smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(S(=O)(=O)F)cnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164755143 720937616 /nfs/dbraw/zinc/93/76/16/720937616.db2.gz YVKVZHRWOBDERN-XUZZJYLKSA-N 1 1 474.602 3.198 20 70 JGIDMO Cc1cc(S(=O)(=O)F)cnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@H]2COCc1cccnc1 ZINC001164755142 720938232 /nfs/dbraw/zinc/93/82/32/720938232.db2.gz YVKVZHRWOBDERN-URXFXBBRSA-N 1 1 474.602 3.198 20 70 JGIDMO Cc1cc(S(=O)(=O)F)cnc1N1CC[C@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164755144 720937448 /nfs/dbraw/zinc/93/74/48/720937448.db2.gz YVKVZHRWOBDERN-ZJSXRUAMSA-N 1 1 474.602 3.198 20 70 JGIDMO Cc1cc(S(=O)(=O)F)cnc1N1CC[C@@]2(C1)C[N@@H+](CC1CC1)C[C@@H]2COCc1cccnc1 ZINC001164755141 720938809 /nfs/dbraw/zinc/93/88/09/720938809.db2.gz YVKVZHRWOBDERN-QPPBQGQZSA-N 1 1 474.602 3.198 20 70 JGIDMO