smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [NH3+]CCCCNCCC[NH2+]CCCC[NH2+]CCCC[NH3+] ZINC000013439041 560103990 /nfs/dbraw/zinc/10/39/90/560103990.db2.gz ITSJFETYKWFREV-UHFFFAOYSA-N 4 3 287.496 0.403 1 0 endogenous,in-man CCAFHP [NH3+]CCCC[NH2+]CCCCNCCC[NH2+]CCCC[NH3+] ZINC000013439041 560103992 /nfs/dbraw/zinc/10/39/92/560103992.db2.gz ITSJFETYKWFREV-UHFFFAOYSA-N 4 3 287.496 0.403 1 0 endogenous,in-man CCAFHP