smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCc1[n-]c(=S)nnc1CCCCCCCC(=O)[O-] ZINC000066103815 221241111 /nfs/dbraw/zinc/24/11/11/221241111.db2.gz RVSIFRZBQFMPIB-UHFFFAOYSA-N -2 3 367.559 5.031 1 30 FKEFHL