smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#C[C@H]1CCCCN1C(=O)[C@@H](N)CCCC[NH3+]	ZINC000013529560	181067862	/nfs/dbraw/zinc/06/78/62/181067862.db2.gz	RVIRSPCRFRPYII-MNOVXSKESA-N	1	3	238.335	0.347	1	30		BCEFHO
N#C[C@H]1CCCCN1C(=O)[C@H](N)CCCC[NH3+]	ZINC000027557518	181067228	/nfs/dbraw/zinc/06/72/28/181067228.db2.gz	RVIRSPCRFRPYII-GHMZBOCLSA-N	1	3	238.335	0.347	1	30		BCEFHO
CC1(C)NC(=N)NC(=[NH2+])N1c1ccc(C#N)cc1	ZINC000017039538	534961511	/nfs/dbraw/zinc/96/15/11/534961511.db2.gz	PFKPHQZLTPKOTF-UHFFFAOYSA-N	1	3	242.286	0.744	1	30		BCEFHO
N#C[C@@H]1CCCCN1C(=O)[C@@H](N)CCCC[NH3+]	ZINC000013529563	181059050	/nfs/dbraw/zinc/05/90/50/181059050.db2.gz	RVIRSPCRFRPYII-QWRGUYRKSA-N	1	3	238.335	0.347	1	30		BCEFHO
N#C[C@@H]1CCCCN1C(=O)[C@H](N)CCCC[NH3+]	ZINC000027557520	181058279	/nfs/dbraw/zinc/05/82/79/181058279.db2.gz	RVIRSPCRFRPYII-WDEREUQCSA-N	1	3	238.335	0.347	1	30		BCEFHO