smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC[C@@H]1CCC[N@H+]2CCCc3c4ccccc4[nH]c3[C@]12C ZINC000006415550 170199617 /nfs/dbraw/zinc/19/96/17/170199617.db2.gz HFTKZFPMMURMOX-QRWLVFNGSA-N 1 3 296.458 4.841 50 0 CJAAHO CCC[C@@H]1CCC[N@@H+]2CCCc3c4ccccc4[nH]c3[C@]12C ZINC000006415550 170199615 /nfs/dbraw/zinc/19/96/15/170199615.db2.gz HFTKZFPMMURMOX-QRWLVFNGSA-N 1 3 296.458 4.841 50 0 CJAAHO CCC[C@H]1CCC[N@H+]2CCCc3c4ccccc4[nH]c3[C@]12C ZINC000006415606 170199466 /nfs/dbraw/zinc/19/94/66/170199466.db2.gz HFTKZFPMMURMOX-YWZLYKJASA-N 1 3 296.458 4.841 50 0 CJAAHO CCC[C@H]1CCC[N@@H+]2CCCc3c4ccccc4[nH]c3[C@]12C ZINC000006415606 170199464 /nfs/dbraw/zinc/19/94/64/170199464.db2.gz HFTKZFPMMURMOX-YWZLYKJASA-N 1 3 296.458 4.841 50 0 CJAAHO