smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cn([C@H]2C[C@@H](N=[N+]=[N-])[C@@H](CC[P@](=O)([O-])O)O2)c(=O)[nH]c1=O ZINC000026956342 202150795 /nfs/dbraw/zinc/15/07/95/202150795.db2.gz BCFAOZSYFUNSAJ-IWSPIJDZSA-N -1 1 345.252 0.379 1 10 ECCFMM Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](C=C[P@](=O)([O-])O)O2)c(=O)[nH]c1=O ZINC000026957234 202150527 /nfs/dbraw/zinc/15/05/27/202150527.db2.gz ZFOXDVZPHQPFDB-NSVNRLROSA-N -1 1 343.236 0.503 1 10 ECCFMM O=C([O-])[C@H](Cc1cnc[nH]1)NC=C1C(=O)NN=C1c1ccccc1 ZINC000072177662 216065798 /nfs/dbraw/zinc/06/57/98/216065798.db2.gz VBIZSOSXLVKQRQ-FSBNRTBOSA-N -1 1 325.328 0.413 1 10 ECCFMM Cc1cn([C@@H]2C[C@H](N=[N+]=[N-])[C@@H](CC[P@](=O)([O-])O)O2)c(=O)[nH]c1=O ZINC000026956350 202149948 /nfs/dbraw/zinc/14/99/48/202149948.db2.gz BCFAOZSYFUNSAJ-YIZRAAEISA-N -1 1 345.252 0.379 1 10 ECCFMM