smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@]12CCCN1CCNC2=O 217948457 344408523 /nfs/dbraw/zinc/40/85/23/344408523.db2.gz OGVXKWGEFRNFLD-QMMMGPOBSA-N 0 3 154.213 -0.029 40 70 ABIBHN C[C@]12CCCN1CCNC2=O 217948528 344408507 /nfs/dbraw/zinc/40/85/07/344408507.db2.gz OGVXKWGEFRNFLD-MRVPVSSYSA-N 0 3 154.213 -0.029 40 70 ABIBHN Cc1cc(=O)[nH]c(=O)n1CCN(C)C 218294114 344411144 /nfs/dbraw/zinc/41/11/44/344411144.db2.gz RWYAFUWBOBFSDA-UHFFFAOYSA-N 0 3 197.238 -0.593 40 70 ABIBHN