smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc2c(c1)[n+]([O-])c(C#N)c(NC(=O)c1ccco1)[n+]2[O-] ZINC000103147786 219261437 /nfs/dbraw/zinc/26/14/37/219261437.db2.gz ZWJSLUSGHCNUEU-UHFFFAOYSA-N 0 2 326.268 0.832 1 30 ECEFLN COc1ccc(C=CC(O)=C2C(=O)NC(=S)NC2=O)cc1OC ZINC000103159560 219264088 /nfs/dbraw/zinc/26/40/88/219264088.db2.gz PYOFLFMVKCNFQG-HWKANZROSA-N 0 2 334.353 0.433 1 30 ECEFLN