smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCc1cc2cc[nH+]c(N)c2o1	96283069	171140904	/nfs/dbraw/zinc/14/09/04/171140904.db2.gz	BBMJIIIUNYCEJB-UHFFFAOYSA-N	1	2	190.246	2.753	1	0		AFAFLO
C[C@@H]1S[C@@H](C)S[C@@H]2CCC[N@@H+]12	261497510	571862770	/nfs/dbraw/zinc/86/27/70/571862770.db2.gz	OJEOXDLLIADRBL-XLPZGREQSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@@H]1S[C@@H](C)S[C@@H]2CCC[N@H+]12	261497510	571862768	/nfs/dbraw/zinc/86/27/68/571862768.db2.gz	OJEOXDLLIADRBL-XLPZGREQSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
CCCC[N@@H+]1COc2ccccc2C1	53246673	572432972	/nfs/dbraw/zinc/43/29/72/572432972.db2.gz	MCGKDDMUEPJECG-UHFFFAOYSA-N	1	2	191.274	2.639	1	0		AFAFLO
CCCC[N@H+]1COc2ccccc2C1	53246673	572432976	/nfs/dbraw/zinc/43/29/76/572432976.db2.gz	MCGKDDMUEPJECG-UHFFFAOYSA-N	1	2	191.274	2.639	1	0		AFAFLO
C[C@@H]1S[C@H]2CCC[N@@H+]2[C@@H](C)S1	32167034	574414047	/nfs/dbraw/zinc/41/40/47/574414047.db2.gz	OJEOXDLLIADRBL-CSMHCCOUSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@@H]1S[C@H]2CCC[N@H+]2[C@@H](C)S1	32167034	574414048	/nfs/dbraw/zinc/41/40/48/574414048.db2.gz	OJEOXDLLIADRBL-CSMHCCOUSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@@H]1S[C@@H](C)S[C@H]2CCC[N@H+]12	32167028	574414050	/nfs/dbraw/zinc/41/40/50/574414050.db2.gz	OJEOXDLLIADRBL-RNJXMRFFSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@@H]1S[C@@H](C)S[C@H]2CCC[N@@H+]12	32167028	574414051	/nfs/dbraw/zinc/41/40/51/574414051.db2.gz	OJEOXDLLIADRBL-RNJXMRFFSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@H]1S[C@H]2CCC[N@@H+]2[C@@H](C)S1	32167032	574414064	/nfs/dbraw/zinc/41/40/64/574414064.db2.gz	OJEOXDLLIADRBL-PRJMDXOYSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@H]1S[C@H]2CCC[N@H+]2[C@@H](C)S1	32167032	574414065	/nfs/dbraw/zinc/41/40/65/574414065.db2.gz	OJEOXDLLIADRBL-PRJMDXOYSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@@H]1S[C@H](C)[N@H+]2CCC[C@H]2S1	100776435	574418664	/nfs/dbraw/zinc/41/86/64/574418664.db2.gz	OJEOXDLLIADRBL-BWZBUEFSSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@@H]1S[C@H](C)[N@@H+]2CCC[C@H]2S1	100776435	574418665	/nfs/dbraw/zinc/41/86/65/574418665.db2.gz	OJEOXDLLIADRBL-BWZBUEFSSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@H]1S[C@H](C)[N@H+]2CCC[C@H]2S1	100776433	574418667	/nfs/dbraw/zinc/41/86/67/574418667.db2.gz	OJEOXDLLIADRBL-GJMOJQLCSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO
C[C@H]1S[C@H](C)[N@@H+]2CCC[C@H]2S1	100776433	574418668	/nfs/dbraw/zinc/41/86/68/574418668.db2.gz	OJEOXDLLIADRBL-GJMOJQLCSA-N	1	2	189.349	2.580	1	0	endogenous,in-man	AFAFLO