smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1nc2n(n1)C(=O)C([C@H](c1cccc(OC(F)F)c1)N1CCOCC1)S2	ZINC000218435671	534714579	/nfs/dbraw/zinc/71/45/79/534714579.db2.gz	IQBWIWQYMZIVHD-ZDUSSCGKSA-N	0	2	396.419	2.828	50	70		GFIALN
CCOc1ccc(S(=O)(=O)Nc2cnn(CC3CCOCC3)c2)cc1F	ZINC000218246252	570818549	/nfs/dbraw/zinc/81/85/49/570818549.db2.gz	VODYZMNRMMAQDH-UHFFFAOYSA-N	0	2	383.445	2.648	50	70		GFIALN
O=C1C([C@@H](c2cccc(OC(F)F)c2)N2CCOCC2)Sc2ncnn21	ZINC000218455130	570890623	/nfs/dbraw/zinc/89/06/23/570890623.db2.gz	AWBHRWIWINOWML-GFCCVEGCSA-N	0	2	382.392	2.519	50	70		GFIALN
O=C1C([C@H](c2cccc(OC(F)F)c2)N2CCOCC2)Sc2ncnn21	ZINC000218455053	570890504	/nfs/dbraw/zinc/89/05/04/570890504.db2.gz	AWBHRWIWINOWML-LBPRGKRZSA-N	0	2	382.392	2.519	50	70		GFIALN
COc1nccc(NS(=O)(=O)c2ccc(NC(=O)C3CCCCC3)cc2)n1	ZINC000217461656	211749560	/nfs/dbraw/zinc/74/95/60/211749560.db2.gz	NSUUELSMOYWSPK-UHFFFAOYSA-N	0	2	390.465	2.805	50	70		GFIALN
Cc1nc2n(n1)C(=O)C([C@@H](c1cc(F)c(F)c(F)c1)N1CCOCC1)S2	ZINC000218544044	570336708	/nfs/dbraw/zinc/33/67/08/570336708.db2.gz	XJFPUJVALBHOKC-CYBMUJFWSA-N	0	2	384.383	2.644	50	70		GFIALN
Cc1nc2n(n1)C(=O)C([C@H](c1cc(F)c(F)c(F)c1)N1CCOCC1)S2	ZINC000218544137	570336785	/nfs/dbraw/zinc/33/67/85/570336785.db2.gz	XJFPUJVALBHOKC-ZDUSSCGKSA-N	0	2	384.383	2.644	50	70		GFIALN
Cc1nc2n(n1)C(=O)C([C@@H](c1cccc(OC(F)F)c1)N1CCOCC1)S2	ZINC000218435759	534715651	/nfs/dbraw/zinc/71/56/51/534715651.db2.gz	IQBWIWQYMZIVHD-CYBMUJFWSA-N	0	2	396.419	2.828	50	70		GFIALN