0  B17R2.3445  c1ccc(c(c1)c2ccccc2[S@@](=O)O)O OBP [1,0,1,0,0,0|1,0,0]=3
1  B17R3.54615  c1ccc2c(c1)-c3ccccc3NC2=O LDR [2,0,0,0,0,0|1,0,0]=3
2  B17R3.54615  c1ccc2c(c1)-c3cccnc3NC2=O XU1 [2,0,0,0,0,0|2,0,0]=4
3  B17R3.54615  c1ccc2c(c1)cc(c3c2cccc3)N 9AP [2,0,0,0,0,0|2,0,0]=4
4  B19R3.87160  c1ccc2c(c1)C(=O)Nc3cc(ccc3N2)Cl HK6 [1,0,0,0,0,1|2,0,0]=4