smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cn1cnc2c1c(=O)n(CCC[N@H+](C)CC(C)(CO)CO)c(=O)n2C ZINC000159530323 482731003 /nfs/dbraw/zinc/73/10/03/482731003.db2.gz DLZAOUVIGZFKSI-UHFFFAOYSA-N 1 0 353.423 -1.254 20 70 FAIDRO