smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)CC(=O)C(=N[N-]c2ccc([N+](=O)[O-])cc2Cl)C(=O)C1	ZINC000005705792	425626114	/nfs/dbraw/zinc/62/61/14/425626114.db2.gz	CMOHHPBIQYYNJO-UHFFFAOYSA-N	-1	1	323.736	2.974	30	30		DFECMM
COC(=O)c1ccc(/C=C2\Oc3c(ccc([O-])c3O)C2=O)cc1	ZINC000072238403	191081709	/nfs/dbraw/zinc/08/17/09/191081709.db2.gz	TZQCWIJMMJLLME-JYRVWZFOSA-N	-1	1	312.277	2.501	30	30		DFECMM
Cc1ccc(S(=O)(=O)[N-]C(=S)NC2[C@@H]3CCCC[C@H]23)cc1	ZINC000020368269	425792448	/nfs/dbraw/zinc/79/24/48/425792448.db2.gz	UINKGPDULZZLAK-PBWFPOADSA-N	-1	1	324.471	2.748	30	30		DFECMM
Cc1ccc(S(=O)(=O)N=C([S-])NC2[C@@H]3CCCC[C@H]23)cc1	ZINC000020368269	425792453	/nfs/dbraw/zinc/79/24/53/425792453.db2.gz	UINKGPDULZZLAK-PBWFPOADSA-N	-1	1	324.471	2.748	30	30		DFECMM