smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(OCC(=O)c2ccccc2)c2cccc(C)c2[nH+]1 ZINC000217442441 567167255 /nfs/dbraw/zinc/16/72/55/567167255.db2.gz UIBWDPAUFGXTBR-UHFFFAOYSA-N 1 2 291.350 4.113 40 70 CIIBLO Cc1cc(OCc2ccccc2)c2cccc(C)c2[nH+]1 ZINC000217423982 567168625 /nfs/dbraw/zinc/16/86/25/567168625.db2.gz KKYBJVOYEPFKJW-UHFFFAOYSA-N 1 2 263.340 4.431 40 70 CIIBLO