0  B12R2.18  CC1C(=O)NC2=CC=CC=C21 M12096 [1,0,0,0,0,0|2,0,0]=3
1  B12R2.18  O=C1NC2=CC=CC=C2C1=O M19257 [1,0,0,0,0,0|1,0,1]=3
2  B12R2.606  O=C1Cc2cc(O)ccc2N1 M28142 [1,0,0,0,0,0|2,0,0]=3
3  B12R2.606  O=C1NC2=C(C=CC(Cl)=C2)O1 M16810 [1,0,0,0,0,0|1,1,0]=3
4  B12R2.606  O=C1NC2=C(C=CC(Cl)=C2)S1 M13202 [1,0,0,0,0,0|1,1,0]=3
5  B12R2.606  O=C1OC2=C(C=CC(O)=C2)S1 M14670 [1,0,0,0,0,0|3,0,0]=4
6  B12R1.49  CCC(=O)NC1=CC=C(O)C=C1 M23761 [0,0,1,0,0,0|3,0,0]=4
7  B12R1.225  O=C(O)C(O)c1cccc(O)c1 M20931 [0,0,1,0,0,0|3,0,0]=4
8  B14R2.8235  Cc1ccc2oc(=O)cc(O)c2c1 M22646 [0,0,0,0,0,1|3,0,0]=4
9  B14R2.8239  CN1Cc2cc(Br)ccc2NC1=O M22252 [0,0,0,0,0,1|1,1,0]=3
10  B11R1.20  CC(=O)NC1=CC=C(O)C=C1 M10198 [1,0,1,0,0,0|2,0,0]=4
11  B11R1.20  N=C(N)Nc1ccc(Cl)cc1 M27453 [1,0,1,0,0,0|1,1,0]=4
12  B11R1.20  NC(=O)NC1=CC=C(Cl)C=C1 M22869 [1,0,1,0,0,0|0,1,0]=3
13  B11R1.20  O=C(O)Cc1ccc(O)cc1 M18084 [1,0,1,0,0,0|2,0,0]=4
14  B11R1.40  C=CC(=O)Nc1ccccc1 M23998 [1,0,1,0,0,0|2,0,0]=4
15  B11R1.36  O=C(O)C(O)C1=CC=CC=C1 M18892 [1,0,1,0,0,0|2,0,0]=4
16  B11R1.36  O=C(O)C(O)c1ccccc1 M19671 [1,0,1,0,0,0|2,0,0]=4
17  B11R1.157  CC(=O)NC1=CC=CC(O)=C1 M15352 [1,0,1,0,0,0|2,0,0]=4
18  B11R1.167  NC1=C(C(=O)O)C=C(Cl)C=C1 M15403 [1,0,1,0,0,0|1,1,0]=4
19  B11R2.1  ClC1=CNC2=C1C=CC=C2 M29561 [2,0,0,0,0,0|2,0,0]=4
20  B11R2.10  O=C1Cc2ccccc2N1 M22658 [2,0,0,0,0,0|1,0,0]=3
21  B11R2.10  O=C1NC2=CC=CC=C2N1 M15321 [2,0,0,0,0,0|0,0,0]=2
22  B11R2.10  S=C1NC2=CC=CC=C2S1 M23643 [2,0,0,0,0,0|1,1,0]=4
23  B13R2.5190  O=C1Nc2cc(O)ccc2C1=O M29518 [1,1,0,0,0,0|1,0,1]=4
24  B13R2.2121  COC1=CC2=C(C=C1)NC(=O)O2 M18751 [1,1,0,0,0,0|2,0,0]=4
25  B15R2.22335  Cn1c(=O)n(C)c2cc(C=O)ccc21 M18794 [0,2,0,0,0,0|2,0,0]=4
26  B11R1.22  NNC(=O)c1ccc(N)cc1 M27839 [0,0,1,0,1,0|2,0,0]=4
27  B13R2.328  O=C1NC(=O)c2ccccc2N1 M21342 [1,0,0,0,0,1|1,0,1]=4
28  B13R2.328  O=c1cc(O)c2ccccc2o1 M22660 [1,0,0,0,0,1|2,0,0]=4
29  B13R2.369  CN1Cc2ccccc2NC1=O M28377 [1,0,0,0,0,1|1,0,0]=3
30  B13R2.369  O=C1Oc2ccccc2C=C1O M21324 [1,0,0,0,0,1|2,0,0]=4