0  B10R1.27  N[C@H](CO)CC1=CNC=N1 AC-16617 [0,0,0,0,0,0|0,0,4]=4
1  B11R1.35  N[C@@H](CC1=CC=CO1)C(=O)O AC-5885 [0,1,0,0,0,0|2,0,0]=3
2  B11R1.35  N[C@@H](CC1=CC=CS1)C(=O)O AC-7950 [0,1,0,0,0,0|2,0,0]=3
3  B11R1.35  N[C@@H](CC1=CNC=N1)C(=O)O AC-35086 [0,1,0,0,0,0|0,0,2]=3
4  B11R1.35  N[C@@H](CC1=CSC=C1)C(=O)O AC-9990 [0,1,0,0,0,0|2,0,0]=3
5  B11R1.35  N[C@@H](CN1C=CC=N1)C(=O)O AC-6716 [0,1,0,0,0,0|2,0,1]=4
6  B11R1.35  N[C@@H](CN1C=CN=C1)C(=O)O AC-4466 [0,1,0,0,0,0|2,0,0]=3
7  B11R1.35  N[C@H](CC1=CC=CO1)C(=O)O AC-5884 [0,1,0,0,0,0|2,0,0]=3
8  B11R1.35  N[C@H](CC1=CC=CS1)C(=O)O AC-9985 [0,1,0,0,0,0|2,0,0]=3
9  B11R1.35  N[C@H](CC1=CNC=N1)C(=O)O AC-8655 [0,1,0,0,0,0|0,0,2]=3
10  B11R1.35  N[C@H](CC1=CSC=C1)C(=O)O AC-9991 [0,1,0,0,0,0|2,0,0]=3
11  B11R1.35  N[C@H](CN1C=CN=C1)C(=O)O AC-4465 [0,1,0,0,0,0|2,0,0]=3
12  B8R1.8  NCCC1=CC=CS1 AC-6275 [2,0,0,0,0,0|2,0,0]=4
13  B8R1.8  NCCC1=CNC=N1 AC-13185 [2,0,0,0,0,0|0,0,2]=4
14  B8R1.8  NCCC1=CNC=N1 AC-24100 [2,0,0,0,0,0|0,0,2]=4
15  B8R1.8  NCCC1=CNC=N1 AC-7507 [2,0,0,0,0,0|0,0,2]=4
16  B8R1.8  NCCN1C=CN=C1 AC-20616 [2,0,0,0,0,0|2,0,0]=4
17  B10R1.16  CC1=CC=C(CCC=O)O1 AC-22554 [1,1,0,0,0,0|2,0,0]=4
18  B10R1.66  CC(=O)CCN1C=CN=C1 AC-17746 [1,1,0,0,0,0|2,0,0]=4
19  B10R1.66  O=C(O)CCC1=CC=CS1 AC-6474 [1,1,0,0,0,0|2,0,0]=4
20  B10R1.66  O=C(O)CCC1=CNC=N1 AC-25677 [1,1,0,0,0,0|0,0,2]=4
21  B10R1.66  O=C(O)CCN1C=CN=C1 AC-26473 [1,1,0,0,0,0|2,0,0]=4
22  B10R1.66  O=C(O)CCN1C=NC=N1 AC-14370 [1,1,0,0,0,0|1,0,1]=4
23  B12R1.43  NC(=O)C(N)CC1=CC=CC=C1 AC-19229 [0,1,0,0,0,1|2,0,0]=4
24  B12R1.43  NC(CC1=CC=CC=C1)C(=O)O AC-24032 [0,1,0,0,0,1|2,0,0]=4
25  B12R1.43  N[C@@H](CC1=CC=CC=C1)C(=O)O AC-22417 [0,1,0,0,0,1|2,0,0]=4
26  B12R1.43  N[C@@H](CC1=CC=CN=C1)C(=O)O AC-10472 [0,1,0,0,0,1|1,0,0]=3
27  B12R1.43  N[C@@H](CC1=CC=NC=C1)C(=O)O AC-9961 [0,1,0,0,0,1|1,0,0]=3
28  B12R1.43  N[C@@H](CC1=CN=CC=C1)C(=O)O AC-9955 [0,1,0,0,0,1|1,0,0]=3
29  B12R1.43  N[C@@H](CC1=NC=CC=C1)C(=O)O AC-5878 [0,1,0,0,0,1|1,0,1]=4
30  B12R1.43  N[C@H](CC1=CC=CC=C1)C(=O)O AC-11292 [0,1,0,0,0,1|2,0,0]=4
31  B12R1.43  N[C@H](CC1=CC=CC=C1)C(=O)O AC-8664 [0,1,0,0,0,1|2,0,0]=4
32  B12R1.43  N[C@H](CC1=CC=CC=N1)C(=O)O AC-5879 [0,1,0,0,0,1|1,0,1]=4
33  B12R1.43  N[C@H](CC1=CC=CN=C1)C(=O)O AC-9956 [0,1,0,0,0,1|1,0,0]=3
34  B12R1.43  N[C@H](CC1=CC=NC=C1)C(=O)O AC-9962 [0,1,0,0,0,1|1,0,0]=3
35  B12R1.43  [C@H](N)(CC1=NC=CC=C1)C(=O)O AC-19148 [0,1,0,0,0,1|1,0,1]=4
36  B10R2.32  O=C1CCN2C=CN=C12 AC-30778 [1,0,0,1,0,0|2,0,0]=4
37  B12R2.246  NC1=NC2=C(N=CN2)C(=O)N1 AC-4743 [0,1,0,1,0,0|1,0,1]=4
38  B12R2.246  NC1=NC2=C(N=CN2)C(=O)N1 AC-8423 [0,1,0,1,0,0|1,0,1]=4