smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+]1(CCNC(=O)C(=O)NCC[N+]2(C)CCCCCC2)CCCCCC1 ZINC000005022288 518326839 /nfs/dbraw/zinc/32/68/39/518326839.db2.gz XEGPBSROWCCWHC-UHFFFAOYSA-P 2 0 368.566 1.260 40 5 FDBBRP Cc1c2c(cc3c(=O)ccn(CC[NH+](C)C)c13)c(=O)ccn2CC[NH+](C)C ZINC000001629464 204014952 /nfs/dbraw/zinc/01/49/52/204014952.db2.gz WXIVGXOYHKWXPQ-UHFFFAOYSA-N 2 0 368.481 1.748 40 5 FDBBRP