smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]1C[N@H+](C)CC[C@@H]1NCCN1CCC([NH+](C)C)CC1 ZINC000160212134 389383696 /nfs/dbraw/zinc/38/36/96/389383696.db2.gz CWVYRCVNNBALLS-HOCLYGCPSA-N 2 3 282.476 0.942 20 70 CCIDHP C[C@H]1C[N@@H+](C)CC[C@@H]1NCCN1CCC([NH+](C)C)CC1 ZINC000160212134 389383698 /nfs/dbraw/zinc/38/36/98/389383698.db2.gz CWVYRCVNNBALLS-HOCLYGCPSA-N 2 3 282.476 0.942 20 70 CCIDHP C[C@@H]1C[N@H+](C)CC[C@@H]1NCCN1CCC([NH+](C)C)CC1 ZINC000160211990 288076249 /nfs/dbraw/zinc/07/62/49/288076249.db2.gz CWVYRCVNNBALLS-ZBFHGGJFSA-N 2 3 282.476 0.942 20 70 CCIDHP C[C@@H]1C[N@@H+](C)CC[C@@H]1NCCN1CCC([NH+](C)C)CC1 ZINC000160211990 288076252 /nfs/dbraw/zinc/07/62/52/288076252.db2.gz CWVYRCVNNBALLS-ZBFHGGJFSA-N 2 3 282.476 0.942 20 70 CCIDHP