smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCCNC(=O)[C@H](N)CCCC[NH3+] ZINC000043491036 183366323 /nfs/dbraw/zinc/36/63/23/183366323.db2.gz YKFORZPFABJQKU-QGZVFWFLSA-N 1 3 313.530 3.480 1 30 DGEFHO CCCCCCCCCCCCNC(=O)[C@@H](N)CCCC[NH3+] ZINC000043328160 183355348 /nfs/dbraw/zinc/35/53/48/183355348.db2.gz YKFORZPFABJQKU-KRWDZBQOSA-N 1 3 313.530 3.480 1 30 DGEFHO