smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[N+](CC)(CC)CCSCC[N+](CC)(CC)CC	ZINC000001851699	717090516	/nfs/dbraw/zinc/09/05/16/717090516.db2.gz	NUZICIKDHNIQMQ-UHFFFAOYSA-N	2	0	290.561	3.473	10	5		CGBERP
C[N+](C)(C)CCC[n+]1cccc(-c2cc3ccccc3[nH]2)c1	ZINC000003620882	169903753	/nfs/dbraw/zinc/90/37/53/169903753.db2.gz	VMYCPUONVPQORK-UHFFFAOYSA-N	2	0	295.430	3.219	10	5		CGBERP
CC[N+](CC)(CC)CCC[n+]1ccc2ccccc2c1	ZINC000001998278	169765980	/nfs/dbraw/zinc/76/59/80/169765980.db2.gz	UMEBHWOQWNMZNC-UHFFFAOYSA-N	2	0	272.436	3.394	10	5		CGBERP
C[N+](C)(C)CCC[N+]1(C)CCC(Cc2ccccc2)CC1	ZINC000003620909	717096281	/nfs/dbraw/zinc/09/62/81/717096281.db2.gz	DYSDWVXKBVDPIB-UHFFFAOYSA-N	2	0	290.495	3.182	10	5		CGBERP
C[N+]1(Cc2ccccc2)CC[N+](C)(Cc2ccccc2)CC1	ZINC000032106140	344929646	/nfs/dbraw/zinc/92/96/46/344929646.db2.gz	CCQOSWKDPVPGRV-UHFFFAOYSA-N	2	0	296.458	3.294	10	5		CGBERP
C[N+](C)(C)CCC[n+]1ccc(/C=C/c2ccccc2)cc1	ZINC000005764620	170138606	/nfs/dbraw/zinc/13/86/06/170138606.db2.gz	OEAYVBLRWAYXPE-ZHACJKMWSA-N	2	0	282.431	3.241	10	5		CGBERP