smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cccc(Nc2cc(N3CC[NH2+]CC3)nc(C)[nH+]2)c1	ZINC000217678569	394455203	/nfs/dbraw/zinc/45/52/03/394455203.db2.gz	SAUYSYFYVTXVSK-UHFFFAOYSA-N	2	1	283.379	2.247	40	70		CEIBMP
Cc1ccc(Nc2cc(NCC[NH3+])nc(C)[nH+]2)cc1	ZINC000217678138	394455266	/nfs/dbraw/zinc/45/52/66/394455266.db2.gz	HDBUPUQIKKJFLJ-UHFFFAOYSA-N	2	1	257.341	2.208	40	70		CEIBMP
Cc1nc(N2CC[NH2+]CC2)cc(Nc2ccc(F)cc2)[nH+]1	ZINC000217678452	394455416	/nfs/dbraw/zinc/45/54/16/394455416.db2.gz	ZRHAOZNOEGDVIJ-UHFFFAOYSA-N	2	1	287.342	2.077	40	70		CEIBMP
CC[C@H]1CCCC[N@H+]1CCCNC(=O)[C@@H]1CCC[NH+](C)C1	ZINC000216912577	529199992	/nfs/dbraw/zinc/19/99/92/529199992.db2.gz	HHRJHJBCZLZZHN-CVEARBPZSA-N	2	1	295.471	2.099	40	70		CEIBMP
CC[C@H]1CCCC[NH+]1CCCNC(=O)[C@@H]1CCC[N@H+](C)C1	ZINC000216912577	529199993	/nfs/dbraw/zinc/19/99/93/529199993.db2.gz	HHRJHJBCZLZZHN-CVEARBPZSA-N	2	1	295.471	2.099	40	70		CEIBMP
CC[C@H]1CCCC[NH+]1CCCNC(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000216912577	529199996	/nfs/dbraw/zinc/19/99/96/529199996.db2.gz	HHRJHJBCZLZZHN-CVEARBPZSA-N	2	1	295.471	2.099	40	70		CEIBMP
CC[C@@H]1CCCC[N@H+]1CCCNC(=O)[C@@H]1CCC[NH+](C)C1	ZINC000216912549	529271777	/nfs/dbraw/zinc/27/17/77/529271777.db2.gz	HHRJHJBCZLZZHN-HZPDHXFCSA-N	2	1	295.471	2.099	40	70		CEIBMP
CC[C@@H]1CCCC[NH+]1CCCNC(=O)[C@@H]1CCC[N@H+](C)C1	ZINC000216912549	529271778	/nfs/dbraw/zinc/27/17/78/529271778.db2.gz	HHRJHJBCZLZZHN-HZPDHXFCSA-N	2	1	295.471	2.099	40	70		CEIBMP
CC[C@@H]1CCCC[NH+]1CCCNC(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000216912549	529271780	/nfs/dbraw/zinc/27/17/80/529271780.db2.gz	HHRJHJBCZLZZHN-HZPDHXFCSA-N	2	1	295.471	2.099	40	70		CEIBMP