C1C=CC=C2 P14764 [0,0,0,1,1,0|2,0,0]=4
15  B14R2.2  C[C@H](O)CC1=CNC2=C1C=CC=C2 P14765 [0,0,0,1,1,0|2,0,0]=4
16  B16R2.241288  CC(C)N1C=C(C=O)C2=C(Br)C=CC=C21 C91197 [0,1,0,1,0,0|1,0,0]=3
17  B16R2.403705  CC1(C)CN[C@@H](C(=O)O)C2=C1C=CC=C2 AT25070 [0,1,0,1,0,0|1,0,1]=4
18  B12R1.107  CC(C)CC(=O)C1=CN=CC=C1 F30170 [1,0,0,0,1,0|1,0,0]=3
19  B12R1.107  CC(C)CC(=O)C1=NC=CC=C1 F30232 [1,0,0,0,1,0|1,0,0]=3