smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN1C(=O)C(=C/C=C(\N2CCCCC2)[NH+]2CCCCC2)C(=O)N(C)C1=O ZINC000006661501 518380930 /nfs/dbraw/zinc/38/09/30/518380930.db2.gz PRHNZGWDNSBWDB-UHFFFAOYSA-N 1 3 360.458 1.776 50 10 FDCAHO CN1C(=O)C(=C/C=C(/N2CCCCC2)[NH+]2CCCCC2)C(=O)N(C)C1=O ZINC000006661501 518380935 /nfs/dbraw/zinc/38/09/35/518380935.db2.gz PRHNZGWDNSBWDB-UHFFFAOYSA-N 1 3 360.458 1.776 50 10 FDCAHO