smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1nccnc1C(=O)Nc1cnccc1N1CCC[C@@H](C[NH3+])C1	ZINC000103237661	219273943	/nfs/dbraw/zinc/27/39/43/219273943.db2.gz	DBFVYHGYASQAJI-NSHDSACASA-N	1	3	327.392	0.881	1	0		ECAFHO
Nc1nccnc1C(=O)Nc1cnccc1N1CCC[C@H](C[NH3+])C1	ZINC000103237659	219273368	/nfs/dbraw/zinc/27/33/68/219273368.db2.gz	DBFVYHGYASQAJI-LLVKDONJSA-N	1	3	327.392	0.881	1	0		ECAFHO
C[C@H]([NH3+])C(=O)N[C@H]1CC[C@H]2CC[C@@H](C(=O)NCc3ccccc3)N2C1	ZINC000040895243	213398722	/nfs/dbraw/zinc/39/87/22/213398722.db2.gz	KGICILLGXCZOKO-HJWJTTGWSA-N	1	3	344.459	0.762	1	0		ECAFHO
CC(C)OCCCNc1nc(OCC[NH3+])cc(OCCN(C)C)n1	ZINC000040395683	213298148	/nfs/dbraw/zinc/29/81/48/213298148.db2.gz	UXPVZGOUPMHMPM-UHFFFAOYSA-N	1	3	341.456	0.982	1	0		ECAFHO
COCCNc1nc(OCCCC[NH3+])cc(OCCN(C)C)n1	ZINC000040874801	213395798	/nfs/dbraw/zinc/39/57/98/213395798.db2.gz	JLLJNWFDSATMDQ-UHFFFAOYSA-N	1	3	327.429	0.593	1	0		ECAFHO