smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCCCC[C@H]([NH3+])C[NH2+]CC ZINC000043860931 175115726 /nfs/dbraw/zinc/11/57/26/175115726.db2.gz CDNCXRTXBJXGIV-SFHVURJKSA-N 2 0 284.532 5.014 1 30 CKEFRP CCCCCCCCCCCCCC[C@@H]([NH3+])C[NH2+]CC ZINC000043860933 175115808 /nfs/dbraw/zinc/11/58/08/175115808.db2.gz CDNCXRTXBJXGIV-GOSISDBHSA-N 2 0 284.532 5.014 1 30 CKEFRP