0  B14R1.160  Nc1ccccc1C(=O)NCC(=O)O MC436011 [0,0,0,0,0,0|3,0,1]=4
1  B13R1.45  CC(C)NNC(=O)C1=CC=NC=C1 MC111368 [1,0,0,0,0,0|3,0,0]=4
2  B13R1.45  CC(O)CCC(=O)C1=CC=CC=C1 CS14046 [1,0,0,0,0,0|2,0,0]=3
3  B13R1.45  CN(C)CCC(=O)C1=CC=CC=C1 MC31215 [1,0,0,0,0,0|2,0,0]=3
4  B13R1.201  CC(C)OC(=O)C1=C(N)C=CC=C1 CS10027 [0,0,0,0,1,0|0,0,0]=1
5  B12R1.30  CCCOC(=O)C1=CC=CC=C1 CS11887 [2,0,0,0,0,0|0,0,0]=2
6  B12R1.30  O=C(OCCCl)C1=CC=CC=C1 MC40015 [2,0,0,0,0,0|1,0,0]=3
7  B12R1.252  CC(O)COCC1=CC=CC=C1 CS20248 [2,0,0,0,0,0|1,0,1]=4
8  B12R1.308  CCCC(=O)C1=C(N)C=CC=C1 MC430441 [2,0,0,0,0,0|0,0,0]=2
9  B12R1.308  CCOC(=O)C1=C(Br)C=CC=C1 MC20191 [2,0,0,0,0,0|1,0,0]=3
10  B12R1.308  CCOC(=O)C1=C(Br)C=NC=C1 MC20829 [2,0,0,0,0,0|2,0,0]=4
11  B12R1.308  CCOC(=O)C1=C(Br)N=CC=C1 CS21405 [2,0,0,0,0,0|2,0,0]=4
12  B12R1.308  CCOC(=O)C1=C(C)C=CC=C1 MC40044 [2,0,0,0,0,0|1,0,0]=3
13  B12R1.308  CCOC(=O)C1=C(Cl)N=CC=C1 CS20897 [2,0,0,0,0,0|2,0,0]=4
14  B12R1.308  CCOC(=O)C1=C(F)C=CC=C1 CS11340 [2,0,0,0,0,0|1,0,0]=3
15  B12R1.308  CCOC(=O)C1=C(N)N=CC=C1 CS13612 [2,0,0,0,0,0|1,0,0]=3
16  B12R1.308  CCOC(=O)C1=C(O)C=NC=C1 MC100279 [2,0,0,0,0,0|2,0,0]=4
17  B12R1.308  CCOC(=O)C1=CC=CC=C1O MC34575 [2,0,0,0,0,0|1,0,0]=3
18  B12R1.308  CCOC(=O)C1=CN=CC=C1Cl CS18275 [2,0,0,0,0,0|2,0,0]=4
19  B12R1.308  CCOC(=O)C1=CN=CN=C1N MC444489 [2,0,0,0,0,0|2,0,0]=4
20  B12R1.308  CCOC(=O)C1=NC=CC=C1F MC432518 [2,0,0,0,0,0|2,0,0]=4
21  B12R1.308  CCOC(=O)C1=NC=CC=C1N CS22110 [2,0,0,0,0,0|1,0,0]=3
22  B12R1.308  O=C(CCCl)C1=C(Cl)C=CC=C1 MC429389 [2,0,0,0,0,0|2,0,0]=4
23  B14R1.3098  CC(C)(C)OOC(=O)C1=CC=CC=C1 MC40132 [1,1,0,0,0,0|1,0,0]=3
24  B14R1.3098  CC(F)(F)COC(=O)C1=CC=CC=C1 MC429357 [1,1,0,0,0,0|1,0,0]=3
25  B14R1.2523  CCCCC(=O)C1=C(O)C=C(C)C=C1 MC41287 [1,1,0,0,0,0|2,0,0]=4
26  B14R1.4451  CC(C)(C)OC(=O)C1=C(Br)C=CC=C1 MC40129 [0,1,0,0,1,0|1,0,0]=3
27  B14R1.4451  CC(C)(C)OC(=O)C1=C(Br)N=CC=C1 MC33505 [0,1,0,0,1,0|2,0,0]=4
28  B14R2.2  CC(N)CC1=CNC2=CC=CC=C12 MC431258 [0,0,0,1,1,0|2,0,0]=4
29  B14R2.8052  CC1(C)OC(=O)C2=C1C=CN=C2Cl MC443816 [0,0,0,1,1,0|2,0,0]=4
30  B14R2.8052  CC1CC(C)(C)C2=C1C(N)=CC=C2 MC431072 [0,0,0,1,1,0|1,0,1]=4
31  B16R2.26185  CC1=CC(C(=O)NCC2CC2)=C(O)C=C1 MC106117 [0,1,0,1,0,0|2,0,0]=4
32  B12R1.107  CC(=O)CC(=O)C1=CC=CC=C1 CS20784 [1,0,0,0,1,0|1,0,1]=4