smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC[C@H](C)[NH2+][C@@H]1CCC[C@@H](C)C1	ZINC000217998313	490069380	/nfs/dbraw/zinc/06/93/80/490069380.db2.gz	HBHCPKYQOSFWSG-FRRDWIJNSA-N	1	0	197.366	3.733	20	70		AHIDRO
CCCC[C@H](C)[NH2+][C@H]1CCC[C@@H](C)C1	ZINC000217998476	490069496	/nfs/dbraw/zinc/06/94/96/490069496.db2.gz	HBHCPKYQOSFWSG-AGIUHOORSA-N	1	0	197.366	3.733	20	70		AHIDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)C(C)C	ZINC000217998664	344408845	/nfs/dbraw/zinc/40/88/45/344408845.db2.gz	FQKMOTMRHGNJFW-UPJWGTAASA-N	1	0	197.366	3.589	20	70		AHIDRO
CC[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)C(C)C	ZINC000217998837	344408843	/nfs/dbraw/zinc/40/88/43/344408843.db2.gz	FQKMOTMRHGNJFW-AGIUHOORSA-N	1	0	197.366	3.589	20	70		AHIDRO
CC(C)(C)C[NH2+]CCCC1CCCC1	ZINC000218085119	344409851	/nfs/dbraw/zinc/40/98/51/344409851.db2.gz	XPBWGLNAEKDLRH-UHFFFAOYSA-N	1	0	197.366	3.593	20	70		AHIDRO
C[C@@H]1CC[C@H](C)[N@H+](CCC(C)(C)C)C1	ZINC000218469484	344412925	/nfs/dbraw/zinc/41/29/25/344412925.db2.gz	BCDNMOJAZRGHBP-NEPJUHHUSA-N	1	0	197.366	3.543	20	70		AHIDRO