smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1(C)NC(=N)NC(=N)N1c1ccc(C=CC(=O)Nc2cccc(S(=O)(=O)F)c2)cc1 ZINC000043307777 563120065 /nfs/dbraw/zinc/12/00/65/563120065.db2.gz RPUULMXPADMYKR-DHZHZOJOSA-N 0 1 444.492 2.182 1 70 IEIFMN CC1(C)NC(=N)NC(=N)N1c1ccc(C=CC(=O)Nc2ccc(S(=O)(=O)F)cc2)cc1 ZINC000043620401 563120978 /nfs/dbraw/zinc/12/09/78/563120978.db2.gz CBGVMQCUTDBIQC-LFYBBSHMSA-N 0 1 444.492 2.182 1 70 IEIFMN