smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O[C@H]1CN(c2cnccn2)CC[N@@H+](C2CCC3(CC[NH2+]CC3)CC2)C1	ZINC000217076705	241235158	/nfs/dbraw/zinc/23/51/58/241235158.db2.gz	MWHLLSCQFNGRHM-QGZVFWFLSA-N	2	0	345.491	1.272	50	70		EDIARP
C[NH+](C)C[C@@H](O)c1cc2n(n1)CCC[N@H+](CCc1ccccc1)C2	ZINC000218048542	241293878	/nfs/dbraw/zinc/29/38/78/241293878.db2.gz	FALAMRXLFDEKFT-LJQANCHMSA-N	2	0	328.460	1.927	50	70		EDIARP
C[NH+](C)Cc1ccc(CNc2cc(C3CC([NH3+])C3)nc(N)n2)cc1	ZINC000218105152	536011763	/nfs/dbraw/zinc/01/17/63/536011763.db2.gz	SIYJSLNKPVEZHD-UHFFFAOYSA-N	2	0	326.448	1.937	50	70		EDIARP
O[C@@H]1CN(c2cc[nH+]cc2)CC[N@H+](Cc2ccc3c(c2)OCO3)C1	ZINC000217460148	241250314	/nfs/dbraw/zinc/25/03/14/241250314.db2.gz	FWTSDROFUYBGQU-INIZCTEOSA-N	2	0	327.384	1.493	50	70		EDIARP
C[NH+](C)C[C@H](O)c1cc2n(n1)CCC[N@H+](CCc1ccccc1)C2	ZINC000218048625	535957151	/nfs/dbraw/zinc/95/71/51/535957151.db2.gz	FALAMRXLFDEKFT-IBGZPJMESA-N	2	0	328.460	1.927	50	70		EDIARP
O[C@@H]1CN(C2CC[NH2+]CC2)CC[N@H+](Cc2cccc3ncccc23)C1	ZINC000217872976	241281730	/nfs/dbraw/zinc/28/17/30/241281730.db2.gz	OVTHREGCCXRXJB-SFHVURJKSA-N	2	0	340.471	1.465	50	70		EDIARP