smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cn1c2ncn(CC[N@H+](C)CC(C)(CO)CO)c2c(=O)n(C)c1=O ZINC000159582819 265359961 /nfs/dbraw/zinc/35/99/61/265359961.db2.gz HRHPHHPSAFORBR-UHFFFAOYSA-N 1 0 339.396 -1.644 20 70 EAIDRO Cn1cnc2c1c(=O)n(CC(=O)N1C[C@H]3CCC[C@@H](C1)[NH2+]3)c(=O)n2C ZINC000160540253 374515251 /nfs/dbraw/zinc/51/52/51/374515251.db2.gz SCFZELPREQGCNG-PHIMTYICSA-N 1 0 346.391 -1.213 20 70 EAIDRO Cn1c2ncn(CC(=O)N3C[C@H]4CCC[C@@H](C3)[NH2+]4)c2c(=O)n(C)c1=O ZINC000160587978 264932227 /nfs/dbraw/zinc/93/22/27/264932227.db2.gz XAYFLYVLFJSLQQ-PHIMTYICSA-N 1 0 346.391 -1.213 20 70 EAIDRO