smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)c1cnc(N2CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)N3CC3CC3)C2)c(S(=O)(=O)F)c1	ZINC001164750311	720860261	/nfs/dbraw/zinc/86/02/61/720860261.db2.gz	PJYBAEQVAFOVFM-OKZBNKHCSA-N	0	3	478.550	1.497	20	70		JDIDHN
COC(=O)c1cnc(N2CC[C@@H]3[C@H](C[C@H](Cn4cncn4)N3CC3CC3)C2)c(S(=O)(=O)F)c1	ZINC001164750309	720860555	/nfs/dbraw/zinc/86/05/55/720860555.db2.gz	PJYBAEQVAFOVFM-KZNAEPCWSA-N	0	3	478.550	1.497	20	70		JDIDHN
COC(=O)c1cnc(N2CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)N3CC3CC3)C2)c(S(=O)(=O)F)c1	ZINC001164750313	720861269	/nfs/dbraw/zinc/86/12/69/720861269.db2.gz	PJYBAEQVAFOVFM-RCCFBDPRSA-N	0	3	478.550	1.497	20	70		JDIDHN
COC(=O)c1cnc(N2CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)N3CC3CC3)C2)c(S(=O)(=O)F)c1	ZINC001164750299	720860645	/nfs/dbraw/zinc/86/06/45/720860645.db2.gz	PJYBAEQVAFOVFM-FGTMMUONSA-N	0	3	478.550	1.497	20	70		JDIDHN