smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1c(Cl)c([O-])c2c(=O)c(-c3cc(Cl)c([O-])c(Cl)c3)coc2c1Cl ZINC000013451755 291293560 /nfs/dbraw/zinc/29/35/60/291293560.db2.gz DLYZYPZOHLDANF-UHFFFAOYSA-N -2 1 422.047 5.493 1 0 biogenic,in-vitro HKAFML CC(C)=CCC/C(C)=C/CC1=C([O-])C2=C([O-])C(=O)C(c3ccc(O)cc3)OC2=CC1=O ZINC000014584389 560222345 /nfs/dbraw/zinc/22/23/45/560222345.db2.gz MBIJQAHZUBUPNM-VIZOYTHASA-N -2 1 422.477 5.518 1 0 in-vitro HKAFML