smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1[C@@H](C)[NH2+]Cc1cccc(COC2CCOCC2)c1 ZINC000159575274 225241058 /nfs/dbraw/zinc/24/10/58/225241058.db2.gz QWVMDZXNYUCHLA-GOSISDBHSA-N 1 0 339.479 4.541 50 70 EJIARO Cc1ccccc1[C@H](C)[NH2+]Cc1cccc(COC2CCOCC2)c1 ZINC000159575396 225242290 /nfs/dbraw/zinc/24/22/90/225242290.db2.gz QWVMDZXNYUCHLA-SFHVURJKSA-N 1 0 339.479 4.541 50 70 EJIARO