smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCNC(=O)c1ccc(Oc2ccc(CC(=O)[O-])cc2OC)c([N-]S(=O)(=O)c2ccc(Cl)cc2Cl)c1	ZINC000043169109	554297528	/nfs/dbraw/zinc/29/75/28/554297528.db2.gz	DKSKRBVXRDGYAS-UHFFFAOYSA-N	-2	0	581.474	5.752	20	0		KKADRL
O=c1c2ccc([O-])cc2occ1-c1ccc(OC2CCCCCCCCCCC2)c(S(=O)(=O)[O-])c1	ZINC001230179632	1072916546	/nfs/dbraw/zinc/91/65/46/1072916546.db2.gz	VJDJPKJIJOWXTG-UHFFFAOYSA-N	-2	0	500.613	6.464	20	0		KKADRL
O=c1c(-c2ccc(OC(c3ccccc3)c3ccccc3)c(S(=O)(=O)[O-])c2)coc2cc([O-])ccc12	ZINC001230175728	1072916809	/nfs/dbraw/zinc/91/68/09/1072916809.db2.gz	KNVWYEDTKZSWSU-UHFFFAOYSA-N	-2	0	500.528	5.581	20	0		KKADRL
Cc1ncccc1NC(=O)c1ccc2c(c1)CC[C@@H]1C[C@@](OP(=O)([O-])[O-])(C(F)(F)F)CC[C@@]21Cc1ccccc1	ZINC000103298102	562824802	/nfs/dbraw/zinc/82/48/02/562824802.db2.gz	BVXLAHSJXXSWFF-KEKPKEOLSA-N	-2	0	574.536	6.280	20	0	investigational	KKADRL