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]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(-n2cc[nH+]c2)c1	ZINC000095968742	564143238	/nfs/dbraw/zinc/14/32/38/564143238.db2.gz	PPSYKEKEXFRLGF-LSDHHAIUSA-N	2	2	336.395	4.192	50	5		EIBALP
C[C@@H]([NH2+][C@@H](C)c1cccc(-n2cc[nH+]c2)c1)c1ccc([N+](=O)[O-])cc1	ZINC000095968741	564143282	/nfs/dbraw/zinc/14/32/82/564143282.db2.gz	PPSYKEKEXFRLGF-CABCVRRESA-N	2	2	336.395	4.192	50	5		EIBALP
C[C@H]([NH2+][C@@H](C)c1cccc(-n2cc[nH+]c2)c1)c1ccc([N+](=O)[O-])cc1	ZINC000095968740	564143243	/nfs/dbraw/zinc/14/32/43/564143243.db2.gz	PPSYKEKEXFRLGF-GJZGRUSLSA-N	2	2	336.395	4.192	50	5		EIBALP
C[C@@H]([NH2+][C@H](C)c1cccc(-n2cc[nH+]c2)c1)c1ccc([N+](=O)[O-])cc1	ZINC000095968743	564143227	/nfs/dbraw/zinc/14/32/27/564143227.db2.gz	PPSYKEKEXFRLGF-HUUCEWRRSA-N	2	2	336.395	4.192	50	5		EIBALP