smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COCCCc1cc(=O)[n-]c(-c2cnn(CC(C)C)c2)n1	ZINC000217789934	330473306	/nfs/dbraw/zinc/47/33/06/330473306.db2.gz	XLJSQEQUHOBRHF-UHFFFAOYSA-N	-1	1	290.367	2.281	40	70		CEIBMM
COCCCc1cc(=O)[n-]c(-c2cnn(C(C)C)c2)n1	ZINC000217789724	330473226	/nfs/dbraw/zinc/47/32/26/330473226.db2.gz	VYAQUSYZXMULPM-UHFFFAOYSA-N	-1	1	276.340	2.206	40	70		CEIBMM
CCCn1cc(-c2nc(CCCOC)cc(=O)[n-]2)cn1	ZINC000217789833	394456340	/nfs/dbraw/zinc/45/63/40/394456340.db2.gz	DJZCDFMQUGYVCE-UHFFFAOYSA-N	-1	1	276.340	2.035	40	70		CEIBMM
COCCCc1cc(=O)[n-]c(-c2cccs2)n1	ZINC000217789393	130763774	/nfs/dbraw/zinc/76/37/74/130763774.db2.gz	WMGBHPBCNMAAFN-UHFFFAOYSA-N	-1	1	250.323	2.490	40	70		CEIBMM