smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cn1c(=O)cc(NCCCN2CCN(c3ccc4c(c3)OC[C@H](CO)O4)CC2)n(C)c1=O ZINC000028332581 563052558 /nfs/dbraw/zinc/05/25/58/563052558.db2.gz QTSKCJCWZQXFMQ-KRWDZBQOSA-N 0 1 445.520 -0.160 1 10 IBCFMN Cn1c(=O)cc(NCCCN2CCN(c3ccc4c(c3)OC[C@@H](CO)O4)CC2)n(C)c1=O ZINC000028332585 563052594 /nfs/dbraw/zinc/05/25/94/563052594.db2.gz QTSKCJCWZQXFMQ-QGZVFWFLSA-N 0 1 445.520 -0.160 1 10 IBCFMN