0  B13R1.45  CN(C)\C=C\C(=O)c1cccnc1 CUR-0097517 [0,0,0,0,0,0|3,0,1]=4
1  B13R1.45  c1ccc(cc1)C(=O)CCC(=O)O CUR-0103031 [0,0,0,0,0,0|3,0,1]=4
2  B13R1.45  c1ccc(cc1)C(=O)NCC(=O)O CUR-0024691 [0,0,0,0,0,0|3,0,1]=4
3  B12R1.30  CCCCC(=O)c1ccccc1 CUR-0102662 [1,0,0,0,0,0|1,0,0]=2
4  B14R1.160  CC(C)COC(=O)c1ccccc1O CUR-0103345 [0,1,0,0,0,0|0,0,0]=1
5  B12R1.107  CC(=O)CC(=O)c1ccccc1 CUR-0102653 [0,0,0,0,1,0|1,0,1]=3
6  B12R1.107  CC(=O)CC(=O)c1cccnc1 CUR-0016991 [0,0,0,0,1,0|2,0,1]=4
7  B12R1.107  C[C@@H](c1ccccc1)NC(C)C CUR-0045830 [0,0,0,0,1,0|2,0,1]=4
8  B12R1.107  C[C@H](c1ccccc1)NC(C)C CUR-0045829 [0,0,0,0,1,0|2,0,1]=4
9  B11R1.16  CCCC(=O)c1ccccc1 CUR-0102314 [2,0,0,0,0,0|0,0,0]=2
10  B11R1.16  CCOC(=O)c1ccccc1 CUR-0008450 [2,0,0,0,0,0|0,0,0]=2
11  B11R1.16  CCOC(=O)c1cccnc1 CUR-0102393 [2,0,0,0,0,0|1,0,0]=3
12  B11R1.16  CCOC(=O)c1ccncc1 CUR-0102401 [2,0,0,0,0,0|1,0,0]=3
13  B11R1.16  c1ccc(cc1)C(=O)CC#N CUR-0029245 [2,0,0,0,0,0|1,0,1]=4
14  B11R1.28  CCCCNc1ccccc1 CUR-0102338 [2,0,0,0,0,0|2,0,0]=4
15  B11R1.28  c1ccc(cc1)COCCN CUR-0029134 [2,0,0,0,0,0|1,0,1]=4
16  B11R1.28  c1ccc(cc1)COCCO CUR-0102437 [2,0,0,0,0,0|1,0,1]=4
17  B13R1.24  CCCCOC(=O)c1ccccc1 CUR-0005235 [1,1,0,0,0,0|0,0,0]=2
18  B13R1.674  CCCOC(=O)c1ccccc1Cl CUR-0017351 [1,1,0,0,0,0|0,0,0]=2
19  B13R1.674  c1ccc(c(c1)C(=O)NCCO)O CUR-0101398 [1,1,0,0,0,0|2,0,0]=4
20  B13R2.5252  c1ccc2c(c1)CCCCC2=O CUR-0003077 [1,0,0,1,0,0|1,0,0]=3
21  B13R2.5252  c1ccc2c(c1)CCCNC2=O CUR-0100570 [1,0,0,1,0,0|1,0,0]=3
22  B13R2.2382  c1ccc(cc1)COCC2CO2 CUR-0023349 [1,0,0,1,0,0|1,0,1]=4
23  B13R2.328  c1ccc2c(c1)CC(=O)OC2=O CUR-0102648 [0,0,0,1,1,0|1,0,1]=4
24  B13R2.12159  CC1(CC(=O)c2c1cccc2)C CUR-0003522 [0,0,0,1,1,0|0,0,0]=2
25  B15R2.1660  CC(C)CSc1[nH]c2ccccc2n1 CUR-0095760 [0,0,0,1,0,1|1,1,0]=4
26  B15R2.24965  CC(C)N1c2ccccc2C(=O)C1=O CUR-0095905 [0,1,0,1,0,0|2,0,0]=4
27  B15R2.18934  CC1(COC(=N1)c2ccc(cc2)Br)C CUR-0099427 [0,1,0,1,0,0|1,0,0]=3
28  B11R1.91  CC(C)NCc1ccccc1 CUR-0102340 [1,0,0,0,1,0|1,0,1]=4
29  B11R1.91  CC(CCc1ccccc1)Br CUR-0007729 [1,0,0,0,1,0|1,0,1]=4
30  B11R1.91  CC(CCc1ccccc1)N CUR-0102337 [1,0,0,0,1,0|1,0,1]=4
31  B11R1.36  CC(C)C(=O)c1ccncc1 CUR-0013855 [0,0,0,0,2,0|1,0,0]=3
32  B13R1.44  CCCCC(=O)Oc1ccccc1 CUR-0142301 [1,0,0,0,0,1|1,0,0]=3