smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOC(=O)[C@H]1CCCN(C(=O)C2CC[NH2+]CC2)C1 ZINC000004298667 347992617 /nfs/dbraw/zinc/99/26/17/347992617.db2.gz GCIXGIYXEJFYGP-LBPRGKRZSA-N 1 0 268.357 0.788 30 0 CCACRO CCOC(=O)[C@@H]1CCCN(C(=O)C2CC[NH2+]CC2)C1 ZINC000004298666 347992147 /nfs/dbraw/zinc/99/21/47/347992147.db2.gz GCIXGIYXEJFYGP-GFCCVEGCSA-N 1 0 268.357 0.788 30 0 CCACRO CC(=O)N1CCN(C(=O)[C@](C)([NH3+])C(C)C)C[C@H]1C ZINC000085340251 179025372 /nfs/dbraw/zinc/02/53/72/179025372.db2.gz ICSNOCHIZHGIIL-ZWNOBZJWSA-N 1 0 255.362 0.439 30 0 CCACRO CC(=O)N1CCN(C(=O)[C@](C)([NH3+])C(C)C)C[C@@H]1C ZINC000085340253 179025433 /nfs/dbraw/zinc/02/54/33/179025433.db2.gz ICSNOCHIZHGIIL-GXFFZTMASA-N 1 0 255.362 0.439 30 0 CCACRO