smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Fc1ccc(C[N@@H+]2CCOCC23CCN(c2ccc4ccc5cccnc5c4n2)CC3)cc1 ZINC001164672142 719499702 /nfs/dbraw/zinc/49/97/02/719499702.db2.gz FPDSILQJBZQZOL-UHFFFAOYSA-N 1 2 442.538 4.794 20 5 IJBDLO Fc1ccc(C[N@H+]2CCOCC23CCN(c2ccc4ccc5cccnc5c4n2)CC3)cc1 ZINC001164672142 719499709 /nfs/dbraw/zinc/49/97/09/719499709.db2.gz FPDSILQJBZQZOL-UHFFFAOYSA-N 1 2 442.538 4.794 20 5 IJBDLO