smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(N[C@@H](c2ccccn2)c2cc(Cl)c3cccnc3c2O)[nH+]c1 ZINC000045944539 212119097 /nfs/dbraw/zinc/11/90/97/212119097.db2.gz BHMOEKIHHLHRPS-LJQANCHMSA-N -1 2 376.847 4.894 10 10 GJCELM Cc1ccc(N[C@H](c2cccnc2)c2cc(Cl)c3cccnc3c2O)[nH+]c1 ZINC000045944558 212118401 /nfs/dbraw/zinc/11/84/01/212118401.db2.gz YFRCBICCPRGOPZ-LJQANCHMSA-N -1 2 376.847 4.894 10 10 GJCELM