smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1c(SCC[NH+]2CCCCC2)nnc1C1CC[NH+](Cc2ccccc2O)CC1	ZINC000014978049	558689971	/nfs/dbraw/zinc/68/99/71/558689971.db2.gz	WATZRQGODSKLFW-UHFFFAOYSA-N	2	0	415.607	3.478	50	10		HGCARP
Cc1cccc(C[NH+]2CCC(C(=O)NCc3ccc(N4CC[NH+](C)CC4)cc3)CC2)c1	ZINC000067604033	558988191	/nfs/dbraw/zinc/98/81/91/558988191.db2.gz	LXWNATMBYMQKLX-UHFFFAOYSA-N	2	0	420.601	3.275	50	10		HGCARP
C[NH+]1CCN(c2ccc(CNC(=O)C3CC[NH+](Cc4ccc(F)cc4)CC3)cc2)CC1	ZINC000067621542	558989751	/nfs/dbraw/zinc/98/97/51/558989751.db2.gz	SCKCHRZHHURQQR-UHFFFAOYSA-N	2	0	424.564	3.106	50	10		HGCARP
CCOc1cccc(C[N@@H+]2CCC[C@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)c1O	ZINC000012022948	558309693	/nfs/dbraw/zinc/30/96/93/558309693.db2.gz	QZIITYVXEIOVQW-LJQANCHMSA-N	2	0	417.594	3.336	50	10		HGCARP
C[NH+]1CCN(c2ccc(CNC(=O)C3CC[NH+](Cc4ccccc4F)CC3)cc2)CC1	ZINC000067604564	558988579	/nfs/dbraw/zinc/98/85/79/558988579.db2.gz	GNQUGDAKVUOXAL-UHFFFAOYSA-N	2	0	424.564	3.106	50	10		HGCARP
Cc1ccc(C[NH+]2CCC(C(=O)NCc3ccc(N4CC[NH+](C)CC4)cc3)CC2)cc1	ZINC000067622596	558989902	/nfs/dbraw/zinc/98/99/02/558989902.db2.gz	AFVABUCOQRFMHY-UHFFFAOYSA-N	2	0	420.601	3.275	50	10		HGCARP
CCOc1cccc(C[N@@H+]2CCC[C@@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)c1O	ZINC000012022945	558309676	/nfs/dbraw/zinc/30/96/76/558309676.db2.gz	QZIITYVXEIOVQW-IBGZPJMESA-N	2	0	417.594	3.336	50	10		HGCARP
Cc1ccccc1C[NH+]1CCC(C(=O)NCc2ccc(N3CC[NH+](C)CC3)cc2)CC1	ZINC000067614146	558989272	/nfs/dbraw/zinc/98/92/72/558989272.db2.gz	VSMBVUHGNYUKOW-UHFFFAOYSA-N	2	0	420.601	3.275	50	10		HGCARP
CCN(CC)c1ccc(C[NH+]2CCC(C(=O)NCC(C)(C)C[NH+](C)C)CC2)cc1	ZINC000012630395	558441625	/nfs/dbraw/zinc/44/16/25/558441625.db2.gz	DSXOTSRBWJLYMB-UHFFFAOYSA-N	2	0	402.627	3.449	50	10		HGCARP
C[NH+]1CCN(c2ccc(CNC(=O)c3ccc(C[NH+]4CCCCC4)cc3)cc2)CC1	ZINC000067629493	558990232	/nfs/dbraw/zinc/99/02/32/558990232.db2.gz	LZUXSANJQBNTHT-UHFFFAOYSA-N	2	0	406.574	3.354	50	10		HGCARP