smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COCC[N@@H+](C)CC(=O)N1CCN(Cc2cn[nH]n2)C[C@@H](O)C1	ZINC000217067362	536774675	/nfs/dbraw/zinc/77/46/75/536774675.db2.gz	TZQFEOHHEQZHSP-CYBMUJFWSA-N	1	1	326.401	-1.612	50	70		EAIAMO
COCC[N@H+](C)CC(=O)N1CCN(Cc2cn[nH]n2)C[C@@H](O)C1	ZINC000217067362	536774666	/nfs/dbraw/zinc/77/46/66/536774666.db2.gz	TZQFEOHHEQZHSP-CYBMUJFWSA-N	1	1	326.401	-1.612	50	70		EAIAMO
Cn1c(=O)[nH]cc(CC[N@H+]2CCCn3nc([C@@H](O)CO)cc3C2)c1=O	ZINC000217191675	241242635	/nfs/dbraw/zinc/24/26/35/241242635.db2.gz	ADHKJUCATFFIIM-AWEZNQCLSA-N	1	1	349.391	-1.256	50	70		EAIAMO
Cn1c(=O)[nH]cc(CC[N@H+]2CCCn3nc([C@H](O)CO)cc3C2)c1=O	ZINC000217191682	241241812	/nfs/dbraw/zinc/24/18/12/241241812.db2.gz	ADHKJUCATFFIIM-CQSZACIVSA-N	1	1	349.391	-1.256	50	70		EAIAMO
COCCn1cncc1CN1CC[N@H+](C(CO)CO)C[C@@H](O)C1	ZINC000217588072	241260625	/nfs/dbraw/zinc/26/06/25/241260625.db2.gz	OIIATAJPZILRRF-HNNXBMFYSA-N	1	1	328.413	-1.639	50	70		EAIAMO