smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=c1cc(Cc2c3ccccc3[nH+]c3ccccc32)c2ccc([N+](=O)[O-])cc2o1	ZINC000064528209	222071902	/nfs/dbraw/zinc/07/19/02/222071902.db2.gz	MSNWDAWRRSWRHO-UHFFFAOYSA-N	1	2	382.375	4.993	1	5		GJBFLO
COC(=O)[C@@H](c1ccc(OC)c(OC)c1)c1c2ccccc2[nH+]c2ccccc21	ZINC000026820001	207318969	/nfs/dbraw/zinc/31/89/69/207318969.db2.gz	WBBHMOSIDJLELA-QFIPXVFZSA-N	1	2	387.435	4.710	1	5		GJBFLO
COC(=O)[C@H](c1ccc(OC)c(OC)c1)c1c2ccccc2[nH+]c2ccccc21	ZINC000026820006	207319637	/nfs/dbraw/zinc/31/96/37/207319637.db2.gz	WBBHMOSIDJLELA-JOCHJYFZSA-N	1	2	387.435	4.710	1	5		GJBFLO
COC(=O)[C@@H](Cc1ccc2c(c1)OCO2)c1c2ccccc2[nH+]c2ccccc21	ZINC000026753048	207320057	/nfs/dbraw/zinc/32/00/57/207320057.db2.gz	KXSQTEDQWJHEDB-SFHVURJKSA-N	1	2	385.419	4.616	1	5		GJBFLO
O=[N+]([O-])c1ccc(N2CCN(c3[nH+]c4ccccc4c4ccccc43)CC2)cc1	ZINC000103264634	136191064	/nfs/dbraw/zinc/19/10/64/136191064.db2.gz	FIKTZRUOWOLPDY-UHFFFAOYSA-N	1	2	384.439	4.623	1	5		GJBFLO