smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1/C(=C/c2ccc([O-])c([N+](=O)[O-])c2)CCC/C1=C\c1ccc(O)c([N+](=O)[O-])c1 ZINC000028911326 207351793 /nfs/dbraw/zinc/35/17/93/207351793.db2.gz FOIOQZCMZJVONY-VOMDNODZSA-N -1 2 396.355 4.134 20 30 GIEDLM N#Cc1ccc(Cl)c(S(=O)(=O)Nc2cc(Cl)c([O-])c(Cl)c2)c1 ZINC000179445242 822484114 /nfs/dbraw/zinc/48/41/14/822484114.db2.gz XLPURNOOTNOTCB-UHFFFAOYSA-N -1 2 377.636 4.025 20 30 GIEDLM