smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(N)=[NH2+])C(=O)N[C@@H](CC(C)C)C(=O)[O-]	ZINC000026576880	561800708	/nfs/dbraw/zinc/80/07/08/561800708.db2.gz	ORFISQWLBSTJAE-KTHKBMNISA-N	0	1	660.817	-0.062	10	30		KBEEMN
C=CC[N@@H+]1CC[C@@]23c4c5c(O)ccc4C[C@@H]1[C@]2(O)CC[C@@H](O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O)[C@@H]3O5	ZINC000077311519	553662714	/nfs/dbraw/zinc/66/27/14/553662714.db2.gz	LGMMRFSFVJQBQH-BBRFUNNUSA-N	0	1	505.520	-0.990	10	30	in-vitro	KBEEMN
C=CC[N@@H+]1CC[C@@]23c4c5c(O)ccc4C[C@@H]1[C@]2(O)CC[C@H](O[C@@H]1O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]1O)[C@@H]3O5	ZINC000077311521	553662722	/nfs/dbraw/zinc/66/27/22/553662722.db2.gz	LGMMRFSFVJQBQH-RPFRAKPZSA-N	0	1	505.520	-0.990	10	30	in-vitro	KBEEMN