smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CNCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)C[NH2+]C)cc1C2=O	ZINC000005765882	204149785	/nfs/dbraw/zinc/14/97/85/204149785.db2.gz	QOYOBSQVKHEJLZ-UHFFFAOYSA-N	1	3	380.404	0.778	40	10		GCCBHO
[NH3+]CCc1ccc(O)c(CN2C[C@H](O)[C@@H](n3c4ccccc4c(=O)[nH]c3=O)C2)c1	ZINC000257290911	212017741	/nfs/dbraw/zinc/01/77/41/212017741.db2.gz	QEUGAYHCRNDICP-HKUYNNGSSA-N	1	3	396.447	0.727	40	10		GCCBHO
CN(C)c1ccc(CN[C@@H]2[C@H]3CO[C@H](O3)[C@H](N(C)CC[NH+](C)C)[C@H]2O)cc1	ZINC000020463949	560092684	/nfs/dbraw/zinc/09/26/84/560092684.db2.gz	CTEOJWCPLNWAMV-LTFPLMDUSA-N	1	3	378.517	0.189	40	10	biogenic,in-vitro	GCCBHO