smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N@H+]1CC[C@@]23C=C[C@H](O)C[C@@H]2Oc2c3c(ccc2OCCCCCCCC[N+](C)(C)C)C1	ZINC000014947232	717111379	/nfs/dbraw/zinc/11/13/79/717111379.db2.gz	IBXVNKSIYGDEGH-DPPGTGKWSA-N	2	1	443.652	4.267	1	5		IIBFMP
OCC[NH2+]CC/[NH+]=c1\cc2n(-c3ccccc3)c3ccccc3nc-2cc1Nc1ccccc1	ZINC000027652323	563045263	/nfs/dbraw/zinc/04/52/63/563045263.db2.gz	PNOLZGHEBLRERG-BGABXYSRSA-N	2	1	449.558	4.357	1	5		IIBFMP
COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CC[N@H+](CCCCCCCC[N+](C)(C)C)C2	ZINC000014947225	717111427	/nfs/dbraw/zinc/11/14/27/717111427.db2.gz	NGTBGFYKCSGZJK-DPPGTGKWSA-N	2	1	443.652	4.267	1	5		IIBFMP
CC[NH+](CC)CCNC(=O)c1ccc2c3c([nH]n2CC[NH+](CC)CC)c2ccccc2[nH+]c31	ZINC000026982473	563038508	/nfs/dbraw/zinc/03/85/08/563038508.db2.gz	RYKZOXWICYCOLY-UHFFFAOYSA-N	3	1	448.615	4.084	1	5		IIBFMP