smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCC[C@H]1C[N@H+](C2CCCCC2)CC[C@@H]1N ZINC000096318672 169014226 /nfs/dbraw/zinc/01/42/26/169014226.db2.gz MOCHGBZSRBVYPK-ZFWWWQNUSA-N 1 3 238.419 3.159 1 0 BGAFHO CCCC[C@H]1C[N@@H+](C2CCCCC2)CC[C@@H]1N ZINC000096318672 169014225 /nfs/dbraw/zinc/01/42/25/169014225.db2.gz MOCHGBZSRBVYPK-ZFWWWQNUSA-N 1 3 238.419 3.159 1 0 BGAFHO N#[N+]C(C(=O)c1ccccc1)c1ccccc1 ZINC000006095543 342773537 /nfs/dbraw/zinc/77/35/37/342773537.db2.gz MIRLIJAGOLVCQI-CYBMUJFWSA-N 1 3 223.255 3.464 2 0 BGAFHO