0  B12R2.252  c1csc2c1[nH]c(c2)C(=O)O T1464 [0,0,0,0,0,0|2,0,0]=2
1  B13R2.430  C1=CC(=CC2=C1C=CN2)C(=O)O 6588 [0,0,0,0,0,1|2,0,0]=3
2  B13R2.430  C1=CC2=C(C=C1C(=O)O)NC=N2 6731 [0,0,0,0,0,1|3,0,0]=4
3  B13R2.430  C1=CC2=C(C=C1C(=O)O)NC=N2 9796 [0,0,0,0,0,1|3,0,0]=4
4  B13R2.430  C1=CC2=C(C=CN2)C=C1C(=O)O 6703 [0,0,0,0,0,1|2,0,0]=3
5  B13R2.435  C1=CC=C2C(=C1)C=C(N2)C(=O)O 6682 [0,0,0,0,0,1|1,0,0]=2
6  B13R2.435  C1=CC=C2C(=C1)C=C(N2)C(=O)O 8607 [0,0,0,0,0,1|1,0,0]=2
7  B13R2.435  C1=CC=C2C(=C1)NC(=N2)C(=O)O 8604 [0,0,0,0,0,1|2,0,0]=3
8  B13R2.435  c1ccc2c(c1)cc([nH]2)C(=O)N I2642 [0,0,0,0,0,1|2,0,0]=3
9  B14R2.966  COC(=O)C1=CC2=C(C=C1)C=CN2 5462 [0,1,0,0,0,1|2,0,0]=4
10  B14R2.450  CC1=C(OC2=CC=CC=C12)C(=O)O 8903 [0,1,0,0,0,1|2,0,0]=4
11  B14R2.4529  C1=CC2=C(C=C1Cl)N=C(N2)C(=O)O C6892 [0,1,0,0,0,1|2,0,0]=4
12  B14R2.4529  C1=CC2=C(C=C1F)C=C(N2)C(=O)O 5480 [0,1,0,0,0,1|1,0,0]=3
13  B14R2.839  CCOC(=O)c1cc2c([nH]1)ccs2 T1465 [0,2,0,0,0,0|2,0,0]=4
14  B12R1.125  C1=CC=C(C(=C1)\C=C\C(=O)O)Br 5999 [0,0,1,0,0,1|2,0,0]=4
15  B12R1.125  c1ccc(c(c1)\C=C\C(=O)O)F 5602 [0,0,1,0,0,1|2,0,0]=4
16  B12R1.226  C1=CC(=CC(=C1)F)\C=C\C(=O)O 6032 [0,0,1,0,0,1|2,0,0]=4
17  B12R2.32  C1=CC=C2C(=C1)C=C(N2)CO 8088 [1,0,0,0,0,1|1,0,1]=4
18  B12R2.32  c1ccc2c(c1)cc([nH]2)C=O I2648 [1,0,0,0,0,1|1,0,0]=3
19  B12R2.32  c1ccc2c(c1)cc([nH]2)CO I2706 [1,0,0,0,0,1|1,0,1]=4
20  B12R2.44  C1=CC2=C(C=CN2)C=C1C=O 10077 [1,0,0,0,0,1|2,0,0]=4
21  B12R2.44  C1=CC2=C(C=CN2)C=C1C=O 9500 [1,0,0,0,0,1|2,0,0]=4
22  B12R2.44  c1cc(cc2c1cc[nH]2)C=O F0277 [1,0,0,0,0,1|2,0,0]=4
23  B14R2.781  C1=CC=C2C(=C1)N=CC(=N2)C(=O)O 8667 [0,0,0,0,0,2|1,0,1]=4
24  B14R2.781  C1=CC=C2C=C(C=CC2=C1)C(=O)O 10245 [0,0,0,0,0,2|2,0,0]=4