smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1/N=N/c1ccc([N+]#N)c(C)c1 ZINC000018068850 179243973 /nfs/dbraw/zinc/24/39/73/179243973.db2.gz NAAZRWOXBIIYRD-ISLYRVAYSA-N 1 0 237.286 5.203 40 10 BKCBRO C#[N+]c1ccc(/N=N\c2ccccc2C)cc1C ZINC000104899504 183317620 /nfs/dbraw/zinc/31/76/20/183317620.db2.gz VEKJVLXDRAFDSC-ZCXUNETKSA-N 1 0 235.290 5.270 40 10 BKCBRO