smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+]=C(C)Nc1cccc(C[NH3+])c1	13780463	166069970	/nfs/dbraw/zinc/06/99/70/166069970.db2.gz	NTATXNKJNSAJKV-UHFFFAOYSA-N	2	0	177.251	1.605	1	30		ADEFRP
[NH3+]CCC[NH2+]CCCCCS	96282269	169183292	/nfs/dbraw/zinc/18/32/92/169183292.db2.gz	UEAAWEWNMXIYCA-UHFFFAOYSA-N	2	0	176.329	1.025	1	30	in-vitro	ADEFRP