smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1ccc2cc3ccccc3cc2c1	ZINC000000164010	342678730	/nfs/dbraw/zinc/67/87/30/342678730.db2.gz	RZRJYURCNBXIST-UHFFFAOYSA-N	-1	0	222.243	3.691	50	5	in-vitro	BHBARM
O=C([O-])Cc1ccc2ccc3ccccc3c2c1	ZINC000000330264	383853912	/nfs/dbraw/zinc/85/39/12/383853912.db2.gz	ZLXFMMQQGQQKFC-UHFFFAOYSA-N	-1	0	236.270	3.620	50	5		BHBARM
O=C([O-])c1ccc2ccc3ccccc3c2c1	ZINC000000345518	182573519	/nfs/dbraw/zinc/57/35/19/182573519.db2.gz	WYQIVZKSGGKUAX-UHFFFAOYSA-N	-1	0	222.243	3.691	50	5		BHBARM
O=C([O-])c1c2ccccc2cc2ccccc21	ZINC000000391311	188099504	/nfs/dbraw/zinc/09/95/04/188099504.db2.gz	XGWFJBFNAQHLEF-UHFFFAOYSA-N	-1	0	222.243	3.691	50	5	in-vitro	BHBARM
O=C([O-])c1cccc2ccc3ccccc3c21	ZINC000000391312	356357905	/nfs/dbraw/zinc/35/79/05/356357905.db2.gz	HHZVGTSZLAQRSM-UHFFFAOYSA-N	-1	0	222.243	3.691	50	5	in-vitro	BHBARM
O=C([O-])c1cc2ccccc2c2ccccc12	ZINC000000402497	342686717	/nfs/dbraw/zinc/68/67/17/342686717.db2.gz	LMFJKKGDLAICPF-UHFFFAOYSA-N	-1	0	222.243	3.691	50	5		BHBARM
O=C([O-])c1cccc2cc3ccccc3cc21	ZINC000002512240	182580401	/nfs/dbraw/zinc/58/04/01/182580401.db2.gz	CCFAKBRKTKVJPO-UHFFFAOYSA-N	-1	0	222.243	3.691	50	5	in-vitro	BHBARM
O=C([O-])c1ccc2c(ccc3ccccc32)c1	ZINC000039428991	356370562	/nfs/dbraw/zinc/37/05/62/356370562.db2.gz	QTWYUOSZMIWHJV-UHFFFAOYSA-N	-1	0	222.243	3.691	50	5		BHBARM