smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(N2CCOCC2)ccc1CN1CCc2nnc([C@H]3CCC[NH2+]3)n2CC1 ZINC000019706476 210284561 /nfs/dbraw/zinc/28/45/61/210284561.db2.gz UQDOJIRIOCYCFG-HXUWFJFHSA-N 1 3 396.539 1.906 40 10 GDCBHO Cc1cc(N2CCOCC2)ccc1CN1CCc2nnc([C@@H]3CCC[NH2+]3)n2CC1 ZINC000019706475 571032274 /nfs/dbraw/zinc/03/22/74/571032274.db2.gz UQDOJIRIOCYCFG-FQEVSTJZSA-N 1 3 396.539 1.906 40 10 GDCBHO