smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1-c1cc(-c2cccs2)[nH]n1 ZINC000216696501 179235176 /nfs/dbraw/zinc/23/51/76/179235176.db2.gz IYDJKKUFJRDDAI-UHFFFAOYSA-N 0 1 240.331 4.114 40 70 BIIBMN Cc1cccc(-c2cc(-c3cccs3)[nH]n2)c1 ZINC000216696572 398093562 /nfs/dbraw/zinc/09/35/62/398093562.db2.gz VMSVYMDIWRSYSU-UHFFFAOYSA-N 0 1 240.331 4.114 40 70 BIIBMN Cc1ccc(-c2cc(-c3cccs3)[nH]n2)cc1 ZINC000216696651 178317177 /nfs/dbraw/zinc/31/71/77/178317177.db2.gz YHFIKZNJXLDRBA-UHFFFAOYSA-N 0 1 240.331 4.114 40 70 BIIBMN