smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(N2CCN(Cc3nnc([C@H]4C[C@@H]([NH3+])C4)n3C)CC2)nc(N)n1 ZINC000218663988 132273160 /nfs/dbraw/zinc/27/31/60/132273160.db2.gz RZEBGPVXHQLQNR-JOCQHMNTSA-N 1 3 357.466 0.023 50 70 FCIAHO