0  B14R1.818  CC(=O)CC(=O)NCC1=CC=CC=C1 OR54477 [0,0,0,0,0,0|2,0,1]=3
1  B13R1.42  CCOC(=O)CCC1=CC=CC=C1 OR17914 [1,0,0,0,0,0|2,0,0]=3
2  B13R1.42  CCOC(=O)CNC1=CC=CC=C1 OR346330 [1,0,0,0,0,0|3,0,0]=4
3  B13R1.42  N#CCC(=O)NCC1=CC=CC=C1 OR14083 [1,0,0,0,0,0|2,0,1]=4
4  B13R1.42  N#CCC(=O)OCC1=CC=CC=C1 OR2049 [1,0,0,0,0,0|1,0,1]=3
5  B15R2.27  O=C1CC(=O)CC(C2=CC=CC=C2)C1 OR11080 [0,0,0,1,0,0|2,0,1]=4
6  B15R2.27  O=C1CC(=O)CC(C2=CC=CC=C2)C1 OR300698 [0,0,0,1,0,0|2,0,1]=4
7  B15R2.327  CC1(C)OC(=O)N[C@@H]1C2=CC=CC=C2 OR40633 [0,0,0,1,0,0|2,0,0]=3
8  B13R1.351  C[C@H](N)C(=O)OCC1=CC=CC=C1 OR52412 [0,0,0,0,1,0|1,0,0]=2
9  B12R1.8  BrCCCOCC1=CC=CC=C1 OR22888 [2,0,0,0,0,0|1,0,1]=4
10  B12R1.27  C#CC(=O)OCC1=CC=CC=C1 OR315220 [2,0,0,0,0,0|0,0,2]=4
11  B12R1.27  COC(=O)CCC1=CC=CC=C1 OR30978 [2,0,0,0,0,0|2,0,0]=4
12  B12R1.27  NNC(=O)OCC1=CC=CC=C1 OR7846 [2,0,0,0,0,0|2,0,0]=4
13  B12R1.27  O=C(CBr)OCC1=CC=CC=C1 OR10827 [2,0,0,0,0,0|1,0,0]=3
14  B12R1.27  O=C(CCl)NCC1=CC=CC=C1 OR4110 [2,0,0,0,0,0|2,0,0]=4
15  B14R1.156  C=CCNC(=O)OCC1=CC=CC=C1 OR28285 [1,1,0,0,0,0|0,0,2]=4
16  B14R1.156  O=C(NCCBr)OCC1=CC=CC=C1 OR52103 [1,1,0,0,0,0|1,0,0]=3
17  B14R1.502  CCOC(=O)CCC1=CC=C(O)C=C1 OR8094 [1,1,0,0,0,0|2,0,0]=4
18  B16R1.12547  CC(C)(C)OC(=O)CNCC1=CC=CC=C1 OR300515 [0,1,0,0,0,1|2,0,0]=4
19  B16R1.12547  CC(C)(C)OC(=O)NOCC1=CC=CC=C1 OR70016 [0,1,0,0,0,1|1,0,0]=3
20  B16R1.11198  CC(C)(C)OC(=O)NCC1=CC=CC(Br)=C1 OR962712 [0,2,0,0,0,0|2,0,0]=4
21  B16R1.11198  CC(C)(C)OC(=O)NCC1=CC=CC(N)=C1 OR301370 [0,2,0,0,0,0|2,0,0]=4
22  B14R2.30  O=C1CCCN1CC2=CC=CC=C2 OR55077 [1,0,0,1,0,0|1,0,0]=3
23  B14R2.598  C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 OR10970 [1,0,0,1,0,0|1,0,0]=3
24  B14R2.738  CC1CC(=O)NC2=CC=CC=C2N1 OR21103 [0,0,0,1,1,0|2,0,0]=4
25  B16R2.3322  NC1CN(C(=O)OCC2=CC=CC=C2)C1 OR317158 [0,0,0,1,0,1|1,0,0]=3
26  B16R2.3322  O=C1CN(C(=O)OCC2=CC=CC=C2)C1 OR309040 [0,0,0,1,0,1|1,0,1]=4
27  B16R2.12060  CC1(C)CNC(=O)N1CC2=CC=CC=C2 OR310063 [0,0,0,1,0,1|1,0,0]=3
28  B16R2.44148  O=C(NC1CNC1)OCC2=CC=CC=C2 OR15686 [0,1,0,1,0,0|1,0,0]=3
29  B12R1.32  CCOC(=O)CC1=CC=CN=C1 OR46218 [1,0,0,0,1,0|2,0,0]=4
30  B12R1.32  CCOC(=O)CC1=NC=CC=C1 OR24900 [1,0,0,0,1,0|2,0,0]=4
31  B12R1.43  CC(Br)C(=O)NC1=CC=CC=C1 OR27916 [0,0,0,0,2,0|2,0,0]=4
32  B12R1.43  CN(C)C(=O)NC1=CC=CC=C1 OR52463 [0,0,0,0,2,0|2,0,0]=4
33  B12R1.107  CC(=O)CC(=O)C1=CC=CC=C1 OR12814 [0,0,0,0,2,0|1,0,1]=4
34  B14R1.520  CCOC(=O)CNCC1=CC=CC=C1 OR2367 [1,0,0,0,0,1|2,0,0]=4