smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Oc1c(Cl)cc(Cl)cc1C1=NN[C@H](c2ccc(N3CCOCC3)cc2)C1	ZINC000049034655	132436098	/nfs/dbraw/zinc/43/60/98/132436098.db2.gz	UTCKLOSNBABJNU-KRWDZBQOSA-N	0	2	392.286	3.974	1	10		GHCFLN
O=C(c1ccc(O)c(Br)c1)c1cc(O)c(O)cc1Br	ZINC000053296953	222009957	/nfs/dbraw/zinc/00/99/57/222009957.db2.gz	BDELDANMBLDDNL-UHFFFAOYSA-N	0	2	388.011	3.559	1	10		GHCFLN
O=C1OC(=Cc2ccc(N3CCOCC3)c(F)c2)C(O)=C1c1ccc(F)cc1	ZINC000095593338	136182519	/nfs/dbraw/zinc/18/25/19/136182519.db2.gz	VUAWNQQUBHYACO-PDGQHHTCSA-N	0	2	385.366	3.668	1	10		GHCFLN
CC(C)(C)COC(=O)[C@H](Cc1ccccc1)NCc1cc([N+](=O)[O-])ccc1O	ZINC000001548797	209331916	/nfs/dbraw/zinc/33/19/16/209331916.db2.gz	LRQKSXNGAPULBF-SFHVURJKSA-N	0	2	386.448	3.591	1	10		GHCFLN
CC(C)CCOC(=O)[C@H](Cc1ccccc1)NCc1cc([N+](=O)[O-])ccc1O	ZINC000001548796	209332849	/nfs/dbraw/zinc/33/28/49/209332849.db2.gz	GDGMJVBCSDZLFZ-IBGZPJMESA-N	0	2	386.448	3.591	1	10		GHCFLN
COCc1c(Br)c(O)c(O)c(Br)c1Br	ZINC000014769541	212117186	/nfs/dbraw/zinc/11/71/86/212117186.db2.gz	DDCGTIAYZULVGZ-UHFFFAOYSA-N	0	2	390.853	3.532	1	10		GHCFLN
CC(C)CCC(=O)Oc1cc(O)cc2oc(-c3ccc(O)c(O)c3)cc(=O)c12	ZINC000064448898	222070395	/nfs/dbraw/zinc/07/03/95/222070395.db2.gz	FRIZMQICGPXSSF-UHFFFAOYSA-N	0	2	384.384	3.918	1	10		GHCFLN