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@H](N)C(=O)N(C1CC1)[C@H]1CC[C@H]([NH+](C)C)CC1 ZINC000242547611 364524330 /nfs/dbraw/zinc/52/43/30/364524330.db2.gz KNASPSIAHMEIJI-SRVKXCTJSA-N 1 3 253.390 1.197 30 0 CDACHO