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+]1c2cc(N)ccc2c2ccc(NCCC[NH3+])cc2c1-c1ccccc1	ZINC000001559822	204011816	/nfs/dbraw/zinc/01/18/16/204011816.db2.gz	YSJRYPBKLMTXLA-UHFFFAOYSA-O	2	0	371.508	4.310	40	5		FIBBRP
NC(=[NH2+])SCc1c2ccccc2c(CSC(N)=[NH2+])c2ccccc21	ZINC000017314588	570749171	/nfs/dbraw/zinc/74/91/71/570749171.db2.gz	ULXNUSWDNFKRMZ-UHFFFAOYSA-N	2	0	354.504	4.246	40	5		FIBBRP
NC(=[NH2+])SCc1cccc2ccc3cccc(CSC(N)=[NH2+])c3c21	ZINC000005742938	570634718	/nfs/dbraw/zinc/63/47/18/570634718.db2.gz	HKXWHBACFMOSTQ-UHFFFAOYSA-N	2	0	354.504	4.246	40	5		FIBBRP
CC(C)(C)C1CCC2(CC1)CC[N+](C)(CCC[N+]1(C)CCOCC1)CC2	ZINC000001581169	570502081	/nfs/dbraw/zinc/50/20/81/570502081.db2.gz	ALRCFTJHOCGIIO-UHFFFAOYSA-N	2	0	366.634	4.316	40	5		FIBBRP
CC[N+](CC)(CC)CCSCCSCC[N+](CC)(CC)CC	ZINC000005469456	570627863	/nfs/dbraw/zinc/62/78/63/570627863.db2.gz	LZFRMWMHOAWNSB-UHFFFAOYSA-N	2	0	350.682	4.206	40	5		FIBBRP