smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCOc1ccc(C=C2SC(=S)[N-]C2=O)cc1 ZINC000059272230 256539432 /nfs/dbraw/zinc/53/94/32/256539432.db2.gz WPNFEOLNZDWAAJ-SDNWHVSQSA-N -1 1 321.467 4.546 40 10 DJCBMM O=C1[N-]C(=S)C(=Cc2cccc(Oc3ccccc3)c2)S1 ZINC000015057000 563406219 /nfs/dbraw/zinc/40/62/19/563406219.db2.gz LNHJJSGWVRZFLV-UVTDQMKNSA-N -1 1 313.403 4.604 40 10 DJCBMM