smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CC2(C[C@@H]1C(=O)NCc1ccc(C[NH+]3CCCC3)cc1)CC[NH2+]CC2	ZINC000072477651	522300929	/nfs/dbraw/zinc/30/09/29/522300929.db2.gz	DWYWOSHKBSCHFD-HXUWFJFHSA-N	2	3	370.541	1.973	50	0		FDAAHP
CN(C)CCN1CC2(CCC1=O)CC[NH+](Cc1cccc(CC[NH3+])c1)CC2	ZINC000091818089	524791459	/nfs/dbraw/zinc/79/14/59/524791459.db2.gz	WJZKWWKKVOZNNM-UHFFFAOYSA-N	2	3	372.557	1.954	50	0		FDAAHP
C[NH2+]CCNC(=O)c1cccc(OC2CCN(C3CC[NH+](C)CC3)CC2)c1	ZINC000095519464	525097298	/nfs/dbraw/zinc/09/72/98/525097298.db2.gz	HPRWVSQVPWBERM-UHFFFAOYSA-N	2	3	374.529	1.573	50	0		FDAAHP
CN1CC2(C[C@@H]1C(=O)NC1CC[NH+](Cc3ccccc3)CC1)CC[NH2+]CC2	ZINC000072409802	522243403	/nfs/dbraw/zinc/24/34/03/522243403.db2.gz	CQRLEJWKIYGLOU-HXUWFJFHSA-N	2	3	370.541	1.841	50	0		FDAAHP
CN1CC2(C[C@H]1C(=O)NC1CC[NH+](Cc3ccccc3)CC1)CC[NH2+]CC2	ZINC000072409803	522241995	/nfs/dbraw/zinc/24/19/95/522241995.db2.gz	CQRLEJWKIYGLOU-FQEVSTJZSA-N	2	3	370.541	1.841	50	0		FDAAHP
CN1CC2(C[C@H]1C(=O)NCc1ccc(C[NH+]3CCCC3)cc1)CC[NH2+]CC2	ZINC000072477652	522300486	/nfs/dbraw/zinc/30/04/86/522300486.db2.gz	DWYWOSHKBSCHFD-FQEVSTJZSA-N	2	3	370.541	1.973	50	0		FDAAHP
CN(C)CCN1CC2(CCC1=O)CC[NH+](Cc1ccc(CC[NH3+])cc1)CC2	ZINC000091738567	524771690	/nfs/dbraw/zinc/77/16/90/524771690.db2.gz	HHWXOHBBPZYDGZ-UHFFFAOYSA-N	2	3	372.557	1.954	50	0		FDAAHP