smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+]1CCN(/[NH+]=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)CC1 ZINC000004871780 204171430 /nfs/dbraw/zinc/17/14/30/204171430.db2.gz PWZLITFPKRHCIF-LKUDQCMESA-N 2 1 370.500 4.738 3 30 FJEFMP