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)Nc2ccc(C)c(C)c2)c2ccccc2[nH+]1 ZINC000217444377 563943449 /nfs/dbraw/zinc/94/34/49/563943449.db2.gz GPKYACRVMIORLQ-UHFFFAOYSA-N 1 2 320.392 4.178 40 70 DIIBLO Cc1cccc(NC(=O)COc2cc(C)[nH+]c3c(C)cccc23)c1 ZINC000217445492 563943434 /nfs/dbraw/zinc/94/34/34/563943434.db2.gz ZSHZRHMAPUAHHA-UHFFFAOYSA-N 1 2 320.392 4.178 40 70 DIIBLO Cc1ccc(NC(=O)COc2cc(C)[nH+]c3c(C)cccc23)cc1 ZINC000217444711 563943456 /nfs/dbraw/zinc/94/34/56/563943456.db2.gz PIJHFWOEHXYEPR-UHFFFAOYSA-N 1 2 320.392 4.178 40 70 DIIBLO