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)(C)c1ccc(N=C=S)cc1 1734881 717089026 /nfs/dbraw/zinc/08/90/26/717089026.db2.gz UWDPMJLRZXNQHD-UHFFFAOYSA-N 1 0 193.295 2.618 40 50 AFGBRO C[N+](C)(CCl)C1CCCCC1 1720068 717089374 /nfs/dbraw/zinc/08/93/74/717089374.db2.gz GYVDXRBIQDFIPX-UHFFFAOYSA-N 1 0 176.711 2.592 40 50 AFGBRO