smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC#CCn1c(N2CCC[C@@H]([NH3+])C2)cc(=O)n(Cc2[nH]c3ccccc3[nH+]2)c1=O	ZINC000096284195	206222366	/nfs/dbraw/zinc/22/23/66/206222366.db2.gz	YVFRUBWAYRHIRX-OAHLLOKOSA-N	2	2	392.463	0.885	1	30		GCEFLP
Cc1ncn(-c2ccc(C[N@@H+]3C[C@H]([NH3+])[C@H](C(=O)N4CCC[C@H]4C#N)C3)cc2)n1	ZINC000028955098	207351336	/nfs/dbraw/zinc/35/13/36/207351336.db2.gz	GKLKDWYNLKARAH-OTWHNJEPSA-N	2	2	379.468	0.849	1	30		GCEFLP
Cc1ncn(-c2ccc(C[N@H+]3C[C@H]([NH3+])[C@H](C(=O)N4CCC[C@H]4C#N)C3)cc2)n1	ZINC000028955098	207351341	/nfs/dbraw/zinc/35/13/41/207351341.db2.gz	GKLKDWYNLKARAH-OTWHNJEPSA-N	2	2	379.468	0.849	1	30		GCEFLP