smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN1CCN(CCCOc2ccc(N3C(=O)/C(=C/c4ccc(Oc5ccc(F)cc5)cc4)SC3=S)cc2)CC1 ZINC000205102633 562874946 /nfs/dbraw/zinc/87/49/46/562874946.db2.gz UVNFVYYNRZPREN-HFTWOUSFSA-N 0 3 563.720 6.040 10 10 KKCEHN