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](C)Oc1ccccc1C[NH+]1CCC(CO)(C[NH+]2CCCC2)CC1 ZINC000218597282 206371305 /nfs/dbraw/zinc/37/13/05/206371305.db2.gz JRRVPGXLQSFKQA-IBGZPJMESA-N 2 0 360.542 3.534 50 70 FHIARP CC[C@@H](C)Oc1ccccc1C[NH+]1CCC(CO)(C[NH+]2CCCC2)CC1 ZINC000218597204 568241722 /nfs/dbraw/zinc/24/17/22/568241722.db2.gz JRRVPGXLQSFKQA-LJQANCHMSA-N 2 0 360.542 3.534 50 70 FHIARP