smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COCCOc1cc(F)c2c(c1)ncnc2Nc1ccc(N)cc1 ZINC001772768882 1441417280 /nfs/dbraw/zinc/41/72/80/1441417280.db2.gz HXMGKWOQQHQRPW-UHFFFAOYSA-N 0 0 328.347 3.120 30 10 EGCCRN