smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(CCN=NC(N)=[NH2+])N=NC(N)=[NH2+]	17354311	166055981	/nfs/dbraw/zinc/05/59/81/166055981.db2.gz	BCXUVOYFVARGFV-XPWJWFAVSA-N	2	0	198.234	-1.296	1	30		AAEFRP
CC(CCN=NC(N)=[NH2+])N=NC(N)=[NH2+]	103218903	166055997	/nfs/dbraw/zinc/05/59/97/166055997.db2.gz	BCXUVOYFVARGFV-LPPGRIHKSA-N	2	0	198.234	-1.296	1	30		AAEFRP
CC(CCN=NC(N)=[NH2+])N=NC(N)=[NH2+]	17354312	166056031	/nfs/dbraw/zinc/05/60/31/166056031.db2.gz	BCXUVOYFVARGFV-HMMKTVFPSA-N	2	0	198.234	-1.715	1	30		AAEFRP
[NH2+]=C(NCC[NH3+])NCCS	95586623	169142069	/nfs/dbraw/zinc/14/20/69/169142069.db2.gz	ASLYUHCEVFDONP-UHFFFAOYSA-N	2	0	162.262	-1.011	1	30		AAEFRP