smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC[N@H+](C)Cc1ncccc1[O-]	164193184	757006856	/nfs/dbraw/zinc/00/68/56/757006856.db2.gz	GTRIKVRGSOKKKJ-UHFFFAOYSA-N	0	1	194.278	2.019	1	0		AEAFMN
CCCC[N@@H+](C)Cc1ncccc1[O-]	164193184	757006867	/nfs/dbraw/zinc/00/68/67/757006867.db2.gz	GTRIKVRGSOKKKJ-UHFFFAOYSA-N	0	1	194.278	2.019	1	0		AEAFMN
C[C@H]1C(=O)C(O)c2ccccc2N1O	6480659	132181226	/nfs/dbraw/zinc/18/12/26/132181226.db2.gz	IGXAUNSZMVQABP-LURJTMIESA-N	0	1	193.202	2.069	1	0		AEAFMN
C[C@@H]1C(=O)C(O)c2ccccc2N1O	5890404	132181324	/nfs/dbraw/zinc/18/13/24/132181324.db2.gz	IGXAUNSZMVQABP-ZCFIWIBFSA-N	0	1	193.202	2.069	1	0		AEAFMN
C=C=CCN1CCc2ccccc2C1	25988571	166152917	/nfs/dbraw/zinc/15/29/17/166152917.db2.gz	RVALEHIOZKRMKW-UHFFFAOYSA-N	0	1	185.270	2.386	1	0		AEAFMN
CC(=O)c1coc2c(O)cc(O)cc12	95592516	166331809	/nfs/dbraw/zinc/33/18/09/166331809.db2.gz	QCWZHYPAEJVXCJ-UHFFFAOYSA-N	0	1	192.170	2.047	1	0		AEAFMN
CCCc1cc([C@H]2CCCN2C)on1	8088	167102339	/nfs/dbraw/zinc/10/23/39/167102339.db2.gz	UBZWBZVKCYZDPE-SNVBAGLBSA-N	0	1	194.278	2.394	1	0		AEAFMN
CCc1c(O)oc2nnc(C)c-2c1C	100641546	167720715	/nfs/dbraw/zinc/72/07/15/167720715.db2.gz	DLCPLJZZQRKYBF-UHFFFAOYSA-N	0	1	192.218	2.059	1	0		AEAFMN
CN1c2ccccc2CN2CCC[C@@H]21	95574221	524036101	/nfs/dbraw/zinc/03/61/01/524036101.db2.gz	DWBAFMVPHMOVBS-GFCCVEGCSA-N	0	1	188.274	2.058	1	0		AEAFMN
CN1c2ccccc2CN2CCC[C@H]21	195456068	524036122	/nfs/dbraw/zinc/03/61/22/524036122.db2.gz	DWBAFMVPHMOVBS-LBPRGKRZSA-N	0	1	188.274	2.058	1	0		AEAFMN