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+](C)(C)CC(=O)N/N=C/C(Br)=C/c1ccccc1 ZINC000004263155 717097921 /nfs/dbraw/zinc/09/79/21/717097921.db2.gz CIGBODMUPVYNRX-XMHXKSDUSA-O 1 0 325.230 2.231 50 50 EEGARO C[N+]1(CCOP(=O)(c2ccccc2)c2ccccc2)CCOCC1 ZINC000000295145 717087832 /nfs/dbraw/zinc/08/78/32/717087832.db2.gz LELURBDAJIEQFH-UHFFFAOYSA-N 1 0 346.387 2.409 50 50 EEGARO