smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc2[nH]c3c(c2c1)c(C)c1c(ccnc1NCCC(C)C)c3C ZINC000006069475 207128044 /nfs/dbraw/zinc/12/80/44/207128044.db2.gz AIKGNCPHGNDPFI-UHFFFAOYSA-N 0 1 361.489 5.953 1 5 FKBFMN CC1(C)CCc2c3[nH]c(-c4ccc([N+](=O)[O-])cc4)nc3c3ccccc3c2O1 ZINC000039179367 205044502 /nfs/dbraw/zinc/04/45/02/205044502.db2.gz XJQANOXEXMZCLB-UHFFFAOYSA-N 0 1 373.412 5.395 1 5 FKBFMN Oc1ccc(CCNc2nc3ccccc3c3[nH]c4ccccc4c32)cc1 ZINC000045374640 205121562 /nfs/dbraw/zinc/12/15/62/205121562.db2.gz VREWPBBKZDUFKM-UHFFFAOYSA-N 0 1 353.425 5.230 1 5 FKBFMN