smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1C(=O)[C@H]2[C@H](N=C(N3CCC[NH2+]CC3)N2Cc2ccccc2)N(C)C1=O	ZINC000036350336	205009663	/nfs/dbraw/zinc/00/96/63/205009663.db2.gz	BLGUSSSWRVVDJB-HZPDHXFCSA-N	1	3	370.457	0.372	1	0		FCAFHO
CN1C(=O)[C@@H]2[C@@H](N=C(N3CCC[NH2+]CC3)N2Cc2ccccc2)N(C)C1=O	ZINC000036350335	205010712	/nfs/dbraw/zinc/01/07/12/205010712.db2.gz	BLGUSSSWRVVDJB-HOTGVXAUSA-N	1	3	370.457	0.372	1	0		FCAFHO
COCCNc1nc(OCCCCNC(N)=[NH2+])cc(OCCN(C)C)n1	ZINC000040955144	205086230	/nfs/dbraw/zinc/08/62/30/205086230.db2.gz	VBONRUWMYMVZOW-UHFFFAOYSA-N	1	3	369.470	0.117	1	0		FCAFHO
CCCNC(=O)NCCCNCCC[NH2+]CCCNC(=O)NCCC	ZINC000049035043	205168851	/nfs/dbraw/zinc/16/88/51/205168851.db2.gz	HYAGSTMBQSKMSF-UHFFFAOYSA-N	1	3	358.531	0.754	1	0		FCAFHO
CN1C(=O)[C@H]2[C@@H](N=C(N3CCC[NH2+]CC3)N2Cc2ccccc2)N(C)C1=O	ZINC000036350337	205011126	/nfs/dbraw/zinc/01/11/26/205011126.db2.gz	BLGUSSSWRVVDJB-CVEARBPZSA-N	1	3	370.457	0.372	1	0		FCAFHO
NCCC[NH2+]CCCC[NH2+]CCCNC(=O)c1ccc(C(=O)[O-])cc1	ZINC000013645789	211045953	/nfs/dbraw/zinc/04/59/53/211045953.db2.gz	ZLOBXIIYJHNOPI-UHFFFAOYSA-N	1	3	350.463	0.813	1	0		FCAFHO
CCNC(=S)NCCCNCCC[NH2+]CCCNC(=S)NCC	ZINC000049036181	221018043	/nfs/dbraw/zinc/01/80/43/221018043.db2.gz	DGSHTGAIXAFEJS-UHFFFAOYSA-N	1	3	362.613	0.304	1	0		FCAFHO
CC1(C)NC(=N)NC(=[NH2+])N1c1cccc(CNC(=O)N2CCOCC2)c1	ZINC000016956088	534961931	/nfs/dbraw/zinc/96/19/31/534961931.db2.gz	OUUBUQCYUIVBMR-UHFFFAOYSA-N	1	3	359.434	0.414	1	0		FCAFHO