smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H]1CN(C(=O)C[C@]2(C(=O)N3C[C@@H](C)[NH2+][C@@H](C)C3)CC[NH2+]C2)C[C@H](C)N1	ZINC000161160322	484281894	/nfs/dbraw/zinc/28/18/94/484281894.db2.gz	XARVAYOMEFDUGE-NTODXPRQSA-N	2	3	365.522	-0.226	20	70		FBIDHP
C[C@@H]1CN(C(=O)[C@@]2(CC(=O)N3C[C@@H](C)[NH2+][C@@H](C)C3)CC[NH2+]C2)C[C@H](C)N1	ZINC000161160322	484281890	/nfs/dbraw/zinc/28/18/90/484281890.db2.gz	XARVAYOMEFDUGE-NTODXPRQSA-N	2	3	365.522	-0.226	20	70		FBIDHP
C[C@@H]1CN(C(=O)C[C@]2(C(=O)N3C[C@@H](C)N[C@@H](C)C3)CC[NH2+]C2)C[C@H](C)N1	ZINC000161160322	484281886	/nfs/dbraw/zinc/28/18/86/484281886.db2.gz	XARVAYOMEFDUGE-NTODXPRQSA-N	2	3	365.522	-0.226	20	70		FBIDHP
C[C@@H]1CN(C(=O)C[C@]2(C(=O)N3C[C@@H](C)[NH2+][C@@H](C)C3)CC[NH2+]C2)C[C@@H](C)N1	ZINC000161160490	484282347	/nfs/dbraw/zinc/28/23/47/484282347.db2.gz	XARVAYOMEFDUGE-GMKVZWAMSA-N	2	3	365.522	-0.226	20	70		FBIDHP
C[C@@H]1CN(C(=O)[C@@]2(CC(=O)N3C[C@@H](C)[NH2+][C@H](C)C3)CC[NH2+]C2)C[C@H](C)N1	ZINC000161160490	484282342	/nfs/dbraw/zinc/28/23/42/484282342.db2.gz	XARVAYOMEFDUGE-GMKVZWAMSA-N	2	3	365.522	-0.226	20	70		FBIDHP
C[C@@H]1CN(C(=O)C[C@]2(C(=O)N3C[C@@H](C)N[C@@H](C)C3)CC[NH2+]C2)C[C@@H](C)N1	ZINC000161160490	484282338	/nfs/dbraw/zinc/28/23/38/484282338.db2.gz	XARVAYOMEFDUGE-GMKVZWAMSA-N	2	3	365.522	-0.226	20	70		FBIDHP