smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN1CCN(c2ccc3[nH]c(-c4ccc5[nH]c(-c6ccc(Cl)cc6)nc5c4)nc3c2)CC1 ZINC000205898505 569583157 /nfs/dbraw/zinc/58/31/57/569583157.db2.gz QXGLWDFFMBHOFL-UHFFFAOYSA-N 0 3 442.954 5.178 30 0 IKACHN CN1CCN(c2ccc3[nH]c(-c4ccc5nc(-c6ccc(Cl)cc6)[nH]c5c4)nc3c2)CC1 ZINC000205898505 569583158 /nfs/dbraw/zinc/58/31/58/569583158.db2.gz QXGLWDFFMBHOFL-UHFFFAOYSA-N 0 3 442.954 5.178 30 0 IKACHN