smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H]1CCC[N@H+](Cc2ccc(C(=O)NCCC3CC[NH+](C)CC3)cc2)C1	ZINC000217017351	496993259	/nfs/dbraw/zinc/99/32/59/496993259.db2.gz	PTUAQCQMQRPOCA-GOSISDBHSA-N	2	0	357.542	3.380	40	70		FGIBRP
C[C@H]1CCC[N@H+](Cc2ccc(C(=O)NCCC3CC[NH+](C)CC3)cc2)C1	ZINC000217017390	496993053	/nfs/dbraw/zinc/99/30/53/496993053.db2.gz	PTUAQCQMQRPOCA-SFHVURJKSA-N	2	0	357.542	3.380	40	70		FGIBRP
Cc1cccc(C[NH+]2CCC(C(=O)NCCC3CC[NH+](C)CC3)CC2)c1	ZINC000217029653	524387015	/nfs/dbraw/zinc/38/70/15/524387015.db2.gz	VIKVNFBBUVCLRE-UHFFFAOYSA-N	2	0	357.542	3.055	40	70		FGIBRP
CC1CC[NH+](Cc2ccc(C(=O)NCCC3CC[NH+](C)CC3)cc2)CC1	ZINC000217017292	206360231	/nfs/dbraw/zinc/36/02/31/206360231.db2.gz	YZHCZFDIPRPZQV-UHFFFAOYSA-N	2	0	357.542	3.380	40	70		FGIBRP
Cc1ccc(C[NH+]2CCC(C(=O)NCCC3CC[NH+](C)CC3)CC2)cc1	ZINC000217029710	524435522	/nfs/dbraw/zinc/43/55/22/524435522.db2.gz	ZUOZMYADVDQMKK-UHFFFAOYSA-N	2	0	357.542	3.055	40	70		FGIBRP
Cc1ccccc1C[NH+]1CCC(C(=O)NCCC2CC[NH+](C)CC2)CC1	ZINC000217029593	525134603	/nfs/dbraw/zinc/13/46/03/525134603.db2.gz	XXETWHHIMNXENJ-UHFFFAOYSA-N	2	0	357.542	3.055	40	70		FGIBRP