smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCCCC[C@@H]1NC(=[NH2+])NC(=[NH2+])N1c1cccc(Br)c1	ZINC000001680768	534983837	/nfs/dbraw/zinc/98/38/37/534983837.db2.gz	FPOQVODWSVXDGO-GOSISDBHSA-N	2	1	422.415	5.146	40	30		HKEBMP
CCN(CC)c1ccc(/C=[NH+]\N2CC[NH+](C3c4ccccc4-c4ccccc43)CC2)cc1	ZINC000012467619	569401611	/nfs/dbraw/zinc/40/16/11/569401611.db2.gz	QMUHYNPZSXIMDG-ANYBSYGZSA-N	2	1	424.592	5.254	40	30		HKEBMP
CCCCCCCC[NH+](CCC[N@H+](CCCCCCCC)CCOC)CCOC	ZINC000100923876	559141756	/nfs/dbraw/zinc/14/17/56/559141756.db2.gz	QCZPZUOWUSBASI-UHFFFAOYSA-N	2	1	414.719	5.994	40	30		HKEBMP