smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1ccc(CCn2cnc3c2ncnc3N2CCNCC2)cc1 ZINC000040878466 134722975 /nfs/dbraw/zinc/72/29/75/134722975.db2.gz ZFUVQRFUUAVZNF-UHFFFAOYSA-N 0 3 323.404 1.061 1 10 DDCFHN NC[C@@H](O)Cn1c2c(c3ccccc3c1=O)C(=O)c1ccccc1-2 ZINC000072179447 191071983 /nfs/dbraw/zinc/07/19/83/191071983.db2.gz HHLLMRFSKVNTSS-LLVKDONJSA-N 0 3 320.348 1.533 1 10 DDCFHN NC[C@H](O)Cn1c2c(c3ccccc3c1=O)C(=O)c1ccccc1-2 ZINC000072179448 191072165 /nfs/dbraw/zinc/07/21/65/191072165.db2.gz HHLLMRFSKVNTSS-NSHDSACASA-N 0 3 320.348 1.533 1 10 DDCFHN COC(=O)[C@@H]1Cc2cc(O)c(O)cc2C2(CCN(C)CC2)O1 ZINC000005940223 181298614 /nfs/dbraw/zinc/29/86/14/181298614.db2.gz XRTLGGOYJLNFNL-AWEZNQCLSA-N 0 3 307.346 1.133 1 10 DDCFHN