smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](CCNc1c2ccccc2[nH+]c2ccccc21)[NH+]1CCN(C)CC1 ZINC000045230974 202546461 /nfs/dbraw/zinc/54/64/61/202546461.db2.gz LUVQGMJWCQIZJG-QGZVFWFLSA-N 2 0 348.494 3.826 1 10 EHCFRP