smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1nccc1C1CC[NH+]([C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1	ZINC000160523387	209111061	/nfs/dbraw/zinc/11/10/61/209111061.db2.gz	UVKVSXDDJREKGC-JOCHJYFZSA-N	1	1	392.478	4.119	50	70		GIIAMO
O[C@H]1[C@@H]2CC[C@H]1C[N@H+](Cc1cccc(OCc3c(F)cccc3Cl)c1)C2	ZINC000217393224	570315473	/nfs/dbraw/zinc/31/54/73/570315473.db2.gz	UOQNMPAUUQRKCI-JIPZTSHUSA-N	1	1	375.871	4.261	50	70		GIIAMO
O=C(Nc1ccc(F)cc1)[C@@H](c1ccccc1)[NH+]1CCC(c2cc[nH]n2)CC1	ZINC000160541928	212057038	/nfs/dbraw/zinc/05/70/38/212057038.db2.gz	AFXHIFNKNVXKAL-OAQYLSRUSA-N	1	1	378.451	4.108	50	70		GIIAMO
CCN(C)c1cc(N2CCC[C@@H](C(=O)c3ccc(C(F)(F)F)cc3)C2)nc[nH+]1	ZINC000216884570	136203126	/nfs/dbraw/zinc/20/31/26/136203126.db2.gz	SQDZAPAEMMEWGC-OAHLLOKOSA-N	1	1	392.425	4.051	50	70		GIIAMO
Cc1ccccc1-c1nn(-c2ccc(F)cc2F)cc1CN1CC[N@@H+](C)[C@@H](C)C1	ZINC000216665292	570304008	/nfs/dbraw/zinc/30/40/08/570304008.db2.gz	TYNZZWLFJTXWGR-KRWDZBQOSA-N	1	1	396.485	4.262	50	70		GIIAMO
Cn1nccc1C1CC[NH+]([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1	ZINC000160523249	570325383	/nfs/dbraw/zinc/32/53/83/570325383.db2.gz	UVKVSXDDJREKGC-QFIPXVFZSA-N	1	1	392.478	4.119	50	70		GIIAMO
O=C(Nc1ccc(F)cc1)[C@H](c1ccccc1)[NH+]1CCC(c2cc[nH]n2)CC1	ZINC000160541778	570325533	/nfs/dbraw/zinc/32/55/33/570325533.db2.gz	AFXHIFNKNVXKAL-NRFANRHFSA-N	1	1	378.451	4.108	50	70		GIIAMO
O=C([C@H]1CC=CCC1)N1CCC([N@H+]2CCC[C@H]2COCc2ccccc2)CC1	ZINC000217597706	212112671	/nfs/dbraw/zinc/11/26/71/212112671.db2.gz	WFIFGIMAIHZLPQ-GMAHTHKFSA-N	1	1	382.548	4.015	50	70		GIIAMO