smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1C=CC(=CNNc2scc(-c3ccccc3)[n+]2-c2ccccc2)C=C1 ZINC000038174120 205040332 /nfs/dbraw/zinc/04/03/32/205040332.db2.gz GEJFVZPCEOCMFA-UHFFFAOYSA-O 1 3 372.473 4.187 40 30 FIEBHO c1ccc(/[NH+]=C(/N(CCN2CCCC2)c2ccccc2)N2CCCC2)cc1 ZINC000016958693 211172677 /nfs/dbraw/zinc/17/26/77/211172677.db2.gz CXTDIZWTRIBIJF-WCWDXBQESA-N 1 3 362.521 4.372 40 30 FIEBHO c1ccc(/[NH+]=C(\N(CCN2CCCC2)c2ccccc2)N2CCCC2)cc1 ZINC000001644238 210364494 /nfs/dbraw/zinc/36/44/94/210364494.db2.gz CXTDIZWTRIBIJF-VHXPQNKSSA-N 1 3 362.521 4.372 40 30 FIEBHO