smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)c1ccc(N2C(=O)C[C@H]([NH2+]CCC[NH+]3CCN(c4ccc(OC)cc4)CC3)C2=O)cc1	ZINC000101684115	569802882	/nfs/dbraw/zinc/80/28/82/569802882.db2.gz	LWCWDUXJHLIDEX-DEOSSOPVSA-N	2	2	494.592	2.306	50	10		JECALP
CN1CCc2cc(C[NH2+]C3CCN(c4ccc(C(=O)NCC[NH+]5CCOCC5)cc4)CC3)ccc21	ZINC000012208575	555942701	/nfs/dbraw/zinc/94/27/01/555942701.db2.gz	FTFBYLYKMXCYIP-UHFFFAOYSA-N	2	2	477.653	2.500	50	10		JECALP
COc1ccc(N2CC[NH+](Cc3cccn3-c3nnc(N4CC[NH+](C)CC4)s3)CC2)cc1	ZINC000015728190	555968007	/nfs/dbraw/zinc/96/80/07/555968007.db2.gz	FTNKNBYHPSGXRN-UHFFFAOYSA-N	2	2	453.616	2.411	50	10		JECALP
CCOC(=O)c1ccc(N2C(=O)C[C@@H]([NH2+]CCC[NH+]3CCN(c4ccc(OC)cc4)CC3)C2=O)cc1	ZINC000018220117	556312896	/nfs/dbraw/zinc/31/28/96/556312896.db2.gz	LWCWDUXJHLIDEX-XMMPIXPASA-N	2	2	494.592	2.306	50	10		JECALP