smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)C[C@H](CC(=O)N[O-])C(=O)N[C@@H](Cc1cccc2ccccc21)C(=O)N[C@@H](C)C(=O)NCC[NH3+]	ZINC000038337298	569801349	/nfs/dbraw/zinc/80/13/49/569801349.db2.gz	YIQGURXEEICMRF-WEYGHZABSA-N	0	3	499.612	1.005	10	30		JDEEHN
CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC[C@H](NC[C@@H]([NH3+])CS)C(C)C)C(=O)[O-]	ZINC000144683735	569867745	/nfs/dbraw/zinc/86/77/45/569867745.db2.gz	QISLMXIYRQCLIR-FYQPLNBISA-N	0	3	470.705	1.381	10	30		JDEEHN
CNCc1ccc(CSCCNC(=NS(C)(=O)=O)NC[C@@H](O)c2ccc(O)cc2)o1	ZINC000011616140	522118189	/nfs/dbraw/zinc/11/81/89/522118189.db2.gz	GZPOYVTZKHVRHE-GOSISDBHSA-N	0	3	456.590	1.166	10	30	investigational	JDEEHN
CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC[C@@H](NC[C@H]([NH3+])CS)C(C)C)C(=O)[O-]	ZINC000019362761	556345304	/nfs/dbraw/zinc/34/53/04/556345304.db2.gz	QISLMXIYRQCLIR-LWYYNNOASA-N	0	3	470.705	1.381	10	30		JDEEHN
CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC[C@H](NC[C@H]([NH3+])CS)C(C)C)C(=O)[O-]	ZINC000019362759	556345383	/nfs/dbraw/zinc/34/53/83/556345383.db2.gz	QISLMXIYRQCLIR-MUGJNUQGSA-N	0	3	470.705	1.381	10	30		JDEEHN