smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CS(=O)(=O)[N-]c1ccc(S(=O)(=O)[N-]C(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)cc1F ZINC000095430678 525225128 /nfs/dbraw/zinc/22/51/28/525225128.db2.gz FKYAAAWHQHTSTL-NEPJUHHUSA-N -2 3 448.444 2.924 20 30 IFEDHL CS(=O)(=O)[N-]c1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)cc1F ZINC000095430679 525224116 /nfs/dbraw/zinc/22/41/16/525224116.db2.gz FKYAAAWHQHTSTL-NWDGAFQWSA-N -2 3 448.444 2.924 20 30 IFEDHL CS(=O)(=O)[N-]c1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)cc1F ZINC000095430677 525224785 /nfs/dbraw/zinc/22/47/85/525224785.db2.gz FKYAAAWHQHTSTL-VXGBXAGGSA-N -2 3 448.444 2.924 20 30 IFEDHL CS(=O)(=O)[N-]c1ccc(S(=O)(=O)[N-]C(=O)[C@H]2C[C@H]2c2cccc(F)c2F)cc1F ZINC000095430680 525223211 /nfs/dbraw/zinc/22/32/11/525223211.db2.gz FKYAAAWHQHTSTL-RYUDHWBXSA-N -2 3 448.444 2.924 20 30 IFEDHL