smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+]1CCCN(CCC#N)CC[N@@H+](C)CCCN(CCC(N)=O)CC1	ZINC000068606252	488368292	/nfs/dbraw/zinc/36/82/92/488368292.db2.gz	UCCDESQWDMSOKU-UHFFFAOYSA-N	2	1	352.527	0.037	40	30		FCEBMP
C[NH+]1CCCN(CCC(N)=O)CC[N@H+](C)CCCN(CCC#N)CC1	ZINC000068606252	488368293	/nfs/dbraw/zinc/36/82/93/488368293.db2.gz	UCCDESQWDMSOKU-UHFFFAOYSA-N	2	1	352.527	0.037	40	30		FCEBMP
C[NH+]1CCCN(CCC(N)=O)CC[N@@H+](C)CCCN(CCC#N)CC1	ZINC000068606252	488368294	/nfs/dbraw/zinc/36/82/94/488368294.db2.gz	UCCDESQWDMSOKU-UHFFFAOYSA-N	2	1	352.527	0.037	40	30		FCEBMP
C[N+](C)(C)CCCC[N+](C)(C)CCC[N+](C)(C)CCCNC(=O)/C=N/[O-]	ZINC000097965947	222217698	/nfs/dbraw/zinc/21/76/98/222217698.db2.gz	ZIISBMMYZVSPAT-UHFFFAOYSA-P	2	1	374.594	0.982	40	30		FCEBMP