smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCc1nc2c(n1Cc1ccc(-c3ccccc3-c3nnn[n-]3)cc1)C(=O)CCCC2	ZINC000003786304	562937895	/nfs/dbraw/zinc/93/78/95/562937895.db2.gz	KCTFTBCZZUBAKN-UHFFFAOYSA-N	-1	3	426.524	4.640	20	0	in-man	IJADHM
CCCc1nc2c(n1Cc1ccc(-c3ccccc3-c3nn[n-]n3)cc1)C(=O)CCCC2	ZINC000003786304	562937897	/nfs/dbraw/zinc/93/78/97/562937897.db2.gz	KCTFTBCZZUBAKN-UHFFFAOYSA-N	-1	3	426.524	4.640	20	0	in-man	IJADHM
CCOc1c(Br)cc(CNCc2ccc(C(=O)[O-])cc2)cc1Br	ZINC000010475232	556335893	/nfs/dbraw/zinc/33/58/93/556335893.db2.gz	IXDHXHLYBNJKEN-UHFFFAOYSA-N	-1	3	443.135	4.598	20	0		IJADHM
FC(F)(c1cc(Cl)nc(=S)[n-]1)N1CCC(F)(F)[C@]2(CCN(c3ccccc3)C2)C1	ZINC001164820787	720395027	/nfs/dbraw/zinc/39/50/27/720395027.db2.gz	CKFJXDBBRGIOEN-KRWDZBQOSA-N	-1	3	446.901	4.706	20	0		IJADHM
FC(F)(c1cc(Cl)nc(=S)[n-]1)N1CCC(F)(F)[C@@]2(CCN(c3ccccc3)C2)C1	ZINC001164820788	720395160	/nfs/dbraw/zinc/39/51/60/720395160.db2.gz	CKFJXDBBRGIOEN-QGZVFWFLSA-N	-1	3	446.901	4.706	20	0		IJADHM