smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCN1CCN(c2nc3ccccc3nc2[N-]S(=O)(=O)c2ccc(F)cc2)CC1	ZINC001165032127	721870632	/nfs/dbraw/zinc/87/06/32/721870632.db2.gz	IOPYGMDLBATYOD-UHFFFAOYSA-N	-1	0	427.505	2.878	20	30		IFEDRM
CS(=O)(=O)Nc1ccc(S(=O)(=O)[N-]C(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)cc1F	ZINC000095430678	525225122	/nfs/dbraw/zinc/22/51/22/525225122.db2.gz	FKYAAAWHQHTSTL-NEPJUHHUSA-N	-1	0	448.444	2.924	20	30		IFEDRM
Cc1ccc(S(=O)(=O)[N-]c2nc3ccccc3nc2N2CCN(CCC#N)CC2)cc1	ZINC001165056341	722022870	/nfs/dbraw/zinc/02/28/70/722022870.db2.gz	PYOHDDQCCLMXKU-UHFFFAOYSA-N	-1	0	436.541	2.775	20	30		IFEDRM
COCCCNC(=S)NN=Cc1cc(Br)cc(Br)c1[O-]	ZINC000263630705	568737374	/nfs/dbraw/zinc/73/73/74/568737374.db2.gz	SLJDJXMPZZUDJL-UHFFFAOYSA-N	-1	0	425.146	2.752	20	30		IFEDRM
CS(=O)(=O)Nc1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)cc1F	ZINC000095430679	525224104	/nfs/dbraw/zinc/22/41/04/525224104.db2.gz	FKYAAAWHQHTSTL-NWDGAFQWSA-N	-1	0	448.444	2.924	20	30		IFEDRM
CS(=O)(=O)Nc1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)cc1F	ZINC000095430677	525224777	/nfs/dbraw/zinc/22/47/77/525224777.db2.gz	FKYAAAWHQHTSTL-VXGBXAGGSA-N	-1	0	448.444	2.924	20	30		IFEDRM
CS(=O)(=O)Nc1ccc(S(=O)(=O)[N-]C(=O)[C@H]2C[C@H]2c2cccc(F)c2F)cc1F	ZINC000095430680	525223197	/nfs/dbraw/zinc/22/31/97/525223197.db2.gz	FKYAAAWHQHTSTL-RYUDHWBXSA-N	-1	0	448.444	2.924	20	30		IFEDRM
COc1ccc(OC)c(S(=O)(=O)[N-]C(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000028123387	563051129	/nfs/dbraw/zinc/05/11/29/563051129.db2.gz	HTDFSJSZLPBKST-UHFFFAOYSA-N	-1	0	428.507	2.996	20	30		IFEDRM