smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
c1ccc(C23CN4CC(C[NH+](C2)CC4)/C3=N\N=C2/C3CN4CC2(c2ccccc2)C[N@@H+](C3)CC4)cc1	ZINC000022942262	555992700	/nfs/dbraw/zinc/99/27/00/555992700.db2.gz	HHFFAAUUEOLJFH-WWQQVGJXSA-N	2	0	480.660	2.181	50	30		JEEARP
C=CCOc1ccccc1C[N@H+]1CCc2nnc([C@H](C)NC(=O)C3CC[NH+](C)CC3)n2CC1	ZINC000012218858	519070557	/nfs/dbraw/zinc/07/05/57/519070557.db2.gz	XBHZUSISTCISEE-IBGZPJMESA-N	2	0	452.603	2.420	50	30		JEEARP
C=CCOc1ccccc1C[N@H+]1CCc2nnc([C@@H](C)NC(=O)C3CC[NH+](C)CC3)n2CC1	ZINC000012218857	519070540	/nfs/dbraw/zinc/07/05/40/519070540.db2.gz	XBHZUSISTCISEE-LJQANCHMSA-N	2	0	452.603	2.420	50	30		JEEARP
c1ccc(C23CN4CC(C[NH+](C2)CC4)C3=NN=C2C3CN4CC2(c2ccccc2)C[N@@H+](C3)CC4)cc1	ZINC000252608149	570085706	/nfs/dbraw/zinc/08/57/06/570085706.db2.gz	HHFFAAUUEOLJFH-UHFFFAOYSA-N	2	0	480.660	2.181	50	30		JEEARP
OCC#CC[N+]1(CC#Cc2ccc(C#CC[N+]3(CC#CCO)CCCCC3)cc2)CCCCC1	ZINC000020806937	527518618	/nfs/dbraw/zinc/51/86/18/527518618.db2.gz	UOJPONFXPYMMBI-UHFFFAOYSA-N	2	0	458.646	2.382	50	30		JEEARP