smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)c1[nH+]c2ccccc2n1CCNC(=O)C1(c2ccccc2)CCOCC1	ZINC000218154285	570326468	/nfs/dbraw/zinc/32/64/68/570326468.db2.gz	SRAFHOOPJCCRLK-UHFFFAOYSA-N	1	2	391.515	4.024	50	70		GIIALO
O=C(Nc1ccc(F)cc1)[C@@H](c1ccccc1)[NH+]1CCC(c2ccn[nH]2)CC1	ZINC000160541928	212057040	/nfs/dbraw/zinc/05/70/40/212057040.db2.gz	AFXHIFNKNVXKAL-OAQYLSRUSA-N	1	2	378.451	4.108	50	70		GIIALO
CCN(C)c1cc(N2CCC[C@@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)[nH+]cn1	ZINC000216884570	136203127	/nfs/dbraw/zinc/20/31/27/136203127.db2.gz	SQDZAPAEMMEWGC-OAHLLOKOSA-N	1	2	392.425	4.051	50	70		GIIALO
Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1C[N@@H+]1CCN(C)[C@@H](C)C1	ZINC000216665292	570304011	/nfs/dbraw/zinc/30/40/11/570304011.db2.gz	TYNZZWLFJTXWGR-KRWDZBQOSA-N	1	2	396.485	4.262	50	70		GIIALO
Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1C[N@H+]1CCN(C)[C@@H](C)C1	ZINC000216665292	570304014	/nfs/dbraw/zinc/30/40/14/570304014.db2.gz	TYNZZWLFJTXWGR-KRWDZBQOSA-N	1	2	396.485	4.262	50	70		GIIALO
CC(C)Cc1[nH]c2ccc(NC(=O)CC3(n4cccc4)CCOCC3)cc2[nH+]1	ZINC000218241621	570328623	/nfs/dbraw/zinc/32/86/23/570328623.db2.gz	KWNCHZAABBVJAP-UHFFFAOYSA-N	1	2	380.492	4.097	50	70		GIIALO
O=C(Nc1ccc(F)cc1)[C@H](c1ccccc1)[NH+]1CCC(c2ccn[nH]2)CC1	ZINC000160541778	570325536	/nfs/dbraw/zinc/32/55/36/570325536.db2.gz	AFXHIFNKNVXKAL-NRFANRHFSA-N	1	2	378.451	4.108	50	70		GIIALO