smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(NS(=O)(=O)c2ccc(N[C@H](c3c(C)n(C)n(-c4ccccc4)c3=O)S(=O)(=O)[O-])cc2)nn1	ZINC000004194719	561694104	/nfs/dbraw/zinc/69/41/04/561694104.db2.gz	BGLHAKAJGYLSOX-QFIPXVFZSA-N	-1	2	560.614	2.082	10	0	in-man	KEAELM
COc1ccc(NS(=O)(=O)c2ccc(N[C@@H](c3c(C)n(C)n(-c4ccccc4)c3=O)S(=O)(=O)[O-])cc2)nn1	ZINC000005502399	561696087	/nfs/dbraw/zinc/69/60/87/561696087.db2.gz	BGLHAKAJGYLSOX-JOCHJYFZSA-N	-1	2	560.614	2.082	10	0	in-man	KEAELM
CCOc1cc(NC(=O)C(O)(CC(=O)[O-])CC(=O)[O-])c(Cl)cc1C(=O)NC[C@@H]1C[N@@H+](Cc2ccc(F)cc2)CCO1	ZINC000072132269	553643427	/nfs/dbraw/zinc/64/34/27/553643427.db2.gz	CHDDVZKTRICFBM-GOSISDBHSA-N	-1	2	596.008	2.128	10	0	in-vitro	KEAELM
CCOc1cc(NC(=O)C(O)(CC(=O)[O-])CC(=O)[O-])c(Cl)cc1C(=O)NC[C@@H]1C[N@H+](Cc2ccc(F)cc2)CCO1	ZINC000072132269	553643424	/nfs/dbraw/zinc/64/34/24/553643424.db2.gz	CHDDVZKTRICFBM-GOSISDBHSA-N	-1	2	596.008	2.128	10	0	in-vitro	KEAELM
CCOc1cc(NC(=O)C(O)(CC(=O)[O-])CC(=O)[O-])c(Cl)cc1C(=O)NC[C@H]1C[N@@H+](Cc2ccc(F)cc2)CCO1	ZINC000072132270	553643366	/nfs/dbraw/zinc/64/33/66/553643366.db2.gz	CHDDVZKTRICFBM-SFHVURJKSA-N	-1	2	596.008	2.128	10	0	in-vitro	KEAELM
CCOc1cc(NC(=O)C(O)(CC(=O)[O-])CC(=O)[O-])c(Cl)cc1C(=O)NC[C@H]1C[N@H+](Cc2ccc(F)cc2)CCO1	ZINC000072132270	553643362	/nfs/dbraw/zinc/64/33/62/553643362.db2.gz	CHDDVZKTRICFBM-SFHVURJKSA-N	-1	2	596.008	2.128	10	0	in-vitro	KEAELM