smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)c1ccc(CN2Cc3[nH]c[nH+]c3C[C@H]2c2nc(-c3cnccn3)no2)cc1	ZINC000015675482	291220159	/nfs/dbraw/zinc/22/01/59/291220159.db2.gz	IGMSTNYIBQZWAV-IBGZPJMESA-N	1	2	402.462	2.615	10	10	biogenic	HFCELO
COc1cc(O)c([C@H](c2cc(OC)c(OC)c(OC)c2)[NH+]2CCOCC2)cc1OC	ZINC000036008918	569357937	/nfs/dbraw/zinc/35/79/37/569357937.db2.gz	GLKYHKSMUCCBFT-NRFANRHFSA-N	1	2	419.474	2.857	10	10		HFCELO
CCN(CC)c1nc(N2CCN(c3ccc(OC)cc3)CC2)nc(N(CC)CC)[nH+]1	ZINC000005928049	535689206	/nfs/dbraw/zinc/68/92/06/535689206.db2.gz	XGLYNYUVGQBPBI-UHFFFAOYSA-N	1	2	413.570	2.899	10	10		HFCELO
CCN(CC)c1nc(N(CC)CC)[nH+]c(N2CCN(c3ccc(OC)cc3)CC2)n1	ZINC000005928049	535689214	/nfs/dbraw/zinc/68/92/14/535689214.db2.gz	XGLYNYUVGQBPBI-UHFFFAOYSA-N	1	2	413.570	2.899	10	10		HFCELO
COc1cc(O)c([C@@H](c2cc(OC)c(OC)c(OC)c2)[NH+]2CCOCC2)cc1OC	ZINC000036008920	569357976	/nfs/dbraw/zinc/35/79/76/569357976.db2.gz	GLKYHKSMUCCBFT-OAQYLSRUSA-N	1	2	419.474	2.857	10	10		HFCELO