smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CC[C@]1(O)C[C@H](CI)[N+]2(C1)CC[N+]1(C[C@](O)(CC=C)C[C@@H]1CI)CC2	ZINC000100501292	717143580	/nfs/dbraw/zinc/14/35/80/717143580.db2.gz	PDTPGEOBPZEFOB-CLELJHENSA-N	2	0	588.312	2.663	50	50		KFGARP
C=CC[C@@]1(O)C[C@H](CI)[N+]2(C1)CC[N+]1(C[C@](O)(CC=C)C[C@@H]1CI)CC2	ZINC000100501294	717143612	/nfs/dbraw/zinc/14/36/12/717143612.db2.gz	PDTPGEOBPZEFOB-HYPPHEFQSA-N	2	0	588.312	2.663	50	50		KFGARP
C=CC[C@]1(O)C[C@H](CI)[N+]2(C1)CC[N+]1(C[C@](O)(CC=C)C[C@H]1CI)CC2	ZINC000100501297	717143630	/nfs/dbraw/zinc/14/36/30/717143630.db2.gz	PDTPGEOBPZEFOB-CIGGEUDFSA-N	2	0	588.312	2.663	50	50		KFGARP
C=CC[C@@]1(O)C[C@@H](CI)[N+]2(C1)CC[N+]1(C[C@](O)(CC=C)C[C@@H]1CI)CC2	ZINC000100501299	717143602	/nfs/dbraw/zinc/14/36/02/717143602.db2.gz	PDTPGEOBPZEFOB-ZKIJNFIPSA-N	2	0	588.312	2.663	50	50		KFGARP