smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=[N+]([O-])c1cc(/C=C\c2nc(-c3ccccc3)cs2)ccc1O ZINC000436797145 338287848 /nfs/dbraw/zinc/28/78/48/338287848.db2.gz MKSNVNLZAWLBAP-CLFYSBASSA-N 0 2 324.361 4.594 20 5 DJBDLN O=[N+]([O-])c1ccc(/C=C/c2nc(-c3ccccc3)cs2)cc1O ZINC000498296272 339302178 /nfs/dbraw/zinc/30/21/78/339302178.db2.gz OFEQXWPYLQHKGF-VQHVLOKHSA-N 0 2 324.361 4.594 20 5 DJBDLN O=[N+]([O-])c1ccc(/C=C\c2nc(-c3ccccc3)cs2)cc1O ZINC000498296271 339302146 /nfs/dbraw/zinc/30/21/46/339302146.db2.gz OFEQXWPYLQHKGF-CLFYSBASSA-N 0 2 324.361 4.594 20 5 DJBDLN