smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[O-]c1ccc(Cl)cc1-c1nn[n-]n1	95219428	1424769403	/nfs/dbraw/zinc/76/94/03/1424769403.db2.gz	XSNIHEDBRUIXEU-UHFFFAOYSA-N	-2	1	196.597	1.226	20	0		ADADML
CCCO[P@](=O)([O-])CCC(=O)[O-]	97054272	167017247	/nfs/dbraw/zinc/01/72/47/167017247.db2.gz	VGTQZYZLIPKNOP-UHFFFAOYSA-N	-2	1	196.139	1.073	20	0		ADADML
O=C([O-])c1cc(Cl)c([O-])cn1	95761330	169356294	/nfs/dbraw/zinc/35/62/94/169356294.db2.gz	WALCLKORLYGCNX-UHFFFAOYSA-N	-2	1	173.555	1.139	20	0		ADADML
O=[P@]([O-])(O)C/C=C/c1ccccc1	34622488	351444386	/nfs/dbraw/zinc/44/43/86/351444386.db2.gz	AIWAKBITCLOITM-QPJJXVBHSA-N	-2	1	198.158	1.878	20	0	in-vitro	ADADML
Cc1nc(Cl)c([O-])cc1C(=O)[O-]	575436868	352202924	/nfs/dbraw/zinc/20/29/24/352202924.db2.gz	UUADGXCEQJKFGH-UHFFFAOYSA-N	-2	1	187.582	1.447	20	0		ADADML
Cc1oc(C)c(C(=O)[O-])c1[S-]	125845942	375393352	/nfs/dbraw/zinc/39/33/52/375393352.db2.gz	BKCBCFWFDLVPCQ-UHFFFAOYSA-N	-2	1	172.205	1.883	20	0		ADADML
CC(C)c1c[n-]n2c(=O)cc([O-])nc12	67175660	1224174147	/nfs/dbraw/zinc/17/41/47/1224174147.db2.gz	WEBRPPNFAKIURK-UHFFFAOYSA-N	-2	1	193.206	1.264	20	0		ADADML