smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(CCN2CN=C(SCc3ccc(Cl)cc3)NC2)cc1OC ZINC000005351406 569255686 /nfs/dbraw/zinc/25/56/86/569255686.db2.gz JRZNGLZDQHVIOO-UHFFFAOYSA-N 0 0 405.951 4.009 30 0 HIACRN COc1cc(OC)c(-c2coc3c4c(cc(O)c3c2=O)OC(C)(C)C=C4)cc1OC ZINC000002561275 569277920 /nfs/dbraw/zinc/27/79/20/569277920.db2.gz WNIRAQXHOVJVDB-UHFFFAOYSA-N 0 0 410.422 4.376 30 0 HIACRN