smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccccc1CN1CCN(C[C@H]2[C@@H]3C[NH2+]C[C@H]23)CC1	ZINC000217760520	407508592	/nfs/dbraw/zinc/50/85/92/407508592.db2.gz	KBHKKHXFSQJPHR-FVQHAEBGSA-N	1	3	301.434	1.278	50	70		DDIAHO
CN1CCCN(CCC[NH2+]C2CCC3(CC2)OCCO3)CC1	ZINC000161026993	354241788	/nfs/dbraw/zinc/24/17/88/354241788.db2.gz	QRHVADOYPDUBRS-UHFFFAOYSA-N	1	3	311.470	1.289	50	70		DDIAHO
CCCCN1CCN(c2cc(C3CC([NH3+])C3)nc(N)n2)CC1	ZINC000218400923	407520119	/nfs/dbraw/zinc/52/01/19/407520119.db2.gz	CKASWFZUQJRWAW-UHFFFAOYSA-N	1	3	304.442	1.186	50	70		DDIAHO
CN1CCCN(c2cc(C3CC([NH3+])C3)nc(C3CC3)n2)CC1	ZINC000218576575	257274177	/nfs/dbraw/zinc/27/41/77/257274177.db2.gz	RQSGLVAGDFDLEU-UHFFFAOYSA-N	1	3	301.438	1.701	50	70		DDIAHO
CCOc1ccccc1N1CCN(C[C@H]2[C@@H]3C[NH2+]C[C@H]23)CC1	ZINC000217801408	201525788	/nfs/dbraw/zinc/52/57/88/201525788.db2.gz	LFKANRXZOGDCFJ-ZSHCYNCHSA-N	1	3	301.434	1.673	50	70		DDIAHO