smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+](C)=NC1CCC(C(C)(C)C)CC1 1582096 342948881 /nfs/dbraw/zinc/94/88/81/342948881.db2.gz OEYCKRRJXXNVEI-UHFFFAOYSA-N 1 0 197.346 3.316 40 10 AGCBRO