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](Cn1cnc2c1ncnc2NC(N)=[NH2+])OC[P@](=O)([O-])O ZINC000029123773 202181968 /nfs/dbraw/zinc/18/19/68/202181968.db2.gz BNPZUOBHVLFDIJ-LURJTMIESA-N 0 1 329.257 -0.729 1 30 EBEFMN C[C@H](Cn1cnc2ncnc(NC(N)=[NH2+])c21)OC[P@](=O)([O-])O ZINC000029123649 202181451 /nfs/dbraw/zinc/18/14/51/202181451.db2.gz USBXDYZHJNKAFO-ZCFIWIBFSA-N 0 1 329.257 -0.729 1 30 EBEFMN CCC1=C(N2CC2)C(=O)C([C@H](COC(N)=O)OC)=C(N2CC2)C1=O ZINC000100839765 219108820 /nfs/dbraw/zinc/10/88/20/219108820.db2.gz FJJJAMDFWWSYCU-JTQLQIEISA-N 0 1 335.360 -0.202 1 30 EBEFMN CCC1=C(N2CC2)C(=O)C([C@@H](COC(N)=O)OC)=C(N2CC2)C1=O ZINC000100839764 219108970 /nfs/dbraw/zinc/10/89/70/219108970.db2.gz FJJJAMDFWWSYCU-SNVBAGLBSA-N 0 1 335.360 -0.202 1 30 EBEFMN