smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCOc1ccc(C[N@H+]2C[C@@H](CN(C)C)[C@H](c3ccnc(N4CCCC4)n3)C2)cc1	ZINC000019583332	569018247	/nfs/dbraw/zinc/01/82/47/569018247.db2.gz	IKVGISAOZXZUEO-FYYLOGMGSA-N	1	3	421.589	3.419	40	30		HGEBHO
C=CCOc1ccc(C[N@@H+]2C[C@@H](CN(C)C)[C@H](c3ccnc(N4CCCC4)n3)C2)cc1	ZINC000019583332	569018248	/nfs/dbraw/zinc/01/82/48/569018248.db2.gz	IKVGISAOZXZUEO-FYYLOGMGSA-N	1	3	421.589	3.419	40	30		HGEBHO
CN(C)C[C@@H]1CCC2=C(C1=O)C(c1ccccc1)C1=C(CC[C@@H](C[NH+](C)C)C1=O)O2	ZINC000001588698	557274788	/nfs/dbraw/zinc/27/47/88/557274788.db2.gz	UHGWCFNLGNUBPD-ROUUACIJSA-N	1	3	408.542	3.390	40	30		HGEBHO
CN(C)C[C@H]1CCC2=C(C1=O)C(c1ccccc1)C1=C(CC[C@H](C[NH+](C)C)C1=O)O2	ZINC000001588699	557274747	/nfs/dbraw/zinc/27/47/47/557274747.db2.gz	UHGWCFNLGNUBPD-QZTJIDSGSA-N	1	3	408.542	3.390	40	30		HGEBHO