smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCCCCCCNC(=O)[C@H]([NH3+])CCCC[NH3+] ZINC000008214422 207223452 /nfs/dbraw/zinc/22/34/52/207223452.db2.gz LWEXAPVESMZHFG-OAQYLSRUSA-N 2 0 369.638 5.040 10 30 in-man FKEERP CCCCCCCCCCCCCCCCCC[NH2+]CCNCC[NH3+] ZINC000103839558 222343638 /nfs/dbraw/zinc/34/36/38/222343638.db2.gz DBNYMXPUYZOHQN-UHFFFAOYSA-N 2 0 355.655 5.386 10 30 FKEERP CCCCCCCCCCCCCCCCOCCC[NH2+]CCC[NH3+] ZINC000103843968 222344001 /nfs/dbraw/zinc/34/40/01/222344001.db2.gz JKVCENSTXGEMCE-UHFFFAOYSA-N 2 0 356.639 5.813 10 30 FKEERP