smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC/[N+](=C/C=C/c1ccccc1)c1ccc([N+](C)(C)CC)cc1 ZINC000004826568 181158022 /nfs/dbraw/zinc/15/80/22/181158022.db2.gz NKDQVQWKRSFCMP-UQFKYPQTSA-N 2 0 308.469 4.722 50 30 DJEARP CCCCCCCCCC[n+]1cccc([C@@H]2CCC[N@@H+]2C)c1 ZINC000017654940 182085085 /nfs/dbraw/zinc/08/50/85/182085085.db2.gz IGRBOGLDQXBDPE-FQEVSTJZSA-N 2 0 303.514 4.882 50 30 DJEARP