smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)CC1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000069440348	184514870	/nfs/dbraw/zinc/51/48/70/184514870.db2.gz	FBUPBHGZUIBKMG-UHFFFAOYSA-N	2	0	307.394	2.247	50	5		DEBARP
Cc1cc(NC[C@](C)(O)C[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000096008539	402046247	/nfs/dbraw/zinc/04/62/47/402046247.db2.gz	LFRUPRBJEKWIJT-INIZCTEOSA-N	2	0	318.377	2.176	50	5		DEBARP
C[NH+](C)CC1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000069325646	402218259	/nfs/dbraw/zinc/21/82/59/402218259.db2.gz	JMJKKVHUBOVYNW-UHFFFAOYSA-N	2	0	307.394	2.247	50	5		DEBARP
C[NH+](C)CCCN(CCC[NH+](C)C)Cc1ccccc1[N+](=O)[O-]	ZINC000002479792	401713955	/nfs/dbraw/zinc/71/39/55/401713955.db2.gz	NVXSNEWJHYFXOY-UHFFFAOYSA-N	2	0	322.453	2.300	50	5		DEBARP
C[NH+](C)CCCN(CCC[NH+](C)C)Cc1ccc([N+](=O)[O-])cc1	ZINC000002893832	401719337	/nfs/dbraw/zinc/71/93/37/401719337.db2.gz	WMBTUDNMSJYBIJ-UHFFFAOYSA-N	2	0	322.453	2.300	50	5		DEBARP
Cc1cc(NC[C@@](C)(O)C[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000096008540	402046116	/nfs/dbraw/zinc/04/61/16/402046116.db2.gz	LFRUPRBJEKWIJT-MRXNPFEDSA-N	2	0	318.377	2.176	50	5		DEBARP