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=C1/C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CC[N@@H+](C)CC[C@@H](OC1=O)C2=O	ZINC000040394373	205063768	/nfs/dbraw/zinc/06/37/68/205063768.db2.gz	FKDPVQYTQVJUGD-HSVPYRLXSA-N	1	1	381.425	-0.018	1	30		GBEFMO
C/C=C1/C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CC[N@H+](C)CC[C@@H](OC1=O)C2=O	ZINC000040394373	205063766	/nfs/dbraw/zinc/06/37/66/205063766.db2.gz	FKDPVQYTQVJUGD-HSVPYRLXSA-N	1	1	381.425	-0.018	1	30		GBEFMO
C[C@@H]1C/C(=C\CO)C(=O)O[C@@H]2CC[N@@H+](C)CC=C(COC(=O)[C@]1(C)O)C2=O	ZINC000040892881	205073758	/nfs/dbraw/zinc/07/37/58/205073758.db2.gz	DJXQRYTVVBNRKB-DCHICZMSSA-N	1	1	381.425	-0.018	1	30		GBEFMO
C[C@@H]1C/C(=C\CO)C(=O)O[C@@H]2CC[N@H+](C)CC=C(COC(=O)[C@]1(C)O)C2=O	ZINC000040892881	205073753	/nfs/dbraw/zinc/07/37/53/205073753.db2.gz	DJXQRYTVVBNRKB-DCHICZMSSA-N	1	1	381.425	-0.018	1	30		GBEFMO