smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN1CC[N+]2(C[C@](C)(O)C[C@@H]2CI)CC1 ZINC000000160472 717087542 /nfs/dbraw/zinc/08/75/42/717087542.db2.gz RMUYGKURLCGPPK-GHMZBOCLSA-N 1 0 325.214 0.707 10 50 ECGERO CN1CC[N+]2(C[C@](C)(O)C[C@H]2CI)CC1 ZINC000000160470 717087855 /nfs/dbraw/zinc/08/78/55/717087855.db2.gz RMUYGKURLCGPPK-WDEREUQCSA-N 1 0 325.214 0.707 10 50 ECGERO CN1CC[N+]2(C[C@@](C)(O)C[C@@H]2CI)CC1 ZINC000000160473 717087790 /nfs/dbraw/zinc/08/77/90/717087790.db2.gz RMUYGKURLCGPPK-MNOVXSKESA-N 1 0 325.214 0.707 10 50 ECGERO CN1CC[N+]2(C[C@@](C)(O)C[C@H]2CI)CC1 ZINC000000160471 717087771 /nfs/dbraw/zinc/08/77/71/717087771.db2.gz RMUYGKURLCGPPK-QWRGUYRKSA-N 1 0 325.214 0.707 10 50 ECGERO