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[C@@]1(C)CC(=O)[C@]2(O)[C@](C)(O1)[C@@H](OC(C)=O)[C@@H](OC(=O)CCN(C)C)[C@H]1C(C)(C)CC[C@H](O)[C@@]12C	ZINC000008036043	552983976	/nfs/dbraw/zinc/98/39/76/552983976.db2.gz	RSOZZQTUMVBTMR-RBRFWQPISA-N	0	3	509.640	2.023	10	30		KEEEHN
CC(=NNC(=N)N)c1cc(NC(=O)CCCCCCCCC(=O)Nc2cc(C(C)=NNC(=N)N)cc(C(C)=NNC(=N)N)c2)cc(C(C)=NNC(=N)N)c1	ZINC000072266997	553646829	/nfs/dbraw/zinc/64/68/29/553646829.db2.gz	PWDYHMBTPGXCSN-VCBMUGGBSA-N	0	3	744.914	2.213	10	30	investigational	KEEEHN
CC[C@H]1OC(=O)[C@H](C)[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)C(=O)/C(C)=C/[C@]1(C)O	ZINC000077291187	553659115	/nfs/dbraw/zinc/65/91/15/553659115.db2.gz	GVPDZXPAAWSLFA-GLBOTDGWSA-N	0	3	571.752	2.464	10	30	in-vitro	KEEEHN
CC(=NNC(=N)N)c1cc(NC(=O)CCCCCCCCC(=O)Nc2cc(C(C)=NNC(=N)N)cc(C(C)=NNC(=N)N)c2)cc(C(C)=NNC(=N)N)c1	ZINC000301054928	572143092	/nfs/dbraw/zinc/14/30/92/572143092.db2.gz	PWDYHMBTPGXCSN-UHFFFAOYSA-N	0	3	744.914	2.213	10	30		KEEEHN