smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1c(Br)c(C)c(C=O)c(O)c1Br ZINC000004299093 431297873 /nfs/dbraw/zinc/29/78/73/431297873.db2.gz IZLGYPJUOGNTOA-UHFFFAOYSA-N 0 1 307.969 3.347 30 0 DGACMN