smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1[nH+]ccn1C[C@@H]1CCC[N@@H+]1[C@H](C(N)=O)c1cccc(Br)c1 ZINC000160684711 551584414 /nfs/dbraw/zinc/58/44/14/551584414.db2.gz RHOAKWLYLYZYQP-HOTGVXAUSA-N 2 2 377.286 2.645 10 70 GFIELP Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@H](C(N)=O)c1cccc(Br)c1 ZINC000160684711 551584416 /nfs/dbraw/zinc/58/44/16/551584416.db2.gz RHOAKWLYLYZYQP-HOTGVXAUSA-N 2 2 377.286 2.645 10 70 GFIELP Cc1[nH+]ccn1C[C@H]1CCC[N@@H+]1[C@H](C(N)=O)c1cccc(Br)c1 ZINC000160684826 551584398 /nfs/dbraw/zinc/58/43/98/551584398.db2.gz RHOAKWLYLYZYQP-CVEARBPZSA-N 2 2 377.286 2.645 10 70 GFIELP Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@H](C(N)=O)c1cccc(Br)c1 ZINC000160684826 551584403 /nfs/dbraw/zinc/58/44/03/551584403.db2.gz RHOAKWLYLYZYQP-CVEARBPZSA-N 2 2 377.286 2.645 10 70 GFIELP