smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+](C)(CC(=O)c1ccccc1)C[C@H](Br)CBr ZINC000004714758 717098727 /nfs/dbraw/zinc/09/87/27/717098727.db2.gz SRVZSPUBPBPNGZ-GFCCVEGCSA-N 1 0 364.101 3.104 40 50 FGGBRO C[N+](C)(CC(=O)c1ccccc1)C[C@@H](Br)CBr ZINC000004714759 717098444 /nfs/dbraw/zinc/09/84/44/717098444.db2.gz SRVZSPUBPBPNGZ-LBPRGKRZSA-N 1 0 364.101 3.104 40 50 FGGBRO C/C=C1\C[N+]2(CCC)CC[C@]34c5cccc(O)c5NC3=C(C=O)[C@H]1C[C@@H]42 ZINC000002109494 717094709 /nfs/dbraw/zinc/09/47/09/717094709.db2.gz BDPFMCBRYUSSOJ-ZCAWPDOLSA-O 1 0 351.470 3.487 40 50 FGGBRO C/C=C1\C[N+]2(CCC)CC[C@@]34c5cccc(O)c5NC3=C(C=O)[C@H]1C[C@@H]42 ZINC000003999404 717097911 /nfs/dbraw/zinc/09/79/11/717097911.db2.gz BDPFMCBRYUSSOJ-MAWZUJCLSA-O 1 0 351.470 3.487 40 50 FGGBRO