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)CCCCCCCCCCCCCCCC[N+](C)(C)C ZINC000006068077 717103378 /nfs/dbraw/zinc/10/33/78/717103378.db2.gz VUQUPFRHEFTWRS-UHFFFAOYSA-N 2 0 342.656 5.860 1 5 EKBFRP CCCC1(CCC)CCC2(CC[N+](C)(CCC[N+](C)(C)C)C2)CC1 ZINC000026744688 202147484 /nfs/dbraw/zinc/14/74/84/202147484.db2.gz DVTHMUBJYGMWTJ-UHFFFAOYSA-N 2 0 338.624 5.080 1 5 EKBFRP