smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[C@H]([NH2+]CCC[NH+](CC)CC)c1cc(Br)ccc1O ZINC000019943061 212088830 /nfs/dbraw/zinc/08/88/30/212088830.db2.gz PRMOSOVACICBEQ-HNNXBMFYSA-N 2 0 343.309 3.927 10 10 EHCERP CC[C@@H]([NH2+]CCC[NH+](CC)CC)c1cc(Br)ccc1O ZINC000019943059 212088817 /nfs/dbraw/zinc/08/88/17/212088817.db2.gz PRMOSOVACICBEQ-OAHLLOKOSA-N 2 0 343.309 3.927 10 10 EHCERP