smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+]CCN[C@@H]1CCc2cccc(O)c21	306350227	674072568	/nfs/dbraw/zinc/07/25/68/674072568.db2.gz	NVXDRBHAELXHPX-SECBINFHSA-N	1	3	192.262	0.928	20	10		ACCDHO
[NH3+]CCN[C@H]1CCc2cccc(O)c21	306350228	674072777	/nfs/dbraw/zinc/07/27/77/674072777.db2.gz	NVXDRBHAELXHPX-VIFPVBQESA-N	1	3	192.262	0.928	20	10		ACCDHO
C[C@@H](C[NH3+])CNCc1ccc(N)cc1	1356082858	1170554975	/nfs/dbraw/zinc/55/49/75/1170554975.db2.gz	FZHJLKMJJOZMKW-VIFPVBQESA-N	1	3	193.294	0.953	20	10		ACCDHO
C[C@H](C[NH3+])CNCc1ccc(N)cc1	1356082857	1170555728	/nfs/dbraw/zinc/55/57/28/1170555728.db2.gz	FZHJLKMJJOZMKW-SECBINFHSA-N	1	3	193.294	0.953	20	10		ACCDHO
[NH3+]C1CC(NCc2ccccc2O)C1	162941939	697668538	/nfs/dbraw/zinc/66/85/38/697668538.db2.gz	UGLLTXSSWXPYIO-UHFFFAOYSA-N	1	3	192.262	0.972	20	10		ACCDHO
[NH3+][C@H]1C[C@H](NCc2ccccc2O)C1	906508671	630753013	/nfs/dbraw/zinc/75/30/13/630753013.db2.gz	UGLLTXSSWXPYIO-MGCOHNPYSA-N	1	3	192.262	0.972	20	10		ACCDHO