smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N+](C)(C)CCOc1ccc(N(CC[N+](C)(C)C)c2ccccc2)cc1	ZINC000005336337	207093885	/nfs/dbraw/zinc/09/38/85/207093885.db2.gz	HPDUQRDACUSTRM-UHFFFAOYSA-N	2	0	357.542	3.616	40	5		FHBBRP
C[NH+]1CCC2(CC[N@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)CC1	ZINC000096268560	222107688	/nfs/dbraw/zinc/10/76/88/222107688.db2.gz	PGFSKEXTNJTVQP-UHFFFAOYSA-N	2	0	357.376	3.531	40	5		FHBBRP
C[N+](C)(C)CCOc1ccccc1N(CC[N+](C)(C)C)c1ccccc1	ZINC000005336341	263340179	/nfs/dbraw/zinc/34/01/79/263340179.db2.gz	MJBWERXXYNCGBE-UHFFFAOYSA-N	2	0	357.542	3.616	40	5		FHBBRP
C[N+]1(CC[N+]2(C)CCC[C@@H]2c2cccnc2)CCC[C@@H]1c1cccnc1	ZINC000003953809	560191706	/nfs/dbraw/zinc/19/17/06/560191706.db2.gz	MJRIWDXWCJJQJG-URFUVCHWSA-N	2	0	352.526	3.740	40	5	in-vitro	FHBBRP
CC[N+](CC)(CCO)CCCCCCCCCC[N+](CC)(CC)CCO	ZINC000005106221	570621220	/nfs/dbraw/zinc/62/12/20/570621220.db2.gz	VHMPLLSMBNURQM-UHFFFAOYSA-N	2	0	374.654	3.805	40	5		FHBBRP
C[N+]1(CC[N+]2(C)CCC[C@H]2c2cccnc2)CCC[C@@H]1c1cccnc1	ZINC000001666688	560183552	/nfs/dbraw/zinc/18/35/52/560183552.db2.gz	MJRIWDXWCJJQJG-PJYWLYPCSA-N	2	0	352.526	3.740	40	5	in-vitro	FHBBRP