smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C=C1OC(=O)c2c([O-])c(C)c([O-])c(C=O)c2[C@H]1C ZINC000014653244 560224011 /nfs/dbraw/zinc/22/40/11/560224011.db2.gz MKXPEMIYFLKLRY-YFKPBYRVSA-N -2 3 248.234 2.006 1 30 biogenic,in-vitro BEEFHL O=c1[nH][n-]cc1C=Nc1cc(Cl)ccc1[O-] ZINC000101758846 183273363 /nfs/dbraw/zinc/27/33/63/183273363.db2.gz OFHRJTPTTRSISE-UUILKARUSA-N -2 3 237.646 2.225 1 30 BEEFHL