smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCCCCCC[NH3+]	ZINC000001545439	170997472	/nfs/dbraw/zinc/99/74/72/170997472.db2.gz	ABVVEAHYODGCLZ-UHFFFAOYSA-N	1	0	199.382	4.256	50	30		AIEARO
CCCCCCCCCCC[NH+](C)C	ZINC000001584580	351288569	/nfs/dbraw/zinc/28/85/69/351288569.db2.gz	MMWFTWUMBYZIRZ-UHFFFAOYSA-N	1	0	199.382	4.079	50	30		AIEARO
CCCCCCCCCCCC[NH2+]C	ZINC000001649055	342954484	/nfs/dbraw/zinc/95/44/84/342954484.db2.gz	OMEMQVZNTDHENJ-UHFFFAOYSA-N	1	0	199.382	4.127	50	30		AIEARO
CCCCCCCCCCC[C@@H](C)[NH3+]	ZINC000001687258	171000311	/nfs/dbraw/zinc/00/03/11/171000311.db2.gz	WCLHZVGJULAEJH-CYBMUJFWSA-N	1	0	199.382	4.255	50	30		AIEARO
CCCCCCCC[NH2+]CCCCC	ZINC000002598119	171008757	/nfs/dbraw/zinc/00/87/57/171008757.db2.gz	MKZYBVBFFWCQGK-UHFFFAOYSA-N	1	0	199.382	4.127	50	30		AIEARO
CCCCCCCCCCC[C@H](C)[NH3+]	ZINC000095719379	171137348	/nfs/dbraw/zinc/13/73/48/171137348.db2.gz	WCLHZVGJULAEJH-ZDUSSCGKSA-N	1	0	199.382	4.255	50	30		AIEARO
CCCCCCCCC[C@H](C)[NH+](C)C	ZINC000101172744	171163160	/nfs/dbraw/zinc/16/31/60/171163160.db2.gz	SPTXBOLKYQANKS-ZDUSSCGKSA-N	1	0	199.382	4.077	50	30		AIEARO
CCCCCCCCC[C@@H](C)[NH+](C)C	ZINC000101172748	171163146	/nfs/dbraw/zinc/16/31/46/171163146.db2.gz	SPTXBOLKYQANKS-CYBMUJFWSA-N	1	0	199.382	4.077	50	30		AIEARO