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@@](O)(C[N-]C(=O)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000034035805	568416649	/nfs/dbraw/zinc/41/66/49/568416649.db2.gz	YCNCRLKXSLARFT-LLVKDONJSA-N	-1	0	403.235	1.982	10	5	in-man	HDBERM
C[C@](O)(C[N-]C(=O)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000034035806	568416631	/nfs/dbraw/zinc/41/66/31/568416631.db2.gz	YCNCRLKXSLARFT-NSHDSACASA-N	-1	0	403.235	1.982	10	5	in-man	HDBERM
[NH3+][C@@H](CC(=O)c1cccc2oc3cc(=O)c4[nH]c(C(=O)[O-])cc(=O)c4c-3nc21)C(=O)[O-]	ZINC000008576231	291199479	/nfs/dbraw/zinc/19/94/79/291199479.db2.gz	QLAHWTNCEYYDRR-QMMMGPOBSA-N	-1	0	423.337	1.230	10	5	biogenic,in-vitro	HDBERM