smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name ClCCCOc1ccc(CNC2(c3nn[n-]n3)CCCC2)cc1 ZINC000811486105 1446780908 /nfs/dbraw/zinc/78/09/08/1446780908.db2.gz JIBWLZDJNUSOFP-UHFFFAOYSA-N -1 3 335.839 2.767 10 50 EFGEHM ClCCCOc1ccc(CNC2(c3nnn[n-]3)CCCC2)cc1 ZINC000811486105 1446780911 /nfs/dbraw/zinc/78/09/11/1446780911.db2.gz JIBWLZDJNUSOFP-UHFFFAOYSA-N -1 3 335.839 2.767 10 50 EFGEHM