smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N+](C)(C)N 1670602 342956528 /nfs/dbraw/zinc/95/65/28/342956528.db2.gz WBWIUGQOOVEZOT-UHFFFAOYSA-N 1 3 89.162 -0.044 40 5 ABBBHO C[N+]1(N)CCOCC1 1564255 571775979 /nfs/dbraw/zinc/77/59/79/571775979.db2.gz ISVBKDLTMQSOQQ-UHFFFAOYSA-N 1 3 117.172 -0.663 40 5 ABBBHO