smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[NH+](CC)CCNc1c2ccc(Cl)cc2[nH+]c2ccc(OC)nc21 ZINC000001763696 204018184 /nfs/dbraw/zinc/01/81/84/204018184.db2.gz LXVKVNMUGPSBSD-UHFFFAOYSA-N 2 2 358.873 4.199 1 5 FIBFLP C[NH+]1CCN(c2c3c4ccccc4[nH]c3[nH+]c3ccc(Cl)cc32)CC1 ZINC000040979327 536417896 /nfs/dbraw/zinc/41/78/96/536417896.db2.gz BODCYYPAWVCMPI-UHFFFAOYSA-N 2 2 350.853 4.275 1 5 FIBFLP C[NH+](C)CCCNc1[nH+]c2c3ccc(O)cc3ccc2c2ccc(O)cc21 ZINC000013600446 220078581 /nfs/dbraw/zinc/07/85/81/220078581.db2.gz XMTVDHJPOGYFDR-UHFFFAOYSA-N 2 2 361.445 4.316 1 5 FIBFLP