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(CN(CC3CC3)C[C@H]2COCc2cccnc2)C1 ZINC001164755143 720937624 /nfs/dbraw/zinc/93/76/24/720937624.db2.gz YVKVZHRWOBDERN-XUZZJYLKSA-N 0 3 474.602 3.198 20 70 JGIDHN Cc1cc(S(=O)(=O)F)cnc1N1CC[C@]2(CN(CC3CC3)C[C@H]2COCc2cccnc2)C1 ZINC001164755142 720938237 /nfs/dbraw/zinc/93/82/37/720938237.db2.gz YVKVZHRWOBDERN-URXFXBBRSA-N 0 3 474.602 3.198 20 70 JGIDHN Cc1cc(S(=O)(=O)F)cnc1N1CC[C@@]2(CN(CC3CC3)C[C@@H]2COCc2cccnc2)C1 ZINC001164755144 720937459 /nfs/dbraw/zinc/93/74/59/720937459.db2.gz YVKVZHRWOBDERN-ZJSXRUAMSA-N 0 3 474.602 3.198 20 70 JGIDHN Cc1cc(S(=O)(=O)F)cnc1N1CC[C@]2(CN(CC3CC3)C[C@@H]2COCc2cccnc2)C1 ZINC001164755141 720938813 /nfs/dbraw/zinc/93/88/13/720938813.db2.gz YVKVZHRWOBDERN-QPPBQGQZSA-N 0 3 474.602 3.198 20 70 JGIDHN