smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(Nc1cccc(COCc2ccco2)c1)c1cccc(-c2nnc[nH]2)c1 ZINC000160982887 567846710 /nfs/dbraw/zinc/84/67/10/567846710.db2.gz PHRQZMMKUIDZRK-UHFFFAOYSA-N 0 1 374.400 4.034 20 70 FIIDMN c1ccc2oc(C3CCN(Cc4ccc(N5CCCC5)nc4)CC3)nc2c1 ZINC000161055215 567852959 /nfs/dbraw/zinc/85/29/59/567852959.db2.gz TVVLGPBUKHUAQR-UHFFFAOYSA-N 0 1 362.477 4.203 20 70 FIIDMN Cc1ccc(-c2nnc([C@@H](C)N3CCC[C@H](c4cc[nH]n4)C3)o2)cc1C ZINC000160940503 567837452 /nfs/dbraw/zinc/83/74/52/567837452.db2.gz BMNZRUWHKKOUJI-WBVHZDCISA-N 0 1 351.454 4.017 20 70 FIIDMN Cc1ccc(-c2nnc([C@H](C)N3CCC[C@H](c4cc[nH]n4)C3)o2)cc1C ZINC000160940639 567837509 /nfs/dbraw/zinc/83/75/09/567837509.db2.gz BMNZRUWHKKOUJI-RDJZCZTQSA-N 0 1 351.454 4.017 20 70 FIIDMN