smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(=[NH2+])Nc1cccc(NC(C)=[NH2+])c1 13780453 166229713 /nfs/dbraw/zinc/22/97/13/166229713.db2.gz GNBJEYDGLAAEGB-UHFFFAOYSA-N 2 0 190.250 2.505 1 0 AFAFRP CC(=[NH2+])Nc1ccc(NC(C)=[NH2+])cc1 26716643 166230684 /nfs/dbraw/zinc/23/06/84/166230684.db2.gz RMGYANWPNSQNJF-UHFFFAOYSA-N 2 0 190.250 2.505 1 0 AFAFRP