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](C(=O)NC1CCN(C)CC1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O	ZINC000220424648	571048904	/nfs/dbraw/zinc/04/89/04/571048904.db2.gz	JOSXQMUHFXTCCE-LBPRGKRZSA-N	0	3	384.458	0.960	40	5		GCBBHN
C[C@H](C(=O)NC1CCN(C)CC1)N(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O	ZINC000220424706	571049273	/nfs/dbraw/zinc/04/92/73/571049273.db2.gz	JOSXQMUHFXTCCE-GFCCVEGCSA-N	0	3	384.458	0.960	40	5		GCBBHN
C[C@H](N)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004899539	204088621	/nfs/dbraw/zinc/08/86/21/204088621.db2.gz	JJSQTVFRQZPPIV-MJVIPROJSA-N	0	3	377.401	0.376	40	5		GCBBHN
Cc1c(N(CC(=O)NC2CCN(C)CC2)S(C)(=O)=O)cccc1[N+](=O)[O-]	ZINC000220038154	570742762	/nfs/dbraw/zinc/74/27/62/570742762.db2.gz	BTHRFZOXRRURCP-UHFFFAOYSA-N	0	3	384.458	0.880	40	5		GCBBHN