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](Nc1cccc(F)c1)c1ccc2ccccc2c1[O-] ZINC000019920695 170928182 /nfs/dbraw/zinc/92/81/82/170928182.db2.gz KMTDZALNRBVESB-LBPRGKRZSA-N -1 3 281.330 4.858 20 10 CJCDHM C[C@@H](NCc1cc(Cl)ccc1[O-])c1ccccc1Cl ZINC000020124086 171005294 /nfs/dbraw/zinc/00/52/94/171005294.db2.gz PXEIVQLWJNYEBB-SNVBAGLBSA-N -1 3 296.197 4.550 20 10 CJCDHM C[C@H](NCc1cc(Cl)ccc1[O-])c1ccccc1Cl ZINC000020124087 171005863 /nfs/dbraw/zinc/00/58/63/171005863.db2.gz PXEIVQLWJNYEBB-JTQLQIEISA-N -1 3 296.197 4.550 20 10 CJCDHM Cc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1Cl ZINC000062744726 525309340 /nfs/dbraw/zinc/30/93/40/525309340.db2.gz LKRPRCMPFLEFKG-JTQLQIEISA-N -1 3 279.742 4.666 20 10 CJCDHM Cc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1Cl ZINC000062744727 525316990 /nfs/dbraw/zinc/31/69/90/525316990.db2.gz LKRPRCMPFLEFKG-SNVBAGLBSA-N -1 3 279.742 4.666 20 10 CJCDHM