smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=c1cc(CN2CCn3nc([C@@H](O)CO)cc3C2)nc2[nH]cnn21 ZINC000217567520 241260321 /nfs/dbraw/zinc/26/03/21/241260321.db2.gz DSCAWOQKJVALKZ-LBPRGKRZSA-N 0 2 331.336 -1.344 50 70 EAIALN O=c1cc(CN2CCn3nc([C@H](O)CO)cc3C2)nc2[nH]cnn21 ZINC000217567599 241261052 /nfs/dbraw/zinc/26/10/52/241261052.db2.gz DSCAWOQKJVALKZ-GFCCVEGCSA-N 0 2 331.336 -1.344 50 70 EAIALN