smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc([C@H](C)NC(=O)c2cccc([O-])c2)cn1	ZINC000218677103	382790653	/nfs/dbraw/zinc/79/06/53/382790653.db2.gz	KDQRXAMZPFGSGI-NSHDSACASA-N	-1	3	256.305	2.587	50	70		CFIAHM
CCS(=O)(=O)[N-]c1ccccc1-c1csc(C)n1	ZINC000218659550	348167447	/nfs/dbraw/zinc/16/74/47/348167447.db2.gz	PKHGRPCOKMDLGA-UHFFFAOYSA-N	-1	3	282.390	2.880	50	70		CFIAHM
CC(=O)c1ccc2c(c1[O-])[C@H](c1ccc(O)cc1)CC(=O)O2	ZINC000217864567	275506163	/nfs/dbraw/zinc/50/61/63/275506163.db2.gz	RRWFYNGCFIDRFC-ZDUSSCGKSA-N	-1	3	298.294	2.741	50	70		CFIAHM
CC(=O)c1ccc2c(c1[O-])[C@@H](c1ccc(O)cc1)CC(=O)O2	ZINC000217864658	277114412	/nfs/dbraw/zinc/11/44/12/277114412.db2.gz	RRWFYNGCFIDRFC-CYBMUJFWSA-N	-1	3	298.294	2.741	50	70		CFIAHM
CC(=O)c1ccc2c(c1[O-])[C@H](c1cccc(O)c1)CC(=O)O2	ZINC000217822274	275806531	/nfs/dbraw/zinc/80/65/31/275806531.db2.gz	KSQOWFTZUYWODM-ZDUSSCGKSA-N	-1	3	298.294	2.741	50	70		CFIAHM
Cc1cccc(C(=O)N[C@H](c2nccn2C)C(C)C)c1[O-]	ZINC000218465131	382790364	/nfs/dbraw/zinc/79/03/64/382790364.db2.gz	RHABGNALFAGAOC-ZDUSSCGKSA-N	-1	3	287.363	2.561	50	70		CFIAHM
CC(=O)c1ccc2c(c1[O-])[C@H](c1ccco1)CC(=O)O2	ZINC000217832653	393757780	/nfs/dbraw/zinc/75/77/80/393757780.db2.gz	STEHKNKTOFLZBV-JTQLQIEISA-N	-1	3	272.256	2.629	50	70		CFIAHM
Cc1ccc([C@@H](C)NC(=O)c2cccc([O-])c2)cn1	ZINC000218677025	382790708	/nfs/dbraw/zinc/79/07/08/382790708.db2.gz	KDQRXAMZPFGSGI-LLVKDONJSA-N	-1	3	256.305	2.587	50	70		CFIAHM
[O-]C(=NO[C@@H]1CCCCO1)Nc1c(F)cc(F)cc1F	ZINC000161314516	378839111	/nfs/dbraw/zinc/83/91/11/378839111.db2.gz	AZMJTSFTFDYDSQ-SNVBAGLBSA-N	-1	3	290.241	2.684	50	70		CFIAHM
Cc1cccc(C(=O)N[C@@H](c2nccn2C)C(C)C)c1[O-]	ZINC000218465064	382790304	/nfs/dbraw/zinc/79/03/04/382790304.db2.gz	RHABGNALFAGAOC-CYBMUJFWSA-N	-1	3	287.363	2.561	50	70		CFIAHM
CC(=O)c1ccc2c(c1[O-])[C@@H](c1cccc(O)c1)CC(=O)O2	ZINC000217822364	275506150	/nfs/dbraw/zinc/50/61/50/275506150.db2.gz	KSQOWFTZUYWODM-CYBMUJFWSA-N	-1	3	298.294	2.741	50	70		CFIAHM
[O-]C(=NO[C@H]1CCCCO1)Nc1c(F)cc(F)cc1F	ZINC000161314641	378838953	/nfs/dbraw/zinc/83/89/53/378838953.db2.gz	AZMJTSFTFDYDSQ-JTQLQIEISA-N	-1	3	290.241	2.684	50	70		CFIAHM
CC(=O)c1ccc2c(c1[O-])[C@@H](c1ccco1)CC(=O)O2	ZINC000217832719	275506123	/nfs/dbraw/zinc/50/61/23/275506123.db2.gz	STEHKNKTOFLZBV-SNVBAGLBSA-N	-1	3	272.256	2.629	50	70		CFIAHM